0 B7R0.6 C=C(Br)CCC(=O)O Amb18648212 [0,0,0,0,0,0|1,0,2]=3 1 B7R0.6 C=C(Br)COC(C)C Amb27197438 [0,0,0,0,0,0|3,0,0]=3 2 B7R0.6 C=C(C)CCB(O)O Amb28316164 [0,0,0,0,0,0|1,0,3]=4 3 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [0,0,0,0,0,0|0,0,2]=2 4 B7R0.6 C=C(C)CCC(C)=O Amb9024770 [0,0,0,0,0,0|1,0,2]=3 5 B7R0.6 C=C(C)CCC(C)Br Amb27878705 [0,0,0,0,0,0|3,0,0]=3 6 B7R0.6 C=C(C)CCC(C)N Amb18641752 [0,0,0,0,0,0|3,0,0]=3 7 B7R0.6 C=C(C)CCC(C)O Amb24062974 [0,0,0,0,0,0|3,0,0]=3 8 B7R0.6 C=C(C)CCC(N)=O Amb27838318 [0,0,0,0,0,0|1,0,2]=3 9 B7R0.6 C=C(C)CCN(C)C Amb28187650 [0,0,0,0,0,0|3,0,0]=3 10 B7R0.6 C=C(C)CC[C@@H](C)N Amb33199549 [0,0,0,0,0,0|3,0,0]=3 11 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [0,0,0,0,0,0|3,0,0]=3 12 B7R0.6 C=C(C)CC[C@H](C)N Amb33199548 [0,0,0,0,0,0|3,0,0]=3 13 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [0,0,0,0,0,0|3,0,0]=3 14 B7R0.6 C=C(C)CC[N+](=O)[O-] Amb33199531 [0,0,0,0,0,0|1,0,3]=4 15 B7R0.6 C=C(C)CNC(N)=O Amb28385347 [0,0,0,0,0,0|2,0,2]=4 16 B7R0.6 C=C(C)CNC(O)=S Amb28240718 [0,0,0,0,0,0|1,1,2]=4 17 B7R0.6 C=C(C)COC(C)=O Amb16187121 [0,0,0,0,0,0|2,0,2]=4 18 B7R0.6 C=C(C)COC(N)=O Amb4017509 [0,0,0,0,0,0|2,0,2]=4 19 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [0,0,0,0,0,0|1,0,2]=3 20 B7R0.6 C=C(C)OCC(C)=O Amb27802616 [0,0,0,0,0,0|2,0,2]=4 21 B7R0.6 C=C(C)\C=C\C(=O)O Amb17593153 [0,0,0,0,0,0|0,0,4]=4 22 B7R0.6 C=C(Cl)CCC(=O)O Amb18642971 [0,0,0,0,0,0|1,0,2]=3 23 B7R0.6 C=C(Cl)CCC(C)=O Amb28316194 [0,0,0,0,0,0|2,0,2]=4 24 B7R0.6 C=C(N)CCC(=O)O Amb27629351 [0,0,0,0,0,0|1,0,2]=3 25 B7R0.6 C=C(O)\C=N\N(C)C Amb27209036 [0,0,0,0,0,0|3,0,1]=4 26 B7R0.6 CC(=N)NCC(C)C Amb27865850 [0,0,0,0,0,0|3,0,0]=3 27 B7R0.6 CC(=N)NCC(N)=O Amb27601983 [0,0,0,0,0,0|3,0,1]=4 28 B7R0.6 CC(=O)C#C[C@@H](C)O Amb27854924 [0,0,0,0,0,0|2,0,2]=4 29 B7R0.6 CC(=O)CC=C(C)C Amb17593170 [0,0,0,0,0,0|1,0,2]=3 30 B7R0.6 CC(=O)CCB(O)O Amb25095502 [0,0,0,0,0,0|2,0,2]=4 31 B7R0.6 CC(=O)CCC(=O)O Amb534169 [0,0,0,0,0,0|1,0,1]=2 32 B7R0.6 CC(=O)CCC(=S)Cl Amb28049019 [0,0,0,0,0,0|2,1,1]=4 33 B7R0.6 CC(=O)CCC(C)=O Amb2793010 [0,0,0,0,0,0|2,0,1]=3 34 B7R0.6 CC(=O)CCC(C)=S Amb27226729 [0,0,0,0,0,0|2,0,1]=3 35 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [0,0,0,0,0,0|2,0,0]=2 36 B7R0.6 CC(=O)CCC(C)C Amb4605991 [0,0,0,0,0,0|1,0,0]=1 37 B7R0.6 CC(=O)CCC(C)O Amb25829594 [0,0,0,0,0,0|2,0,0]=2 38 B7R0.6 CC(=O)CCC(F)F Amb27413848 [0,0,0,0,0,0|3,0,0]=3 39 B7R0.6 CC(=O)CCC(N)=O Amb17142854 [0,0,0,0,0,0|2,0,1]=3 40 B7R0.6 CC(=O)CCC(O)=S Amb27267983 [0,0,0,0,0,0|1,1,1]=3 41 B7R0.6 CC(=O)CCN(C)C Amb1129203 [0,0,0,0,0,0|2,0,0]=2 42 B7R0.6 CC(=O)CCN(C)C Amb343601 [0,0,0,0,0,0|2,0,0]=2 43 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [0,0,0,0,0,0|2,0,0]=2 44 B7R0.6 CC(=O)CC[N+](=O)[O-] Amb18198961 [0,0,0,0,0,0|2,0,2]=4 45 B7R0.6 CC(=O)CNC(C)=O Amb6297294 [0,0,0,0,0,0|3,0,1]=4 46 B7R0.6 CC(=O)CNC(C)C Amb28126943 [0,0,0,0,0,0|2,0,0]=2 47 B7R0.6 CC(=O)CNC(C)C Amb32661638 [0,0,0,0,0,0|2,0,0]=2 48 B7R0.6 CC(=O)CNS(C)=O Amb27243778 [0,0,0,0,0,0|4,0,0]=4 49 B7R0.6 CC(=O)COC(C)=O Amb8517567 [0,0,0,0,0,0|3,0,1]=4 50 B7R0.6 CC(=O)COC(C)C Amb9665256 [0,0,0,0,0,0|2,0,0]=2 51 B7R0.6 CC(=O)COC(F)F Amb27636211 [0,0,0,0,0,0|4,0,0]=4 52 B7R0.6 CC(=O)CSC(C)C Amb22549127 [0,0,0,0,0,0|2,0,0]=2 53 B7R0.6 CC(=O)C\C=C(\C)Cl Amb27880641 [0,0,0,0,0,0|2,0,2]=4 54 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,0,0,0,0,0|2,0,1]=3 55 B7R0.6 CC(=O)NCC(C)C Amb3364211 [0,0,0,0,0,0|2,0,0]=2 56 B7R0.6 CC(=O)NCC(C)N Amb18631377 [0,0,0,0,0,0|3,0,0]=3 57 B7R0.6 CC(=O)NCC(C)O Amb9276316 [0,0,0,0,0,0|3,0,0]=3 58 B7R0.6 CC(=O)NCC(Cl)Cl Amb27978268 [0,0,0,0,0,0|4,0,0]=4 59 B7R0.6 CC(=O)NCC(F)F Amb27961410 [0,0,0,0,0,0|4,0,0]=4 60 B7R0.6 CC(=O)NCC(N)=O Amb17231824 [0,0,0,0,0,0|3,0,1]=4 61 B7R0.6 CC(=O)NCN(C)C Amb27838840 [0,0,0,0,0,0|3,0,0]=3 62 B7R0.6 CC(=O)NN=C(C)C Amb1047247 [0,0,0,0,0,0|3,0,1]=4 63 B7R0.6 CC(=O)NNC(C)C Amb22233621 [0,0,0,0,0,0|3,0,0]=3 64 B7R0.6 CC(=O)OCC(=O)Cl Amb3939160 [0,0,0,0,0,0|3,0,1]=4 65 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,0,0,0,0,0|2,0,1]=3 66 B7R0.6 CC(=O)OCC(C)Br Amb25360690 [0,0,0,0,0,0|3,0,0]=3 67 B7R0.6 CC(=O)OCC(C)O Amb24056158 [0,0,0,0,0,0|3,0,0]=3 68 B7R0.6 CC(=O)OCC(F)F Amb10839327 [0,0,0,0,0,0|4,0,0]=4 69 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,0,0,0,0,0|3,0,1]=4 70 B7R0.6 CC(=O)OC[C@H](C)Br Amb27878701 [0,0,0,0,0,0|3,0,0]=3 71 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [0,0,0,0,0,0|3,0,0]=3 72 B7R0.6 CC(=O)ON=C(C)C Amb2781649 [0,0,0,0,0,0|3,0,1]=4 73 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [0,0,0,0,0,0|3,0,1]=4 74 B7R0.6 CC(=O)SCC(C)O Amb27801534 [0,0,0,0,0,0|3,0,0]=3 75 B7R0.6 CC(=O)SCC(Cl)Cl Amb4012737 [0,0,0,0,0,0|4,0,0]=4 76 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,0,0,0,0,0|3,0,1]=4 77 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [0,0,0,0,0,0|1,0,3]=4 78 B7R0.6 CC(=O)\C=C\C(C)C Amb28524833 [0,0,0,0,0,0|1,0,2]=3 79 B7R0.6 CC(=O)\C=C\C(C)Cl Amb25782801 [0,0,0,0,0,0|2,0,2]=4 80 B7R0.6 CC(=O)\C=C\N(C)C Amb4019563 [0,0,0,0,0,0|2,0,2]=4 81 B7R0.6 CC(=O)\C=N\N(C)C Amb28316186 [0,0,0,0,0,0|3,0,1]=4 82 B7R0.6 CC(=O)\N=C\C(=O)O Amb27262053 [0,0,0,0,0,0|2,0,2]=4 83 B7R0.6 CC(=O)\N=C\C(C)O Amb27457691 [0,0,0,0,0,0|3,0,1]=4 84 B7R0.6 CC(=O)\N=C\N(C)C Amb27950201 [0,0,0,0,0,0|3,0,1]=4 85 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [0,0,0,0,0,0|2,0,1]=3 86 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [0,0,0,0,0,0|2,0,1]=3 87 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [0,0,0,0,0,0|1,0,0]=1 88 B7R0.6 CC(Br)CCC(F)F Amb27636046 [0,0,0,0,0,0|3,0,1]=4 89 B7R0.6 CC(Br)CCN(C)C Amb28122888 [0,0,0,0,0,0|3,0,1]=4 90 B7R0.6 CC(Br)CNC(C)C Amb35685661 [0,0,0,0,0,0|3,0,1]=4 91 B7R0.6 CC(Br)COC(C)C Amb24053045 [0,0,0,0,0,0|3,0,1]=4 92 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [0,0,0,0,0,0|0,0,2]=2 93 B7R0.6 CC(C)=CCC(=O)[O-] Amb22491058 [0,0,0,0,0,0|0,0,3]=3 94 B7R0.6 CC(C)=CCC(C)C Amb22731329 [0,0,0,0,0,0|2,0,1]=3 95 B7R0.6 CC(C)=CCC(C)Cl Amb27590455 [0,0,0,0,0,0|3,0,1]=4 96 B7R0.6 CC(C)=CCC(C)N Amb27391176 [0,0,0,0,0,0|3,0,1]=4 97 B7R0.6 CC(C)=CCN(C)C Amb27837555 [0,0,0,0,0,0|3,0,1]=4 98 B7R0.6 CC(C)=CC[C@@H](C)O Amb28315798 [0,0,0,0,0,0|1,0,3]=4 99 B7R0.6 CC(C)=NCC(N)=O Amb27489401 [0,0,0,0,0,0|2,0,1]=3 100 B7R0.6 CC(C)=NNC(C)C Amb28056106 [0,0,0,0,0,0|4,0,0]=4 101 B7R0.6 CC(C)=NNC(N)=O Amb6366342 [0,0,0,0,0,0|3,0,1]=4 102 B7R0.6 CC(C)C#CC(=O)O Amb33544341 [0,0,0,0,0,0|0,0,2]=2 103 B7R0.6 CC(C)CCB(O)O Amb13890540 [0,0,0,0,0,0|1,0,1]=2 104 B7R0.6 CC(C)CCC(=N)N Amb19890005 [0,0,0,0,0,0|2,0,0]=2 105 B7R0.6 CC(C)CCC(=N)N Amb6266403 [0,0,0,0,0,0|2,0,0]=2 106 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [0,0,0,0,0,0|1,0,0]=1 107 B7R0.6 CC(C)CCC(=O)O Amb1153016 [0,0,0,0,0,0|0,0,0]=0 108 B7R0.6 CC(C)CCC(C)Br Amb8835419 [0,0,0,0,0,0|2,0,1]=3 109 B7R0.6 CC(C)CCC(C)C Amb8513431 [0,0,0,0,0,0|2,0,1]=3 110 B7R0.6 CC(C)CCC(C)N Amb32405136 [0,0,0,0,0,0|2,0,1]=3 111 B7R0.6 CC(C)CCC(C)N Amb9703135 [0,0,0,0,0,0|2,0,1]=3 112 B7R0.6 CC(C)CCC(C)O Amb9748244 [0,0,0,0,0,0|1,0,1]=2 113 B7R0.6 CC(C)CCC(C)S Amb7784741 [0,0,0,0,0,0|1,1,1]=3 114 B7R0.6 CC(C)CCC(N)=O Amb8997711 [0,0,0,0,0,0|1,0,0]=1 115 B7R0.6 CC(C)CCC(N)=S Amb6248593 [0,0,0,0,0,0|1,1,0]=2 116 B7R0.6 CC(C)CCN(C)O Amb33361677 [0,0,0,0,0,0|2,0,0]=2 117 B7R0.6 CC(C)CCP(Cl)Cl Amb27793518 [0,0,0,0,0,0|3,0,0]=3 118 B7R0.6 CC(C)CCS(=O)Cl Amb27201771 [0,0,0,0,0,0|2,0,0]=2 119 B7R0.6 CC(C)CCS(=O)[O-] Amb25914733 [0,0,0,0,0,0|1,0,1]=2 120 B7R0.6 CC(C)CCS(N)=O Amb32720359 [0,0,0,0,0,0|2,0,0]=2 121 B7R0.6 CC(C)CC[C@@H](C)N Amb26479301 [0,0,0,0,0,0|2,0,1]=3 122 B7R0.6 CC(C)CC[C@@H](C)O Amb26500468 [0,0,0,0,0,0|1,0,1]=2 123 B7R0.6 CC(C)CC[C@H](C)N Amb3941458 [0,0,0,0,0,0|2,0,1]=3 124 B7R0.6 CC(C)CC[C@H](C)O Amb27768728 [0,0,0,0,0,0|1,0,1]=2 125 B7R0.6 CC(C)CC[N+](=O)[O-] Amb17672612 [0,0,0,0,0,0|1,0,1]=2 126 B7R0.6 CC(C)CNC(=N)N Amb26326628 [0,0,0,0,0,0|3,0,0]=3 127 B7R0.6 CC(C)CNC(=O)Cl Amb35637064 [0,0,0,0,0,0|2,0,0]=2 128 B7R0.6 CC(C)CNC(C)C Amb6242871 [0,0,0,0,0,0|3,0,1]=4 129 B7R0.6 CC(C)CNC(C)C Amb6892783 [0,0,0,0,0,0|3,0,1]=4 130 B7R0.6 CC(C)CNC(N)=O Amb1151241 [0,0,0,0,0,0|2,0,0]=2 131 B7R0.6 CC(C)CNC(N)=S Amb2370605 [0,0,0,0,0,0|2,1,0]=3 132 B7R0.6 CC(C)CNC(O)=S Amb27597328 [0,0,0,0,0,0|1,1,0]=2 133 B7R0.6 CC(C)COC(=O)Cl Amb3940231 [0,0,0,0,0,0|2,0,0]=2 134 B7R0.6 CC(C)COC(=S)S Amb27804114 [0,0,0,0,0,0|1,2,0]=3 135 B7R0.6 CC(C)COC(C)Cl Amb25337737 [0,0,0,0,0,0|3,0,1]=4 136 B7R0.6 CC(C)COC(Cl)Cl Amb27966536 [0,0,0,0,0,0|3,0,1]=4 137 B7R0.6 CC(C)COC(N)=O Amb4020010 [0,0,0,0,0,0|2,0,0]=2 138 B7R0.6 CC(C)COC(O)O Amb28120630 [0,0,0,0,0,0|1,0,2]=3 139 B7R0.6 CC(C)CON(=O)O Amb33780821 [0,0,0,0,0,0|2,0,0]=2 140 B7R0.6 CC(C)CO[N+](=O)[O-] Amb22348027 [0,0,0,0,0,0|2,0,1]=3 141 B7R0.6 CC(C)CO[PH](=O)O Amb27252350 [0,0,0,0,0,0|2,0,0]=2 142 B7R0.6 CC(C)CSC(=N)N Amb20676000 [0,0,0,0,0,0|3,0,0]=3 143 B7R0.6 CC(C)CSC(=N)N Amb27875967 [0,0,0,0,0,0|3,0,0]=3 144 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [0,0,0,0,0,0|2,0,0]=2 145 B7R0.6 CC(C)CSC(C)C Amb4017819 [0,0,0,0,0,0|3,0,1]=4 146 B7R0.6 CC(C)NCC(=N)N Amb27186805 [0,0,0,0,0,0|3,0,0]=3 147 B7R0.6 CC(C)NCC(=O)Cl Amb27441169 [0,0,0,0,0,0|2,0,0]=2 148 B7R0.6 CC(C)NCC(=O)O Amb2372347 [0,0,0,0,0,0|1,0,0]=1 149 B7R0.6 CC(C)NCC(=O)O Amb6892753 [0,0,0,0,0,0|1,0,0]=1 150 B7R0.6 CC(C)NCC(F)F Amb33549622 [0,0,0,0,0,0|3,0,1]=4 151 B7R0.6 CC(C)NCC(F)F Amb8853771 [0,0,0,0,0,0|3,0,1]=4 152 B7R0.6 CC(C)NCC(N)=O Amb2370772 [0,0,0,0,0,0|2,0,0]=2 153 B7R0.6 CC(C)NCC(N)=O Amb399843 [0,0,0,0,0,0|2,0,0]=2 154 B7R0.6 CC(C)NCC(N)=S Amb17231884 [0,0,0,0,0,0|2,1,0]=3 155 B7R0.6 CC(C)NC[C@@H](C)O Amb27641886 [0,0,0,0,0,0|2,0,1]=3 156 B7R0.6 CC(C)NNC(N)=O Amb27409411 [0,0,0,0,0,0|3,0,0]=3 157 B7R0.6 CC(C)OCB(O)O Amb28058696 [0,0,0,0,0,0|2,0,1]=3 158 B7R0.6 CC(C)OCC(=N)N Amb33551035 [0,0,0,0,0,0|3,0,0]=3 159 B7R0.6 CC(C)OCC(=N)N Amb6268584 [0,0,0,0,0,0|3,0,0]=3 160 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [0,0,0,0,0,0|2,0,0]=2 161 B7R0.6 CC(C)OCC(=O)O Amb6275796 [0,0,0,0,0,0|1,0,0]=1 162 B7R0.6 CC(C)OCC(N)=O Amb26515707 [0,0,0,0,0,0|2,0,0]=2 163 B7R0.6 CC(C)OCC(N)=S Amb6267503 [0,0,0,0,0,0|2,1,0]=3 164 B7R0.6 CC(C)OC[C@@H](C)N Amb18016635 [0,0,0,0,0,0|3,0,1]=4 165 B7R0.6 CC(C)OC[C@@H](C)O Amb24689920 [0,0,0,0,0,0|2,0,1]=3 166 B7R0.6 CC(C)OC[C@H](C)N Amb17061649 [0,0,0,0,0,0|3,0,1]=4 167 B7R0.6 CC(C)OC[C@H](C)N Amb33496097 [0,0,0,0,0,0|3,0,1]=4 168 B7R0.6 CC(C)OC[C@H](C)O Amb24449028 [0,0,0,0,0,0|2,0,1]=3 169 B7R0.6 CC(C)ONC(N)=O Amb2899784 [0,0,0,0,0,0|3,0,0]=3 170 B7R0.6 CC(C)SCC(=O)O Amb1128460 [0,0,0,0,0,0|1,0,0]=1 171 B7R0.6 CC(C)SC[C@@H](C)N Amb28049038 [0,0,0,0,0,0|3,0,1]=4 172 B7R0.6 CC(C)\C=C\B(O)O Amb27149192 [0,0,0,0,0,0|1,0,3]=4 173 B7R0.6 CC(C)\C=C\C(=O)Cl Amb24481563 [0,0,0,0,0,0|1,0,2]=3 174 B7R0.6 CC(C)\C=C\C(=O)O Amb8517064 [0,0,0,0,0,0|0,0,2]=2 175 B7R0.6 CC(C)\C=C\C(C)O Amb25746608 [0,0,0,0,0,0|1,0,3]=4 176 B7R0.6 CC(C)\C=C\[C@H](C)O Amb28189174 [0,0,0,0,0,0|1,0,3]=4 177 B7R0.6 CC(C)\C=C\[N+](=O)[O-] Amb32644472 [0,0,0,0,0,0|1,0,3]=4 178 B7R0.6 CC(C)\C=N\S(C)=O Amb35681708 [0,0,0,0,0,0|3,0,1]=4 179 B7R0.6 CC(C)\N=C\C(N)=O Amb28388359 [0,0,0,0,0,0|2,0,1]=3 180 B7R0.6 CC(Cl)C#CC(=O)O Amb28410751 [0,0,0,0,0,0|1,0,2]=3 181 B7R0.6 CC(Cl)CCB(O)O Amb26366806 [0,0,0,0,0,0|2,0,1]=3 182 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,0,0,0,0,0|2,0,0]=2 183 B7R0.6 CC(Cl)CCC(C)Cl Amb27263593 [0,0,0,0,0,0|3,0,1]=4 184 B7R0.6 CC(Cl)CCC(F)F Amb32672187 [0,0,0,0,0,0|3,0,1]=4 185 B7R0.6 CC(Cl)CCS(=O)Cl Amb32720414 [0,0,0,0,0,0|3,0,0]=3 186 B7R0.6 CC(Cl)CCS(=O)[O-] Amb32755731 [0,0,0,0,0,0|2,0,1]=3 187 B7R0.6 CC(Cl)CCS(N)=O Amb32720415 [0,0,0,0,0,0|3,0,0]=3 188 B7R0.6 CC(Cl)CNC(C)C Amb27667386 [0,0,0,0,0,0|3,0,1]=4 189 B7R0.6 CC(Cl)\C=C\C(=O)Cl Amb24579654 [0,0,0,0,0,0|2,0,2]=4 190 B7R0.6 CC(F)CCC(F)F Amb32672189 [0,0,0,0,0,0|3,0,1]=4 191 B7R0.6 CC(F)CCS(=O)Cl Amb32720694 [0,0,0,0,0,0|3,0,0]=3 192 B7R0.6 CC(F)CCS(=O)[O-] Amb32754854 [0,0,0,0,0,0|2,0,1]=3 193 B7R0.6 CC(F)CCS(N)=O Amb32720695 [0,0,0,0,0,0|3,0,0]=3 194 B7R0.6 CC(I)CCC(=O)O Amb25938596 [0,0,0,0,0,0|1,0,0]=1 195 B7R0.6 CC(I)CCC(F)F Amb32672188 [0,0,0,0,0,0|3,0,1]=4 196 B7R0.6 CC(N)C#CC(=O)O Amb27876109 [0,0,0,0,0,0|1,0,2]=3 197 B7R0.6 CC(N)CC=C(Cl)Cl Amb29870254 [0,0,0,0,0,0|3,0,1]=4 198 B7R0.6 CC(N)CCC(=O)O Amb17593212 [0,0,0,0,0,0|1,0,0]=1 199 B7R0.6 CC(N)CCC(=O)O Amb19515603 [0,0,0,0,0,0|1,0,0]=1 200 B7R0.6 CC(N)CCC(C)N Amb27251969 [0,0,0,0,0,0|3,0,1]=4 201 B7R0.6 CC(N)CCC(C)O Amb18641930 [0,0,0,0,0,0|2,0,1]=3 202 B7R0.6 CC(N)CCC(F)F Amb32659595 [0,0,0,0,0,0|3,0,1]=4 203 B7R0.6 CC(N)CCC(F)F Amb32659596 [0,0,0,0,0,0|3,0,1]=4 204 B7R0.6 CC(N)CCN(C)C Amb7969829 [0,0,0,0,0,0|3,0,1]=4 205 B7R0.6 CC(N)CCN(C)C Amb9711596 [0,0,0,0,0,0|3,0,1]=4 206 B7R0.6 CC(N)CCP(O)O Amb27468069 [0,0,0,0,0,0|2,0,1]=3 207 B7R0.6 CC(N)CCS(=O)O Amb27839082 [0,0,0,0,0,0|2,0,0]=2 208 B7R0.6 CC(N)CCS(C)=O Amb19337158 [0,0,0,0,0,0|3,0,0]=3 209 B7R0.6 CC(N)CCS(C)=O Amb22059582 [0,0,0,0,0,0|3,0,0]=3 210 B7R0.6 CC(N)CC[N+](=O)[O-] Amb33745572 [0,0,0,0,0,0|2,0,1]=3 211 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [0,0,0,0,0,0|2,0,0]=2 212 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,0,0,0,0,0|3,0,0]=3 213 B7R0.6 CC(N)COC(C)C Amb6661582 [0,0,0,0,0,0|3,0,1]=4 214 B7R0.6 CC(N)COC(N)=O Amb29849466 [0,0,0,0,0,0|3,0,0]=3 215 B7R0.6 CC(N)SCC(=O)O Amb27401691 [0,0,0,0,0,0|2,0,0]=2 216 B7R0.6 CC(N)\C=C\C(=O)O Amb33804531 [0,0,0,0,0,0|1,0,2]=3 217 B7R0.6 CC(O)C#CC(=O)O Amb27803065 [0,0,0,0,0,0|1,0,2]=3 218 B7R0.6 CC(O)CCB(O)O Amb24594819 [0,0,0,0,0,0|2,0,1]=3 219 B7R0.6 CC(O)CCC(=N)N Amb29849256 [0,0,0,0,0,0|3,0,0]=3 220 B7R0.6 CC(O)CCC(=O)O Amb18294804 [0,0,0,0,0,0|1,0,0]=1 221 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [0,0,0,0,0,0|1,0,1]=2 222 B7R0.6 CC(O)CCC(C)O Amb2688714 [0,0,0,0,0,0|2,0,1]=3 223 B7R0.6 CC(O)CCC(F)F Amb28252655 [0,0,0,0,0,0|3,0,1]=4 224 B7R0.6 CC(O)CCC(N)=S Amb28078352 [0,0,0,0,0,0|2,1,0]=3 225 B7R0.6 CC(O)CCN(C)C Amb26489582 [0,0,0,0,0,0|2,0,1]=3 226 B7R0.6 CC(O)CCS(=O)[O-] Amb27662317 [0,0,0,0,0,0|2,0,1]=3 227 B7R0.6 CC(O)CNC(=N)N Amb27759521 [0,0,0,0,0,0|4,0,0]=4 228 B7R0.6 CC(O)CNC(C)C Amb9247472 [0,0,0,0,0,0|2,0,1]=3 229 B7R0.6 CC(O)COB(O)O Amb28206200 [0,0,0,0,0,0|3,0,1]=4 230 B7R0.6 CC(O)COC(N)=O Amb26359577 [0,0,0,0,0,0|3,0,0]=3 231 B7R0.6 CC(O)COS(C)=O Amb27982299 [0,0,0,0,0,0|4,0,0]=4 232 B7R0.6 CC(S)CCC(=O)O Amb8471198 [0,0,0,0,0,0|1,0,0]=1 233 B7R0.6 CC(S)CCC(N)=O Amb28399630 [0,0,0,0,0,0|2,0,0]=2 234 B7R0.6 CC(S)CCN(C)C Amb32788207 [0,0,0,0,0,0|2,1,1]=4 235 B7R0.6 CC(S)CNC(C)C Amb18124379 [0,0,0,0,0,0|2,1,1]=4 236 B7R0.6 CC(S)CSC(C)C Amb32788025 [0,0,0,0,0,0|2,1,1]=4 237 B7R0.6 CN(C)CC=C(Cl)Cl Amb35684044 [0,0,0,0,0,0|3,0,1]=4 238 B7R0.6 CN(C)CCB(O)O Amb27787216 [0,0,0,0,0,0|2,0,1]=3 239 B7R0.6 CN(C)CCC(=N)N Amb2695941 [0,0,0,0,0,0|3,0,0]=3 240 B7R0.6 CN(C)CCC(=N)N Amb33551563 [0,0,0,0,0,0|3,0,0]=3 241 B7R0.6 CN(C)CCC(=O)Cl Amb26050113 [0,0,0,0,0,0|2,0,0]=2 242 B7R0.6 CN(C)CCC(=O)Cl Amb32652940 [0,0,0,0,0,0|2,0,0]=2 243 B7R0.6 CN(C)CCC(=O)O Amb19888182 [0,0,0,0,0,0|1,0,0]=1 244 B7R0.6 CN(C)CCC(=O)O Amb6633385 [0,0,0,0,0,0|1,0,0]=1 245 B7R0.6 CN(C)CCC(N)=O Amb17231825 [0,0,0,0,0,0|2,0,0]=2 246 B7R0.6 CN(C)CCC(N)=S Amb6268885 [0,0,0,0,0,0|2,1,0]=3 247 B7R0.6 CN(C)CCC(N)=S Amb6893069 [0,0,0,0,0,0|2,1,0]=3 248 B7R0.6 CN(C)CCN(C)C Amb1195988 [0,0,0,0,0,0|4,0,0]=4 249 B7R0.6 CN(C)CCN(C)C Amb22728764 [0,0,0,0,0,0|4,0,0]=4 250 B7R0.6 CN(C)CCS(=O)[O-] Amb32754654 [0,0,0,0,0,0|2,0,1]=3 251 B7R0.6 CN(C)CCS(C)=O Amb27811384 [0,0,0,0,0,0|3,0,0]=3 252 B7R0.6 CN(C)OCC(=O)O Amb28120004 [0,0,0,0,0,0|2,0,0]=2 253 B7R0.6 CN(C)SCC(N)=O Amb27838357 [0,0,0,0,0,0|3,0,0]=3 254 B7R0.6 CN(C)\C=C\C(=O)O Amb25273624 [0,0,0,0,0,0|1,0,2]=3 255 B7R0.6 CN(N)CCC(=O)O Amb2698078 [0,0,0,0,0,0|2,0,0]=2 256 B7R0.6 CN(O)CCC(N)=O Amb27390605 [0,0,0,0,0,0|3,0,0]=3 257 B7R0.6 CN(O)\C=C\C(=O)O Amb27788003 [0,0,0,0,0,0|2,0,2]=4 258 B7R0.6 CP(C)CCP(C)C Amb8515396 [0,0,0,0,0,0|4,0,0]=4 259 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [0,0,0,0,0,0|2,0,0]=2 260 B7R0.6 CS(=O)CCS(C)=O Amb26455659 [0,0,0,0,0,0|4,0,0]=4 261 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [0,0,0,0,0,0|3,0,0]=3 262 B7R0.6 CS(=O)\C=C\C(=O)O Amb18642965 [0,0,0,0,0,0|2,0,2]=4 263 B7R0.6 C[C@@H](Br)CO[N+](=O)[O-] Amb27880933 [0,0,0,0,0,0|3,0,1]=4 264 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [0,0,0,0,0,0|1,0,0]=1 265 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [0,0,0,0,0,0|1,0,0]=1 266 B7R0.6 C[C@@H](N)CCC(F)F Amb32811584 [0,0,0,0,0,0|3,0,1]=4 267 B7R0.6 C[C@@H](N)CCN(C)C Amb28126846 [0,0,0,0,0,0|3,0,1]=4 268 B7R0.6 C[C@@H](N)CC[N+](=O)[O-] Amb33731289 [0,0,0,0,0,0|2,0,1]=3 269 B7R0.6 C[C@@H](O)CCC(F)F Amb33337801 [0,0,0,0,0,0|3,0,1]=4 270 B7R0.6 C[C@@H](O)CCN(C)C Amb33272289 [0,0,0,0,0,0|2,0,1]=3 271 B7R0.6 C[C@@H](O)CC[C@@H](C)O Amb4166310 [0,0,0,0,0,0|2,0,1]=3 272 B7R0.6 C[C@@H](O)CNC(N)=O Amb28315793 [0,0,0,0,0,0|3,0,0]=3 273 B7R0.6 C[C@H](Br)CO[N+](=O)[O-] Amb27843578 [0,0,0,0,0,0|3,0,1]=4 274 B7R0.6 C[C@H](N)C#CC(=O)O Amb27644755 [0,0,0,0,0,0|1,0,2]=3 275 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [0,0,0,0,0,0|1,0,0]=1 276 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [0,0,0,0,0,0|1,0,0]=1 277 B7R0.6 C[C@H](N)CCC(F)F Amb32811585 [0,0,0,0,0,0|3,0,1]=4 278 B7R0.6 C[C@H](N)CCN(C)C Amb26640371 [0,0,0,0,0,0|3,0,1]=4 279 B7R0.6 C[C@H](N)CC[C@H](C)N Amb27838291 [0,0,0,0,0,0|3,0,1]=4 280 B7R0.6 C[C@H](N)CC[N+](=O)[O-] Amb33729333 [0,0,0,0,0,0|2,0,1]=3 281 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [0,0,0,0,0,0|1,0,0]=1 282 B7R0.6 C[C@H](O)CCC(F)F Amb33485344 [0,0,0,0,0,0|3,0,1]=4 283 B7R0.6 C[C@H](O)CCN(C)C Amb33272277 [0,0,0,0,0,0|2,0,1]=3 284 B7R0.6 C[C@H](O)CC[C@@H](C)O Amb26407371 [0,0,0,0,0,0|2,0,1]=3 285 B7R0.6 C[C@H](O)CC[C@H](C)O Amb4166315 [0,0,0,0,0,0|2,0,1]=3 286 B7R0.6 C[C@H](O)CNC(=N)N Amb28135994 [0,0,0,0,0,0|4,0,0]=4 287 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [0,0,0,0,0,0|1,0,0]=1 288 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [0,0,0,0,0,0|1,0,0]=1 289 B7R0.6 C[S+](C)CCC(=O)[O-] Amb20247306 [0,0,0,0,0,0|1,0,1]=2 290 B7R0.6 C[SiH](C)CC[SiH](C)C Amb10603346 [0,0,0,0,0,0|2,2,0]=4 291 B7R0.6 C\C(Cl)=C/CC(N)=O Amb27750566 [0,0,0,0,0,0|2,0,2]=4 292 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [0,0,0,0,0,0|1,0,2]=3 293 B7R0.6 C\C(N)=N/C[C@H](C)O Amb28049584 [0,0,0,0,0,0|4,0,0]=4 294 B7R0.6 N=C(N)CCC(N)=O Amb25680023 [0,0,0,0,0,0|3,0,1]=4 295 B7R0.6 N=C(N)NCC(=O)O Amb16231404 [0,0,0,0,0,0|3,0,1]=4 296 B7R0.6 N=C(N)NCC(=O)O Amb2781642 [0,0,0,0,0,0|3,0,1]=4 297 B7R0.6 N=C(N)SCC(=O)O Amb33544354 [0,0,0,0,0,0|3,0,1]=4 298 B7R0.6 NC(=O)CCC(=O)Cl Amb28240580 [0,0,0,0,0,0|3,0,1]=4 299 B7R0.6 NC(=O)CCC(=O)O Amb2967294 [0,0,0,0,0,0|2,0,1]=3 300 B7R0.6 NC(=O)CCC(Cl)Cl Amb32671996 [0,0,0,0,0,0|3,0,0]=3 301 B7R0.6 NC(=O)CCC(N)=O Amb1353209 [0,0,0,0,0,0|3,0,1]=4 302 B7R0.6 NC(=O)CCC(O)O Amb27254204 [0,0,0,0,0,0|3,0,0]=3 303 B7R0.6 NC(=O)NCC(=O)O Amb6366364 [0,0,0,0,0,0|3,0,1]=4 304 B7R0.6 NC(=O)NCC(Cl)Cl Amb27763808 [0,0,0,0,0,0|4,0,0]=4 305 B7R0.6 NC(=O)NCC(F)F Amb27827918 [0,0,0,0,0,0|4,0,0]=4 306 B7R0.6 NC(=S)CCC(=O)O Amb18102382 [0,0,0,0,0,0|2,0,1]=3 307 B7R0.6 NC(=S)NCC(=O)O Amb9786290 [0,0,0,0,0,0|3,0,1]=4 308 B7R0.6 O=C(Cl)CCC(=O)Cl Amb3940240 [0,0,0,0,0,0|3,0,1]=4 309 B7R0.6 O=C(Cl)NCC(F)F Amb35625623 [0,0,0,0,0,0|4,0,0]=4 310 B7R0.6 O=C(Cl)OCC(Cl)Cl Amb27634817 [0,0,0,0,0,0|4,0,0]=4 311 B7R0.6 O=C(Cl)OCC(F)F Amb27431456 [0,0,0,0,0,0|4,0,0]=4 312 B7R0.6 O=C(O)C#CC(F)F Amb24455798 [0,0,0,0,0,0|2,0,2]=4 313 B7R0.6 O=C(O)CC=C(Cl)Cl Amb17593875 [0,0,0,0,0,0|2,0,2]=4 314 B7R0.6 O=C(O)CCB(O)O Amb24640288 [0,0,0,0,0,0|3,0,0]=3 315 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [0,0,0,0,0,0|2,0,1]=3 316 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [0,0,0,0,0,0|2,0,1]=3 317 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [0,0,0,0,0,0|2,0,0]=2 318 B7R0.6 O=C(O)CCC(F)F Amb20623135 [0,0,0,0,0,0|2,0,0]=2 319 B7R0.6 O=C(O)CCN(F)F Amb28370344 [0,0,0,0,0,0|3,0,0]=3 320 B7R0.6 O=C(O)CCP(O)O Amb27424479 [0,0,0,0,0,0|3,0,0]=3 321 B7R0.6 O=C(O)CCS(=O)O Amb27144832 [0,0,0,0,0,0|3,0,0]=3 322 B7R0.6 O=C(O)CC[N+](=O)[O-] Amb10843224 [0,0,0,0,0,0|3,0,0]=3 323 B7R0.6 O=C(O)CC[SH](=O)=O Amb27410689 [0,0,0,0,0,0|3,0,0]=3 324 B7R0.6 O=C(O)CNC(=O)S Amb27424662 [0,0,0,0,0,0|3,0,1]=4 325 B7R0.6 O=C(O)CN[N+](=O)[O-] Amb26397226 [0,0,0,0,0,0|4,0,0]=4 326 B7R0.6 O=C(O)COC(=O)Cl Amb27199161 [0,0,0,0,0,0|3,0,1]=4 327 B7R0.6 O=C(O)COC(F)F Amb26635492 [0,0,0,0,0,0|3,0,0]=3 328 B7R0.6 O=C(O)CSC(F)F Amb9215372 [0,0,0,0,0,0|3,0,0]=3 329 B7R0.6 O=C(O)\C=C\C(Cl)Cl Amb26464246 [0,0,0,0,0,0|2,0,2]=4 330 B7R0.6 O=C(O)\C=C\C(F)F Amb24340205 [0,0,0,0,0,0|2,0,2]=4 331 B7R0.6 O=C([O-])CCC(=O)[O-] Amb33512742 [0,0,0,0,0,0|2,0,2]=4 332 B7R0.6 O=C([O-])CCC(=O)[O-] Amb8514379 [0,0,0,0,0,0|2,0,2]=4 333 B7R0.6 O=C([O-])CSC(F)F Amb33719493 [0,0,0,0,0,0|3,0,1]=4 334 B7R0.6 O=S([O-])CCC(F)F Amb32755037 [0,0,0,0,0,0|3,0,1]=4 335 B7R0.6 O=[N+]([O-])CCC(F)F Amb33485345 [0,0,0,0,0,0|3,0,1]=4 336 B7R0.6 OC(O)CCC(O)O Amb26000162 [0,0,0,0,0,0|2,0,2]=4 337 B7R0.6 [BH3-]C(=O)NCC(=O)O Amb27478291 [0,0,0,0,0,0|3,0,1]=4 338 B6R0.4 C#CCCC(=O)Cl Amb26949181 [1,0,0,0,0,0|1,0,2]=4 339 B6R0.4 C#CCCC(=O)O Amb33532622 [1,0,0,0,0,0|0,0,2]=3 340 B6R0.4 C#CCCC(=O)[O-] Amb22232009 [1,0,0,0,0,0|0,0,3]=4 341 B6R0.4 C#CCCC(C)=O Amb8869638 [1,0,0,0,0,0|1,0,2]=4 342 B6R0.4 C#CCCC(C)C Amb4036275 [1,0,0,0,0,0|1,0,1]=3 343 B6R0.4 C#CCCC(C)N Amb27873806 [1,0,0,0,0,0|2,0,1]=4 344 B6R0.4 C#CCCC(C)O Amb27175253 [1,0,0,0,0,0|2,0,1]=4 345 B6R0.4 C#CCCN(C)C Amb24460389 [1,0,0,0,0,0|2,0,1]=4 346 B6R0.4 C#CCCN(C)C Amb32729352 [1,0,0,0,0,0|2,0,1]=4 347 B6R0.4 C#CCNC(C)C Amb30584674 [1,0,0,0,0,0|2,0,1]=4 348 B6R0.4 C#CCNC(C)C Amb6683660 [1,0,0,0,0,0|2,0,1]=4 349 B6R0.4 C#CCOC(C)C Amb26901901 [1,0,0,0,0,0|2,0,1]=4 350 B6R0.4 C#NCCC(C)C Amb31132337 [1,0,0,0,0,0|2,0,0]=3 351 B6R0.4 C=C(Br)CCCCl Amb28320778 [1,0,0,0,0,0|3,0,0]=4 352 B6R0.4 C=C(Br)CCCN Amb27219336 [1,0,0,0,0,0|3,0,0]=4 353 B6R0.4 C=C(Br)CCCO Amb27471781 [1,0,0,0,0,0|3,0,0]=4 354 B6R0.4 C=C(Br)CSCC Amb28063803 [1,0,0,0,0,0|3,0,0]=4 355 B6R0.4 C=C(C)CCCBr Amb22886717 [1,0,0,0,0,0|3,0,0]=4 356 B6R0.4 C=C(C)CCCC Amb2721685 [1,0,0,0,0,0|2,0,0]=3 357 B6R0.4 C=C(C)CCCCl Amb24089299 [1,0,0,0,0,0|3,0,0]=4 358 B6R0.4 C=C(C)CCCN Amb24761452 [1,0,0,0,0,0|3,0,0]=4 359 B6R0.4 C=C(C)CCCN Amb33534233 [1,0,0,0,0,0|3,0,0]=4 360 B6R0.4 C=C(C)CCCO Amb22886814 [1,0,0,0,0,0|0,0,3]=4 361 B6R0.4 C=C(C)CCCS Amb33198962 [1,0,0,0,0,0|3,0,0]=4 362 B6R0.4 C=C(C)CCNC Amb18993045 [1,0,0,0,0,0|3,0,0]=4 363 B6R0.4 C=C(C)CCOC Amb33546340 [1,0,0,0,0,0|3,0,0]=4 364 B6R0.4 C=C(C)CCSC Amb28400079 [1,0,0,0,0,0|3,0,0]=4 365 B6R0.4 C=C(C)CNCC Amb3940049 [1,0,0,0,0,0|3,0,0]=4 366 B6R0.4 C=C(Cl)CCCBr Amb25811643 [1,0,0,0,0,0|3,0,0]=4 367 B6R0.4 C=C(Cl)CCCCl Amb24635037 [1,0,0,0,0,0|3,0,0]=4 368 B6R0.4 C=C(Cl)CCCN Amb27413032 [1,0,0,0,0,0|3,0,0]=4 369 B6R0.4 C=C(Cl)CCCO Amb28065233 [1,0,0,0,0,0|3,0,0]=4 370 B6R0.4 C=C(Cl)CSCC Amb27972493 [1,0,0,0,0,0|3,0,0]=4 371 B6R0.4 C=C(F)CCCO Amb25811029 [1,0,0,0,0,0|3,0,0]=4 372 B6R0.4 C=C(I)CCCCl Amb27239930 [1,0,0,0,0,0|3,0,0]=4 373 B6R0.4 C=C=CCC(=O)O Amb26657414 [1,0,0,0,0,0|0,0,3]=4 374 B6R0.4 C=CCCC(=C)C Amb22228883 [1,0,0,0,0,0|1,0,2]=4 375 B6R0.4 C=CCCC(=O)Cl Amb3939003 [1,0,0,0,0,0|1,0,2]=4 376 B6R0.4 C=CCCC(=O)O Amb3940112 [1,0,0,0,0,0|0,0,2]=3 377 B6R0.4 C=CCCC(C)=O Amb2721704 [1,0,0,0,0,0|1,0,2]=4 378 B6R0.4 C=CCCC(C)Br Amb20669632 [1,0,0,0,0,0|2,0,0]=3 379 B6R0.4 C=CCCC(C)N Amb18121283 [1,0,0,0,0,0|2,0,0]=3 380 B6R0.4 C=CCCC(C)N Amb35751395 [1,0,0,0,0,0|2,0,0]=3 381 B6R0.4 C=CCCC(C)O Amb22059013 [1,0,0,0,0,0|2,0,0]=3 382 B6R0.4 C=CCCC(C)O Amb34915890 [1,0,0,0,0,0|2,0,0]=3 383 B6R0.4 C=CCCC(C)S Amb17939255 [1,0,0,0,0,0|2,0,0]=3 384 B6R0.4 C=CCCC(N)=O Amb28136349 [1,0,0,0,0,0|1,0,2]=4 385 B6R0.4 C=CCCN(C)C Amb27838193 [1,0,0,0,0,0|2,0,0]=3 386 B6R0.4 C=CCC[C@@H](C)O Amb19929324 [1,0,0,0,0,0|2,0,0]=3 387 B6R0.4 C=CCC[C@H](C)O Amb22226511 [1,0,0,0,0,0|2,0,0]=3 388 B6R0.4 C=CCNC(C)C Amb10609485 [1,0,0,0,0,0|2,0,0]=3 389 B6R0.4 C=CCNC(C)C Amb6683889 [1,0,0,0,0,0|2,0,0]=3 390 B6R0.4 C=CCNC(C)C Amb8428139 [1,0,0,0,0,0|2,0,0]=3 391 B6R0.4 C=CNCC(=O)O Amb28346027 [1,0,0,0,0,0|1,0,2]=4 392 B6R0.4 C=COCC(=O)O Amb27247261 [1,0,0,0,0,0|1,0,2]=4 393 B6R0.4 C=COCC(C)C Amb22338580 [1,0,0,0,0,0|2,0,0]=3 394 B6R0.4 C=COCC(C)C Amb6366362 [1,0,0,0,0,0|2,0,0]=3 395 B6R0.4 C=C\C=C\C(C)C Amb27185806 [1,0,0,0,0,0|1,0,2]=4 396 B6R0.4 CC#CCC(=O)O Amb17939740 [1,0,0,0,0,0|0,0,2]=3 397 B6R0.4 CC#CCC(C)=O Amb27648528 [1,0,0,0,0,0|1,0,2]=4 398 B6R0.4 CC(=O)CCC#N Amb17334046 [1,0,0,0,0,0|2,0,1]=4 399 B6R0.4 CC(=O)CCC=O Amb18639597 [1,0,0,0,0,0|1,0,1]=3 400 B6R0.4 CC(=O)CCCBr Amb8394105 [1,0,0,0,0,0|2,0,0]=3 401 B6R0.4 CC(=O)CCCCl Amb3940272 [1,0,0,0,0,0|2,0,0]=3 402 B6R0.4 CC(=O)CCCF Amb25068187 [1,0,0,0,0,0|2,0,0]=3 403 B6R0.4 CC(=O)CCCN Amb18121547 [1,0,0,0,0,0|2,0,0]=3 404 B6R0.4 CC(=O)CCCN Amb32661221 [1,0,0,0,0,0|2,0,0]=3 405 B6R0.4 CC(=O)CCCN Amb32661286 [1,0,0,0,0,0|2,0,0]=3 406 B6R0.4 CC(=O)CCCO Amb3940340 [1,0,0,0,0,0|2,0,0]=3 407 B6R0.4 CC(=O)NCC=O Amb25757509 [1,0,0,0,0,0|2,0,1]=4 408 B6R0.4 CC(=O)NCCBr Amb4311522 [1,0,0,0,0,0|3,0,0]=4 409 B6R0.4 CC(=O)NCCCl Amb423758 [1,0,0,0,0,0|3,0,0]=4 410 B6R0.4 CC(=O)NCCN Amb1218225 [1,0,0,0,0,0|3,0,0]=4 411 B6R0.4 CC(=O)NCCO Amb2720909 [1,0,0,0,0,0|3,0,0]=4 412 B6R0.4 CC(=O)NCCS Amb22230992 [1,0,0,0,0,0|3,0,0]=4 413 B6R0.4 CC(=O)OCCBr Amb3940209 [1,0,0,0,0,0|3,0,0]=4 414 B6R0.4 CC(=O)OCCN Amb18121947 [1,0,0,0,0,0|3,0,0]=4 415 B6R0.4 CC(=O)OCCN Amb28827650 [1,0,0,0,0,0|3,0,0]=4 416 B6R0.4 CC(=O)OCCO Amb3941004 [1,0,0,0,0,0|3,0,0]=4 417 B6R0.4 CC(=O)SCC=O Amb27873378 [1,0,0,0,0,0|2,0,1]=4 418 B6R0.4 CC(=O)SCCBr Amb24608039 [1,0,0,0,0,0|3,0,0]=4 419 B6R0.4 CC(=O)SCCN Amb21953963 [1,0,0,0,0,0|3,0,0]=4 420 B6R0.4 CC(=O)SCCN Amb22011516 [1,0,0,0,0,0|3,0,0]=4 421 B6R0.4 CC(=O)SCCN Amb31291049 [1,0,0,0,0,0|3,0,0]=4 422 B6R0.4 CC(=O)SCCO Amb27481182 [1,0,0,0,0,0|3,0,0]=4 423 B6R0.4 CC(Br)CCC#N Amb23599106 [1,0,0,0,0,0|2,0,1]=4 424 B6R0.4 CC(Br)CCCBr Amb2686750 [1,0,0,0,0,0|2,0,1]=4 425 B6R0.4 CC(Br)CCCF Amb33334194 [1,0,0,0,0,0|2,0,1]=4 426 B6R0.4 CC(C)=CCC=O Amb18120881 [1,0,0,0,0,0|0,0,2]=3 427 B6R0.4 CC(C)=CCCO Amb22002283 [1,0,0,0,0,0|0,0,3]=4 428 B6R0.4 CC(C)=CNC=O Amb27973472 [1,0,0,0,0,0|1,0,2]=4 429 B6R0.4 CC(C)=NCCO Amb27612560 [1,0,0,0,0,0|1,0,2]=4 430 B6R0.4 CC(C)=NNC=O Amb2419224 [1,0,0,0,0,0|2,0,1]=4 431 B6R0.4 CC(C)CCC#N Amb6243011 [1,0,0,0,0,0|1,0,1]=3 432 B6R0.4 CC(C)CCC=O Amb17673735 [1,0,0,0,0,0|0,0,0]=1 433 B6R0.4 CC(C)CCCBr Amb3940143 [1,0,0,0,0,0|1,0,1]=3 434 B6R0.4 CC(C)CCCCl Amb33546075 [1,0,0,0,0,0|1,0,1]=3 435 B6R0.4 CC(C)CCCI Amb27814431 [1,0,0,0,0,0|1,0,1]=3 436 B6R0.4 CC(C)CCCN Amb1136518 [1,0,0,0,0,0|1,0,1]=3 437 B6R0.4 CC(C)CCCN Amb13952127 [1,0,0,0,0,0|1,0,1]=3 438 B6R0.4 CC(C)CCCO Amb3939329 [1,0,0,0,0,0|0,0,1]=2 439 B6R0.4 CC(C)CCCS Amb26425936 [1,0,0,0,0,0|0,1,1]=3 440 B6R0.4 CC(C)CCNN Amb20622972 [1,0,0,0,0,0|2,0,0]=3 441 B6R0.4 CC(C)CCNN Amb28990929 [1,0,0,0,0,0|2,0,0]=3 442 B6R0.4 CC(C)CCNN Amb6244044 [1,0,0,0,0,0|2,0,0]=3 443 B6R0.4 CC(C)CCNO Amb27439608 [1,0,0,0,0,0|1,0,0]=2 444 B6R0.4 CC(C)CCON Amb17101067 [1,0,0,0,0,0|2,0,0]=3 445 B6R0.4 CC(C)CCON Amb28994300 [1,0,0,0,0,0|2,0,0]=3 446 B6R0.4 CC(C)CN=C=O Amb5750714 [1,0,0,0,0,0|1,0,1]=3 447 B6R0.4 CC(C)CN=C=S Amb6565431 [1,0,0,0,0,0|1,1,1]=4 448 B6R0.4 CC(C)CN=[N+]=[N-] Amb25328317 [1,0,0,0,0,0|3,0,0]=4 449 B6R0.4 CC(C)CNC#N Amb28126061 [1,0,0,0,0,0|2,0,1]=4 450 B6R0.4 CC(C)CNC=S Amb27422882 [1,0,0,0,0,0|1,1,0]=3 451 B6R0.4 CC(C)COC#N Amb27449552 [1,0,0,0,0,0|2,0,1]=4 452 B6R0.4 CC(C)COC=O Amb8513682 [1,0,0,0,0,0|1,0,0]=2 453 B6R0.4 CC(C)COCCl Amb27146190 [1,0,0,0,0,0|2,0,1]=4 454 B6R0.4 CC(C)CON=O Amb8514844 [1,0,0,0,0,0|2,0,0]=3 455 B6R0.4 CC(C)CSCCl Amb28347319 [1,0,0,0,0,0|2,0,1]=4 456 B6R0.4 CC(C)C\C=C\Br Amb27974340 [1,0,0,0,0,0|1,0,1]=3 457 B6R0.4 CC(C)C\C=N\N Amb27660829 [1,0,0,0,0,0|2,0,1]=4 458 B6R0.4 CC(C)NCC#N Amb2724416 [1,0,0,0,0,0|2,0,1]=4 459 B6R0.4 CC(C)NCC#N Amb28984223 [1,0,0,0,0,0|2,0,1]=4 460 B6R0.4 CC(C)NCCCl Amb17334075 [1,0,0,0,0,0|2,0,1]=4 461 B6R0.4 CC(C)NCCCl Amb22001878 [1,0,0,0,0,0|2,0,1]=4 462 B6R0.4 CC(C)NCCF Amb27830762 [1,0,0,0,0,0|2,0,1]=4 463 B6R0.4 CC(C)NCCN Amb29844469 [1,0,0,0,0,0|2,0,1]=4 464 B6R0.4 CC(C)NCCN Amb33299284 [1,0,0,0,0,0|2,0,1]=4 465 B6R0.4 CC(C)NCCN Amb8513197 [1,0,0,0,0,0|2,0,1]=4 466 B6R0.4 CC(C)NCCO Amb3939914 [1,0,0,0,0,0|1,0,1]=3 467 B6R0.4 CC(C)OCC#N Amb6279199 [1,0,0,0,0,0|2,0,1]=4 468 B6R0.4 CC(C)OCC=O Amb25820659 [1,0,0,0,0,0|1,0,0]=2 469 B6R0.4 CC(C)OCCBr Amb1105066 [1,0,0,0,0,0|2,0,1]=4 470 B6R0.4 CC(C)OCCCl Amb535223 [1,0,0,0,0,0|2,0,1]=4 471 B6R0.4 CC(C)OCCF Amb27982936 [1,0,0,0,0,0|2,0,1]=4 472 B6R0.4 CC(C)OCCI Amb25936982 [1,0,0,0,0,0|2,0,1]=4 473 B6R0.4 CC(C)OCCN Amb22491045 [1,0,0,0,0,0|2,0,1]=4 474 B6R0.4 CC(C)OCCN Amb2784936 [1,0,0,0,0,0|2,0,1]=4 475 B6R0.4 CC(C)OCCO Amb3939032 [1,0,0,0,0,0|1,0,1]=3 476 B6R0.4 CC(C)OCCS Amb25107566 [1,0,0,0,0,0|1,1,1]=4 477 B6R0.4 CC(C)O\C=C/Br Amb27632454 [1,0,0,0,0,0|2,0,1]=4 478 B6R0.4 CC(C)SCC#N Amb17501743 [1,0,0,0,0,0|2,0,1]=4 479 B6R0.4 CC(C)SCC=O Amb24479811 [1,0,0,0,0,0|1,0,0]=2 480 B6R0.4 CC(C)SCCBr Amb18321807 [1,0,0,0,0,0|2,0,1]=4 481 B6R0.4 CC(C)SCCCl Amb15694848 [1,0,0,0,0,0|2,0,1]=4 482 B6R0.4 CC(C)SCCN Amb21959653 [1,0,0,0,0,0|2,0,1]=4 483 B6R0.4 CC(C)SCCN Amb22586910 [1,0,0,0,0,0|2,0,1]=4 484 B6R0.4 CC(C)SCCN Amb6256717 [1,0,0,0,0,0|2,0,1]=4 485 B6R0.4 CC(C)SCCO Amb3939476 [1,0,0,0,0,0|1,0,1]=3 486 B6R0.4 CC(C)SCCS Amb27226092 [1,0,0,0,0,0|1,1,1]=4 487 B6R0.4 CC(C)S\C=C\Cl Amb26031924 [1,0,0,0,0,0|2,0,1]=4 488 B6R0.4 CC(C)\C=C\C=O Amb8515214 [1,0,0,0,0,0|0,0,2]=3 489 B6R0.4 CC(C)\C=C\CO Amb25802048 [1,0,0,0,0,0|0,0,3]=4 490 B6R0.4 CC(Cl)CCC#N Amb33547855 [1,0,0,0,0,0|2,0,1]=4 491 B6R0.4 CC(Cl)CCC=O Amb18124284 [1,0,0,0,0,0|1,0,0]=2 492 B6R0.4 CC(Cl)CCCCl Amb19516004 [1,0,0,0,0,0|2,0,1]=4 493 B6R0.4 CC(Cl)CCCO Amb28138028 [1,0,0,0,0,0|1,0,1]=3 494 B6R0.4 CC(Cl)CN=S=O Amb28118892 [1,0,0,0,0,0|3,0,0]=4 495 B6R0.4 CC(F)CCC#N Amb27864416 [1,0,0,0,0,0|2,0,1]=4 496 B6R0.4 CC(F)CCCBr Amb27760484 [1,0,0,0,0,0|2,0,1]=4 497 B6R0.4 CC(F)CCCO Amb27186289 [1,0,0,0,0,0|1,0,1]=3 498 B6R0.4 CC(I)CCC#N Amb27838195 [1,0,0,0,0,0|2,0,1]=4 499 B6R0.4 CC(N)CCCF Amb27612972 [1,0,0,0,0,0|2,0,1]=4 500 B6R0.4 CC(N)CCCN Amb22168271 [1,0,0,0,0,0|2,0,1]=4 501 B6R0.4 CC(N)CCCN Amb28827626 [1,0,0,0,0,0|2,0,1]=4 502 B6R0.4 CC(N)CCCO Amb17569888 [1,0,0,0,0,0|1,0,1]=3 503 B6R0.4 CC(N)C\C=C\Cl Amb35606912 [1,0,0,0,0,0|2,0,1]=4 504 B6R0.4 CC(N)NCCO Amb26442749 [1,0,0,0,0,0|2,0,1]=4 505 B6R0.4 CC(O)CCC#N Amb27974459 [1,0,0,0,0,0|2,0,1]=4 506 B6R0.4 CC(O)CCC=O Amb17593090 [1,0,0,0,0,0|1,0,0]=2 507 B6R0.4 CC(O)CCCBr Amb25889007 [1,0,0,0,0,0|2,0,1]=4 508 B6R0.4 CC(O)CCCCl Amb22270232 [1,0,0,0,0,0|2,0,1]=4 509 B6R0.4 CC(O)CCCF Amb24385806 [1,0,0,0,0,0|2,0,1]=4 510 B6R0.4 CC(O)CCCN Amb8630414 [1,0,0,0,0,0|2,0,1]=4 511 B6R0.4 CC(O)CCCO Amb22227752 [1,0,0,0,0,0|1,0,1]=3 512 B6R0.4 CC(O)COC=O Amb27436963 [1,0,0,0,0,0|2,0,0]=3 513 B6R0.4 CC(O)COCO Amb27764974 [1,0,0,0,0,0|2,0,1]=4 514 B6R0.4 CC(O)C\C=C\Br Amb27216240 [1,0,0,0,0,0|2,0,1]=4 515 B6R0.4 CC(O)C\C=C\Cl Amb24479438 [1,0,0,0,0,0|2,0,1]=4 516 B6R0.4 CC(O)OCCO Amb28065279 [1,0,0,0,0,0|2,0,1]=4 517 B6R0.4 CC(O)\C=C\C=O Amb18639615 [1,0,0,0,0,0|1,0,2]=4 518 B6R0.4 CC(S)CCC#N Amb29852814 [1,0,0,0,0,0|2,0,1]=4 519 B6R0.4 CC(S)CCCN Amb18251084 [1,0,0,0,0,0|2,0,1]=4 520 B6R0.4 CC(S)CCCO Amb24412207 [1,0,0,0,0,0|1,0,1]=3 521 B6R0.4 CC=C=CC(=O)O Amb17593065 [1,0,0,0,0,0|0,0,3]=4 522 B6R0.4 CCC#CC(=O)O Amb6336503 [1,0,0,0,0,0|0,0,2]=3 523 B6R0.4 CCC#CC(C)=O Amb2721702 [1,0,0,0,0,0|1,0,2]=4 524 B6R0.4 CCCC=C(C)C Amb4035860 [1,0,0,0,0,0|2,0,1]=4 525 B6R0.4 CCCCB(Cl)Cl Amb22230362 [1,0,0,0,0,0|3,0,0]=4 526 B6R0.4 CCCCB(F)F Amb27268214 [1,0,0,0,0,0|3,0,0]=4 527 B6R0.4 CCCCB(O)O Amb2447142 [1,0,0,0,0,0|1,0,1]=3 528 B6R0.4 CCCCC(=N)N Amb10066937 [1,0,0,0,0,0|2,0,0]=3 529 B6R0.4 CCCCC(=N)N Amb2696360 [1,0,0,0,0,0|2,0,0]=3 530 B6R0.4 CCCCC(=O)Cl Amb3939066 [1,0,0,0,0,0|1,0,0]=2 531 B6R0.4 CCCCC(=O)O Amb3939877 [1,0,0,0,0,0|0,0,0]=1 532 B6R0.4 CCCCC(=O)[O-] Amb22056343 [1,0,0,0,0,0|0,0,1]=2 533 B6R0.4 CCCCC(=S)S Amb27195855 [1,0,0,0,0,0|0,2,0]=3 534 B6R0.4 CCCCC(C)=O Amb6608652 [1,0,0,0,0,0|1,0,0]=2 535 B6R0.4 CCCCC(C)Br Amb4015489 [1,0,0,0,0,0|2,0,1]=4 536 B6R0.4 CCCCC(C)C Amb8513255 [1,0,0,0,0,0|1,0,1]=3 537 B6R0.4 CCCCC(C)I Amb17673919 [1,0,0,0,0,0|2,0,1]=4 538 B6R0.4 CCCCC(C)N Amb33527132 [1,0,0,0,0,0|2,0,1]=4 539 B6R0.4 CCCCC(C)N Amb33532410 [1,0,0,0,0,0|2,0,1]=4 540 B6R0.4 CCCCC(C)O Amb4605977 [1,0,0,0,0,0|1,0,1]=3 541 B6R0.4 CCCCC(C)S Amb26326801 [1,0,0,0,0,0|1,1,1]=4 542 B6R0.4 CCCCC(Cl)Br Amb28050002 [1,0,0,0,0,0|2,0,1]=4 543 B6R0.4 CCCCC(Cl)Cl Amb26420376 [1,0,0,0,0,0|2,0,1]=4 544 B6R0.4 CCCCC(F)Br Amb27211132 [1,0,0,0,0,0|2,0,1]=4 545 B6R0.4 CCCCC(N)=O Amb6891958 [1,0,0,0,0,0|1,0,0]=2 546 B6R0.4 CCCCC(N)=S Amb6249558 [1,0,0,0,0,0|1,1,0]=3 547 B6R0.4 CCCCN(C)N Amb22730468 [1,0,0,0,0,0|3,0,0]=4 548 B6R0.4 CCCCN(C)O Amb33204268 [1,0,0,0,0,0|2,0,0]=3 549 B6R0.4 CCCCP(Cl)Cl Amb25051489 [1,0,0,0,0,0|3,0,0]=4 550 B6R0.4 CCCCS(=O)Cl Amb24551332 [1,0,0,0,0,0|2,0,0]=3 551 B6R0.4 CCCCS(=O)[O-] Amb19889352 [1,0,0,0,0,0|1,0,1]=3 552 B6R0.4 CCCCS(N)=O Amb32720302 [1,0,0,0,0,0|2,0,0]=3 553 B6R0.4 CCCC[C@@H](C)N Amb20242479 [1,0,0,0,0,0|2,0,1]=4 554 B6R0.4 CCCC[C@@H](C)O Amb19929139 [1,0,0,0,0,0|1,0,1]=3 555 B6R0.4 CCCC[C@H](C)N Amb20242478 [1,0,0,0,0,0|2,0,1]=4 556 B6R0.4 CCCC[C@H](C)O Amb8515092 [1,0,0,0,0,0|1,0,1]=3 557 B6R0.4 CCCC[N+](=O)[O-] Amb6298783 [1,0,0,0,0,0|1,0,1]=3 558 B6R0.4 CCCC[PH](=O)O Amb8391286 [1,0,0,0,0,0|1,0,0]=2 559 B6R0.4 CCCC[SiH](C)C Amb9807507 [1,0,0,0,0,0|1,1,1]=4 560 B6R0.4 CCCNC(=N)N Amb10844865 [1,0,0,0,0,0|3,0,0]=4 561 B6R0.4 CCCNC(=N)N Amb20667746 [1,0,0,0,0,0|3,0,0]=4 562 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,0,0,0,0,0|2,0,0]=3 563 B6R0.4 CCCNC(=S)S Amb28128280 [1,0,0,0,0,0|1,2,0]=4 564 B6R0.4 CCCNC(C)=O Amb5835710 [1,0,0,0,0,0|2,0,0]=3 565 B6R0.4 CCCNC(C)C Amb6248300 [1,0,0,0,0,0|2,0,1]=4 566 B6R0.4 CCCNC(N)=O Amb1152241 [1,0,0,0,0,0|2,0,0]=3 567 B6R0.4 CCCNC(N)=S Amb1152085 [1,0,0,0,0,0|2,1,0]=4 568 B6R0.4 CCCN[N+](=O)[O-] Amb21953652 [1,0,0,0,0,0|2,0,1]=4 569 B6R0.4 CCCOC(=O)Cl Amb10604123 [1,0,0,0,0,0|2,0,0]=3 570 B6R0.4 CCCOC(=O)F Amb32667886 [1,0,0,0,0,0|2,0,0]=3 571 B6R0.4 CCCOC(=S)[S-] Amb594778 [1,0,0,0,0,0|1,2,0]=4 572 B6R0.4 CCCOC(C)C Amb27234578 [1,0,0,0,0,0|2,0,1]=4 573 B6R0.4 CCCOC(N)=O Amb6334809 [1,0,0,0,0,0|2,0,0]=3 574 B6R0.4 CCCO[N+](=O)[O-] Amb22732564 [1,0,0,0,0,0|2,0,1]=4 575 B6R0.4 CCCSC(=N)N Amb20676008 [1,0,0,0,0,0|3,0,0]=4 576 B6R0.4 CCCSC(=N)N Amb23482968 [1,0,0,0,0,0|3,0,0]=4 577 B6R0.4 CCCSC(C)=O Amb22043301 [1,0,0,0,0,0|2,0,0]=3 578 B6R0.4 CCCSC(C)C Amb4017934 [1,0,0,0,0,0|2,0,1]=4 579 B6R0.4 CCCSC(N)=O Amb27167907 [1,0,0,0,0,0|2,0,0]=3 580 B6R0.4 CCNCC(=N)N Amb28050789 [1,0,0,0,0,0|3,0,0]=4 581 B6R0.4 CCNCC(=O)Cl Amb27948279 [1,0,0,0,0,0|2,0,0]=3 582 B6R0.4 CCNCC(=O)O Amb10609667 [1,0,0,0,0,0|1,0,0]=2 583 B6R0.4 CCNCC(=O)O Amb7764661 [1,0,0,0,0,0|1,0,0]=2 584 B6R0.4 CCNCC(C)=O Amb24545893 [1,0,0,0,0,0|2,0,0]=3 585 B6R0.4 CCNCC(C)=O Amb32661185 [1,0,0,0,0,0|2,0,0]=3 586 B6R0.4 CCNCC(C)C Amb6247357 [1,0,0,0,0,0|2,0,1]=4 587 B6R0.4 CCNCC(C)C Amb6893129 [1,0,0,0,0,0|2,0,1]=4 588 B6R0.4 CCNCC(C)O Amb32666214 [1,0,0,0,0,0|2,0,1]=4 589 B6R0.4 CCNCC(C)O Amb9247475 [1,0,0,0,0,0|2,0,1]=4 590 B6R0.4 CCNCC(N)=O Amb1128676 [1,0,0,0,0,0|2,0,0]=3 591 B6R0.4 CCNCC(N)=O Amb4035424 [1,0,0,0,0,0|2,0,0]=3 592 B6R0.4 CCNC[C@@H](C)O Amb27827890 [1,0,0,0,0,0|2,0,1]=4 593 B6R0.4 CCNC[C@@H](C)O Amb32652513 [1,0,0,0,0,0|2,0,1]=4 594 B6R0.4 CCNC[C@H](C)O Amb25785620 [1,0,0,0,0,0|2,0,1]=4 595 B6R0.4 CCNC[C@H](C)O Amb32652535 [1,0,0,0,0,0|2,0,1]=4 596 B6R0.4 CCOCC(=N)N Amb19890012 [1,0,0,0,0,0|3,0,0]=4 597 B6R0.4 CCOCC(=N)N Amb6268669 [1,0,0,0,0,0|3,0,0]=4 598 B6R0.4 CCOCC(=O)Cl Amb33528415 [1,0,0,0,0,0|2,0,0]=3 599 B6R0.4 CCOCC(=O)O Amb3939880 [1,0,0,0,0,0|1,0,0]=2 600 B6R0.4 CCOCC(=O)S Amb27813482 [1,0,0,0,0,0|1,1,0]=3 601 B6R0.4 CCOCC(C)=O Amb9666086 [1,0,0,0,0,0|2,0,0]=3 602 B6R0.4 CCOCC(C)O Amb33535096 [1,0,0,0,0,0|2,0,1]=4 603 B6R0.4 CCOCC(N)=S Amb6276655 [1,0,0,0,0,0|2,1,0]=4 604 B6R0.4 CCOC[C@@H](C)O Amb27203934 [1,0,0,0,0,0|2,0,1]=4 605 B6R0.4 CCONC(C)=O Amb22230675 [1,0,0,0,0,0|3,0,0]=4 606 B6R0.4 CCPCC(=O)O Amb28321137 [1,0,0,0,0,0|1,0,0]=2 607 B6R0.4 CCSCC(=N)N Amb6680834 [1,0,0,0,0,0|3,0,0]=4 608 B6R0.4 CCSCC(=O)O Amb1125185 [1,0,0,0,0,0|1,0,0]=2 609 B6R0.4 CCSCC(C)=O Amb4018179 [1,0,0,0,0,0|2,0,0]=3 610 B6R0.4 CCSCC(C)C Amb22230686 [1,0,0,0,0,0|2,0,1]=4 611 B6R0.4 CCSCC(N)=S Amb27188472 [1,0,0,0,0,0|2,1,0]=4 612 B6R0.4 CCSC[C@@H](C)O Amb26059442 [1,0,0,0,0,0|2,0,1]=4 613 B6R0.4 CCSC[C@H](C)O Amb25220206 [1,0,0,0,0,0|2,0,1]=4 614 B6R0.4 CC\C=C/C(=O)O Amb28429841 [1,0,0,0,0,0|0,0,2]=3 615 B6R0.4 CC\C=C/C(C)=O Amb27835645 [1,0,0,0,0,0|1,0,2]=4 616 B6R0.4 CC\C=C\C(=O)Cl Amb2690073 [1,0,0,0,0,0|1,0,2]=4 617 B6R0.4 CC\C=C\C(=O)O Amb6608967 [1,0,0,0,0,0|0,0,2]=3 618 B6R0.4 CC\C=C\C(C)=O Amb26022886 [1,0,0,0,0,0|1,0,2]=4 619 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,0,0,0,0,0|1,0,2]=4 620 B6R0.4 CC\N=C\C(=O)O Amb28041425 [1,0,0,0,0,0|1,0,1]=3 621 B6R0.4 CC\N=C\C(C)=O Amb27854982 [1,0,0,0,0,0|2,0,1]=4 622 B6R0.4 CN(C)C#CC=O Amb27424954 [1,0,0,0,0,0|1,0,2]=4 623 B6R0.4 CN(C)CCC#N Amb3940297 [1,0,0,0,0,0|2,0,1]=4 624 B6R0.4 CN(C)CCC#N Amb9677325 [1,0,0,0,0,0|2,0,1]=4 625 B6R0.4 CN(C)CCC=O Amb22001057 [1,0,0,0,0,0|1,0,0]=2 626 B6R0.4 CN(C)CCCBr Amb10603677 [1,0,0,0,0,0|2,0,1]=4 627 B6R0.4 CN(C)CCCCl Amb33537241 [1,0,0,0,0,0|2,0,1]=4 628 B6R0.4 CN(C)CCCCl Amb8513141 [1,0,0,0,0,0|2,0,1]=4 629 B6R0.4 CN(C)CCCI Amb35781980 [1,0,0,0,0,0|2,0,1]=4 630 B6R0.4 CN(C)CCCN Amb3939839 [1,0,0,0,0,0|2,0,1]=4 631 B6R0.4 CN(C)CCCO Amb3939321 [1,0,0,0,0,0|1,0,1]=3 632 B6R0.4 CN(C)CCCS Amb24078629 [1,0,0,0,0,0|1,1,1]=4 633 B6R0.4 CN(C)CCCS Amb27974610 [1,0,0,0,0,0|1,1,1]=4 634 B6R0.4 CN(C)CCNN Amb1116628 [1,0,0,0,0,0|3,0,0]=4 635 B6R0.4 CN(C)CCNN Amb32414597 [1,0,0,0,0,0|3,0,0]=4 636 B6R0.4 CN(C)CCNN Amb33545778 [1,0,0,0,0,0|3,0,0]=4 637 B6R0.4 CN(C)CCNN Amb6892602 [1,0,0,0,0,0|3,0,0]=4 638 B6R0.4 CN(C)CCON Amb17104842 [1,0,0,0,0,0|3,0,0]=4 639 B6R0.4 CN(C)CCON Amb5721904 [1,0,0,0,0,0|3,0,0]=4 640 B6R0.4 CN(C)CNC=O Amb27216675 [1,0,0,0,0,0|2,0,0]=3 641 B6R0.4 CN(C)C\C=C/Cl Amb27407781 [1,0,0,0,0,0|2,0,1]=4 642 B6R0.4 CN(C)\C=C\C=O Amb3940430 [1,0,0,0,0,0|1,0,2]=4 643 B6R0.4 CN(O)CCCF Amb33480871 [1,0,0,0,0,0|3,0,0]=4 644 B6R0.4 CNCCC(=O)Cl Amb27422890 [1,0,0,0,0,0|2,0,0]=3 645 B6R0.4 CNCCC(=O)O Amb10609760 [1,0,0,0,0,0|1,0,0]=2 646 B6R0.4 CNCCC(=O)O Amb7766400 [1,0,0,0,0,0|1,0,0]=2 647 B6R0.4 CNCCC(C)=O Amb24560306 [1,0,0,0,0,0|2,0,0]=3 648 B6R0.4 CNCCC(C)=O Amb28827637 [1,0,0,0,0,0|2,0,0]=3 649 B6R0.4 CNCCC(C)C Amb10609494 [1,0,0,0,0,0|2,0,0]=3 650 B6R0.4 CNCCC(C)C Amb1114399 [1,0,0,0,0,0|2,0,0]=3 651 B6R0.4 CNCCC(C)N Amb18288833 [1,0,0,0,0,0|3,0,0]=4 652 B6R0.4 CNCCC(C)O Amb17569889 [1,0,0,0,0,0|2,0,1]=4 653 B6R0.4 CNCCC(C)O Amb34141241 [1,0,0,0,0,0|2,0,1]=4 654 B6R0.4 CNCCC(N)=O Amb19959913 [1,0,0,0,0,0|2,0,0]=3 655 B6R0.4 CNCCC(N)=O Amb33538309 [1,0,0,0,0,0|2,0,0]=3 656 B6R0.4 CNCCN(C)C Amb19958398 [1,0,0,0,0,0|3,0,0]=4 657 B6R0.4 CNCCN(C)C Amb3939354 [1,0,0,0,0,0|3,0,0]=4 658 B6R0.4 CNCCN(C)O Amb27628863 [1,0,0,0,0,0|3,0,0]=4 659 B6R0.4 CNCCP(C)C Amb28068836 [1,0,0,0,0,0|3,0,0]=4 660 B6R0.4 CNCCS(C)=O Amb21984676 [1,0,0,0,0,0|3,0,0]=4 661 B6R0.4 CNCC[C@@H](C)N Amb28429755 [1,0,0,0,0,0|3,0,0]=4 662 B6R0.4 CNCC[C@H](C)O Amb27801301 [1,0,0,0,0,0|2,0,1]=4 663 B6R0.4 CNCC[N+](=O)[O-] Amb35704404 [1,0,0,0,0,0|2,0,1]=4 664 B6R0.4 CNOCC(C)C Amb28346650 [1,0,0,0,0,0|3,0,0]=4 665 B6R0.4 CNOCC(C)C Amb32412836 [1,0,0,0,0,0|3,0,0]=4 666 B6R0.4 COCCB(O)O Amb27173037 [1,0,0,0,0,0|2,0,1]=4 667 B6R0.4 COCCC(=N)N Amb2696283 [1,0,0,0,0,0|3,0,0]=4 668 B6R0.4 COCCC(=N)N Amb8630184 [1,0,0,0,0,0|3,0,0]=4 669 B6R0.4 COCCC(=O)Cl Amb2689274 [1,0,0,0,0,0|2,0,0]=3 670 B6R0.4 COCCC(=O)O Amb3938990 [1,0,0,0,0,0|1,0,0]=2 671 B6R0.4 COCCC(C)=O Amb7764907 [1,0,0,0,0,0|2,0,0]=3 672 B6R0.4 COCCC(C)Br Amb18805533 [1,0,0,0,0,0|3,0,0]=4 673 B6R0.4 COCCC(C)Cl Amb27207909 [1,0,0,0,0,0|3,0,0]=4 674 B6R0.4 COCCC(C)N Amb7772188 [1,0,0,0,0,0|3,0,0]=4 675 B6R0.4 COCCC(C)O Amb20621489 [1,0,0,0,0,0|2,0,1]=4 676 B6R0.4 COCCC(C)S Amb27836211 [1,0,0,0,0,0|3,0,0]=4 677 B6R0.4 COCCC(N)=O Amb33538943 [1,0,0,0,0,0|2,0,0]=3 678 B6R0.4 COCCC(N)=S Amb6250669 [1,0,0,0,0,0|2,1,0]=4 679 B6R0.4 COCCC(O)Br Amb20242943 [1,0,0,0,0,0|2,0,1]=4 680 B6R0.4 COCCC(O)O Amb28410462 [1,0,0,0,0,0|1,0,2]=4 681 B6R0.4 COCCN(C)C Amb16231530 [1,0,0,0,0,0|3,0,0]=4 682 B6R0.4 COCCN(C)O Amb33428857 [1,0,0,0,0,0|3,0,0]=4 683 B6R0.4 COCCS(=O)Cl Amb25914790 [1,0,0,0,0,0|3,0,0]=4 684 B6R0.4 COCCS(=O)[O-] Amb26874008 [1,0,0,0,0,0|2,0,1]=4 685 B6R0.4 COCCS(N)=O Amb32720336 [1,0,0,0,0,0|3,0,0]=4 686 B6R0.4 COCC[C@@H](C)N Amb25934655 [1,0,0,0,0,0|3,0,0]=4 687 B6R0.4 COCC[C@@H](C)N Amb33620890 [1,0,0,0,0,0|3,0,0]=4 688 B6R0.4 COCC[C@@H](C)O Amb27237141 [1,0,0,0,0,0|2,0,1]=4 689 B6R0.4 COCC[C@H](C)N Amb25888528 [1,0,0,0,0,0|3,0,0]=4 690 B6R0.4 COCC[C@H](C)N Amb33741910 [1,0,0,0,0,0|3,0,0]=4 691 B6R0.4 COCC[C@H](C)O Amb26559043 [1,0,0,0,0,0|2,0,1]=4 692 B6R0.4 COCNC(N)=O Amb25744350 [1,0,0,0,0,0|3,0,0]=4 693 B6R0.4 CONCC(N)=O Amb28455463 [1,0,0,0,0,0|3,0,0]=4 694 B6R0.4 CO\C=C\C(=O)O Amb18121767 [1,0,0,0,0,0|1,0,2]=4 695 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,0,0,0,0,0|2,0,1]=4 696 B6R0.4 CS(=O)CCCN Amb18974527 [1,0,0,0,0,0|3,0,0]=4 697 B6R0.4 CS(=O)CCCN Amb32684177 [1,0,0,0,0,0|3,0,0]=4 698 B6R0.4 CSC#CC(=O)O Amb33309663 [1,0,0,0,0,0|1,0,2]=4 699 B6R0.4 CSCCC(=N)N Amb19373501 [1,0,0,0,0,0|3,0,0]=4 700 B6R0.4 CSCCC(=N)N Amb19516878 [1,0,0,0,0,0|3,0,0]=4 701 B6R0.4 CSCCC(=O)O Amb3939879 [1,0,0,0,0,0|1,0,0]=2 702 B6R0.4 CSCCC(C)=O Amb8392858 [1,0,0,0,0,0|2,0,0]=3 703 B6R0.4 CSCCC(C)Br Amb33007127 [1,0,0,0,0,0|3,0,0]=4 704 B6R0.4 CSCCC(C)C Amb4016370 [1,0,0,0,0,0|2,0,0]=3 705 B6R0.4 CSCCC(C)N Amb19515505 [1,0,0,0,0,0|3,0,0]=4 706 B6R0.4 CSCCC(C)O Amb27860401 [1,0,0,0,0,0|2,0,1]=4 707 B6R0.4 CSCCC(N)=S Amb17307559 [1,0,0,0,0,0|2,1,0]=4 708 B6R0.4 CSCCN(=O)=O Amb24179458 [1,0,0,0,0,0|2,0,1]=4 709 B6R0.4 CSCCN(C)O Amb33272058 [1,0,0,0,0,0|3,0,0]=4 710 B6R0.4 CSCC[C@@H](C)N Amb33200180 [1,0,0,0,0,0|3,0,0]=4 711 B6R0.4 CSCC[C@@H](C)O Amb33198759 [1,0,0,0,0,0|2,0,1]=4 712 B6R0.4 CSCC[C@H](C)N Amb33200178 [1,0,0,0,0,0|3,0,0]=4 713 B6R0.4 CSCC[C@H](C)O Amb33198747 [1,0,0,0,0,0|2,0,1]=4 714 B6R0.4 CSCSC(C)=O Amb27876851 [1,0,0,0,0,0|3,0,0]=4 715 B6R0.4 CSSCC(=O)O Amb25378801 [1,0,0,0,0,0|2,0,0]=3 716 B6R0.4 CS\C=C\C(=O)O Amb30584688 [1,0,0,0,0,0|1,0,2]=4 717 B6R0.4 C[C@@H](Cl)CCC=O Amb27595266 [1,0,0,0,0,0|1,0,0]=2 718 B6R0.4 C[C@@H](Cl)CCCO Amb27233570 [1,0,0,0,0,0|1,0,1]=3 719 B6R0.4 C[C@@H](N)CCCF Amb33377445 [1,0,0,0,0,0|2,0,1]=4 720 B6R0.4 C[C@@H](N)CCCO Amb27602210 [1,0,0,0,0,0|1,0,1]=3 721 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [1,0,0,0,0,0|2,0,1]=4 722 B6R0.4 C[C@@H](O)CCCF Amb33376908 [1,0,0,0,0,0|2,0,1]=4 723 B6R0.4 C[C@@H](O)CCCO Amb28047449 [1,0,0,0,0,0|1,0,1]=3 724 B6R0.4 C[C@H](Cl)CCC=O Amb28141995 [1,0,0,0,0,0|1,0,0]=2 725 B6R0.4 C[C@H](N)CCCF Amb33377444 [1,0,0,0,0,0|2,0,1]=4 726 B6R0.4 C[C@H](N)CNC=S Amb28365925 [1,0,0,0,0,0|2,1,0]=4 727 B6R0.4 C[C@H](O)CCC=O Amb27188424 [1,0,0,0,0,0|1,0,0]=2 728 B6R0.4 C[C@H](O)CCCF Amb33376887 [1,0,0,0,0,0|2,0,1]=4 729 B6R0.4 C[SiH](C)CCCCl Amb27655852 [1,0,0,0,0,0|1,1,1]=4 730 B6R0.4 C\C=C/CC(C)C Amb27421132 [1,0,0,0,0,0|1,0,1]=3 731 B6R0.4 C\C=C\CC(=O)O Amb3941538 [1,0,0,0,0,0|0,0,2]=3 732 B6R0.4 C\C=C\CC(C)N Amb27843415 [1,0,0,0,0,0|2,0,1]=4 733 B6R0.4 C\C=C\CC(N)=O Amb26589975 [1,0,0,0,0,0|1,0,2]=4 734 B6R0.4 C\C=C\C[C@H](C)O Amb27662307 [1,0,0,0,0,0|2,0,1]=4 735 B6R0.4 C\C=C\NC(C)C Amb28457171 [1,0,0,0,0,0|2,0,1]=4 736 B6R0.4 C\N=C\CC(C)=O Amb28202181 [1,0,0,0,0,0|2,0,1]=4 737 B6R0.4 N#CCCC(=O)Cl Amb25106570 [1,0,0,0,0,0|2,0,1]=4 738 B6R0.4 N#CCCC(=O)O Amb2694975 [1,0,0,0,0,0|1,0,1]=3 739 B6R0.4 N#CCCC(N)=O Amb8841150 [1,0,0,0,0,0|2,0,1]=4 740 B6R0.4 N=C(N)CCCBr Amb4297022 [1,0,0,0,0,0|3,0,0]=4 741 B6R0.4 N=C(N)CCCCl Amb4297061 [1,0,0,0,0,0|3,0,0]=4 742 B6R0.4 N=C(N)CCCF Amb27231400 [1,0,0,0,0,0|3,0,0]=4 743 B6R0.4 N=C(N)CCCN Amb25888970 [1,0,0,0,0,0|3,0,0]=4 744 B6R0.4 N=C(N)CCCN Amb33299271 [1,0,0,0,0,0|3,0,0]=4 745 B6R0.4 N=C(N)CCCO Amb33038287 [1,0,0,0,0,0|3,0,0]=4 746 B6R0.4 N=CNCC(=O)O Amb24670244 [1,0,0,0,0,0|2,0,1]=4 747 B6R0.4 NC(=O)CCCCl Amb1138237 [1,0,0,0,0,0|2,0,0]=3 748 B6R0.4 NC(=O)CCCF Amb28073400 [1,0,0,0,0,0|2,0,0]=3 749 B6R0.4 NC(=O)CCCO Amb20623438 [1,0,0,0,0,0|2,0,0]=3 750 B6R0.4 NC(=O)CCCS Amb27174778 [1,0,0,0,0,0|2,0,0]=3 751 B6R0.4 NC(=O)NCCBr Amb28385599 [1,0,0,0,0,0|3,0,0]=4 752 B6R0.4 NC(=O)NCCF Amb27446994 [1,0,0,0,0,0|3,0,0]=4 753 B6R0.4 NC(=O)NCCI Amb27454955 [1,0,0,0,0,0|3,0,0]=4 754 B6R0.4 NC(=O)NCCO Amb1146041 [1,0,0,0,0,0|3,0,0]=4 755 B6R0.4 NC(=O)OCCCl Amb3940645 [1,0,0,0,0,0|3,0,0]=4 756 B6R0.4 NC(=O)OCCO Amb20623788 [1,0,0,0,0,0|3,0,0]=4 757 B6R0.4 NC(=O)SCCCl Amb27619850 [1,0,0,0,0,0|3,0,0]=4 758 B6R0.4 NC(=S)CCCBr Amb33328371 [1,0,0,0,0,0|2,1,0]=4 759 B6R0.4 NC(=S)CCCCl Amb33328364 [1,0,0,0,0,0|2,1,0]=4 760 B6R0.4 NC(=S)CCCO Amb9215001 [1,0,0,0,0,0|2,1,0]=4 761 B6R0.4 NCC#CC(=O)O Amb25703096 [1,0,0,0,0,0|1,0,2]=4 762 B6R0.4 NCC#CC(=O)O Amb32666878 [1,0,0,0,0,0|1,0,2]=4 763 B6R0.4 NCCCB(O)O Amb25878196 [1,0,0,0,0,0|2,0,1]=4 764 B6R0.4 NCCCB(O)O Amb33339111 [1,0,0,0,0,0|2,0,1]=4 765 B6R0.4 NCCCC(=O)Cl Amb1935063 [1,0,0,0,0,0|2,0,0]=3 766 B6R0.4 NCCCC(=O)O Amb1935210 [1,0,0,0,0,0|1,0,0]=2 767 B6R0.4 NCCCC(N)=O Amb2099583 [1,0,0,0,0,0|2,0,0]=3 768 B6R0.4 NCCCC(N)=O Amb6543438 [1,0,0,0,0,0|2,0,0]=3 769 B6R0.4 NCCCS(=O)O Amb25185942 [1,0,0,0,0,0|2,0,0]=3 770 B6R0.4 NCCC[N+](=O)[O-] Amb18833132 [1,0,0,0,0,0|2,0,1]=4 771 B6R0.4 NCCC[PH](=O)O Amb22370049 [1,0,0,0,0,0|2,0,0]=3 772 B6R0.4 NCCNC(N)=O Amb19374121 [1,0,0,0,0,0|3,0,0]=4 773 B6R0.4 NCCNC(N)=O Amb32665340 [1,0,0,0,0,0|3,0,0]=4 774 B6R0.4 NCCNC(N)=O Amb6254968 [1,0,0,0,0,0|3,0,0]=4 775 B6R0.4 NCCOC(N)=O Amb22059480 [1,0,0,0,0,0|3,0,0]=4 776 B6R0.4 NCCOC(N)=O Amb24271076 [1,0,0,0,0,0|3,0,0]=4 777 B6R0.4 NCCOS(=O)O Amb25843211 [1,0,0,0,0,0|3,0,0]=4 778 B6R0.4 NCCO[PH](=O)O Amb28046334 [1,0,0,0,0,0|3,0,0]=4 779 B6R0.4 NC\C=C/C(=O)O Amb24117018 [1,0,0,0,0,0|1,0,2]=4 780 B6R0.4 NC\C=C\C(=O)O Amb33422010 [1,0,0,0,0,0|1,0,2]=4 781 B6R0.4 NC\C=C\C(=O)O Amb33422035 [1,0,0,0,0,0|1,0,2]=4 782 B6R0.4 NNCCC(=O)O Amb33756816 [1,0,0,0,0,0|2,0,0]=3 783 B6R0.4 NOCCC(=O)O Amb17569891 [1,0,0,0,0,0|2,0,0]=3 784 B6R0.4 NOCCC(=O)O Amb32693437 [1,0,0,0,0,0|2,0,0]=3 785 B6R0.4 NOCCC(N)=O Amb27838275 [1,0,0,0,0,0|3,0,0]=4 786 B6R0.4 NS(=O)CCCBr Amb32720400 [1,0,0,0,0,0|3,0,0]=4 787 B6R0.4 NS(=O)CCCCl Amb32720303 [1,0,0,0,0,0|3,0,0]=4 788 B6R0.4 NS(=O)CCCF Amb32720390 [1,0,0,0,0,0|3,0,0]=4 789 B6R0.4 O=C(Br)CCCBr Amb25724818 [1,0,0,0,0,0|2,0,0]=3 790 B6R0.4 O=C(Cl)CCCBr Amb3940241 [1,0,0,0,0,0|2,0,0]=3 791 B6R0.4 O=C(Cl)CCCCl Amb6608638 [1,0,0,0,0,0|2,0,0]=3 792 B6R0.4 O=C(Cl)NCCBr Amb28123956 [1,0,0,0,0,0|3,0,0]=4 793 B6R0.4 O=C(Cl)NCCCl Amb24479815 [1,0,0,0,0,0|3,0,0]=4 794 B6R0.4 O=C(Cl)NCCF Amb35633248 [1,0,0,0,0,0|3,0,0]=4 795 B6R0.4 O=C(Cl)OCCBr Amb8514406 [1,0,0,0,0,0|3,0,0]=4 796 B6R0.4 O=C(Cl)OCCCl Amb6608837 [1,0,0,0,0,0|3,0,0]=4 797 B6R0.4 O=C(Cl)OCCF Amb21618836 [1,0,0,0,0,0|3,0,0]=4 798 B6R0.4 O=C(O)C#CCCl Amb33544591 [1,0,0,0,0,0|1,0,2]=4 799 B6R0.4 O=C(O)C#CCI Amb27860307 [1,0,0,0,0,0|1,0,2]=4 800 B6R0.4 O=C(O)C#CCO Amb22002375 [1,0,0,0,0,0|1,0,2]=4 801 B6R0.4 O=C(O)CCCBr Amb8393276 [1,0,0,0,0,0|1,0,0]=2 802 B6R0.4 O=C(O)CCCCl Amb3940333 [1,0,0,0,0,0|1,0,0]=2 803 B6R0.4 O=C(O)CCCF Amb17593104 [1,0,0,0,0,0|1,0,0]=2 804 B6R0.4 O=C(O)CCCI Amb22295911 [1,0,0,0,0,0|1,0,0]=2 805 B6R0.4 O=C(O)CCCO Amb18640332 [1,0,0,0,0,0|1,0,0]=2 806 B6R0.4 O=C(O)CCCS Amb16185429 [1,0,0,0,0,0|1,0,0]=2 807 B6R0.4 O=C(O)CCNO Amb28067767 [1,0,0,0,0,0|2,0,0]=3 808 B6R0.4 O=C(O)CCSCl Amb28387511 [1,0,0,0,0,0|2,0,0]=3 809 B6R0.4 O=C(O)COCF Amb33378705 [1,0,0,0,0,0|2,0,0]=3 810 B6R0.4 O=C(O)CPCO Amb28340565 [1,0,0,0,0,0|2,0,0]=3 811 B6R0.4 O=C(O)CSSCl Amb27477882 [1,0,0,0,0,0|3,0,0]=4 812 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [1,0,0,0,0,0|1,0,2]=4 813 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [1,0,0,0,0,0|1,0,2]=4 814 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [1,0,0,0,0,0|1,0,2]=4 815 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [1,0,0,0,0,0|1,0,2]=4 816 B6R0.4 O=C(O)\C=C\CF Amb33470171 [1,0,0,0,0,0|1,0,2]=4 817 B6R0.4 O=C(O)\C=C\CO Amb32662006 [1,0,0,0,0,0|1,0,2]=4 818 B6R0.4 O=C(S)NCCO Amb27430045 [1,0,0,0,0,0|2,1,0]=4 819 B6R0.4 O=C([O-])CCCO Amb3429667 [1,0,0,0,0,0|1,0,1]=3 820 B6R0.4 O=C([O-])CNCO Amb8383630 [1,0,0,0,0,0|2,0,1]=4 821 B6R0.4 O=CCCC(=O)O Amb17673897 [1,0,0,0,0,0|1,0,1]=3 822 B6R0.4 O=CCCC(F)F Amb25848573 [1,0,0,0,0,0|2,0,0]=3 823 B6R0.4 O=CCCC(O)O Amb27838257 [1,0,0,0,0,0|2,0,0]=3 824 B6R0.4 O=CCC[N+](=O)[O-] Amb24052990 [1,0,0,0,0,0|3,0,0]=4 825 B6R0.4 O=CNCC(=O)O Amb1911508 [1,0,0,0,0,0|2,0,1]=4 826 B6R0.4 O=COCC(=O)O Amb26624011 [1,0,0,0,0,0|2,0,1]=4 827 B6R0.4 O=S(Cl)CCCBr Amb32720399 [1,0,0,0,0,0|3,0,0]=4 828 B6R0.4 O=S(Cl)CCCCl Amb25791632 [1,0,0,0,0,0|3,0,0]=4 829 B6R0.4 O=S(Cl)CCCF Amb32720389 [1,0,0,0,0,0|3,0,0]=4 830 B6R0.4 O=S(O)COCO Amb27410575 [1,0,0,0,0,0|3,0,0]=4 831 B6R0.4 O=S(O)OCCCl Amb27786730 [1,0,0,0,0,0|3,0,0]=4 832 B6R0.4 O=S([O-])CCCBr Amb32754123 [1,0,0,0,0,0|2,0,1]=4 833 B6R0.4 O=S([O-])CCCCl Amb26370094 [1,0,0,0,0,0|2,0,1]=4 834 B6R0.4 O=S([O-])CCCF Amb32754093 [1,0,0,0,0,0|2,0,1]=4 835 B6R0.4 O=S([O-])CCCO Amb27221257 [1,0,0,0,0,0|2,0,1]=4 836 B6R0.4 O=[N+]([O-])CCCCl Amb25267487 [1,0,0,0,0,0|2,0,1]=4 837 B6R0.4 O=[N+]([O-])CCCF Amb25234942 [1,0,0,0,0,0|2,0,1]=4 838 B6R0.4 O=[N+]([O-])CCCO Amb20247690 [1,0,0,0,0,0|2,0,1]=4 839 B6R0.4 O=[PH](O)CCCO Amb28345330 [1,0,0,0,0,0|2,0,0]=3 840 B6R0.4 OB(O)CCCBr Amb24480413 [1,0,0,0,0,0|2,0,1]=4 841 B6R0.4 OB(O)CCCCl Amb28347311 [1,0,0,0,0,0|2,0,1]=4 842 B6R0.4 OCCCB(O)O Amb27391604 [1,0,0,0,0,0|2,0,1]=4 843 B6R0.4 OCCCC(F)F Amb26940819 [1,0,0,0,0,0|2,0,1]=4 844 B6R0.4 [C-]#[N+]CCC(C)C Amb2688906 [1,0,0,0,0,0|2,0,0]=3 845 B6R0.4 [C-]#[N+]CCN(C)C Amb1981033 [1,0,0,0,0,0|3,0,0]=4 846 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [1,0,0,0,0,0|3,0,0]=4 847 B8R0.9 C#CC(=C)CCC(=O)O Amb27655639 [0,1,0,0,0,0|0,0,3]=4 848 B8R0.9 C#CC(=O)CCN(C)C Amb28198080 [0,1,0,0,0,0|2,0,0]=3 849 B8R0.9 C#CC(=O)COC(C)C Amb28253401 [0,1,0,0,0,0|2,0,0]=3 850 B8R0.9 C#CC(=O)NCC(C)N Amb27406534 [0,1,0,0,0,0|3,0,0]=4 851 B8R0.9 C#CC(=O)OCC(C)Br Amb33050567 [0,1,0,0,0,0|3,0,0]=4 852 B8R0.9 C#CC(=O)OC[C@@H](C)O Amb27761509 [0,1,0,0,0,0|3,0,0]=4 853 B8R0.9 C#CC(=O)OC[C@H](C)O Amb27613818 [0,1,0,0,0,0|3,0,0]=4 854 B8R0.9 C#CC(C)CCC(N)=O Amb27602261 [0,1,0,0,0,0|1,0,1]=3 855 B8R0.9 C#CC(C)NCC(=O)O Amb27207997 [0,1,0,0,0,0|1,0,1]=3 856 B8R0.9 C#CC(C)NCC(N)=O Amb28352348 [0,1,0,0,0,0|2,0,1]=4 857 B8R0.9 C#CC(C)SCC(=O)O Amb27168265 [0,1,0,0,0,0|1,0,1]=3 858 B8R0.9 C#CC(F)CCC(=O)O Amb28041990 [0,1,0,0,0,0|1,0,1]=3 859 B8R0.9 C#CC(N)CCC(=O)O Amb22352566 [0,1,0,0,0,0|1,0,1]=3 860 B8R0.9 C#CC(O)CCC(C)N Amb35740609 [0,1,0,0,0,0|2,0,1]=4 861 B8R0.9 C=C(Br)CNC(C)CO Amb18303323 [0,1,0,0,0,0|3,0,0]=4 862 B8R0.9 C=C(C)CCC(=O)CN Amb27809573 [0,1,0,0,0,0|1,0,2]=4 863 B8R0.9 C=C(C)CCC(C)CBr Amb27794197 [0,1,0,0,0,0|2,0,0]=3 864 B8R0.9 C=C(C)CCC(C)CN Amb27180681 [0,1,0,0,0,0|2,0,0]=3 865 B8R0.9 C=C(C)CCC(C)NC Amb27452757 [0,1,0,0,0,0|2,0,0]=3 866 B8R0.9 C=C(C)CCC(N)CC Amb27395082 [0,1,0,0,0,0|3,0,0]=4 867 B8R0.9 C=C(C)CCC(N)CN Amb27422880 [0,1,0,0,0,0|3,0,0]=4 868 B8R0.9 C=C(C)CCC(O)CO Amb28315440 [0,1,0,0,0,0|3,0,0]=4 869 B8R0.9 C=C(C)CNC(=O)CO Amb27866006 [0,1,0,0,0,0|1,0,2]=4 870 B8R0.9 C=C(C)CNC(=O)OC Amb27473324 [0,1,0,0,0,0|1,0,2]=4 871 B8R0.9 C=C(C)CNC(C)CC Amb17308623 [0,1,0,0,0,0|3,0,0]=4 872 B8R0.9 C=C(C)CNC(C)CN Amb27166201 [0,1,0,0,0,0|3,0,0]=4 873 B8R0.9 C=C(C)COC(=O)CO Amb28280952 [0,1,0,0,0,0|1,0,2]=4 874 B8R0.9 C=C(C)COC(C)CN Amb18630505 [0,1,0,0,0,0|3,0,0]=4 875 B8R0.9 C=C(C)CSC(C)CC Amb27615012 [0,1,0,0,0,0|3,0,0]=4 876 B8R0.9 C=C(C)CSC(C)CO Amb28046498 [0,1,0,0,0,0|3,0,0]=4 877 B8R0.9 C=C(C=O)CCC(=O)O Amb27655564 [0,1,0,0,0,0|0,0,3]=4 878 B8R0.9 C=C(CBr)CCN(C)C Amb33007727 [0,1,0,0,0,0|3,0,0]=4 879 B8R0.9 C=C(CBr)COC(C)C Amb33432394 [0,1,0,0,0,0|3,0,0]=4 880 B8R0.9 C=C(CC)CNC(C)C Amb27448942 [0,1,0,0,0,0|3,0,0]=4 881 B8R0.9 C=C(CCl)CCN(C)C Amb33057366 [0,1,0,0,0,0|3,0,0]=4 882 B8R0.9 C=C(CCl)COC(C)C Amb27489533 [0,1,0,0,0,0|3,0,0]=4 883 B8R0.9 C=C(CN)CCN(C)C Amb33271981 [0,1,0,0,0,0|3,0,0]=4 884 B8R0.9 C=C(CN)COC(C)C Amb24763256 [0,1,0,0,0,0|3,0,0]=4 885 B8R0.9 C=C(CO)CC=C(C)C Amb27665270 [0,1,0,0,0,0|1,0,2]=4 886 B8R0.9 C=C(CO)CCN(C)C Amb28049092 [0,1,0,0,0,0|2,0,0]=3 887 B8R0.9 C=C(CO)SCC(C)C Amb27805315 [0,1,0,0,0,0|2,0,0]=3 888 B8R0.9 C=C(Cl)CNC(C)CO Amb18303324 [0,1,0,0,0,0|3,0,0]=4 889 B8R0.9 C=C(Cl)CSC(C)CC Amb28062133 [0,1,0,0,0,0|3,0,0]=4 890 B8R0.9 C=C=C(C)CNC(C)C Amb27643817 [0,1,0,0,0,0|3,0,0]=4 891 B8R0.9 C=CC(=C)CCC(=O)O Amb18642412 [0,1,0,0,0,0|0,0,3]=4 892 B8R0.9 C=CC(=C)CCC(C)O Amb27956504 [0,1,0,0,0,0|3,0,0]=4 893 B8R0.9 C=CC(=C)CC[C@H](C)O Amb28207351 [0,1,0,0,0,0|3,0,0]=4 894 B8R0.9 C=CC(=O)CC=C(C)C Amb27838740 [0,1,0,0,0,0|1,0,2]=4 895 B8R0.9 C=CC(=O)CCC(C)C Amb25341966 [0,1,0,0,0,0|1,0,0]=2 896 B8R0.9 C=CC(=O)CCN(C)C Amb27838465 [0,1,0,0,0,0|2,0,0]=3 897 B8R0.9 C=CC(=O)COC(C)C Amb24614526 [0,1,0,0,0,0|2,0,0]=3 898 B8R0.9 C=CC(=O)CSC(C)C Amb28313053 [0,1,0,0,0,0|2,0,0]=3 899 B8R0.9 C=CC(=O)NCC(C)N Amb27837537 [0,1,0,0,0,0|3,0,0]=4 900 B8R0.9 C=CC(=O)NCC(C)O Amb9361385 [0,1,0,0,0,0|3,0,0]=4 901 B8R0.9 C=CC(=O)OCC(C)C Amb3940723 [0,1,0,0,0,0|2,0,0]=3 902 B8R0.9 C=CC(=O)OCC(C)O Amb4016502 [0,1,0,0,0,0|3,0,0]=4 903 B8R0.9 C=CC(=O)OCN(C)C Amb28058081 [0,1,0,0,0,0|3,0,0]=4 904 B8R0.9 C=CC(=O)\C=C\C(C)C Amb26344609 [0,1,0,0,0,0|1,0,2]=4 905 B8R0.9 C=CC(Br)CCC(C)C Amb27232781 [0,1,0,0,0,0|2,0,1]=4 906 B8R0.9 C=CC(C)CCC(C)=O Amb26390728 [0,1,0,0,0,0|1,0,1]=3 907 B8R0.9 C=CC(C)OCC(=O)O Amb18642764 [0,1,0,0,0,0|1,0,1]=3 908 B8R0.9 C=CC(C)SCC(C)=O Amb27837610 [0,1,0,0,0,0|2,0,1]=4 909 B8R0.9 C=CC(N)CCC(=O)O Amb10843623 [0,1,0,0,0,0|1,0,1]=3 910 B8R0.9 C=CC(N)CCC(=O)O Amb22056347 [0,1,0,0,0,0|1,0,1]=3 911 B8R0.9 C=CC(O)CCC(=O)O Amb25785193 [0,1,0,0,0,0|1,0,1]=3 912 B8R0.9 C=CC(O)CCC(C)C Amb28397043 [0,1,0,0,0,0|1,0,1]=3 913 B8R0.9 C=CC(O)CCN(C)C Amb24649110 [0,1,0,0,0,0|2,0,1]=4 914 B8R0.9 C=CC(O)COC(C)C Amb26516191 [0,1,0,0,0,0|2,0,1]=4 915 B8R0.9 C=CC([NH3+])CCC(=O)O Amb10845648 [0,1,0,0,0,0|1,0,1]=3 916 B8R0.9 C=C[C@H](N)CCC(=O)O Amb25694354 [0,1,0,0,0,0|1,0,1]=3 917 B8R0.9 C=C[C@H](O)CCC(=O)O Amb27168215 [0,1,0,0,0,0|1,0,1]=3 918 B8R0.9 C=C\C(C)=C\CC(=O)O Amb33276241 [0,1,0,0,0,0|0,0,3]=4 919 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,1,0,0,0,0|2,0,1]=4 920 B8R0.9 CC(=O)CCC(=O)NO Amb26971070 [0,1,0,0,0,0|1,0,1]=3 921 B8R0.9 CC(=O)CCC(C)C=O Amb18642612 [0,1,0,0,0,0|1,0,1]=3 922 B8R0.9 CC(=O)CCC(C)CO Amb27838673 [0,1,0,0,0,0|1,0,0]=2 923 B8R0.9 CC(=O)CCC(Cl)CCl Amb27259129 [0,1,0,0,0,0|2,0,0]=3 924 B8R0.9 CC(=O)CCC(F)CCl Amb28060125 [0,1,0,0,0,0|2,0,0]=3 925 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,1,0,0,0,0|2,0,0]=3 926 B8R0.9 CC(=O)CCC(O)CF Amb28322193 [0,1,0,0,0,0|2,0,0]=3 927 B8R0.9 CC(=O)CCN(C)C=O Amb27802453 [0,1,0,0,0,0|2,0,1]=4 928 B8R0.9 CC(=O)CCN(C)N=O Amb28364300 [0,1,0,0,0,0|3,0,0]=4 929 B8R0.9 CC(=O)CNC(C)CO Amb27614242 [0,1,0,0,0,0|2,0,0]=3 930 B8R0.9 CC(=O)COC(C)CN Amb18110559 [0,1,0,0,0,0|2,0,0]=3 931 B8R0.9 CC(=O)NCC(=O)CO Amb27494067 [0,1,0,0,0,0|2,0,1]=4 932 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [0,1,0,0,0,0|2,0,1]=4 933 B8R0.9 CC(=O)NCC(C)C=O Amb27485699 [0,1,0,0,0,0|2,0,1]=4 934 B8R0.9 CC(=O)NCC(C)CN Amb18300590 [0,1,0,0,0,0|2,0,0]=3 935 B8R0.9 CC(=O)NCC(C)ON Amb17138377 [0,1,0,0,0,0|3,0,0]=4 936 B8R0.9 CC(=O)NC[C@@H](O)CO Amb27156658 [0,1,0,0,0,0|3,0,0]=4 937 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,1,0,0,0,0|3,0,0]=4 938 B8R0.9 CC(=O)OCC(=O)CO Amb28253910 [0,1,0,0,0,0|2,0,1]=4 939 B8R0.9 CC(=O)OCC(C)CBr Amb22386917 [0,1,0,0,0,0|2,0,0]=3 940 B8R0.9 CC(=O)OCC(F)CO Amb27443281 [0,1,0,0,0,0|3,0,0]=4 941 B8R0.9 CC(=O)OCC(N)CO Amb33140919 [0,1,0,0,0,0|3,0,0]=4 942 B8R0.9 CC(=O)OCC(O)CCl Amb17593815 [0,1,0,0,0,0|3,0,0]=4 943 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,1,0,0,0,0|3,0,0]=4 944 B8R0.9 CC(=O)OCC(S)CCl Amb28056223 [0,1,0,0,0,0|3,0,0]=4 945 B8R0.9 CC(=O)OC[C@@H](O)CCl Amb27469927 [0,1,0,0,0,0|3,0,0]=4 946 B8R0.9 CC(=O)OC[C@H](C)C=O Amb27230590 [0,1,0,0,0,0|2,0,1]=4 947 B8R0.9 CC(=O)OC[C@H](C)CBr Amb28385279 [0,1,0,0,0,0|2,0,0]=3 948 B8R0.9 CC(=O)SCC(C)C=O Amb27827463 [0,1,0,0,0,0|2,0,1]=4 949 B8R0.9 CC(=O)SCC(C)CCl Amb4605870 [0,1,0,0,0,0|2,0,0]=3 950 B8R0.9 CC(=O)SC[C@H](O)CO Amb27261704 [0,1,0,0,0,0|3,0,0]=4 951 B8R0.9 CC(C#CC(=O)O)CN Amb33168959 [0,1,0,0,0,0|0,0,2]=3 952 B8R0.9 CC(C#N)NCC(=O)O Amb18293465 [0,1,0,0,0,0|1,0,1]=3 953 B8R0.9 CC(C)=CC[C@@H](C)CO Amb27619671 [0,1,0,0,0,0|2,0,1]=4 954 B8R0.9 CC(C)CCC(=O)CCl Amb20668816 [0,1,0,0,0,0|1,0,0]=2 955 B8R0.9 CC(C)CCC(=O)CN Amb27599814 [0,1,0,0,0,0|1,0,0]=2 956 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,1,0,0,0,0|0,0,0]=1 957 B8R0.9 CC(C)CCC(=O)NN Amb6744504 [0,1,0,0,0,0|1,0,0]=2 958 B8R0.9 CC(C)CCC(=O)NO Amb6744847 [0,1,0,0,0,0|0,0,0]=1 959 B8R0.9 CC(C)CCC(C)CBr Amb26565964 [0,1,0,0,0,0|2,0,1]=4 960 B8R0.9 CC(C)CCC(C)CCl Amb25774761 [0,1,0,0,0,0|2,0,1]=4 961 B8R0.9 CC(C)CCC(C)CN Amb8950152 [0,1,0,0,0,0|2,0,1]=4 962 B8R0.9 CC(C)CCC(C)CO Amb24478637 [0,1,0,0,0,0|1,0,1]=3 963 B8R0.9 CC(C)CCC(F)CO Amb28315415 [0,1,0,0,0,0|1,0,1]=3 964 B8R0.9 CC(C)CCC(N)CO Amb18832528 [0,1,0,0,0,0|1,0,1]=3 965 B8R0.9 CC(C)CCC(N)CO Amb28960290 [0,1,0,0,0,0|1,0,1]=3 966 B8R0.9 CC(C)CCC(O)CCl Amb27473402 [0,1,0,0,0,0|1,0,1]=3 967 B8R0.9 CC(C)CCC(O)CN Amb28282095 [0,1,0,0,0,0|1,0,1]=3 968 B8R0.9 CC(C)CC[C@@H](C)CN Amb33747730 [0,1,0,0,0,0|2,0,1]=4 969 B8R0.9 CC(C)CC[C@@H](C)CO Amb27156839 [0,1,0,0,0,0|1,0,1]=3 970 B8R0.9 CC(C)CC[C@H](C)CN Amb33747151 [0,1,0,0,0,0|2,0,1]=4 971 B8R0.9 CC(C)CC[C@H](C)CO Amb25781634 [0,1,0,0,0,0|1,0,1]=3 972 B8R0.9 CC(C)CC[C@H](O)CO Amb28315482 [0,1,0,0,0,0|0,0,2]=3 973 B8R0.9 CC(C)CC\C(Cl)=N\O Amb28366200 [0,1,0,0,0,0|1,0,0]=2 974 B8R0.9 CC(C)CC\C(N)=N\N Amb28290196 [0,1,0,0,0,0|2,0,0]=3 975 B8R0.9 CC(C)CC\C(N)=N\O Amb10205331 [0,1,0,0,0,0|1,0,0]=2 976 B8R0.9 CC(C)CNC(=O)CBr Amb10608023 [0,1,0,0,0,0|2,0,0]=3 977 B8R0.9 CC(C)CNC(=O)CCl Amb1160207 [0,1,0,0,0,0|2,0,0]=3 978 B8R0.9 CC(C)CNC(=O)CN Amb13951745 [0,1,0,0,0,0|2,0,0]=3 979 B8R0.9 CC(C)CNC(=O)CN Amb5783029 [0,1,0,0,0,0|2,0,0]=3 980 B8R0.9 CC(C)CNC(=O)CO Amb9421416 [0,1,0,0,0,0|1,0,0]=2 981 B8R0.9 CC(C)CNC(=O)NN Amb8854030 [0,1,0,0,0,0|2,0,0]=3 982 B8R0.9 CC(C)CNC(=S)C#N Amb27830555 [0,1,0,0,0,0|2,1,0]=4 983 B8R0.9 CC(C)CNC(=S)NN Amb9205773 [0,1,0,0,0,0|2,1,0]=4 984 B8R0.9 CC(C)COC(=O)CBr Amb22036611 [0,1,0,0,0,0|2,0,0]=3 985 B8R0.9 CC(C)COC(=O)CN Amb19011993 [0,1,0,0,0,0|2,0,0]=3 986 B8R0.9 CC(C)COC(=O)CO Amb27218940 [0,1,0,0,0,0|1,0,0]=2 987 B8R0.9 CC(C)COC(=S)NN Amb28421757 [0,1,0,0,0,0|2,1,0]=4 988 B8R0.9 CC(C)COC(C)CO Amb24395755 [0,1,0,0,0,0|2,0,1]=4 989 B8R0.9 CC(C)COS(=O)CCl Amb28145714 [0,1,0,0,0,0|3,0,0]=4 990 B8R0.9 CC(C)CO\C(N)=N\O Amb27653313 [0,1,0,0,0,0|2,0,0]=3 991 B8R0.9 CC(C)NCC(=O)NN Amb27630359 [0,1,0,0,0,0|2,0,0]=3 992 B8R0.9 CC(C)NCC(O)CF Amb24709218 [0,1,0,0,0,0|2,0,1]=4 993 B8R0.9 CC(C)NCC(O)CN Amb18560964 [0,1,0,0,0,0|2,0,1]=4 994 B8R0.9 CC(C)NCC(O)CO Amb33549746 [0,1,0,0,0,0|1,0,2]=4 995 B8R0.9 CC(C)NC[C@@H](O)CO Amb22225216 [0,1,0,0,0,0|1,0,2]=4 996 B8R0.9 CC(C)NC[C@H](O)CCl Amb27856335 [0,1,0,0,0,0|2,0,1]=4 997 B8R0.9 CC(C)NC[C@H](O)CO Amb22226523 [0,1,0,0,0,0|1,0,2]=4 998 B8R0.9 CC(C)NC\C(Cl)=C\Cl Amb28191916 [0,1,0,0,0,0|3,0,0]=4 999 B8R0.9 CC(C)NC\C(N)=N\O Amb27264292 [0,1,0,0,0,0|2,0,0]=3 1000 B8R0.9 CC(C)N\C=C(\F)C=O Amb27215808 [0,1,0,0,0,0|2,0,1]=4 1001 B8R0.9 CC(C)OCC(=O)CCl Amb24481789 [0,1,0,0,0,0|2,0,0]=3 1002 B8R0.9 CC(C)OCC(=O)CN Amb24481788 [0,1,0,0,0,0|2,0,0]=3 1003 B8R0.9 CC(C)OCC(=O)NN Amb2089067 [0,1,0,0,0,0|2,0,0]=3 1004 B8R0.9 CC(C)OCC(=O)NN Amb2189164 [0,1,0,0,0,0|2,0,0]=3 1005 B8R0.9 CC(C)OCC(C)ON Amb33274496 [0,1,0,0,0,0|2,0,1]=4 1006 B8R0.9 CC(C)OCC(Cl)CO Amb28140618 [0,1,0,0,0,0|2,0,1]=4 1007 B8R0.9 CC(C)OCC(N)CO Amb27763204 [0,1,0,0,0,0|2,0,1]=4 1008 B8R0.9 CC(C)OCC(O)C=O Amb27239297 [0,1,0,0,0,0|1,0,1]=3 1009 B8R0.9 CC(C)OCC(O)CBr Amb26570375 [0,1,0,0,0,0|2,0,1]=4 1010 B8R0.9 CC(C)OCC(O)CCl Amb22359767 [0,1,0,0,0,0|2,0,1]=4 1011 B8R0.9 CC(C)OCC(O)CF Amb28049138 [0,1,0,0,0,0|2,0,1]=4 1012 B8R0.9 CC(C)OCC(O)CI Amb20668786 [0,1,0,0,0,0|2,0,1]=4 1013 B8R0.9 CC(C)OCC(O)CN Amb534372 [0,1,0,0,0,0|2,0,1]=4 1014 B8R0.9 CC(C)OCC(O)CO Amb24384701 [0,1,0,0,0,0|1,0,2]=4 1015 B8R0.9 CC(C)OCC(O)CS Amb27768361 [0,1,0,0,0,0|1,1,1]=4 1016 B8R0.9 CC(C)OCC(S)CO Amb28049252 [0,1,0,0,0,0|1,1,1]=4 1017 B8R0.9 CC(C)OC[C@@H](N)CO Amb26854335 [0,1,0,0,0,0|2,0,1]=4 1018 B8R0.9 CC(C)OC[C@@H](O)CN Amb25357930 [0,1,0,0,0,0|2,0,1]=4 1019 B8R0.9 CC(C)OC[C@H](N)CO Amb33445890 [0,1,0,0,0,0|2,0,1]=4 1020 B8R0.9 CC(C)OC[C@H](O)CN Amb28453780 [0,1,0,0,0,0|2,0,1]=4 1021 B8R0.9 CC(C)OC\C(N)=N\O Amb9177999 [0,1,0,0,0,0|2,0,0]=3 1022 B8R0.9 CC(C)O\C=C(/Br)C=O Amb26443914 [0,1,0,0,0,0|2,0,1]=4 1023 B8R0.9 CC(C)O\C=C(\Br)C=O Amb24670208 [0,1,0,0,0,0|2,0,1]=4 1024 B8R0.9 CC(C)SCC(O)CBr Amb27792867 [0,1,0,0,0,0|2,0,1]=4 1025 B8R0.9 CC(C)SCC(O)CCl Amb27615697 [0,1,0,0,0,0|2,0,1]=4 1026 B8R0.9 CC(C)SCC(O)CN Amb18303997 [0,1,0,0,0,0|2,0,1]=4 1027 B8R0.9 CC(C)SC[C@H](N)CO Amb27394485 [0,1,0,0,0,0|2,0,1]=4 1028 B8R0.9 CC(C)SC\C(N)=N\O Amb25771404 [0,1,0,0,0,0|2,0,0]=3 1029 B8R0.9 CC(C)\C=C\C(=O)CBr Amb26425645 [0,1,0,0,0,0|1,0,2]=4 1030 B8R0.9 CC(C=O)CCN(C)C Amb26582309 [0,1,0,0,0,0|2,0,1]=4 1031 B8R0.9 CC(C=O)CC[N+](=O)[O-] Amb27985090 [0,1,0,0,0,0|1,0,2]=4 1032 B8R0.9 CC(C=O)COC(C)C Amb25939491 [0,1,0,0,0,0|2,0,1]=4 1033 B8R0.9 CC(CBr)CCN(C)C Amb33007680 [0,1,0,0,0,0|3,0,0]=4 1034 B8R0.9 CC(CBr)CCS(C)=O Amb26630308 [0,1,0,0,0,0|2,0,0]=3 1035 B8R0.9 CC(CBr)COC(N)=O Amb27879004 [0,1,0,0,0,0|2,0,0]=3 1036 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [0,1,0,0,0,0|1,0,0]=2 1037 B8R0.9 CC(CCN(C)C)ON Amb33272259 [0,1,0,0,0,0|2,0,1]=4 1038 B8R0.9 CC(CCl)CCC(=O)Cl Amb25921088 [0,1,0,0,0,0|1,0,0]=2 1039 B8R0.9 CC(CCl)CCC(=O)O Amb27838484 [0,1,0,0,0,0|0,0,0]=1 1040 B8R0.9 CC(CCl)CCS(C)=O Amb26541793 [0,1,0,0,0,0|2,0,0]=3 1041 B8R0.9 CC(CN)CCC(=O)O Amb22059189 [0,1,0,0,0,0|0,0,0]=1 1042 B8R0.9 CC(CN)CCC(=O)O Amb28935016 [0,1,0,0,0,0|0,0,0]=1 1043 B8R0.9 CC(CN)CCN(C)C Amb17334118 [0,1,0,0,0,0|3,0,0]=4 1044 B8R0.9 CC(CN)CCS(C)=O Amb28430263 [0,1,0,0,0,0|2,0,0]=3 1045 B8R0.9 CC(CN)CC[N+](=O)[O-] Amb33746654 [0,1,0,0,0,0|1,0,1]=3 1046 B8R0.9 CC(CN)CNC(N)=O Amb18994081 [0,1,0,0,0,0|2,0,0]=3 1047 B8R0.9 CC(CN)NC[C@@H](C)O Amb27768689 [0,1,0,0,0,0|2,0,1]=4 1048 B8R0.9 CC(CN)OCC(=O)O Amb18629591 [0,1,0,0,0,0|1,0,0]=2 1049 B8R0.9 CC(CN)SCC(=O)O Amb28142553 [0,1,0,0,0,0|1,0,0]=2 1050 B8R0.9 CC(CO)CCS(C)=O Amb27815628 [0,1,0,0,0,0|2,0,0]=3 1051 B8R0.9 CC(CO)CC[C@H](C)O Amb28207320 [0,1,0,0,0,0|1,0,1]=3 1052 B8R0.9 CC(CO)CC[N+](=O)[O-] Amb27481503 [0,1,0,0,0,0|1,0,1]=3 1053 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,1,0,0,0,0|2,0,0]=3 1054 B8R0.9 CC(CO)SCC(=N)N Amb27219645 [0,1,0,0,0,0|3,0,0]=4 1055 B8R0.9 CC(CO)SCC(N)=O Amb27969999 [0,1,0,0,0,0|2,0,0]=3 1056 B8R0.9 CC(Cl)CNC(=O)CCl Amb24480042 [0,1,0,0,0,0|3,0,0]=4 1057 B8R0.9 CC(Cl)CSC(=O)CCl Amb27863331 [0,1,0,0,0,0|3,0,0]=4 1058 B8R0.9 CC(N)CCC(=O)NN Amb27945385 [0,1,0,0,0,0|2,0,0]=3 1059 B8R0.9 CC(N)CCC(=O)NO Amb27606094 [0,1,0,0,0,0|1,0,0]=2 1060 B8R0.9 CC(N)CC\C(N)=N\O Amb30008328 [0,1,0,0,0,0|2,0,0]=3 1061 B8R0.9 CC(O)CCC(=O)NN Amb19748590 [0,1,0,0,0,0|2,0,0]=3 1062 B8R0.9 CC(O)CCC(C)C#N Amb28315408 [0,1,0,0,0,0|1,0,2]=4 1063 B8R0.9 CC(O)CCC(C)CO Amb27218004 [0,1,0,0,0,0|1,0,1]=3 1064 B8R0.9 CC(O)CCN(C)C=O Amb27485177 [0,1,0,0,0,0|3,0,0]=4 1065 B8R0.9 CC(O)CC\C(N)=N\O Amb29852670 [0,1,0,0,0,0|2,0,0]=3 1066 B8R0.9 CC(O)CNC(=O)CCl Amb17324265 [0,1,0,0,0,0|3,0,0]=4 1067 B8R0.9 CC(O)CNC(C)CO Amb19005093 [0,1,0,0,0,0|2,0,1]=4 1068 B8R0.9 CC(O)COC(=O)CBr Amb25253067 [0,1,0,0,0,0|3,0,0]=4 1069 B8R0.9 CC(O)CSC(C)CO Amb27621669 [0,1,0,0,0,0|2,0,1]=4 1070 B8R0.9 CC(\C=C\C(=O)O)CN Amb27234754 [0,1,0,0,0,0|0,0,2]=3 1071 B8R0.9 CCC(=N)SCC(=O)O Amb27412807 [0,1,0,0,0,0|2,0,1]=4 1072 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,1,0,0,0,0|1,0,1]=3 1073 B8R0.9 CCC(=O)CCC(C)=O Amb17593347 [0,1,0,0,0,0|2,0,1]=4 1074 B8R0.9 CCC(=O)CCC(C)C Amb9031667 [0,1,0,0,0,0|1,0,0]=2 1075 B8R0.9 CCC(=O)CCC(C)N Amb27866596 [0,1,0,0,0,0|2,0,0]=3 1076 B8R0.9 CCC(=O)CNC(C)C Amb28341444 [0,1,0,0,0,0|2,0,0]=3 1077 B8R0.9 CCC(=O)COC(C)C Amb27960841 [0,1,0,0,0,0|2,0,0]=3 1078 B8R0.9 CCC(=O)CSC(C)C Amb27450301 [0,1,0,0,0,0|2,0,0]=3 1079 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,1,0,0,0,0|2,0,1]=4 1080 B8R0.9 CCC(=O)NCC(C)Br Amb28207756 [0,1,0,0,0,0|3,0,0]=4 1081 B8R0.9 CCC(=O)NCC(C)C Amb17798304 [0,1,0,0,0,0|2,0,0]=3 1082 B8R0.9 CCC(=O)NCC(C)Cl Amb27836210 [0,1,0,0,0,0|3,0,0]=4 1083 B8R0.9 CCC(=O)NCC(C)O Amb9275499 [0,1,0,0,0,0|3,0,0]=4 1084 B8R0.9 CCC(=O)OCC(C)Br Amb28436820 [0,1,0,0,0,0|3,0,0]=4 1085 B8R0.9 CCC(=O)OCC(C)C Amb8393164 [0,1,0,0,0,0|2,0,0]=3 1086 B8R0.9 CCC(=O)OCC(C)O Amb28184966 [0,1,0,0,0,0|3,0,0]=4 1087 B8R0.9 CCC(=O)OC[C@@H](C)O Amb28049124 [0,1,0,0,0,0|3,0,0]=4 1088 B8R0.9 CCC(Br)CCC(=O)O Amb28367201 [0,1,0,0,0,0|1,0,0]=2 1089 B8R0.9 CCC(Br)COC(C)=O Amb26916647 [0,1,0,0,0,0|3,0,0]=4 1090 B8R0.9 CCC(C)C#CC(=O)O Amb28145990 [0,1,0,0,0,0|0,0,2]=3 1091 B8R0.9 CCC(C)CCB(O)O Amb25063737 [0,1,0,0,0,0|1,0,1]=3 1092 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,1,0,0,0,0|0,0,0]=1 1093 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,1,0,0,0,0|1,0,0]=2 1094 B8R0.9 CCC(C)CCC(C)Br Amb19078823 [0,1,0,0,0,0|2,0,1]=4 1095 B8R0.9 CCC(C)CCC(C)C Amb22228305 [0,1,0,0,0,0|2,0,1]=4 1096 B8R0.9 CCC(C)CCC(C)N Amb26637268 [0,1,0,0,0,0|2,0,1]=4 1097 B8R0.9 CCC(C)CCC(C)O Amb22732215 [0,1,0,0,0,0|1,0,1]=3 1098 B8R0.9 CCC(C)CCN(C)C Amb27233760 [0,1,0,0,0,0|3,0,0]=4 1099 B8R0.9 CCC(C)CC[C@@H](C)N Amb33318484 [0,1,0,0,0,0|2,0,1]=4 1100 B8R0.9 CCC(C)CC[C@@H](C)O Amb26485746 [0,1,0,0,0,0|1,0,1]=3 1101 B8R0.9 CCC(C)CC[C@H](C)N Amb33318483 [0,1,0,0,0,0|2,0,1]=4 1102 B8R0.9 CCC(C)CC[C@H](C)O Amb33318485 [0,1,0,0,0,0|1,0,1]=3 1103 B8R0.9 CCC(C)CC[N+](=O)[O-] Amb33226911 [0,1,0,0,0,0|1,0,1]=3 1104 B8R0.9 CCC(C)CNC(=O)Cl Amb29881345 [0,1,0,0,0,0|2,0,0]=3 1105 B8R0.9 CCC(C)CNC(C)=O Amb27643953 [0,1,0,0,0,0|2,0,0]=3 1106 B8R0.9 CCC(C)CNC(N)=O Amb27258807 [0,1,0,0,0,0|2,0,0]=3 1107 B8R0.9 CCC(C)COC(=O)Cl Amb20246588 [0,1,0,0,0,0|2,0,0]=3 1108 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,1,0,0,0,0|1,0,0]=2 1109 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,1,0,0,0,0|1,0,0]=2 1110 B8R0.9 CCC(C)NCC(N)=O Amb6661064 [0,1,0,0,0,0|2,0,0]=3 1111 B8R0.9 CCC(C)NC[C@@H](C)O Amb27184367 [0,1,0,0,0,0|2,0,1]=4 1112 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,1,0,0,0,0|1,0,0]=2 1113 B8R0.9 CCC(C)OCC(C)=O Amb27803509 [0,1,0,0,0,0|2,0,0]=3 1114 B8R0.9 CCC(C)OCC(C)O Amb28207569 [0,1,0,0,0,0|2,0,1]=4 1115 B8R0.9 CCC(C)OCC(N)=O Amb27167179 [0,1,0,0,0,0|2,0,0]=3 1116 B8R0.9 CCC(C)OC[C@H](C)O Amb27869786 [0,1,0,0,0,0|2,0,1]=4 1117 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,1,0,0,0,0|1,0,0]=2 1118 B8R0.9 CCC(C)SCC(N)=O Amb27603087 [0,1,0,0,0,0|2,0,0]=3 1119 B8R0.9 CCC(C)SC[C@H](C)O Amb28248745 [0,1,0,0,0,0|2,0,1]=4 1120 B8R0.9 CCC(C)\C=C\C(=O)O Amb33171963 [0,1,0,0,0,0|0,0,2]=3 1121 B8R0.9 CCC(C)\C=C\C(C)=O Amb24062970 [0,1,0,0,0,0|1,0,2]=4 1122 B8R0.9 CCC(C)\C=C\C(N)=O Amb27439352 [0,1,0,0,0,0|1,0,2]=4 1123 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,1,0,0,0,0|2,0,0]=3 1124 B8R0.9 CCC(Cl)CCC(=O)O Amb27955847 [0,1,0,0,0,0|1,0,0]=2 1125 B8R0.9 CCC(Cl)COC(=O)Cl Amb25967600 [0,1,0,0,0,0|3,0,0]=4 1126 B8R0.9 CCC(N)C#CC(=O)O Amb33168922 [0,1,0,0,0,0|1,0,2]=4 1127 B8R0.9 CCC(N)CCC(=O)O Amb21961489 [0,1,0,0,0,0|1,0,0]=2 1128 B8R0.9 CCC(N)CCC(=O)O Amb5717972 [0,1,0,0,0,0|1,0,0]=2 1129 B8R0.9 CCC(N)CCC(C)C Amb8869732 [0,1,0,0,0,0|2,0,1]=4 1130 B8R0.9 CCC(N)CCC(N)=O Amb27194979 [0,1,0,0,0,0|2,0,0]=3 1131 B8R0.9 CCC(N)CNC(N)=O Amb27437062 [0,1,0,0,0,0|3,0,0]=4 1132 B8R0.9 CCC(N)\C=C\C(=O)O Amb27867410 [0,1,0,0,0,0|1,0,2]=4 1133 B8R0.9 CCC(O)C#CC(=O)O Amb27169546 [0,1,0,0,0,0|1,0,2]=4 1134 B8R0.9 CCC(O)CCB(O)O Amb24353745 [0,1,0,0,0,0|2,0,1]=4 1135 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [0,1,0,0,0,0|1,0,0]=2 1136 B8R0.9 CCC(O)CCC(C)C Amb19944686 [0,1,0,0,0,0|1,0,1]=3 1137 B8R0.9 CCC(O)CCC(N)=O Amb27234638 [0,1,0,0,0,0|2,0,0]=3 1138 B8R0.9 CCC(O)CC[C@@H](C)O Amb28049249 [0,1,0,0,0,0|2,0,1]=4 1139 B8R0.9 CCC(O)CNC(C)C Amb18304016 [0,1,0,0,0,0|2,0,1]=4 1140 B8R0.9 CCC(O)CNC(N)=O Amb27235306 [0,1,0,0,0,0|3,0,0]=4 1141 B8R0.9 CCC(O)COC(N)=O Amb27175099 [0,1,0,0,0,0|3,0,0]=4 1142 B8R0.9 CCC(S)CCC(=O)O Amb27954753 [0,1,0,0,0,0|1,0,0]=2 1143 B8R0.9 CCN(C)CCC(=O)O Amb8428205 [0,1,0,0,0,0|1,0,0]=2 1144 B8R0.9 CCN(C)CCC(=O)O Amb8890954 [0,1,0,0,0,0|1,0,0]=2 1145 B8R0.9 CCS(=O)CCC(=O)O Amb9173461 [0,1,0,0,0,0|2,0,0]=3 1146 B8R0.9 CCS(=O)NCC(=O)O Amb28322707 [0,1,0,0,0,0|3,0,0]=4 1147 B8R0.9 CC[C@@H](Br)COC(C)=O Amb28254442 [0,1,0,0,0,0|3,0,0]=4 1148 B8R0.9 CC[C@@H](C)C#CC(=O)O Amb27975780 [0,1,0,0,0,0|0,0,2]=3 1149 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,1,0,0,0,0|0,0,0]=1 1150 B8R0.9 CC[C@@H](C)\C=C\C(=O)O Amb24117189 [0,1,0,0,0,0|0,0,2]=3 1151 B8R0.9 CC[C@@H](N)CCC(C)C Amb27455872 [0,1,0,0,0,0|2,0,1]=4 1152 B8R0.9 CC[C@@H](O)CCC(N)=O Amb27254154 [0,1,0,0,0,0|2,0,0]=3 1153 B8R0.9 CC[C@@H](O)CNC(C)C Amb27197410 [0,1,0,0,0,0|2,0,1]=4 1154 B8R0.9 CC[C@H](C)C#CC(=O)O Amb28132200 [0,1,0,0,0,0|0,0,2]=3 1155 B8R0.9 CC[C@H](C)CCC(C)=O Amb27447760 [0,1,0,0,0,0|1,0,0]=2 1156 B8R0.9 CC[C@H](C)CCC(N)=O Amb28346481 [0,1,0,0,0,0|1,0,0]=2 1157 B8R0.9 CC[C@H](C)CC[C@H](C)O Amb27807458 [0,1,0,0,0,0|1,0,1]=3 1158 B8R0.9 CC[C@H](C)CNC(N)=S Amb28285101 [0,1,0,0,0,0|2,1,0]=4 1159 B8R0.9 CC[C@H](C)COC(C)=O Amb27408010 [0,1,0,0,0,0|2,0,0]=3 1160 B8R0.9 CC[C@H](N)CCC(C)C Amb28070136 [0,1,0,0,0,0|2,0,1]=4 1161 B8R0.9 CC[C@H](N)\C=C\C(=O)O Amb27878954 [0,1,0,0,0,0|1,0,2]=4 1162 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [0,1,0,0,0,0|1,0,0]=2 1163 B8R0.9 CC[C@H](O)CNC(C)=O Amb27762160 [0,1,0,0,0,0|3,0,0]=4 1164 B8R0.9 CC\C(C)=C\CC(=O)O Amb22011800 [0,1,0,0,0,0|0,0,2]=3 1165 B8R0.9 CN(C#N)CCC(=O)O Amb35634504 [0,1,0,0,0,0|1,0,1]=3 1166 B8R0.9 CN(C#N)CCC(N)=O Amb27190230 [0,1,0,0,0,0|2,0,1]=4 1167 B8R0.9 CN(C)CCC(=O)CCl Amb33057681 [0,1,0,0,0,0|2,0,0]=3 1168 B8R0.9 CN(C)CCC(=O)CN Amb18203194 [0,1,0,0,0,0|2,0,0]=3 1169 B8R0.9 CN(C)CCC(=O)NN Amb396230 [0,1,0,0,0,0|2,0,0]=3 1170 B8R0.9 CN(C)CCC(=O)NO Amb27762089 [0,1,0,0,0,0|1,0,0]=2 1171 B8R0.9 CN(C)CCC(F)CO Amb28129904 [0,1,0,0,0,0|2,0,1]=4 1172 B8R0.9 CN(C)CCC(N)CO Amb26847148 [0,1,0,0,0,0|2,0,1]=4 1173 B8R0.9 CN(C)CCC(N)CO Amb33329311 [0,1,0,0,0,0|2,0,1]=4 1174 B8R0.9 CN(C)CCC(O)CBr Amb33485673 [0,1,0,0,0,0|2,0,1]=4 1175 B8R0.9 CN(C)CCC(O)CCl Amb33412515 [0,1,0,0,0,0|2,0,1]=4 1176 B8R0.9 CN(C)CCC(O)CF Amb33271983 [0,1,0,0,0,0|2,0,1]=4 1177 B8R0.9 CN(C)CCC(O)CN Amb18124365 [0,1,0,0,0,0|2,0,1]=4 1178 B8R0.9 CN(C)CCC(O)CO Amb27242879 [0,1,0,0,0,0|1,0,2]=4 1179 B8R0.9 CN(C)CCN(C)C=O Amb22344699 [0,1,0,0,0,0|3,0,0]=4 1180 B8R0.9 CN(C)CC[C@@H](N)CO Amb33272271 [0,1,0,0,0,0|2,0,1]=4 1181 B8R0.9 CN(C)CC[C@@H](O)CN Amb33272523 [0,1,0,0,0,0|2,0,1]=4 1182 B8R0.9 CN(C)CC[C@H](N)CO Amb33272272 [0,1,0,0,0,0|2,0,1]=4 1183 B8R0.9 CN(C)CC[C@H](O)CN Amb33272522 [0,1,0,0,0,0|2,0,1]=4 1184 B8R0.9 CN(C)CC[C@H](O)CO Amb28079205 [0,1,0,0,0,0|1,0,2]=4 1185 B8R0.9 CN(C)CC\C(N)=N/O Amb2695942 [0,1,0,0,0,0|2,0,0]=3 1186 B8R0.9 CN(C)CC\C(N)=N\O Amb1118599 [0,1,0,0,0,0|2,0,0]=3 1187 B8R0.9 CN(C)COC(=O)CCl Amb28072123 [0,1,0,0,0,0|3,0,0]=4 1188 B8R0.9 CN(CCC(=O)O)N=O Amb17618592 [0,1,0,0,0,0|2,0,0]=3 1189 B8R0.9 CN(CCC(N)=O)N=O Amb27487572 [0,1,0,0,0,0|3,0,0]=4 1190 B8R0.9 CNC(=N)CSC(C)C Amb28285261 [0,1,0,0,0,0|3,0,0]=4 1191 B8R0.9 CNC(=N)NCC(C)C Amb27845003 [0,1,0,0,0,0|3,0,0]=4 1192 B8R0.9 CNC(=O)CCC(=O)O Amb2720937 [0,1,0,0,0,0|1,0,1]=3 1193 B8R0.9 CNC(=O)CCC(C)=O Amb17334107 [0,1,0,0,0,0|2,0,1]=4 1194 B8R0.9 CNC(=O)CCC(C)C Amb27165938 [0,1,0,0,0,0|1,0,0]=2 1195 B8R0.9 CNC(=O)CCC(C)N Amb33109814 [0,1,0,0,0,0|2,0,0]=3 1196 B8R0.9 CNC(=O)CCC(C)O Amb17334125 [0,1,0,0,0,0|2,0,0]=3 1197 B8R0.9 CNC(=O)CCC(Cl)Cl Amb32671998 [0,1,0,0,0,0|3,0,0]=4 1198 B8R0.9 CNC(=O)CCC(F)F Amb27837707 [0,1,0,0,0,0|3,0,0]=4 1199 B8R0.9 CNC(=O)CCC(N)=O Amb17334114 [0,1,0,0,0,0|2,0,1]=4 1200 B8R0.9 CNC(=O)CCN(C)C Amb24735586 [0,1,0,0,0,0|2,0,0]=3 1201 B8R0.9 CNC(=O)CC[C@H](C)O Amb27799232 [0,1,0,0,0,0|2,0,0]=3 1202 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,1,0,0,0,0|2,0,1]=4 1203 B8R0.9 CNC(=O)NCC(C)O Amb28326263 [0,1,0,0,0,0|3,0,0]=4 1204 B8R0.9 CNC(=O)OCC(=O)O Amb30018932 [0,1,0,0,0,0|2,0,1]=4 1205 B8R0.9 CNC(=O)OCC(C)N Amb35735119 [0,1,0,0,0,0|3,0,0]=4 1206 B8R0.9 CNC(=S)NCC(=O)O Amb4044376 [0,1,0,0,0,0|2,0,1]=4 1207 B8R0.9 CNC(=S)OCC(C)C Amb27493142 [0,1,0,0,0,0|2,1,0]=4 1208 B8R0.9 CNC(C)CCS(C)=O Amb27791401 [0,1,0,0,0,0|2,0,0]=3 1209 B8R0.9 COC(=O)C#CC(C)C Amb28250141 [0,1,0,0,0,0|0,0,2]=3 1210 B8R0.9 COC(=O)C#CC(C)Cl Amb27243956 [0,1,0,0,0,0|1,0,2]=4 1211 B8R0.9 COC(=O)C#C[C@H](C)O Amb27981745 [0,1,0,0,0,0|1,0,2]=4 1212 B8R0.9 COC(=O)C=C=C(C)C Amb32423562 [0,1,0,0,0,0|0,0,3]=4 1213 B8R0.9 COC(=O)CCB(O)O Amb25705142 [0,1,0,0,0,0|3,0,0]=4 1214 B8R0.9 COC(=O)CCC(=O)Cl Amb3939311 [0,1,0,0,0,0|2,0,1]=4 1215 B8R0.9 COC(=O)CCC(=O)O Amb6538024 [0,1,0,0,0,0|1,0,1]=3 1216 B8R0.9 COC(=O)CCC(C)=O Amb13777321 [0,1,0,0,0,0|1,0,1]=3 1217 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,1,0,0,0,0|1,0,0]=2 1218 B8R0.9 COC(=O)CCC(C)C Amb9241809 [0,1,0,0,0,0|0,0,0]=1 1219 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,1,0,0,0,0|1,0,0]=2 1220 B8R0.9 COC(=O)CCC(C)I Amb27445524 [0,1,0,0,0,0|1,0,0]=2 1221 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,1,0,0,0,0|1,0,0]=2 1222 B8R0.9 COC(=O)CCC(C)N Amb35750839 [0,1,0,0,0,0|1,0,0]=2 1223 B8R0.9 COC(=O)CCC(C)O Amb26459430 [0,1,0,0,0,0|1,0,0]=2 1224 B8R0.9 COC(=O)CCC(C)S Amb28066829 [0,1,0,0,0,0|1,0,0]=2 1225 B8R0.9 COC(=O)CCC(C)[O-] Amb30988005 [0,1,0,0,0,0|1,0,0]=2 1226 B8R0.9 COC(=O)CCC(F)F Amb27770565 [0,1,0,0,0,0|2,0,0]=3 1227 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,1,0,0,0,0|2,0,1]=4 1228 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [0,1,0,0,0,0|2,0,1]=4 1229 B8R0.9 COC(=O)CCN(C)C Amb7757843 [0,1,0,0,0,0|1,0,0]=2 1230 B8R0.9 COC(=O)CCS(=O)Cl Amb25944850 [0,1,0,0,0,0|3,0,0]=4 1231 B8R0.9 COC(=O)CCS(=O)O Amb25967240 [0,1,0,0,0,0|2,0,1]=4 1232 B8R0.9 COC(=O)CCS(=O)[O-] Amb21520328 [0,1,0,0,0,0|3,0,0]=4 1233 B8R0.9 COC(=O)CCS(N)=O Amb32720304 [0,1,0,0,0,0|3,0,0]=4 1234 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,1,0,0,0,0|1,0,0]=2 1235 B8R0.9 COC(=O)CC[C@H](C)N Amb27950697 [0,1,0,0,0,0|1,0,0]=2 1236 B8R0.9 COC(=O)CC[N+](=O)[O-] Amb26494342 [0,1,0,0,0,0|3,0,0]=4 1237 B8R0.9 COC(=O)CNC(C)=O Amb3886556 [0,1,0,0,0,0|2,0,1]=4 1238 B8R0.9 COC(=O)CNC(C)C Amb6687063 [0,1,0,0,0,0|1,0,0]=2 1239 B8R0.9 COC(=O)COC(C)=O Amb28049254 [0,1,0,0,0,0|2,0,1]=4 1240 B8R0.9 COC(=O)COC(C)C Amb9206385 [0,1,0,0,0,0|1,0,0]=2 1241 B8R0.9 COC(=O)COC(Cl)Cl Amb22230457 [0,1,0,0,0,0|3,0,0]=4 1242 B8R0.9 COC(=O)CSC(C)C Amb28049081 [0,1,0,0,0,0|1,0,0]=2 1243 B8R0.9 COC(=O)NCC(=O)O Amb3941451 [0,1,0,0,0,0|2,0,1]=4 1244 B8R0.9 COC(=O)NCC(C)=O Amb28461105 [0,1,0,0,0,0|2,0,1]=4 1245 B8R0.9 COC(=O)NCC(C)Cl Amb27401852 [0,1,0,0,0,0|2,0,0]=3 1246 B8R0.9 COC(=O)NCC(C)O Amb9285615 [0,1,0,0,0,0|2,0,0]=3 1247 B8R0.9 COC(=O)NC[C@@H](C)O Amb28204216 [0,1,0,0,0,0|2,0,0]=3 1248 B8R0.9 COC(=O)NNC(C)C Amb22496456 [0,1,0,0,0,0|2,0,0]=3 1249 B8R0.9 COC(=O)OCC(=O)O Amb8393899 [0,1,0,0,0,0|2,0,1]=4 1250 B8R0.9 COC(=O)OCC(F)F Amb24088551 [0,1,0,0,0,0|3,0,0]=4 1251 B8R0.9 COC(=O)SCC(C)Cl Amb28386344 [0,1,0,0,0,0|2,0,0]=3 1252 B8R0.9 COC(=O)\C=C\C(C)C Amb2689521 [0,1,0,0,0,0|0,0,2]=3 1253 B8R0.9 COC(=O)\C=C\C(C)N Amb33069659 [0,1,0,0,0,0|1,0,2]=4 1254 B8R0.9 COC(=O)\C=C\C(C)N Amb33069671 [0,1,0,0,0,0|1,0,2]=4 1255 B8R0.9 COC(=O)\C=C\C(C)O Amb27484758 [0,1,0,0,0,0|1,0,2]=4 1256 B8R0.9 COC(=O)\C=C\N(C)C Amb33986628 [0,1,0,0,0,0|1,0,2]=4 1257 B8R0.9 COC(=O)\C=C\[C@@H](C)N Amb27252211 [0,1,0,0,0,0|1,0,2]=4 1258 B8R0.9 COC(=S)SCC(=O)O Amb26653180 [0,1,0,0,0,0|2,0,1]=4 1259 B8R0.9 COC(C)CCC(=O)O Amb24271104 [0,1,0,0,0,0|0,0,0]=1 1260 B8R0.9 COC(C)CCC(C)=O Amb25880180 [0,1,0,0,0,0|1,0,0]=2 1261 B8R0.9 COC(C)CCC(C)Br Amb28385552 [0,1,0,0,0,0|2,0,1]=4 1262 B8R0.9 COC(C)CNC(=O)Cl Amb35633401 [0,1,0,0,0,0|2,0,0]=3 1263 B8R0.9 COC(C)CNC(C)C Amb33530559 [0,1,0,0,0,0|2,0,1]=4 1264 B8R0.9 COC(C)COC(=O)Cl Amb32656121 [0,1,0,0,0,0|2,0,0]=3 1265 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,1,0,0,0,0|2,0,0]=3 1266 B8R0.9 COC(C)CSC(C)C Amb27180882 [0,1,0,0,0,0|2,0,1]=4 1267 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,1,0,0,0,0|2,0,0]=3 1268 B8R0.9 COC(C)\C=C\C(=O)O Amb27203687 [0,1,0,0,0,0|0,0,2]=3 1269 B8R0.9 COC(C)\C=C\C(C)=O Amb27841431 [0,1,0,0,0,0|1,0,2]=4 1270 B8R0.9 COC(F)C#CC(=O)O Amb33169067 [0,1,0,0,0,0|1,0,2]=4 1271 B8R0.9 CON(C)CCC(=O)O Amb27881744 [0,1,0,0,0,0|1,0,0]=2 1272 B8R0.9 CON(C)\C=C\C(=O)O Amb35734889 [0,1,0,0,0,0|1,0,2]=4 1273 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [0,1,0,0,0,0|0,0,0]=1 1274 B8R0.9 CO[C@@H](C)CC[C@@H](C)O Amb28065305 [0,1,0,0,0,0|1,0,1]=3 1275 B8R0.9 CO[C@@H](C)CNC(=N)N Amb35637333 [0,1,0,0,0,0|3,0,0]=4 1276 B8R0.9 CO[C@@H](C)CNC(C)=O Amb35605355 [0,1,0,0,0,0|2,0,0]=3 1277 B8R0.9 CO[C@@H](C)CNC(N)=O Amb35641866 [0,1,0,0,0,0|2,0,0]=3 1278 B8R0.9 CO[C@H](C)CNC(=N)N Amb35637343 [0,1,0,0,0,0|3,0,0]=4 1279 B8R0.9 CO[C@H](C)CNC(C)=O Amb30024558 [0,1,0,0,0,0|2,0,0]=3 1280 B8R0.9 CO[C@H](C)CNC(N)=O Amb29883111 [0,1,0,0,0,0|2,0,0]=3 1281 B8R0.9 CO\C(C)=C\CC(=O)O Amb27963206 [0,1,0,0,0,0|0,0,2]=3 1282 B8R0.9 CO\P(=O)=C\CC(=O)O Amb27199324 [0,1,0,0,0,0|2,0,1]=4 1283 B8R0.9 CS(=O)CCC(N)CO Amb27867840 [0,1,0,0,0,0|3,0,0]=4 1284 B8R0.9 CS(=O)CCC(O)CN Amb27403927 [0,1,0,0,0,0|3,0,0]=4 1285 B8R0.9 CS(=O)CC\C(N)=N\O Amb27852254 [0,1,0,0,0,0|3,0,0]=4 1286 B8R0.9 CSC(=O)CCC(C)C Amb25743840 [0,1,0,0,0,0|0,1,0]=2 1287 B8R0.9 CSC(=O)CCC(C)O Amb28065144 [0,1,0,0,0,0|1,1,0]=3 1288 B8R0.9 CSC(C)CCC(=O)O Amb22059071 [0,1,0,0,0,0|0,0,0]=1 1289 B8R0.9 CSC(C)CCC(N)=O Amb27247670 [0,1,0,0,0,0|1,0,0]=2 1290 B8R0.9 CSC(C)CNC(=N)N Amb28187786 [0,1,0,0,0,0|3,0,0]=4 1291 B8R0.9 CSC(C)CNC(=O)Cl Amb35633460 [0,1,0,0,0,0|2,0,0]=3 1292 B8R0.9 CSC(C)CNC(N)=S Amb28206418 [0,1,0,0,0,0|2,1,0]=4 1293 B8R0.9 C[C@@H](CN)CC[N+](=O)[O-] Amb33744961 [0,1,0,0,0,0|1,0,1]=3 1294 B8R0.9 C[C@@H](CO)CC[N+](=O)[O-] Amb13883660 [0,1,0,0,0,0|1,0,1]=3 1295 B8R0.9 C[C@@H](O)CNC(=O)CBr Amb28049185 [0,1,0,0,0,0|3,0,0]=4 1296 B8R0.9 C[C@@H](O)CNC(=O)CN Amb27495538 [0,1,0,0,0,0|3,0,0]=4 1297 B8R0.9 C[C@H](CN)CC[N+](=O)[O-] Amb33748017 [0,1,0,0,0,0|1,0,1]=3 1298 B8R0.9 C[C@H](CO)CC[N+](=O)[O-] Amb33743126 [0,1,0,0,0,0|1,0,1]=3 1299 B8R0.9 C[C@H](O)CC[C@H](C)CO Amb28049197 [0,1,0,0,0,0|1,0,1]=3 1300 B8R0.9 C[C@H](O)CNC(=O)CCl Amb28049186 [0,1,0,0,0,0|3,0,0]=4 1301 B8R0.9 C[C@H](O)CNC(=O)CN Amb27399091 [0,1,0,0,0,0|3,0,0]=4 1302 B8R0.9 C[C@H](O)CNC(=O)CO Amb27829811 [0,1,0,0,0,0|2,0,0]=3 1303 B8R0.9 C[C@H](O)CO[C@@H](C)CO Amb27761584 [0,1,0,0,0,0|2,0,1]=4 1304 B8R0.9 C\C(C#N)=C\CC(=O)O Amb27196398 [0,1,0,0,0,0|0,0,3]=4 1305 B8R0.9 C\C(C=O)=C/OC(C)C Amb27659430 [0,1,0,0,0,0|2,0,1]=4 1306 B8R0.9 C\C(C=O)=C\CC(C)C Amb24573481 [0,1,0,0,0,0|1,0,1]=3 1307 B8R0.9 C\C(CCC(=O)O)=N/O Amb25138471 [0,1,0,0,0,0|1,0,1]=3 1308 B8R0.9 C\C(CCC(C)C)=N/O Amb25235824 [0,1,0,0,0,0|1,0,0]=2 1309 B8R0.9 C\C(CCC(C)C)=N\O Amb24547350 [0,1,0,0,0,0|1,0,0]=2 1310 B8R0.9 C\C(CCN(C)C)=N/O Amb27813221 [0,1,0,0,0,0|2,0,0]=3 1311 B8R0.9 C\C(CSC(C)C)=N/O Amb27406156 [0,1,0,0,0,0|2,0,0]=3 1312 B8R0.9 C\C=C(C)/C=C/C(=O)O Amb27838460 [0,1,0,0,0,0|0,0,3]=4 1313 B8R0.9 C\C=C(C)\C=C\C(=O)O Amb18642399 [0,1,0,0,0,0|0,0,3]=4 1314 B8R0.9 C\C=C(\C)CCC(C)=O Amb24610198 [0,1,0,0,0,0|1,0,1]=3 1315 B8R0.9 C\C=C(\C)OCC(C)=O Amb27844138 [0,1,0,0,0,0|2,0,1]=4 1316 B8R0.9 N#CC(N)CCC(=O)O Amb27596135 [0,1,0,0,0,0|1,0,1]=3 1317 B8R0.9 N#CC(N)CCC(=O)O Amb30666632 [0,1,0,0,0,0|1,0,1]=3 1318 B8R0.9 N=C(CCl)NCC(=O)O Amb28282661 [0,1,0,0,0,0|2,0,1]=4 1319 B8R0.9 NC(=O)CCC(O)CO Amb28073389 [0,1,0,0,0,0|2,0,0]=3 1320 B8R0.9 NC(=O)CC[C@H](N)CF Amb27431484 [0,1,0,0,0,0|2,0,0]=3 1321 B8R0.9 NC(=O)CC[C@H](N)CO Amb24368577 [0,1,0,0,0,0|2,0,0]=3 1322 B8R0.9 NC(=O)OCC(Br)CBr Amb22732242 [0,1,0,0,0,0|3,0,0]=4 1323 B8R0.9 NC(=O)OCC(Cl)CCl Amb27771643 [0,1,0,0,0,0|3,0,0]=4 1324 B8R0.9 NC(=O)OCC(N)CO Amb27956487 [0,1,0,0,0,0|3,0,0]=4 1325 B8R0.9 NC(CCl)CCC(=O)O Amb27440510 [0,1,0,0,0,0|1,0,0]=2 1326 B8R0.9 NC(CF)CCC(=O)Cl Amb27876552 [0,1,0,0,0,0|2,0,0]=3 1327 B8R0.9 NC(CF)CCC(=O)O Amb19148378 [0,1,0,0,0,0|1,0,0]=2 1328 B8R0.9 NC(CF)CCC(=O)O Amb33473114 [0,1,0,0,0,0|1,0,0]=2 1329 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [0,1,0,0,0,0|1,0,0]=2 1330 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [0,1,0,0,0,0|1,0,0]=2 1331 B8R0.9 NC(CS)CCC(=O)O Amb27458291 [0,1,0,0,0,0|1,0,0]=2 1332 B8R0.9 NCC(=O)CCC(=O)O Amb2720232 [0,1,0,0,0,0|1,0,1]=3 1333 B8R0.9 NCC(=O)CCC(=O)O Amb5395775 [0,1,0,0,0,0|1,0,1]=3 1334 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,1,0,0,0,0|2,0,1]=4 1335 B8R0.9 NCC(=O)NCC(=O)O Amb8382637 [0,1,0,0,0,0|2,0,1]=4 1336 B8R0.9 NCC(N)CCC(=O)O Amb19328773 [0,1,0,0,0,0|1,0,0]=2 1337 B8R0.9 NCC(N)CCC(=O)O Amb27837536 [0,1,0,0,0,0|1,0,0]=2 1338 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [0,1,0,0,0,0|1,0,0]=2 1339 B8R0.9 NCC(O)CCC(=O)[O-] Amb33330648 [0,1,0,0,0,0|1,0,1]=3 1340 B8R0.9 NCC(O)CNC(N)=O Amb27838588 [0,1,0,0,0,0|3,0,0]=4 1341 B8R0.9 NCC(O)CNC(N)=O Amb33457634 [0,1,0,0,0,0|3,0,0]=4 1342 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [0,1,0,0,0,0|1,0,0]=2 1343 B8R0.9 NC[C@H](N)CCC(=O)O Amb28068164 [0,1,0,0,0,0|1,0,0]=2 1344 B8R0.9 N[C@@H](CS)CCC(=O)O Amb28341808 [0,1,0,0,0,0|1,0,0]=2 1345 B8R0.9 N[C@H](CF)CCC(=O)O Amb32729481 [0,1,0,0,0,0|1,0,0]=2 1346 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [0,1,0,0,0,0|1,0,0]=2 1347 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [0,1,0,0,0,0|1,0,0]=2 1348 B8R0.9 O=C(Cl)OCC(Cl)CCl Amb27758582 [0,1,0,0,0,0|3,0,0]=4 1349 B8R0.9 O=C(O)CCC(=O)CCl Amb25736440 [0,1,0,0,0,0|1,0,1]=3 1350 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [0,1,0,0,0,0|1,0,0]=2 1351 B8R0.9 O=C(O)CCC(S)CS Amb27407074 [0,1,0,0,0,0|1,0,0]=2 1352 B8R0.9 O=C(O)CC\C(O)=N\O Amb24745795 [0,1,0,0,0,0|2,0,1]=4 1353 B8R0.9 O=C(O)CNC(=O)CCl Amb1144436 [0,1,0,0,0,0|2,0,1]=4 1354 B8R0.9 O=C(O)CNC(=O)CO Amb18124375 [0,1,0,0,0,0|2,0,1]=4 1355 B8R0.9 O=C(O)COC(=O)CCl Amb18644547 [0,1,0,0,0,0|2,0,1]=4 1356 B8R0.9 O=C(O)CSC(=O)CS Amb27213308 [0,1,0,0,0,0|2,0,1]=4 1357 B8R0.9 O=C(O)\C=C\C(O)CO Amb18642875 [0,1,0,0,0,0|1,0,2]=4 1358 B8R0.9 O=C(O)\C=C\[C@H](O)CO Amb27437218 [0,1,0,0,0,0|1,0,2]=4 1359 B8R0.9 O=CC(=O)CCC(=O)O Amb18642737 [0,1,0,0,0,0|1,0,2]=4 1360 B8R0.9 O=NN(O)CCC(=O)O Amb27495384 [0,1,0,0,0,0|3,0,0]=4 1361 B8R0.9 [C-]#[N+]C(C)CCC(C)C Amb3973082 [0,1,0,0,0,0|2,0,1]=4 1362 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [0,1,0,0,0,0|2,0,1]=4 1363 B8R0.23 C=C(Br)CC(N)C(=O)O Amb24557771 [0,1,0,0,0,0|1,0,2]=4 1364 B8R0.23 C=C(Br)CC(O)C(C)C Amb27197177 [0,1,0,0,0,0|2,0,0]=3 1365 B8R0.23 C=C(Br)CN(C)C(C)C Amb27636090 [0,1,0,0,0,0|3,0,0]=4 1366 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O Amb22746251 [0,1,0,0,0,0|1,0,2]=4 1367 B8R0.23 C=C(Br)C[C@H](N)C(=O)O Amb25918807 [0,1,0,0,0,0|1,0,2]=4 1368 B8R0.23 C=C(Br)[C@@H](O)CC(=O)O Amb27392180 [0,1,0,0,0,0|1,0,2]=4 1369 B8R0.23 C=C(C)C(=O)CC(C)C Amb25222433 [0,1,0,0,0,0|2,0,1]=4 1370 B8R0.23 C=C(C)C(C)CC(=O)O Amb18642614 [0,1,0,0,0,0|0,0,2]=3 1371 B8R0.23 C=C(C)C(C)CC(C)=O Amb27607290 [0,1,0,0,0,0|1,0,2]=4 1372 B8R0.23 C=C(C)C(N)CC(=O)O Amb2697570 [0,1,0,0,0,0|0,0,2]=3 1373 B8R0.23 C=C(C)C(N)CC(N)=O Amb24401112 [0,1,0,0,0,0|1,0,2]=4 1374 B8R0.23 C=C(C)C(O)CC(=O)O Amb18642756 [0,1,0,0,0,0|0,0,2]=3 1375 B8R0.23 C=C(C)C(O)CC(C)=O Amb27605750 [0,1,0,0,0,0|1,0,2]=4 1376 B8R0.23 C=C(C)C(O)CC(C)N Amb35583525 [0,1,0,0,0,0|3,0,0]=4 1377 B8R0.23 C=C(C)CC(=O)C(=O)O Amb28073130 [0,1,0,0,0,0|0,0,3]=4 1378 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [0,1,0,0,0,0|0,0,2]=3 1379 B8R0.23 C=C(C)CC(C)C(C)=O Amb28203090 [0,1,0,0,0,0|1,0,2]=4 1380 B8R0.23 C=C(C)CC(C)C(C)Cl Amb27816011 [0,1,0,0,0,0|3,0,0]=4 1381 B8R0.23 C=C(C)CC(C)C(C)O Amb28063256 [0,1,0,0,0,0|3,0,0]=4 1382 B8R0.23 C=C(C)CC(Cl)C(C)=O Amb27458140 [0,1,0,0,0,0|1,0,2]=4 1383 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [0,1,0,0,0,0|0,0,2]=3 1384 B8R0.23 C=C(C)CC(N)C(C)C Amb27595590 [0,1,0,0,0,0|2,0,0]=3 1385 B8R0.23 C=C(C)CC(N)C(N)=O Amb26326676 [0,1,0,0,0,0|1,0,2]=4 1386 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [0,1,0,0,0,0|0,0,2]=3 1387 B8R0.23 C=C(C)CC(O)C(C)Br Amb27212973 [0,1,0,0,0,0|3,0,0]=4 1388 B8R0.23 C=C(C)CC(O)C(C)C Amb22228361 [0,1,0,0,0,0|2,0,0]=3 1389 B8R0.23 C=C(C)CC(O)C(C)N Amb35588698 [0,1,0,0,0,0|3,0,0]=4 1390 B8R0.23 C=C(C)CC(O)[C@@H](C)N Amb35624113 [0,1,0,0,0,0|3,0,0]=4 1391 B8R0.23 C=C(C)CC(O)[C@H](C)N Amb35737769 [0,1,0,0,0,0|3,0,0]=4 1392 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [0,1,0,0,0,0|0,0,2]=3 1393 B8R0.23 C=C(C)C[C@@H](C)[C@H](C)N Amb28074299 [0,1,0,0,0,0|3,0,0]=4 1394 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [0,1,0,0,0,0|0,0,2]=3 1395 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [0,1,0,0,0,0|0,0,2]=3 1396 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [0,1,0,0,0,0|0,0,2]=3 1397 B8R0.23 C=C(C)[C@@H](O)CC(=O)O Amb25789715 [0,1,0,0,0,0|0,0,2]=3 1398 B8R0.23 C=C(C)[C@@H](O)CC(C)=O Amb26477424 [0,1,0,0,0,0|1,0,2]=4 1399 B8R0.23 C=C(C)[C@H](C)CC(=O)O Amb27447241 [0,1,0,0,0,0|0,0,2]=3 1400 B8R0.23 C=C(C)[C@H](O)CC(=O)O Amb28286173 [0,1,0,0,0,0|0,0,2]=3 1401 B8R0.23 C=C(C)[C@H](O)CC(C)=O Amb27409964 [0,1,0,0,0,0|1,0,2]=4 1402 B8R0.23 C=C(CC(=O)O)C(C)=O Amb27831643 [0,1,0,0,0,0|1,0,2]=4 1403 B8R0.23 C=C(CC(C)C)C(=O)Cl Amb28256819 [0,1,0,0,0,0|1,0,1]=3 1404 B8R0.23 C=C(CC(C)C)C(=O)O Amb33542856 [0,1,0,0,0,0|0,0,1]=2 1405 B8R0.23 C=C(CC(C)C)C(C)=O Amb22277685 [0,1,0,0,0,0|1,0,1]=3 1406 B8R0.23 C=C(CN(C)C)C(=O)O Amb33544507 [0,1,0,0,0,0|1,0,1]=3 1407 B8R0.23 C=C(CN(C)C)C(C)=O Amb8397272 [0,1,0,0,0,0|2,0,1]=4 1408 B8R0.23 C=C(CN(C)O)C(=O)O Amb27640409 [0,1,0,0,0,0|2,0,1]=4 1409 B8R0.23 C=C(Cl)CC(=O)C(C)C Amb28144043 [0,1,0,0,0,0|2,0,1]=4 1410 B8R0.23 C=C(Cl)CC(C)C(C)O Amb33212811 [0,1,0,0,0,0|3,0,0]=4 1411 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb24411473 [0,1,0,0,0,0|1,0,2]=4 1412 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb28935021 [0,1,0,0,0,0|1,0,2]=4 1413 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660529 [0,1,0,0,0,0|1,0,2]=4 1414 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660530 [0,1,0,0,0,0|1,0,2]=4 1415 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb28059492 [0,1,0,0,0,0|1,0,2]=4 1416 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb32656263 [0,1,0,0,0,0|1,0,2]=4 1417 B8R0.23 C=C(F)CC(C)C(=O)O Amb27975781 [0,1,0,0,0,0|1,0,2]=4 1418 B8R0.23 C=C(F)CC(Cl)C(=O)O Amb27876022 [0,1,0,0,0,0|1,0,2]=4 1419 B8R0.23 C=C(F)C[C@@H](N)C(=O)O Amb27771842 [0,1,0,0,0,0|1,0,2]=4 1420 B8R0.23 C=C(O)CC(=C)N(C)C Amb27767982 [0,1,0,0,0,0|2,0,1]=4 1421 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,1,0,0,0,0|3,0,0]=4 1422 B8R0.23 C=C(OC(C)C)C(C)=O Amb27263012 [0,1,0,0,0,0|2,0,1]=4 1423 B8R0.23 CC(=N)NC(C)C(C)C Amb27837452 [0,1,0,0,0,0|3,0,0]=4 1424 B8R0.23 CC(=O)C(=O)CC(=O)O Amb17593364 [0,1,0,0,0,0|1,0,2]=4 1425 B8R0.23 CC(=O)C(=O)CC(C)C Amb22489717 [0,1,0,0,0,0|1,0,1]=3 1426 B8R0.23 CC(=O)C(=O)NC(C)C Amb17399820 [0,1,0,0,0,0|2,0,1]=4 1427 B8R0.23 CC(=O)C(=O)OC(C)C Amb22232277 [0,1,0,0,0,0|2,0,1]=4 1428 B8R0.23 CC(=O)C(Br)CC(=O)O Amb27834306 [0,1,0,0,0,0|1,0,1]=3 1429 B8R0.23 CC(=O)C(C)CC(=O)O Amb18292788 [0,1,0,0,0,0|1,0,1]=3 1430 B8R0.23 CC(=O)C(C)CC(C)C Amb24640121 [0,1,0,0,0,0|1,0,0]=2 1431 B8R0.23 CC(=O)C(C)CN(C)C Amb4019104 [0,1,0,0,0,0|2,0,0]=3 1432 B8R0.23 CC(=O)C(Cl)CC(C)O Amb27454439 [0,1,0,0,0,0|2,0,0]=3 1433 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [0,1,0,0,0,0|1,0,1]=3 1434 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,1,0,0,0,0|2,0,1]=4 1435 B8R0.23 CC(=O)C(O)CC(=O)O Amb25341886 [0,1,0,0,0,0|1,0,1]=3 1436 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [0,1,0,0,0,0|1,0,0]=2 1437 B8R0.23 CC(=O)CC(=O)C(=O)O Amb18642736 [0,1,0,0,0,0|1,0,2]=4 1438 B8R0.23 CC(=O)CC(=O)C(C)C Amb17778966 [0,1,0,0,0,0|1,0,1]=3 1439 B8R0.23 CC(=O)CC(=O)N(C)C Amb1152296 [0,1,0,0,0,0|2,0,1]=4 1440 B8R0.23 CC(=O)CC(=S)N(C)C Amb27836775 [0,1,0,0,0,0|2,0,1]=4 1441 B8R0.23 CC(=O)CC(Br)C(C)C Amb28436887 [0,1,0,0,0,0|1,0,0]=2 1442 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [0,1,0,0,0,0|1,0,1]=3 1443 B8R0.23 CC(=O)CC(C)C(C)=O Amb26490545 [0,1,0,0,0,0|2,0,1]=4 1444 B8R0.23 CC(=O)CC(Cl)=C(C)C Amb28351823 [0,1,0,0,0,0|1,0,2]=4 1445 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [0,1,0,0,0,0|1,0,1]=3 1446 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [0,1,0,0,0,0|1,0,1]=3 1447 B8R0.23 CC(=O)CC(N)C(C)C Amb27409984 [0,1,0,0,0,0|1,0,0]=2 1448 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [0,1,0,0,0,0|2,0,1]=4 1449 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [0,1,0,0,0,0|1,0,1]=3 1450 B8R0.23 CC(=O)CN(C)C(C)C Amb22587141 [0,1,0,0,0,0|2,0,0]=3 1451 B8R0.23 CC(=O)CS(=O)C(C)C Amb27804515 [0,1,0,0,0,0|2,0,0]=3 1452 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [0,1,0,0,0,0|1,0,1]=3 1453 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [0,1,0,0,0,0|1,0,1]=3 1454 B8R0.23 CC(=O)C[C@@H](O)C(C)C Amb25135567 [0,1,0,0,0,0|1,0,0]=2 1455 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [0,1,0,0,0,0|1,0,1]=3 1456 B8R0.23 CC(=O)C[C@H](C)C(C)=O Amb28051038 [0,1,0,0,0,0|2,0,1]=4 1457 B8R0.23 CC(=O)C[C@H](C)C(C)C Amb28285288 [0,1,0,0,0,0|1,0,0]=2 1458 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [0,1,0,0,0,0|1,0,1]=3 1459 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [0,1,0,0,0,0|1,0,1]=3 1460 B8R0.23 CC(=O)N(C)CC(=O)O Amb33526797 [0,1,0,0,0,0|2,0,1]=4 1461 B8R0.23 CC(=O)N(Cl)CC(=O)O Amb28366945 [0,1,0,0,0,0|2,0,1]=4 1462 B8R0.23 CC(=O)NC(=O)C(C)C Amb28428628 [0,1,0,0,0,0|2,0,1]=4 1463 B8R0.23 CC(=O)NC(C)C(=O)O Amb9745652 [0,1,0,0,0,0|2,0,1]=4 1464 B8R0.23 CC(=O)N[C@@H](C)C(=O)O Amb8390375 [0,1,0,0,0,0|2,0,1]=4 1465 B8R0.23 CC(=O)N[C@H](C)C(=O)O Amb19944277 [0,1,0,0,0,0|2,0,1]=4 1466 B8R0.23 CC(=O)OC(C)C(=O)O Amb22360672 [0,1,0,0,0,0|2,0,1]=4 1467 B8R0.23 CC(=O)OC(C)C(C)O Amb28366888 [0,1,0,0,0,0|3,0,0]=4 1468 B8R0.23 CC(=O)O[C@@H](C)C(=O)O Amb3938984 [0,1,0,0,0,0|2,0,1]=4 1469 B8R0.23 CC(=O)O[C@@H](C)[C@@H](C)Br Amb24558149 [0,1,0,0,0,0|3,0,0]=4 1470 B8R0.23 CC(=O)O[C@@H](C)[C@H](C)O Amb28321279 [0,1,0,0,0,0|3,0,0]=4 1471 B8R0.23 CC(=O)O[C@H](C)C(=O)O Amb26458759 [0,1,0,0,0,0|2,0,1]=4 1472 B8R0.23 CC(=O)O[C@H](C)C(C)O Amb27192959 [0,1,0,0,0,0|3,0,0]=4 1473 B8R0.23 CC(=O)S[C@@H](C)C(=O)O Amb26639910 [0,1,0,0,0,0|2,0,1]=4 1474 B8R0.23 CC(=O)S[C@H](C)C(=O)O Amb28118658 [0,1,0,0,0,0|2,0,1]=4 1475 B8R0.23 CC(=O)[C@@H](C)CN(C)C Amb27162005 [0,1,0,0,0,0|2,0,0]=3 1476 B8R0.23 CC(=O)[C@@H](N)CC(C)C Amb28344512 [0,1,0,0,0,0|1,0,0]=2 1477 B8R0.23 CC(=O)[C@@H](N)CC(N)=O Amb28044564 [0,1,0,0,0,0|2,0,1]=4 1478 B8R0.23 CC(=O)[C@@H](O)CC(=O)O Amb28398474 [0,1,0,0,0,0|1,0,1]=3 1479 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [0,1,0,0,0,0|1,0,0]=2 1480 B8R0.23 CC(=O)[C@H](C)CC(=O)O Amb25360184 [0,1,0,0,0,0|1,0,1]=3 1481 B8R0.23 CC(=O)[C@H](N)CC(C)C Amb27490707 [0,1,0,0,0,0|1,0,0]=2 1482 B8R0.23 CC(=O)\C(C)=N/C(C)C Amb27165098 [0,1,0,0,0,0|2,0,1]=4 1483 B8R0.23 CC(=O)\C(C)=N\C(C)C Amb27826830 [0,1,0,0,0,0|2,0,1]=4 1484 B8R0.23 CC(=O)\C=C(/C)C(C)C Amb27649040 [0,1,0,0,0,0|1,0,2]=4 1485 B8R0.23 CC(=O)\C=C(/N)C(C)C Amb27477023 [0,1,0,0,0,0|1,0,2]=4 1486 B8R0.23 CC(=S)CC(=O)C(C)C Amb27838816 [0,1,0,0,0,0|1,1,1]=4 1487 B8R0.23 CC(=S)NC(C)C(=O)O Amb27876447 [0,1,0,0,0,0|2,0,1]=4 1488 B8R0.23 CC(Br)C(C)NC(N)=O Amb27233701 [0,1,0,0,0,0|3,0,0]=4 1489 B8R0.23 CC(Br)CC(=O)C(=O)O Amb28146183 [0,1,0,0,0,0|1,0,1]=3 1490 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [0,1,0,0,0,0|1,0,0]=2 1491 B8R0.23 CC(C)=C(C)CC(=O)O Amb18642613 [0,1,0,0,0,0|0,0,2]=3 1492 B8R0.23 CC(C)=CC(O)C(=O)O Amb28346343 [0,1,0,0,0,0|0,0,2]=3 1493 B8R0.23 CC(C)=CC(O)C(C)C Amb28187123 [0,1,0,0,0,0|2,0,1]=4 1494 B8R0.23 CC(C)=C[C@@H](O)C(=O)O Amb27228179 [0,1,0,0,0,0|0,0,2]=3 1495 B8R0.23 CC(C)=C[C@H](O)C(=O)O Amb27473652 [0,1,0,0,0,0|0,0,2]=3 1496 B8R0.23 CC(C)=C[C@H](O)C(C)C Amb28049217 [0,1,0,0,0,0|2,0,1]=4 1497 B8R0.23 CC(C)C(=O)CS(C)=O Amb28041249 [0,1,0,0,0,0|2,0,1]=4 1498 B8R0.23 CC(C)C(=O)C[C@H](C)O Amb28285164 [0,1,0,0,0,0|1,0,2]=4 1499 B8R0.23 CC(C)C(=O)C[N+](=O)[O-] Amb27802158 [0,1,0,0,0,0|1,0,2]=4 1500 B8R0.23 CC(C)C(=O)NC(N)=O Amb25716051 [0,1,0,0,0,0|2,0,1]=4 1501 B8R0.23 CC(C)C(=S)NC(N)=O Amb27168629 [0,1,0,0,0,0|2,0,1]=4 1502 B8R0.23 CC(C)C(C)C=C(Br)Br Amb27837696 [0,1,0,0,0,0|2,0,1]=4 1503 B8R0.23 CC(C)C(C)CB(O)O Amb28138502 [0,1,0,0,0,0|1,0,1]=3 1504 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,1,0,0,0,0|0,0,0]=1 1505 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,1,0,0,0,0|1,0,0]=2 1506 B8R0.23 CC(C)C(C)CN(C)N Amb28056669 [0,1,0,0,0,0|3,0,0]=4 1507 B8R0.23 CC(C)C(C)NC(=O)Cl Amb35637133 [0,1,0,0,0,0|2,0,0]=3 1508 B8R0.23 CC(C)C(C)NC(N)=O Amb7761978 [0,1,0,0,0,0|2,0,0]=3 1509 B8R0.23 CC(C)C(C)OC(=O)Cl Amb27835399 [0,1,0,0,0,0|2,0,0]=3 1510 B8R0.23 CC(C)C(C)SC(=N)N Amb27830196 [0,1,0,0,0,0|3,0,0]=4 1511 B8R0.23 CC(C)C(Cl)C=C(Cl)Cl Amb28458515 [0,1,0,0,0,0|2,0,1]=4 1512 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [0,1,0,0,0,0|0,0,0]=1 1513 B8R0.23 CC(C)C(Cl)OC(=O)Cl Amb8515447 [0,1,0,0,0,0|2,0,0]=3 1514 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [0,1,0,0,0,0|0,0,0]=1 1515 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [0,1,0,0,0,0|0,0,0]=1 1516 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,1,0,0,0,0|1,0,0]=2 1517 B8R0.23 CC(C)C(N)CN(C)C Amb28934928 [0,1,0,0,0,0|3,0,0]=4 1518 B8R0.23 CC(C)C(N)CN(C)C Amb6715643 [0,1,0,0,0,0|3,0,0]=4 1519 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [0,1,0,0,0,0|0,0,0]=1 1520 B8R0.23 CC(C)C(O)CN(C)C Amb25882026 [0,1,0,0,0,0|3,0,0]=4 1521 B8R0.23 CC(C)C(O)OS(=O)[O-] Amb28455243 [0,1,0,0,0,0|2,0,1]=4 1522 B8R0.23 CC(C)CC(=N)C(=O)O Amb27268516 [0,1,0,0,0,0|0,0,1]=2 1523 B8R0.23 CC(C)CC(=O)C(=O)Cl Amb28350424 [0,1,0,0,0,0|1,0,1]=3 1524 B8R0.23 CC(C)CC(=O)C(=O)O Amb8387123 [0,1,0,0,0,0|0,0,1]=2 1525 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb21962530 [0,1,0,0,0,0|0,0,2]=3 1526 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb22360647 [0,1,0,0,0,0|0,0,2]=3 1527 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb8393074 [0,1,0,0,0,0|0,0,2]=3 1528 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb8513874 [0,1,0,0,0,0|0,0,2]=3 1529 B8R0.23 CC(C)CC(=O)C(C)O Amb25808608 [0,1,0,0,0,0|1,0,2]=4 1530 B8R0.23 CC(C)CC(=O)C(N)=S Amb28046427 [0,1,0,0,0,0|1,1,1]=4 1531 B8R0.23 CC(C)CC(=O)[C@H](C)O Amb27598746 [0,1,0,0,0,0|1,0,2]=4 1532 B8R0.23 CC(C)CC(Br)C(=O)Cl Amb26515942 [0,1,0,0,0,0|1,0,0]=2 1533 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [0,1,0,0,0,0|0,0,0]=1 1534 B8R0.23 CC(C)CC(Br)C(C)C Amb27777169 [0,1,0,0,0,0|2,0,1]=4 1535 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [0,1,0,0,0,0|0,0,0]=1 1536 B8R0.23 CC(C)CC(C)C(C)Br Amb18330279 [0,1,0,0,0,0|2,0,1]=4 1537 B8R0.23 CC(C)CC(C)C(C)C Amb22729265 [0,1,0,0,0,0|2,0,1]=4 1538 B8R0.23 CC(C)CC(C)C(C)N Amb18289569 [0,1,0,0,0,0|2,0,1]=4 1539 B8R0.23 CC(C)CC(C)C(C)O Amb27620814 [0,1,0,0,0,0|1,0,1]=3 1540 B8R0.23 CC(C)CC(C)N(C)N Amb27838596 [0,1,0,0,0,0|3,0,0]=4 1541 B8R0.23 CC(C)CC(C)S(=O)Cl Amb32720376 [0,1,0,0,0,0|2,0,0]=3 1542 B8R0.23 CC(C)CC(C)S(=O)[O-] Amb24371233 [0,1,0,0,0,0|1,0,1]=3 1543 B8R0.23 CC(C)CC(C)S(N)=O Amb32720382 [0,1,0,0,0,0|2,0,0]=3 1544 B8R0.23 CC(C)CC(C)[C@@H](C)N Amb33738428 [0,1,0,0,0,0|2,0,1]=4 1545 B8R0.23 CC(C)CC(C)[C@H](C)N Amb33745256 [0,1,0,0,0,0|2,0,1]=4 1546 B8R0.23 CC(C)CC(Cl)C(=O)Cl Amb27400431 [0,1,0,0,0,0|1,0,0]=2 1547 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [0,1,0,0,0,0|0,0,0]=1 1548 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [0,1,0,0,0,0|0,0,0]=1 1549 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [0,1,0,0,0,0|0,0,0]=1 1550 B8R0.23 CC(C)CC(N)C(C)C Amb18993301 [0,1,0,0,0,0|2,0,1]=4 1551 B8R0.23 CC(C)CC(N)C(C)N Amb28282150 [0,1,0,0,0,0|2,0,1]=4 1552 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [0,1,0,0,0,0|1,0,1]=3 1553 B8R0.23 CC(C)CC(N)C(N)=O Amb6334827 [0,1,0,0,0,0|1,0,0]=2 1554 B8R0.23 CC(C)CC(N)C(N)=O Amb9729639 [0,1,0,0,0,0|1,0,0]=2 1555 B8R0.23 CC(C)CC(N)C(N)=S Amb28292675 [0,1,0,0,0,0|1,1,0]=3 1556 B8R0.23 CC(C)CC(N)C(O)O Amb27970496 [0,1,0,0,0,0|0,0,2]=3 1557 B8R0.23 CC(C)CC(N)P(O)O Amb27231724 [0,1,0,0,0,0|1,0,1]=3 1558 B8R0.23 CC(C)CC(N)[PH](=O)O Amb27831348 [0,1,0,0,0,0|1,0,0]=2 1559 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [0,1,0,0,0,0|0,0,0]=1 1560 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [0,1,0,0,0,0|0,0,1]=2 1561 B8R0.23 CC(C)CC(O)C(C)N Amb17470368 [0,1,0,0,0,0|2,0,1]=4 1562 B8R0.23 CC(C)CC(O)C(F)F Amb28204156 [0,1,0,0,0,0|2,0,1]=4 1563 B8R0.23 CC(C)CC(O)[C@@H](C)N Amb35618093 [0,1,0,0,0,0|2,0,1]=4 1564 B8R0.23 CC(C)CC(O)[C@H](C)N Amb35737731 [0,1,0,0,0,0|2,0,1]=4 1565 B8R0.23 CC(C)CC(O)[N+](=O)[O-] Amb27162218 [0,1,0,0,0,0|1,0,1]=3 1566 B8R0.23 CC(C)CC(O)[PH](=O)O Amb27255267 [0,1,0,0,0,0|1,0,0]=2 1567 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [0,1,0,0,0,0|0,0,0]=1 1568 B8R0.23 CC(C)CN(C)C(=N)N Amb28934936 [0,1,0,0,0,0|3,0,0]=4 1569 B8R0.23 CC(C)CN(C)C(=N)N Amb8899971 [0,1,0,0,0,0|3,0,0]=4 1570 B8R0.23 CC(C)CN(C)C(=O)Cl Amb26589878 [0,1,0,0,0,0|2,0,0]=3 1571 B8R0.23 CC(C)CN(C)C(N)=S Amb8899763 [0,1,0,0,0,0|2,1,0]=4 1572 B8R0.23 CC(C)CN(N)C(N)=O Amb27624191 [0,1,0,0,0,0|2,0,0]=3 1573 B8R0.23 CC(C)CN(N)C(N)=S Amb27252050 [0,1,0,0,0,0|2,1,0]=4 1574 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [0,1,0,0,0,0|0,0,0]=1 1575 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [0,1,0,0,0,0|0,0,0]=1 1576 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [0,1,0,0,0,0|0,0,0]=1 1577 B8R0.23 CC(C)C[C@@H](N)B(O)O Amb27978098 [0,1,0,0,0,0|1,0,1]=3 1578 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [0,1,0,0,0,0|0,0,0]=1 1579 B8R0.23 CC(C)C[C@@H](N)C(C)O Amb28201191 [0,1,0,0,0,0|1,0,1]=3 1580 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb16183944 [0,1,0,0,0,0|1,0,0]=2 1581 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,1,0,0,0,0|1,0,0]=2 1582 B8R0.23 CC(C)C[C@@H](N)C(N)=S Amb27450783 [0,1,0,0,0,0|1,1,0]=3 1583 B8R0.23 CC(C)C[C@@H](N)[C@@H](C)N Amb27882552 [0,1,0,0,0,0|2,0,1]=4 1584 B8R0.23 CC(C)C[C@@H](N)[C@@H](C)O Amb27593782 [0,1,0,0,0,0|1,0,1]=3 1585 B8R0.23 CC(C)C[C@@H](N)[C@H](C)N Amb27630065 [0,1,0,0,0,0|2,0,1]=4 1586 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [0,1,0,0,0,0|0,0,0]=1 1587 B8R0.23 CC(C)C[C@@H](O)C(C)C Amb28207354 [0,1,0,0,0,0|2,0,1]=4 1588 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [0,1,0,0,0,0|0,0,0]=1 1589 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [0,1,0,0,0,0|0,0,0]=1 1590 B8R0.23 CC(C)C[C@H](Br)C(N)=O Amb28197754 [0,1,0,0,0,0|1,0,0]=2 1591 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [0,1,0,0,0,0|0,0,0]=1 1592 B8R0.23 CC(C)C[C@H](Cl)C(=O)Cl Amb27657532 [0,1,0,0,0,0|1,0,0]=2 1593 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [0,1,0,0,0,0|0,0,0]=1 1594 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [0,1,0,0,0,0|0,0,0]=1 1595 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [0,1,0,0,0,0|1,0,1]=3 1596 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [0,1,0,0,0,0|0,0,0]=1 1597 B8R0.23 CC(C)C[C@H](N)C(=O)S Amb27810129 [0,1,0,0,0,0|0,1,0]=2 1598 B8R0.23 CC(C)C[C@H](N)C(F)F Amb28364932 [0,1,0,0,0,0|2,0,1]=4 1599 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb10670112 [0,1,0,0,0,0|1,0,0]=2 1600 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb8515324 [0,1,0,0,0,0|1,0,0]=2 1601 B8R0.23 CC(C)C[C@H](N)C(N)=S Amb28285298 [0,1,0,0,0,0|1,1,0]=3 1602 B8R0.23 CC(C)C[C@H](N)[C@H](C)N Amb27392071 [0,1,0,0,0,0|2,0,1]=4 1603 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [0,1,0,0,0,0|0,0,0]=1 1604 B8R0.23 CC(C)N(C)CC(=O)O Amb10609863 [0,1,0,0,0,0|1,0,0]=2 1605 B8R0.23 CC(C)N(C)CC(=O)O Amb6639901 [0,1,0,0,0,0|1,0,0]=2 1606 B8R0.23 CC(C)NC(=O)C(=O)O Amb2693957 [0,1,0,0,0,0|1,0,1]=3 1607 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [0,1,0,0,0,0|1,0,0]=2 1608 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [0,1,0,0,0,0|1,0,0]=2 1609 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [0,1,0,0,0,0|1,0,0]=2 1610 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [0,1,0,0,0,0|1,0,0]=2 1611 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb6541556 [0,1,0,0,0,0|1,0,1]=3 1612 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb9172207 [0,1,0,0,0,0|1,0,1]=3 1613 B8R0.23 CC(C)OC(F)C(=O)O Amb28045324 [0,1,0,0,0,0|1,0,0]=2 1614 B8R0.23 CC(C)O[C@@H](C)[C@H](C)O Amb27844566 [0,1,0,0,0,0|2,0,1]=4 1615 B8R0.23 CC(C)SC(=S)C(=O)O Amb27196601 [0,1,0,0,0,0|1,0,1]=3 1616 B8R0.23 CC(C)SC(C)C(=N)N Amb27789497 [0,1,0,0,0,0|3,0,0]=4 1617 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [0,1,0,0,0,0|1,0,0]=2 1618 B8R0.23 CC(C)SC(C)C(C)O Amb27816029 [0,1,0,0,0,0|2,0,1]=4 1619 B8R0.23 CC(C)SC(C)C(N)=O Amb28071700 [0,1,0,0,0,0|2,0,0]=3 1620 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [0,1,0,0,0,0|1,0,0]=2 1621 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,1,0,0,0,0|0,0,0]=1 1622 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [0,1,0,0,0,0|0,0,0]=1 1623 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [0,1,0,0,0,0|0,0,0]=1 1624 B8R0.23 CC(C)[C@@H](N)CC(N)=O Amb28340737 [0,1,0,0,0,0|1,0,0]=2 1625 B8R0.23 CC(C)[C@@H](N)CN(C)C Amb34913359 [0,1,0,0,0,0|3,0,0]=4 1626 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [0,1,0,0,0,0|0,0,0]=1 1627 B8R0.23 CC(C)[C@@H](O)CC(N)=O Amb27443470 [0,1,0,0,0,0|1,0,0]=2 1628 B8R0.23 CC(C)[C@@H](O)CN(C)C Amb26616081 [0,1,0,0,0,0|3,0,0]=4 1629 B8R0.23 CC(C)[C@H](C)CB(O)O Amb27169740 [0,1,0,0,0,0|1,0,1]=3 1630 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [0,1,0,0,0,0|0,0,0]=1 1631 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [0,1,0,0,0,0|0,0,0]=1 1632 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,1,0,0,0,0|1,0,0]=2 1633 B8R0.23 CC(C)[C@H](N)CN(C)C Amb24578683 [0,1,0,0,0,0|3,0,0]=4 1634 B8R0.23 CC(C)[C@H](N)CN(C)C Amb34913336 [0,1,0,0,0,0|3,0,0]=4 1635 B8R0.23 CC(C)[C@H](N)C[C@H](C)O Amb27457995 [0,1,0,0,0,0|1,0,1]=3 1636 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [0,1,0,0,0,0|0,0,0]=1 1637 B8R0.23 CC(C)\C(N)=C\C(N)=O Amb27413103 [0,1,0,0,0,0|1,0,2]=4 1638 B8R0.23 CC(C)\C=C(/F)C(=O)O Amb34913203 [0,1,0,0,0,0|0,0,2]=3 1639 B8R0.23 CC(C)\C=C(\Br)C(=O)O Amb27789870 [0,1,0,0,0,0|0,0,2]=3 1640 B8R0.23 CC(C)\C=C(\F)C(=O)O Amb27838509 [0,1,0,0,0,0|0,0,2]=3 1641 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,1,0,0,0,0|2,0,1]=4 1642 B8R0.23 CC(CC(=O)O)C(F)F Amb27441233 [0,1,0,0,0,0|2,0,0]=3 1643 B8R0.23 CC(CC(=O)O)C(N)=O Amb25737942 [0,1,0,0,0,0|2,0,1]=4 1644 B8R0.23 CC(CC(=O)O)C(N)N Amb27481204 [0,1,0,0,0,0|2,0,0]=3 1645 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [0,1,0,0,0,0|1,0,0]=2 1646 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [0,1,0,0,0,0|1,0,0]=2 1647 B8R0.23 CC(CC(=O)O)N(C)O Amb27639550 [0,1,0,0,0,0|2,0,0]=3 1648 B8R0.23 CC(CC(F)F)C(=O)O Amb22896466 [0,1,0,0,0,0|2,0,0]=3 1649 B8R0.23 CC(CC(N)=O)C(=O)O Amb27596628 [0,1,0,0,0,0|2,0,1]=4 1650 B8R0.23 CC(CC(N)=O)N(C)C Amb17231867 [0,1,0,0,0,0|2,0,0]=3 1651 B8R0.23 CC(CC(N)=S)N(C)C Amb17232023 [0,1,0,0,0,0|2,1,0]=4 1652 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [0,1,0,0,0,0|1,0,0]=2 1653 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [0,1,0,0,0,0|1,0,0]=2 1654 B8R0.23 CC(CN(C)C)C(N)=O Amb17231865 [0,1,0,0,0,0|2,0,0]=3 1655 B8R0.23 CC(CN(C)C)[N+](=O)[O-] Amb22274691 [0,1,0,0,0,0|2,0,1]=4 1656 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [0,1,0,0,0,0|2,0,0]=3 1657 B8R0.23 CC(CS(=O)O)C(=O)O Amb28118949 [0,1,0,0,0,0|3,0,0]=4 1658 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [0,1,0,0,0,0|2,0,0]=3 1659 B8R0.23 CC(CS(C)=O)C(N)=O Amb27981416 [0,1,0,0,0,0|3,0,0]=4 1660 B8R0.23 CC(C[PH](=O)O)C(=O)O Amb27477749 [0,1,0,0,0,0|3,0,0]=4 1661 B8R0.23 CC(Cl)C(C)OC(=O)Cl Amb27831442 [0,1,0,0,0,0|3,0,0]=4 1662 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [0,1,0,0,0,0|1,0,0]=2 1663 B8R0.23 CC(Cl)\C=C(\O)C(=O)O Amb27658885 [0,1,0,0,0,0|1,0,2]=4 1664 B8R0.23 CC(N)C(C)NC(N)=O Amb27427383 [0,1,0,0,0,0|3,0,0]=4 1665 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [0,1,0,0,0,0|1,0,0]=2 1666 B8R0.23 CC(N)C(O)CC(N)=O Amb28184577 [0,1,0,0,0,0|2,0,0]=3 1667 B8R0.23 CC(N)C(O)C[PH](=O)O Amb28130506 [0,1,0,0,0,0|2,0,0]=3 1668 B8R0.23 CC(N)CC(C)C(C)C Amb28057003 [0,1,0,0,0,0|2,0,1]=4 1669 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [0,1,0,0,0,0|1,0,0]=2 1670 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [0,1,0,0,0,0|1,0,0]=2 1671 B8R0.23 CC(N)CN(C)C(N)=O Amb18203178 [0,1,0,0,0,0|3,0,0]=4 1672 B8R0.23 CC(N)[C@@H](O)C[PH](=O)O Amb27841881 [0,1,0,0,0,0|2,0,0]=3 1673 B8R0.23 CC(O)C(C)C[SiH](C)C Amb27601186 [0,1,0,0,0,0|1,1,1]=4 1674 B8R0.23 CC(O)C(C)NC(N)=O Amb27254184 [0,1,0,0,0,0|3,0,0]=4 1675 B8R0.23 CC(O)C(C)OC(N)=O Amb27644455 [0,1,0,0,0,0|3,0,0]=4 1676 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [0,1,0,0,0,0|1,0,0]=2 1677 B8R0.23 CC(O)C(N)CC(N)=O Amb27246007 [0,1,0,0,0,0|2,0,0]=3 1678 B8R0.23 CC(O)C(N)CN(C)C Amb18203169 [0,1,0,0,0,0|2,0,1]=4 1679 B8R0.23 CC(O)CC(=O)C(=O)O Amb25789747 [0,1,0,0,0,0|1,0,1]=3 1680 B8R0.23 CC(O)CC(C)C(C)C Amb28059818 [0,1,0,0,0,0|1,0,1]=3 1681 B8R0.23 CC(O)CC(C)N(C)C Amb27258208 [0,1,0,0,0,0|2,0,1]=4 1682 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [0,1,0,0,0,0|1,0,0]=2 1683 B8R0.23 CC(O)CC(N)C(C)C Amb27956567 [0,1,0,0,0,0|1,0,1]=3 1684 B8R0.23 CC(O)CC(N)C(N)=O Amb33065888 [0,1,0,0,0,0|2,0,0]=3 1685 B8R0.23 CC(O)CC(O)C(C)C Amb535791 [0,1,0,0,0,0|1,0,1]=3 1686 B8R0.23 CC(O)CC(S)C(C)C Amb28049086 [0,1,0,0,0,0|1,0,1]=3 1687 B8R0.23 CC(O)CN(C)C(C)C Amb17334133 [0,1,0,0,0,0|2,0,1]=4 1688 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [0,1,0,0,0,0|1,0,0]=2 1689 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [0,1,0,0,0,0|1,0,0]=2 1690 B8R0.23 CC(OC(F)F)C(=O)O Amb24358717 [0,1,0,0,0,0|3,0,0]=4 1691 B8R0.23 CN(C)C(=O)CC(=O)O Amb17399822 [0,1,0,0,0,0|1,0,1]=3 1692 B8R0.23 CN(C)C(=O)CC(N)=O Amb17760295 [0,1,0,0,0,0|2,0,1]=4 1693 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [0,1,0,0,0,0|1,0,0]=2 1694 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [0,1,0,0,0,0|1,0,0]=2 1695 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [0,1,0,0,0,0|1,0,0]=2 1696 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [0,1,0,0,0,0|2,0,0]=3 1697 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [0,1,0,0,0,0|1,0,0]=2 1698 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [0,1,0,0,0,0|1,0,0]=2 1699 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [0,1,0,0,0,0|1,0,0]=2 1700 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [0,1,0,0,0,0|1,0,0]=2 1701 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [0,1,0,0,0,0|1,0,0]=2 1702 B8R0.23 CN(CC(=O)O)S(C)=O Amb27862060 [0,1,0,0,0,0|3,0,0]=4 1703 B8R0.23 CN(N)C(=O)CC(=O)O Amb25326354 [0,1,0,0,0,0|2,0,1]=4 1704 B8R0.23 CS(=N)C[C@H](N)C(=O)O Amb27838573 [0,1,0,0,0,0|2,0,0]=3 1705 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [0,1,0,0,0,0|2,0,0]=3 1706 B8R0.23 CS(=O)CC(N)C(N)=O Amb27608115 [0,1,0,0,0,0|3,0,0]=4 1707 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [0,1,0,0,0,0|2,0,0]=3 1708 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [0,1,0,0,0,0|2,0,0]=3 1709 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [0,1,0,0,0,0|2,0,1]=4 1710 B8R0.23 C[C@@H](CC(F)F)C(=O)O Amb33749533 [0,1,0,0,0,0|2,0,0]=3 1711 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [0,1,0,0,0,0|1,0,0]=2 1712 B8R0.23 C[C@@H](N)C(=O)CC(N)=O Amb28188661 [0,1,0,0,0,0|2,0,1]=4 1713 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [0,1,0,0,0,0|1,0,0]=2 1714 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [0,1,0,0,0,0|1,0,0]=2 1715 B8R0.23 C[C@@H](OC(F)F)C(=O)O Amb24389309 [0,1,0,0,0,0|3,0,0]=4 1716 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [0,1,0,0,0,0|2,0,1]=4 1717 B8R0.23 C[C@H](CC(=O)O)C(Cl)Cl Amb28292581 [0,1,0,0,0,0|2,0,0]=3 1718 B8R0.23 C[C@H](CC(=O)O)C(N)=O Amb28133461 [0,1,0,0,0,0|2,0,1]=4 1719 B8R0.23 C[C@H](CC(=O)O)S(C)=O Amb27410588 [0,1,0,0,0,0|2,0,0]=3 1720 B8R0.23 C[C@H](CC(F)F)C(=O)O Amb33727762 [0,1,0,0,0,0|2,0,0]=3 1721 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [0,1,0,0,0,0|1,0,0]=2 1722 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [0,1,0,0,0,0|1,0,0]=2 1723 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [0,1,0,0,0,0|1,0,0]=2 1724 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [0,1,0,0,0,0|1,0,0]=2 1725 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [0,1,0,0,0,0|1,0,0]=2 1726 B8R0.23 C[C@H](NS(C)=O)C(=O)O Amb27212723 [0,1,0,0,0,0|3,0,0]=4 1727 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [0,1,0,0,0,0|1,0,0]=2 1728 B8R0.23 C[C@H](O)[C@@H](N)CN(C)C Amb25114644 [0,1,0,0,0,0|2,0,1]=4 1729 B8R0.23 C[C@H](OC(F)F)C(=O)O Amb26499188 [0,1,0,0,0,0|3,0,0]=4 1730 B8R0.23 C[C@H](OC(N)=O)[C@@H](C)Cl Amb27875080 [0,1,0,0,0,0|3,0,0]=4 1731 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [0,1,0,0,0,0|2,0,0]=3 1732 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [0,1,0,0,0,0|2,0,0]=3 1733 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [0,1,0,0,0,0|2,0,0]=3 1734 B8R0.23 C\C(=C/C(=O)O)C(C)C Amb17506861 [0,1,0,0,0,0|0,0,2]=3 1735 B8R0.23 C\C(=C/C(C)C)C(=O)O Amb18642616 [0,1,0,0,0,0|0,0,2]=3 1736 B8R0.23 C\C(=C/C(C)C)C(N)=O Amb27807446 [0,1,0,0,0,0|1,0,2]=4 1737 B8R0.23 C\C(=C/C(N)=O)C(C)C Amb27468615 [0,1,0,0,0,0|1,0,2]=4 1738 B8R0.23 C\C(=C\C(C)C)C(N)=O Amb28350432 [0,1,0,0,0,0|1,0,2]=4 1739 B8R0.23 C\C(=C\C(C)N)C(=O)O Amb25731207 [0,1,0,0,0,0|1,0,2]=4 1740 B8R0.23 C\C(Cl)=C/C(C)C(=O)O Amb28285105 [0,1,0,0,0,0|1,0,2]=4 1741 B8R0.23 C\C(Cl)=C/C(Cl)C(=O)O Amb28128482 [0,1,0,0,0,0|1,0,2]=4 1742 B8R0.23 NC(=O)C(N)CC(=O)O Amb18124347 [0,1,0,0,0,0|2,0,1]=4 1743 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666212 [0,1,0,0,0,0|2,0,1]=4 1744 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666239 [0,1,0,0,0,0|2,0,1]=4 1745 B8R0.23 NC(=O)C(N)CC(F)F Amb27409676 [0,1,0,0,0,0|3,0,0]=4 1746 B8R0.23 NC(=O)CC(Br)C(=O)O Amb26012685 [0,1,0,0,0,0|2,0,1]=4 1747 B8R0.23 NC(=O)CC(Cl)C(=O)O Amb27478086 [0,1,0,0,0,0|2,0,1]=4 1748 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [0,1,0,0,0,0|2,0,1]=4 1749 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [0,1,0,0,0,0|2,0,1]=4 1750 B8R0.23 NC(=O)CC(N)C(F)F Amb32418214 [0,1,0,0,0,0|3,0,0]=4 1751 B8R0.23 NC(=O)CC(O)C(=O)O Amb27807542 [0,1,0,0,0,0|2,0,1]=4 1752 B8R0.23 NC(=O)CC(S)C(=O)O Amb27494183 [0,1,0,0,0,0|2,0,1]=4 1753 B8R0.23 NC(=O)C[C@@H](Br)C(=O)O Amb27858620 [0,1,0,0,0,0|2,0,1]=4 1754 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [0,1,0,0,0,0|2,0,1]=4 1755 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [0,1,0,0,0,0|2,0,1]=4 1756 B8R0.23 NC(=O)C[C@@H](O)C(=O)O Amb24681022 [0,1,0,0,0,0|2,0,1]=4 1757 B8R0.23 NC(=O)C[C@@H](S)C(=O)O Amb27234637 [0,1,0,0,0,0|2,0,1]=4 1758 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [0,1,0,0,0,0|2,0,1]=4 1759 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [0,1,0,0,0,0|2,0,1]=4 1760 B8R0.23 NC(=O)C[C@H](S)C(=O)O Amb27253643 [0,1,0,0,0,0|2,0,1]=4 1761 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb19334954 [0,1,0,0,0,0|2,0,1]=4 1762 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb31291739 [0,1,0,0,0,0|2,0,1]=4 1763 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb32652393 [0,1,0,0,0,0|2,0,1]=4 1764 B8R0.23 NC(=O)[C@H](N)CC(=O)O Amb27768775 [0,1,0,0,0,0|2,0,1]=4 1765 B8R0.23 NC(=O)[C@H](N)CC(F)F Amb27163215 [0,1,0,0,0,0|3,0,0]=4 1766 B8R0.23 NC(=S)C[C@H](N)C(=O)O Amb28410343 [0,1,0,0,0,0|2,0,1]=4 1767 B8R0.23 NC(CB(O)O)C(=O)O Amb28285179 [0,1,0,0,0,0|3,0,0]=4 1768 B8R0.23 NC(CB(O)O)C(=O)O Amb33803309 [0,1,0,0,0,0|3,0,0]=4 1769 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [0,1,0,0,0,0|2,0,1]=4 1770 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22167994 [0,1,0,0,0,0|2,0,1]=4 1771 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22337568 [0,1,0,0,0,0|2,0,1]=4 1772 B8R0.23 NC(CC(=O)O)C(Cl)Cl Amb27964120 [0,1,0,0,0,0|2,0,0]=3 1773 B8R0.23 NC(CC(=O)O)C(F)F Amb23570587 [0,1,0,0,0,0|2,0,0]=3 1774 B8R0.23 NC(CC(Cl)Cl)C(=O)O Amb27791749 [0,1,0,0,0,0|2,0,0]=3 1775 B8R0.23 NC(CC(F)F)C(=O)O Amb13952714 [0,1,0,0,0,0|2,0,0]=3 1776 B8R0.23 NC(CC(F)F)C(=O)O Amb33546007 [0,1,0,0,0,0|2,0,0]=3 1777 B8R0.23 NC(CS(=O)O)C(=O)O Amb541272 [0,1,0,0,0,0|3,0,0]=4 1778 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [0,1,0,0,0,0|2,0,1]=4 1779 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [0,1,0,0,0,0|2,0,1]=4 1780 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Amb22801032 [0,1,0,0,0,0|2,0,1]=4 1781 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [0,1,0,0,0,0|2,0,1]=4 1782 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [0,1,0,0,0,0|2,0,1]=4 1783 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb26944439 [0,1,0,0,0,0|2,0,0]=3 1784 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb33482837 [0,1,0,0,0,0|2,0,0]=3 1785 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb6600148 [0,1,0,0,0,0|3,0,0]=4 1786 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb9809803 [0,1,0,0,0,0|3,0,0]=4 1787 B8R0.23 N[C@@H](C[SH](=O)=O)C(=O)O Amb27858626 [0,1,0,0,0,0|3,0,0]=4 1788 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [0,1,0,0,0,0|2,0,1]=4 1789 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb25117310 [0,1,0,0,0,0|2,0,0]=3 1790 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb33743521 [0,1,0,0,0,0|2,0,0]=3 1791 B8R0.23 O=C(O)C(=O)CC(F)F Amb33337766 [0,1,0,0,0,0|2,0,1]=4 1792 B8R0.23 O=C(O)C(O)CC(F)F Amb25274709 [0,1,0,0,0,0|2,0,0]=3 1793 B8R0.23 O=C(O)C(O)CC(O)O Amb28397948 [0,1,0,0,0,0|2,0,0]=3 1794 B8R0.23 O=C(O)C(O)C[N+](=O)[O-] Amb6883775 [0,1,0,0,0,0|3,0,0]=4 1795 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [0,1,0,0,0,0|2,0,1]=4 1796 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [0,1,0,0,0,0|2,0,1]=4 1797 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [0,1,0,0,0,0|2,0,1]=4 1798 B8R0.23 O=C(O)CC(O)C(Cl)Cl Amb27985520 [0,1,0,0,0,0|2,0,0]=3 1799 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [0,1,0,0,0,0|2,0,1]=4 1800 B8R0.23 O=C(O)CS(=O)C(F)F Amb18979309 [0,1,0,0,0,0|3,0,0]=4 1801 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [0,1,0,0,0,0|2,0,1]=4 1802 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [0,1,0,0,0,0|2,0,1]=4 1803 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [0,1,0,0,0,0|2,0,1]=4 1804 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [0,1,0,0,0,0|2,0,1]=4 1805 B8R0.23 O=C(O)C[C@@H](O)C(F)F Amb33337779 [0,1,0,0,0,0|2,0,0]=3 1806 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [0,1,0,0,0,0|2,0,1]=4 1807 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [0,1,0,0,0,0|2,0,1]=4 1808 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [0,1,0,0,0,0|2,0,1]=4 1809 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [0,1,0,0,0,0|2,0,1]=4 1810 B8R0.23 O=C(O)C[C@H](O)C(F)F Amb33485299 [0,1,0,0,0,0|2,0,0]=3 1811 B8R0.23 O=C(O)[C@H](Cl)CC(Cl)Cl Amb27831354 [0,1,0,0,0,0|2,0,0]=3 1812 B8R0.29 C=C(Br)COC(C)(C)C Amb27597301 [0,1,0,0,0,0|3,0,0]=4 1813 B8R0.29 C=C(C)CCC(C)(C)N Amb33200278 [0,1,0,0,0,0|2,0,0]=3 1814 B8R0.29 C=C(C)CCP(=O)(O)O Amb27163975 [0,1,0,0,0,0|1,0,2]=4 1815 B8R0.29 C=C(Cl)CNC(C)(C)C Amb18969565 [0,1,0,0,0,0|3,0,0]=4 1816 B8R0.29 CC(=O)CCC(C)(C)C Amb27481983 [0,1,0,0,0,0|1,0,0]=2 1817 B8R0.29 CC(=O)CCC(C)(C)Cl Amb27260509 [0,1,0,0,0,0|1,0,0]=2 1818 B8R0.29 CC(=O)CCC(C)(C)F Amb26512496 [0,1,0,0,0,0|1,0,0]=2 1819 B8R0.29 CC(=O)CCC(C)(C)O Amb26961451 [0,1,0,0,0,0|1,0,0]=2 1820 B8R0.29 CC(=O)CCC(C)(F)F Amb26479040 [0,1,0,0,0,0|2,0,0]=3 1821 B8R0.29 CC(=O)CCC(F)(F)F Amb24055935 [0,1,0,0,0,0|3,0,0]=4 1822 B8R0.29 CC(=O)CCS(C)(=O)=O Amb18181020 [0,1,0,0,0,0|3,0,0]=4 1823 B8R0.29 CC(=O)CC[N+](C)(C)C Amb4015632 [0,1,0,0,0,0|2,0,0]=3 1824 B8R0.29 CC(=O)CC[Si](C)(C)C Amb28324359 [0,1,0,0,0,0|1,1,0]=3 1825 B8R0.29 CC(=O)CC[Si](C)(C)Cl Amb27828965 [0,1,0,0,0,0|1,1,0]=3 1826 B8R0.29 CC(=O)CNC(C)(C)C Amb1091895 [0,1,0,0,0,0|2,0,0]=3 1827 B8R0.29 CC(=O)COC(C)(C)C Amb9666858 [0,1,0,0,0,0|2,0,0]=3 1828 B8R0.29 CC(=O)COP(C)(C)=O Amb27749793 [0,1,0,0,0,0|3,0,0]=4 1829 B8R0.29 CC(=O)CO[Si](C)(C)C Amb28202264 [0,1,0,0,0,0|2,1,0]=4 1830 B8R0.29 CC(=O)CSC(C)(C)C Amb4165959 [0,1,0,0,0,0|2,0,0]=3 1831 B8R0.29 CC(=O)NCC(C)(C)N Amb18642812 [0,1,0,0,0,0|2,0,0]=3 1832 B8R0.29 CC(=O)NCC(C)(C)O Amb25082896 [0,1,0,0,0,0|2,0,0]=3 1833 B8R0.29 CC(=O)NCC(C)(C)S Amb27489471 [0,1,0,0,0,0|2,0,0]=3 1834 B8R0.29 CC(=O)NCC(C)(F)F Amb29855696 [0,1,0,0,0,0|3,0,0]=4 1835 B8R0.29 CC(=O)NC[Si](C)(C)C Amb27461438 [0,1,0,0,0,0|2,1,0]=4 1836 B8R0.29 CC(=O)NC[Si](C)(C)O Amb27837682 [0,1,0,0,0,0|2,1,0]=4 1837 B8R0.29 CC(=O)OCC(C)(C)Br Amb33276495 [0,1,0,0,0,0|2,0,0]=3 1838 B8R0.29 CC(=O)OC[Si](C)(C)C Amb8514528 [0,1,0,0,0,0|2,1,0]=4 1839 B8R0.29 CC(=O)ONC(C)(C)C Amb22263962 [0,1,0,0,0,0|3,0,0]=4 1840 B8R0.29 CC(=O)SCC(C)(C)C Amb26932052 [0,1,0,0,0,0|2,0,0]=3 1841 B8R0.29 CC(=O)SCC(C)(C)O Amb27397144 [0,1,0,0,0,0|2,0,0]=3 1842 B8R0.29 CC(=O)\C=C/C(C)(C)C Amb28202021 [0,1,0,0,0,0|1,0,2]=4 1843 B8R0.29 CC(=O)\C=C\C(C)(C)C Amb26512040 [0,1,0,0,0,0|1,0,2]=4 1844 B8R0.29 CC(=O)\C=C\C(C)(C)F Amb33271799 [0,1,0,0,0,0|1,0,2]=4 1845 B8R0.29 CC(=O)\C=N/C(C)(C)C Amb28193333 [0,1,0,0,0,0|2,0,1]=4 1846 B8R0.29 CC(Br)(Br)COC(N)=O Amb27435159 [0,1,0,0,0,0|3,0,0]=4 1847 B8R0.29 CC(Br)CCC(C)(C)C Amb27832634 [0,1,0,0,0,0|2,0,1]=4 1848 B8R0.29 CC(Br)CCS(C)(=O)=O Amb33481791 [0,1,0,0,0,0|2,0,1]=4 1849 B8R0.29 CC(C)(Br)CCC(=O)O Amb27402242 [0,1,0,0,0,0|0,0,0]=1 1850 B8R0.29 CC(C)(C)C#CC(=O)O Amb33545064 [0,1,0,0,0,0|0,0,2]=3 1851 B8R0.29 CC(C)(C)CCB(O)O Amb24502180 [0,1,0,0,0,0|1,0,1]=3 1852 B8R0.29 CC(C)(C)CCC(=N)N Amb24412583 [0,1,0,0,0,0|2,0,0]=3 1853 B8R0.29 CC(C)(C)CCC(=N)N Amb33743592 [0,1,0,0,0,0|2,0,0]=3 1854 B8R0.29 CC(C)(C)CCC(=O)Cl Amb25105178 [0,1,0,0,0,0|1,0,0]=2 1855 B8R0.29 CC(C)(C)CCC(=O)O Amb8467936 [0,1,0,0,0,0|0,0,0]=1 1856 B8R0.29 CC(C)(C)CCC(N)=O Amb28349074 [0,1,0,0,0,0|1,0,0]=2 1857 B8R0.29 CC(C)(C)CCC(N)=S Amb28049043 [0,1,0,0,0,0|1,1,0]=3 1858 B8R0.29 CC(C)(C)CCS(=O)Cl Amb27226931 [0,1,0,0,0,0|2,0,0]=3 1859 B8R0.29 CC(C)(C)CCS(=O)[O-] Amb26987947 [0,1,0,0,0,0|1,0,1]=3 1860 B8R0.29 CC(C)(C)CCS(N)=O Amb32720539 [0,1,0,0,0,0|2,0,0]=3 1861 B8R0.29 CC(C)(C)CC[N+](=O)[O-] Amb32954794 [0,1,0,0,0,0|1,0,1]=3 1862 B8R0.29 CC(C)(C)CNC(=O)Cl Amb35625636 [0,1,0,0,0,0|2,0,0]=3 1863 B8R0.29 CC(C)(C)CNC(N)=O Amb20623709 [0,1,0,0,0,0|2,0,0]=3 1864 B8R0.29 CC(C)(C)COC(=O)Cl Amb10844667 [0,1,0,0,0,0|2,0,0]=3 1865 B8R0.29 CC(C)(C)COC(=O)F Amb27238052 [0,1,0,0,0,0|2,0,0]=3 1866 B8R0.29 CC(C)(C)COC(N)=S Amb27644061 [0,1,0,0,0,0|2,1,0]=4 1867 B8R0.29 CC(C)(C)CO[N+](=O)[O-] Amb27242666 [0,1,0,0,0,0|2,0,1]=4 1868 B8R0.29 CC(C)(C)NCC(=O)Cl Amb22739730 [0,1,0,0,0,0|2,0,0]=3 1869 B8R0.29 CC(C)(C)NCC(=O)Cl Amb26459118 [0,1,0,0,0,0|2,0,0]=3 1870 B8R0.29 CC(C)(C)NCC(=O)O Amb10610332 [0,1,0,0,0,0|1,0,0]=2 1871 B8R0.29 CC(C)(C)NCC(=O)O Amb7766549 [0,1,0,0,0,0|1,0,0]=2 1872 B8R0.29 CC(C)(C)NCC(N)=O Amb6714542 [0,1,0,0,0,0|2,0,0]=3 1873 B8R0.29 CC(C)(C)OCC(=N)N Amb28934930 [0,1,0,0,0,0|3,0,0]=4 1874 B8R0.29 CC(C)(C)OCC(=N)N Amb7792497 [0,1,0,0,0,0|3,0,0]=4 1875 B8R0.29 CC(C)(C)OCC(=O)Cl Amb33552858 [0,1,0,0,0,0|2,0,0]=3 1876 B8R0.29 CC(C)(C)OCC(=O)O Amb2691328 [0,1,0,0,0,0|1,0,0]=2 1877 B8R0.29 CC(C)(C)OCC(N)=O Amb22228918 [0,1,0,0,0,0|2,0,0]=3 1878 B8R0.29 CC(C)(C)OCC(N)=S Amb7792151 [0,1,0,0,0,0|2,1,0]=4 1879 B8R0.29 CC(C)(C)SCC(=O)O Amb433078 [0,1,0,0,0,0|1,0,0]=2 1880 B8R0.29 CC(C)(C)SCC(N)=S Amb27801917 [0,1,0,0,0,0|2,1,0]=4 1881 B8R0.29 CC(C)(C)[NH2+]CC(=O)O Amb2695316 [0,1,0,0,0,0|1,0,0]=2 1882 B8R0.29 CC(C)(C)\C=C\C(=O)O Amb30585155 [0,1,0,0,0,0|0,0,2]=3 1883 B8R0.29 CC(C)(Cl)CCB(O)O Amb28136544 [0,1,0,0,0,0|1,0,1]=3 1884 B8R0.29 CC(C)(Cl)CCC(=O)O Amb18644451 [0,1,0,0,0,0|0,0,0]=1 1885 B8R0.29 CC(C)(F)CCC(=O)O Amb26316862 [0,1,0,0,0,0|0,0,0]=1 1886 B8R0.29 CC(C)(F)CC[N+](=O)[O-] Amb33271853 [0,1,0,0,0,0|1,0,1]=3 1887 B8R0.29 CC(C)(F)OCC(=O)O Amb33225288 [0,1,0,0,0,0|1,0,0]=2 1888 B8R0.29 CC(C)(F)\C=C\C(=O)O Amb33272218 [0,1,0,0,0,0|0,0,2]=3 1889 B8R0.29 CC(C)(N)CC=C(Cl)Cl Amb35654333 [0,1,0,0,0,0|2,0,1]=4 1890 B8R0.29 CC(C)(N)CCC(=O)O Amb13951332 [0,1,0,0,0,0|0,0,0]=1 1891 B8R0.29 CC(C)(N)CCC(=O)O Amb6740013 [0,1,0,0,0,0|0,0,0]=1 1892 B8R0.29 CC(C)(N)CCC(F)F Amb25172484 [0,1,0,0,0,0|2,0,1]=4 1893 B8R0.29 CC(C)(N)CNC(N)=O Amb8631174 [0,1,0,0,0,0|2,0,0]=3 1894 B8R0.29 CC(C)(N)CNC(N)=O Amb8631175 [0,1,0,0,0,0|2,0,0]=3 1895 B8R0.29 CC(C)(N)\C=C\C(=O)O Amb26640960 [0,1,0,0,0,0|0,0,2]=3 1896 B8R0.29 CC(C)(O)C#CC(=O)O Amb6364820 [0,1,0,0,0,0|0,0,2]=3 1897 B8R0.29 CC(C)(O)CCC(=O)[O-] Amb33552947 [0,1,0,0,0,0|0,0,1]=2 1898 B8R0.29 CC(C)(O)CCC(N)=O Amb27667598 [0,1,0,0,0,0|1,0,0]=2 1899 B8R0.29 CC(C)(O)CNC(N)=O Amb27175271 [0,1,0,0,0,0|2,0,0]=3 1900 B8R0.29 CC(C)(S)CCC(=O)O Amb22489759 [0,1,0,0,0,0|0,0,0]=1 1901 B8R0.29 CC(C)CCC(C)(C)C Amb4016445 [0,1,0,0,0,0|2,0,1]=4 1902 B8R0.29 CC(C)CCC(C)(C)Cl Amb22228727 [0,1,0,0,0,0|2,0,1]=4 1903 B8R0.29 CC(C)CCC(C)(C)N Amb18299832 [0,1,0,0,0,0|2,0,1]=4 1904 B8R0.29 CC(C)CCC(C)(C)O Amb4035887 [0,1,0,0,0,0|1,0,1]=3 1905 B8R0.29 CC(C)CCS(=O)(=O)Br Amb23555504 [0,1,0,0,0,0|1,0,1]=3 1906 B8R0.29 CC(C)CCS(=O)(=O)Cl Amb18289340 [0,1,0,0,0,0|1,0,1]=3 1907 B8R0.29 CC(C)CCS(=O)(=O)F Amb32716844 [0,1,0,0,0,0|1,0,1]=3 1908 B8R0.29 CC(C)CCS(=O)(=O)O Amb26996755 [0,1,0,0,0,0|1,0,0]=2 1909 B8R0.29 CC(C)CCS(C)(=N)=O Amb32671062 [0,1,0,0,0,0|2,0,0]=3 1910 B8R0.29 CC(C)CCS(N)(=O)=O Amb18791482 [0,1,0,0,0,0|1,0,1]=3 1911 B8R0.29 CC(C)CNS(=O)(=O)Cl Amb17193918 [0,1,0,0,0,0|2,0,1]=4 1912 B8R0.29 CC(C)CNS(C)(=N)=O Amb35715263 [0,1,0,0,0,0|3,0,0]=4 1913 B8R0.29 CC(C)CNS(C)(=O)=O Amb3357776 [0,1,0,0,0,0|2,0,1]=4 1914 B8R0.29 CC(C)CNS(N)(=O)=O Amb24462446 [0,1,0,0,0,0|2,0,1]=4 1915 B8R0.29 CC(C)COP(=O)(O)O Amb25264732 [0,1,0,0,0,0|2,0,0]=3 1916 B8R0.29 CC(C)COP(C)(C)=O Amb25042087 [0,1,0,0,0,0|3,0,0]=4 1917 B8R0.29 CC(C)COS(C)(=O)=O Amb22388880 [0,1,0,0,0,0|2,0,1]=4 1918 B8R0.29 CC(C)COS(N)(=O)=O Amb33054160 [0,1,0,0,0,0|2,0,1]=4 1919 B8R0.29 CC(C)NCC(C)(C)O Amb4020606 [0,1,0,0,0,0|2,0,1]=4 1920 B8R0.29 CC(C)NCS(=O)(=O)O Amb27409883 [0,1,0,0,0,0|2,0,0]=3 1921 B8R0.29 CC(C)OCC(C)(C)O Amb27838443 [0,1,0,0,0,0|2,0,1]=4 1922 B8R0.29 CC(C)SCC(C)(C)O Amb27836847 [0,1,0,0,0,0|2,0,1]=4 1923 B8R0.29 CC(Cl)CCC(C)(C)O Amb27659351 [0,1,0,0,0,0|2,0,1]=4 1924 B8R0.29 CC(Cl)CCS(=O)(=O)Cl Amb26007552 [0,1,0,0,0,0|2,0,1]=4 1925 B8R0.29 CC(Cl)CCS(=O)(=O)F Amb32719144 [0,1,0,0,0,0|2,0,1]=4 1926 B8R0.29 CC(Cl)CCS(N)(=O)=O Amb25774525 [0,1,0,0,0,0|2,0,1]=4 1927 B8R0.29 CC(F)(F)CCC(=O)O Amb6252611 [0,1,0,0,0,0|1,0,0]=2 1928 B8R0.29 CC(F)(F)CCS(=O)Cl Amb32720776 [0,1,0,0,0,0|3,0,0]=4 1929 B8R0.29 CC(F)(F)CCS(=O)[O-] Amb32755253 [0,1,0,0,0,0|2,0,1]=4 1930 B8R0.29 CC(F)(F)CCS(N)=O Amb32720772 [0,1,0,0,0,0|3,0,0]=4 1931 B8R0.29 CC(F)(F)CC[N+](=O)[O-] Amb32810125 [0,1,0,0,0,0|2,0,1]=4 1932 B8R0.29 CC(F)(F)CNC(=O)Cl Amb35633315 [0,1,0,0,0,0|3,0,0]=4 1933 B8R0.29 CC(F)(F)CNC(N)=O Amb30007305 [0,1,0,0,0,0|3,0,0]=4 1934 B8R0.29 CC(F)(F)OCC(=O)O Amb32809085 [0,1,0,0,0,0|2,0,0]=3 1935 B8R0.29 CC(F)(F)\C=C\C(=O)O Amb22295928 [0,1,0,0,0,0|1,0,2]=4 1936 B8R0.29 CC(F)CCS(=O)(=O)Cl Amb28072755 [0,1,0,0,0,0|2,0,1]=4 1937 B8R0.29 CC(F)CCS(=O)(=O)F Amb32717836 [0,1,0,0,0,0|2,0,1]=4 1938 B8R0.29 CC(N)CCC(C)(C)C Amb18993576 [0,1,0,0,0,0|2,0,1]=4 1939 B8R0.29 CC(N)CCC(C)(C)F Amb33272196 [0,1,0,0,0,0|2,0,1]=4 1940 B8R0.29 CC(N)CCP(=O)(O)O Amb27392223 [0,1,0,0,0,0|2,0,0]=3 1941 B8R0.29 CC(N)CCS(=O)(=O)F Amb33463870 [0,1,0,0,0,0|2,0,1]=4 1942 B8R0.29 CC(N)CCS(C)(=O)=O Amb18300587 [0,1,0,0,0,0|2,0,1]=4 1943 B8R0.29 CC(O)CCC(C)(C)C Amb28410318 [0,1,0,0,0,0|1,0,1]=3 1944 B8R0.29 CC(O)CCC(C)(C)F Amb24757018 [0,1,0,0,0,0|1,0,1]=3 1945 B8R0.29 CC(O)CCC(C)(C)N Amb18642848 [0,1,0,0,0,0|1,0,1]=3 1946 B8R0.29 CC(O)CCC(C)(F)F Amb26442575 [0,1,0,0,0,0|2,0,1]=4 1947 B8R0.29 CC(O)CCS(=O)(=O)Cl Amb27882564 [0,1,0,0,0,0|2,0,1]=4 1948 B8R0.29 CC(O)CCS(C)(=O)=O Amb18180142 [0,1,0,0,0,0|2,0,1]=4 1949 B8R0.29 CC(O)CNC(C)(C)C Amb17138374 [0,1,0,0,0,0|2,0,1]=4 1950 B8R0.29 CC(O)COC(C)(C)C Amb4605856 [0,1,0,0,0,0|2,0,1]=4 1951 B8R0.29 CC(O)COP(C)(=O)O Amb28069786 [0,1,0,0,0,0|3,0,0]=4 1952 B8R0.29 CC(O)NCP(=O)(O)O Amb27201283 [0,1,0,0,0,0|3,0,0]=4 1953 B8R0.29 CC(S)CCC(C)(C)C Amb25044907 [0,1,0,0,0,0|1,1,1]=4 1954 B8R0.29 CN(C)CCC(C)(C)C Amb24477868 [0,1,0,0,0,0|3,0,0]=4 1955 B8R0.29 CN(C)CCC(C)(C)N Amb18203192 [0,1,0,0,0,0|3,0,0]=4 1956 B8R0.29 CN(C)CCC(C)(C)N Amb22491500 [0,1,0,0,0,0|3,0,0]=4 1957 B8R0.29 CN(C)CCC(C)(C)O Amb24126299 [0,1,0,0,0,0|2,0,1]=4 1958 B8R0.29 CN(C)CCP(=O)(O)O Amb26639131 [0,1,0,0,0,0|2,0,0]=3 1959 B8R0.29 CN(C)CCS(=O)(=O)Cl Amb24524149 [0,1,0,0,0,0|2,0,1]=4 1960 B8R0.29 CN(C)CCS(=O)(=O)Cl Amb32751259 [0,1,0,0,0,0|2,0,1]=4 1961 B8R0.29 CN(C)CCS(=O)(=O)F Amb26867208 [0,1,0,0,0,0|2,0,1]=4 1962 B8R0.29 CN(C)CCS(=O)(=O)F Amb32661317 [0,1,0,0,0,0|2,0,1]=4 1963 B8R0.29 CN(C)CCS(=O)(=O)O Amb25875615 [0,1,0,0,0,0|2,0,0]=3 1964 B8R0.29 CN(C)CCS(N)(=O)=O Amb27145875 [0,1,0,0,0,0|2,0,1]=4 1965 B8R0.29 CN(N)CCC(C)(C)C Amb27783489 [0,1,0,0,0,0|3,0,0]=4 1966 B8R0.29 CN(O)CCC(C)(C)C Amb33203937 [0,1,0,0,0,0|2,0,0]=3 1967 B8R0.29 CP(=O)(O)CCC(=O)O Amb1792559 [0,1,0,0,0,0|2,0,0]=3 1968 B8R0.29 CP(=O)(O)OCC(=O)O Amb26578720 [0,1,0,0,0,0|3,0,0]=4 1969 B8R0.29 CS(=N)(=O)NCC(=O)O Amb35687837 [0,1,0,0,0,0|3,0,0]=4 1970 B8R0.29 CS(=O)(=O)CCC(=O)O Amb6275720 [0,1,0,0,0,0|2,0,0]=3 1971 B8R0.29 CS(=O)(=O)NCC(=O)O Amb1120433 [0,1,0,0,0,0|3,0,0]=4 1972 B8R0.29 CS(=O)(=O)OCC(=O)O Amb25783884 [0,1,0,0,0,0|3,0,0]=4 1973 B8R0.29 CS(=O)(=O)SCC(=O)O Amb17610576 [0,1,0,0,0,0|3,0,0]=4 1974 B8R0.29 CS(C)(=O)=NCC(=O)O Amb27159666 [0,1,0,0,0,0|2,0,0]=3 1975 B8R0.29 C[C@@H](N)CCC(C)(C)C Amb25780124 [0,1,0,0,0,0|2,0,1]=4 1976 B8R0.29 C[C@@H](N)CCC(C)(C)F Amb33272189 [0,1,0,0,0,0|2,0,1]=4 1977 B8R0.29 C[C@@H](N)CCP(C)(=O)Cl Amb28119076 [0,1,0,0,0,0|3,0,0]=4 1978 B8R0.29 C[C@@H](N)CCS(C)(=O)=O Amb33411441 [0,1,0,0,0,0|2,0,1]=4 1979 B8R0.29 C[C@@H](N)COS(=O)(=O)O Amb27598040 [0,1,0,0,0,0|3,0,0]=4 1980 B8R0.29 C[C@@H](O)CCC(C)(C)C Amb33380491 [0,1,0,0,0,0|1,0,1]=3 1981 B8R0.29 C[C@@H](O)CCC(C)(C)F Amb33272518 [0,1,0,0,0,0|1,0,1]=3 1982 B8R0.29 C[C@@H](O)CCC(C)(F)F Amb32809872 [0,1,0,0,0,0|2,0,1]=4 1983 B8R0.29 C[C@@H](O)CCS(C)(=O)=O Amb33055796 [0,1,0,0,0,0|2,0,1]=4 1984 B8R0.29 C[C@@H](O)COC(C)(C)C Amb19929334 [0,1,0,0,0,0|2,0,1]=4 1985 B8R0.29 C[C@H](N)CCC(C)(C)C Amb26868532 [0,1,0,0,0,0|2,0,1]=4 1986 B8R0.29 C[C@H](N)CCC(C)(C)F Amb33272194 [0,1,0,0,0,0|2,0,1]=4 1987 B8R0.29 C[C@H](N)CCS(C)(=O)=O Amb33481789 [0,1,0,0,0,0|2,0,1]=4 1988 B8R0.29 C[C@H](O)CCC(C)(C)C Amb33380503 [0,1,0,0,0,0|1,0,1]=3 1989 B8R0.29 C[C@H](O)CCC(C)(C)F Amb33272519 [0,1,0,0,0,0|1,0,1]=3 1990 B8R0.29 C[C@H](O)CCC(C)(F)F Amb32810129 [0,1,0,0,0,0|2,0,1]=4 1991 B8R0.29 C[C@H](O)CCS(C)(=O)=O Amb33055794 [0,1,0,0,0,0|2,0,1]=4 1992 B8R0.29 C[C@H](O)COC(C)(C)C Amb19929322 [0,1,0,0,0,0|2,0,1]=4 1993 B8R0.29 C[N+](C)(C)CCC(=O)O Amb24117222 [0,1,0,0,0,0|1,0,0]=2 1994 B8R0.29 C[N+](C)(C)CCC(=O)O Amb33803200 [0,1,0,0,0,0|1,0,0]=2 1995 B8R0.29 C[N+](C)(C)CCC(=O)[O-] Amb26420871 [0,1,0,0,0,0|1,0,1]=3 1996 B8R0.29 C[N+](C)(N)CCC(=O)O Amb27878681 [0,1,0,0,0,0|1,0,0]=2 1997 B8R0.29 C[Si](C)(C)C#CC(=O)O Amb2721672 [0,1,0,0,0,0|0,1,2]=4 1998 B8R0.29 C[Si](C)(C)CCB(O)O Amb27180564 [0,1,0,0,0,0|1,1,1]=4 1999 B8R0.29 C[Si](C)(C)CCC(=O)Cl Amb27187901 [0,1,0,0,0,0|1,1,0]=3 2000 B8R0.29 C[Si](C)(C)CNC(N)=O Amb19944636 [0,1,0,0,0,0|2,1,0]=4 2001 B8R0.29 NC(=O)CCC(Cl)(Cl)Cl Amb27424705 [0,1,0,0,0,0|3,0,0]=4 2002 B8R0.29 NC(=O)CCC(F)(F)F Amb2702583 [0,1,0,0,0,0|3,0,0]=4 2003 B8R0.29 NS(=O)(=O)CCC(=O)O Amb6741826 [0,1,0,0,0,0|3,0,0]=4 2004 B8R0.29 O=C(Br)CCC(F)(F)F Amb22360324 [0,1,0,0,0,0|3,0,0]=4 2005 B8R0.29 O=C(Cl)CCC(F)(F)F Amb19737369 [0,1,0,0,0,0|3,0,0]=4 2006 B8R0.29 O=C(O)CCC(Cl)(Cl)Cl Amb2725076 [0,1,0,0,0,0|2,0,0]=3 2007 B8R0.29 O=C(O)CCC(F)(F)Br Amb10838819 [0,1,0,0,0,0|2,0,0]=3 2008 B8R0.29 O=C(O)CCC(F)(F)Cl Amb27848419 [0,1,0,0,0,0|2,0,0]=3 2009 B8R0.29 O=C(O)CCC(F)(F)F Amb2778697 [0,1,0,0,0,0|2,0,0]=3 2010 B8R0.29 O=C(O)CCP(=O)(O)O Amb2228990 [0,1,0,0,0,0|3,0,0]=4 2011 B8R0.29 O=C(O)CCS(=O)(=O)O Amb17399954 [0,1,0,0,0,0|3,0,0]=4 2012 B8R0.29 O=C(O)CCS(=O)(=O)[O-] Amb28960294 [0,1,0,0,0,0|3,0,0]=4 2013 B8R0.29 O=C(O)COC(F)(F)F Amb9677564 [0,1,0,0,0,0|3,0,0]=4 2014 B8R0.29 O=C(O)CSC(F)(F)F Amb4443073 [0,1,0,0,0,0|3,0,0]=4 2015 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [0,0,0,1,0,0|1,0,2]=4 2016 B8R1.3 C=C1CCC(C)CC1 Amb24058250 [0,0,0,1,0,0|2,0,0]=3 2017 B8R1.3 C=C1CCC(C)NC1 Amb27626150 [0,0,0,1,0,0|3,0,0]=4 2018 B8R1.3 C=C1CCC(C)OC1 Amb30011003 [0,0,0,1,0,0|3,0,0]=4 2019 B8R1.3 C=C1CCC(C)SC1 Amb35611382 [0,0,0,1,0,0|3,0,0]=4 2020 B8R1.3 C=C1CCC(N)CC1 Amb23599023 [0,0,0,1,0,0|3,0,0]=4 2021 B8R1.3 C=C1CCC(N)CC1 Amb33537570 [0,0,0,1,0,0|3,0,0]=4 2022 B8R1.3 C=C1CCC(O)CC1 Amb27603595 [0,0,0,1,0,0|3,0,0]=4 2023 B8R1.3 C=C1CCN(C)CC1 Amb19514532 [0,0,0,1,0,0|3,0,0]=4 2024 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,0,0,1,0,0|1,0,2]=4 2025 B8R1.3 CC1=CCC(C)CC1 Amb26354597 [0,0,0,1,0,0|2,0,0]=3 2026 B8R1.3 CC1=CC[C@@H](N)CC1 Amb27493017 [0,0,0,1,0,0|3,0,0]=4 2027 B8R1.3 CC1=CC[C@H](N)CC1 Amb28365931 [0,0,0,1,0,0|3,0,0]=4 2028 B8R1.3 CC1=NCC(C)CN1 Amb29877830 [0,0,0,1,0,0|3,0,0]=4 2029 B8R1.3 CC1=NNC(=O)CC1 Amb2606146 [0,0,0,1,0,0|2,0,1]=4 2030 B8R1.3 CC1C=CC(=O)CC1 Amb24556470 [0,0,0,1,0,0|1,0,1]=3 2031 B8R1.3 CC1CC=C(Cl)CC1 Amb27783557 [0,0,0,1,0,0|2,0,0]=3 2032 B8R1.3 CC1CCC(=O)CC1 Amb6608654 [0,0,0,1,0,0|1,0,0]=2 2033 B8R1.3 CC1CCC(=O)CN1 Amb26979747 [0,0,0,1,0,0|2,0,0]=3 2034 B8R1.3 CC1CCC(=O)CN1 Amb32686523 [0,0,0,1,0,0|2,0,0]=3 2035 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,0,0,1,0,0|2,0,0]=3 2036 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,0,0,1,0,0|2,0,0]=3 2037 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,0,0,1,0,0|1,0,0]=2 2038 B8R1.3 CC1CCC(=O)NN1 Amb27443930 [0,0,0,1,0,0|2,0,0]=3 2039 B8R1.3 CC1CCC(=O)OC1 Amb27667524 [0,0,0,1,0,0|0,0,0]=1 2040 B8R1.3 CC1CCC(Br)CC1 Amb8968450 [0,0,0,1,0,0|2,0,1]=4 2041 B8R1.3 CC1CCC(C)CC1 Amb9787672 [0,0,0,1,0,0|2,0,1]=4 2042 B8R1.3 CC1CCC(C)NC1 Amb18641751 [0,0,0,1,0,0|2,0,1]=4 2043 B8R1.3 CC1CCC(C)NC1 Amb20623339 [0,0,0,1,0,0|2,0,1]=4 2044 B8R1.3 CC1CCC(Cl)CC1 Amb9205061 [0,0,0,1,0,0|2,0,1]=4 2045 B8R1.3 CC1CCC(I)CC1 Amb26023440 [0,0,0,1,0,0|2,0,1]=4 2046 B8R1.3 CC1CCC(N)CC1 Amb16236164 [0,0,0,1,0,0|2,0,1]=4 2047 B8R1.3 CC1CCC(N)CC1 Amb3939809 [0,0,0,1,0,0|2,0,1]=4 2048 B8R1.3 CC1CCC(N)CO1 Amb35709402 [0,0,0,1,0,0|2,0,1]=4 2049 B8R1.3 CC1CCC(O)CC1 Amb4605823 [0,0,0,1,0,0|1,0,1]=3 2050 B8R1.3 CC1CCC(O)CC1 Amb9787282 [0,0,0,1,0,0|1,0,1]=3 2051 B8R1.3 CC1CCC(O)CN1 Amb18641838 [0,0,0,1,0,0|2,0,1]=4 2052 B8R1.3 CC1CCC(O)CN1 Amb28934843 [0,0,0,1,0,0|2,0,1]=4 2053 B8R1.3 CC1CCC(O)CO1 Amb26381886 [0,0,0,1,0,0|2,0,1]=4 2054 B8R1.3 CC1CCC(O)OC1 Amb27835928 [0,0,0,1,0,0|0,0,2]=3 2055 B8R1.3 CC1CCC(S)CC1 Amb9208053 [0,0,0,1,0,0|1,1,1]=4 2056 B8R1.3 CC1CCC(S)CO1 Amb32788236 [0,0,0,1,0,0|2,0,1]=4 2057 B8R1.3 CC1CCN(N)CC1 Amb17231817 [0,0,0,1,0,0|3,0,0]=4 2058 B8R1.3 CC1CN=C(N)NC1 Amb24685625 [0,0,0,1,0,0|3,0,0]=4 2059 B8R1.3 CC1CN=C(N)NC1 Amb35747465 [0,0,0,1,0,0|3,0,0]=4 2060 B8R1.3 CC1CN=C(N)SC1 Amb25169567 [0,0,0,1,0,0|2,1,0]=4 2061 B8R1.3 CC1CN=C(O)NC1 Amb25268854 [0,0,0,1,0,0|2,0,0]=3 2062 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,0,0,1,0,0|2,0,0]=3 2063 B8R1.3 CC1CNC(=O)CN1 Amb34912937 [0,0,0,1,0,0|2,0,0]=3 2064 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,0,0,1,0,0|2,0,0]=3 2065 B8R1.3 CC1COC(C)CN1 Amb22751384 [0,0,0,1,0,0|2,0,1]=4 2066 B8R1.3 CC1COC(C)CN1 Amb6892608 [0,0,0,1,0,0|2,0,1]=4 2067 B8R1.3 CC1COC(C)CO1 Amb25738098 [0,0,0,1,0,0|2,0,1]=4 2068 B8R1.3 CC1COS(=O)OC1 Amb27785765 [0,0,0,1,0,0|2,0,0]=3 2069 B8R1.3 CC1OCC(=O)CO1 Amb28316125 [0,0,0,1,0,0|3,0,0]=4 2070 B8R1.3 CN1C=CC(=O)CC1 Amb17593148 [0,0,0,1,0,0|2,0,1]=4 2071 B8R1.3 CN1CC=C(Br)CC1 Amb22728686 [0,0,0,1,0,0|3,0,0]=4 2072 B8R1.3 CN1CC=C(I)CC1 Amb27879736 [0,0,0,1,0,0|3,0,0]=4 2073 B8R1.3 CN1CCC(=O)CC1 Amb2725656 [0,0,0,1,0,0|2,0,0]=3 2074 B8R1.3 CN1CCC(=S)CC1 Amb27830961 [0,0,0,1,0,0|2,1,0]=4 2075 B8R1.3 CN1CCC(O)CC1 Amb2720333 [0,0,0,1,0,0|2,0,1]=4 2076 B8R1.3 CN1CCC(O)CC1 Amb8387049 [0,0,0,1,0,0|2,0,1]=4 2077 B8R1.3 C[C@@H]1C=CC(=O)CC1 Amb28144188 [0,0,0,1,0,0|1,0,1]=3 2078 B8R1.3 C[C@@H]1CCC(=N)NC1 Amb27429397 [0,0,0,1,0,0|2,0,0]=3 2079 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,0,0,1,0,0|2,0,0]=3 2080 B8R1.3 C[C@@H]1CCC(=O)OC1 Amb26004046 [0,0,0,1,0,0|0,0,0]=1 2081 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb22886214 [0,0,0,1,0,0|2,0,1]=4 2082 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb25175824 [0,0,0,1,0,0|2,0,1]=4 2083 B8R1.3 C[C@@H]1CC[C@H](Br)CO1 Amb27656949 [0,0,0,1,0,0|2,0,1]=4 2084 B8R1.3 C[C@@H]1CC[C@H](Cl)CO1 Amb28076706 [0,0,0,1,0,0|2,0,1]=4 2085 B8R1.3 C[C@@H]1CC[C@H](O)CN1 Amb22886213 [0,0,0,1,0,0|2,0,1]=4 2086 B8R1.3 C[C@@H]1CC[C@H](O)CN1 Amb26440123 [0,0,0,1,0,0|2,0,1]=4 2087 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,0,0,1,0,0|2,0,0]=3 2088 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,0,0,1,0,0|2,0,0]=3 2089 B8R1.3 C[C@@H]1CNC(=O)CO1 Amb27470503 [0,0,0,1,0,0|2,0,0]=3 2090 B8R1.3 C[C@@H]1CO[C@H](C)CN1 Amb22745542 [0,0,0,1,0,0|2,0,1]=4 2091 B8R1.3 C[C@@H]1CO[C@H](C)CN1 Amb22747293 [0,0,0,1,0,0|2,0,1]=4 2092 B8R1.3 C[C@H]1C=C[C@@H](O)CC1 Amb27186928 [0,0,0,1,0,0|1,0,2]=4 2093 B8R1.3 C[C@H]1CCC(=O)NC1 Amb27838374 [0,0,0,1,0,0|1,0,0]=2 2094 B8R1.3 C[C@H]1CC[C@@H](C)CC1 Amb22230414 [0,0,0,1,0,0|2,0,1]=4 2095 B8R1.3 C[C@H]1CC[C@@H](N)CC1 Amb17617288 [0,0,0,1,0,0|2,0,1]=4 2096 B8R1.3 C[C@H]1CC[C@@H](N)CC1 Amb22747002 [0,0,0,1,0,0|2,0,1]=4 2097 B8R1.3 C[C@H]1CC[C@@H](O)CC1 Amb10844735 [0,0,0,1,0,0|1,0,1]=3 2098 B8R1.3 C[C@H]1CC[C@@H](O)CN1 Amb27420157 [0,0,0,1,0,0|2,0,1]=4 2099 B8R1.3 C[C@H]1CC[C@@H](O)CN1 Amb34140397 [0,0,0,1,0,0|2,0,1]=4 2100 B8R1.3 C[C@H]1CC[C@H](C)CC1 Amb4016290 [0,0,0,1,0,0|2,0,1]=4 2101 B8R1.3 C[C@H]1CC[C@H](C)NC1 Amb2695174 [0,0,0,1,0,0|2,0,1]=4 2102 B8R1.3 C[C@H]1CC[C@H](C)NC1 Amb33496156 [0,0,0,1,0,0|2,0,1]=4 2103 B8R1.3 C[C@H]1CC[C@H](N)CC1 Amb8391115 [0,0,0,1,0,0|2,0,1]=4 2104 B8R1.3 C[C@H]1CC[C@H](N)CC1 Amb8628495 [0,0,0,1,0,0|2,0,1]=4 2105 B8R1.3 C[C@H]1CC[C@H](O)CC1 Amb8513394 [0,0,0,1,0,0|1,0,1]=3 2106 B8R1.3 C[C@H]1CC[C@H](O)CN1 Amb24575263 [0,0,0,1,0,0|2,0,1]=4 2107 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,0,0,1,0,0|2,0,0]=3 2108 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,0,0,1,0,0|2,0,0]=3 2109 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,0,0,1,0,0|2,0,0]=3 2110 B8R1.3 C[C@H]1CN[C@H](C)CO1 Amb26023229 [0,0,0,1,0,0|2,0,1]=4 2111 B8R1.3 C[C@H]1CO[C@@H](C)CN1 Amb24087467 [0,0,0,1,0,0|2,0,1]=4 2112 B8R1.3 C[C@H]1CO[C@@H](C)CN1 Amb27881537 [0,0,0,1,0,0|2,0,1]=4 2113 B8R1.3 C[C@H]1CO[C@H](C)CN1 Amb22745541 [0,0,0,1,0,0|2,0,1]=4 2114 B8R1.3 NC1CCC(=O)CC1 Amb10067105 [0,0,0,1,0,0|2,0,0]=3 2115 B8R1.3 NC1CCC(=O)CC1 Amb21862513 [0,0,0,1,0,0|2,0,0]=3 2116 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [0,0,0,1,0,0|2,0,0]=3 2117 B8R1.3 NC1CCC(=O)NC1 Amb18833034 [0,0,0,1,0,0|2,0,0]=3 2118 B8R1.3 NC1CCC(O)CC1 Amb2684385 [0,0,0,1,0,0|2,0,1]=4 2119 B8R1.3 NC1CCC(O)CC1 Amb8627755 [0,0,0,1,0,0|2,0,1]=4 2120 B8R1.3 NC1CCS(=O)CC1 Amb18943776 [0,0,0,1,0,0|3,0,0]=4 2121 B8R1.3 NC1CCS(=O)CC1 Amb21988665 [0,0,0,1,0,0|3,0,0]=4 2122 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb2699221 [0,0,0,1,0,0|2,0,0]=3 2123 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb27432343 [0,0,0,1,0,0|2,0,0]=3 2124 B8R1.3 N[C@H]1CCC(=O)NC1 Amb22748949 [0,0,0,1,0,0|2,0,0]=3 2125 B8R1.3 N[C@H]1CCC(=O)NC1 Amb2699220 [0,0,0,1,0,0|2,0,0]=3 2126 B8R1.3 N[C@H]1CC[C@@H](O)CC1 Amb10071293 [0,0,0,1,0,0|2,0,1]=4 2127 B8R1.3 N[C@H]1CC[C@@H](O)CC1 Amb2684002 [0,0,0,1,0,0|2,0,1]=4 2128 B8R1.3 N[C@H]1CC[C@H](O)CC1 Amb2720456 [0,0,0,1,0,0|2,0,1]=4 2129 B8R1.3 N[C@H]1CC[C@H](O)CC1 Amb9825572 [0,0,0,1,0,0|2,0,1]=4 2130 B8R1.3 O=C1C=CC(O)CC1 Amb28048996 [0,0,0,1,0,0|2,0,1]=4 2131 B8R1.3 O=C1CCC(=O)CC1 Amb6471902 [0,0,0,1,0,0|2,0,1]=4 2132 B8R1.3 O=C1CCC(=O)NC1 Amb15692796 [0,0,0,1,0,0|2,0,1]=4 2133 B8R1.3 O=C1CCC(=O)OC1 Amb26404271 [0,0,0,1,0,0|1,0,1]=3 2134 B8R1.3 O=C1CCC(Br)CC1 Amb28342260 [0,0,0,1,0,0|2,0,0]=3 2135 B8R1.3 O=C1CCC(Cl)CC1 Amb26585218 [0,0,0,1,0,0|2,0,0]=3 2136 B8R1.3 O=C1CCC(F)CC1 Amb20671078 [0,0,0,1,0,0|2,0,0]=3 2137 B8R1.3 O=C1CCC(I)CC1 Amb27232393 [0,0,0,1,0,0|2,0,0]=3 2138 B8R1.3 O=C1CCC(O)CC1 Amb2699831 [0,0,0,1,0,0|2,0,0]=3 2139 B8R1.3 O=C1CCC(O)CN1 Amb10066907 [0,0,0,1,0,0|2,0,0]=3 2140 B8R1.3 O=C1CCC(O)CO1 Amb26345105 [0,0,0,1,0,0|1,0,0]=2 2141 B8R1.3 O=C1CCN(Cl)CC1 Amb27430526 [0,0,0,1,0,0|3,0,0]=4 2142 B8R1.3 O=C1CCS(=O)CC1 Amb2612398 [0,0,0,1,0,0|3,0,0]=4 2143 B8R1.3 O=C1CC[C@@H](O)CN1 Amb2698033 [0,0,0,1,0,0|2,0,0]=3 2144 B8R1.3 O=C1CC[C@H](O)CN1 Amb2698032 [0,0,0,1,0,0|2,0,0]=3 2145 B8R1.3 O=C1COC(=O)CN1 Amb2612815 [0,0,0,1,0,0|2,0,1]=4 2146 B8R1.3 O=C1COC(=O)CO1 Amb2725557 [0,0,0,1,0,0|2,0,1]=4 2147 B8R1.3 O=C1NCC(O)CN1 Amb19516674 [0,0,0,1,0,0|3,0,0]=4 2148 B8R1.3 O=C1NCC(O)CO1 Amb27210928 [0,0,0,1,0,0|2,0,0]=3 2149 B8R1.3 O=S1CCC(Cl)CC1 Amb21988466 [0,0,0,1,0,0|3,0,0]=4 2150 B8R1.3 O=S1CCC(O)CC1 Amb21988465 [0,0,0,1,0,0|3,0,0]=4 2151 B8R1.3 O=S1CCC(S)CC1 Amb32788878 [0,0,0,1,0,0|3,0,0]=4 2152 B8R1.3 OC1=NCC(O)CN1 Amb20001781 [0,0,0,1,0,0|3,0,0]=4 2153 B8R1.3 OC1CCC(Br)CC1 Amb24117124 [0,0,0,1,0,0|2,0,1]=4 2154 B8R1.3 OC1CCC(Cl)CC1 Amb2720844 [0,0,0,1,0,0|2,0,1]=4 2155 B8R1.3 OC1CCC(Cl)CO1 Amb27232820 [0,0,0,1,0,0|1,0,2]=4 2156 B8R1.3 OC1CCC(F)CC1 Amb25698698 [0,0,0,1,0,0|2,0,1]=4 2157 B8R1.3 OC1CCC(O)CC1 Amb2778648 [0,0,0,1,0,0|2,0,1]=4 2158 B8R1.3 OC1CCC(O)OC1 Amb28349930 [0,0,0,1,0,0|1,0,2]=4 2159 B8R1.3 OC1CCC(O)SC1 Amb27472799 [0,0,0,1,0,0|1,1,1]=4 2160 B8R1.3 OC1CCC(S)CC1 Amb27197599 [0,0,0,1,0,0|2,0,1]=4 2161 B8R1.3 O[C@H]1CC[C@@H](F)CC1 Amb25341995 [0,0,0,1,0,0|2,0,1]=4 2162 B8R1.3 O[C@H]1CC[C@@H](O)CC1 Amb33524036 [0,0,0,1,0,0|2,0,1]=4 2163 B8R1.3 O[C@H]1CC[C@H](Cl)CC1 Amb27232988 [0,0,0,1,0,0|2,0,1]=4 2164 B8R1.3 O[C@H]1CC[C@H](O)CC1 Amb22750651 [0,0,0,1,0,0|2,0,1]=4 2165 B8R1.3 O[C@H]1CC[C@H](S)CC1 Amb33524237 [0,0,0,1,0,0|2,0,1]=4 2166 B8R1.20 C=C1CC1CC(=O)O Amb25870954 [0,0,0,1,0,0|0,0,2]=3 2167 B8R1.20 C=C1CC1CC(C)=O Amb28326031 [0,0,0,1,0,0|1,0,2]=4 2168 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,0,0,1,0,0|1,0,2]=4 2169 B8R1.20 CC(=O)CC1CC1C Amb26916692 [0,0,0,1,0,0|1,0,0]=2 2170 B8R1.20 CC(=O)CC1OC1C Amb27767850 [0,0,0,1,0,0|2,0,0]=3 2171 B8R1.20 CC(=O)C[C@H]1C[C@H]1C Amb28121459 [0,0,0,1,0,0|1,0,0]=2 2172 B8R1.20 CC(=O)NC1CC1N Amb32663550 [0,0,0,1,0,0|3,0,0]=4 2173 B8R1.20 CC(=O)NC1CC1N Amb9457357 [0,0,0,1,0,0|3,0,0]=4 2174 B8R1.20 CC(=O)N[C@@H]1C[C@H]1N Amb32664511 [0,0,0,1,0,0|3,0,0]=4 2175 B8R1.20 CC(=O)N[C@@H]1C[C@H]1N Amb32664512 [0,0,0,1,0,0|3,0,0]=4 2176 B8R1.20 CC(Br)CC1CC1C Amb33433867 [0,0,0,1,0,0|2,0,1]=4 2177 B8R1.20 CC(C)CC1CC1N Amb18285795 [0,0,0,1,0,0|2,0,1]=4 2178 B8R1.20 CC(C)CC1CC1N Amb32661702 [0,0,0,1,0,0|2,0,1]=4 2179 B8R1.20 CC(C)CC1CC1O Amb27625280 [0,0,0,1,0,0|1,0,1]=3 2180 B8R1.20 CC(C)C[C@@H]1C[C@H]1N Amb25964927 [0,0,0,1,0,0|2,0,1]=4 2181 B8R1.20 CC(C)C[C@@H]1C[C@H]1N Amb28736198 [0,0,0,1,0,0|2,0,1]=4 2182 B8R1.20 CC(O)CC1CC1C Amb28284530 [0,0,0,1,0,0|1,0,1]=3 2183 B8R1.20 CC(O)CC1OC1C Amb27763687 [0,0,0,1,0,0|2,0,1]=4 2184 B8R1.20 CC(O)C[C@@H]1C[C@H]1C Amb27456742 [0,0,0,1,0,0|1,0,1]=3 2185 B8R1.20 CC(O)C[C@@H]1O[C@@H]1C Amb27852494 [0,0,0,1,0,0|2,0,1]=4 2186 B8R1.20 CC(O)C[C@@H]1O[C@H]1C Amb28197530 [0,0,0,1,0,0|2,0,1]=4 2187 B8R1.20 CC(O)C[C@H]1O[C@H]1C Amb27220288 [0,0,0,1,0,0|2,0,1]=4 2188 B8R1.20 CC1CC1CC(=N)N Amb33144831 [0,0,0,1,0,0|2,0,0]=3 2189 B8R1.20 CC1CC1CC(=O)O Amb25316515 [0,0,0,1,0,0|0,0,0]=1 2190 B8R1.20 CC1CC1CC(N)=S Amb33144881 [0,0,0,1,0,0|1,1,0]=3 2191 B8R1.20 CC1CC1CN(C)O Amb33145039 [0,0,0,1,0,0|2,0,0]=3 2192 B8R1.20 CC1CC1C[C@@H](C)N Amb33144899 [0,0,0,1,0,0|2,0,1]=4 2193 B8R1.20 CC1CC1C[C@@H](C)O Amb33144240 [0,0,0,1,0,0|1,0,1]=3 2194 B8R1.20 CC1CC1C[C@H](C)N Amb33144898 [0,0,0,1,0,0|2,0,1]=4 2195 B8R1.20 CC1CC1C[C@H](C)O Amb33144242 [0,0,0,1,0,0|1,0,1]=3 2196 B8R1.20 CC1CC1C[N+](=O)[O-] Amb33144229 [0,0,0,1,0,0|1,0,1]=3 2197 B8R1.20 CC1CC1NC(=O)Cl Amb35625773 [0,0,0,1,0,0|2,0,0]=3 2198 B8R1.20 CC1CC1NC(N)=S Amb25361754 [0,0,0,1,0,0|2,1,0]=4 2199 B8R1.20 CC1C\C1=C/C(=O)O Amb25256441 [0,0,0,1,0,0|0,0,2]=3 2200 B8R1.20 C[C@@H]1C[C@H]1CB(O)O Amb27448502 [0,0,0,1,0,0|1,0,1]=3 2201 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [0,0,0,1,0,0|0,0,0]=1 2202 B8R1.20 C[C@@H]1C[C@H]1NC(N)=O Amb28059830 [0,0,0,1,0,0|2,0,0]=3 2203 B8R1.20 NC1CC1CC(=O)O Amb27201670 [0,0,0,1,0,0|1,0,0]=2 2204 B8R1.20 N[C@@H]1C[C@H]1CC(=O)O Amb27252154 [0,0,0,1,0,0|1,0,0]=2 2205 B8R1.20 O=C(O)CC1CC1O Amb27981662 [0,0,0,1,0,0|1,0,0]=2 2206 B8R1.23 C=C(C)C1CC(=O)N1 Amb27858929 [0,0,0,1,0,0|1,0,2]=4 2207 B8R1.23 C=C(C)[C@@H]1CC(=O)N1 Amb28251769 [0,0,0,1,0,0|1,0,2]=4 2208 B8R1.23 C=C1CC(C(=O)Cl)C1 Amb10071441 [0,0,0,1,0,0|1,0,2]=4 2209 B8R1.23 C=C1CC(C(=O)O)C1 Amb613197 [0,0,0,1,0,0|0,0,2]=3 2210 B8R1.23 C=C1CC(C(C)=O)C1 Amb26547728 [0,0,0,1,0,0|1,0,2]=4 2211 B8R1.23 C=C1CC(C(N)=O)C1 Amb22896664 [0,0,0,1,0,0|1,0,2]=4 2212 B8R1.23 CC(=N)N1CC(C)C1 Amb30023408 [0,0,0,1,0,0|3,0,0]=4 2213 B8R1.23 CC(=O)C1=CC(C)C1 Amb27802162 [0,0,0,1,0,0|1,0,2]=4 2214 B8R1.23 CC(=O)C1C=C(C)C1 Amb24676939 [0,0,0,1,0,0|1,0,2]=4 2215 B8R1.23 CC(=O)C1CC(=N)C1 Amb27636166 [0,0,0,1,0,0|2,0,1]=4 2216 B8R1.23 CC(=O)C1CC(C)C1 Amb23590280 [0,0,0,1,0,0|1,0,0]=2 2217 B8R1.23 CC(=O)C1CC(N)C1 Amb29880102 [0,0,0,1,0,0|2,0,0]=3 2218 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,0,0,1,0,0|2,0,0]=3 2219 B8R1.23 CC(=O)N1CC(N)C1 Amb19329932 [0,0,0,1,0,0|3,0,0]=4 2220 B8R1.23 CC(=O)N1CC(N)C1 Amb22406088 [0,0,0,1,0,0|3,0,0]=4 2221 B8R1.23 CC(=O)N1CC(N)C1 Amb33339040 [0,0,0,1,0,0|3,0,0]=4 2222 B8R1.23 CC(=O)N1CC(O)C1 Amb17935746 [0,0,0,1,0,0|3,0,0]=4 2223 B8R1.23 CC(=O)N1CC(S)C1 Amb27433776 [0,0,0,1,0,0|3,0,0]=4 2224 B8R1.23 CC(=O)[C@H]1C[C@@H](C)C1 Amb28253646 [0,0,0,1,0,0|1,0,0]=2 2225 B8R1.23 CC(C)C1=CC(=O)C1 Amb27948687 [0,0,0,1,0,0|1,0,1]=3 2226 B8R1.23 CC(C)C1CC(=O)C1 Amb25806486 [0,0,0,1,0,0|1,0,0]=2 2227 B8R1.23 CC(C)C1CC(=O)N1 Amb26450589 [0,0,0,1,0,0|1,0,0]=2 2228 B8R1.23 CC(C)C1CC(Br)C1 Amb28248812 [0,0,0,1,0,0|2,0,1]=4 2229 B8R1.23 CC(C)C1CC(Cl)C1 Amb27391569 [0,0,0,1,0,0|2,0,1]=4 2230 B8R1.23 CC(C)C1CC(N)C1 Amb33532837 [0,0,0,1,0,0|2,0,1]=4 2231 B8R1.23 CC(C)C1CC(N)C1 Amb35752862 [0,0,0,1,0,0|2,0,1]=4 2232 B8R1.23 CC(C)C1CC(S)C1 Amb27242962 [0,0,0,1,0,0|1,1,1]=4 2233 B8R1.23 CC(C)C1CN(N)C1 Amb27869424 [0,0,0,1,0,0|3,0,0]=4 2234 B8R1.23 CC(C)N1CC(O)C1 Amb19516900 [0,0,0,1,0,0|2,0,1]=4 2235 B8R1.23 CC(C)N1CC(O)C1 Amb4014463 [0,0,0,1,0,0|2,0,1]=4 2236 B8R1.23 CC(C)[C@@H]1CC(=O)N1 Amb28363876 [0,0,0,1,0,0|1,0,0]=2 2237 B8R1.23 CC(C)[C@H]1C[C@@H](O)C1 Amb27946929 [0,0,0,1,0,0|1,0,1]=3 2238 B8R1.23 CC(Cl)C1CC(=O)O1 Amb27878702 [0,0,0,1,0,0|1,0,0]=2 2239 B8R1.23 CC(F)C1CC(=O)C1 Amb34159489 [0,0,0,1,0,0|2,0,0]=3 2240 B8R1.23 CC(N)C1CC(O)C1 Amb34164942 [0,0,0,1,0,0|2,0,1]=4 2241 B8R1.23 CC(O)C1CC(=O)C1 Amb34159488 [0,0,0,1,0,0|2,0,0]=3 2242 B8R1.23 CC(O)C1CC(N)C1 Amb35625271 [0,0,0,1,0,0|2,0,1]=4 2243 B8R1.23 CC(O)C1CN(C)C1 Amb21960300 [0,0,0,1,0,0|2,0,1]=4 2244 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [0,0,0,1,0,0|0,0,0]=1 2245 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [0,0,0,1,0,0|1,0,0]=2 2246 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [0,0,0,1,0,0|1,0,0]=2 2247 B8R1.23 CC1CC(C(C)N)C1 Amb27218204 [0,0,0,1,0,0|2,0,1]=4 2248 B8R1.23 CC1CC(C(C)O)C1 Amb23590278 [0,0,0,1,0,0|1,0,1]=3 2249 B8R1.23 CC1CC(C(C)O)O1 Amb28125884 [0,0,0,1,0,0|2,0,1]=4 2250 B8R1.23 CC1CC(C(N)=O)C1 Amb27954948 [0,0,0,1,0,0|1,0,0]=2 2251 B8R1.23 CC1CN(C(=N)N)C1 Amb35667760 [0,0,0,1,0,0|3,0,0]=4 2252 B8R1.23 CC1CN(C(=O)Cl)C1 Amb35667757 [0,0,0,1,0,0|2,0,0]=3 2253 B8R1.23 CC1CN(C(N)=O)C1 Amb30039472 [0,0,0,1,0,0|2,0,0]=3 2254 B8R1.23 CC1CN(C(N)=S)C1 Amb35607400 [0,0,0,1,0,0|2,1,0]=4 2255 B8R1.23 CC1C[C@H]([C@H](C)O)O1 Amb27775507 [0,0,0,1,0,0|2,0,1]=4 2256 B8R1.23 CN(C)C1CC(=O)C1 Amb34159682 [0,0,0,1,0,0|2,0,0]=3 2257 B8R1.23 CN(C)C1CC(O)C1 Amb26612733 [0,0,0,1,0,0|2,0,1]=4 2258 B8R1.23 CN(C)C1CC(O)C1 Amb32410247 [0,0,0,1,0,0|2,0,1]=4 2259 B8R1.23 CN(C)[C@H]1C[C@@H](O)C1 Amb26069569 [0,0,0,1,0,0|2,0,1]=4 2260 B8R1.23 CN(C)[C@H]1C[C@@H](O)C1 Amb32653404 [0,0,0,1,0,0|2,0,1]=4 2261 B8R1.23 CN(C)[C@H]1C[C@H](O)C1 Amb27950158 [0,0,0,1,0,0|2,0,1]=4 2262 B8R1.23 CN(C)[C@H]1C[C@H](O)C1 Amb33204495 [0,0,0,1,0,0|2,0,1]=4 2263 B8R1.23 CN1CC(C(=O)Cl)C1 Amb35781982 [0,0,0,1,0,0|2,0,0]=3 2264 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [0,0,0,1,0,0|1,0,0]=2 2265 B8R1.23 C[C@@H](N)C1CC(O)C1 Amb34912829 [0,0,0,1,0,0|2,0,1]=4 2266 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [0,0,0,1,0,0|1,0,0]=2 2267 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [0,0,0,1,0,0|1,0,0]=2 2268 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [0,0,0,1,0,0|1,0,0]=2 2269 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [0,0,0,1,0,0|1,0,0]=2 2270 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [0,0,0,1,0,0|0,0,0]=1 2271 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [0,0,0,1,0,0|0,0,0]=1 2272 B8R1.23 N=C(N)C1CC(F)C1 Amb26358514 [0,0,0,1,0,0|3,0,0]=4 2273 B8R1.23 NC(=O)C1CC(Cl)C1 Amb27424316 [0,0,0,1,0,0|2,0,0]=3 2274 B8R1.23 NC(=O)C1CC(F)C1 Amb27946575 [0,0,0,1,0,0|2,0,0]=3 2275 B8R1.23 NC(=O)C1CC(N)C1 Amb20622654 [0,0,0,1,0,0|2,0,0]=3 2276 B8R1.23 NC(=O)C1CC(N)C1 Amb32664988 [0,0,0,1,0,0|2,0,0]=3 2277 B8R1.23 NC(=O)N1CC(N)C1 Amb27632971 [0,0,0,1,0,0|3,0,0]=4 2278 B8R1.23 NC(=O)N1CC(N)C1 Amb33483188 [0,0,0,1,0,0|3,0,0]=4 2279 B8R1.23 NC(=O)N1CC(O)C1 Amb28068660 [0,0,0,1,0,0|3,0,0]=4 2280 B8R1.23 NC(=O)[C@H]1C[C@@H](Cl)C1 Amb27882303 [0,0,0,1,0,0|2,0,0]=3 2281 B8R1.23 NC(=O)[C@H]1C[C@@H](N)C1 Amb22896793 [0,0,0,1,0,0|2,0,0]=3 2282 B8R1.23 NC(=O)[C@H]1C[C@@H](N)C1 Amb32664685 [0,0,0,1,0,0|2,0,0]=3 2283 B8R1.23 NC(=O)[C@H]1C[C@H](Cl)C1 Amb27882281 [0,0,0,1,0,0|2,0,0]=3 2284 B8R1.23 NC(=O)[C@H]1C[C@H](N)C1 Amb22896794 [0,0,0,1,0,0|2,0,0]=3 2285 B8R1.23 NC(=O)[C@H]1C[C@H](N)C1 Amb32668185 [0,0,0,1,0,0|2,0,0]=3 2286 B8R1.23 NC(=S)[C@H]1C[C@H](Cl)C1 Amb35789073 [0,0,0,1,0,0|2,1,0]=4 2287 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [0,0,0,1,0,0|1,0,0]=2 2288 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [0,0,0,1,0,0|1,0,0]=2 2289 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [0,0,0,1,0,0|1,0,0]=2 2290 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [0,0,0,1,0,0|1,0,0]=2 2291 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [0,0,0,1,0,0|1,0,0]=2 2292 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [0,0,0,1,0,0|1,0,0]=2 2293 B8R1.23 O=C(Cl)C1CC(Cl)C1 Amb24739809 [0,0,0,1,0,0|2,0,0]=3 2294 B8R1.23 O=C(Cl)C1CC(F)C1 Amb28049013 [0,0,0,1,0,0|2,0,0]=3 2295 B8R1.23 O=C(Cl)N1CC(F)C1 Amb33803382 [0,0,0,1,0,0|3,0,0]=4 2296 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [0,0,0,1,0,0|1,0,0]=2 2297 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [0,0,0,1,0,0|1,0,0]=2 2298 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [0,0,0,1,0,0|1,0,0]=2 2299 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [0,0,0,1,0,0|1,0,0]=2 2300 B8R1.23 O=C(O)C1CS(=O)C1 Amb26056015 [0,0,0,1,0,0|2,0,0]=3 2301 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [0,0,0,1,0,0|1,0,0]=2 2302 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [0,0,0,1,0,0|1,0,0]=2 2303 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [0,0,0,1,0,0|1,0,0]=2 2304 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [0,0,0,1,0,0|1,0,0]=2 2305 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [0,0,0,1,0,0|1,0,0]=2 2306 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [0,0,0,1,0,0|1,0,0]=2 2307 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [0,0,0,1,0,0|1,0,0]=2 2308 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [0,0,0,1,0,0|1,0,0]=2 2309 B8R1.23 O=C1CC(C(=O)Cl)C1 Amb16230813 [0,0,0,1,0,0|2,0,1]=4 2310 B8R1.23 O=C1CC(C(=O)O)C1 Amb33544325 [0,0,0,1,0,0|1,0,1]=3 2311 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [0,0,0,1,0,0|2,0,1]=4 2312 B8R1.23 O=C1CC(C(=O)O)O1 Amb26887454 [0,0,0,1,0,0|2,0,1]=4 2313 B8R1.23 O=C1CC(C(Cl)Cl)O1 Amb27952844 [0,0,0,1,0,0|2,0,0]=3 2314 B8R1.23 O=C1CC(C(F)F)C1 Amb27805522 [0,0,0,1,0,0|3,0,0]=4 2315 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [0,0,0,1,0,0|2,0,1]=4 2316 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [0,0,0,1,0,0|2,0,1]=4 2317 B8R1.35 C=C(Br)CNC1CC1 Amb18969560 [0,0,0,1,0,0|3,0,0]=4 2318 B8R1.35 C=C(C)CNC1CC1 Amb17317871 [0,0,0,1,0,0|3,0,0]=4 2319 B8R1.35 C=C(Cl)CNC1CC1 Amb18969181 [0,0,0,1,0,0|3,0,0]=4 2320 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [0,0,0,1,0,0|1,0,0]=2 2321 B8R1.35 CC(=O)CCC1CO1 Amb28388031 [0,0,0,1,0,0|2,0,0]=3 2322 B8R1.35 CC(=O)CNC1CC1 Amb27831542 [0,0,0,1,0,0|2,0,0]=3 2323 B8R1.35 CC(=O)NCC1CC1 Amb2782861 [0,0,0,1,0,0|2,0,0]=3 2324 B8R1.35 CC(=O)NCC1CO1 Amb23557281 [0,0,0,1,0,0|3,0,0]=4 2325 B8R1.35 CC(=O)NC[C@@H]1CO1 Amb27871512 [0,0,0,1,0,0|3,0,0]=4 2326 B8R1.35 CC(=O)NC[C@H]1CO1 Amb25068125 [0,0,0,1,0,0|3,0,0]=4 2327 B8R1.35 CC(=O)OCC1CO1 Amb10789133 [0,0,0,1,0,0|3,0,0]=4 2328 B8R1.35 CC(=O)OC[C@@H]1CO1 Amb27391694 [0,0,0,1,0,0|3,0,0]=4 2329 B8R1.35 CC(=O)\C=C\C1CC1 Amb32955627 [0,0,0,1,0,0|1,0,2]=4 2330 B8R1.35 CC(Br)CCC1CC1 Amb25067290 [0,0,0,1,0,0|2,0,1]=4 2331 B8R1.35 CC(C)CCC1CO1 Amb26899468 [0,0,0,1,0,0|1,0,1]=3 2332 B8R1.35 CC(C)NC[C@@H]1CO1 Amb27838969 [0,0,0,1,0,0|2,0,1]=4 2333 B8R1.35 CC(C)OCC1CO1 Amb9720529 [0,0,0,1,0,0|2,0,1]=4 2334 B8R1.35 CC(C)OC[C@@H]1CO1 Amb26933797 [0,0,0,1,0,0|2,0,1]=4 2335 B8R1.35 CC(C)OC[C@H]1CO1 Amb24641497 [0,0,0,1,0,0|2,0,1]=4 2336 B8R1.35 CC(C)SC[C@@H]1CO1 Amb27852374 [0,0,0,1,0,0|2,0,1]=4 2337 B8R1.35 CC(C)SC[C@H]1CO1 Amb27833655 [0,0,0,1,0,0|2,0,1]=4 2338 B8R1.35 CC(N)CCC1CC1 Amb18203368 [0,0,0,1,0,0|2,0,1]=4 2339 B8R1.35 CC(O)CCC1CC1 Amb25733792 [0,0,0,1,0,0|1,0,1]=3 2340 B8R1.35 CC(O)CNC1CC1 Amb17138364 [0,0,0,1,0,0|2,0,1]=4 2341 B8R1.35 CN(C)CCC1CO1 Amb24482563 [0,0,0,1,0,0|2,0,1]=4 2342 B8R1.35 CN(C)CC[C@@H]1CO1 Amb33271611 [0,0,0,1,0,0|2,0,1]=4 2343 B8R1.35 CN(C)CC[C@H]1CO1 Amb33271612 [0,0,0,1,0,0|2,0,1]=4 2344 B8R1.35 CN(O)CCC1CC1 Amb33361504 [0,0,0,1,0,0|2,0,0]=3 2345 B8R1.35 CS(=O)CCC1CO1 Amb27837563 [0,0,0,1,0,0|3,0,0]=4 2346 B8R1.35 C[C@@H](N)CCC1CC1 Amb25745640 [0,0,0,1,0,0|2,0,1]=4 2347 B8R1.35 C[C@@H](O)CCC1CC1 Amb24693085 [0,0,0,1,0,0|1,0,1]=3 2348 B8R1.35 C[C@@H](O)CNC1CC1 Amb25083354 [0,0,0,1,0,0|2,0,1]=4 2349 B8R1.35 C[C@H](N)CCC1CC1 Amb26075601 [0,0,0,1,0,0|2,0,1]=4 2350 B8R1.35 C[C@H](O)CCC1CC1 Amb25025020 [0,0,0,1,0,0|1,0,1]=3 2351 B8R1.35 C[C@H](O)CNC1CC1 Amb25694355 [0,0,0,1,0,0|2,0,1]=4 2352 B8R1.35 N=C(N)CCC1CC1 Amb26607260 [0,0,0,1,0,0|2,0,0]=3 2353 B8R1.35 N=C(N)NCC1CC1 Amb19748557 [0,0,0,1,0,0|3,0,0]=4 2354 B8R1.35 N=C(N)OCC1CC1 Amb27430108 [0,0,0,1,0,0|3,0,0]=4 2355 B8R1.35 N=C(N)SCC1CC1 Amb24364813 [0,0,0,1,0,0|3,0,0]=4 2356 B8R1.35 N=C(N)SCC1CC1 Amb3428823 [0,0,0,1,0,0|3,0,0]=4 2357 B8R1.35 NC(=O)CCC1CC1 Amb28066625 [0,0,0,1,0,0|1,0,0]=2 2358 B8R1.35 NC(=O)CCC1CO1 Amb28252693 [0,0,0,1,0,0|2,0,0]=3 2359 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,0,0,1,0,0|2,0,0]=3 2360 B8R1.35 NC(=O)CNC1CC1 Amb6246049 [0,0,0,1,0,0|2,0,0]=3 2361 B8R1.35 NC(=O)NCC1CC1 Amb1138798 [0,0,0,1,0,0|2,0,0]=3 2362 B8R1.35 NC(=O)OCC1CC1 Amb27668381 [0,0,0,1,0,0|2,0,0]=3 2363 B8R1.35 NC(=O)\C=C/C1CC1 Amb27422387 [0,0,0,1,0,0|1,0,2]=4 2364 B8R1.35 NC(=S)CCC1CC1 Amb24483097 [0,0,0,1,0,0|1,1,0]=3 2365 B8R1.35 NC(=S)NCC1CC1 Amb2725385 [0,0,0,1,0,0|2,1,0]=4 2366 B8R1.35 NS(=O)CCC1CC1 Amb32720477 [0,0,0,1,0,0|2,0,0]=3 2367 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [0,0,0,1,0,0|1,0,0]=2 2368 B8R1.35 O=C(Cl)NCC1CC1 Amb27410108 [0,0,0,1,0,0|2,0,0]=3 2369 B8R1.35 O=C(Cl)OCC1CC1 Amb33528888 [0,0,0,1,0,0|2,0,0]=3 2370 B8R1.35 O=C(O)C#CC1CC1 Amb1036650 [0,0,0,1,0,0|0,0,2]=3 2371 B8R1.35 O=C(O)CCC1=CC1 Amb28364765 [0,0,0,1,0,0|0,0,2]=3 2372 B8R1.35 O=C(O)CCC1CC1 Amb2686667 [0,0,0,1,0,0|0,0,0]=1 2373 B8R1.35 O=C(O)CCC1CO1 Amb27667995 [0,0,0,1,0,0|1,0,0]=2 2374 B8R1.35 O=C(O)CNC1CC1 Amb7766401 [0,0,0,1,0,0|1,0,0]=2 2375 B8R1.35 O=C(O)CNC1CC1 Amb9677481 [0,0,0,1,0,0|1,0,0]=2 2376 B8R1.35 O=C(O)COC1CC1 Amb27214838 [0,0,0,1,0,0|1,0,0]=2 2377 B8R1.35 O=C(O)CSC1CC1 Amb6760620 [0,0,0,1,0,0|1,0,0]=2 2378 B8R1.35 O=C(O)\C=C/C1CC1 Amb28247513 [0,0,0,1,0,0|0,0,2]=3 2379 B8R1.35 O=C(O)\C=C\C1CC1 Amb18285135 [0,0,0,1,0,0|0,0,2]=3 2380 B8R1.35 O=C(O)\C=C\C1CC1 Amb33714766 [0,0,0,1,0,0|0,0,2]=3 2381 B8R1.35 O=C(O)\C=C\C1CO1 Amb24548089 [0,0,0,1,0,0|1,0,2]=4 2382 B8R1.35 O=S(Cl)CCC1CC1 Amb26910502 [0,0,0,1,0,0|2,0,0]=3 2383 B8R1.35 O=S([O-])CCC1CC1 Amb25212503 [0,0,0,1,0,0|1,0,1]=3 2384 B8R1.35 O=[N+]([O-])CCC1CC1 Amb33429105 [0,0,0,1,0,0|1,0,1]=3 2385 B8R1.35 OB(O)CCC1CC1 Amb26515786 [0,0,0,1,0,0|1,0,1]=3 2386 B8R1.51 C=C1CCC(C)(C)C1 Amb27471090 [0,0,0,1,0,0|2,0,0]=3 2387 B8R1.51 C=C1COC(C)(C)C1 Amb27216431 [0,0,0,1,0,0|3,0,0]=4 2388 B8R1.51 CC1(C)C=CC(=O)C1 Amb15693471 [0,0,0,1,0,0|1,0,2]=4 2389 B8R1.51 CC1(C)CC(=O)CN1 Amb24460323 [0,0,0,1,0,0|2,0,0]=3 2390 B8R1.51 CC1(C)CC(=O)CN1 Amb32693438 [0,0,0,1,0,0|2,0,0]=3 2391 B8R1.51 CC1(C)CC(=O)CO1 Amb24083194 [0,0,0,1,0,0|2,0,0]=3 2392 B8R1.51 CC1(C)CC(=O)NN1 Amb22289371 [0,0,0,1,0,0|3,0,0]=4 2393 B8R1.51 CC1(C)CC(=O)NO1 Amb26895186 [0,0,0,1,0,0|3,0,0]=4 2394 B8R1.51 CC1(C)CC(O)CN1 Amb25722225 [0,0,0,1,0,0|2,0,1]=4 2395 B8R1.51 CC1(C)CC(O)CO1 Amb25296086 [0,0,0,1,0,0|2,0,1]=4 2396 B8R1.51 CC1(C)CC=C(Br)C1 Amb28315141 [0,0,0,1,0,0|2,0,1]=4 2397 B8R1.51 CC1(C)CCC(=N)N1 Amb25733497 [0,0,0,1,0,0|2,0,0]=3 2398 B8R1.51 CC1(C)CCC(=N)N1 Amb32662918 [0,0,0,1,0,0|2,0,0]=3 2399 B8R1.51 CC1(C)CCC(=O)C1 Amb19516867 [0,0,0,1,0,0|1,0,0]=2 2400 B8R1.51 CC1(C)CCC(=O)N1 Amb9173662 [0,0,0,1,0,0|1,0,0]=2 2401 B8R1.51 CC1(C)CCC(=O)O1 Amb8631207 [0,0,0,1,0,0|0,0,0]=1 2402 B8R1.51 CC1(C)CCC(Br)C1 Amb33551115 [0,0,0,1,0,0|2,0,1]=4 2403 B8R1.51 CC1(C)CCC(N)C1 Amb22740161 [0,0,0,1,0,0|2,0,1]=4 2404 B8R1.51 CC1(C)CCC(N)C1 Amb24460775 [0,0,0,1,0,0|2,0,1]=4 2405 B8R1.51 CC1(C)CCC(O)C1 Amb22549345 [0,0,0,1,0,0|1,0,1]=3 2406 B8R1.51 CC1(C)CCC(O)O1 Amb26962652 [0,0,0,1,0,0|0,0,2]=3 2407 B8R1.51 CC1(C)CCC(S)C1 Amb26871880 [0,0,0,1,0,0|1,1,1]=4 2408 B8R1.51 CC1(C)CN=C(N)N1 Amb24454073 [0,0,0,1,0,0|3,0,0]=4 2409 B8R1.51 CC1(C)CN=C(N)N1 Amb33338744 [0,0,0,1,0,0|3,0,0]=4 2410 B8R1.51 CC1(C)CN=C(N)O1 Amb25720624 [0,0,0,1,0,0|2,0,0]=3 2411 B8R1.51 CC1(C)CNC(=O)C1 Amb6752004 [0,0,0,1,0,0|2,0,0]=3 2412 B8R1.51 CC1(C)CNC(=O)N1 Amb4022598 [0,0,0,1,0,0|2,0,0]=3 2413 B8R1.51 CC1(C)CNC(=O)O1 Amb16202554 [0,0,0,1,0,0|1,0,0]=2 2414 B8R1.51 CC1(C)CNC(=O)S1 Amb27655652 [0,0,0,1,0,0|1,1,0]=3 2415 B8R1.51 CC1(C)CNC(=S)N1 Amb4032825 [0,0,0,1,0,0|2,1,0]=4 2416 B8R1.51 CC1(C)CNC(=S)O1 Amb27838912 [0,0,0,1,0,0|1,1,0]=3 2417 B8R1.51 CC1(C)COC(=O)C1 Amb22284870 [0,0,0,1,0,0|2,0,0]=3 2418 B8R1.51 CC1(C)COC(=O)N1 Amb19516997 [0,0,0,1,0,0|2,0,0]=3 2419 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,0,0,1,0,0|1,0,0]=2 2420 B8R1.51 CC1(C)COC(=S)N1 Amb2608889 [0,0,0,1,0,0|2,1,0]=4 2421 B8R1.51 CC1(C)COC(N)=N1 Amb22732038 [0,0,0,1,0,0|3,0,0]=4 2422 B8R1.51 CC1(C)COP(Cl)O1 Amb25889232 [0,0,0,1,0,0|3,0,0]=4 2423 B8R1.51 CC1(C)CSC(=O)N1 Amb27173093 [0,0,0,1,0,0|2,0,0]=3 2424 B8R1.51 CC1(C)CSC(N)=N1 Amb27643676 [0,0,0,1,0,0|3,0,0]=4 2425 B8R1.51 CC1(C)NCC(=N)O1 Amb27838287 [0,0,0,1,0,0|2,0,0]=3 2426 B8R1.51 CC1(C)NCC(=O)N1 Amb27770341 [0,0,0,1,0,0|2,0,0]=3 2427 B8R1.51 CC1(C)NCC(=O)O1 Amb27969182 [0,0,0,1,0,0|1,0,0]=2 2428 B8R1.51 CC1(C)OCC(=O)O1 Amb10601611 [0,0,0,1,0,0|1,0,0]=2 2429 B8R1.51 CC1(C)OCC(N)O1 Amb28068957 [0,0,0,1,0,0|2,0,1]=4 2430 B8R1.51 CC1(F)CCC(=O)O1 Amb27597762 [0,0,0,1,0,0|1,0,0]=2 2431 B8R1.51 CC1(F)COC(=O)O1 Amb27420932 [0,0,0,1,0,0|2,0,0]=3 2432 B8R1.51 CC1(O)C=CC(=O)O1 Amb26551626 [0,0,0,1,0,0|1,0,2]=4 2433 B8R1.51 CC1(O)CCC(N)C1 Amb24483255 [0,0,0,1,0,0|2,0,1]=4 2434 B8R1.51 CC1(O)CCC(N)C1 Amb33951111 [0,0,0,1,0,0|2,0,1]=4 2435 B8R1.51 CC1(O)CCC(O)C1 Amb27763253 [0,0,0,1,0,0|2,0,1]=4 2436 B8R1.51 CC1(O)CNC(=O)C1 Amb2722777 [0,0,0,1,0,0|3,0,0]=4 2437 B8R1.51 CC1=CC(C)(C)CN1 Amb27461268 [0,0,0,1,0,0|3,0,0]=4 2438 B8R1.51 CC1=NC(C)(C)CO1 Amb4005048 [0,0,0,1,0,0|3,0,0]=4 2439 B8R1.51 CC1=NC(C)(C)NC1 Amb28284258 [0,0,0,1,0,0|3,0,0]=4 2440 B8R1.51 CC1=NC(C)(C)SC1 Amb24733807 [0,0,0,1,0,0|3,0,0]=4 2441 B8R1.51 CC1CC(C)(O)CO1 Amb35728712 [0,0,0,1,0,0|2,0,1]=4 2442 B8R1.51 CC1CCC(C)(C)N1 Amb18833048 [0,0,0,1,0,0|2,0,1]=4 2443 B8R1.51 CC1CCC(C)(C)N1 Amb28934856 [0,0,0,1,0,0|2,0,1]=4 2444 B8R1.51 CC1CCC(C)(C)[Cl+]1 Amb27483739 [0,0,0,1,0,0|2,0,1]=4 2445 B8R1.51 CC1CCC(C)(N)C1 Amb26046406 [0,0,0,1,0,0|2,0,1]=4 2446 B8R1.51 CC1CCC(C)(O)C1 Amb26863470 [0,0,0,1,0,0|1,0,1]=3 2447 B8R1.51 CC1CCC(F)(F)C1 Amb32654498 [0,0,0,1,0,0|2,0,1]=4 2448 B8R1.51 CC1CCS(=O)(=O)C1 Amb2548451 [0,0,0,1,0,0|1,0,1]=3 2449 B8R1.51 CC1CCS(=O)(=O)N1 Amb24556783 [0,0,0,1,0,0|2,0,1]=4 2450 B8R1.51 CC1CCS(=O)(=O)O1 Amb26382065 [0,0,0,1,0,0|2,0,1]=4 2451 B8R1.51 CC1CNS(=O)(=O)C1 Amb24117862 [0,0,0,1,0,0|2,0,1]=4 2452 B8R1.51 CC1NCC(C)(C)O1 Amb17506152 [0,0,0,1,0,0|2,0,1]=4 2453 B8R1.51 CS1(=O)=NC(=O)CC1 Amb33483218 [0,0,0,1,0,0|3,0,0]=4 2454 B8R1.51 C[C@@H]1COC(C)(C)O1 Amb27768765 [0,0,0,1,0,0|2,0,1]=4 2455 B8R1.51 C[C@]1(O)CNC(=O)C1 Amb28253160 [0,0,0,1,0,0|3,0,0]=4 2456 B8R1.51 C[N+]1(C)CCC([O-])=N1 Amb25113848 [0,0,0,1,0,0|2,0,1]=4 2457 B8R1.51 C[Si]1(C)CCC(=O)C1 Amb29837969 [0,0,0,1,0,0|1,1,0]=3 2458 B8R1.51 C[Si]1(C)CCC(O)C1 Amb24504254 [0,0,0,1,0,0|1,1,1]=4 2459 B8R1.51 NC1CCS(=O)(=O)C1 Amb1080886 [0,0,0,1,0,0|2,0,1]=4 2460 B8R1.51 NC1CCS(=O)(=O)C1 Amb1152771 [0,0,0,1,0,0|2,0,1]=4 2461 B8R1.51 NC1CCS(=O)(=O)C1 Amb8508170 [0,0,0,1,0,0|2,0,1]=4 2462 B8R1.51 NC1CC[S+](=O)([O-])C1 Amb17726901 [0,0,0,1,0,0|2,0,1]=4 2463 B8R1.51 N[C@@H]1CCS(=O)(=O)C1 Amb33872364 [0,0,0,1,0,0|2,0,1]=4 2464 B8R1.51 N[C@H]1CCS(=O)(=O)C1 Amb30634357 [0,0,0,1,0,0|2,0,1]=4 2465 B8R1.51 O=C1CCC(Cl)(Cl)C1 Amb28141254 [0,0,0,1,0,0|3,0,0]=4 2466 B8R1.51 O=C1CCC(F)(F)C1 Amb21963547 [0,0,0,1,0,0|3,0,0]=4 2467 B8R1.51 O=C1CCS(=O)(=O)O1 Amb17399828 [0,0,0,1,0,0|3,0,0]=4 2468 B8R1.51 O=S1(=O)CCC(Br)C1 Amb2813269 [0,0,0,1,0,0|2,0,1]=4 2469 B8R1.51 O=S1(=O)CCC(Cl)C1 Amb2598932 [0,0,0,1,0,0|2,0,1]=4 2470 B8R1.51 O=S1(=O)CCC(I)C1 Amb19517046 [0,0,0,1,0,0|2,0,1]=4 2471 B8R1.51 O=S1(=O)CCC(O)C1 Amb5716885 [0,0,0,1,0,0|2,0,1]=4 2472 B8R1.51 O=S1(=O)CCC(S)C1 Amb2796511 [0,0,0,1,0,0|2,0,1]=4 2473 B8R1.51 O=S1(=O)CCC([S-])C1 Amb18526895 [0,0,0,1,0,0|2,0,1]=4 2474 B8R1.51 O=S1(=O)CC[C@@H](O)C1 Amb27981301 [0,0,0,1,0,0|2,0,1]=4 2475 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 Amb2793187 [0,0,0,1,0,0|2,0,1]=4 2476 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 Amb3911968 [0,0,0,1,0,0|2,0,1]=4 2477 B8R1.69 CC1(N)CCC1(C)O Amb24117489 [0,0,0,1,0,0|2,0,1]=4 2478 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,0,0,1,0,0|1,0,0]=2 2479 B8R1.77 CC(=O)C1CC1(C)O Amb27963572 [0,0,0,1,0,0|2,0,0]=3 2480 B8R1.77 CC(=O)C1CC1(Cl)Cl Amb25890324 [0,0,0,1,0,0|3,0,0]=4 2481 B8R1.77 CC(=O)C1CC1(F)F Amb25219948 [0,0,0,1,0,0|3,0,0]=4 2482 B8R1.77 CC(=O)C1OC1(C)C Amb4605897 [0,0,0,1,0,0|2,0,0]=3 2483 B8R1.77 CC(Br)C1CC1(C)C Amb27779654 [0,0,0,1,0,0|2,0,1]=4 2484 B8R1.77 CC(Cl)C1CC1(C)C Amb28195508 [0,0,0,1,0,0|2,0,1]=4 2485 B8R1.77 CC(N)C1CC1(C)C Amb23590883 [0,0,0,1,0,0|2,0,1]=4 2486 B8R1.77 CC(S)C1CC1(C)C Amb28134850 [0,0,0,1,0,0|1,1,1]=4 2487 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [0,0,0,1,0,0|1,0,0]=2 2488 B8R1.77 CC1(C)CC1B(O)O Amb28316229 [0,0,0,1,0,0|1,0,1]=3 2489 B8R1.77 CC1(C)CC1C(=N)N Amb28048937 [0,0,0,1,0,0|2,0,0]=3 2490 B8R1.77 CC1(C)CC1C(=N)N Amb28934919 [0,0,0,1,0,0|2,0,0]=3 2491 B8R1.77 CC1(C)CC1C(=O)Cl Amb16230811 [0,0,0,1,0,0|1,0,0]=2 2492 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [0,0,0,1,0,0|0,0,0]=1 2493 B8R1.77 CC1(C)CC1C(N)=O Amb2778846 [0,0,0,1,0,0|1,0,0]=2 2494 B8R1.77 CC1(C)CC1C(N)=S Amb25983596 [0,0,0,1,0,0|1,1,0]=3 2495 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [0,0,0,1,0,0|0,0,0]=1 2496 B8R1.77 CC1(C)C[C@@H]1C(N)=O Amb4166316 [0,0,0,1,0,0|1,0,0]=2 2497 B8R1.77 CC1(C)C[C@H]1C(N)=O Amb10072071 [0,0,0,1,0,0|1,0,0]=2 2498 B8R1.77 CC1(C)OC1C(=O)O Amb24481352 [0,0,0,1,0,0|1,0,0]=2 2499 B8R1.77 CC1(C)SC1C(N)=O Amb27838390 [0,0,0,1,0,0|2,0,0]=3 2500 B8R1.77 CN(C)C1CC1(C)C Amb27838003 [0,0,0,1,0,0|3,0,0]=4 2501 B8R1.77 C[C@@H](N)C1CC1(C)C Amb24434247 [0,0,0,1,0,0|2,0,1]=4 2502 B8R1.77 C[C@@H](O)[C@@H]1CC1(C)C Amb28207137 [0,0,0,1,0,0|1,0,1]=3 2503 B8R1.77 C[C@@H](O)[C@@H]1OC1(C)C Amb27422577 [0,0,0,1,0,0|2,0,1]=4 2504 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [0,0,0,1,0,0|1,0,0]=2 2505 B8R1.77 C[C@H](N)C1CC1(C)C Amb25684599 [0,0,0,1,0,0|2,0,1]=4 2506 B8R1.77 C[C@H](O)C1CC1(C)C Amb27602446 [0,0,0,1,0,0|1,0,1]=3 2507 B8R1.77 C[C@H](O)[C@@H]1CC1(C)C Amb27197232 [0,0,0,1,0,0|1,0,1]=3 2508 B8R1.77 C[C@H](O)[C@@H]1OC1(C)C Amb27422584 [0,0,0,1,0,0|2,0,1]=4 2509 B8R1.77 C[C@H](O)[C@H]1OC1(C)C Amb27219828 [0,0,0,1,0,0|2,0,1]=4 2510 B8R1.77 NC(=O)C1CC1(Cl)Cl Amb2722922 [0,0,0,1,0,0|3,0,0]=4 2511 B8R1.77 NC(=O)C1CC1(F)F Amb24715693 [0,0,0,1,0,0|3,0,0]=4 2512 B8R1.77 O=C(Cl)C1CC1(Cl)Cl Amb16230810 [0,0,0,1,0,0|3,0,0]=4 2513 B8R1.77 O=C(Cl)C1CC1(F)F Amb27864246 [0,0,0,1,0,0|3,0,0]=4 2514 B8R1.77 O=C(Cl)[C@@H]1C[C@@]1(F)Cl Amb27768018 [0,0,0,1,0,0|3,0,0]=4 2515 B8R1.77 O=C(Cl)[C@@H]1C[C@]1(F)Cl Amb27249625 [0,0,0,1,0,0|3,0,0]=4 2516 B8R1.77 O=C(O)C1CC1(Cl)Cl Amb1106460 [0,0,0,1,0,0|2,0,0]=3 2517 B8R1.77 O=C(O)C1CC1(F)Br Amb25952257 [0,0,0,1,0,0|2,0,0]=3 2518 B8R1.77 O=C(O)C1CC1(F)Cl Amb10841879 [0,0,0,1,0,0|2,0,0]=3 2519 B8R1.77 O=C(O)C1CC1(F)F Amb2691845 [0,0,0,1,0,0|2,0,0]=3 2520 B8R1.77 O=C(O)[C@@H]1CC1(F)F Amb30869365 [0,0,0,1,0,0|2,0,0]=3 2521 B8R1.77 O=C(O)[C@@H]1C[C@@]1(F)Cl Amb28252683 [0,0,0,1,0,0|2,0,0]=3 2522 B8R1.77 O=C(O)[C@H]1CC1(Cl)Cl Amb27444143 [0,0,0,1,0,0|2,0,0]=3 2523 B8R1.77 O=C(O)[C@H]1CC1(F)F Amb33802940 [0,0,0,1,0,0|2,0,0]=3 2524 B6R0.2 C=C(Br)CC(C)C Amb22583739 [0,0,0,0,1,0|2,0,0]=3 2525 B6R0.2 C=C(C)CC(=O)O Amb6278832 [0,0,0,0,1,0|0,0,2]=3 2526 B6R0.2 C=C(C)CC(C)=O Amb17593075 [0,0,0,0,1,0|1,0,2]=4 2527 B6R0.2 C=C(C)CC(C)Br Amb24365286 [0,0,0,0,1,0|3,0,0]=4 2528 B6R0.2 C=C(C)CC(C)C Amb4019530 [0,0,0,0,1,0|2,0,0]=3 2529 B6R0.2 C=C(C)CC(C)Cl Amb24558200 [0,0,0,0,1,0|3,0,0]=4 2530 B6R0.2 C=C(C)CC(C)O Amb17593083 [0,0,0,0,1,0|3,0,0]=4 2531 B6R0.2 C=C(C)CN(C)C Amb25747292 [0,0,0,0,1,0|3,0,0]=4 2532 B6R0.2 C=C(C)C[C@@H](C)N Amb33199541 [0,0,0,0,1,0|3,0,0]=4 2533 B6R0.2 C=C(C)C[C@@H](C)O Amb25888510 [0,0,0,0,1,0|3,0,0]=4 2534 B6R0.2 C=C(C)C[C@H](C)N Amb33199534 [0,0,0,0,1,0|3,0,0]=4 2535 B6R0.2 C=C(C)C[C@H](C)O Amb27466720 [0,0,0,0,1,0|3,0,0]=4 2536 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [0,0,0,0,1,0|1,0,2]=4 2537 B6R0.2 C=C(Cl)CC(C)Cl Amb28396615 [0,0,0,0,1,0|3,0,0]=4 2538 B6R0.2 C=C(Cl)CN(C)C Amb27425092 [0,0,0,0,1,0|3,0,0]=4 2539 B6R0.2 C=C(I)CC(=O)O Amb27598435 [0,0,0,0,1,0|1,0,2]=4 2540 B6R0.2 CB(C)CC(C)C Amb28050346 [0,0,0,0,1,0|3,0,0]=4 2541 B6R0.2 CC(=O)C=C(C)C Amb2793052 [0,0,0,0,1,0|1,0,2]=4 2542 B6R0.2 CC(=O)CC(=O)F Amb28122452 [0,0,0,0,1,0|2,0,1]=4 2543 B6R0.2 CC(=O)CC(=O)O Amb377432 [0,0,0,0,1,0|1,0,1]=3 2544 B6R0.2 CC(=O)CC(=O)[O-] Amb31031013 [0,0,0,0,1,0|1,0,2]=4 2545 B6R0.2 CC(=O)CC(C)=O Amb2716228 [0,0,0,0,1,0|2,0,1]=4 2546 B6R0.2 CC(=O)CC(C)=S Amb28381251 [0,0,0,0,1,0|2,0,1]=4 2547 B6R0.2 CC(=O)CC(C)C Amb4605990 [0,0,0,0,1,0|1,0,0]=2 2548 B6R0.2 CC(=O)CC(C)Cl Amb17593234 [0,0,0,0,1,0|2,0,0]=3 2549 B6R0.2 CC(=O)CC(C)N Amb22587050 [0,0,0,0,1,0|2,0,0]=3 2550 B6R0.2 CC(=O)CC(C)N Amb2583230 [0,0,0,0,1,0|2,0,0]=3 2551 B6R0.2 CC(=O)CC(C)O Amb17593091 [0,0,0,0,1,0|2,0,0]=3 2552 B6R0.2 CC(=O)CC(C)S Amb24600676 [0,0,0,0,1,0|2,0,0]=3 2553 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [0,0,0,0,1,0|2,0,0]=3 2554 B6R0.2 CC(=O)CC(F)F Amb24669174 [0,0,0,0,1,0|3,0,0]=4 2555 B6R0.2 CC(=O)CC(N)=O Amb6608777 [0,0,0,0,1,0|2,0,1]=4 2556 B6R0.2 CC(=O)CN(C)C Amb9217324 [0,0,0,0,1,0|2,0,0]=3 2557 B6R0.2 CC(=O)C[C@@H](C)N Amb27493422 [0,0,0,0,1,0|2,0,0]=3 2558 B6R0.2 CC(=O)C[C@H](C)N Amb27222720 [0,0,0,0,1,0|2,0,0]=3 2559 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [0,0,0,0,1,0|2,0,1]=4 2560 B6R0.2 CC(=O)C[S+](C)Cl Amb27835653 [0,0,0,0,1,0|3,0,0]=4 2561 B6R0.2 CC(=O)NC(C)Br Amb27444682 [0,0,0,0,1,0|3,0,0]=4 2562 B6R0.2 CC(=O)NC(C)C Amb3366263 [0,0,0,0,1,0|2,0,0]=3 2563 B6R0.2 CC(=O)NC(C)N Amb27468729 [0,0,0,0,1,0|3,0,0]=4 2564 B6R0.2 CC(=O)NN(C)C Amb25064806 [0,0,0,0,1,0|3,0,0]=4 2565 B6R0.2 CC(=O)OC(C)Br Amb19958925 [0,0,0,0,1,0|3,0,0]=4 2566 B6R0.2 CC(=O)OC(C)C Amb3940484 [0,0,0,0,1,0|2,0,0]=3 2567 B6R0.2 CC(=O)OC(C)Cl Amb24058273 [0,0,0,0,1,0|3,0,0]=4 2568 B6R0.2 CC(=O)OC(C)N Amb27184949 [0,0,0,0,1,0|3,0,0]=4 2569 B6R0.2 CC(=O)OC(C)O Amb27457187 [0,0,0,0,1,0|3,0,0]=4 2570 B6R0.2 CC(=O)O[SiH](C)C Amb2687439 [0,0,0,0,1,0|2,1,0]=4 2571 B6R0.2 CC(=S)CC(=O)O Amb28067768 [0,0,0,0,1,0|1,0,1]=3 2572 B6R0.2 CC(=S)NC(C)C Amb27953313 [0,0,0,0,1,0|2,1,0]=4 2573 B6R0.2 CC(=S)OC(C)C Amb24697607 [0,0,0,0,1,0|2,1,0]=4 2574 B6R0.2 CC(Br)CC(=O)O Amb8517108 [0,0,0,0,1,0|1,0,0]=2 2575 B6R0.2 CC(C)=CC(=O)Cl Amb2782315 [0,0,0,0,1,0|1,0,2]=4 2576 B6R0.2 CC(C)=CC(=O)O Amb1485519 [0,0,0,0,1,0|0,0,2]=3 2577 B6R0.2 CC(C)=CC(C)C Amb4016282 [0,0,0,0,1,0|2,0,1]=4 2578 B6R0.2 CC(C)=CC(N)=O Amb10561758 [0,0,0,0,1,0|1,0,2]=4 2579 B6R0.2 CC(C)=NC(C)C Amb2689015 [0,0,0,0,1,0|3,0,0]=4 2580 B6R0.2 CC(C)CB(Br)Br Amb28050274 [0,0,0,0,1,0|3,0,0]=4 2581 B6R0.2 CC(C)CB(O)O Amb2447316 [0,0,0,0,1,0|1,0,1]=3 2582 B6R0.2 CC(C)CC(=N)N Amb10066934 [0,0,0,0,1,0|2,0,0]=3 2583 B6R0.2 CC(C)CC(=N)N Amb2696279 [0,0,0,0,1,0|2,0,0]=3 2584 B6R0.2 CC(C)CC(=O)Br Amb26486664 [0,0,0,0,1,0|1,0,0]=2 2585 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [0,0,0,0,1,0|1,0,0]=2 2586 B6R0.2 CC(C)CC(=O)F Amb32667643 [0,0,0,0,1,0|1,0,0]=2 2587 B6R0.2 CC(C)CC(=O)O Amb3939848 [0,0,0,0,1,0|0,0,0]=1 2588 B6R0.2 CC(C)CC(C)Br Amb2720906 [0,0,0,0,1,0|2,0,1]=4 2589 B6R0.2 CC(C)CC(C)C Amb22045157 [0,0,0,0,1,0|2,0,1]=4 2590 B6R0.2 CC(C)CC(C)Cl Amb7766810 [0,0,0,0,1,0|2,0,1]=4 2591 B6R0.2 CC(C)CC(C)I Amb25783778 [0,0,0,0,1,0|2,0,1]=4 2592 B6R0.2 CC(C)CC(C)N Amb31289290 [0,0,0,0,1,0|2,0,1]=4 2593 B6R0.2 CC(C)CC(C)N Amb9706523 [0,0,0,0,1,0|2,0,1]=4 2594 B6R0.2 CC(C)CC(C)O Amb6608920 [0,0,0,0,1,0|1,0,1]=3 2595 B6R0.2 CC(C)CC(C)S Amb7784717 [0,0,0,0,1,0|1,1,1]=4 2596 B6R0.2 CC(C)CC(N)=O Amb2722931 [0,0,0,0,1,0|1,0,0]=2 2597 B6R0.2 CC(C)CC(N)=S Amb6246355 [0,0,0,0,1,0|1,1,0]=3 2598 B6R0.2 CC(C)CC(N)O Amb28383510 [0,0,0,0,1,0|1,0,1]=3 2599 B6R0.2 CC(C)CC(O)O Amb27207854 [0,0,0,0,1,0|0,0,2]=3 2600 B6R0.2 CC(C)CN(C)C Amb17231805 [0,0,0,0,1,0|3,0,0]=4 2601 B6R0.2 CC(C)CN(C)O Amb33360311 [0,0,0,0,1,0|2,0,0]=3 2602 B6R0.2 CC(C)CS(=O)Cl Amb26409520 [0,0,0,0,1,0|2,0,0]=3 2603 B6R0.2 CC(C)CS(=O)[O-] Amb19930010 [0,0,0,0,1,0|1,0,1]=3 2604 B6R0.2 CC(C)CS(C)=O Amb27972160 [0,0,0,0,1,0|2,0,0]=3 2605 B6R0.2 CC(C)CS(N)=O Amb24527860 [0,0,0,0,1,0|2,0,0]=3 2606 B6R0.2 CC(C)C[AlH3](Cl)Cl Amb22353406 [0,0,0,0,1,0|3,0,0]=4 2607 B6R0.2 CC(C)C[C@@H](C)N Amb28247479 [0,0,0,0,1,0|2,0,1]=4 2608 B6R0.2 CC(C)C[C@@H](C)N Amb33329943 [0,0,0,0,1,0|2,0,1]=4 2609 B6R0.2 CC(C)C[C@@H](C)O Amb8517525 [0,0,0,0,1,0|1,0,1]=3 2610 B6R0.2 CC(C)C[C@H](C)N Amb27254209 [0,0,0,0,1,0|2,0,1]=4 2611 B6R0.2 CC(C)C[C@H](C)N Amb33329057 [0,0,0,0,1,0|2,0,1]=4 2612 B6R0.2 CC(C)C[C@H](C)O Amb8517526 [0,0,0,0,1,0|1,0,1]=3 2613 B6R0.2 CC(C)C[N+](=O)[O-] Amb17672613 [0,0,0,0,1,0|1,0,1]=3 2614 B6R0.2 CC(C)NC(=N)N Amb24271074 [0,0,0,0,1,0|3,0,0]=4 2615 B6R0.2 CC(C)NC(=N)N Amb26339394 [0,0,0,0,1,0|3,0,0]=4 2616 B6R0.2 CC(C)NC(=N)N Amb32410104 [0,0,0,0,1,0|3,0,0]=4 2617 B6R0.2 CC(C)NC(=O)Cl Amb27780560 [0,0,0,0,1,0|2,0,0]=3 2618 B6R0.2 CC(C)NC(=O)S Amb27817487 [0,0,0,0,1,0|1,1,0]=3 2619 B6R0.2 CC(C)NC(N)=O Amb1104587 [0,0,0,0,1,0|2,0,0]=3 2620 B6R0.2 CC(C)NC(N)=S Amb1152626 [0,0,0,0,1,0|2,1,0]=4 2621 B6R0.2 CC(C)NS(C)=O Amb27777975 [0,0,0,0,1,0|3,0,0]=4 2622 B6R0.2 CC(C)OB(O)O Amb28410460 [0,0,0,0,1,0|2,0,1]=4 2623 B6R0.2 CC(C)OC(=O)Cl Amb3941687 [0,0,0,0,1,0|2,0,0]=3 2624 B6R0.2 CC(C)OC(=S)S Amb24465791 [0,0,0,0,1,0|1,2,0]=4 2625 B6R0.2 CC(C)OC(=S)[S-] Amb19748282 [0,0,0,0,1,0|1,2,0]=4 2626 B6R0.2 CC(C)OC(=S)[S-] Amb534231 [0,0,0,0,1,0|1,2,0]=4 2627 B6R0.2 CC(C)OC(N)=O Amb4017684 [0,0,0,0,1,0|2,0,0]=3 2628 B6R0.2 CC(C)OC(N)=S Amb25732665 [0,0,0,0,1,0|2,1,0]=4 2629 B6R0.2 CC(C)O[PH](=O)S Amb27447273 [0,0,0,0,1,0|2,1,0]=4 2630 B6R0.2 CC(C)SC(=N)N Amb1093763 [0,0,0,0,1,0|3,0,0]=4 2631 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [0,0,0,0,1,0|2,0,0]=3 2632 B6R0.2 CC(Cl)CC(=O)Cl Amb28343061 [0,0,0,0,1,0|2,0,0]=3 2633 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [0,0,0,0,1,0|1,0,0]=2 2634 B6R0.2 CC(Cl)NC(N)=O Amb28130611 [0,0,0,0,1,0|3,0,0]=4 2635 B6R0.2 CC(Cl)OC(=O)Cl Amb6608999 [0,0,0,0,1,0|3,0,0]=4 2636 B6R0.2 CC(I)CC(=O)O Amb28398380 [0,0,0,0,1,0|1,0,0]=2 2637 B6R0.2 CC(N)CC(=O)O Amb8379759 [0,0,0,0,1,0|1,0,0]=2 2638 B6R0.2 CC(N)CC(=O)S Amb27413857 [0,0,0,0,1,0|1,1,0]=3 2639 B6R0.2 CC(N)CC(C)O Amb18640217 [0,0,0,0,1,0|2,0,1]=4 2640 B6R0.2 CC(N)CC(N)=O Amb18281237 [0,0,0,0,1,0|2,0,0]=3 2641 B6R0.2 CC(N)CC(N)=O Amb33532770 [0,0,0,0,1,0|2,0,0]=3 2642 B6R0.2 CC(N)CS(C)=O Amb33546327 [0,0,0,0,1,0|3,0,0]=4 2643 B6R0.2 CC(O)CC(=O)O Amb8513187 [0,0,0,0,1,0|1,0,0]=2 2644 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [0,0,0,0,1,0|1,0,1]=3 2645 B6R0.2 CC(O)CC(C)F Amb28065744 [0,0,0,0,1,0|2,0,1]=4 2646 B6R0.2 CC(O)CC(C)O Amb10068523 [0,0,0,0,1,0|2,0,1]=4 2647 B6R0.2 CC(O)CC(C)S Amb24122653 [0,0,0,0,1,0|2,0,1]=4 2648 B6R0.2 CC(O)CC(N)=O Amb26394320 [0,0,0,0,1,0|2,0,0]=3 2649 B6R0.2 CC(O)CC(N)=S Amb24479794 [0,0,0,0,1,0|2,1,0]=4 2650 B6R0.2 CC(O)CN(C)C Amb8513140 [0,0,0,0,1,0|2,0,1]=4 2651 B6R0.2 CC(O)CS(C)=O Amb28137235 [0,0,0,0,1,0|3,0,0]=4 2652 B6R0.2 CC(O)C[N+](=O)[O-] Amb9678341 [0,0,0,0,1,0|2,0,1]=4 2653 B6R0.2 CC(O)C[NH+](C)C Amb33934480 [0,0,0,0,1,0|2,0,1]=4 2654 B6R0.2 CC(S)CC(=O)O Amb33538201 [0,0,0,0,1,0|1,0,0]=2 2655 B6R0.2 CN(C)CC(=N)N Amb10610521 [0,0,0,0,1,0|3,0,0]=4 2656 B6R0.2 CN(C)CC(=N)N Amb10610536 [0,0,0,0,1,0|3,0,0]=4 2657 B6R0.2 CN(C)CC(=N)N Amb4297035 [0,0,0,0,1,0|3,0,0]=4 2658 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [0,0,0,0,1,0|2,0,0]=3 2659 B6R0.2 CN(C)CC(=O)Cl Amb3939582 [0,0,0,0,1,0|2,0,0]=3 2660 B6R0.2 CN(C)CC(=O)O Amb3319051 [0,0,0,0,1,0|1,0,0]=2 2661 B6R0.2 CN(C)CC(=O)O Amb3940366 [0,0,0,0,1,0|1,0,0]=2 2662 B6R0.2 CN(C)CC(N)=O Amb17231806 [0,0,0,0,1,0|2,0,0]=3 2663 B6R0.2 CN(C)CC(N)=O Amb33321491 [0,0,0,0,1,0|2,0,0]=3 2664 B6R0.2 CN(C)CC(N)=S Amb16232219 [0,0,0,0,1,0|2,1,0]=4 2665 B6R0.2 CN(C)CC(N)=S Amb19373088 [0,0,0,0,1,0|2,1,0]=4 2666 B6R0.2 CN(C)CC(N)=S Amb21912622 [0,0,0,0,1,0|2,1,0]=4 2667 B6R0.2 CN(C)CC(N)=S Amb534722 [0,0,0,0,1,0|2,1,0]=4 2668 B6R0.2 CN(C)NC(=O)Cl Amb35637051 [0,0,0,0,1,0|3,0,0]=4 2669 B6R0.2 CN(C)NC(N)=O Amb24325231 [0,0,0,0,1,0|3,0,0]=4 2670 B6R0.2 CN(N)CC(=O)O Amb23592296 [0,0,0,0,1,0|2,0,0]=3 2671 B6R0.2 CN(O)CC(=O)O Amb29838290 [0,0,0,0,1,0|2,0,0]=3 2672 B6R0.2 CS(=O)CC(N)=O Amb24394100 [0,0,0,0,1,0|3,0,0]=4 2673 B6R0.2 CS(C)=NC(N)=O Amb27837994 [0,0,0,0,1,0|3,0,0]=4 2674 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [0,0,0,0,1,0|1,0,0]=2 2675 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [0,0,0,0,1,0|1,0,0]=2 2676 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [0,0,0,0,1,0|1,0,0]=2 2677 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [0,0,0,0,1,0|1,0,0]=2 2678 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [0,0,0,0,1,0|1,0,0]=2 2679 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [0,0,0,0,1,0|1,0,1]=3 2680 B6R0.2 C[C@@H](O)CN(C)C Amb22746407 [0,0,0,0,1,0|2,0,1]=4 2681 B6R0.2 C[C@@H](O)CS(C)=O Amb27457390 [0,0,0,0,1,0|3,0,0]=4 2682 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [0,0,0,0,1,0|1,0,0]=2 2683 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [0,0,0,0,1,0|1,0,0]=2 2684 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [0,0,0,0,1,0|1,0,0]=2 2685 B6R0.2 C[C@H](N)CC(N)=O Amb27873963 [0,0,0,0,1,0|2,0,0]=3 2686 B6R0.2 C[C@H](N)C[C@H](C)O Amb27593805 [0,0,0,0,1,0|2,0,1]=4 2687 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [0,0,0,0,1,0|1,0,0]=2 2688 B6R0.2 C[C@H](O)C[C@@H](C)F Amb27486566 [0,0,0,0,1,0|2,0,1]=4 2689 B6R0.2 C[C@H](O)C[C@@H](C)O Amb27273041 [0,0,0,0,1,0|2,0,1]=4 2690 B6R0.2 C[C@H](O)C[C@H](C)I Amb28042894 [0,0,0,0,1,0|2,0,1]=4 2691 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [0,0,0,0,1,0|2,0,1]=4 2692 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [0,0,0,0,1,0|2,0,0]=3 2693 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [0,0,0,0,1,0|1,0,0]=2 2694 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [0,0,0,0,1,0|1,0,0]=2 2695 B6R0.2 C[S+](C)CC(=O)[O-] Amb26065720 [0,0,0,0,1,0|1,0,1]=3 2696 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [0,0,0,0,1,0|1,0,2]=4 2697 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [0,0,0,0,1,0|1,0,2]=4 2698 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [0,0,0,0,1,0|1,0,2]=4 2699 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [0,0,0,0,1,0|1,0,2]=4 2700 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [0,0,0,0,1,0|1,0,2]=4 2701 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [0,0,0,0,1,0|1,0,2]=4 2702 B6R0.2 NC(=O)CC(=O)O Amb4034884 [0,0,0,0,1,0|2,0,1]=4 2703 B6R0.2 NC(=O)CC(F)F Amb28401488 [0,0,0,0,1,0|3,0,0]=4 2704 B6R0.2 NC(=S)CC(=O)O Amb17465742 [0,0,0,0,1,0|2,0,1]=4 2705 B6R0.2 NC(S)CC(=O)O Amb27391244 [0,0,0,0,1,0|2,0,0]=3 2706 B6R0.2 O=C(O)CB(O)O Amb24053058 [0,0,0,0,1,0|3,0,0]=4 2707 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [0,0,0,0,1,0|2,0,1]=4 2708 B6R0.2 O=C(O)CC(=O)O Amb2689065 [0,0,0,0,1,0|2,0,1]=4 2709 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [0,0,0,0,1,0|2,0,0]=3 2710 B6R0.2 O=C(O)CC(F)F Amb22001551 [0,0,0,0,1,0|2,0,0]=3 2711 B6R0.2 O=C(O)CS(=O)O Amb27788997 [0,0,0,0,1,0|3,0,0]=4 2712 B6R0.2 O=C([O-])CC(F)F Amb24117960 [0,0,0,0,1,0|2,0,1]=4 2713 B6R0.2 O=S(O)CC(F)F Amb30035176 [0,0,0,0,1,0|3,0,0]=4 2714 B6R0.2 OC(=S)CC(F)F Amb34179023 [0,0,0,0,1,0|2,1,0]=4 2715 B8R0.28 C=C(Br)CNC[C@@H](C)O Amb28285300 [0,0,0,0,0,1|3,0,0]=4 2716 B8R0.28 C=C(Br)CNC[C@H](C)O Amb27184417 [0,0,0,0,0,1|3,0,0]=4 2717 B8R0.28 C=C(Br)COCC(C)C Amb28246325 [0,0,0,0,0,1|2,0,0]=3 2718 B8R0.28 C=C(Br)CSCC(C)N Amb27464775 [0,0,0,0,0,1|3,0,0]=4 2719 B8R0.28 C=C(C)CCC=C(C)C Amb27424700 [0,0,0,0,0,1|2,0,1]=4 2720 B8R0.28 C=C(C)CCCC(=O)O Amb2699907 [0,0,0,0,0,1|0,0,2]=3 2721 B8R0.28 C=C(C)CCCC(C)=O Amb17739959 [0,0,0,0,0,1|1,0,2]=4 2722 B8R0.28 C=C(C)CCCC(C)Br Amb27955163 [0,0,0,0,0,1|3,0,0]=4 2723 B8R0.28 C=C(C)CCCC(C)C Amb22228386 [0,0,0,0,0,1|2,0,0]=3 2724 B8R0.28 C=C(C)CCCC(C)Cl Amb27965952 [0,0,0,0,0,1|3,0,0]=4 2725 B8R0.28 C=C(C)CCCC(N)=O Amb27837767 [0,0,0,0,0,1|1,0,2]=4 2726 B8R0.28 C=C(C)CCC[C@@H](C)N Amb28049331 [0,0,0,0,0,1|3,0,0]=4 2727 B8R0.28 C=C(C)CCNC(C)=O Amb27780923 [0,0,0,0,0,1|1,0,2]=4 2728 B8R0.28 C=C(C)CCNN(C)C Amb27656804 [0,0,0,0,0,1|3,0,0]=4 2729 B8R0.28 C=C(C)CCOC(C)=O Amb4035107 [0,0,0,0,0,1|1,0,2]=4 2730 B8R0.28 C=C(C)CCSC(C)C Amb27443471 [0,0,0,0,0,1|2,0,0]=3 2731 B8R0.28 C=C(C)CNCC(C)C Amb17308640 [0,0,0,0,0,1|2,0,0]=3 2732 B8R0.28 C=C(C)CNC[C@H](C)O Amb27852384 [0,0,0,0,0,1|3,0,0]=4 2733 B8R0.28 C=C(C)CSCC(=O)O Amb6280447 [0,0,0,0,0,1|0,0,2]=3 2734 B8R0.28 C=C(C)CSCC(C)=O Amb27877304 [0,0,0,0,0,1|1,0,2]=4 2735 B8R0.28 C=C(C)C\C=C\C(=O)O Amb27602149 [0,0,0,0,0,1|0,0,3]=4 2736 B8R0.28 C=C(C)\C=C\CC(=O)O Amb18642409 [0,0,0,0,0,1|0,0,3]=4 2737 B8R0.28 C=C(Cl)CNC[C@H](C)O Amb27642026 [0,0,0,0,0,1|3,0,0]=4 2738 B8R0.28 C=C(F)CCCC(=O)O Amb22641515 [0,0,0,0,0,1|1,0,2]=4 2739 B8R0.28 CC(=N)NCCC(N)=O Amb28049611 [0,0,0,0,0,1|2,0,1]=4 2740 B8R0.28 CC(=O)C#CCC(C)C Amb27442442 [0,0,0,0,0,1|1,0,1]=3 2741 B8R0.28 CC(=O)CC=C=C(C)C Amb17593280 [0,0,0,0,0,1|1,0,2]=4 2742 B8R0.28 CC(=O)CCC=C(C)C Amb533052 [0,0,0,0,0,1|1,0,1]=3 2743 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,0,0,0,0,1|1,0,1]=3 2744 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [0,0,0,0,0,1|2,0,1]=4 2745 B8R0.28 CC(=O)CCCC(C)C Amb33532191 [0,0,0,0,0,1|1,0,0]=2 2746 B8R0.28 CC(=O)CCCC(C)N Amb27483216 [0,0,0,0,0,1|2,0,0]=3 2747 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,0,0,0,0,1|2,0,1]=4 2748 B8R0.28 CC(=O)CCCN(C)C Amb2778944 [0,0,0,0,0,1|2,0,0]=3 2749 B8R0.28 CC(=O)CCNC(C)=O Amb17102868 [0,0,0,0,0,1|2,0,1]=4 2750 B8R0.28 CC(=O)CCNC(C)C Amb26463473 [0,0,0,0,0,1|1,0,0]=2 2751 B8R0.28 CC(=O)CCNN(C)C Amb27838684 [0,0,0,0,0,1|2,0,0]=3 2752 B8R0.28 CC(=O)CCOC(C)=O Amb4605918 [0,0,0,0,0,1|2,0,1]=4 2753 B8R0.28 CC(=O)CCOC(C)C Amb22229804 [0,0,0,0,0,1|1,0,0]=2 2754 B8R0.28 CC(=O)CC\C=C(\C)Cl Amb17593664 [0,0,0,0,0,1|2,0,1]=4 2755 B8R0.28 CC(=O)CNCC(C)C Amb25067661 [0,0,0,0,0,1|1,0,0]=2 2756 B8R0.28 CC(=O)CNCC(C)C Amb32663767 [0,0,0,0,0,1|1,0,0]=2 2757 B8R0.28 CC(=O)CNCC(C)O Amb24589662 [0,0,0,0,0,1|2,0,0]=3 2758 B8R0.28 CC(=O)CSCC(=O)O Amb26415891 [0,0,0,0,0,1|1,0,1]=3 2759 B8R0.28 CC(=O)CSCC(=O)[O-] Amb20622616 [0,0,0,0,0,1|1,0,2]=4 2760 B8R0.28 CC(=O)CSCC(C)C Amb9269384 [0,0,0,0,0,1|1,0,0]=2 2761 B8R0.28 CC(=O)CSCC(C)F Amb28135753 [0,0,0,0,0,1|2,0,0]=3 2762 B8R0.28 CC(=O)CSCC(C)O Amb27215204 [0,0,0,0,0,1|2,0,0]=3 2763 B8R0.28 CC(=O)CSCC(F)F Amb27956449 [0,0,0,0,0,1|3,0,0]=4 2764 B8R0.28 CC(=O)CSCC(N)=O Amb27411260 [0,0,0,0,0,1|2,0,1]=4 2765 B8R0.28 CC(=O)C\C=C\C(C)C Amb26846089 [0,0,0,0,0,1|1,0,1]=3 2766 B8R0.28 CC(=O)C\C=C\C(C)O Amb26528351 [0,0,0,0,0,1|2,0,1]=4 2767 B8R0.28 CC(=O)C\C=C\N(C)C Amb27191796 [0,0,0,0,0,1|2,0,1]=4 2768 B8R0.28 CC(=O)NCC=C(C)C Amb26606550 [0,0,0,0,0,1|1,0,2]=4 2769 B8R0.28 CC(=O)NCCC(=O)O Amb1104704 [0,0,0,0,0,1|1,0,1]=3 2770 B8R0.28 CC(=O)NCCC(C)Cl Amb27952422 [0,0,0,0,0,1|2,0,0]=3 2771 B8R0.28 CC(=O)NCCC(N)=O Amb8997734 [0,0,0,0,0,1|2,0,1]=4 2772 B8R0.28 CC(=O)NCCS(=O)O Amb27638053 [0,0,0,0,0,1|2,0,1]=4 2773 B8R0.28 CC(=O)NOCC(=O)O Amb25921073 [0,0,0,0,0,1|2,0,1]=4 2774 B8R0.28 CC(=O)N\C=C/C(C)C Amb28437296 [0,0,0,0,0,1|1,0,2]=4 2775 B8R0.28 CC(=O)OCC=C(C)C Amb22002433 [0,0,0,0,0,1|1,0,2]=4 2776 B8R0.28 CC(=O)OCCC(=O)O Amb18642866 [0,0,0,0,0,1|1,0,1]=3 2777 B8R0.28 CC(=O)OCCC(C)C Amb2793054 [0,0,0,0,0,1|1,0,0]=2 2778 B8R0.28 CC(=O)OCCC(C)O Amb26357497 [0,0,0,0,0,1|2,0,0]=3 2779 B8R0.28 CC(=O)OCCC(C)S Amb25077156 [0,0,0,0,0,1|2,0,0]=3 2780 B8R0.28 CC(=O)OCCC(N)=O Amb25921090 [0,0,0,0,0,1|2,0,1]=4 2781 B8R0.28 CC(=O)OCCN(C)C Amb8516593 [0,0,0,0,0,1|2,0,0]=3 2782 B8R0.28 CC(=O)OCC[C@H](C)O Amb28192682 [0,0,0,0,0,1|2,0,0]=3 2783 B8R0.28 CC(=O)SCC=C(C)C Amb17617246 [0,0,0,0,0,1|1,0,2]=4 2784 B8R0.28 CC(=O)SCCC(=O)Cl Amb26637117 [0,0,0,0,0,1|2,0,1]=4 2785 B8R0.28 CC(=O)SCCC(=O)O Amb17607685 [0,0,0,0,0,1|1,0,1]=3 2786 B8R0.28 CC(=O)SCCN(C)C Amb27607143 [0,0,0,0,0,1|2,0,0]=3 2787 B8R0.28 CC(=O)\C=C/CC(C)C Amb27190424 [0,0,0,0,0,1|1,0,1]=3 2788 B8R0.28 CC(=O)\C=C/NC(C)C Amb28388378 [0,0,0,0,0,1|1,0,2]=4 2789 B8R0.28 CC(=O)\C=C\CC(=O)O Amb26900226 [0,0,0,0,0,1|1,0,2]=4 2790 B8R0.28 CC(=O)\C=C\CC(C)C Amb3354778 [0,0,0,0,0,1|1,0,1]=3 2791 B8R0.28 CC(=O)\C=N\NC(C)C Amb27600772 [0,0,0,0,0,1|2,0,1]=4 2792 B8R0.28 CC(Br)CCOC(C)C Amb25966606 [0,0,0,0,0,1|2,0,1]=4 2793 B8R0.28 CC(C)=CCCC(=O)O Amb10601609 [0,0,0,0,0,1|0,0,1]=2 2794 B8R0.28 CC(C)=CCCC(C)C Amb30023884 [0,0,0,0,0,1|2,0,0]=3 2795 B8R0.28 CC(C)=CCCC(C)Cl Amb25032126 [0,0,0,0,0,1|3,0,0]=4 2796 B8R0.28 CC(C)=CCCC(C)N Amb3371996 [0,0,0,0,0,1|3,0,0]=4 2797 B8R0.28 CC(C)=CCC[C@@H](C)Br Amb27400323 [0,0,0,0,0,1|3,0,0]=4 2798 B8R0.28 CC(C)=CCC[C@@H](C)N Amb27404604 [0,0,0,0,0,1|3,0,0]=4 2799 B8R0.28 CC(C)=CCC[C@@H](C)O Amb22049561 [0,0,0,0,0,1|1,0,2]=4 2800 B8R0.28 CC(C)=CCC[C@H](C)N Amb27162485 [0,0,0,0,0,1|3,0,0]=4 2801 B8R0.28 CC(C)=CCC[C@H](C)O Amb22049564 [0,0,0,0,0,1|1,0,2]=4 2802 B8R0.28 CC(C)=CCNC(C)C Amb18642550 [0,0,0,0,0,1|2,0,1]=4 2803 B8R0.28 CC(C)=CNCC(C)C Amb28364333 [0,0,0,0,0,1|2,0,1]=4 2804 B8R0.28 CC(C)=C\C=C\C(=O)O Amb18642414 [0,0,0,0,0,1|0,0,3]=4 2805 B8R0.28 CC(C)=NNCC(=O)O Amb27958222 [0,0,0,0,0,1|1,0,1]=3 2806 B8R0.28 CC(C)=NOCC(=O)Cl Amb27466545 [0,0,0,0,0,1|2,0,1]=4 2807 B8R0.28 CC(C)=NOCC(N)=O Amb27613522 [0,0,0,0,0,1|2,0,1]=4 2808 B8R0.28 CC(C)C#CCC(=O)O Amb26516061 [0,0,0,0,0,1|0,0,1]=2 2809 B8R0.28 CC(C)CC#CC(=O)O Amb28398479 [0,0,0,0,0,1|0,0,1]=2 2810 B8R0.28 CC(C)CCCC(=N)N Amb23569433 [0,0,0,0,0,1|2,0,0]=3 2811 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [0,0,0,0,0,1|0,0,0]=1 2812 B8R0.28 CC(C)CCCC(C)Br Amb18330330 [0,0,0,0,0,1|2,0,1]=4 2813 B8R0.28 CC(C)CCCC(C)C Amb22228384 [0,0,0,0,0,1|2,0,1]=4 2814 B8R0.28 CC(C)CCCC(C)Cl Amb28435889 [0,0,0,0,0,1|2,0,1]=4 2815 B8R0.28 CC(C)CCCC(C)N Amb3939833 [0,0,0,0,0,1|2,0,1]=4 2816 B8R0.28 CC(C)CCCC(C)O Amb2721284 [0,0,0,0,0,1|1,0,1]=3 2817 B8R0.28 CC(C)CCCC(N)=S Amb28285193 [0,0,0,0,0,1|1,1,0]=3 2818 B8R0.28 CC(C)CCCP(O)O Amb27835938 [0,0,0,0,0,1|1,0,1]=3 2819 B8R0.28 CC(C)CCCS(=O)Cl Amb32720416 [0,0,0,0,0,1|2,0,0]=3 2820 B8R0.28 CC(C)CCCS(=O)[O-] Amb32754454 [0,0,0,0,0,1|1,0,1]=3 2821 B8R0.28 CC(C)CCCS(N)=O Amb32720417 [0,0,0,0,0,1|2,0,0]=3 2822 B8R0.28 CC(C)CCC[C@@H](C)N Amb22232273 [0,0,0,0,0,1|2,0,1]=4 2823 B8R0.28 CC(C)CCC[C@@H](C)O Amb22746847 [0,0,0,0,0,1|1,0,1]=3 2824 B8R0.28 CC(C)CCC[C@H](C)N Amb22225819 [0,0,0,0,0,1|2,0,1]=4 2825 B8R0.28 CC(C)CCC[C@H](C)O Amb28291294 [0,0,0,0,0,1|1,0,1]=3 2826 B8R0.28 CC(C)CCC[N+](=O)[O-] Amb33226988 [0,0,0,0,0,1|1,0,1]=3 2827 B8R0.28 CC(C)CCNC(=N)N Amb24524670 [0,0,0,0,0,1|2,0,0]=3 2828 B8R0.28 CC(C)CCNC(C)C Amb6247916 [0,0,0,0,0,1|2,0,1]=4 2829 B8R0.28 CC(C)CCNC(N)=O Amb1104833 [0,0,0,0,0,1|1,0,0]=2 2830 B8R0.28 CC(C)CCNC(N)=S Amb386166 [0,0,0,0,0,1|1,1,0]=3 2831 B8R0.28 CC(C)CCOC(=N)N Amb27169586 [0,0,0,0,0,1|2,0,0]=3 2832 B8R0.28 CC(C)CCOC(=O)Cl Amb27463593 [0,0,0,0,0,1|1,0,0]=2 2833 B8R0.28 CC(C)CCOC(=S)[S-] Amb13777309 [0,0,0,0,0,1|0,2,0]=3 2834 B8R0.28 CC(C)CCOC(C)Cl Amb25724972 [0,0,0,0,0,1|2,0,1]=4 2835 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [0,0,0,0,0,1|1,0,0]=2 2836 B8R0.28 CC(C)CCOS(=O)[O-] Amb24524507 [0,0,0,0,0,1|1,0,1]=3 2837 B8R0.28 CC(C)CCO[N+](=O)[O-] Amb2720793 [0,0,0,0,0,1|1,0,1]=3 2838 B8R0.28 CC(C)CCSC(=N)N Amb20676007 [0,0,0,0,0,1|2,0,0]=3 2839 B8R0.28 CC(C)CCSC(C)C Amb28291781 [0,0,0,0,0,1|2,0,1]=4 2840 B8R0.28 CC(C)CNCC(=O)O Amb19373106 [0,0,0,0,0,1|0,0,0]=1 2841 B8R0.28 CC(C)CNCC(=O)O Amb7766417 [0,0,0,0,0,1|0,0,0]=1 2842 B8R0.28 CC(C)CNCC(C)C Amb3938961 [0,0,0,0,0,1|2,0,1]=4 2843 B8R0.28 CC(C)CNCC(C)O Amb534459 [0,0,0,0,0,1|1,0,1]=3 2844 B8R0.28 CC(C)CNCC(F)F Amb27487770 [0,0,0,0,0,1|2,0,1]=4 2845 B8R0.28 CC(C)CNCC(N)=O Amb1118171 [0,0,0,0,0,1|1,0,0]=2 2846 B8R0.28 CC(C)CNCC(N)=O Amb6892556 [0,0,0,0,0,1|1,0,0]=2 2847 B8R0.28 CC(C)CNC[C@@H](C)N Amb28341760 [0,0,0,0,0,1|2,0,1]=4 2848 B8R0.28 CC(C)CNC[C@H](C)N Amb27956495 [0,0,0,0,0,1|2,0,1]=4 2849 B8R0.28 CC(C)CNNC(N)=S Amb27181155 [0,0,0,0,0,1|2,1,0]=4 2850 B8R0.28 CC(C)COCC(=O)O Amb2608476 [0,0,0,0,0,1|0,0,0]=1 2851 B8R0.28 CC(C)COCC(C)C Amb9787620 [0,0,0,0,0,1|2,0,1]=4 2852 B8R0.28 CC(C)COCC(C)N Amb13952731 [0,0,0,0,0,1|2,0,1]=4 2853 B8R0.28 CC(C)COCC(C)N Amb6660615 [0,0,0,0,0,1|2,0,1]=4 2854 B8R0.28 CC(C)COCC(C)O Amb9787471 [0,0,0,0,0,1|1,0,1]=3 2855 B8R0.28 CC(C)COCC(N)=S Amb6279156 [0,0,0,0,0,1|1,1,0]=3 2856 B8R0.28 CC(C)COC[C@@H](C)N Amb28146471 [0,0,0,0,0,1|2,0,1]=4 2857 B8R0.28 CC(C)COC[C@H](C)N Amb28285168 [0,0,0,0,0,1|2,0,1]=4 2858 B8R0.28 CC(C)CSCC(=O)O Amb1134811 [0,0,0,0,0,1|0,0,0]=1 2859 B8R0.28 CC(C)CSCC(C)N Amb28285127 [0,0,0,0,0,1|2,0,1]=4 2860 B8R0.28 CC(C)CSCC(C)O Amb27260857 [0,0,0,0,0,1|1,0,1]=3 2861 B8R0.28 CC(C)C[AlH3+]CC(C)C Amb20240962 [0,0,0,0,0,1|2,0,1]=4 2862 B8R0.28 CC(C)C\C=C\B(O)O Amb21856369 [0,0,0,0,0,1|1,0,2]=4 2863 B8R0.28 CC(C)C\C=C\C(=O)O Amb8392407 [0,0,0,0,0,1|0,0,1]=2 2864 B8R0.28 CC(C)C\C=C\[N+](=O)[O-] Amb32412856 [0,0,0,0,0,1|1,0,2]=4 2865 B8R0.28 CC(C)C\C=N\S(C)=O Amb35681170 [0,0,0,0,0,1|2,0,1]=4 2866 B8R0.28 CC(C)NCC=C(Cl)Cl Amb35684048 [0,0,0,0,0,1|2,0,1]=4 2867 B8R0.28 CC(C)NCCC(=O)O Amb1106349 [0,0,0,0,0,1|0,0,0]=1 2868 B8R0.28 CC(C)NCCC(=O)O Amb528114 [0,0,0,0,0,1|0,0,0]=1 2869 B8R0.28 CC(C)NCCC(N)=O Amb8841611 [0,0,0,0,0,1|1,0,0]=2 2870 B8R0.28 CC(C)NCCN(C)C Amb1111866 [0,0,0,0,0,1|3,0,0]=4 2871 B8R0.28 CC(C)NCCN(C)N Amb18642857 [0,0,0,0,0,1|3,0,0]=4 2872 B8R0.28 CC(C)NCCS(C)=O Amb27489425 [0,0,0,0,0,1|2,0,0]=3 2873 B8R0.28 CC(C)NCC[C@H](C)O Amb27829826 [0,0,0,0,0,1|1,0,1]=3 2874 B8R0.28 CC(C)NCC[PH](=O)O Amb28056178 [0,0,0,0,0,1|1,0,0]=2 2875 B8R0.28 CC(C)OCCC(=N)N Amb32674823 [0,0,0,0,0,1|2,0,0]=3 2876 B8R0.28 CC(C)OCCC(=N)N Amb6276326 [0,0,0,0,0,1|2,0,0]=3 2877 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [0,0,0,0,0,1|1,0,0]=2 2878 B8R0.28 CC(C)OCCC(=O)O Amb6260272 [0,0,0,0,0,1|0,0,0]=1 2879 B8R0.28 CC(C)OCCC(N)=S Amb6256598 [0,0,0,0,0,1|1,1,0]=3 2880 B8R0.28 CC(C)OCCN(C)C Amb27205777 [0,0,0,0,0,1|3,0,0]=4 2881 B8R0.28 CC(C)OCCN(C)N Amb28203943 [0,0,0,0,0,1|3,0,0]=4 2882 B8R0.28 CC(C)OCCN(C)O Amb33274847 [0,0,0,0,0,1|2,0,0]=3 2883 B8R0.28 CC(C)OCCS(=O)Cl Amb28286105 [0,0,0,0,0,1|2,0,0]=3 2884 B8R0.28 CC(C)OCCS(=O)[O-] Amb27476549 [0,0,0,0,0,1|1,0,1]=3 2885 B8R0.28 CC(C)OCCS(N)=O Amb32720491 [0,0,0,0,0,1|2,0,0]=3 2886 B8R0.28 CC(C)OCC[C@@H](C)N Amb27489790 [0,0,0,0,0,1|2,0,1]=4 2887 B8R0.28 CC(C)OCC[C@@H](C)O Amb28065212 [0,0,0,0,0,1|1,0,1]=3 2888 B8R0.28 CC(C)OCC[C@H](C)N Amb27264599 [0,0,0,0,0,1|2,0,1]=4 2889 B8R0.28 CC(C)OCC[C@H](C)O Amb25090046 [0,0,0,0,0,1|1,0,1]=3 2890 B8R0.28 CC(C)OCC[N+](=O)[O-] Amb33274121 [0,0,0,0,0,1|1,0,1]=3 2891 B8R0.28 CC(C)ONC[C@@H](C)O Amb27660025 [0,0,0,0,0,1|2,0,1]=4 2892 B8R0.28 CC(C)ONC[C@H](C)O Amb27434107 [0,0,0,0,0,1|2,0,1]=4 2893 B8R0.28 CC(C)SCCC(=N)N Amb27623018 [0,0,0,0,0,1|2,0,0]=3 2894 B8R0.28 CC(C)SCCC(=O)O Amb6267279 [0,0,0,0,0,1|0,0,0]=1 2895 B8R0.28 CC(C)SCCC(N)=S Amb17307561 [0,0,0,0,0,1|1,1,0]=3 2896 B8R0.28 CC(C)SCCN(C)C Amb27241372 [0,0,0,0,0,1|3,0,0]=4 2897 B8R0.28 CC(C)S\C=C\C(=O)O Amb27838559 [0,0,0,0,0,1|0,0,2]=3 2898 B8R0.28 CC(C)\C=C\CC(=O)O Amb17844074 [0,0,0,0,0,1|0,0,1]=2 2899 B8R0.28 CC(Cl)CCCC(=O)Cl Amb26491427 [0,0,0,0,0,1|2,0,0]=3 2900 B8R0.28 CC(Cl)CCCC(N)=O Amb27869185 [0,0,0,0,0,1|2,0,0]=3 2901 B8R0.28 CC(Cl)CCCS(C)=O Amb27627114 [0,0,0,0,0,1|3,0,0]=4 2902 B8R0.28 CC(Cl)CCNC(C)C Amb28254047 [0,0,0,0,0,1|2,0,1]=4 2903 B8R0.28 CC(Cl)CCOC(C)C Amb27454710 [0,0,0,0,0,1|2,0,1]=4 2904 B8R0.28 CC(F)CCCC(=O)O Amb28144031 [0,0,0,0,0,1|1,0,0]=2 2905 B8R0.28 CC(N)CCCC(=O)O Amb22059416 [0,0,0,0,0,1|1,0,0]=2 2906 B8R0.28 CC(N)CCCC(=O)O Amb28934990 [0,0,0,0,0,1|1,0,0]=2 2907 B8R0.28 CC(N)CCNC(C)C Amb19008024 [0,0,0,0,0,1|2,0,1]=4 2908 B8R0.28 CC(N)CCOC(C)C Amb19025758 [0,0,0,0,0,1|2,0,1]=4 2909 B8R0.28 CC(N)CSCC(=O)O Amb27221487 [0,0,0,0,0,1|1,0,0]=2 2910 B8R0.28 CC(N)C\C=C\C(=O)O Amb27863954 [0,0,0,0,0,1|1,0,1]=3 2911 B8R0.28 CC(O)CCC=C(Cl)Cl Amb35710409 [0,0,0,0,0,1|3,0,0]=4 2912 B8R0.28 CC(O)CCCB(O)O Amb24389636 [0,0,0,0,0,1|2,0,1]=4 2913 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [0,0,0,0,0,1|1,0,0]=2 2914 B8R0.28 CC(O)CCCC(=O)[O-] Amb17615415 [0,0,0,0,0,1|1,0,1]=3 2915 B8R0.28 CC(O)CCCC(N)=S Amb27265713 [0,0,0,0,0,1|2,1,0]=4 2916 B8R0.28 CC(O)CCCN(C)C Amb24271102 [0,0,0,0,0,1|2,0,1]=4 2917 B8R0.28 CC(O)CCNC(C)C Amb24117028 [0,0,0,0,0,1|1,0,1]=3 2918 B8R0.28 CC(O)CCNC(N)=S Amb27950544 [0,0,0,0,0,1|2,1,0]=4 2919 B8R0.28 CC(O)CCOC(C)C Amb28049548 [0,0,0,0,0,1|1,0,1]=3 2920 B8R0.28 CC(O)CNCC(=O)O Amb9359979 [0,0,0,0,0,1|1,0,0]=2 2921 B8R0.28 CC(O)CNCC(=O)[O-] Amb35789181 [0,0,0,0,0,1|1,0,1]=3 2922 B8R0.28 CC(O)CNCC(C)O Amb4036799 [0,0,0,0,0,1|2,0,1]=4 2923 B8R0.28 CC(O)CNC[C@H](C)O Amb27236687 [0,0,0,0,0,1|2,0,1]=4 2924 B8R0.28 CC(O)COCC(=O)O Amb27968624 [0,0,0,0,0,1|1,0,0]=2 2925 B8R0.28 CC(O)COCC(C)O Amb8516611 [0,0,0,0,0,1|2,0,1]=4 2926 B8R0.28 CC(O)COCC(N)=O Amb27216633 [0,0,0,0,0,1|2,0,0]=3 2927 B8R0.28 CC(O)COC[C@H](C)O Amb27470308 [0,0,0,0,0,1|2,0,1]=4 2928 B8R0.28 CC(O)CSCC(=O)O Amb19005278 [0,0,0,0,0,1|1,0,0]=2 2929 B8R0.28 CC(O)\C=C\CC(C)C Amb27242551 [0,0,0,0,0,1|1,0,2]=4 2930 B8R0.28 CN(C)CC#CC(=O)[O-] Amb33307179 [0,0,0,0,0,1|1,0,2]=4 2931 B8R0.28 CN(C)CCCB(O)O Amb24069054 [0,0,0,0,0,1|2,0,1]=4 2932 B8R0.28 CN(C)CCCC(=N)N Amb32751305 [0,0,0,0,0,1|3,0,0]=4 2933 B8R0.28 CN(C)CCCC(=N)N Amb6278287 [0,0,0,0,0,1|3,0,0]=4 2934 B8R0.28 CN(C)CCCC(=O)Cl Amb27450969 [0,0,0,0,0,1|2,0,0]=3 2935 B8R0.28 CN(C)CCCC(=O)Cl Amb32409435 [0,0,0,0,0,1|2,0,0]=3 2936 B8R0.28 CN(C)CCCC(=O)O Amb2716225 [0,0,0,0,0,1|1,0,0]=2 2937 B8R0.28 CN(C)CCCC(=O)O Amb9176338 [0,0,0,0,0,1|1,0,0]=2 2938 B8R0.28 CN(C)CCCC(N)=O Amb25887462 [0,0,0,0,0,1|2,0,0]=3 2939 B8R0.28 CN(C)CCCC(N)=S Amb6256460 [0,0,0,0,0,1|2,1,0]=4 2940 B8R0.28 CN(C)CCCN(C)O Amb33272648 [0,0,0,0,0,1|3,0,0]=4 2941 B8R0.28 CN(C)CCCS(=O)[O-] Amb32755542 [0,0,0,0,0,1|2,0,1]=4 2942 B8R0.28 CN(C)CCC[N+](=O)[O-] Amb26394292 [0,0,0,0,0,1|2,0,1]=4 2943 B8R0.28 CN(C)CCNC(=N)N Amb19515467 [0,0,0,0,0,1|3,0,0]=4 2944 B8R0.28 CN(C)CCNC(=S)S Amb22264565 [0,0,0,0,0,1|1,2,0]=4 2945 B8R0.28 CN(C)CCNC(=S)[S-] Amb32645851 [0,0,0,0,0,1|1,2,0]=4 2946 B8R0.28 CN(C)CCNC(N)=O Amb1129425 [0,0,0,0,0,1|2,0,0]=3 2947 B8R0.28 CN(C)CCNC(N)=O Amb33552131 [0,0,0,0,0,1|2,0,0]=3 2948 B8R0.28 CN(C)CCNC(N)=S Amb8485796 [0,0,0,0,0,1|2,1,0]=4 2949 B8R0.28 CN(C)CCNC(O)=S Amb25106929 [0,0,0,0,0,1|1,1,0]=3 2950 B8R0.28 CN(C)CCOC(=N)N Amb26930420 [0,0,0,0,0,1|3,0,0]=4 2951 B8R0.28 CN(C)CCOC(=S)[S-] Amb20671933 [0,0,0,0,0,1|1,2,0]=4 2952 B8R0.28 CN(C)CCOC(N)=O Amb28423955 [0,0,0,0,0,1|2,0,0]=3 2953 B8R0.28 CN(C)CCSC(=N)N Amb25314717 [0,0,0,0,0,1|3,0,0]=4 2954 B8R0.28 CN(C)C\C=C/C(=O)O Amb26347338 [0,0,0,0,0,1|1,0,1]=3 2955 B8R0.28 CN(C)C\C=C/C(=O)[O-] Amb32674754 [0,0,0,0,0,1|1,0,2]=4 2956 B8R0.28 CN(C)C\C=C\C(=O)Cl Amb32666591 [0,0,0,0,0,1|2,0,1]=4 2957 B8R0.28 CN(C)C\C=C\C(=O)Cl Amb32666795 [0,0,0,0,0,1|2,0,1]=4 2958 B8R0.28 CN(C)C\C=C\C(=O)O Amb15695416 [0,0,0,0,0,1|1,0,1]=3 2959 B8R0.28 CN(C)C\C=C\C(=O)O Amb33716600 [0,0,0,0,0,1|1,0,1]=3 2960 B8R0.28 CN(C)C\C=C\C(=O)O Amb8395946 [0,0,0,0,0,1|1,0,1]=3 2961 B8R0.28 CN(C)C\C=C\C(N)=O Amb24476695 [0,0,0,0,0,1|2,0,1]=4 2962 B8R0.28 CN(C)NCCC(N)=O Amb28072486 [0,0,0,0,0,1|2,0,0]=3 2963 B8R0.28 CN(C)NCCS(C)=O Amb27795934 [0,0,0,0,0,1|3,0,0]=4 2964 B8R0.28 CS(=O)CCNC(=O)Cl Amb35633190 [0,0,0,0,0,1|3,0,0]=4 2965 B8R0.28 C[C@@H](O)CCCN(C)C Amb33272247 [0,0,0,0,0,1|2,0,1]=4 2966 B8R0.28 C[C@@H](O)CCC[C@@H](C)O Amb4166306 [0,0,0,0,0,1|2,0,1]=4 2967 B8R0.28 C[C@@H](O)CCNC(=N)N Amb28063422 [0,0,0,0,0,1|3,0,0]=4 2968 B8R0.28 C[C@H](N)C\C=C\C(=O)O Amb27784845 [0,0,0,0,0,1|1,0,1]=3 2969 B8R0.28 C[C@H](N)\C=C\CC(=O)O Amb28044026 [0,0,0,0,0,1|1,0,1]=3 2970 B8R0.28 C[C@H](O)CCCN(C)C Amb33272243 [0,0,0,0,0,1|2,0,1]=4 2971 B8R0.28 C[C@H](O)CCNC(=N)N Amb27211779 [0,0,0,0,0,1|3,0,0]=4 2972 B8R0.28 C[C@H](O)CNCC(N)=O Amb27879357 [0,0,0,0,0,1|2,0,0]=3 2973 B8R0.28 C[C@H](O)COC[C@H](C)O Amb27662102 [0,0,0,0,0,1|2,0,1]=4 2974 B8R0.28 C[C@H](O)CSC[C@H](C)O Amb27603289 [0,0,0,0,0,1|2,0,1]=4 2975 B8R0.28 C[C@H](O)C\C=C\C(=O)O Amb27812394 [0,0,0,0,0,1|1,0,1]=3 2976 B8R0.28 C[NH+](C)CCCC(=O)O Amb9786711 [0,0,0,0,0,1|1,0,0]=2 2977 B8R0.28 C\C(Br)=C/CCC(C)C Amb8389870 [0,0,0,0,0,1|2,0,0]=3 2978 B8R0.28 C\C(Cl)=C\CCC(C)O Amb27653025 [0,0,0,0,0,1|3,0,0]=4 2979 B8R0.28 N=C(N)CSCC(=O)O Amb28040821 [0,0,0,0,0,1|2,0,1]=4 2980 B8R0.28 N=C(N)NCCC(=O)O Amb3940732 [0,0,0,0,0,1|2,0,1]=4 2981 B8R0.28 N=C(N)SCCC(=O)O Amb1043190 [0,0,0,0,0,1|2,0,1]=4 2982 B8R0.28 NC(=O)CCCC(=O)O Amb5718388 [0,0,0,0,0,1|2,0,1]=4 2983 B8R0.28 NC(=O)CCSC(F)F Amb27809296 [0,0,0,0,0,1|3,0,0]=4 2984 B8R0.28 NC(=O)COCC(=O)O Amb3429648 [0,0,0,0,0,1|2,0,1]=4 2985 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [0,0,0,0,0,1|2,0,1]=4 2986 B8R0.28 NC(=O)NCCC(=O)O Amb6567400 [0,0,0,0,0,1|2,0,1]=4 2987 B8R0.28 NC(=O)SCCC(=O)O Amb28340935 [0,0,0,0,0,1|2,0,1]=4 2988 B8R0.28 NC(=S)CCCC(=O)O Amb27956588 [0,0,0,0,0,1|2,0,1]=4 2989 B8R0.28 NC(=S)NCCC(=O)O Amb27815302 [0,0,0,0,0,1|2,0,1]=4 2990 B8R0.28 NC(=S)SCCC(=O)O Amb4007391 [0,0,0,0,0,1|2,0,1]=4 2991 B8R0.28 O=C(Cl)NCCC(F)F Amb35625886 [0,0,0,0,0,1|3,0,0]=4 2992 B8R0.28 O=C(O)CCCC(=O)O Amb4037276 [0,0,0,0,0,1|2,0,1]=4 2993 B8R0.28 O=C(O)CCCC(F)F Amb24117996 [0,0,0,0,0,1|2,0,0]=3 2994 B8R0.28 O=C(O)CCCN(Cl)Cl Amb28313437 [0,0,0,0,0,1|3,0,0]=4 2995 B8R0.28 O=C(O)CCC[N+](=O)[O-] Amb24711043 [0,0,0,0,0,1|3,0,0]=4 2996 B8R0.28 O=C(O)CCO[N+](=O)[O-] Amb21953424 [0,0,0,0,0,1|3,0,0]=4 2997 B8R0.28 O=C(O)CCSC(F)F Amb8840854 [0,0,0,0,0,1|2,0,0]=3 2998 B8R0.28 O=C(O)CNCC(=O)O Amb3940364 [0,0,0,0,0,1|2,0,1]=4 2999 B8R0.28 O=C(O)COCC(=O)O Amb4433967 [0,0,0,0,0,1|2,0,1]=4 3000 B8R0.28 O=C(O)COCC(F)F Amb27218102 [0,0,0,0,0,1|2,0,0]=3 3001 B8R0.28 O=C(O)CSCC(=O)O Amb6608738 [0,0,0,0,0,1|2,0,1]=4 3002 B8R0.28 O=C(O)CSCC(F)F Amb18791606 [0,0,0,0,0,1|2,0,0]=3 3003 B8R0.28 O=C([O-])COCC(=O)O Amb9787328 [0,0,0,0,0,1|2,0,1]=4 3004 B5R0.1 BC(=O)NCC Amb27430059 [2,0,0,0,0,0|2,0,0]=4 3005 B5R0.1 C#CCC(=O)O Amb33532662 [2,0,0,0,0,0|0,0,2]=4 3006 B5R0.1 C#CCC(C)C Amb3941531 [2,0,0,0,0,0|0,0,2]=4 3007 B5R0.1 C#NCC(C)C Amb31132436 [2,0,0,0,0,0|1,0,1]=4 3008 B5R0.1 C=C(C)CC=O Amb28202583 [2,0,0,0,0,0|0,0,2]=4 3009 B5R0.1 C=C(C)CCC Amb8513259 [2,0,0,0,0,0|2,0,0]=4 3010 B5R0.1 C=C(C)CCO Amb34916534 [2,0,0,0,0,0|0,0,2]=4 3011 B5R0.1 C=C(C)CCO Amb8513522 [2,0,0,0,0,0|0,0,2]=4 3012 B5R0.1 C=CCC(=O)O Amb3940098 [2,0,0,0,0,0|0,0,2]=4 3013 B5R0.1 C=CCC(C)Br Amb26870150 [2,0,0,0,0,0|1,0,1]=4 3014 B5R0.1 C=CCC(C)C Amb8513260 [2,0,0,0,0,0|0,0,1]=3 3015 B5R0.1 C=CCC(C)Cl Amb26588784 [2,0,0,0,0,0|1,0,1]=4 3016 B5R0.1 C=CCC(C)N Amb17673480 [2,0,0,0,0,0|1,0,1]=4 3017 B5R0.1 C=CCC(C)N Amb19515336 [2,0,0,0,0,0|1,0,1]=4 3018 B5R0.1 C=CCC(C)O Amb33539328 [2,0,0,0,0,0|1,0,1]=4 3019 B5R0.1 C=CC[C@@H](C)O Amb22225370 [2,0,0,0,0,0|1,0,1]=4 3020 B5R0.1 C=CC[C@H](C)N Amb28315904 [2,0,0,0,0,0|1,0,1]=4 3021 B5R0.1 C=CC[C@H](C)O Amb22226758 [2,0,0,0,0,0|1,0,1]=4 3022 B5R0.1 C=CNC(C)C Amb28075363 [2,0,0,0,0,0|1,0,1]=4 3023 B5R0.1 C=COC(C)C Amb22230777 [2,0,0,0,0,0|1,0,1]=4 3024 B5R0.1 CC#CC(=O)O Amb2685714 [2,0,0,0,0,0|0,0,2]=4 3025 B5R0.1 CC(=O)CCBr Amb24078246 [2,0,0,0,0,0|2,0,0]=4 3026 B5R0.1 CC(=O)CCCl Amb2720823 [2,0,0,0,0,0|2,0,0]=4 3027 B5R0.1 CC(=O)CCF Amb26427773 [2,0,0,0,0,0|2,0,0]=4 3028 B5R0.1 CC(=O)CCN Amb18632933 [2,0,0,0,0,0|2,0,0]=4 3029 B5R0.1 CC(=O)CCN Amb33544540 [2,0,0,0,0,0|2,0,0]=4 3030 B5R0.1 CC(=O)CCO Amb836357 [2,0,0,0,0,0|1,0,1]=4 3031 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [2,0,0,0,0,0|2,0,0]=4 3032 B5R0.1 CC(Br)CCBr Amb8513667 [2,0,0,0,0,0|2,0,0]=4 3033 B5R0.1 CC(Br)CCCl Amb27613510 [2,0,0,0,0,0|2,0,0]=4 3034 B5R0.1 CC(Br)CCF Amb28255100 [2,0,0,0,0,0|2,0,0]=4 3035 B5R0.1 CC(C)=CC=O Amb8385061 [2,0,0,0,0,0|0,0,2]=4 3036 B5R0.1 CC(C)=CCO Amb4605830 [2,0,0,0,0,0|0,0,2]=4 3037 B5R0.1 CC(C)C=C=O Amb27858445 [2,0,0,0,0,0|0,0,2]=4 3038 B5R0.1 CC(C)CC#N Amb1162737 [2,0,0,0,0,0|1,0,1]=4 3039 B5R0.1 CC(C)CC=O Amb3939851 [2,0,0,0,0,0|0,0,0]=2 3040 B5R0.1 CC(C)CCBr Amb2795762 [2,0,0,0,0,0|1,0,0]=3 3041 B5R0.1 CC(C)CCCl Amb3941523 [2,0,0,0,0,0|1,0,0]=3 3042 B5R0.1 CC(C)CCI Amb6296701 [2,0,0,0,0,0|1,0,0]=3 3043 B5R0.1 CC(C)CCN Amb22337707 [2,0,0,0,0,0|1,0,0]=3 3044 B5R0.1 CC(C)CCN Amb3939010 [2,0,0,0,0,0|1,0,0]=3 3045 B5R0.1 CC(C)CCO Amb4605831 [2,0,0,0,0,0|0,0,0]=2 3046 B5R0.1 CC(C)CCS Amb8513472 [2,0,0,0,0,0|0,1,0]=3 3047 B5R0.1 CC(C)CNN Amb1105732 [2,0,0,0,0,0|2,0,0]=4 3048 B5R0.1 CC(C)CNN Amb22886984 [2,0,0,0,0,0|2,0,0]=4 3049 B5R0.1 CC(C)CNN Amb2691317 [2,0,0,0,0,0|2,0,0]=4 3050 B5R0.1 CC(C)CNO Amb25887512 [2,0,0,0,0,0|1,0,0]=3 3051 B5R0.1 CC(C)CON Amb19889788 [2,0,0,0,0,0|2,0,0]=4 3052 B5R0.1 CC(C)CON Amb2819061 [2,0,0,0,0,0|2,0,0]=4 3053 B5R0.1 CC(C)N=C=O Amb3939055 [2,0,0,0,0,0|1,0,1]=4 3054 B5R0.1 CC(C)NC=O Amb4017634 [2,0,0,0,0,0|1,0,0]=3 3055 B5R0.1 CC(C)NC=S Amb28049627 [2,0,0,0,0,0|1,1,0]=4 3056 B5R0.1 CC(C)OC=N Amb22337834 [2,0,0,0,0,0|2,0,0]=4 3057 B5R0.1 CC(C)OC=O Amb9787311 [2,0,0,0,0,0|1,0,0]=3 3058 B5R0.1 CC(C)OCCl Amb33545059 [2,0,0,0,0,0|2,0,0]=4 3059 B5R0.1 CC(C)OCN Amb28315690 [2,0,0,0,0,0|2,0,0]=4 3060 B5R0.1 CC(C)ON=O Amb17938692 [2,0,0,0,0,0|2,0,0]=4 3061 B5R0.1 CC(C)SCCl Amb25807978 [2,0,0,0,0,0|2,0,0]=4 3062 B5R0.1 CC(C)\C=N\O Amb2455920 [2,0,0,0,0,0|1,0,1]=4 3063 B5R0.1 CC(Cl)CCBr Amb27412989 [2,0,0,0,0,0|2,0,0]=4 3064 B5R0.1 CC(Cl)CCF Amb27657075 [2,0,0,0,0,0|2,0,0]=4 3065 B5R0.1 CC(Cl)CCN Amb28383162 [2,0,0,0,0,0|2,0,0]=4 3066 B5R0.1 CC(Cl)CCO Amb27625144 [2,0,0,0,0,0|1,0,0]=3 3067 B5R0.1 CC(F)CC=O Amb28051612 [2,0,0,0,0,0|1,0,0]=3 3068 B5R0.1 CC(F)CCBr Amb27955878 [2,0,0,0,0,0|2,0,0]=4 3069 B5R0.1 CC(F)CCCl Amb28315660 [2,0,0,0,0,0|2,0,0]=4 3070 B5R0.1 CC(F)CCI Amb25146599 [2,0,0,0,0,0|2,0,0]=4 3071 B5R0.1 CC(F)CCN Amb26081186 [2,0,0,0,0,0|2,0,0]=4 3072 B5R0.1 CC(F)CCN Amb32653508 [2,0,0,0,0,0|2,0,0]=4 3073 B5R0.1 CC(F)CCO Amb21951900 [2,0,0,0,0,0|1,0,0]=3 3074 B5R0.1 CC(N)CCCl Amb26959021 [2,0,0,0,0,0|2,0,0]=4 3075 B5R0.1 CC(N)CCCl Amb32670914 [2,0,0,0,0,0|2,0,0]=4 3076 B5R0.1 CC(N)CCF Amb25811370 [2,0,0,0,0,0|2,0,0]=4 3077 B5R0.1 CC(N)CCN Amb18951361 [2,0,0,0,0,0|2,0,0]=4 3078 B5R0.1 CC(N)CCN Amb19338152 [2,0,0,0,0,0|2,0,0]=4 3079 B5R0.1 CC(N)CCO Amb2697504 [2,0,0,0,0,0|1,0,0]=3 3080 B5R0.1 CC(N)CCO Amb32666060 [2,0,0,0,0,0|1,0,0]=3 3081 B5R0.1 CC(N)CCS Amb28049414 [2,0,0,0,0,0|1,1,0]=4 3082 B5R0.1 CC(O)CC=O Amb4036424 [2,0,0,0,0,0|1,0,0]=3 3083 B5R0.1 CC(O)CCBr Amb33548043 [2,0,0,0,0,0|2,0,0]=4 3084 B5R0.1 CC(O)CCCl Amb24551052 [2,0,0,0,0,0|2,0,0]=4 3085 B5R0.1 CC(O)CCF Amb26449397 [2,0,0,0,0,0|2,0,0]=4 3086 B5R0.1 CC(O)CCN Amb32666140 [2,0,0,0,0,0|2,0,0]=4 3087 B5R0.1 CC(O)CCN Amb33537908 [2,0,0,0,0,0|2,0,0]=4 3088 B5R0.1 CC(O)CCO Amb6608662 [2,0,0,0,0,0|1,0,0]=3 3089 B5R0.1 CC(O)NC=O Amb28049622 [2,0,0,0,0,0|2,0,0]=4 3090 B5R0.1 CC(S)CCN Amb18908261 [2,0,0,0,0,0|2,0,0]=4 3091 B5R0.1 CC(S)CCN Amb32675067 [2,0,0,0,0,0|2,0,0]=4 3092 B5R0.1 CC(S)CCO Amb19148316 [2,0,0,0,0,0|1,0,0]=3 3093 B5R0.1 CC(S)CCS Amb22227722 [2,0,0,0,0,0|1,1,0]=4 3094 B5R0.1 CCCB(O)O Amb2447105 [2,0,0,0,0,0|1,0,1]=4 3095 B5R0.1 CCCC(=N)N Amb10610381 [2,0,0,0,0,0|2,0,0]=4 3096 B5R0.1 CCCC(=N)N Amb2695914 [2,0,0,0,0,0|2,0,0]=4 3097 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,0]=3 3098 B5R0.1 CCCC(=O)Cl Amb2792903 [2,0,0,0,0,0|1,0,0]=3 3099 B5R0.1 CCCC(=O)O Amb3939012 [2,0,0,0,0,0|0,0,0]=2 3100 B5R0.1 CCCC(=O)[O-] Amb8514901 [2,0,0,0,0,0|0,0,1]=3 3101 B5R0.1 CCCC(=S)Cl Amb24626931 [2,0,0,0,0,0|1,1,0]=4 3102 B5R0.1 CCCC(C)=O Amb6608910 [2,0,0,0,0,0|1,0,0]=3 3103 B5R0.1 CCCC(C)Br Amb3940201 [2,0,0,0,0,0|1,0,1]=4 3104 B5R0.1 CCCC(C)Cl Amb4018346 [2,0,0,0,0,0|1,0,1]=4 3105 B5R0.1 CCCC(C)I Amb17939400 [2,0,0,0,0,0|1,0,1]=4 3106 B5R0.1 CCCC(C)N Amb10609075 [2,0,0,0,0,0|1,0,1]=4 3107 B5R0.1 CCCC(C)N Amb3941259 [2,0,0,0,0,0|1,0,1]=4 3108 B5R0.1 CCCC(C)O Amb4605839 [2,0,0,0,0,0|1,0,1]=4 3109 B5R0.1 CCCC(C)S Amb7784731 [2,0,0,0,0,0|1,0,1]=4 3110 B5R0.1 CCCC(N)=O Amb3886524 [2,0,0,0,0,0|1,0,0]=3 3111 B5R0.1 CCCC(N)=S Amb6245403 [2,0,0,0,0,0|1,1,0]=4 3112 B5R0.1 CCCC(N)=[NH2+] Amb8384484 [2,0,0,0,0,0|2,0,0]=4 3113 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|0,1,0]=3 3114 B5R0.1 CCCC(O)Cl Amb22552567 [2,0,0,0,0,0|1,0,1]=4 3115 B5R0.1 CCCC(O)O Amb26364594 [2,0,0,0,0,0|0,0,2]=4 3116 B5R0.1 CCCN(C)C Amb22733186 [2,0,0,0,0,0|1,0,1]=4 3117 B5R0.1 CCCN(C)O Amb25024622 [2,0,0,0,0,0|2,0,0]=4 3118 B5R0.1 CCCS(=O)Cl Amb25025566 [2,0,0,0,0,0|2,0,0]=4 3119 B5R0.1 CCCS(=O)[O-] Amb19929119 [2,0,0,0,0,0|1,0,1]=4 3120 B5R0.1 CCCS(N)=O Amb24733579 [2,0,0,0,0,0|2,0,0]=4 3121 B5R0.1 CCC[C@@H](C)N Amb22898992 [2,0,0,0,0,0|1,0,1]=4 3122 B5R0.1 CCC[C@@H](C)N Amb23439500 [2,0,0,0,0,0|1,0,1]=4 3123 B5R0.1 CCC[C@@H](C)O Amb8628178 [2,0,0,0,0,0|1,0,1]=4 3124 B5R0.1 CCC[C@@H](N)O Amb28074861 [2,0,0,0,0,0|1,0,1]=4 3125 B5R0.1 CCC[C@H](C)Br Amb27650565 [2,0,0,0,0,0|1,0,1]=4 3126 B5R0.1 CCC[C@H](C)N Amb21618754 [2,0,0,0,0,0|1,0,1]=4 3127 B5R0.1 CCC[C@H](C)N Amb31204590 [2,0,0,0,0,0|1,0,1]=4 3128 B5R0.1 CCC[C@H](C)O Amb8389338 [2,0,0,0,0,0|1,0,1]=4 3129 B5R0.1 CCC[N+](=O)[O-] Amb8513268 [2,0,0,0,0,0|1,0,1]=4 3130 B5R0.1 CCNC(=O)Cl Amb25791793 [2,0,0,0,0,0|2,0,0]=4 3131 B5R0.1 CCNC(C)=O Amb2780415 [2,0,0,0,0,0|2,0,0]=4 3132 B5R0.1 CCNC(C)C Amb3938992 [2,0,0,0,0,0|1,0,1]=4 3133 B5R0.1 CCNC(N)=O Amb6608844 [2,0,0,0,0,0|2,0,0]=4 3134 B5R0.1 CCOC(=O)Cl Amb2793045 [2,0,0,0,0,0|2,0,0]=4 3135 B5R0.1 CCOC(=O)O Amb8393208 [2,0,0,0,0,0|1,0,0]=3 3136 B5R0.1 CCOC(C)=O Amb3940488 [2,0,0,0,0,0|2,0,0]=4 3137 B5R0.1 CCOC(C)C Amb22230687 [2,0,0,0,0,0|1,0,1]=4 3138 B5R0.1 CCOC(N)=O Amb6608672 [2,0,0,0,0,0|2,0,0]=4 3139 B5R0.1 CCO[PH](=O)O Amb22360741 [2,0,0,0,0,0|2,0,0]=4 3140 B5R0.1 CCO[Si](=O)O Amb26569259 [2,0,0,0,0,0|1,1,0]=4 3141 B5R0.1 CCSC(=O)Cl Amb8516064 [2,0,0,0,0,0|2,0,0]=4 3142 B5R0.1 CCSC(C)C Amb22731934 [2,0,0,0,0,0|1,0,1]=4 3143 B5R0.1 CN(Br)CCO Amb27405311 [2,0,0,0,0,0|2,0,0]=4 3144 B5R0.1 CN(C)CC=O Amb22002191 [2,0,0,0,0,0|1,0,0]=3 3145 B5R0.1 CN(C)CC=O Amb22491245 [2,0,0,0,0,0|1,0,0]=3 3146 B5R0.1 CN(C)CCBr Amb10603116 [2,0,0,0,0,0|2,0,0]=4 3147 B5R0.1 CN(C)CCBr Amb10608907 [2,0,0,0,0,0|2,0,0]=4 3148 B5R0.1 CN(C)CCCl Amb1152528 [2,0,0,0,0,0|2,0,0]=4 3149 B5R0.1 CN(C)CCCl Amb22233801 [2,0,0,0,0,0|2,0,0]=4 3150 B5R0.1 CN(C)CCCl Amb2519363 [2,0,0,0,0,0|2,0,0]=4 3151 B5R0.1 CN(C)CCF Amb27861975 [2,0,0,0,0,0|2,0,0]=4 3152 B5R0.1 CN(C)CCI Amb26601022 [2,0,0,0,0,0|2,0,0]=4 3153 B5R0.1 CN(C)CCI Amb32670598 [2,0,0,0,0,0|2,0,0]=4 3154 B5R0.1 CN(C)CCI Amb35781981 [2,0,0,0,0,0|2,0,0]=4 3155 B5R0.1 CN(C)CCN Amb2720698 [2,0,0,0,0,0|2,0,0]=4 3156 B5R0.1 CN(C)CCO Amb2793033 [2,0,0,0,0,0|1,0,0]=3 3157 B5R0.1 CN(C)CCS Amb7764632 [2,0,0,0,0,0|1,1,0]=4 3158 B5R0.1 CN(C)CCS Amb8513139 [2,0,0,0,0,0|1,1,0]=4 3159 B5R0.1 CN(C)NC=O Amb1930732 [2,0,0,0,0,0|2,0,0]=4 3160 B5R0.1 CN(Cl)CCO Amb27457982 [2,0,0,0,0,0|2,0,0]=4 3161 B5R0.1 CN(N)CCO Amb28400197 [2,0,0,0,0,0|2,0,0]=4 3162 B5R0.1 CNCC(=O)O Amb6298808 [2,0,0,0,0,0|1,0,0]=3 3163 B5R0.1 CNCC(=O)O Amb6599996 [2,0,0,0,0,0|1,0,0]=3 3164 B5R0.1 CNCC(=O)[O-] Amb20246714 [2,0,0,0,0,0|1,0,1]=4 3165 B5R0.1 CNCC(C)=O Amb17621974 [2,0,0,0,0,0|2,0,0]=4 3166 B5R0.1 CNCC(C)=O Amb21959975 [2,0,0,0,0,0|2,0,0]=4 3167 B5R0.1 CNCC(C)C Amb1119103 [2,0,0,0,0,0|1,0,1]=4 3168 B5R0.1 CNCC(C)C Amb13951443 [2,0,0,0,0,0|1,0,1]=4 3169 B5R0.1 CNCC(N)=O Amb19134307 [2,0,0,0,0,0|2,0,0]=4 3170 B5R0.1 CNCC(N)=O Amb3940074 [2,0,0,0,0,0|2,0,0]=4 3171 B5R0.1 CNCC(N)=O Amb9151172 [2,0,0,0,0,0|2,0,0]=4 3172 B5R0.1 COCC(=O)Cl Amb3939326 [2,0,0,0,0,0|2,0,0]=4 3173 B5R0.1 COCC(=O)O Amb3939876 [2,0,0,0,0,0|1,0,0]=3 3174 B5R0.1 COCC(C)=O Amb8513767 [2,0,0,0,0,0|2,0,0]=4 3175 B5R0.1 COCC(C)C Amb26897702 [2,0,0,0,0,0|1,0,1]=4 3176 B5R0.1 COCC(N)=O Amb1153776 [2,0,0,0,0,0|2,0,0]=4 3177 B5R0.1 CS(=O)CCO Amb28075364 [2,0,0,0,0,0|2,0,0]=4 3178 B5R0.1 CSCC(=O)Cl Amb24528357 [2,0,0,0,0,0|2,0,0]=4 3179 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|1,0,0]=3 3180 B5R0.1 CSCC(C)=O Amb20621731 [2,0,0,0,0,0|2,0,0]=4 3181 B5R0.1 CSCC(N)=O Amb19515874 [2,0,0,0,0,0|2,0,0]=4 3182 B5R0.1 C[C@@H](N)CCF Amb33481445 [2,0,0,0,0,0|2,0,0]=4 3183 B5R0.1 C[C@@H](N)CCO Amb19515999 [2,0,0,0,0,0|1,0,0]=3 3184 B5R0.1 C[C@@H](N)CCO Amb22746127 [2,0,0,0,0,0|1,0,0]=3 3185 B5R0.1 C[C@@H](O)CCBr Amb27392288 [2,0,0,0,0,0|2,0,0]=4 3186 B5R0.1 C[C@@H](O)CCF Amb33376906 [2,0,0,0,0,0|2,0,0]=4 3187 B5R0.1 C[C@@H](O)CCI Amb27594639 [2,0,0,0,0,0|2,0,0]=4 3188 B5R0.1 C[C@@H](O)CCN Amb22736702 [2,0,0,0,0,0|2,0,0]=4 3189 B5R0.1 C[C@@H](O)CCN Amb28555327 [2,0,0,0,0,0|2,0,0]=4 3190 B5R0.1 C[C@@H](O)CCO Amb4166294 [2,0,0,0,0,0|1,0,0]=3 3191 B5R0.1 C[C@@H](S)CCO Amb27255216 [2,0,0,0,0,0|1,0,0]=3 3192 B5R0.1 C[C@H](F)CCBr Amb28291619 [2,0,0,0,0,0|2,0,0]=4 3193 B5R0.1 C[C@H](F)CCO Amb28428651 [2,0,0,0,0,0|1,0,0]=3 3194 B5R0.1 C[C@H](N)CCF Amb33481439 [2,0,0,0,0,0|2,0,0]=4 3195 B5R0.1 C[C@H](N)CCO Amb19515998 [2,0,0,0,0,0|1,0,0]=3 3196 B5R0.1 C[C@H](N)CCO Amb24055217 [2,0,0,0,0,0|1,0,0]=3 3197 B5R0.1 C[C@H](O)CC=O Amb27595676 [2,0,0,0,0,0|1,0,0]=3 3198 B5R0.1 C[C@H](O)CCBr Amb28367228 [2,0,0,0,0,0|2,0,0]=4 3199 B5R0.1 C[C@H](O)CCF Amb33376900 [2,0,0,0,0,0|2,0,0]=4 3200 B5R0.1 C[C@H](O)CCN Amb22736705 [2,0,0,0,0,0|2,0,0]=4 3201 B5R0.1 C[C@H](O)CCN Amb34159890 [2,0,0,0,0,0|2,0,0]=4 3202 B5R0.1 C[C@H](O)CCO Amb4166300 [2,0,0,0,0,0|1,0,0]=3 3203 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [2,0,0,0,0,0|2,0,0]=4 3204 B5R0.1 C[S+](C)CCCl Amb22496543 [2,0,0,0,0,0|2,0,0]=4 3205 B5R0.1 C\C=C/C(=O)O Amb27779315 [2,0,0,0,0,0|0,0,2]=4 3206 B5R0.1 C\C=C/C(C)C Amb20618870 [2,0,0,0,0,0|1,0,1]=4 3207 B5R0.1 C\C=C\C(=O)O Amb8385856 [2,0,0,0,0,0|0,0,2]=4 3208 B5R0.1 C\C=C\C(C)C Amb4019538 [2,0,0,0,0,0|1,0,1]=4 3209 B5R0.1 N#CCC(=O)O Amb2609022 [2,0,0,0,0,0|1,0,1]=4 3210 B5R0.1 NC(=O)CCBr Amb21618712 [2,0,0,0,0,0|2,0,0]=4 3211 B5R0.1 NC(=O)CCCl Amb1127569 [2,0,0,0,0,0|2,0,0]=4 3212 B5R0.1 NC(=O)CCF Amb28289353 [2,0,0,0,0,0|2,0,0]=4 3213 B5R0.1 NC(=O)CCI Amb27966778 [2,0,0,0,0,0|2,0,0]=4 3214 B5R0.1 NC(=O)CCO Amb9421407 [2,0,0,0,0,0|2,0,0]=4 3215 B5R0.1 NC(=O)CCS Amb27154802 [2,0,0,0,0,0|2,0,0]=4 3216 B5R0.1 NC(O)CCO Amb28252327 [2,0,0,0,0,0|2,0,0]=4 3217 B5R0.1 NCCC(=O)Cl Amb24117140 [2,0,0,0,0,0|2,0,0]=4 3218 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|1,0,0]=3 3219 B5R0.1 NCCC(=O)[O-] Amb28991330 [2,0,0,0,0,0|1,0,1]=4 3220 B5R0.1 NCCC(N)=O Amb1137251 [2,0,0,0,0,0|2,0,0]=4 3221 B5R0.1 NCCC(N)=O Amb9147573 [2,0,0,0,0,0|2,0,0]=4 3222 B5R0.1 NCCS(=O)O Amb6600043 [2,0,0,0,0,0|2,0,0]=4 3223 B5R0.1 NCC[PH](=O)O Amb22168066 [2,0,0,0,0,0|2,0,0]=4 3224 B5R0.1 NCC[PH](=O)O Amb35788864 [2,0,0,0,0,0|2,0,0]=4 3225 B5R0.1 NNCC(=O)O Amb32751165 [2,0,0,0,0,0|2,0,0]=4 3226 B5R0.1 NNCC(=O)O Amb6740299 [2,0,0,0,0,0|2,0,0]=4 3227 B5R0.1 NOCC(=O)O Amb1154237 [2,0,0,0,0,0|2,0,0]=4 3228 B5R0.1 NOCC(=O)O Amb4324355 [2,0,0,0,0,0|2,0,0]=4 3229 B5R0.1 NOCC(=O)O Amb8513076 [2,0,0,0,0,0|2,0,0]=4 3230 B5R0.1 O=C(Br)CCBr Amb24624022 [2,0,0,0,0,0|2,0,0]=4 3231 B5R0.1 O=C(Cl)CCBr Amb3941484 [2,0,0,0,0,0|2,0,0]=4 3232 B5R0.1 O=C(Cl)CCCl Amb3939313 [2,0,0,0,0,0|2,0,0]=4 3233 B5R0.1 O=C(Cl)CCF Amb27148631 [2,0,0,0,0,0|2,0,0]=4 3234 B5R0.1 O=C(Cl)CCI Amb28454579 [2,0,0,0,0,0|2,0,0]=4 3235 B5R0.1 O=C(Cl)CCO Amb27270014 [2,0,0,0,0,0|2,0,0]=4 3236 B5R0.1 O=C(F)CCCl Amb27257545 [2,0,0,0,0,0|2,0,0]=4 3237 B5R0.1 O=C(O)CCBr Amb2685479 [2,0,0,0,0,0|1,0,0]=3 3238 B5R0.1 O=C(O)CCCl Amb5395408 [2,0,0,0,0,0|1,0,0]=3 3239 B5R0.1 O=C(O)CCF Amb10603694 [2,0,0,0,0,0|1,0,0]=3 3240 B5R0.1 O=C(O)CCI Amb2688882 [2,0,0,0,0,0|1,0,0]=3 3241 B5R0.1 O=C(O)CCO Amb2688785 [2,0,0,0,0,0|1,0,0]=3 3242 B5R0.1 O=C(O)CCS Amb6608916 [2,0,0,0,0,0|1,0,0]=3 3243 B5R0.1 O=C(O)CNO Amb24120360 [2,0,0,0,0,0|2,0,0]=4 3244 B5R0.1 O=C(S)CCCl Amb27461454 [2,0,0,0,0,0|1,1,0]=4 3245 B5R0.1 O=C([O-])CCO Amb22055495 [2,0,0,0,0,0|1,0,1]=4 3246 B5R0.1 O=CCC(=O)O Amb22169407 [2,0,0,0,0,0|1,0,1]=4 3247 B5R0.1 O=CCC(Cl)Cl Amb27749867 [2,0,0,0,0,0|2,0,0]=4 3248 B5R0.1 O=CCC(F)F Amb27234494 [2,0,0,0,0,0|2,0,0]=4 3249 B5R0.1 O=S(O)CCO Amb25937057 [2,0,0,0,0,0|2,0,0]=4 3250 B5R0.1 OCCC(F)F Amb33007913 [2,0,0,0,0,0|2,0,0]=4 3251 B5R0.1 OCCC(O)Cl Amb26052481 [2,0,0,0,0,0|2,0,0]=4 3252 B5R0.1 [C-]#[N+]CC(C)C Amb22900913 [2,0,0,0,0,0|1,0,1]=4 3253 B5R0.2 C#CCCC=O Amb28049678 [2,0,0,0,0,0|0,0,2]=4 3254 B5R0.2 C#CCCCC Amb4135448 [2,0,0,0,0,0|1,0,1]=4 3255 B5R0.2 C#NCCCC Amb31132446 [2,0,0,0,0,0|2,0,0]=4 3256 B5R0.2 C=CCCC=O Amb4358616 [2,0,0,0,0,0|0,0,2]=4 3257 B5R0.2 C=CCCCBr Amb3940219 [2,0,0,0,0,0|2,0,0]=4 3258 B5R0.2 C=CCCCC Amb3940497 [2,0,0,0,0,0|1,0,0]=3 3259 B5R0.2 C=CCCCCl Amb22229585 [2,0,0,0,0,0|2,0,0]=4 3260 B5R0.2 C=CCCCF Amb25689705 [2,0,0,0,0,0|2,0,0]=4 3261 B5R0.2 C=CCCCI Amb25278794 [2,0,0,0,0,0|2,0,0]=4 3262 B5R0.2 C=CCCCN Amb18299670 [2,0,0,0,0,0|2,0,0]=4 3263 B5R0.2 C=CCCCN Amb22001451 [2,0,0,0,0,0|2,0,0]=4 3264 B5R0.2 C=CCCCO Amb8513439 [2,0,0,0,0,0|2,0,0]=4 3265 B5R0.2 C=CCCC[CH2-] Amb32644015 [2,0,0,0,0,0|1,0,1]=4 3266 B5R0.2 C=CCCNC Amb18993048 [2,0,0,0,0,0|2,0,0]=4 3267 B5R0.2 C=CCCNC Amb33553635 [2,0,0,0,0,0|2,0,0]=4 3268 B5R0.2 C=CCCOC Amb28065418 [2,0,0,0,0,0|2,0,0]=4 3269 B5R0.2 C=CCCSC Amb24431590 [2,0,0,0,0,0|2,0,0]=4 3270 B5R0.2 C=CCNCC Amb13951161 [2,0,0,0,0,0|2,0,0]=4 3271 B5R0.2 C=CCNCC Amb6683951 [2,0,0,0,0,0|2,0,0]=4 3272 B5R0.2 C=CCOCC Amb2684299 [2,0,0,0,0,0|2,0,0]=4 3273 B5R0.2 C=CCSCC Amb6366495 [2,0,0,0,0,0|2,0,0]=4 3274 B5R0.2 C=CNCCC Amb27461242 [2,0,0,0,0,0|2,0,0]=4 3275 B5R0.2 C=COCCC Amb17940706 [2,0,0,0,0,0|2,0,0]=4 3276 B5R0.2 CC#CCC=O Amb27850282 [2,0,0,0,0,0|0,0,2]=4 3277 B5R0.2 CCC#CC=O Amb25663194 [2,0,0,0,0,0|0,0,2]=4 3278 B5R0.2 CCCCC#N Amb6662839 [2,0,0,0,0,0|1,0,1]=4 3279 B5R0.2 CCCCC=O Amb3939655 [2,0,0,0,0,0|0,0,0]=2 3280 B5R0.2 CCCCCBr Amb3940084 [2,0,0,0,0,0|1,0,1]=4 3281 B5R0.2 CCCCCC Amb2447471 [2,0,0,0,0,0|1,0,1]=4 3282 B5R0.2 CCCCCCl Amb8514576 [2,0,0,0,0,0|1,0,1]=4 3283 B5R0.2 CCCCCF Amb10838686 [2,0,0,0,0,0|1,0,1]=4 3284 B5R0.2 CCCCCI Amb6891946 [2,0,0,0,0,0|1,0,1]=4 3285 B5R0.2 CCCCCN Amb3939830 [2,0,0,0,0,0|1,0,1]=4 3286 B5R0.2 CCCCCO Amb3939051 [2,0,0,0,0,0|0,0,1]=3 3287 B5R0.2 CCCCCS Amb8513287 [2,0,0,0,0,0|0,1,1]=4 3288 B5R0.2 CCCCC[SiH3] Amb19893989 [2,0,0,0,0,0|1,0,1]=4 3289 B5R0.2 CCCCNC Amb3939351 [2,0,0,0,0,0|2,0,0]=4 3290 B5R0.2 CCCCNN Amb1105203 [2,0,0,0,0,0|2,0,0]=4 3291 B5R0.2 CCCCNN Amb22230363 [2,0,0,0,0,0|2,0,0]=4 3292 B5R0.2 CCCCNN Amb33055062 [2,0,0,0,0,0|2,0,0]=4 3293 B5R0.2 CCCCNO Amb24686451 [2,0,0,0,0,0|1,0,0]=3 3294 B5R0.2 CCCCNO Amb32687485 [2,0,0,0,0,0|1,0,0]=3 3295 B5R0.2 CCCCON Amb17101066 [2,0,0,0,0,0|2,0,0]=4 3296 B5R0.2 CCCCON Amb6308542 [2,0,0,0,0,0|2,0,0]=4 3297 B5R0.2 CCCCSC Amb4036342 [2,0,0,0,0,0|2,0,0]=4 3298 B5R0.2 CCCN=C=O Amb3939331 [2,0,0,0,0,0|1,0,1]=4 3299 B5R0.2 CCCNC=S Amb27754027 [2,0,0,0,0,0|1,1,0]=4 3300 B5R0.2 CCC\C=C\Br Amb17673688 [2,0,0,0,0,0|1,0,1]=4 3301 B5R0.2 CCC\C=C\Cl Amb25026521 [2,0,0,0,0,0|1,0,1]=4 3302 B5R0.2 CCC\C=C\N Amb27217273 [2,0,0,0,0,0|1,0,1]=4 3303 B5R0.2 CCC\C=N\O Amb27213413 [2,0,0,0,0,0|1,0,1]=4 3304 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|1,0,1]=4 3305 B5R0.2 CCNCCO Amb3940070 [2,0,0,0,0,0|1,0,1]=4 3306 B5R0.2 CCOCCO Amb3939142 [2,0,0,0,0,0|1,0,1]=4 3307 B5R0.2 CCSCC=O Amb17940620 [2,0,0,0,0,0|1,0,0]=3 3308 B5R0.2 CCSCCO Amb1085958 [2,0,0,0,0,0|1,0,1]=4 3309 B5R0.2 CC\C=C\C=O Amb33986391 [2,0,0,0,0,0|0,0,2]=4 3310 B5R0.2 CNCCCO Amb9246656 [2,0,0,0,0,0|1,0,1]=4 3311 B5R0.2 CNCCNO Amb27976196 [2,0,0,0,0,0|2,0,0]=4 3312 B5R0.2 COCCC=O Amb10602324 [2,0,0,0,0,0|1,0,0]=3 3313 B5R0.2 COCCCO Amb8385593 [2,0,0,0,0,0|1,0,1]=4 3314 B5R0.2 COCCNO Amb25284480 [2,0,0,0,0,0|2,0,0]=4 3315 B5R0.2 COCNC=O Amb28049834 [2,0,0,0,0,0|2,0,0]=4 3316 B5R0.2 CSCCC=O Amb3939952 [2,0,0,0,0,0|1,0,0]=3 3317 B5R0.2 CSCCCO Amb3939523 [2,0,0,0,0,0|1,0,1]=4 3318 B5R0.2 CSCCNO Amb33272071 [2,0,0,0,0,0|2,0,0]=4 3319 B5R0.2 C\C=C/CCC Amb6366719 [2,0,0,0,0,0|1,0,1]=4 3320 B5R0.2 C\C=C\CC=O Amb26655030 [2,0,0,0,0,0|0,0,2]=4 3321 B5R0.2 C\C=N\CCC Amb27954749 [2,0,0,0,0,0|2,0,0]=4 3322 B5R0.2 N#CCCC=O Amb3941009 [2,0,0,0,0,0|1,0,1]=4 3323 B5R0.2 NCCCC=O Amb26851044 [2,0,0,0,0,0|1,0,0]=3 3324 B5R0.2 NCCCCO Amb3939336 [2,0,0,0,0,0|1,0,1]=4 3325 B5R0.2 NCCCN=O Amb28049442 [2,0,0,0,0,0|2,0,0]=4 3326 B5R0.2 NCCCNO Amb27882495 [2,0,0,0,0,0|2,0,0]=4 3327 B5R0.2 NCCCNO Amb32729324 [2,0,0,0,0,0|2,0,0]=4 3328 B5R0.2 NCCOC=O Amb24612320 [2,0,0,0,0,0|2,0,0]=4 3329 B5R0.2 O=CCCC=O Amb8395090 [2,0,0,0,0,0|1,0,1]=4 3330 B5R0.2 O=CCCCBr Amb18644189 [2,0,0,0,0,0|1,0,0]=3 3331 B5R0.2 O=CCCCCl Amb8395190 [2,0,0,0,0,0|1,0,0]=3 3332 B5R0.2 O=CCCCF Amb24056028 [2,0,0,0,0,0|1,0,0]=3 3333 B5R0.2 O=CCCCI Amb27249641 [2,0,0,0,0,0|1,0,0]=3 3334 B5R0.2 O=CCCCO Amb24589235 [2,0,0,0,0,0|1,0,0]=3 3335 B5R0.2 O=CCCSS Amb22524519 [2,0,0,0,0,0|2,0,0]=4 3336 B5R0.2 O=CNCCF Amb28205988 [2,0,0,0,0,0|2,0,0]=4 3337 B5R0.2 O=COCCBr Amb27816149 [2,0,0,0,0,0|2,0,0]=4 3338 B5R0.2 O=COCCO Amb26625741 [2,0,0,0,0,0|2,0,0]=4 3339 B5R0.2 OCCCCBr Amb8395353 [2,0,0,0,0,0|1,0,1]=4 3340 B5R0.2 OCCCCCl Amb1101976 [2,0,0,0,0,0|1,0,1]=4 3341 B5R0.2 OCCCCF Amb17593046 [2,0,0,0,0,0|1,0,1]=4 3342 B5R0.2 OCCCCO Amb2793029 [2,0,0,0,0,0|1,0,1]=4 3343 B5R0.2 ONCCCF Amb25931859 [2,0,0,0,0,0|2,0,0]=4 3344 B5R0.2 O\C=N\CCCl Amb24684796 [2,0,0,0,0,0|2,0,0]=4 3345 B5R0.2 [C-]#[N+]CCCC Amb2235001 [2,0,0,0,0,0|2,0,0]=4 3346 B7R0.2 C#CC(C)CC(=O)O Amb27246384 [1,1,0,0,0,0|0,0,2]=4 3347 B7R0.2 C#CC(C)CC(C)C Amb24334125 [1,1,0,0,0,0|1,0,1]=4 3348 B7R0.2 C#CC(N)CC(C)C Amb26948631 [1,1,0,0,0,0|1,0,1]=4 3349 B7R0.2 C#CC(O)CC(C)C Amb8392590 [1,1,0,0,0,0|1,0,1]=4 3350 B7R0.2 C#C[C@H](O)CC(=O)O Amb28285208 [1,1,0,0,0,0|0,0,2]=4 3351 B7R0.2 C#C[C@H](O)CC(C)C Amb27950860 [1,1,0,0,0,0|1,0,1]=4 3352 B7R0.2 C=C(C)CC(C)C=O Amb18641711 [1,1,0,0,0,0|0,0,2]=4 3353 B7R0.2 C=C(C)CC(C)CC Amb22228340 [1,1,0,0,0,0|2,0,0]=4 3354 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [1,1,0,0,0,0|0,0,1]=3 3355 B7R0.2 C=C(CC)CC(N)=O Amb27394598 [1,1,0,0,0,0|1,0,1]=4 3356 B7R0.2 C=C(CO)CC(C)C Amb25889172 [1,1,0,0,0,0|0,0,2]=4 3357 B7R0.2 C=CC(=O)CC(C)C Amb27412805 [1,1,0,0,0,0|1,0,1]=4 3358 B7R0.2 C=CC(Br)CC(C)C Amb27984920 [1,1,0,0,0,0|1,0,0]=3 3359 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [1,1,0,0,0,0|0,0,2]=4 3360 B7R0.2 C=CC(C)CC(C)C Amb22229087 [1,1,0,0,0,0|1,0,0]=3 3361 B7R0.2 C=CC(C)CN(C)C Amb27837809 [1,1,0,0,0,0|2,0,0]=4 3362 B7R0.2 C=CC(N)CC(=O)O Amb22641963 [1,1,0,0,0,0|0,0,2]=4 3363 B7R0.2 C=CC(N)CC(=O)O Amb31307621 [1,1,0,0,0,0|0,0,2]=4 3364 B7R0.2 C=CC(N)CC(C)C Amb25743094 [1,1,0,0,0,0|1,0,0]=3 3365 B7R0.2 C=CC(N)CN(C)C Amb27224710 [1,1,0,0,0,0|2,0,0]=4 3366 B7R0.2 C=CC(O)CC(=O)O Amb18641866 [1,1,0,0,0,0|0,0,2]=4 3367 B7R0.2 C=CC(O)CC(C)C Amb24532138 [1,1,0,0,0,0|1,0,0]=3 3368 B7R0.2 C=CC(O)CC(C)N Amb35583445 [1,1,0,0,0,0|2,0,0]=4 3369 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [1,1,0,0,0,0|0,0,2]=4 3370 B7R0.2 C=C[C@@H](C)C[C@@H](C)O Amb28138655 [1,1,0,0,0,0|2,0,0]=4 3371 B7R0.2 C=C[C@@H](N)CC(=O)O Amb28315938 [1,1,0,0,0,0|0,0,2]=4 3372 B7R0.2 C=C[C@@H](O)CC(C)C Amb28429716 [1,1,0,0,0,0|1,0,0]=3 3373 B7R0.2 C=C[C@@H](O)C[C@H](C)O Amb28318465 [1,1,0,0,0,0|2,0,0]=4 3374 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [1,1,0,0,0,0|0,0,2]=4 3375 B7R0.2 C=C[C@H](C)C[C@H](C)O Amb27221624 [1,1,0,0,0,0|2,0,0]=4 3376 B7R0.2 C=C[C@H](N)CC(C)C Amb27202733 [1,1,0,0,0,0|1,0,0]=3 3377 B7R0.2 C=C[C@H](O)CC(C)C Amb28366037 [1,1,0,0,0,0|1,0,0]=3 3378 B7R0.2 CC(=O)CC(C)CCl Amb28313530 [1,1,0,0,0,0|2,0,0]=4 3379 B7R0.2 CC(=O)CC(C)CN Amb18251072 [1,1,0,0,0,0|2,0,0]=4 3380 B7R0.2 CC(=O)CC(N)CO Amb27240210 [1,1,0,0,0,0|2,0,0]=4 3381 B7R0.2 CC(=O)CC(O)CCl Amb27827457 [1,1,0,0,0,0|2,0,0]=4 3382 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [1,1,0,0,0,0|1,0,1]=4 3383 B7R0.2 CC(=O)C[C@@H](O)CCl Amb27817734 [1,1,0,0,0,0|2,0,0]=4 3384 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [1,1,0,0,0,0|1,0,1]=4 3385 B7R0.2 CC(=O)C[C@H](O)CO Amb28316148 [1,1,0,0,0,0|2,0,0]=4 3386 B7R0.2 CC(Br)CC(C)CO Amb27477984 [1,1,0,0,0,0|1,0,1]=4 3387 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [1,1,0,0,0,0|1,0,1]=4 3388 B7R0.2 CC(C)CC(=O)C=O Amb25189904 [1,1,0,0,0,0|0,0,1]=3 3389 B7R0.2 CC(C)CC(=O)CO Amb18559774 [1,1,0,0,0,0|0,0,2]=4 3390 B7R0.2 CC(C)CC(=O)NO Amb6280209 [1,1,0,0,0,0|1,0,1]=4 3391 B7R0.2 CC(C)CC(Br)C#N Amb26980908 [1,1,0,0,0,0|1,0,1]=4 3392 B7R0.2 CC(C)CC(Br)CF Amb27477819 [1,1,0,0,0,0|1,0,1]=4 3393 B7R0.2 CC(C)CC(Br)CN Amb27598426 [1,1,0,0,0,0|1,0,1]=4 3394 B7R0.2 CC(C)CC(C)C#N Amb8950036 [1,1,0,0,0,0|1,0,1]=4 3395 B7R0.2 CC(C)CC(C)C=O Amb18641813 [1,1,0,0,0,0|0,0,0]=2 3396 B7R0.2 CC(C)CC(C)CBr Amb22641845 [1,1,0,0,0,0|1,0,1]=4 3397 B7R0.2 CC(C)CC(C)CCl Amb25741744 [1,1,0,0,0,0|1,0,1]=4 3398 B7R0.2 CC(C)CC(C)CI Amb27409447 [1,1,0,0,0,0|1,0,1]=4 3399 B7R0.2 CC(C)CC(C)CN Amb8950132 [1,1,0,0,0,0|1,0,1]=4 3400 B7R0.2 CC(C)CC(C)CO Amb22228341 [1,1,0,0,0,0|0,0,1]=3 3401 B7R0.2 CC(C)CC(C)CS Amb26032846 [1,1,0,0,0,0|0,1,1]=4 3402 B7R0.2 CC(C)CC(C)NO Amb27808390 [1,1,0,0,0,0|1,0,0]=3 3403 B7R0.2 CC(C)CC(C)ON Amb24412592 [1,1,0,0,0,0|2,0,0]=4 3404 B7R0.2 CC(C)CC(F)CN Amb24387968 [1,1,0,0,0,0|1,0,1]=4 3405 B7R0.2 CC(C)CC(N)C#N Amb10203324 [1,1,0,0,0,0|1,0,1]=4 3406 B7R0.2 CC(C)CC(N)C#N Amb1137462 [1,1,0,0,0,0|1,0,1]=4 3407 B7R0.2 CC(C)CC(N)CBr Amb27607201 [1,1,0,0,0,0|1,0,1]=4 3408 B7R0.2 CC(C)CC(N)CCl Amb28184730 [1,1,0,0,0,0|1,0,1]=4 3409 B7R0.2 CC(C)CC(N)CF Amb33624255 [1,1,0,0,0,0|1,0,1]=4 3410 B7R0.2 CC(C)CC(N)CN Amb33527180 [1,1,0,0,0,0|1,0,1]=4 3411 B7R0.2 CC(C)CC(N)CN Amb9380668 [1,1,0,0,0,0|1,0,1]=4 3412 B7R0.2 CC(C)CC(N)CO Amb18015118 [1,1,0,0,0,0|0,0,1]=3 3413 B7R0.2 CC(C)CC(O)C#N Amb9294978 [1,1,0,0,0,0|1,0,1]=4 3414 B7R0.2 CC(C)CC(O)C=O Amb27250174 [1,1,0,0,0,0|0,0,0]=2 3415 B7R0.2 CC(C)CC(O)CBr Amb24483137 [1,1,0,0,0,0|1,0,1]=4 3416 B7R0.2 CC(C)CC(O)CCl Amb25889371 [1,1,0,0,0,0|1,0,1]=4 3417 B7R0.2 CC(C)CC(O)CF Amb26535087 [1,1,0,0,0,0|1,0,1]=4 3418 B7R0.2 CC(C)CC(O)CN Amb33548420 [1,1,0,0,0,0|1,0,1]=4 3419 B7R0.2 CC(C)CC(O)CN Amb9295087 [1,1,0,0,0,0|1,0,1]=4 3420 B7R0.2 CC(C)CC(O)CO Amb24731733 [1,1,0,0,0,0|0,0,1]=3 3421 B7R0.2 CC(C)CC(S)CN Amb18251146 [1,1,0,0,0,0|1,0,1]=4 3422 B7R0.2 CC(C)CN(C)N=O Amb33035920 [1,1,0,0,0,0|2,0,0]=4 3423 B7R0.2 CC(C)C[C@@H](C)C=O Amb27164638 [1,1,0,0,0,0|0,0,0]=2 3424 B7R0.2 CC(C)C[C@@H](C)CBr Amb27483719 [1,1,0,0,0,0|1,0,1]=4 3425 B7R0.2 CC(C)C[C@@H](C)CN Amb33738463 [1,1,0,0,0,0|1,0,1]=4 3426 B7R0.2 CC(C)C[C@@H](C)CO Amb26613066 [1,1,0,0,0,0|0,0,1]=3 3427 B7R0.2 CC(C)C[C@@H](N)C#N Amb18542350 [1,1,0,0,0,0|1,0,1]=4 3428 B7R0.2 CC(C)C[C@@H](N)CCl Amb27640666 [1,1,0,0,0,0|1,0,1]=4 3429 B7R0.2 CC(C)C[C@@H](N)CN Amb25345853 [1,1,0,0,0,0|1,0,1]=4 3430 B7R0.2 CC(C)C[C@@H](N)CO Amb22746869 [1,1,0,0,0,0|0,0,1]=3 3431 B7R0.2 CC(C)C[C@@H](N)CO Amb3939340 [1,1,0,0,0,0|0,0,1]=3 3432 B7R0.2 CC(C)C[C@@H](N)CS Amb27185571 [1,1,0,0,0,0|0,1,1]=4 3433 B7R0.2 CC(C)C[C@@H](O)CN Amb33203519 [1,1,0,0,0,0|1,0,1]=4 3434 B7R0.2 CC(C)C[C@@H](O)CO Amb27406200 [1,1,0,0,0,0|0,0,1]=3 3435 B7R0.2 CC(C)C[C@@H](S)CN Amb27602168 [1,1,0,0,0,0|1,0,1]=4 3436 B7R0.2 CC(C)C[C@H](Br)CO Amb27831368 [1,1,0,0,0,0|0,0,1]=3 3437 B7R0.2 CC(C)C[C@H](C)CBr Amb27411125 [1,1,0,0,0,0|1,0,1]=4 3438 B7R0.2 CC(C)C[C@H](C)CN Amb33747134 [1,1,0,0,0,0|1,0,1]=4 3439 B7R0.2 CC(C)C[C@H](C)CO Amb26022305 [1,1,0,0,0,0|0,0,1]=3 3440 B7R0.2 CC(C)C[C@H](Cl)C#N Amb28076532 [1,1,0,0,0,0|1,0,1]=4 3441 B7R0.2 CC(C)C[C@H](N)C#N Amb17399794 [1,1,0,0,0,0|1,0,1]=4 3442 B7R0.2 CC(C)C[C@H](N)C=O Amb26851754 [1,1,0,0,0,0|0,0,0]=2 3443 B7R0.2 CC(C)C[C@H](N)CBr Amb24462739 [1,1,0,0,0,0|1,0,1]=4 3444 B7R0.2 CC(C)C[C@H](N)CCl Amb27430500 [1,1,0,0,0,0|1,0,1]=4 3445 B7R0.2 CC(C)C[C@H](N)CO Amb22504556 [1,1,0,0,0,0|0,0,1]=3 3446 B7R0.2 CC(C)C[C@H](N)CO Amb3940063 [1,1,0,0,0,0|0,0,1]=3 3447 B7R0.2 CC(C)C[C@H](N)CS Amb24392884 [1,1,0,0,0,0|0,1,1]=4 3448 B7R0.2 CC(C)C[C@H](O)CN Amb33203517 [1,1,0,0,0,0|1,0,1]=4 3449 B7R0.2 CC(C)C[C@H](O)CO Amb27432389 [1,1,0,0,0,0|0,0,1]=3 3450 B7R0.2 CC(C)C[C@H](S)CN Amb27815055 [1,1,0,0,0,0|1,0,1]=4 3451 B7R0.2 CC(C)C\C(N)=N/O Amb2696576 [1,1,0,0,0,0|1,0,1]=4 3452 B7R0.2 CC(C)C\C(N)=N\O Amb8384557 [1,1,0,0,0,0|1,0,1]=4 3453 B7R0.2 CC(C)NC(=O)C=O Amb27881630 [1,1,0,0,0,0|1,0,1]=4 3454 B7R0.2 CC(C)NC(C)CO Amb9359755 [1,1,0,0,0,0|1,0,1]=4 3455 B7R0.2 CC(C)N[C@@H](C)CO Amb28283887 [1,1,0,0,0,0|1,0,1]=4 3456 B7R0.2 CC(C)OC(C)C=O Amb25243083 [1,1,0,0,0,0|1,0,0]=3 3457 B7R0.2 CC(C)OC(O)CO Amb27761642 [1,1,0,0,0,0|1,0,1]=4 3458 B7R0.2 CC(C)SC(C)C=O Amb18642905 [1,1,0,0,0,0|1,0,0]=3 3459 B7R0.2 CC(CC(=O)O)NN Amb28346224 [1,1,0,0,0,0|2,0,0]=4 3460 B7R0.2 CC(CC(=O)O)NN Amb33141007 [1,1,0,0,0,0|2,0,0]=4 3461 B7R0.2 CC(CCl)CC(=O)Cl Amb27949867 [1,1,0,0,0,0|2,0,0]=4 3462 B7R0.2 CC(CF)CC(=O)O Amb25990964 [1,1,0,0,0,0|1,0,0]=3 3463 B7R0.2 CC(CN)CC(=O)O Amb18124263 [1,1,0,0,0,0|1,0,0]=3 3464 B7R0.2 CC(CN)CC(=O)O Amb20669501 [1,1,0,0,0,0|1,0,0]=3 3465 B7R0.2 CC(CN)CC(=O)O Amb32752805 [1,1,0,0,0,0|1,0,0]=3 3466 B7R0.2 CC(CN)CC(N)=O Amb18641899 [1,1,0,0,0,0|2,0,0]=4 3467 B7R0.2 CC(CO)CC(=O)O Amb18198168 [1,1,0,0,0,0|1,0,0]=3 3468 B7R0.2 CC(CO)CC(=O)[O-] Amb33329956 [1,1,0,0,0,0|1,0,1]=4 3469 B7R0.2 CC(CO)CN(C)C Amb8428170 [1,1,0,0,0,0|1,0,1]=4 3470 B7R0.2 CC(CO)C[SiH](C)C Amb27662162 [1,1,0,0,0,0|0,1,1]=4 3471 B7R0.2 CC(Cl)CN(C)C=O Amb27184558 [1,1,0,0,0,0|2,0,0]=4 3472 B7R0.2 CC(N)CC(C)CO Amb35593039 [1,1,0,0,0,0|1,0,1]=4 3473 B7R0.2 CC(N)CC(O)CO Amb18124268 [1,1,0,0,0,0|1,0,1]=4 3474 B7R0.2 CC(O)C[C@H](C)CO Amb27394893 [1,1,0,0,0,0|1,0,1]=4 3475 B7R0.2 CC(O)C[C@H](O)CO Amb27397070 [1,1,0,0,0,0|1,0,1]=4 3476 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [1,1,0,0,0,0|0,0,1]=3 3477 B7R0.2 CCC(=O)CC(C)=O Amb9775078 [1,1,0,0,0,0|1,0,1]=4 3478 B7R0.2 CCC(=O)CC(N)=O Amb8384375 [1,1,0,0,0,0|1,0,1]=4 3479 B7R0.2 CCC(C)CB(O)O Amb27591902 [1,1,0,0,0,0|1,0,1]=4 3480 B7R0.2 CCC(C)CC(=N)N Amb10607625 [1,1,0,0,0,0|2,0,0]=4 3481 B7R0.2 CCC(C)CC(=N)N Amb19890168 [1,1,0,0,0,0|2,0,0]=4 3482 B7R0.2 CCC(C)CC(=O)Cl Amb10844649 [1,1,0,0,0,0|1,0,0]=3 3483 B7R0.2 CCC(C)CC(=O)O Amb2689581 [1,1,0,0,0,0|0,0,0]=2 3484 B7R0.2 CCC(C)CC(C)=O Amb10608208 [1,1,0,0,0,0|1,0,0]=3 3485 B7R0.2 CCC(C)CC(C)C Amb22228298 [1,1,0,0,0,0|1,0,1]=4 3486 B7R0.2 CCC(C)CC(C)O Amb4035421 [1,1,0,0,0,0|1,0,1]=4 3487 B7R0.2 CCC(C)CC(N)=O Amb25230669 [1,1,0,0,0,0|1,0,0]=3 3488 B7R0.2 CCC(C)CC(N)=S Amb26989527 [1,1,0,0,0,0|1,1,0]=4 3489 B7R0.2 CCC(C)CN(C)O Amb33373890 [1,1,0,0,0,0|2,0,0]=4 3490 B7R0.2 CCC(C)CS(=O)Cl Amb32720505 [1,1,0,0,0,0|2,0,0]=4 3491 B7R0.2 CCC(C)CS(=O)[O-] Amb27408549 [1,1,0,0,0,0|1,0,1]=4 3492 B7R0.2 CCC(C)CS(C)=O Amb27837877 [1,1,0,0,0,0|2,0,0]=4 3493 B7R0.2 CCC(C)CS(N)=O Amb32720506 [1,1,0,0,0,0|2,0,0]=4 3494 B7R0.2 CCC(C)C[C@@H](C)O Amb33318318 [1,1,0,0,0,0|1,0,1]=4 3495 B7R0.2 CCC(C)C[C@H](C)O Amb33318389 [1,1,0,0,0,0|1,0,1]=4 3496 B7R0.2 CCC(C)C[N+](=O)[O-] Amb25075983 [1,1,0,0,0,0|1,0,1]=4 3497 B7R0.2 CCC(C)NC(=O)Cl Amb27838339 [1,1,0,0,0,0|2,0,0]=4 3498 B7R0.2 CCC(C)NC(C)=O Amb3358085 [1,1,0,0,0,0|2,0,0]=4 3499 B7R0.2 CCC(C)NC(N)=O Amb9702507 [1,1,0,0,0,0|2,0,0]=4 3500 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [1,1,0,0,0,0|2,0,0]=4 3501 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [1,1,0,0,0,0|2,0,0]=4 3502 B7R0.2 CCC(Cl)CC(C)=O Amb28121450 [1,1,0,0,0,0|1,0,0]=3 3503 B7R0.2 CCC(Cl)CC(C)C Amb28399717 [1,1,0,0,0,0|1,0,1]=4 3504 B7R0.2 CCC(Cl)OC(C)=O Amb27392214 [1,1,0,0,0,0|2,0,0]=4 3505 B7R0.2 CCC(Cl)SC(=O)Cl Amb27945612 [1,1,0,0,0,0|2,0,0]=4 3506 B7R0.2 CCC(Cl)SC(C)=O Amb27407733 [1,1,0,0,0,0|2,0,0]=4 3507 B7R0.2 CCC(N)CC(=O)O Amb1993862 [1,1,0,0,0,0|0,0,0]=2 3508 B7R0.2 CCC(N)CC(=O)O Amb8631361 [1,1,0,0,0,0|0,0,0]=2 3509 B7R0.2 CCC(N)CC(C)=O Amb18631696 [1,1,0,0,0,0|1,0,0]=3 3510 B7R0.2 CCC(N)CC(C)=O Amb26895708 [1,1,0,0,0,0|1,0,0]=3 3511 B7R0.2 CCC(N)CC(C)C Amb18523780 [1,1,0,0,0,0|1,0,1]=4 3512 B7R0.2 CCC(N)CC(C)O Amb27604743 [1,1,0,0,0,0|1,0,1]=4 3513 B7R0.2 CCC(N)CC(N)=O Amb25727686 [1,1,0,0,0,0|1,0,0]=3 3514 B7R0.2 CCC(N)CC(N)=S Amb28078345 [1,1,0,0,0,0|1,1,0]=4 3515 B7R0.2 CCC(O)CC(=O)O Amb10844270 [1,1,0,0,0,0|0,0,0]=2 3516 B7R0.2 CCC(O)CC(C)=O Amb25065181 [1,1,0,0,0,0|1,0,0]=3 3517 B7R0.2 CCC(O)CC(C)O Amb26515705 [1,1,0,0,0,0|1,0,1]=4 3518 B7R0.2 CCC(O)CS(C)=O Amb28457838 [1,1,0,0,0,0|2,0,0]=4 3519 B7R0.2 CCC(O)C[N+](=O)[O-] Amb25136685 [1,1,0,0,0,0|1,0,1]=4 3520 B7R0.2 CCC(O)OC(C)=O Amb28256771 [1,1,0,0,0,0|2,0,0]=4 3521 B7R0.2 CCN(C)CC(=O)O Amb33620688 [1,1,0,0,0,0|1,0,0]=3 3522 B7R0.2 CCN(C)CC(=O)O Amb8428140 [1,1,0,0,0,0|1,0,0]=3 3523 B7R0.2 CCN(C)CC(C)=O Amb8427987 [1,1,0,0,0,0|2,0,0]=4 3524 B7R0.2 CCN(C)CC(C)=O Amb9173327 [1,1,0,0,0,0|2,0,0]=4 3525 B7R0.2 CCN(C)CC(N)=O Amb27639873 [1,1,0,0,0,0|2,0,0]=4 3526 B7R0.2 CCN(O)CC(=O)O Amb28195485 [1,1,0,0,0,0|1,0,0]=3 3527 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [1,1,0,0,0,0|1,0,0]=3 3528 B7R0.2 CCS(=O)CC(C)=O Amb26873160 [1,1,0,0,0,0|2,0,0]=4 3529 B7R0.2 CCS(=O)CC(N)=O Amb27762121 [1,1,0,0,0,0|2,0,0]=4 3530 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [1,1,0,0,0,0|0,0,0]=2 3531 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [1,1,0,0,0,0|0,0,0]=2 3532 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [1,1,0,0,0,0|0,0,0]=2 3533 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [1,1,0,0,0,0|0,0,0]=2 3534 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [1,1,0,0,0,0|1,0,0]=3 3535 B7R0.2 CC[C@@H](O)CC(C)C Amb27603599 [1,1,0,0,0,0|1,0,1]=4 3536 B7R0.2 CC[C@@H](O)C[C@@H](C)O Amb4166323 [1,1,0,0,0,0|1,0,1]=4 3537 B7R0.2 CC[C@@H](O)C[C@H](C)O Amb27946301 [1,1,0,0,0,0|1,0,1]=4 3538 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [1,1,0,0,0,0|0,0,0]=2 3539 B7R0.2 CC[C@H](C)CC(C)O Amb27437194 [1,1,0,0,0,0|1,0,1]=4 3540 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [1,1,0,0,0,0|0,0,0]=2 3541 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [1,1,0,0,0,0|0,0,0]=2 3542 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [1,1,0,0,0,0|0,0,0]=2 3543 B7R0.2 CC[C@H](O)CC(C)=O Amb26980782 [1,1,0,0,0,0|1,0,0]=3 3544 B7R0.2 CC[C@H](O)C[C@@H](C)O Amb27790287 [1,1,0,0,0,0|1,0,1]=4 3545 B7R0.2 CC\C(Br)=C\C(=O)O Amb27409320 [1,1,0,0,0,0|0,0,2]=4 3546 B7R0.2 CC\C(C)=C/C(=O)O Amb18281014 [1,1,0,0,0,0|0,0,2]=4 3547 B7R0.2 CC\C(C)=C\C(=O)O Amb33528462 [1,1,0,0,0,0|0,0,2]=4 3548 B7R0.2 CC\C(F)=C/C(=O)O Amb27780201 [1,1,0,0,0,0|0,0,2]=4 3549 B7R0.2 CC\C(N)=C\C(=O)O Amb28145108 [1,1,0,0,0,0|0,0,2]=4 3550 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [1,1,0,0,0,0|0,0,2]=4 3551 B7R0.2 CN(C)CC(N)CO Amb25742525 [1,1,0,0,0,0|1,0,1]=4 3552 B7R0.2 CN(C)CC(N)CO Amb28934849 [1,1,0,0,0,0|1,0,1]=4 3553 B7R0.2 CN(C)CC(O)CO Amb8396811 [1,1,0,0,0,0|1,0,1]=4 3554 B7R0.2 CN(C)C[C@H](O)CO Amb27593496 [1,1,0,0,0,0|1,0,1]=4 3555 B7R0.2 CN(CO)CC(=O)O Amb27663224 [1,1,0,0,0,0|2,0,0]=4 3556 B7R0.2 CNC(=O)CC(=O)O Amb33529761 [1,1,0,0,0,0|1,0,1]=4 3557 B7R0.2 CNC(C)CC(=O)O Amb21959674 [1,1,0,0,0,0|1,0,0]=3 3558 B7R0.2 CNC(C)CC(=O)O Amb9398363 [1,1,0,0,0,0|1,0,0]=3 3559 B7R0.2 CNC(C)CC(C)C Amb6892568 [1,1,0,0,0,0|2,0,0]=4 3560 B7R0.2 CNC(C)CC(C)C Amb9705224 [1,1,0,0,0,0|2,0,0]=4 3561 B7R0.2 CNC(C)CC(N)=O Amb17231826 [1,1,0,0,0,0|2,0,0]=4 3562 B7R0.2 CNC(C)CC(N)=O Amb19960012 [1,1,0,0,0,0|2,0,0]=4 3563 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [1,1,0,0,0,0|1,0,0]=3 3564 B7R0.2 COC(=O)CC(=O)O Amb16232032 [1,1,0,0,0,0|1,0,1]=4 3565 B7R0.2 COC(C)CC(=O)O Amb4001695 [1,1,0,0,0,0|1,0,0]=3 3566 B7R0.2 COC(C)CC(C)=O Amb26512071 [1,1,0,0,0,0|2,0,0]=4 3567 B7R0.2 COC(C)CC(N)=O Amb27838372 [1,1,0,0,0,0|2,0,0]=4 3568 B7R0.2 COC(Cl)CC(C)C Amb27776731 [1,1,0,0,0,0|2,0,0]=4 3569 B7R0.2 CON(C)CC(=O)O Amb8010467 [1,1,0,0,0,0|2,0,0]=4 3570 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [1,1,0,0,0,0|1,0,0]=3 3571 B7R0.2 CO[C@H](C)CC(C)=O Amb26494510 [1,1,0,0,0,0|2,0,0]=4 3572 B7R0.2 CSC(C)CC(=O)O Amb18967824 [1,1,0,0,0,0|1,0,0]=3 3573 B7R0.2 CSC(C)CC(C)=O Amb25714199 [1,1,0,0,0,0|2,0,0]=4 3574 B7R0.2 CSC(C)CC(N)=O Amb27838848 [1,1,0,0,0,0|2,0,0]=4 3575 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [1,1,0,0,0,0|1,0,0]=3 3576 B7R0.2 C[C@@H](CCl)CC(=O)Cl Amb27855839 [1,1,0,0,0,0|2,0,0]=4 3577 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [1,1,0,0,0,0|1,0,0]=3 3578 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [1,1,0,0,0,0|1,0,0]=3 3579 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [1,1,0,0,0,0|1,0,0]=3 3580 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [1,1,0,0,0,0|1,0,0]=3 3581 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [1,1,0,0,0,0|1,0,0]=3 3582 B7R0.2 C[C@H](CO)CN(C)C Amb27457944 [1,1,0,0,0,0|1,0,1]=4 3583 B7R0.2 C[C@H](O)C[C@H](O)CO Amb27472671 [1,1,0,0,0,0|1,0,1]=4 3584 B7R0.2 C[S+](C)C[C@@H](O)CO Amb27829968 [1,1,0,0,0,0|1,0,1]=4 3585 B7R0.2 C[S+](C)C[C@H](O)CO Amb27652893 [1,1,0,0,0,0|1,0,1]=4 3586 B7R0.2 C\C(=C\Cl)CC(C)C Amb30621737 [1,1,0,0,0,0|1,0,1]=4 3587 B7R0.2 C\C(CC(C)C)=N/O Amb26630838 [1,1,0,0,0,0|1,0,1]=4 3588 B7R0.2 C\C(CC(C)C)=N\O Amb27624178 [1,1,0,0,0,0|1,0,1]=4 3589 B7R0.2 C\C=C(/C)CC(C)C Amb27459658 [1,1,0,0,0,0|1,0,1]=4 3590 B7R0.2 C\C=C(\C)CC(C)C Amb24566930 [1,1,0,0,0,0|1,0,1]=4 3591 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [1,1,0,0,0,0|0,0,2]=4 3592 B7R0.2 N#CC(N)CC(=O)O Amb27985578 [1,1,0,0,0,0|1,0,1]=4 3593 B7R0.2 NC(=O)CC(Br)CO Amb28384721 [1,1,0,0,0,0|2,0,0]=4 3594 B7R0.2 NC(=O)CC(N)CCl Amb26458731 [1,1,0,0,0,0|2,0,0]=4 3595 B7R0.2 NC(=O)CC(O)CO Amb25662216 [1,1,0,0,0,0|2,0,0]=4 3596 B7R0.2 NC(=O)C[C@@H](O)CCl Amb27173051 [1,1,0,0,0,0|2,0,0]=4 3597 B7R0.2 NC(=O)C[C@H](O)CO Amb8388588 [1,1,0,0,0,0|2,0,0]=4 3598 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [1,1,0,0,0,0|1,0,1]=4 3599 B7R0.2 NC(CF)CC(=O)O Amb24428065 [1,1,0,0,0,0|1,0,0]=3 3600 B7R0.2 NC(CS)CC(=O)O Amb25090412 [1,1,0,0,0,0|1,0,0]=3 3601 B7R0.2 NCC(F)C[PH](=O)O Amb28398603 [1,1,0,0,0,0|2,0,0]=4 3602 B7R0.2 NCC(N)CC(=O)O Amb19515145 [1,1,0,0,0,0|1,0,0]=3 3603 B7R0.2 NCC(N)CC(=O)O Amb21858324 [1,1,0,0,0,0|1,0,0]=3 3604 B7R0.2 NCC(N)CC(N)=O Amb27603845 [1,1,0,0,0,0|2,0,0]=4 3605 B7R0.2 NCC(O)CC(=O)O Amb32663899 [1,1,0,0,0,0|1,0,0]=3 3606 B7R0.2 NCC(O)CC(=O)O Amb33544754 [1,1,0,0,0,0|1,0,0]=3 3607 B7R0.2 NCC(O)CS(=O)O Amb27831981 [1,1,0,0,0,0|2,0,0]=4 3608 B7R0.2 NC[C@@H](F)CC(=O)O Amb27481078 [1,1,0,0,0,0|1,0,0]=3 3609 B7R0.2 NC[C@@H](F)CS(=O)O Amb27460870 [1,1,0,0,0,0|2,0,0]=4 3610 B7R0.2 NC[C@@H](F)C[PH](=O)O Amb24481490 [1,1,0,0,0,0|2,0,0]=4 3611 B7R0.2 NC[C@@H](N)CC(=O)O Amb10603267 [1,1,0,0,0,0|1,0,0]=3 3612 B7R0.2 NC[C@@H](O)CC(=O)O Amb32665211 [1,1,0,0,0,0|1,0,0]=3 3613 B7R0.2 NC[C@@H](O)CC(=O)O Amb8386098 [1,1,0,0,0,0|1,0,0]=3 3614 B7R0.2 NC[C@@H](O)CC(N)=O Amb27838875 [1,1,0,0,0,0|2,0,0]=4 3615 B7R0.2 NC[C@@H](O)C[PH](=O)O Amb27596096 [1,1,0,0,0,0|2,0,0]=4 3616 B7R0.2 NC[C@H](F)C[PH](=O)O Amb27216774 [1,1,0,0,0,0|2,0,0]=4 3617 B7R0.2 NC[C@H](O)CC(=O)O Amb8628962 [1,1,0,0,0,0|1,0,0]=3 3618 B7R0.2 N[C@@H](CO)CC(=O)O Amb16184020 [1,1,0,0,0,0|1,0,0]=3 3619 B7R0.2 N[C@@H](CO)CC(=O)O Amb22388520 [1,1,0,0,0,0|1,0,0]=3 3620 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [1,1,0,0,0,0|1,0,1]=4 3621 B7R0.2 N[C@H](CO)CC(=O)O Amb2694944 [1,1,0,0,0,0|1,0,0]=3 3622 B7R0.2 N[C@H](CS)CC(=O)O Amb28326106 [1,1,0,0,0,0|1,0,0]=3 3623 B7R0.2 O=C(O)CC(=O)CCl Amb18124484 [1,1,0,0,0,0|1,0,1]=4 3624 B7R0.2 O=C(O)CC(O)CBr Amb27592126 [1,1,0,0,0,0|1,0,0]=3 3625 B7R0.2 O=C(O)CC(O)CF Amb26557587 [1,1,0,0,0,0|1,0,0]=3 3626 B7R0.2 O=C(O)CC(O)CO Amb28120003 [1,1,0,0,0,0|1,0,0]=3 3627 B7R0.2 O=C(O)CC(O)CS Amb27244674 [1,1,0,0,0,0|1,0,0]=3 3628 B7R0.2 O=C(O)C[C@@H](O)CF Amb33377449 [1,1,0,0,0,0|1,0,0]=3 3629 B7R0.2 O=C(O)C[C@H](O)CBr Amb28325607 [1,1,0,0,0,0|1,0,0]=3 3630 B7R0.2 O=C(O)C[C@H](O)CCl Amb27830780 [1,1,0,0,0,0|1,0,0]=3 3631 B7R0.2 O=C(O)C[C@H](O)CF Amb33377451 [1,1,0,0,0,0|1,0,0]=3 3632 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [1,1,0,0,0,0|1,0,0]=3 3633 B7R0.2 O=C([O-])CC(O)CO Amb24117078 [1,1,0,0,0,0|1,0,1]=4 3634 B7R0.2 [C-]#[N+]C(C)CC(C)C Amb19944627 [1,1,0,0,0,0|2,0,0]=4 3635 B7R0.3 C#CC(=O)CCCC Amb28128200 [1,1,0,0,0,0|1,0,0]=3 3636 B7R0.3 C#CC(=O)CCCCl Amb27669507 [1,1,0,0,0,0|2,0,0]=4 3637 B7R0.3 C#CC(=O)CCCN Amb27631285 [1,1,0,0,0,0|2,0,0]=4 3638 B7R0.3 C#CC(=O)CCCO Amb27593195 [1,1,0,0,0,0|2,0,0]=4 3639 B7R0.3 C#CC(=O)OCCC Amb27761363 [1,1,0,0,0,0|2,0,0]=4 3640 B7R0.3 C#CCCC(=O)OC Amb18115985 [1,1,0,0,0,0|0,0,2]=4 3641 B7R0.3 C#CCCC(C)CBr Amb27870517 [1,1,0,0,0,0|1,0,1]=4 3642 B7R0.3 C#CCCC(C)CC Amb33318457 [1,1,0,0,0,0|1,0,1]=4 3643 B7R0.3 C#CCCC(C)CCl Amb28385488 [1,1,0,0,0,0|1,0,1]=4 3644 B7R0.3 C#C[C@H](C)CCCO Amb28126416 [1,1,0,0,0,0|0,0,2]=4 3645 B7R0.3 C=C(C=O)CCCC Amb4025817 [1,1,0,0,0,0|1,0,0]=3 3646 B7R0.3 C=C(C=O)CCCO Amb28128165 [1,1,0,0,0,0|2,0,0]=4 3647 B7R0.3 C=C(C=O)CCOC Amb27948778 [1,1,0,0,0,0|2,0,0]=4 3648 B7R0.3 C=C(CBr)CCCC Amb25249105 [1,1,0,0,0,0|2,0,0]=4 3649 B7R0.3 C=C(CC)CCC=O Amb27233336 [1,1,0,0,0,0|0,0,2]=4 3650 B7R0.3 C=C(CC)CCCC Amb9787281 [1,1,0,0,0,0|2,0,0]=4 3651 B7R0.3 C=C(CCl)CCCC Amb25889368 [1,1,0,0,0,0|2,0,0]=4 3652 B7R0.3 C=C(CN)CCCC Amb27630595 [1,1,0,0,0,0|2,0,0]=4 3653 B7R0.3 C=CC(=O)CCCC Amb25062494 [1,1,0,0,0,0|1,0,0]=3 3654 B7R0.3 C=CC(=O)CCCCl Amb24568327 [1,1,0,0,0,0|2,0,0]=4 3655 B7R0.3 C=CC(=O)CCOC Amb24744935 [1,1,0,0,0,0|2,0,0]=4 3656 B7R0.3 C=CC(=O)CCSC Amb25334636 [1,1,0,0,0,0|2,0,0]=4 3657 B7R0.3 C=CC(=O)COCC Amb27248148 [1,1,0,0,0,0|2,0,0]=4 3658 B7R0.3 C=CC(=O)CSCC Amb25865187 [1,1,0,0,0,0|2,0,0]=4 3659 B7R0.3 C=CC(=O)NCCC Amb9480391 [1,1,0,0,0,0|2,0,0]=4 3660 B7R0.3 C=CC(=O)OCCC Amb22045218 [1,1,0,0,0,0|2,0,0]=4 3661 B7R0.3 C=CC(C)CCCO Amb22641468 [1,1,0,0,0,0|0,0,2]=4 3662 B7R0.3 C=CC(N)CCC=O Amb33036368 [1,1,0,0,0,0|1,0,1]=4 3663 B7R0.3 C=CCCC(=O)NO Amb28205003 [1,1,0,0,0,0|0,0,2]=4 3664 B7R0.3 C=CCCC(=O)OC Amb2369959 [1,1,0,0,0,0|0,0,2]=4 3665 B7R0.3 C=CCCC(Br)CBr Amb17779511 [1,1,0,0,0,0|2,0,0]=4 3666 B7R0.3 C=CCCC(C)C#N Amb18124159 [1,1,0,0,0,0|1,0,1]=4 3667 B7R0.3 C=CCCC(C)C=O Amb25100921 [1,1,0,0,0,0|1,0,1]=4 3668 B7R0.3 C=CCCC(C)CBr Amb26952992 [1,1,0,0,0,0|1,0,0]=3 3669 B7R0.3 C=CCCC(C)CC Amb26860723 [1,1,0,0,0,0|1,0,0]=3 3670 B7R0.3 C=CCCC(C)CCl Amb24481361 [1,1,0,0,0,0|1,0,0]=3 3671 B7R0.3 C=CCCC(C)CN Amb25189032 [1,1,0,0,0,0|1,0,0]=3 3672 B7R0.3 C=CCCC(C)CN Amb33611653 [1,1,0,0,0,0|1,0,0]=3 3673 B7R0.3 C=CCCC(C)CO Amb27760347 [1,1,0,0,0,0|1,0,0]=3 3674 B7R0.3 C=CCCC(C)NC Amb18641747 [1,1,0,0,0,0|1,0,0]=3 3675 B7R0.3 C=CCCC(C)SC Amb28049294 [1,1,0,0,0,0|1,0,0]=3 3676 B7R0.3 C=CCCC(Cl)CC Amb27394730 [1,1,0,0,0,0|2,0,0]=4 3677 B7R0.3 C=CCCC(N)CN Amb20667712 [1,1,0,0,0,0|2,0,0]=4 3678 B7R0.3 C=CCCC(N)CN Amb27267278 [1,1,0,0,0,0|2,0,0]=4 3679 B7R0.3 C=CCCC(N)CO Amb33532619 [1,1,0,0,0,0|2,0,0]=4 3680 B7R0.3 C=CCCC(O)CC Amb22052608 [1,1,0,0,0,0|2,0,0]=4 3681 B7R0.3 C=CCCC(O)CN Amb8630191 [1,1,0,0,0,0|2,0,0]=4 3682 B7R0.3 C=CCCC(O)CO Amb10071251 [1,1,0,0,0,0|2,0,0]=4 3683 B7R0.3 C=CCCN(C)OC Amb27837936 [1,1,0,0,0,0|2,0,0]=4 3684 B7R0.3 C=CCC[C@@H](O)CO Amb27405919 [1,1,0,0,0,0|2,0,0]=4 3685 B7R0.3 C=CCC[C@H](C)C=O Amb27799770 [1,1,0,0,0,0|1,0,1]=4 3686 B7R0.3 C=CCC[C@H](N)CO Amb27390564 [1,1,0,0,0,0|2,0,0]=4 3687 B7R0.3 C=CCC[C@H](O)CC Amb27946057 [1,1,0,0,0,0|2,0,0]=4 3688 B7R0.3 C=CCNC(C)CC Amb6683957 [1,1,0,0,0,0|2,0,0]=4 3689 B7R0.3 C=CCNC(C)CO Amb27870336 [1,1,0,0,0,0|2,0,0]=4 3690 B7R0.3 C=CCOC(C)CN Amb33530554 [1,1,0,0,0,0|2,0,0]=4 3691 B7R0.3 C=CCO[C@@H](C)CN Amb27593844 [1,1,0,0,0,0|2,0,0]=4 3692 B7R0.3 C=CCO[C@@H](C)CO Amb25228448 [1,1,0,0,0,0|2,0,0]=4 3693 B7R0.3 C=CCSC(C)CC Amb3940675 [1,1,0,0,0,0|2,0,0]=4 3694 B7R0.3 C=CCSC(C)CO Amb28341848 [1,1,0,0,0,0|2,0,0]=4 3695 B7R0.3 C=C[C@@H](C)CCC=O Amb25025116 [1,1,0,0,0,0|0,0,1]=3 3696 B7R0.3 CC#CCC(=O)OC Amb6336504 [1,1,0,0,0,0|0,0,2]=4 3697 B7R0.3 CC(CCCO)NN Amb24462745 [1,1,0,0,0,0|1,0,1]=4 3698 B7R0.3 CC(CCl)CCCN Amb27472589 [1,1,0,0,0,0|1,0,1]=4 3699 B7R0.3 CC(CCl)CCCO Amb27439284 [1,1,0,0,0,0|0,0,1]=3 3700 B7R0.3 CC(CN)CCC=N Amb27640087 [1,1,0,0,0,0|1,0,0]=3 3701 B7R0.3 CC(CN)CCCBr Amb28246470 [1,1,0,0,0,0|1,0,1]=4 3702 B7R0.3 CC(CN)CCCO Amb17569906 [1,1,0,0,0,0|0,0,1]=3 3703 B7R0.3 CC(CN)CCCO Amb28934846 [1,1,0,0,0,0|0,0,1]=3 3704 B7R0.3 CC(CN)NCCO Amb24738477 [1,1,0,0,0,0|1,0,1]=4 3705 B7R0.3 CC(CN)OCCO Amb27883131 [1,1,0,0,0,0|1,0,1]=4 3706 B7R0.3 CC(CO)CCC#N Amb28128191 [1,1,0,0,0,0|1,0,1]=4 3707 B7R0.3 CC(CO)CCCN Amb17569904 [1,1,0,0,0,0|1,0,1]=4 3708 B7R0.3 CC(CO)CCCN Amb32686956 [1,1,0,0,0,0|1,0,1]=4 3709 B7R0.3 CC(CO)CCCO Amb25098490 [1,1,0,0,0,0|0,0,1]=3 3710 B7R0.3 CC(CO)CNC=O Amb27482480 [1,1,0,0,0,0|1,0,0]=3 3711 B7R0.3 CC(CO)NCCO Amb9360025 [1,1,0,0,0,0|1,0,1]=4 3712 B7R0.3 CC(CO)OCCO Amb27594177 [1,1,0,0,0,0|1,0,1]=4 3713 B7R0.3 CC(CO)SCCO Amb27440688 [1,1,0,0,0,0|1,0,1]=4 3714 B7R0.3 CCC#CC(=O)OC Amb27838321 [1,1,0,0,0,0|0,0,2]=4 3715 B7R0.3 CCC(=O)CCCBr Amb25765636 [1,1,0,0,0,0|2,0,0]=4 3716 B7R0.3 CCC(=O)CCCCl Amb17593423 [1,1,0,0,0,0|2,0,0]=4 3717 B7R0.3 CCC(=O)CCCN Amb18833012 [1,1,0,0,0,0|2,0,0]=4 3718 B7R0.3 CCC(=O)CCNC Amb27963044 [1,1,0,0,0,0|2,0,0]=4 3719 B7R0.3 CCC(=O)CCSC Amb25680024 [1,1,0,0,0,0|2,0,0]=4 3720 B7R0.3 CCC(C)C#CC=O Amb27828859 [1,1,0,0,0,0|0,0,2]=4 3721 B7R0.3 CCC(C)CCC#N Amb26382039 [1,1,0,0,0,0|1,0,1]=4 3722 B7R0.3 CCC(C)CCCBr Amb18184302 [1,1,0,0,0,0|1,0,1]=4 3723 B7R0.3 CCC(C)CCCCl Amb25094579 [1,1,0,0,0,0|1,0,1]=4 3724 B7R0.3 CCC(C)CCCN Amb17569898 [1,1,0,0,0,0|1,0,1]=4 3725 B7R0.3 CCC(C)CCCO Amb28070020 [1,1,0,0,0,0|0,0,1]=3 3726 B7R0.3 CCC(C)CCCS Amb33318441 [1,1,0,0,0,0|0,1,1]=4 3727 B7R0.3 CCC(C)CCNC Amb18523839 [1,1,0,0,0,0|2,0,0]=4 3728 B7R0.3 CCC(C)CCNN Amb27852367 [1,1,0,0,0,0|2,0,0]=4 3729 B7R0.3 CCC(C)CCNO Amb27442658 [1,1,0,0,0,0|1,0,0]=3 3730 B7R0.3 CCC(C)CCON Amb33226956 [1,1,0,0,0,0|2,0,0]=4 3731 B7R0.3 CCC(C)CN=C=O Amb25783333 [1,1,0,0,0,0|1,0,1]=4 3732 B7R0.3 CCC(C)C\C=N\O Amb27843883 [1,1,0,0,0,0|1,0,1]=4 3733 B7R0.3 CCC(C)NCCO Amb6707239 [1,1,0,0,0,0|1,0,1]=4 3734 B7R0.3 CCC(C)\C=C\C=O Amb32954899 [1,1,0,0,0,0|0,0,2]=4 3735 B7R0.3 CCC(Cl)CCC=O Amb27637733 [1,1,0,0,0,0|1,0,0]=3 3736 B7R0.3 CCC(N)CCC=O Amb33036216 [1,1,0,0,0,0|1,0,0]=3 3737 B7R0.3 CCC(N)CCCO Amb18641929 [1,1,0,0,0,0|1,0,1]=4 3738 B7R0.3 CCC(O)CCCO Amb17593216 [1,1,0,0,0,0|1,0,1]=4 3739 B7R0.3 CCCCC(=N)OC Amb17617956 [1,1,0,0,0,0|1,0,0]=3 3740 B7R0.3 CCCCC(=N)OC Amb25353357 [1,1,0,0,0,0|1,0,0]=3 3741 B7R0.3 CCCCC(=O)C#N Amb22729179 [1,1,0,0,0,0|1,0,0]=3 3742 B7R0.3 CCCCC(=O)CBr Amb24563421 [1,1,0,0,0,0|1,0,0]=3 3743 B7R0.3 CCCCC(=O)CC Amb4605999 [1,1,0,0,0,0|1,0,0]=3 3744 B7R0.3 CCCCC(=O)CCl Amb17593420 [1,1,0,0,0,0|1,0,0]=3 3745 B7R0.3 CCCCC(=O)CN Amb24473062 [1,1,0,0,0,0|1,0,0]=3 3746 B7R0.3 CCCCC(=O)CO Amb26073501 [1,1,0,0,0,0|0,0,0]=2 3747 B7R0.3 CCCCC(=O)NC Amb5797766 [1,1,0,0,0,0|1,0,0]=3 3748 B7R0.3 CCCCC(=O)NN Amb534136 [1,1,0,0,0,0|1,0,0]=3 3749 B7R0.3 CCCCC(=O)NO Amb6269796 [1,1,0,0,0,0|0,0,0]=2 3750 B7R0.3 CCCCC(=S)NC Amb27838397 [1,1,0,0,0,0|1,1,0]=4 3751 B7R0.3 CCCCC(Br)C=O Amb17594581 [1,1,0,0,0,0|1,0,1]=4 3752 B7R0.3 CCCCC(C)C=O Amb17593191 [1,1,0,0,0,0|1,0,1]=4 3753 B7R0.3 CCCCC(C)CBr Amb22227886 [1,1,0,0,0,0|1,0,1]=4 3754 B7R0.3 CCCCC(C)CC Amb10071971 [1,1,0,0,0,0|1,0,1]=4 3755 B7R0.3 CCCCC(C)CCl Amb24481359 [1,1,0,0,0,0|1,0,1]=4 3756 B7R0.3 CCCCC(C)CN Amb18311071 [1,1,0,0,0,0|1,0,1]=4 3757 B7R0.3 CCCCC(C)CO Amb17593205 [1,1,0,0,0,0|1,0,1]=4 3758 B7R0.3 CCCCC(C)NC Amb9620956 [1,1,0,0,0,0|1,0,1]=4 3759 B7R0.3 CCCCC(C)ON Amb33428411 [1,1,0,0,0,0|1,0,1]=4 3760 B7R0.3 CCCCC(F)C=O Amb27838938 [1,1,0,0,0,0|1,0,1]=4 3761 B7R0.3 CCCCC(N)C=O Amb28422291 [1,1,0,0,0,0|1,0,1]=4 3762 B7R0.3 CCCCC(N)CO Amb3939373 [1,1,0,0,0,0|1,0,1]=4 3763 B7R0.3 CCCCC(O)CBr Amb25233429 [1,1,0,0,0,0|1,0,1]=4 3764 B7R0.3 CCCCC(O)CC Amb10844720 [1,1,0,0,0,0|1,0,1]=4 3765 B7R0.3 CCCCC(O)CCl Amb24481415 [1,1,0,0,0,0|1,0,1]=4 3766 B7R0.3 CCCCC(O)CF Amb27807497 [1,1,0,0,0,0|1,0,1]=4 3767 B7R0.3 CCCCC(O)CN Amb8630130 [1,1,0,0,0,0|1,0,1]=4 3768 B7R0.3 CCCCC(O)CO Amb8390318 [1,1,0,0,0,0|0,0,2]=4 3769 B7R0.3 CCCCN(C)C=O Amb26967032 [1,1,0,0,0,0|2,0,0]=4 3770 B7R0.3 CCCCN(C)N=O Amb22231185 [1,1,0,0,0,0|2,0,0]=4 3771 B7R0.3 CCCCN(O)CC Amb27230146 [1,1,0,0,0,0|2,0,0]=4 3772 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [1,1,0,0,0,0|1,0,1]=4 3773 B7R0.3 CCCC[C@@H](C)CN Amb27780030 [1,1,0,0,0,0|1,0,1]=4 3774 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [1,1,0,0,0,0|1,0,1]=4 3775 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [1,1,0,0,0,0|1,0,1]=4 3776 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [1,1,0,0,0,0|1,0,1]=4 3777 B7R0.3 CCCC[C@@H](O)C#N Amb27798698 [1,1,0,0,0,0|1,0,1]=4 3778 B7R0.3 CCCC[C@@H](O)CN Amb33428417 [1,1,0,0,0,0|1,0,1]=4 3779 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [1,1,0,0,0,0|1,0,1]=4 3780 B7R0.3 CCCC[C@H](C)CN Amb25889982 [1,1,0,0,0,0|1,0,1]=4 3781 B7R0.3 CCCC[C@H](C)CO Amb26370424 [1,1,0,0,0,0|1,0,1]=4 3782 B7R0.3 CCCC[C@H](F)CO Amb28315208 [1,1,0,0,0,0|1,0,1]=4 3783 B7R0.3 CCCC[C@H](N)CO Amb3941478 [1,1,0,0,0,0|1,0,1]=4 3784 B7R0.3 CCCC[C@H](O)CF Amb27656199 [1,1,0,0,0,0|1,0,1]=4 3785 B7R0.3 CCCC[C@H](O)CN Amb33428416 [1,1,0,0,0,0|1,0,1]=4 3786 B7R0.3 CCCC[C@H](S)CO Amb27804425 [1,1,0,0,0,0|0,1,1]=4 3787 B7R0.3 CCCC\C(Br)=C\Cl Amb27484205 [1,1,0,0,0,0|2,0,0]=4 3788 B7R0.3 CCCC\C(C)=N\N Amb27883272 [1,1,0,0,0,0|2,0,0]=4 3789 B7R0.3 CCCC\C(Cl)=N\O Amb28397410 [1,1,0,0,0,0|1,0,0]=3 3790 B7R0.3 CCCC\C(N)=N/O Amb2696577 [1,1,0,0,0,0|1,0,0]=3 3791 B7R0.3 CCCC\C(N)=N\O Amb8391665 [1,1,0,0,0,0|1,0,0]=3 3792 B7R0.3 CCCNC(=O)CBr Amb17330843 [1,1,0,0,0,0|2,0,0]=4 3793 B7R0.3 CCCNC(=O)CC Amb5797516 [1,1,0,0,0,0|2,0,0]=4 3794 B7R0.3 CCCNC(=O)CCl Amb1207068 [1,1,0,0,0,0|2,0,0]=4 3795 B7R0.3 CCCNC(=O)CI Amb23512283 [1,1,0,0,0,0|2,0,0]=4 3796 B7R0.3 CCCNC(=O)CN Amb10781813 [1,1,0,0,0,0|2,0,0]=4 3797 B7R0.3 CCCNC(=O)CN Amb426858 [1,1,0,0,0,0|2,0,0]=4 3798 B7R0.3 CCCNC(=O)CO Amb5798169 [1,1,0,0,0,0|1,0,0]=3 3799 B7R0.3 CCCNC(=O)NCl Amb28057729 [1,1,0,0,0,0|2,0,0]=4 3800 B7R0.3 CCCNC(=O)NN Amb8854021 [1,1,0,0,0,0|2,0,0]=4 3801 B7R0.3 CCCN\C(C)=N\O Amb27234636 [1,1,0,0,0,0|2,0,0]=4 3802 B7R0.3 CCCN\C(N)=N\O Amb28430250 [1,1,0,0,0,0|2,0,0]=4 3803 B7R0.3 CCCOC(=O)C=O Amb18641875 [1,1,0,0,0,0|1,0,1]=4 3804 B7R0.3 CCCOC(=O)CCl Amb9787444 [1,1,0,0,0,0|2,0,0]=4 3805 B7R0.3 CCCOC(=O)CN Amb9826861 [1,1,0,0,0,0|2,0,0]=4 3806 B7R0.3 CCCOC(=O)CO Amb25964379 [1,1,0,0,0,0|1,0,0]=3 3807 B7R0.3 CCCOC(=O)OC Amb27153532 [1,1,0,0,0,0|1,0,0]=3 3808 B7R0.3 CCCSC(=O)CBr Amb28385643 [1,1,0,0,0,0|2,0,0]=4 3809 B7R0.3 CCCSC(=O)CC Amb25882938 [1,1,0,0,0,0|2,0,0]=4 3810 B7R0.3 CCCSC(=O)NC Amb27788550 [1,1,0,0,0,0|2,0,0]=4 3811 B7R0.3 CCCSC(=O)NN Amb27769595 [1,1,0,0,0,0|2,0,0]=4 3812 B7R0.3 CCC\C=C(/Cl)C=O Amb27201672 [1,1,0,0,0,0|1,0,1]=4 3813 B7R0.3 CCN(C)CCCO Amb8428182 [1,1,0,0,0,0|1,0,1]=4 3814 B7R0.3 CCNCC(=O)NC Amb32680747 [1,1,0,0,0,0|2,0,0]=4 3815 B7R0.3 CCNCC(=O)NC Amb6251820 [1,1,0,0,0,0|2,0,0]=4 3816 B7R0.3 CCNCC(=O)NO Amb27755137 [1,1,0,0,0,0|1,0,0]=3 3817 B7R0.3 CCNCC(=O)OC Amb19514718 [1,1,0,0,0,0|1,0,0]=3 3818 B7R0.3 CCNCC(=O)OC Amb6687125 [1,1,0,0,0,0|1,0,0]=3 3819 B7R0.3 CCNC\C(N)=N\O Amb24612871 [1,1,0,0,0,0|2,0,0]=4 3820 B7R0.3 CCOCC(=O)CC Amb27406475 [1,1,0,0,0,0|2,0,0]=4 3821 B7R0.3 CCOCC(=O)CCl Amb25087764 [1,1,0,0,0,0|2,0,0]=4 3822 B7R0.3 CCOCC(=O)CF Amb28316133 [1,1,0,0,0,0|2,0,0]=4 3823 B7R0.3 CCOCC(=O)CN Amb27453616 [1,1,0,0,0,0|2,0,0]=4 3824 B7R0.3 CCOCC(=O)CO Amb28066809 [1,1,0,0,0,0|1,0,0]=3 3825 B7R0.3 CCOCC(=O)NN Amb2111918 [1,1,0,0,0,0|2,0,0]=4 3826 B7R0.3 CCOCC(=O)NN Amb6744505 [1,1,0,0,0,0|2,0,0]=4 3827 B7R0.3 CCOCC(=O)OC Amb7753022 [1,1,0,0,0,0|1,0,0]=3 3828 B7R0.3 CCOCC(O)C=O Amb27883256 [1,1,0,0,0,0|1,0,1]=4 3829 B7R0.3 CCOC\C(C)=N\O Amb28049034 [1,1,0,0,0,0|2,0,0]=4 3830 B7R0.3 CCOC\C(N)=N\O Amb6280903 [1,1,0,0,0,0|2,0,0]=4 3831 B7R0.3 CCONC(=O)CO Amb27762105 [1,1,0,0,0,0|2,0,0]=4 3832 B7R0.3 CCSCC(=O)CCl Amb24545960 [1,1,0,0,0,0|2,0,0]=4 3833 B7R0.3 CCSCC(=O)CN Amb33324079 [1,1,0,0,0,0|2,0,0]=4 3834 B7R0.3 CCSCC(=O)NN Amb2610654 [1,1,0,0,0,0|2,0,0]=4 3835 B7R0.3 CCSCC(=O)OC Amb7753193 [1,1,0,0,0,0|1,0,0]=3 3836 B7R0.3 CCSC\C(N)=N\O Amb6680779 [1,1,0,0,0,0|2,0,0]=4 3837 B7R0.3 CCS\C=C(\O)C=O Amb27412581 [1,1,0,0,0,0|1,0,1]=4 3838 B7R0.3 CC[C@@H](C)CCC=O Amb27949584 [1,1,0,0,0,0|0,0,0]=2 3839 B7R0.3 CC[C@@H](C)CCCCl Amb27166913 [1,1,0,0,0,0|1,0,1]=4 3840 B7R0.3 CC[C@@H](C)CCCO Amb22799989 [1,1,0,0,0,0|0,0,1]=3 3841 B7R0.3 CC[C@H](C)CCCBr Amb27619630 [1,1,0,0,0,0|1,0,1]=4 3842 B7R0.3 CC[C@H](C)CCCO Amb22226203 [1,1,0,0,0,0|0,0,1]=3 3843 B7R0.3 CC[C@H](C)CN=C=O Amb27210806 [1,1,0,0,0,0|1,0,1]=4 3844 B7R0.3 CC[C@H](C)\C=C\C=O Amb27873518 [1,1,0,0,0,0|0,0,2]=4 3845 B7R0.3 CC\C=C\C(=O)OC Amb2689583 [1,1,0,0,0,0|0,0,2]=4 3846 B7R0.3 CN(CCC=O)N=O Amb17617679 [1,1,0,0,0,0|2,0,0]=4 3847 B7R0.3 CNC(=O)CCCCl Amb1137464 [1,1,0,0,0,0|2,0,0]=4 3848 B7R0.3 CNC(=O)CCCI Amb27625606 [1,1,0,0,0,0|2,0,0]=4 3849 B7R0.3 CNC(=O)CCCN Amb6263864 [1,1,0,0,0,0|2,0,0]=4 3850 B7R0.3 CNC(=O)CCCN Amb9176288 [1,1,0,0,0,0|2,0,0]=4 3851 B7R0.3 CNC(=O)CCCO Amb17231829 [1,1,0,0,0,0|2,0,0]=4 3852 B7R0.3 CNC(=O)CCCS Amb27259921 [1,1,0,0,0,0|2,0,0]=4 3853 B7R0.3 CNC(=O)CCOC Amb27655430 [1,1,0,0,0,0|2,0,0]=4 3854 B7R0.3 CNC(C)CCC#N Amb29852752 [1,1,0,0,0,0|1,0,1]=4 3855 B7R0.3 CNC(C)CCCO Amb17569902 [1,1,0,0,0,0|0,0,1]=3 3856 B7R0.3 CNC(C)CCOC Amb17569918 [1,1,0,0,0,0|2,0,0]=4 3857 B7R0.3 CNC(C)CCSC Amb19515468 [1,1,0,0,0,0|2,0,0]=4 3858 B7R0.3 CNCCC(=N)OC Amb28411188 [1,1,0,0,0,0|2,0,0]=4 3859 B7R0.3 CNCCC(=O)NC Amb19959924 [1,1,0,0,0,0|2,0,0]=4 3860 B7R0.3 CNCCC(=O)NC Amb8428200 [1,1,0,0,0,0|2,0,0]=4 3861 B7R0.3 CNCCC(=O)NN Amb28143068 [1,1,0,0,0,0|2,0,0]=4 3862 B7R0.3 CNCCC(=O)NO Amb27763537 [1,1,0,0,0,0|1,0,0]=3 3863 B7R0.3 CNCCC(=O)OC Amb22168213 [1,1,0,0,0,0|1,0,0]=3 3864 B7R0.3 CNCCC(=O)OC Amb7969878 [1,1,0,0,0,0|1,0,0]=3 3865 B7R0.3 CNCCC(C)CN Amb17334066 [1,1,0,0,0,0|2,0,0]=4 3866 B7R0.3 CNCCC(C)CO Amb17569900 [1,1,0,0,0,0|2,0,0]=4 3867 B7R0.3 CNCCC(C)OC Amb17569916 [1,1,0,0,0,0|2,0,0]=4 3868 B7R0.3 CNCC\C(N)=N/O Amb19981296 [1,1,0,0,0,0|2,0,0]=4 3869 B7R0.3 CNCC\C(N)=N\O Amb22410480 [1,1,0,0,0,0|2,0,0]=4 3870 B7R0.3 CNOCC(=O)OC Amb32662920 [1,1,0,0,0,0|2,0,0]=4 3871 B7R0.3 CNOCC(=O)OC Amb33067971 [1,1,0,0,0,0|2,0,0]=4 3872 B7R0.3 COC(=N)CCCCl Amb16231406 [1,1,0,0,0,0|2,0,0]=4 3873 B7R0.3 COC(=N)CCCCl Amb27631457 [1,1,0,0,0,0|2,0,0]=4 3874 B7R0.3 COC(=N)CCCS Amb27628992 [1,1,0,0,0,0|2,0,0]=4 3875 B7R0.3 COC(=O)CCC#N Amb2689406 [1,1,0,0,0,0|1,0,1]=4 3876 B7R0.3 COC(=O)CCC=O Amb18124259 [1,1,0,0,0,0|1,0,1]=4 3877 B7R0.3 COC(=O)CCCBr Amb8516943 [1,1,0,0,0,0|1,0,0]=3 3878 B7R0.3 COC(=O)CCCCl Amb3940271 [1,1,0,0,0,0|1,0,0]=3 3879 B7R0.3 COC(=O)CCCI Amb3941711 [1,1,0,0,0,0|1,0,0]=3 3880 B7R0.3 COC(=O)CCCN Amb402626 [1,1,0,0,0,0|1,0,0]=3 3881 B7R0.3 COC(=O)CCCS Amb19373761 [1,1,0,0,0,0|1,0,0]=3 3882 B7R0.3 COC(=O)CCC[NH3+] Amb2778689 [1,1,0,0,0,0|1,0,0]=3 3883 B7R0.3 COC(=O)CCON Amb29848091 [1,1,0,0,0,0|2,0,0]=4 3884 B7R0.3 COC(=O)CCSC Amb8393179 [1,1,0,0,0,0|1,0,0]=3 3885 B7R0.3 COC(=O)CSCBr Amb28458464 [1,1,0,0,0,0|2,0,0]=4 3886 B7R0.3 COC(=O)NCCN Amb18970459 [1,1,0,0,0,0|2,0,0]=4 3887 B7R0.3 COC(=O)NCCN Amb28934803 [1,1,0,0,0,0|2,0,0]=4 3888 B7R0.3 COC(=O)NCCO Amb9285601 [1,1,0,0,0,0|2,0,0]=4 3889 B7R0.3 COC(=O)NCSC Amb28398191 [1,1,0,0,0,0|2,0,0]=4 3890 B7R0.3 COC(=O)OCCBr Amb27228663 [1,1,0,0,0,0|2,0,0]=4 3891 B7R0.3 COC(=O)SCCCl Amb27640237 [1,1,0,0,0,0|2,0,0]=4 3892 B7R0.3 COC(C)CCC=O Amb25917630 [1,1,0,0,0,0|0,0,0]=2 3893 B7R0.3 COC(C)CCCBr Amb27198618 [1,1,0,0,0,0|1,0,1]=4 3894 B7R0.3 COC(C)CCCCl Amb28397922 [1,1,0,0,0,0|1,0,1]=4 3895 B7R0.3 COC(C)CCCN Amb17569913 [1,1,0,0,0,0|1,0,1]=4 3896 B7R0.3 COC(C)\C=C\C=O Amb27640624 [1,1,0,0,0,0|0,0,2]=4 3897 B7R0.3 COCCC(=O)CCl Amb20622320 [1,1,0,0,0,0|2,0,0]=4 3898 B7R0.3 COCCC(=O)CN Amb26515688 [1,1,0,0,0,0|2,0,0]=4 3899 B7R0.3 COCCC(=O)NN Amb2689273 [1,1,0,0,0,0|2,0,0]=4 3900 B7R0.3 COCCC(=O)OC Amb6296150 [1,1,0,0,0,0|1,0,0]=3 3901 B7R0.3 COCCC(C)CBr Amb27210700 [1,1,0,0,0,0|2,0,0]=4 3902 B7R0.3 COCCC(C)CCl Amb26887699 [1,1,0,0,0,0|2,0,0]=4 3903 B7R0.3 COCCC(C)CN Amb17569915 [1,1,0,0,0,0|2,0,0]=4 3904 B7R0.3 COCCC(C)SC Amb27838053 [1,1,0,0,0,0|2,0,0]=4 3905 B7R0.3 COCC\C(N)=C\O Amb28364926 [1,1,0,0,0,0|2,0,0]=4 3906 B7R0.3 COCC\C(N)=N/O Amb19890177 [1,1,0,0,0,0|2,0,0]=4 3907 B7R0.3 COCC\C(N)=N/O Amb2696139 [1,1,0,0,0,0|2,0,0]=4 3908 B7R0.3 COCC\C(N)=N\O Amb22490466 [1,1,0,0,0,0|2,0,0]=4 3909 B7R0.3 COCC\C(N)=N\O Amb8384548 [1,1,0,0,0,0|2,0,0]=4 3910 B7R0.3 COCNC(=O)OC Amb27253203 [1,1,0,0,0,0|2,0,0]=4 3911 B7R0.3 CON(C)CCCO Amb26370515 [1,1,0,0,0,0|1,0,1]=4 3912 B7R0.3 CO[C@@H](C)CNC=O Amb35605354 [1,1,0,0,0,0|1,0,0]=3 3913 B7R0.3 CO[C@H](C)CNC=O Amb35605356 [1,1,0,0,0,0|1,0,0]=3 3914 B7R0.3 CO\C(C)=C\CC=O Amb28283269 [1,1,0,0,0,0|0,0,2]=4 3915 B7R0.3 CSC(=O)CCCCl Amb27249585 [1,1,0,0,0,0|1,1,0]=4 3916 B7R0.3 CSC(C)CN=C=O Amb28422389 [1,1,0,0,0,0|1,0,1]=4 3917 B7R0.3 CSCCC(=O)CCl Amb25910902 [1,1,0,0,0,0|2,0,0]=4 3918 B7R0.3 CSCCC(=O)CF Amb28316167 [1,1,0,0,0,0|2,0,0]=4 3919 B7R0.3 CSCCC(=O)CN Amb33199125 [1,1,0,0,0,0|2,0,0]=4 3920 B7R0.3 CSCCC(C)CBr Amb26508349 [1,1,0,0,0,0|2,0,0]=4 3921 B7R0.3 CSCCC(C)CCl Amb27870601 [1,1,0,0,0,0|2,0,0]=4 3922 B7R0.3 CSCCC(C)CN Amb28291178 [1,1,0,0,0,0|2,0,0]=4 3923 B7R0.3 CSCC\C(N)=N\O Amb25127504 [1,1,0,0,0,0|2,0,0]=4 3924 B7R0.3 C[C@@H](CN)CCCO Amb27947738 [1,1,0,0,0,0|0,0,1]=3 3925 B7R0.3 C[C@@H](CO)CCCBr Amb28128316 [1,1,0,0,0,0|1,0,1]=4 3926 B7R0.3 C[C@@H](CO)CCCO Amb27664197 [1,1,0,0,0,0|0,0,1]=3 3927 B7R0.3 C[C@@H](CO)NCCO Amb27881216 [1,1,0,0,0,0|1,0,1]=4 3928 B7R0.3 C[C@@H](CO)OCCO Amb28461084 [1,1,0,0,0,0|1,0,1]=4 3929 B7R0.3 C[C@H](CN)NCCO Amb28049033 [1,1,0,0,0,0|1,0,1]=4 3930 B7R0.3 C[C@H](CO)NCCO Amb27173258 [1,1,0,0,0,0|1,0,1]=4 3931 B7R0.3 C\C(CCCO)=N/O Amb28207168 [1,1,0,0,0,0|2,0,0]=4 3932 B7R0.3 C\C=C(/C)CCCC Amb22229367 [1,1,0,0,0,0|2,0,0]=4 3933 B7R0.3 C\C=C\CC(=O)OC Amb8394879 [1,1,0,0,0,0|0,0,2]=4 3934 B7R0.3 C\C=C\C[C@@H](C)CO Amb27650152 [1,1,0,0,0,0|1,0,1]=4 3935 B7R0.3 N#CC(=O)CCCCl Amb28410737 [1,1,0,0,0,0|2,0,0]=4 3936 B7R0.3 NC(CO)CCCO Amb18641979 [1,1,0,0,0,0|1,0,1]=4 3937 B7R0.3 NCC(O)CCC=O Amb27855481 [1,1,0,0,0,0|1,0,0]=3 3938 B7R0.3 NCCCC(=O)NN Amb18061734 [1,1,0,0,0,0|2,0,0]=4 3939 B7R0.3 NCCC\C(N)=N\O Amb25889843 [1,1,0,0,0,0|2,0,0]=4 3940 B7R0.3 NC[C@H](O)CCCO Amb27632965 [1,1,0,0,0,0|1,0,1]=4 3941 B7R0.3 NNC(=O)CCCCl Amb9818914 [1,1,0,0,0,0|2,0,0]=4 3942 B7R0.3 NNC(=O)CCCO Amb535400 [1,1,0,0,0,0|2,0,0]=4 3943 B7R0.3 N[C@@H](CO)CCCO Amb28254525 [1,1,0,0,0,0|1,0,1]=4 3944 B7R0.3 N[C@H](CO)CCCO Amb24117047 [1,1,0,0,0,0|1,0,1]=4 3945 B7R0.3 N\C(CCCBr)=N/O Amb4297023 [1,1,0,0,0,0|2,0,0]=4 3946 B7R0.3 O=C(CBr)CCCBr Amb27153779 [1,1,0,0,0,0|2,0,0]=4 3947 B7R0.3 O=C(CBr)CCCCl Amb27875989 [1,1,0,0,0,0|2,0,0]=4 3948 B7R0.3 O=C(CCCCl)NO Amb28061167 [1,1,0,0,0,0|1,0,0]=3 3949 B7R0.3 O=C(CCCF)NO Amb28185008 [1,1,0,0,0,0|1,0,0]=3 3950 B7R0.3 O=C(CCl)CCCBr Amb22395325 [1,1,0,0,0,0|2,0,0]=4 3951 B7R0.3 O=C(CCl)CCCCl Amb22395285 [1,1,0,0,0,0|2,0,0]=4 3952 B7R0.3 O=C(CO)CCCO Amb27227084 [1,1,0,0,0,0|1,0,0]=3 3953 B7R0.3 O=C(CO)NCCO Amb5798091 [1,1,0,0,0,0|2,0,0]=4 3954 B7R0.3 O=C(CO)OCCF Amb28049311 [1,1,0,0,0,0|2,0,0]=4 3955 B7R0.3 O=CC(=O)CCCO Amb27751348 [1,1,0,0,0,0|1,0,1]=4 3956 B7R0.3 O=CCCC(=O)CO Amb27799816 [1,1,0,0,0,0|1,0,1]=4 3957 B7R0.3 O=CCCC(Cl)C=O Amb27232955 [1,1,0,0,0,0|1,0,1]=4 3958 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [1,1,0,0,0,0|1,0,1]=4 3959 B7R0.3 OCCCC(Cl)CCl Amb27203325 [1,1,0,0,0,0|1,0,1]=4 3960 B7R0.3 OCCCC(O)CO Amb17593225 [1,1,0,0,0,0|1,0,1]=4 3961 B7R0.3 OCCCC(S)CS Amb27185627 [1,1,0,0,0,0|1,0,1]=4 3962 B7R0.3 OCCC[C@@H](O)CO Amb27213939 [1,1,0,0,0,0|1,0,1]=4 3963 B7R0.3 OCCC[C@H](Cl)CO Amb27165705 [1,1,0,0,0,0|1,0,1]=4 3964 B7R0.3 [C-]#[N+]CCC(=O)OC Amb2689499 [1,1,0,0,0,0|1,0,1]=4 3965 B7R0.3 [C-]#[N+]CCC(C)CC Amb33373874 [1,1,0,0,0,0|2,0,0]=4 3966 B7R0.4 C#CCCCC(=O)Cl Amb2688725 [1,1,0,0,0,0|1,0,1]=4 3967 B7R0.4 C#CCCCC(=O)O Amb2721705 [1,1,0,0,0,0|0,0,1]=3 3968 B7R0.4 C#CCCCC(C)=O Amb18115312 [1,1,0,0,0,0|1,0,1]=4 3969 B7R0.4 C#CCCCC(C)C Amb18635315 [1,1,0,0,0,0|1,0,1]=4 3970 B7R0.4 C#CCCCC(N)=O Amb27590599 [1,1,0,0,0,0|1,0,1]=4 3971 B7R0.4 C#CCCOC(C)C Amb33473566 [1,1,0,0,0,0|1,0,1]=4 3972 B7R0.4 C#CCNCC(=O)O Amb33551387 [1,1,0,0,0,0|0,0,2]=4 3973 B7R0.4 C#CCNCC(=O)O Amb6740302 [1,1,0,0,0,0|0,0,2]=4 3974 B7R0.4 C#CCNCC(C)C Amb5262806 [1,1,0,0,0,0|1,0,1]=4 3975 B7R0.4 C#CCOCC(=O)O Amb9208655 [1,1,0,0,0,0|0,0,2]=4 3976 B7R0.4 C#CCSCC(=O)O Amb2372297 [1,1,0,0,0,0|0,0,2]=4 3977 B7R0.4 C=C(Br)CCCCBr Amb4035450 [1,1,0,0,0,0|2,0,0]=4 3978 B7R0.4 C=C(C)CCCCC Amb6298938 [1,1,0,0,0,0|2,0,0]=4 3979 B7R0.4 C=C(C)CCCCO Amb26872404 [1,1,0,0,0,0|2,0,0]=4 3980 B7R0.4 C=C(C)CCNC=O Amb27228134 [1,1,0,0,0,0|0,0,2]=4 3981 B7R0.4 C=C(C)CNCCC Amb17308631 [1,1,0,0,0,0|2,0,0]=4 3982 B7R0.4 C=C(C)COCC=O Amb27949608 [1,1,0,0,0,0|0,0,2]=4 3983 B7R0.4 C=C(C)CSCCC Amb27449649 [1,1,0,0,0,0|2,0,0]=4 3984 B7R0.4 C=C(Cl)CNCCC Amb19004838 [1,1,0,0,0,0|2,0,0]=4 3985 B7R0.4 C=C(F)CCCCO Amb22641473 [1,1,0,0,0,0|2,0,0]=4 3986 B7R0.4 C=CCCC=C(C)C Amb25789441 [1,1,0,0,0,0|1,0,1]=4 3987 B7R0.4 C=CCCCC(=O)Cl Amb8392411 [1,1,0,0,0,0|1,0,1]=4 3988 B7R0.4 C=CCCCC(=O)O Amb3941675 [1,1,0,0,0,0|0,0,1]=3 3989 B7R0.4 C=CCCCC(C)=O Amb17593171 [1,1,0,0,0,0|1,0,1]=4 3990 B7R0.4 C=CCCCC(C)C Amb25127926 [1,1,0,0,0,0|1,0,0]=3 3991 B7R0.4 C=CCCCC(C)N Amb25880150 [1,1,0,0,0,0|2,0,0]=4 3992 B7R0.4 C=CCCCC(C)O Amb22059432 [1,1,0,0,0,0|2,0,0]=4 3993 B7R0.4 C=CCCNC(C)C Amb18312589 [1,1,0,0,0,0|1,0,0]=3 3994 B7R0.4 C=CCCOC(C)C Amb28184344 [1,1,0,0,0,0|1,0,0]=3 3995 B7R0.4 C=CCCSC(C)C Amb27802079 [1,1,0,0,0,0|1,0,0]=3 3996 B7R0.4 C=CCNCC(=O)O Amb7766404 [1,1,0,0,0,0|0,0,2]=4 3997 B7R0.4 C=CCNCC(=O)O Amb8631497 [1,1,0,0,0,0|0,0,2]=4 3998 B7R0.4 C=CCNCC(C)C Amb6683812 [1,1,0,0,0,0|1,0,0]=3 3999 B7R0.4 C=CCNCC(C)Cl Amb27658629 [1,1,0,0,0,0|2,0,0]=4 4000 B7R0.4 C=CCNCC(C)O Amb17138365 [1,1,0,0,0,0|2,0,0]=4 4001 B7R0.4 C=CCNC[C@H](C)O Amb27950182 [1,1,0,0,0,0|2,0,0]=4 4002 B7R0.4 C=CCOCC(=O)O Amb9208694 [1,1,0,0,0,0|0,0,2]=4 4003 B7R0.4 C=CCOCC(C)O Amb22733640 [1,1,0,0,0,0|2,0,0]=4 4004 B7R0.4 C=CCOC[C@@H](C)O Amb27780603 [1,1,0,0,0,0|2,0,0]=4 4005 B7R0.4 C=CCONC(C)C Amb27974775 [1,1,0,0,0,0|2,0,0]=4 4006 B7R0.4 C=CCSCC(=O)O Amb33526723 [1,1,0,0,0,0|0,0,2]=4 4007 B7R0.4 C=CCSCC(C)C Amb28049003 [1,1,0,0,0,0|1,0,0]=3 4008 B7R0.4 C=CCSCC(C)O Amb28065376 [1,1,0,0,0,0|2,0,0]=4 4009 B7R0.4 C=CCSC[C@@H](C)N Amb28401212 [1,1,0,0,0,0|2,0,0]=4 4010 B7R0.4 C=CCSC[C@H](C)N Amb27752407 [1,1,0,0,0,0|2,0,0]=4 4011 B7R0.4 C=CCSC[C@H](C)O Amb27220310 [1,1,0,0,0,0|2,0,0]=4 4012 B7R0.4 C=CNCCC(=O)O Amb27429817 [1,1,0,0,0,0|0,0,2]=4 4013 B7R0.4 C=COCCC(=O)O Amb28350126 [1,1,0,0,0,0|0,0,2]=4 4014 B7R0.4 C=COCCC(C)Br Amb28343139 [1,1,0,0,0,0|2,0,0]=4 4015 B7R0.4 C=COCCN(C)C Amb21618684 [1,1,0,0,0,0|2,0,0]=4 4016 B7R0.4 C=CSCCN(C)C Amb4017465 [1,1,0,0,0,0|2,0,0]=4 4017 B7R0.4 CC#CCCC(=O)O Amb3987196 [1,1,0,0,0,0|0,0,1]=3 4018 B7R0.4 CC#CCCC(C)C Amb22052677 [1,1,0,0,0,0|1,0,1]=4 4019 B7R0.4 CC(=O)CCCC#N Amb17106756 [1,1,0,0,0,0|1,0,1]=4 4020 B7R0.4 CC(=O)CCCCBr Amb16234126 [1,1,0,0,0,0|1,0,0]=3 4021 B7R0.4 CC(=O)CCCCCl Amb3941549 [1,1,0,0,0,0|1,0,0]=3 4022 B7R0.4 CC(=O)CCCCF Amb27490855 [1,1,0,0,0,0|1,0,0]=3 4023 B7R0.4 CC(=O)CCCCN Amb27401218 [1,1,0,0,0,0|1,0,0]=3 4024 B7R0.4 CC(=O)CCCCO Amb10603864 [1,1,0,0,0,0|1,0,0]=3 4025 B7R0.4 CC(=O)CC\C=N\O Amb27656180 [1,1,0,0,0,0|1,0,1]=4 4026 B7R0.4 CC(=O)COCCCl Amb25346574 [1,1,0,0,0,0|2,0,0]=4 4027 B7R0.4 CC(=O)COCCF Amb27463527 [1,1,0,0,0,0|2,0,0]=4 4028 B7R0.4 CC(=O)COCCO Amb28122841 [1,1,0,0,0,0|2,0,0]=4 4029 B7R0.4 CC(=O)CSCCF Amb24621173 [1,1,0,0,0,0|2,0,0]=4 4030 B7R0.4 CC(=O)CSCCN Amb17500454 [1,1,0,0,0,0|2,0,0]=4 4031 B7R0.4 CC(=O)CSCCO Amb4165952 [1,1,0,0,0,0|2,0,0]=4 4032 B7R0.4 CC(=O)NCCC=O Amb17102165 [1,1,0,0,0,0|1,0,1]=4 4033 B7R0.4 CC(=O)NCCCBr Amb8826231 [1,1,0,0,0,0|2,0,0]=4 4034 B7R0.4 CC(=O)NCCCCl Amb3886559 [1,1,0,0,0,0|2,0,0]=4 4035 B7R0.4 CC(=O)NCCCN Amb10610286 [1,1,0,0,0,0|2,0,0]=4 4036 B7R0.4 CC(=O)NCCCN Amb6664982 [1,1,0,0,0,0|2,0,0]=4 4037 B7R0.4 CC(=O)NCCCO Amb3429354 [1,1,0,0,0,0|2,0,0]=4 4038 B7R0.4 CC(=O)OCCCBr Amb26515737 [1,1,0,0,0,0|2,0,0]=4 4039 B7R0.4 CC(=O)OCCCCl Amb3940269 [1,1,0,0,0,0|2,0,0]=4 4040 B7R0.4 CC(=O)OCCCO Amb25854267 [1,1,0,0,0,0|2,0,0]=4 4041 B7R0.4 CC(=O)OCCCS Amb4018773 [1,1,0,0,0,0|2,0,0]=4 4042 B7R0.4 CC(=O)SCCC=O Amb25101351 [1,1,0,0,0,0|1,0,1]=4 4043 B7R0.4 CC(=O)SCCCBr Amb17610077 [1,1,0,0,0,0|2,0,0]=4 4044 B7R0.4 CC(=O)SCCCCl Amb3940270 [1,1,0,0,0,0|2,0,0]=4 4045 B7R0.4 CC(C)=CCCC=O Amb17593168 [1,1,0,0,0,0|0,0,1]=3 4046 B7R0.4 CC(C)=CCCCO Amb26478086 [1,1,0,0,0,0|0,0,2]=4 4047 B7R0.4 CC(C)=CCNC=O Amb27838354 [1,1,0,0,0,0|0,0,2]=4 4048 B7R0.4 CC(C)C=C=CCO Amb27424344 [1,1,0,0,0,0|0,0,2]=4 4049 B7R0.4 CC(C)CC#CCO Amb27780210 [1,1,0,0,0,0|0,0,2]=4 4050 B7R0.4 CC(C)CCCC#N Amb21811944 [1,1,0,0,0,0|1,0,1]=4 4051 B7R0.4 CC(C)CCCC=O Amb17940235 [1,1,0,0,0,0|0,0,0]=2 4052 B7R0.4 CC(C)CCCCBr Amb2721514 [1,1,0,0,0,0|1,0,1]=4 4053 B7R0.4 CC(C)CCCCCl Amb20670590 [1,1,0,0,0,0|1,0,1]=4 4054 B7R0.4 CC(C)CCCCN Amb33548422 [1,1,0,0,0,0|1,0,1]=4 4055 B7R0.4 CC(C)CCCCN Amb9304907 [1,1,0,0,0,0|1,0,1]=4 4056 B7R0.4 CC(C)CCCCO Amb3939382 [1,1,0,0,0,0|0,0,1]=3 4057 B7R0.4 CC(C)CCCCS Amb32788388 [1,1,0,0,0,0|0,1,1]=4 4058 B7R0.4 CC(C)CCCON Amb28315398 [1,1,0,0,0,0|0,0,1]=3 4059 B7R0.4 CC(C)CCN=C=O Amb5750733 [1,1,0,0,0,0|0,0,1]=3 4060 B7R0.4 CC(C)CCN=C=S Amb5750756 [1,1,0,0,0,0|0,1,1]=4 4061 B7R0.4 CC(C)CCN=[N+]=[N-] Amb20622300 [1,1,0,0,0,0|2,0,0]=4 4062 B7R0.4 CC(C)CCNC=O Amb27460935 [1,1,0,0,0,0|0,0,0]=2 4063 B7R0.4 CC(C)CCNCN Amb27194901 [1,1,0,0,0,0|1,0,1]=4 4064 B7R0.4 CC(C)CCNCO Amb27403355 [1,1,0,0,0,0|0,0,1]=3 4065 B7R0.4 CC(C)CCON=O Amb7809245 [1,1,0,0,0,0|1,0,0]=3 4066 B7R0.4 CC(C)CCSC#N Amb25707952 [1,1,0,0,0,0|1,0,1]=4 4067 B7R0.4 CC(C)CNCC#N Amb6707252 [1,1,0,0,0,0|1,0,1]=4 4068 B7R0.4 CC(C)CNCCCl Amb17334145 [1,1,0,0,0,0|1,0,1]=4 4069 B7R0.4 CC(C)CNCCI Amb27801831 [1,1,0,0,0,0|1,0,1]=4 4070 B7R0.4 CC(C)CNCCN Amb17091016 [1,1,0,0,0,0|1,0,1]=4 4071 B7R0.4 CC(C)CNCCO Amb22587152 [1,1,0,0,0,0|0,0,1]=3 4072 B7R0.4 CC(C)CNCCO Amb6707299 [1,1,0,0,0,0|0,0,1]=3 4073 B7R0.4 CC(C)CNCCS Amb24616771 [1,1,0,0,0,0|0,1,1]=4 4074 B7R0.4 CC(C)COCCBr Amb6255231 [1,1,0,0,0,0|1,0,1]=4 4075 B7R0.4 CC(C)COCCN Amb33548979 [1,1,0,0,0,0|1,0,1]=4 4076 B7R0.4 CC(C)COCCN Amb6247554 [1,1,0,0,0,0|1,0,1]=4 4077 B7R0.4 CC(C)COCCO Amb3939640 [1,1,0,0,0,0|0,0,1]=3 4078 B7R0.4 CC(C)COCCS Amb24589392 [1,1,0,0,0,0|0,1,1]=4 4079 B7R0.4 CC(C)CSCCCl Amb9304957 [1,1,0,0,0,0|1,0,1]=4 4080 B7R0.4 CC(C)CSCCN Amb28934790 [1,1,0,0,0,0|1,0,1]=4 4081 B7R0.4 CC(C)CSCCN Amb6274135 [1,1,0,0,0,0|1,0,1]=4 4082 B7R0.4 CC(C)C\C=C\C=O Amb33359709 [1,1,0,0,0,0|0,0,1]=3 4083 B7R0.4 CC(C)C\C=C\CN Amb24615023 [1,1,0,0,0,0|1,0,1]=4 4084 B7R0.4 CC(C)C\C=C\CO Amb25851501 [1,1,0,0,0,0|0,0,1]=3 4085 B7R0.4 CC(C)NCCC#N Amb17720404 [1,1,0,0,0,0|1,0,1]=4 4086 B7R0.4 CC(C)NCCCF Amb27753882 [1,1,0,0,0,0|1,0,1]=4 4087 B7R0.4 CC(C)NCCCN Amb8515462 [1,1,0,0,0,0|1,0,1]=4 4088 B7R0.4 CC(C)NCCCO Amb22492397 [1,1,0,0,0,0|0,0,1]=3 4089 B7R0.4 CC(C)NCCCO Amb4422880 [1,1,0,0,0,0|0,0,1]=3 4090 B7R0.4 CC(C)N\C=C\C=O Amb26418674 [1,1,0,0,0,0|0,0,2]=4 4091 B7R0.4 CC(C)OCCC#N Amb4017899 [1,1,0,0,0,0|1,0,1]=4 4092 B7R0.4 CC(C)OCCC=O Amb26443003 [1,1,0,0,0,0|0,0,0]=2 4093 B7R0.4 CC(C)OCCCBr Amb8828214 [1,1,0,0,0,0|1,0,1]=4 4094 B7R0.4 CC(C)OCCCCl Amb6255095 [1,1,0,0,0,0|1,0,1]=4 4095 B7R0.4 CC(C)OCCCN Amb6608864 [1,1,0,0,0,0|1,0,1]=4 4096 B7R0.4 CC(C)OCCCN Amb6892638 [1,1,0,0,0,0|1,0,1]=4 4097 B7R0.4 CC(C)OCCCO Amb10608350 [1,1,0,0,0,0|0,0,1]=3 4098 B7R0.4 CC(C)OCCCS Amb24551906 [1,1,0,0,0,0|0,1,1]=4 4099 B7R0.4 CC(C)OCCNN Amb32712146 [1,1,0,0,0,0|2,0,0]=4 4100 B7R0.4 CC(C)OCCNO Amb33274852 [1,1,0,0,0,0|1,0,0]=3 4101 B7R0.4 CC(C)OCCON Amb25113499 [1,1,0,0,0,0|1,0,1]=4 4102 B7R0.4 CC(C)OC\C=C/Br Amb28291637 [1,1,0,0,0,0|1,0,1]=4 4103 B7R0.4 CC(C)ONCCO Amb27421126 [1,1,0,0,0,0|1,0,1]=4 4104 B7R0.4 CC(C)SCCC#N Amb17307556 [1,1,0,0,0,0|1,0,1]=4 4105 B7R0.4 CC(C)SCCCBr Amb19053955 [1,1,0,0,0,0|1,0,1]=4 4106 B7R0.4 CC(C)SCCCN Amb10075505 [1,1,0,0,0,0|1,0,1]=4 4107 B7R0.4 CC(C)SCCCO Amb17502841 [1,1,0,0,0,0|0,0,1]=3 4108 B7R0.4 CC(C)SCCON Amb27989200 [1,1,0,0,0,0|1,0,1]=4 4109 B7R0.4 CC(C)\C=C\CCO Amb25117403 [1,1,0,0,0,0|0,0,2]=4 4110 B7R0.4 CC(Cl)CCCC=O Amb27983674 [1,1,0,0,0,0|1,0,0]=3 4111 B7R0.4 CC(N)CCCCO Amb17569907 [1,1,0,0,0,0|1,0,1]=4 4112 B7R0.4 CC(N)CCCCO Amb28934868 [1,1,0,0,0,0|1,0,1]=4 4113 B7R0.4 CC(O)CCCC=O Amb18641887 [1,1,0,0,0,0|1,0,0]=3 4114 B7R0.4 CC(O)CCCCF Amb27486303 [1,1,0,0,0,0|1,0,1]=4 4115 B7R0.4 CC(O)CCCCN Amb17569903 [1,1,0,0,0,0|1,0,1]=4 4116 B7R0.4 CC(O)CCCCO Amb22227757 [1,1,0,0,0,0|1,0,1]=4 4117 B7R0.4 CC(O)CCCC[SiH3] Amb28322353 [1,1,0,0,0,0|1,0,1]=4 4118 B7R0.4 CC(O)CCOP=O Amb27443310 [1,1,0,0,0,0|2,0,0]=4 4119 B7R0.4 CC(O)CCO[PH2]=O Amb27594830 [1,1,0,0,0,0|2,0,0]=4 4120 B7R0.4 CC(O)CC\C=C\Cl Amb27878569 [1,1,0,0,0,0|2,0,0]=4 4121 B7R0.4 CC(O)CNCCO Amb4020001 [1,1,0,0,0,0|1,0,1]=4 4122 B7R0.4 CC(O)CSCCO Amb22055428 [1,1,0,0,0,0|1,0,1]=4 4123 B7R0.4 CC(O)C\C=C\CO Amb27432058 [1,1,0,0,0,0|1,0,1]=4 4124 B7R0.4 CCC#CCC(=O)O Amb26515701 [1,1,0,0,0,0|0,0,1]=3 4125 B7R0.4 CCC#CCC(C)=O Amb28040888 [1,1,0,0,0,0|1,0,1]=4 4126 B7R0.4 CCCC#CC(=O)O Amb2721706 [1,1,0,0,0,0|0,0,1]=3 4127 B7R0.4 CCCC#CC(C)=O Amb26844271 [1,1,0,0,0,0|1,0,1]=4 4128 B7R0.4 CCCC#CC(N)=O Amb27175227 [1,1,0,0,0,0|1,0,1]=4 4129 B7R0.4 CCCCC=C(C)C Amb22228888 [1,1,0,0,0,0|2,0,0]=4 4130 B7R0.4 CCCCCB(O)O Amb2447470 [1,1,0,0,0,0|1,0,1]=4 4131 B7R0.4 CCCCCC(=N)N Amb19890171 [1,1,0,0,0,0|2,0,0]=4 4132 B7R0.4 CCCCCC(=N)N Amb2696574 [1,1,0,0,0,0|2,0,0]=4 4133 B7R0.4 CCCCCC(=N)N Amb35747068 [1,1,0,0,0,0|2,0,0]=4 4134 B7R0.4 CCCCCC(=O)F Amb26061517 [1,1,0,0,0,0|1,0,0]=3 4135 B7R0.4 CCCCCC(=O)O Amb3939846 [1,1,0,0,0,0|0,0,0]=2 4136 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [1,1,0,0,0,0|0,0,1]=3 4137 B7R0.4 CCCCCC(C)=O Amb6608885 [1,1,0,0,0,0|1,0,0]=3 4138 B7R0.4 CCCCCC(C)C Amb8513253 [1,1,0,0,0,0|1,0,1]=4 4139 B7R0.4 CCCCCC(C)O Amb8383668 [1,1,0,0,0,0|1,0,1]=4 4140 B7R0.4 CCCCCC(N)=S Amb6246072 [1,1,0,0,0,0|1,1,0]=4 4141 B7R0.4 CCCCCC(O)Cl Amb27232933 [1,1,0,0,0,0|1,0,1]=4 4142 B7R0.4 CCCCCC(O)O Amb25921998 [1,1,0,0,0,0|0,0,2]=4 4143 B7R0.4 CCCCCN(C)O Amb33428427 [1,1,0,0,0,0|2,0,0]=4 4144 B7R0.4 CCCCCS(=O)Cl Amb32720370 [1,1,0,0,0,0|2,0,0]=4 4145 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [1,1,0,0,0,0|1,0,1]=4 4146 B7R0.4 CCCCCS(C)=O Amb27457494 [1,1,0,0,0,0|2,0,0]=4 4147 B7R0.4 CCCCCS(N)=O Amb32720371 [1,1,0,0,0,0|2,0,0]=4 4148 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,1,0,0,0,0|1,0,1]=4 4149 B7R0.4 CCCCC[C@H](C)O Amb8395591 [1,1,0,0,0,0|1,0,1]=4 4150 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [1,1,0,0,0,0|1,0,1]=4 4151 B7R0.4 CCCCNC(=N)N Amb19748357 [1,1,0,0,0,0|2,0,0]=4 4152 B7R0.4 CCCCNC(=N)N Amb32653258 [1,1,0,0,0,0|2,0,0]=4 4153 B7R0.4 CCCCNC(=O)Cl Amb24574309 [1,1,0,0,0,0|1,0,0]=3 4154 B7R0.4 CCCCNC(C)=N Amb27663050 [1,1,0,0,0,0|2,0,0]=4 4155 B7R0.4 CCCCNC(C)=O Amb5835711 [1,1,0,0,0,0|1,0,0]=3 4156 B7R0.4 CCCCNC(C)C Amb2111112 [1,1,0,0,0,0|1,0,1]=4 4157 B7R0.4 CCCCNC(C)C Amb6251422 [1,1,0,0,0,0|1,0,1]=4 4158 B7R0.4 CCCCNC(N)=O Amb6663202 [1,1,0,0,0,0|1,0,0]=3 4159 B7R0.4 CCCCNC(N)=S Amb1152044 [1,1,0,0,0,0|1,1,0]=4 4160 B7R0.4 CCCCOB(O)O Amb25687500 [1,1,0,0,0,0|1,0,1]=4 4161 B7R0.4 CCCCOC(=O)Cl Amb6608833 [1,1,0,0,0,0|1,0,0]=3 4162 B7R0.4 CCCCOC(=S)[S-] Amb16186572 [1,1,0,0,0,0|0,2,0]=4 4163 B7R0.4 CCCCOC(C)=O Amb6608782 [1,1,0,0,0,0|1,0,0]=3 4164 B7R0.4 CCCCOC(C)O Amb26537694 [1,1,0,0,0,0|1,0,1]=4 4165 B7R0.4 CCCCOC(N)=O Amb4136361 [1,1,0,0,0,0|1,0,0]=3 4166 B7R0.4 CCCCO[PH](=O)O Amb26035392 [1,1,0,0,0,0|1,0,0]=3 4167 B7R0.4 CCCCSC(=N)N Amb10552525 [1,1,0,0,0,0|2,0,0]=4 4168 B7R0.4 CCCCSC(=N)N Amb4007584 [1,1,0,0,0,0|2,0,0]=4 4169 B7R0.4 CCCCSC(=O)Cl Amb22352826 [1,1,0,0,0,0|1,0,0]=3 4170 B7R0.4 CCCCSC(C)C Amb4020661 [1,1,0,0,0,0|1,0,1]=4 4171 B7R0.4 CCCCSC(C)O Amb27191967 [1,1,0,0,0,0|1,0,1]=4 4172 B7R0.4 CCCNCC(=O)O Amb10609640 [1,1,0,0,0,0|0,0,0]=2 4173 B7R0.4 CCCNCC(=O)O Amb1110628 [1,1,0,0,0,0|0,0,0]=2 4174 B7R0.4 CCCNCC(C)=O Amb26954588 [1,1,0,0,0,0|1,0,0]=3 4175 B7R0.4 CCCNCC(C)C Amb6258024 [1,1,0,0,0,0|1,0,1]=4 4176 B7R0.4 CCCNCC(C)O Amb9359420 [1,1,0,0,0,0|1,0,1]=4 4177 B7R0.4 CCCNCC(N)=O Amb1124632 [1,1,0,0,0,0|1,0,0]=3 4178 B7R0.4 CCCNCC(N)=O Amb28934788 [1,1,0,0,0,0|1,0,0]=3 4179 B7R0.4 CCCNNC(N)=O Amb27405031 [1,1,0,0,0,0|2,0,0]=4 4180 B7R0.4 CCCOCB(O)O Amb27461328 [1,1,0,0,0,0|1,0,1]=4 4181 B7R0.4 CCCOCC(=O)Cl Amb27260778 [1,1,0,0,0,0|1,0,0]=3 4182 B7R0.4 CCCOCC(=O)O Amb8874504 [1,1,0,0,0,0|0,0,0]=2 4183 B7R0.4 CCCOCC(N)=O Amb27844884 [1,1,0,0,0,0|1,0,0]=3 4184 B7R0.4 CCCOCC(N)=S Amb8874828 [1,1,0,0,0,0|1,1,0]=4 4185 B7R0.4 CCCOC[C@@H](C)O Amb28048955 [1,1,0,0,0,0|1,0,1]=4 4186 B7R0.4 CCCONC(C)=O Amb27764366 [1,1,0,0,0,0|2,0,0]=4 4187 B7R0.4 CCCONC(N)=O Amb2899788 [1,1,0,0,0,0|2,0,0]=4 4188 B7R0.4 CCCSCC(=O)O Amb1137113 [1,1,0,0,0,0|0,0,0]=2 4189 B7R0.4 CCCSCC(C)=O Amb9668676 [1,1,0,0,0,0|1,0,0]=3 4190 B7R0.4 CCCSCC(C)C Amb4017817 [1,1,0,0,0,0|1,0,1]=4 4191 B7R0.4 CCCSCC(C)O Amb27463818 [1,1,0,0,0,0|1,0,1]=4 4192 B7R0.4 CCCSCC(N)=O Amb27424658 [1,1,0,0,0,0|1,0,0]=3 4193 B7R0.4 CCCSC[C@@H](C)O Amb27641885 [1,1,0,0,0,0|1,0,1]=4 4194 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [1,1,0,0,0,0|1,0,1]=4 4195 B7R0.4 CCC\C=C\C(=O)Cl Amb2688716 [1,1,0,0,0,0|1,0,1]=4 4196 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [1,1,0,0,0,0|0,0,1]=3 4197 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [1,1,0,0,0,0|1,0,1]=4 4198 B7R0.4 CCC\C=C\C(N)=O Amb26397290 [1,1,0,0,0,0|1,0,1]=4 4199 B7R0.4 CCNCCC(=O)O Amb28934794 [1,1,0,0,0,0|0,0,0]=2 4200 B7R0.4 CCNCCC(=O)O Amb7766402 [1,1,0,0,0,0|0,0,0]=2 4201 B7R0.4 CCNCCC(C)=O Amb18641851 [1,1,0,0,0,0|1,0,0]=3 4202 B7R0.4 CCNCCC(C)C Amb6244455 [1,1,0,0,0,0|1,0,1]=4 4203 B7R0.4 CCNCCC(C)O Amb27239293 [1,1,0,0,0,0|1,0,1]=4 4204 B7R0.4 CCNCCC(N)=O Amb33533384 [1,1,0,0,0,0|1,0,0]=3 4205 B7R0.4 CCNCCC(N)=O Amb35749820 [1,1,0,0,0,0|1,0,0]=3 4206 B7R0.4 CCNCCC(N)=S Amb17231882 [1,1,0,0,0,0|1,1,0]=4 4207 B7R0.4 CCNNCC(=O)O Amb28326075 [1,1,0,0,0,0|1,0,0]=3 4208 B7R0.4 CCOCCC(=N)N Amb2696677 [1,1,0,0,0,0|2,0,0]=4 4209 B7R0.4 CCOCCC(=N)N Amb33551393 [1,1,0,0,0,0|2,0,0]=4 4210 B7R0.4 CCOCCC(=O)Cl Amb20672027 [1,1,0,0,0,0|1,0,0]=3 4211 B7R0.4 CCOCCC(=O)O Amb3939859 [1,1,0,0,0,0|0,0,0]=2 4212 B7R0.4 CCOCCC(C)=O Amb7764636 [1,1,0,0,0,0|1,0,0]=3 4213 B7R0.4 CCOCCC(C)O Amb27852957 [1,1,0,0,0,0|1,0,1]=4 4214 B7R0.4 CCOCCC(N)=S Amb6263797 [1,1,0,0,0,0|1,1,0]=4 4215 B7R0.4 CCOCCS(=O)Cl Amb24625733 [1,1,0,0,0,0|2,0,0]=4 4216 B7R0.4 CCOCCS(=O)[O-] Amb26001359 [1,1,0,0,0,0|1,0,1]=4 4217 B7R0.4 CCOCCS(N)=O Amb32720346 [1,1,0,0,0,0|2,0,0]=4 4218 B7R0.4 CCOCC[C@H](C)O Amb27946039 [1,1,0,0,0,0|1,0,1]=4 4219 B7R0.4 CCOCNC(N)=O Amb25765493 [1,1,0,0,0,0|2,0,0]=4 4220 B7R0.4 CCOCOC(=O)Cl Amb27623794 [1,1,0,0,0,0|2,0,0]=4 4221 B7R0.4 CCO\C=C\C(=O)O Amb2725260 [1,1,0,0,0,0|0,0,2]=4 4222 B7R0.4 CCO\N=C\C(=O)O Amb27468748 [1,1,0,0,0,0|1,0,1]=4 4223 B7R0.4 CCSCCC(=N)N Amb6680836 [1,1,0,0,0,0|2,0,0]=4 4224 B7R0.4 CCSCCC(=O)O Amb6273140 [1,1,0,0,0,0|0,0,0]=2 4225 B7R0.4 CCSCCC(C)=O Amb9655821 [1,1,0,0,0,0|1,0,0]=3 4226 B7R0.4 CCSCCC(C)C Amb22230685 [1,1,0,0,0,0|1,0,1]=4 4227 B7R0.4 CCSCCC(C)O Amb28048927 [1,1,0,0,0,0|1,0,1]=4 4228 B7R0.4 CCSCCC(N)=O Amb27258252 [1,1,0,0,0,0|1,0,0]=3 4229 B7R0.4 CCSCCC(N)=S Amb17307560 [1,1,0,0,0,0|1,1,0]=4 4230 B7R0.4 CCSCCN(C)O Amb33324043 [1,1,0,0,0,0|2,0,0]=4 4231 B7R0.4 CCSCC[C@@H](C)O Amb33223925 [1,1,0,0,0,0|1,0,1]=4 4232 B7R0.4 CCSCC[C@H](C)O Amb33323733 [1,1,0,0,0,0|1,0,1]=4 4233 B7R0.4 CCSCC[N+](=O)[O-] Amb27838043 [1,1,0,0,0,0|1,0,1]=4 4234 B7R0.4 CCSSCC(C)=O Amb28316151 [1,1,0,0,0,0|2,0,0]=4 4235 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [1,1,0,0,0,0|0,0,1]=3 4236 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [1,1,0,0,0,0|1,0,1]=4 4237 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [1,1,0,0,0,0|1,0,1]=4 4238 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [1,1,0,0,0,0|0,0,1]=3 4239 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [1,1,0,0,0,0|1,0,1]=4 4240 B7R0.4 CC\C=C\CC(C)C Amb4016285 [1,1,0,0,0,0|1,0,1]=4 4241 B7R0.4 CC\C=C\C[PH](=O)O Amb8391288 [1,1,0,0,0,0|1,0,1]=4 4242 B7R0.4 CN(C)CCCC=O Amb22753951 [1,1,0,0,0,0|1,0,0]=3 4243 B7R0.4 CN(C)CCCC=O Amb24117840 [1,1,0,0,0,0|1,0,0]=3 4244 B7R0.4 CN(C)CCCCO Amb9273966 [1,1,0,0,0,0|1,0,1]=4 4245 B7R0.4 CN(C)CCCNO Amb33272652 [1,1,0,0,0,0|1,0,1]=4 4246 B7R0.4 CN(C)CCCON Amb17104868 [1,1,0,0,0,0|1,0,1]=4 4247 B7R0.4 CN(C)CCCON Amb35747638 [1,1,0,0,0,0|1,0,1]=4 4248 B7R0.4 CN(C)CCN=C=O Amb19649310 [1,1,0,0,0,0|1,0,1]=4 4249 B7R0.4 CN(C)CC\C=C\Cl Amb27878814 [1,1,0,0,0,0|2,0,0]=4 4250 B7R0.4 CNCC#CC(=O)O Amb27218273 [1,1,0,0,0,0|0,0,2]=4 4251 B7R0.4 CNCCCC(=O)O Amb1153115 [1,1,0,0,0,0|0,0,0]=2 4252 B7R0.4 CNCCCC(=O)O Amb4521435 [1,1,0,0,0,0|0,0,0]=2 4253 B7R0.4 CNCCCC(C)=O Amb27838406 [1,1,0,0,0,0|1,0,0]=3 4254 B7R0.4 CNCCCC(C)C Amb32757651 [1,1,0,0,0,0|1,0,1]=4 4255 B7R0.4 CNCCCC(C)C Amb8853654 [1,1,0,0,0,0|1,0,1]=4 4256 B7R0.4 CNCCCC(C)O Amb17569899 [1,1,0,0,0,0|1,0,1]=4 4257 B7R0.4 CNCCCC(N)=O Amb18303611 [1,1,0,0,0,0|1,0,0]=3 4258 B7R0.4 CNCCCC(N)=O Amb31307731 [1,1,0,0,0,0|1,0,0]=3 4259 B7R0.4 CNCCCS(C)=O Amb27827686 [1,1,0,0,0,0|2,0,0]=4 4260 B7R0.4 CNCCC[C@@H](C)O Amb27784601 [1,1,0,0,0,0|1,0,1]=4 4261 B7R0.4 CNCCNC(C)=O Amb28934797 [1,1,0,0,0,0|2,0,0]=4 4262 B7R0.4 CNCCNC(C)=O Amb9256137 [1,1,0,0,0,0|2,0,0]=4 4263 B7R0.4 CNCCNC(N)=O Amb18299975 [1,1,0,0,0,0|2,0,0]=4 4264 B7R0.4 CNCCOC(C)=O Amb18124262 [1,1,0,0,0,0|2,0,0]=4 4265 B7R0.4 CNCCOC(C)=O Amb33621071 [1,1,0,0,0,0|2,0,0]=4 4266 B7R0.4 CNCCOC(C)C Amb33538267 [1,1,0,0,0,0|2,0,0]=4 4267 B7R0.4 CNCCOC(N)=O Amb25136928 [1,1,0,0,0,0|2,0,0]=4 4268 B7R0.4 CNCCOC(N)=O Amb32693459 [1,1,0,0,0,0|2,0,0]=4 4269 B7R0.4 CNCCSC(C)C Amb19024679 [1,1,0,0,0,0|2,0,0]=4 4270 B7R0.4 CNC\C=C\C(=O)O Amb25368293 [1,1,0,0,0,0|0,0,2]=4 4271 B7R0.4 COCC#CC(=O)O Amb33544473 [1,1,0,0,0,0|0,0,2]=4 4272 B7R0.4 COCCCB(O)O Amb27754195 [1,1,0,0,0,0|1,0,1]=4 4273 B7R0.4 COCCCC(=N)N Amb19269156 [1,1,0,0,0,0|2,0,0]=4 4274 B7R0.4 COCCCC(=N)N Amb6266770 [1,1,0,0,0,0|2,0,0]=4 4275 B7R0.4 COCCCC(=O)O Amb6275629 [1,1,0,0,0,0|0,0,0]=2 4276 B7R0.4 COCCCC(C)=O Amb9031556 [1,1,0,0,0,0|1,0,0]=3 4277 B7R0.4 COCCCC(C)Br Amb18185551 [1,1,0,0,0,0|1,0,1]=4 4278 B7R0.4 COCCCC(C)Cl Amb26489622 [1,1,0,0,0,0|1,0,1]=4 4279 B7R0.4 COCCCC(C)N Amb9031757 [1,1,0,0,0,0|1,0,1]=4 4280 B7R0.4 COCCCC(C)O Amb4020863 [1,1,0,0,0,0|1,0,1]=4 4281 B7R0.4 COCCCC(C)S Amb25810805 [1,1,0,0,0,0|1,0,1]=4 4282 B7R0.4 COCCCC(N)=S Amb6270649 [1,1,0,0,0,0|1,1,0]=4 4283 B7R0.4 COCCCN(C)C Amb2779456 [1,1,0,0,0,0|1,0,1]=4 4284 B7R0.4 COCCCN(C)C Amb30585124 [1,1,0,0,0,0|1,0,1]=4 4285 B7R0.4 COCCCN(C)O Amb33377831 [1,1,0,0,0,0|2,0,0]=4 4286 B7R0.4 COCCCS(=O)Cl Amb26013061 [1,1,0,0,0,0|2,0,0]=4 4287 B7R0.4 COCCCS(=O)[O-] Amb27974844 [1,1,0,0,0,0|1,0,1]=4 4288 B7R0.4 COCCCS(N)=O Amb32720360 [1,1,0,0,0,0|2,0,0]=4 4289 B7R0.4 COCCC[C@@H](C)Cl Amb27590769 [1,1,0,0,0,0|1,0,1]=4 4290 B7R0.4 COCCC[C@@H](C)N Amb24749054 [1,1,0,0,0,0|1,0,1]=4 4291 B7R0.4 COCCC[C@@H](C)O Amb33428680 [1,1,0,0,0,0|1,0,1]=4 4292 B7R0.4 COCCC[C@H](C)N Amb27164382 [1,1,0,0,0,0|1,0,1]=4 4293 B7R0.4 COCCC[C@H](C)O Amb27396064 [1,1,0,0,0,0|1,0,1]=4 4294 B7R0.4 COCCC[N+](=O)[O-] Amb33428678 [1,1,0,0,0,0|1,0,1]=4 4295 B7R0.4 COCCNC(C)=O Amb3358082 [1,1,0,0,0,0|2,0,0]=4 4296 B7R0.4 COCCNC(C)C Amb2785295 [1,1,0,0,0,0|1,0,1]=4 4297 B7R0.4 COCCNC(N)=O Amb1104938 [1,1,0,0,0,0|2,0,0]=4 4298 B7R0.4 COCCOC(=O)Cl Amb2689125 [1,1,0,0,0,0|2,0,0]=4 4299 B7R0.4 COCCOC(C)=O Amb4037074 [1,1,0,0,0,0|2,0,0]=4 4300 B7R0.4 COCCOC(N)=O Amb25054225 [1,1,0,0,0,0|2,0,0]=4 4301 B7R0.4 COCOCC(=O)O Amb28059312 [1,1,0,0,0,0|1,0,0]=3 4302 B7R0.4 COCSCC(=O)O Amb27466837 [1,1,0,0,0,0|1,0,0]=3 4303 B7R0.4 COCSCC(C)C Amb28142603 [1,1,0,0,0,0|1,0,1]=4 4304 B7R0.4 COC\C=C\C(=O)O Amb33986212 [1,1,0,0,0,0|0,0,2]=4 4305 B7R0.4 CONCCC(C)C Amb20669574 [1,1,0,0,0,0|1,0,0]=3 4306 B7R0.4 CONCCC(C)F Amb28120126 [1,1,0,0,0,0|2,0,0]=4 4307 B7R0.4 CS(=O)CCCCBr Amb27874454 [1,1,0,0,0,0|2,0,0]=4 4308 B7R0.4 CS(=O)CCCCCl Amb27253421 [1,1,0,0,0,0|2,0,0]=4 4309 B7R0.4 CS(=O)CCCCN Amb17617794 [1,1,0,0,0,0|2,0,0]=4 4310 B7R0.4 CSCCCC(=N)N Amb27829199 [1,1,0,0,0,0|2,0,0]=4 4311 B7R0.4 CSCCCC(=O)O Amb17503622 [1,1,0,0,0,0|0,0,0]=2 4312 B7R0.4 CSCCCC(C)=O Amb25122381 [1,1,0,0,0,0|1,0,0]=3 4313 B7R0.4 CSCCCC(C)C Amb28289938 [1,1,0,0,0,0|0,1,1]=4 4314 B7R0.4 CSCCCC(C)O Amb25958947 [1,1,0,0,0,0|1,0,1]=4 4315 B7R0.4 CSCCCC(N)=S Amb28048945 [1,1,0,0,0,0|1,1,0]=4 4316 B7R0.4 CSCCCN(C)O Amb33198763 [1,1,0,0,0,0|2,0,0]=4 4317 B7R0.4 CSCCC[C@@H](C)O Amb33198286 [1,1,0,0,0,0|1,0,1]=4 4318 B7R0.4 CSCCC[C@H](C)O Amb33198288 [1,1,0,0,0,0|1,0,1]=4 4319 B7R0.4 CSCCC[N+](=O)[O-] Amb33200220 [1,1,0,0,0,0|1,0,1]=4 4320 B7R0.4 CSCCNC(=O)Cl Amb29882959 [1,1,0,0,0,0|2,0,0]=4 4321 B7R0.4 CSCCNC(C)=O Amb8504699 [1,1,0,0,0,0|2,0,0]=4 4322 B7R0.4 CSCCNC(N)=O Amb27424586 [1,1,0,0,0,0|2,0,0]=4 4323 B7R0.4 CSCCSC(C)=O Amb27635033 [1,1,0,0,0,0|2,0,0]=4 4324 B7R0.4 CSCSCC(=O)O Amb27858824 [1,1,0,0,0,0|1,0,0]=3 4325 B7R0.4 CSCSCC(C)C Amb28324036 [1,1,0,0,0,0|2,0,0]=4 4326 B7R0.4 CSSCCC(=O)O Amb26848465 [1,1,0,0,0,0|1,0,0]=3 4327 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [1,1,0,0,0,0|0,0,2]=4 4328 B7R0.4 C[C@@H](O)CCCCBr Amb28343132 [1,1,0,0,0,0|1,0,1]=4 4329 B7R0.4 C[C@@H](O)CCCCCl Amb8517538 [1,1,0,0,0,0|1,0,1]=4 4330 B7R0.4 C[C@@H](O)CCCCF Amb33196128 [1,1,0,0,0,0|1,0,1]=4 4331 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [1,1,0,0,0,0|1,0,1]=4 4332 B7R0.4 C[C@H](F)CCCCO Amb27945000 [1,1,0,0,0,0|1,0,1]=4 4333 B7R0.4 C[C@H](O)CCCCF Amb33196129 [1,1,0,0,0,0|1,0,1]=4 4334 B7R0.4 C[C@H](O)CCCCO Amb28381637 [1,1,0,0,0,0|1,0,1]=4 4335 B7R0.4 C[C@H](O)C\C=C\CO Amb27945050 [1,1,0,0,0,0|1,0,1]=4 4336 B7R0.4 C[SiH](C)OCCCO Amb28065227 [1,1,0,0,0,0|0,1,1]=4 4337 B7R0.4 C\C(Cl)=C\CCC=O Amb27792418 [1,1,0,0,0,0|1,0,1]=4 4338 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [1,1,0,0,0,0|0,0,1]=3 4339 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [1,1,0,0,0,0|1,0,1]=4 4340 B7R0.4 C\C=C\CCC(C)Br Amb25889216 [1,1,0,0,0,0|2,0,0]=4 4341 B7R0.4 C\C=C\CCC(C)C Amb24401080 [1,1,0,0,0,0|1,0,0]=3 4342 B7R0.4 C\C=C\CCC(C)N Amb27838292 [1,1,0,0,0,0|2,0,0]=4 4343 B7R0.4 C\C=C\CCC(C)O Amb32665057 [1,1,0,0,0,0|2,0,0]=4 4344 B7R0.4 C\C=C\CC[C@@H](C)O Amb27652940 [1,1,0,0,0,0|2,0,0]=4 4345 B7R0.4 C\C=C\CNC(C)C Amb18641745 [1,1,0,0,0,0|1,0,1]=4 4346 B7R0.4 C\C=C\NCC(C)C Amb27839051 [1,1,0,0,0,0|1,0,1]=4 4347 B7R0.4 N#CCCCC(=O)O Amb33542831 [1,1,0,0,0,0|0,0,1]=3 4348 B7R0.4 N#CCSCC(=O)O Amb6243720 [1,1,0,0,0,0|1,0,1]=4 4349 B7R0.4 N#CNCCC(=O)O Amb30031691 [1,1,0,0,0,0|1,0,1]=4 4350 B7R0.4 N=C(N)CCCCBr Amb4297024 [1,1,0,0,0,0|2,0,0]=4 4351 B7R0.4 N=C(N)CCCCCl Amb4297063 [1,1,0,0,0,0|2,0,0]=4 4352 B7R0.4 N=C(N)CCCCF Amb27486600 [1,1,0,0,0,0|2,0,0]=4 4353 B7R0.4 N=C(N)CCCCN Amb25714813 [1,1,0,0,0,0|2,0,0]=4 4354 B7R0.4 N=C(N)CCCCN Amb33299438 [1,1,0,0,0,0|2,0,0]=4 4355 B7R0.4 NC(=O)CCCCBr Amb27875083 [1,1,0,0,0,0|1,0,0]=3 4356 B7R0.4 NC(=O)CCCCCl Amb7782532 [1,1,0,0,0,0|1,0,0]=3 4357 B7R0.4 NC(=O)CCCCO Amb3939470 [1,1,0,0,0,0|1,0,0]=3 4358 B7R0.4 NC(=O)CCCCS Amb27839239 [1,1,0,0,0,0|1,0,0]=3 4359 B7R0.4 NC(=O)CCSCCl Amb27430706 [1,1,0,0,0,0|2,0,0]=4 4360 B7R0.4 NC(=O)CNCCO Amb6714605 [1,1,0,0,0,0|2,0,0]=4 4361 B7R0.4 NC(=O)COCCBr Amb25133475 [1,1,0,0,0,0|2,0,0]=4 4362 B7R0.4 NC(=O)COCCCl Amb5722397 [1,1,0,0,0,0|2,0,0]=4 4363 B7R0.4 NC(=O)CSCCBr Amb28193514 [1,1,0,0,0,0|2,0,0]=4 4364 B7R0.4 NC(=O)CSCCO Amb6754148 [1,1,0,0,0,0|2,0,0]=4 4365 B7R0.4 NC(=O)CSCCS Amb27651871 [1,1,0,0,0,0|2,0,0]=4 4366 B7R0.4 NC(=O)NCCCF Amb27396406 [1,1,0,0,0,0|2,0,0]=4 4367 B7R0.4 NC(=O)NCCCO Amb9248133 [1,1,0,0,0,0|2,0,0]=4 4368 B7R0.4 NC(=O)OCCCBr Amb28316236 [1,1,0,0,0,0|2,0,0]=4 4369 B7R0.4 NC(=S)CCCCBr Amb27622634 [1,1,0,0,0,0|1,1,0]=4 4370 B7R0.4 NC(=S)CCCCCl Amb25177620 [1,1,0,0,0,0|1,1,0]=4 4371 B7R0.4 NCC#CCC(=O)O Amb27976019 [1,1,0,0,0,0|0,0,2]=4 4372 B7R0.4 NCCC#CC(=O)O Amb32656225 [1,1,0,0,0,0|0,0,2]=4 4373 B7R0.4 NCCCCB(O)O Amb27436221 [1,1,0,0,0,0|1,0,1]=4 4374 B7R0.4 NCCCCC(=O)Cl Amb26599615 [1,1,0,0,0,0|1,0,0]=3 4375 B7R0.4 NCCCCC(=O)O Amb2780021 [1,1,0,0,0,0|0,0,0]=2 4376 B7R0.4 NCCCCC(=O)O Amb3941646 [1,1,0,0,0,0|0,0,0]=2 4377 B7R0.4 NCCCCC(=O)O Amb9825855 [1,1,0,0,0,0|0,0,0]=2 4378 B7R0.4 NCCCCC(N)=O Amb18641897 [1,1,0,0,0,0|1,0,0]=3 4379 B7R0.4 NCCCCC(N)=O Amb33552086 [1,1,0,0,0,0|1,0,0]=3 4380 B7R0.4 NCCCCS(=O)O Amb27882127 [1,1,0,0,0,0|1,0,0]=3 4381 B7R0.4 NCCCNC(=O)O Amb24093884 [1,1,0,0,0,0|1,0,0]=3 4382 B7R0.4 NCCCNC(=O)S Amb27839485 [1,1,0,0,0,0|1,1,0]=4 4383 B7R0.4 NCCCNC(N)=O Amb18296186 [1,1,0,0,0,0|2,0,0]=4 4384 B7R0.4 NCCCNC(N)=O Amb20622408 [1,1,0,0,0,0|2,0,0]=4 4385 B7R0.4 NCCCOC(N)=O Amb26334419 [1,1,0,0,0,0|2,0,0]=4 4386 B7R0.4 NCCCOC(N)=O Amb33299259 [1,1,0,0,0,0|2,0,0]=4 4387 B7R0.4 NCCCOS(=O)O Amb26007874 [1,1,0,0,0,0|2,0,0]=4 4388 B7R0.4 NCCNCC(=O)O Amb17608063 [1,1,0,0,0,0|1,0,0]=3 4389 B7R0.4 NCCNCC(=O)O Amb33339058 [1,1,0,0,0,0|1,0,0]=3 4390 B7R0.4 NCCNCC(N)=O Amb28388338 [1,1,0,0,0,0|2,0,0]=4 4391 B7R0.4 NCCOCC(=O)O Amb18630146 [1,1,0,0,0,0|1,0,0]=3 4392 B7R0.4 NCCOCC(=O)O Amb33550947 [1,1,0,0,0,0|1,0,0]=3 4393 B7R0.4 NCCOCC(N)=O Amb18523830 [1,1,0,0,0,0|2,0,0]=4 4394 B7R0.4 NCCOCC(N)=O Amb33549549 [1,1,0,0,0,0|2,0,0]=4 4395 B7R0.4 NCCSCC(=O)O Amb17500446 [1,1,0,0,0,0|1,0,0]=3 4396 B7R0.4 NCCSCC(=O)O Amb20622325 [1,1,0,0,0,0|1,0,0]=3 4397 B7R0.4 NCCSCC(N)=O Amb6266329 [1,1,0,0,0,0|2,0,0]=4 4398 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [1,1,0,0,0,0|0,0,2]=4 4399 B7R0.4 NOCCCC(=O)O Amb10975956 [1,1,0,0,0,0|1,0,0]=3 4400 B7R0.4 NOCCCC(=O)O Amb22011795 [1,1,0,0,0,0|1,0,0]=3 4401 B7R0.4 NOCCCC(=O)O Amb31283653 [1,1,0,0,0,0|1,0,0]=3 4402 B7R0.4 NS(=O)CCCCCl Amb32720307 [1,1,0,0,0,0|2,0,0]=4 4403 B7R0.4 NS(=O)CCCCF Amb32720393 [1,1,0,0,0,0|2,0,0]=4 4404 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [1,1,0,0,0,0|1,0,0]=3 4405 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [1,1,0,0,0,0|1,0,0]=3 4406 B7R0.4 O=C(Cl)COCCCl Amb17610887 [1,1,0,0,0,0|2,0,0]=4 4407 B7R0.4 O=C(Cl)NCCCCl Amb27856097 [1,1,0,0,0,0|2,0,0]=4 4408 B7R0.4 O=C(Cl)NCCCF Amb35633310 [1,1,0,0,0,0|2,0,0]=4 4409 B7R0.4 O=C(Cl)OCCCCl Amb10844795 [1,1,0,0,0,0|2,0,0]=4 4410 B7R0.4 O=C(Cl)OCCCF Amb26994902 [1,1,0,0,0,0|2,0,0]=4 4411 B7R0.4 O=C(O)C#CCCO Amb25844914 [1,1,0,0,0,0|0,0,2]=4 4412 B7R0.4 O=C(O)CCCCBr Amb6608763 [1,1,0,0,0,0|0,0,0]=2 4413 B7R0.4 O=C(O)CCCCCl Amb3940369 [1,1,0,0,0,0|0,0,0]=2 4414 B7R0.4 O=C(O)CCCCF Amb26639920 [1,1,0,0,0,0|0,0,0]=2 4415 B7R0.4 O=C(O)CCCCO Amb9214971 [1,1,0,0,0,0|0,0,0]=2 4416 B7R0.4 O=C(O)CCCCS Amb17503767 [1,1,0,0,0,0|0,0,0]=2 4417 B7R0.4 O=C(O)CCCNCl Amb27173950 [1,1,0,0,0,0|1,0,0]=3 4418 B7R0.4 O=C(O)CCN=C=S Amb24562253 [1,1,0,0,0,0|1,0,1]=4 4419 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [1,1,0,0,0,0|0,0,2]=4 4420 B7R0.4 O=C(O)CC\C=N\O Amb27211579 [1,1,0,0,0,0|1,0,1]=4 4421 B7R0.4 O=C(O)CNCCF Amb28076282 [1,1,0,0,0,0|1,0,0]=3 4422 B7R0.4 O=C(O)CNCCO Amb9325653 [1,1,0,0,0,0|1,0,0]=3 4423 B7R0.4 O=C(O)COCCCl Amb21857870 [1,1,0,0,0,0|1,0,0]=3 4424 B7R0.4 O=C(O)COCCF Amb27866609 [1,1,0,0,0,0|1,0,0]=3 4425 B7R0.4 O=C(O)COCCO Amb6680914 [1,1,0,0,0,0|1,0,0]=3 4426 B7R0.4 O=C(O)CSCCCl Amb18644703 [1,1,0,0,0,0|1,0,0]=3 4427 B7R0.4 O=C(O)CSSCCl Amb27983630 [1,1,0,0,0,0|2,0,0]=4 4428 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [1,1,0,0,0,0|0,0,2]=4 4429 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [1,1,0,0,0,0|0,0,2]=4 4430 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [1,1,0,0,0,0|0,0,2]=4 4431 B7R0.4 O=C(O)\C=C\CCBr Amb25702661 [1,1,0,0,0,0|0,0,2]=4 4432 B7R0.4 O=C(O)\C=C\CCF Amb33196445 [1,1,0,0,0,0|0,0,2]=4 4433 B7R0.4 O=C([O-])CCCCF Amb33527827 [1,1,0,0,0,0|0,0,1]=3 4434 B7R0.4 O=C([O-])CCCCO Amb13952763 [1,1,0,0,0,0|0,0,1]=3 4435 B7R0.4 O=C([O-])CCCCO Amb22749314 [1,1,0,0,0,0|0,0,1]=3 4436 B7R0.4 O=C([O-])COCCO Amb33553026 [1,1,0,0,0,0|1,0,1]=4 4437 B7R0.4 O=C=NCCC(=O)O Amb26053417 [1,1,0,0,0,0|1,0,1]=4 4438 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,1,0,0,0,0|0,0,1]=3 4439 B7R0.4 O=CCCCC(F)F Amb25243487 [1,1,0,0,0,0|2,0,0]=4 4440 B7R0.4 O=CCCCC(O)O Amb25889261 [1,1,0,0,0,0|2,0,0]=4 4441 B7R0.4 O=CNCCC(=O)O Amb18290434 [1,1,0,0,0,0|1,0,1]=4 4442 B7R0.4 O=NSCCC(=O)O Amb28429846 [1,1,0,0,0,0|2,0,0]=4 4443 B7R0.4 O=S(Cl)CCCCCl Amb32720306 [1,1,0,0,0,0|2,0,0]=4 4444 B7R0.4 O=S(Cl)CCCCF Amb32720392 [1,1,0,0,0,0|2,0,0]=4 4445 B7R0.4 O=S([O-])CCCCCl Amb28400114 [1,1,0,0,0,0|1,0,1]=4 4446 B7R0.4 O=S([O-])CCCCF Amb32754733 [1,1,0,0,0,0|1,0,1]=4 4447 B7R0.4 O=S([O-])CCCCO Amb27181023 [1,1,0,0,0,0|1,0,1]=4 4448 B7R0.4 O=[N+]([O-])CCCCF Amb33171716 [1,1,0,0,0,0|1,0,1]=4 4449 B7R0.4 O=[N+]([O-])CCCCO Amb25739830 [1,1,0,0,0,0|1,0,1]=4 4450 B7R0.4 OB(O)CCCCBr Amb20171450 [1,1,0,0,0,0|1,0,1]=4 4451 B7R0.4 OC(Cl)CCCCCl Amb27410884 [1,1,0,0,0,0|1,0,1]=4 4452 B7R0.4 OCCCCB(O)O Amb25351122 [1,1,0,0,0,0|1,0,1]=4 4453 B7R0.4 [C-]#[N+]CCCC(C)C Amb27792444 [1,1,0,0,0,0|1,0,1]=4 4454 B7R0.4 [C-]#[N+]CCOC(C)C Amb1981101 [1,1,0,0,0,0|2,0,0]=4 4455 B7R0.4 [N-]=[N+]=NCCC(=O)O Amb20622326 [1,1,0,0,0,0|2,0,0]=4 4456 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [1,1,0,0,0,0|0,0,2]=4 4457 B7R0.5 C#CCC(Cl)C(C)C Amb27594781 [1,1,0,0,0,0|1,0,1]=4 4458 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [1,1,0,0,0,0|0,0,2]=4 4459 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [1,1,0,0,0,0|0,0,2]=4 4460 B7R0.5 C#CCC(N)C(C)C Amb18959774 [1,1,0,0,0,0|1,0,1]=4 4461 B7R0.5 C#CCC(O)C(=O)O Amb27154881 [1,1,0,0,0,0|0,0,2]=4 4462 B7R0.5 C#CCC(O)C(C)C Amb20623629 [1,1,0,0,0,0|1,0,1]=4 4463 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [1,1,0,0,0,0|0,0,2]=4 4464 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [1,1,0,0,0,0|0,0,2]=4 4465 B7R0.5 C#CC[C@@H](O)C(C)C Amb28315168 [1,1,0,0,0,0|1,0,1]=4 4466 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [1,1,0,0,0,0|0,0,2]=4 4467 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [1,1,0,0,0,0|0,0,2]=4 4468 B7R0.5 C=C(C)C(Cl)CCC Amb28121399 [1,1,0,0,0,0|2,0,0]=4 4469 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [1,1,0,0,0,0|0,0,1]=3 4470 B7R0.5 C=C(CCF)C(=O)O Amb33480692 [1,1,0,0,0,0|1,0,1]=4 4471 B7R0.5 C=C(CCN)C(=O)O Amb27267272 [1,1,0,0,0,0|1,0,1]=4 4472 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [1,1,0,0,0,0|1,0,1]=4 4473 B7R0.5 C=C(COC)C(=O)O Amb26978134 [1,1,0,0,0,0|1,0,1]=4 4474 B7R0.5 C=C(CSC)C(=O)O Amb26953041 [1,1,0,0,0,0|1,0,1]=4 4475 B7R0.5 C=C(F)C(O)CCC Amb27833609 [1,1,0,0,0,0|2,0,0]=4 4476 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [1,1,0,0,0,0|0,0,2]=4 4477 B7R0.5 C=CCC(C)C(C)C Amb22229588 [1,1,0,0,0,0|1,0,0]=3 4478 B7R0.5 C=CCC(C)C(C)O Amb26435224 [1,1,0,0,0,0|2,0,0]=4 4479 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [1,1,0,0,0,0|0,0,2]=4 4480 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [1,1,0,0,0,0|0,0,2]=4 4481 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [1,1,0,0,0,0|0,0,2]=4 4482 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [1,1,0,0,0,0|0,0,2]=4 4483 B7R0.5 C=CCC(O)C(C)C Amb22052662 [1,1,0,0,0,0|1,0,0]=3 4484 B7R0.5 C=CCC(O)[C@H](C)N Amb35738412 [1,1,0,0,0,0|2,0,0]=4 4485 B7R0.5 C=CC[C@@H](C)[C@@H](C)N Amb27471731 [1,1,0,0,0,0|2,0,0]=4 4486 B7R0.5 C=CC[C@@H](C)[C@H](C)N Amb28383991 [1,1,0,0,0,0|2,0,0]=4 4487 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [1,1,0,0,0,0|0,0,2]=4 4488 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [1,1,0,0,0,0|0,0,2]=4 4489 B7R0.5 C=CC[C@@H](N)C(C)C Amb27815025 [1,1,0,0,0,0|1,0,0]=3 4490 B7R0.5 C=CC[C@@H](O)[C@H](C)N Amb27838342 [1,1,0,0,0,0|2,0,0]=4 4491 B7R0.5 C=CC[C@H](C)C(C)O Amb28350029 [1,1,0,0,0,0|2,0,0]=4 4492 B7R0.5 C=CC[C@H](C)[C@@H](C)N Amb27807483 [1,1,0,0,0,0|2,0,0]=4 4493 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [1,1,0,0,0,0|0,0,2]=4 4494 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [1,1,0,0,0,0|0,0,2]=4 4495 B7R0.5 C=CC[C@H](O)[C@H](C)O Amb28366034 [1,1,0,0,0,0|2,0,0]=4 4496 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [1,1,0,0,0,0|0,0,2]=4 4497 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [1,1,0,0,0,0|0,0,2]=4 4498 B7R0.5 CC(=O)C(Br)CCBr Amb26442822 [1,1,0,0,0,0|2,0,0]=4 4499 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [1,1,0,0,0,0|2,0,0]=4 4500 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [1,1,0,0,0,0|2,0,0]=4 4501 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [1,1,0,0,0,0|2,0,0]=4 4502 B7R0.5 CC(=O)C(C)CCO Amb13881368 [1,1,0,0,0,0|2,0,0]=4 4503 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [1,1,0,0,0,0|1,0,1]=4 4504 B7R0.5 CC(=O)C(Cl)CCBr Amb27259779 [1,1,0,0,0,0|2,0,0]=4 4505 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [1,1,0,0,0,0|2,0,0]=4 4506 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [1,1,0,0,0,0|2,0,0]=4 4507 B7R0.5 CC(=O)C(F)CCBr Amb28429129 [1,1,0,0,0,0|2,0,0]=4 4508 B7R0.5 CC(=O)C(F)CCCl Amb27390864 [1,1,0,0,0,0|2,0,0]=4 4509 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,1,0,0,0,0|2,0,0]=4 4510 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,1,0,0,0,0|2,0,0]=4 4511 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [1,1,0,0,0,0|2,0,0]=4 4512 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [1,1,0,0,0,0|1,0,1]=4 4513 B7R0.5 CC(C)=C(C)CC=O Amb27625010 [1,1,0,0,0,0|0,0,2]=4 4514 B7R0.5 CC(C)C(=O)CC=O Amb25771325 [1,1,0,0,0,0|0,0,1]=3 4515 B7R0.5 CC(C)C(=O)CCO Amb20669209 [1,1,0,0,0,0|0,0,2]=4 4516 B7R0.5 CC(C)C(C)CC=O Amb18641816 [1,1,0,0,0,0|0,0,0]=2 4517 B7R0.5 CC(C)C(C)CCBr Amb24425543 [1,1,0,0,0,0|1,0,1]=4 4518 B7R0.5 CC(C)C(C)CCCl Amb25315867 [1,1,0,0,0,0|1,0,1]=4 4519 B7R0.5 CC(C)C(C)CCN Amb18293552 [1,1,0,0,0,0|1,0,1]=4 4520 B7R0.5 CC(C)C(C)CCO Amb26515738 [1,1,0,0,0,0|0,0,1]=3 4521 B7R0.5 CC(C)C(C)CNN Amb27234443 [1,1,0,0,0,0|2,0,0]=4 4522 B7R0.5 CC(C)C(C)CON Amb33360272 [1,1,0,0,0,0|2,0,0]=4 4523 B7R0.5 CC(C)C(C)N=C=O Amb25235166 [1,1,0,0,0,0|1,0,1]=4 4524 B7R0.5 CC(C)C(C)\C=N\O Amb27184671 [1,1,0,0,0,0|1,0,1]=4 4525 B7R0.5 CC(C)C(Cl)\C=N\O Amb27424666 [1,1,0,0,0,0|1,0,1]=4 4526 B7R0.5 CC(C)C(F)CCN Amb25356457 [1,1,0,0,0,0|1,0,1]=4 4527 B7R0.5 CC(C)C(N)CC#N Amb28283930 [1,1,0,0,0,0|1,0,1]=4 4528 B7R0.5 CC(C)C(N)CC=O Amb27628058 [1,1,0,0,0,0|0,0,0]=2 4529 B7R0.5 CC(C)C(N)CCF Amb29869421 [1,1,0,0,0,0|1,0,1]=4 4530 B7R0.5 CC(C)C(N)CCO Amb1993950 [1,1,0,0,0,0|0,0,1]=3 4531 B7R0.5 CC(C)C(O)CC#N Amb17231814 [1,1,0,0,0,0|1,0,1]=4 4532 B7R0.5 CC(C)C(O)CCCl Amb24643325 [1,1,0,0,0,0|1,0,1]=4 4533 B7R0.5 CC(C)C(O)CCN Amb17231832 [1,1,0,0,0,0|1,0,1]=4 4534 B7R0.5 CC(C)C(O)CCO Amb26658678 [1,1,0,0,0,0|0,0,1]=3 4535 B7R0.5 CC(C)C(O)CNO Amb27430090 [1,1,0,0,0,0|1,0,0]=3 4536 B7R0.5 CC(C)C(O)\C=C\Br Amb27231802 [1,1,0,0,0,0|1,0,1]=4 4537 B7R0.5 CC(C)N(C)CCO Amb3941039 [1,1,0,0,0,0|1,0,1]=4 4538 B7R0.5 CC(C)N(O)CCO Amb28347031 [1,1,0,0,0,0|1,0,1]=4 4539 B7R0.5 CC(C)[C@@H](C)CC=O Amb28388606 [1,1,0,0,0,0|0,0,0]=2 4540 B7R0.5 CC(C)[C@@H](C)N=C=O Amb22045305 [1,1,0,0,0,0|1,0,1]=4 4541 B7R0.5 CC(C)[C@@H](N)CCO Amb26864199 [1,1,0,0,0,0|0,0,1]=3 4542 B7R0.5 CC(C)[C@@H](O)CC#N Amb27853213 [1,1,0,0,0,0|1,0,1]=4 4543 B7R0.5 CC(C)[C@@H](O)CCN Amb24474145 [1,1,0,0,0,0|1,0,1]=4 4544 B7R0.5 CC(C)[C@H](C)CCBr Amb27983673 [1,1,0,0,0,0|1,0,1]=4 4545 B7R0.5 CC(C)[C@H](C)N=C=O Amb22053850 [1,1,0,0,0,0|1,0,1]=4 4546 B7R0.5 CC(C)[C@H](N)CCN Amb29849539 [1,1,0,0,0,0|1,0,1]=4 4547 B7R0.5 CC(C)[C@H](N)CCO Amb28284336 [1,1,0,0,0,0|0,0,1]=3 4548 B7R0.5 CC(C)[C@H](N)NC=O Amb28187220 [1,1,0,0,0,0|1,0,0]=3 4549 B7R0.5 CC(C)[C@H](O)CC#N Amb27970556 [1,1,0,0,0,0|1,0,1]=4 4550 B7R0.5 CC(C)[C@H](O)CCN Amb26345189 [1,1,0,0,0,0|1,0,1]=4 4551 B7R0.5 CC(C)[C@H](O)CCN Amb30586553 [1,1,0,0,0,0|1,0,1]=4 4552 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [1,1,0,0,0,0|1,0,1]=4 4553 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [1,1,0,0,0,0|1,0,1]=4 4554 B7R0.5 CC(CC=O)C(Cl)Cl Amb28320750 [1,1,0,0,0,0|2,0,0]=4 4555 B7R0.5 CC(CC=O)N(C)C Amb18203067 [1,1,0,0,0,0|1,0,0]=3 4556 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [1,1,0,0,0,0|2,0,0]=4 4557 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [1,1,0,0,0,0|1,0,0]=3 4558 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [1,1,0,0,0,0|2,0,0]=4 4559 B7R0.5 CC(CCF)C(=O)O Amb24678386 [1,1,0,0,0,0|1,0,0]=3 4560 B7R0.5 CC(CCN)C(=O)O Amb20667970 [1,1,0,0,0,0|1,0,0]=3 4561 B7R0.5 CC(CCN)C(=O)O Amb538221 [1,1,0,0,0,0|1,0,0]=3 4562 B7R0.5 CC(CCO)C(=O)O Amb18641949 [1,1,0,0,0,0|1,0,0]=3 4563 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [1,1,0,0,0,0|1,0,1]=4 4564 B7R0.5 CC(CCO)C(N)=O Amb28280962 [1,1,0,0,0,0|2,0,0]=4 4565 B7R0.5 CC(CCO)N(C)C Amb8428180 [1,1,0,0,0,0|1,0,1]=4 4566 B7R0.5 CC(CNO)C(=O)O Amb28315956 [1,1,0,0,0,0|2,0,0]=4 4567 B7R0.5 CC(CSS)C(=O)O Amb27437183 [1,1,0,0,0,0|2,0,0]=4 4568 B7R0.5 CC(Cl)C(C)OC=O Amb28245214 [1,1,0,0,0,0|2,0,0]=4 4569 B7R0.5 CC(NCO)C(=O)O Amb27468253 [1,1,0,0,0,0|2,0,0]=4 4570 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [1,1,0,0,0,0|0,0,1]=3 4571 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [1,1,0,0,0,0|1,0,1]=4 4572 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [1,1,0,0,0,0|1,0,0]=3 4573 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [1,1,0,0,0,0|0,0,0]=2 4574 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [1,1,0,0,0,0|1,0,0]=3 4575 B7R0.5 CCCC(Br)S(C)=O Amb27471989 [1,1,0,0,0,0|2,0,0]=4 4576 B7R0.5 CCCC(C)C(=N)N Amb27810844 [1,1,0,0,0,0|2,0,0]=4 4577 B7R0.5 CCCC(C)C(=N)N Amb33212650 [1,1,0,0,0,0|2,0,0]=4 4578 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [1,1,0,0,0,0|1,0,0]=3 4579 B7R0.5 CCCC(C)C(=O)O Amb3938958 [1,1,0,0,0,0|0,0,0]=2 4580 B7R0.5 CCCC(C)C(C)=O Amb4034597 [1,1,0,0,0,0|1,0,0]=3 4581 B7R0.5 CCCC(C)C(C)C Amb4019539 [1,1,0,0,0,0|1,0,1]=4 4582 B7R0.5 CCCC(C)C(C)O Amb4036337 [1,1,0,0,0,0|1,0,1]=4 4583 B7R0.5 CCCC(C)C(N)=O Amb3886535 [1,1,0,0,0,0|1,0,0]=3 4584 B7R0.5 CCCC(C)C(N)=S Amb25138492 [1,1,0,0,0,0|1,1,0]=4 4585 B7R0.5 CCCC(C)S(=O)Cl Amb32720536 [1,1,0,0,0,0|2,0,0]=4 4586 B7R0.5 CCCC(C)S(=O)[O-] Amb32754802 [1,1,0,0,0,0|1,0,1]=4 4587 B7R0.5 CCCC(C)S(N)=O Amb32720511 [1,1,0,0,0,0|2,0,0]=4 4588 B7R0.5 CCCC(C)[C@@H](C)O Amb33322347 [1,1,0,0,0,0|1,0,1]=4 4589 B7R0.5 CCCC(C)[C@H](C)O Amb33322346 [1,1,0,0,0,0|1,0,1]=4 4590 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [1,1,0,0,0,0|0,0,0]=2 4591 B7R0.5 CCCC(F)C(=O)O Amb25842008 [1,1,0,0,0,0|0,0,0]=2 4592 B7R0.5 CCCC(F)C(C)=O Amb28316211 [1,1,0,0,0,0|1,0,0]=3 4593 B7R0.5 CCCC(F)C(N)=O Amb28127390 [1,1,0,0,0,0|1,0,0]=3 4594 B7R0.5 CCCC(N)C(=N)N Amb27222841 [1,1,0,0,0,0|2,0,0]=4 4595 B7R0.5 CCCC(N)C(=O)O Amb6262055 [1,1,0,0,0,0|0,0,0]=2 4596 B7R0.5 CCCC(N)C(C)=O Amb27838289 [1,1,0,0,0,0|1,0,0]=3 4597 B7R0.5 CCCC(N)C(C)C Amb9031899 [1,1,0,0,0,0|1,0,1]=4 4598 B7R0.5 CCCC(N)C(N)=O Amb22284825 [1,1,0,0,0,0|1,0,0]=3 4599 B7R0.5 CCCC(N)C(N)=O Amb9514970 [1,1,0,0,0,0|1,0,0]=3 4600 B7R0.5 CCCC(N)C(N)=S Amb28121515 [1,1,0,0,0,0|1,1,0]=4 4601 B7R0.5 CCCC(O)C(=N)N Amb27881736 [1,1,0,0,0,0|2,0,0]=4 4602 B7R0.5 CCCC(O)C(=O)O Amb2818222 [1,1,0,0,0,0|0,0,0]=2 4603 B7R0.5 CCCC(O)C(C)=O Amb22495823 [1,1,0,0,0,0|1,0,0]=3 4604 B7R0.5 CCCC(O)C(C)C Amb8513256 [1,1,0,0,0,0|1,0,1]=4 4605 B7R0.5 CCCC(O)C(N)=O Amb24116553 [1,1,0,0,0,0|1,0,0]=3 4606 B7R0.5 CCCC(S)C(=O)O Amb18124440 [1,1,0,0,0,0|0,0,0]=2 4607 B7R0.5 CCCN(C)C(=O)Cl Amb26478280 [1,1,0,0,0,0|2,0,0]=4 4608 B7R0.5 CCCN(C)C(N)=O Amb8898960 [1,1,0,0,0,0|2,0,0]=4 4609 B7R0.5 CCCN(N)C(C)=O Amb18641903 [1,1,0,0,0,0|2,0,0]=4 4610 B7R0.5 CCCN(O)C(N)=O Amb28347092 [1,1,0,0,0,0|2,0,0]=4 4611 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [1,1,0,0,0,0|0,0,0]=2 4612 B7R0.5 CCC[C@@H](C)C(C)O Amb28187641 [1,1,0,0,0,0|1,0,1]=4 4613 B7R0.5 CCC[C@@H](C)[C@@H](C)O Amb27181050 [1,1,0,0,0,0|1,0,1]=4 4614 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [1,1,0,0,0,0|0,0,0]=2 4615 B7R0.5 CCC[C@@H](Cl)[C@H](C)O Amb27668868 [1,1,0,0,0,0|1,0,1]=4 4616 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [1,1,0,0,0,0|0,0,0]=2 4617 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [1,1,0,0,0,0|1,0,0]=3 4618 B7R0.5 CCC[C@@H](N)C(C)O Amb29849610 [1,1,0,0,0,0|1,0,1]=4 4619 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [1,1,0,0,0,0|1,0,0]=3 4620 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [1,1,0,0,0,0|1,0,0]=3 4621 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [1,1,0,0,0,0|0,0,0]=2 4622 B7R0.5 CCC[C@@H](O)[C@@H](C)O Amb27457775 [1,1,0,0,0,0|1,0,1]=4 4623 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [1,1,0,0,0,0|0,0,0]=2 4624 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [1,1,0,0,0,0|0,0,0]=2 4625 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [1,1,0,0,0,0|1,0,0]=3 4626 B7R0.5 CCC[C@H](C)[C@H](C)O Amb28065150 [1,1,0,0,0,0|1,0,1]=4 4627 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [1,1,0,0,0,0|0,0,0]=2 4628 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [1,1,0,0,0,0|0,0,0]=2 4629 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [1,1,0,0,0,0|0,0,0]=2 4630 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [1,1,0,0,0,0|1,0,0]=3 4631 B7R0.5 CCC[C@H](N)C(C)C Amb27229389 [1,1,0,0,0,0|1,0,1]=4 4632 B7R0.5 CCC[C@H](N)C(C)O Amb35664016 [1,1,0,0,0,0|1,0,1]=4 4633 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [1,1,0,0,0,0|1,0,0]=3 4634 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [1,1,0,0,0,0|1,0,0]=3 4635 B7R0.5 CCC[C@H](N)[C@H](C)O Amb27883481 [1,1,0,0,0,0|1,0,1]=4 4636 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [1,1,0,0,0,0|0,0,0]=2 4637 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [1,1,0,0,0,0|1,0,0]=3 4638 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [1,1,0,0,0,0|0,0,0]=2 4639 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [1,1,0,0,0,0|1,0,1]=4 4640 B7R0.5 CCNC(C)C(=O)O Amb33527634 [1,1,0,0,0,0|1,0,0]=3 4641 B7R0.5 CCNC(C)C(=O)O Amb9326962 [1,1,0,0,0,0|1,0,0]=3 4642 B7R0.5 CCNC(C)C(N)=O Amb21959648 [1,1,0,0,0,0|2,0,0]=4 4643 B7R0.5 CCNC(C)C(N)=O Amb7758139 [1,1,0,0,0,0|2,0,0]=4 4644 B7R0.5 CCNC(O)C(=O)O Amb27259098 [1,1,0,0,0,0|1,0,0]=3 4645 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [1,1,0,0,0,0|1,0,0]=3 4646 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [1,1,0,0,0,0|1,0,0]=3 4647 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [1,1,0,0,0,0|1,0,1]=4 4648 B7R0.5 CCOC(C)C(=O)O Amb9725271 [1,1,0,0,0,0|1,0,0]=3 4649 B7R0.5 CCOC(C)C(C)=O Amb9666103 [1,1,0,0,0,0|2,0,0]=4 4650 B7R0.5 CCOC(C)C(N)=O Amb19960053 [1,1,0,0,0,0|2,0,0]=4 4651 B7R0.5 CCOC(Cl)C(=O)Cl Amb27659279 [1,1,0,0,0,0|2,0,0]=4 4652 B7R0.5 CCOC(Cl)C(N)=O Amb27468650 [1,1,0,0,0,0|2,0,0]=4 4653 B7R0.5 CCOC(F)C(=O)O Amb27210743 [1,1,0,0,0,0|1,0,0]=3 4654 B7R0.5 CCSC(=O)C(=O)O Amb28410577 [1,1,0,0,0,0|1,0,1]=4 4655 B7R0.5 CCSC(C)C(=O)O Amb9721554 [1,1,0,0,0,0|1,0,0]=3 4656 B7R0.5 CCSC(C)C(N)=O Amb27830179 [1,1,0,0,0,0|2,0,0]=4 4657 B7R0.5 CCSC(Cl)C(C)=O Amb27862346 [1,1,0,0,0,0|2,0,0]=4 4658 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [1,1,0,0,0,0|0,0,2]=4 4659 B7R0.5 CC\C=C(/F)C(=O)O Amb27968785 [1,1,0,0,0,0|0,0,2]=4 4660 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [1,1,0,0,0,0|0,0,2]=4 4661 B7R0.5 CN(C)C(=S)CC=O Amb27974853 [1,1,0,0,0,0|1,0,1]=4 4662 B7R0.5 CNCC(C)C(=O)O Amb13952364 [1,1,0,0,0,0|1,0,0]=3 4663 B7R0.5 CNCC(C)C(=O)O Amb9400281 [1,1,0,0,0,0|1,0,0]=3 4664 B7R0.5 CNCC(C)C(N)=O Amb8943991 [1,1,0,0,0,0|2,0,0]=4 4665 B7R0.5 CNCC(N)C(=O)O Amb10845350 [1,1,0,0,0,0|1,0,0]=3 4666 B7R0.5 CNCC(N)C(C)C Amb18290164 [1,1,0,0,0,0|2,0,0]=4 4667 B7R0.5 CNCC(O)C(=O)O Amb26894610 [1,1,0,0,0,0|1,0,0]=3 4668 B7R0.5 CNCC(O)C(C)C Amb18523805 [1,1,0,0,0,0|2,0,0]=4 4669 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [1,1,0,0,0,0|1,0,0]=3 4670 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [1,1,0,0,0,0|1,0,0]=3 4671 B7R0.5 CNC[C@H](O)C(C)C Amb27398588 [1,1,0,0,0,0|2,0,0]=4 4672 B7R0.5 COCC(Br)C(=O)Cl Amb27797270 [1,1,0,0,0,0|2,0,0]=4 4673 B7R0.5 COCC(Br)C(=O)O Amb17594709 [1,1,0,0,0,0|1,0,0]=3 4674 B7R0.5 COCC(C)C(=O)O Amb33545090 [1,1,0,0,0,0|1,0,0]=3 4675 B7R0.5 COCC(C)C(C)=O Amb24683449 [1,1,0,0,0,0|2,0,0]=4 4676 B7R0.5 COCC(C)C(N)=O Amb27401584 [1,1,0,0,0,0|2,0,0]=4 4677 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [1,1,0,0,0,0|1,0,0]=3 4678 B7R0.5 COCC(N)C(=O)O Amb33551350 [1,1,0,0,0,0|1,0,0]=3 4679 B7R0.5 COCC(N)C(=O)O Amb6752055 [1,1,0,0,0,0|1,0,0]=3 4680 B7R0.5 COCC(N)C(C)=O Amb27468401 [1,1,0,0,0,0|2,0,0]=4 4681 B7R0.5 COCC(N)C(C)C Amb18202679 [1,1,0,0,0,0|2,0,0]=4 4682 B7R0.5 COCC(N)C(C)C Amb21954041 [1,1,0,0,0,0|2,0,0]=4 4683 B7R0.5 COCC(N)C(N)=O Amb18984372 [1,1,0,0,0,0|2,0,0]=4 4684 B7R0.5 COCC(N)C(N)=O Amb32693410 [1,1,0,0,0,0|2,0,0]=4 4685 B7R0.5 COCC(O)C(=O)O Amb18124273 [1,1,0,0,0,0|1,0,0]=3 4686 B7R0.5 COCC(O)C(C)C Amb20623562 [1,1,0,0,0,0|2,0,0]=4 4687 B7R0.5 COCC(O)C(N)=O Amb28069186 [1,1,0,0,0,0|2,0,0]=4 4688 B7R0.5 COCC(S)C(=O)O Amb27763656 [1,1,0,0,0,0|1,0,0]=3 4689 B7R0.5 COCC(S)C(C)C Amb25809664 [1,1,0,0,0,0|2,0,0]=4 4690 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [1,1,0,0,0,0|1,0,0]=3 4691 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [1,1,0,0,0,0|1,0,0]=3 4692 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [1,1,0,0,0,0|1,0,0]=3 4693 B7R0.5 COC[C@@H](N)C(C)C Amb17061638 [1,1,0,0,0,0|2,0,0]=4 4694 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [1,1,0,0,0,0|1,0,0]=3 4695 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [1,1,0,0,0,0|1,0,0]=3 4696 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [1,1,0,0,0,0|1,0,0]=3 4697 B7R0.5 COC[C@H](N)C(C)C Amb18016631 [1,1,0,0,0,0|2,0,0]=4 4698 B7R0.5 COC[C@H](N)C(C)C Amb32411970 [1,1,0,0,0,0|2,0,0]=4 4699 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [1,1,0,0,0,0|1,0,0]=3 4700 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [1,1,0,0,0,0|2,0,0]=4 4701 B7R0.5 CSCC(C)C(=O)O Amb18967825 [1,1,0,0,0,0|1,0,0]=3 4702 B7R0.5 CSCC(Cl)C(=O)Cl Amb27801927 [1,1,0,0,0,0|2,0,0]=4 4703 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [1,1,0,0,0,0|1,0,0]=3 4704 B7R0.5 CSCC(N)C(=O)O Amb33804791 [1,1,0,0,0,0|1,0,0]=3 4705 B7R0.5 CSCC(N)C(=O)O Amb6280829 [1,1,0,0,0,0|1,0,0]=3 4706 B7R0.5 CSCC(O)C(=O)O Amb25131873 [1,1,0,0,0,0|1,0,0]=3 4707 B7R0.5 CSCC(O)C(C)=O Amb25983211 [1,1,0,0,0,0|2,0,0]=4 4708 B7R0.5 CSCC(O)C(C)C Amb27401267 [1,1,0,0,0,0|2,0,0]=4 4709 B7R0.5 CSCC(O)C(N)=O Amb27168145 [1,1,0,0,0,0|2,0,0]=4 4710 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [1,1,0,0,0,0|1,0,0]=3 4711 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [1,1,0,0,0,0|1,0,0]=3 4712 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [1,1,0,0,0,0|1,0,0]=3 4713 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [1,1,0,0,0,0|2,0,0]=4 4714 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [1,1,0,0,0,0|1,0,0]=3 4715 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [1,1,0,0,0,0|1,0,0]=3 4716 B7R0.5 C[C@@H](CCO)N(C)C Amb27488981 [1,1,0,0,0,0|1,0,1]=4 4717 B7R0.5 C[C@@H](O)[C@@H](O)CC=O Amb27643485 [1,1,0,0,0,0|1,0,0]=3 4718 B7R0.5 C[C@@H](O)[C@H](O)CC=O Amb27798254 [1,1,0,0,0,0|1,0,0]=3 4719 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [1,1,0,0,0,0|1,0,0]=3 4720 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [1,1,0,0,0,0|2,0,0]=4 4721 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [1,1,0,0,0,0|1,0,0]=3 4722 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [1,1,0,0,0,0|1,0,0]=3 4723 B7R0.5 C\C(=C/C=O)C(C)C Amb18641697 [1,1,0,0,0,0|0,0,2]=4 4724 B7R0.5 C\C(=C\C=O)C(C)C Amb27872238 [1,1,0,0,0,0|0,0,2]=4 4725 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [1,1,0,0,0,0|0,0,2]=4 4726 B7R0.5 C\C=C\C(Br)C(C)C Amb24333001 [1,1,0,0,0,0|1,0,1]=4 4727 B7R0.5 C\C=C\C(N)C(C)C Amb24473868 [1,1,0,0,0,0|1,0,1]=4 4728 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [1,1,0,0,0,0|0,0,2]=4 4729 B7R0.5 C\C=C\C(O)C(C)C Amb22231665 [1,1,0,0,0,0|1,0,1]=4 4730 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [1,1,0,0,0,0|0,0,2]=4 4731 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [1,1,0,0,0,0|0,0,2]=4 4732 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [1,1,0,0,0,0|0,0,2]=4 4733 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [1,1,0,0,0,0|1,0,1]=4 4734 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [1,1,0,0,0,0|1,0,1]=4 4735 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [1,1,0,0,0,0|1,0,1]=4 4736 B7R0.5 NC(=O)C(Br)CCCl Amb27954931 [1,1,0,0,0,0|2,0,0]=4 4737 B7R0.5 NC(=O)C(N)CCF Amb24391278 [1,1,0,0,0,0|2,0,0]=4 4738 B7R0.5 NC(=O)C(N)CCO Amb24481392 [1,1,0,0,0,0|2,0,0]=4 4739 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [1,1,0,0,0,0|1,0,0]=3 4740 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [1,1,0,0,0,0|1,0,0]=3 4741 B7R0.5 NC(CCF)C(=O)O Amb25889337 [1,1,0,0,0,0|1,0,0]=3 4742 B7R0.5 NC(CCF)C(=O)O Amb28934889 [1,1,0,0,0,0|1,0,0]=3 4743 B7R0.5 NC(CCO)C(=O)O Amb8514287 [1,1,0,0,0,0|1,0,0]=3 4744 B7R0.5 NC(CCS)C(=O)O Amb19267093 [1,1,0,0,0,0|1,0,0]=3 4745 B7R0.5 NC(CCS)C(=O)O Amb3499433 [1,1,0,0,0,0|1,0,0]=3 4746 B7R0.5 NC(CCS)[PH](=O)O Amb27409002 [1,1,0,0,0,0|2,0,0]=4 4747 B7R0.5 NC(CNO)C(=O)O Amb4092732 [1,1,0,0,0,0|2,0,0]=4 4748 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [1,1,0,0,0,0|1,1,0]=4 4749 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [1,1,0,0,0,0|1,0,0]=3 4750 B7R0.5 NCCC(F)C(=O)O Amb10838221 [1,1,0,0,0,0|1,0,0]=3 4751 B7R0.5 NCCC(F)C(=O)O Amb22229524 [1,1,0,0,0,0|1,0,0]=3 4752 B7R0.5 NCCC(F)[PH](=O)O Amb27639139 [1,1,0,0,0,0|2,0,0]=4 4753 B7R0.5 NCCC(N)C(=O)O Amb2697841 [1,1,0,0,0,0|1,0,0]=3 4754 B7R0.5 NCCC(N)C(=O)O Amb8514694 [1,1,0,0,0,0|1,0,0]=3 4755 B7R0.5 NCCC(O)C(=O)O Amb16232090 [1,1,0,0,0,0|1,0,0]=3 4756 B7R0.5 NCCC(O)C(N)=O Amb28121985 [1,1,0,0,0,0|2,0,0]=4 4757 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [1,1,0,0,0,0|1,0,0]=3 4758 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [1,1,0,0,0,0|1,0,0]=3 4759 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [1,1,0,0,0,0|1,0,0]=3 4760 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [1,1,0,0,0,0|1,0,0]=3 4761 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [1,1,0,0,0,0|2,0,0]=4 4762 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [1,1,0,0,0,0|1,0,0]=3 4763 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [1,1,0,0,0,0|1,0,0]=3 4764 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [1,1,0,0,0,0|1,0,0]=3 4765 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [1,1,0,0,0,0|1,0,0]=3 4766 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [1,1,0,0,0,0|1,0,0]=3 4767 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [1,1,0,0,0,0|1,0,0]=3 4768 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [1,1,0,0,0,0|1,0,0]=3 4769 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [1,1,0,0,0,0|2,0,0]=4 4770 B7R0.5 NOCC(N)C(=O)O Amb24184086 [1,1,0,0,0,0|2,0,0]=4 4771 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [1,1,0,0,0,0|1,0,0]=3 4772 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [1,1,0,0,0,0|1,0,0]=3 4773 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [1,1,0,0,0,0|1,0,0]=3 4774 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [1,1,0,0,0,0|1,0,0]=3 4775 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [1,1,0,0,0,0|1,0,0]=3 4776 B7R0.5 N[C@@H](OCS)C(=O)O Amb27591629 [1,1,0,0,0,0|2,0,0]=4 4777 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [1,1,0,0,0,0|1,0,1]=4 4778 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [1,1,0,0,0,0|1,0,0]=3 4779 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [1,1,0,0,0,0|1,0,0]=3 4780 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [1,1,0,0,0,0|1,0,0]=3 4781 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [1,1,0,0,0,0|2,0,0]=4 4782 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [1,1,0,0,0,0|2,0,0]=4 4783 B7R0.5 O=C(Cl)C(Br)CCCl Amb26515711 [1,1,0,0,0,0|2,0,0]=4 4784 B7R0.5 O=C(O)C(=O)CCF Amb33377241 [1,1,0,0,0,0|1,0,1]=4 4785 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [1,1,0,0,0,0|1,0,1]=4 4786 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [1,1,0,0,0,0|1,0,0]=3 4787 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [1,1,0,0,0,0|1,0,0]=3 4788 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [1,1,0,0,0,0|1,0,0]=3 4789 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [1,1,0,0,0,0|1,0,0]=3 4790 B7R0.5 O=C(O)C(O)CCF Amb28071189 [1,1,0,0,0,0|1,0,0]=3 4791 B7R0.5 O=C(O)C(O)CCO Amb24689942 [1,1,0,0,0,0|1,0,0]=3 4792 B7R0.5 O=C(O)C(O)CNO Amb27405525 [1,1,0,0,0,0|2,0,0]=4 4793 B7R0.5 O=C(O)C(S)CCS Amb27634893 [1,1,0,0,0,0|1,0,0]=3 4794 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [1,1,0,0,0,0|1,0,0]=3 4795 B7R0.5 [NH3+]CCC([NH3+])C(=O)[O-] Amb33513240 [1,1,0,0,0,0|1,0,1]=4 4796 B7R0.8 C#CCCC(C)(C)C Amb2721458 [1,1,0,0,0,0|1,0,1]=4 4797 B7R0.8 C#CCCC(C)(C)F Amb33271800 [1,1,0,0,0,0|1,0,1]=4 4798 B7R0.8 C#CCCC(C)(C)N Amb35658022 [1,1,0,0,0,0|1,0,1]=4 4799 B7R0.8 C=CCCC(C)(C)C Amb24687786 [1,1,0,0,0,0|1,0,0]=3 4800 B7R0.8 C=CCCC(C)(C)Cl Amb25068240 [1,1,0,0,0,0|1,0,0]=3 4801 B7R0.8 C=CCCC(C)(C)N Amb18641750 [1,1,0,0,0,0|1,0,0]=3 4802 B7R0.8 C=CCCC(C)(C)N Amb32661209 [1,1,0,0,0,0|1,0,0]=3 4803 B7R0.8 C=CCCC(C)(C)O Amb26932721 [1,1,0,0,0,0|1,0,0]=3 4804 B7R0.8 C=CCC[Si](C)(C)C Amb10071973 [1,1,0,0,0,0|1,1,0]=4 4805 B7R0.8 C=CCNC(C)(C)C Amb18986065 [1,1,0,0,0,0|2,0,0]=4 4806 B7R0.8 C=CCNC(C)(C)C Amb28934807 [1,1,0,0,0,0|2,0,0]=4 4807 B7R0.8 C=CCOC(C)(C)C Amb33326193 [1,1,0,0,0,0|2,0,0]=4 4808 B7R0.8 C=CCSC(C)(C)C Amb22731571 [1,1,0,0,0,0|2,0,0]=4 4809 B7R0.8 C=COCC(C)(C)C Amb27237689 [1,1,0,0,0,0|2,0,0]=4 4810 B7R0.8 C=COCC(C)(C)N Amb27175426 [1,1,0,0,0,0|2,0,0]=4 4811 B7R0.8 CC(C)(C)C#CC=O Amb17593130 [1,1,0,0,0,0|0,0,2]=4 4812 B7R0.8 CC(C)(C)CCC#N Amb15701560 [1,1,0,0,0,0|1,0,1]=4 4813 B7R0.8 CC(C)(C)CCC=O Amb18641814 [1,1,0,0,0,0|0,0,0]=2 4814 B7R0.8 CC(C)(C)CCCBr Amb22227840 [1,1,0,0,0,0|1,0,1]=4 4815 B7R0.8 CC(C)(C)CCCCl Amb25705668 [1,1,0,0,0,0|1,0,1]=4 4816 B7R0.8 CC(C)(C)CCCI Amb28316140 [1,1,0,0,0,0|1,0,1]=4 4817 B7R0.8 CC(C)(C)CCCN Amb15701618 [1,1,0,0,0,0|1,0,1]=4 4818 B7R0.8 CC(C)(C)CCCN Amb17078776 [1,1,0,0,0,0|1,0,1]=4 4819 B7R0.8 CC(C)(C)CCCO Amb15701555 [1,1,0,0,0,0|0,0,1]=3 4820 B7R0.8 CC(C)(C)CCCS Amb25110303 [1,1,0,0,0,0|0,1,1]=4 4821 B7R0.8 CC(C)(C)CCNN Amb32751193 [1,1,0,0,0,0|2,0,0]=4 4822 B7R0.8 CC(C)(C)CCNN Amb6243998 [1,1,0,0,0,0|2,0,0]=4 4823 B7R0.8 CC(C)(C)CCNO Amb27220747 [1,1,0,0,0,0|1,0,0]=3 4824 B7R0.8 CC(C)(C)CCON Amb26509692 [1,1,0,0,0,0|2,0,0]=4 4825 B7R0.8 CC(C)(C)CN=C=O Amb6270798 [1,1,0,0,0,0|1,0,1]=4 4826 B7R0.8 CC(C)(C)C\C=C/Br Amb28206708 [1,1,0,0,0,0|1,0,1]=4 4827 B7R0.8 CC(C)(C)NCCO Amb2720727 [1,1,0,0,0,0|1,0,1]=4 4828 B7R0.8 CC(C)(C)OCCO Amb3939641 [1,1,0,0,0,0|1,0,1]=4 4829 B7R0.8 CC(C)(C)SCCO Amb4021234 [1,1,0,0,0,0|1,0,1]=4 4830 B7R0.8 CC(C)(C)\C=C\C=O Amb18641695 [1,1,0,0,0,0|0,0,2]=4 4831 B7R0.8 CC(C)(Cl)CCC#N Amb2778544 [1,1,0,0,0,0|1,0,1]=4 4832 B7R0.8 CC(C)(Cl)CCCCl Amb33545049 [1,1,0,0,0,0|1,0,1]=4 4833 B7R0.8 CC(C)(Cl)CCCN Amb26578819 [1,1,0,0,0,0|1,0,1]=4 4834 B7R0.8 CC(C)(F)CCC#N Amb27813425 [1,1,0,0,0,0|1,0,1]=4 4835 B7R0.8 CC(C)(F)CCC=O Amb25223234 [1,1,0,0,0,0|0,0,0]=2 4836 B7R0.8 CC(C)(F)CCCBr Amb25227493 [1,1,0,0,0,0|1,0,1]=4 4837 B7R0.8 CC(C)(F)CCCN Amb26415060 [1,1,0,0,0,0|1,0,1]=4 4838 B7R0.8 CC(C)(F)CCCN Amb35749565 [1,1,0,0,0,0|1,0,1]=4 4839 B7R0.8 CC(C)(F)CCCO Amb24639473 [1,1,0,0,0,0|0,0,1]=3 4840 B7R0.8 CC(C)(F)CCCS Amb33271130 [1,1,0,0,0,0|0,1,1]=4 4841 B7R0.8 CC(C)(F)CCON Amb28195896 [1,1,0,0,0,0|2,0,0]=4 4842 B7R0.8 CC(C)(F)CN=C=O Amb24513700 [1,1,0,0,0,0|1,0,1]=4 4843 B7R0.8 CC(C)(F)\C=C\C=O Amb33271856 [1,1,0,0,0,0|0,0,2]=4 4844 B7R0.8 CC(C)(N)C#CC=O Amb24657217 [1,1,0,0,0,0|0,0,2]=4 4845 B7R0.8 CC(C)(N)CCC#N Amb27975778 [1,1,0,0,0,0|1,0,1]=4 4846 B7R0.8 CC(C)(N)CCCF Amb26410141 [1,1,0,0,0,0|1,0,1]=4 4847 B7R0.8 CC(C)(N)CCCN Amb18641912 [1,1,0,0,0,0|1,0,1]=4 4848 B7R0.8 CC(C)(N)CCCO Amb8631065 [1,1,0,0,0,0|0,0,1]=3 4849 B7R0.8 CC(C)(N)CCNN Amb28455560 [1,1,0,0,0,0|2,0,0]=4 4850 B7R0.8 CC(C)(N)C\C=C\Cl Amb35657862 [1,1,0,0,0,0|1,0,1]=4 4851 B7R0.8 CC(C)(O)C#CC=O Amb25084561 [1,1,0,0,0,0|0,0,2]=4 4852 B7R0.8 CC(C)(O)CCCF Amb33196444 [1,1,0,0,0,0|1,0,1]=4 4853 B7R0.8 CC(C)(O)CCCN Amb17569908 [1,1,0,0,0,0|1,0,1]=4 4854 B7R0.8 CC(C)(O)CCCO Amb20668492 [1,1,0,0,0,0|0,0,1]=3 4855 B7R0.8 CC(C)(O)CCNN Amb25303050 [1,1,0,0,0,0|2,0,0]=4 4856 B7R0.8 CC(C)(O)CCNN Amb33473718 [1,1,0,0,0,0|2,0,0]=4 4857 B7R0.8 CC(C)(O)CNC=O Amb28250027 [1,1,0,0,0,0|1,0,0]=3 4858 B7R0.8 CC(C)(S)CCC#N Amb28315161 [1,1,0,0,0,0|1,0,1]=4 4859 B7R0.8 CC(F)(F)CCC=O Amb25935601 [1,1,0,0,0,0|1,0,0]=3 4860 B7R0.8 CC(F)(F)CCCO Amb26370455 [1,1,0,0,0,0|1,0,1]=4 4861 B7R0.8 CC(F)(F)CNC=O Amb35722437 [1,1,0,0,0,0|2,0,0]=4 4862 B7R0.8 CCCCC(C)(C)Br Amb24401418 [1,1,0,0,0,0|1,0,1]=4 4863 B7R0.8 CCCCC(C)(C)C Amb22228234 [1,1,0,0,0,0|1,0,1]=4 4864 B7R0.8 CCCCC(C)(C)N Amb18993512 [1,1,0,0,0,0|1,0,1]=4 4865 B7R0.8 CCCCC(C)(C)O Amb8513443 [1,1,0,0,0,0|1,0,1]=4 4866 B7R0.8 CCCCC(C)(C)S Amb27397079 [1,1,0,0,0,0|1,0,1]=4 4867 B7R0.8 CCCCP(=O)(Cl)Cl Amb8515452 [1,1,0,0,0,0|2,0,0]=4 4868 B7R0.8 CCCCP(=O)(O)O Amb22053921 [1,1,0,0,0,0|1,0,0]=3 4869 B7R0.8 CCCCS(=O)(=O)Cl Amb3939750 [1,1,0,0,0,0|1,0,1]=4 4870 B7R0.8 CCCCS(=O)(=O)F Amb10610096 [1,1,0,0,0,0|1,0,1]=4 4871 B7R0.8 CCCCS(=O)(=O)O Amb10844727 [1,1,0,0,0,0|1,0,0]=3 4872 B7R0.8 CCCCS(=O)(=O)[O-] Amb8514323 [1,1,0,0,0,0|1,0,1]=4 4873 B7R0.8 CCCCS(=O)(=O)[O-] Amb9871422 [1,1,0,0,0,0|1,0,1]=4 4874 B7R0.8 CCCCS(N)(=O)=O Amb1132715 [1,1,0,0,0,0|1,0,1]=4 4875 B7R0.8 CCCC[Sn](O)(O)Cl Amb19894194 [1,1,0,0,0,0|1,0,1]=4 4876 B7R0.8 CCCNS(=O)(=O)O Amb27430064 [1,1,0,0,0,0|2,0,0]=4 4877 B7R0.8 CCCOP(=O)(O)O Amb27789994 [1,1,0,0,0,0|2,0,0]=4 4878 B7R0.8 CCCOP(C)(=O)O Amb24553958 [1,1,0,0,0,0|2,0,0]=4 4879 B7R0.8 CNCCC(C)(C)C Amb19959916 [1,1,0,0,0,0|2,0,0]=4 4880 B7R0.8 CNCCC(C)(C)C Amb8841433 [1,1,0,0,0,0|2,0,0]=4 4881 B7R0.8 CNCCC(C)(C)F Amb24679513 [1,1,0,0,0,0|2,0,0]=4 4882 B7R0.8 CNCCC(C)(C)N Amb23400851 [1,1,0,0,0,0|2,0,0]=4 4883 B7R0.8 CNCCC(C)(C)N Amb23402091 [1,1,0,0,0,0|2,0,0]=4 4884 B7R0.8 CNCCC(C)(C)O Amb10607875 [1,1,0,0,0,0|2,0,0]=4 4885 B7R0.8 CNCCP(=O)(O)O Amb27751957 [1,1,0,0,0,0|2,0,0]=4 4886 B7R0.8 CNCCS(=O)(=O)O Amb6825625 [1,1,0,0,0,0|2,0,0]=4 4887 B7R0.8 COCCC(C)(C)N Amb17569920 [1,1,0,0,0,0|2,0,0]=4 4888 B7R0.8 COCCC(C)(C)N Amb20623585 [1,1,0,0,0,0|2,0,0]=4 4889 B7R0.8 COCCC(C)(C)O Amb25940052 [1,1,0,0,0,0|2,0,0]=4 4890 B7R0.8 CP(=O)(O)CCC=O Amb27643443 [1,1,0,0,0,0|2,0,0]=4 4891 B7R0.8 CP(=O)(O)CCCN Amb634789 [1,1,0,0,0,0|2,0,0]=4 4892 B7R0.8 CS(=O)(=O)CCC=O Amb28289688 [1,1,0,0,0,0|2,0,0]=4 4893 B7R0.8 CSCCC(C)(C)N Amb24435204 [1,1,0,0,0,0|2,0,0]=4 4894 B7R0.8 CSCCC(C)(C)O Amb24483080 [1,1,0,0,0,0|2,0,0]=4 4895 B7R0.8 C[N+](C)(N)CCC=O Amb28250962 [1,1,0,0,0,0|1,0,0]=3 4896 B7R0.8 C[Si](C)(C)C\C=C\O Amb24054162 [1,1,0,0,0,0|0,1,1]=4 4897 B7R0.8 C\C=C\CC(C)(C)C Amb26516327 [1,1,0,0,0,0|1,0,1]=4 4898 B7R0.8 C\C=C\CC(C)(C)N Amb35653978 [1,1,0,0,0,0|1,0,1]=4 4899 B7R0.8 NCCCP(=O)(O)O Amb2714831 [1,1,0,0,0,0|2,0,0]=4 4900 B7R0.8 NCCCS(=O)(=O)O Amb3940464 [1,1,0,0,0,0|2,0,0]=4 4901 B7R0.8 O=CCCC(F)(F)F Amb24056014 [1,1,0,0,0,0|2,0,0]=4 4902 B7R0.8 O=CCCC(F)(F)F Amb33544389 [1,1,0,0,0,0|2,0,0]=4 4903 B7R0.8 O=P(O)(O)CCCCl Amb22388825 [1,1,0,0,0,0|2,0,0]=4 4904 B7R0.8 O=P(O)(O)CCCO Amb28207371 [1,1,0,0,0,0|2,0,0]=4 4905 B7R0.8 O=S(=O)(O)CCCBr Amb27391135 [1,1,0,0,0,0|2,0,0]=4 4906 B7R0.8 O=S(=O)(O)CCCI Amb29859913 [1,1,0,0,0,0|2,0,0]=4 4907 B7R0.8 O=S(=O)(O)CCCS Amb20620653 [1,1,0,0,0,0|2,0,0]=4 4908 B7R0.8 [C-]#[N+]CCC(C)(C)C Amb2687509 [1,1,0,0,0,0|2,0,0]=4 4909 B7R0.8 [C-]#[N+]CCC(C)(C)F Amb25951708 [1,1,0,0,0,0|2,0,0]=4 4910 B7R0.9 C=C(C)CC(C)(C)N Amb30030887 [0,1,0,0,1,0|2,0,0]=4 4911 B7R0.9 C=C(C)CC(C)(C)O Amb22052674 [0,1,0,0,1,0|2,0,0]=4 4912 B7R0.9 CC(=O)CC(C)(C)C Amb4605984 [0,1,0,0,1,0|1,0,0]=3 4913 B7R0.9 CC(=O)CC(C)(C)Cl Amb27861037 [0,1,0,0,1,0|1,0,0]=3 4914 B7R0.9 CC(=O)CC(C)(C)N Amb3940544 [0,1,0,0,1,0|1,0,0]=3 4915 B7R0.9 CC(=O)CC(C)(C)N Amb4136360 [0,1,0,0,1,0|1,0,0]=3 4916 B7R0.9 CC(=O)CC(C)(C)O Amb2721701 [0,1,0,0,1,0|1,0,0]=3 4917 B7R0.9 CC(=O)CC(C)(C)S Amb17593394 [0,1,0,0,1,0|1,0,0]=3 4918 B7R0.9 CC(=O)CC(C)(F)F Amb21951914 [0,1,0,0,1,0|2,0,0]=4 4919 B7R0.9 CC(=O)C[N+](C)(C)C Amb32661846 [0,1,0,0,1,0|2,0,0]=4 4920 B7R0.9 CC(=O)C[N+](C)(C)C Amb32662610 [0,1,0,0,1,0|2,0,0]=4 4921 B7R0.9 CC(=O)C[P+](C)(C)C Amb28285163 [0,1,0,0,1,0|2,0,0]=4 4922 B7R0.9 CC(=O)NC(C)(C)C Amb2721059 [0,1,0,0,1,0|2,0,0]=4 4923 B7R0.9 CC(=O)OC(C)(C)C Amb8386362 [0,1,0,0,1,0|2,0,0]=4 4924 B7R0.9 CC(=O)OC(C)(C)Cl Amb28456284 [0,1,0,0,1,0|2,0,0]=4 4925 B7R0.9 CC(=O)SC(C)(C)C Amb22231459 [0,1,0,0,1,0|2,0,0]=4 4926 B7R0.9 CC(C)(Br)CC(=O)Cl Amb32665504 [0,1,0,0,1,0|1,0,0]=3 4927 B7R0.9 CC(C)(Br)CC(=O)O Amb27400399 [0,1,0,0,1,0|0,0,0]=2 4928 B7R0.9 CC(C)(C)CB(O)O Amb13890355 [0,1,0,0,1,0|1,0,1]=4 4929 B7R0.9 CC(C)(C)CC(=N)N Amb33292469 [0,1,0,0,1,0|2,0,0]=4 4930 B7R0.9 CC(C)(C)CC(=O)Cl Amb3939309 [0,1,0,0,1,0|1,0,0]=3 4931 B7R0.9 CC(C)(C)CC(=O)O Amb3939865 [0,1,0,0,1,0|0,0,0]=2 4932 B7R0.9 CC(C)(C)CC(N)=O Amb3886534 [0,1,0,0,1,0|1,0,0]=3 4933 B7R0.9 CC(C)(C)CC(N)=S Amb26548586 [0,1,0,0,1,0|1,1,0]=4 4934 B7R0.9 CC(C)(C)CS(=O)Cl Amb25914797 [0,1,0,0,1,0|2,0,0]=4 4935 B7R0.9 CC(C)(C)CS(=O)[O-] Amb27826292 [0,1,0,0,1,0|1,0,1]=4 4936 B7R0.9 CC(C)(C)CS(N)=O Amb32720484 [0,1,0,0,1,0|2,0,0]=4 4937 B7R0.9 CC(C)(C)C[N+](=O)[O-] Amb27168586 [0,1,0,0,1,0|1,0,1]=4 4938 B7R0.9 CC(C)(C)NC(N)=O Amb2721329 [0,1,0,0,1,0|2,0,0]=4 4939 B7R0.9 CC(C)(C)OC(=O)Cl Amb6743390 [0,1,0,0,1,0|2,0,0]=4 4940 B7R0.9 CC(C)(C)OC(N)=O Amb2236390 [0,1,0,0,1,0|2,0,0]=4 4941 B7R0.9 CC(C)(C)SC(=O)Cl Amb22353785 [0,1,0,0,1,0|2,0,0]=4 4942 B7R0.9 CC(C)(Cl)CC(=O)O Amb28047719 [0,1,0,0,1,0|0,0,0]=2 4943 B7R0.9 CC(C)(F)CC(=N)N Amb33227105 [0,1,0,0,1,0|2,0,0]=4 4944 B7R0.9 CC(C)(F)CC(=O)O Amb26360155 [0,1,0,0,1,0|0,0,0]=2 4945 B7R0.9 CC(C)(F)CC(N)=S Amb33272488 [0,1,0,0,1,0|1,1,0]=4 4946 B7R0.9 CC(C)(F)C[N+](=O)[O-] Amb33271808 [0,1,0,0,1,0|1,0,1]=4 4947 B7R0.9 CC(C)(N)CC(=O)Cl Amb27173472 [0,1,0,0,1,0|1,0,0]=3 4948 B7R0.9 CC(C)(N)CC(=O)O Amb19267108 [0,1,0,0,1,0|0,0,0]=2 4949 B7R0.9 CC(C)(N)CC(=O)O Amb2691269 [0,1,0,0,1,0|0,0,0]=2 4950 B7R0.9 CC(C)(N)CC(=O)O Amb33109875 [0,1,0,0,1,0|0,0,0]=2 4951 B7R0.9 CC(C)(N)CC(N)=O Amb23402094 [0,1,0,0,1,0|1,0,0]=3 4952 B7R0.9 CC(C)(N)CC(N)=O Amb24271090 [0,1,0,0,1,0|1,0,0]=3 4953 B7R0.9 CC(C)(O)CC(=O)O Amb10605560 [0,1,0,0,1,0|0,0,0]=2 4954 B7R0.9 CC(C)(O)CC(=O)[O-] Amb17678748 [0,1,0,0,1,0|0,0,1]=3 4955 B7R0.9 CC(C)(O)CC(=O)[O-] Amb22729769 [0,1,0,0,1,0|0,0,1]=3 4956 B7R0.9 CC(C)(O)CC(N)=O Amb25889946 [0,1,0,0,1,0|1,0,0]=3 4957 B7R0.9 CC(C)(O)C[N+](=O)[O-] Amb2586533 [0,1,0,0,1,0|1,0,1]=4 4958 B7R0.9 CC(C)(S)CC(=O)O Amb28314250 [0,1,0,0,1,0|0,0,0]=2 4959 B7R0.9 CC(C)CC(C)(C)O Amb4018559 [0,1,0,0,1,0|1,0,1]=4 4960 B7R0.9 CC(C)CP(C)(=O)Cl Amb27882661 [0,1,0,0,1,0|2,0,0]=4 4961 B7R0.9 CC(C)CS(=O)(=O)Br Amb23555503 [0,1,0,0,1,0|1,0,1]=4 4962 B7R0.9 CC(C)CS(=O)(=O)Cl Amb8397044 [0,1,0,0,1,0|1,0,1]=4 4963 B7R0.9 CC(C)CS(=O)(=O)F Amb19893332 [0,1,0,0,1,0|1,0,1]=4 4964 B7R0.9 CC(C)CS(=O)(=O)O Amb28349282 [0,1,0,0,1,0|1,0,0]=3 4965 B7R0.9 CC(C)CS(=O)(=O)[S-] Amb3987906 [0,1,0,0,1,0|1,0,1]=4 4966 B7R0.9 CC(C)CS(C)(=N)=O Amb32671042 [0,1,0,0,1,0|2,0,0]=4 4967 B7R0.9 CC(C)CS(N)(=O)=O Amb13951979 [0,1,0,0,1,0|1,0,1]=4 4968 B7R0.9 CC(C)NS(=O)(=O)O Amb28385158 [0,1,0,0,1,0|2,0,0]=4 4969 B7R0.9 CC(C)OP(=O)(O)O Amb22493772 [0,1,0,0,1,0|2,0,0]=4 4970 B7R0.9 CC(C)OP(C)(=O)O Amb10842159 [0,1,0,0,1,0|2,0,0]=4 4971 B7R0.9 CC(F)(F)CC(=O)Cl Amb27596822 [0,1,0,0,1,0|2,0,0]=4 4972 B7R0.9 CC(F)(F)CC(=O)O Amb26018420 [0,1,0,0,1,0|1,0,0]=3 4973 B7R0.9 CC(N)CP(=O)(O)O Amb27592463 [0,1,0,0,1,0|2,0,0]=4 4974 B7R0.9 CC(O)(F)CC(=O)O Amb28072926 [0,1,0,0,1,0|1,0,0]=3 4975 B7R0.9 CC(O)(O)CC(=O)O Amb27405076 [0,1,0,0,1,0|1,0,0]=3 4976 B7R0.9 CC(O)(O)CC(N)=O Amb27882731 [0,1,0,0,1,0|2,0,0]=4 4977 B7R0.9 CC(O)CC(C)(C)C Amb22337936 [0,1,0,0,1,0|1,0,1]=4 4978 B7R0.9 CC(O)CC(C)(C)F Amb26885413 [0,1,0,0,1,0|1,0,1]=4 4979 B7R0.9 CC(O)CC(C)(C)N Amb2785812 [0,1,0,0,1,0|1,0,1]=4 4980 B7R0.9 CC(O)CC(C)(C)O Amb8386003 [0,1,0,0,1,0|1,0,1]=4 4981 B7R0.9 CC(O)CS(=O)(=O)O Amb17593541 [0,1,0,0,1,0|2,0,0]=4 4982 B7R0.9 CN(O)CC(C)(C)C Amb33313056 [0,1,0,0,1,0|2,0,0]=4 4983 B7R0.9 CN(O)CC(C)(C)F Amb33273010 [0,1,0,0,1,0|2,0,0]=4 4984 B7R0.9 CP(=O)(O)CC(=O)O Amb3371772 [0,1,0,0,1,0|2,0,0]=4 4985 B7R0.9 CP(C)(=O)CC(=O)O Amb25197683 [0,1,0,0,1,0|1,0,0]=3 4986 B7R0.9 CS(=O)(=O)CC(=O)O Amb3939888 [0,1,0,0,1,0|2,0,0]=4 4987 B7R0.9 CS(C)(Cl)CC(=O)O Amb27633859 [0,1,0,0,1,0|1,0,0]=3 4988 B7R0.9 C[C@@H](O)CC(C)(C)C Amb24544035 [0,1,0,0,1,0|1,0,1]=4 4989 B7R0.9 C[C@@H](O)CC(C)(C)F Amb33272516 [0,1,0,0,1,0|1,0,1]=4 4990 B7R0.9 C[C@@H](O)CC(C)(C)O Amb10606102 [0,1,0,0,1,0|1,0,1]=4 4991 B7R0.9 C[C@H](N)CP(=O)(O)O Amb27647907 [0,1,0,0,1,0|2,0,0]=4 4992 B7R0.9 C[C@H](N)CS(=O)(=O)O Amb25760668 [0,1,0,0,1,0|2,0,0]=4 4993 B7R0.9 C[C@H](O)CC(C)(C)C Amb24672407 [0,1,0,0,1,0|1,0,1]=4 4994 B7R0.9 C[C@H](O)CC(C)(C)F Amb33272517 [0,1,0,0,1,0|1,0,1]=4 4995 B7R0.9 C[C@H](O)CC(C)(C)O Amb20669803 [0,1,0,0,1,0|1,0,1]=4 4996 B7R0.9 C[N+](C)(C)CC(=O)O Amb3428940 [0,1,0,0,1,0|1,0,0]=3 4997 B7R0.9 C[N+](C)(C)CC(=O)[O-] Amb10843741 [0,1,0,0,1,0|1,0,1]=4 4998 B7R0.9 C[N+](C)(C)CC(=O)[O-] Amb22002454 [0,1,0,0,1,0|1,0,1]=4 4999 B7R0.9 C[N+](C)(C)CC(=O)[O-] Amb6599998 [0,1,0,0,1,0|1,0,1]=4 5000 B7R0.9 C[N+](C)(C)CC(N)=O Amb4282755 [0,1,0,0,1,0|2,0,0]=4 5001 B7R0.9 C[N+](C)(N)CC(=O)O Amb27242840 [0,1,0,0,1,0|1,0,0]=3 5002 B7R0.9 C[Si](C)(C)CC(=O)O Amb19894126 [0,1,0,0,1,0|0,1,0]=3 5003 B7R0.9 O=C(O)CC(Cl)(Cl)Cl Amb27955278 [0,1,0,0,1,0|2,0,0]=4 5004 B7R0.9 O=C(O)CC(F)(F)Br Amb24373833 [0,1,0,0,1,0|2,0,0]=4 5005 B7R0.9 O=C(O)CC(F)(F)F Amb2691112 [0,1,0,0,1,0|2,0,0]=4 5006 B7R0.16 C=C(C(=O)O)C(C)C Amb17593189 [0,1,0,0,1,0|0,0,1]=3 5007 B7R0.16 C=C(C(=O)O)C(C)N Amb27794714 [0,1,0,0,1,0|1,0,1]=4 5008 B7R0.16 C=C(C(=O)O)N(C)C Amb27162682 [0,1,0,0,1,0|1,0,1]=4 5009 B7R0.16 C=C(C(=O)O)[C@@H](C)N Amb27440248 [0,1,0,0,1,0|1,0,1]=4 5010 B7R0.16 C=C(C(=O)O)[C@H](C)O Amb27410183 [0,1,0,0,1,0|1,0,1]=4 5011 B7R0.16 C=C(C)C(C)C(=O)O Amb18641781 [0,1,0,0,1,0|0,0,2]=4 5012 B7R0.16 C=C(C)C(N)C(=O)O Amb18641831 [0,1,0,0,1,0|0,0,2]=4 5013 B7R0.16 C=C(C)C(N)C(C)C Amb18641748 [0,1,0,0,1,0|2,0,0]=4 5014 B7R0.16 C=C(C)C(O)C(=O)O Amb27859701 [0,1,0,0,1,0|0,0,2]=4 5015 B7R0.16 C=C(C)[C@@H](N)C(=O)O Amb26012631 [0,1,0,0,1,0|0,0,2]=4 5016 B7R0.16 C=C(C)[C@@H](O)C(=O)O Amb28071409 [0,1,0,0,1,0|0,0,2]=4 5017 B7R0.16 CC(=O)C(=O)C(C)C Amb26614542 [0,1,0,0,1,0|1,0,1]=4 5018 B7R0.16 CC(=O)C(Br)C(C)C Amb2389580 [0,1,0,0,1,0|1,0,0]=3 5019 B7R0.16 CC(=O)C(Br)C(C)Cl Amb27791473 [0,1,0,0,1,0|2,0,0]=4 5020 B7R0.16 CC(=O)C(C)C(C)O Amb17593202 [0,1,0,0,1,0|2,0,0]=4 5021 B7R0.16 CC(=O)C(C)[C@@H](C)O Amb28316228 [0,1,0,0,1,0|2,0,0]=4 5022 B7R0.16 CC(=O)C(Cl)C(C)C Amb24483197 [0,1,0,0,1,0|1,0,0]=3 5023 B7R0.16 CC(=O)C(F)C(C)O Amb28437134 [0,1,0,0,1,0|2,0,0]=4 5024 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [0,1,0,0,1,0|1,0,1]=4 5025 B7R0.16 CC(=O)C(N)C(C)C Amb23536905 [0,1,0,0,1,0|1,0,0]=3 5026 B7R0.16 CC(=O)C(O)C(C)C Amb25087800 [0,1,0,0,1,0|1,0,0]=3 5027 B7R0.16 CC(=O)C(O)C(C)O Amb26597030 [0,1,0,0,1,0|2,0,0]=4 5028 B7R0.16 CC(=O)C(S)C(C)C Amb28254219 [0,1,0,0,1,0|1,0,0]=3 5029 B7R0.16 CC(=O)N(C)C(C)C Amb28435200 [0,1,0,0,1,0|2,0,0]=4 5030 B7R0.16 CC(=O)N(N)C(C)C Amb18641904 [0,1,0,0,1,0|2,0,0]=4 5031 B7R0.16 CC(=O)[C@@H](C)[C@@H](C)Cl Amb28325873 [0,1,0,0,1,0|2,0,0]=4 5032 B7R0.16 CC(=O)[C@@H](C)[C@H](C)O Amb26966954 [0,1,0,0,1,0|2,0,0]=4 5033 B7R0.16 CC(=O)[C@@H](N)C(C)C Amb28410324 [0,1,0,0,1,0|1,0,0]=3 5034 B7R0.16 CC(=O)[C@@H](O)[C@@H](C)O Amb24481484 [0,1,0,0,1,0|2,0,0]=4 5035 B7R0.16 CC(=O)[C@@H](O)[C@H](C)O Amb28045145 [0,1,0,0,1,0|2,0,0]=4 5036 B7R0.16 CC(=O)[C@H](C)C(C)C Amb24753185 [0,1,0,0,1,0|1,0,0]=3 5037 B7R0.16 CC(=O)[C@H](C)[C@H](C)O Amb28249967 [0,1,0,0,1,0|2,0,0]=4 5038 B7R0.16 CC(=O)[C@H](O)C(C)C Amb24379445 [0,1,0,0,1,0|1,0,0]=3 5039 B7R0.16 CC(=O)[C@H](O)[C@@H](C)O Amb24701454 [0,1,0,0,1,0|2,0,0]=4 5040 B7R0.16 CC(=S)C(S)C(=O)O Amb27791825 [0,1,0,0,1,0|1,0,1]=4 5041 B7R0.16 CC(Br)C(=O)C(=O)O Amb23400913 [0,1,0,0,1,0|1,0,1]=4 5042 B7R0.16 CC(Br)C(Br)C(=O)Cl Amb27482606 [0,1,0,0,1,0|2,0,0]=4 5043 B7R0.16 CC(Br)C(Br)C(=O)O Amb4008645 [0,1,0,0,1,0|1,0,0]=3 5044 B7R0.16 CC(C(=O)O)N(C)C Amb21955631 [0,1,0,0,1,0|1,0,0]=3 5045 B7R0.16 CC(C(=O)O)N(C)C Amb6653762 [0,1,0,0,1,0|1,0,0]=3 5046 B7R0.16 CC(C(=O)O)N(C)N Amb22372039 [0,1,0,0,1,0|2,0,0]=4 5047 B7R0.16 CC(C(=O)[O-])[C@H](C)O Amb27835918 [0,1,0,0,1,0|1,0,1]=4 5048 B7R0.16 CC(C)=C(Br)C(=O)O Amb17594579 [0,1,0,0,1,0|0,0,2]=4 5049 B7R0.16 CC(C)=C(C)C(=O)O Amb17593186 [0,1,0,0,1,0|0,0,2]=4 5050 B7R0.16 CC(C)=C(Cl)C(=O)O Amb18642954 [0,1,0,0,1,0|0,0,2]=4 5051 B7R0.16 CC(C)=C(F)C(=O)O Amb20669103 [0,1,0,0,1,0|0,0,2]=4 5052 B7R0.16 CC(C)C(=N)C(=O)O Amb28073845 [0,1,0,0,1,0|0,0,1]=3 5053 B7R0.16 CC(C)C(=O)C(=O)Cl Amb27843357 [0,1,0,0,1,0|1,0,1]=4 5054 B7R0.16 CC(C)C(=O)C(=O)O Amb6600000 [0,1,0,0,1,0|0,0,1]=3 5055 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8393075 [0,1,0,0,1,0|0,0,2]=4 5056 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8513875 [0,1,0,0,1,0|0,0,2]=4 5057 B7R0.16 CC(C)C(=O)C(N)=O Amb28119959 [0,1,0,0,1,0|1,0,1]=4 5058 B7R0.16 CC(C)C(Br)C(=N)N Amb28285546 [0,1,0,0,1,0|2,0,0]=4 5059 B7R0.16 CC(C)C(Br)C(=O)Cl Amb17569838 [0,1,0,0,1,0|1,0,0]=3 5060 B7R0.16 CC(C)C(Br)C(=O)O Amb9703217 [0,1,0,0,1,0|0,0,0]=2 5061 B7R0.16 CC(C)C(Br)C(N)=O Amb9725771 [0,1,0,0,1,0|1,0,0]=3 5062 B7R0.16 CC(C)C(C)C(=O)Cl Amb27645335 [0,1,0,0,1,0|1,0,0]=3 5063 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [0,1,0,0,1,0|0,0,0]=2 5064 B7R0.16 CC(C)C(C)C(C)O Amb24640694 [0,1,0,0,1,0|1,0,1]=4 5065 B7R0.16 CC(C)C(C)C(N)=S Amb28400471 [0,1,0,0,1,0|1,1,0]=4 5066 B7R0.16 CC(C)C(C)S(=O)Cl Amb32720503 [0,1,0,0,1,0|2,0,0]=4 5067 B7R0.16 CC(C)C(C)S(=O)[O-] Amb25685559 [0,1,0,0,1,0|1,0,1]=4 5068 B7R0.16 CC(C)C(C)S(N)=O Amb32720504 [0,1,0,0,1,0|2,0,0]=4 5069 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,1,0,0,1,0|1,0,0]=3 5070 B7R0.16 CC(C)C(Cl)C(=O)O Amb6739911 [0,1,0,0,1,0|0,0,0]=2 5071 B7R0.16 CC(C)C(F)C(=N)N Amb32456108 [0,1,0,0,1,0|2,0,0]=4 5072 B7R0.16 CC(C)C(F)C(=O)O Amb19957386 [0,1,0,0,1,0|0,0,0]=2 5073 B7R0.16 CC(C)C(N)B(O)O Amb24482349 [0,1,0,0,1,0|1,0,1]=4 5074 B7R0.16 CC(C)C(N)C(=O)Cl Amb6740265 [0,1,0,0,1,0|1,0,0]=3 5075 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [0,1,0,0,1,0|0,0,0]=2 5076 B7R0.16 CC(C)C(N)C(C)O Amb18641932 [0,1,0,0,1,0|1,0,1]=4 5077 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,1,0,0,1,0|1,0,0]=3 5078 B7R0.16 CC(C)C(N)C(N)=O Amb32666402 [0,1,0,0,1,0|1,0,0]=3 5079 B7R0.16 CC(C)C(N)C(N)=O Amb6271181 [0,1,0,0,1,0|1,0,0]=3 5080 B7R0.16 CC(C)C(N)C(N)=S Amb19148044 [0,1,0,0,1,0|1,1,0]=4 5081 B7R0.16 CC(C)C(O)C(=O)Cl Amb27213311 [0,1,0,0,1,0|1,0,0]=3 5082 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [0,1,0,0,1,0|0,0,0]=2 5083 B7R0.16 CC(C)C(O)C(C)O Amb27251557 [0,1,0,0,1,0|1,0,1]=4 5084 B7R0.16 CC(C)C(O)[PH](=O)O Amb27430184 [0,1,0,0,1,0|1,0,0]=3 5085 B7R0.16 CC(C)C(S)C(=O)O Amb18282761 [0,1,0,0,1,0|0,0,0]=2 5086 B7R0.16 CC(C)N(C)C(=O)Cl Amb25807313 [0,1,0,0,1,0|2,0,0]=4 5087 B7R0.16 CC(C)N(O)C(N)=O Amb18202545 [0,1,0,0,1,0|2,0,0]=4 5088 B7R0.16 CC(C)[C@@H](Br)C(=O)O Amb8629113 [0,1,0,0,1,0|0,0,0]=2 5089 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [0,1,0,0,1,0|0,0,0]=2 5090 B7R0.16 CC(C)[C@@H](C)C(N)=O Amb27838382 [0,1,0,0,1,0|1,0,0]=3 5091 B7R0.16 CC(C)[C@@H](C)[C@@H](C)O Amb27801928 [0,1,0,0,1,0|1,0,1]=4 5092 B7R0.16 CC(C)[C@@H](Cl)C(=O)Cl Amb32658177 [0,1,0,0,1,0|1,0,0]=3 5093 B7R0.16 CC(C)[C@@H](Cl)[C@@H](C)O Amb27433932 [0,1,0,0,1,0|1,0,1]=4 5094 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [0,1,0,0,1,0|0,0,0]=2 5095 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,1,0,0,1,0|1,0,0]=3 5096 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,1,0,0,1,0|1,0,0]=3 5097 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb4013551 [0,1,0,0,1,0|1,0,0]=3 5098 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [0,1,0,0,1,0|0,0,0]=2 5099 B7R0.16 CC(C)[C@@H](O)C(N)=O Amb27879443 [0,1,0,0,1,0|1,0,0]=3 5100 B7R0.16 CC(C)[C@H](Br)C(=O)O Amb8629114 [0,1,0,0,1,0|0,0,0]=2 5101 B7R0.16 CC(C)[C@H](C)B(O)O Amb27604530 [0,1,0,0,1,0|1,0,1]=4 5102 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [0,1,0,0,1,0|0,0,0]=2 5103 B7R0.16 CC(C)[C@H](C)C(N)=O Amb28345619 [0,1,0,0,1,0|1,0,0]=3 5104 B7R0.16 CC(C)[C@H](Cl)C(=O)Cl Amb27407011 [0,1,0,0,1,0|1,0,0]=3 5105 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [0,1,0,0,1,0|0,0,0]=2 5106 B7R0.16 CC(C)[C@H](N)C(C)O Amb35623965 [0,1,0,0,1,0|1,0,1]=4 5107 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16183986 [0,1,0,0,1,0|1,0,0]=3 5108 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16231400 [0,1,0,0,1,0|1,0,0]=3 5109 B7R0.16 CC(C)[C@H](N)C(N)=O Amb30595108 [0,1,0,0,1,0|1,0,0]=3 5110 B7R0.16 CC(C)[C@H](N)[C@H](C)O Amb27167748 [0,1,0,0,1,0|1,0,1]=4 5111 B7R0.16 CC(C)[C@H](N)[PH](=O)O Amb27814729 [0,1,0,0,1,0|1,0,0]=3 5112 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [0,1,0,0,1,0|0,0,0]=2 5113 B7R0.16 CC(Cl)C(C)C(=O)O Amb28325096 [0,1,0,0,1,0|1,0,0]=3 5114 B7R0.16 CC(Cl)C(Cl)C(=O)Cl Amb27634873 [0,1,0,0,1,0|2,0,0]=4 5115 B7R0.16 CC(Cl)C(Cl)C(=O)O Amb28396619 [0,1,0,0,1,0|1,0,0]=3 5116 B7R0.16 CC(F)C(=O)C(=O)O Amb27246511 [0,1,0,0,1,0|1,0,1]=4 5117 B7R0.16 CC(F)C(N)C(=O)O Amb10838661 [0,1,0,0,1,0|1,0,0]=3 5118 B7R0.16 CC(F)C(N)C(=O)O Amb32752736 [0,1,0,0,1,0|1,0,0]=3 5119 B7R0.16 CC(F)C(N)C(N)=O Amb28250824 [0,1,0,0,1,0|2,0,0]=4 5120 B7R0.16 CC(F)[C@@H](N)C(=O)O Amb28316197 [0,1,0,0,1,0|1,0,0]=3 5121 B7R0.16 CC(N)C(C)C(=O)O Amb18124261 [0,1,0,0,1,0|1,0,0]=3 5122 B7R0.16 CC(N)C(C)C(=O)O Amb28934866 [0,1,0,0,1,0|1,0,0]=3 5123 B7R0.16 CC(N)C(C)C(N)=O Amb27172764 [0,1,0,0,1,0|2,0,0]=4 5124 B7R0.16 CC(N)C(F)C(=O)O Amb27411861 [0,1,0,0,1,0|1,0,0]=3 5125 B7R0.16 CC(N)C(N)C(=O)O Amb22728051 [0,1,0,0,1,0|1,0,0]=3 5126 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [0,1,0,0,1,0|1,0,0]=3 5127 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [0,1,0,0,1,0|1,0,0]=3 5128 B7R0.16 CC(N)C(O)C(N)=O Amb27483181 [0,1,0,0,1,0|2,0,0]=4 5129 B7R0.16 CC(N)[C@H](N)C(=O)O Amb25083113 [0,1,0,0,1,0|1,0,0]=3 5130 B7R0.16 CC(N)[C@H](N)C(=O)O Amb33740158 [0,1,0,0,1,0|1,0,0]=3 5131 B7R0.16 CC(O)C(=O)C(=O)O Amb24481396 [0,1,0,0,1,0|1,0,1]=4 5132 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,1,0,0,1,0|1,0,0]=3 5133 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,1,0,0,1,0|1,0,0]=3 5134 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,1,0,0,1,0|1,0,0]=3 5135 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,1,0,0,1,0|1,0,0]=3 5136 B7R0.16 CC(O)C(N)C(=O)Cl Amb27830226 [0,1,0,0,1,0|2,0,0]=4 5137 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,1,0,0,1,0|1,0,0]=3 5138 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,1,0,0,1,0|1,0,0]=3 5139 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,1,0,0,1,0|2,0,0]=4 5140 B7R0.16 CC(O)C(N)C(N)=O Amb4006836 [0,1,0,0,1,0|2,0,0]=4 5141 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,1,0,0,1,0|1,0,0]=3 5142 B7R0.16 CC(O)[C@H](N)C(N)=O Amb27643319 [0,1,0,0,1,0|2,0,0]=4 5143 B7R0.16 CC(S)C(=O)C(=O)O Amb28128312 [0,1,0,0,1,0|1,0,1]=4 5144 B7R0.16 CC(S)C(N)C(=O)O Amb17593434 [0,1,0,0,1,0|1,0,0]=3 5145 B7R0.16 CC(S)[C@@H](N)C(=O)O Amb24606864 [0,1,0,0,1,0|1,0,0]=3 5146 B7R0.16 CN(C)C(=N)C(=O)O Amb18641880 [0,1,0,0,1,0|1,0,1]=4 5147 B7R0.16 CN(C)C(=O)C(=O)O Amb2691325 [0,1,0,0,1,0|1,0,1]=4 5148 B7R0.16 CN(C)C(O)C(=O)O Amb28399618 [0,1,0,0,1,0|1,0,0]=3 5149 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb22587534 [0,1,0,0,1,0|1,0,0]=3 5150 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb28934882 [0,1,0,0,1,0|1,0,0]=3 5151 B7R0.16 C[C@@H](Cl)[C@@H](Cl)C(=O)O Amb28343001 [0,1,0,0,1,0|1,0,0]=3 5152 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(=O)O Amb28283911 [0,1,0,0,1,0|1,0,0]=3 5153 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(N)=O Amb27607679 [0,1,0,0,1,0|2,0,0]=4 5154 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb28286576 [0,1,0,0,1,0|1,0,0]=3 5155 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb32668519 [0,1,0,0,1,0|1,0,0]=3 5156 B7R0.16 C[C@@H](N)[C@@H](C)C(=O)O Amb25679842 [0,1,0,0,1,0|1,0,0]=3 5157 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb22745441 [0,1,0,0,1,0|1,0,0]=3 5158 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb24481409 [0,1,0,0,1,0|1,0,0]=3 5159 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,1,0,0,1,0|1,0,0]=3 5160 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,1,0,0,1,0|1,0,0]=3 5161 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,1,0,0,1,0|1,0,0]=3 5162 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,1,0,0,1,0|1,0,0]=3 5163 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,1,0,0,1,0|1,0,0]=3 5164 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,1,0,0,1,0|1,0,0]=3 5165 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,1,0,0,1,0|1,0,0]=3 5166 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,1,0,0,1,0|1,0,0]=3 5167 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,1,0,0,1,0|2,0,0]=4 5168 B7R0.16 C[C@@H](S)[C@H](N)C(=O)O Amb24117242 [0,1,0,0,1,0|1,0,0]=3 5169 B7R0.16 C[C@H](C(=O)O)N(C)C Amb22586633 [0,1,0,0,1,0|1,0,0]=3 5170 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,1,0,0,1,0|1,0,0]=3 5171 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)Cl Amb28384464 [0,1,0,0,1,0|2,0,0]=4 5172 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)O Amb27955873 [0,1,0,0,1,0|1,0,0]=3 5173 B7R0.16 C[C@H](N)[C@@H](C)C(=O)O Amb26887656 [0,1,0,0,1,0|1,0,0]=3 5174 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [0,1,0,0,1,0|1,0,0]=3 5175 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb17678797 [0,1,0,0,1,0|1,0,0]=3 5176 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb26887696 [0,1,0,0,1,0|1,0,0]=3 5177 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,1,0,0,1,0|1,0,0]=3 5178 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,1,0,0,1,0|1,0,0]=3 5179 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,1,0,0,1,0|1,0,0]=3 5180 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,1,0,0,1,0|1,0,0]=3 5181 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,1,0,0,1,0|1,0,0]=3 5182 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,1,0,0,1,0|1,0,0]=3 5183 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,1,0,0,1,0|1,0,0]=3 5184 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,1,0,0,1,0|1,0,0]=3 5185 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,1,0,0,1,0|1,0,0]=3 5186 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,1,0,0,1,0|1,0,0]=3 5187 B7R0.16 C[PH](=O)C(O)C(=O)O Amb34916646 [0,1,0,0,1,0|2,0,0]=4 5188 B7R0.16 NC(C(=O)O)C(F)F Amb24713127 [0,1,0,0,1,0|2,0,0]=4 5189 B7R0.16 NC(C(=O)O)C(F)F Amb32644474 [0,1,0,0,1,0|2,0,0]=4 5190 B7R0.16 N[C@H](C(=O)O)C(O)O Amb27867398 [0,1,0,0,1,0|2,0,0]=4 5191 B7R0.16 O=C(O)C(F)C(Cl)Cl Amb4015382 [0,1,0,0,1,0|2,0,0]=4 5192 B7R0.16 O=C(O)C(F)C(F)F Amb27481077 [0,1,0,0,1,0|2,0,0]=4 5193 B7R0.16 O=C(O)C(O)C(Cl)Cl Amb27212773 [0,1,0,0,1,0|2,0,0]=4 5194 B7R0.16 O=C(O)C(O)C(F)F Amb25074883 [0,1,0,0,1,0|2,0,0]=4 5195 B9R0.1 C#CC(=O)CSCC(C)C Amb27468346 [0,1,0,0,0,1|1,0,0]=3 5196 B9R0.1 C#CC(=O)NCC[C@H](C)O Amb28049725 [0,1,0,0,0,1|2,0,0]=4 5197 B9R0.1 C#CC(=O)NOCC(C)C Amb27207762 [0,1,0,0,0,1|2,0,0]=4 5198 B9R0.1 C#CC(C)CCCC(=O)O Amb27273525 [0,1,0,0,0,1|0,0,1]=3 5199 B9R0.1 C#CC(C)CCCC(C)=O Amb26936323 [0,1,0,0,0,1|1,0,1]=4 5200 B9R0.1 C#CC(C)OCCC(=O)O Amb28041173 [0,1,0,0,0,1|0,0,1]=3 5201 B9R0.1 C#C\C(C)=C\CCC(=O)O Amb27461397 [0,1,0,0,0,1|0,0,2]=4 5202 B9R0.1 C=C(Br)CNCC(C)OC Amb28240774 [0,1,0,0,0,1|2,0,0]=4 5203 B9R0.1 C=C(Br)CSCC(C)CC Amb27457594 [0,1,0,0,0,1|2,0,0]=4 5204 B9R0.1 C=C(C)CCCC(=O)OC Amb25995990 [0,1,0,0,0,1|0,0,2]=4 5205 B9R0.1 C=C(C)CCCC(C)CCl Amb27761160 [0,1,0,0,0,1|2,0,0]=4 5206 B9R0.1 C=C(C)CCCC(C)CO Amb25888306 [0,1,0,0,0,1|2,0,0]=4 5207 B9R0.1 C=C(C)CCC[C@H](C)CO Amb28369841 [0,1,0,0,0,1|2,0,0]=4 5208 B9R0.1 C=C(C)CCNC(=O)OC Amb27247131 [0,1,0,0,0,1|0,0,2]=4 5209 B9R0.1 C=C(C)CCNC(C)CN Amb28069099 [0,1,0,0,0,1|2,0,0]=4 5210 B9R0.1 C=C(C)CCOC(=O)CO Amb27976305 [0,1,0,0,0,1|0,0,2]=4 5211 B9R0.1 C=C(C)CCSC(C)CO Amb27268746 [0,1,0,0,0,1|2,0,0]=4 5212 B9R0.1 C=C(CC)CNCC(=O)O Amb27661467 [0,1,0,0,0,1|0,0,2]=4 5213 B9R0.1 C=C(CC)CSCC(C)C Amb27756996 [0,1,0,0,0,1|2,0,0]=4 5214 B9R0.1 C=C(CO)CCC=C(C)C Amb27839217 [0,1,0,0,0,1|1,0,1]=4 5215 B9R0.1 C=C(CO)SCCC(C)C Amb27972273 [0,1,0,0,0,1|1,0,0]=3 5216 B9R0.1 C=C(CS)CSCC(C)C Amb28123804 [0,1,0,0,0,1|1,1,0]=4 5217 B9R0.1 C=C(Cl)CNCC(C)OC Amb28254492 [0,1,0,0,0,1|2,0,0]=4 5218 B9R0.1 C=C(Cl)CSCC(C)CO Amb27213614 [0,1,0,0,0,1|2,0,0]=4 5219 B9R0.1 C=CC(=O)CCCN(C)C Amb27234807 [0,1,0,0,0,1|2,0,0]=4 5220 B9R0.1 C=CC(=O)CCOC(C)C Amb27850742 [0,1,0,0,0,1|1,0,0]=3 5221 B9R0.1 C=CC(=O)NCCC(C)N Amb27617254 [0,1,0,0,0,1|2,0,0]=4 5222 B9R0.1 C=CC(=O)NCCC(C)O Amb27479091 [0,1,0,0,0,1|2,0,0]=4 5223 B9R0.1 C=CC(=O)NCCN(C)C Amb9480403 [0,1,0,0,0,1|2,0,0]=4 5224 B9R0.1 C=CC(=O)NCOC(C)C Amb28189895 [0,1,0,0,0,1|2,0,0]=4 5225 B9R0.1 C=CC(=O)OCCC(C)C Amb17933945 [0,1,0,0,0,1|1,0,0]=3 5226 B9R0.1 C=CC(C)CCCC(C)=O Amb27596967 [0,1,0,0,0,1|1,0,1]=4 5227 B9R0.1 C=CC(C)CCOC(C)=O Amb27249442 [0,1,0,0,0,1|1,0,1]=4 5228 B9R0.1 C=CC(C)COCC(=O)O Amb27831618 [0,1,0,0,0,1|0,0,1]=3 5229 B9R0.1 C=CC(C)OCCC(=O)O Amb27404617 [0,1,0,0,0,1|0,0,1]=3 5230 B9R0.1 C=CC(O)CCCC(C)C Amb27785702 [0,1,0,0,0,1|1,0,1]=4 5231 B9R0.1 C=C[C@@H](C)CCCC(C)=O Amb24379305 [0,1,0,0,0,1|1,0,1]=4 5232 B9R0.1 CC(=O)CCCC(=O)NO Amb27980256 [0,1,0,0,0,1|1,0,1]=4 5233 B9R0.1 CC(=O)CCCC(C)C#N Amb18124539 [0,1,0,0,0,1|1,0,1]=4 5234 B9R0.1 CC(=O)CCC[C@@H](C)CO Amb26391997 [0,1,0,0,0,1|1,0,0]=3 5235 B9R0.1 CC(=O)CCNC(C)CO Amb32675833 [0,1,0,0,0,1|1,0,0]=3 5236 B9R0.1 CC(=O)CSCC(O)CO Amb28049681 [0,1,0,0,0,1|2,0,0]=4 5237 B9R0.1 CC(=O)NCCC(C)CO Amb28203991 [0,1,0,0,0,1|1,0,0]=3 5238 B9R0.1 CC(=O)NCCC(N)CN Amb27838083 [0,1,0,0,0,1|2,0,0]=4 5239 B9R0.1 CC(=O)NCCC(O)CO Amb32645132 [0,1,0,0,0,1|2,0,0]=4 5240 B9R0.1 CC(=O)NCC[C@@H](N)CN Amb28073891 [0,1,0,0,0,1|2,0,0]=4 5241 B9R0.1 CC(=O)OCCC(C)C=O Amb28387659 [0,1,0,0,0,1|1,0,1]=4 5242 B9R0.1 CC(=O)OCCC(C)CBr Amb27866079 [0,1,0,0,0,1|1,0,0]=3 5243 B9R0.1 CC(=O)OCCC(O)CO Amb27171870 [0,1,0,0,0,1|2,0,0]=4 5244 B9R0.1 CC(=O)OCC[C@H](O)CO Amb27588999 [0,1,0,0,0,1|2,0,0]=4 5245 B9R0.1 CC(C#N)CCCC(=O)O Amb18643710 [0,1,0,0,0,1|0,0,1]=3 5246 B9R0.1 CC(C#N)CSCC(N)=O Amb28205326 [0,1,0,0,0,1|1,0,1]=4 5247 B9R0.1 CC(C#N)C\C=C\C(=O)O Amb24670837 [0,1,0,0,0,1|0,0,2]=4 5248 B9R0.1 CC(C)=CCCC(=O)CCl Amb27173844 [0,1,0,0,0,1|1,0,1]=4 5249 B9R0.1 CC(C)=CCCC(=O)CF Amb28249661 [0,1,0,0,0,1|1,0,1]=4 5250 B9R0.1 CC(C)=CCCC(C)CBr Amb24548827 [0,1,0,0,0,1|2,0,0]=4 5251 B9R0.1 CC(C)=CCCC(C)CCl Amb27810893 [0,1,0,0,0,1|2,0,0]=4 5252 B9R0.1 CC(C)=CCCC(C)CN Amb26571754 [0,1,0,0,0,1|2,0,0]=4 5253 B9R0.1 CC(C)=CCC[C@H](C)CO Amb27603484 [0,1,0,0,0,1|2,0,0]=4 5254 B9R0.1 CC(C)=CCC\C(C)=C\O Amb28050727 [0,1,0,0,0,1|1,0,1]=4 5255 B9R0.1 CC(C)CCCC(=O)CCl Amb32677818 [0,1,0,0,0,1|1,0,0]=3 5256 B9R0.1 CC(C)CCCC(=O)CN Amb28197069 [0,1,0,0,0,1|1,0,0]=3 5257 B9R0.1 CC(C)CCCC(=O)CO Amb26467261 [0,1,0,0,0,1|0,0,0]=2 5258 B9R0.1 CC(C)CCCC(=O)NN Amb28429070 [0,1,0,0,0,1|1,0,0]=3 5259 B9R0.1 CC(C)CCCC(C)CO Amb24082368 [0,1,0,0,0,1|1,0,1]=4 5260 B9R0.1 CC(C)CCCC(N)CO Amb27233021 [0,1,0,0,0,1|1,0,1]=4 5261 B9R0.1 CC(C)CCC[C@@H](C)CO Amb26336716 [0,1,0,0,0,1|1,0,1]=4 5262 B9R0.1 CC(C)CCC[C@H](C)CO Amb33730882 [0,1,0,0,0,1|1,0,1]=4 5263 B9R0.1 CC(C)CCNC(=O)CBr Amb17325046 [0,1,0,0,0,1|1,0,0]=3 5264 B9R0.1 CC(C)CCNC(=O)CCl Amb1643484 [0,1,0,0,0,1|1,0,0]=3 5265 B9R0.1 CC(C)CCNC(=O)CI Amb27839136 [0,1,0,0,0,1|1,0,0]=3 5266 B9R0.1 CC(C)CCNC(=O)CN Amb5783141 [0,1,0,0,0,1|1,0,0]=3 5267 B9R0.1 CC(C)CCNC(=O)CO Amb9421652 [0,1,0,0,0,1|0,0,0]=2 5268 B9R0.1 CC(C)CCNC(=O)NN Amb8853939 [0,1,0,0,0,1|1,0,0]=3 5269 B9R0.1 CC(C)CCNC(=S)NN Amb1152525 [0,1,0,0,0,1|1,1,0]=4 5270 B9R0.1 CC(C)CCOC(=O)C=O Amb27762562 [0,1,0,0,0,1|0,0,1]=3 5271 B9R0.1 CC(C)CCOC(=O)CN Amb17569860 [0,1,0,0,0,1|1,0,0]=3 5272 B9R0.1 CC(C)CCOC(=O)CO Amb27626229 [0,1,0,0,0,1|0,0,0]=2 5273 B9R0.1 CC(C)CCOC(=O)CS Amb22230770 [0,1,0,0,0,1|0,1,0]=3 5274 B9R0.1 CC(C)CCOC(C)CO Amb28050709 [0,1,0,0,0,1|1,0,1]=4 5275 B9R0.1 CC(C)CNCC(=O)CN Amb27781669 [0,1,0,0,0,1|1,0,0]=3 5276 B9R0.1 CC(C)CNCC(C)CO Amb28323127 [0,1,0,0,0,1|1,0,1]=4 5277 B9R0.1 CC(C)CNCC(O)CO Amb17308639 [0,1,0,0,0,1|0,0,2]=4 5278 B9R0.1 CC(C)CNC[C@@H](O)CO Amb33041847 [0,1,0,0,0,1|0,0,2]=4 5279 B9R0.1 CC(C)CNC[C@H](O)CO Amb27837587 [0,1,0,0,0,1|0,0,2]=4 5280 B9R0.1 CC(C)COCC(N)CO Amb27976629 [0,1,0,0,0,1|1,0,1]=4 5281 B9R0.1 CC(C)COCC(O)CBr Amb27945542 [0,1,0,0,0,1|1,0,1]=4 5282 B9R0.1 CC(C)COCC(O)CN Amb842783 [0,1,0,0,0,1|1,0,1]=4 5283 B9R0.1 CC(C)COCC(O)CO Amb9787114 [0,1,0,0,0,1|0,0,2]=4 5284 B9R0.1 CC(C)CONC(=O)CBr Amb27233116 [0,1,0,0,0,1|2,0,0]=4 5285 B9R0.1 CC(C)CSCC(=O)NN Amb28422592 [0,1,0,0,0,1|1,0,0]=3 5286 B9R0.1 CC(C)CSCC(N)CO Amb27799380 [0,1,0,0,0,1|1,0,1]=4 5287 B9R0.1 CC(C)CSC\C(N)=N\O Amb7764595 [0,1,0,0,0,1|1,0,0]=3 5288 B9R0.1 CC(C)NCCC(=O)NO Amb27948303 [0,1,0,0,0,1|0,0,0]=2 5289 B9R0.1 CC(C)NCC\C(N)=N/O Amb19981282 [0,1,0,0,0,1|1,0,0]=3 5290 B9R0.1 CC(C)OCCC(N)CO Amb24592118 [0,1,0,0,0,1|1,0,1]=4 5291 B9R0.1 CC(C)OCCC(O)CCl Amb27247605 [0,1,0,0,0,1|1,0,1]=4 5292 B9R0.1 CC(C)OCCC(O)CN Amb27839103 [0,1,0,0,0,1|1,0,1]=4 5293 B9R0.1 CC(C)OCCN(C)C=O Amb28315774 [0,1,0,0,0,1|2,0,0]=4 5294 B9R0.1 CC(C)OCC\C(N)=N\O Amb6265128 [0,1,0,0,0,1|1,0,0]=3 5295 B9R0.1 CC(C)PCCC(N)CO Amb27617153 [0,1,0,0,0,1|1,0,1]=4 5296 B9R0.1 CC(C)SCC\C(N)=N\O Amb18792441 [0,1,0,0,0,1|1,0,0]=3 5297 B9R0.1 CC(C=O)CCCC(=O)O Amb27173621 [0,1,0,0,0,1|0,0,1]=3 5298 B9R0.1 CC(C=O)CCOC(C)C Amb27833048 [0,1,0,0,0,1|1,0,1]=4 5299 B9R0.1 CC(CBr)CCCS(C)=O Amb27879970 [0,1,0,0,0,1|2,0,0]=4 5300 B9R0.1 CC(CN)CCCC(=O)O Amb27592530 [0,1,0,0,0,1|0,0,0]=2 5301 B9R0.1 CC(CN)CCCS(C)=O Amb27815622 [0,1,0,0,0,1|2,0,0]=4 5302 B9R0.1 CC(CN)CNC[C@H](C)O Amb28054468 [0,1,0,0,0,1|1,0,1]=4 5303 B9R0.1 CC(CN)CSCC(=O)O Amb27639745 [0,1,0,0,0,1|0,0,0]=2 5304 B9R0.1 CC(CN)OCCC(=O)O Amb18629690 [0,1,0,0,0,1|0,0,0]=2 5305 B9R0.1 CC(CN)OCCS(C)=O Amb27397178 [0,1,0,0,0,1|2,0,0]=4 5306 B9R0.1 CC(CN)SCCC(=O)O Amb27425055 [0,1,0,0,0,1|0,0,0]=2 5307 B9R0.1 CC(CO)CCOC(C)C Amb28434553 [0,1,0,0,0,1|1,0,1]=4 5308 B9R0.1 CC(CO)CNCC(=O)O Amb28246419 [0,1,0,0,0,1|0,0,0]=2 5309 B9R0.1 CC(CO)CNCC(N)=O Amb27463837 [0,1,0,0,0,1|1,0,0]=3 5310 B9R0.1 CC(CO)COCC(=O)O Amb28280816 [0,1,0,0,0,1|0,0,0]=2 5311 B9R0.1 CC(CO)CSCC(=N)N Amb27646125 [0,1,0,0,0,1|2,0,0]=4 5312 B9R0.1 CC(CO)CSCC(=O)O Amb28365901 [0,1,0,0,0,1|0,0,0]=2 5313 B9R0.1 CC(CO)CSCC(N)=O Amb27649504 [0,1,0,0,0,1|1,0,0]=3 5314 B9R0.1 CC(CO)NCCS(C)=O Amb28205542 [0,1,0,0,0,1|2,0,0]=4 5315 B9R0.1 CC(CO)N\C=C\C(=O)O Amb27776997 [0,1,0,0,0,1|0,0,2]=4 5316 B9R0.1 CC(N)CCCC(=O)NO Amb28122781 [0,1,0,0,0,1|1,0,0]=3 5317 B9R0.1 CC(N)CSCC(=O)NN Amb27221925 [0,1,0,0,0,1|2,0,0]=4 5318 B9R0.1 CC(O)CCCC(=O)NN Amb24352284 [0,1,0,0,0,1|2,0,0]=4 5319 B9R0.1 CC(O)CCNC(=O)CS Amb28120401 [0,1,0,0,0,1|1,1,0]=4 5320 B9R0.1 CC(O)CNC\C(N)=N\O Amb28368064 [0,1,0,0,0,1|2,0,0]=4 5321 B9R0.1 CC(O)CSCC(C)CO Amb27425054 [0,1,0,0,0,1|1,0,1]=4 5322 B9R0.1 CCC(=O)CCCC(C)C Amb9031663 [0,1,0,0,0,1|1,0,0]=3 5323 B9R0.1 CCC(=O)CCCN(C)C Amb27960845 [0,1,0,0,0,1|2,0,0]=4 5324 B9R0.1 CCC(=O)CCNC(C)C Amb28050476 [0,1,0,0,0,1|1,0,0]=3 5325 B9R0.1 CCC(=O)CSCC(C)C Amb18800475 [0,1,0,0,0,1|1,0,0]=3 5326 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,1,0,0,0,1|1,0,1]=4 5327 B9R0.1 CCC(=O)NOCC(C)C Amb27606898 [0,1,0,0,0,1|2,0,0]=4 5328 B9R0.1 CCC(=O)OCCC(=O)O Amb26597385 [0,1,0,0,0,1|1,0,1]=4 5329 B9R0.1 CCC(=O)OCCC(C)F Amb28293863 [0,1,0,0,0,1|2,0,0]=4 5330 B9R0.1 CCC(=O)SCCC(=O)O Amb27657281 [0,1,0,0,0,1|1,0,1]=4 5331 B9R0.1 CCC(=S)NCCC(C)C Amb27866037 [0,1,0,0,0,1|1,1,0]=4 5332 B9R0.1 CCC(C)CC#CC(=O)O Amb24661749 [0,1,0,0,0,1|0,0,1]=3 5333 B9R0.1 CCC(C)CCC=C(C)C Amb25076343 [0,1,0,0,0,1|2,0,0]=4 5334 B9R0.1 CCC(C)CCCC(=O)O Amb18124682 [0,1,0,0,0,1|0,0,0]=2 5335 B9R0.1 CCC(C)CCCC(C)=O Amb24424926 [0,1,0,0,0,1|1,0,0]=3 5336 B9R0.1 CCC(C)CCOC(C)=O Amb24325171 [0,1,0,0,0,1|1,0,0]=3 5337 B9R0.1 CCC(C)CNCC(N)=O Amb6718890 [0,1,0,0,0,1|1,0,0]=3 5338 B9R0.1 CCC(C)COCC(=O)O Amb28368866 [0,1,0,0,0,1|0,0,0]=2 5339 B9R0.1 CCC(C)CONC(N)=O Amb27448732 [0,1,0,0,0,1|2,0,0]=4 5340 B9R0.1 CCC(C)CSCC(C)=O Amb27590937 [0,1,0,0,0,1|1,0,0]=3 5341 B9R0.1 CCC(C)NCCC(C)=O Amb28321451 [0,1,0,0,0,1|1,0,0]=3 5342 B9R0.1 CCC(C)NCCC(N)=O Amb19960042 [0,1,0,0,0,1|1,0,0]=3 5343 B9R0.1 CCC(C)NCCC(N)=O Amb8841100 [0,1,0,0,0,1|1,0,0]=3 5344 B9R0.1 CCC(C)NOCC(N)=O Amb28383310 [0,1,0,0,0,1|2,0,0]=4 5345 B9R0.1 CCC(C)OCCC(=O)O Amb27947378 [0,1,0,0,0,1|0,0,0]=2 5346 B9R0.1 CCC(C)OCCC(C)=O Amb22229878 [0,1,0,0,0,1|1,0,0]=3 5347 B9R0.1 CCC(C)OCCC(N)=O Amb27412703 [0,1,0,0,0,1|1,0,0]=3 5348 B9R0.1 CCC(C)OCCC(N)=S Amb18180036 [0,1,0,0,0,1|1,1,0]=4 5349 B9R0.1 CCC(Cl)CCOC(C)=O Amb27984879 [0,1,0,0,0,1|2,0,0]=4 5350 B9R0.1 CCC(F)CSCC(C)=O Amb27804706 [0,1,0,0,0,1|2,0,0]=4 5351 B9R0.1 CCC(N)CCNC(N)=O Amb27842050 [0,1,0,0,0,1|2,0,0]=4 5352 B9R0.1 CCC(O)CC#CC(=O)O Amb27461426 [0,1,0,0,0,1|1,0,1]=4 5353 B9R0.1 CCC(O)CCCC(=O)O Amb18644263 [0,1,0,0,0,1|1,0,0]=3 5354 B9R0.1 CCC(O)CCNC(N)=O Amb27262212 [0,1,0,0,0,1|2,0,0]=4 5355 B9R0.1 CCC(O)CSCC(=O)O Amb18792573 [0,1,0,0,0,1|1,0,0]=3 5356 B9R0.1 CCC(O)CSCC(C)C Amb18792450 [0,1,0,0,0,1|1,0,1]=4 5357 B9R0.1 CCN(C)CCCC(C)=O Amb9659156 [0,1,0,0,0,1|2,0,0]=4 5358 B9R0.1 CCN(C)C\C=C\C(=O)O Amb19020698 [0,1,0,0,0,1|1,0,1]=4 5359 B9R0.1 CCN(O)CCCC(=O)O Amb27630754 [0,1,0,0,0,1|2,0,0]=4 5360 B9R0.1 CCS(=O)CCCC(C)C Amb27802443 [0,1,0,0,0,1|2,0,0]=4 5361 B9R0.1 CCS(=O)CCOC(C)C Amb27982644 [0,1,0,0,0,1|2,0,0]=4 5362 B9R0.1 CC[C@@H](O)CCCC(C)=O Amb27227255 [0,1,0,0,0,1|2,0,0]=4 5363 B9R0.1 CC[C@@H](O)CNCC(N)=O Amb27226499 [0,1,0,0,0,1|2,0,0]=4 5364 B9R0.1 CC[C@@H](O)CSCC(C)C Amb28381554 [0,1,0,0,0,1|1,0,1]=4 5365 B9R0.1 CC[C@@H](O)CSCC(N)=O Amb28202586 [0,1,0,0,0,1|2,0,0]=4 5366 B9R0.1 CC[C@H](C)CCCC(=O)O Amb28313011 [0,1,0,0,0,1|0,0,0]=2 5367 B9R0.1 CC[C@H](C)C\C=C/C(=O)O Amb27779551 [0,1,0,0,0,1|0,0,1]=3 5368 B9R0.1 CC\C(C)=C\CCC(=O)O Amb27474810 [0,1,0,0,0,1|0,0,1]=3 5369 B9R0.1 CC\C(C)=C\CCC(C)=O Amb2721172 [0,1,0,0,0,1|1,0,1]=4 5370 B9R0.1 CN(C#N)CCCC(=O)O Amb28281828 [0,1,0,0,0,1|1,0,1]=4 5371 B9R0.1 CN(C)CCC\C(N)=N\O Amb20668517 [0,1,0,0,0,1|2,0,0]=4 5372 B9R0.1 CN(C)CCC\C(N)=N\O Amb6270125 [0,1,0,0,0,1|2,0,0]=4 5373 B9R0.1 CN(C)CCNC(=O)CBr Amb17331884 [0,1,0,0,0,1|2,0,0]=4 5374 B9R0.1 CN(C)CCNC(=O)CCl Amb1137595 [0,1,0,0,0,1|2,0,0]=4 5375 B9R0.1 CN(C)CCNC(=O)CCl Amb13951935 [0,1,0,0,0,1|2,0,0]=4 5376 B9R0.1 CN(C)CCNC(=O)CN Amb5783037 [0,1,0,0,0,1|2,0,0]=4 5377 B9R0.1 CN(C)CCNC(=O)CO Amb5798178 [0,1,0,0,0,1|1,0,0]=3 5378 B9R0.1 CN(C)CCNC(=O)NN Amb18064496 [0,1,0,0,0,1|2,0,0]=4 5379 B9R0.1 CN(C)CCOC(=O)CO Amb33016861 [0,1,0,0,0,1|1,0,0]=3 5380 B9R0.1 CN(CCCC(=O)O)N=O Amb17618588 [0,1,0,0,0,1|2,0,0]=4 5381 B9R0.1 CNC(=N)NCCC(=O)O Amb26014274 [0,1,0,0,0,1|1,0,1]=4 5382 B9R0.1 CNC(=O)CCCC(C)N Amb27261578 [0,1,0,0,0,1|2,0,0]=4 5383 B9R0.1 CNC(=O)CCNN(C)C Amb27401745 [0,1,0,0,0,1|2,0,0]=4 5384 B9R0.1 CNC(=O)CNCC(=O)O Amb8943036 [0,1,0,0,0,1|1,0,1]=4 5385 B9R0.1 CNC(=O)CNC[C@@H](C)O Amb28188407 [0,1,0,0,0,1|2,0,0]=4 5386 B9R0.1 CNC(=O)COCC(=O)O Amb17232024 [0,1,0,0,0,1|1,0,1]=4 5387 B9R0.1 CNC(=O)CSCC(=O)O Amb6251930 [0,1,0,0,0,1|1,0,1]=4 5388 B9R0.1 CNC(=O)CSCC(C)C Amb27982678 [0,1,0,0,0,1|1,0,0]=3 5389 B9R0.1 CNC(=O)CSC[C@@H](C)N Amb27485191 [0,1,0,0,0,1|2,0,0]=4 5390 B9R0.1 CNC(=O)CSC[C@@H](C)O Amb27790534 [0,1,0,0,0,1|2,0,0]=4 5391 B9R0.1 CNC(=O)CSC[C@H](C)N Amb27591048 [0,1,0,0,0,1|2,0,0]=4 5392 B9R0.1 CNC(=O)NCCC(=O)O Amb1127025 [0,1,0,0,0,1|1,0,1]=4 5393 B9R0.1 CNC(=O)NCCC(C)O Amb27971912 [0,1,0,0,0,1|2,0,0]=4 5394 B9R0.1 CNC(C)CCC=C(C)C Amb17593577 [0,1,0,0,0,1|2,0,0]=4 5395 B9R0.1 CNC(C)CCNC(N)=O Amb28067069 [0,1,0,0,0,1|1,0,0]=3 5396 B9R0.1 COC(=N)CCOC(C)C Amb27613351 [0,1,0,0,0,1|1,0,0]=3 5397 B9R0.1 COC(=N)CSCC(C)C Amb27877661 [0,1,0,0,0,1|1,0,0]=3 5398 B9R0.1 COC(=O)C#CCC(C)C Amb25915710 [0,1,0,0,0,1|0,0,1]=3 5399 B9R0.1 COC(=O)C#CCN(C)C Amb33168812 [0,1,0,0,0,1|1,0,1]=4 5400 B9R0.1 COC(=O)CCCC(=O)O Amb2720900 [0,1,0,0,0,1|1,0,1]=4 5401 B9R0.1 COC(=O)CCCC(C)=O Amb17846860 [0,1,0,0,0,1|1,0,1]=4 5402 B9R0.1 COC(=O)CCCC(C)Br Amb24346809 [0,1,0,0,0,1|1,0,0]=3 5403 B9R0.1 COC(=O)CCCC(C)Cl Amb24626627 [0,1,0,0,0,1|1,0,0]=3 5404 B9R0.1 COC(=O)CCCC(C)N Amb27759913 [0,1,0,0,0,1|1,0,0]=3 5405 B9R0.1 COC(=O)CCCC(C)O Amb24414468 [0,1,0,0,0,1|1,0,0]=3 5406 B9R0.1 COC(=O)CCCS(C)=O Amb18788307 [0,1,0,0,0,1|2,0,0]=4 5407 B9R0.1 COC(=O)CCC[C@H](C)O Amb27839593 [0,1,0,0,0,1|1,0,0]=3 5408 B9R0.1 COC(=O)CCNC(C)=O Amb15691935 [0,1,0,0,0,1|1,0,1]=4 5409 B9R0.1 COC(=O)CCNC(C)C Amb9203616 [0,1,0,0,0,1|0,0,0]=2 5410 B9R0.1 COC(=O)CCNN(C)C Amb24113609 [0,1,0,0,0,1|1,0,0]=3 5411 B9R0.1 COC(=O)CCOC(C)=O Amb27972208 [0,1,0,0,0,1|1,0,1]=4 5412 B9R0.1 COC(=O)CCOC(C)C Amb9206383 [0,1,0,0,0,1|0,0,0]=2 5413 B9R0.1 COC(=O)CC\N=C(/C)N Amb27826068 [0,1,0,0,0,1|1,0,1]=4 5414 B9R0.1 COC(=O)CNCC(=O)O Amb7766422 [0,1,0,0,0,1|1,0,1]=4 5415 B9R0.1 COC(=O)CNCC(C)C Amb6686983 [0,1,0,0,0,1|0,0,0]=2 5416 B9R0.1 COC(=O)CNCC(C)O Amb9247006 [0,1,0,0,0,1|1,0,0]=3 5417 B9R0.1 COC(=O)CNCC(F)F Amb18179465 [0,1,0,0,0,1|2,0,0]=4 5418 B9R0.1 COC(=O)CNCC(F)F Amb33204438 [0,1,0,0,0,1|2,0,0]=4 5419 B9R0.1 COC(=O)CNCN(C)C Amb28041215 [0,1,0,0,0,1|1,0,0]=3 5420 B9R0.1 COC(=O)COCC(=O)O Amb25305044 [0,1,0,0,0,1|1,0,1]=4 5421 B9R0.1 COC(=O)COCC(C)=O Amb8392403 [0,1,0,0,0,1|1,0,1]=4 5422 B9R0.1 COC(=O)COCC(C)C Amb9206382 [0,1,0,0,0,1|0,0,0]=2 5423 B9R0.1 COC(=O)CSCC(=O)O Amb33532171 [0,1,0,0,0,1|1,0,1]=4 5424 B9R0.1 COC(=O)CSCC(C)=O Amb2444691 [0,1,0,0,0,1|1,0,1]=4 5425 B9R0.1 COC(=O)CSCC(C)C Amb839626 [0,1,0,0,0,1|0,0,0]=2 5426 B9R0.1 COC(=O)CSCC(C)N Amb27770371 [0,1,0,0,0,1|1,0,0]=3 5427 B9R0.1 COC(=O)CSCC(C)O Amb18792574 [0,1,0,0,0,1|1,0,0]=3 5428 B9R0.1 COC(=O)C\C=C\C(C)O Amb27756374 [0,1,0,0,0,1|1,0,1]=4 5429 B9R0.1 COC(=O)C\C=C\[C@@H](C)O Amb28321357 [0,1,0,0,0,1|1,0,1]=4 5430 B9R0.1 COC(=O)NCCC(=O)O Amb6468177 [0,1,0,0,0,1|1,0,1]=4 5431 B9R0.1 COC(=O)NCC[C@H](C)O Amb27663109 [0,1,0,0,0,1|1,0,0]=3 5432 B9R0.1 COC(=O)OCCC(C)=O Amb28049880 [0,1,0,0,0,1|1,0,1]=4 5433 B9R0.1 COC(=O)OCCC(C)C Amb27777595 [0,1,0,0,0,1|0,0,0]=2 5434 B9R0.1 COC(=O)\C=C/CC(C)C Amb10071548 [0,1,0,0,0,1|0,0,1]=3 5435 B9R0.1 COC(=O)\C=C\CC(C)C Amb2689517 [0,1,0,0,0,1|0,0,1]=3 5436 B9R0.1 COC(=O)\C=C\CC(C)C Amb33714772 [0,1,0,0,0,1|0,0,1]=3 5437 B9R0.1 COC(=O)\C=C\CN(C)C Amb17612878 [0,1,0,0,0,1|1,0,1]=4 5438 B9R0.1 COC(=O)\C=C\SC(C)C Amb27197412 [0,1,0,0,0,1|0,0,2]=4 5439 B9R0.1 COC(=S)SCCC(=O)O Amb27983821 [0,1,0,0,0,1|1,0,1]=4 5440 B9R0.1 COC(C)CCCC(C)O Amb27833630 [0,1,0,0,0,1|1,0,1]=4 5441 B9R0.1 COC(C)CCNC(=N)N Amb27260710 [0,1,0,0,0,1|2,0,0]=4 5442 B9R0.1 COC(C)CCNC(C)=O Amb27260083 [0,1,0,0,0,1|1,0,0]=3 5443 B9R0.1 COC(C)CCOC(C)=O Amb19958959 [0,1,0,0,0,1|1,0,0]=3 5444 B9R0.1 COC(C)CNCC(C)C Amb27872977 [0,1,0,0,0,1|1,0,1]=4 5445 B9R0.1 COC(C)COCC(C)O Amb22729718 [0,1,0,0,0,1|1,0,1]=4 5446 B9R0.1 COC(C)CONC(C)=O Amb27856871 [0,1,0,0,0,1|2,0,0]=4 5447 B9R0.1 COC(C)CSCC(C)C Amb28049301 [0,1,0,0,0,1|1,0,1]=4 5448 B9R0.1 COC(C)OCCC(C)=O Amb27267196 [0,1,0,0,0,1|1,0,0]=3 5449 B9R0.1 CON(C)CCCC(=O)O Amb28126925 [0,1,0,0,0,1|1,0,0]=3 5450 B9R0.1 CON(C)CCNC(C)=O Amb27822674 [0,1,0,0,0,1|2,0,0]=4 5451 B9R0.1 CSC(=N)NCCC(=O)O Amb28193743 [0,1,0,0,0,1|1,0,1]=4 5452 B9R0.1 CSC(C)CCNC(C)=O Amb27964419 [0,1,0,0,0,1|1,0,0]=3 5453 B9R0.1 CSC(C)CCOC(=O)Cl Amb28199680 [0,1,0,0,0,1|1,0,0]=3 5454 B9R0.1 CSC(C)\C=C/CC(=O)O Amb28121047 [0,1,0,0,0,1|0,0,1]=3 5455 B9R0.1 CSC(C)\C=C\CC(=O)O Amb18645413 [0,1,0,0,0,1|0,0,1]=3 5456 B9R0.1 C[C@@H](CF)NCCC(N)=O Amb28315929 [0,1,0,0,0,1|1,0,0]=3 5457 B9R0.1 C\C(=C\CCC(C)C)CN Amb28145079 [0,1,0,0,0,1|2,0,0]=4 5458 B9R0.1 C\C(C=O)=C/CCC(C)O Amb27598642 [0,1,0,0,0,1|2,0,0]=4 5459 B9R0.1 C\C(C=O)=C/COC(C)C Amb28398385 [0,1,0,0,0,1|1,0,1]=4 5460 B9R0.1 C\C(C=O)=C\CCC(C)O Amb27841297 [0,1,0,0,0,1|2,0,0]=4 5461 B9R0.1 C\C(C=O)=C\COC(C)C Amb28052700 [0,1,0,0,0,1|1,0,1]=4 5462 B9R0.1 C\C(CCCC(=O)O)=N/O Amb27779283 [0,1,0,0,0,1|1,0,1]=4 5463 B9R0.1 C\C(CCl)=N/OCC(=O)O Amb27831952 [0,1,0,0,0,1|1,0,1]=4 5464 B9R0.1 C\C(CF)=N/OCC(=O)O Amb27174879 [0,1,0,0,0,1|1,0,1]=4 5465 B9R0.1 C\C(CSCC(C)C)=N/N Amb27980210 [0,1,0,0,0,1|2,0,0]=4 5466 B9R0.1 N=C(CN)NCCC(=O)O Amb28346899 [0,1,0,0,0,1|1,0,1]=4 5467 B9R0.1 NC(=O)CCC[C@H](N)CS Amb28251296 [0,1,0,0,0,1|2,0,0]=4 5468 B9R0.1 NC(=O)CNCC(O)CF Amb27859350 [0,1,0,0,0,1|2,0,0]=4 5469 B9R0.1 NC(=O)CSCC(O)CF Amb27249405 [0,1,0,0,0,1|2,0,0]=4 5470 B9R0.1 NC(=O)CSCC(O)CO Amb27593990 [0,1,0,0,0,1|2,0,0]=4 5471 B9R0.1 NC(CO)CCCC(=O)O Amb25889148 [0,1,0,0,0,1|1,0,0]=3 5472 B9R0.1 NCC(=O)CCCC(=O)O Amb22035333 [0,1,0,0,0,1|1,0,1]=4 5473 B9R0.1 NCC(=O)CNCC(=O)O Amb27979091 [0,1,0,0,0,1|1,0,1]=4 5474 B9R0.1 NCC(=O)NCCC(=O)O Amb4018061 [0,1,0,0,0,1|1,0,1]=4 5475 B9R0.1 NC[C@@H](N)CCCC(=O)O Amb33756779 [0,1,0,0,0,1|1,0,0]=3 5476 B9R0.1 N[C@H](CO)CCCC(=O)O Amb27751891 [0,1,0,0,0,1|1,0,0]=3 5477 B9R0.1 O=C(O)CCCC(=O)CO Amb27493969 [0,1,0,0,0,1|1,0,1]=4 5478 B9R0.1 O=C(O)CCCC(Cl)CCl Amb18649051 [0,1,0,0,0,1|1,0,0]=3 5479 B9R0.1 O=C(O)CCNC(=O)CBr Amb17609911 [0,1,0,0,0,1|1,0,1]=4 5480 B9R0.1 O=C(O)CCNC(=O)CCl Amb2781692 [0,1,0,0,0,1|1,0,1]=4 5481 B9R0.1 O=C(O)CCNC(=O)CO Amb24478846 [0,1,0,0,0,1|1,0,1]=4 5482 B9R0.1 O=C(O)CSCC(O)CCl Amb27858669 [0,1,0,0,0,1|1,0,0]=3 5483 B9R0.7 C=C(Br)CNC(C)C(C)C Amb18303973 [0,1,0,0,0,1|2,0,0]=4 5484 B9R0.7 C=C(C)C(C)CCC(=O)O Amb27254117 [0,1,0,0,0,1|0,0,2]=4 5485 B9R0.7 C=C(C)C(Cl)CCC(C)C Amb27402118 [0,1,0,0,0,1|2,0,0]=4 5486 B9R0.7 C=C(C)C(N)CCC(=O)O Amb33199957 [0,1,0,0,0,1|0,0,2]=4 5487 B9R0.7 C=C(C)C(N)CSC(C)C Amb27828261 [0,1,0,0,0,1|2,0,0]=4 5488 B9R0.7 C=C(C)C(O)COC(C)C Amb28126844 [0,1,0,0,0,1|2,0,0]=4 5489 B9R0.7 C=C(C)CCC(=C)C(=O)O Amb28047421 [0,1,0,0,0,1|0,0,2]=4 5490 B9R0.7 C=C(C)CCC(=O)C(C)C Amb9031731 [0,1,0,0,0,1|2,0,0]=4 5491 B9R0.7 C=C(C)CCC(C)C(=O)O Amb25809141 [0,1,0,0,0,1|0,0,2]=4 5492 B9R0.7 C=C(C)CCC(N)C(=O)O Amb28121242 [0,1,0,0,0,1|0,0,2]=4 5493 B9R0.7 C=C(C)CCC(O)C(=O)O Amb27436256 [0,1,0,0,0,1|0,0,2]=4 5494 B9R0.7 C=C(C)CCC(O)C(C)C Amb27171665 [0,1,0,0,0,1|2,0,0]=4 5495 B9R0.7 C=C(C)CC[C@@H](N)C(=O)O Amb25775219 [0,1,0,0,0,1|0,0,2]=4 5496 B9R0.7 C=C(C)CC[C@H](N)C(=O)O Amb25948355 [0,1,0,0,0,1|0,0,2]=4 5497 B9R0.7 C=C(C)CSC(C)C(=O)O Amb6263518 [0,1,0,0,0,1|0,0,2]=4 5498 B9R0.7 C=C(CCC(=O)O)C(C)=O Amb27814984 [0,1,0,0,0,1|1,0,1]=4 5499 B9R0.7 C=C(CCC(=O)O)C(C)C Amb28050060 [0,1,0,0,0,1|0,0,0]=2 5500 B9R0.7 C=C(CCN(C)C)C(=O)O Amb28903893 [0,1,0,0,0,1|1,0,0]=3 5501 B9R0.7 C=C(CCN(C)C)C(=O)O Amb32667385 [0,1,0,0,0,1|1,0,0]=3 5502 B9R0.7 C=C(COC(C)C)C(=O)O Amb25958768 [0,1,0,0,0,1|0,0,1]=3 5503 B9R0.7 C=C(OCC(C)C)C(=O)Cl Amb27233166 [0,1,0,0,0,1|1,0,1]=4 5504 B9R0.7 CC(=N)N(C)CCC(=O)O Amb27242469 [0,1,0,0,0,1|1,0,1]=4 5505 B9R0.7 CC(=O)C#CC(O)C(C)C Amb27858338 [0,1,0,0,0,1|1,0,1]=4 5506 B9R0.7 CC(=O)C(=O)NCC(C)C Amb17399879 [0,1,0,0,0,1|1,0,1]=4 5507 B9R0.7 CC(=O)C(=O)OCC(C)C Amb28254557 [0,1,0,0,0,1|1,0,1]=4 5508 B9R0.7 CC(=O)C(Br)CC=C(C)C Amb27614912 [0,1,0,0,0,1|1,0,1]=4 5509 B9R0.7 CC(=O)C(C)CCC(=O)O Amb4020917 [0,1,0,0,0,1|1,0,1]=4 5510 B9R0.7 CC(=O)C(C)CCC(C)O Amb27823560 [0,1,0,0,0,1|2,0,0]=4 5511 B9R0.7 CC(=O)C(C)CCN(C)C Amb27470904 [0,1,0,0,0,1|2,0,0]=4 5512 B9R0.7 CC(=O)C(C)CNN(C)C Amb28049906 [0,1,0,0,0,1|2,0,0]=4 5513 B9R0.7 CC(=O)C(C)NCC(C)C Amb24480697 [0,1,0,0,0,1|1,0,0]=3 5514 B9R0.7 CC(=O)C(C)OCC(C)C Amb9665195 [0,1,0,0,0,1|1,0,0]=3 5515 B9R0.7 CC(=O)C(C)SCC(C)O Amb27651284 [0,1,0,0,0,1|2,0,0]=4 5516 B9R0.7 CC(=O)C(F)CC=C(C)C Amb27599420 [0,1,0,0,0,1|1,0,1]=4 5517 B9R0.7 CC(=O)C(F)CCC(=O)O Amb27620074 [0,1,0,0,0,1|1,0,1]=4 5518 B9R0.7 CC(=O)C(N)CCC(=O)O Amb27875288 [0,1,0,0,0,1|1,0,1]=4 5519 B9R0.7 CC(=O)C(O)CCC(=O)O Amb27826305 [0,1,0,0,0,1|1,0,1]=4 5520 B9R0.7 CC(=O)C(O)COC(C)C Amb28201134 [0,1,0,0,0,1|1,0,0]=3 5521 B9R0.7 CC(=O)CCC(=O)C(C)C Amb19515553 [0,1,0,0,0,1|1,0,0]=3 5522 B9R0.7 CC(=O)CCC(=O)N(C)C Amb17334213 [0,1,0,0,0,1|2,0,0]=4 5523 B9R0.7 CC(=O)CCC(C)=C(C)C Amb27799949 [0,1,0,0,0,1|1,0,1]=4 5524 B9R0.7 CC(=O)CCC(C)C(C)O Amb27838958 [0,1,0,0,0,1|2,0,0]=4 5525 B9R0.7 CC(=O)CCC(Cl)C(C)C Amb27974244 [0,1,0,0,0,1|1,0,0]=3 5526 B9R0.7 CC(=O)CCC(N)C(=O)O Amb20669473 [0,1,0,0,0,1|1,0,1]=4 5527 B9R0.7 CC(=O)CCC(N)C(=O)O Amb22157242 [0,1,0,0,0,1|1,0,1]=4 5528 B9R0.7 CC(=O)CCN(C)C(C)C Amb7777312 [0,1,0,0,0,1|1,0,0]=3 5529 B9R0.7 CC(=O)CC[C@@H](C)[C@@H](C)O Amb25984868 [0,1,0,0,0,1|2,0,0]=4 5530 B9R0.7 CC(=O)CC[C@@H](N)C(=O)O Amb26516732 [0,1,0,0,0,1|1,0,1]=4 5531 B9R0.7 CC(=O)CC[C@H](C)C(C)C Amb27860337 [0,1,0,0,0,1|1,0,0]=3 5532 B9R0.7 CC(=O)CC[C@H](C)[C@@H](C)O Amb22747043 [0,1,0,0,0,1|2,0,0]=4 5533 B9R0.7 CC(=O)CC[C@H](N)C(=O)O Amb25147501 [0,1,0,0,0,1|1,0,1]=4 5534 B9R0.7 CC(=O)CNS(=O)C(C)C Amb28194716 [0,1,0,0,0,1|2,0,0]=4 5535 B9R0.7 CC(=O)COC(=O)C(C)C Amb27198382 [0,1,0,0,0,1|1,0,1]=4 5536 B9R0.7 CC(=O)COC(C)C(C)C Amb27837849 [0,1,0,0,0,1|1,0,0]=3 5537 B9R0.7 CC(=O)CSC(C)C(=O)O Amb17501621 [0,1,0,0,0,1|1,0,1]=4 5538 B9R0.7 CC(=O)CSC(C)C(C)C Amb27166652 [0,1,0,0,0,1|1,0,0]=3 5539 B9R0.7 CC(=O)CSC(C)C(C)O Amb28344436 [0,1,0,0,0,1|2,0,0]=4 5540 B9R0.7 CC(=O)C\C=C(/C)C(C)C Amb24725292 [0,1,0,0,0,1|1,0,1]=4 5541 B9R0.7 CC(=O)C\C=C(\C)C(C)C Amb24408897 [0,1,0,0,0,1|1,0,1]=4 5542 B9R0.7 CC(=O)N(C)CCC(=O)O Amb2691290 [0,1,0,0,0,1|1,0,1]=4 5543 B9R0.7 CC(=O)N(C)CCC(C)Br Amb27393471 [0,1,0,0,0,1|2,0,0]=4 5544 B9R0.7 CC(=O)N(O)CCC(=O)O Amb28050128 [0,1,0,0,0,1|1,0,1]=4 5545 B9R0.7 CC(=O)NCC(N)C(=O)O Amb26046380 [0,1,0,0,0,1|1,0,1]=4 5546 B9R0.7 CC(=O)NC[C@H](C)C(=O)O Amb27472985 [0,1,0,0,0,1|1,0,1]=4 5547 B9R0.7 CC(=O)OCC(=O)C(C)C Amb24456861 [0,1,0,0,0,1|1,0,1]=4 5548 B9R0.7 CC(=O)OCC(C)C(=O)O Amb28050166 [0,1,0,0,0,1|1,0,1]=4 5549 B9R0.7 CC(=O)OCC(N)C(=O)O Amb17593668 [0,1,0,0,0,1|1,0,1]=4 5550 B9R0.7 CC(=O)OCC(N)C(C)C Amb27604557 [0,1,0,0,0,1|1,0,0]=3 5551 B9R0.7 CC(=O)OC[C@@H](N)C(=O)O Amb2699176 [0,1,0,0,0,1|1,0,1]=4 5552 B9R0.7 CC(=O)OC[C@@H]([NH3+])C(=O)O Amb3499386 [0,1,0,0,0,1|1,0,1]=4 5553 B9R0.7 CC(=O)OC[C@H](Br)C(C)C Amb28186618 [0,1,0,0,0,1|1,0,0]=3 5554 B9R0.7 CC(=O)OC[C@H](C)C(=O)O Amb28340504 [0,1,0,0,0,1|1,0,1]=4 5555 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb2778750 [0,1,0,0,0,1|1,0,1]=4 5556 B9R0.7 CC(=O)OC[C@H](N)C(=O)O Amb33757552 [0,1,0,0,0,1|1,0,1]=4 5557 B9R0.7 CC(=O)OC[C@H](N)C(C)C Amb28401299 [0,1,0,0,0,1|1,0,0]=3 5558 B9R0.7 CC(=O)SCC(=O)C(C)C Amb27858864 [0,1,0,0,0,1|1,0,1]=4 5559 B9R0.7 CC(=O)SCC(C)C(=O)O Amb2732386 [0,1,0,0,0,1|1,0,1]=4 5560 B9R0.7 CC(=O)SCC(N)C(=O)O Amb22490452 [0,1,0,0,0,1|1,0,1]=4 5561 B9R0.7 CC(=O)SCC(O)C(=O)O Amb31030973 [0,1,0,0,0,1|1,0,1]=4 5562 B9R0.7 CC(=O)SC[C@@H](C)C(=O)O Amb8628177 [0,1,0,0,0,1|1,0,1]=4 5563 B9R0.7 CC(=O)[C@H](C)CCC(=O)O Amb24671283 [0,1,0,0,0,1|1,0,1]=4 5564 B9R0.7 CC(=O)\C=C\[C@H](C)C(C)C Amb27859468 [0,1,0,0,0,1|1,0,1]=4 5565 B9R0.7 CC(Br)C(=O)NCC(=O)O Amb4015128 [0,1,0,0,0,1|1,0,1]=4 5566 B9R0.7 CC(Br)C(Br)\C=C\C(=O)O Amb22347457 [0,1,0,0,0,1|1,0,1]=4 5567 B9R0.7 CC(C#CC(=O)O)[C@@H](C)O Amb28423499 [0,1,0,0,0,1|1,0,1]=4 5568 B9R0.7 CC(C)=CCC(C)C(=O)O Amb18643879 [0,1,0,0,0,1|0,0,1]=3 5569 B9R0.7 CC(C)=CCC(N)C(=O)O Amb6276273 [0,1,0,0,0,1|0,0,1]=3 5570 B9R0.7 CC(C)=CCC(N)C(C)C Amb30029404 [0,1,0,0,0,1|2,0,0]=4 5571 B9R0.7 CC(C)=CCC(N)C(N)=O Amb24697159 [0,1,0,0,0,1|1,0,1]=4 5572 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O Amb27254062 [0,1,0,0,0,1|0,0,1]=3 5573 B9R0.7 CC(C)=CC[C@H](N)C(=O)O Amb25836895 [0,1,0,0,0,1|0,0,1]=3 5574 B9R0.7 CC(C)=NOC(C)C(=O)O Amb9814220 [0,1,0,0,0,1|1,0,1]=4 5575 B9R0.7 CC(C)=NO[C@H](C)C(=O)O Amb27831924 [0,1,0,0,0,1|1,0,1]=4 5576 B9R0.7 CC(C)C#CC(C)C(=O)O Amb27646536 [0,1,0,0,0,1|0,0,1]=3 5577 B9R0.7 CC(C)C(=N)NCC(=O)O Amb27162604 [0,1,0,0,0,1|0,0,1]=3 5578 B9R0.7 CC(C)C(=O)CNC(N)=O Amb27262218 [0,1,0,0,0,1|1,0,1]=4 5579 B9R0.7 CC(C)C(=O)NCC(=O)O Amb1112853 [0,1,0,0,0,1|0,0,1]=3 5580 B9R0.7 CC(C)C(=O)NCC(N)=O Amb17231981 [0,1,0,0,0,1|1,0,1]=4 5581 B9R0.7 CC(C)C(=O)\C=C\C(=O)O Amb25117573 [0,1,0,0,0,1|0,0,2]=4 5582 B9R0.7 CC(C)C(=S)SCC(=O)O Amb27878469 [0,1,0,0,0,1|0,0,1]=3 5583 B9R0.7 CC(C)C(C)CNC(=O)Cl Amb35633392 [0,1,0,0,0,1|1,0,0]=3 5584 B9R0.7 CC(C)C(C)COC(N)=O Amb27174302 [0,1,0,0,0,1|1,0,0]=3 5585 B9R0.7 CC(C)C(C)NC[C@@H](C)O Amb27620664 [0,1,0,0,0,1|1,0,1]=4 5586 B9R0.7 CC(C)C(C)OCC(N)=O Amb27837847 [0,1,0,0,0,1|1,0,0]=3 5587 B9R0.7 CC(C)C(C)OCC(N)=S Amb27800249 [0,1,0,0,0,1|1,1,0]=4 5588 B9R0.7 CC(C)C(N)C#CC(=O)O Amb27408416 [0,1,0,0,0,1|0,0,1]=3 5589 B9R0.7 CC(C)C(N)CC=C(Cl)Cl Amb29870142 [0,1,0,0,0,1|2,0,0]=4 5590 B9R0.7 CC(C)C(N)CCC(=O)O Amb18124745 [0,1,0,0,0,1|0,0,0]=2 5591 B9R0.7 CC(C)C(N)CCS(C)=O Amb27222830 [0,1,0,0,0,1|2,0,0]=4 5592 B9R0.7 CC(C)C(N)CNC(N)=O Amb27832804 [0,1,0,0,0,1|1,0,0]=3 5593 B9R0.7 CC(C)C(O)CCC(=O)O Amb25252592 [0,1,0,0,0,1|0,0,0]=2 5594 B9R0.7 CC(C)C(O)CC[C@@H](C)O Amb27213851 [0,1,0,0,0,1|1,0,1]=4 5595 B9R0.7 CC(C)CCC(=O)C(=O)O Amb26508699 [0,1,0,0,0,1|0,0,0]=2 5596 B9R0.7 CC(C)CCC(Br)C(=O)O Amb18131059 [0,1,0,0,0,1|0,0,0]=2 5597 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [0,1,0,0,0,1|0,0,0]=2 5598 B9R0.7 CC(C)CCC(C)C(C)O Amb25262988 [0,1,0,0,0,1|1,0,1]=4 5599 B9R0.7 CC(C)CCC(C)C(O)O Amb27431362 [0,1,0,0,0,1|0,0,2]=4 5600 B9R0.7 CC(C)CCC(F)C(=O)O Amb26612835 [0,1,0,0,0,1|0,0,0]=2 5601 B9R0.7 CC(C)CCC(N)C(=O)Cl Amb27396445 [0,1,0,0,0,1|1,0,0]=3 5602 B9R0.7 CC(C)CCC(N)C(=O)O Amb19269152 [0,1,0,0,0,1|0,0,0]=2 5603 B9R0.7 CC(C)CCC(N)C(=O)O Amb6269218 [0,1,0,0,0,1|0,0,0]=2 5604 B9R0.7 CC(C)CCC(N)C(N)=O Amb27424766 [0,1,0,0,0,1|1,0,0]=3 5605 B9R0.7 CC(C)CCC(O)C(=O)O Amb27788603 [0,1,0,0,0,1|0,0,0]=2 5606 B9R0.7 CC(C)CCN(C)C(=O)Cl Amb27617143 [0,1,0,0,0,1|1,0,0]=3 5607 B9R0.7 CC(C)CCN(C)C(N)=S Amb18792302 [0,1,0,0,0,1|1,1,0]=4 5608 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [0,1,0,0,0,1|0,0,0]=2 5609 B9R0.7 CC(C)CC[C@@H](Cl)C(=O)Cl Amb27164122 [0,1,0,0,0,1|1,0,0]=3 5610 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb19133196 [0,1,0,0,0,1|0,0,0]=2 5611 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb22899130 [0,1,0,0,0,1|0,0,0]=2 5612 B9R0.7 CC(C)CC[C@@H](O)C(=O)[O-] Amb27218868 [0,1,0,0,0,1|0,0,1]=3 5613 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [0,1,0,0,0,1|0,0,0]=2 5614 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb16183866 [0,1,0,0,0,1|0,0,0]=2 5615 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb33339290 [0,1,0,0,0,1|0,0,0]=2 5616 B9R0.7 CC(C)CC[C@H](N)[C@H](C)O Amb28119956 [0,1,0,0,0,1|1,0,1]=4 5617 B9R0.7 CC(C)CNC(=O)C(=O)O Amb2693956 [0,1,0,0,0,1|0,0,1]=3 5618 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [0,1,0,0,0,1|0,0,0]=2 5619 B9R0.7 CC(C)CNC(C)C(C)O Amb28348388 [0,1,0,0,0,1|1,0,1]=4 5620 B9R0.7 CC(C)CNC(C)C(N)=O Amb9203289 [0,1,0,0,0,1|1,0,0]=3 5621 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [0,1,0,0,0,1|0,0,0]=2 5622 B9R0.7 CC(C)COC(C)C(=O)O Amb6258223 [0,1,0,0,0,1|0,0,0]=2 5623 B9R0.7 CC(C)COC(C)C(C)O Amb27426578 [0,1,0,0,0,1|1,0,1]=4 5624 B9R0.7 CC(C)COC(C)C(N)=O Amb19960054 [0,1,0,0,0,1|1,0,0]=3 5625 B9R0.7 CC(C)COC(C)C(N)=S Amb18798043 [0,1,0,0,0,1|1,1,0]=4 5626 B9R0.7 CC(C)COC(F)C(=O)O Amb27825878 [0,1,0,0,0,1|0,0,0]=2 5627 B9R0.7 CC(C)CSC(C)C(=O)O Amb6270237 [0,1,0,0,0,1|0,0,0]=2 5628 B9R0.7 CC(C)C\C=C(/F)C(=O)O Amb18124770 [0,1,0,0,0,1|0,0,1]=3 5629 B9R0.7 CC(C)N(C)CCC(=N)N Amb6275560 [0,1,0,0,0,1|2,0,0]=4 5630 B9R0.7 CC(C)N(C)CCC(=O)O Amb6611753 [0,1,0,0,0,1|0,0,0]=2 5631 B9R0.7 CC(C)N(C)CCC(=O)O Amb8428206 [0,1,0,0,0,1|0,0,0]=2 5632 B9R0.7 CC(C)N(C)CCC(N)=S Amb6268403 [0,1,0,0,0,1|1,1,0]=4 5633 B9R0.7 CC(C)N(C)CC[C@@H](C)O Amb33321334 [0,1,0,0,0,1|1,0,1]=4 5634 B9R0.7 CC(C)N(C)CC[C@H](C)O Amb33321332 [0,1,0,0,0,1|1,0,1]=4 5635 B9R0.7 CC(C)N(C)\C=C\C(=O)O Amb27768790 [0,1,0,0,0,1|0,0,2]=4 5636 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [0,1,0,0,0,1|0,0,0]=2 5637 B9R0.7 CC(C)NCC(C)C(N)=O Amb8944544 [0,1,0,0,0,1|1,0,0]=3 5638 B9R0.7 CC(C)NCC(C)S(C)=O Amb27474158 [0,1,0,0,0,1|2,0,0]=4 5639 B9R0.7 CC(C)NCC(N)C(C)O Amb27449854 [0,1,0,0,0,1|1,0,1]=4 5640 B9R0.7 CC(C)NCC(N)C(N)=O Amb27812569 [0,1,0,0,0,1|1,0,0]=3 5641 B9R0.7 CC(C)OCC(=O)C(=O)O Amb27620494 [0,1,0,0,0,1|0,0,1]=3 5642 B9R0.7 CC(C)OCC(C)C(=O)O Amb26037515 [0,1,0,0,0,1|0,0,0]=2 5643 B9R0.7 CC(C)OCC(C)C(C)O Amb26872862 [0,1,0,0,0,1|1,0,1]=4 5644 B9R0.7 CC(C)OCC(Cl)C(=O)O Amb27770474 [0,1,0,0,0,1|0,0,0]=2 5645 B9R0.7 CC(C)OCC(N)C(=O)O Amb25956723 [0,1,0,0,0,1|0,0,0]=2 5646 B9R0.7 CC(C)OCC(N)C(=O)O Amb32665467 [0,1,0,0,0,1|0,0,0]=2 5647 B9R0.7 CC(C)OCC(N)C(N)=O Amb25104507 [0,1,0,0,0,1|1,0,0]=3 5648 B9R0.7 CC(C)OCC(O)C(=O)O Amb24583914 [0,1,0,0,0,1|0,0,0]=2 5649 B9R0.7 CC(C)OC[C@@H](N)C(=O)O Amb24479342 [0,1,0,0,0,1|0,0,0]=2 5650 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb26960408 [0,1,0,0,0,1|0,0,0]=2 5651 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb32664966 [0,1,0,0,0,1|0,0,0]=2 5652 B9R0.7 CC(C)OC[C@H](N)C(N)=O Amb27184033 [0,1,0,0,0,1|1,0,0]=3 5653 B9R0.7 CC(C)S(=O)\C=C\C(=O)O Amb27166984 [0,1,0,0,0,1|0,0,2]=4 5654 B9R0.7 CC(C)SCC(C)C(=N)N Amb18792298 [0,1,0,0,0,1|2,0,0]=4 5655 B9R0.7 CC(C)SCC(N)C(=O)O Amb6273927 [0,1,0,0,0,1|0,0,0]=2 5656 B9R0.7 CC(C)[C@@H](O)CCC(=O)O Amb28314215 [0,1,0,0,0,1|0,0,0]=2 5657 B9R0.7 CC(C)[C@@H](O)CC[C@@H](C)O Amb28455603 [0,1,0,0,0,1|1,0,1]=4 5658 B9R0.7 CC(C)[C@H](O)CC[C@@H](C)O Amb28079178 [0,1,0,0,0,1|1,0,1]=4 5659 B9R0.7 CC(CCC(=O)O)N(C)C Amb32654401 [0,1,0,0,0,1|1,0,0]=3 5660 B9R0.7 CC(CCC(=O)O)N(C)C Amb8010013 [0,1,0,0,0,1|1,0,0]=3 5661 B9R0.7 CC(CCC(F)F)C(=O)O Amb32672190 [0,1,0,0,0,1|2,0,0]=4 5662 B9R0.7 CC(CCN(C)C)C(=O)O Amb26502003 [0,1,0,0,0,1|1,0,0]=3 5663 B9R0.7 CC(CCN(C)C)C(=O)O Amb32675008 [0,1,0,0,0,1|1,0,0]=3 5664 B9R0.7 CC(CCS(C)=O)C(=O)O Amb27237254 [0,1,0,0,0,1|2,0,0]=4 5665 B9R0.7 CC(CNC(=O)Cl)N(C)C Amb35625817 [0,1,0,0,0,1|2,0,0]=4 5666 B9R0.7 CC(CNN(C)C)C(=O)O Amb27855116 [0,1,0,0,0,1|1,0,0]=3 5667 B9R0.7 CC(CSC(F)F)C(=O)O Amb24685869 [0,1,0,0,0,1|2,0,0]=4 5668 B9R0.7 CC(Cl)C(=O)CCC(=O)O Amb25362323 [0,1,0,0,0,1|1,0,0]=3 5669 B9R0.7 CC(Cl)C(=O)NCC(=O)O Amb8393827 [0,1,0,0,0,1|1,0,1]=4 5670 B9R0.7 CC(F)C(N)CCC(=O)O Amb27207659 [0,1,0,0,0,1|1,0,0]=3 5671 B9R0.7 CC(N)C(=O)NCC(=O)O Amb2778754 [0,1,0,0,0,1|1,0,1]=4 5672 B9R0.7 CC(N)C(O)CCC(=O)O Amb27881667 [0,1,0,0,0,1|1,0,0]=3 5673 B9R0.7 CC(N)CCC(O)C(=O)O Amb28436655 [0,1,0,0,0,1|1,0,0]=3 5674 B9R0.7 CC(N)CCN(C)C(N)=O Amb27643169 [0,1,0,0,0,1|2,0,0]=4 5675 B9R0.7 CC(NC[C@@H](C)O)C(=O)O Amb27617222 [0,1,0,0,0,1|1,0,0]=3 5676 B9R0.7 CC(NC[C@H](C)O)C(=O)O Amb27248684 [0,1,0,0,0,1|1,0,0]=3 5677 B9R0.7 CC(NC[C@H](C)O)C(N)=O Amb27596825 [0,1,0,0,0,1|2,0,0]=4 5678 B9R0.7 CC(O)C(=O)OCC(=O)O Amb27392962 [0,1,0,0,0,1|1,0,1]=4 5679 B9R0.7 CC(O)C(C)CCC(=O)O Amb27424805 [0,1,0,0,0,1|1,0,0]=3 5680 B9R0.7 CC(O)C(C)NCC(=O)O Amb27444950 [0,1,0,0,0,1|1,0,0]=3 5681 B9R0.7 CC(O)C(C)NCC(N)=O Amb27476355 [0,1,0,0,0,1|2,0,0]=4 5682 B9R0.7 CC(O)C(C)\C=C\C(=O)O Amb27759324 [0,1,0,0,0,1|1,0,1]=4 5683 B9R0.7 CC(O)C(O)CCC(N)=O Amb28146727 [0,1,0,0,0,1|2,0,0]=4 5684 B9R0.7 CC(O)CCC(=O)C(=O)O Amb27799217 [0,1,0,0,0,1|1,0,0]=3 5685 B9R0.7 CC(O)CCC(N)C(=O)O Amb26598749 [0,1,0,0,0,1|1,0,0]=3 5686 B9R0.7 CC(O)CCC(N)C(N)=O Amb33036759 [0,1,0,0,0,1|2,0,0]=4 5687 B9R0.7 CC(O)CCN(C)C(C)C Amb28313099 [0,1,0,0,0,1|1,0,1]=4 5688 B9R0.7 CC(O)CC[C@@H](N)C(=O)O Amb28126862 [0,1,0,0,0,1|1,0,0]=3 5689 B9R0.7 CC(O)CC[C@H](N)C(=O)O Amb26346481 [0,1,0,0,0,1|1,0,0]=3 5690 B9R0.7 CC(O)CNC(C)C(=O)O Amb18523859 [0,1,0,0,0,1|1,0,0]=3 5691 B9R0.7 CC(O)CNC(C)C(C)C Amb9359486 [0,1,0,0,0,1|1,0,1]=4 5692 B9R0.7 CC(O)CN[C@H](C)C(=O)O Amb28246243 [0,1,0,0,0,1|1,0,0]=3 5693 B9R0.7 CC(O)CO[C@@H](C)C(=O)O Amb27273395 [0,1,0,0,0,1|1,0,0]=3 5694 B9R0.7 CC(O)NC[C@H](N)C(=O)O Amb24575047 [0,1,0,0,0,1|1,0,0]=3 5695 B9R0.7 CC(O)OC[C@@H](N)C(=O)O Amb28348403 [0,1,0,0,0,1|1,0,0]=3 5696 B9R0.7 CC(O)\C=C\C(C)C(=O)O Amb28246267 [0,1,0,0,0,1|1,0,1]=4 5697 B9R0.7 CC(OCC(Cl)Cl)C(=O)O Amb27656855 [0,1,0,0,0,1|2,0,0]=4 5698 B9R0.7 CC(S)C(=O)NCC(=O)O Amb2777540 [0,1,0,0,0,1|1,0,1]=4 5699 B9R0.7 CN(C)C(=O)CCC(=O)Cl Amb27273505 [0,1,0,0,0,1|2,0,0]=4 5700 B9R0.7 CN(C)C(=O)CCC(=O)O Amb1135807 [0,1,0,0,0,1|1,0,0]=3 5701 B9R0.7 CN(C)C(=O)CCC(N)=O Amb17334218 [0,1,0,0,0,1|2,0,0]=4 5702 B9R0.7 CN(C)C(=O)NCC(=O)O Amb9304726 [0,1,0,0,0,1|1,0,1]=4 5703 B9R0.7 CN(C)C(=O)SCC(=O)O Amb28199270 [0,1,0,0,0,1|1,0,1]=4 5704 B9R0.7 CN(C)C(=S)NCC(=O)O Amb25708504 [0,1,0,0,0,1|1,0,1]=4 5705 B9R0.7 CN(C)C(=S)SCC(=O)O Amb3986957 [0,1,0,0,0,1|1,0,1]=4 5706 B9R0.7 CN(C)CCC(=O)C(=O)O Amb33272647 [0,1,0,0,0,1|1,0,0]=3 5707 B9R0.7 CN(C)CCC(F)C(=O)O Amb27959150 [0,1,0,0,0,1|1,0,0]=3 5708 B9R0.7 CN(C)CCC(N)C(=O)O Amb32661000 [0,1,0,0,0,1|1,0,0]=3 5709 B9R0.7 CN(C)CCC(N)C(=O)O Amb6259376 [0,1,0,0,0,1|1,0,0]=3 5710 B9R0.7 CN(C)CCC(N)C(N)=O Amb19036813 [0,1,0,0,0,1|2,0,0]=4 5711 B9R0.7 CN(C)CCC(O)C(=O)O Amb26847402 [0,1,0,0,0,1|1,0,0]=3 5712 B9R0.7 CN(C)CCN(C)C(=O)Cl Amb26649650 [0,1,0,0,0,1|2,0,0]=4 5713 B9R0.7 CN(C)CC[C@@H](N)C(=O)O Amb26453522 [0,1,0,0,0,1|1,0,0]=3 5714 B9R0.7 CN(C)CC[C@H](N)C(=O)O Amb25108550 [0,1,0,0,0,1|1,0,0]=3 5715 B9R0.7 CN(C)CC[C@H](N)C(N)=O Amb28364893 [0,1,0,0,0,1|2,0,0]=4 5716 B9R0.7 CN(C)NCC(N)C(=O)O Amb28045970 [0,1,0,0,0,1|1,0,0]=3 5717 B9R0.7 CN(O)C(=O)CCC(=O)O Amb27460547 [0,1,0,0,0,1|2,0,0]=4 5718 B9R0.7 CN(O)CC[C@H](N)C(=O)O Amb27640254 [0,1,0,0,0,1|2,0,0]=4 5719 B9R0.7 CS(=N)CCC(N)C(=O)O Amb25243030 [0,1,0,0,0,1|2,0,0]=4 5720 B9R0.7 CS(=O)CCC(N)C(=O)O Amb6336322 [0,1,0,0,0,1|2,0,0]=4 5721 B9R0.7 CS(=O)CCC(O)C(=O)O Amb28118981 [0,1,0,0,0,1|2,0,0]=4 5722 B9R0.7 CS(=O)CC[C@@H](N)C(=O)O Amb19133021 [0,1,0,0,0,1|2,0,0]=4 5723 B9R0.7 CS(=O)CC[C@H](N)C(=O)O Amb6600089 [0,1,0,0,0,1|2,0,0]=4 5724 B9R0.7 CS(=O)NCC(N)C(=O)O Amb28122995 [0,1,0,0,0,1|2,0,0]=4 5725 B9R0.7 C[C@@H](Br)C(=O)NCC(=O)O Amb27169385 [0,1,0,0,0,1|1,0,1]=4 5726 B9R0.7 C[C@@H](F)[C@@H](N)CCC(=O)O Amb27604296 [0,1,0,0,0,1|1,0,0]=3 5727 B9R0.7 C[C@@H](F)[C@H](O)CCC(=O)O Amb28256347 [0,1,0,0,0,1|1,0,0]=3 5728 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb22756673 [0,1,0,0,0,1|1,0,1]=4 5729 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb30867950 [0,1,0,0,0,1|1,0,1]=4 5730 B9R0.7 C[C@@H](N)CC[C@@H](O)C(=O)O Amb27815031 [0,1,0,0,0,1|1,0,0]=3 5731 B9R0.7 C[C@@H](N)CN[C@H](C)C(=O)O Amb27646700 [0,1,0,0,0,1|1,0,0]=3 5732 B9R0.7 C[C@@H](N)[C@@H](O)CCC(=O)O Amb27655533 [0,1,0,0,0,1|1,0,0]=3 5733 B9R0.7 C[C@@H](NCC(F)F)C(=O)O Amb27440930 [0,1,0,0,0,1|2,0,0]=4 5734 B9R0.7 C[C@@H](O)[C@@H](O)\C=C\C(=O)O Amb28067737 [0,1,0,0,0,1|1,0,1]=4 5735 B9R0.7 C[C@@H](O)[C@H](C)C#CC(=O)O Amb27831855 [0,1,0,0,0,1|1,0,1]=4 5736 B9R0.7 C[C@@H](O)[C@H](O)CCC(=O)O Amb27628876 [0,1,0,0,0,1|1,0,0]=3 5737 B9R0.7 C[C@H](Br)[C@H](O)\C=C\C(=O)O Amb27751397 [0,1,0,0,0,1|1,0,1]=4 5738 B9R0.7 C[C@H](Cl)C(=O)NCC(=O)O Amb27776749 [0,1,0,0,0,1|1,0,1]=4 5739 B9R0.7 C[C@H](F)[C@H](O)CCC(=O)O Amb28126864 [0,1,0,0,0,1|1,0,0]=3 5740 B9R0.7 C[C@H](N)C(=O)NCC(=O)O Amb4035944 [0,1,0,0,0,1|1,0,1]=4 5741 B9R0.7 C[C@H](N)CN[C@H](C)C(=O)O Amb27445282 [0,1,0,0,0,1|1,0,0]=3 5742 B9R0.7 C[C@H](O)[C@@H](C)\C=C\C(=O)O Amb28239463 [0,1,0,0,0,1|1,0,1]=4 5743 B9R0.7 C[C@H](O)[C@H](N)CCC(=O)O Amb27217393 [0,1,0,0,0,1|1,0,0]=3 5744 B9R0.7 C[C@H](O)\C=C\[C@@H](C)C(=O)O Amb27617100 [0,1,0,0,0,1|1,0,1]=4 5745 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006595 [0,1,0,0,0,1|1,0,0]=3 5746 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4006626 [0,1,0,0,0,1|1,0,0]=3 5747 B9R0.7 C[S+](C)CCC(N)C(=O)O Amb4007490 [0,1,0,0,0,1|1,0,0]=3 5748 B9R0.7 C[S+](C)CCC(O)C(=O)O Amb33482959 [0,1,0,0,0,1|1,0,0]=3 5749 B9R0.7 C[S+](C)CCC(O)C(=O)[O-] Amb28069582 [0,1,0,0,0,1|1,0,1]=4 5750 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb35781977 [0,1,0,0,0,1|1,0,0]=3 5751 B9R0.7 C[S+](C)CC[C@@H](N)C(=O)O Amb6336613 [0,1,0,0,0,1|1,0,0]=3 5752 B9R0.7 C[S+](C)CC[C@H](N)C(=O)O Amb10601599 [0,1,0,0,0,1|1,0,0]=3 5753 B9R0.7 C[SH](C)CC[C@H](N)C(=O)O Amb24440849 [0,1,0,0,0,1|1,0,0]=3 5754 B9R0.7 C\C(=C/CC(=O)O)C(C)C Amb25866328 [0,1,0,0,0,1|0,0,1]=3 5755 B9R0.7 C\C(=C/CC(C)C)C(=O)O Amb27815070 [0,1,0,0,0,1|0,0,1]=3 5756 B9R0.7 C\C(=C/C[C@@H](C)O)C(=O)O Amb27254118 [0,1,0,0,0,1|1,0,1]=4 5757 B9R0.7 C\C(=C\CC(C)C)C(=O)O Amb27203321 [0,1,0,0,0,1|0,0,1]=3 5758 B9R0.7 C\C(=N/CC(C)C)C(=O)O Amb27426682 [0,1,0,0,0,1|0,0,1]=3 5759 B9R0.7 C\C(=N/NC(C)C)C(=O)O Amb27881746 [0,1,0,0,0,1|1,0,1]=4 5760 B9R0.7 C\C(Cl)=C/CC(Cl)C(=O)O Amb27212547 [0,1,0,0,0,1|1,0,1]=4 5761 B9R0.7 C\C(Cl)=C\CC(Cl)C(=O)O Amb17594711 [0,1,0,0,0,1|1,0,1]=4 5762 B9R0.7 C\C(F)=C/C[C@H](N)C(=O)O Amb27205690 [0,1,0,0,0,1|1,0,1]=4 5763 B9R0.7 NC(CCC(=O)O)C(F)F Amb19148415 [0,1,0,0,0,1|2,0,0]=4 5764 B9R0.7 NC(COC(F)F)C(=O)O Amb27849786 [0,1,0,0,0,1|2,0,0]=4 5765 B9R0.7 N[C@H](COC(F)F)C(=O)O Amb27637675 [0,1,0,0,0,1|2,0,0]=4 5766 B9R0.7 N[C@H](CSC(F)F)C(=O)O Amb28290955 [0,1,0,0,0,1|2,0,0]=4 5767 B9R0.7 O=C(O)C(F)OCC(F)F Amb27233933 [0,1,0,0,0,1|2,0,0]=4 5768 B9R0.7 O=C(O)CCC(=O)C(Cl)Cl Amb28343114 [0,1,0,0,0,1|2,0,0]=4 5769 B9R0.7 O=C(O)CCC(=O)C(O)O Amb28429041 [0,1,0,0,0,1|2,0,0]=4 5770 B9R0.53 C=C(C)CC(C)CC(C)C Amb27391628 [0,1,0,0,0,1|2,0,0]=4 5771 B9R0.53 C=C(C)CC(N)CC(=O)O Amb32687894 [0,1,0,0,0,1|0,0,2]=4 5772 B9R0.53 C=C(C)C[C@@H](O)CC(C)C Amb28050778 [0,1,0,0,0,1|2,0,0]=4 5773 B9R0.53 C=C(CC(=O)O)CC(C)C Amb18643897 [0,1,0,0,0,1|0,0,0]=2 5774 B9R0.53 CC(=N)NC(C)CC(C)C Amb27613701 [0,1,0,0,0,1|2,0,0]=4 5775 B9R0.53 CC(=O)CC(=O)CC(C)C Amb8516702 [0,1,0,0,0,1|1,0,0]=3 5776 B9R0.53 CC(=O)CC(=O)OC(C)C Amb6608870 [0,1,0,0,0,1|1,0,1]=4 5777 B9R0.53 CC(=O)CC(C)CC(C)C Amb20621119 [0,1,0,0,0,1|1,0,0]=3 5778 B9R0.53 CC(=O)CC(C)CN(C)C Amb28252208 [0,1,0,0,0,1|2,0,0]=4 5779 B9R0.53 CC(=O)CC(O)CC(C)O Amb28202187 [0,1,0,0,0,1|2,0,0]=4 5780 B9R0.53 CC(=O)C[C@@H](C)CC(=O)O Amb27881969 [0,1,0,0,0,1|1,0,1]=4 5781 B9R0.53 CC(=O)C[C@@H](O)CC(C)C Amb27471828 [0,1,0,0,0,1|1,0,0]=3 5782 B9R0.53 CC(=O)C[C@H](O)C[C@@H](C)O Amb27973069 [0,1,0,0,0,1|2,0,0]=4 5783 B9R0.53 CC(=O)NC(C)CC(=O)O Amb9007551 [0,1,0,0,0,1|1,0,1]=4 5784 B9R0.53 CC(=O)NC(C)CC(C)Br Amb28255391 [0,1,0,0,0,1|2,0,0]=4 5785 B9R0.53 CC(=O)NC(C)CC(C)Cl Amb27851051 [0,1,0,0,0,1|2,0,0]=4 5786 B9R0.53 CC(=O)NC(C)OC(C)C Amb22729317 [0,1,0,0,0,1|2,0,0]=4 5787 B9R0.53 CC(=O)N[C@@H](C)CC(=O)O Amb2372568 [0,1,0,0,0,1|1,0,1]=4 5788 B9R0.53 CC(=O)N[C@H](C)CN(C)C Amb27198150 [0,1,0,0,0,1|2,0,0]=4 5789 B9R0.53 CC(=O)OC(C)CC(C)Br Amb27257886 [0,1,0,0,0,1|2,0,0]=4 5790 B9R0.53 CC(=O)OC(C)CC(C)C Amb22733405 [0,1,0,0,0,1|1,0,0]=3 5791 B9R0.53 CC(=O)OC(C)CC(C)Cl Amb28119662 [0,1,0,0,0,1|2,0,0]=4 5792 B9R0.53 CC(=O)OC(C)CN(C)C Amb4020548 [0,1,0,0,0,1|2,0,0]=4 5793 B9R0.53 CC(=O)O[C@@H](C)CC(=O)O Amb28340506 [0,1,0,0,0,1|1,0,1]=4 5794 B9R0.53 CC(=O)O[C@H](C)C[C@@H](C)Cl Amb27945614 [0,1,0,0,0,1|2,0,0]=4 5795 B9R0.53 CC(=O)O[C@H](C)C[C@H](C)Cl Amb27433810 [0,1,0,0,0,1|2,0,0]=4 5796 B9R0.53 CC(=O)SC(C)CC(=O)O Amb4014288 [0,1,0,0,0,1|1,0,1]=4 5797 B9R0.53 CC(=O)\C=C(/C)CC(C)C Amb28063284 [0,1,0,0,0,1|1,0,1]=4 5798 B9R0.53 CC(=O)\C=C(/O)CC(C)C Amb28288330 [0,1,0,0,0,1|1,0,1]=4 5799 B9R0.53 CC(C)=CC(N)CC(N)=O Amb25805588 [0,1,0,0,0,1|1,0,1]=4 5800 B9R0.53 CC(C)CC(=N)CC(N)=O Amb27827487 [0,1,0,0,0,1|1,0,0]=3 5801 B9R0.53 CC(C)CC(Br)NC(N)=O Amb27635818 [0,1,0,0,0,1|1,0,0]=3 5802 B9R0.53 CC(C)CC(C)CC(=O)O Amb6749218 [0,1,0,0,0,1|0,0,0]=2 5803 B9R0.53 CC(C)CC(C)CC(C)O Amb33546273 [0,1,0,0,0,1|1,0,1]=4 5804 B9R0.53 CC(C)CC(C)NC(=O)Cl Amb35625633 [0,1,0,0,0,1|1,0,0]=3 5805 B9R0.53 CC(C)CC(C)OC(=O)Cl Amb33531475 [0,1,0,0,0,1|1,0,0]=3 5806 B9R0.53 CC(C)CC(C)SC(=N)N Amb27602440 [0,1,0,0,0,1|2,0,0]=4 5807 B9R0.53 CC(C)CC(Cl)OC(=O)Cl Amb27618475 [0,1,0,0,0,1|1,0,0]=3 5808 B9R0.53 CC(C)CC(N)CC(=O)O Amb2438867 [0,1,0,0,0,1|0,0,0]=2 5809 B9R0.53 CC(C)CC(N)CC(N)=O Amb25785407 [0,1,0,0,0,1|1,0,0]=3 5810 B9R0.53 CC(C)CC(O)CC(=O)O Amb17232005 [0,1,0,0,0,1|0,0,0]=2 5811 B9R0.53 CC(C)CN(C)CC(=N)N Amb8899951 [0,1,0,0,0,1|2,0,0]=4 5812 B9R0.53 CC(C)CN(C)CC(=O)O Amb8900040 [0,1,0,0,0,1|0,0,0]=2 5813 B9R0.53 CC(C)CN(C)CC(C)O Amb17334256 [0,1,0,0,0,1|1,0,1]=4 5814 B9R0.53 CC(C)CN(C)CC(N)=O Amb28204122 [0,1,0,0,0,1|1,0,0]=3 5815 B9R0.53 CC(C)CN(C)CC(N)=S Amb8899887 [0,1,0,0,0,1|1,1,0]=4 5816 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631385 [0,1,0,0,0,1|0,0,0]=2 5817 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631386 [0,1,0,0,0,1|0,0,0]=2 5818 B9R0.53 CC(C)C[C@@H](O)CC(=O)O Amb28050162 [0,1,0,0,0,1|0,0,0]=2 5819 B9R0.53 CC(C)C[C@@H](O)C[C@H](C)O Amb27594620 [0,1,0,0,0,1|1,0,1]=4 5820 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb16184017 [0,1,0,0,0,1|0,0,0]=2 5821 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb19944305 [0,1,0,0,0,1|0,0,0]=2 5822 B9R0.53 CC(C)C[C@H](N)CC(N)=O Amb28120875 [0,1,0,0,0,1|1,0,0]=3 5823 B9R0.53 CC(C)C[C@H](O)CC(=O)O Amb24505145 [0,1,0,0,0,1|0,0,0]=2 5824 B9R0.53 CC(C)NC(=O)CC(=O)O Amb17399889 [0,1,0,0,0,1|0,0,1]=3 5825 B9R0.53 CC(C)NC(=O)CC(N)=O Amb28050038 [0,1,0,0,0,1|1,0,1]=4 5826 B9R0.53 CC(C)NC(C)CC(=O)O Amb9398367 [0,1,0,0,0,1|0,0,0]=2 5827 B9R0.53 CC(C)NC(C)CC(N)=O Amb17231987 [0,1,0,0,0,1|1,0,0]=3 5828 B9R0.53 CC(C)NC(C)CS(C)=O Amb28434480 [0,1,0,0,0,1|2,0,0]=4 5829 B9R0.53 CC(C)OC(=O)CC(=O)O Amb25887628 [0,1,0,0,0,1|0,0,1]=3 5830 B9R0.53 CC(C)OC(=O)CC(N)=O Amb27765049 [0,1,0,0,0,1|1,0,1]=4 5831 B9R0.53 CC(CC(=O)O)CN(C)C Amb27948144 [0,1,0,0,0,1|1,0,0]=3 5832 B9R0.53 CC(CC(=O)O)CN(C)C Amb32680754 [0,1,0,0,0,1|1,0,0]=3 5833 B9R0.53 CC(CC(=O)O)NN(C)C Amb28317947 [0,1,0,0,0,1|1,0,0]=3 5834 B9R0.53 CC(CN(C)C)NC(=O)Cl Amb35625559 [0,1,0,0,0,1|2,0,0]=4 5835 B9R0.53 CC(CN(C)C)OC(N)=O Amb28383868 [0,1,0,0,0,1|2,0,0]=4 5836 B9R0.53 CC(Cl)CC(Cl)CC(=O)O Amb28436914 [0,1,0,0,0,1|1,0,0]=3 5837 B9R0.53 CC(O)CC(C)NC(N)=O Amb27227923 [0,1,0,0,0,1|2,0,0]=4 5838 B9R0.53 CN(C)CC(O)CC(=O)O Amb4477325 [0,1,0,0,0,1|1,0,0]=3 5839 B9R0.53 CN(C)CC(O)OS(=O)O Amb27972568 [0,1,0,0,0,1|2,0,0]=4 5840 B9R0.53 CN(C)C[C@H](O)CC(=O)O Amb10069803 [0,1,0,0,0,1|1,0,0]=3 5841 B9R0.53 CN(C)NC(=O)CC(=O)O Amb20246800 [0,1,0,0,0,1|1,0,1]=4 5842 B9R0.53 CS(=O)C[C@H](N)CC(=O)O Amb27776743 [0,1,0,0,0,1|2,0,0]=4 5843 B9R0.53 C[C@@H](O)CN(C)CC(N)=O Amb27979416 [0,1,0,0,0,1|2,0,0]=4 5844 B9R0.53 C[C@H](CN(C)C)OC(N)=O Amb27475764 [0,1,0,0,0,1|2,0,0]=4 5845 B9R0.53 C\C(=C\C(=O)O)CC(C)C Amb26947874 [0,1,0,0,0,1|0,0,1]=3 5846 B9R0.53 C\C(=C\C(C)C)CC(=O)O Amb27784871 [0,1,0,0,0,1|0,0,1]=3 5847 B9R0.56 C=C(Br)CCCC(C)(C)C Amb27860453 [0,1,0,0,0,1|2,0,0]=4 5848 B9R0.56 C=C(Br)CNCC(C)(C)C Amb19010383 [0,1,0,0,0,1|2,0,0]=4 5849 B9R0.56 C=C(Br)COCC(C)(C)N Amb27614367 [0,1,0,0,0,1|2,0,0]=4 5850 B9R0.56 C=C(C)CCCC(C)(C)C Amb26001485 [0,1,0,0,0,1|2,0,0]=4 5851 B9R0.56 C=C(C)CCCC(C)(C)O Amb22353103 [0,1,0,0,0,1|2,0,0]=4 5852 B9R0.56 C=C(C)CCSC(C)(C)C Amb27811470 [0,1,0,0,0,1|2,0,0]=4 5853 B9R0.56 C=C(C)CNCC(C)(C)C Amb27765012 [0,1,0,0,0,1|2,0,0]=4 5854 B9R0.56 C=C(C)COCC(C)(C)N Amb18630818 [0,1,0,0,0,1|2,0,0]=4 5855 B9R0.56 C=C(C)CSCC(C)(C)O Amb27800955 [0,1,0,0,0,1|2,0,0]=4 5856 B9R0.56 C=C(Cl)CCCC(C)(C)C Amb28120618 [0,1,0,0,0,1|2,0,0]=4 5857 B9R0.56 C=C(Cl)CNCC(C)(C)C Amb18305401 [0,1,0,0,0,1|2,0,0]=4 5858 B9R0.56 C=C(Cl)CSCC(C)(C)N Amb27875972 [0,1,0,0,0,1|2,0,0]=4 5859 B9R0.56 CC(=N)NCCC(C)(C)C Amb27765040 [0,1,0,0,0,1|2,0,0]=4 5860 B9R0.56 CC(=N)NCCC(C)(C)F Amb29872536 [0,1,0,0,0,1|2,0,0]=4 5861 B9R0.56 CC(=O)C#CCC(C)(C)O Amb27626465 [0,1,0,0,0,1|1,0,1]=4 5862 B9R0.56 CC(=O)CC#CC(C)(C)C Amb28241583 [0,1,0,0,0,1|1,0,1]=4 5863 B9R0.56 CC(=O)CCCC(C)(C)C Amb27466157 [0,1,0,0,0,1|1,0,0]=3 5864 B9R0.56 CC(=O)CCCC(C)(C)O Amb17593627 [0,1,0,0,0,1|1,0,0]=3 5865 B9R0.56 CC(=O)CCC[Si](C)(C)C Amb25879079 [0,1,0,0,0,1|1,1,0]=4 5866 B9R0.56 CC(=O)CCNC(C)(C)C Amb24478983 [0,1,0,0,0,1|1,0,0]=3 5867 B9R0.56 CC(=O)CCOC(C)(C)C Amb7793019 [0,1,0,0,0,1|1,0,0]=3 5868 B9R0.56 CC(=O)COCC(C)(C)N Amb18106342 [0,1,0,0,0,1|1,0,0]=3 5869 B9R0.56 CC(=O)NCCC(C)(C)N Amb35720691 [0,1,0,0,0,1|1,0,0]=3 5870 B9R0.56 CC(=O)NCC[Si](C)(C)C Amb27985894 [0,1,0,0,0,1|1,1,0]=4 5871 B9R0.56 CC(=O)OCCC(C)(C)O Amb28454807 [0,1,0,0,0,1|1,0,0]=3 5872 B9R0.56 CC(=O)OCCC(C)(C)S Amb27969153 [0,1,0,0,0,1|1,0,0]=3 5873 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb3940923 [0,1,0,0,0,1|2,0,0]=4 5874 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb8514749 [0,1,0,0,0,1|2,0,0]=4 5875 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb8516476 [0,1,0,0,0,1|2,0,0]=4 5876 B9R0.56 CC(=O)OCC[N+](C)(C)[O-] Amb28400650 [0,1,0,0,0,1|2,0,0]=4 5877 B9R0.56 CC(=O)OCC[Si](C)(C)C Amb27155978 [0,1,0,0,0,1|1,1,0]=4 5878 B9R0.56 CC(=O)OCC[Si](C)(C)Cl Amb19893511 [0,1,0,0,0,1|1,1,0]=4 5879 B9R0.56 CC(=O)SCC[N+](C)(C)C Amb3429518 [0,1,0,0,0,1|2,0,0]=4 5880 B9R0.56 CC(=O)SCC[Si](C)(C)C Amb27666582 [0,1,0,0,0,1|1,1,0]=4 5881 B9R0.56 CC(=O)\C=C\CC(C)(C)C Amb33473937 [0,1,0,0,0,1|1,0,1]=4 5882 B9R0.56 CC(C)(C)C=C=CC(=O)O Amb17593545 [0,1,0,0,0,1|0,0,2]=4 5883 B9R0.56 CC(C)(C)CC#CC(=O)O Amb25342948 [0,1,0,0,0,1|0,0,1]=3 5884 B9R0.56 CC(C)(C)CCCC(=O)O Amb18307485 [0,1,0,0,0,1|0,0,0]=2 5885 B9R0.56 CC(C)(C)CCCC(N)=O Amb25268901 [0,1,0,0,0,1|1,0,0]=3 5886 B9R0.56 CC(C)(C)CCCS(=O)Cl Amb32720706 [0,1,0,0,0,1|2,0,0]=4 5887 B9R0.56 CC(C)(C)CCCS(=O)[O-] Amb32754908 [0,1,0,0,0,1|1,0,1]=4 5888 B9R0.56 CC(C)(C)CCCS(N)=O Amb32720707 [0,1,0,0,0,1|2,0,0]=4 5889 B9R0.56 CC(C)(C)CCC[N+](=O)[O-] Amb33362527 [0,1,0,0,0,1|1,0,1]=4 5890 B9R0.56 CC(C)(C)CCNC(=O)Cl Amb35625532 [0,1,0,0,0,1|1,0,0]=3 5891 B9R0.56 CC(C)(C)CCNC(N)=S Amb27242410 [0,1,0,0,0,1|1,1,0]=4 5892 B9R0.56 CC(C)(C)CCOC(N)=O Amb24575181 [0,1,0,0,0,1|1,0,0]=3 5893 B9R0.56 CC(C)(C)CNCC(=O)O Amb19012829 [0,1,0,0,0,1|0,0,0]=2 5894 B9R0.56 CC(C)(C)CNCC(=O)O Amb28555432 [0,1,0,0,0,1|0,0,0]=2 5895 B9R0.56 CC(C)(C)COCC(=O)Cl Amb21964966 [0,1,0,0,0,1|1,0,0]=3 5896 B9R0.56 CC(C)(C)COCC(=O)O Amb25079059 [0,1,0,0,0,1|0,0,0]=2 5897 B9R0.56 CC(C)(C)CSCC(=O)O Amb28050005 [0,1,0,0,0,1|0,0,0]=2 5898 B9R0.56 CC(C)(C)C\C=C\C(N)=O Amb27843454 [0,1,0,0,0,1|1,0,1]=4 5899 B9R0.56 CC(C)(C)NCCC(=O)O Amb1106324 [0,1,0,0,0,1|0,0,0]=2 5900 B9R0.56 CC(C)(C)NCCC(=O)O Amb528113 [0,1,0,0,0,1|0,0,0]=2 5901 B9R0.56 CC(C)(C)NCCC(N)=O Amb8842940 [0,1,0,0,0,1|1,0,0]=3 5902 B9R0.56 CC(C)(C)OCCC(=N)N Amb7792495 [0,1,0,0,0,1|2,0,0]=4 5903 B9R0.56 CC(C)(C)OCCC(=O)O Amb2691288 [0,1,0,0,0,1|0,0,0]=2 5904 B9R0.56 CC(C)(C)OCCC(N)=O Amb28398446 [0,1,0,0,0,1|1,0,0]=3 5905 B9R0.56 CC(C)(C)OCCC(N)=S Amb7792162 [0,1,0,0,0,1|1,1,0]=4 5906 B9R0.56 CC(C)(C)OCCS(=O)Cl Amb32720513 [0,1,0,0,0,1|2,0,0]=4 5907 B9R0.56 CC(C)(C)OCCS(=O)[O-] Amb32754353 [0,1,0,0,0,1|1,0,1]=4 5908 B9R0.56 CC(C)(C)OCCS(N)=O Amb32720514 [0,1,0,0,0,1|2,0,0]=4 5909 B9R0.56 CC(C)(C)OCC[N+](=O)[O-] Amb27244108 [0,1,0,0,0,1|1,0,1]=4 5910 B9R0.56 CC(C)(C)SCCC(=O)O Amb6680208 [0,1,0,0,0,1|0,0,0]=2 5911 B9R0.56 CC(C)(C)\C=C\CC(=O)O Amb24608675 [0,1,0,0,0,1|0,0,1]=3 5912 B9R0.56 CC(C)(F)CCCC(=O)O Amb25270576 [0,1,0,0,0,1|0,0,0]=2 5913 B9R0.56 CC(C)(F)CCNC(=N)N Amb35611701 [0,1,0,0,0,1|2,0,0]=4 5914 B9R0.56 CC(C)(F)CCNC(=O)Cl Amb35636875 [0,1,0,0,0,1|1,0,0]=3 5915 B9R0.56 CC(C)(F)CCNC(N)=O Amb35655516 [0,1,0,0,0,1|1,0,0]=3 5916 B9R0.56 CC(C)(F)CCNC(N)=S Amb35655513 [0,1,0,0,0,1|1,1,0]=4 5917 B9R0.56 CC(C)(N)CC#CC(=O)O Amb33168977 [0,1,0,0,0,1|0,0,1]=3 5918 B9R0.56 CC(C)(N)CNCC(N)=O Amb28321690 [0,1,0,0,0,1|1,0,0]=3 5919 B9R0.56 CC(C)(N)COCC(=O)O Amb18630788 [0,1,0,0,0,1|0,0,0]=2 5920 B9R0.56 CC(C)(O)CCCC(=O)O Amb24340189 [0,1,0,0,0,1|0,0,0]=2 5921 B9R0.56 CC(C)(O)CCCC(=O)[O-] Amb32653027 [0,1,0,0,0,1|0,0,1]=3 5922 B9R0.56 CC(C)(O)CSCC(=O)O Amb18307056 [0,1,0,0,0,1|0,0,0]=2 5923 B9R0.56 CC(C)(O)CSCC(N)=O Amb27763121 [0,1,0,0,0,1|1,0,0]=3 5924 B9R0.56 CC(C)(O)C\C=C\C(=O)O Amb18644104 [0,1,0,0,0,1|0,0,1]=3 5925 B9R0.56 CC(C)=CCCC(C)(C)C Amb35582948 [0,1,0,0,0,1|2,0,0]=4 5926 B9R0.56 CC(C)=CCCC(C)(C)N Amb35738438 [0,1,0,0,0,1|2,0,0]=4 5927 B9R0.56 CC(C)CCCC(C)(N)O Amb27768620 [0,1,0,0,0,1|1,0,1]=4 5928 B9R0.56 CC(C)CCCS(=O)(=O)Cl Amb24478902 [0,1,0,0,0,1|1,0,1]=4 5929 B9R0.56 CC(C)CCCS(=O)(=O)F Amb32717696 [0,1,0,0,0,1|1,0,1]=4 5930 B9R0.56 CC(C)CCCS(N)(=O)=O Amb24479274 [0,1,0,0,0,1|1,0,1]=4 5931 B9R0.56 CC(C)CCNS(=O)(=O)Cl Amb17193922 [0,1,0,0,0,1|1,0,1]=4 5932 B9R0.56 CC(C)CCNS(C)(=O)=O Amb1777719 [0,1,0,0,0,1|1,0,1]=4 5933 B9R0.56 CC(C)CCOS(N)(=O)=O Amb33054406 [0,1,0,0,0,1|1,0,1]=4 5934 B9R0.56 CC(C)CNCC(C)(C)O Amb17138403 [0,1,0,0,0,1|1,0,1]=4 5935 B9R0.56 CC(C)CNCS(=O)(=O)O Amb27426840 [0,1,0,0,0,1|1,0,0]=3 5936 B9R0.56 CC(C)NCCP(=O)(O)O Amb27490847 [0,1,0,0,0,1|1,0,0]=3 5937 B9R0.56 CC(C)NCCS(=O)(=O)F Amb33463760 [0,1,0,0,0,1|1,0,1]=4 5938 B9R0.56 CC(C)NCCS(C)(=O)=O Amb18800964 [0,1,0,0,0,1|1,0,1]=4 5939 B9R0.56 CC(C)OCCC(C)(C)O Amb33274506 [0,1,0,0,0,1|1,0,1]=4 5940 B9R0.56 CC(C)OCCS(=O)(=O)Cl Amb18307388 [0,1,0,0,0,1|1,0,1]=4 5941 B9R0.56 CC(C)OCCS(=O)(=O)F Amb32717070 [0,1,0,0,0,1|1,0,1]=4 5942 B9R0.56 CC(C)OCCS(N)(=O)=O Amb18792944 [0,1,0,0,0,1|1,0,1]=4 5943 B9R0.56 CC(F)(F)CCCC(=O)O Amb17593778 [0,1,0,0,0,1|1,0,0]=3 5944 B9R0.56 CC(F)(F)CCNC(=O)Cl Amb35636877 [0,1,0,0,0,1|2,0,0]=4 5945 B9R0.56 CC(N)CCCP(=O)(O)O Amb27232848 [0,1,0,0,0,1|2,0,0]=4 5946 B9R0.56 CC(O)CCCC(C)(C)C Amb27205826 [0,1,0,0,0,1|1,0,1]=4 5947 B9R0.56 CC(O)CCOC(C)(C)C Amb25683681 [0,1,0,0,0,1|1,0,1]=4 5948 B9R0.56 CC(O)CCOP(=O)(O)O Amb27617038 [0,1,0,0,0,1|2,0,0]=4 5949 B9R0.56 CC(O)CNCC(C)(C)C Amb19012828 [0,1,0,0,0,1|1,0,1]=4 5950 B9R0.56 CC(O)COCC(C)(C)N Amb28347818 [0,1,0,0,0,1|1,0,1]=4 5951 B9R0.56 CN(C)(C)CCOC(N)=O Amb10241337 [0,1,0,0,0,1|2,0,0]=4 5952 B9R0.56 CN(C)CCOP(=O)(O)O Amb28341982 [0,1,0,0,0,1|2,0,0]=4 5953 B9R0.56 CN(C)CCOS(=O)(=O)O Amb19988267 [0,1,0,0,0,1|2,0,0]=4 5954 B9R0.56 CN(O)CCOC(C)(C)C Amb33326255 [0,1,0,0,0,1|2,0,0]=4 5955 B9R0.56 CP(=O)(O)CCCC(=O)O Amb24524573 [0,1,0,0,0,1|2,0,0]=4 5956 B9R0.56 CP(C)(=O)CNCC(=O)O Amb25339632 [0,1,0,0,0,1|1,0,0]=3 5957 B9R0.56 CS(=O)(=O)CCCC(=O)O Amb17503668 [0,1,0,0,0,1|2,0,0]=4 5958 B9R0.56 CS(=O)(=O)NCCC(=O)O Amb33536611 [0,1,0,0,0,1|2,0,0]=4 5959 B9R0.56 CS(=O)(=O)SCCC(=O)O Amb10071647 [0,1,0,0,0,1|2,0,0]=4 5960 B9R0.56 C[C@@H](O)CCCC(C)(C)C Amb33380506 [0,1,0,0,0,1|1,0,1]=4 5961 B9R0.56 C[C@@H](O)CCCC(C)(C)O Amb27979592 [0,1,0,0,0,1|1,0,1]=4 5962 B9R0.56 C[C@@H](O)CCOC(C)(C)C Amb33326186 [0,1,0,0,0,1|1,0,1]=4 5963 B9R0.56 C[C@H](O)CCCC(C)(C)C Amb33380507 [0,1,0,0,0,1|1,0,1]=4 5964 B9R0.56 C[C@H](O)CCOC(C)(C)C Amb33326191 [0,1,0,0,0,1|1,0,1]=4 5965 B9R0.56 C[C@H](O)CNCC(C)(C)N Amb27192760 [0,1,0,0,0,1|1,0,1]=4 5966 B9R0.56 C[N+](C)(C)CCCC(=O)O Amb9825976 [0,1,0,0,0,1|1,0,0]=3 5967 B9R0.56 C[N+](C)(C)CCCC(=O)[O-] Amb25961797 [0,1,0,0,0,1|1,0,1]=4 5968 B9R0.56 C[N+](C)(C)CCOC(N)=O Amb6296084 [0,1,0,0,0,1|2,0,0]=4 5969 B9R0.56 C[N+](C)(C)NCCC(=O)[O-] Amb2099568 [0,1,0,0,0,1|1,0,1]=4 5970 B9R0.56 C[N+](C)(C)NCCC(=O)[O-] Amb28983712 [0,1,0,0,0,1|1,0,1]=4 5971 B9R0.56 C[Si](C)(C)C#CCC(=O)O Amb25273592 [0,1,0,0,0,1|0,1,1]=4 5972 B9R0.56 C[Si](C)(C)CC#CC(=O)O Amb27794250 [0,1,0,0,0,1|0,1,1]=4 5973 B9R0.56 C[Si](C)(C)CCCC(=O)O Amb26455818 [0,1,0,0,0,1|0,1,0]=3 5974 B9R0.56 C[Si](C)(C)CCOC(=O)Cl Amb33547034 [0,1,0,0,0,1|1,1,0]=4 5975 B9R0.56 C[Si](C)(C)C\C=C/C(=O)O Amb27434781 [0,1,0,0,0,1|0,1,1]=4 5976 B9R0.56 C[Si](C)(Cl)CCCC(=O)Cl Amb27623945 [0,1,0,0,0,1|1,1,0]=4 5977 B9R0.56 O=C(O)CCCC(Cl)(Cl)Cl Amb8480058 [0,1,0,0,0,1|2,0,0]=4 5978 B9R0.56 O=C(O)CCCC(F)(F)F Amb33544347 [0,1,0,0,0,1|2,0,0]=4 5979 B9R0.56 O=C(O)CCOC(F)(F)F Amb28050287 [0,1,0,0,0,1|2,0,0]=4 5980 B9R0.56 O=C(O)CCSC(F)(F)F Amb7969562 [0,1,0,0,0,1|2,0,0]=4 5981 B9R0.56 O=C(O)CNCC(F)(F)F Amb19372984 [0,1,0,0,0,1|2,0,0]=4 5982 B9R0.56 O=C(O)CNCC(F)(F)F Amb7766553 [0,1,0,0,0,1|2,0,0]=4 5983 B9R0.56 O=C(O)COCC(F)(F)F Amb2795380 [0,1,0,0,0,1|2,0,0]=4 5984 B9R0.56 O=C(O)CSCC(F)(F)F Amb1135874 [0,1,0,0,0,1|2,0,0]=4 5985 B9R0.21 C#CC(=O)OCC(C)(C)Br Amb33050569 [0,2,0,0,0,0|2,0,0]=4 5986 B9R0.21 C#CC(O)CCC(C)(C)N Amb30023531 [0,2,0,0,0,0|1,0,1]=4 5987 B9R0.21 C=CC(=O)CC[Si](C)(C)C Amb27267152 [0,2,0,0,0,0|1,1,0]=4 5988 B9R0.21 C=CC(=O)CNC(C)(C)C Amb27842054 [0,2,0,0,0,0|2,0,0]=4 5989 B9R0.21 C=CC(=O)COC(C)(C)C Amb25027988 [0,2,0,0,0,0|2,0,0]=4 5990 B9R0.21 C=CC(=O)NCC(C)(C)N Amb27233921 [0,2,0,0,0,0|2,0,0]=4 5991 B9R0.21 CC(C)(C)CCC(=O)CN Amb28126831 [0,2,0,0,0,0|1,0,0]=3 5992 B9R0.21 CC(C)(C)CCC(N)CO Amb18201750 [0,2,0,0,0,0|1,0,1]=4 5993 B9R0.21 CC(C)(C)CCC(N)CO Amb28555558 [0,2,0,0,0,0|1,0,1]=4 5994 B9R0.21 CC(C)(C)CCC(O)C#N Amb27945366 [0,2,0,0,0,0|1,0,1]=4 5995 B9R0.21 CC(C)(C)CCC(O)C=O Amb28454335 [0,2,0,0,0,0|0,0,1]=3 5996 B9R0.21 CC(C)(C)CCC(O)CN Amb27425057 [0,2,0,0,0,0|1,0,1]=4 5997 B9R0.21 CC(C)(C)CC\C(N)=N\O Amb24356913 [0,2,0,0,0,0|1,0,0]=3 5998 B9R0.21 CC(C)(C)CNC(=N)CO Amb27234623 [0,2,0,0,0,0|2,0,0]=4 5999 B9R0.21 CC(C)(C)CNC(=O)CBr Amb24116139 [0,2,0,0,0,0|2,0,0]=4 6000 B9R0.21 CC(C)(C)CNC(=O)CCl Amb18792529 [0,2,0,0,0,0|2,0,0]=4 6001 B9R0.21 CC(C)(C)COC(=O)CBr Amb27492905 [0,2,0,0,0,0|2,0,0]=4 6002 B9R0.21 CC(C)(C)NCC(=O)NO Amb27830850 [0,2,0,0,0,0|1,0,0]=3 6003 B9R0.21 CC(C)(C)OCC(=O)CCl Amb28145821 [0,2,0,0,0,0|2,0,0]=4 6004 B9R0.21 CC(C)(C)OCC(=O)CF Amb27762543 [0,2,0,0,0,0|2,0,0]=4 6005 B9R0.21 CC(C)(C)OCC(=O)CN Amb28060393 [0,2,0,0,0,0|2,0,0]=4 6006 B9R0.21 CC(C)(C)OCC(=O)NO Amb27425147 [0,2,0,0,0,0|1,0,0]=3 6007 B9R0.21 CC(C)(C)OC\C(N)=N\O Amb7792357 [0,2,0,0,0,0|2,0,0]=4 6008 B9R0.21 CC(C)(C)SC\C(N)=N\O Amb6680786 [0,2,0,0,0,0|2,0,0]=4 6009 B9R0.21 CC(C)(N)CCC(=O)NN Amb27167334 [0,2,0,0,0,0|1,0,0]=3 6010 B9R0.21 CC(C)(N)CNC(=O)CBr Amb32679171 [0,2,0,0,0,0|2,0,0]=4 6011 B9R0.21 CC(C)(N)CNC(=O)CCl Amb32679169 [0,2,0,0,0,0|2,0,0]=4 6012 B9R0.21 CC(C)(O)CCC(=O)NN Amb27408014 [0,2,0,0,0,0|1,0,0]=3 6013 B9R0.21 CC(C)(O)CCC(O)CO Amb27751923 [0,2,0,0,0,0|0,0,2]=4 6014 B9R0.21 CC(C)(O)CC[C@H](O)CO Amb27770512 [0,2,0,0,0,0|0,0,2]=4 6015 B9R0.21 CC(C)(O)CNC(=O)CCl Amb25889876 [0,2,0,0,0,0|2,0,0]=4 6016 B9R0.21 CC(C)(O)CNC(=O)CN Amb27614853 [0,2,0,0,0,0|2,0,0]=4 6017 B9R0.21 CC(C=O)CCP(=O)(O)O Amb27261915 [0,2,0,0,0,0|1,0,1]=4 6018 B9R0.21 CC(CBr)CCS(C)(=O)=O Amb25796734 [0,2,0,0,0,0|1,0,1]=4 6019 B9R0.21 CC(CCl)CCS(C)(=O)=O Amb24363403 [0,2,0,0,0,0|1,0,1]=4 6020 B9R0.21 CC(CN)CCS(=O)(=O)F Amb33463873 [0,2,0,0,0,0|1,0,1]=4 6021 B9R0.21 CC(CN)CCS(C)(=O)=O Amb18312080 [0,2,0,0,0,0|1,0,1]=4 6022 B9R0.21 CC(CO)CCC(C)(C)C Amb25075048 [0,2,0,0,0,0|1,0,1]=4 6023 B9R0.21 CC(F)(F)CCC(=O)NN Amb28126410 [0,2,0,0,0,0|2,0,0]=4 6024 B9R0.21 CCC(=O)CCC(C)(C)O Amb28321026 [0,2,0,0,0,0|1,0,0]=3 6025 B9R0.21 CCC(=O)CNC(C)(C)C Amb1091987 [0,2,0,0,0,0|2,0,0]=4 6026 B9R0.21 CCC(=O)NCC(C)(C)N Amb24355970 [0,2,0,0,0,0|2,0,0]=4 6027 B9R0.21 CCC(=O)OCC(C)(C)Br Amb33276520 [0,2,0,0,0,0|2,0,0]=4 6028 B9R0.21 CCC(C)CCS(=O)(=O)Cl Amb27778335 [0,2,0,0,0,0|1,0,1]=4 6029 B9R0.21 CCC(C)CCS(=O)(=O)F Amb33352888 [0,2,0,0,0,0|1,0,1]=4 6030 B9R0.21 CCC(C)CCS(N)(=O)=O Amb25371078 [0,2,0,0,0,0|1,0,1]=4 6031 B9R0.21 CCC(O)CCC(C)(C)C Amb27755750 [0,2,0,0,0,0|1,0,1]=4 6032 B9R0.21 CCC(O)CCC(C)(C)O Amb27650906 [0,2,0,0,0,0|1,0,1]=4 6033 B9R0.21 CC[C@@H](O)CCC(C)(C)O Amb27397117 [0,2,0,0,0,0|1,0,1]=4 6034 B9R0.21 CC[C@H](C)CCS(=O)(=O)Cl Amb27229585 [0,2,0,0,0,0|1,0,1]=4 6035 B9R0.21 CN(C=O)CCC(C)(C)C Amb27468980 [0,2,0,0,0,0|2,0,0]=4 6036 B9R0.21 CNC(=O)CCC(C)(C)N Amb15701576 [0,2,0,0,0,0|1,0,0]=3 6037 B9R0.21 CNC(=O)CCC(C)(C)N Amb22587380 [0,2,0,0,0,0|1,0,0]=3 6038 B9R0.21 CNC(=O)CCC(C)(C)O Amb27456261 [0,2,0,0,0,0|1,0,0]=3 6039 B9R0.21 CNC(=O)CCC(C)(F)F Amb27805988 [0,2,0,0,0,0|2,0,0]=4 6040 B9R0.21 CNC(=O)CSC(C)(C)C Amb8341982 [0,2,0,0,0,0|2,0,0]=4 6041 B9R0.21 CNC(=O)NCC(C)(C)C Amb27164342 [0,2,0,0,0,0|2,0,0]=4 6042 B9R0.21 CNC(C)CCS(=O)(=O)F Amb33463856 [0,2,0,0,0,0|1,0,1]=4 6043 B9R0.21 CNC(C)COS(=O)(=O)O Amb27425086 [0,2,0,0,0,0|2,0,0]=4 6044 B9R0.21 COC(=N)CCC(C)(C)C Amb28458087 [0,2,0,0,0,0|1,0,0]=3 6045 B9R0.21 COC(=N)CSC(C)(C)C Amb27978947 [0,2,0,0,0,0|2,0,0]=4 6046 B9R0.21 COC(=O)C#CC(C)(C)C Amb9791084 [0,2,0,0,0,0|0,0,2]=4 6047 B9R0.21 COC(=O)C#CC(C)(C)F Amb28430752 [0,2,0,0,0,0|0,0,2]=4 6048 B9R0.21 COC(=O)C#CC(C)(C)N Amb32671658 [0,2,0,0,0,0|0,0,2]=4 6049 B9R0.21 COC(=O)C#CC(C)(C)O Amb9790321 [0,2,0,0,0,0|0,0,2]=4 6050 B9R0.21 COC(=O)CCC(C)(C)N Amb19415866 [0,2,0,0,0,0|0,0,0]=2 6051 B9R0.21 COC(=O)CCC(C)(C)N Amb24383846 [0,2,0,0,0,0|0,0,0]=2 6052 B9R0.21 COC(=O)CCC(C)(F)F Amb26639214 [0,2,0,0,0,0|1,0,0]=3 6053 B9R0.21 COC(=O)CCC(Cl)(Cl)Cl Amb26963389 [0,2,0,0,0,0|2,0,0]=4 6054 B9R0.21 COC(=O)CCC(F)(F)F Amb10840427 [0,2,0,0,0,0|2,0,0]=4 6055 B9R0.21 COC(=O)CCS(C)(=N)=O Amb33621261 [0,2,0,0,0,0|2,0,0]=4 6056 B9R0.21 COC(=O)CCS(C)(=N)=O Amb33749083 [0,2,0,0,0,0|2,0,0]=4 6057 B9R0.21 COC(=O)CCS(C)(=O)=O Amb18177820 [0,2,0,0,0,0|2,0,0]=4 6058 B9R0.21 COC(=O)CC[S@](C)(=N)=O Amb33744014 [0,2,0,0,0,0|2,0,0]=4 6059 B9R0.21 COC(=O)CC[Si](C)(C)C Amb25681301 [0,2,0,0,0,0|0,1,0]=3 6060 B9R0.21 COC(=O)CC[Si](C)(Cl)Cl Amb19893679 [0,2,0,0,0,0|1,1,0]=4 6061 B9R0.21 COC(=O)CNC(C)(C)C Amb2779525 [0,2,0,0,0,0|1,0,0]=3 6062 B9R0.21 COC(=O)COC(C)(C)C Amb7789989 [0,2,0,0,0,0|1,0,0]=3 6063 B9R0.21 COC(=O)CSC(C)(C)C Amb7752950 [0,2,0,0,0,0|1,0,0]=3 6064 B9R0.21 COC(=O)NCC(C)(F)F Amb29855921 [0,2,0,0,0,0|2,0,0]=4 6065 B9R0.21 COC(=O)\C=C\C(C)(C)C Amb32789660 [0,2,0,0,0,0|0,0,2]=4 6066 B9R0.21 COC(=O)\C=C\C(C)(C)N Amb33330542 [0,2,0,0,0,0|0,0,2]=4 6067 B9R0.21 COC(=O)\C=C\C(C)(C)N Amb33330543 [0,2,0,0,0,0|0,0,2]=4 6068 B9R0.21 COC(C)CCS(=O)(=O)Cl Amb24683435 [0,2,0,0,0,0|1,0,1]=4 6069 B9R0.21 CON(C)CCC(C)(C)N Amb28185029 [0,2,0,0,0,0|2,0,0]=4 6070 B9R0.21 CS(=O)(=O)CCC(=O)NO Amb28049751 [0,2,0,0,0,0|2,0,0]=4 6071 B9R0.21 C[C@@H](CO)CCC(C)(C)C Amb33746882 [0,2,0,0,0,0|1,0,1]=4 6072 B9R0.21 C[C@H](CO)CCC(C)(C)C Amb33730477 [0,2,0,0,0,0|1,0,1]=4 6073 B9R0.21 C[Si](C)(C)CCC(=O)C#N Amb27783383 [0,2,0,0,0,0|1,1,0]=4 6074 B9R0.21 C\C(CCC(C)(C)C)=N/O Amb28124501 [0,2,0,0,0,0|1,0,0]=3 6075 B9R0.21 C\C(CNC(C)(C)C)=N/O Amb27412956 [0,2,0,0,0,0|2,0,0]=4 6076 B9R0.21 O=C(CCC(F)(F)F)NO Amb28074999 [0,2,0,0,0,0|2,0,0]=4 6077 B9R0.21 O=C(CO)CCC(F)(F)F Amb28135519 [0,2,0,0,0,0|2,0,0]=4 6078 B9R0.21 O=P(O)(O)CCC(O)CO Amb27775417 [0,2,0,0,0,0|2,0,0]=4 6079 B9R0.23 C#CC(=O)[C@@H](N)CC(C)C Amb35617479 [0,2,0,0,0,0|1,0,0]=3 6080 B9R0.23 C#CC(=O)[C@H](N)CC(C)C Amb35737491 [0,2,0,0,0,0|1,0,0]=3 6081 B9R0.23 C#CC(O)C(N)CC(C)C Amb30024358 [0,2,0,0,0,0|1,0,1]=4 6082 B9R0.23 C#CC(O)[C@@H](N)CC(C)C Amb35623819 [0,2,0,0,0,0|1,0,1]=4 6083 B9R0.23 C#CC(O)[C@H](N)CC(C)C Amb35588416 [0,2,0,0,0,0|1,0,1]=4 6084 B9R0.23 C=C(C)CC(C)C(=O)OC Amb27857780 [0,2,0,0,0,0|0,0,2]=4 6085 B9R0.23 C=C(C)CC(C)C(C)CN Amb28248400 [0,2,0,0,0,0|2,0,0]=4 6086 B9R0.23 C=C(C)CC(Cl)C(=O)OC Amb28051409 [0,2,0,0,0,0|0,0,2]=4 6087 B9R0.23 C=C(C)CC(Cl)C(C)CC Amb27948813 [0,2,0,0,0,0|2,0,0]=4 6088 B9R0.23 C=C(C)CC(N)C(=O)OC Amb26654974 [0,2,0,0,0,0|0,0,2]=4 6089 B9R0.23 C=C(C)CC(O)C(=O)OC Amb24464009 [0,2,0,0,0,0|0,0,2]=4 6090 B9R0.23 C=C(C)CC(O)C(C)OC Amb28323852 [0,2,0,0,0,0|2,0,0]=4 6091 B9R0.23 C=C(C)C[C@@H](O)C(=O)OC Amb27219810 [0,2,0,0,0,0|0,0,2]=4 6092 B9R0.23 C=C(C)C[C@@H](O)[C@@H](C)CO Amb27662139 [0,2,0,0,0,0|2,0,0]=4 6093 B9R0.23 C=C(CC(C)C)C(=O)OC Amb27827319 [0,2,0,0,0,0|0,0,1]=3 6094 B9R0.23 C=C(CC)C(N)CC(=O)O Amb25068441 [0,2,0,0,0,0|0,0,2]=4 6095 B9R0.23 C=CC(=O)C(N)CC(C)C Amb28348598 [0,2,0,0,0,0|1,0,0]=3 6096 B9R0.23 C=CC(C)C(C)CC(C)=O Amb27424833 [0,2,0,0,0,0|1,0,1]=4 6097 B9R0.23 C=CC(O)C(C)CC(C)C Amb27754188 [0,2,0,0,0,0|1,0,1]=4 6098 B9R0.23 C=CC(O)C(O)CC(C)C Amb27396161 [0,2,0,0,0,0|1,0,1]=4 6099 B9R0.23 C=C[C@@H](O)[C@H](O)CC(C)C Amb27603726 [0,2,0,0,0,0|1,0,1]=4 6100 B9R0.23 C=C[C@H](O)[C@@H](N)CC(C)C Amb27221855 [0,2,0,0,0,0|1,0,1]=4 6101 B9R0.23 CC(=O)CC(C)C(C)C=O Amb28049891 [0,2,0,0,0,0|1,0,1]=4 6102 B9R0.23 CC(=O)CN(C)C(C)CO Amb27603879 [0,2,0,0,0,0|2,0,0]=4 6103 B9R0.23 CC(=O)C[C@@H](O)[C@@H](O)CO Amb25767917 [0,2,0,0,0,0|2,0,0]=4 6104 B9R0.23 CC(=O)OC(C)C(C)CN Amb27838034 [0,2,0,0,0,0|2,0,0]=4 6105 B9R0.23 CC(=O)O[C@H](C)[C@H](C)CN Amb27876408 [0,2,0,0,0,0|2,0,0]=4 6106 B9R0.23 CC(C)CC(=O)C(=O)CBr Amb28346721 [0,2,0,0,0,0|1,0,1]=4 6107 B9R0.23 CC(C)CC(=O)\C(Cl)=N/O Amb27470975 [0,2,0,0,0,0|1,0,1]=4 6108 B9R0.23 CC(C)CC(C)C(C)CO Amb24415190 [0,2,0,0,0,0|1,0,1]=4 6109 B9R0.23 CC(C)CC(C)C(O)CN Amb27971833 [0,2,0,0,0,0|1,0,1]=4 6110 B9R0.23 CC(C)CC(C)C(O)CO Amb27854831 [0,2,0,0,0,0|0,0,2]=4 6111 B9R0.23 CC(C)CC(C)[C@@H](C)CO Amb33746686 [0,2,0,0,0,0|1,0,1]=4 6112 B9R0.23 CC(C)CC(C)[C@H](C)CO Amb33743118 [0,2,0,0,0,0|1,0,1]=4 6113 B9R0.23 CC(C)CC(C)\C(N)=N\N Amb28141507 [0,2,0,0,0,0|2,0,0]=4 6114 B9R0.23 CC(C)CC(N)C(=O)NN Amb18559331 [0,2,0,0,0,0|1,0,0]=3 6115 B9R0.23 CC(C)CC(N)C(=O)NO Amb27264492 [0,2,0,0,0,0|0,0,0]=2 6116 B9R0.23 CC(C)CC(N)C(O)CN Amb33039008 [0,2,0,0,0,0|1,0,1]=4 6117 B9R0.23 CC(C)CC(N)C(O)CO Amb27876197 [0,2,0,0,0,0|0,0,2]=4 6118 B9R0.23 CC(C)CC(O)C(C)CO Amb27480790 [0,2,0,0,0,0|1,0,1]=4 6119 B9R0.23 CC(C)CC(O)C(F)CO Amb28401376 [0,2,0,0,0,0|1,0,1]=4 6120 B9R0.23 CC(C)CC(O)C(O)CO Amb27835878 [0,2,0,0,0,0|0,0,2]=4 6121 B9R0.23 CC(C)CC(S)C(=O)NN Amb30008515 [0,2,0,0,0,0|1,0,0]=3 6122 B9R0.23 CC(C)CN(C)C(=O)CCl Amb8874231 [0,2,0,0,0,0|2,0,0]=4 6123 B9R0.23 CC(C)CN(C)C(=O)CN Amb8899915 [0,2,0,0,0,0|2,0,0]=4 6124 B9R0.23 CC(C)CN(C)C(=O)NN Amb8900175 [0,2,0,0,0,0|2,0,0]=4 6125 B9R0.23 CC(C)CN(C)\C(N)=N\O Amb26512558 [0,2,0,0,0,0|2,0,0]=4 6126 B9R0.23 CC(C)C[C@@H](N)C(=O)NN Amb27768739 [0,2,0,0,0,0|1,0,0]=3 6127 B9R0.23 CC(C)C[C@H](F)[C@H](O)CO Amb28205951 [0,2,0,0,0,0|0,0,2]=4 6128 B9R0.23 CC(C)C[C@H](N)C(=O)CCl Amb27646024 [0,2,0,0,0,0|1,0,0]=3 6129 B9R0.23 CC(C)C[C@H](N)C(=O)CCl Amb33788832 [0,2,0,0,0,0|1,0,0]=3 6130 B9R0.23 CC(C)C[C@H](N)C(=O)NO Amb24440728 [0,2,0,0,0,0|0,0,0]=2 6131 B9R0.23 CC(C)NC(C)\C(N)=N\O Amb27592532 [0,2,0,0,0,0|2,0,0]=4 6132 B9R0.23 CC(C)OC(C)C(=O)NN Amb2089066 [0,2,0,0,0,0|2,0,0]=4 6133 B9R0.23 CC(C)OC(C)C(=O)NN Amb9172213 [0,2,0,0,0,0|2,0,0]=4 6134 B9R0.23 CC(C=O)C(C)CC(=O)O Amb27838156 [0,2,0,0,0,0|0,0,1]=3 6135 B9R0.23 CC(CC(=O)O)C(N)CO Amb27843636 [0,2,0,0,0,0|1,0,0]=3 6136 B9R0.23 CC(CN(C)C)C(=O)NN Amb27600492 [0,2,0,0,0,0|2,0,0]=4 6137 B9R0.23 CC(CN)N(C)CC(=O)O Amb27453888 [0,2,0,0,0,0|1,0,0]=3 6138 B9R0.23 CC(CO)C(C)NC(N)=O Amb28351735 [0,2,0,0,0,0|2,0,0]=4 6139 B9R0.23 CC(O)CC(C)C(=O)NN Amb27666364 [0,2,0,0,0,0|2,0,0]=4 6140 B9R0.23 CC(O)CC(O)C(O)C=O Amb25713186 [0,2,0,0,0,0|1,0,1]=4 6141 B9R0.23 CCC(=O)C(C)CC(C)C Amb28397602 [0,2,0,0,0,0|1,0,0]=3 6142 B9R0.23 CCC(=O)C(C)CN(C)C Amb10603104 [0,2,0,0,0,0|2,0,0]=4 6143 B9R0.23 CCC(=O)C(N)CC(C)C Amb18202462 [0,2,0,0,0,0|1,0,0]=3 6144 B9R0.23 CCC(=O)C(O)CC(C)C Amb27589828 [0,2,0,0,0,0|1,0,0]=3 6145 B9R0.23 CCC(=O)[C@@H](C)CN(C)C Amb25976293 [0,2,0,0,0,0|2,0,0]=4 6146 B9R0.23 CCC(C)C(=N)CC(C)=O Amb27629398 [0,2,0,0,0,0|1,0,1]=4 6147 B9R0.23 CCC(C)C(=O)CC(C)=O Amb24544654 [0,2,0,0,0,0|1,0,1]=4 6148 B9R0.23 CCC(C)C(C)CC(=O)O Amb18304200 [0,2,0,0,0,0|0,0,0]=2 6149 B9R0.23 CCC(C)C(C)NC(=O)Cl Amb35625811 [0,2,0,0,0,0|2,0,0]=4 6150 B9R0.23 CCC(C)C(C)NC(C)=O Amb27778847 [0,2,0,0,0,0|2,0,0]=4 6151 B9R0.23 CCC(C)C(N)CC(=O)O Amb2438880 [0,2,0,0,0,0|0,0,0]=2 6152 B9R0.23 CCC(C)C(N)CC(N)=O Amb25312995 [0,2,0,0,0,0|1,0,0]=3 6153 B9R0.23 CCC(C)C(N)CS(C)=O Amb27768663 [0,2,0,0,0,0|2,0,0]=4 6154 B9R0.23 CCC(C)C(O)CC(=O)O Amb18310690 [0,2,0,0,0,0|0,0,0]=2 6155 B9R0.23 CCC(C)N(C)CC(=O)O Amb8900884 [0,2,0,0,0,0|1,0,0]=3 6156 B9R0.23 CCC(C)N(C)CC(N)=O Amb27171388 [0,2,0,0,0,0|2,0,0]=4 6157 B9R0.23 CCC(C)S(=O)CC(=O)O Amb18523822 [0,2,0,0,0,0|1,0,0]=3 6158 B9R0.23 CCC(C)[C@@H](N)CC(=O)O Amb28455466 [0,2,0,0,0,0|0,0,0]=2 6159 B9R0.23 CCC(C)[C@@H](N)CC(N)=O Amb25823252 [0,2,0,0,0,0|1,0,0]=3 6160 B9R0.23 CCC(C)[C@@H](O)CC(=O)O Amb33318493 [0,2,0,0,0,0|0,0,0]=2 6161 B9R0.23 CCC(C)[C@@H](O)CC(C)=O Amb27227937 [0,2,0,0,0,0|1,0,0]=3 6162 B9R0.23 CCC(C)[C@@H](O)C[C@@H](C)O Amb28126884 [0,2,0,0,0,0|1,0,1]=4 6163 B9R0.23 CCC(C)[C@H](N)CC(=O)O Amb25117039 [0,2,0,0,0,0|0,0,0]=2 6164 B9R0.23 CCC(C)[C@H](N)CC(N)=O Amb28050389 [0,2,0,0,0,0|1,0,0]=3 6165 B9R0.23 CCC(C)[C@H](O)CC(=O)O Amb33318492 [0,2,0,0,0,0|0,0,0]=2 6166 B9R0.23 CCC(C)[C@H](O)CC(C)=O Amb27243299 [0,2,0,0,0,0|1,0,0]=3 6167 B9R0.23 CCC(C)[C@H](O)C[C@@H](C)O Amb27835112 [0,2,0,0,0,0|1,0,1]=4 6168 B9R0.23 CCC(C)\C(C)=C\C(=O)O Amb27837581 [0,2,0,0,0,0|0,0,2]=4 6169 B9R0.23 CCC(C)\C(Cl)=C\C(=O)O Amb28254394 [0,2,0,0,0,0|0,0,2]=4 6170 B9R0.23 CCC(O)C(C)CC(C)C Amb27985797 [0,2,0,0,0,0|1,0,1]=4 6171 B9R0.23 CCN(C)C(=O)CC(=O)O Amb18987423 [0,2,0,0,0,0|1,0,1]=4 6172 B9R0.23 CCN(C)C(C)CC(=O)O Amb22587145 [0,2,0,0,0,0|1,0,0]=3 6173 B9R0.23 CCN(C)C(C)CC(=O)O Amb9399322 [0,2,0,0,0,0|1,0,0]=3 6174 B9R0.23 CCS(=O)C(C)CC(=O)O Amb19012075 [0,2,0,0,0,0|2,0,0]=4 6175 B9R0.23 CC[C@@H](C)C(N)CC(=O)O Amb32687892 [0,2,0,0,0,0|0,0,0]=2 6176 B9R0.23 CC[C@@H](C)[C@@H](N)CC(=O)O Amb25689818 [0,2,0,0,0,0|0,0,0]=2 6177 B9R0.23 CC[C@H](C)C(N)CC(=O)O Amb32687890 [0,2,0,0,0,0|0,0,0]=2 6178 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O Amb16184016 [0,2,0,0,0,0|0,0,0]=2 6179 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb19944304 [0,2,0,0,0,0|0,0,0]=2 6180 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb25068405 [0,2,0,0,0,0|0,0,0]=2 6181 B9R0.23 CC[C@H](O)[C@@H](N)CC(=O)O Amb27469484 [0,2,0,0,0,0|1,0,0]=3 6182 B9R0.23 CC\C(C)=C(/C)CC(=O)O Amb28050046 [0,2,0,0,0,0|0,0,2]=4 6183 B9R0.23 CNC(=O)C(C)CC(C)C Amb28315942 [0,2,0,0,0,0|1,0,0]=3 6184 B9R0.23 CNC(=O)C(C)SC(C)C Amb28316085 [0,2,0,0,0,0|2,0,0]=4 6185 B9R0.23 CNC(=O)C(N)CC(=O)O Amb18862479 [0,2,0,0,0,0|1,0,1]=4 6186 B9R0.23 CNC(=O)C(N)CC(C)C Amb7969680 [0,2,0,0,0,0|1,0,0]=3 6187 B9R0.23 CNC(=O)C(N)CC(C)C Amb9724493 [0,2,0,0,0,0|1,0,0]=3 6188 B9R0.23 CNC(=O)C(O)CC(C)C Amb25708055 [0,2,0,0,0,0|1,0,0]=3 6189 B9R0.23 CNC(=O)N(C)CC(C)C Amb27774643 [0,2,0,0,0,0|2,0,0]=4 6190 B9R0.23 CNC(=O)[C@@H](N)CC(C)C Amb17231992 [0,2,0,0,0,0|1,0,0]=3 6191 B9R0.23 CNC(=O)[C@H](C)NC(C)C Amb27823247 [0,2,0,0,0,0|2,0,0]=4 6192 B9R0.23 CNC(=O)[C@H](N)CC(C)C Amb18035928 [0,2,0,0,0,0|1,0,0]=3 6193 B9R0.23 CNC(=S)C(N)CC(C)C Amb24482442 [0,2,0,0,0,0|1,1,0]=4 6194 B9R0.23 COC(=O)C(=O)CC(C)C Amb17740021 [0,2,0,0,0,0|0,0,1]=3 6195 B9R0.23 COC(=O)C(Br)CC(=O)O Amb18656999 [0,2,0,0,0,0|1,0,1]=4 6196 B9R0.23 COC(=O)C(Br)CC(C)C Amb22490955 [0,2,0,0,0,0|0,0,0]=2 6197 B9R0.23 COC(=O)C(C)CC(=O)O Amb18644248 [0,2,0,0,0,0|1,0,1]=4 6198 B9R0.23 COC(=O)C(C)CC(C)=O Amb27465860 [0,2,0,0,0,0|1,0,1]=4 6199 B9R0.23 COC(=O)C(C)CN(C)C Amb8428189 [0,2,0,0,0,0|1,0,0]=3 6200 B9R0.23 COC(=O)C(C)NC(C)C Amb19003119 [0,2,0,0,0,0|1,0,0]=3 6201 B9R0.23 COC(=O)C(C)NN(C)C Amb27985422 [0,2,0,0,0,0|2,0,0]=4 6202 B9R0.23 COC(=O)C(Cl)CC(=O)O Amb27589899 [0,2,0,0,0,0|1,0,1]=4 6203 B9R0.23 COC(=O)C(Cl)CC(C)C Amb18800856 [0,2,0,0,0,0|0,0,0]=2 6204 B9R0.23 COC(=O)C(F)CC(=O)O Amb27837974 [0,2,0,0,0,0|1,0,1]=4 6205 B9R0.23 COC(=O)C(N)CC(=O)O Amb18644309 [0,2,0,0,0,0|1,0,1]=4 6206 B9R0.23 COC(=O)C(N)CC(C)=O Amb25367296 [0,2,0,0,0,0|1,0,1]=4 6207 B9R0.23 COC(=O)C(N)CC(C)C Amb1152419 [0,2,0,0,0,0|0,0,0]=2 6208 B9R0.23 COC(=O)C(N)CC(C)C Amb22489476 [0,2,0,0,0,0|0,0,0]=2 6209 B9R0.23 COC(=O)C(N)CC(C)C Amb932819 [0,2,0,0,0,0|0,0,0]=2 6210 B9R0.23 COC(=O)C(N)CC(C)O Amb33065512 [0,2,0,0,0,0|1,0,0]=3 6211 B9R0.23 COC(=O)C(N)CC(Cl)Cl Amb28121067 [0,2,0,0,0,0|2,0,0]=4 6212 B9R0.23 COC(=O)C(N)CC(F)F Amb22059458 [0,2,0,0,0,0|2,0,0]=4 6213 B9R0.23 COC(=O)C(N)CC(F)F Amb32693476 [0,2,0,0,0,0|2,0,0]=4 6214 B9R0.23 COC(=O)C(N)CN(C)C Amb24715537 [0,2,0,0,0,0|1,0,0]=3 6215 B9R0.23 COC(=O)C(N)CN(C)C Amb28555446 [0,2,0,0,0,0|1,0,0]=3 6216 B9R0.23 COC(=O)C(O)CC(=O)O Amb17615865 [0,2,0,0,0,0|1,0,1]=4 6217 B9R0.23 COC(=O)C(O)CC(C)C Amb19306745 [0,2,0,0,0,0|0,0,0]=2 6218 B9R0.23 COC(=O)C(O)CC(F)F Amb32811459 [0,2,0,0,0,0|2,0,0]=4 6219 B9R0.23 COC(=O)N(C)CC(C)N Amb27948991 [0,2,0,0,0,0|2,0,0]=4 6220 B9R0.23 COC(=O)N(C)C[C@@H](C)O Amb28456472 [0,2,0,0,0,0|2,0,0]=4 6221 B9R0.23 COC(=O)N(C)C[C@H](C)O Amb27873990 [0,2,0,0,0,0|2,0,0]=4 6222 B9R0.23 COC(=O)[C@@H](Br)CC(C)C Amb27400688 [0,2,0,0,0,0|0,0,0]=2 6223 B9R0.23 COC(=O)[C@@H](F)CC(=O)O Amb27406311 [0,2,0,0,0,0|1,0,1]=4 6224 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb22746069 [0,2,0,0,0,0|1,0,1]=4 6225 B9R0.23 COC(=O)[C@@H](N)CC(=O)O Amb8390387 [0,2,0,0,0,0|1,0,1]=4 6226 B9R0.23 COC(=O)[C@@H](N)CC(C)C Amb533935 [0,2,0,0,0,0|0,0,0]=2 6227 B9R0.23 COC(=O)[C@@H](N)CC(C)C Amb8513236 [0,2,0,0,0,0|0,0,0]=2 6228 B9R0.23 COC(=O)[C@@H](N)CC(Cl)Cl Amb27444622 [0,2,0,0,0,0|2,0,0]=4 6229 B9R0.23 COC(=O)[C@@H](N)CC(F)F Amb28187129 [0,2,0,0,0,0|2,0,0]=4 6230 B9R0.23 COC(=O)[C@@H](N)CN(C)C Amb31295179 [0,2,0,0,0,0|1,0,0]=3 6231 B9R0.23 COC(=O)[C@@H](O)CC(=O)O Amb17615867 [0,2,0,0,0,0|1,0,1]=4 6232 B9R0.23 COC(=O)[C@H](Br)CC(C)C Amb27796257 [0,2,0,0,0,0|0,0,0]=2 6233 B9R0.23 COC(=O)[C@H](C)CC(=O)O Amb24561954 [0,2,0,0,0,0|1,0,1]=4 6234 B9R0.23 COC(=O)[C@H](C)NC(C)C Amb9228611 [0,2,0,0,0,0|1,0,0]=3 6235 B9R0.23 COC(=O)[C@H](Cl)CC(=O)O Amb27232518 [0,2,0,0,0,0|1,0,1]=4 6236 B9R0.23 COC(=O)[C@H](N)CC(=O)O Amb19944281 [0,2,0,0,0,0|1,0,1]=4 6237 B9R0.23 COC(=O)[C@H](N)CC(C)C Amb2719741 [0,2,0,0,0,0|0,0,0]=2 6238 B9R0.23 COC(=O)[C@H](N)CC(C)C Amb3941143 [0,2,0,0,0,0|0,0,0]=2 6239 B9R0.23 COC(=O)[C@H](N)CC(F)F Amb33482999 [0,2,0,0,0,0|2,0,0]=4 6240 B9R0.23 COC(=O)[C@H](N)CC(F)F Amb33483000 [0,2,0,0,0,0|2,0,0]=4 6241 B9R0.23 COC(=O)[C@H](O)C=C(C)C Amb27432220 [0,2,0,0,0,0|0,0,2]=4 6242 B9R0.23 COC(=O)[C@H](O)CC(=O)O Amb17615866 [0,2,0,0,0,0|1,0,1]=4 6243 B9R0.23 COC(=O)[C@H](O)CC(C)C Amb26022448 [0,2,0,0,0,0|0,0,0]=2 6244 B9R0.23 COC(=O)\C(I)=C\C(C)C Amb27230893 [0,2,0,0,0,0|0,0,2]=4 6245 B9R0.23 COC(=O)\C(N)=C\C(C)C Amb28050074 [0,2,0,0,0,0|0,0,2]=4 6246 B9R0.23 COC(C)C(=O)CC(C)=O Amb26479508 [0,2,0,0,0,0|1,0,1]=4 6247 B9R0.23 COC(C)C(C)CC(=O)O Amb18202340 [0,2,0,0,0,0|0,0,0]=2 6248 B9R0.23 COC(C)C(N)CC(=O)O Amb26567214 [0,2,0,0,0,0|0,0,0]=2 6249 B9R0.23 COC(C)C(N)CC(N)=O Amb26580109 [0,2,0,0,0,0|1,0,0]=3 6250 B9R0.23 COC(C)C(O)CC(C)C Amb27433190 [0,2,0,0,0,0|1,0,1]=4 6251 B9R0.23 COC(C)[C@@H](C)NC(C)=O Amb27197797 [0,2,0,0,0,0|2,0,0]=4 6252 B9R0.23 COC(C)[C@H](C)NC(C)=O Amb28063340 [0,2,0,0,0,0|2,0,0]=4 6253 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35788177 [0,2,0,0,0,0|0,0,0]=2 6254 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35789671 [0,2,0,0,0,0|0,0,0]=2 6255 B9R0.23 C[C@@H](N)C[C@@H](O)C(=O)NO Amb27620269 [0,2,0,0,0,0|1,0,0]=3 6256 B9R0.23 C[C@@H](O)CN(C)C(=O)CO Amb28456435 [0,2,0,0,0,0|2,0,0]=4 6257 B9R0.23 C[C@H](C=O)[C@@H](C)CC(=O)O Amb27874077 [0,2,0,0,0,0|0,0,1]=3 6258 B9R0.23 C[C@H](CO)N(C)CC(=O)O Amb28254590 [0,2,0,0,0,0|1,0,0]=3 6259 B9R0.23 C[C@H](CO)N(C)CC(N)=O Amb28316067 [0,2,0,0,0,0|2,0,0]=4 6260 B9R0.23 C\C(=C/N)C(N)CC(=O)O Amb28075172 [0,2,0,0,0,0|0,0,2]=4 6261 B9R0.23 C\C(=C/O)C(=O)CC(C)C Amb28056098 [0,2,0,0,0,0|1,0,1]=4 6262 B9R0.23 C\C(=N/O)C(=O)CC(C)C Amb28381111 [0,2,0,0,0,0|1,0,1]=4 6263 B9R0.23 C\C(=N/O)C(O)CC(=O)O Amb27223478 [0,2,0,0,0,0|1,0,1]=4 6264 B9R0.23 C\C(C=O)=C(\O)CC(C)C Amb27439095 [0,2,0,0,0,0|1,0,1]=4 6265 B9R0.23 C\C=C(\C)C(Cl)CC(C)C Amb28325584 [0,2,0,0,0,0|2,0,0]=4 6266 B9R0.23 C\C=C(\C)C(N)CC(=O)O Amb28245387 [0,2,0,0,0,0|0,0,1]=3 6267 B9R0.23 C\C=C(\C)C(O)CC(C)C Amb27981715 [0,2,0,0,0,0|2,0,0]=4 6268 B9R0.23 NC(=O)CC(N)[C@H](O)CO Amb28050874 [0,2,0,0,0,0|2,0,0]=4 6269 B9R0.23 NC(=O)C[C@@H](O)[C@H](O)CO Amb27788545 [0,2,0,0,0,0|2,0,0]=4 6270 B9R0.23 NC(=O)C[C@H](O)[C@H](O)CO Amb27759937 [0,2,0,0,0,0|2,0,0]=4 6271 B9R0.23 NC(CC(=O)O)C(O)CF Amb28071644 [0,2,0,0,0,0|1,0,0]=3 6272 B9R0.23 NC(CO)C(N)CC(=O)O Amb27804493 [0,2,0,0,0,0|1,0,0]=3 6273 B9R0.23 N[C@@H](CO)[C@H](N)CC(=O)O Amb27594534 [0,2,0,0,0,0|1,0,0]=3 6274 B9R0.23 O=C(O)CC(Br)C(=O)CBr Amb15772353 [0,2,0,0,0,0|1,0,1]=4 6275 B9R0.23 O=C(O)CC(S)C(=O)CS Amb27758589 [0,2,0,0,0,0|1,0,1]=4 6276 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO Amb24726353 [0,2,0,0,0,0|1,0,0]=3 6277 B9R0.24 C#CC(=O)NCC(C)CC Amb35715065 [0,2,0,0,0,0|2,0,0]=4 6278 B9R0.24 C#CC(=O)NCC(C)CN Amb18908339 [0,2,0,0,0,0|2,0,0]=4 6279 B9R0.24 C#CC(=O)NCC(C)OC Amb27982507 [0,2,0,0,0,0|2,0,0]=4 6280 B9R0.24 C#CC(=O)NC[C@@H](C)OC Amb35637595 [0,2,0,0,0,0|2,0,0]=4 6281 B9R0.24 C#CC(=O)NC[C@H](C)OC Amb35637594 [0,2,0,0,0,0|2,0,0]=4 6282 B9R0.24 C#CC(C)NCC(=O)OC Amb27401661 [0,2,0,0,0,0|1,0,1]=4 6283 B9R0.24 C#CC(C)OCC(=O)OC Amb27660803 [0,2,0,0,0,0|1,0,1]=4 6284 B9R0.24 C#CC(O)CCC(=O)OC Amb27851096 [0,2,0,0,0,0|1,0,1]=4 6285 B9R0.24 C#C[C@@H](O)CCC(=O)OC Amb28207270 [0,2,0,0,0,0|1,0,1]=4 6286 B9R0.24 C=CC(=O)CCC(C)CC Amb27227030 [0,2,0,0,0,0|1,0,0]=3 6287 B9R0.24 C=CC(=O)CSC(C)CC Amb27251841 [0,2,0,0,0,0|2,0,0]=4 6288 B9R0.24 C=CC(=O)NCC(C)CO Amb27224821 [0,2,0,0,0,0|2,0,0]=4 6289 B9R0.24 C=CC(=O)OCC(C)CC Amb17934097 [0,2,0,0,0,0|2,0,0]=4 6290 B9R0.24 C=CC(C)CCC(=O)CC Amb28141338 [0,2,0,0,0,0|1,0,1]=4 6291 B9R0.24 C=CC(N)CCC(=O)OC Amb18124639 [0,2,0,0,0,0|1,0,1]=4 6292 B9R0.24 C=CC(O)CCC(C)OC Amb27167483 [0,2,0,0,0,0|1,0,1]=4 6293 B9R0.24 C=C[C@@H](N)CCC(=O)OC Amb27247194 [0,2,0,0,0,0|1,0,1]=4 6294 B9R0.24 CC(CO)CCC(=O)NN Amb28350052 [0,2,0,0,0,0|1,0,0]=3 6295 B9R0.24 CC(CO)CCC(C)CO Amb25232821 [0,2,0,0,0,0|1,0,1]=4 6296 B9R0.24 CC(CO)CNC(=O)CBr Amb27175197 [0,2,0,0,0,0|2,0,0]=4 6297 B9R0.24 CC(CO)CNC(=O)CCl Amb27833178 [0,2,0,0,0,0|2,0,0]=4 6298 B9R0.24 CC(CO)CNC(=O)CN Amb27197708 [0,2,0,0,0,0|2,0,0]=4 6299 B9R0.24 CC(CO)CNC(=O)CS Amb27401279 [0,2,0,0,0,0|1,1,0]=4 6300 B9R0.24 CCC(=O)CCC(C)C=O Amb27424839 [0,2,0,0,0,0|1,0,1]=4 6301 B9R0.24 CCC(=O)CCC(C)CC Amb28348884 [0,2,0,0,0,0|1,0,0]=3 6302 B9R0.24 CCC(=O)CCC(C)CN Amb28060686 [0,2,0,0,0,0|1,0,0]=3 6303 B9R0.24 CCC(=O)CCC(N)CC Amb27454005 [0,2,0,0,0,0|2,0,0]=4 6304 B9R0.24 CCC(=O)CCC(O)CF Amb28437142 [0,2,0,0,0,0|2,0,0]=4 6305 B9R0.24 CCC(=O)COC(C)CC Amb27395562 [0,2,0,0,0,0|2,0,0]=4 6306 B9R0.24 CCC(=O)CSC(C)CC Amb18800476 [0,2,0,0,0,0|2,0,0]=4 6307 B9R0.24 CCC(=O)NCC(C)CBr Amb28249686 [0,2,0,0,0,0|2,0,0]=4 6308 B9R0.24 CCC(=O)NCC(C)CCl Amb28049464 [0,2,0,0,0,0|2,0,0]=4 6309 B9R0.24 CCC(=O)NCC(C)CN Amb19027064 [0,2,0,0,0,0|2,0,0]=4 6310 B9R0.24 CCC(=O)OCC(C)CBr Amb27603933 [0,2,0,0,0,0|2,0,0]=4 6311 B9R0.24 CCC(Br)CCC(=O)OC Amb28049989 [0,2,0,0,0,0|1,0,0]=3 6312 B9R0.24 CCC(C)C#CC(=O)OC Amb25333980 [0,2,0,0,0,0|0,0,2]=4 6313 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [0,2,0,0,0,0|0,0,0]=2 6314 B9R0.24 CCC(C)CCC(O)CCl Amb27770538 [0,2,0,0,0,0|1,0,1]=4 6315 B9R0.24 CCC(C)CNC(=O)CBr Amb23512819 [0,2,0,0,0,0|2,0,0]=4 6316 B9R0.24 CCC(C)CN\C(N)=N\O Amb27470141 [0,2,0,0,0,0|2,0,0]=4 6317 B9R0.24 CCC(C)COC(=O)CO Amb27425710 [0,2,0,0,0,0|1,0,0]=3 6318 B9R0.24 CCC(C)C\C=C(\C)C=O Amb27493317 [0,2,0,0,0,0|1,0,1]=4 6319 B9R0.24 CCC(C)NCC(=O)OC Amb6687134 [0,2,0,0,0,0|1,0,0]=3 6320 B9R0.24 CCC(C)OCC(=O)CCl Amb27250551 [0,2,0,0,0,0|2,0,0]=4 6321 B9R0.24 CCC(C)SCC(=O)NC Amb28138235 [0,2,0,0,0,0|2,0,0]=4 6322 B9R0.24 CCC(C)SC\C(N)=N\O Amb6680771 [0,2,0,0,0,0|2,0,0]=4 6323 B9R0.24 CCC(C)\C=C/C(=O)OC Amb27760361 [0,2,0,0,0,0|0,0,2]=4 6324 B9R0.24 CCC(C)\C=C\C(=O)OC Amb28049396 [0,2,0,0,0,0|0,0,2]=4 6325 B9R0.24 CCC(Cl)CCC(=O)OC Amb28076681 [0,2,0,0,0,0|1,0,0]=3 6326 B9R0.24 CCC(N)CCC(=O)NC Amb27483390 [0,2,0,0,0,0|2,0,0]=4 6327 B9R0.24 CCC(N)CCC(=O)OC Amb26855249 [0,2,0,0,0,0|1,0,0]=3 6328 B9R0.24 CCC(N)CCC(=O)OC Amb33483211 [0,2,0,0,0,0|1,0,0]=3 6329 B9R0.24 CCC(O)CCC(=O)NN Amb6337544 [0,2,0,0,0,0|2,0,0]=4 6330 B9R0.24 CCC(O)CCC(=O)OC Amb25850223 [0,2,0,0,0,0|1,0,0]=3 6331 B9R0.24 CCN(C)CCC(=O)OC Amb8890963 [0,2,0,0,0,0|1,0,0]=3 6332 B9R0.24 CC[C@@H](O)CCC(=O)OC Amb24561650 [0,2,0,0,0,0|1,0,0]=3 6333 B9R0.24 CNC(=O)CCC(=O)OC Amb17399893 [0,2,0,0,0,0|1,0,1]=4 6334 B9R0.24 CNC(=O)CCC(C)C#N Amb28248720 [0,2,0,0,0,0|1,0,1]=4 6335 B9R0.24 CNC(=O)CCN(C)OC Amb27485562 [0,2,0,0,0,0|2,0,0]=4 6336 B9R0.24 CNC(=O)NCC(C)CO Amb28363662 [0,2,0,0,0,0|2,0,0]=4 6337 B9R0.24 CNC(=O)NC[C@@H](C)OC Amb35637593 [0,2,0,0,0,0|2,0,0]=4 6338 B9R0.24 CNC(=O)NC[C@H](C)OC Amb35641868 [0,2,0,0,0,0|2,0,0]=4 6339 B9R0.24 COC(=O)C#CC(C)CN Amb33168811 [0,2,0,0,0,0|0,0,2]=4 6340 B9R0.24 COC(=O)CCC(=O)CBr Amb33526898 [0,2,0,0,0,0|1,0,1]=4 6341 B9R0.24 COC(=O)CCC(=O)CCl Amb26649344 [0,2,0,0,0,0|1,0,1]=4 6342 B9R0.24 COC(=O)CCC(=O)CN Amb18202127 [0,2,0,0,0,0|1,0,1]=4 6343 B9R0.24 COC(=O)CCC(=O)CN Amb6366854 [0,2,0,0,0,0|1,0,1]=4 6344 B9R0.24 COC(=O)CCC(=O)NO Amb28454716 [0,2,0,0,0,0|1,0,1]=4 6345 B9R0.24 COC(=O)CCC(=O)OC Amb2793094 [0,2,0,0,0,0|1,0,1]=4 6346 B9R0.24 COC(=O)CCC(C)C=O Amb18644121 [0,2,0,0,0,0|0,0,1]=3 6347 B9R0.24 COC(=O)CCC(C)CN Amb26032831 [0,2,0,0,0,0|0,0,0]=2 6348 B9R0.24 COC(=O)CCC(C)CO Amb28319952 [0,2,0,0,0,0|0,0,0]=2 6349 B9R0.24 COC(=O)CCC(C)OC Amb26355788 [0,2,0,0,0,0|0,0,0]=2 6350 B9R0.24 COC(=O)CCC(Cl)C=O Amb27760397 [0,2,0,0,0,0|1,0,1]=4 6351 B9R0.24 COC(=O)CCC(N)CF Amb24517084 [0,2,0,0,0,0|1,0,0]=3 6352 B9R0.24 COC(=O)CCN(C)N=O Amb17618594 [0,2,0,0,0,0|2,0,0]=4 6353 B9R0.24 COC(=O)CCN(C)OC Amb27206937 [0,2,0,0,0,0|1,0,0]=3 6354 B9R0.24 COC(=O)CCS(=O)OC Amb22728623 [0,2,0,0,0,0|2,0,0]=4 6355 B9R0.24 COC(=O)CC[C@@H](C)CN Amb27468094 [0,2,0,0,0,0|0,0,0]=2 6356 B9R0.24 COC(=O)CC[C@@H](C)CO Amb28050698 [0,2,0,0,0,0|0,0,0]=2 6357 B9R0.24 COC(=O)CC[C@@H](O)C#N Amb27763450 [0,2,0,0,0,0|1,0,1]=4 6358 B9R0.24 COC(=O)CC[C@@H](O)CO Amb27761525 [0,2,0,0,0,0|1,0,0]=3 6359 B9R0.24 COC(=O)CC[C@H](N)CF Amb27628411 [0,2,0,0,0,0|1,0,0]=3 6360 B9R0.24 COC(=O)CC[C@H](O)C#N Amb28050749 [0,2,0,0,0,0|1,0,1]=4 6361 B9R0.24 COC(=O)CC[C@H](O)CBr Amb27635803 [0,2,0,0,0,0|1,0,0]=3 6362 B9R0.24 COC(=O)CC\C(C)=N\O Amb28064373 [0,2,0,0,0,0|1,0,1]=4 6363 B9R0.24 COC(=O)CNC(C)C#N Amb17044888 [0,2,0,0,0,0|1,0,1]=4 6364 B9R0.24 COC(=O)C\C=C(\C)CO Amb28050664 [0,2,0,0,0,0|0,0,2]=4 6365 B9R0.24 COC(=O)C\N=C(/C)OC Amb27632931 [0,2,0,0,0,0|1,0,1]=4 6366 B9R0.24 COC(=O)NCC(C)C#N Amb27599655 [0,2,0,0,0,0|1,0,1]=4 6367 B9R0.24 COC(=O)NCC(C)CO Amb28286586 [0,2,0,0,0,0|1,0,0]=3 6368 B9R0.24 COC(=O)NCC(N)CO Amb27598507 [0,2,0,0,0,0|2,0,0]=4 6369 B9R0.24 COC(=O)NCC(O)CO Amb27876174 [0,2,0,0,0,0|2,0,0]=4 6370 B9R0.24 COC(=O)OCC(C)CBr Amb27391484 [0,2,0,0,0,0|1,0,0]=3 6371 B9R0.24 COC(=O)OCC(Cl)CCl Amb27483962 [0,2,0,0,0,0|2,0,0]=4 6372 B9R0.24 COC(=O)\C=C\C(C)CO Amb28454593 [0,2,0,0,0,0|0,0,2]=4 6373 B9R0.24 COC(=S)SCC(C)OC Amb27604357 [0,2,0,0,0,0|1,1,0]=4 6374 B9R0.24 COC(C)CCC(=O)CN Amb27257316 [0,2,0,0,0,0|1,0,0]=3 6375 B9R0.24 COC(C)CCC(=O)NN Amb27232398 [0,2,0,0,0,0|1,0,0]=3 6376 B9R0.24 COC(C)CNC(=O)CN Amb27474446 [0,2,0,0,0,0|2,0,0]=4 6377 B9R0.24 COC(C)CNC(=O)CS Amb27656573 [0,2,0,0,0,0|1,1,0]=4 6378 B9R0.24 C\C=C(/C)CNC(=O)OC Amb28346258 [0,2,0,0,0,0|1,0,1]=4 6379 B9R0.24 [C-]#[N+]C(C)CNC(=O)OC Amb27193602 [0,2,0,0,0,0|1,0,1]=4 6380 B9R0.42 C#CC(O)CC(N)C(C)C Amb28384974 [0,2,0,0,0,0|1,0,1]=4 6381 B9R0.42 C#C[C@@H](O)C[C@@H](N)C(=O)O Amb28321822 [0,2,0,0,0,0|1,0,1]=4 6382 B9R0.42 C=C(C)C(N)CC(C)CC Amb28064517 [0,2,0,0,0,0|2,0,0]=4 6383 B9R0.42 C=C(C)C(O)CC(=O)OC Amb27839501 [0,2,0,0,0,0|0,0,2]=4 6384 B9R0.42 C=C(C)[C@@H](O)CC(=O)OC Amb33199529 [0,2,0,0,0,0|0,0,2]=4 6385 B9R0.42 C=C(C)[C@H](O)CC(=O)OC Amb33199525 [0,2,0,0,0,0|0,0,2]=4 6386 B9R0.42 C=C(C=O)CC(=O)C(C)C Amb28436744 [0,2,0,0,0,0|1,0,1]=4 6387 B9R0.42 C=C(CC(C)CC)C(=O)O Amb27794839 [0,2,0,0,0,0|0,0,1]=3 6388 B9R0.42 C=C(CC(O)CC)C(=O)O Amb27427164 [0,2,0,0,0,0|1,0,1]=4 6389 B9R0.42 C=C(CC(O)CO)C(=O)O Amb28050042 [0,2,0,0,0,0|1,0,1]=4 6390 B9R0.42 C=C(CC)CC(N)C(=O)O Amb28064280 [0,2,0,0,0,0|0,0,2]=4 6391 B9R0.42 C=C(CC)CC(O)C(C)C Amb27855870 [0,2,0,0,0,0|2,0,0]=4 6392 B9R0.42 C=C(CC)C[C@@H](N)C(=O)O Amb26340266 [0,2,0,0,0,0|0,0,2]=4 6393 B9R0.42 C=C(CC)C[C@H](N)C(=O)O Amb25694434 [0,2,0,0,0,0|0,0,2]=4 6394 B9R0.42 C=C(C[C@@H](C)CC)C(C)=O Amb26853718 [0,2,0,0,0,0|1,0,1]=4 6395 B9R0.42 C=CC(=O)C[C@@H](O)C(C)C Amb27212029 [0,2,0,0,0,0|1,0,0]=3 6396 B9R0.42 C=CC(C)C[C@H](C)C(=O)O Amb27788729 [0,2,0,0,0,0|0,0,1]=3 6397 B9R0.42 C=CC(C)O[C@H](C)C(=O)O Amb27863058 [0,2,0,0,0,0|1,0,1]=4 6398 B9R0.42 C=CC(C)SC(C)C(=O)O Amb18310581 [0,2,0,0,0,0|1,0,1]=4 6399 B9R0.42 C=C[C@H](C)C[C@@H](C)C(C)=O Amb27787532 [0,2,0,0,0,0|1,0,1]=4 6400 B9R0.42 CC(=O)C(C)CC(C)C#N Amb18643436 [0,2,0,0,0,0|1,0,1]=4 6401 B9R0.42 CC(=O)C(C)CC(O)CO Amb27616537 [0,2,0,0,0,0|2,0,0]=4 6402 B9R0.42 CC(=O)C(C)OC(C)CN Amb18110684 [0,2,0,0,0,0|2,0,0]=4 6403 B9R0.42 CC(=O)C(O)CC(O)CO Amb28049878 [0,2,0,0,0,0|2,0,0]=4 6404 B9R0.42 CC(C#N)CC(N)C(=O)O Amb25262927 [0,2,0,0,0,0|0,0,1]=3 6405 B9R0.42 CC(C#N)CC(N)C(N)=O Amb33035593 [0,2,0,0,0,0|1,0,1]=4 6406 B9R0.42 CC(C#N)C[C@@H](N)C(=O)O Amb33127539 [0,2,0,0,0,0|0,0,1]=3 6407 B9R0.42 CC(C#N)C[C@H](N)C(=O)O Amb33036873 [0,2,0,0,0,0|0,0,1]=3 6408 B9R0.42 CC(C#N)O[C@H](C)C(=O)O Amb27847636 [0,2,0,0,0,0|1,0,1]=4 6409 B9R0.42 CC(C)C(C)NC(=O)CBr Amb27222957 [0,2,0,0,0,0|2,0,0]=4 6410 B9R0.42 CC(C)C(C)NC(=O)CCl Amb385410 [0,2,0,0,0,0|2,0,0]=4 6411 B9R0.42 CC(C)C(C)OC(=O)CCl Amb28142831 [0,2,0,0,0,0|2,0,0]=4 6412 B9R0.42 CC(C)C(N)CC(O)CF Amb33220389 [0,2,0,0,0,0|1,0,1]=4 6413 B9R0.42 CC(C)C(N)CC(O)CO Amb27468412 [0,2,0,0,0,0|0,0,2]=4 6414 B9R0.42 CC(C)[C@@H](O)C[C@@H](C)CO Amb27839231 [0,2,0,0,0,0|1,0,1]=4 6415 B9R0.42 CC(C)[C@H](C)NC(=O)CBr Amb28315593 [0,2,0,0,0,0|2,0,0]=4 6416 B9R0.42 CC(C)[C@H](O)CC(=O)NN Amb28050746 [0,2,0,0,0,0|1,0,0]=3 6417 B9R0.42 CC(C=O)CC(C)C(C)C Amb27169390 [0,2,0,0,0,0|1,0,1]=4 6418 B9R0.42 CC(CC(=O)CCl)C(=O)O Amb24585160 [0,2,0,0,0,0|1,0,1]=4 6419 B9R0.42 CC(CF)CC(N)C(=O)O Amb27838056 [0,2,0,0,0,0|0,0,0]=2 6420 B9R0.42 CC(CN(C)C#N)C(=O)O Amb35593372 [0,2,0,0,0,0|1,0,1]=4 6421 B9R0.42 CC(CN)NC(=O)C(=O)O Amb28340502 [0,2,0,0,0,0|1,0,1]=4 6422 B9R0.42 CC(CN)NC(C)C(N)=O Amb27839468 [0,2,0,0,0,0|2,0,0]=4 6423 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [0,2,0,0,0,0|0,0,0]=2 6424 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [0,2,0,0,0,0|0,0,0]=2 6425 B9R0.42 CC(CO)CC(N)C(N)=O Amb32787927 [0,2,0,0,0,0|1,0,0]=3 6426 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [0,2,0,0,0,0|0,0,0]=2 6427 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [0,2,0,0,0,0|0,0,0]=2 6428 B9R0.42 CC(CO)NC(C)C(N)=O Amb9360038 [0,2,0,0,0,0|2,0,0]=4 6429 B9R0.42 CC(CO)OC(C)C(=O)O Amb27664032 [0,2,0,0,0,0|1,0,0]=3 6430 B9R0.42 CC(CO)O[C@@H](C)C(=O)O Amb28255959 [0,2,0,0,0,0|1,0,0]=3 6431 B9R0.42 CC(CO)O[C@H](C)C(=O)O Amb27450794 [0,2,0,0,0,0|1,0,0]=3 6432 B9R0.42 CC(CO)SC(C)C(N)=O Amb27664026 [0,2,0,0,0,0|2,0,0]=4 6433 B9R0.42 CC(CO)SC(F)C(=O)O Amb28205607 [0,2,0,0,0,0|1,0,0]=3 6434 B9R0.42 CC(C[C@H](N)CS)C(=O)O Amb27981242 [0,2,0,0,0,0|1,0,0]=3 6435 B9R0.42 CC(C\C(N)=N\O)N(C)C Amb24549714 [0,2,0,0,0,0|2,0,0]=4 6436 B9R0.42 CC(C\C(N)=N\O)N(C)C Amb32656077 [0,2,0,0,0,0|2,0,0]=4 6437 B9R0.42 CC(N[C@@H](C)CF)C(N)=O Amb28315959 [0,2,0,0,0,0|2,0,0]=4 6438 B9R0.42 CC(O)C(O)CC(=O)C=O Amb28201309 [0,2,0,0,0,0|1,0,1]=4 6439 B9R0.42 CC(O)C(O)CC(=O)CO Amb27615146 [0,2,0,0,0,0|1,0,0]=3 6440 B9R0.42 CC(O)[C@H](C)C[C@H](C)CO Amb28050593 [0,2,0,0,0,0|1,0,1]=4 6441 B9R0.42 CCC(=O)CC(=O)C(C)C Amb9775083 [0,2,0,0,0,0|1,0,1]=4 6442 B9R0.42 CCC(=O)CC(N)C(=O)O Amb22546324 [0,2,0,0,0,0|1,0,1]=4 6443 B9R0.42 CCC(=O)CC(N)C(=O)O Amb24479073 [0,2,0,0,0,0|1,0,1]=4 6444 B9R0.42 CCC(=O)CC(O)C(=O)O Amb27655574 [0,2,0,0,0,0|1,0,1]=4 6445 B9R0.42 CCC(=O)CS(=O)C(C)C Amb27838993 [0,2,0,0,0,0|2,0,0]=4 6446 B9R0.42 CCC(=O)C[C@@H](N)C(=O)O Amb26061186 [0,2,0,0,0,0|1,0,1]=4 6447 B9R0.42 CCC(=O)C[C@H](N)C(=O)O Amb24479266 [0,2,0,0,0,0|1,0,1]=4 6448 B9R0.42 CCC(=O)NC(C)C(C)C Amb23329699 [0,2,0,0,0,0|2,0,0]=4 6449 B9R0.42 CCC(=O)OC(Br)C(C)C Amb28344177 [0,2,0,0,0,0|2,0,0]=4 6450 B9R0.42 CCC(=O)OC(Cl)C(C)C Amb8393725 [0,2,0,0,0,0|2,0,0]=4 6451 B9R0.42 CCC(=O)OC(N)C(C)C Amb28240454 [0,2,0,0,0,0|2,0,0]=4 6452 B9R0.42 CCC(C)CC(=O)C(=O)O Amb27600368 [0,2,0,0,0,0|0,0,1]=3 6453 B9R0.42 CCC(C)CC(Br)C(C)=O Amb27224857 [0,2,0,0,0,0|1,0,0]=3 6454 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [0,2,0,0,0,0|0,0,0]=2 6455 B9R0.42 CCC(C)CC(C)C(C)O Amb24478003 [0,2,0,0,0,0|1,0,1]=4 6456 B9R0.42 CCC(C)CC(Cl)C(=O)O Amb28050903 [0,2,0,0,0,0|0,0,0]=2 6457 B9R0.42 CCC(C)CC(Cl)C(N)=O Amb27669368 [0,2,0,0,0,0|1,0,0]=3 6458 B9R0.42 CCC(C)CC(N)C(=O)O Amb18313985 [0,2,0,0,0,0|0,0,0]=2 6459 B9R0.42 CCC(C)CC(N)C(=O)O Amb20667726 [0,2,0,0,0,0|0,0,0]=2 6460 B9R0.42 CCC(C)CC(N)C(N)=O Amb26989566 [0,2,0,0,0,0|1,0,0]=3 6461 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [0,2,0,0,0,0|0,0,0]=2 6462 B9R0.42 CCC(C)CC(S)C(=O)O Amb18798152 [0,2,0,0,0,0|0,0,0]=2 6463 B9R0.42 CCC(C)CN(C)C(=O)Cl Amb27837817 [0,2,0,0,0,0|2,0,0]=4 6464 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [0,2,0,0,0,0|0,0,0]=2 6465 B9R0.42 CCC(C)C[C@@H](N)C(=O)O Amb25127143 [0,2,0,0,0,0|0,0,0]=2 6466 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [0,2,0,0,0,0|0,0,0]=2 6467 B9R0.42 CCC(C)C[C@H](N)C(=O)O Amb27471067 [0,2,0,0,0,0|0,0,0]=2 6468 B9R0.42 CCC(C)C[C@H](N)C(N)=O Amb27429524 [0,2,0,0,0,0|1,0,0]=3 6469 B9R0.42 CCC(C)NC(=O)C(=O)O Amb9303796 [0,2,0,0,0,0|1,0,1]=4 6470 B9R0.42 CCC(C)NC(C)C(N)=O Amb9203258 [0,2,0,0,0,0|2,0,0]=4 6471 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [0,2,0,0,0,0|1,0,0]=3 6472 B9R0.42 CCC(C)O[C@@H](C)C(=O)O Amb27395318 [0,2,0,0,0,0|1,0,0]=3 6473 B9R0.42 CCC(C)O[C@H](C)C(=O)O Amb27495202 [0,2,0,0,0,0|1,0,0]=3 6474 B9R0.42 CCC(C)SC(C)C(N)=O Amb18800585 [0,2,0,0,0,0|2,0,0]=4 6475 B9R0.42 CCC(C)SC(F)C(=O)O Amb27272834 [0,2,0,0,0,0|1,0,0]=3 6476 B9R0.42 CCC(C)\C=C(/C)C(=O)O Amb18643945 [0,2,0,0,0,0|0,0,2]=4 6477 B9R0.42 CCC(C)\C=C(\C)C(=O)O Amb27837721 [0,2,0,0,0,0|0,0,2]=4 6478 B9R0.42 CCC(N)CC(N)C(=O)O Amb27205091 [0,2,0,0,0,0|1,0,0]=3 6479 B9R0.42 CCC(O)CC(C)C(=O)O Amb28348984 [0,2,0,0,0,0|1,0,0]=3 6480 B9R0.42 CCC(O)CC(Cl)C(=O)O Amb28244776 [0,2,0,0,0,0|1,0,0]=3 6481 B9R0.42 CCC(O)CC(N)C(=O)O Amb24117068 [0,2,0,0,0,0|1,0,0]=3 6482 B9R0.42 CCC(O)CC(N)C(C)C Amb27838019 [0,2,0,0,0,0|1,0,1]=4 6483 B9R0.42 CCC(O)CC(N)C(N)=O Amb33308821 [0,2,0,0,0,0|2,0,0]=4 6484 B9R0.42 CCC(O)CC(O)C(=O)O Amb28050169 [0,2,0,0,0,0|1,0,0]=3 6485 B9R0.42 CCC(O)C[C@@H](N)C(=O)O Amb33065603 [0,2,0,0,0,0|1,0,0]=3 6486 B9R0.42 CCC(O)C[C@H](N)C(=O)O Amb24759913 [0,2,0,0,0,0|1,0,0]=3 6487 B9R0.42 CCN(C)CC(C)C(=O)O Amb8428202 [0,2,0,0,0,0|1,0,0]=3 6488 B9R0.42 CCN(C)CC(C)C(=O)O Amb9173364 [0,2,0,0,0,0|1,0,0]=3 6489 B9R0.42 CCN(C)CC(N)C(=O)O Amb27478110 [0,2,0,0,0,0|1,0,0]=3 6490 B9R0.42 CCN(C)CC(N)C(N)=O Amb27768725 [0,2,0,0,0,0|2,0,0]=4 6491 B9R0.42 CCS(=O)CC(C)C(=O)O Amb19012076 [0,2,0,0,0,0|2,0,0]=4 6492 B9R0.42 CCS(=O)CC(N)C(C)C Amb27837871 [0,2,0,0,0,0|2,0,0]=4 6493 B9R0.42 CCS(=O)CC(O)C(=O)O Amb28342085 [0,2,0,0,0,0|2,0,0]=4 6494 B9R0.42 CCS(=O)C[C@H](N)C(=O)O Amb28118843 [0,2,0,0,0,0|2,0,0]=4 6495 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [0,2,0,0,0,0|0,0,0]=2 6496 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [0,2,0,0,0,0|0,0,0]=2 6497 B9R0.42 CC[C@@H](O)C[C@@H](N)C(C)C Amb27204219 [0,2,0,0,0,0|1,0,1]=4 6498 B9R0.42 CC[C@@H](O)C[C@H](N)C(C)C Amb19929610 [0,2,0,0,0,0|1,0,1]=4 6499 B9R0.42 CC[C@H](C)CC(=O)C(=O)O Amb27473360 [0,2,0,0,0,0|0,0,1]=3 6500 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [0,2,0,0,0,0|0,0,0]=2 6501 B9R0.42 CC[C@H](C)CC(N)C(=O)O Amb28364291 [0,2,0,0,0,0|0,0,0]=2 6502 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [0,2,0,0,0,0|0,0,0]=2 6503 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb25662528 [0,2,0,0,0,0|0,0,0]=2 6504 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb33620552 [0,2,0,0,0,0|0,0,0]=2 6505 B9R0.42 CC[C@H](C)\C=C(/C)C(=O)O Amb27831923 [0,2,0,0,0,0|0,0,2]=4 6506 B9R0.42 CNC(=O)CC(C)C(C)N Amb23536745 [0,2,0,0,0,0|2,0,0]=4 6507 B9R0.42 CNC(=O)CC(N)C(=O)O Amb27839034 [0,2,0,0,0,0|1,0,1]=4 6508 B9R0.42 CNC(=O)CC(N)C(C)C Amb28325378 [0,2,0,0,0,0|1,0,0]=3 6509 B9R0.42 CNC(=O)CN(C)C(C)C Amb27982658 [0,2,0,0,0,0|2,0,0]=4 6510 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O Amb20240891 [0,2,0,0,0,0|1,0,1]=4 6511 B9R0.42 CNC(C)CC(C)S(C)=O Amb27437059 [0,2,0,0,0,0|2,0,0]=4 6512 B9R0.42 COC(=O)CC(=O)C(C)Br Amb19888842 [0,2,0,0,0,0|1,0,1]=4 6513 B9R0.42 COC(=O)CC(=O)C(C)C Amb2689576 [0,2,0,0,0,0|0,0,1]=3 6514 B9R0.42 COC(=O)CC(=O)C(C)Cl Amb27592185 [0,2,0,0,0,0|1,0,1]=4 6515 B9R0.42 COC(=O)CC(=O)C(C)F Amb24589068 [0,2,0,0,0,0|1,0,1]=4 6516 B9R0.42 COC(=O)CC(=O)C(C)O Amb27827292 [0,2,0,0,0,0|1,0,1]=4 6517 B9R0.42 COC(=O)CC(=O)N(C)C Amb17399891 [0,2,0,0,0,0|1,0,1]=4 6518 B9R0.42 COC(=O)CC(Br)C(=O)O Amb18656998 [0,2,0,0,0,0|1,0,1]=4 6519 B9R0.42 COC(=O)CC(Br)C(C)=O Amb17403794 [0,2,0,0,0,0|1,0,1]=4 6520 B9R0.42 COC(=O)CC(C)C(=O)O Amb18644239 [0,2,0,0,0,0|1,0,1]=4 6521 B9R0.42 COC(=O)CC(C)N(C)C Amb9399294 [0,2,0,0,0,0|1,0,0]=3 6522 B9R0.42 COC(=O)CC(Cl)C(=O)O Amb32941126 [0,2,0,0,0,0|1,0,1]=4 6523 B9R0.42 COC(=O)CC(Cl)C(C)=O Amb25061154 [0,2,0,0,0,0|1,0,1]=4 6524 B9R0.42 COC(=O)CC(N)C(=O)O Amb22489498 [0,2,0,0,0,0|1,0,1]=4 6525 B9R0.42 COC(=O)CC(N)C(=O)O Amb7172558 [0,2,0,0,0,0|1,0,1]=4 6526 B9R0.42 COC(=O)CC(N)C(=O)O Amb8390391 [0,2,0,0,0,0|1,0,1]=4 6527 B9R0.42 COC(=O)CC(N)C(C)C Amb22168224 [0,2,0,0,0,0|0,0,0]=2 6528 B9R0.42 COC(=O)CC(N)C(C)C Amb26870018 [0,2,0,0,0,0|0,0,0]=2 6529 B9R0.42 COC(=O)CC(O)C(=O)O Amb25786182 [0,2,0,0,0,0|1,0,1]=4 6530 B9R0.42 COC(=O)CC(O)C(C)C Amb24423234 [0,2,0,0,0,0|0,0,0]=2 6531 B9R0.42 COC(=O)CC(O)C(C)N Amb27429441 [0,2,0,0,0,0|1,0,0]=3 6532 B9R0.42 COC(=O)CC(O)C(C)O Amb27969056 [0,2,0,0,0,0|1,0,0]=3 6533 B9R0.42 COC(=O)CC(O)C(F)F Amb26541815 [0,2,0,0,0,0|2,0,0]=4 6534 B9R0.42 COC(=O)CC(O)[C@H](C)O Amb27455910 [0,2,0,0,0,0|1,0,0]=3 6535 B9R0.42 COC(=O)CN(C)C(C)C Amb7757820 [0,2,0,0,0,0|1,0,0]=3 6536 B9R0.42 COC(=O)C[C@@H](C)C(=O)O Amb3939892 [0,2,0,0,0,0|1,0,1]=4 6537 B9R0.42 COC(=O)C[C@@H](C)C(C)=O Amb26846867 [0,2,0,0,0,0|1,0,1]=4 6538 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb22745861 [0,2,0,0,0,0|1,0,1]=4 6539 B9R0.42 COC(=O)C[C@@H](N)C(=O)O Amb8385327 [0,2,0,0,0,0|1,0,1]=4 6540 B9R0.42 COC(=O)C[C@@H](N)C(C)C Amb26391960 [0,2,0,0,0,0|0,0,0]=2 6541 B9R0.42 COC(=O)C[C@@H](N)C(C)C Amb30640927 [0,2,0,0,0,0|0,0,0]=2 6542 B9R0.42 COC(=O)C[C@@H](N)[C@@H](C)O Amb28340873 [0,2,0,0,0,0|1,0,0]=3 6543 B9R0.42 COC(=O)C[C@@H](O)C(=O)O Amb23603858 [0,2,0,0,0,0|1,0,1]=4 6544 B9R0.42 COC(=O)C[C@@H](O)C(C)C Amb25847717 [0,2,0,0,0,0|0,0,0]=2 6545 B9R0.42 COC(=O)C[C@@H](O)C(F)F Amb32811475 [0,2,0,0,0,0|2,0,0]=4 6546 B9R0.42 COC(=O)C[C@@H](O)[C@H](C)N Amb27429613 [0,2,0,0,0,0|1,0,0]=3 6547 B9R0.42 COC(=O)C[C@H](Br)C(=O)O Amb26619839 [0,2,0,0,0,0|1,0,1]=4 6548 B9R0.42 COC(=O)C[C@H](C)C(=O)O Amb26967622 [0,2,0,0,0,0|1,0,1]=4 6549 B9R0.42 COC(=O)C[C@H](C)C(C)=O Amb26873807 [0,2,0,0,0,0|1,0,1]=4 6550 B9R0.42 COC(=O)C[C@H](N)C(=O)O Amb8629121 [0,2,0,0,0,0|1,0,1]=4 6551 B9R0.42 COC(=O)C[C@H](N)C(C)C Amb23401522 [0,2,0,0,0,0|0,0,0]=2 6552 B9R0.42 COC(=O)C[C@H](N)C(C)C Amb25865860 [0,2,0,0,0,0|0,0,0]=2 6553 B9R0.42 COC(=O)C[C@H](O)C(=O)O Amb25367304 [0,2,0,0,0,0|1,0,1]=4 6554 B9R0.42 COC(=O)C[C@H](O)C(C)C Amb26322416 [0,2,0,0,0,0|0,0,0]=2 6555 B9R0.42 COC(=O)C[C@H](O)C(F)F Amb32811477 [0,2,0,0,0,0|2,0,0]=4 6556 B9R0.42 COC(=O)C[C@H](O)[C@H](C)O Amb28069717 [0,2,0,0,0,0|1,0,0]=3 6557 B9R0.42 COC(=O)NC(C)C(C)S Amb28040967 [0,2,0,0,0,0|2,0,0]=4 6558 B9R0.42 COC(=O)\C=C(/C)C(C)C Amb33472138 [0,2,0,0,0,0|0,0,2]=4 6559 B9R0.42 COC(=O)\C=C(/N)C(C)C Amb32701567 [0,2,0,0,0,0|0,0,2]=4 6560 B9R0.42 COC(=O)\N=C(/N)C(C)C Amb25147336 [0,2,0,0,0,0|1,0,1]=4 6561 B9R0.42 COC(C)CC(=O)C(=O)O Amb27614317 [0,2,0,0,0,0|0,0,1]=3 6562 B9R0.42 COC(C)CC(C)C(C)=O Amb27841945 [0,2,0,0,0,0|1,0,0]=3 6563 B9R0.42 COC(C)CC(N)C(=O)O Amb25147752 [0,2,0,0,0,0|0,0,0]=2 6564 B9R0.42 COC(C)CC(N)C(C)C Amb27975321 [0,2,0,0,0,0|1,0,1]=4 6565 B9R0.42 COC(C)CC(N)C(N)=O Amb25349298 [0,2,0,0,0,0|1,0,0]=3 6566 B9R0.42 COC(C)CC(O)C(=O)O Amb33353368 [0,2,0,0,0,0|0,0,0]=2 6567 B9R0.42 COC(C)CN(C)C(=O)Cl Amb33296838 [0,2,0,0,0,0|2,0,0]=4 6568 B9R0.42 COC(C)C[C@@H](N)C(=O)O Amb24412403 [0,2,0,0,0,0|0,0,0]=2 6569 B9R0.42 COC(C)C[C@H](N)C(=O)O Amb27801695 [0,2,0,0,0,0|0,0,0]=2 6570 B9R0.42 COC(C)\C=C(\C)C(=O)O Amb27432877 [0,2,0,0,0,0|0,0,2]=4 6571 B9R0.42 CSC(=O)OC(Cl)C(C)C Amb27985253 [0,2,0,0,0,0|1,1,0]=4 6572 B9R0.42 CSC(=S)CC(O)C(C)C Amb27977774 [0,2,0,0,0,0|0,2,0]=4 6573 B9R0.42 CSC(C)C[C@H](N)C(=O)O Amb28208334 [0,2,0,0,0,0|0,0,0]=2 6574 B9R0.42 CS[C@@H](C)C[C@@H](N)C(=O)O Amb27755570 [0,2,0,0,0,0|0,0,0]=2 6575 B9R0.42 C[C@@H](CN)NC(=O)C(=O)O Amb28316025 [0,2,0,0,0,0|1,0,1]=4 6576 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [0,2,0,0,0,0|0,0,0]=2 6577 B9R0.42 C[C@@H](CO)NC(=O)C(=O)O Amb28049727 [0,2,0,0,0,0|1,0,1]=4 6578 B9R0.42 C[C@@H](C[C@@H](O)CN)C(=O)O Amb27768864 [0,2,0,0,0,0|1,0,0]=3 6579 B9R0.42 C[C@@H](O)[C@@H](O)C[C@H](O)C=O Amb27617150 [0,2,0,0,0,0|1,0,1]=4 6580 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [0,2,0,0,0,0|0,0,0]=2 6581 B9R0.42 C[C@H](C[C@@H](O)CN)C(=O)O Amb27169198 [0,2,0,0,0,0|1,0,0]=3 6582 B9R0.42 C[C@H](O)[C@H](O)C[C@@H](O)C=O Amb27169403 [0,2,0,0,0,0|1,0,1]=4 6583 B9R0.42 C\C(=C/Cl)CC(N)C(=O)O Amb25934493 [0,2,0,0,0,0|0,0,2]=4 6584 B9R0.42 C\C(=C/Cl)CC(N)C(C)C Amb35616291 [0,2,0,0,0,0|2,0,0]=4 6585 B9R0.42 C\C(=C/Cl)C[C@@H](N)C(=O)O Amb27168937 [0,2,0,0,0,0|0,0,2]=4 6586 B9R0.42 C\C(=C/Cl)C[C@H](N)C(=O)O Amb26888703 [0,2,0,0,0,0|0,0,2]=4 6587 B9R0.42 C\C(=C\C(N)C(C)C)CO Amb28118444 [0,2,0,0,0,0|1,0,1]=4 6588 B9R0.42 C\C=C(/C)C[C@H](N)C(=O)O Amb27827659 [0,2,0,0,0,0|0,0,1]=3 6589 B9R0.42 NC(=O)C(N)CC(O)CF Amb33308795 [0,2,0,0,0,0|2,0,0]=4 6590 B9R0.42 NC(=O)C(N)CC(O)CO Amb33066193 [0,2,0,0,0,0|2,0,0]=4 6591 B9R0.42 NC(CC(=O)CI)C(=O)O Amb27803464 [0,2,0,0,0,0|1,0,1]=4 6592 B9R0.42 NC(CC(=O)CO)C(=O)O Amb18644310 [0,2,0,0,0,0|1,0,1]=4 6593 B9R0.42 NC(CC(F)CO)C(=O)O Amb27632459 [0,2,0,0,0,0|1,0,0]=3 6594 B9R0.42 NC(CC(O)C=O)C(=O)O Amb28126784 [0,2,0,0,0,0|1,0,1]=4 6595 B9R0.42 NC(CC(O)CF)C(=O)O Amb33065776 [0,2,0,0,0,0|1,0,0]=3 6596 B9R0.42 NC(CC(O)CO)C(=O)O Amb18644388 [0,2,0,0,0,0|1,0,0]=3 6597 B9R0.42 NC(CC(O)CO)C(=O)O Amb24117285 [0,2,0,0,0,0|1,0,0]=3 6598 B9R0.42 NCC(F)C[C@H](N)C(=O)O Amb28126719 [0,2,0,0,0,0|1,0,0]=3 6599 B9R0.42 NCC(O)CC(N)C(=O)O Amb30988061 [0,2,0,0,0,0|1,0,0]=3 6600 B9R0.42 NCC(O)CC(O)C(=O)O Amb27170737 [0,2,0,0,0,0|1,0,0]=3 6601 B9R0.42 NC[C@H](O)CC(O)C(=O)O Amb27590744 [0,2,0,0,0,0|1,0,0]=3 6602 B9R0.42 N[C@@H](CC(=O)CCl)C(=O)O Amb27168692 [0,2,0,0,0,0|1,0,1]=4 6603 B9R0.42 N[C@@H](CC(=O)CI)C(=O)O Amb27248631 [0,2,0,0,0,0|1,0,1]=4 6604 B9R0.42 N[C@@H](CC(=O)CO)C(=O)O Amb28050099 [0,2,0,0,0,0|1,0,1]=4 6605 B9R0.42 N[C@@H](CC(O)CCl)C(=O)O Amb27837835 [0,2,0,0,0,0|1,0,0]=3 6606 B9R0.42 N[C@@H](CC(O)CF)C(=O)O Amb33036578 [0,2,0,0,0,0|1,0,0]=3 6607 B9R0.42 N[C@@H](CC(O)CO)C(=O)O Amb25870815 [0,2,0,0,0,0|1,0,0]=3 6608 B9R0.42 N[C@H](CC(O)CF)C(=O)O Amb32796094 [0,2,0,0,0,0|1,0,0]=3 6609 B9R0.42 N[C@H](CC(O)CO)C(=O)O Amb33036156 [0,2,0,0,0,0|1,0,0]=3 6610 B9R0.42 O=C(CBr)C[C@H](O)C(=O)O Amb27876238 [0,2,0,0,0,0|1,0,1]=4 6611 B9R0.42 O=C(O)C(=O)C[C@H](O)CO Amb26605764 [0,2,0,0,0,0|1,0,1]=4 6612 B9R0.42 O=C(O)C(Br)CC(Br)CCl Amb28315583 [0,2,0,0,0,0|1,0,0]=3 6613 B9R0.42 O=C(O)C(O)C[C@H](O)CO Amb27984868 [0,2,0,0,0,0|1,0,0]=3 6614 B9R0.43 C#CC(CC)CCC(N)=O Amb27960862 [0,2,0,0,0,0|1,0,1]=4 6615 B9R0.43 C#CC(CC)NCC(=O)O Amb28453722 [0,2,0,0,0,0|1,0,1]=4 6616 B9R0.43 C=C(C)CCC(CC)CC Amb28134762 [0,2,0,0,0,0|2,0,0]=4 6617 B9R0.43 C=C(C)CCC(CC)NC Amb27458876 [0,2,0,0,0,0|2,0,0]=4 6618 B9R0.43 C=C[C@@H](CO)SCC(=O)O Amb27634822 [0,2,0,0,0,0|1,0,1]=4 6619 B9R0.43 CC(=O)OCC(CO)CO Amb27839393 [0,2,0,0,0,0|2,0,0]=4 6620 B9R0.43 CC(=O)SCC(CN)CN Amb28995117 [0,2,0,0,0,0|2,0,0]=4 6621 B9R0.43 CC(C)CCP(CO)CO Amb27457678 [0,2,0,0,0,0|1,0,1]=4 6622 B9R0.43 CC(O)CC\C(=C\Cl)CO Amb27974248 [0,2,0,0,0,0|2,0,0]=4 6623 B9R0.43 CCC(C#CC(=O)O)CC Amb27982193 [0,2,0,0,0,0|0,0,2]=4 6624 B9R0.43 CCC(C#CC(=O)O)SC Amb33169062 [0,2,0,0,0,0|0,0,2]=4 6625 B9R0.43 CCC(C#N)CCC(=O)O Amb18643712 [0,2,0,0,0,0|0,0,1]=3 6626 B9R0.43 CCC(C#N)CCC(C)=O Amb18643428 [0,2,0,0,0,0|1,0,1]=4 6627 B9R0.43 CCC(C#N)OCC(=O)O Amb27426226 [0,2,0,0,0,0|1,0,1]=4 6628 B9R0.43 CCC(C#N)SCC(=O)O Amb18182420 [0,2,0,0,0,0|1,0,1]=4 6629 B9R0.43 CCC(C=O)CCC(C)=O Amb18643911 [0,2,0,0,0,0|1,0,1]=4 6630 B9R0.43 CCC(C=O)CCC(C)C Amb27876026 [0,2,0,0,0,0|1,0,1]=4 6631 B9R0.43 CCC(CBr)CCS(C)=O Amb25292711 [0,2,0,0,0,0|2,0,0]=4 6632 B9R0.43 CCC(CBr)COC(C)=O Amb27831455 [0,2,0,0,0,0|2,0,0]=4 6633 B9R0.43 CCC(CC)CCC(=O)Cl Amb28421704 [0,2,0,0,0,0|1,0,0]=3 6634 B9R0.43 CCC(CC)CCC(=O)O Amb27462787 [0,2,0,0,0,0|0,0,0]=2 6635 B9R0.43 CCC(CC)CCC(C)=O Amb26444168 [0,2,0,0,0,0|1,0,0]=3 6636 B9R0.43 CCC(CC)CCC(C)O Amb4017702 [0,2,0,0,0,0|1,0,1]=4 6637 B9R0.43 CCC(CC)CC[C@@H](C)O Amb28350101 [0,2,0,0,0,0|1,0,1]=4 6638 B9R0.43 CCC(CC)CC[C@H](C)O Amb33313780 [0,2,0,0,0,0|1,0,1]=4 6639 B9R0.43 CCC(CC)CC[N+](=O)[O-] Amb33313764 [0,2,0,0,0,0|1,0,1]=4 6640 B9R0.43 CCC(CC)CNC(C)=O Amb27814537 [0,2,0,0,0,0|2,0,0]=4 6641 B9R0.43 CCC(CC)COC(=O)Cl Amb25142812 [0,2,0,0,0,0|2,0,0]=4 6642 B9R0.43 CCC(CC)COC(C)=O Amb2687794 [0,2,0,0,0,0|2,0,0]=4 6643 B9R0.43 CCC(CC)COC(N)=O Amb28050143 [0,2,0,0,0,0|2,0,0]=4 6644 B9R0.43 CCC(CC)OCC(=O)O Amb28051262 [0,2,0,0,0,0|1,0,0]=3 6645 B9R0.43 CCC(CC)SCC(=O)O Amb28182473 [0,2,0,0,0,0|1,0,0]=3 6646 B9R0.43 CCC(CCC(=O)O)NC Amb27230822 [0,2,0,0,0,0|0,0,0]=2 6647 B9R0.43 CCC(CCC(=O)O)OC Amb26936159 [0,2,0,0,0,0|0,0,0]=2 6648 B9R0.43 CCC(CCC(C)=O)OC Amb26981457 [0,2,0,0,0,0|1,0,0]=3 6649 B9R0.43 CCC(CCC(C)O)OC Amb28050767 [0,2,0,0,0,0|1,0,1]=4 6650 B9R0.43 CCC(CC[C@@H](C)O)OC Amb33325784 [0,2,0,0,0,0|1,0,1]=4 6651 B9R0.43 CCC(CC[C@H](C)O)OC Amb33325785 [0,2,0,0,0,0|1,0,1]=4 6652 B9R0.43 CCC(CC[N+](=O)[O-])OC Amb33325771 [0,2,0,0,0,0|1,0,1]=4 6653 B9R0.43 CCC(CCl)CCS(C)=O Amb24617545 [0,2,0,0,0,0|2,0,0]=4 6654 B9R0.43 CCC(CNC(N)=O)OC Amb28184895 [0,2,0,0,0,0|2,0,0]=4 6655 B9R0.43 CCC(CO)CCC(C)=O Amb8395984 [0,2,0,0,0,0|1,0,0]=3 6656 B9R0.43 CCC(CO)CCC(C)C Amb28126755 [0,2,0,0,0,0|1,0,1]=4 6657 B9R0.43 CCC(CO)CCC(C)O Amb8395987 [0,2,0,0,0,0|1,0,1]=4 6658 B9R0.43 CCC(CO)CCS(C)=O Amb27874513 [0,2,0,0,0,0|2,0,0]=4 6659 B9R0.43 CCC(COC(C)=O)OC Amb24323241 [0,2,0,0,0,0|2,0,0]=4 6660 B9R0.43 CCC(OC)OCC(=O)O Amb33341549 [0,2,0,0,0,0|1,0,0]=3 6661 B9R0.43 CCC(\C=C\C(=O)O)CC Amb24375784 [0,2,0,0,0,0|0,0,2]=4 6662 B9R0.43 CCC(\C=C\C(=O)O)OC Amb33326095 [0,2,0,0,0,0|0,0,2]=4 6663 B9R0.43 CCN(CC)CCC(=O)O Amb6651899 [0,2,0,0,0,0|1,0,0]=3 6664 B9R0.43 CCN(CC)CCC(=O)O Amb8513118 [0,2,0,0,0,0|1,0,0]=3 6665 B9R0.43 CCN(CC)CCC(C)=O Amb965734 [0,2,0,0,0,0|2,0,0]=4 6666 B9R0.43 CCN(CC)CCC(N)=O Amb17231985 [0,2,0,0,0,0|2,0,0]=4 6667 B9R0.43 CCP(CC)CCC(C)=O Amb27267092 [0,2,0,0,0,0|2,0,0]=4 6668 B9R0.43 CCP(CC)CCC(N)=O Amb28399366 [0,2,0,0,0,0|2,0,0]=4 6669 B9R0.43 CC[C@H](C=O)CCC(C)=O Amb24573990 [0,2,0,0,0,0|1,0,1]=4 6670 B9R0.43 CC\C(C=O)=C\CC(C)C Amb27640555 [0,2,0,0,0,0|1,0,1]=4 6671 B9R0.43 CC\C(CCC(=O)O)=N/O Amb27459310 [0,2,0,0,0,0|1,0,1]=4 6672 B9R0.43 CC\C(CCC(C)Cl)=N/O Amb27983792 [0,2,0,0,0,0|2,0,0]=4 6673 B9R0.43 CNC(=NCC(=O)O)NC Amb24478941 [0,2,0,0,0,0|1,0,1]=4 6674 B9R0.43 COC(C#CC(=O)O)OC Amb27769936 [0,2,0,0,0,0|0,0,2]=4 6675 B9R0.43 COC(C#N)CCC(C)C Amb27785242 [0,2,0,0,0,0|1,0,1]=4 6676 B9R0.43 COC(CCC(=N)N)OC Amb4297073 [0,2,0,0,0,0|2,0,0]=4 6677 B9R0.43 COC(CCC(=O)O)OC Amb24657204 [0,2,0,0,0,0|0,0,0]=2 6678 B9R0.43 COC(CCC(C)O)OC Amb25348063 [0,2,0,0,0,0|1,0,1]=4 6679 B9R0.43 COC(CCC(N)=S)OC Amb27163717 [0,2,0,0,0,0|1,1,0]=4 6680 B9R0.43 COC(CCN(=O)=O)OC Amb20619407 [0,2,0,0,0,0|1,0,1]=4 6681 B9R0.43 COC(CC[C@@H](C)O)OC Amb33225618 [0,2,0,0,0,0|1,0,1]=4 6682 B9R0.43 COC(CC[C@H](C)O)OC Amb33342091 [0,2,0,0,0,0|1,0,1]=4 6683 B9R0.43 COC(CC[N+](=O)[O-])OC Amb1088901 [0,2,0,0,0,0|1,0,1]=4 6684 B9R0.43 COC(CCl)COC(C)=O Amb27205285 [0,2,0,0,0,0|2,0,0]=4 6685 B9R0.43 COC(CN)CCC(C)C Amb25975513 [0,2,0,0,0,0|1,0,1]=4 6686 B9R0.43 COC(CNC(C)=O)OC Amb10808671 [0,2,0,0,0,0|2,0,0]=4 6687 B9R0.43 COC(CNC(N)=O)OC Amb16244926 [0,2,0,0,0,0|2,0,0]=4 6688 B9R0.43 COC(CO)CCC(C)C Amb27770508 [0,2,0,0,0,0|0,0,2]=4 6689 B9R0.43 COC(CO)COC(C)=O Amb27838147 [0,2,0,0,0,0|2,0,0]=4 6690 B9R0.43 COC(OC)OCC(=O)O Amb33340630 [0,2,0,0,0,0|1,0,0]=3 6691 B9R0.43 CO[C@@H](CO)COC(C)=O Amb27874052 [0,2,0,0,0,0|2,0,0]=4 6692 B9R0.43 CS(=O)CCC(CBr)CBr Amb27787292 [0,2,0,0,0,0|2,0,0]=4 6693 B9R0.43 CS(=O)CCC(CCl)CCl Amb27449496 [0,2,0,0,0,0|2,0,0]=4 6694 B9R0.43 CSC(=NCC(=O)O)SC Amb28118980 [0,2,0,0,0,0|1,0,1]=4 6695 B9R0.43 C\C=C(/CC)CCC(C)=O Amb25857597 [0,2,0,0,0,0|1,0,1]=4 6696 B9R0.43 N#CC(C#N)CCC(=O)O Amb27790230 [0,2,0,0,0,0|0,0,2]=4 6697 B9R0.43 O=C(O)CSC(CS)CS Amb27400350 [0,2,0,0,0,0|1,0,0]=3 6698 B9R0.48 C#CCC(=O)CCC(C)N Amb28050500 [0,2,0,0,0,0|2,0,0]=4 6699 B9R0.48 C#CCC(=O)CSC(C)C Amb27263103 [0,2,0,0,0,0|2,0,0]=4 6700 B9R0.48 C#CCC(=O)NCC(C)C Amb27641048 [0,2,0,0,0,0|2,0,0]=4 6701 B9R0.48 C#CCN(C)CCC(=O)O Amb17561257 [0,2,0,0,0,0|1,0,0]=3 6702 B9R0.48 C#CCN(C)CCC(C)=O Amb27750362 [0,2,0,0,0,0|2,0,0]=4 6703 B9R0.48 C=C(C)CCC(=O)OCC Amb22270105 [0,2,0,0,0,0|0,0,2]=4 6704 B9R0.48 C=C(CCC)CCC(=O)O Amb27475552 [0,2,0,0,0,0|0,0,2]=4 6705 B9R0.48 C=C=C[C@H](N)CCC(=O)O Amb27391437 [0,2,0,0,0,0|1,0,1]=4 6706 B9R0.48 C=CCC(=O)CCN(C)C Amb28049408 [0,2,0,0,0,0|2,0,0]=4 6707 B9R0.48 C=CCC(=O)CNC(C)C Amb28050361 [0,2,0,0,0,0|2,0,0]=4 6708 B9R0.48 C=CCC(=O)COC(C)C Amb28134581 [0,2,0,0,0,0|2,0,0]=4 6709 B9R0.48 C=CCC(=O)OCC(C)C Amb10807377 [0,2,0,0,0,0|2,0,0]=4 6710 B9R0.48 C=CCC(C)CCC(=O)O Amb27605823 [0,2,0,0,0,0|0,0,0]=2 6711 B9R0.48 C=CCC(O)CCC(C)=O Amb28194573 [0,2,0,0,0,0|2,0,0]=4 6712 B9R0.48 C=CCN(C)CCC(N)=O Amb28365390 [0,2,0,0,0,0|2,0,0]=4 6713 B9R0.48 C=CC[C@@H](O)CCC(C)=O Amb28386579 [0,2,0,0,0,0|2,0,0]=4 6714 B9R0.48 CC#CC(=O)NCC(C)C Amb27594983 [0,2,0,0,0,0|2,0,0]=4 6715 B9R0.48 CC(=O)CCC(C)CC=O Amb28199726 [0,2,0,0,0,0|1,0,0]=3 6716 B9R0.48 CC(=O)CCC(C)CCN Amb27426882 [0,2,0,0,0,0|1,0,0]=3 6717 B9R0.48 CC(=O)CCC(O)CC#N Amb18643714 [0,2,0,0,0,0|2,0,0]=4 6718 B9R0.48 CC(=O)CC[C@@H](C)CCO Amb27944575 [0,2,0,0,0,0|1,0,0]=3 6719 B9R0.48 CC(=O)CC[C@H](C)CC=O Amb27255456 [0,2,0,0,0,0|1,0,0]=3 6720 B9R0.48 CC(=O)CSC(C)CCO Amb27875971 [0,2,0,0,0,0|2,0,0]=4 6721 B9R0.48 CC(=O)NCC(C)CCBr Amb27851099 [0,2,0,0,0,0|2,0,0]=4 6722 B9R0.48 CC(=O)NCC(C)CCCl Amb27162325 [0,2,0,0,0,0|2,0,0]=4 6723 B9R0.48 CC(=O)NCC(C)CCO Amb28364911 [0,2,0,0,0,0|2,0,0]=4 6724 B9R0.48 CC(=O)OCC(C)CC=O Amb18644137 [0,2,0,0,0,0|2,0,0]=4 6725 B9R0.48 CC(=O)OC[C@H](C)CCO Amb27753095 [0,2,0,0,0,0|2,0,0]=4 6726 B9R0.48 CC(C)CCC(=O)CC#N Amb7768256 [0,2,0,0,0,0|1,0,0]=3 6727 B9R0.48 CC(C)CCC(=O)N=C=O Amb25202030 [0,2,0,0,0,0|0,0,1]=3 6728 B9R0.48 CC(C)CCC(=O)NC#N Amb27460826 [0,2,0,0,0,0|1,0,0]=3 6729 B9R0.48 CC(C)CCC(=O)OCCl Amb24480678 [0,2,0,0,0,0|0,0,0]=2 6730 B9R0.48 CC(C)CCC(=O)\C=C\Cl Amb17594013 [0,2,0,0,0,0|1,0,0]=3 6731 B9R0.48 CC(C)CCC(C)N=C=O Amb27870889 [0,2,0,0,0,0|1,0,1]=4 6732 B9R0.48 CC(C)CCC(O)CC#N Amb28320835 [0,2,0,0,0,0|1,0,1]=4 6733 B9R0.48 CC(C)CCC(O)CCN Amb25254667 [0,2,0,0,0,0|1,0,1]=4 6734 B9R0.48 CC(C)CCS(=O)CCN Amb27263412 [0,2,0,0,0,0|2,0,0]=4 6735 B9R0.48 CC(C)CC\C([O-])=C\C#N Amb32712089 [0,2,0,0,0,0|1,0,1]=4 6736 B9R0.48 CC(C)CNC(=N)CCO Amb28401358 [0,2,0,0,0,0|2,0,0]=4 6737 B9R0.48 CC(C)CNC(=O)C#CBr Amb27882317 [0,2,0,0,0,0|2,0,0]=4 6738 B9R0.48 CC(C)CNC(=O)CC#N Amb1673126 [0,2,0,0,0,0|2,0,0]=4 6739 B9R0.48 CC(C)CNC(=O)CCBr Amb17324139 [0,2,0,0,0,0|2,0,0]=4 6740 B9R0.48 CC(C)CNC(=O)CCCl Amb1139656 [0,2,0,0,0,0|2,0,0]=4 6741 B9R0.48 CC(C)CNC(=O)CCN Amb1131997 [0,2,0,0,0,0|2,0,0]=4 6742 B9R0.48 CC(C)CNC(=O)CCN Amb21957035 [0,2,0,0,0,0|2,0,0]=4 6743 B9R0.48 CC(C)CNC(=O)CCO Amb17334239 [0,2,0,0,0,0|1,0,0]=3 6744 B9R0.48 CC(C)CNC(=O)CCS Amb28200139 [0,2,0,0,0,0|1,1,0]=4 6745 B9R0.48 CC(C)CNC(=O)CNO Amb28072902 [0,2,0,0,0,0|1,0,0]=3 6746 B9R0.48 CC(C)CNC(=O)\C=C\Br Amb26946868 [0,2,0,0,0,0|2,0,0]=4 6747 B9R0.48 CC(C)CNC(=O)\C=C\Cl Amb26629544 [0,2,0,0,0,0|2,0,0]=4 6748 B9R0.48 CC(C)COC(=O)CC#N Amb8514814 [0,2,0,0,0,0|2,0,0]=4 6749 B9R0.48 CC(C)COC(=O)CCCl Amb27254306 [0,2,0,0,0,0|2,0,0]=4 6750 B9R0.48 CC(C)COC(=O)CCN Amb27462887 [0,2,0,0,0,0|2,0,0]=4 6751 B9R0.48 CC(C)COC(=O)N=C=O Amb27212650 [0,2,0,0,0,0|1,0,1]=4 6752 B9R0.48 CC(C)COC(=O)OCCl Amb27847524 [0,2,0,0,0,0|1,0,0]=3 6753 B9R0.48 CC(C)NNC(=O)CCO Amb28050638 [0,2,0,0,0,0|2,0,0]=4 6754 B9R0.48 CC(C)OCC(=O)CCN Amb24550934 [0,2,0,0,0,0|2,0,0]=4 6755 B9R0.48 CC(C)OCC(=O)N=C=O Amb27475800 [0,2,0,0,0,0|1,0,1]=4 6756 B9R0.48 CC(C)\C=C\C(=O)\C=C\O Amb27427742 [0,2,0,0,0,0|0,0,2]=4 6757 B9R0.48 CC(CC=O)CCC(=O)O Amb27439382 [0,2,0,0,0,0|0,0,0]=2 6758 B9R0.48 CC(CCC(=O)O)N=C=O Amb33471389 [0,2,0,0,0,0|0,0,1]=3 6759 B9R0.48 CC(CCC(=O)O)N=C=S Amb33471622 [0,2,0,0,0,0|0,0,1]=3 6760 B9R0.48 CC(CCCl)CCC(=O)O Amb27834348 [0,2,0,0,0,0|0,0,0]=2 6761 B9R0.48 CC(CCN)CCC(=O)O Amb18124749 [0,2,0,0,0,0|0,0,0]=2 6762 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [0,2,0,0,0,0|1,0,0]=3 6763 B9R0.48 CC(CCN)CNC(N)=O Amb27455693 [0,2,0,0,0,0|2,0,0]=4 6764 B9R0.48 CC(CCN)SCC(=O)O Amb27244497 [0,2,0,0,0,0|1,0,0]=3 6765 B9R0.48 CC(CCN)SCC(N)=O Amb27234451 [0,2,0,0,0,0|2,0,0]=4 6766 B9R0.48 CC(CCO)NCC(=O)O Amb27174877 [0,2,0,0,0,0|1,0,0]=3 6767 B9R0.48 CC(CCO)NCC(N)=O Amb27857723 [0,2,0,0,0,0|2,0,0]=4 6768 B9R0.48 CC(CCS)CCC(=O)O Amb28291582 [0,2,0,0,0,0|0,0,0]=2 6769 B9R0.48 CC(\C=C\C(=O)O)CCO Amb27646330 [0,2,0,0,0,0|0,0,2]=4 6770 B9R0.48 CCCC(=O)CCC(C)C Amb9031590 [0,2,0,0,0,0|1,0,0]=3 6771 B9R0.48 CCCC(=O)CCC(C)N Amb27866591 [0,2,0,0,0,0|2,0,0]=4 6772 B9R0.48 CCCC(=O)CCN(C)C Amb28422505 [0,2,0,0,0,0|2,0,0]=4 6773 B9R0.48 CCCC(=O)CNC(C)C Amb27391405 [0,2,0,0,0,0|2,0,0]=4 6774 B9R0.48 CCCC(=O)COC(C)C Amb27869454 [0,2,0,0,0,0|2,0,0]=4 6775 B9R0.48 CCCC(=O)OCC(C)C Amb4017886 [0,2,0,0,0,0|2,0,0]=4 6776 B9R0.48 CCCC(C)C#CC(=O)O Amb27981033 [0,2,0,0,0,0|0,0,2]=4 6777 B9R0.48 CCCC(C)CCB(O)O Amb25104756 [0,2,0,0,0,0|1,0,1]=4 6778 B9R0.48 CCCC(C)CCC(=O)O Amb28193257 [0,2,0,0,0,0|0,0,0]=2 6779 B9R0.48 CCCC(C)CCC(C)=O Amb10807385 [0,2,0,0,0,0|1,0,0]=3 6780 B9R0.48 CCCC(C)CCC(C)O Amb26868390 [0,2,0,0,0,0|1,0,1]=4 6781 B9R0.48 CCCC(C)CC[C@@H](C)O Amb33321144 [0,2,0,0,0,0|1,0,1]=4 6782 B9R0.48 CCCC(C)CC[C@H](C)O Amb33321145 [0,2,0,0,0,0|1,0,1]=4 6783 B9R0.48 CCCC(C)CC[N+](=O)[O-] Amb33321108 [0,2,0,0,0,0|1,0,1]=4 6784 B9R0.48 CCCC(C)COC(C)=O Amb22735194 [0,2,0,0,0,0|2,0,0]=4 6785 B9R0.48 CCCC(C)OCC(=O)O Amb18124782 [0,2,0,0,0,0|1,0,0]=3 6786 B9R0.48 CCCC(C)OCC(C)=O Amb27444940 [0,2,0,0,0,0|2,0,0]=4 6787 B9R0.48 CCCC(C)SCC(C)=O Amb28280192 [0,2,0,0,0,0|2,0,0]=4 6788 B9R0.48 CCCC(C)\C=C\C(=O)O Amb33474963 [0,2,0,0,0,0|0,0,2]=4 6789 B9R0.48 CCCC(Cl)CCC(=O)Cl Amb27831367 [0,2,0,0,0,0|2,0,0]=4 6790 B9R0.48 CCCC(N)CCC(=O)O Amb1014101 [0,2,0,0,0,0|1,0,0]=3 6791 B9R0.48 CCCC(O)CCC(=O)O Amb17689110 [0,2,0,0,0,0|1,0,0]=3 6792 B9R0.48 CCCC(O)CCC(=O)[O-] Amb17778117 [0,2,0,0,0,0|1,0,1]=4 6793 B9R0.48 CCCC(O)CCC(=O)[O-] Amb2386295 [0,2,0,0,0,0|1,0,1]=4 6794 B9R0.48 CCCC(O)CCC(C)C Amb27971606 [0,2,0,0,0,0|1,0,1]=4 6795 B9R0.48 CCCN(C)CCC(=O)O Amb33546079 [0,2,0,0,0,0|1,0,0]=3 6796 B9R0.48 CCCN(C)CCC(=O)O Amb8899165 [0,2,0,0,0,0|1,0,0]=3 6797 B9R0.48 CCCN(C)CCC(N)=O Amb27454732 [0,2,0,0,0,0|2,0,0]=4 6798 B9R0.48 CCCN(O)CCC(=O)O Amb27196070 [0,2,0,0,0,0|2,0,0]=4 6799 B9R0.48 CCCS(=O)CCC(=O)O Amb18792575 [0,2,0,0,0,0|2,0,0]=4 6800 B9R0.48 CCC[C@@H](O)CCC(=O)O Amb28050107 [0,2,0,0,0,0|1,0,0]=3 6801 B9R0.48 CCC[C@H](C)CCC(=O)O Amb24446759 [0,2,0,0,0,0|0,0,0]=2 6802 B9R0.48 CCC[C@H](O)CCC(=O)O Amb27618330 [0,2,0,0,0,0|1,0,0]=3 6803 B9R0.48 CCC[C@H](O)CCC(N)=O Amb27765010 [0,2,0,0,0,0|2,0,0]=4 6804 B9R0.48 CCNC(=N)CCC(C)C Amb27255688 [0,2,0,0,0,0|2,0,0]=4 6805 B9R0.48 CCNC(=O)CCC(=O)O Amb2967295 [0,2,0,0,0,0|1,0,1]=4 6806 B9R0.48 CCNC(=O)CCC(C)N Amb28195386 [0,2,0,0,0,0|2,0,0]=4 6807 B9R0.48 CCNC(=O)CCC(C)O Amb17334243 [0,2,0,0,0,0|2,0,0]=4 6808 B9R0.48 CCNC(=O)COC(C)C Amb27770601 [0,2,0,0,0,0|2,0,0]=4 6809 B9R0.48 CCNC(=O)NCC(C)C Amb28195283 [0,2,0,0,0,0|2,0,0]=4 6810 B9R0.48 CCN[C@@H](C)CNC(C)=O Amb28137826 [0,2,0,0,0,0|2,0,0]=4 6811 B9R0.48 CCN[C@H](C)CNC(C)=O Amb27267319 [0,2,0,0,0,0|2,0,0]=4 6812 B9R0.48 CCOC(=O)C#CC(C)C Amb10604567 [0,2,0,0,0,0|0,0,2]=4 6813 B9R0.48 CCOC(=O)CC=C(C)C Amb4036274 [0,2,0,0,0,0|0,0,2]=4 6814 B9R0.48 CCOC(=O)CCC(=O)O Amb1151260 [0,2,0,0,0,0|1,0,1]=4 6815 B9R0.48 CCOC(=O)CCC(C)=O Amb4605992 [0,2,0,0,0,0|1,0,1]=4 6816 B9R0.48 CCOC(=O)CCC(C)Br Amb20618752 [0,2,0,0,0,0|1,0,0]=3 6817 B9R0.48 CCOC(=O)CCC(C)C Amb9273760 [0,2,0,0,0,0|0,0,0]=2 6818 B9R0.48 CCOC(=O)CCC(C)N Amb25690130 [0,2,0,0,0,0|1,0,0]=3 6819 B9R0.48 CCOC(=O)CCC(C)N Amb33552104 [0,2,0,0,0,0|1,0,0]=3 6820 B9R0.48 CCOC(=O)CCC(C)O Amb26877286 [0,2,0,0,0,0|1,0,0]=3 6821 B9R0.48 CCOC(=O)CCC(F)F Amb22896370 [0,2,0,0,0,0|2,0,0]=4 6822 B9R0.48 CCOC(=O)CCN(C)C Amb6608740 [0,2,0,0,0,0|1,0,0]=3 6823 B9R0.48 CCOC(=O)CCS(C)=O Amb18788306 [0,2,0,0,0,0|2,0,0]=4 6824 B9R0.48 CCOC(=O)CC[C@@H](C)O Amb27486190 [0,2,0,0,0,0|1,0,0]=3 6825 B9R0.48 CCOC(=O)CC[C@H](C)O Amb28370101 [0,2,0,0,0,0|1,0,0]=3 6826 B9R0.48 CCOC(=O)CNC(C)C Amb19887458 [0,2,0,0,0,0|1,0,0]=3 6827 B9R0.48 CCOC(=O)CNC(C)C Amb6706356 [0,2,0,0,0,0|1,0,0]=3 6828 B9R0.48 CCOC(=O)COC(C)C Amb9206384 [0,2,0,0,0,0|1,0,0]=3 6829 B9R0.48 CCOC(=O)NCC(C)C Amb17862254 [0,2,0,0,0,0|1,0,0]=3 6830 B9R0.48 CCOC(=O)NCC(C)Cl Amb27758631 [0,2,0,0,0,0|2,0,0]=4 6831 B9R0.48 CCOC(=O)NCC(C)N Amb27408678 [0,2,0,0,0,0|2,0,0]=4 6832 B9R0.48 CCOC(=O)NCC(C)O Amb9285612 [0,2,0,0,0,0|2,0,0]=4 6833 B9R0.48 CCOC(=O)NC[C@@H](C)O Amb27786644 [0,2,0,0,0,0|2,0,0]=4 6834 B9R0.48 CCOC(=O)OCC(C)C Amb26419608 [0,2,0,0,0,0|1,0,0]=3 6835 B9R0.48 CCOC(=O)OCC(C)O Amb27763424 [0,2,0,0,0,0|2,0,0]=4 6836 B9R0.48 CCOC(=O)\C=C\C(C)C Amb20247117 [0,2,0,0,0,0|0,0,2]=4 6837 B9R0.48 CCOC(=S)NCC(C)C Amb27949099 [0,2,0,0,0,0|1,1,0]=4 6838 B9R0.48 CCOC(C)CCC(=O)O Amb24690847 [0,2,0,0,0,0|0,0,0]=2 6839 B9R0.48 CCOC(C)CCC(C)=O Amb27859467 [0,2,0,0,0,0|1,0,0]=3 6840 B9R0.48 CCOC(C)CCC(C)O Amb33425313 [0,2,0,0,0,0|1,0,1]=4 6841 B9R0.48 CCOC(C)CC[C@@H](C)O Amb33425310 [0,2,0,0,0,0|1,0,1]=4 6842 B9R0.48 CCOC(C)CC[C@H](C)O Amb33425312 [0,2,0,0,0,0|1,0,1]=4 6843 B9R0.48 CCOC(C)CC[N+](=O)[O-] Amb33425046 [0,2,0,0,0,0|1,0,1]=4 6844 B9R0.48 CCOC(C)CNC(C)=O Amb27174342 [0,2,0,0,0,0|2,0,0]=4 6845 B9R0.48 CCOC(C)COC(C)=O Amb25959518 [0,2,0,0,0,0|2,0,0]=4 6846 B9R0.48 CCOC(C)OCC(=O)O Amb28126960 [0,2,0,0,0,0|1,0,0]=3 6847 B9R0.48 CCOC(C)\C=C\C(=O)O Amb33425399 [0,2,0,0,0,0|0,0,2]=4 6848 B9R0.48 CC\C=C(/C)CCC(=O)O Amb27832037 [0,2,0,0,0,0|0,0,1]=3 6849 B9R0.48 CC\C=C(/C)CCC(C)=O Amb27464326 [0,2,0,0,0,0|1,0,1]=4 6850 B9R0.48 CC\C=C(\C)CCC(=O)O Amb27811548 [0,2,0,0,0,0|0,0,1]=3 6851 B9R0.48 CN(C)CCC(=O)CCN Amb33272649 [0,2,0,0,0,0|2,0,0]=4 6852 B9R0.48 CN(C)CCC(=O)ONN Amb27217216 [0,2,0,0,0,0|1,0,0]=3 6853 B9R0.48 CN(CC#N)CCC(=O)O Amb17561163 [0,2,0,0,0,0|1,0,0]=3 6854 B9R0.48 CN(CC=O)CCC(N)=O Amb27452718 [0,2,0,0,0,0|2,0,0]=4 6855 B9R0.48 CN(CCCl)CCC(=O)O Amb27949173 [0,2,0,0,0,0|1,0,0]=3 6856 B9R0.48 CN(CCN)CCC(=O)O Amb28382339 [0,2,0,0,0,0|1,0,0]=3 6857 B9R0.48 CN(CCO)CCC(=O)Cl Amb17142907 [0,2,0,0,0,0|2,0,0]=4 6858 B9R0.48 CN(CCO)CCC(=O)O Amb5774461 [0,2,0,0,0,0|1,0,0]=3 6859 B9R0.48 CN(CCO)CCC(N)=O Amb17142868 [0,2,0,0,0,0|2,0,0]=4 6860 B9R0.48 CNCC(=O)CCC(C)C Amb28050435 [0,2,0,0,0,0|1,0,0]=3 6861 B9R0.48 CNCC(=O)CCN(C)C Amb33272624 [0,2,0,0,0,0|2,0,0]=4 6862 B9R0.48 CNCC(=O)COC(C)C Amb25302659 [0,2,0,0,0,0|2,0,0]=4 6863 B9R0.48 CNCC(=O)NCC(C)C Amb6248395 [0,2,0,0,0,0|2,0,0]=4 6864 B9R0.48 CNCC(C)C#CC(=O)O Amb33169001 [0,2,0,0,0,0|0,0,2]=4 6865 B9R0.48 CNCC(C)CNC(N)=O Amb28049490 [0,2,0,0,0,0|2,0,0]=4 6866 B9R0.48 CNOC(=O)CCC(=O)O Amb28126710 [0,2,0,0,0,0|1,0,1]=4 6867 B9R0.48 COCC(=O)CC=C(C)C Amb27233842 [0,2,0,0,0,0|0,0,2]=4 6868 B9R0.48 COCC(=O)CCC(=O)O Amb27797755 [0,2,0,0,0,0|1,0,1]=4 6869 B9R0.48 COCC(=O)CCC(C)C Amb28069967 [0,2,0,0,0,0|0,0,0]=2 6870 B9R0.48 COCC(=O)CCC(F)F Amb27424785 [0,2,0,0,0,0|2,0,0]=4 6871 B9R0.48 COCC(=O)CCN(C)C Amb27866944 [0,2,0,0,0,0|1,0,0]=3 6872 B9R0.48 COCC(=O)CNC(C)C Amb27231606 [0,2,0,0,0,0|1,0,0]=3 6873 B9R0.48 COCC(=O)OCC(C)Br Amb33276571 [0,2,0,0,0,0|2,0,0]=4 6874 B9R0.48 COCC(C)C#CC(=O)O Amb33168980 [0,2,0,0,0,0|0,0,2]=4 6875 B9R0.48 COCC(C)NCC(=O)O Amb33549979 [0,2,0,0,0,0|1,0,0]=3 6876 B9R0.48 COCC(C)NCC(=O)O Amb7766445 [0,2,0,0,0,0|1,0,0]=3 6877 B9R0.48 COCC(C)OCC(=O)O Amb27807862 [0,2,0,0,0,0|1,0,0]=3 6878 B9R0.48 COCC(C)OCC(C)=O Amb27632346 [0,2,0,0,0,0|2,0,0]=4 6879 B9R0.48 COCC(Cl)CCC(=O)O Amb27456486 [0,2,0,0,0,0|1,0,0]=3 6880 B9R0.48 COCC(N)CCC(=O)O Amb33036364 [0,2,0,0,0,0|1,0,0]=3 6881 B9R0.48 COCC(O)CCC(=O)O Amb33036250 [0,2,0,0,0,0|1,0,0]=3 6882 B9R0.48 COCC(O)CCC(C)C Amb27625588 [0,2,0,0,0,0|0,0,2]=4 6883 B9R0.48 CONC(=O)CCC(=O)O Amb27839045 [0,2,0,0,0,0|1,0,1]=4 6884 B9R0.48 CONC(=O)CCC(C)C Amb27491099 [0,2,0,0,0,0|0,0,0]=2 6885 B9R0.48 CONC(=O)CSC(C)C Amb27490607 [0,2,0,0,0,0|1,0,0]=3 6886 B9R0.48 CO\N=C(/C)CCC(C)=O Amb24583507 [0,2,0,0,0,0|1,0,1]=4 6887 B9R0.48 CO\N=C(/C)CCC(C)C Amb27255698 [0,2,0,0,0,0|1,0,0]=3 6888 B9R0.48 CSCC(=O)NCC(C)C Amb27593029 [0,2,0,0,0,0|1,1,0]=4 6889 B9R0.48 CSCC(C)NCC(N)=O Amb27865220 [0,2,0,0,0,0|2,0,0]=4 6890 B9R0.48 CSCC(N)CCC(=O)O Amb33272065 [0,2,0,0,0,0|1,0,0]=3 6891 B9R0.48 CSCC(O)CCC(=O)O Amb27490998 [0,2,0,0,0,0|1,0,0]=3 6892 B9R0.48 CSSC(C)CCC(=O)O Amb27843301 [0,2,0,0,0,0|0,0,0]=2 6893 B9R0.48 C[C@@H](CC#N)CCC(=O)O Amb27950078 [0,2,0,0,0,0|0,0,0]=2 6894 B9R0.48 C[C@@H](CCO)CCC(=O)O Amb28250798 [0,2,0,0,0,0|0,0,0]=2 6895 B9R0.48 C[C@H](\C=C\C(=O)O)CCO Amb28050109 [0,2,0,0,0,0|0,0,2]=4 6896 B9R0.48 C\C(=C/C#N)CCC(C)C Amb28193250 [0,2,0,0,0,0|2,0,0]=4 6897 B9R0.48 C\C(=C/C=O)CCC(C)C Amb27268552 [0,2,0,0,0,0|1,0,0]=3 6898 B9R0.48 C\C(=C/CCl)CCC(C)C Amb28340951 [0,2,0,0,0,0|2,0,0]=4 6899 B9R0.48 C\C(=C/CO)CCC(=O)O Amb27630663 [0,2,0,0,0,0|0,0,1]=3 6900 B9R0.48 C\C(=C\CC(C)C)CC=O Amb28247159 [0,2,0,0,0,0|1,0,1]=4 6901 B9R0.48 C\C=C/[C@@H](O)CCC(C)=O Amb25146706 [0,2,0,0,0,0|2,0,0]=4 6902 B9R0.48 C\C=C\C(C)CNC(N)=O Amb22365219 [0,2,0,0,0,0|2,0,0]=4 6903 B9R0.48 C\C=C\C(C)\C=C/C(=O)O Amb27468642 [0,2,0,0,0,0|0,0,2]=4 6904 B9R0.48 C\C=C\C(O)CCC(C)=O Amb25142677 [0,2,0,0,0,0|2,0,0]=4 6905 B9R0.48 C\C=C\C(O)CCC(C)C Amb28125762 [0,2,0,0,0,0|1,0,1]=4 6906 B9R0.48 C\C=N\C(=O)CCC(=O)O Amb27217285 [0,2,0,0,0,0|1,0,1]=4 6907 B9R0.48 N#CCC(=O)CCC(=O)O Amb24053663 [0,2,0,0,0,0|1,0,1]=4 6908 B9R0.48 NC(CCF)CCC(=O)O Amb33480872 [0,2,0,0,0,0|1,0,0]=3 6909 B9R0.48 NC(\C=C\F)CCC(=O)O Amb27221055 [0,2,0,0,0,0|1,0,1]=4 6910 B9R0.48 NCCC(N)CCC(=O)O Amb27390542 [0,2,0,0,0,0|1,0,0]=3 6911 B9R0.48 NCNC(=O)CCC(=O)O Amb27753445 [0,2,0,0,0,0|1,0,1]=4 6912 B9R0.48 N[C@H](CCS)CCC(=O)O Amb27857300 [0,2,0,0,0,0|1,0,0]=3 6913 B9R0.48 O=C(O)CCC(=O)NCO Amb28132582 [0,2,0,0,0,0|1,0,1]=4 6914 B9R0.48 O=C(O)CCC(O)CCO Amb28121295 [0,2,0,0,0,0|1,0,0]=3 6915 B9R0.48 O=CCC(=O)CCC(=O)O Amb18644074 [0,2,0,0,0,0|1,0,1]=4 6916 B9R0.64 C#CC(C)(C)NCC(C)=O Amb1088982 [0,2,0,0,0,0|2,0,0]=4 6917 B9R0.64 C#CC(C)(C)NCC(C)=O Amb22283919 [0,2,0,0,0,0|2,0,0]=4 6918 B9R0.64 C#CC(C)(C)NCC(N)=O Amb27167261 [0,2,0,0,0,0|2,0,0]=4 6919 B9R0.64 C#CC(C)(C)OCC(=O)O Amb27630706 [0,2,0,0,0,0|1,0,0]=3 6920 B9R0.64 C#CC(C)(O)CCC(=O)O Amb27168591 [0,2,0,0,0,0|0,0,1]=3 6921 B9R0.64 C#CC(C)(O)CCC(C)=O Amb27954164 [0,2,0,0,0,0|1,0,1]=4 6922 B9R0.64 C#CC(C)(O)CCC(C)C Amb2721454 [0,2,0,0,0,0|1,0,1]=4 6923 B9R0.64 C=C(C)CCC(C)(C)C=O Amb18643634 [0,2,0,0,0,0|2,0,0]=4 6924 B9R0.64 C=C(C)CCC(C)(C)CN Amb27231016 [0,2,0,0,0,0|2,0,0]=4 6925 B9R0.64 C=C(C)CCC(C)(C)CO Amb27839434 [0,2,0,0,0,0|2,0,0]=4 6926 B9R0.64 C=CC(C)(C)CCC(=O)O Amb28429810 [0,2,0,0,0,0|0,0,0]=2 6927 B9R0.64 C=CC(C)(C)CCC(C)O Amb27197486 [0,2,0,0,0,0|1,0,1]=4 6928 B9R0.64 CC(=O)CCC(C)(C)C#N Amb18124540 [0,2,0,0,0,0|1,0,0]=3 6929 B9R0.64 CC(=O)CCC(C)(C)C=O Amb18643910 [0,2,0,0,0,0|1,0,0]=3 6930 B9R0.64 CC(=O)CCC(C)(C)CO Amb33200191 [0,2,0,0,0,0|1,0,0]=3 6931 B9R0.64 CC(=O)NCC(C)(C)CCl Amb28049432 [0,2,0,0,0,0|2,0,0]=4 6932 B9R0.64 CC(=O)NCC(C)(C)CN Amb25810145 [0,2,0,0,0,0|2,0,0]=4 6933 B9R0.64 CC(=O)SCC(C)(C)CO Amb27983021 [0,2,0,0,0,0|2,0,0]=4 6934 B9R0.64 CC(C)(C#N)CCC(=O)O Amb26858929 [0,2,0,0,0,0|0,0,0]=2 6935 B9R0.64 CC(C)(C#N)CCS(=O)Cl Amb32720568 [0,2,0,0,0,0|2,0,0]=4 6936 B9R0.64 CC(C)(C#N)CCS(=O)[O-] Amb32755028 [0,2,0,0,0,0|1,0,1]=4 6937 B9R0.64 CC(C)(C#N)CCS(N)=O Amb32720579 [0,2,0,0,0,0|2,0,0]=4 6938 B9R0.64 CC(C)(C#N)NCC(=O)O Amb25699825 [0,2,0,0,0,0|1,0,0]=3 6939 B9R0.64 CC(C)(C=O)CCC(=O)O Amb18644118 [0,2,0,0,0,0|0,0,0]=2 6940 B9R0.64 CC(C)(C=O)CCC(N)=O Amb27812357 [0,2,0,0,0,0|1,0,0]=3 6941 B9R0.64 CC(C)(C=O)\C=C/C(=O)O Amb27473340 [0,2,0,0,0,0|0,0,2]=4 6942 B9R0.64 CC(C)(CN)CCC(=O)O Amb27790470 [0,2,0,0,0,0|0,0,0]=2 6943 B9R0.64 CC(C)(CN)CNC(N)=O Amb28364087 [0,2,0,0,0,0|2,0,0]=4 6944 B9R0.64 CC(C)(CN)OCC(N)=O Amb28367964 [0,2,0,0,0,0|2,0,0]=4 6945 B9R0.64 CC(C)(CN)SCC(N)=O Amb27591047 [0,2,0,0,0,0|2,0,0]=4 6946 B9R0.64 CC(C)(CO)CCC(=O)O Amb27173192 [0,2,0,0,0,0|0,0,0]=2 6947 B9R0.64 CC(C)(CO)CC[N+](=O)[O-] Amb33197713 [0,2,0,0,0,0|1,0,1]=4 6948 B9R0.64 CC(C)(CO)CNC(N)=O Amb18831448 [0,2,0,0,0,0|2,0,0]=4 6949 B9R0.64 CC(C)(CO)COC(N)=O Amb8630736 [0,2,0,0,0,0|2,0,0]=4 6950 B9R0.64 CC(C)(CO)OCC(=O)O Amb33202720 [0,2,0,0,0,0|1,0,0]=3 6951 B9R0.64 CC(C)(\C=C\C(=O)O)CO Amb26900319 [0,2,0,0,0,0|0,0,2]=4 6952 B9R0.64 CC(C)CCC(C)(C)C=O Amb24746190 [0,2,0,0,0,0|1,0,1]=4 6953 B9R0.64 CC(C)CCC(C)(C)CO Amb27485276 [0,2,0,0,0,0|1,0,1]=4 6954 B9R0.64 CC(C)CCC(C)(N)CO Amb19009003 [0,2,0,0,0,0|1,0,1]=4 6955 B9R0.64 CC(C)CCC(C)(O)CCl Amb27461453 [0,2,0,0,0,0|1,0,1]=4 6956 B9R0.64 CC(C)CCC(C)(O)CN Amb9295110 [0,2,0,0,0,0|1,0,1]=4 6957 B9R0.64 CC(O)(C#N)CCC(=O)O Amb28050165 [0,2,0,0,0,0|0,0,1]=3 6958 B9R0.64 CC(O)CCC(C)(C)C=O Amb25101824 [0,2,0,0,0,0|1,0,1]=4 6959 B9R0.64 CC(O)CCC(C)(C)CO Amb33200192 [0,2,0,0,0,0|1,0,1]=4 6960 B9R0.64 CC(O)CCC(C)(O)CO Amb27206193 [0,2,0,0,0,0|1,0,1]=4 6961 B9R0.64 CCC(C)(C)C#CC(=O)O Amb27836215 [0,2,0,0,0,0|0,0,2]=4 6962 B9R0.64 CCC(C)(C)CCC(=O)O Amb18644164 [0,2,0,0,0,0|0,0,0]=2 6963 B9R0.64 CCC(C)(C)CCC(C)=O Amb25926360 [0,2,0,0,0,0|1,0,0]=3 6964 B9R0.64 CCC(C)(C)CCC(C)O Amb25168708 [0,2,0,0,0,0|1,0,1]=4 6965 B9R0.64 CCC(C)(C)CCS(=O)Cl Amb32720887 [0,2,0,0,0,0|2,0,0]=4 6966 B9R0.64 CCC(C)(C)CCS(=O)[O-] Amb32755576 [0,2,0,0,0,0|1,0,1]=4 6967 B9R0.64 CCC(C)(C)CCS(N)=O Amb32720855 [0,2,0,0,0,0|2,0,0]=4 6968 B9R0.64 CCC(C)(C)CC[C@@H](C)O Amb33266336 [0,2,0,0,0,0|1,0,1]=4 6969 B9R0.64 CCC(C)(C)CC[C@H](C)O Amb33266337 [0,2,0,0,0,0|1,0,1]=4 6970 B9R0.64 CCC(C)(C)CC[N+](=O)[O-] Amb33266301 [0,2,0,0,0,0|1,0,1]=4 6971 B9R0.64 CCC(C)(C)CNC(=O)Cl Amb35633498 [0,2,0,0,0,0|2,0,0]=4 6972 B9R0.64 CCC(C)(C)CNC(C)=O Amb27217830 [0,2,0,0,0,0|2,0,0]=4 6973 B9R0.64 CCC(C)(C)COC(N)=O Amb28340947 [0,2,0,0,0,0|2,0,0]=4 6974 B9R0.64 CCC(C)(C)OCC(=O)O Amb9208491 [0,2,0,0,0,0|1,0,0]=3 6975 B9R0.64 CCC(C)(C)OCC(C)=O Amb9667104 [0,2,0,0,0,0|2,0,0]=4 6976 B9R0.64 CCC(C)(C)OCC(N)=O Amb27791287 [0,2,0,0,0,0|2,0,0]=4 6977 B9R0.64 CCC(C)(C)\C=C\C(=O)O Amb33428990 [0,2,0,0,0,0|0,0,2]=4 6978 B9R0.64 CCC(C)(N)C#CC(=O)O Amb33168969 [0,2,0,0,0,0|0,0,2]=4 6979 B9R0.64 CCC(C)(N)CCC(=O)O Amb33036311 [0,2,0,0,0,0|0,0,0]=2 6980 B9R0.64 CCC(C)(N)CCS(C)=O Amb27449521 [0,2,0,0,0,0|2,0,0]=4 6981 B9R0.64 CCC(C)(N)COC(N)=O Amb28071815 [0,2,0,0,0,0|2,0,0]=4 6982 B9R0.64 CCC(C)(O)CCC(=O)O Amb25317242 [0,2,0,0,0,0|0,0,0]=2 6983 B9R0.64 CCC(C)(O)CCC(C)C Amb4011931 [0,2,0,0,0,0|1,0,1]=4 6984 B9R0.64 CCC(C)(O)CNC(C)=O Amb27795587 [0,2,0,0,0,0|2,0,0]=4 6985 B9R0.64 CCS(=N)(=O)CCC(C)C Amb32671033 [0,2,0,0,0,0|2,0,0]=4 6986 B9R0.64 CCS(=O)(=O)CCC(=O)O Amb6266853 [0,2,0,0,0,0|2,0,0]=4 6987 B9R0.64 CCS(=O)(=O)CCC(C)C Amb28350869 [0,2,0,0,0,0|1,0,1]=4 6988 B9R0.64 CC[C@](C)(O)CCC(=O)O Amb27810635 [0,2,0,0,0,0|0,0,0]=2 6989 B9R0.64 CNC(C)(C)CNC(C)=O Amb27969171 [0,2,0,0,0,0|2,0,0]=4 6990 B9R0.64 CNC(C)(C)CNC(N)=O Amb28063794 [0,2,0,0,0,0|2,0,0]=4 6991 B9R0.64 CNS(=O)(=O)CCC(=O)O Amb6741778 [0,2,0,0,0,0|2,0,0]=4 6992 B9R0.64 CNS(=O)(=O)CCC(C)C Amb24505094 [0,2,0,0,0,0|1,0,1]=4 6993 B9R0.64 COC(C)(C)C#CC(=O)O Amb25777780 [0,2,0,0,0,0|0,0,2]=4 6994 B9R0.64 COC(C)(C)CCC(=N)N Amb25886208 [0,2,0,0,0,0|2,0,0]=4 6995 B9R0.64 COC(C)(C)CCC(=O)O Amb27835401 [0,2,0,0,0,0|0,0,0]=2 6996 B9R0.64 COC(C)(C)CCC(C)=O Amb25767114 [0,2,0,0,0,0|1,0,0]=3 6997 B9R0.64 COC(C)(C)CCC(C)O Amb25737740 [0,2,0,0,0,0|1,0,1]=4 6998 B9R0.64 COC(C)(C)CCC(N)=S Amb24732987 [0,2,0,0,0,0|1,1,0]=4 6999 B9R0.64 COC(C)(C)CCN(C)O Amb33196325 [0,2,0,0,0,0|2,0,0]=4 7000 B9R0.64 COC(C)(C)CCS(=O)Cl Amb32720668 [0,2,0,0,0,0|2,0,0]=4 7001 B9R0.64 COC(C)(C)CCS(=O)[O-] Amb24504769 [0,2,0,0,0,0|1,0,1]=4 7002 B9R0.64 COC(C)(C)CCS(N)=O Amb32720670 [0,2,0,0,0,0|2,0,0]=4 7003 B9R0.64 COC(C)(C)CC[C@@H](C)O Amb33195938 [0,2,0,0,0,0|1,0,1]=4 7004 B9R0.64 COC(C)(C)CC[C@H](C)O Amb33195939 [0,2,0,0,0,0|1,0,1]=4 7005 B9R0.64 COC(C)(C)CC[N+](=O)[O-] Amb33195907 [0,2,0,0,0,0|1,0,1]=4 7006 B9R0.64 COC(C)(C)CNC(=O)Cl Amb35633399 [0,2,0,0,0,0|2,0,0]=4 7007 B9R0.64 COC(C)(C)CNC(C)=O Amb28255406 [0,2,0,0,0,0|2,0,0]=4 7008 B9R0.64 COC(C)(C)CNC(N)=O Amb28120338 [0,2,0,0,0,0|2,0,0]=4 7009 B9R0.64 CS(=O)CCC(C)(C)C#N Amb28289948 [0,2,0,0,0,0|2,0,0]=4 7010 B9R0.64 CS(=O)CCC(C)(C)C=O Amb25229657 [0,2,0,0,0,0|2,0,0]=4 7011 B9R0.64 CS(=O)CCC(C)(C)CBr Amb25292710 [0,2,0,0,0,0|2,0,0]=4 7012 B9R0.64 CS(=O)CCC(C)(C)CCl Amb26541565 [0,2,0,0,0,0|2,0,0]=4 7013 B9R0.64 CSC(C)(C)CCC(=O)O Amb28245393 [0,2,0,0,0,0|0,0,0]=2 7014 B9R0.64 CSC(C)(C)CNC(=O)Cl Amb35633357 [0,2,0,0,0,0|2,0,0]=4 7015 B9R0.64 C[C@@H](O)CCC(C)(C)CO Amb33198507 [0,2,0,0,0,0|1,0,1]=4 7016 B9R0.64 C[C@H](O)CCC(C)(C)CO Amb33198516 [0,2,0,0,0,0|1,0,1]=4 7017 B9R0.64 O=C(O)CCC(F)(F)CCl Amb27477848 [0,2,0,0,0,0|1,0,0]=3 7018 B9R0.64 O=C(O)CCC(F)(F)CO Amb33620699 [0,2,0,0,0,0|1,0,0]=3 7019 B9R0.64 O=C(O)CCP(=O)(O)CCl Amb27615065 [0,2,0,0,0,0|2,0,0]=4 7020 B9R0.64 O=C(O)CCS(=O)(=O)CF Amb27793811 [0,2,0,0,0,0|2,0,0]=4 7021 B9R0.10 C=C(C)CC(O)C(C)(C)N Amb30024284 [0,2,0,0,0,0|2,0,0]=4 7022 B9R0.10 C=C(C)C[C@H](O)C(C)(C)C Amb28293155 [0,2,0,0,0,0|2,0,0]=4 7023 B9R0.10 CC(=O)CC(=O)C(C)(C)C Amb7764664 [0,2,0,0,0,0|1,0,1]=4 7024 B9R0.10 CC(=O)CC(O)C(C)(C)C Amb28315879 [0,2,0,0,0,0|1,0,0]=3 7025 B9R0.10 CC(=O)CS(=O)C(C)(C)C Amb4166041 [0,2,0,0,0,0|2,0,0]=4 7026 B9R0.10 CC(=O)C[C@H](O)C(C)(C)C Amb27250072 [0,2,0,0,0,0|1,0,0]=3 7027 B9R0.10 CC(=O)OC(Cl)C(C)(C)C Amb28436880 [0,2,0,0,0,0|2,0,0]=4 7028 B9R0.10 CC(C)(C)C(=O)CC(=O)[Na] Amb27762570 [0,2,0,0,0,0|1,0,1]=4 7029 B9R0.10 CC(C)(C)C(=O)CC(N)=O Amb28240438 [0,2,0,0,0,0|1,0,1]=4 7030 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb31307616 [0,2,0,0,0,0|0,0,0]=2 7031 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb8515866 [0,2,0,0,0,0|0,0,0]=2 7032 B9R0.10 CC(C)(C)C(N)CC(N)=O Amb25304992 [0,2,0,0,0,0|1,0,0]=3 7033 B9R0.10 CC(C)(C)C(O)CC(=O)O Amb17232006 [0,2,0,0,0,0|0,0,0]=2 7034 B9R0.10 CC(C)(C)C(O)C[N+](=O)[O-] Amb27631975 [0,2,0,0,0,0|1,0,1]=4 7035 B9R0.10 CC(C)(C)S(=O)CC(=O)O Amb18974534 [0,2,0,0,0,0|1,0,0]=3 7036 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb19888358 [0,2,0,0,0,0|0,0,0]=2 7037 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb33456414 [0,2,0,0,0,0|0,0,0]=2 7038 B9R0.10 CC(C)(C)[C@@H](O)CC(=O)O Amb24505172 [0,2,0,0,0,0|0,0,0]=2 7039 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O Amb33456294 [0,2,0,0,0,0|0,0,0]=2 7040 B9R0.10 CC(C)(C)[C@H](O)CC(=O)O Amb25889023 [0,2,0,0,0,0|0,0,0]=2 7041 B9R0.10 CC(C)(C)[C@H]([NH3+])CC(=O)[O-] Amb22224981 [0,2,0,0,0,0|0,0,1]=3 7042 B9R0.10 CC(C)(C)\C(N)=C\C(=O)O Amb28313951 [0,2,0,0,0,0|0,0,2]=4 7043 B9R0.10 CC(C)(F)C(N)CC(=O)O Amb33273018 [0,2,0,0,0,0|0,0,0]=2 7044 B9R0.10 CC(C)(F)C(O)CC(=O)O Amb33272209 [0,2,0,0,0,0|0,0,0]=2 7045 B9R0.10 CC(C)(F)[C@@H](O)CC(=O)O Amb33272208 [0,2,0,0,0,0|0,0,0]=2 7046 B9R0.10 CC(C)(F)[C@H](O)CC(=O)O Amb33225482 [0,2,0,0,0,0|0,0,0]=2 7047 B9R0.10 CC(C)(S)C(N)CC(=O)O Amb28182470 [0,2,0,0,0,0|0,0,0]=2 7048 B9R0.10 CC(C)(S)C(N)C[PH](=O)O Amb27792834 [0,2,0,0,0,0|1,0,0]=3 7049 B9R0.10 CC(C)CC(C)S(=O)(=O)Cl Amb18324761 [0,2,0,0,0,0|1,0,1]=4 7050 B9R0.10 CC(C)CC(C)S(=O)(=O)F Amb28351601 [0,2,0,0,0,0|1,0,1]=4 7051 B9R0.10 CC(C)CC(C)S(N)(=O)=O Amb18183520 [0,2,0,0,0,0|1,0,1]=4 7052 B9R0.10 CC(C)CC(N)C(C)(C)O Amb26857325 [0,2,0,0,0,0|1,0,1]=4 7053 B9R0.10 CC(C)CC(N)P(=O)(O)O Amb564159 [0,2,0,0,0,0|1,0,0]=3 7054 B9R0.10 CC(C)CC(N)S(=O)(=O)O Amb24390196 [0,2,0,0,0,0|1,0,0]=3 7055 B9R0.10 CC(C)CC(O)P(=O)(O)O Amb28050623 [0,2,0,0,0,0|1,0,0]=3 7056 B9R0.10 CC(C)CC(O)P(C)(=O)O Amb27971788 [0,2,0,0,0,0|1,0,0]=3 7057 B9R0.10 CC(C)CC(O)S(=O)(=O)[O-] Amb22475705 [0,2,0,0,0,0|1,0,1]=4 7058 B9R0.10 CC(C)CC(O)S(=O)(=O)[O-] Amb29083391 [0,2,0,0,0,0|1,0,1]=4 7059 B9R0.10 CC(C)C[C@@H](N)C(C)(C)O Amb28315066 [0,2,0,0,0,0|1,0,1]=4 7060 B9R0.10 CC(C)C[C@@H](N)P(=O)(O)O Amb25992755 [0,2,0,0,0,0|1,0,0]=3 7061 B9R0.10 CC(C)C[C@H](N)P(=O)(O)O Amb25889931 [0,2,0,0,0,0|1,0,0]=3 7062 B9R0.10 CC(C)C[C@H](O)C(C)(C)O Amb27839459 [0,2,0,0,0,0|1,0,1]=4 7063 B9R0.10 CC(C)C[C@H](O)P(=O)(O)O Amb28126885 [0,2,0,0,0,0|1,0,0]=3 7064 B9R0.10 CC(CC(=O)Cl)C(C)(C)C Amb27194252 [0,2,0,0,0,0|1,0,0]=3 7065 B9R0.10 CC(CC(=O)O)C(C)(C)C Amb6749223 [0,2,0,0,0,0|0,0,0]=2 7066 B9R0.10 CC(CC(=O)O)C(C)(C)F Amb27633286 [0,2,0,0,0,0|0,0,0]=2 7067 B9R0.10 CC(CC(=O)O)C(C)(C)N Amb19651352 [0,2,0,0,0,0|0,0,0]=2 7068 B9R0.10 CC(CC(=O)O)C(C)(C)O Amb27815005 [0,2,0,0,0,0|0,0,0]=2 7069 B9R0.10 CC(CC(=O)O)C(Cl)(Cl)Cl Amb27643592 [0,2,0,0,0,0|2,0,0]=4 7070 B9R0.10 CC(CC(=O)O)C(F)(F)F Amb2690936 [0,2,0,0,0,0|2,0,0]=4 7071 B9R0.10 CC(CC(N)=O)C(C)(C)N Amb27463473 [0,2,0,0,0,0|1,0,0]=3 7072 B9R0.10 CC(CC(N)=O)[Si](C)(C)C Amb27966699 [0,2,0,0,0,0|1,1,0]=4 7073 B9R0.10 CC(CS(=O)Cl)C(C)(C)C Amb32720661 [0,2,0,0,0,0|2,0,0]=4 7074 B9R0.10 CC(CS(=O)[O-])C(C)(C)C Amb32755647 [0,2,0,0,0,0|1,0,1]=4 7075 B9R0.10 CC(CS(N)=O)C(C)(C)C Amb32720662 [0,2,0,0,0,0|2,0,0]=4 7076 B9R0.10 CC(F)(F)C(N)CC(=O)O Amb32810091 [0,2,0,0,0,0|1,0,0]=3 7077 B9R0.10 CC(F)(F)C(O)CC(=O)O Amb32809827 [0,2,0,0,0,0|1,0,0]=3 7078 B9R0.10 CC(F)(F)[C@@H](O)CC(=O)O Amb33482321 [0,2,0,0,0,0|1,0,0]=3 7079 B9R0.10 CC(F)(F)[C@H](O)CC(=O)O Amb32809834 [0,2,0,0,0,0|1,0,0]=3 7080 B9R0.10 CC(NC(=O)Cl)C(C)(C)C Amb35625608 [0,2,0,0,0,0|2,0,0]=4 7081 B9R0.10 CC(O)CC(C)C(C)(C)O Amb27207013 [0,2,0,0,0,0|1,0,1]=4 7082 B9R0.10 CC(O)CC(N)C(C)(C)C Amb35625104 [0,2,0,0,0,0|1,0,1]=4 7083 B9R0.10 CC(O)CC(O)C(C)(C)C Amb27812145 [0,2,0,0,0,0|1,0,1]=4 7084 B9R0.10 CN(CC(=O)O)C(C)(C)C Amb17334246 [0,2,0,0,0,0|1,0,0]=3 7085 B9R0.10 CP(=O)(O)C(N)CC(=O)O Amb27831332 [0,2,0,0,0,0|2,0,0]=4 7086 B9R0.10 CS(=O)CC(N)C(C)(C)C Amb27235425 [0,2,0,0,0,0|2,0,0]=4 7087 B9R0.10 C[C@@H](CC(=O)O)C(C)(C)C Amb28050110 [0,2,0,0,0,0|0,0,0]=2 7088 B9R0.10 C[C@@H](O)C[C@H](O)C(C)(C)C Amb27839492 [0,2,0,0,0,0|1,0,1]=4 7089 B9R0.10 C\C(=C/C(=O)O)C(C)(C)C Amb6749108 [0,2,0,0,0,0|0,0,2]=4 7090 B9R0.10 C\C(=C\C(=O)O)C(C)(C)C Amb28314071 [0,2,0,0,0,0|0,0,2]=4 7091 B9R0.10 NC(CC(=O)O)C(F)(F)Cl Amb27483984 [0,2,0,0,0,0|2,0,0]=4 7092 B9R0.10 NC(CC(=O)O)C(F)(F)F Amb1091770 [0,2,0,0,0,0|2,0,0]=4 7093 B9R0.10 N[C@@H](CC(=O)O)C(F)(F)F Amb22388421 [0,2,0,0,0,0|2,0,0]=4 7094 B9R0.10 N[C@H](CC(=O)O)C(F)(F)F Amb20670844 [0,2,0,0,0,0|2,0,0]=4 7095 B9R0.10 O=C(O)CC(Cl)C(F)(Cl)Cl Amb27636927 [0,2,0,0,0,0|2,0,0]=4 7096 B9R0.10 O=C(O)CC(Cl)C(F)(F)F Amb33330159 [0,2,0,0,0,0|2,0,0]=4 7097 B9R0.10 O=C(O)CC(F)C(F)(F)F Amb24472441 [0,2,0,0,0,0|2,0,0]=4 7098 B9R0.10 O=C(O)CC(O)C(Cl)(Cl)Cl Amb2782906 [0,2,0,0,0,0|2,0,0]=4 7099 B9R0.10 O=C(O)CC(O)C(F)(F)F Amb5720894 [0,2,0,0,0,0|2,0,0]=4 7100 B9R0.10 O=C(O)CC(S)C(F)(F)F Amb18790270 [0,2,0,0,0,0|2,0,0]=4 7101 B9R0.10 O=C(O)C[C@H](O)C(F)(F)F Amb10838307 [0,2,0,0,0,0|2,0,0]=4 7102 B9R0.10 [NH3+]C(CC(=O)O)C(F)(F)F Amb4013621 [0,2,0,0,0,0|2,0,0]=4 7103 B9R0.11 C=C(C)C(C)(C)CC(=O)O Amb25703730 [0,2,0,0,0,0|0,0,2]=4 7104 B9R0.11 C=C(C)C(C)(N)CC(=O)O Amb22641962 [0,2,0,0,0,0|0,0,2]=4 7105 B9R0.11 C=C(C)C(C)(N)CC(=O)O Amb31307620 [0,2,0,0,0,0|0,0,2]=4 7106 B9R0.11 C=C(C)C(F)(F)CC(=O)O Amb32810021 [0,2,0,0,0,0|0,0,2]=4 7107 B9R0.11 C=C(C)CC(C)(C)C(=O)O Amb27619182 [0,2,0,0,0,0|0,0,2]=4 7108 B9R0.11 C=C(C)CC(C)(N)C(=O)O Amb27838051 [0,2,0,0,0,0|0,0,2]=4 7109 B9R0.11 C=C(C)CC(C)(O)C(=O)O Amb24763776 [0,2,0,0,0,0|0,0,2]=4 7110 B9R0.11 C=C(C)CC(F)(F)C(=O)O Amb26356276 [0,2,0,0,0,0|0,0,2]=4 7111 B9R0.11 C=C(C)C[C@](C)(O)C(=O)O Amb27618953 [0,2,0,0,0,0|0,0,2]=4 7112 B9R0.11 CC(=O)C(C)(C)CC(=O)O Amb594714 [0,2,0,0,0,0|1,0,1]=4 7113 B9R0.11 CC(=O)C(C)(C)CC(C)C Amb2722976 [0,2,0,0,0,0|1,0,0]=3 7114 B9R0.11 CC(=O)C(C)(C)CN(C)C Amb19267109 [0,2,0,0,0,0|2,0,0]=4 7115 B9R0.11 CC(=O)C(C)(O)CC(C)C Amb17593631 [0,2,0,0,0,0|1,0,0]=3 7116 B9R0.11 CC(=O)CC(C)(C)C(=O)O Amb18644092 [0,2,0,0,0,0|1,0,1]=4 7117 B9R0.11 CC(=O)CC(C)(O)C(C)C Amb28131972 [0,2,0,0,0,0|1,0,0]=3 7118 B9R0.11 CC(=O)CC(C)(S)C(=O)O Amb27984551 [0,2,0,0,0,0|1,0,1]=4 7119 B9R0.11 CC(=O)C[C@](C)(O)C(=O)O Amb27170683 [0,2,0,0,0,0|1,0,1]=4 7120 B9R0.11 CC(=O)NC(C)(C)C(C)C Amb22723319 [0,2,0,0,0,0|2,0,0]=4 7121 B9R0.11 CC(C)(CC(=O)O)C(F)F Amb28184494 [0,2,0,0,0,0|2,0,0]=4 7122 B9R0.11 CC(C)(CC(F)F)C(=O)O Amb24395430 [0,2,0,0,0,0|2,0,0]=4 7123 B9R0.11 CC(C)=CC(C)(C)C(=O)O Amb27162610 [0,2,0,0,0,0|0,0,2]=4 7124 B9R0.11 CC(C)C(C)(C)CC(=O)O Amb18124695 [0,2,0,0,0,0|0,0,0]=2 7125 B9R0.11 CC(C)C(C)(C)CS(=O)Cl Amb32720679 [0,2,0,0,0,0|2,0,0]=4 7126 B9R0.11 CC(C)C(C)(C)CS(=O)[O-] Amb32754960 [0,2,0,0,0,0|1,0,1]=4 7127 B9R0.11 CC(C)C(C)(C)CS(N)=O Amb32720666 [0,2,0,0,0,0|2,0,0]=4 7128 B9R0.11 CC(C)C(C)(C)NC(=O)Cl Amb35625797 [0,2,0,0,0,0|2,0,0]=4 7129 B9R0.11 CC(C)C(C)(C)NC(N)=O Amb28050034 [0,2,0,0,0,0|2,0,0]=4 7130 B9R0.11 CC(C)C(C)(N)CC(=O)O Amb25934755 [0,2,0,0,0,0|0,0,0]=2 7131 B9R0.11 CC(C)C(C)(N)CC(N)=O Amb32787537 [0,2,0,0,0,0|1,0,0]=3 7132 B9R0.11 CC(C)C(C)(O)CC(=O)O Amb18991699 [0,2,0,0,0,0|0,0,0]=2 7133 B9R0.11 CC(C)C(F)(F)CC(=O)O Amb26991653 [0,2,0,0,0,0|0,0,0]=2 7134 B9R0.11 CC(C)CC(C)(C)C(=O)O Amb10843993 [0,2,0,0,0,0|0,0,0]=2 7135 B9R0.11 CC(C)CC(C)(C)C(C)O Amb2780728 [0,2,0,0,0,0|1,0,1]=4 7136 B9R0.11 CC(C)CC(C)(F)C(=O)O Amb25997944 [0,2,0,0,0,0|0,0,0]=2 7137 B9R0.11 CC(C)CC(C)(N)C(=O)O Amb4134832 [0,2,0,0,0,0|0,0,0]=2 7138 B9R0.11 CC(C)CC(C)(N)C(N)=O Amb18288986 [0,2,0,0,0,0|1,0,0]=3 7139 B9R0.11 CC(C)CC(C)(O)C(=O)O Amb18523766 [0,2,0,0,0,0|0,0,0]=2 7140 B9R0.11 CC(C)CC(F)(F)C(=O)O Amb25773701 [0,2,0,0,0,0|0,0,0]=2 7141 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O Amb8630501 [0,2,0,0,0,0|0,0,0]=2 7142 B9R0.11 CC(C)C[C@](C)(N)C(=O)O Amb10066904 [0,2,0,0,0,0|0,0,0]=2 7143 B9R0.11 CC(C)NC(C)(C)C(=O)O Amb3978636 [0,2,0,0,0,0|1,0,0]=3 7144 B9R0.11 CC(C)OC(C)(C)C(=O)O Amb18976739 [0,2,0,0,0,0|1,0,0]=3 7145 B9R0.11 CC(C)OC(C)(C)C(N)=O Amb27945543 [0,2,0,0,0,0|2,0,0]=4 7146 B9R0.11 CC(C)S(=O)(=O)CC(=O)O Amb6281038 [0,2,0,0,0,0|1,0,0]=3 7147 B9R0.11 CC(C)SC(C)(C)C(=O)O Amb17501486 [0,2,0,0,0,0|1,0,0]=3 7148 B9R0.11 CC(C)[C@@](C)(N)CC(=O)O Amb27185746 [0,2,0,0,0,0|0,0,0]=2 7149 B9R0.11 CC(C)[C@](C)(N)CC(=O)O Amb28346262 [0,2,0,0,0,0|0,0,0]=2 7150 B9R0.11 CC(C)[C@](C)(O)CC(=O)O Amb27810826 [0,2,0,0,0,0|0,0,0]=2 7151 B9R0.11 CC(N)(CC(=O)O)C(F)F Amb32787868 [0,2,0,0,0,0|2,0,0]=4 7152 B9R0.11 CC(N)(CC(=O)O)C(F)F Amb35788392 [0,2,0,0,0,0|2,0,0]=4 7153 B9R0.11 CC(N)C(C)(C)CC(=O)O Amb26440704 [0,2,0,0,0,0|1,0,0]=3 7154 B9R0.11 CC(N)C(C)(N)CC(=O)O Amb33255266 [0,2,0,0,0,0|1,0,0]=3 7155 B9R0.11 CC(N)C(C)(N)CC(N)=O Amb33254064 [0,2,0,0,0,0|2,0,0]=4 7156 B9R0.11 CC(N)CC(C)(C)C(=O)O Amb27881524 [0,2,0,0,0,0|1,0,0]=3 7157 B9R0.11 CC(O)(CC(F)F)C(=O)O Amb27254585 [0,2,0,0,0,0|2,0,0]=4 7158 B9R0.11 CC(O)CC(C)(N)C(=O)O Amb28289237 [0,2,0,0,0,0|1,0,0]=3 7159 B9R0.11 CC(O)CC(C)(N)C(N)=O Amb35725166 [0,2,0,0,0,0|2,0,0]=4 7160 B9R0.11 CC(S)CC(C)(C)C(=O)O Amb35675430 [0,2,0,0,0,0|1,0,0]=3 7161 B9R0.11 CN(C)C(C)(C)CC(=O)O Amb27839164 [0,2,0,0,0,0|1,0,0]=3 7162 B9R0.11 CN(C)CC(C)(C)C(=O)O Amb17334247 [0,2,0,0,0,0|1,0,0]=3 7163 B9R0.11 CN(C)CC(C)(C)C(=O)O Amb33527437 [0,2,0,0,0,0|1,0,0]=3 7164 B9R0.11 CN(C)CC(C)(N)C(=O)O Amb18294465 [0,2,0,0,0,0|1,0,0]=3 7165 B9R0.11 CN(C)CC(F)(F)C(=O)O Amb25857752 [0,2,0,0,0,0|1,0,0]=3 7166 B9R0.11 CN(C)CC(F)(F)C(N)=O Amb33188963 [0,2,0,0,0,0|2,0,0]=4 7167 B9R0.11 CN(C)S(=O)(=O)CC(=O)O Amb6742030 [0,2,0,0,0,0|2,0,0]=4 7168 B9R0.11 CN(O)C(C)(C)CC(=O)O Amb30025601 [0,2,0,0,0,0|2,0,0]=4 7169 B9R0.11 CN(O)CC(C)(O)C(=O)O Amb28349124 [0,2,0,0,0,0|2,0,0]=4 7170 B9R0.11 CN(O)CC(F)(F)C(=O)O Amb33169729 [0,2,0,0,0,0|2,0,0]=4 7171 B9R0.11 CS(=O)C(C)(C)CC(=O)O Amb28128345 [0,2,0,0,0,0|2,0,0]=4 7172 B9R0.11 CS(=O)CC(C)(C)C(=O)O Amb28049647 [0,2,0,0,0,0|2,0,0]=4 7173 B9R0.11 CS(=O)CC(C)(O)C(=O)O Amb27984742 [0,2,0,0,0,0|2,0,0]=4 7174 B9R0.11 CS(=O)CC(F)(F)C(=O)O Amb33169820 [0,2,0,0,0,0|2,0,0]=4 7175 B9R0.11 C[C@@](O)(CC(F)F)C(=O)O Amb27165726 [0,2,0,0,0,0|2,0,0]=4 7176 B9R0.11 C[C@](O)(CC(F)F)C(=O)O Amb27657615 [0,2,0,0,0,0|2,0,0]=4 7177 B9R0.11 O=C(O)C(F)(F)CC(F)F Amb33337757 [0,2,0,0,0,0|2,0,0]=4 7178 B9R0.11 O=C(O)CC(F)(F)C(F)F Amb7793548 [0,2,0,0,0,0|2,0,0]=4 7179 B9R0.39 C#CC(CC(=O)O)C(C)C Amb27408324 [0,2,0,0,0,0|0,0,0]=2 7180 B9R0.39 C#C[C@@H](CC(=O)O)C(C)C Amb27977044 [0,2,0,0,0,0|0,0,0]=2 7181 B9R0.39 C#C[C@H](CC(=O)O)C(C)C Amb27253902 [0,2,0,0,0,0|0,0,0]=2 7182 B9R0.39 C=C(C)C(CC)CC(=O)O Amb27655611 [0,2,0,0,0,0|0,0,2]=4 7183 B9R0.39 C=C(C)C(CN)CC(=O)O Amb33199956 [0,2,0,0,0,0|0,0,2]=4 7184 B9R0.39 C=C(C)CC(C#N)C(=O)O Amb35741470 [0,2,0,0,0,0|0,0,2]=4 7185 B9R0.39 C=C(C)CC(CBr)C(C)C Amb32689614 [0,2,0,0,0,0|2,0,0]=4 7186 B9R0.39 C=C(C)CC(CCl)C(C)C Amb32689645 [0,2,0,0,0,0|2,0,0]=4 7187 B9R0.39 C=C(C)CC(OC)C(=O)O Amb26386702 [0,2,0,0,0,0|0,0,2]=4 7188 B9R0.39 C=C(C)C[C@@H](CC)C(=O)O Amb27785162 [0,2,0,0,0,0|0,0,2]=4 7189 B9R0.39 C=C(Cl)CC(C=O)C(C)C Amb27799725 [0,2,0,0,0,0|2,0,0]=4 7190 B9R0.39 C=C(Cl)CC(CBr)C(C)C Amb32689665 [0,2,0,0,0,0|2,0,0]=4 7191 B9R0.39 C=C(Cl)CC(CCl)C(C)C Amb32689725 [0,2,0,0,0,0|2,0,0]=4 7192 B9R0.39 C=CC(CC(=O)O)C(C)C Amb18643903 [0,2,0,0,0,0|0,0,0]=2 7193 B9R0.39 C=CC(SC(C)C)C(=O)O Amb28123807 [0,2,0,0,0,0|1,0,0]=3 7194 B9R0.39 C=C[C@@H](CC(=O)O)C(C)C Amb27881786 [0,2,0,0,0,0|0,0,0]=2 7195 B9R0.39 C=C[C@H](CC(=O)O)C(C)C Amb27962891 [0,2,0,0,0,0|0,0,0]=2 7196 B9R0.39 CC(=O)CC(C#N)C(C)C Amb25871529 [0,2,0,0,0,0|1,0,0]=3 7197 B9R0.39 CC(=O)CC(C=O)C(=O)O Amb28048038 [0,2,0,0,0,0|1,0,1]=4 7198 B9R0.39 CC(=O)CC(C=O)C(C)C Amb27838017 [0,2,0,0,0,0|1,0,0]=3 7199 B9R0.39 CC(=O)NC(C#N)C(C)C Amb17399848 [0,2,0,0,0,0|2,0,0]=4 7200 B9R0.39 CC(=O)NC(CBr)C(C)C Amb27162063 [0,2,0,0,0,0|2,0,0]=4 7201 B9R0.39 CC(=O)NC(CCl)C(C)C Amb27614887 [0,2,0,0,0,0|2,0,0]=4 7202 B9R0.39 CC(=O)NC(CI)C(C)C Amb27803581 [0,2,0,0,0,0|2,0,0]=4 7203 B9R0.39 CC(=O)NC(CO)C(C)C Amb17102545 [0,2,0,0,0,0|2,0,0]=4 7204 B9R0.39 CC(=O)N[C@@H](C#N)C(C)C Amb27802242 [0,2,0,0,0,0|2,0,0]=4 7205 B9R0.39 CC(=O)OC(C#N)C(C)C Amb25711523 [0,2,0,0,0,0|2,0,0]=4 7206 B9R0.39 CC(=O)OC(CCl)C(C)C Amb27815071 [0,2,0,0,0,0|2,0,0]=4 7207 B9R0.39 CC(=O)\C(=C/Cl)CC(C)C Amb27614904 [0,2,0,0,0,0|1,0,1]=4 7208 B9R0.39 CC(=O)\C(=C/O)CC(C)C Amb27752064 [0,2,0,0,0,0|1,0,1]=4 7209 B9R0.39 CC(C)C(C#N)CC(=O)O Amb25818234 [0,2,0,0,0,0|0,0,0]=2 7210 B9R0.39 CC(C)C(CN)CC(=O)O Amb26910759 [0,2,0,0,0,0|0,0,0]=2 7211 B9R0.39 CC(C)CC(C#N)C(=O)O Amb23558965 [0,2,0,0,0,0|0,0,0]=2 7212 B9R0.39 CC(C)CC(C#N)C(N)=O Amb27229152 [0,2,0,0,0,0|1,0,0]=3 7213 B9R0.39 CC(C)CC(CN)C(=O)O Amb19021764 [0,2,0,0,0,0|0,0,0]=2 7214 B9R0.39 CC(C)CC(CN)C(=O)O Amb28555451 [0,2,0,0,0,0|0,0,0]=2 7215 B9R0.39 CC(C)CC(CO)C(=O)O Amb18124780 [0,2,0,0,0,0|0,0,0]=2 7216 B9R0.39 CC(C)CC(N=O)C(=O)O Amb27461396 [0,2,0,0,0,0|0,0,0]=2 7217 B9R0.39 CC(C)CC(NCl)B(O)O Amb27763791 [0,2,0,0,0,0|1,0,1]=4 7218 B9R0.39 CC(C)CC(NCl)C(=O)O Amb27401848 [0,2,0,0,0,0|0,0,0]=2 7219 B9R0.39 CC(C)CC(ON)C(=O)O Amb18644321 [0,2,0,0,0,0|0,0,0]=2 7220 B9R0.39 CC(C)CC(ON)C(=O)O Amb33484371 [0,2,0,0,0,0|0,0,0]=2 7221 B9R0.39 CC(C)CN(C#N)C(N)=O Amb27596538 [0,2,0,0,0,0|2,0,0]=4 7222 B9R0.39 CC(C)CN(N=O)C(N)=O Amb25809440 [0,2,0,0,0,0|2,0,0]=4 7223 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756732 [0,2,0,0,0,0|0,0,0]=2 7224 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756740 [0,2,0,0,0,0|0,0,0]=2 7225 B9R0.39 CC(C)C[C@@H](NN)C(=O)O Amb27424998 [0,2,0,0,0,0|0,0,0]=2 7226 B9R0.39 CC(C)C[C@@H](ON)C(=O)O Amb27975779 [0,2,0,0,0,0|0,0,0]=2 7227 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb26390781 [0,2,0,0,0,0|0,0,0]=2 7228 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb32620226 [0,2,0,0,0,0|0,0,0]=2 7229 B9R0.39 CC(C)C[C@H](NN)C(=O)O Amb27488207 [0,2,0,0,0,0|0,0,0]=2 7230 B9R0.39 CC(C)C[C@H](NN)C(N)=O Amb27604368 [0,2,0,0,0,0|1,0,0]=3 7231 B9R0.39 CC(C)C\C(=N\O)C(N)=O Amb27450654 [0,2,0,0,0,0|1,0,1]=4 7232 B9R0.39 CC(C)N(C#N)CC(=O)O Amb35634517 [0,2,0,0,0,0|1,0,0]=3 7233 B9R0.39 CC(C)NC(CN)C(=O)O Amb28291039 [0,2,0,0,0,0|1,0,0]=3 7234 B9R0.39 CC(C)NC(CO)C(=O)O Amb26046487 [0,2,0,0,0,0|1,0,0]=3 7235 B9R0.39 CC(C)NC(CO)C(N)=O Amb27838044 [0,2,0,0,0,0|2,0,0]=4 7236 B9R0.39 CC(C)NC(CS)C(=O)O Amb27233014 [0,2,0,0,0,0|1,0,0]=3 7237 B9R0.39 CC(C)N[C@@H](CS)C(=O)O Amb25299344 [0,2,0,0,0,0|1,0,0]=3 7238 B9R0.39 CC(C)S[C@@H](CN)C(=O)O Amb27444140 [0,2,0,0,0,0|1,0,0]=3 7239 B9R0.39 CC(C)[C@@H](C#N)CC(=O)O Amb27473398 [0,2,0,0,0,0|0,0,0]=2 7240 B9R0.39 CC(C)[C@H](C#N)CC(=O)O Amb28184580 [0,2,0,0,0,0|0,0,0]=2 7241 B9R0.39 CC(C)[C@H](C=O)CC(=O)[O-] Amb27948625 [0,2,0,0,0,0|0,0,1]=3 7242 B9R0.39 CC(C)[C@H](CO)C[C@@H](C)O Amb28126537 [0,2,0,0,0,0|1,0,1]=4 7243 B9R0.39 CC(C)\C=C(/C#N)C(=O)O Amb25864734 [0,2,0,0,0,0|0,0,2]=4 7244 B9R0.39 CC(Cl)CC(CN)C(=O)O Amb28396430 [0,2,0,0,0,0|1,0,0]=3 7245 B9R0.39 CC(N)NC(CS)C(=O)O Amb27792112 [0,2,0,0,0,0|2,0,0]=4 7246 B9R0.39 CC(O)CC(C#N)C(=O)O Amb35741473 [0,2,0,0,0,0|1,0,0]=3 7247 B9R0.39 CCC(CC(=O)O)C(C)C Amb33534084 [0,2,0,0,0,0|0,0,0]=2 7248 B9R0.39 CCC(CC(=O)O)C(C)O Amb18831453 [0,2,0,0,0,0|1,0,0]=3 7249 B9R0.39 CCC(CC(=O)O)C(F)F Amb33436479 [0,2,0,0,0,0|2,0,0]=4 7250 B9R0.39 CCC(CC(C)=O)C(=O)O Amb18644109 [0,2,0,0,0,0|1,0,1]=4 7251 B9R0.39 CCC(CC(C)C)C(=O)O Amb19014184 [0,2,0,0,0,0|0,0,0]=2 7252 B9R0.39 CCC(CC(C)O)C(=O)O Amb27254121 [0,2,0,0,0,0|1,0,0]=3 7253 B9R0.39 CCC(CC(F)F)C(=O)O Amb25709926 [0,2,0,0,0,0|2,0,0]=4 7254 B9R0.39 CCC(CC(N)=O)C(C)C Amb27806878 [0,2,0,0,0,0|1,0,0]=3 7255 B9R0.39 CCC(NC(=O)Cl)C(C)C Amb35625855 [0,2,0,0,0,0|2,0,0]=4 7256 B9R0.39 CCC(NC(C)C)C(=O)O Amb28555426 [0,2,0,0,0,0|1,0,0]=3 7257 B9R0.39 CCC(NC(C)C)C(=O)O Amb9620437 [0,2,0,0,0,0|1,0,0]=3 7258 B9R0.39 CCC(SC(C)C)C(=O)O Amb17501347 [0,2,0,0,0,0|1,0,0]=3 7259 B9R0.39 CCC(SC(C)C)C(N)=O Amb18788099 [0,2,0,0,0,0|2,0,0]=4 7260 B9R0.39 CCN(CC(C)=O)C(C)C Amb9661463 [0,2,0,0,0,0|2,0,0]=4 7261 B9R0.39 CCN(CC(C)C)C(C)=O Amb27458275 [0,2,0,0,0,0|2,0,0]=4 7262 B9R0.39 CCN(CC(C)C)C(N)=O Amb8901538 [0,2,0,0,0,0|2,0,0]=4 7263 B9R0.39 CC[C@@H](CC(C)C)C(=O)O Amb28397993 [0,2,0,0,0,0|0,0,0]=2 7264 B9R0.39 CC[C@H](CC(=O)O)C(C)C Amb25989910 [0,2,0,0,0,0|0,0,0]=2 7265 B9R0.39 CC\C(=C/C(=O)O)C(C)C Amb18967765 [0,2,0,0,0,0|0,0,2]=4 7266 B9R0.39 CC\C(=C/C(C)C)C(=O)O Amb18643946 [0,2,0,0,0,0|0,0,2]=4 7267 B9R0.39 CN(C)C(CO)CC(=O)O Amb18202308 [0,2,0,0,0,0|1,0,0]=3 7268 B9R0.39 CN(C)CC(C#N)C(=O)O Amb26639275 [0,2,0,0,0,0|1,0,0]=3 7269 B9R0.39 CNC(CC(=O)O)C(C)=O Amb18611382 [0,2,0,0,0,0|1,0,1]=4 7270 B9R0.39 CNC(CC(=O)O)C(C)C Amb27209417 [0,2,0,0,0,0|0,0,0]=2 7271 B9R0.39 CNC(CC(C)C)C(=O)O Amb22274694 [0,2,0,0,0,0|0,0,0]=2 7272 B9R0.39 CNC(CC(C)C)C(=O)O Amb9283589 [0,2,0,0,0,0|0,0,0]=2 7273 B9R0.39 CNC(CC(C)C)C(N)=O Amb19006600 [0,2,0,0,0,0|1,0,0]=3 7274 B9R0.39 CNC(CC(C)C)C(N)=O Amb32753443 [0,2,0,0,0,0|1,0,0]=3 7275 B9R0.39 CNC(CN(C)C)C(=O)O Amb28388875 [0,2,0,0,0,0|1,0,0]=3 7276 B9R0.39 CNC(CS(C)=O)C(C)C Amb27597532 [0,2,0,0,0,0|2,0,0]=4 7277 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb16183858 [0,2,0,0,0,0|0,0,0]=2 7278 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb2779901 [0,2,0,0,0,0|0,0,0]=2 7279 B9R0.39 CN[C@@H](CC(C)C)C(N)=O Amb24550819 [0,2,0,0,0,0|1,0,0]=3 7280 B9R0.39 CN[C@@H](CC(C)C)C(N)=O Amb32679561 [0,2,0,0,0,0|1,0,0]=3 7281 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb10842218 [0,2,0,0,0,0|0,0,0]=2 7282 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb22745995 [0,2,0,0,0,0|0,0,0]=2 7283 B9R0.39 COC(C=C(C)C)C(=O)O Amb20621506 [0,2,0,0,0,0|0,0,2]=4 7284 B9R0.39 COC(CC(=O)O)C(C)=O Amb27952022 [0,2,0,0,0,0|1,0,1]=4 7285 B9R0.39 COC(CC(C)C)C(=O)O Amb26656466 [0,2,0,0,0,0|0,0,0]=2 7286 B9R0.39 COC(CC(C)C)C(N)=O Amb27769639 [0,2,0,0,0,0|1,0,0]=3 7287 B9R0.39 COC(CC(F)F)C(=O)O Amb32811478 [0,2,0,0,0,0|2,0,0]=4 7288 B9R0.39 COC(CN(C)C)C(=O)O Amb27196900 [0,2,0,0,0,0|1,0,0]=3 7289 B9R0.39 COC(CS(=O)Cl)C(C)C Amb32720871 [0,2,0,0,0,0|2,0,0]=4 7290 B9R0.39 COC(CS(=O)[O-])C(C)C Amb32755484 [0,2,0,0,0,0|1,0,1]=4 7291 B9R0.39 COC(CS(N)=O)C(C)C Amb32720872 [0,2,0,0,0,0|2,0,0]=4 7292 B9R0.39 COC(NC(C)=O)C(C)C Amb27831760 [0,2,0,0,0,0|2,0,0]=4 7293 B9R0.39 CON(CC(C)C)C(C)=O Amb28368883 [0,2,0,0,0,0|2,0,0]=4 7294 B9R0.39 CO[C@@H](CC(C)C)C(=O)O Amb28126876 [0,2,0,0,0,0|0,0,0]=2 7295 B9R0.39 CSC(CC(C)C)C(=O)O Amb27658945 [0,2,0,0,0,0|0,0,0]=2 7296 B9R0.39 C\C=C(\CC(C)=O)C(C)C Amb25265231 [0,2,0,0,0,0|1,0,1]=4 7297 B9R0.39 N#CC(CC(F)F)C(=O)O Amb35741475 [0,2,0,0,0,0|2,0,0]=4 7298 B9R0.39 NCC(CC(=O)O)C(F)F Amb27192581 [0,2,0,0,0,0|2,0,0]=4 7299 B9R0.39 NCC(CC(=O)O)C(F)F Amb28555657 [0,2,0,0,0,0|2,0,0]=4 7300 B9R0.39 O=C(O)CC(CF)C(F)F Amb24513956 [0,2,0,0,0,0|2,0,0]=4 7301 B9R0.57 C=C(CC(C)(C)C)C(=O)O Amb27815006 [0,2,0,0,0,0|0,0,1]=3 7302 B9R0.57 C=C(OC(C)(C)C)C(=O)O Amb18644144 [0,2,0,0,0,0|1,0,1]=4 7303 B9R0.57 CC(=O)C(Cl)CC(C)(C)C Amb25280760 [0,2,0,0,0,0|1,0,0]=3 7304 B9R0.57 CC(=O)C(Cl)SC(C)(C)C Amb4165960 [0,2,0,0,0,0|2,0,0]=4 7305 B9R0.57 CC(=O)C(N)CC(C)(C)C Amb27959417 [0,2,0,0,0,0|1,0,0]=3 7306 B9R0.57 CC(=O)N(C)CC(C)(C)N Amb35685159 [0,2,0,0,0,0|2,0,0]=4 7307 B9R0.57 CC(=O)N(C)CC(C)(C)O Amb24392062 [0,2,0,0,0,0|2,0,0]=4 7308 B9R0.57 CC(C)(C)CC(=O)C(=O)O Amb6295779 [0,2,0,0,0,0|0,0,1]=3 7309 B9R0.57 CC(C)(C)CC(Cl)C(N)=O Amb18788248 [0,2,0,0,0,0|1,0,0]=3 7310 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb7172575 [0,2,0,0,0,0|0,0,0]=2 7311 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb8385710 [0,2,0,0,0,0|0,0,0]=2 7312 B9R0.57 CC(C)(C)CC(N)C(N)=O Amb19000296 [0,2,0,0,0,0|1,0,0]=3 7313 B9R0.57 CC(C)(C)CC(O)C(=O)O Amb18302187 [0,2,0,0,0,0|0,0,0]=2 7314 B9R0.57 CC(C)(C)CC(O)C(N)=O Amb27482301 [0,2,0,0,0,0|1,0,0]=3 7315 B9R0.57 CC(C)(C)C[C@@H](Br)C(=O)O Amb28049945 [0,2,0,0,0,0|0,0,0]=2 7316 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O Amb16184025 [0,2,0,0,0,0|0,0,0]=2 7317 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O Amb6295897 [0,2,0,0,0,0|0,0,0]=2 7318 B9R0.57 CC(C)(C)NC(=O)C(=O)O Amb2693955 [0,2,0,0,0,0|1,0,1]=4 7319 B9R0.57 CC(C)(C)OC(F)C(=O)O Amb27399823 [0,2,0,0,0,0|1,0,0]=3 7320 B9R0.57 CC(C)(C)\C=C(/F)C(=O)O Amb27194420 [0,2,0,0,0,0|0,0,2]=4 7321 B9R0.57 CC(C)(C)\C=C(\Br)C(=O)O Amb27230191 [0,2,0,0,0,0|0,0,2]=4 7322 B9R0.57 CC(C)(Cl)CC(N)C(=O)O Amb28555620 [0,2,0,0,0,0|0,0,0]=2 7323 B9R0.57 CC(C)(F)CC(=O)C(=O)O Amb33273007 [0,2,0,0,0,0|0,0,1]=3 7324 B9R0.57 CC(C)(F)CC(N)C(=O)O Amb26496047 [0,2,0,0,0,0|0,0,0]=2 7325 B9R0.57 CC(C)(F)CC(N)C(N)=O Amb33036949 [0,2,0,0,0,0|1,0,0]=3 7326 B9R0.57 CC(C)(F)CC(O)C(=O)O Amb33272231 [0,2,0,0,0,0|0,0,0]=2 7327 B9R0.57 CC(C)(F)C[C@@H](N)C(=O)O Amb24055873 [0,2,0,0,0,0|0,0,0]=2 7328 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O Amb26959500 [0,2,0,0,0,0|0,0,0]=2 7329 B9R0.57 CC(C)(O)CC(N)C(=O)O Amb18644326 [0,2,0,0,0,0|0,0,0]=2 7330 B9R0.57 CC(C)(O)CC(N)C(=O)[O-] Amb33109899 [0,2,0,0,0,0|0,0,1]=3 7331 B9R0.57 CC(C)(O)CC(N)C(N)=O Amb33065412 [0,2,0,0,0,0|1,0,0]=3 7332 B9R0.57 CC(C)(O)CC(O)C(=O)O Amb27953570 [0,2,0,0,0,0|0,0,0]=2 7333 B9R0.57 CC(C)(O)C[C@@H](N)C(=O)O Amb24479570 [0,2,0,0,0,0|0,0,0]=2 7334 B9R0.57 CC(C)(O)C[C@@H](O)C(=O)O Amb27254266 [0,2,0,0,0,0|0,0,0]=2 7335 B9R0.57 CC(C)(O)C[C@H](N)C(=O)O Amb25992355 [0,2,0,0,0,0|0,0,0]=2 7336 B9R0.57 CC(C)(S)CC(N)C(=O)O Amb27984144 [0,2,0,0,0,0|0,0,0]=2 7337 B9R0.57 CC(C)C(C)CS(=O)(=O)Cl Amb25300919 [0,2,0,0,0,0|1,0,1]=4 7338 B9R0.57 CC(C)C(C)CS(=O)(=O)F Amb33352331 [0,2,0,0,0,0|1,0,1]=4 7339 B9R0.57 CC(C)C(C)CS(N)(=O)=O Amb26643308 [0,2,0,0,0,0|1,0,1]=4 7340 B9R0.57 CC(C)C(C)OP(C)(=O)O Amb25104688 [0,2,0,0,0,0|2,0,0]=4 7341 B9R0.57 CC(C)C(N)CS(=O)(=O)F Amb33463802 [0,2,0,0,0,0|1,0,1]=4 7342 B9R0.57 CC(C)C(O)CC(C)(C)O Amb25283197 [0,2,0,0,0,0|1,0,1]=4 7343 B9R0.57 CC(C)C(O)CS(C)(=O)=O Amb18801119 [0,2,0,0,0,0|1,0,1]=4 7344 B9R0.57 CC(C)[C@@H](N)CP(C)(=O)O Amb27476831 [0,2,0,0,0,0|1,0,0]=3 7345 B9R0.57 CC(C)[C@@H](O)CS(=O)(=O)[O-] Amb27833745 [0,2,0,0,0,0|1,0,1]=4 7346 B9R0.57 CC(C)[C@H](N)CS(=O)(=O)Cl Amb27975777 [0,2,0,0,0,0|1,0,1]=4 7347 B9R0.57 CC(CC(C)(C)C)C(=O)O Amb18124693 [0,2,0,0,0,0|0,0,0]=2 7348 B9R0.57 CC(CC(C)(C)F)C(=O)O Amb25971880 [0,2,0,0,0,0|0,0,0]=2 7349 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb22364426 [0,2,0,0,0,0|0,0,0]=2 7350 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb28555536 [0,2,0,0,0,0|0,0,0]=2 7351 B9R0.57 CC(CC(C)(F)F)C(=O)O Amb33482229 [0,2,0,0,0,0|1,0,0]=3 7352 B9R0.57 CC(CC(F)(F)F)C(=O)O Amb10605557 [0,2,0,0,0,0|2,0,0]=4 7353 B9R0.57 CC(CP(C)(C)=O)C(=O)O Amb28050894 [0,2,0,0,0,0|1,0,0]=3 7354 B9R0.57 CC(CS(C)(=O)=O)C(=O)O Amb18971622 [0,2,0,0,0,0|2,0,0]=4 7355 B9R0.57 CC(C[Si](C)(C)C)C(=O)O Amb28383938 [0,2,0,0,0,0|0,1,0]=3 7356 B9R0.57 CC(F)(F)CC(=O)C(=O)O Amb32809797 [0,2,0,0,0,0|1,0,1]=4 7357 B9R0.57 CC(F)(F)CC(N)C(=O)O Amb26866987 [0,2,0,0,0,0|1,0,0]=3 7358 B9R0.57 CC(F)(F)CC(N)C(=O)O Amb33483896 [0,2,0,0,0,0|1,0,0]=3 7359 B9R0.57 CC(F)(F)CC(N)C(N)=O Amb33036598 [0,2,0,0,0,0|2,0,0]=4 7360 B9R0.57 CC(F)(F)CC(O)C(=O)O Amb26361859 [0,2,0,0,0,0|1,0,0]=3 7361 B9R0.57 CC(F)(F)C[C@@H](N)C(=O)O Amb33309023 [0,2,0,0,0,0|1,0,0]=3 7362 B9R0.57 CC(F)(F)C[C@H](N)C(=O)O Amb26573683 [0,2,0,0,0,0|1,0,0]=3 7363 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb17399895 [0,2,0,0,0,0|1,0,0]=3 7364 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb28991327 [0,2,0,0,0,0|1,0,0]=3 7365 B9R0.57 CC(N[Si](C)(C)C)C(=O)O Amb27984746 [0,2,0,0,0,0|1,1,0]=4 7366 B9R0.57 CC(O)C(C)CC(C)(C)C Amb27763853 [0,2,0,0,0,0|1,0,1]=4 7367 B9R0.57 CC(O)C(N)CC(C)(C)C Amb35622344 [0,2,0,0,0,0|1,0,1]=4 7368 B9R0.57 CC(OC(C)(C)C)C(=O)O Amb9208483 [0,2,0,0,0,0|1,0,0]=3 7369 B9R0.57 CC(OC(C)(C)C)C(N)=O Amb27972385 [0,2,0,0,0,0|2,0,0]=4 7370 B9R0.57 CN(CC(C)(C)C)C(=O)Cl Amb26956442 [0,2,0,0,0,0|2,0,0]=4 7371 B9R0.57 CP(=O)(O)CC(N)C(=O)O Amb27770381 [0,2,0,0,0,0|2,0,0]=4 7372 B9R0.57 CS(=O)(=O)CC(Cl)C(=O)O Amb27257814 [0,2,0,0,0,0|2,0,0]=4 7373 B9R0.57 CS(=O)(=O)CC(N)C(=O)O Amb27983621 [0,2,0,0,0,0|2,0,0]=4 7374 B9R0.57 CS(=O)(=O)CC(N)C(=O)O Amb32753509 [0,2,0,0,0,0|2,0,0]=4 7375 B9R0.57 CS(=O)(=O)CC(O)C(=O)O Amb24398186 [0,2,0,0,0,0|2,0,0]=4 7376 B9R0.57 CS(=O)(=O)C[C@@H](N)C(=O)O Amb27831327 [0,2,0,0,0,0|2,0,0]=4 7377 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O Amb27231797 [0,2,0,0,0,0|2,0,0]=4 7378 B9R0.57 CS(=O)(=O)C[C@H](N)C(=O)O Amb32683294 [0,2,0,0,0,0|2,0,0]=4 7379 B9R0.57 C[C@@H](CC(C)(C)C)C(=O)O Amb10844016 [0,2,0,0,0,0|0,0,0]=2 7380 B9R0.57 C[C@@H](CC(C)(F)F)C(=O)O Amb33744369 [0,2,0,0,0,0|1,0,0]=3 7381 B9R0.57 C[C@@H](CC(F)(F)F)C(=O)O Amb33729771 [0,2,0,0,0,0|2,0,0]=4 7382 B9R0.57 C[C@@H](O)[C@H](N)CS(=O)(=O)O Amb27483111 [0,2,0,0,0,0|2,0,0]=4 7383 B9R0.57 C[C@H](CC(C)(C)C)C(=O)O Amb10844015 [0,2,0,0,0,0|0,0,0]=2 7384 B9R0.57 C[C@H](CC(C)(F)F)C(=O)O Amb33743241 [0,2,0,0,0,0|1,0,0]=3 7385 B9R0.57 C[C@H](CC(F)(F)F)C(=O)O Amb32651677 [0,2,0,0,0,0|2,0,0]=4 7386 B9R0.57 C[C@H](O)[C@@H](O)CP(=O)(O)O Amb28079090 [0,2,0,0,0,0|2,0,0]=4 7387 B9R0.57 C[C@H](O[Si](C)(C)C)C(=O)O Amb28320757 [0,2,0,0,0,0|1,1,0]=4 7388 B9R0.57 C[Si](C)(C)CC(N)C(=O)O Amb26361043 [0,2,0,0,0,0|0,1,0]=3 7389 B9R0.57 C[Si](C)(C)CC(N)C(N)=O Amb33308618 [0,2,0,0,0,0|1,1,0]=4 7390 B9R0.57 C[Si](C)(C)C[C@@H](N)C(=O)O Amb27658975 [0,2,0,0,0,0|0,1,0]=3 7391 B9R0.57 C[Si](C)(C)C[C@H](N)C(=O)O Amb24482244 [0,2,0,0,0,0|0,1,0]=3 7392 B9R0.57 C[Si](C)(O)C[C@H](N)C(=O)O Amb27408998 [0,2,0,0,0,0|0,1,0]=3 7393 B9R0.57 C\C(=C/C(C)(C)C)C(=O)O Amb28050296 [0,2,0,0,0,0|0,0,2]=4 7394 B9R0.57 NC(CC(F)(F)Cl)C(=O)O Amb27477823 [0,2,0,0,0,0|2,0,0]=4 7395 B9R0.57 NC(CC(F)(F)F)C(=O)O Amb10603542 [0,2,0,0,0,0|2,0,0]=4 7396 B9R0.57 NC(CC(F)(F)F)C(=O)O Amb2684546 [0,2,0,0,0,0|2,0,0]=4 7397 B9R0.57 N[C@@H](CC(Cl)(Cl)Cl)C(=O)O Amb25967143 [0,2,0,0,0,0|2,0,0]=4 7398 B9R0.57 N[C@@H](CC(F)(F)F)C(=O)O Amb19889287 [0,2,0,0,0,0|2,0,0]=4 7399 B9R0.57 N[C@H](CC(F)(F)F)C(=O)O Amb19889286 [0,2,0,0,0,0|2,0,0]=4 7400 B9R0.57 O=C(O)C(Br)CC(F)(F)F Amb10841945 [0,2,0,0,0,0|2,0,0]=4 7401 B9R0.57 O=C(O)C(F)CC(F)(F)F Amb25701547 [0,2,0,0,0,0|2,0,0]=4 7402 B9R0.57 O=C(O)C(O)CC(F)(F)F Amb24482207 [0,2,0,0,0,0|2,0,0]=4 7403 B9R0.79 C=C(C(=O)O)C(O)C(C)C Amb27468733 [0,2,0,0,0,0|0,0,1]=3 7404 B9R0.79 C=C(C(N)=O)[C@@H](O)C(C)C Amb27246122 [0,2,0,0,0,0|1,0,1]=4 7405 B9R0.79 C=C(C)C(C)C(C)C(=O)O Amb28042819 [0,2,0,0,0,0|0,0,2]=4 7406 B9R0.79 C=C(C)C(C)C(O)C(C)C Amb27197463 [0,2,0,0,0,0|2,0,0]=4 7407 B9R0.79 C=C(C)C(N)C(C)C(=O)O Amb33036349 [0,2,0,0,0,0|0,0,2]=4 7408 B9R0.79 C=C(C)C(O)C(C)C(=O)O Amb18644101 [0,2,0,0,0,0|0,0,2]=4 7409 B9R0.79 C=C(C)C(O)C(N)C(=O)O Amb33199606 [0,2,0,0,0,0|0,0,2]=4 7410 B9R0.79 C=C(C)C(O)C(N)C(C)C Amb30024356 [0,2,0,0,0,0|2,0,0]=4 7411 B9R0.79 C=C(C)C(O)C(O)C(C)C Amb27858601 [0,2,0,0,0,0|2,0,0]=4 7412 B9R0.79 C=C(C)C(O)[C@@H](N)C(C)C Amb35737398 [0,2,0,0,0,0|2,0,0]=4 7413 B9R0.79 C=C(C)C(O)[C@H](N)C(C)C Amb35623970 [0,2,0,0,0,0|2,0,0]=4 7414 B9R0.79 C=C(C)[C@@H](C)[C@@H](C)C(=O)O Amb28050111 [0,2,0,0,0,0|0,0,2]=4 7415 B9R0.79 C=C(C)[C@@H](C)[C@H](O)C(C)C Amb27812172 [0,2,0,0,0,0|2,0,0]=4 7416 B9R0.79 C=C(C)[C@@H](O)[C@@H](C)C(=O)O Amb28283987 [0,2,0,0,0,0|0,0,2]=4 7417 B9R0.79 CC(=O)C(C)C(=O)C(C)C Amb17778960 [0,2,0,0,0,0|1,0,1]=4 7418 B9R0.79 CC(=O)C(C)C(N)C(=O)O Amb18202116 [0,2,0,0,0,0|1,0,1]=4 7419 B9R0.79 CC(=O)C(C)C(O)C(C)C Amb27453442 [0,2,0,0,0,0|1,0,0]=3 7420 B9R0.79 CC(=O)C(C)S(=O)C(C)C Amb28061580 [0,2,0,0,0,0|2,0,0]=4 7421 B9R0.79 CC(=O)C(O)C(=O)C(C)C Amb27480227 [0,2,0,0,0,0|1,0,1]=4 7422 B9R0.79 CC(=O)C(O)C(O)C(=O)O Amb25292189 [0,2,0,0,0,0|1,0,1]=4 7423 B9R0.79 CC(=O)[C@@H](C)[C@@H](O)C(=O)O Amb27661780 [0,2,0,0,0,0|1,0,1]=4 7424 B9R0.79 CC(=O)[C@@H](C)[C@H](O)C(=O)O Amb28050113 [0,2,0,0,0,0|1,0,1]=4 7425 B9R0.79 CC(=O)[C@@H](O)[C@@H](O)C(C)C Amb28200089 [0,2,0,0,0,0|1,0,0]=3 7426 B9R0.79 CC(=O)[C@H](C)[C@@H](O)C(C)C Amb26874392 [0,2,0,0,0,0|1,0,0]=3 7427 B9R0.79 CC(=O)[C@H](C)[C@H](N)C(=O)O Amb27424983 [0,2,0,0,0,0|1,0,1]=4 7428 B9R0.79 CC(=S)[C@H](C)[C@H](N)C(=O)O Amb26642807 [0,2,0,0,0,0|1,0,1]=4 7429 B9R0.79 CC(C(=O)O)C(=O)N(C)C Amb24454556 [0,2,0,0,0,0|1,0,1]=4 7430 B9R0.79 CC(C(=O)O)C(C)N(C)C Amb28139119 [0,2,0,0,0,0|1,0,0]=3 7431 B9R0.79 CC(C(F)F)C(N)C(=O)O Amb4442353 [0,2,0,0,0,0|2,0,0]=4 7432 B9R0.79 CC(C(F)F)[C@H](N)C(=O)O Amb27424746 [0,2,0,0,0,0|2,0,0]=4 7433 B9R0.79 CC(C(N)C(=O)O)N(C)C Amb30020664 [0,2,0,0,0,0|1,0,0]=3 7434 B9R0.79 CC(C(N)C(N)=O)N(C)C Amb30036996 [0,2,0,0,0,0|2,0,0]=4 7435 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33330058 [0,2,0,0,0,0|0,0,2]=4 7436 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33484307 [0,2,0,0,0,0|0,0,2]=4 7437 B9R0.79 CC(C)C(=O)C(=O)C(=O)O Amb31099538 [0,2,0,0,0,0|0,0,2]=4 7438 B9R0.79 CC(C)C(=S)[C@H](N)C(=O)O Amb26586364 [0,2,0,0,0,0|0,0,1]=3 7439 B9R0.79 CC(C)C(C)C(=O)C(=O)O Amb27473341 [0,2,0,0,0,0|0,0,1]=3 7440 B9R0.79 CC(C)C(C)C(=O)C(N)=O Amb27413554 [0,2,0,0,0,0|1,0,1]=4 7441 B9R0.79 CC(C)C(C)C(C)C(C)O Amb27801953 [0,2,0,0,0,0|1,0,1]=4 7442 B9R0.79 CC(C)C(C)C(N)C(=O)O Amb26965499 [0,2,0,0,0,0|0,0,0]=2 7443 B9R0.79 CC(C)C(C)C(N)C(N)=O Amb28315989 [0,2,0,0,0,0|1,0,0]=3 7444 B9R0.79 CC(C)C(C)N(C)C(=O)Cl Amb27617142 [0,2,0,0,0,0|2,0,0]=4 7445 B9R0.79 CC(C)C(C)[C@@H](N)C(=O)O Amb28119442 [0,2,0,0,0,0|0,0,0]=2 7446 B9R0.79 CC(C)C(C)[C@H](N)C(=O)O Amb27951299 [0,2,0,0,0,0|0,0,0]=2 7447 B9R0.79 CC(C)C(Cl)C(=O)C(=O)O Amb18646182 [0,2,0,0,0,0|0,0,1]=3 7448 B9R0.79 CC(C)C(F)C(N)C(=O)O Amb28071157 [0,2,0,0,0,0|0,0,0]=2 7449 B9R0.79 CC(C)C(F)[C@@H](N)C(=O)O Amb27248487 [0,2,0,0,0,0|0,0,0]=2 7450 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb25863595 [0,2,0,0,0,0|0,0,0]=2 7451 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb33328671 [0,2,0,0,0,0|0,0,0]=2 7452 B9R0.79 CC(C)C(N)C(C)C(=O)O Amb28121227 [0,2,0,0,0,0|0,0,0]=2 7453 B9R0.79 CC(C)C(N)C(F)C(=O)O Amb28385013 [0,2,0,0,0,0|0,0,0]=2 7454 B9R0.79 CC(C)C(N)C(O)C(=O)O Amb27615047 [0,2,0,0,0,0|0,0,0]=2 7455 B9R0.79 CC(C)C(O)C(C)C(=O)O Amb18990636 [0,2,0,0,0,0|0,0,0]=2 7456 B9R0.79 CC(C)C(O)C(C)[N+](=O)[O-] Amb27472692 [0,2,0,0,0,0|1,0,1]=4 7457 B9R0.79 CC(C)C(O)C(F)C(=O)O Amb33136392 [0,2,0,0,0,0|0,0,0]=2 7458 B9R0.79 CC(C)C(O)C(N)C(=O)O Amb23399656 [0,2,0,0,0,0|0,0,0]=2 7459 B9R0.79 CC(C)C(O)C(O)C(=O)O Amb27655491 [0,2,0,0,0,0|0,0,0]=2 7460 B9R0.79 CC(C)C(O)[C@@H](C)C(=O)O Amb27494047 [0,2,0,0,0,0|0,0,0]=2 7461 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O Amb24509492 [0,2,0,0,0,0|0,0,0]=2 7462 B9R0.79 CC(C)C(S)C(N)C(=O)O Amb28076641 [0,2,0,0,0,0|0,0,0]=2 7463 B9R0.79 CC(C)N(C)C(=O)C(=O)O Amb9303810 [0,2,0,0,0,0|1,0,1]=4 7464 B9R0.79 CC(C)N(C)C(C)C(N)=O Amb28293057 [0,2,0,0,0,0|2,0,0]=4 7465 B9R0.79 CC(C)N(N)C(C)C(=O)O Amb27850417 [0,2,0,0,0,0|1,0,0]=3 7466 B9R0.79 CC(C)N(O)C(=O)C(=O)O Amb24671329 [0,2,0,0,0,0|1,0,1]=4 7467 B9R0.79 CC(C)[C@@H](Cl)[C@@H](N)C(=O)O Amb27409092 [0,2,0,0,0,0|0,0,0]=2 7468 B9R0.79 CC(C)[C@@H](O)[C@@H](Br)C(=O)O Amb27394249 [0,2,0,0,0,0|0,0,0]=2 7469 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)Cl Amb27472722 [0,2,0,0,0,0|1,0,0]=3 7470 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O Amb27874042 [0,2,0,0,0,0|0,0,0]=2 7471 B9R0.79 CC(C)[C@@H](O)[C@H](C)C(=O)O Amb28347218 [0,2,0,0,0,0|0,0,0]=2 7472 B9R0.79 CC(C)[C@H](Cl)[C@@H](N)C(=O)O Amb27796326 [0,2,0,0,0,0|0,0,0]=2 7473 B9R0.79 CC(C)[C@H](N)[C@H](C)C(=O)O Amb27216704 [0,2,0,0,0,0|0,0,0]=2 7474 B9R0.79 CC(C)[C@H](N)[C@H](O)C(=O)O Amb25147282 [0,2,0,0,0,0|0,0,0]=2 7475 B9R0.79 CC(C)[C@H](O)[C@@H](C)C(=O)O Amb10844253 [0,2,0,0,0,0|0,0,0]=2 7476 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O Amb10807407 [0,2,0,0,0,0|0,0,0]=2 7477 B9R0.79 CC(C)[C@H](O)[C@H](C)C(=O)O Amb28346279 [0,2,0,0,0,0|0,0,0]=2 7478 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O Amb26333625 [0,2,0,0,0,0|0,0,0]=2 7479 B9R0.79 CC(C)[C@H](O)[C@H](O)C(=O)O Amb28050049 [0,2,0,0,0,0|0,0,0]=2 7480 B9R0.79 CC(Cl)C(C)C(N)C(=O)O Amb27838066 [0,2,0,0,0,0|1,0,0]=3 7481 B9R0.79 CC(F)C(C)C(Br)C(=O)O Amb28050032 [0,2,0,0,0,0|1,0,0]=3 7482 B9R0.79 CC(F)C(C)C(N)C(=O)O Amb28041913 [0,2,0,0,0,0|1,0,0]=3 7483 B9R0.79 CC(N)C(O)C(C)C(=O)O Amb25870814 [0,2,0,0,0,0|1,0,0]=3 7484 B9R0.79 CC(O)C(C)C(C)C(=O)O Amb28059349 [0,2,0,0,0,0|1,0,0]=3 7485 B9R0.79 CC(O)C(C)C(N)C(=O)O Amb21953714 [0,2,0,0,0,0|1,0,0]=3 7486 B9R0.79 CC(O)C(C)C(N)C(N)=O Amb33036679 [0,2,0,0,0,0|2,0,0]=4 7487 B9R0.79 CC(O)C(C)[C@@H](N)C(=O)O Amb22800202 [0,2,0,0,0,0|1,0,0]=3 7488 B9R0.79 CC(O)C(C)[C@H](N)C(=O)O Amb27390194 [0,2,0,0,0,0|1,0,0]=3 7489 B9R0.79 CC(O)C(O)C(N)C(=O)O Amb27210841 [0,2,0,0,0,0|1,0,0]=3 7490 B9R0.79 CC(O)[C@@H](C)[C@@H](N)C(=O)O Amb33524291 [0,2,0,0,0,0|1,0,0]=3 7491 B9R0.79 CC(S)C(C)C(N)C(=O)O Amb27241739 [0,2,0,0,0,0|1,0,0]=3 7492 B9R0.79 CN(C)C(=O)C(F)C(=O)O Amb28050091 [0,2,0,0,0,0|1,0,1]=4 7493 B9R0.79 C[C@@H](O)[C@@H](O)[C@H](O)C(N)=O Amb27760015 [0,2,0,0,0,0|2,0,0]=4 7494 B9R0.79 C[C@@H](O)[C@H](C)[C@@H](N)C(=O)O Amb27252085 [0,2,0,0,0,0|1,0,0]=3 7495 B9R0.79 C[C@@H](O)[C@H](C)[C@H](N)C(=O)O Amb17615448 [0,2,0,0,0,0|1,0,0]=3 7496 B9R0.79 C[C@@H]([C@@H](O)C(=O)O)N(C)C Amb28364201 [0,2,0,0,0,0|1,0,0]=3 7497 B9R0.79 C[C@H](N)[C@@H](O)[C@@H](C)C(=O)O Amb27845316 [0,2,0,0,0,0|1,0,0]=3 7498 B9R0.79 C[C@H](O)[C@@H](C)[C@@H](N)C(=O)O Amb27655509 [0,2,0,0,0,0|1,0,0]=3 7499 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O Amb27595659 [0,2,0,0,0,0|1,0,0]=3 7500 B9R0.79 C[C@H](O)[C@H](O)[C@@H](O)C(=O)O Amb27592166 [0,2,0,0,0,0|1,0,0]=3 7501 B9R0.79 C[C@H](O)[C@H](O)[C@@H](O)C(N)=O Amb27424984 [0,2,0,0,0,0|2,0,0]=4 7502 B9R0.79 C[C@H]([C@@H](C)O)[C@@H](N)C(=O)O Amb25693814 [0,2,0,0,0,0|1,0,0]=3 7503 B9R0.79 C\C(=C(\F)C(=O)O)C(C)C Amb27615103 [0,2,0,0,0,0|0,0,2]=4 7504 B9R0.79 NC(C(=O)O)C(O)C(Cl)Cl Amb27837948 [0,2,0,0,0,0|2,0,0]=4 7505 B9R0.79 NC(C(=O)O)C(O)C(F)F Amb19148422 [0,2,0,0,0,0|2,0,0]=4 7506 B9R0.79 N[C@@H](C(=O)O)[C@@H](O)C(Cl)Cl Amb27792191 [0,2,0,0,0,0|2,0,0]=4 7507 B9R0.79 N[C@@H](C(=O)O)[C@H](O)C(F)F Amb25940794 [0,2,0,0,0,0|2,0,0]=4 7508 B9R0.79 N[C@H](C(=O)O)[C@@H](O)C(F)F Amb26336091 [0,2,0,0,0,0|2,0,0]=4 7509 B9R0.77 CC(C)(C)CCC(C)(C)O Amb24729070 [0,2,0,0,0,0|1,0,1]=4 7510 B9R0.77 CC(C)(C)CCS(=O)(=O)Cl Amb17505558 [0,2,0,0,0,0|1,0,1]=4 7511 B9R0.77 CC(C)(C)CCS(=O)(=O)F Amb19373790 [0,2,0,0,0,0|1,0,1]=4 7512 B9R0.77 CC(C)(C)CCS(=O)(=O)[O-] Amb4013364 [0,2,0,0,0,0|1,0,1]=4 7513 B9R0.77 CC(C)(C)CCS(C)(=O)=O Amb27979405 [0,2,0,0,0,0|1,0,1]=4 7514 B9R0.77 CC(C)(C)CCS(N)(=O)=O Amb18792708 [0,2,0,0,0,0|1,0,1]=4 7515 B9R0.77 CC(C)(C)COP(=O)(O)O Amb27489865 [0,2,0,0,0,0|2,0,0]=4 7516 B9R0.77 CC(C)(C)NCP(=O)(O)O Amb27778513 [0,2,0,0,0,0|2,0,0]=4 7517 B9R0.77 CC(C)(F)CCS(=O)(=O)Cl Amb27646714 [0,2,0,0,0,0|1,0,1]=4 7518 B9R0.77 CC(C)(F)CCS(=O)(=O)F Amb33485526 [0,2,0,0,0,0|1,0,1]=4 7519 B9R0.77 CC(C)(N)CCC(C)(C)O Amb35615400 [0,2,0,0,0,0|1,0,1]=4 7520 B9R0.77 CC(C)(N)CCS(=O)(=O)F Amb33463852 [0,2,0,0,0,0|1,0,1]=4 7521 B9R0.77 CC(C)(N)CCS(C)(=O)=O Amb33531004 [0,2,0,0,0,0|1,0,1]=4 7522 B9R0.77 CC(C)(O)CCC(C)(C)O Amb2782000 [0,2,0,0,0,0|1,0,1]=4 7523 B9R0.77 CC(C)(O)CCS(=O)(=O)Cl Amb27751910 [0,2,0,0,0,0|1,0,1]=4 7524 B9R0.77 CC(C)(O)CCS(C)(=O)=O Amb27966618 [0,2,0,0,0,0|1,0,1]=4 7525 B7R1.2 C=C1CCC(Br)C1 Amb25135798 [1,0,0,1,0,0|2,0,0]=4 7526 B7R1.2 C=C1COC(C)C1 Amb35695393 [1,0,0,1,0,0|2,0,0]=4 7527 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [1,0,0,1,0,0|0,0,2]=4 7528 B7R1.2 CC1=CC(C)CC1 Amb24479860 [1,0,0,1,0,0|1,0,1]=4 7529 B7R1.2 CC1=NCC(=O)O1 Amb27783804 [1,0,0,1,0,0|1,0,1]=4 7530 B7R1.2 CC1C=CC(=O)C1 Amb27260718 [1,0,0,1,0,0|0,0,2]=4 7531 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [1,0,0,1,0,0|0,0,2]=4 7532 B7R1.2 CC1CC(=O)CN1 Amb28349308 [1,0,0,1,0,0|1,0,0]=3 7533 B7R1.2 CC1CC(=O)CO1 Amb25888380 [1,0,0,1,0,0|1,0,0]=3 7534 B7R1.2 CC1CC(=O)CS1 Amb23598370 [1,0,0,1,0,0|1,0,0]=3 7535 B7R1.2 CC1CC(=O)NN1 Amb493880 [1,0,0,1,0,0|2,0,0]=4 7536 B7R1.2 CC1CC(O)CN1 Amb33329377 [1,0,0,1,0,0|1,0,1]=4 7537 B7R1.2 CC1CC(O)CN1 Amb33545349 [1,0,0,1,0,0|1,0,1]=4 7538 B7R1.2 CC1CC(O)CO1 Amb28430079 [1,0,0,1,0,0|1,0,1]=4 7539 B7R1.2 CC1CCC(=O)C1 Amb8513672 [1,0,0,1,0,0|0,0,0]=2 7540 B7R1.2 CC1CCC(=O)N1 Amb19267101 [1,0,0,1,0,0|1,0,0]=3 7541 B7R1.2 CC1CCC(=O)O1 Amb6298321 [1,0,0,1,0,0|0,0,0]=2 7542 B7R1.2 CC1CCC(=O)S1 Amb27252897 [1,0,0,1,0,0|0,1,0]=3 7543 B7R1.2 CC1CCC(=S)N1 Amb27849283 [1,0,0,1,0,0|1,1,0]=4 7544 B7R1.2 CC1CCC(Br)C1 Amb26339047 [1,0,0,1,0,0|1,0,1]=4 7545 B7R1.2 CC1CCC(Cl)C1 Amb25129430 [1,0,0,1,0,0|1,0,1]=4 7546 B7R1.2 CC1CCC(I)C1 Amb27402602 [1,0,0,1,0,0|1,0,1]=4 7547 B7R1.2 CC1CCC(N)C1 Amb20669202 [1,0,0,1,0,0|1,0,1]=4 7548 B7R1.2 CC1CCC(N)C1 Amb24062164 [1,0,0,1,0,0|1,0,1]=4 7549 B7R1.2 CC1CCC(O)C1 Amb4605822 [1,0,0,1,0,0|0,0,1]=3 7550 B7R1.2 CC1CCC(O)N1 Amb28067624 [1,0,0,1,0,0|1,0,1]=4 7551 B7R1.2 CC1CCC(S)C1 Amb25829470 [1,0,0,1,0,0|0,1,1]=4 7552 B7R1.2 CC1CCN(N)C1 Amb24385963 [1,0,0,1,0,0|2,0,0]=4 7553 B7R1.2 CC1CN=C(Cl)O1 Amb27959043 [1,0,0,1,0,0|2,0,0]=4 7554 B7R1.2 CC1CN=C(N)O1 Amb26657342 [1,0,0,1,0,0|2,0,0]=4 7555 B7R1.2 CC1CN=C(N)O1 Amb33611634 [1,0,0,1,0,0|2,0,0]=4 7556 B7R1.2 CC1CNC(=O)C1 Amb10608004 [1,0,0,1,0,0|1,0,0]=3 7557 B7R1.2 CC1CNC(=O)N1 Amb17506853 [1,0,0,1,0,0|2,0,0]=4 7558 B7R1.2 CC1CNC(=O)O1 Amb19651732 [1,0,0,1,0,0|1,0,0]=3 7559 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,0,0,1,0,0|1,0,0]=3 7560 B7R1.2 CC1COC(=O)N1 Amb19517037 [1,0,0,1,0,0|2,0,0]=4 7561 B7R1.2 CC1COC(=O)O1 Amb8513300 [1,0,0,1,0,0|1,0,0]=3 7562 B7R1.2 CC1COC(O)C1 Amb28050442 [1,0,0,1,0,0|1,0,1]=4 7563 B7R1.2 CC1COS(=O)O1 Amb22346070 [1,0,0,1,0,0|2,0,0]=4 7564 B7R1.2 CC1CSC(=O)N1 Amb28320497 [1,0,0,1,0,0|2,0,0]=4 7565 B7R1.2 CC1NC(=O)CS1 Amb27806202 [1,0,0,1,0,0|2,0,0]=4 7566 B7R1.2 CC1NCC(=O)N1 Amb28456791 [1,0,0,1,0,0|2,0,0]=4 7567 B7R1.2 CC1OC(=O)CS1 Amb25314322 [1,0,0,1,0,0|1,0,0]=3 7568 B7R1.2 CN1CCC(=O)C1 Amb22236123 [1,0,0,1,0,0|1,0,0]=3 7569 B7R1.2 CN1CCC(=O)C1 Amb8947873 [1,0,0,1,0,0|1,0,0]=3 7570 B7R1.2 CN1CCC(=O)N1 Amb24064860 [1,0,0,1,0,0|2,0,0]=4 7571 B7R1.2 CN1CCC(O)C1 Amb32652719 [1,0,0,1,0,0|1,0,1]=4 7572 B7R1.2 CN1CCC(O)C1 Amb8384297 [1,0,0,1,0,0|1,0,1]=4 7573 B7R1.2 CN1CC[C@@H](O)C1 Amb8386825 [1,0,0,1,0,0|1,0,1]=4 7574 B7R1.2 CN1CC[C@H](O)C1 Amb10070789 [1,0,0,1,0,0|1,0,1]=4 7575 B7R1.2 CP1CC[C@H](O)C1 Amb27452496 [1,0,0,1,0,0|1,0,1]=4 7576 B7R1.2 C[C@@H]1C=CC(=O)C1 Amb28199837 [1,0,0,1,0,0|0,0,2]=4 7577 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,0,0,1,0,0|0,0,0]=2 7578 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [1,0,0,1,0,0|1,0,0]=3 7579 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [1,0,0,1,0,0|0,0,0]=2 7580 B7R1.2 C[C@@H]1CC[C@@H](Br)C1 Amb27791803 [1,0,0,1,0,0|1,0,1]=4 7581 B7R1.2 C[C@@H]1CC[C@@H](C)C1 Amb25176920 [1,0,0,1,0,0|1,0,1]=4 7582 B7R1.2 C[C@@H]1CC[C@H](O)C1 Amb27853110 [1,0,0,1,0,0|0,0,1]=3 7583 B7R1.2 C[C@@H]1CN=C(N)O1 Amb33742469 [1,0,0,1,0,0|2,0,0]=4 7584 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,0,0,1,0,0|1,0,0]=3 7585 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [1,0,0,1,0,0|1,0,0]=3 7586 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,0,0,1,0,0|1,0,0]=3 7587 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [1,0,0,1,0,0|2,0,0]=4 7588 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [1,0,0,1,0,0|1,0,0]=3 7589 B7R1.2 C[C@@H]1COC(O)C1 Amb27399504 [1,0,0,1,0,0|1,0,1]=4 7590 B7R1.2 C[C@@H]1COS(=O)O1 Amb27979548 [1,0,0,1,0,0|2,0,0]=4 7591 B7R1.2 C[C@@H]1CO[C@@H](O)C1 Amb27422487 [1,0,0,1,0,0|1,0,1]=4 7592 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22746400 [1,0,0,1,0,0|1,0,1]=4 7593 B7R1.2 C[C@@H]1C[C@H](O)CN1 Amb22886268 [1,0,0,1,0,0|1,0,1]=4 7594 B7R1.2 C[C@H]1C=CC(=O)C1 Amb27262978 [1,0,0,1,0,0|0,0,2]=4 7595 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [1,0,0,1,0,0|0,0,0]=2 7596 B7R1.2 C[C@H]1CC[C@H](C)C1 Amb22747863 [1,0,0,1,0,0|1,0,1]=4 7597 B7R1.2 C[C@H]1CN=C(N)O1 Amb33744016 [1,0,0,1,0,0|2,0,0]=4 7598 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [1,0,0,1,0,0|1,0,0]=3 7599 B7R1.2 C[C@H]1CNC(=O)N1 Amb27413051 [1,0,0,1,0,0|2,0,0]=4 7600 B7R1.2 C[C@H]1CNC(=S)O1 Amb27843992 [1,0,0,1,0,0|1,1,0]=4 7601 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,0,0,1,0,0|1,0,0]=3 7602 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [1,0,0,1,0,0|2,0,0]=4 7603 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [1,0,0,1,0,0|1,0,0]=3 7604 B7R1.2 C[C@H]1C[C@@H](O)CN1 Amb33872130 [1,0,0,1,0,0|1,0,1]=4 7605 B7R1.2 C[C@H]1C[C@@H](O)CO1 Amb28245786 [1,0,0,1,0,0|1,0,1]=4 7606 B7R1.2 C[C@H]1C[C@@H](O)CS1 Amb27662171 [1,0,0,1,0,0|1,0,1]=4 7607 B7R1.2 C[C@H]1C[C@H](O)CN1 Amb33801108 [1,0,0,1,0,0|1,0,1]=4 7608 B7R1.2 NC1CCC(=O)C1 Amb22494268 [1,0,0,1,0,0|1,0,0]=3 7609 B7R1.2 NC1CCC(=O)N1 Amb24480433 [1,0,0,1,0,0|2,0,0]=4 7610 B7R1.2 NC1CCC(=O)O1 Amb17593085 [1,0,0,1,0,0|1,0,0]=3 7611 B7R1.2 NC1CCC(O)C1 Amb18561405 [1,0,0,1,0,0|1,0,1]=4 7612 B7R1.2 NC1CCC(O)C1 Amb19958405 [1,0,0,1,0,0|1,0,1]=4 7613 B7R1.2 NC1CCS(=O)C1 Amb19149072 [1,0,0,1,0,0|2,0,0]=4 7614 B7R1.2 NC1CCS(=O)C1 Amb25133789 [1,0,0,1,0,0|2,0,0]=4 7615 B7R1.2 NC1CNC(=O)C1 Amb17760661 [1,0,0,1,0,0|2,0,0]=4 7616 B7R1.2 NC1CNC(=O)C1 Amb33544169 [1,0,0,1,0,0|2,0,0]=4 7617 B7R1.2 NC1COC(=O)C1 Amb30594428 [1,0,0,1,0,0|2,0,0]=4 7618 B7R1.2 NC1COC(=O)C1 Amb9782136 [1,0,0,1,0,0|2,0,0]=4 7619 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Amb10066961 [1,0,0,1,0,0|1,0,1]=4 7620 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Amb16233749 [1,0,0,1,0,0|1,0,1]=4 7621 B7R1.2 N[C@@H]1CC[C@H](O)C1 Amb10066973 [1,0,0,1,0,0|1,0,1]=4 7622 B7R1.2 N[C@@H]1CC[C@H](O)C1 Amb22406236 [1,0,0,1,0,0|1,0,1]=4 7623 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [1,0,0,1,0,0|2,0,0]=4 7624 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [1,0,0,1,0,0|2,0,0]=4 7625 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [1,0,0,1,0,0|2,0,0]=4 7626 B7R1.2 N[C@@H]1COC(=O)C1 Amb16233747 [1,0,0,1,0,0|2,0,0]=4 7627 B7R1.2 N[C@@H]1COC(=O)C1 Amb26477774 [1,0,0,1,0,0|2,0,0]=4 7628 B7R1.2 N[C@H]1CCC(=O)N1 Amb27482175 [1,0,0,1,0,0|2,0,0]=4 7629 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb10066971 [1,0,0,1,0,0|1,0,1]=4 7630 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb22274622 [1,0,0,1,0,0|1,0,1]=4 7631 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb34916039 [1,0,0,1,0,0|1,0,1]=4 7632 B7R1.2 N[C@H]1CC[C@H](O)C1 Amb10066972 [1,0,0,1,0,0|1,0,1]=4 7633 B7R1.2 N[C@H]1CC[C@H](O)C1 Amb22386861 [1,0,0,1,0,0|1,0,1]=4 7634 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [1,0,0,1,0,0|2,0,0]=4 7635 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [1,0,0,1,0,0|2,0,0]=4 7636 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [1,0,0,1,0,0|2,0,0]=4 7637 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [1,0,0,1,0,0|2,0,0]=4 7638 B7R1.2 O=C1CC(F)CO1 Amb24431109 [1,0,0,1,0,0|2,0,0]=4 7639 B7R1.2 O=C1CC(I)CO1 Amb27401189 [1,0,0,1,0,0|2,0,0]=4 7640 B7R1.2 O=C1CC(O)CN1 Amb19958404 [1,0,0,1,0,0|2,0,0]=4 7641 B7R1.2 O=C1CC(O)CO1 Amb4006296 [1,0,0,1,0,0|2,0,0]=4 7642 B7R1.2 O=C1CC(S)CN1 Amb25685875 [1,0,0,1,0,0|2,0,0]=4 7643 B7R1.2 O=C1CCC(=O)C1 Amb2696524 [1,0,0,1,0,0|1,0,1]=4 7644 B7R1.2 O=C1CCC(=O)O1 Amb2793017 [1,0,0,1,0,0|1,0,1]=4 7645 B7R1.2 O=C1CCC(Br)C1 Amb24334292 [1,0,0,1,0,0|1,0,0]=3 7646 B7R1.2 O=C1CCC(Br)N1 Amb27592181 [1,0,0,1,0,0|2,0,0]=4 7647 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [1,0,0,1,0,0|1,0,0]=3 7648 B7R1.2 O=C1CCC(Cl)C1 Amb26585347 [1,0,0,1,0,0|1,0,0]=3 7649 B7R1.2 O=C1CCC(Cl)O1 Amb27477474 [1,0,0,1,0,0|1,0,0]=3 7650 B7R1.2 O=C1CCC(F)C1 Amb21963553 [1,0,0,1,0,0|1,0,0]=3 7651 B7R1.2 O=C1CCC(O)C1 Amb22057378 [1,0,0,1,0,0|1,0,0]=3 7652 B7R1.2 O=C1CCC(O)O1 Amb22740957 [1,0,0,1,0,0|1,0,0]=3 7653 B7R1.2 O=C1CCS(=O)C1 Amb27199097 [1,0,0,1,0,0|2,0,0]=4 7654 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [1,0,0,1,0,0|1,0,0]=3 7655 B7R1.2 O=C1CC[C@@H](O)N1 Amb27458284 [1,0,0,1,0,0|2,0,0]=4 7656 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [1,0,0,1,0,0|1,0,0]=3 7657 B7R1.2 O=C1CC[C@H](O)N1 Amb27881572 [1,0,0,1,0,0|2,0,0]=4 7658 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [1,0,0,1,0,0|2,0,0]=4 7659 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [1,0,0,1,0,0|2,0,0]=4 7660 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [1,0,0,1,0,0|2,0,0]=4 7661 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [1,0,0,1,0,0|2,0,0]=4 7662 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [1,0,0,1,0,0|2,0,0]=4 7663 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [1,0,0,1,0,0|2,0,0]=4 7664 B7R1.2 O=C1OC(O)CS1 Amb28066979 [1,0,0,1,0,0|2,0,0]=4 7665 B7R1.2 O=C1OCC(Cl)O1 Amb10842117 [1,0,0,1,0,0|2,0,0]=4 7666 B7R1.2 O=C1OCC(F)O1 Amb10841016 [1,0,0,1,0,0|2,0,0]=4 7667 B7R1.2 O=S1CCC(Br)C1 Amb27872345 [1,0,0,1,0,0|2,0,0]=4 7668 B7R1.2 O=S1CCC(O)C1 Amb26600157 [1,0,0,1,0,0|2,0,0]=4 7669 B7R1.2 O=S1CC[C@@H](O)C1 Amb28191911 [1,0,0,1,0,0|2,0,0]=4 7670 B7R1.2 OC1CCC(O)C1 Amb8513837 [1,0,0,1,0,0|1,0,1]=4 7671 B7R1.2 OC1CCN(O)C1 Amb27430271 [1,0,0,1,0,0|2,0,0]=4 7672 B7R1.2 O[C@@H]1CC[C@@H](O)C1 Amb24519755 [1,0,0,1,0,0|1,0,1]=4 7673 B7R1.2 O[C@H]1CC[C@@H](O)C1 Amb26035335 [1,0,0,1,0,0|1,0,1]=4 7674 B7R1.2 O[C@H]1CC[C@H](O)C1 Amb26400686 [1,0,0,1,0,0|1,0,1]=4 7675 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [1,0,0,1,0,0|2,0,0]=4 7676 B7R1.3 BrC1=CCCCC1 Amb21856761 [1,0,0,1,0,0|2,0,0]=4 7677 B7R1.3 BrC1=CCCCO1 Amb24322651 [1,0,0,1,0,0|1,0,1]=4 7678 B7R1.3 BrC1CC=CCC1 Amb22229671 [1,0,0,1,0,0|2,0,0]=4 7679 B7R1.3 BrC1CCCCO1 Amb24322575 [1,0,0,1,0,0|1,0,1]=4 7680 B7R1.3 BrC1CCCOC1 Amb9173669 [1,0,0,1,0,0|1,0,1]=4 7681 B7R1.3 C=C1CCCCC1 Amb8515603 [1,0,0,1,0,0|2,0,0]=4 7682 B7R1.3 C=C1CCCCN1 Amb27801038 [1,0,0,1,0,0|2,0,0]=4 7683 B7R1.3 C=C1CCCCO1 Amb28345156 [1,0,0,1,0,0|1,0,0]=3 7684 B7R1.3 C=C1OCCCO1 Amb25734089 [1,0,0,1,0,0|2,0,0]=4 7685 B7R1.3 CC1=CCCCC1 Amb8513524 [1,0,0,1,0,0|2,0,0]=4 7686 B7R1.3 CC1=CCCCO1 Amb24480530 [1,0,0,1,0,0|1,0,1]=4 7687 B7R1.3 CC1=NCCCC1 Amb27459940 [1,0,0,1,0,0|2,0,0]=4 7688 B7R1.3 CC1CC=CCN1 Amb27460532 [1,0,0,1,0,0|2,0,0]=4 7689 B7R1.3 CC1CC=NCC1 Amb27453017 [1,0,0,1,0,0|2,0,0]=4 7690 B7R1.3 CC1CCCCO1 Amb4035049 [1,0,0,1,0,0|1,0,1]=4 7691 B7R1.3 CC1CCCNC1 Amb22491688 [1,0,0,1,0,0|1,0,1]=4 7692 B7R1.3 CC1CCCNC1 Amb9703089 [1,0,0,1,0,0|1,0,1]=4 7693 B7R1.3 CC1CCCOC1 Amb22347806 [1,0,0,1,0,0|0,0,1]=3 7694 B7R1.3 CC1CCNCC1 Amb2689655 [1,0,0,1,0,0|2,0,0]=4 7695 B7R1.3 CC1CCOCC1 Amb22043825 [1,0,0,1,0,0|2,0,0]=4 7696 B7R1.3 CC1CCSCC1 Amb27436849 [1,0,0,1,0,0|2,0,0]=4 7697 B7R1.3 CC1CN=CNC1 Amb27626010 [1,0,0,1,0,0|2,0,0]=4 7698 B7R1.3 CC1COCCN1 Amb22728071 [1,0,0,1,0,0|1,0,1]=4 7699 B7R1.3 CC1COCCN1 Amb6740293 [1,0,0,1,0,0|1,0,1]=4 7700 B7R1.3 CN1CC=CCC1 Amb22734271 [1,0,0,1,0,0|2,0,0]=4 7701 B7R1.3 C[C@@H]1CCCNC1 Amb24461444 [1,0,0,1,0,0|1,0,1]=4 7702 B7R1.3 C[C@@H]1CCCNC1 Amb33801279 [1,0,0,1,0,0|1,0,1]=4 7703 B7R1.3 C[C@@H]1COCCN1 Amb10066948 [1,0,0,1,0,0|1,0,1]=4 7704 B7R1.3 C[C@@H]1COCCN1 Amb22169654 [1,0,0,1,0,0|1,0,1]=4 7705 B7R1.3 C[C@H]1CCCNC1 Amb22745835 [1,0,0,1,0,0|1,0,1]=4 7706 B7R1.3 C[C@H]1CCCNC1 Amb8387001 [1,0,0,1,0,0|1,0,1]=4 7707 B7R1.3 C[C@H]1COCCN1 Amb10066947 [1,0,0,1,0,0|1,0,1]=4 7708 B7R1.3 C[C@H]1COCCN1 Amb19516190 [1,0,0,1,0,0|1,0,1]=4 7709 B7R1.3 C[SiH]1CCCCO1 Amb26582586 [1,0,0,1,0,0|1,1,0]=4 7710 B7R1.3 ClC1=CCCCC1 Amb9785147 [1,0,0,1,0,0|2,0,0]=4 7711 B7R1.3 ClC1=CCCCO1 Amb27449514 [1,0,0,1,0,0|1,0,1]=4 7712 B7R1.3 ClC1CC=CCC1 Amb22229749 [1,0,0,1,0,0|2,0,0]=4 7713 B7R1.3 ClC1CC=COC1 Amb27400096 [1,0,0,1,0,0|1,0,1]=4 7714 B7R1.3 ClC1CCCCO1 Amb17673285 [1,0,0,1,0,0|1,0,1]=4 7715 B7R1.3 ClC1CCCOC1 Amb20622589 [1,0,0,1,0,0|1,0,1]=4 7716 B7R1.3 FC1CCCCO1 Amb24322826 [1,0,0,1,0,0|1,0,1]=4 7717 B7R1.3 FC1CCCOC1 Amb24322825 [1,0,0,1,0,0|1,0,1]=4 7718 B7R1.3 IC1=CCCCC1 Amb27750996 [1,0,0,1,0,0|2,0,0]=4 7719 B7R1.3 IC1CC=CCC1 Amb27446684 [1,0,0,1,0,0|2,0,0]=4 7720 B7R1.3 IC1CCCOC1 Amb22831295 [1,0,0,1,0,0|1,0,1]=4 7721 B7R1.3 N=C1CCCCC1 Amb26924126 [1,0,0,1,0,0|2,0,0]=4 7722 B7R1.3 N=C1CCCCN1 Amb17616049 [1,0,0,1,0,0|2,0,0]=4 7723 B7R1.3 N=C1CCCCN1 Amb2780013 [1,0,0,1,0,0|2,0,0]=4 7724 B7R1.3 N=C1NCCCO1 Amb23597225 [1,0,0,1,0,0|2,0,0]=4 7725 B7R1.3 N=C1NCCCO1 Amb28990985 [1,0,0,1,0,0|2,0,0]=4 7726 B7R1.3 NC1=CCCCC1 Amb28456773 [1,0,0,1,0,0|2,0,0]=4 7727 B7R1.3 NC1=NCCCC1 Amb3997189 [1,0,0,1,0,0|2,0,0]=4 7728 B7R1.3 NC1CC=CCC1 Amb18639038 [1,0,0,1,0,0|2,0,0]=4 7729 B7R1.3 NC1CC=CCC1 Amb19515491 [1,0,0,1,0,0|2,0,0]=4 7730 B7R1.3 NC1CCCOC1 Amb1091859 [1,0,0,1,0,0|1,0,1]=4 7731 B7R1.3 NC1CCCOC1 Amb19889218 [1,0,0,1,0,0|1,0,1]=4 7732 B7R1.3 N[C@@H]1CC=CCC1 Amb27975676 [1,0,0,1,0,0|2,0,0]=4 7733 B7R1.3 N[C@@H]1CCCOC1 Amb19516292 [1,0,0,1,0,0|1,0,1]=4 7734 B7R1.3 N[C@@H]1CCCOC1 Amb20241267 [1,0,0,1,0,0|1,0,1]=4 7735 B7R1.3 N[C@H]1CC=CCC1 Amb26609127 [1,0,0,1,0,0|2,0,0]=4 7736 B7R1.3 N[C@H]1CCCCO1 Amb27655590 [1,0,0,1,0,0|1,0,1]=4 7737 B7R1.3 N[C@H]1CCCOC1 Amb19516313 [1,0,0,1,0,0|1,0,1]=4 7738 B7R1.3 N[C@H]1CCCOC1 Amb20241266 [1,0,0,1,0,0|1,0,1]=4 7739 B7R1.3 N[C@H]1CCCOC1 Amb34916114 [1,0,0,1,0,0|1,0,1]=4 7740 B7R1.3 O=C1C=CCCC1 Amb17843126 [1,0,0,1,0,0|1,0,1]=4 7741 B7R1.3 O=C1C=CCCO1 Amb15693457 [1,0,0,1,0,0|0,0,2]=4 7742 B7R1.3 O=C1CCCCC1 Amb2793026 [1,0,0,1,0,0|1,0,0]=3 7743 B7R1.3 O=C1CCCCN1 Amb6892006 [1,0,0,1,0,0|1,0,0]=3 7744 B7R1.3 O=C1CCCCO1 Amb8513592 [1,0,0,1,0,0|0,0,0]=2 7745 B7R1.3 O=C1CCCCS1 Amb25186924 [1,0,0,1,0,0|0,1,0]=3 7746 B7R1.3 O=C1CCCNC1 Amb10070944 [1,0,0,1,0,0|2,0,0]=4 7747 B7R1.3 O=C1CCCNC1 Amb10602349 [1,0,0,1,0,0|2,0,0]=4 7748 B7R1.3 O=C1CCCNC1 Amb19958010 [1,0,0,1,0,0|2,0,0]=4 7749 B7R1.3 O=C1CCCNN1 Amb18061622 [1,0,0,1,0,0|2,0,0]=4 7750 B7R1.3 O=C1CCCOC1 Amb19373430 [1,0,0,1,0,0|2,0,0]=4 7751 B7R1.3 O=C1CCCON1 Amb26560803 [1,0,0,1,0,0|2,0,0]=4 7752 B7R1.3 O=C1CCCSC1 Amb13952257 [1,0,0,1,0,0|2,0,0]=4 7753 B7R1.3 O=C1CCNCC1 Amb2690392 [1,0,0,1,0,0|2,0,0]=4 7754 B7R1.3 O=C1CCNCC1 Amb2793002 [1,0,0,1,0,0|2,0,0]=4 7755 B7R1.3 O=C1CCNCC1 Amb8394939 [1,0,0,1,0,0|2,0,0]=4 7756 B7R1.3 O=C1CCNCN1 Amb27458283 [1,0,0,1,0,0|2,0,0]=4 7757 B7R1.3 O=C1CCOCC1 Amb2725565 [1,0,0,1,0,0|2,0,0]=4 7758 B7R1.3 O=C1CCSCC1 Amb1154265 [1,0,0,1,0,0|2,0,0]=4 7759 B7R1.3 O=C1CNCCN1 Amb4138465 [1,0,0,1,0,0|2,0,0]=4 7760 B7R1.3 O=C1CNCCN1 Amb6334808 [1,0,0,1,0,0|2,0,0]=4 7761 B7R1.3 O=C1CNCCO1 Amb19958702 [1,0,0,1,0,0|1,0,0]=3 7762 B7R1.3 O=C1CNCCO1 Amb32410210 [1,0,0,1,0,0|1,0,0]=3 7763 B7R1.3 O=C1COCCN1 Amb15691115 [1,0,0,1,0,0|2,0,0]=4 7764 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,1,0,0|1,0,0]=3 7765 B7R1.3 O=C1CSCCN1 Amb674722 [1,0,0,1,0,0|2,0,0]=4 7766 B7R1.3 O=C1CSCCO1 Amb28069740 [1,0,0,1,0,0|1,0,0]=3 7767 B7R1.3 O=C1CSCCS1 Amb24539369 [1,0,0,1,0,0|1,1,0]=4 7768 B7R1.3 O=C1NCCCN1 Amb4034594 [1,0,0,1,0,0|2,0,0]=4 7769 B7R1.3 O=C1NCCCO1 Amb10608499 [1,0,0,1,0,0|1,0,0]=3 7770 B7R1.3 O=C1NCCCS1 Amb24117134 [1,0,0,1,0,0|1,1,0]=4 7771 B7R1.3 O=C1NNCCO1 Amb32683554 [1,0,0,1,0,0|2,0,0]=4 7772 B7R1.3 O=C1OCCCO1 Amb4034896 [1,0,0,1,0,0|1,0,0]=3 7773 B7R1.3 O=S1OCCCO1 Amb20240777 [1,0,0,1,0,0|2,0,0]=4 7774 B7R1.3 OC1=NCCNC1 Amb22330543 [1,0,0,1,0,0|2,0,0]=4 7775 B7R1.3 OC1CCCCC1 Amb4605832 [1,0,0,1,0,0|1,0,1]=4 7776 B7R1.3 OC1CCCCN1 Amb8393085 [1,0,0,1,0,0|1,0,1]=4 7777 B7R1.3 OC1CCCCO1 Amb8517292 [1,0,0,1,0,0|0,0,2]=4 7778 B7R1.3 OC1CCCOC1 Amb16192108 [1,0,0,1,0,0|1,0,1]=4 7779 B7R1.3 OC1CCNOC1 Amb32698233 [1,0,0,1,0,0|2,0,0]=4 7780 B7R1.3 ON1CCCCC1 Amb6468702 [1,0,0,1,0,0|2,0,0]=4 7781 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [1,0,0,1,0,0|1,0,1]=4 7782 B7R1.3 O[C@H]1CCCOC1 Amb20241306 [1,0,0,1,0,0|1,0,1]=4 7783 B7R1.3 S=C1CCCCN1 Amb5720520 [1,0,0,1,0,0|1,1,0]=4 7784 B7R1.3 S=C1NCCCO1 Amb22524560 [1,0,0,1,0,0|1,1,0]=4 7785 B7R1.3 SC1CC=CCC1 Amb33318612 [1,0,0,1,0,0|2,0,0]=4 7786 B7R1.3 SC1CCCOC1 Amb24066221 [1,0,0,1,0,0|1,0,1]=4 7787 B7R1.5 C#CCC1CC1C Amb33144239 [1,0,0,1,0,0|1,0,1]=4 7788 B7R1.5 C=CCC1CC1O Amb26478050 [1,0,0,1,0,0|2,0,0]=4 7789 B7R1.5 C=CC[C@@H]1C[C@@H]1Cl Amb27983599 [1,0,0,1,0,0|2,0,0]=4 7790 B7R1.5 C=CC[C@@H]1C[C@@H]1O Amb28053769 [1,0,0,1,0,0|2,0,0]=4 7791 B7R1.5 CC1CC1CC#N Amb25888500 [1,0,0,1,0,0|1,0,1]=4 7792 B7R1.5 CC1CC1CC=O Amb25737156 [1,0,0,1,0,0|0,0,0]=2 7793 B7R1.5 CC1CC1CCBr Amb26055211 [1,0,0,1,0,0|1,0,1]=4 7794 B7R1.5 CC1CC1CCN Amb27835415 [1,0,0,1,0,0|1,0,1]=4 7795 B7R1.5 CC1CC1CCO Amb25026465 [1,0,0,1,0,0|0,0,1]=3 7796 B7R1.5 CC1CC1CCS Amb33143846 [1,0,0,1,0,0|0,1,1]=4 7797 B7R1.5 CC1CC1CNN Amb10610283 [1,0,0,1,0,0|2,0,0]=4 7798 B7R1.5 CC1CC1CNN Amb6246477 [1,0,0,1,0,0|2,0,0]=4 7799 B7R1.5 CC1CC1CNO Amb32954149 [1,0,0,1,0,0|1,0,0]=3 7800 B7R1.5 CC1CC1CON Amb33144974 [1,0,0,1,0,0|2,0,0]=4 7801 B7R1.5 CC1CC1N=C=O Amb9730071 [1,0,0,1,0,0|1,0,1]=4 7802 B7R1.5 CC1CC1NC=O Amb28200843 [1,0,0,1,0,0|1,0,0]=3 7803 B7R1.5 CCCC1ON1C Amb22232363 [1,0,0,1,0,0|2,0,0]=4 7804 B7R1.5 CNCC1CC1C Amb35789304 [1,0,0,1,0,0|2,0,0]=4 7805 B7R1.5 CNCC1CC1C Amb8853678 [1,0,0,1,0,0|2,0,0]=4 7806 B7R1.5 CNC[C@@H]1C[C@H]1C Amb27214669 [1,0,0,1,0,0|2,0,0]=4 7807 B7R1.5 C[C@@H]1C[C@@H]1CCBr Amb27454257 [1,0,0,1,0,0|1,0,1]=4 7808 B7R1.5 C[C@@H]1C[C@@H]1CCO Amb26012892 [1,0,0,1,0,0|0,0,1]=3 7809 B7R1.5 C[C@@H]1O[C@H]1CCO Amb27184243 [1,0,0,1,0,0|1,0,1]=4 7810 B7R1.5 C[C@H]1C[C@H]1CCCl Amb27630412 [1,0,0,1,0,0|1,0,1]=4 7811 B7R1.5 N[C@@H]1C[C@H]1CCO Amb28074110 [1,0,0,1,0,0|1,0,1]=4 7812 B7R1.5 OCCC1CC1F Amb27238848 [1,0,0,1,0,0|1,0,1]=4 7813 B7R1.5 [C-]#[N+]CC1CC1C Amb33144641 [1,0,0,1,0,0|2,0,0]=4 7814 B7R1.7 BrCCCC1CC1 Amb24606733 [1,0,0,1,0,0|1,0,1]=4 7815 B7R1.7 C#CCCC1CC1 Amb33429088 [1,0,0,1,0,0|1,0,1]=4 7816 B7R1.7 C=CCCC1CO1 Amb3940512 [1,0,0,1,0,0|2,0,0]=4 7817 B7R1.7 C=CCC[C@@H]1CO1 Amb28050706 [1,0,0,1,0,0|2,0,0]=4 7818 B7R1.7 C=CCC[C@H]1CO1 Amb24429350 [1,0,0,1,0,0|2,0,0]=4 7819 B7R1.7 C=CCNC1CC1 Amb17309103 [1,0,0,1,0,0|2,0,0]=4 7820 B7R1.7 C=CCNC1CC1 Amb28555343 [1,0,0,1,0,0|2,0,0]=4 7821 B7R1.7 CCCCC1CO1 Amb17771532 [1,0,0,1,0,0|1,0,1]=4 7822 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [1,0,0,1,0,0|1,0,1]=4 7823 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [1,0,0,1,0,0|1,0,1]=4 7824 B7R1.7 CNCCC1CC1 Amb18979588 [1,0,0,1,0,0|2,0,0]=4 7825 B7R1.7 CNCCC1CC1 Amb33550263 [1,0,0,1,0,0|2,0,0]=4 7826 B7R1.7 CSCCC1CC1 Amb28079007 [1,0,0,1,0,0|2,0,0]=4 7827 B7R1.7 ICCCC1CC1 Amb35720662 [1,0,0,1,0,0|1,0,1]=4 7828 B7R1.7 N#CCCC1CC1 Amb33548668 [1,0,0,1,0,0|1,0,1]=4 7829 B7R1.7 NCCCC1CC1 Amb18296303 [1,0,0,1,0,0|1,0,1]=4 7830 B7R1.7 NCCCC1CC1 Amb33548306 [1,0,0,1,0,0|1,0,1]=4 7831 B7R1.7 NNCCC1CC1 Amb27806776 [1,0,0,1,0,0|2,0,0]=4 7832 B7R1.7 NOCCC1CC1 Amb28050766 [1,0,0,1,0,0|2,0,0]=4 7833 B7R1.7 NOCCC1CC1 Amb6308072 [1,0,0,1,0,0|2,0,0]=4 7834 B7R1.7 O=C=NCC1CC1 Amb18955466 [1,0,0,1,0,0|1,0,1]=4 7835 B7R1.7 O=CCC=C1CC1 Amb27799822 [1,0,0,1,0,0|0,0,2]=4 7836 B7R1.7 O=CCCC1CC1 Amb21864768 [1,0,0,1,0,0|0,0,0]=2 7837 B7R1.7 O=CNCC1CC1 Amb28322746 [1,0,0,1,0,0|1,0,0]=3 7838 B7R1.7 O=COCC1CO1 Amb24632689 [1,0,0,1,0,0|2,0,0]=4 7839 B7R1.7 O=C\C=C\C1CC1 Amb32664515 [1,0,0,1,0,0|0,0,2]=4 7840 B7R1.7 OCCCC1CC1 Amb19888792 [1,0,0,1,0,0|0,0,1]=3 7841 B7R1.7 OCCCC1CO1 Amb28294234 [1,0,0,1,0,0|1,0,1]=4 7842 B7R1.7 OCCC[C@@H]1CO1 Amb27394788 [1,0,0,1,0,0|1,0,1]=4 7843 B7R1.7 OCCNC1CC1 Amb6251502 [1,0,0,1,0,0|1,0,1]=4 7844 B7R1.7 OCCOC1CC1 Amb26852318 [1,0,0,1,0,0|1,0,1]=4 7845 B7R1.7 ONCCC1CC1 Amb33361506 [1,0,0,1,0,0|1,0,0]=3 7846 B7R1.7 O\N=C\CC1CC1 Amb24627412 [1,0,0,1,0,0|1,0,1]=4 7847 B7R1.7 SCCCC1CC1 Amb28244922 [1,0,0,1,0,0|0,1,1]=4 7848 B7R1.7 [C-]#[N+]CCC1CC1 Amb33428962 [1,0,0,1,0,0|2,0,0]=4 7849 B7R1.10 C=C1CC(C=O)C1 Amb22896623 [1,0,0,1,0,0|0,0,2]=4 7850 B7R1.10 C=C[C@H]1C[C@@H](O)C1 Amb27981576 [1,0,0,1,0,0|2,0,0]=4 7851 B7R1.10 CC1CC(C=O)C1 Amb27827798 [1,0,0,1,0,0|0,0,0]=2 7852 B7R1.10 CC1CC(CBr)C1 Amb23537768 [1,0,0,1,0,0|1,0,1]=4 7853 B7R1.10 CC1CC(CCl)C1 Amb23556405 [1,0,0,1,0,0|1,0,1]=4 7854 B7R1.10 CC1CC(CN)C1 Amb22886186 [1,0,0,1,0,0|1,0,1]=4 7855 B7R1.10 CC1CC(CN)C1 Amb23580259 [1,0,0,1,0,0|1,0,1]=4 7856 B7R1.10 CC1CC(CO)C1 Amb23556375 [1,0,0,1,0,0|0,0,1]=3 7857 B7R1.10 CC1CC(CO)N1 Amb33802775 [1,0,0,1,0,0|1,0,1]=4 7858 B7R1.10 CC1CN(C=O)C1 Amb35587584 [1,0,0,1,0,0|1,0,0]=3 7859 B7R1.10 CCC1CC(=O)C1 Amb24406738 [1,0,0,1,0,0|1,0,0]=3 7860 B7R1.10 CN1CC(CO)C1 Amb27460499 [1,0,0,1,0,0|1,0,1]=4 7861 B7R1.10 CN1CC(CO)C1 Amb33456857 [1,0,0,1,0,0|1,0,1]=4 7862 B7R1.10 CNC1CC(C)C1 Amb22886204 [1,0,0,1,0,0|2,0,0]=4 7863 B7R1.10 COC1CC(=O)C1 Amb22754340 [1,0,0,1,0,0|2,0,0]=4 7864 B7R1.10 COC1CC(=O)N1 Amb27802279 [1,0,0,1,0,0|2,0,0]=4 7865 B7R1.10 CSC1CC(=O)C1 Amb32655823 [1,0,0,1,0,0|2,0,0]=4 7866 B7R1.10 CSC1CC(=O)N1 Amb25265230 [1,0,0,1,0,0|2,0,0]=4 7867 B7R1.10 CS[C@@H]1CC(=O)N1 Amb27981333 [1,0,0,1,0,0|2,0,0]=4 7868 B7R1.10 C[C@H]1C[C@@H](CBr)C1 Amb27237309 [1,0,0,1,0,0|1,0,1]=4 7869 B7R1.10 C[C@H]1C[C@H](CBr)C1 Amb27590260 [1,0,0,1,0,0|1,0,1]=4 7870 B7R1.10 NC1CC(CO)C1 Amb21960726 [1,0,0,1,0,0|1,0,1]=4 7871 B7R1.10 NC1CC(CO)C1 Amb23570501 [1,0,0,1,0,0|1,0,1]=4 7872 B7R1.10 NCC1CC(=O)C1 Amb18251063 [1,0,0,1,0,0|2,0,0]=4 7873 B7R1.10 NCC1CC(=O)C1 Amb22406094 [1,0,0,1,0,0|2,0,0]=4 7874 B7R1.10 NCC1CC(=O)N1 Amb25230632 [1,0,0,1,0,0|2,0,0]=4 7875 B7R1.10 N[C@H]1C[C@@H](CO)C1 Amb22745997 [1,0,0,1,0,0|1,0,1]=4 7876 B7R1.10 N[C@H]1C[C@@H](CO)C1 Amb22747308 [1,0,0,1,0,0|1,0,1]=4 7877 B7R1.10 N[C@H]1C[C@H](CO)C1 Amb23439196 [1,0,0,1,0,0|1,0,1]=4 7878 B7R1.10 N[C@H]1C[C@H](CO)C1 Amb25124019 [1,0,0,1,0,0|1,0,1]=4 7879 B7R1.10 O=C1CC(CBr)C1 Amb20671344 [1,0,0,1,0,0|2,0,0]=4 7880 B7R1.10 O=C1CC(CBr)O1 Amb26981027 [1,0,0,1,0,0|1,0,0]=3 7881 B7R1.10 O=C1CC(CCl)C1 Amb10610581 [1,0,0,1,0,0|2,0,0]=4 7882 B7R1.10 O=C1CC(CCl)O1 Amb28322279 [1,0,0,1,0,0|1,0,0]=3 7883 B7R1.10 O=C1CC(CF)C1 Amb26416198 [1,0,0,1,0,0|2,0,0]=4 7884 B7R1.10 O=C1CC(CI)N1 Amb27838210 [1,0,0,1,0,0|2,0,0]=4 7885 B7R1.10 O=C1CC(CO)C1 Amb16231082 [1,0,0,1,0,0|2,0,0]=4 7886 B7R1.10 O=C1CC(CO)N1 Amb22388379 [1,0,0,1,0,0|2,0,0]=4 7887 B7R1.10 O=C1C[C@H](CO)N1 Amb26887642 [1,0,0,1,0,0|2,0,0]=4 7888 B7R1.10 O=CC1CC(F)C1 Amb28198994 [1,0,0,1,0,0|1,0,0]=3 7889 B7R1.10 O=CC1CC(O)C1 Amb33512133 [1,0,0,1,0,0|1,0,0]=3 7890 B7R1.10 OCC1CC(Br)C1 Amb35747688 [1,0,0,1,0,0|1,0,1]=4 7891 B7R1.10 OCC1CC(Cl)C1 Amb21962428 [1,0,0,1,0,0|1,0,1]=4 7892 B7R1.10 OCC1CC(F)C1 Amb22886692 [1,0,0,1,0,0|1,0,1]=4 7893 B7R1.10 OCC1CC(O)C1 Amb22284484 [1,0,0,1,0,0|1,0,1]=4 7894 B7R1.10 OC[C@H]1C[C@H](O)C1 Amb27490798 [1,0,0,1,0,0|1,0,1]=4 7895 B7R1.12 C=C1CC1C(=O)O Amb9774969 [1,0,0,1,0,0|0,0,2]=4 7896 B7R1.12 CC(=O)C1CC1C Amb25720437 [1,0,0,1,0,0|1,0,0]=3 7897 B7R1.12 CC(=O)C1OC1C Amb25920285 [1,0,0,1,0,0|2,0,0]=4 7898 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [1,0,0,1,0,0|1,0,0]=3 7899 B7R1.12 CC(=O)[C@@H]1OC1C Amb27165592 [1,0,0,1,0,0|2,0,0]=4 7900 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [1,0,0,1,0,0|1,0,0]=3 7901 B7R1.12 CC(=O)[C@H]1O[C@H]1C Amb28052513 [1,0,0,1,0,0|2,0,0]=4 7902 B7R1.12 CC(=O)[C@H]1S[C@@H]1C Amb27231676 [1,0,0,1,0,0|2,0,0]=4 7903 B7R1.12 CC(C)C1=C(Br)C1 Amb25972622 [1,0,0,1,0,0|1,0,1]=4 7904 B7R1.12 CC(C)C1CC1N Amb18280885 [1,0,0,1,0,0|1,0,1]=4 7905 B7R1.12 CC(C)C1CC1N Amb32663388 [1,0,0,1,0,0|1,0,1]=4 7906 B7R1.12 CC(C)[C@@H]1C[C@@H]1O Amb27804487 [1,0,0,1,0,0|0,0,1]=3 7907 B7R1.12 CC(C)[C@@H]1C[C@H]1N Amb24470295 [1,0,0,1,0,0|1,0,1]=4 7908 B7R1.12 CC(C)[C@@H]1C[C@H]1N Amb28643805 [1,0,0,1,0,0|1,0,1]=4 7909 B7R1.12 CC(C)[C@@H]1C[C@H]1O Amb27443199 [1,0,0,1,0,0|0,0,1]=3 7910 B7R1.12 CC(O)[C@H]1C[C@@H]1C Amb27443623 [1,0,0,1,0,0|1,0,1]=4 7911 B7R1.12 CC1=CC1C(=O)O Amb27157805 [1,0,0,1,0,0|0,0,2]=4 7912 B7R1.12 CC1CC1C(=N)N Amb25139920 [1,0,0,1,0,0|2,0,0]=4 7913 B7R1.12 CC1CC1C(=N)N Amb32667599 [1,0,0,1,0,0|2,0,0]=4 7914 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [1,0,0,1,0,0|1,0,0]=3 7915 B7R1.12 CC1CC1C(=O)O Amb9703126 [1,0,0,1,0,0|0,0,0]=2 7916 B7R1.12 CC1CC1C(N)=O Amb8858378 [1,0,0,1,0,0|1,0,0]=3 7917 B7R1.12 CC1CC1C(N)=S Amb25302556 [1,0,0,1,0,0|1,1,0]=4 7918 B7R1.12 CC1CC1[C@@H](C)O Amb24683424 [1,0,0,1,0,0|1,0,1]=4 7919 B7R1.12 CC1CC1[C@H](C)O Amb25271040 [1,0,0,1,0,0|1,0,1]=4 7920 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|1,0,0]=3 7921 B7R1.12 CC1SC1C(=O)O Amb27195238 [1,0,0,1,0,0|1,0,0]=3 7922 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [1,0,0,1,0,0|1,0,0]=3 7923 B7R1.12 CN(C)C1CC1O Amb27249817 [1,0,0,1,0,0|1,0,1]=4 7924 B7R1.12 C[C@@H]1C[C@@H]1B(O)O Amb24329037 [1,0,0,1,0,0|1,0,1]=4 7925 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [1,0,0,1,0,0|0,0,0]=2 7926 B7R1.12 C[C@@H]1C[C@H]1C(=N)N Amb27252052 [1,0,0,1,0,0|2,0,0]=4 7927 B7R1.12 C[C@@H]1C[C@H]1C(=N)N Amb33483860 [1,0,0,1,0,0|2,0,0]=4 7928 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [1,0,0,1,0,0|1,0,0]=3 7929 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [1,0,0,1,0,0|0,0,0]=2 7930 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [1,0,0,1,0,0|1,0,0]=3 7931 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [1,0,0,1,0,0|1,0,0]=3 7932 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [1,0,0,1,0,0|1,0,0]=3 7933 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [1,0,0,1,0,0|1,0,0]=3 7934 B7R1.12 C[C@H](O)[C@@H]1C[C@H]1C Amb28065317 [1,0,0,1,0,0|1,0,1]=4 7935 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [1,0,0,1,0,0|0,0,0]=2 7936 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [1,0,0,1,0,0|1,0,0]=3 7937 B7R1.12 C[C@H]1C[C@H]1B(O)O Amb24515113 [1,0,0,1,0,0|1,0,1]=4 7938 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|0,0,0]=2 7939 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [1,0,0,1,0,0|1,0,0]=3 7940 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [1,0,0,1,0,0|1,0,0]=3 7941 B7R1.12 NC(=O)C1CC1Br Amb27838278 [1,0,0,1,0,0|2,0,0]=4 7942 B7R1.12 NC(=O)C1CC1F Amb26026786 [1,0,0,1,0,0|2,0,0]=4 7943 B7R1.12 NC(=O)C1CC1N Amb18279694 [1,0,0,1,0,0|2,0,0]=4 7944 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F Amb27758752 [1,0,0,1,0,0|2,0,0]=4 7945 B7R1.12 NC(=O)[C@@H]1C[C@H]1F Amb27403700 [1,0,0,1,0,0|2,0,0]=4 7946 B7R1.12 NC1CC1C(=O)O Amb7762823 [1,0,0,1,0,0|1,0,0]=3 7947 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [1,0,0,1,0,0|1,0,0]=3 7948 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [1,0,0,1,0,0|1,0,0]=3 7949 B7R1.12 O=C(Cl)C1CC1Cl Amb27865442 [1,0,0,1,0,0|2,0,0]=4 7950 B7R1.12 O=C(Cl)C1CC1F Amb8389490 [1,0,0,1,0,0|2,0,0]=4 7951 B7R1.12 O=C(Cl)[C@@H]1C[C@@H]1Cl Amb28291528 [1,0,0,1,0,0|2,0,0]=4 7952 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [1,0,0,1,0,0|2,0,0]=4 7953 B7R1.12 O=C(O)C1CC1Br Amb27760446 [1,0,0,1,0,0|1,0,0]=3 7954 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [1,0,0,1,0,0|1,0,0]=3 7955 B7R1.12 O=C(O)C1CC1F Amb22490547 [1,0,0,1,0,0|1,0,0]=3 7956 B7R1.12 O=C(O)C1CC1I Amb26047069 [1,0,0,1,0,0|1,0,0]=3 7957 B7R1.12 O=C(O)C1CC1S Amb20246988 [1,0,0,1,0,0|1,0,0]=3 7958 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [1,0,0,1,0,0|1,0,0]=3 7959 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [1,0,0,1,0,0|1,0,0]=3 7960 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [1,0,0,1,0,0|1,0,0]=3 7961 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [1,0,0,1,0,0|1,0,0]=3 7962 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [1,0,0,1,0,0|1,0,0]=3 7963 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [1,0,0,1,0,0|1,0,0]=3 7964 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [1,0,0,1,0,0|1,0,0]=3 7965 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [1,0,0,1,0,0|1,0,0]=3 7966 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [1,0,0,1,0,0|1,0,0]=3 7967 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [1,0,0,1,0,0|1,0,0]=3 7968 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [1,0,0,1,0,0|1,0,0]=3 7969 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [1,0,0,1,0,0|1,0,0]=3 7970 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [1,0,0,1,0,0|1,0,0]=3 7971 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [1,0,0,1,0,0|1,0,0]=3 7972 B7R1.14 CC1(C)C=CCC1 Amb27471019 [1,0,0,1,0,0|1,0,0]=3 7973 B7R1.14 CC1(C)C=CCN1 Amb33743434 [1,0,0,1,0,0|2,0,0]=4 7974 B7R1.14 CC1(C)C=CCN1 Amb33743597 [1,0,0,1,0,0|2,0,0]=4 7975 B7R1.14 CC1(C)CCC=N1 Amb23589194 [1,0,0,1,0,0|1,0,0]=3 7976 B7R1.14 CC1(C)CCCC1 Amb4019558 [1,0,0,1,0,0|1,0,1]=4 7977 B7R1.14 CC1(C)CCCN1 Amb8428102 [1,0,0,1,0,0|1,0,1]=4 7978 B7R1.14 CC1(C)CCCN1 Amb9173089 [1,0,0,1,0,0|1,0,1]=4 7979 B7R1.14 CC1(C)CCCO1 Amb22053786 [1,0,0,1,0,0|0,0,1]=3 7980 B7R1.14 CC1(C)CCCS1 Amb27838272 [1,0,0,1,0,0|0,1,1]=4 7981 B7R1.14 CC1(C)CCNC1 Amb10607828 [1,0,0,1,0,0|2,0,0]=4 7982 B7R1.14 CC1(C)CCNC1 Amb19308490 [1,0,0,1,0,0|2,0,0]=4 7983 B7R1.14 CC1(C)CCOC1 Amb27398819 [1,0,0,1,0,0|2,0,0]=4 7984 B7R1.14 CC1(C)CCSS1 Amb25358324 [1,0,0,1,0,0|1,1,0]=4 7985 B7R1.14 CC1(C)CNC=N1 Amb3940526 [1,0,0,1,0,0|2,0,0]=4 7986 B7R1.14 CC1(C)CNCO1 Amb17506151 [1,0,0,1,0,0|1,0,1]=4 7987 B7R1.14 CC1(C)OCCO1 Amb8395262 [1,0,0,1,0,0|1,0,1]=4 7988 B7R1.14 CC1(C)OCCS1 Amb27591507 [1,0,0,1,0,0|1,0,1]=4 7989 B7R1.14 CC1(O)CCCC1 Amb4037281 [1,0,0,1,0,0|1,0,1]=4 7990 B7R1.14 C[N+]1(C)CCC=N1 Amb27780346 [1,0,0,1,0,0|2,0,0]=4 7991 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [1,0,0,1,0,0|2,0,0]=4 7992 B7R1.14 O=S1(=O)CCCC1 Amb2973382 [1,0,0,1,0,0|1,0,1]=4 7993 B7R1.17 C=C1CCC1(C)C Amb28254823 [1,0,0,1,0,0|1,0,0]=3 7994 B7R1.17 CC1(C)C=CC1=O Amb27486040 [1,0,0,1,0,0|0,0,2]=4 7995 B7R1.17 CC1(C)CCC1=O Amb28050382 [1,0,0,1,0,0|0,0,0]=2 7996 B7R1.17 CC1(C)CCC1Br Amb26499007 [1,0,0,1,0,0|1,0,1]=4 7997 B7R1.17 CC1(C)CCC1Cl Amb27803029 [1,0,0,1,0,0|1,0,1]=4 7998 B7R1.17 CC1(C)CCC1N Amb26419669 [1,0,0,1,0,0|1,0,1]=4 7999 B7R1.17 CC1(C)CCC1N Amb28827670 [1,0,0,1,0,0|1,0,1]=4 8000 B7R1.17 CC1(C)CCC1O Amb26862384 [1,0,0,1,0,0|0,0,1]=3 8001 B7R1.17 CC1(C)CCC1S Amb25719512 [1,0,0,1,0,0|0,1,1]=4 8002 B7R1.17 CC1(C)CNC1=O Amb26954140 [1,0,0,1,0,0|1,0,0]=3 8003 B7R1.17 CC1(C)COC1=O Amb17619458 [1,0,0,1,0,0|1,0,0]=3 8004 B7R1.17 CC1(C)NCC1O Amb34147348 [1,0,0,1,0,0|1,0,1]=4 8005 B7R1.17 CC1(C)OCC1=O Amb27666218 [1,0,0,1,0,0|1,0,0]=3 8006 B7R1.17 CC1(C)OCC1O Amb24479212 [1,0,0,1,0,0|1,0,1]=4 8007 B7R1.17 CC1(N)COC1=O Amb24626106 [1,0,0,1,0,0|2,0,0]=4 8008 B7R1.17 CC1CCS1(=O)=O Amb22364950 [1,0,0,1,0,0|1,0,1]=4 8009 B7R1.17 C[C@H]1CCS1(=O)=O Amb27661382 [1,0,0,1,0,0|1,0,1]=4 8010 B7R1.17 C[C@]1(N)COC1=O Amb27232689 [1,0,0,1,0,0|2,0,0]=4 8011 B7R1.18 C=C(C)C1CCC1 Amb25662691 [1,0,0,1,0,0|2,0,0]=4 8012 B7R1.18 C=C(F)C1CCC1 Amb27403200 [1,0,0,1,0,0|2,0,0]=4 8013 B7R1.18 CC(=O)C1CCC1 Amb4037098 [1,0,0,1,0,0|1,0,0]=3 8014 B7R1.18 CC(=O)C1CCN1 Amb28142364 [1,0,0,1,0,0|2,0,0]=4 8015 B7R1.18 CC(=O)C1CNC1 Amb23400009 [1,0,0,1,0,0|2,0,0]=4 8016 B7R1.18 CC(=O)C1CNC1 Amb23401240 [1,0,0,1,0,0|2,0,0]=4 8017 B7R1.18 CC(=O)C1CNC1 Amb33473586 [1,0,0,1,0,0|2,0,0]=4 8018 B7R1.18 CC(=O)C1COC1 Amb27397483 [1,0,0,1,0,0|2,0,0]=4 8019 B7R1.18 CC(=O)C1CSC1 Amb29849423 [1,0,0,1,0,0|2,0,0]=4 8020 B7R1.18 CC(=O)N1CCC1 Amb22008358 [1,0,0,1,0,0|2,0,0]=4 8021 B7R1.18 CC(C)C1CCC1 Amb24479859 [1,0,0,1,0,0|1,0,1]=4 8022 B7R1.18 CC(C)C1CCN1 Amb32712115 [1,0,0,1,0,0|1,0,1]=4 8023 B7R1.18 CC(C)C1CCN1 Amb8010874 [1,0,0,1,0,0|1,0,1]=4 8024 B7R1.18 CC(C)C1CNC1 Amb22059801 [1,0,0,1,0,0|2,0,0]=4 8025 B7R1.18 CC(C)C1CNC1 Amb32681170 [1,0,0,1,0,0|2,0,0]=4 8026 B7R1.18 CC(C)[C@H]1CCN1 Amb27267401 [1,0,0,1,0,0|1,0,1]=4 8027 B7R1.18 CC(O)C1CCC1 Amb10603414 [1,0,0,1,0,0|1,0,1]=4 8028 B7R1.18 CC(O)C1CCO1 Amb26873978 [1,0,0,1,0,0|1,0,1]=4 8029 B7R1.18 C[C@@H](O)C1CCC1 Amb24478546 [1,0,0,1,0,0|1,0,1]=4 8030 B7R1.18 C[C@H](O)C1CCC1 Amb25145632 [1,0,0,1,0,0|1,0,1]=4 8031 B7R1.18 N=C(N)C1CCC1 Amb2695056 [1,0,0,1,0,0|2,0,0]=4 8032 B7R1.18 N=C(N)C1CCC1 Amb33528962 [1,0,0,1,0,0|2,0,0]=4 8033 B7R1.18 NC(=O)C1CCC1 Amb33552668 [1,0,0,1,0,0|1,0,0]=3 8034 B7R1.18 NC(=O)C1CCN1 Amb22230240 [1,0,0,1,0,0|2,0,0]=4 8035 B7R1.18 NC(=O)C1CCN1 Amb22491865 [1,0,0,1,0,0|2,0,0]=4 8036 B7R1.18 NC(=O)C1CNC1 Amb10976072 [1,0,0,1,0,0|2,0,0]=4 8037 B7R1.18 NC(=O)C1CNC1 Amb20061301 [1,0,0,1,0,0|2,0,0]=4 8038 B7R1.18 NC(=O)C1CNC1 Amb21960249 [1,0,0,1,0,0|2,0,0]=4 8039 B7R1.18 NC(=O)C1CSC1 Amb27209831 [1,0,0,1,0,0|2,0,0]=4 8040 B7R1.18 NC(=O)N1CCC1 Amb25326782 [1,0,0,1,0,0|2,0,0]=4 8041 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [1,0,0,1,0,0|2,0,0]=4 8042 B7R1.18 NC(=S)C1CCC1 Amb18108358 [1,0,0,1,0,0|1,1,0]=4 8043 B7R1.18 NS(=O)C1CCC1 Amb32720395 [1,0,0,1,0,0|2,0,0]=4 8044 B7R1.18 O=C(Br)C1CCC1 Amb28291328 [1,0,0,1,0,0|1,0,0]=3 8045 B7R1.18 O=C(Cl)C1CCC1 Amb33528386 [1,0,0,1,0,0|1,0,0]=3 8046 B7R1.18 O=C(Cl)N1CCC1 Amb28144777 [1,0,0,1,0,0|2,0,0]=4 8047 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [1,0,0,1,0,0|0,0,2]=4 8048 B7R1.18 O=C(O)C1CCC1 Amb2686619 [1,0,0,1,0,0|0,0,0]=2 8049 B7R1.18 O=C(O)C1CCN1 Amb2371568 [1,0,0,1,0,0|1,0,0]=3 8050 B7R1.18 O=C(O)C1CCN1 Amb8391098 [1,0,0,1,0,0|1,0,0]=3 8051 B7R1.18 O=C(O)C1CCO1 Amb2383526 [1,0,0,1,0,0|1,0,0]=3 8052 B7R1.18 O=C(O)C1CCS1 Amb27209836 [1,0,0,1,0,0|1,0,0]=3 8053 B7R1.18 O=C(O)C1CNC1 Amb2444164 [1,0,0,1,0,0|1,0,0]=3 8054 B7R1.18 O=C(O)C1CNC1 Amb8384273 [1,0,0,1,0,0|1,0,0]=3 8055 B7R1.18 O=C(O)C1COC1 Amb33542663 [1,0,0,1,0,0|1,0,0]=3 8056 B7R1.18 O=C(O)C1CSC1 Amb20171470 [1,0,0,1,0,0|1,0,0]=3 8057 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [1,0,0,1,0,0|1,0,0]=3 8058 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [1,0,0,1,0,0|1,0,0]=3 8059 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [1,0,0,1,0,0|1,0,0]=3 8060 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [1,0,0,1,0,0|1,0,0]=3 8061 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [1,0,0,1,0,0|1,0,0]=3 8062 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [1,0,0,1,0,0|1,0,0]=3 8063 B7R1.18 O=S(Cl)C1CCC1 Amb32720394 [1,0,0,1,0,0|2,0,0]=4 8064 B7R1.18 O=S([O-])C1CCC1 Amb32755305 [1,0,0,1,0,0|1,0,1]=4 8065 B7R1.18 O=[N+]([O-])C1CCC1 Amb13883563 [1,0,0,1,0,0|1,0,1]=4 8066 B7R1.18 OB(O)C1CCC1 Amb10071491 [1,0,0,1,0,0|1,0,1]=4 8067 B7R1.20 C=C(C)CC1CC1 Amb27207160 [1,0,0,1,0,0|2,0,0]=4 8068 B7R1.20 CC(=O)CC1CC1 Amb10603417 [1,0,0,1,0,0|1,0,0]=3 8069 B7R1.20 CC(=O)NC1CC1 Amb3366973 [1,0,0,1,0,0|2,0,0]=4 8070 B7R1.20 CC(C)CC1CO1 Amb24631080 [1,0,0,1,0,0|0,0,1]=3 8071 B7R1.20 CC(C)C[C@@H]1CO1 Amb33318768 [1,0,0,1,0,0|0,0,1]=3 8072 B7R1.20 CC(C)C[C@H]1CO1 Amb33374124 [1,0,0,1,0,0|0,0,1]=3 8073 B7R1.20 CC(O)CC1CC1 Amb26536953 [1,0,0,1,0,0|1,0,1]=4 8074 B7R1.20 CN(C)CC1CO1 Amb1139214 [1,0,0,1,0,0|1,0,1]=4 8075 B7R1.20 CN(C)C[C@@H]1CO1 Amb27397092 [1,0,0,1,0,0|1,0,1]=4 8076 B7R1.20 CN(O)CC1CC1 Amb33429117 [1,0,0,1,0,0|2,0,0]=4 8077 B7R1.20 C[C@@H](O)CC1CC1 Amb22896775 [1,0,0,1,0,0|1,0,1]=4 8078 B7R1.20 C[C@H](O)CC1CC1 Amb28050168 [1,0,0,1,0,0|1,0,1]=4 8079 B7R1.20 N=C(N)CC1CC1 Amb21964664 [1,0,0,1,0,0|2,0,0]=4 8080 B7R1.20 N=C(N)CC1CC1 Amb9423215 [1,0,0,1,0,0|2,0,0]=4 8081 B7R1.20 NC(=O)CC1CC1 Amb33552967 [1,0,0,1,0,0|1,0,0]=3 8082 B7R1.20 NC(=O)NC1CC1 Amb1152776 [1,0,0,1,0,0|2,0,0]=4 8083 B7R1.20 NC(=O)OC1CC1 Amb27265645 [1,0,0,1,0,0|2,0,0]=4 8084 B7R1.20 NC(=S)CC1CC1 Amb9423151 [1,0,0,1,0,0|1,1,0]=4 8085 B7R1.20 NS(=O)CC1CC1 Amb32720358 [1,0,0,1,0,0|2,0,0]=4 8086 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [1,0,0,1,0,0|1,0,0]=3 8087 B7R1.20 O=C(Cl)NC1CC1 Amb27848787 [1,0,0,1,0,0|2,0,0]=4 8088 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [1,0,0,1,0,0|2,0,0]=4 8089 B7R1.20 O=C(O)C=C1CC1 Amb8392543 [1,0,0,1,0,0|0,0,2]=4 8090 B7R1.20 O=C(O)CC1CC1 Amb2686657 [1,0,0,1,0,0|0,0,0]=2 8091 B7R1.20 O=C(O)CC1CO1 Amb25244347 [1,0,0,1,0,0|1,0,0]=3 8092 B7R1.20 O=C(O)C[C@@H]1CO1 Amb27253415 [1,0,0,1,0,0|1,0,0]=3 8093 B7R1.20 O=C(O)C[C@H]1CO1 Amb26068484 [1,0,0,1,0,0|1,0,0]=3 8094 B7R1.20 O=S(Cl)CC1CC1 Amb25914604 [1,0,0,1,0,0|2,0,0]=4 8095 B7R1.20 O=S([O-])CC1CC1 Amb27483189 [1,0,0,1,0,0|1,0,1]=4 8096 B7R1.23 C=CC1CC1(C)Br Amb28284153 [1,0,0,1,0,0|2,0,0]=4 8097 B7R1.23 CC1(Br)CC1C=O Amb25679179 [1,0,0,1,0,0|1,0,0]=3 8098 B7R1.23 CC1(Br)CC1CO Amb25169573 [1,0,0,1,0,0|1,0,1]=4 8099 B7R1.23 CC1(C)CC1C#N Amb8385608 [1,0,0,1,0,0|1,0,1]=4 8100 B7R1.23 CC1(C)CC1C=O Amb28071200 [1,0,0,1,0,0|0,0,0]=2 8101 B7R1.23 CC1(C)CC1CBr Amb33548078 [1,0,0,1,0,0|1,0,1]=4 8102 B7R1.23 CC1(C)CC1CCl Amb27751989 [1,0,0,1,0,0|1,0,1]=4 8103 B7R1.23 CC1(C)CC1CN Amb10608232 [1,0,0,1,0,0|1,0,1]=4 8104 B7R1.23 CC1(C)CC1CN Amb19515077 [1,0,0,1,0,0|1,0,1]=4 8105 B7R1.23 CC1(C)CC1CO Amb10608336 [1,0,0,1,0,0|0,0,1]=3 8106 B7R1.23 CC1(C)CC1CS Amb32788433 [1,0,0,1,0,0|0,1,1]=4 8107 B7R1.23 CC1(C)C[C@@H]1C=O Amb26416941 [1,0,0,1,0,0|0,0,0]=2 8108 B7R1.23 CC1(C)C[C@@H]1CN Amb25932170 [1,0,0,1,0,0|1,0,1]=4 8109 B7R1.23 CC1(C)C[C@@H]1CO Amb28125782 [1,0,0,1,0,0|0,0,1]=3 8110 B7R1.23 CC1(C)C\C1=C/Cl Amb27407556 [1,0,0,1,0,0|1,0,1]=4 8111 B7R1.23 CC1(C)OC1C=O Amb24724709 [1,0,0,1,0,0|1,0,0]=3 8112 B7R1.23 CC1(C)OC1CO Amb28050426 [1,0,0,1,0,0|1,0,1]=4 8113 B7R1.23 CC1(C)O[C@@H]1C=O Amb28050526 [1,0,0,1,0,0|1,0,0]=3 8114 B7R1.23 CC1(C)O[C@@H]1CO Amb27857580 [1,0,0,1,0,0|1,0,1]=4 8115 B7R1.23 CC1(C)O[C@H]1CO Amb28207443 [1,0,0,1,0,0|1,0,1]=4 8116 B7R1.23 CNC1CC1(C)C Amb18279475 [1,0,0,1,0,0|2,0,0]=4 8117 B7R1.23 CNC1CC1(C)C Amb28555340 [1,0,0,1,0,0|2,0,0]=4 8118 B7R1.23 C[C@]1(Br)C[C@@H]1C=O Amb27215359 [1,0,0,1,0,0|1,0,0]=3 8119 B7R1.23 C[C@]1(N)C[C@H]1CO Amb27440843 [1,0,0,1,0,0|1,0,1]=4 8120 B7R1.23 O=CC1CC1(Cl)Cl Amb25187914 [1,0,0,1,0,0|2,0,0]=4 8121 B7R1.23 O=CC1CC1(F)F Amb22002395 [1,0,0,1,0,0|2,0,0]=4 8122 B7R1.16 C=C1CC(C)(C)C1 Amb27984115 [0,0,0,1,1,0|2,0,0]=4 8123 B7R1.16 CC1(C)CC(=O)C1 Amb24117921 [0,0,0,1,1,0|1,0,0]=3 8124 B7R1.16 CC1(C)CC(=O)N1 Amb19515692 [0,0,0,1,1,0|1,0,0]=3 8125 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [0,0,0,1,1,0|0,0,0]=2 8126 B7R1.16 CC1(C)CC(O)C1 Amb33550904 [0,0,0,1,1,0|1,0,1]=4 8127 B7R1.16 CC1(N)CC(=O)C1 Amb31308099 [0,0,0,1,1,0|2,0,0]=4 8128 B7R1.16 CC1(N)CC(=O)C1 Amb32675476 [0,0,0,1,1,0|2,0,0]=4 8129 B7R1.16 O=C1CC(Cl)(Cl)O1 Amb28120599 [0,0,0,1,1,0|2,0,0]=4 8130 B9R1.35 C=C(C)C1CNC(=O)O1 Amb33199198 [0,0,0,1,0,1|0,0,2]=4 8131 B9R1.35 C=C1CCC(C(=O)O)C1 Amb28369274 [0,0,0,1,0,1|0,0,2]=4 8132 B9R1.35 C=C1CCC(C(C)C)C1 Amb28342758 [0,0,0,1,0,1|2,0,0]=4 8133 B9R1.35 C=C1CN[C@@H](C(=O)O)C1 Amb27795857 [0,0,0,1,0,1|0,0,2]=4 8134 B9R1.35 C=C1CN[C@H](C(=O)O)C1 Amb27400250 [0,0,0,1,0,1|0,0,2]=4 8135 B9R1.35 C=C1COC(C(C)C)C1 Amb35584917 [0,0,0,1,0,1|2,0,0]=4 8136 B9R1.35 CC(=O)C1CC(C)CO1 Amb27780018 [0,0,0,1,0,1|1,0,0]=3 8137 B9R1.35 CC(=O)C1CC=C(C)C1 Amb26910073 [0,0,0,1,0,1|1,0,1]=4 8138 B9R1.35 CC(=O)C1CCC(=O)O1 Amb3428694 [0,0,0,1,0,1|1,0,1]=4 8139 B9R1.35 CC(=O)C1CCC(N)C1 Amb27960182 [0,0,0,1,0,1|2,0,0]=4 8140 B9R1.35 CC(=O)C1CCC(N)C1 Amb33447083 [0,0,0,1,0,1|2,0,0]=4 8141 B9R1.35 CC(=O)C1CCN(C)C1 Amb27829019 [0,0,0,1,0,1|2,0,0]=4 8142 B9R1.35 CC(=O)C1CC[C@@H](C)O1 Amb33423868 [0,0,0,1,0,1|2,0,0]=4 8143 B9R1.35 CC(=O)C1CC[C@H](C)C1 Amb27261938 [0,0,0,1,0,1|1,0,0]=3 8144 B9R1.35 CC(=O)C1SCC(C)S1 Amb24676738 [0,0,0,1,0,1|2,0,0]=4 8145 B9R1.35 CC(=O)N1CCC(F)C1 Amb35614292 [0,0,0,1,0,1|2,0,0]=4 8146 B9R1.35 CC(=O)N1CCC(N)C1 Amb17739841 [0,0,0,1,0,1|2,0,0]=4 8147 B9R1.35 CC(=O)N1CCC(N)C1 Amb33549525 [0,0,0,1,0,1|2,0,0]=4 8148 B9R1.35 CC(=O)N1CCC(O)C1 Amb20622704 [0,0,0,1,0,1|2,0,0]=4 8149 B9R1.35 CC(=O)N1CC[C@@H](Br)C1 Amb22227483 [0,0,0,1,0,1|2,0,0]=4 8150 B9R1.35 CC(=O)N1CC[C@@H](Cl)C1 Amb22227481 [0,0,0,1,0,1|2,0,0]=4 8151 B9R1.35 CC(=O)N1CC[C@@H](I)C1 Amb22227495 [0,0,0,1,0,1|2,0,0]=4 8152 B9R1.35 CC(=O)N1CC[C@@H](N)C1 Amb19891343 [0,0,0,1,0,1|2,0,0]=4 8153 B9R1.35 CC(=O)N1CC[C@@H](N)C1 Amb22227487 [0,0,0,1,0,1|2,0,0]=4 8154 B9R1.35 CC(=O)N1CC[C@@H](O)C1 Amb17935744 [0,0,0,1,0,1|2,0,0]=4 8155 B9R1.35 CC(=O)N1CC[C@H](Cl)C1 Amb22227524 [0,0,0,1,0,1|2,0,0]=4 8156 B9R1.35 CC(=O)N1CC[C@H](I)C1 Amb22227531 [0,0,0,1,0,1|2,0,0]=4 8157 B9R1.35 CC(=O)N1CC[C@H](N)C1 Amb19890016 [0,0,0,1,0,1|2,0,0]=4 8158 B9R1.35 CC(=O)N1CC[C@H](N)C1 Amb22227520 [0,0,0,1,0,1|2,0,0]=4 8159 B9R1.35 CC(=O)N1CC[C@H](O)C1 Amb17935745 [0,0,0,1,0,1|2,0,0]=4 8160 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [0,0,0,1,0,1|1,0,1]=4 8161 B9R1.35 CC(=O)[C@@H]1CC[C@@H](C)C1 Amb27861348 [0,0,0,1,0,1|1,0,0]=3 8162 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)C1 Amb27861349 [0,0,0,1,0,1|1,0,0]=3 8163 B9R1.35 CC(=O)[C@@H]1CC[C@H](C)O1 Amb26958731 [0,0,0,1,0,1|2,0,0]=4 8164 B9R1.35 CC(Br)C1CNC(=O)O1 Amb27424630 [0,0,0,1,0,1|1,0,0]=3 8165 B9R1.35 CC(C)C1=CC(=O)CC1 Amb26866593 [0,0,0,1,0,1|1,0,0]=3 8166 B9R1.35 CC(C)C1=CCC(=O)O1 Amb27462536 [0,0,0,1,0,1|0,0,1]=3 8167 B9R1.35 CC(C)C1=NCC(=O)N1 Amb27446386 [0,0,0,1,0,1|1,0,1]=4 8168 B9R1.35 CC(C)C1=NNC(=O)O1 Amb20246867 [0,0,0,1,0,1|1,0,1]=4 8169 B9R1.35 CC(C)C1=NSC(=O)O1 Amb27762657 [0,0,0,1,0,1|1,0,1]=4 8170 B9R1.35 CC(C)C1C=CC(=O)C1 Amb27838734 [0,0,0,1,0,1|1,0,1]=4 8171 B9R1.35 CC(C)C1CC(=O)CS1 Amb25263073 [0,0,0,1,0,1|1,0,0]=3 8172 B9R1.35 CC(C)C1CC(O)CN1 Amb27162965 [0,0,0,1,0,1|1,0,1]=4 8173 B9R1.35 CC(C)C1CC(O)CO1 Amb35700372 [0,0,0,1,0,1|1,0,1]=4 8174 B9R1.35 CC(C)C1CCC(=O)C1 Amb25147190 [0,0,0,1,0,1|1,0,0]=3 8175 B9R1.35 CC(C)C1CCC(=O)N1 Amb24120594 [0,0,0,1,0,1|1,0,0]=3 8176 B9R1.35 CC(C)C1CN=C(N)C1 Amb26848193 [0,0,0,1,0,1|2,0,0]=4 8177 B9R1.35 CC(C)C1CN=C(N)N1 Amb25805876 [0,0,0,1,0,1|2,0,0]=4 8178 B9R1.35 CC(C)C1CNC(=O)C1 Amb19305356 [0,0,0,1,0,1|1,0,0]=3 8179 B9R1.35 CC(C)C1CNC(=O)N1 Amb17506854 [0,0,0,1,0,1|1,0,0]=3 8180 B9R1.35 CC(C)C1CNC(=O)O1 Amb27494066 [0,0,0,1,0,1|0,0,0]=2 8181 B9R1.35 CC(C)C1CNC(S)=N1 Amb26428913 [0,0,0,1,0,1|1,1,0]=4 8182 B9R1.35 CC(C)C1COC(=O)N1 Amb10071773 [0,0,0,1,0,1|1,0,0]=3 8183 B9R1.35 CC(C)C1COC(=S)N1 Amb10068057 [0,0,0,1,0,1|1,1,0]=4 8184 B9R1.35 CC(C)C1COC(N)=N1 Amb23449373 [0,0,0,1,0,1|2,0,0]=4 8185 B9R1.35 CC(C)C1COC(O)C1 Amb27956543 [0,0,0,1,0,1|1,0,1]=4 8186 B9R1.35 CC(C)C1CSC(=O)N1 Amb27784925 [0,0,0,1,0,1|1,0,0]=3 8187 B9R1.35 CC(C)C1CSC(=S)N1 Amb10068056 [0,0,0,1,0,1|1,1,0]=4 8188 B9R1.35 CC(C)C1NCC(=O)N1 Amb27948988 [0,0,0,1,0,1|1,0,0]=3 8189 B9R1.35 CC(C)N1CCC(=O)C1 Amb22587607 [0,0,0,1,0,1|1,0,0]=3 8190 B9R1.35 CC(C)N1CCC(=O)C1 Amb33528255 [0,0,0,1,0,1|1,0,0]=3 8191 B9R1.35 CC(C)N1CCC(N)=N1 Amb27768678 [0,0,0,1,0,1|2,0,0]=4 8192 B9R1.35 CC(C)N1CCC(O)C1 Amb21618751 [0,0,0,1,0,1|1,0,1]=4 8193 B9R1.35 CC(C)N1CC[C@@H](O)C1 Amb27397969 [0,0,0,1,0,1|1,0,1]=4 8194 B9R1.35 CC(C)[C@@H]1CCC(=O)C1 Amb27255871 [0,0,0,1,0,1|1,0,0]=3 8195 B9R1.35 CC(C)[C@@H]1CCC(=O)N1 Amb24476688 [0,0,0,1,0,1|1,0,0]=3 8196 B9R1.35 CC(C)[C@@H]1CNC(=O)C1 Amb24446919 [0,0,0,1,0,1|1,0,0]=3 8197 B9R1.35 CC(C)[C@@H]1CNC(=O)N1 Amb27816928 [0,0,0,1,0,1|1,0,0]=3 8198 B9R1.35 CC(C)[C@@H]1COC(=O)N1 Amb8515206 [0,0,0,1,0,1|1,0,0]=3 8199 B9R1.35 CC(C)[C@@H]1CSC(=S)N1 Amb8629034 [0,0,0,1,0,1|1,1,0]=4 8200 B9R1.35 CC(C)[C@H]1CCC(=O)C1 Amb27589313 [0,0,0,1,0,1|1,0,0]=3 8201 B9R1.35 CC(C)[C@H]1CCC(=O)N1 Amb27253005 [0,0,0,1,0,1|1,0,0]=3 8202 B9R1.35 CC(C)[C@H]1CC[C@H](O)C1 Amb28292198 [0,0,0,1,0,1|1,0,1]=4 8203 B9R1.35 CC(C)[C@H]1CNC(=O)C1 Amb28248188 [0,0,0,1,0,1|1,0,0]=3 8204 B9R1.35 CC(C)[C@H]1CNC(=S)S1 Amb26455642 [0,0,0,1,0,1|0,2,0]=4 8205 B9R1.35 CC(C)[C@H]1COC(=O)C1 Amb27242562 [0,0,0,1,0,1|1,0,0]=3 8206 B9R1.35 CC(C)[C@H]1COC(=O)N1 Amb8385596 [0,0,0,1,0,1|1,0,0]=3 8207 B9R1.35 CC(C)[C@H]1COC(=S)N1 Amb22338996 [0,0,0,1,0,1|1,1,0]=4 8208 B9R1.35 CC(C)[C@H]1COC(N)=N1 Amb27438757 [0,0,0,1,0,1|2,0,0]=4 8209 B9R1.35 CC(C)[C@H]1CSC(=S)N1 Amb8628921 [0,0,0,1,0,1|1,1,0]=4 8210 B9R1.35 CC(Cl)C1CCC(=O)C1 Amb27983825 [0,0,0,1,0,1|2,0,0]=4 8211 B9R1.35 CC(O)C1=CC(=O)CC1 Amb28146470 [0,0,0,1,0,1|2,0,0]=4 8212 B9R1.35 CC(O)C1CCC(=O)O1 Amb25998293 [0,0,0,1,0,1|1,0,0]=3 8213 B9R1.35 CC(O)C1CNC(=O)C1 Amb27258070 [0,0,0,1,0,1|2,0,0]=4 8214 B9R1.35 CC(O)C1CNC(O)=N1 Amb27444197 [0,0,0,1,0,1|2,0,0]=4 8215 B9R1.35 CC(O)[C@H]1C=CC(=O)O1 Amb27632756 [0,0,0,1,0,1|1,0,1]=4 8216 B9R1.35 CC1=CC(C(=O)O)NC1 Amb27751727 [0,0,0,1,0,1|0,0,2]=4 8217 B9R1.35 CC1=CC(C(=O)O)SC1 Amb10809142 [0,0,0,1,0,1|0,0,2]=4 8218 B9R1.35 CC1=CCC(C(N)=O)C1 Amb28195175 [0,0,0,1,0,1|1,0,1]=4 8219 B9R1.35 CC1=NC(C(=O)O)CC1 Amb23438203 [0,0,0,1,0,1|1,0,1]=4 8220 B9R1.35 CC1=NC(C(=O)O)CC1 Amb32409643 [0,0,0,1,0,1|1,0,1]=4 8221 B9R1.35 CC1=NC(C(=O)O)CO1 Amb20621597 [0,0,0,1,0,1|1,0,1]=4 8222 B9R1.35 CC1=NC(C(=O)O)CS1 Amb18124720 [0,0,0,1,0,1|1,0,1]=4 8223 B9R1.35 CC1=NC(C(C)C)CN1 Amb35737149 [0,0,0,1,0,1|2,0,0]=4 8224 B9R1.35 CC1=NC(C(C)C)CS1 Amb27946060 [0,0,0,1,0,1|2,0,0]=4 8225 B9R1.35 CC1=NCC(C(=O)O)N1 Amb24599993 [0,0,0,1,0,1|1,0,1]=4 8226 B9R1.35 CC1=NCC(C(=O)O)S1 Amb27958674 [0,0,0,1,0,1|1,0,1]=4 8227 B9R1.35 CC1=NC[C@H](C(=O)O)N1 Amb27827434 [0,0,0,1,0,1|1,0,1]=4 8228 B9R1.35 CC1=NOC(C(=O)O)C1 Amb7088977 [0,0,0,1,0,1|1,0,1]=4 8229 B9R1.35 CC1=NO[C@H](C(=O)O)C1 Amb25189709 [0,0,0,1,0,1|1,0,1]=4 8230 B9R1.35 CC1=N[C@@H](C(=O)O)CS1 Amb32676192 [0,0,0,1,0,1|1,0,1]=4 8231 B9R1.35 CC1=N[C@H](C(=O)O)CC1 Amb27455557 [0,0,0,1,0,1|1,0,1]=4 8232 B9R1.35 CC1=N[C@H](C(=O)O)CS1 Amb35648200 [0,0,0,1,0,1|1,0,1]=4 8233 B9R1.35 CC1C=C(C(=O)O)CC1 Amb18642397 [0,0,0,1,0,1|0,0,1]=3 8234 B9R1.35 CC1C=CC(C(=O)O)O1 Amb18642586 [0,0,0,1,0,1|1,0,1]=4 8235 B9R1.35 CC1CC(C(=O)O)=NO1 Amb25694020 [0,0,0,1,0,1|1,0,1]=4 8236 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [0,0,0,1,0,1|0,0,0]=2 8237 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [0,0,0,1,0,1|0,0,0]=2 8238 B9R1.35 CC1CC(C(=O)O)SS1 Amb28385584 [0,0,0,1,0,1|1,0,0]=3 8239 B9R1.35 CC1CC(C(N)=O)CN1 Amb27665690 [0,0,0,1,0,1|1,0,0]=3 8240 B9R1.35 CC1CCC(C(=O)Cl)O1 Amb27424709 [0,0,0,1,0,1|2,0,0]=4 8241 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [0,0,0,1,0,1|0,0,0]=2 8242 B9R1.35 CC1CCC(C(=O)O)N1 Amb18832572 [0,0,0,1,0,1|1,0,0]=3 8243 B9R1.35 CC1CCC(C(=O)O)N1 Amb32652343 [0,0,0,1,0,1|1,0,0]=3 8244 B9R1.35 CC1CCC(C(=O)O)O1 Amb17593370 [0,0,0,1,0,1|1,0,0]=3 8245 B9R1.35 CC1CCC(C(=O)O)S1 Amb25719281 [0,0,0,1,0,1|1,0,0]=3 8246 B9R1.35 CC1CCC(C(N)=O)O1 Amb27838521 [0,0,0,1,0,1|2,0,0]=4 8247 B9R1.35 CC1CCC(S(=O)Cl)C1 Amb32720564 [0,0,0,1,0,1|2,0,0]=4 8248 B9R1.35 CC1CCC(S(=O)[O-])C1 Amb32755283 [0,0,0,1,0,1|1,0,1]=4 8249 B9R1.35 CC1CCC(S(N)=O)C1 Amb32720565 [0,0,0,1,0,1|2,0,0]=4 8250 B9R1.35 CC1CCN(C(=N)N)C1 Amb27195024 [0,0,0,1,0,1|2,0,0]=4 8251 B9R1.35 CC1CCN(C(=O)Cl)C1 Amb27391470 [0,0,0,1,0,1|1,0,0]=3 8252 B9R1.35 CC1CC[C@H](C(=O)O)N1 Amb22748252 [0,0,0,1,0,1|1,0,0]=3 8253 B9R1.35 CC1CNC(C(C)C)O1 Amb17506164 [0,0,0,1,0,1|1,0,1]=4 8254 B9R1.35 CC1CNC(C(N)=O)C1 Amb27783370 [0,0,0,1,0,1|1,0,0]=3 8255 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [0,0,0,1,0,1|0,0,0]=2 8256 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [0,0,0,1,0,1|0,0,0]=2 8257 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [0,0,0,1,0,1|0,0,0]=2 8258 B9R1.35 CC1COC(C(C)C)O1 Amb25929793 [0,0,0,1,0,1|1,0,1]=4 8259 B9R1.35 CC1NC(C(=O)O)CS1 Amb9718451 [0,0,0,1,0,1|1,0,0]=3 8260 B9R1.35 CC1NC(C(N)=O)CS1 Amb28194888 [0,0,0,1,0,1|2,0,0]=4 8261 B9R1.35 CC1N[C@H](C(=O)O)CS1 Amb16203706 [0,0,0,1,0,1|1,0,0]=3 8262 B9R1.35 CN(C)C1=CC(=O)CC1 Amb28131924 [0,0,0,1,0,1|2,0,0]=4 8263 B9R1.35 CN(C)C1=NC(=O)CC1 Amb27944641 [0,0,0,1,0,1|2,0,0]=4 8264 B9R1.35 CN(C)C1=NCC(=O)O1 Amb28075156 [0,0,0,1,0,1|1,0,1]=4 8265 B9R1.35 CN1C=NC(C(=O)O)C1 Amb28934983 [0,0,0,1,0,1|1,0,1]=4 8266 B9R1.35 CN1C=NC(C(=O)O)C1 Amb8393352 [0,0,0,1,0,1|1,0,1]=4 8267 B9R1.35 CN1CCC(C(=O)O)C1 Amb3941190 [0,0,0,1,0,1|1,0,0]=3 8268 B9R1.35 CN1CCC(C(=O)O)C1 Amb9154860 [0,0,0,1,0,1|1,0,0]=3 8269 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22746030 [0,0,0,1,0,1|1,0,0]=3 8270 B9R1.35 CN1CC[C@@H](C(=O)O)C1 Amb22756448 [0,0,0,1,0,1|1,0,0]=3 8271 B9R1.35 CN1CC[C@H](C(=O)O)C1 Amb26635487 [0,0,0,1,0,1|1,0,0]=3 8272 B9R1.35 C[C@@H](F)[C@@H]1COC(=O)N1 Amb33715177 [0,0,0,1,0,1|2,0,0]=4 8273 B9R1.35 C[C@@H](N)[C@H]1CCC(=O)O1 Amb28456584 [0,0,0,1,0,1|1,0,0]=3 8274 B9R1.35 C[C@@H](O)C1CNC(=O)C1 Amb27390672 [0,0,0,1,0,1|2,0,0]=4 8275 B9R1.35 C[C@@H]1C=C[C@@H](C(=O)O)S1 Amb28347473 [0,0,0,1,0,1|1,0,1]=4 8276 B9R1.35 C[C@@H]1C=N[C@H](C(=O)O)C1 Amb27468755 [0,0,0,1,0,1|0,0,1]=3 8277 B9R1.35 C[C@@H]1CCC(C(=O)O)O1 Amb33423875 [0,0,0,1,0,1|1,0,0]=3 8278 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [0,0,0,1,0,1|0,0,0]=2 8279 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Amb31308105 [0,0,0,1,0,1|1,0,0]=3 8280 B9R1.35 C[C@@H]1CC[C@@H](C(N)=O)N1 Amb28456271 [0,0,0,1,0,1|2,0,0]=4 8281 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [0,0,0,1,0,1|0,0,0]=2 8282 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb24399449 [0,0,0,1,0,1|1,0,0]=3 8283 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb32652487 [0,0,0,1,0,1|1,0,0]=3 8284 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 Amb22886534 [0,0,0,1,0,1|1,0,0]=3 8285 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [0,0,0,1,0,1|0,0,0]=2 8286 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [0,0,0,1,0,1|0,0,0]=2 8287 B9R1.35 C[C@@H]1CS[C@@H](C(=O)Cl)S1 Amb25110654 [0,0,0,1,0,1|2,0,0]=4 8288 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [0,0,0,1,0,1|0,0,0]=2 8289 B9R1.35 C[C@@H]1O[C@H](C(=O)O)CS1 Amb26951854 [0,0,0,1,0,1|1,0,0]=3 8290 B9R1.35 C[C@H](N)[C@H]1CCC(=O)O1 Amb27850574 [0,0,0,1,0,1|1,0,0]=3 8291 B9R1.35 C[C@H](O)C1CNC(=O)C1 Amb27838586 [0,0,0,1,0,1|2,0,0]=4 8292 B9R1.35 C[C@H](O)[C@@H]1C=CC(=O)O1 Amb27213832 [0,0,0,1,0,1|1,0,1]=4 8293 B9R1.35 C[C@H](O)[C@@H]1COC(=O)O1 Amb27197946 [0,0,0,1,0,1|1,0,0]=3 8294 B9R1.35 C[C@H](O)[C@H]1C=CC(=O)O1 Amb28435793 [0,0,0,1,0,1|1,0,1]=4 8295 B9R1.35 C[C@H](O)[C@H]1CNC(=O)C1 Amb27968562 [0,0,0,1,0,1|2,0,0]=4 8296 B9R1.35 C[C@H](O)[C@H]1COC(=O)C1 Amb27980502 [0,0,0,1,0,1|2,0,0]=4 8297 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb24598417 [0,0,0,1,0,1|1,0,0]=3 8298 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb35745779 [0,0,0,1,0,1|1,0,0]=3 8299 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)O1 Amb24651587 [0,0,0,1,0,1|1,0,0]=3 8300 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)C1 Amb27630457 [0,0,0,1,0,1|1,0,0]=3 8301 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)N1 Amb28059269 [0,0,0,1,0,1|2,0,0]=4 8302 B9R1.35 C[C@H]1CC[C@@H](C(N)=O)O1 Amb27390111 [0,0,0,1,0,1|2,0,0]=4 8303 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 Amb33871500 [0,0,0,1,0,1|1,0,0]=3 8304 B9R1.35 C[C@H]1CC[C@H](C(N)=O)N1 Amb27204783 [0,0,0,1,0,1|2,0,0]=4 8305 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [0,0,0,1,0,1|0,0,0]=2 8306 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [0,0,0,1,0,1|0,0,0]=2 8307 B9R1.35 C[C@H]1CS[C@H](C(=O)Cl)S1 Amb28320678 [0,0,0,1,0,1|2,0,0]=4 8308 B9R1.35 C[C@H]1N[C@@H](C(=O)O)CS1 Amb28198473 [0,0,0,1,0,1|1,0,0]=3 8309 B9R1.35 C[C@H]1O[C@H](C(=O)O)CS1 Amb27252305 [0,0,0,1,0,1|1,0,0]=3 8310 B9R1.35 NC(=O)C1CC(F)CN1 Amb21963545 [0,0,0,1,0,1|2,0,0]=4 8311 B9R1.35 NC(=O)C1CC(F)CN1 Amb32666337 [0,0,0,1,0,1|2,0,0]=4 8312 B9R1.35 NC(=O)C1CC(O)CN1 Amb1152420 [0,0,0,1,0,1|2,0,0]=4 8313 B9R1.35 NC(=O)C1CC(O)CN1 Amb32668520 [0,0,0,1,0,1|2,0,0]=4 8314 B9R1.35 NC(=O)C1CCC(Cl)C1 Amb27253059 [0,0,0,1,0,1|2,0,0]=4 8315 B9R1.35 NC(=O)C1CCC(F)C1 Amb27155322 [0,0,0,1,0,1|2,0,0]=4 8316 B9R1.35 NC(=O)C1CCC(N)C1 Amb25104222 [0,0,0,1,0,1|2,0,0]=4 8317 B9R1.35 NC(=O)C1CCC(N)C1 Amb32663130 [0,0,0,1,0,1|2,0,0]=4 8318 B9R1.35 NC(=O)N1CCC(F)C1 Amb35591996 [0,0,0,1,0,1|2,0,0]=4 8319 B9R1.35 NC(=O)N1CCC(N)C1 Amb18943828 [0,0,0,1,0,1|2,0,0]=4 8320 B9R1.35 NC(=O)N1CCC(N)C1 Amb19373727 [0,0,0,1,0,1|2,0,0]=4 8321 B9R1.35 NC(=O)N1CCC(O)C1 Amb24635585 [0,0,0,1,0,1|2,0,0]=4 8322 B9R1.35 NC(=O)N1CC[C@@H](O)C1 Amb27763323 [0,0,0,1,0,1|2,0,0]=4 8323 B9R1.35 NC(=O)N1CC[C@H](S)C1 Amb27602032 [0,0,0,1,0,1|2,0,0]=4 8324 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22747998 [0,0,0,1,0,1|2,0,0]=4 8325 B9R1.35 NC(=O)[C@@H]1CC(O)CN1 Amb28054059 [0,0,0,1,0,1|2,0,0]=4 8326 B9R1.35 NC(=O)[C@@H]1CC[C@H](S)C1 Amb25290990 [0,0,0,1,0,1|2,0,0]=4 8327 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745766 [0,0,0,1,0,1|2,0,0]=4 8328 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745768 [0,0,0,1,0,1|2,0,0]=4 8329 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb24061354 [0,0,0,1,0,1|2,0,0]=4 8330 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb28985696 [0,0,0,1,0,1|2,0,0]=4 8331 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 Amb10808100 [0,0,0,1,0,1|2,0,0]=4 8332 B9R1.35 NC(=O)[C@@H]1C[C@H](O)CN1 Amb27476480 [0,0,0,1,0,1|2,0,0]=4 8333 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb25321319 [0,0,0,1,0,1|2,0,0]=4 8334 B9R1.35 NC(=O)[C@H]1CC[C@@H](N)C1 Amb28921043 [0,0,0,1,0,1|2,0,0]=4 8335 B9R1.35 NC(=O)[C@H]1C[C@@H](O)CN1 Amb27628841 [0,0,0,1,0,1|2,0,0]=4 8336 B9R1.35 NC(=O)[C@H]1C[C@H](F)CN1 Amb27205380 [0,0,0,1,0,1|2,0,0]=4 8337 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24586279 [0,0,0,1,0,1|2,0,0]=4 8338 B9R1.35 NC1C=C(C(=O)O)CC1 Amb18642496 [0,0,0,1,0,1|1,0,1]=4 8339 B9R1.35 NC1C=CC(C(=O)O)C1 Amb20622377 [0,0,0,1,0,1|1,0,1]=4 8340 B9R1.35 NC1C=CC(C(=O)O)C1 Amb20623555 [0,0,0,1,0,1|1,0,1]=4 8341 B9R1.35 NC1CC=C(C(=O)O)C1 Amb18642495 [0,0,0,1,0,1|1,0,1]=4 8342 B9R1.35 NC1CC=C(C(=O)O)C1 Amb32667606 [0,0,0,1,0,1|1,0,1]=4 8343 B9R1.35 NC1CCC(C(=O)O)C1 Amb10066880 [0,0,0,1,0,1|1,0,0]=3 8344 B9R1.35 NC1CCC(C(=O)O)C1 Amb2694935 [0,0,0,1,0,1|1,0,0]=3 8345 B9R1.35 NC1CN[C@H](C(=O)O)C1 Amb28145911 [0,0,0,1,0,1|1,0,0]=3 8346 B9R1.35 NC1COC(C(=O)O)C1 Amb18642828 [0,0,0,1,0,1|1,0,0]=3 8347 B9R1.35 NC1CSC(C(=O)O)C1 Amb18831415 [0,0,0,1,0,1|1,0,0]=3 8348 B9R1.35 N[C@@H]1C=C[C@H](C(=O)O)C1 Amb8516355 [0,0,0,1,0,1|1,0,1]=4 8349 B9R1.35 N[C@@H]1CC=C(C(=O)O)C1 Amb25824589 [0,0,0,1,0,1|1,0,1]=4 8350 B9R1.35 N[C@@H]1CCC(C(=O)O)C1 Amb27263056 [0,0,0,1,0,1|1,0,0]=3 8351 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb10066881 [0,0,0,1,0,1|1,0,0]=3 8352 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 Amb33801942 [0,0,0,1,0,1|1,0,0]=3 8353 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb33801272 [0,0,0,1,0,1|1,0,0]=3 8354 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 Amb8516357 [0,0,0,1,0,1|1,0,0]=3 8355 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb19515889 [0,0,0,1,0,1|1,0,0]=3 8356 B9R1.35 N[C@@H]1CN[C@@H](C(=O)O)C1 Amb25992752 [0,0,0,1,0,1|1,0,0]=3 8357 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10070446 [0,0,0,1,0,1|1,0,0]=3 8358 B9R1.35 N[C@@H]1CN[C@H](C(=O)O)C1 Amb10603136 [0,0,0,1,0,1|1,0,0]=3 8359 B9R1.35 N[C@@H]1CO[C@@H](C(=O)O)C1 Amb25691536 [0,0,0,1,0,1|1,0,0]=3 8360 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 Amb16232675 [0,0,0,1,0,1|1,0,1]=4 8361 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 Amb19515761 [0,0,0,1,0,1|1,0,1]=4 8362 B9R1.35 N[C@H]1CC=C(C(=O)O)C1 Amb25143919 [0,0,0,1,0,1|1,0,1]=4 8363 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb22746692 [0,0,0,1,0,1|1,0,0]=3 8364 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 Amb8516356 [0,0,0,1,0,1|1,0,0]=3 8365 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb10066883 [0,0,0,1,0,1|1,0,0]=3 8366 B9R1.35 N[C@H]1CC[C@H](C(=O)O)C1 Amb22756038 [0,0,0,1,0,1|1,0,0]=3 8367 B9R1.35 N[C@H]1CN[C@@H](C(=O)O)C1 Amb27255323 [0,0,0,1,0,1|1,0,0]=3 8368 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10070445 [0,0,0,1,0,1|1,0,0]=3 8369 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 Amb10603131 [0,0,0,1,0,1|1,0,0]=3 8370 B9R1.35 N[C@H]1CO[C@H](C(=O)O)C1 Amb24117069 [0,0,0,1,0,1|1,0,0]=3 8371 B9R1.35 O=C(Cl)C1CCC(Cl)C1 Amb24707520 [0,0,0,1,0,1|2,0,0]=4 8372 B9R1.35 O=C(Cl)N1CCC(F)C1 Amb29869318 [0,0,0,1,0,1|2,0,0]=4 8373 B9R1.35 O=C(O)C1=CC(Br)CC1 Amb27776760 [0,0,0,1,0,1|1,0,1]=4 8374 B9R1.35 O=C(O)C1=CC(O)CC1 Amb27619747 [0,0,0,1,0,1|1,0,1]=4 8375 B9R1.35 O=C(O)C1=C[C@@H](O)CC1 Amb27412374 [0,0,0,1,0,1|1,0,1]=4 8376 B9R1.35 O=C(O)C1=NC[C@@H](O)C1 Amb28198348 [0,0,0,1,0,1|1,0,1]=4 8377 B9R1.35 O=C(O)C1CC(Cl)CN1 Amb28436107 [0,0,0,1,0,1|1,0,0]=3 8378 B9R1.35 O=C(O)C1CC(F)CN1 Amb10608925 [0,0,0,1,0,1|1,0,0]=3 8379 B9R1.35 O=C(O)C1CC(I)CN1 Amb27467588 [0,0,0,1,0,1|1,0,0]=3 8380 B9R1.35 O=C(O)C1CC(O)CN1 Amb32666298 [0,0,0,1,0,1|1,0,0]=3 8381 B9R1.35 O=C(O)C1CC(O)CN1 Amb33481348 [0,0,0,1,0,1|1,0,0]=3 8382 B9R1.35 O=C(O)C1CC(O)CN1 Amb9702801 [0,0,0,1,0,1|1,0,0]=3 8383 B9R1.35 O=C(O)C1CC(O)CO1 Amb18642869 [0,0,0,1,0,1|1,0,0]=3 8384 B9R1.35 O=C(O)C1CCC(Br)C1 Amb2695404 [0,0,0,1,0,1|1,0,0]=3 8385 B9R1.35 O=C(O)C1CCC(F)C1 Amb22886545 [0,0,0,1,0,1|1,0,0]=3 8386 B9R1.35 O=C(O)C1CCC(I)C1 Amb23456141 [0,0,0,1,0,1|1,0,0]=3 8387 B9R1.35 O=C(O)C1CCC(O)C1 Amb21963572 [0,0,0,1,0,1|1,0,0]=3 8388 B9R1.35 O=C(O)C1CCC(S)C1 Amb27403449 [0,0,0,1,0,1|1,0,0]=3 8389 B9R1.35 O=C(O)C1CSS(=O)C1 Amb27165800 [0,0,0,1,0,1|2,0,0]=4 8390 B9R1.35 O=C(O)C1C[C@H](O)CN1 Amb34913473 [0,0,0,1,0,1|1,0,0]=3 8391 B9R1.35 O=C(O)C1NC(O)CS1 Amb26536906 [0,0,0,1,0,1|2,0,0]=4 8392 B9R1.35 O=C(O)[C@@H]1CC(O)CN1 Amb25743296 [0,0,0,1,0,1|1,0,0]=3 8393 B9R1.35 O=C(O)[C@@H]1CC(S)CN1 Amb28430216 [0,0,0,1,0,1|1,0,0]=3 8394 B9R1.35 O=C(O)[C@@H]1CC[C@@H](O)C1 Amb22746558 [0,0,0,1,0,1|1,0,0]=3 8395 B9R1.35 O=C(O)[C@@H]1CC[C@H](O)C1 Amb27784295 [0,0,0,1,0,1|1,0,0]=3 8396 B9R1.35 O=C(O)[C@@H]1CC[C@H](S)C1 Amb26438302 [0,0,0,1,0,1|1,0,0]=3 8397 B9R1.35 O=C(O)[C@@H]1C[C@@H](Br)CN1 Amb10603132 [0,0,0,1,0,1|1,0,0]=3 8398 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb16232298 [0,0,0,1,0,1|1,0,0]=3 8399 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 Amb8386381 [0,0,0,1,0,1|1,0,0]=3 8400 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)C=N1 Amb27215307 [0,0,0,1,0,1|1,0,1]=4 8401 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CN1 Amb1994991 [0,0,0,1,0,1|1,0,0]=3 8402 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)CO1 Amb28287549 [0,0,0,1,0,1|1,0,0]=3 8403 B9R1.35 O=C(O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,0,0,1,0,1|1,0,0]=3 8404 B9R1.35 O=C(O)[C@@H]1C[C@H](Br)CN1 Amb10603137 [0,0,0,1,0,1|1,0,0]=3 8405 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb27630657 [0,0,0,1,0,1|1,0,0]=3 8406 B9R1.35 O=C(O)[C@@H]1C[C@H](Cl)CN1 Amb35749342 [0,0,0,1,0,1|1,0,0]=3 8407 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb10603139 [0,0,0,1,0,1|1,0,0]=3 8408 B9R1.35 O=C(O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,0,0,1,0,1|1,0,0]=3 8409 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb22748218 [0,0,0,1,0,1|1,0,0]=3 8410 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8384483 [0,0,0,1,0,1|1,0,0]=3 8411 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 Amb8629987 [0,0,0,1,0,1|1,0,0]=3 8412 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb27783148 [0,0,0,1,0,1|1,0,0]=3 8413 B9R1.35 O=C(O)[C@@H]1C[C@H](S)CN1 Amb28994765 [0,0,0,1,0,1|1,0,0]=3 8414 B9R1.35 O=C(O)[C@H]1CC(F)CN1 Amb27447262 [0,0,0,1,0,1|1,0,0]=3 8415 B9R1.35 O=C(O)[C@H]1CC[C@H](O)C1 Amb26960428 [0,0,0,1,0,1|1,0,0]=3 8416 B9R1.35 O=C(O)[C@H]1CC[C@H](O)N1 Amb27421972 [0,0,0,1,0,1|2,0,0]=4 8417 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb10839999 [0,0,0,1,0,1|1,0,0]=3 8418 B9R1.35 O=C(O)[C@H]1C[C@@H](F)CN1 Amb33726117 [0,0,0,1,0,1|1,0,0]=3 8419 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5718663 [0,0,0,1,0,1|1,0,0]=3 8420 B9R1.35 O=C(O)[C@H]1C[C@@H](O)CN1 Amb5719209 [0,0,0,1,0,1|1,0,0]=3 8421 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb10067741 [0,0,0,1,0,1|1,0,0]=3 8422 B9R1.35 O=C(O)[C@H]1C[C@H](F)CN1 Amb28989995 [0,0,0,1,0,1|1,0,0]=3 8423 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb16230723 [0,0,0,1,0,1|1,0,0]=3 8424 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 Amb8628928 [0,0,0,1,0,1|1,0,0]=3 8425 B9R1.35 O=C(O)[C@H]1O[C@H](O)CS1 Amb25288477 [0,0,0,1,0,1|2,0,0]=4 8426 B9R1.35 O=C1CC(C(=O)O)CN1 Amb33545000 [0,0,0,1,0,1|1,0,1]=4 8427 B9R1.35 O=C1CC(C(=O)O)CO1 Amb22642307 [0,0,0,1,0,1|1,0,1]=4 8428 B9R1.35 O=C1CC(C(=O)O)CS1 Amb10073724 [0,0,0,1,0,1|1,0,1]=4 8429 B9R1.35 O=C1CCC(C(=O)O)C1 Amb2695400 [0,0,0,1,0,1|1,0,1]=4 8430 B9R1.35 O=C1CC[C@@H](C(=O)O)C1 Amb27254141 [0,0,0,1,0,1|1,0,1]=4 8431 B9R1.35 O=C1CC[C@H](C(=O)O)C1 Amb22746923 [0,0,0,1,0,1|1,0,1]=4 8432 B9R1.35 O=C1CNC(C(=O)O)C1 Amb30625211 [0,0,0,1,0,1|1,0,1]=4 8433 B9R1.35 O=C1CNC(C(=O)O)C1 Amb8386094 [0,0,0,1,0,1|1,0,1]=4 8434 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb22747440 [0,0,0,1,0,1|1,0,1]=4 8435 B9R1.35 O=C1CN[C@H](C(=O)O)C1 Amb8628977 [0,0,0,1,0,1|1,0,1]=4 8436 B9R1.35 O=C1COC(C(=O)O)C1 Amb32651713 [0,0,0,1,0,1|1,0,1]=4 8437 B9R1.35 O=C1CSC(C(=O)O)C1 Amb24061425 [0,0,0,1,0,1|1,0,1]=4 8438 B9R1.35 O=C1C[C@@H](C(=O)O)CN1 Amb23439643 [0,0,0,1,0,1|1,0,1]=4 8439 B9R1.35 O=C1C[C@@H](C(=O)O)CO1 Amb27253217 [0,0,0,1,0,1|1,0,1]=4 8440 B9R1.35 O=C1C[C@H](C(=O)O)CN1 Amb25946886 [0,0,0,1,0,1|1,0,1]=4 8441 B9R1.35 O=C1NCC(C(F)F)O1 Amb27199411 [0,0,0,1,0,1|2,0,0]=4 8442 B9R1.35 O=C1OCC(C(Cl)Cl)O1 Amb27794666 [0,0,0,1,0,1|2,0,0]=4 8443 B9R1.35 O=C1OCC(C(F)F)O1 Amb22387067 [0,0,0,1,0,1|2,0,0]=4 8444 B9R1.46 CC(=O)CCC1CC1C Amb25873753 [0,0,0,1,0,1|1,0,0]=3 8445 B9R1.46 CC(=O)CCC1OC1C Amb28194562 [0,0,0,1,0,1|2,0,0]=4 8446 B9R1.46 CC(=O)OCC1CC1C Amb27836351 [0,0,0,1,0,1|1,0,0]=3 8447 B9R1.46 CC(=O)SCC1CC1C Amb27965313 [0,0,0,1,0,1|1,0,0]=3 8448 B9R1.46 CC(=O)\C=C\C1CC1C Amb33143910 [0,0,0,1,0,1|1,0,1]=4 8449 B9R1.46 CC(O)CCC1CC1C Amb33172627 [0,0,0,1,0,1|1,0,1]=4 8450 B9R1.46 CC1CC1C#CC(=O)O Amb24390173 [0,0,0,1,0,1|0,0,1]=3 8451 B9R1.46 CC1CC1CCC(=O)O Amb27220003 [0,0,0,1,0,1|0,0,0]=2 8452 B9R1.46 CC1CC1CC[C@@H](C)O Amb33144245 [0,0,0,1,0,1|1,0,1]=4 8453 B9R1.46 CC1CC1CC[C@H](C)O Amb33144246 [0,0,0,1,0,1|1,0,1]=4 8454 B9R1.46 CC1CC1CC[N+](=O)[O-] Amb33144228 [0,0,0,1,0,1|1,0,1]=4 8455 B9R1.46 CC1CC1CNC(=O)Cl Amb35625728 [0,0,0,1,0,1|1,0,0]=3 8456 B9R1.46 CC1CC1COC(=O)Cl Amb33296958 [0,0,0,1,0,1|1,0,0]=3 8457 B9R1.46 CC1CC1NCC(N)=O Amb18990531 [0,0,0,1,0,1|1,0,0]=3 8458 B9R1.46 CC1CC1OCC(=O)O Amb33144889 [0,0,0,1,0,1|0,0,0]=2 8459 B9R1.46 CC1CC1\C=C\C(=O)O Amb33226425 [0,0,0,1,0,1|0,0,1]=3 8460 B9R1.46 C[C@@H]1O[C@H]1\C=C\C(=O)O Amb27191995 [0,0,0,1,0,1|1,0,1]=4 8461 B9R1.46 C[C@H]1O[C@H]1\C=C\C(=O)O Amb27614487 [0,0,0,1,0,1|1,0,1]=4 8462 B9R1.46 O=C(O)CCC1=C(Br)C1 Amb27650642 [0,0,0,1,0,1|1,0,1]=4 8463 B9R1.49 C=C1CCCC(C)CC1 Amb22364866 [0,0,0,1,0,1|2,0,0]=4 8464 B9R1.49 CC1=CCCC(=O)CC1 Amb27948552 [0,0,0,1,0,1|1,0,1]=4 8465 B9R1.49 CC1=NCC(C)NCC1 Amb27596558 [0,0,0,1,0,1|2,0,0]=4 8466 B9R1.49 CC1CC=CC(=O)CC1 Amb27838660 [0,0,0,1,0,1|1,0,1]=4 8467 B9R1.49 CC1CCCC(=O)CC1 Amb27265770 [0,0,0,1,0,1|1,0,0]=3 8468 B9R1.49 CC1CCCC(O)CC1 Amb25146901 [0,0,0,1,0,1|1,0,1]=4 8469 B9R1.49 CC1CCNC(=O)CC1 Amb9316850 [0,0,0,1,0,1|1,0,0]=3 8470 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,0,0,1,0,1|1,0,0]=3 8471 B9R1.49 CC1CCS(=O)CCN1 Amb24413310 [0,0,0,1,0,1|2,0,0]=4 8472 B9R1.49 CC1CCS(=O)CCN1 Amb28555361 [0,0,0,1,0,1|2,0,0]=4 8473 B9R1.49 CC1CNC(=O)CCN1 Amb10607813 [0,0,0,1,0,1|1,0,0]=3 8474 B9R1.49 CC1CNC(=O)CCN1 Amb22587019 [0,0,0,1,0,1|1,0,0]=3 8475 B9R1.49 CC1CNC(=S)CCS1 Amb27444108 [0,0,0,1,0,1|1,1,0]=4 8476 B9R1.49 CN1CCCC(=O)CC1 Amb8383587 [0,0,0,1,0,1|2,0,0]=4 8477 B9R1.49 CN1CCCC(=O)CC1 Amb8394679 [0,0,0,1,0,1|2,0,0]=4 8478 B9R1.49 CN1CCNC(=O)CC1 Amb21857545 [0,0,0,1,0,1|2,0,0]=4 8479 B9R1.49 CN1CCNC(=O)CC1 Amb8393772 [0,0,0,1,0,1|2,0,0]=4 8480 B9R1.49 C[C@@H]1CCCC(=O)CC1 Amb26483475 [0,0,0,1,0,1|1,0,0]=3 8481 B9R1.49 C[C@@H]1CCCC(=O)NC1 Amb27814970 [0,0,0,1,0,1|1,0,0]=3 8482 B9R1.49 C[C@H]1CCCC(=O)CC1 Amb28199901 [0,0,0,1,0,1|1,0,0]=3 8483 B9R1.49 C[C@H]1CCC[C@@H](O)CC1 Amb27661374 [0,0,0,1,0,1|1,0,1]=4 8484 B9R1.49 C[C@H]1CCC[C@H](O)CC1 Amb27220545 [0,0,0,1,0,1|1,0,1]=4 8485 B9R1.49 NC1CCCC(=O)NC1 Amb22230053 [0,0,0,1,0,1|2,0,0]=4 8486 B9R1.49 NC1CCCC(=O)NC1 Amb27867752 [0,0,0,1,0,1|2,0,0]=4 8487 B9R1.49 NC1CCNC(=O)CC1 Amb24689800 [0,0,0,1,0,1|2,0,0]=4 8488 B9R1.49 NC1CCNC(=O)CC1 Amb32663578 [0,0,0,1,0,1|2,0,0]=4 8489 B9R1.49 NC1CCNC(=O)CC1 Amb32663872 [0,0,0,1,0,1|2,0,0]=4 8490 B9R1.49 O=C1CCC(Cl)CCN1 Amb27768772 [0,0,0,1,0,1|2,0,0]=4 8491 B9R1.49 O=C1CCC(O)CCN1 Amb26443713 [0,0,0,1,0,1|2,0,0]=4 8492 B9R1.49 O=C1CCC(O)CCO1 Amb23598292 [0,0,0,1,0,1|2,0,0]=4 8493 B9R1.49 O=C1CCCC(O)CN1 Amb22491274 [0,0,0,1,0,1|2,0,0]=4 8494 B9R1.49 O=C1CCCC(O)CO1 Amb28138759 [0,0,0,1,0,1|1,0,0]=3 8495 B9R1.49 O=C1CCC[C@H](O)CC1 Amb27838657 [0,0,0,1,0,1|2,0,0]=4 8496 B9R1.49 O=C1CC[C@@H](Br)CCO1 Amb27447872 [0,0,0,1,0,1|2,0,0]=4 8497 B9R1.49 O=C1CC[C@H](Br)CCO1 Amb28458370 [0,0,0,1,0,1|2,0,0]=4 8498 B9R1.49 O=C1CNCC(O)CN1 Amb27838571 [0,0,0,1,0,1|2,0,0]=4 8499 B9R1.49 O=C1COC(=O)CCN1 Amb27168286 [0,0,0,1,0,1|1,0,1]=4 8500 B9R1.53 C=C(Br)CN1CC(C)C1 Amb30037978 [0,0,0,1,0,1|2,0,0]=4 8501 B9R1.53 C=C1CC(CC(=O)O)C1 Amb35788335 [0,0,0,1,0,1|0,0,2]=4 8502 B9R1.53 C=C1CN(CC(=O)O)C1 Amb30026788 [0,0,0,1,0,1|0,0,2]=4 8503 B9R1.53 CC(=O)CC1CC(C)C1 Amb28141809 [0,0,0,1,0,1|1,0,0]=3 8504 B9R1.53 CC(=O)CC1CC(N)C1 Amb33132563 [0,0,0,1,0,1|2,0,0]=4 8505 B9R1.53 CC(=O)C[C@H]1C[C@H](C)C1 Amb28193019 [0,0,0,1,0,1|1,0,0]=3 8506 B9R1.53 CC(=O)NC1CC(C)C1 Amb27465175 [0,0,0,1,0,1|1,0,0]=3 8507 B9R1.53 CC(=O)NC1CC(N)C1 Amb30594183 [0,0,0,1,0,1|2,0,0]=4 8508 B9R1.53 CC(=O)NC1CC(N)C1 Amb9458539 [0,0,0,1,0,1|2,0,0]=4 8509 B9R1.53 CC(=O)NC1CN(C)C1 Amb28383021 [0,0,0,1,0,1|2,0,0]=4 8510 B9R1.53 CC(=O)N[C@H]1C[C@H](N)C1 Amb27881328 [0,0,0,1,0,1|2,0,0]=4 8511 B9R1.53 CC(=O)O[C@H]1C[C@@H](O)C1 Amb34156629 [0,0,0,1,0,1|2,0,0]=4 8512 B9R1.53 CC(=O)O[C@H]1C[C@H](O)C1 Amb25777769 [0,0,0,1,0,1|2,0,0]=4 8513 B9R1.53 CC(=O)SC1CC(F)C1 Amb34136222 [0,0,0,1,0,1|2,0,0]=4 8514 B9R1.53 CC(C)CC1CC(=O)C1 Amb28246719 [0,0,0,1,0,1|1,0,0]=3 8515 B9R1.53 CC(C)CC1CC(=O)N1 Amb26853129 [0,0,0,1,0,1|1,0,0]=3 8516 B9R1.53 CC(C)CN1CC(O)C1 Amb19516880 [0,0,0,1,0,1|1,0,1]=4 8517 B9R1.53 CC(C)CN1CC(O)C1 Amb22587408 [0,0,0,1,0,1|1,0,1]=4 8518 B9R1.53 CC(C)OC1CC(=O)C1 Amb26031896 [0,0,0,1,0,1|1,0,0]=3 8519 B9R1.53 CC(C)OC1CC(O)C1 Amb24478808 [0,0,0,1,0,1|1,0,1]=4 8520 B9R1.53 CC(C)O[C@H]1C[C@@H](O)C1 Amb24670140 [0,0,0,1,0,1|1,0,1]=4 8521 B9R1.53 CC(C)SC1CC(O)C1 Amb32753275 [0,0,0,1,0,1|1,0,1]=4 8522 B9R1.53 CC(C)S[C@H]1C[C@@H](O)C1 Amb32674540 [0,0,0,1,0,1|1,0,1]=4 8523 B9R1.53 CC(N)CC1CC(=O)N1 Amb32676997 [0,0,0,1,0,1|2,0,0]=4 8524 B9R1.53 CC(O)CC1CC(=O)N1 Amb26596056 [0,0,0,1,0,1|2,0,0]=4 8525 B9R1.53 CC1CC(CC(=O)O)C1 Amb27461451 [0,0,0,1,0,1|0,0,0]=2 8526 B9R1.53 CC1CC(CS(=O)Cl)C1 Amb32720979 [0,0,0,1,0,1|2,0,0]=4 8527 B9R1.53 CC1CC(CS(N)=O)C1 Amb32720992 [0,0,0,1,0,1|2,0,0]=4 8528 B9R1.53 CC1CC(NC(=O)Cl)C1 Amb35631524 [0,0,0,1,0,1|1,0,0]=3 8529 B9R1.53 CC1CC(NC(N)=S)C1 Amb26982036 [0,0,0,1,0,1|1,1,0]=4 8530 B9R1.53 CC1CN(CC(=N)N)C1 Amb35587752 [0,0,0,1,0,1|2,0,0]=4 8531 B9R1.53 CC1CN(CC(=O)O)C1 Amb27838507 [0,0,0,1,0,1|0,0,0]=2 8532 B9R1.53 CC1CN(CC(=O)O)C1 Amb32661050 [0,0,0,1,0,1|0,0,0]=2 8533 B9R1.53 CC1CN(CC(N)=O)C1 Amb35587579 [0,0,0,1,0,1|1,0,0]=3 8534 B9R1.53 CC1CN(CC(N)=S)C1 Amb35666366 [0,0,0,1,0,1|1,1,0]=4 8535 B9R1.53 CC1CN(C[C@@H](C)O)C1 Amb35744125 [0,0,0,1,0,1|1,0,1]=4 8536 B9R1.53 CC1CN(C[C@H](C)O)C1 Amb35744124 [0,0,0,1,0,1|1,0,1]=4 8537 B9R1.53 CN1CC(CC(=O)O)C1 Amb26596162 [0,0,0,1,0,1|1,0,0]=3 8538 B9R1.53 CN1CC(CC(=O)O)C1 Amb28895941 [0,0,0,1,0,1|1,0,0]=3 8539 B9R1.53 CN1CC(NC(=O)Cl)C1 Amb35633536 [0,0,0,1,0,1|2,0,0]=4 8540 B9R1.53 C[C@H]1C[C@H](CC(=O)O)C1 Amb27859343 [0,0,0,1,0,1|0,0,0]=2 8541 B9R1.53 NC(=O)CC1CC(N)C1 Amb32682490 [0,0,0,1,0,1|2,0,0]=4 8542 B9R1.53 NC(=O)CC1CC(N)C1 Amb32682492 [0,0,0,1,0,1|2,0,0]=4 8543 B9R1.53 NC(=O)CN1CC(N)C1 Amb28287183 [0,0,0,1,0,1|2,0,0]=4 8544 B9R1.53 NC(=O)NC1CC(N)C1 Amb33527601 [0,0,0,1,0,1|2,0,0]=4 8545 B9R1.53 NC(=O)NC1CC(N)C1 Amb9460200 [0,0,0,1,0,1|2,0,0]=4 8546 B9R1.53 NC1CC(CC(=O)O)C1 Amb23440231 [0,0,0,1,0,1|1,0,0]=3 8547 B9R1.53 NC1CC(CC(=O)O)C1 Amb30585228 [0,0,0,1,0,1|1,0,0]=3 8548 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 Amb23440232 [0,0,0,1,0,1|1,0,0]=3 8549 B9R1.53 N[C@H]1C[C@@H](CC(=O)O)C1 Amb24056536 [0,0,0,1,0,1|1,0,0]=3 8550 B9R1.53 N[C@H]1C[C@H](CC(=O)O)C1 Amb23440233 [0,0,0,1,0,1|1,0,0]=3 8551 B9R1.53 N[C@H]1C[C@H](CC(=O)O)C1 Amb31291707 [0,0,0,1,0,1|1,0,0]=3 8552 B9R1.53 O=C(Cl)O[C@H]1C[C@H](Br)C1 Amb33297200 [0,0,0,1,0,1|2,0,0]=4 8553 B9R1.53 O=C(Cl)O[C@H]1C[C@H](Cl)C1 Amb33297198 [0,0,0,1,0,1|2,0,0]=4 8554 B9R1.53 O=C(O)CC1CC(=O)C1 Amb27493654 [0,0,0,1,0,1|1,0,1]=4 8555 B9R1.53 O=C(O)CC1CC(=O)N1 Amb24351879 [0,0,0,1,0,1|1,0,1]=4 8556 B9R1.53 O=C(O)CC1CC(F)C1 Amb27186311 [0,0,0,1,0,1|1,0,0]=3 8557 B9R1.53 O=C(O)CN1CC(O)C1 Amb25339150 [0,0,0,1,0,1|1,0,0]=3 8558 B9R1.53 O=C(O)C[C@H]1C[C@@H](O)C1 Amb26043308 [0,0,0,1,0,1|1,0,0]=3 8559 B9R1.53 O=C(O)C[C@H]1C[C@H](O)C1 Amb25204858 [0,0,0,1,0,1|1,0,0]=3 8560 B9R1.53 O=C([O-])CN1CC(O)C1 Amb35751645 [0,0,0,1,0,1|1,0,1]=4 8561 B9R1.66 C=C1CCCC(C)(C)C1 Amb27171015 [0,0,0,1,0,1|2,0,0]=4 8562 B9R1.66 C=C1CCNC(C)(C)C1 Amb29861445 [0,0,0,1,0,1|2,0,0]=4 8563 B9R1.66 CC1(C)C=C(I)CCO1 Amb26559423 [0,0,0,1,0,1|2,0,0]=4 8564 B9R1.66 CC1(C)C=C(N)CCO1 Amb28429736 [0,0,0,1,0,1|2,0,0]=4 8565 B9R1.66 CC1(C)CC(=O)CCN1 Amb18832677 [0,0,0,1,0,1|1,0,0]=3 8566 B9R1.66 CC1(C)CC(=O)CCN1 Amb22756378 [0,0,0,1,0,1|1,0,0]=3 8567 B9R1.66 CC1(C)CC(=O)CCO1 Amb533122 [0,0,0,1,0,1|1,0,0]=3 8568 B9R1.66 CC1(C)CC(=O)CCS1 Amb17593636 [0,0,0,1,0,1|1,0,0]=3 8569 B9R1.66 CC1(C)CC(O)CCN1 Amb22270194 [0,0,0,1,0,1|1,0,1]=4 8570 B9R1.66 CC1(C)CC(O)CCN1 Amb9781743 [0,0,0,1,0,1|1,0,1]=4 8571 B9R1.66 CC1(C)CC(O)CCO1 Amb33545291 [0,0,0,1,0,1|1,0,1]=4 8572 B9R1.66 CC1(C)CC(O)CCS1 Amb18202259 [0,0,0,1,0,1|1,0,1]=4 8573 B9R1.66 CC1(C)CC=CC(=O)C1 Amb9782605 [0,0,0,1,0,1|1,0,1]=4 8574 B9R1.66 CC1(C)CCCC(=O)C1 Amb13883565 [0,0,0,1,0,1|1,0,0]=3 8575 B9R1.66 CC1(C)CCCC(=O)N1 Amb26079134 [0,0,0,1,0,1|1,0,0]=3 8576 B9R1.66 CC1(C)CCCC(=O)O1 Amb25863489 [0,0,0,1,0,1|0,0,0]=2 8577 B9R1.66 CC1(C)CCCC(O)C1 Amb4034655 [0,0,0,1,0,1|1,0,1]=4 8578 B9R1.66 CC1(C)CCNC(=O)C1 Amb24451332 [0,0,0,1,0,1|1,0,0]=3 8579 B9R1.66 CC1(C)CCNC(N)=N1 Amb24600476 [0,0,0,1,0,1|2,0,0]=4 8580 B9R1.66 CC1(C)CCOC(=O)C1 Amb27826965 [0,0,0,1,0,1|1,0,0]=3 8581 B9R1.66 CC1(C)CCOC(O)C1 Amb28315463 [0,0,0,1,0,1|1,0,1]=4 8582 B9R1.66 CC1(C)CNCC(=O)N1 Amb25858036 [0,0,0,1,0,1|1,0,0]=3 8583 B9R1.66 CC1(C)CNCC(=O)N1 Amb32412168 [0,0,0,1,0,1|1,0,0]=3 8584 B9R1.66 CC1(C)CNCC(=O)O1 Amb28122961 [0,0,0,1,0,1|0,0,0]=2 8585 B9R1.66 CC1(C)CNCC(O)C1 Amb28132394 [0,0,0,1,0,1|1,0,1]=4 8586 B9R1.66 CC1(C)CNCC(O)C1 Amb30585178 [0,0,0,1,0,1|1,0,1]=4 8587 B9R1.66 CC1(C)COCC(=O)C1 Amb26515851 [0,0,0,1,0,1|1,0,0]=3 8588 B9R1.66 CC1(C)COCC(=O)N1 Amb5787087 [0,0,0,1,0,1|1,0,0]=3 8589 B9R1.66 CC1(C)COCC(N)O1 Amb24403091 [0,0,0,1,0,1|1,0,1]=4 8590 B9R1.66 CC1(C)CS(=O)CCN1 Amb24271114 [0,0,0,1,0,1|2,0,0]=4 8591 B9R1.66 CC1(C)CS(=O)CCN1 Amb33249695 [0,0,0,1,0,1|2,0,0]=4 8592 B9R1.66 CC1(C)CSCC(=O)N1 Amb27169504 [0,0,0,1,0,1|1,0,0]=3 8593 B9R1.66 CC1(C)OC=CC(=O)O1 Amb27635269 [0,0,0,1,0,1|0,0,2]=4 8594 B9R1.66 CC1(O)CCCC(=O)C1 Amb28202235 [0,0,0,1,0,1|2,0,0]=4 8595 B9R1.66 CC1(O)CCOC(=O)C1 Amb2695275 [0,0,0,1,0,1|2,0,0]=4 8596 B9R1.66 CC1=NC(C)(C)CCC1 Amb24101420 [0,0,0,1,0,1|2,0,0]=4 8597 B9R1.66 CC1=NC(C)(C)CCN1 Amb30021268 [0,0,0,1,0,1|2,0,0]=4 8598 B9R1.66 CC1=NC(C)(C)CCS1 Amb28068173 [0,0,0,1,0,1|2,0,0]=4 8599 B9R1.66 CC1CC(C)(O)CCN1 Amb25303339 [0,0,0,1,0,1|1,0,1]=4 8600 B9R1.66 CC1CC(C)(O)CCO1 Amb26952131 [0,0,0,1,0,1|1,0,1]=4 8601 B9R1.66 CC1CCCC(C)(C)O1 Amb24477890 [0,0,0,1,0,1|1,0,1]=4 8602 B9R1.66 CC1CCCC(C)(O)C1 Amb9675873 [0,0,0,1,0,1|1,0,1]=4 8603 B9R1.66 CC1CCNC(C)(C)O1 Amb27461422 [0,0,0,1,0,1|1,0,1]=4 8604 B9R1.66 CC1CCOC(C)(C)O1 Amb27959633 [0,0,0,1,0,1|1,0,1]=4 8605 B9R1.66 CC1CCOP(=O)(O)O1 Amb27493323 [0,0,0,1,0,1|2,0,0]=4 8606 B9R1.66 CC1CNCC(C)(C)O1 Amb9455114 [0,0,0,1,0,1|1,0,1]=4 8607 B9R1.66 CC1CNCC(C)(O)C1 Amb35728797 [0,0,0,1,0,1|1,0,1]=4 8608 B9R1.66 CC1CS(=O)(=O)CCN1 Amb19515399 [0,0,0,1,0,1|1,0,1]=4 8609 B9R1.66 CC1CS(=O)(=O)CCN1 Amb32758712 [0,0,0,1,0,1|1,0,1]=4 8610 B9R1.66 CC1CS(=O)(=O)CCO1 Amb2736270 [0,0,0,1,0,1|1,0,1]=4 8611 B9R1.66 CC1NCCC(C)(C)O1 Amb33194423 [0,0,0,1,0,1|1,0,1]=4 8612 B9R1.66 C[C@@H]1CS(=O)(=O)CCN1 Amb24652818 [0,0,0,1,0,1|1,0,1]=4 8613 B9R1.66 C[C@@H]1CS(=O)(=O)CCN1 Amb33621085 [0,0,0,1,0,1|1,0,1]=4 8614 B9R1.66 C[C@@]1(O)CCOC(=O)C1 Amb22388612 [0,0,0,1,0,1|2,0,0]=4 8615 B9R1.66 C[C@H]1CS(=O)(=O)CCN1 Amb25246713 [0,0,0,1,0,1|1,0,1]=4 8616 B9R1.66 C[C@H]1CS(=O)(=O)CCN1 Amb33621086 [0,0,0,1,0,1|1,0,1]=4 8617 B9R1.66 C[Si]1(C)CCCC(=O)O1 Amb27845166 [0,0,0,1,0,1|0,1,0]=3 8618 B9R1.85 C=C(C)CSCC1CC1 Amb28133272 [0,0,0,1,0,1|2,0,0]=4 8619 B9R1.85 CC(=O)CCCC1CC1 Amb25303589 [0,0,0,1,0,1|1,0,0]=3 8620 B9R1.85 CC(=O)CCNC1CC1 Amb24377194 [0,0,0,1,0,1|1,0,0]=3 8621 B9R1.85 CC(=O)CNCC1CC1 Amb27251858 [0,0,0,1,0,1|1,0,0]=3 8622 B9R1.85 CC(=O)\C=C\CC1CC1 Amb33361179 [0,0,0,1,0,1|1,0,1]=4 8623 B9R1.85 CC(C)=CCCC1CC1 Amb30023883 [0,0,0,1,0,1|2,0,0]=4 8624 B9R1.85 CC(C)CCCC1CO1 Amb27232305 [0,0,0,1,0,1|1,0,1]=4 8625 B9R1.85 CC(C)COCC1CO1 Amb6600577 [0,0,0,1,0,1|1,0,1]=4 8626 B9R1.85 CC(C)COC[C@H]1CO1 Amb27833842 [0,0,0,1,0,1|1,0,1]=4 8627 B9R1.85 CC(C)CSC[C@@H]1CO1 Amb27956612 [0,0,0,1,0,1|1,0,1]=4 8628 B9R1.85 CC(C)OCCC1CO1 Amb25138542 [0,0,0,1,0,1|1,0,1]=4 8629 B9R1.85 CC(C)SCCC1CO1 Amb27981259 [0,0,0,1,0,1|1,0,1]=4 8630 B9R1.85 CC(O)CCCC1CC1 Amb27780444 [0,0,0,1,0,1|1,0,1]=4 8631 B9R1.85 CC(O)CNCC1CC1 Amb9423143 [0,0,0,1,0,1|1,0,1]=4 8632 B9R1.85 CC(O)COCC1CC1 Amb27835307 [0,0,0,1,0,1|1,0,1]=4 8633 B9R1.85 C[C@@H](O)CCCC1CC1 Amb33361223 [0,0,0,1,0,1|1,0,1]=4 8634 B9R1.85 C[C@@H](O)CNCC1CC1 Amb28285299 [0,0,0,1,0,1|1,0,1]=4 8635 B9R1.85 C[C@H](O)CCCC1CC1 Amb33224926 [0,0,0,1,0,1|1,0,1]=4 8636 B9R1.85 C[C@H](O)COCC1CC1 Amb28397570 [0,0,0,1,0,1|1,0,1]=4 8637 B9R1.85 N=C(N)CCNC1CC1 Amb28289053 [0,0,0,1,0,1|2,0,0]=4 8638 B9R1.85 N=C(N)SCCC1CC1 Amb27180708 [0,0,0,1,0,1|2,0,0]=4 8639 B9R1.85 NC(=O)CCCC1CC1 Amb28193047 [0,0,0,1,0,1|1,0,0]=3 8640 B9R1.85 NC(=O)CCNC1CC1 Amb8841117 [0,0,0,1,0,1|1,0,0]=3 8641 B9R1.85 NC(=O)COCC1CC1 Amb19411503 [0,0,0,1,0,1|1,0,0]=3 8642 B9R1.85 NC(=S)COCC1CC1 Amb6681251 [0,0,0,1,0,1|1,1,0]=4 8643 B9R1.85 NC(=S)NCCC1CC1 Amb24495275 [0,0,0,1,0,1|1,1,0]=4 8644 B9R1.85 NS(=O)CCCC1CC1 Amb32720967 [0,0,0,1,0,1|2,0,0]=4 8645 B9R1.85 O=C(Cl)NCCC1CC1 Amb35633396 [0,0,0,1,0,1|1,0,0]=3 8646 B9R1.85 O=C(Cl)OCCC1CC1 Amb27162058 [0,0,0,1,0,1|1,0,0]=3 8647 B9R1.85 O=C(O)CCCC1CC1 Amb18832629 [0,0,0,1,0,1|0,0,0]=2 8648 B9R1.85 O=C(O)CCCC1CO1 Amb28453878 [0,0,0,1,0,1|1,0,0]=3 8649 B9R1.85 O=C(O)CCC[C@@H]1CO1 Amb27257665 [0,0,0,1,0,1|1,0,0]=3 8650 B9R1.85 O=C(O)CCNC1CC1 Amb1106410 [0,0,0,1,0,1|0,0,0]=2 8651 B9R1.85 O=C(O)CCNC1CC1 Amb532234 [0,0,0,1,0,1|0,0,0]=2 8652 B9R1.85 O=C(O)CCOC1CC1 Amb25926315 [0,0,0,1,0,1|0,0,0]=2 8653 B9R1.85 O=C(O)CNCC1CC1 Amb33038298 [0,0,0,1,0,1|0,0,0]=2 8654 B9R1.85 O=C(O)CNCC1CC1 Amb7766420 [0,0,0,1,0,1|0,0,0]=2 8655 B9R1.85 O=C(O)COCC1CC1 Amb6680905 [0,0,0,1,0,1|0,0,0]=2 8656 B9R1.85 O=C(O)CSCC1CC1 Amb9173460 [0,0,0,1,0,1|0,0,0]=2 8657 B9R1.85 O=C(O)\C=C\CC1CC1 Amb33362399 [0,0,0,1,0,1|0,0,1]=3 8658 B9R1.85 O=C(O)\C=C\NC1CC1 Amb22363623 [0,0,0,1,0,1|0,0,2]=4 8659 B9R1.85 O=C(O)\C=N\OC1CC1 Amb26008284 [0,0,0,1,0,1|1,0,1]=4 8660 B9R1.85 O=S(Cl)CCCC1CC1 Amb32720966 [0,0,0,1,0,1|2,0,0]=4 8661 B9R1.85 O=S([O-])CCCC1CC1 Amb32755669 [0,0,0,1,0,1|1,0,1]=4 8662 B9R1.85 O=[N+]([O-])CCCC1CC1 Amb33361218 [0,0,0,1,0,1|1,0,1]=4 8663 B9R1.150 CC1(C)CCCC1(C)O Amb27838538 [0,0,0,1,0,1|1,0,1]=4 8664 B9R1.150 CC1(C)CCNS1(=O)=O Amb31188291 [0,0,0,1,0,1|1,0,1]=4 8665 B9R1.161 C=C(C)C1CC1C(=O)O Amb25887453 [0,0,0,1,0,1|0,0,2]=4 8666 B9R1.161 C=C(C)[C@@H]1C[C@H]1C(=O)O Amb33199898 [0,0,0,1,0,1|0,0,2]=4 8667 B9R1.161 CC(=O)C1CC1=C(C)C Amb27409612 [0,0,0,1,0,1|1,0,1]=4 8668 B9R1.161 CC(=O)C1CC1C(C)C Amb28049066 [0,0,0,1,0,1|1,0,0]=3 8669 B9R1.161 CC(=O)C1OC1C(C)C Amb27212949 [0,0,0,1,0,1|1,0,0]=3 8670 B9R1.161 CC(C)C1CC1C(=O)O Amb18285139 [0,0,0,1,0,1|0,0,0]=2 8671 B9R1.161 CC(C)C1CC1C(C)O Amb28190309 [0,0,0,1,0,1|1,0,1]=4 8672 B9R1.161 CC(C)C1CC1C(N)=O Amb27815060 [0,0,0,1,0,1|1,0,0]=3 8673 B9R1.161 CC(C)[C@@H]1C[C@H]1C(=O)O Amb33360310 [0,0,0,1,0,1|0,0,0]=2 8674 B9R1.161 CC(C)[C@@H]1C[C@H]1[C@@H](C)O Amb27852782 [0,0,0,1,0,1|1,0,1]=4 8675 B9R1.161 CC(C)[C@@H]1C[C@H]1[C@H](C)O Amb27853890 [0,0,0,1,0,1|1,0,1]=4 8676 B9R1.161 CC(C)[C@@H]1O[C@H]1C(=O)O Amb28252782 [0,0,0,1,0,1|0,0,0]=2 8677 B9R1.161 CC(C)[C@@H]1O[C@H]1[C@@H](C)O Amb27206013 [0,0,0,1,0,1|1,0,1]=4 8678 B9R1.161 CC(C)[C@H]1O[C@@H]1[C@@H](C)O Amb27219889 [0,0,0,1,0,1|1,0,1]=4 8679 B9R1.161 CC(N)C1CC1C(=O)O Amb27441985 [0,0,0,1,0,1|1,0,0]=3 8680 B9R1.161 CC(O)C1CC1C(=O)O Amb25888760 [0,0,0,1,0,1|1,0,0]=3 8681 B9R1.161 CC(O)[C@@H]1C[C@@H]1C(=O)O Amb28457538 [0,0,0,1,0,1|1,0,0]=3 8682 B9R1.161 CC(O)[C@@H]1C[C@H]1C(=O)O Amb27489157 [0,0,0,1,0,1|1,0,0]=3 8683 B9R1.161 O=C(O)C1CC1C(F)F Amb25338314 [0,0,0,1,0,1|2,0,0]=4 8684 B9R1.161 O=C(O)[C@@H]1C[C@@H]1C(F)F Amb26459940 [0,0,0,1,0,1|2,0,0]=4 8685 B9R1.161 O=C(O)[C@@H]1C[C@H]1C(F)F Amb24654017 [0,0,0,1,0,1|2,0,0]=4 8686 B9R1.166 CC(=O)C1OCC1(C)C Amb27226252 [0,0,0,1,0,1|1,0,0]=3 8687 B9R1.166 CC(=O)[C@H]1CC[C@@]1(C)F Amb27788386 [0,0,0,1,0,1|2,0,0]=4 8688 B9R1.166 CC1(C)CCC1C(=O)O Amb25032090 [0,0,0,1,0,1|0,0,0]=2 8689 B9R1.166 CC1(C)CNC1C(=O)O Amb24117326 [0,0,0,1,0,1|0,0,0]=2 8690 B9R1.166 CC1(C)CNC1C(=O)O Amb27253737 [0,0,0,1,0,1|0,0,0]=2 8691 B9R1.166 CC1(C)CN[C@@H]1C(=O)O Amb30869393 [0,0,0,1,0,1|0,0,0]=2 8692 B9R1.166 CC1(C)CN[C@H]1C(=O)O Amb34161295 [0,0,0,1,0,1|0,0,0]=2 8693 B9R1.166 CC1(C)COC1C(=O)Cl Amb35745011 [0,0,0,1,0,1|1,0,0]=3 8694 B9R1.166 CC1(C)COC1C(=O)O Amb8010835 [0,0,0,1,0,1|0,0,0]=2 8695 B9R1.166 O=C(O)C1CCC1(F)F Amb24452747 [0,0,0,1,0,1|2,0,0]=4 8696 B9R1.166 O=C(O)C1NCC1(F)F Amb27813163 [0,0,0,1,0,1|2,0,0]=4 8697 B9R1.170 CC(=O)CC1CC1(C)O Amb28461242 [0,0,0,1,0,1|2,0,0]=4 8698 B9R1.170 CC1(C)CC1CC(=O)O Amb25145962 [0,0,0,1,0,1|0,0,0]=2 8699 B9R1.170 CC1(C)CC1NC(=O)Cl Amb35625820 [0,0,0,1,0,1|1,0,0]=3 8700 B9R1.170 CC1(C)C\C1=C/C(=O)O Amb25056977 [0,0,0,1,0,1|0,0,1]=3 8701 B9R1.170 CC1(C)OC1C[N+](=O)[O-] Amb32669078 [0,0,0,1,0,1|1,0,1]=4 8702 B9R1.170 O=C(O)CC1CC1(Cl)Cl Amb28458433 [0,0,0,1,0,1|2,0,0]=4 8703 B9R1.170 O=C(O)CC1CC1(F)F Amb22411507 [0,0,0,1,0,1|2,0,0]=4 8704 B9R1.1 C#CC1CCC(=O)CC1 Amb27807116 [0,1,0,1,0,0|1,0,1]=4 8705 B9R1.1 C=C1CCC(CBr)CC1 Amb15695263 [0,1,0,1,0,0|2,0,0]=4 8706 B9R1.1 C=C1CCC(CN)CC1 Amb13882965 [0,1,0,1,0,0|2,0,0]=4 8707 B9R1.1 C=C1CCC(CN)CC1 Amb30585185 [0,1,0,1,0,0|2,0,0]=4 8708 B9R1.1 C=C1CCC(CO)CC1 Amb10975464 [0,1,0,1,0,0|2,0,0]=4 8709 B9R1.1 CC1=CCC(CO)CC1 Amb2699906 [0,1,0,1,0,0|2,0,0]=4 8710 B9R1.1 CC1CC=C(C#N)CC1 Amb18642016 [0,1,0,1,0,0|2,0,0]=4 8711 B9R1.1 CC1CC=C(CO)CN1 Amb27186346 [0,1,0,1,0,0|2,0,0]=4 8712 B9R1.1 CC1CCC(=CBr)CC1 Amb22227652 [0,1,0,1,0,0|2,0,0]=4 8713 B9R1.1 CC1CCC(=CCl)CC1 Amb27858789 [0,1,0,1,0,0|2,0,0]=4 8714 B9R1.1 CC1CCC(=NO)CC1 Amb391426 [0,1,0,1,0,0|1,0,0]=3 8715 B9R1.1 CC1CCC(C=O)CC1 Amb18642467 [0,1,0,1,0,0|1,0,1]=4 8716 B9R1.1 CC1CCC(C=O)OC1 Amb27827433 [0,1,0,1,0,0|0,0,1]=3 8717 B9R1.1 CC1CCC(CBr)CO1 Amb35679306 [0,1,0,1,0,0|1,0,1]=4 8718 B9R1.1 CC1CCC(CBr)OC1 Amb35788523 [0,1,0,1,0,0|1,0,1]=4 8719 B9R1.1 CC1CCC(CCl)CO1 Amb35679305 [0,1,0,1,0,0|1,0,1]=4 8720 B9R1.1 CC1CCC(CN)CO1 Amb29860382 [0,1,0,1,0,0|1,0,1]=4 8721 B9R1.1 CC1CCC(CO)CC1 Amb22229834 [0,1,0,1,0,0|1,0,1]=4 8722 B9R1.1 CC1CCC(CO)CO1 Amb35678925 [0,1,0,1,0,0|1,0,1]=4 8723 B9R1.1 CC1CCC(CO)NC1 Amb22886337 [0,1,0,1,0,0|1,0,1]=4 8724 B9R1.1 CC1CCC(CO)OC1 Amb27833600 [0,1,0,1,0,0|0,0,2]=4 8725 B9R1.1 CC1CCN(N=O)CC1 Amb24601452 [0,1,0,1,0,0|2,0,0]=4 8726 B9R1.1 CC1CC\C(=N\O)CO1 Amb35709647 [0,1,0,1,0,0|2,0,0]=4 8727 B9R1.1 CC1CC\C(=N\O)CS1 Amb35611376 [0,1,0,1,0,0|2,0,0]=4 8728 B9R1.1 CC=C1CCC(=O)CC1 Amb28129794 [0,1,0,1,0,0|1,0,1]=4 8729 B9R1.1 CCC1C=CC(=O)CC1 Amb26870913 [0,1,0,1,0,0|1,0,1]=4 8730 B9R1.1 CCC1CCC(=O)CC1 Amb6296028 [0,1,0,1,0,0|1,0,0]=3 8731 B9R1.1 CCC1CNC(=O)CN1 Amb18832614 [0,1,0,1,0,0|2,0,0]=4 8732 B9R1.1 CCC1CNC(=O)CO1 Amb27427622 [0,1,0,1,0,0|2,0,0]=4 8733 B9R1.1 CCC1CNC(=O)NC1 Amb25960166 [0,1,0,1,0,0|2,0,0]=4 8734 B9R1.1 CCC1COC(=O)CN1 Amb27179683 [0,1,0,1,0,0|1,0,0]=3 8735 B9R1.1 CCN1CCC(=O)CC1 Amb4606003 [0,1,0,1,0,0|2,0,0]=4 8736 B9R1.1 CCP1CCC(=O)CC1 Amb28285169 [0,1,0,1,0,0|2,0,0]=4 8737 B9R1.1 CC[C@H]1CC[C@H](O)CC1 Amb22231677 [0,1,0,1,0,0|1,0,1]=4 8738 B9R1.1 CN1CC=C(CO)CC1 Amb22754040 [0,1,0,1,0,0|2,0,0]=4 8739 B9R1.1 CN1CC=C(CO)CC1 Amb32662654 [0,1,0,1,0,0|2,0,0]=4 8740 B9R1.1 CN1CCC(=NO)CC1 Amb1934546 [0,1,0,1,0,0|2,0,0]=4 8741 B9R1.1 CN1CCC(=NO)CC1 Amb448560 [0,1,0,1,0,0|2,0,0]=4 8742 B9R1.1 CNC1CCC(=O)CC1 Amb10602371 [0,1,0,1,0,0|1,0,0]=3 8743 B9R1.1 CNC1CCC(=O)CC1 Amb22170247 [0,1,0,1,0,0|1,0,0]=3 8744 B9R1.1 CNC1CCC(=O)NC1 Amb28047809 [0,1,0,1,0,0|1,0,0]=3 8745 B9R1.1 CNC1CCC(C)OC1 Amb35703065 [0,1,0,1,0,0|1,0,1]=4 8746 B9R1.1 CNC1CCC(O)CC1 Amb18642719 [0,1,0,1,0,0|1,0,1]=4 8747 B9R1.1 CNC1CCC(O)CC1 Amb32729406 [0,1,0,1,0,0|1,0,1]=4 8748 B9R1.1 CNC1CCS(=O)CC1 Amb18948971 [0,1,0,1,0,0|2,0,0]=4 8749 B9R1.1 CNC1CCS(=O)CC1 Amb33549853 [0,1,0,1,0,0|2,0,0]=4 8750 B9R1.1 CN[C@@H]1CC=C(C)CC1 Amb28049919 [0,1,0,1,0,0|2,0,0]=4 8751 B9R1.1 CN[C@H]1CC[C@@H](O)CC1 Amb22744978 [0,1,0,1,0,0|1,0,1]=4 8752 B9R1.1 CN[C@H]1CC[C@@H](O)CC1 Amb22747298 [0,1,0,1,0,0|1,0,1]=4 8753 B9R1.1 CN[C@H]1CC[C@H](O)CC1 Amb22745615 [0,1,0,1,0,0|1,0,1]=4 8754 B9R1.1 CN[C@H]1CC[C@H](O)CC1 Amb30634178 [0,1,0,1,0,0|1,0,1]=4 8755 B9R1.1 COC1=CCC(O)CC1 Amb21858056 [0,1,0,1,0,0|2,0,0]=4 8756 B9R1.1 COC1=NCC(C)CC1 Amb28364252 [0,1,0,1,0,0|1,0,0]=3 8757 B9R1.1 COC1C=CC(=O)CC1 Amb27256443 [0,1,0,1,0,0|1,0,1]=4 8758 B9R1.1 COC1CC=C(C)CC1 Amb25279365 [0,1,0,1,0,0|2,0,0]=4 8759 B9R1.1 COC1CCC(=O)CC1 Amb2385260 [0,1,0,1,0,0|1,0,0]=3 8760 B9R1.1 COC1CCC(=O)CO1 Amb27265592 [0,1,0,1,0,0|2,0,0]=4 8761 B9R1.1 COC1CCC(C)CC1 Amb24323754 [0,1,0,1,0,0|1,0,1]=4 8762 B9R1.1 COC1CCC(O)CC1 Amb17593378 [0,1,0,1,0,0|1,0,1]=4 8763 B9R1.1 COC1CCC(O)OC1 Amb27805680 [0,1,0,1,0,0|0,0,2]=4 8764 B9R1.1 COC1CN=C(N)OC1 Amb27413531 [0,1,0,1,0,0|2,0,0]=4 8765 B9R1.1 CON1CCC(=O)CC1 Amb20670427 [0,1,0,1,0,0|2,0,0]=4 8766 B9R1.1 CO[C@@H]1CCC(=O)CO1 Amb27659850 [0,1,0,1,0,0|2,0,0]=4 8767 B9R1.1 CO[C@H]1CC[C@@H](O)CC1 Amb24502360 [0,1,0,1,0,0|1,0,1]=4 8768 B9R1.1 CO[C@H]1CC[C@@H](O)OC1 Amb28344966 [0,1,0,1,0,0|0,0,2]=4 8769 B9R1.1 CSC1C=CC(=O)CC1 Amb27211800 [0,1,0,1,0,0|1,0,1]=4 8770 B9R1.1 CS[C@H]1CC[C@@H](O)CC1 Amb15693040 [0,1,0,1,0,0|1,0,1]=4 8771 B9R1.1 C[C@@H]1CC[C@@H](CN)OC1 Amb35788826 [0,1,0,1,0,0|1,0,1]=4 8772 B9R1.1 C[C@@H]1CC[C@@H](CN)OC1 Amb35789057 [0,1,0,1,0,0|1,0,1]=4 8773 B9R1.1 C[C@@H]1CC[C@@H](CO)NC1 Amb26027160 [0,1,0,1,0,0|1,0,1]=4 8774 B9R1.1 C[C@@H]1CC[C@@H](CO)NC1 Amb35750775 [0,1,0,1,0,0|1,0,1]=4 8775 B9R1.1 C[C@H]1CC[C@@H](C=O)CC1 Amb27614173 [0,1,0,1,0,0|1,0,1]=4 8776 B9R1.1 C[C@H]1CC[C@@H](CO)CC1 Amb26407994 [0,1,0,1,0,0|1,0,1]=4 8777 B9R1.1 C[C@H]1CC[C@@H](CO)NC1 Amb27630533 [0,1,0,1,0,0|1,0,1]=4 8778 B9R1.1 C[C@H]1CC[C@H](C=O)CC1 Amb25075627 [0,1,0,1,0,0|1,0,1]=4 8779 B9R1.1 C[C@H]1CC[C@H](CO)CC1 Amb22886817 [0,1,0,1,0,0|1,0,1]=4 8780 B9R1.1 N#CC1CCC(=O)CC1 Amb16231535 [0,1,0,1,0,0|1,0,1]=4 8781 B9R1.1 NCC1CCC(=O)CC1 Amb31307747 [0,1,0,1,0,0|1,0,0]=3 8782 B9R1.1 NCC1CCC(=O)NC1 Amb18832607 [0,1,0,1,0,0|1,0,0]=3 8783 B9R1.1 NCC1CCC(=O)NC1 Amb32653087 [0,1,0,1,0,0|1,0,0]=3 8784 B9R1.1 NCC1CCC(=O)NC1 Amb32653107 [0,1,0,1,0,0|1,0,0]=3 8785 B9R1.1 NCC1CCC(=O)NC1 Amb35748141 [0,1,0,1,0,0|1,0,0]=3 8786 B9R1.1 NCC1CCC(O)CC1 Amb20669423 [0,1,0,1,0,0|1,0,1]=4 8787 B9R1.1 NCC1CCC(O)CC1 Amb25930193 [0,1,0,1,0,0|1,0,1]=4 8788 B9R1.1 NCC1CNC(=O)CO1 Amb22235660 [0,1,0,1,0,0|2,0,0]=4 8789 B9R1.1 NCC1CNC(=O)CO1 Amb24682214 [0,1,0,1,0,0|2,0,0]=4 8790 B9R1.1 NCC1COC(=O)CO1 Amb26575044 [0,1,0,1,0,0|1,0,0]=3 8791 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 Amb24183403 [0,1,0,1,0,0|1,0,1]=4 8792 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 Amb25323044 [0,1,0,1,0,0|1,0,1]=4 8793 B9R1.1 NC[C@H]1CC[C@H](O)CC1 Amb23439293 [0,1,0,1,0,0|1,0,1]=4 8794 B9R1.1 NC[C@H]1CC[C@H](O)CC1 Amb25075878 [0,1,0,1,0,0|1,0,1]=4 8795 B9R1.1 O=C1C=C[C@@H](CO)CC1 Amb27838659 [0,1,0,1,0,0|1,0,1]=4 8796 B9R1.1 O=C1CCC(CBr)CC1 Amb26583100 [0,1,0,1,0,0|1,0,0]=3 8797 B9R1.1 O=C1CCC(CBr)CN1 Amb23597460 [0,1,0,1,0,0|1,0,0]=3 8798 B9R1.1 O=C1CCC(CCl)CC1 Amb27196238 [0,1,0,1,0,0|1,0,0]=3 8799 B9R1.1 O=C1CCC(CO)CC1 Amb10071596 [0,1,0,1,0,0|1,0,0]=3 8800 B9R1.1 O=C1CCC(CO)CN1 Amb19958990 [0,1,0,1,0,0|1,0,0]=3 8801 B9R1.1 O=C1COC(CBr)CN1 Amb28281419 [0,1,0,1,0,0|2,0,0]=4 8802 B9R1.1 O=C1COC(CCl)CO1 Amb33734959 [0,1,0,1,0,0|1,0,0]=3 8803 B9R1.1 O=C1COC(CO)CN1 Amb22236094 [0,1,0,1,0,0|2,0,0]=4 8804 B9R1.1 O=C1COC(CO)CO1 Amb28315509 [0,1,0,1,0,0|1,0,0]=3 8805 B9R1.1 O=C1CO[C@H](CO)CN1 Amb10067153 [0,1,0,1,0,0|2,0,0]=4 8806 B9R1.1 O=CC1CCC(=O)CC1 Amb8385725 [0,1,0,1,0,0|1,0,1]=4 8807 B9R1.1 OC1CCC(CBr)CO1 Amb28285273 [0,1,0,1,0,0|0,0,2]=4 8808 B9R1.1 OC1CCC(CCl)CC1 Amb24480360 [0,1,0,1,0,0|1,0,1]=4 8809 B9R1.1 OC1CCC(CI)CC1 Amb25728551 [0,1,0,1,0,0|1,0,1]=4 8810 B9R1.1 OCC1=CCC(O)CC1 Amb28206504 [0,1,0,1,0,0|2,0,0]=4 8811 B9R1.1 OCC1CC=C(O)CC1 Amb27465669 [0,1,0,1,0,0|1,0,0]=3 8812 B9R1.1 OCC1CCC(O)CC1 Amb13883568 [0,1,0,1,0,0|1,0,1]=4 8813 B9R1.1 OC[C@H]1CC[C@@H](O)CC1 Amb26345146 [0,1,0,1,0,0|1,0,1]=4 8814 B9R1.1 OC[C@H]1CC[C@H](O)CC1 Amb25320791 [0,1,0,1,0,0|1,0,1]=4 8815 B9R1.10 C=C1CCC(C)(C)CC1 Amb24058249 [0,1,0,1,0,0|2,0,0]=4 8816 B9R1.10 C=C1CCC(C)(O)CC1 Amb24613129 [0,1,0,1,0,0|2,0,0]=4 8817 B9R1.10 C=C1COC(C)(C)OC1 Amb27604293 [0,1,0,1,0,0|2,0,0]=4 8818 B9R1.10 CC1(C)C=CC(=O)CC1 Amb8515573 [0,1,0,1,0,0|1,0,0]=3 8819 B9R1.10 CC1(C)C=CC(=O)CS1 Amb28144116 [0,1,0,1,0,0|2,0,0]=4 8820 B9R1.10 CC1(C)C=CC(O)CC1 Amb27827311 [0,1,0,1,0,0|1,0,1]=4 8821 B9R1.10 CC1(C)CC=C(Br)CC1 Amb22227865 [0,1,0,1,0,0|2,0,0]=4 8822 B9R1.10 CC1(C)CC=C(Cl)CC1 Amb27473762 [0,1,0,1,0,0|2,0,0]=4 8823 B9R1.10 CC1(C)CC=C(O)CC1 Amb27641416 [0,1,0,1,0,0|1,0,0]=3 8824 B9R1.10 CC1(C)CCC(=N)NC1 Amb27238730 [0,1,0,1,0,0|2,0,0]=4 8825 B9R1.10 CC1(C)CCC(=O)CC1 Amb15692607 [0,1,0,1,0,0|1,0,0]=3 8826 B9R1.10 CC1(C)CCC(=O)NC1 Amb33530532 [0,1,0,1,0,0|1,0,0]=3 8827 B9R1.10 CC1(C)CCC(=O)OC1 Amb28120623 [0,1,0,1,0,0|0,0,0]=2 8828 B9R1.10 CC1(C)CCC(N)=NC1 Amb24432942 [0,1,0,1,0,0|2,0,0]=4 8829 B9R1.10 CC1(C)CCC(N)CO1 Amb22504670 [0,1,0,1,0,0|1,0,1]=4 8830 B9R1.10 CC1(C)CCC(O)CC1 Amb2722969 [0,1,0,1,0,0|1,0,1]=4 8831 B9R1.10 CC1(C)CCC(O)CN1 Amb35751099 [0,1,0,1,0,0|1,0,1]=4 8832 B9R1.10 CC1(C)CCC(O)CN1 Amb35752365 [0,1,0,1,0,0|1,0,1]=4 8833 B9R1.10 CC1(C)CN=C(O)NC1 Amb25320550 [0,1,0,1,0,0|2,0,0]=4 8834 B9R1.10 CC1(C)CNC(=O)CN1 Amb18832615 [0,1,0,1,0,0|2,0,0]=4 8835 B9R1.10 CC1(C)CNC(=O)CO1 Amb26423126 [0,1,0,1,0,0|1,0,0]=3 8836 B9R1.10 CC1(C)CNC(=O)OC1 Amb8392177 [0,1,0,1,0,0|1,0,0]=3 8837 B9R1.10 CC1(C)COS(=O)OC1 Amb22741141 [0,1,0,1,0,0|2,0,0]=4 8838 B9R1.10 CC1(C)CO[PH](=O)OC1 Amb22369714 [0,1,0,1,0,0|2,0,0]=4 8839 B9R1.10 CC1(C)OCC(=O)CO1 Amb5718679 [0,1,0,1,0,0|1,0,0]=3 8840 B9R1.10 CC1(F)CCC(=O)CC1 Amb28062001 [0,1,0,1,0,0|1,0,0]=3 8841 B9R1.10 CC1(N)CCC(=O)CC1 Amb23589791 [0,1,0,1,0,0|1,0,0]=3 8842 B9R1.10 CC1(N)CCC(O)CC1 Amb23589778 [0,1,0,1,0,0|1,0,1]=4 8843 B9R1.10 CC1(N)CCC(O)CC1 Amb33330208 [0,1,0,1,0,0|1,0,1]=4 8844 B9R1.10 CC1(N)CCS(=O)CC1 Amb25140040 [0,1,0,1,0,0|2,0,0]=4 8845 B9R1.10 CC1(N)COS(=O)OC1 Amb29848057 [0,1,0,1,0,0|2,0,0]=4 8846 B9R1.10 CC1(O)CCC(=O)CC1 Amb22235468 [0,1,0,1,0,0|1,0,0]=3 8847 B9R1.10 CC1(O)CCC(O)CC1 Amb25674827 [0,1,0,1,0,0|1,0,1]=4 8848 B9R1.10 CC1CCC(C)(O)CC1 Amb9675900 [0,1,0,1,0,0|1,0,1]=4 8849 B9R1.10 CC1CCC(C)(O)CO1 Amb30016383 [0,1,0,1,0,0|1,0,1]=4 8850 B9R1.10 CC1CCC(C)(O)CS1 Amb29855989 [0,1,0,1,0,0|1,0,1]=4 8851 B9R1.10 CC1COS(=O)(=O)OC1 Amb33456745 [0,1,0,1,0,0|2,0,0]=4 8852 B9R1.10 CP1(=O)CCC(=O)CC1 Amb26489398 [0,1,0,1,0,0|2,0,0]=4 8853 B9R1.10 CP1(=S)CCC(=O)CC1 Amb28201085 [0,1,0,1,0,0|2,0,0]=4 8854 B9R1.10 C[C@H]1CC[C@](C)(O)CC1 Amb28205300 [0,1,0,1,0,0|1,0,1]=4 8855 B9R1.10 C[C@]1(N)CC[C@@H](O)CC1 Amb23440250 [0,1,0,1,0,0|1,0,1]=4 8856 B9R1.10 C[C@]1(N)CC[C@@H](O)CC1 Amb24645739 [0,1,0,1,0,0|1,0,1]=4 8857 B9R1.10 C[C@]1(N)CC[C@H](O)CC1 Amb23440251 [0,1,0,1,0,0|1,0,1]=4 8858 B9R1.10 C[C@]1(N)CC[C@H](O)CC1 Amb26504982 [0,1,0,1,0,0|1,0,1]=4 8859 B9R1.10 C[C@]1(O)CC[C@@H](O)CC1 Amb24643905 [0,1,0,1,0,0|1,0,1]=4 8860 B9R1.10 C[C@]1(O)CC[C@H](O)CC1 Amb27421997 [0,1,0,1,0,0|1,0,1]=4 8861 B9R1.10 C[N+]1(C)CCC(=O)CC1 Amb10552886 [0,1,0,1,0,0|2,0,0]=4 8862 B9R1.10 NC1(N)CCC(=O)CC1 Amb25695419 [0,1,0,1,0,0|2,0,0]=4 8863 B9R1.10 O=C1CCC(F)(F)CC1 Amb10982553 [0,1,0,1,0,0|2,0,0]=4 8864 B9R1.10 O=C1CCC(F)(F)CN1 Amb23439794 [0,1,0,1,0,0|2,0,0]=4 8865 B9R1.10 OC1=CCC(F)(F)CC1 Amb27855284 [0,1,0,1,0,0|2,0,0]=4 8866 B9R1.55 C=C1C[C@@H](C(=O)O)[C@H]1N Amb28055563 [0,1,0,1,0,0|0,0,2]=4 8867 B9R1.55 CC(=O)C1=C(C)C(C)C1 Amb28122458 [0,1,0,1,0,0|1,0,1]=4 8868 B9R1.55 CC(=O)C1CC(Cl)C1Cl Amb25689885 [0,1,0,1,0,0|2,0,0]=4 8869 B9R1.55 CC(=O)[C@@H]1C[C@H](Cl)[C@H]1Cl Amb27244175 [0,1,0,1,0,0|2,0,0]=4 8870 B9R1.55 CC(C)C1C[C@@H](O)[C@H]1O Amb27420495 [0,1,0,1,0,0|0,0,2]=4 8871 B9R1.55 CC(C)C1C[C@H](O)[C@@H]1O Amb28194183 [0,1,0,1,0,0|0,0,2]=4 8872 B9R1.55 CC(C)[C@@H]1CC(=O)[C@H]1C Amb28194589 [0,1,0,1,0,0|1,0,0]=3 8873 B9R1.55 CC(C)[C@@H]1NC(=O)[C@@H]1N Amb28349277 [0,1,0,1,0,0|1,0,0]=3 8874 B9R1.55 CC(C)[C@@H]1OC(=O)[C@H]1O Amb27196798 [0,1,0,1,0,0|0,0,0]=2 8875 B9R1.55 CC(O)C1CC(C)C1C Amb27174537 [0,1,0,1,0,0|1,0,1]=4 8876 B9R1.55 CC1CC(C(=O)Cl)N1C Amb27594214 [0,1,0,1,0,0|1,0,0]=3 8877 B9R1.55 CC1CC(C(=O)O)N1C Amb28285280 [0,1,0,1,0,0|0,0,0]=2 8878 B9R1.55 CC1OC(C(=O)[O-])C1O Amb28069594 [0,1,0,1,0,0|1,0,1]=4 8879 B9R1.55 CN1CC(C(=O)O)C1=O Amb17593354 [0,1,0,1,0,0|1,0,1]=4 8880 B9R1.55 C[C@@H]1C[C@@H](C(=O)Cl)N1C Amb25336470 [0,1,0,1,0,0|1,0,0]=3 8881 B9R1.55 C[C@@H]1C[C@H](C(=O)Cl)N1C Amb27654275 [0,1,0,1,0,0|1,0,0]=3 8882 B9R1.55 C[C@H]1CC(C(=O)O)[C@@H]1C Amb28132441 [0,1,0,1,0,0|0,0,0]=2 8883 B9R1.55 C[C@H]1C[C@@H](C(=O)Cl)N1C Amb27858264 [0,1,0,1,0,0|1,0,0]=3 8884 B9R1.55 N[C@H]1[C@@H](C(=O)O)C[C@H]1O Amb27848566 [0,1,0,1,0,0|1,0,0]=3 8885 B9R1.67 CC(=O)CC1CCC1F Amb27597070 [0,1,0,1,0,0|2,0,0]=4 8886 B9R1.67 CC(C)CC1CCC1=O Amb28285165 [0,1,0,1,0,0|1,0,0]=3 8887 B9R1.67 CC(C)CC1CCC1O Amb33213816 [0,1,0,1,0,0|1,0,1]=4 8888 B9R1.67 CC1CCC1NC(=O)Cl Amb35633330 [0,1,0,1,0,0|2,0,0]=4 8889 B9R1.67 CC1CCN1CC(=O)O Amb27838508 [0,1,0,1,0,0|1,0,0]=3 8890 B9R1.67 CC1CCN1CC(=O)O Amb33552557 [0,1,0,1,0,0|1,0,0]=3 8891 B9R1.67 CN(C)CC1CCC1=O Amb28429154 [0,1,0,1,0,0|2,0,0]=4 8892 B9R1.67 O=C(O)CC1CCC1F Amb33351668 [0,1,0,1,0,0|1,0,0]=3 8893 B9R1.69 C=C1CC(C)CNC1=O Amb27640032 [0,1,0,1,0,0|1,0,1]=4 8894 B9R1.69 C=C1CCC(C)CC1O Amb28049090 [0,1,0,1,0,0|1,0,0]=3 8895 B9R1.69 C=C1CC[C@H](C)[C@H](O)C1 Amb28133380 [0,1,0,1,0,0|2,0,0]=4 8896 B9R1.69 C=C1CN(C)CCC1=O Amb27881222 [0,1,0,1,0,0|2,0,0]=4 8897 B9R1.69 CC1=C(C)CC(C)CC1 Amb26603643 [0,1,0,1,0,0|2,0,0]=4 8898 B9R1.69 CC1=C(C)NC(=O)CC1 Amb8394546 [0,1,0,1,0,0|1,0,1]=4 8899 B9R1.69 CC1=CC(=O)CC[C@H]1C Amb27838729 [0,1,0,1,0,0|1,0,0]=3 8900 B9R1.69 CC1=CC(C)C(C)CC1 Amb25048711 [0,1,0,1,0,0|2,0,0]=4 8901 B9R1.69 CC1=CC(Cl)C(C)CC1 Amb27483834 [0,1,0,1,0,0|2,0,0]=4 8902 B9R1.69 CC1=CC(O)CCC1C Amb27218950 [0,1,0,1,0,0|1,0,1]=4 8903 B9R1.69 CC1=CC(O)CC[C@H]1C Amb28350322 [0,1,0,1,0,0|1,0,1]=4 8904 B9R1.69 CC1=CC(O)[C@H](C)CC1 Amb28049248 [0,1,0,1,0,0|2,0,0]=4 8905 B9R1.69 CC1=CCC(C)C(O)O1 Amb27206419 [0,1,0,1,0,0|1,0,1]=4 8906 B9R1.69 CC1=CCC(C)CC1O Amb27842013 [0,1,0,1,0,0|1,0,1]=4 8907 B9R1.69 CC1=CC[C@@H](C)C[C@H]1O Amb28401379 [0,1,0,1,0,0|1,0,1]=4 8908 B9R1.69 CC1=N[C@@H](C)C(=O)OC1 Amb27656381 [0,1,0,1,0,0|1,0,1]=4 8909 B9R1.69 CC1C=C(I)C(=O)CC1 Amb32867829 [0,1,0,1,0,0|1,0,1]=4 8910 B9R1.69 CC1C=CC(=O)C(C)C1 Amb27433057 [0,1,0,1,0,0|1,0,1]=4 8911 B9R1.69 CC1CC(=N)NC[C@@H]1C Amb27213704 [0,1,0,1,0,0|2,0,0]=4 8912 B9R1.69 CC1CC(=O)C(O)=CO1 Amb28351460 [0,1,0,1,0,0|1,0,1]=4 8913 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,1,0,1,0,0|2,0,0]=4 8914 B9R1.69 CC1CC(=O)CCN1C Amb19148128 [0,1,0,1,0,0|2,0,0]=4 8915 B9R1.69 CC1CC(=O)CC[C@H]1C Amb28141697 [0,1,0,1,0,0|1,0,0]=3 8916 B9R1.69 CC1CC(=O)NCC1O Amb27257393 [0,1,0,1,0,0|2,0,0]=4 8917 B9R1.69 CC1CC(=O)OCC1O Amb27956456 [0,1,0,1,0,0|1,0,0]=3 8918 B9R1.69 CC1CC(Br)CCC1=O Amb28396505 [0,1,0,1,0,0|2,0,0]=4 8919 B9R1.69 CC1CC=C(Br)C(O)C1 Amb27662803 [0,1,0,1,0,0|1,0,1]=4 8920 B9R1.69 CC1CC=C(Cl)C(=O)C1 Amb27199164 [0,1,0,1,0,0|1,0,1]=4 8921 B9R1.69 CC1CCC(=O)C(Br)C1 Amb18325312 [0,1,0,1,0,0|1,0,0]=3 8922 B9R1.69 CC1CCC(=O)C(C)C1 Amb27945615 [0,1,0,1,0,0|1,0,0]=3 8923 B9R1.69 CC1CCC(=O)C(F)C1 Amb27947951 [0,1,0,1,0,0|1,0,0]=3 8924 B9R1.69 CC1CCC(=O)C(O)C1 Amb25333970 [0,1,0,1,0,0|0,0,0]=2 8925 B9R1.69 CC1CCC(=O)C=C1O Amb26053264 [0,1,0,1,0,0|1,0,1]=4 8926 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [0,1,0,1,0,0|1,0,1]=4 8927 B9R1.69 CC1CCC(=O)CC1C Amb22732216 [0,1,0,1,0,0|1,0,0]=3 8928 B9R1.69 CC1CCC(=O)CC1Cl Amb27872191 [0,1,0,1,0,0|1,0,0]=3 8929 B9R1.69 CC1CCC(=O)CC1I Amb32867595 [0,1,0,1,0,0|1,0,0]=3 8930 B9R1.69 CC1CCC(=O)CC1N Amb32866958 [0,1,0,1,0,0|1,0,0]=3 8931 B9R1.69 CC1CCC(=O)CC1O Amb27180113 [0,1,0,1,0,0|1,0,0]=3 8932 B9R1.69 CC1CCC(=O)NC1=O Amb21963732 [0,1,0,1,0,0|1,0,1]=4 8933 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [0,1,0,1,0,0|0,0,1]=3 8934 B9R1.69 CC1CCC(Br)C(=O)C1 Amb27666885 [0,1,0,1,0,0|1,0,1]=4 8935 B9R1.69 CC1CCC(C)C(=O)C1 Amb22228357 [0,1,0,1,0,0|1,0,1]=4 8936 B9R1.69 CC1CCC(C)C(O)C1 Amb3941490 [0,1,0,1,0,0|1,0,1]=4 8937 B9R1.69 CC1CCC(Cl)C(=O)C1 Amb28195532 [0,1,0,1,0,0|1,0,1]=4 8938 B9R1.69 CC1CCC(Cl)C(O)C1 Amb27965032 [0,1,0,1,0,0|1,0,1]=4 8939 B9R1.69 CC1CCC(F)C(=O)C1 Amb27836782 [0,1,0,1,0,0|1,0,1]=4 8940 B9R1.69 CC1CCC(O)=CC1=O Amb24532888 [0,1,0,1,0,0|1,0,1]=4 8941 B9R1.69 CC1CCC(O)C(=O)O1 Amb28285159 [0,1,0,1,0,0|1,0,1]=4 8942 B9R1.69 CC1CCC(O)C(C)C1 Amb4034595 [0,1,0,1,0,0|1,0,1]=4 8943 B9R1.69 CC1CCC(O)C(Cl)C1 Amb28291502 [0,1,0,1,0,0|1,0,1]=4 8944 B9R1.69 CC1CCC(O)C(F)C1 Amb33229936 [0,1,0,1,0,0|1,0,1]=4 8945 B9R1.69 CC1CCC(O)C(N)C1 Amb18832563 [0,1,0,1,0,0|1,0,1]=4 8946 B9R1.69 CC1CCC(O)C(S)C1 Amb27495493 [0,1,0,1,0,0|0,1,1]=4 8947 B9R1.69 CC1CCC(O)CC1C Amb10844787 [0,1,0,1,0,0|1,0,1]=4 8948 B9R1.69 CC1CCC(O)CC1N Amb32867259 [0,1,0,1,0,0|1,0,1]=4 8949 B9R1.69 CC1CC[C@@H](O)[C@H](N)C1 Amb25912139 [0,1,0,1,0,0|1,0,1]=4 8950 B9R1.69 CC1CN(C)C(=O)CN1 Amb22227754 [0,1,0,1,0,0|2,0,0]=4 8951 B9R1.69 CC1CN(C)CCC1=O Amb9783387 [0,1,0,1,0,0|2,0,0]=4 8952 B9R1.69 CC1CN=C(N)C(C)C1 Amb26951260 [0,1,0,1,0,0|2,0,0]=4 8953 B9R1.69 CC1CNC(=N)CC1C Amb25960293 [0,1,0,1,0,0|2,0,0]=4 8954 B9R1.69 CC1CNC(=O)C(C)C1 Amb20670731 [0,1,0,1,0,0|1,0,0]=3 8955 B9R1.69 CC1CNC(=O)C(C)N1 Amb25255409 [0,1,0,1,0,0|2,0,0]=4 8956 B9R1.69 CC1CNC(=O)C(C)O1 Amb25831184 [0,1,0,1,0,0|2,0,0]=4 8957 B9R1.69 CC1CNC(=O)CC1=O Amb19958593 [0,1,0,1,0,0|1,0,1]=4 8958 B9R1.69 CC1CNC(=O)CC1O Amb27816242 [0,1,0,1,0,0|1,0,0]=3 8959 B9R1.69 CC1CNC(=O)CN1C Amb33347762 [0,1,0,1,0,0|2,0,0]=4 8960 B9R1.69 CC1CNC(=O)N(C)C1 Amb15701562 [0,1,0,1,0,0|2,0,0]=4 8961 B9R1.69 CC1CNC(=O)NC1N Amb27229171 [0,1,0,1,0,0|2,0,0]=4 8962 B9R1.69 CC1CNC(=O)[C@H](C)N1 Amb18832613 [0,1,0,1,0,0|2,0,0]=4 8963 B9R1.69 CC1NC(=O)CCC1Cl Amb27397322 [0,1,0,1,0,0|2,0,0]=4 8964 B9R1.69 CC1NC(=O)CCC1N Amb25276175 [0,1,0,1,0,0|2,0,0]=4 8965 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [0,1,0,1,0,0|2,0,0]=4 8966 B9R1.69 CC1NC(=O)COC1C Amb27440075 [0,1,0,1,0,0|2,0,0]=4 8967 B9R1.69 CC1NCC(=O)NC1C Amb27201107 [0,1,0,1,0,0|2,0,0]=4 8968 B9R1.69 CC1OC(=O)CCC1Br Amb27875143 [0,1,0,1,0,0|1,0,0]=3 8969 B9R1.69 CC1SCC(=O)OC1=O Amb2431035 [0,1,0,1,0,0|1,0,1]=4 8970 B9R1.69 CN1CC(N)CCC1=O Amb15701238 [0,1,0,1,0,0|2,0,0]=4 8971 B9R1.69 CN1CC(N)CCC1=O Amb22405964 [0,1,0,1,0,0|2,0,0]=4 8972 B9R1.69 CN1CC(N)CCC1=O Amb22586977 [0,1,0,1,0,0|2,0,0]=4 8973 B9R1.69 CN1CC(O)CCC1=O Amb22304825 [0,1,0,1,0,0|2,0,0]=4 8974 B9R1.69 CN1CCC(=O)C(N)C1 Amb18832618 [0,1,0,1,0,0|2,0,0]=4 8975 B9R1.69 CN1CCC(=O)C(O)C1 Amb32649088 [0,1,0,1,0,0|1,0,0]=3 8976 B9R1.69 CN1CCC(=O)CC1Cl Amb22496675 [0,1,0,1,0,0|2,0,0]=4 8977 B9R1.69 CN1C[C@@H](N)CCC1=O Amb27473199 [0,1,0,1,0,0|2,0,0]=4 8978 B9R1.69 C[C@@H]1CC(=O)C(O)=CO1 Amb28350976 [0,1,0,1,0,0|1,0,1]=4 8979 B9R1.69 C[C@@H]1CC(=O)CC[C@H]1O Amb34913315 [0,1,0,1,0,0|2,0,0]=4 8980 B9R1.69 C[C@@H]1CCC(=O)C(O)C1 Amb27838716 [0,1,0,1,0,0|0,0,0]=2 8981 B9R1.69 C[C@@H]1CCC(=O)[C@@H](Cl)C1 Amb28457297 [0,1,0,1,0,0|1,0,0]=3 8982 B9R1.69 C[C@@H]1CCC(=O)[C@H](O)C1 Amb27434293 [0,1,0,1,0,0|0,0,0]=2 8983 B9R1.69 C[C@@H]1CCC(O)C[C@H]1C Amb27445019 [0,1,0,1,0,0|1,0,1]=4 8984 B9R1.69 C[C@@H]1CC[C@@H](C)[C@H](O)C1 Amb27184906 [0,1,0,1,0,0|1,0,1]=4 8985 B9R1.69 C[C@@H]1CC[C@@H](O)CN1C Amb26591207 [0,1,0,1,0,0|1,0,1]=4 8986 B9R1.69 C[C@@H]1CC[C@@H](O)C[C@H]1C Amb28053499 [0,1,0,1,0,0|1,0,1]=4 8987 B9R1.69 C[C@@H]1CC[C@H](F)C(=O)C1 Amb28246572 [0,1,0,1,0,0|1,0,1]=4 8988 B9R1.69 C[C@@H]1CC[C@H](O)[C@H](O)C1 Amb28204040 [0,1,0,1,0,0|0,0,2]=4 8989 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 Amb22225141 [0,1,0,1,0,0|2,0,0]=4 8990 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 Amb24184039 [0,1,0,1,0,0|2,0,0]=4 8991 B9R1.69 C[C@@H]1CNC(=O)[C@@H](C)N1 Amb28254593 [0,1,0,1,0,0|2,0,0]=4 8992 B9R1.69 C[C@@H]1CNC(=O)[C@@H](C)O1 Amb28287913 [0,1,0,1,0,0|2,0,0]=4 8993 B9R1.69 C[C@@H]1COC(=O)N[C@H]1C Amb27203324 [0,1,0,1,0,0|1,0,0]=3 8994 B9R1.69 C[C@@H]1COC(O)[C@H](C)C1 Amb28429550 [0,1,0,1,0,0|0,0,2]=4 8995 B9R1.69 C[C@@H]1OC(=S)NC[C@H]1C Amb27439669 [0,1,0,1,0,0|1,1,0]=4 8996 B9R1.69 C[C@@H]1OCC(=O)N[C@@H]1C Amb26870419 [0,1,0,1,0,0|2,0,0]=4 8997 B9R1.69 C[C@@H]1O[C@H](C)CNC1=O Amb24561641 [0,1,0,1,0,0|2,0,0]=4 8998 B9R1.69 C[C@H]1CC(=O)CC[C@H]1C Amb25363978 [0,1,0,1,0,0|1,0,0]=3 8999 B9R1.69 C[C@H]1CC(=O)NC[C@H]1O Amb28365998 [0,1,0,1,0,0|2,0,0]=4 9000 B9R1.69 C[C@H]1CCC(=O)C[C@@H]1C Amb26440377 [0,1,0,1,0,0|1,0,0]=3 9001 B9R1.69 C[C@H]1CCC(=O)C[C@H]1C Amb26910681 [0,1,0,1,0,0|1,0,0]=3 9002 B9R1.69 C[C@H]1CCC(=O)[C@H](Cl)C1 Amb27778268 [0,1,0,1,0,0|1,0,0]=3 9003 B9R1.69 C[C@H]1CC[C@@H](C)C[C@@H]1O Amb27221189 [0,1,0,1,0,0|1,0,1]=4 9004 B9R1.69 C[C@H]1CC[C@@H](C)C[C@H]1O Amb27848128 [0,1,0,1,0,0|1,0,1]=4 9005 B9R1.69 C[C@H]1CC[C@@H](O)C[C@@H]1C Amb27452456 [0,1,0,1,0,0|1,0,1]=4 9006 B9R1.69 C[C@H]1CC[C@@H](O)C[C@H]1C Amb28247082 [0,1,0,1,0,0|1,0,1]=4 9007 B9R1.69 C[C@H]1CC[C@H](Br)C(=O)C1 Amb23592295 [0,1,0,1,0,0|1,0,1]=4 9008 B9R1.69 C[C@H]1CC[C@H](C)[C@@H](O)C1 Amb27849642 [0,1,0,1,0,0|1,0,1]=4 9009 B9R1.69 C[C@H]1CC[C@H](Cl)C(=O)C1 Amb28245372 [0,1,0,1,0,0|1,0,1]=4 9010 B9R1.69 C[C@H]1CC[C@H](O)CN1C Amb27214298 [0,1,0,1,0,0|1,0,1]=4 9011 B9R1.69 C[C@H]1CC[C@H](O)C[C@H]1C Amb28134680 [0,1,0,1,0,0|1,0,1]=4 9012 B9R1.69 C[C@H]1CN(C)C(=O)CN1 Amb20670247 [0,1,0,1,0,0|2,0,0]=4 9013 B9R1.69 C[C@H]1CN(C)C(=O)CN1 Amb22225454 [0,1,0,1,0,0|2,0,0]=4 9014 B9R1.69 C[C@H]1CN(C)CCC1=O Amb24472489 [0,1,0,1,0,0|2,0,0]=4 9015 B9R1.69 C[C@H]1CNC(=O)O[C@H]1C Amb27492970 [0,1,0,1,0,0|1,0,0]=3 9016 B9R1.69 C[C@H]1CNC(=O)[C@H](C)N1 Amb24602366 [0,1,0,1,0,0|2,0,0]=4 9017 B9R1.69 C[C@H]1CNC(=O)[C@H](C)O1 Amb24629269 [0,1,0,1,0,0|2,0,0]=4 9018 B9R1.69 C[C@H]1COC(=O)C[C@@H]1O Amb27853905 [0,1,0,1,0,0|0,0,0]=2 9019 B9R1.69 C[C@H]1C[C@@H](C)COC1=O Amb27251551 [0,1,0,1,0,0|0,0,0]=2 9020 B9R1.69 C[C@H]1C[C@@H](C)COC1O Amb27441083 [0,1,0,1,0,0|0,0,2]=4 9021 B9R1.69 C[C@H]1C[C@@H](O)CCC1=O Amb28253634 [0,1,0,1,0,0|2,0,0]=4 9022 B9R1.69 C[C@H]1C[C@@H](O)CC[C@H]1C Amb27978914 [0,1,0,1,0,0|1,0,1]=4 9023 B9R1.69 C[C@H]1NC(=O)CC[C@@H]1O Amb28128446 [0,1,0,1,0,0|2,0,0]=4 9024 B9R1.69 NC1CC(O)CCC1=O Amb28430066 [0,1,0,1,0,0|2,0,0]=4 9025 B9R1.69 NC1CC(O)CNC1=O Amb25076949 [0,1,0,1,0,0|2,0,0]=4 9026 B9R1.69 NC1CCC(=O)N(P)C1 Amb25303528 [0,1,0,1,0,0|2,0,0]=4 9027 B9R1.69 NC1CCC(=O)OC1=O Amb27838431 [0,1,0,1,0,0|1,0,1]=4 9028 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22745558 [0,1,0,1,0,0|2,0,0]=4 9029 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22755435 [0,1,0,1,0,0|2,0,0]=4 9030 B9R1.69 N[C@H]1C[C@@H](O)CNC1=O Amb25277394 [0,1,0,1,0,0|2,0,0]=4 9031 B9R1.69 O=C1CCC(Br)C(=O)O1 Amb25680134 [0,1,0,1,0,0|1,0,1]=4 9032 B9R1.69 O=C1CCC(Cl)CC1Cl Amb27237551 [0,1,0,1,0,0|2,0,0]=4 9033 B9R1.69 O=C1CCC(O)CC1O Amb27494789 [0,1,0,1,0,0|1,0,0]=3 9034 B9R1.69 O=C1CCS(=O)CC1O Amb29847922 [0,1,0,1,0,0|2,0,0]=4 9035 B9R1.69 O=C1CC[C@H](Br)C[C@H]1Cl Amb27622141 [0,1,0,1,0,0|2,0,0]=4 9036 B9R1.69 O=C1CC[C@H](Cl)C[C@@H]1Cl Amb27799562 [0,1,0,1,0,0|2,0,0]=4 9037 B9R1.69 O=C1CC[C@H](Cl)C[C@H]1Br Amb27229463 [0,1,0,1,0,0|2,0,0]=4 9038 B9R1.69 O=C1CC[C@H](Cl)C[C@H]1Cl Amb27789880 [0,1,0,1,0,0|2,0,0]=4 9039 B9R1.69 O=C1C[C@H](O)[C@H](O)CN1 Amb24517387 [0,1,0,1,0,0|2,0,0]=4 9040 B9R1.69 O=C1NCC(O)CC1O Amb28247470 [0,1,0,1,0,0|2,0,0]=4 9041 B9R1.69 O=C1NC[C@H](O)C[C@H]1O Amb27460866 [0,1,0,1,0,0|2,0,0]=4 9042 B9R1.78 C#CC(=O)NC1CC1C Amb27617055 [0,1,0,1,0,0|2,0,0]=4 9043 B9R1.78 CC1CC1CC(=O)CN Amb33132711 [0,1,0,1,0,0|1,0,0]=3 9044 B9R1.78 CC1CC1CC(=O)NO Amb27981204 [0,1,0,1,0,0|0,0,0]=2 9045 B9R1.78 CC1CC1CC(N)CO Amb33144903 [0,1,0,1,0,0|1,0,1]=4 9046 B9R1.78 CC1CC1CC(O)CN Amb33144859 [0,1,0,1,0,0|1,0,1]=4 9047 B9R1.78 CC1CC1NC(=O)CCl Amb27865793 [0,1,0,1,0,0|2,0,0]=4 9048 B9R1.78 CC1CC1NC(=O)NN Amb27874903 [0,1,0,1,0,0|2,0,0]=4 9049 B9R1.78 CNC(=O)N[C@@H]1C[C@H]1C Amb27779304 [0,1,0,1,0,0|2,0,0]=4 9050 B9R1.78 C[C@@H]1C[C@H]1NC(=O)CO Amb27944646 [0,1,0,1,0,0|1,0,0]=3 9051 B9R1.80 C#CC(=O)CNC1CC1 Amb25930248 [0,1,0,1,0,0|2,0,0]=4 9052 B9R1.80 C=CC(=O)CCC1CC1 Amb28241113 [0,1,0,1,0,0|1,0,0]=3 9053 B9R1.80 C=CC(=O)CNC1CC1 Amb25369017 [0,1,0,1,0,0|2,0,0]=4 9054 B9R1.80 CC(CBr)CCC1CO1 Amb32688135 [0,1,0,1,0,0|1,0,1]=4 9055 B9R1.80 CC(CCl)CCC1CO1 Amb32688089 [0,1,0,1,0,0|1,0,1]=4 9056 B9R1.80 CC(CO)CCC1CC1 Amb33749212 [0,1,0,1,0,0|1,0,1]=4 9057 B9R1.80 CCC(=O)CNC1CC1 Amb25245788 [0,1,0,1,0,0|2,0,0]=4 9058 B9R1.80 CC[C@H](O)CCC1CC1 Amb27192177 [0,1,0,1,0,0|1,0,1]=4 9059 B9R1.80 CN(C=O)CCC1CC1 Amb27772099 [0,1,0,1,0,0|2,0,0]=4 9060 B9R1.80 CNC(=O)CCC1CC1 Amb27197385 [0,1,0,1,0,0|1,0,0]=3 9061 B9R1.80 COC(=O)C#CC1CC1 Amb1036567 [0,1,0,1,0,0|0,0,2]=4 9062 B9R1.80 COC(=O)CCC1CO1 Amb25377501 [0,1,0,1,0,0|1,0,0]=3 9063 B9R1.80 COC(=O)CNC1CC1 Amb20622332 [0,1,0,1,0,0|1,0,0]=3 9064 B9R1.80 COC(=O)CNC1CC1 Amb6706354 [0,1,0,1,0,0|1,0,0]=3 9065 B9R1.80 COC(=O)CSC1CC1 Amb6760569 [0,1,0,1,0,0|1,0,0]=3 9066 B9R1.80 COC(=O)\C=C\C1CC1 Amb33986066 [0,1,0,1,0,0|0,0,2]=4 9067 B9R1.80 COC(=S)SCC1CC1 Amb27262158 [0,1,0,1,0,0|1,1,0]=4 9068 B9R1.80 CON(C)CCC1CC1 Amb28064552 [0,1,0,1,0,0|2,0,0]=4 9069 B9R1.80 C[C@@H](CO)CCC1CC1 Amb33747154 [0,1,0,1,0,0|1,0,1]=4 9070 B9R1.80 C[C@H](CO)CCC1CC1 Amb33748163 [0,1,0,1,0,0|1,0,1]=4 9071 B9R1.80 NC(CO)CCC1CC1 Amb24715971 [0,1,0,1,0,0|1,0,1]=4 9072 B9R1.80 NCC(=O)CCC1CC1 Amb25245782 [0,1,0,1,0,0|1,0,0]=3 9073 B9R1.80 NCC(=O)CCC1CO1 Amb33307827 [0,1,0,1,0,0|2,0,0]=4 9074 B9R1.80 NCC(=O)CNC1CC1 Amb28130064 [0,1,0,1,0,0|2,0,0]=4 9075 B9R1.80 NCC(=O)NCC1CC1 Amb30585150 [0,1,0,1,0,0|2,0,0]=4 9076 B9R1.80 NCC(=O)NCC1CC1 Amb6271968 [0,1,0,1,0,0|2,0,0]=4 9077 B9R1.80 NCC(=O)OCC1CC1 Amb13952550 [0,1,0,1,0,0|2,0,0]=4 9078 B9R1.80 NCC(=O)OCC1CC1 Amb18305119 [0,1,0,1,0,0|2,0,0]=4 9079 B9R1.80 NCC(O)CCC1CC1 Amb25136180 [0,1,0,1,0,0|1,0,1]=4 9080 B9R1.80 NNC(=O)NCC1CC1 Amb8854046 [0,1,0,1,0,0|2,0,0]=4 9081 B9R1.80 N\C(CCC1CC1)=N/O Amb25848987 [0,1,0,1,0,0|1,0,0]=3 9082 B9R1.80 N\C(CNC1CC1)=N/O Amb26940454 [0,1,0,1,0,0|2,0,0]=4 9083 B9R1.80 N\N=C(/N)CCC1CC1 Amb27192178 [0,1,0,1,0,0|2,0,0]=4 9084 B9R1.80 O=C(CBr)NCC1CC1 Amb22059289 [0,1,0,1,0,0|2,0,0]=4 9085 B9R1.80 O=C(CCC1CC1)NO Amb28248660 [0,1,0,1,0,0|0,0,0]=2 9086 B9R1.80 O=C(CCl)CCC1CC1 Amb27779850 [0,1,0,1,0,0|1,0,0]=3 9087 B9R1.80 O=C(CCl)NCC1CC1 Amb2785974 [0,1,0,1,0,0|2,0,0]=4 9088 B9R1.80 O=C(CCl)OCC1CC1 Amb32416286 [0,1,0,1,0,0|2,0,0]=4 9089 B9R1.80 O=C(CI)NCC1CC1 Amb24660173 [0,1,0,1,0,0|2,0,0]=4 9090 B9R1.80 O=C(CNC1CC1)NO Amb27395406 [0,1,0,1,0,0|1,0,0]=3 9091 B9R1.80 O=C(CO)OCC1CC1 Amb27806245 [0,1,0,1,0,0|1,0,0]=3 9092 B9R1.80 O=C(CS)OCC1CC1 Amb28457833 [0,1,0,1,0,0|1,1,0]=4 9093 B9R1.80 OCC(O)CCC1CC1 Amb27444259 [0,1,0,1,0,0|0,0,2]=4 9094 B9R1.80 O\N=C(/Cl)CCC1CC1 Amb27861367 [0,1,0,1,0,0|1,0,0]=3 9095 B9R1.82 C#CC(=O)C1CC(C)C1 Amb30032163 [0,1,0,1,0,0|1,0,0]=3 9096 B9R1.82 C#CC(=O)C1CC(N)C1 Amb33131646 [0,1,0,1,0,0|2,0,0]=4 9097 B9R1.82 C#CC(O)C1CC(C)C1 Amb35644181 [0,1,0,1,0,0|1,0,1]=4 9098 B9R1.82 C=C1CC(C(=O)OC)C1 Amb21962131 [0,1,0,1,0,0|0,0,2]=4 9099 B9R1.82 C=CC(=O)C1CC(C)C1 Amb30031980 [0,1,0,1,0,0|1,0,0]=3 9100 B9R1.82 C=CC(=O)C1CC(N)C1 Amb33131642 [0,1,0,1,0,0|2,0,0]=4 9101 B9R1.82 C=CC(=O)N1CC(C)C1 Amb35664710 [0,1,0,1,0,0|2,0,0]=4 9102 B9R1.82 C=CC(O)C1CC(C)C1 Amb35644182 [0,1,0,1,0,0|1,0,1]=4 9103 B9R1.82 C=C[C@@H](C)[C@@H]1CC(=O)N1 Amb27655563 [0,1,0,1,0,0|1,0,1]=4 9104 B9R1.82 CC(CO)C1CC(=O)O1 Amb28315511 [0,1,0,1,0,0|0,0,0]=2 9105 B9R1.82 CC1CC(C(=N)NO)C1 Amb33033622 [0,1,0,1,0,0|1,0,0]=3 9106 B9R1.82 CC1CC(C(=O)CBr)C1 Amb29885059 [0,1,0,1,0,0|1,0,0]=3 9107 B9R1.82 CC1CC(C(=O)CCl)C1 Amb29886995 [0,1,0,1,0,0|1,0,0]=3 9108 B9R1.82 CC1CC(C(=O)CN)C1 Amb30032039 [0,1,0,1,0,0|1,0,0]=3 9109 B9R1.82 CC1CC(C(=O)NO)C1 Amb27203488 [0,1,0,1,0,0|0,0,0]=2 9110 B9R1.82 CC1CC(C(O)CN)C1 Amb33512561 [0,1,0,1,0,0|1,0,1]=4 9111 B9R1.82 CC1CC(\C(N)=N\N)C1 Amb29885195 [0,1,0,1,0,0|2,0,0]=4 9112 B9R1.82 CC1CN(C(=O)CCl)C1 Amb27636123 [0,1,0,1,0,0|2,0,0]=4 9113 B9R1.82 CC1CN(C(=O)CN)C1 Amb30037688 [0,1,0,1,0,0|2,0,0]=4 9114 B9R1.82 CC1CN(C(=O)CS)C1 Amb29892053 [0,1,0,1,0,0|1,1,0]=4 9115 B9R1.82 CC1CN(C(=O)NN)C1 Amb35667978 [0,1,0,1,0,0|2,0,0]=4 9116 B9R1.82 CC1CN(\C(N)=N\O)C1 Amb30022589 [0,1,0,1,0,0|2,0,0]=4 9117 B9R1.82 CCC(=O)C1CC(C)C1 Amb23589656 [0,1,0,1,0,0|1,0,0]=3 9118 B9R1.82 CCC(=O)C1CC(N)C1 Amb33131647 [0,1,0,1,0,0|2,0,0]=4 9119 B9R1.82 CCC(Br)C1CC(=O)O1 Amb27636202 [0,1,0,1,0,0|1,0,0]=3 9120 B9R1.82 CCC(C)C1CC(=O)N1 Amb27780586 [0,1,0,1,0,0|1,0,0]=3 9121 B9R1.82 CNC(=O)C1CC(O)C1 Amb19888985 [0,1,0,1,0,0|2,0,0]=4 9122 B9R1.82 CNC(=O)C1CN(C)C1 Amb27432445 [0,1,0,1,0,0|2,0,0]=4 9123 B9R1.82 CNC(=O)N1CC(C)C1 Amb35659570 [0,1,0,1,0,0|2,0,0]=4 9124 B9R1.82 CNC(=O)[C@H]1C[C@@H](N)C1 Amb27966745 [0,1,0,1,0,0|2,0,0]=4 9125 B9R1.82 COC(=O)C1CC(=O)C1 Amb17597687 [0,1,0,1,0,0|1,0,1]=4 9126 B9R1.82 COC(=O)C1CC(Br)C1 Amb23439345 [0,1,0,1,0,0|1,0,0]=3 9127 B9R1.82 COC(=O)C1CC(C)C1 Amb25771219 [0,1,0,1,0,0|0,0,0]=2 9128 B9R1.82 COC(=O)C1CC(C)N1 Amb33743739 [0,1,0,1,0,0|1,0,0]=3 9129 B9R1.82 COC(=O)C1CC(C)N1 Amb33743758 [0,1,0,1,0,0|1,0,0]=3 9130 B9R1.82 COC(=O)C1CC(C)O1 Amb22737249 [0,1,0,1,0,0|1,0,0]=3 9131 B9R1.82 COC(=O)C1CC(Cl)C1 Amb21962427 [0,1,0,1,0,0|1,0,0]=3 9132 B9R1.82 COC(=O)C1CC(F)C1 Amb24480349 [0,1,0,1,0,0|1,0,0]=3 9133 B9R1.82 COC(=O)C1CC(N)C1 Amb20622659 [0,1,0,1,0,0|1,0,0]=3 9134 B9R1.82 COC(=O)C1CC(N)C1 Amb21963494 [0,1,0,1,0,0|1,0,0]=3 9135 B9R1.82 COC(=O)C1CC(O)C1 Amb19516177 [0,1,0,1,0,0|1,0,0]=3 9136 B9R1.82 COC(=O)N1CC(F)C1 Amb24476710 [0,1,0,1,0,0|2,0,0]=4 9137 B9R1.82 COC(=O)N1CC(N)C1 Amb20668343 [0,1,0,1,0,0|2,0,0]=4 9138 B9R1.82 COC(=O)N1CC(N)C1 Amb33506233 [0,1,0,1,0,0|2,0,0]=4 9139 B9R1.82 COC(=O)N1CC(O)C1 Amb24056451 [0,1,0,1,0,0|2,0,0]=4 9140 B9R1.82 COC(=O)[C@@H]1C[C@@H](C)O1 Amb24056487 [0,1,0,1,0,0|1,0,0]=3 9141 B9R1.82 COC(=O)[C@@H]1C[C@H](C)O1 Amb26885653 [0,1,0,1,0,0|1,0,0]=3 9142 B9R1.82 COC(=O)[C@H]1C[C@@H](Br)C1 Amb24361749 [0,1,0,1,0,0|1,0,0]=3 9143 B9R1.82 COC(=O)[C@H]1C[C@@H](Cl)C1 Amb25032105 [0,1,0,1,0,0|1,0,0]=3 9144 B9R1.82 COC(=O)[C@H]1C[C@@H](F)C1 Amb34152215 [0,1,0,1,0,0|1,0,0]=3 9145 B9R1.82 COC(=O)[C@H]1C[C@@H](N)C1 Amb22757971 [0,1,0,1,0,0|1,0,0]=3 9146 B9R1.82 COC(=O)[C@H]1C[C@@H](N)C1 Amb7970127 [0,1,0,1,0,0|1,0,0]=3 9147 B9R1.82 COC(=O)[C@H]1C[C@@H](O)C1 Amb22754751 [0,1,0,1,0,0|1,0,0]=3 9148 B9R1.82 COC(=O)[C@H]1C[C@H](Br)C1 Amb23439405 [0,1,0,1,0,0|1,0,0]=3 9149 B9R1.82 COC(=O)[C@H]1C[C@H](F)C1 Amb25870416 [0,1,0,1,0,0|1,0,0]=3 9150 B9R1.82 COC(=O)[C@H]1C[C@H](N)C1 Amb19148540 [0,1,0,1,0,0|1,0,0]=3 9151 B9R1.82 COC(=O)[C@H]1C[C@H](N)C1 Amb22747954 [0,1,0,1,0,0|1,0,0]=3 9152 B9R1.82 COC(=O)[C@H]1C[C@H](O)C1 Amb22746996 [0,1,0,1,0,0|1,0,0]=3 9153 B9R1.82 COC(C)C1CC(=O)N1 Amb28320401 [0,1,0,1,0,0|1,0,0]=3 9154 B9R1.82 C[C@@H](C=O)C1CC(=O)N1 Amb28184488 [0,1,0,1,0,0|1,0,1]=4 9155 B9R1.82 C[C@@H](CO)[C@@H]1CC(=O)N1 Amb28059566 [0,1,0,1,0,0|1,0,0]=3 9156 B9R1.82 NC1CC(C(=O)NO)C1 Amb29885636 [0,1,0,1,0,0|1,0,0]=3 9157 B9R1.82 NNC(=O)C1CC(N)C1 Amb29885782 [0,1,0,1,0,0|2,0,0]=4 9158 B9R1.82 NNC(=O)[C@H]1C[C@@H](N)C1 Amb29888129 [0,1,0,1,0,0|2,0,0]=4 9159 B9R1.82 NNC(=O)[C@H]1C[C@H](N)C1 Amb35585940 [0,1,0,1,0,0|2,0,0]=4 9160 B9R1.82 N[C@H]1C[C@@H](C(=O)NO)C1 Amb35594492 [0,1,0,1,0,0|1,0,0]=3 9161 B9R1.82 N[C@H]1C[C@H](C(=O)NO)C1 Amb35585941 [0,1,0,1,0,0|1,0,0]=3 9162 B9R1.82 N\C(=N/O)[C@H]1C[C@H](Cl)C1 Amb35750948 [0,1,0,1,0,0|2,0,0]=4 9163 B9R1.82 O=C(CO)N1CC(F)C1 Amb28256581 [0,1,0,1,0,0|2,0,0]=4 9164 B9R1.82 O=C1CC(C(=O)NO)C1 Amb27163827 [0,1,0,1,0,0|1,0,1]=4 9165 B9R1.84 CC(=O)CCC1CCC1 Amb24534447 [0,1,0,1,0,0|1,0,0]=3 9166 B9R1.84 CC(=O)CCC1CNC1 Amb33307594 [0,1,0,1,0,0|1,0,0]=3 9167 B9R1.84 CC(=O)CCC1COC1 Amb27670151 [0,1,0,1,0,0|1,0,0]=3 9168 B9R1.84 CC(=O)COC1CNC1 Amb27634342 [0,1,0,1,0,0|2,0,0]=4 9169 B9R1.84 CC(=O)NCC1CNC1 Amb28289479 [0,1,0,1,0,0|2,0,0]=4 9170 B9R1.84 CC(=O)NCC1CNC1 Amb33839583 [0,1,0,1,0,0|2,0,0]=4 9171 B9R1.84 CC(=O)NCC1CSC1 Amb35635237 [0,1,0,1,0,0|2,0,0]=4 9172 B9R1.84 CC(=O)OCC1CCC1 Amb27980327 [0,1,0,1,0,0|2,0,0]=4 9173 B9R1.84 CC(O)CCC1CCC1 Amb27146306 [0,1,0,1,0,0|1,0,1]=4 9174 B9R1.84 CC(O)CCC1COC1 Amb27795130 [0,1,0,1,0,0|1,0,1]=4 9175 B9R1.84 C[C@@H](O)CCC1CCC1 Amb33314114 [0,1,0,1,0,0|1,0,1]=4 9176 B9R1.84 C[C@H](O)CCC1CCC1 Amb33195478 [0,1,0,1,0,0|1,0,1]=4 9177 B9R1.84 NC(=O)CCC1CCC1 Amb27196680 [0,1,0,1,0,0|1,0,0]=3 9178 B9R1.84 NC(=O)CNC1CCC1 Amb18989288 [0,1,0,1,0,0|2,0,0]=4 9179 B9R1.84 NC(=O)CNC1CNC1 Amb27394146 [0,1,0,1,0,0|2,0,0]=4 9180 B9R1.84 NC(=O)CNC1COC1 Amb27837511 [0,1,0,1,0,0|2,0,0]=4 9181 B9R1.84 NC(=O)CNC1CSC1 Amb27837658 [0,1,0,1,0,0|2,0,0]=4 9182 B9R1.84 NC(=O)COC1CNC1 Amb20623915 [0,1,0,1,0,0|2,0,0]=4 9183 B9R1.84 NC(=O)COC1CNC1 Amb22059197 [0,1,0,1,0,0|2,0,0]=4 9184 B9R1.84 NC(=O)COC1CNC1 Amb30585161 [0,1,0,1,0,0|2,0,0]=4 9185 B9R1.84 NC(=O)NCC1CCN1 Amb28052840 [0,1,0,1,0,0|2,0,0]=4 9186 B9R1.84 NC(=O)NCC1CSC1 Amb30037012 [0,1,0,1,0,0|2,0,0]=4 9187 B9R1.84 NS(=O)CCC1CCC1 Amb32720704 [0,1,0,1,0,0|2,0,0]=4 9188 B9R1.84 O=C(Cl)NCC1CCC1 Amb35625731 [0,1,0,1,0,0|2,0,0]=4 9189 B9R1.84 O=C(Cl)NCC1CSC1 Amb35633440 [0,1,0,1,0,0|2,0,0]=4 9190 B9R1.84 O=C(Cl)OCC1CCC1 Amb24551352 [0,1,0,1,0,0|2,0,0]=4 9191 B9R1.84 O=C(Cl)OCC1COC1 Amb33297065 [0,1,0,1,0,0|2,0,0]=4 9192 B9R1.84 O=C(O)C#CC1CCC1 Amb26413119 [0,1,0,1,0,0|0,0,2]=4 9193 B9R1.84 O=C(O)C#CC1CCN1 Amb33168952 [0,1,0,1,0,0|0,0,2]=4 9194 B9R1.84 O=C(O)C#CC1CNC1 Amb32656048 [0,1,0,1,0,0|0,0,2]=4 9195 B9R1.84 O=C(O)C#CC1CNC1 Amb33299377 [0,1,0,1,0,0|0,0,2]=4 9196 B9R1.84 O=C(O)C#CC1COC1 Amb33169027 [0,1,0,1,0,0|0,0,2]=4 9197 B9R1.84 O=C(O)CCC1CCC1 Amb8011305 [0,1,0,1,0,0|0,0,0]=2 9198 B9R1.84 O=C(O)CCC1CCO1 Amb28280741 [0,1,0,1,0,0|0,0,0]=2 9199 B9R1.84 O=C(O)CCN1CCC1 Amb22292346 [0,1,0,1,0,0|1,0,0]=3 9200 B9R1.84 O=C(O)CC[C@@H]1CCN1 Amb27439305 [0,1,0,1,0,0|0,0,0]=2 9201 B9R1.84 O=C(O)CN=C1CCC1 Amb28121224 [0,1,0,1,0,0|1,0,1]=4 9202 B9R1.84 O=C(O)CNC1CCC1 Amb18982434 [0,1,0,1,0,0|1,0,0]=3 9203 B9R1.84 O=C(O)CNC1COC1 Amb22737320 [0,1,0,1,0,0|1,0,0]=3 9204 B9R1.84 O=C(O)CNC1CSC1 Amb27186145 [0,1,0,1,0,0|1,0,0]=3 9205 B9R1.84 O=C(O)COC1CCC1 Amb18295877 [0,1,0,1,0,0|1,0,0]=3 9206 B9R1.84 O=C(O)COC1CNC1 Amb24454311 [0,1,0,1,0,0|1,0,0]=3 9207 B9R1.84 O=C(O)COC1CNC1 Amb28555348 [0,1,0,1,0,0|1,0,0]=3 9208 B9R1.84 O=C(O)COC1CNC1 Amb32665028 [0,1,0,1,0,0|1,0,0]=3 9209 B9R1.84 O=C(O)COC1COC1 Amb24539538 [0,1,0,1,0,0|1,0,0]=3 9210 B9R1.84 O=C(O)CSC1COC1 Amb27589904 [0,1,0,1,0,0|1,0,0]=3 9211 B9R1.84 O=C(O)\C=C\C1CCC1 Amb20624021 [0,1,0,1,0,0|0,0,2]=4 9212 B9R1.84 O=C([O-])CCC1CCO1 Amb32663662 [0,1,0,1,0,0|0,0,1]=3 9213 B9R1.84 O=C([O-])COC1COC1 Amb33744117 [0,1,0,1,0,0|1,0,1]=4 9214 B9R1.84 O=S(Cl)CCC1CCC1 Amb25179912 [0,1,0,1,0,0|2,0,0]=4 9215 B9R1.84 O=S([O-])CCC1CCC1 Amb26425804 [0,1,0,1,0,0|1,0,1]=4 9216 B9R1.84 O=[N+]([O-])CCC1CCC1 Amb15692934 [0,1,0,1,0,0|1,0,1]=4 9217 B9R1.86 CC(C)CC1OC1C=O Amb27838606 [0,1,0,1,0,0|0,0,1]=3 9218 B9R1.86 CC(C)CC1OC1CO Amb25885601 [0,1,0,1,0,0|0,0,2]=4 9219 B9R1.86 CC(C)C[C@@H]1O[C@@H]1CO Amb27651703 [0,1,0,1,0,0|0,0,2]=4 9220 B9R1.86 CCC1CC1CC(=O)O Amb27249848 [0,1,0,1,0,0|0,0,0]=2 9221 B9R1.86 CCC1CC1NC(=O)Cl Amb35633240 [0,1,0,1,0,0|2,0,0]=4 9222 B9R1.86 CC[C@@H]1C[C@H]1NC(C)=O Amb28190147 [0,1,0,1,0,0|2,0,0]=4 9223 B9R1.86 CC[C@@H]1C[C@H]1NC(N)=O Amb28455899 [0,1,0,1,0,0|2,0,0]=4 9224 B9R1.86 NC(=O)NC1CC1CO Amb27424914 [0,1,0,1,0,0|2,0,0]=4 9225 B9R1.86 NC(=O)N[C@@H]1C[C@H]1CO Amb27231937 [0,1,0,1,0,0|2,0,0]=4 9226 B9R1.86 O=C(O)CC1CC1CF Amb27237859 [0,1,0,1,0,0|0,0,0]=2 9227 B9R1.95 C#CC1CC(C(=O)O)C1 Amb27168169 [0,1,0,1,0,0|0,0,1]=3 9228 B9R1.95 C#CC1CC(C(C)=O)C1 Amb27669434 [0,1,0,1,0,0|1,0,1]=4 9229 B9R1.95 C#C[C@H]1C[C@@H](C(C)=O)C1 Amb27211903 [0,1,0,1,0,0|1,0,1]=4 9230 B9R1.95 CC(=O)C1CC(C=O)C1 Amb32669290 [0,1,0,1,0,0|1,0,1]=4 9231 B9R1.95 CC(=O)N1CC(CBr)C1 Amb27813085 [0,1,0,1,0,0|2,0,0]=4 9232 B9R1.95 CC(=O)N1CC(CN)C1 Amb28436806 [0,1,0,1,0,0|2,0,0]=4 9233 B9R1.95 CC(=O)N1CC(CN)C1 Amb33463045 [0,1,0,1,0,0|2,0,0]=4 9234 B9R1.95 CC(=O)N1CC(CO)C1 Amb26549681 [0,1,0,1,0,0|2,0,0]=4 9235 B9R1.95 CC(C)C1CC(C=O)C1 Amb26516211 [0,1,0,1,0,0|1,0,1]=4 9236 B9R1.95 CC(C)C1CC(CO)C1 Amb22497609 [0,1,0,1,0,0|1,0,1]=4 9237 B9R1.95 CCC1CC(C(=O)Cl)C1 Amb25791521 [0,1,0,1,0,0|1,0,0]=3 9238 B9R1.95 CCC1CC(C(=O)O)C1 Amb23456004 [0,1,0,1,0,0|0,0,0]=2 9239 B9R1.95 CCC1CN(C(=O)Cl)C1 Amb35667759 [0,1,0,1,0,0|2,0,0]=4 9240 B9R1.95 CCC1CN(C(C)=O)C1 Amb35645756 [0,1,0,1,0,0|2,0,0]=4 9241 B9R1.95 CCC1CN(C(N)=O)C1 Amb30039311 [0,1,0,1,0,0|2,0,0]=4 9242 B9R1.95 CCN1CC(C(=O)O)C1 Amb24117130 [0,1,0,1,0,0|1,0,0]=3 9243 B9R1.95 CC[C@H]1C[C@@H](C(N)=O)C1 Amb27168704 [0,1,0,1,0,0|1,0,0]=3 9244 B9R1.95 CNC1CC(C(=O)O)C1 Amb20622656 [0,1,0,1,0,0|0,0,0]=2 9245 B9R1.95 CNC1CC(C(=O)O)C1 Amb32668940 [0,1,0,1,0,0|0,0,0]=2 9246 B9R1.95 CNC1CC(C(C)=O)C1 Amb30032621 [0,1,0,1,0,0|1,0,0]=3 9247 B9R1.95 CNC1CC(C(C)O)C1 Amb35740813 [0,1,0,1,0,0|1,0,1]=4 9248 B9R1.95 CNC1CC(C(N)=O)C1 Amb32670672 [0,1,0,1,0,0|1,0,0]=3 9249 B9R1.95 CNC1CC(C(N)=O)C1 Amb32670673 [0,1,0,1,0,0|1,0,0]=3 9250 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb28903920 [0,1,0,1,0,0|0,0,0]=2 9251 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb32667482 [0,1,0,1,0,0|0,0,0]=2 9252 B9R1.95 CN[C@H]1C[C@@H](C(N)=O)C1 Amb32670695 [0,1,0,1,0,0|1,0,0]=3 9253 B9R1.95 CN[C@H]1C[C@@H](C(N)=O)C1 Amb32670696 [0,1,0,1,0,0|1,0,0]=3 9254 B9R1.95 COC1CC(C(=O)O)C1 Amb8011538 [0,1,0,1,0,0|0,0,0]=2 9255 B9R1.95 COC1CC(C(C)=O)C1 Amb24595933 [0,1,0,1,0,0|1,0,0]=3 9256 B9R1.95 COC1CN(C(=O)Cl)C1 Amb32863915 [0,1,0,1,0,0|2,0,0]=4 9257 B9R1.95 COC1CN(C(N)=O)C1 Amb27656454 [0,1,0,1,0,0|2,0,0]=4 9258 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 Amb23440276 [0,1,0,1,0,0|0,0,0]=2 9259 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 Amb23440277 [0,1,0,1,0,0|0,0,0]=2 9260 B9R1.95 N#CC1CC(C(=O)O)C1 Amb26049887 [0,1,0,1,0,0|0,0,1]=3 9261 B9R1.95 N#CN1CC(C(=O)O)C1 Amb35634495 [0,1,0,1,0,0|1,0,1]=4 9262 B9R1.95 NC(O)C1CC(CO)C1 Amb28285108 [0,1,0,1,0,0|1,0,1]=4 9263 B9R1.95 NCC1CC(C(=O)O)C1 Amb26631130 [0,1,0,1,0,0|0,0,0]=2 9264 B9R1.95 NCC1CC(C(=O)O)C1 Amb31307793 [0,1,0,1,0,0|0,0,0]=2 9265 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34136858 [0,1,0,1,0,0|0,0,0]=2 9266 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34148892 [0,1,0,1,0,0|0,0,0]=2 9267 B9R1.95 NC[C@H]1C[C@H](C(=O)O)C1 Amb33715808 [0,1,0,1,0,0|0,0,0]=2 9268 B9R1.95 NN=C1CC(C(=O)O)C1 Amb23570285 [0,1,0,1,0,0|1,0,1]=4 9269 B9R1.95 O=C(O)C1CC(CBr)C1 Amb19958667 [0,1,0,1,0,0|0,0,0]=2 9270 B9R1.95 O=C(O)C1CC(CF)C1 Amb27186059 [0,1,0,1,0,0|0,0,0]=2 9271 B9R1.95 O=C(O)C1CC(CO)C1 Amb22002175 [0,1,0,1,0,0|0,0,0]=2 9272 B9R1.95 O=C(O)[C@H]1C[C@H](CO)C1 Amb34162163 [0,1,0,1,0,0|0,0,0]=2 9273 B9R1.95 O=C[C@H]1C[C@@H](C(=O)O)C1 Amb33309677 [0,1,0,1,0,0|0,0,1]=3 9274 B9R1.95 OCC1CC(B(O)O)C1 Amb27791655 [0,1,0,1,0,0|1,0,1]=4 9275 B9R1.121 CC1(C)CCC1(C)CO Amb27185732 [0,1,0,1,0,0|1,0,1]=4 9276 B9R1.121 CC1(C)CCC1(O)CN Amb28122578 [0,1,0,1,0,0|1,0,1]=4 9277 B9R1.125 C=C1CCC(C)(CO)C1 Amb28138620 [0,1,0,1,0,0|2,0,0]=4 9278 B9R1.125 C=C1COC(C)(CO)O1 Amb27602471 [0,1,0,1,0,0|2,0,0]=4 9279 B9R1.125 C=CC1(C)CCC(=O)O1 Amb29849361 [0,1,0,1,0,0|0,0,1]=3 9280 B9R1.125 CC1(C#N)CCC(=O)C1 Amb24722939 [0,1,0,1,0,0|1,0,1]=4 9281 B9R1.125 CC1(C#N)CCC(=O)N1 Amb10608311 [0,1,0,1,0,0|1,0,1]=4 9282 B9R1.125 CC1(C=O)CCC(=O)C1 Amb28285173 [0,1,0,1,0,0|1,0,1]=4 9283 B9R1.125 CC1(C=O)CCC(=O)N1 Amb28364896 [0,1,0,1,0,0|1,0,1]=4 9284 B9R1.125 CC1(C=O)CCC(=O)O1 Amb28348513 [0,1,0,1,0,0|0,0,1]=3 9285 B9R1.125 CC1(CBr)CNC(=O)C1 Amb32666888 [0,1,0,1,0,0|2,0,0]=4 9286 B9R1.125 CC1(CBr)CNC(=O)O1 Amb24753177 [0,1,0,1,0,0|1,0,0]=3 9287 B9R1.125 CC1(CBr)COC(=O)N1 Amb32656363 [0,1,0,1,0,0|2,0,0]=4 9288 B9R1.125 CC1(CN)CCC(=O)N1 Amb25253003 [0,1,0,1,0,0|1,0,0]=3 9289 B9R1.125 CC1(CN)CCC(=O)N1 Amb28935017 [0,1,0,1,0,0|1,0,0]=3 9290 B9R1.125 CC1(CN)CCC(=O)O1 Amb27815595 [0,1,0,1,0,0|0,0,0]=2 9291 B9R1.125 CC1(CN)CNC(=O)C1 Amb24677517 [0,1,0,1,0,0|2,0,0]=4 9292 B9R1.125 CC1(CN)COC(=O)N1 Amb32676828 [0,1,0,1,0,0|2,0,0]=4 9293 B9R1.125 CC1(CN)COC(=O)N1 Amb32676829 [0,1,0,1,0,0|2,0,0]=4 9294 B9R1.125 CC1(CO)CCC(=O)N1 Amb25796503 [0,1,0,1,0,0|1,0,0]=3 9295 B9R1.125 CC1(CO)CNC(=O)C1 Amb22546426 [0,1,0,1,0,0|2,0,0]=4 9296 B9R1.125 CC1(CO)COC(=O)C1 Amb24748377 [0,1,0,1,0,0|2,0,0]=4 9297 B9R1.125 CC1(CO)COC(=O)N1 Amb4018739 [0,1,0,1,0,0|2,0,0]=4 9298 B9R1.125 CC1(CO)CSC(=O)C1 Amb27594628 [0,1,0,1,0,0|2,0,0]=4 9299 B9R1.125 CC1CCC(C)(C=O)C1 Amb23454036 [0,1,0,1,0,0|1,0,1]=4 9300 B9R1.125 CC1CCC(C)(CBr)O1 Amb27956518 [0,1,0,1,0,0|1,0,1]=4 9301 B9R1.125 CC1CCC(C)(CI)O1 Amb27752199 [0,1,0,1,0,0|1,0,1]=4 9302 B9R1.125 CC1CCC(C)(CO)O1 Amb27202221 [0,1,0,1,0,0|1,0,1]=4 9303 B9R1.125 CC1CCC(N)(CO)C1 Amb27600606 [0,1,0,1,0,0|1,0,1]=4 9304 B9R1.125 CC1CCC(O)(C#N)C1 Amb28288710 [0,1,0,1,0,0|1,0,1]=4 9305 B9R1.125 CC1CCC(O)(CN)C1 Amb27788631 [0,1,0,1,0,0|1,0,1]=4 9306 B9R1.125 CCC1(C)CC(=O)CO1 Amb27803429 [0,1,0,1,0,0|2,0,0]=4 9307 B9R1.125 CCC1(C)CN=C(N)O1 Amb28366764 [0,1,0,1,0,0|2,0,0]=4 9308 B9R1.125 CCC1(C)CNC(=O)C1 Amb24655544 [0,1,0,1,0,0|2,0,0]=4 9309 B9R1.125 CCC1(C)CSC(=O)C1 Amb26406975 [0,1,0,1,0,0|2,0,0]=4 9310 B9R1.125 CCC1(C)NCC(=O)N1 Amb27196981 [0,1,0,1,0,0|2,0,0]=4 9311 B9R1.125 CCC1(O)CCC(C)C1 Amb25132617 [0,1,0,1,0,0|1,0,1]=4 9312 B9R1.125 CC[C@]1(C)CCC(=O)C1 Amb27838732 [0,1,0,1,0,0|1,0,0]=3 9313 B9R1.125 C[C@@H]1CCC(Cl)(CO)C1 Amb28049123 [0,1,0,1,0,0|1,0,1]=4 9314 B9R1.125 C[C@@H]1CC[C@@](C)(CO)C1 Amb27457811 [0,1,0,1,0,0|1,0,1]=4 9315 B9R1.125 C[C@@]1(C=O)CCC(=O)C1 Amb27798280 [0,1,0,1,0,0|1,0,1]=4 9316 B9R1.125 C[C@@]1(CCl)CNC(=O)O1 Amb27229268 [0,1,0,1,0,0|1,0,0]=3 9317 B9R1.125 C[C@]1(CO)COC(=O)N1 Amb28194228 [0,1,0,1,0,0|2,0,0]=4 9318 B9R1.127 C#CC1(C)CC1C(=O)O Amb4041187 [0,1,0,1,0,0|0,0,1]=3 9319 B9R1.127 C=CC1(C)CC1C(C)=O Amb27948651 [0,1,0,1,0,0|1,0,1]=4 9320 B9R1.127 CC(=O)C1OC1(C)CCl Amb24670937 [0,1,0,1,0,0|2,0,0]=4 9321 B9R1.127 CC(C)C1CC1(N)CO Amb24638729 [0,1,0,1,0,0|1,0,1]=4 9322 B9R1.127 CC1(CN)CC1C(=O)O Amb27481579 [0,1,0,1,0,0|0,0,0]=2 9323 B9R1.127 CCC1(C)CC1C(=O)O Amb18285802 [0,1,0,1,0,0|0,0,0]=2 9324 B9R1.133 CC1(C)CCC(C=O)O1 Amb26575148 [0,1,0,1,0,0|0,0,1]=3 9325 B9R1.133 CC1(C)CCC(CBr)O1 Amb25108584 [0,1,0,1,0,0|1,0,1]=4 9326 B9R1.133 CC1(C)CCC(CN)O1 Amb26637570 [0,1,0,1,0,0|1,0,1]=4 9327 B9R1.133 CC1(C)CCC(CN)O1 Amb33109857 [0,1,0,1,0,0|1,0,1]=4 9328 B9R1.133 CC1(C)CCC(CO)C1 Amb27185557 [0,1,0,1,0,0|1,0,1]=4 9329 B9R1.133 CC1(C)CCC(CO)N1 Amb24400098 [0,1,0,1,0,0|1,0,1]=4 9330 B9R1.133 CC1(C)CCC(CO)O1 Amb26648132 [0,1,0,1,0,0|0,0,2]=4 9331 B9R1.133 CC1(C)CC[C@@H](CN)O1 Amb27467890 [0,1,0,1,0,0|1,0,1]=4 9332 B9R1.133 CC1(C)CC[C@@H](CO)O1 Amb22886789 [0,1,0,1,0,0|0,0,2]=4 9333 B9R1.133 CC1(C)CN=C(CCl)O1 Amb33802643 [0,1,0,1,0,0|2,0,0]=4 9334 B9R1.133 CC1(C)CN\C(=N/O)S1 Amb25912071 [0,1,0,1,0,0|1,1,0]=4 9335 B9R1.133 CC1(C)COC(CO)=N1 Amb28125776 [0,1,0,1,0,0|2,0,0]=4 9336 B9R1.133 CC1(C)C\C(=N\O)CO1 Amb28130918 [0,1,0,1,0,0|2,0,0]=4 9337 B9R1.133 CC1(C)NCC(C=O)O1 Amb27619812 [0,1,0,1,0,0|1,0,1]=4 9338 B9R1.133 CC1(C)OCC(C=O)O1 Amb9785152 [0,1,0,1,0,0|1,0,1]=4 9339 B9R1.133 CC1(C)OC[C@@H](C=O)O1 Amb8384061 [0,1,0,1,0,0|1,0,1]=4 9340 B9R1.133 CC1(C)OC[C@H](C=O)O1 Amb6308308 [0,1,0,1,0,0|1,0,1]=4 9341 B9R1.133 CNC1CCS(=N)(=O)C1 Amb32671202 [0,1,0,1,0,0|2,0,0]=4 9342 B9R1.133 CNC1CCS(=N)(=O)C1 Amb32927015 [0,1,0,1,0,0|2,0,0]=4 9343 B9R1.133 CNC1CCS(=O)(=O)C1 Amb1290363 [0,1,0,1,0,0|1,0,1]=4 9344 B9R1.133 CNC1CCS(=O)(=O)C1 Amb5716905 [0,1,0,1,0,0|1,0,1]=4 9345 B9R1.133 COC1=NCC(C)(C)C1 Amb33218444 [0,1,0,1,0,0|2,0,0]=4 9346 B9R1.133 COC1CCS(=O)(=O)C1 Amb2793199 [0,1,0,1,0,0|1,0,1]=4 9347 B9R1.133 C[NH2+]C1CCS(=O)(=O)C1 Amb3318766 [0,1,0,1,0,0|1,0,1]=4 9348 B9R1.133 C[NH2+]C1CCS(=O)(=O)C1 Amb5716909 [0,1,0,1,0,0|1,0,1]=4 9349 B9R1.133 NCC1CCS(=O)(=O)C1 Amb19204939 [0,1,0,1,0,0|1,0,1]=4 9350 B9R1.133 NCC1CCS(=O)(=O)C1 Amb2793200 [0,1,0,1,0,0|1,0,1]=4 9351 B9R1.133 O=P1(O)CC(CO)CO1 Amb27588943 [0,1,0,1,0,0|2,0,0]=4 9352 B9R1.133 O=P1(O)CCC(CO)C1 Amb27853831 [0,1,0,1,0,0|1,0,0]=3 9353 B9R1.133 O=S1(=O)CCC(CBr)C1 Amb25321623 [0,1,0,1,0,0|1,0,1]=4 9354 B9R1.133 O=S1(=O)CCC(CCl)C1 Amb9751094 [0,1,0,1,0,0|1,0,1]=4 9355 B9R1.133 O=S1(=O)CCC(CO)C1 Amb2548453 [0,1,0,1,0,0|1,0,1]=4 9356 B9R1.133 O=S1(=O)CCC(CS)C1 Amb18062508 [0,1,0,1,0,0|1,0,1]=4 9357 B9R1.133 [NH3+]CC1CCS(=O)(=O)C1 Amb5716911 [0,1,0,1,0,0|1,0,1]=4 9358 B9R1.138 C=C1CCC(C)(C)C1=O Amb27785076 [0,1,0,1,0,0|1,0,0]=3 9359 B9R1.138 CC1(C)CC=C(Br)C1O Amb27841903 [0,1,0,1,0,0|1,0,1]=4 9360 B9R1.138 CC1(C)CCC(=O)C1=O Amb27838751 [0,1,0,1,0,0|0,0,1]=3 9361 B9R1.138 CC1(C)CCC(=S)N1O Amb27861093 [0,1,0,1,0,0|0,1,0]=3 9362 B9R1.138 CC1(C)CCC(Br)C1=O Amb25306183 [0,1,0,1,0,0|1,0,1]=4 9363 B9R1.138 CC1(C)CCC(Cl)C1=O Amb28285286 [0,1,0,1,0,0|1,0,1]=4 9364 B9R1.138 CC1(C)CCC(F)C1=O Amb33496172 [0,1,0,1,0,0|1,0,1]=4 9365 B9R1.138 CC1(C)CCC(F)C1O Amb33496154 [0,1,0,1,0,0|1,0,1]=4 9366 B9R1.138 CC1(C)CCC(O)C1O Amb35695654 [0,1,0,1,0,0|0,0,2]=4 9367 B9R1.138 CC1(C)CCC(O)N1O Amb27867326 [0,1,0,1,0,0|0,0,2]=4 9368 B9R1.138 CC1(C)CNC(=O)C1=O Amb22295904 [0,1,0,1,0,0|1,0,1]=4 9369 B9R1.138 CC1(C)CNC(=O)C1N Amb25224596 [0,1,0,1,0,0|2,0,0]=4 9370 B9R1.138 CC1(C)CNC(=O)C1O Amb16203297 [0,1,0,1,0,0|1,0,0]=3 9371 B9R1.138 CC1(C)COC(=O)C1=O Amb3941520 [0,1,0,1,0,0|1,0,1]=4 9372 B9R1.138 CC1(C)COC(=O)C1Cl Amb27477382 [0,1,0,1,0,0|2,0,0]=4 9373 B9R1.138 CC1(C)COC(=O)C1N Amb18642696 [0,1,0,1,0,0|2,0,0]=4 9374 B9R1.138 CC1(C)COC(=O)C1N Amb28935018 [0,1,0,1,0,0|2,0,0]=4 9375 B9R1.138 CC1(C)COC(=O)C1O Amb532977 [0,1,0,1,0,0|1,0,0]=3 9376 B9R1.138 CC1(C)COC(=O)N1Br Amb26616806 [0,1,0,1,0,0|2,0,0]=4 9377 B9R1.138 CC1(C)COC(=O)[C@@H]1Br Amb22747532 [0,1,0,1,0,0|2,0,0]=4 9378 B9R1.138 CC1(C)COC(=O)[C@@H]1N Amb25083661 [0,1,0,1,0,0|2,0,0]=4 9379 B9R1.138 CC1(C)COC(=O)[C@@H]1N Amb33338971 [0,1,0,1,0,0|2,0,0]=4 9380 B9R1.138 CC1(C)COC(=O)[C@@H]1O Amb2719697 [0,1,0,1,0,0|1,0,0]=3 9381 B9R1.138 CC1(C)COC(=O)[C@H]1Br Amb27479666 [0,1,0,1,0,0|2,0,0]=4 9382 B9R1.138 CC1(C)COC(=O)[C@H]1N Amb24589212 [0,1,0,1,0,0|2,0,0]=4 9383 B9R1.138 CC1(C)COC(=O)[C@H]1N Amb33330894 [0,1,0,1,0,0|2,0,0]=4 9384 B9R1.138 CC1(C)COC(=O)[C@H]1O Amb3939674 [0,1,0,1,0,0|1,0,0]=3 9385 B9R1.138 CC1(C)CSC(=O)C1N Amb28250198 [0,1,0,1,0,0|2,0,0]=4 9386 B9R1.138 CC1(C)CSC(=O)C1N Amb34930436 [0,1,0,1,0,0|2,0,0]=4 9387 B9R1.138 CC1(C)CSC(=O)C1O Amb27405285 [0,1,0,1,0,0|1,0,0]=3 9388 B9R1.138 CC1(C)NCC(=O)N1O Amb27945580 [0,1,0,1,0,0|1,0,0]=3 9389 B9R1.138 CC1(C)OCC(O)C1=O Amb27468092 [0,1,0,1,0,0|1,0,1]=4 9390 B9R1.138 CC1(Cl)CCC(=O)C1=O Amb27486096 [0,1,0,1,0,0|1,0,1]=4 9391 B9R1.138 CC1(O)CCC(=O)C1=O Amb28122175 [0,1,0,1,0,0|1,0,1]=4 9392 B9R1.138 CC1(O)CCC(=O)C1O Amb28128781 [0,1,0,1,0,0|1,0,0]=3 9393 B9R1.138 CC1(O)CCC(O)C1=O Amb27861206 [0,1,0,1,0,0|1,0,1]=4 9394 B9R1.138 CC1=[N+]([O-])C(C)(C)CC1 Amb28195773 [0,1,0,1,0,0|1,0,1]=4 9395 B9R1.138 CC1C(O)CCC1(C)C Amb27857523 [0,1,0,1,0,0|1,0,1]=4 9396 B9R1.138 CC1CCC(C)(C)C1=O Amb22228221 [0,1,0,1,0,0|1,0,1]=4 9397 B9R1.138 CN1C(=O)CCC1(C)C Amb27456813 [0,1,0,1,0,0|1,0,0]=3 9398 B9R1.138 CN1C(=O)OCC1(C)C Amb27970325 [0,1,0,1,0,0|2,0,0]=4 9399 B9R1.138 C[C@@]1(O)CC=C(O)C1=O Amb28351523 [0,1,0,1,0,0|1,0,1]=4 9400 B9R1.138 C[C@@]1(O)CCC(=O)C1=O Amb27838709 [0,1,0,1,0,0|1,0,1]=4 9401 B9R1.138 C[C@@]1(O)CC[C@H](O)C1=O Amb27818075 [0,1,0,1,0,0|1,0,1]=4 9402 B9R1.138 C[C@H]1C(=O)CC[C@@]1(C)O Amb28194858 [0,1,0,1,0,0|2,0,0]=4 9403 B9R1.138 C[C@H]1CCC(C)(C)[C@@H]1O Amb27432296 [0,1,0,1,0,0|1,0,1]=4 9404 B9R1.147 C=C(C)CCC1(N)CC1 Amb33200279 [0,1,0,1,0,0|2,0,0]=4 9405 B9R1.147 C=C(C)CCC1(O)CC1 Amb33199208 [0,1,0,1,0,0|2,0,0]=4 9406 B9R1.147 CC(=O)CCC1(C)CC1 Amb33314305 [0,1,0,1,0,0|1,0,0]=3 9407 B9R1.147 CC(=O)NCC1(C)CC1 Amb28189735 [0,1,0,1,0,0|2,0,0]=4 9408 B9R1.147 CC(=O)NCC1(N)CC1 Amb33228760 [0,1,0,1,0,0|2,0,0]=4 9409 B9R1.147 CC(=O)OCC1(F)CC1 Amb28291710 [0,1,0,1,0,0|2,0,0]=4 9410 B9R1.147 CC(=O)SCC1(C)CC1 Amb28120147 [0,1,0,1,0,0|2,0,0]=4 9411 B9R1.147 CC(C)CCC1(C)CO1 Amb27606995 [0,1,0,1,0,0|1,0,1]=4 9412 B9R1.147 CC(C)CCC1(O)CC1 Amb24642189 [0,1,0,1,0,0|1,0,1]=4 9413 B9R1.147 CC(O)CCC1(C)CC1 Amb33313079 [0,1,0,1,0,0|1,0,1]=4 9414 B9R1.147 CC(O)CCC1(N)CC1 Amb35643076 [0,1,0,1,0,0|1,0,1]=4 9415 B9R1.147 CC(O)CCC1(O)CC1 Amb28205941 [0,1,0,1,0,0|1,0,1]=4 9416 B9R1.147 CC1(C#CC(=O)O)CC1 Amb25662631 [0,1,0,1,0,0|0,0,2]=4 9417 B9R1.147 CC1(CCC(=O)Cl)N=N1 Amb27200316 [0,1,0,1,0,0|2,0,0]=4 9418 B9R1.147 CC1(CCC(=O)O)CC1 Amb8009614 [0,1,0,1,0,0|0,0,0]=2 9419 B9R1.147 CC1(CCC(=O)O)N=N1 Amb25840850 [0,1,0,1,0,0|1,0,0]=3 9420 B9R1.147 CC1(CCC(N)=O)N=N1 Amb27142692 [0,1,0,1,0,0|2,0,0]=4 9421 B9R1.147 CC1(CCS(=O)Cl)CC1 Amb32720683 [0,1,0,1,0,0|2,0,0]=4 9422 B9R1.147 CC1(CCS(=O)[O-])CC1 Amb32754822 [0,1,0,1,0,0|1,0,1]=4 9423 B9R1.147 CC1(CCS(N)=O)CC1 Amb32720684 [0,1,0,1,0,0|2,0,0]=4 9424 B9R1.147 CC1(CC[N+](=O)[O-])CC1 Amb33312920 [0,1,0,1,0,0|1,0,1]=4 9425 B9R1.147 CC1(CNC(=O)Cl)CC1 Amb35633322 [0,1,0,1,0,0|2,0,0]=4 9426 B9R1.147 CC1(NCC(=O)O)CC1 Amb27444501 [0,1,0,1,0,0|1,0,0]=3 9427 B9R1.147 CC1(NCC(N)=O)CC1 Amb27974935 [0,1,0,1,0,0|2,0,0]=4 9428 B9R1.147 CC1(OCC(=O)O)CC1 Amb26056469 [0,1,0,1,0,0|1,0,0]=3 9429 B9R1.147 CC1(\C=C\C(=O)O)CC1 Amb33313120 [0,1,0,1,0,0|0,0,2]=4 9430 B9R1.147 CS(=O)CCC1(N)CC1 Amb28142473 [0,1,0,1,0,0|2,0,0]=4 9431 B9R1.147 C[C@@H](O)CCC1(C)CC1 Amb33310957 [0,1,0,1,0,0|1,0,1]=4 9432 B9R1.147 C[C@H](O)CCC1(C)CC1 Amb33311525 [0,1,0,1,0,0|1,0,1]=4 9433 B9R1.147 NC1(CCC(=O)O)CC1 Amb18832570 [0,1,0,1,0,0|0,0,0]=2 9434 B9R1.147 O=C(O)CCC1(Cl)CC1 Amb25865061 [0,1,0,1,0,0|0,0,0]=2 9435 B9R1.147 O=C(O)CCC1(F)CC1 Amb27423404 [0,1,0,1,0,0|0,0,0]=2 9436 B9R1.147 O=C(O)CCC1(O)CC1 Amb28325490 [0,1,0,1,0,0|0,0,0]=2 9437 B9R1.185 C#C[C@H](O)C1CC1(C)C Amb27806915 [0,1,0,1,0,0|1,0,1]=4 9438 B9R1.185 C=C(CC)C1CC1(C)C Amb27459137 [0,1,0,1,0,0|2,0,0]=4 9439 B9R1.185 CC(CO)C1CC1(C)C Amb33744601 [0,1,0,1,0,0|1,0,1]=4 9440 B9R1.185 CC(CO)C1CC1(C)O Amb28187622 [0,1,0,1,0,0|1,0,1]=4 9441 B9R1.185 CC(NO)C1CC1(C)C Amb27220751 [0,1,0,1,0,0|1,0,1]=4 9442 B9R1.185 CC1(C)CC1C(=O)NN Amb10608316 [0,1,0,1,0,0|1,0,0]=3 9443 B9R1.185 CC1(C)CC1C(=O)NN Amb19890094 [0,1,0,1,0,0|1,0,0]=3 9444 B9R1.185 CC1(C)CC1\C(N)=N\O Amb25376693 [0,1,0,1,0,0|1,0,0]=3 9445 B9R1.185 CCC(=O)C1CC1(C)C Amb10608271 [0,1,0,1,0,0|1,0,0]=3 9446 B9R1.185 CCC(O)C1CC1(C)C Amb27603064 [0,1,0,1,0,0|1,0,1]=4 9447 B9R1.185 CC[C@@H](O)C1CC1(C)C Amb27272856 [0,1,0,1,0,0|1,0,1]=4 9448 B9R1.185 CC[C@@H](O)[C@@H]1CC1(C)C Amb27978407 [0,1,0,1,0,0|1,0,1]=4 9449 B9R1.185 CC[C@H](O)[C@@H]1CC1(C)C Amb27620170 [0,1,0,1,0,0|1,0,1]=4 9450 B9R1.185 CC[C@H](O)[C@H]1CC1(C)C Amb27420475 [0,1,0,1,0,0|1,0,1]=4 9451 B9R1.185 COC(=N)C1CC1(C)C Amb25720677 [0,1,0,1,0,0|1,0,0]=3 9452 B9R1.185 COC(=N)C1CC1(C)C Amb32666726 [0,1,0,1,0,0|1,0,0]=3 9453 B9R1.185 COC(=O)C1CC1(C)C Amb25762943 [0,1,0,1,0,0|0,0,0]=2 9454 B9R1.185 COC(=O)C1OC1(C)C Amb4418353 [0,1,0,1,0,0|1,0,0]=3 9455 B9R1.185 C[C@@H](CO)C1CC1(C)C Amb33738950 [0,1,0,1,0,0|1,0,1]=4 9456 B9R1.185 C[C@H](CO)C1CC1(C)C Amb33748165 [0,1,0,1,0,0|1,0,1]=4 9457 B9R1.185 C\C(=N/O)C1CC1(C)C Amb28134848 [0,1,0,1,0,0|1,0,0]=3 9458 B9R1.185 O=C(NO)C1CC1(Cl)Cl Amb27783648 [0,1,0,1,0,0|2,0,0]=4 9459 B9R1.36 C=C1CC(C)(C)NC1=O Amb27224823 [0,1,0,1,0,0|1,0,1]=4 9460 B9R1.36 C=C1CC(C)(C)OC1=O Amb27879663 [0,1,0,1,0,0|0,0,1]=3 9461 B9R1.36 CC1(C)CC(=O)C(=O)C1 Amb25888889 [0,1,0,1,0,0|1,0,1]=4 9462 B9R1.36 CC1(C)CC(=O)C(Cl)C1 Amb28206748 [0,1,0,1,0,0|1,0,0]=3 9463 B9R1.36 CC1(C)CC(=O)C(O)C1 Amb26892864 [0,1,0,1,0,0|1,0,0]=3 9464 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb18124322 [0,1,0,1,0,0|0,0,0]=2 9465 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb32674857 [0,1,0,1,0,0|0,0,0]=2 9466 B9R1.36 CC1(C)CC(O)C(F)C1 Amb27208518 [0,1,0,1,0,0|1,0,1]=4 9467 B9R1.36 CC1(C)CC(O)C(O)C1 Amb24478613 [0,1,0,1,0,0|1,0,1]=4 9468 B9R1.36 CC1(C)C[C@@H](N)C(=O)O1 Amb28196700 [0,1,0,1,0,0|0,0,0]=2 9469 B9R1.36 CC1(C)C[C@@H](O)C(=O)O1 Amb27472564 [0,1,0,1,0,0|0,0,0]=2 9470 B9R1.36 CC1(C)C[C@H](N)C(=O)O1 Amb24476611 [0,1,0,1,0,0|0,0,0]=2 9471 B9R1.36 CC1(C)C[C@H](O)C(=O)O1 Amb28205922 [0,1,0,1,0,0|0,0,0]=2 9472 B9R1.36 CC1=CC(C)(C)CC1O Amb27969092 [0,1,0,1,0,0|2,0,0]=4 9473 B9R1.36 CC1CC(C)(C)CC1=O Amb15693405 [0,1,0,1,0,0|1,0,0]=3 9474 B9R1.36 CC1CC(C)(C)CC1O Amb28454062 [0,1,0,1,0,0|1,0,1]=4 9475 B9R1.36 CC1CC(C)(C)NC1=O Amb19149267 [0,1,0,1,0,0|1,0,0]=3 9476 B9R1.36 CC1CC(C)(C)OC1=O Amb24444118 [0,1,0,1,0,0|0,0,0]=2 9477 B9R1.36 CC1CC(C)(O)CC1C Amb24477851 [0,1,0,1,0,0|1,0,1]=4 9478 B9R1.36 CC1CS(=O)(=O)CC1Cl Amb27477904 [0,1,0,1,0,0|1,0,1]=4 9479 B9R1.36 CC1CS(=O)(=O)CC1N Amb24340271 [0,1,0,1,0,0|1,0,1]=4 9480 B9R1.36 CC1CS(=O)(=O)CC1O Amb2233406 [0,1,0,1,0,0|1,0,1]=4 9481 B9R1.36 CC1CS(=O)(=O)CC1[NH3+] Amb4153217 [0,1,0,1,0,0|1,0,1]=4 9482 B9R1.36 CC1NC(C)(C)OC1=N Amb27179876 [0,1,0,1,0,0|2,0,0]=4 9483 B9R1.36 CC1OC(C)(C)CC1O Amb27956476 [0,1,0,1,0,0|1,0,1]=4 9484 B9R1.36 CC1SC(C)(C)NC1=O Amb27875455 [0,1,0,1,0,0|2,0,0]=4 9485 B9R1.36 C[C@@H]1CS(=O)(=O)C[C@@H]1N Amb25124954 [0,1,0,1,0,0|1,0,1]=4 9486 B9R1.36 C[C@@H]1CS(=O)(=O)C[C@@H]1N Amb32653275 [0,1,0,1,0,0|1,0,1]=4 9487 B9R1.36 C[C@@H]1CS(=O)(=O)C[C@H]1N Amb24587782 [0,1,0,1,0,0|1,0,1]=4 9488 B9R1.36 C[C@@H]1CS(=O)(=O)C[C@H]1N Amb28735706 [0,1,0,1,0,0|1,0,1]=4 9489 B9R1.36 C[C@H]1CC(C)(C)NC1=O Amb35825454 [0,1,0,1,0,0|1,0,0]=3 9490 B9R1.36 C[C@H]1CS(=O)(=O)C[C@@H]1N Amb34916430 [0,1,0,1,0,0|1,0,1]=4 9491 B9R1.36 C[C@H]1CS(=O)(=O)C[C@H]1N Amb25222669 [0,1,0,1,0,0|1,0,1]=4 9492 B9R1.36 C[C@H]1CS(=O)(=O)C[C@H]1N Amb34163853 [0,1,0,1,0,0|1,0,1]=4 9493 B9R1.38 C=C1OC(=O)OC1(C)C Amb1033029 [0,1,0,1,0,0|1,0,1]=4 9494 B9R1.38 CC1(C)C=C(Br)CC1O Amb28126130 [0,1,0,1,0,0|2,0,0]=4 9495 B9R1.38 CC1(C)C=C(Br)C[C@H]1O Amb25147101 [0,1,0,1,0,0|2,0,0]=4 9496 B9R1.38 CC1(C)CC(=O)CC1=O Amb25993979 [0,1,0,1,0,0|1,0,1]=4 9497 B9R1.38 CC1(C)NC(=O)CC1=O Amb18832699 [0,1,0,1,0,0|1,0,1]=4 9498 B9R1.38 CC1(C)NC(=O)CC1N Amb34932666 [0,1,0,1,0,0|1,0,0]=3 9499 B9R1.38 CC1(C)NC(=O)NC1[O-] Amb28074007 [0,1,0,1,0,0|2,0,0]=4 9500 B9R1.38 CC1(C)OC(=O)C=C1N Amb28193555 [0,1,0,1,0,0|0,0,2]=4 9501 B9R1.38 CC1(C)OC(=O)C=C1O Amb28060059 [0,1,0,1,0,0|0,0,2]=4 9502 B9R1.38 CC1(C)OC(=O)CC1=O Amb27838818 [0,1,0,1,0,0|0,0,1]=3 9503 B9R1.38 CC1(C)OC(=O)C[C@H]1O Amb27208228 [0,1,0,1,0,0|0,0,0]=2 9504 B9R1.38 CC1(C)OC(=O)N=C1N Amb23515141 [0,1,0,1,0,0|1,0,1]=4 9505 B9R1.38 CC1(C)OC(=O)NC1=O Amb6296615 [0,1,0,1,0,0|1,0,1]=4 9506 B9R1.38 CC1(C)SC(=O)CC1N Amb28367437 [0,1,0,1,0,0|0,1,0]=3 9507 B9R1.38 CC1(Cl)OC(=O)OC1F Amb27955117 [0,1,0,1,0,0|2,0,0]=4 9508 B9R1.38 CC1(F)OC(=O)OC1Cl Amb26390809 [0,1,0,1,0,0|2,0,0]=4 9509 B9R1.38 CC1=CC(=O)OC1(C)C Amb32664388 [0,1,0,1,0,0|0,0,2]=4 9510 B9R1.38 CC1=CC(C)(C)C(O)C1 Amb28315490 [0,1,0,1,0,0|2,0,0]=4 9511 B9R1.38 CC1CC(=O)NC1(C)C Amb19516972 [0,1,0,1,0,0|1,0,0]=3 9512 B9R1.38 CC1CC(=O)OC1(C)C Amb28206444 [0,1,0,1,0,0|0,0,0]=2 9513 B9R1.38 CC1CC(=S)NC1(C)C Amb27799257 [0,1,0,1,0,0|1,1,0]=4 9514 B9R1.38 CC1CC(C)C(C)(O)C1 Amb27488714 [0,1,0,1,0,0|1,0,1]=4 9515 B9R1.38 CC1CC(C)S(=O)(=O)C1 Amb2227622 [0,1,0,1,0,0|1,0,1]=4 9516 B9R1.38 CC1C[C@@H](N)P(=O)(O)O1 Amb27230015 [0,1,0,1,0,0|2,0,0]=4 9517 B9R1.38 CC1NC(=O)CC1(C)C Amb24618176 [0,1,0,1,0,0|2,0,0]=4 9518 B9R1.38 CC1NC(=O)NC1(C)C Amb27945549 [0,1,0,1,0,0|2,0,0]=4 9519 B9R1.38 CC1NC(=O)OC1(C)C Amb28457652 [0,1,0,1,0,0|1,0,0]=3 9520 B9R1.38 CC1NC(=S)OC1(C)C Amb28285111 [0,1,0,1,0,0|1,1,0]=4 9521 B9R1.38 CC1OC(=O)CC1(C)C Amb26942367 [0,1,0,1,0,0|2,0,0]=4 9522 B9R1.38 CN1CC(=O)CC1(C)C Amb26496918 [0,1,0,1,0,0|2,0,0]=4 9523 B9R1.44 CC(=O)CC1(C)OC1C Amb28054341 [0,1,0,1,0,0|2,0,0]=4 9524 B9R1.44 CC(=O)OC1(C)CC1C Amb27837613 [0,1,0,1,0,0|2,0,0]=4 9525 B9R1.44 CC1(CC(=O)O)CC1F Amb32664391 [0,1,0,1,0,0|1,0,0]=3 9526 B9R1.44 CC1CC1(N)CC(=O)O Amb27816522 [0,1,0,1,0,0|0,0,0]=2 9527 B9R1.44 CC1CC1(N)CC(N)=O Amb27631646 [0,1,0,1,0,0|1,0,0]=3 9528 B9R1.45 C=C(C(=O)O)C1CC1C Amb33144231 [0,1,0,1,0,0|0,0,1]=3 9529 B9R1.45 C=C1CC1C(N)C(=O)O Amb24117258 [0,1,0,1,0,0|0,0,2]=4 9530 B9R1.45 C=C1CC1C(N)C(=O)O Amb27489118 [0,1,0,1,0,0|0,0,2]=4 9531 B9R1.45 C=C1CC1C(O)C(=O)O Amb27816361 [0,1,0,1,0,0|0,0,2]=4 9532 B9R1.45 C=C1C[C@@H]1C(O)C(=O)O Amb28410295 [0,1,0,1,0,0|0,0,2]=4 9533 B9R1.45 C=C1C[C@@H]1[C@H](N)C(=O)O Amb28349320 [0,1,0,1,0,0|0,0,2]=4 9534 B9R1.45 C=C1C[C@@H]1[C@H](O)C(C)C Amb28133345 [0,1,0,1,0,0|2,0,0]=4 9535 B9R1.45 C=C1C[C@H]1[C@H](O)C(C)C Amb27650505 [0,1,0,1,0,0|2,0,0]=4 9536 B9R1.45 CC1CC1C(=O)C(=O)O Amb24760671 [0,1,0,1,0,0|0,0,1]=3 9537 B9R1.45 CC1CC1C(C)C(=O)O Amb25708709 [0,1,0,1,0,0|0,0,0]=2 9538 B9R1.45 CC1CC1C(N)C(=O)O Amb33359576 [0,1,0,1,0,0|0,0,0]=2 9539 B9R1.45 CC1CC1C(O)C(=O)O Amb33474336 [0,1,0,1,0,0|0,0,0]=2 9540 B9R1.112 C=C(C)C(N)CC1CC1 Amb28313656 [0,1,0,1,0,0|2,0,0]=4 9541 B9R1.112 CC(=O)C(C)NC1CC1 Amb25119978 [0,1,0,1,0,0|2,0,0]=4 9542 B9R1.112 CC(=O)C(N)CC1CC1 Amb33132583 [0,1,0,1,0,0|1,0,0]=3 9543 B9R1.112 CC(C)C(O)CC1CO1 Amb27616412 [0,1,0,1,0,0|1,0,1]=4 9544 B9R1.112 CC(CC1CC1)C(=O)O Amb28075498 [0,1,0,1,0,0|0,0,0]=2 9545 B9R1.112 CC(CC1CC1)C(N)=O Amb33495655 [0,1,0,1,0,0|1,0,0]=3 9546 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [0,1,0,1,0,0|1,0,0]=3 9547 B9R1.112 CC(NC1CC1)C(N)=O Amb7758269 [0,1,0,1,0,0|2,0,0]=4 9548 B9R1.112 CC(O)C(C)CC1CC1 Amb24429505 [0,1,0,1,0,0|1,0,1]=4 9549 B9R1.112 CC(OC1CC1)C(=O)O Amb27667232 [0,1,0,1,0,0|1,0,0]=3 9550 B9R1.112 CN(CC1CC1)C(=O)Cl Amb32863866 [0,1,0,1,0,0|2,0,0]=4 9551 B9R1.112 C[C@@H](CC1CC1)C(=O)O Amb10844014 [0,1,0,1,0,0|0,0,0]=2 9552 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [0,1,0,1,0,0|1,0,0]=3 9553 B9R1.112 C[C@H](CC1CC1)C(=O)O Amb33749387 [0,1,0,1,0,0|0,0,0]=2 9554 B9R1.112 C\C(=C/C1CC1)C(=O)O Amb25996000 [0,1,0,1,0,0|0,0,2]=4 9555 B9R1.112 NC(=O)C(N)CC1CC1 Amb25767604 [0,1,0,1,0,0|1,0,0]=3 9556 B9R1.112 NC(=O)C(N)CC1CC1 Amb34199787 [0,1,0,1,0,0|1,0,0]=3 9557 B9R1.112 NC(CC1CC1)C(=O)O Amb23399727 [0,1,0,1,0,0|0,0,0]=2 9558 B9R1.112 NC(CC1CC1)C(=O)O Amb4019455 [0,1,0,1,0,0|0,0,0]=2 9559 B9R1.112 N[C@@H](CC1CC1)C(=O)O Amb24329024 [0,1,0,1,0,0|0,0,0]=2 9560 B9R1.112 N[C@@H](C[C@H]1CO1)C(=O)O Amb28252257 [0,1,0,1,0,0|1,0,0]=3 9561 B9R1.112 N[C@H](CC1CC1)C(=O)O Amb2699114 [0,1,0,1,0,0|0,0,0]=2 9562 B9R1.112 O=C(O)C(=O)CC1CC1 Amb18988329 [0,1,0,1,0,0|0,0,1]=3 9563 B9R1.112 O=C(O)C(=O)NC1CC1 Amb9303797 [0,1,0,1,0,0|1,0,1]=4 9564 B9R1.112 O=C(O)C(F)CC1CC1 Amb27838541 [0,1,0,1,0,0|0,0,0]=2 9565 B9R1.112 O=C(O)C(O)CC1CC1 Amb25082516 [0,1,0,1,0,0|0,0,0]=2 9566 B9R1.112 O=C(O)C(S)CC1CC1 Amb18296302 [0,1,0,1,0,0|0,0,0]=2 9567 B9R1.112 O=C(O)[C@@H](O)CC1CC1 Amb23401512 [0,1,0,1,0,0|0,0,0]=2 9568 B9R1.112 O=C(O)[C@H](O)CC1CC1 Amb26014645 [0,1,0,1,0,0|0,0,0]=2 9569 B9R1.112 O=C(O)\C(F)=C\C1CC1 Amb25102827 [0,1,0,1,0,0|0,0,2]=4 9570 B9R1.137 CC(=O)CC(=O)C1CC1 Amb9206108 [0,1,0,1,0,0|1,0,1]=4 9571 B9R1.137 CC(=O)CC(C)C1CC1 Amb25877260 [0,1,0,1,0,0|1,0,0]=3 9572 B9R1.137 CC(=O)CC(N)C1CC1 Amb27228240 [0,1,0,1,0,0|1,0,0]=3 9573 B9R1.137 CC(=O)OC(C)C1CC1 Amb4418355 [0,1,0,1,0,0|2,0,0]=4 9574 B9R1.137 CC(=O)O[C@H](C)C1CC1 Amb28049288 [0,1,0,1,0,0|2,0,0]=4 9575 B9R1.137 CC(C)CC(C)C1CO1 Amb28285318 [0,1,0,1,0,0|1,0,1]=4 9576 B9R1.137 CC(C)CC(O)C1CO1 Amb28042958 [0,1,0,1,0,0|1,0,1]=4 9577 B9R1.137 CC(C)C[C@@H](O)[C@H]1CO1 Amb27422414 [0,1,0,1,0,0|1,0,1]=4 9578 B9R1.137 CC(CC(=N)N)C1CC1 Amb32729505 [0,1,0,1,0,0|2,0,0]=4 9579 B9R1.137 CC(CC(=O)O)C1CC1 Amb6749210 [0,1,0,1,0,0|0,0,0]=2 9580 B9R1.137 CC(CC(N)=S)C1CC1 Amb32729514 [0,1,0,1,0,0|1,1,0]=4 9581 B9R1.137 CC(CS(=O)Cl)C1CC1 Amb32720647 [0,1,0,1,0,0|2,0,0]=4 9582 B9R1.137 CC(CS(N)=O)C1CC1 Amb32720637 [0,1,0,1,0,0|2,0,0]=4 9583 B9R1.137 CC(C[C@@H](C)O)C1CC1 Amb32728774 [0,1,0,1,0,0|1,0,1]=4 9584 B9R1.137 CC(C[C@H](C)O)C1CC1 Amb32728773 [0,1,0,1,0,0|1,0,1]=4 9585 B9R1.137 CC(NC(=O)Cl)C1CC1 Amb35625512 [0,1,0,1,0,0|2,0,0]=4 9586 B9R1.137 CC(NC(N)=O)C1CC1 Amb341486 [0,1,0,1,0,0|2,0,0]=4 9587 B9R1.137 CC(O)CC(N)C1CC1 Amb35582307 [0,1,0,1,0,0|1,0,1]=4 9588 B9R1.137 CN(CC(=O)O)C1CC1 Amb8892577 [0,1,0,1,0,0|1,0,0]=3 9589 B9R1.137 C\C(=C/C(=O)O)C1CC1 Amb10609547 [0,1,0,1,0,0|0,0,2]=4 9590 B9R1.137 C\C(=C\C(=O)O)C1CC1 Amb10718081 [0,1,0,1,0,0|0,0,2]=4 9591 B9R1.137 NC(=O)CC(N)C1CC1 Amb18988331 [0,1,0,1,0,0|1,0,0]=3 9592 B9R1.137 NC(=O)CC(N)C1CC1 Amb33549860 [0,1,0,1,0,0|1,0,0]=3 9593 B9R1.137 NC(=O)C[C@@H](N)C1CC1 Amb25259754 [0,1,0,1,0,0|1,0,0]=3 9594 B9R1.137 NC(=O)C[C@H](N)C1CC1 Amb28347712 [0,1,0,1,0,0|1,0,0]=3 9595 B9R1.137 NC(CC(=O)O)C1CC1 Amb2683273 [0,1,0,1,0,0|0,0,0]=2 9596 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb26989123 [0,1,0,1,0,0|0,0,0]=2 9597 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb33329309 [0,1,0,1,0,0|0,0,0]=2 9598 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb24349802 [0,1,0,1,0,0|0,0,0]=2 9599 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb33329112 [0,1,0,1,0,0|0,0,0]=2 9600 B9R1.137 O=C(O)CC(=O)C1CC1 Amb10576272 [0,1,0,1,0,0|0,0,1]=3 9601 B9R1.137 O=C(O)CC(O)C1CC1 Amb17231863 [0,1,0,1,0,0|0,0,0]=2 9602 B9R1.137 O=C(O)C[C@@H](O)C1CC1 Amb25367343 [0,1,0,1,0,0|0,0,0]=2 9603 B9R1.137 O=C(O)C[C@H](O)C1CC1 Amb27468740 [0,1,0,1,0,0|0,0,0]=2 9604 B9R1.137 O=C(O)\C=C(\Cl)C1CC1 Amb25272142 [0,1,0,1,0,0|0,0,2]=4 9605 B9R1.137 O=C([O-])CC(O)C1CC1 Amb31188275 [0,1,0,1,0,0|0,0,1]=3 9606 B9R1.137 O=[N+]([O-])CC(O)C1CC1 Amb22262975 [0,1,0,1,0,0|1,0,1]=4 9607 B9R1.139 C=C(C)C1C(N)C1(C)C Amb33199250 [0,1,0,1,0,0|2,0,0]=4 9608 B9R1.139 C=C(C)[C@@H]1[C@@H](N)C1(C)C Amb33199242 [0,1,0,1,0,0|2,0,0]=4 9609 B9R1.139 C=C1C(C(C)=O)C1(C)C Amb27762509 [0,1,0,1,0,0|1,0,1]=4 9610 B9R1.139 CC(=O)C1C(Br)C1(C)C Amb27193217 [0,1,0,1,0,0|1,0,0]=3 9611 B9R1.139 CC(=O)C1C(Cl)C1(C)C Amb25685934 [0,1,0,1,0,0|1,0,0]=3 9612 B9R1.139 CC(=O)[C@@H]1[C@@H](Br)C1(C)C Amb28244808 [0,1,0,1,0,0|1,0,0]=3 9613 B9R1.139 CC(O)C1C(Cl)C1(C)C Amb27232557 [0,1,0,1,0,0|1,0,1]=4 9614 B9R1.139 CC(O)[C@@H]1[C@H](C)C1(C)C Amb27423117 [0,1,0,1,0,0|1,0,1]=4 9615 B9R1.139 CC1(C)C(Br)C1C(=O)O Amb28078793 [0,1,0,1,0,0|0,0,0]=2 9616 B9R1.139 CC1(C)C(C(=O)O)[C@H]1Cl Amb28043135 [0,1,0,1,0,0|0,0,0]=2 9617 B9R1.139 CC1(C)C(Cl)C1C(=O)Cl Amb27858247 [0,1,0,1,0,0|1,0,0]=3 9618 B9R1.139 CC1(C)C(O)C1C(=O)O Amb27642274 [0,1,0,1,0,0|0,0,0]=2 9619 B9R1.139 CC1C(C(=O)Cl)C1(C)C Amb25088892 [0,1,0,1,0,0|1,0,0]=3 9620 B9R1.139 CC1C(C(=O)O)C1(F)F Amb19515667 [0,1,0,1,0,0|2,0,0]=4 9621 B9R1.139 C[C@@H]1[C@@H](C(=O)O)C1(C)C Amb27247272 [0,1,0,1,0,0|0,0,0]=2 9622 B9R1.139 C[C@@H]1[C@@H](C(=O)O)C1(F)F Amb33457734 [0,1,0,1,0,0|2,0,0]=4 9623 B9R1.139 C[C@@H]1[C@H](C(=O)Cl)C1(C)C Amb27767899 [0,1,0,1,0,0|1,0,0]=3 9624 B9R1.139 C[C@H](O)[C@H]1[C@@H](Cl)C1(C)C Amb27192187 [0,1,0,1,0,0|1,0,1]=4 9625 B9R1.139 C[C@H]1[C@@H](C(=O)Cl)C1(C)C Amb26926523 [0,1,0,1,0,0|1,0,0]=3 9626 B9R1.139 C[C@H]1[C@@H](C(=O)O)C1(C)C Amb28429827 [0,1,0,1,0,0|0,0,0]=2 9627 B9R1.139 C[C@H]1[C@@H]([C@@H](C)O)C1(C)C Amb28345302 [0,1,0,1,0,0|1,0,1]=4 9628 B9R1.152 C=C(C)C1(O)CC(C)C1 Amb27449730 [0,1,0,1,0,0|2,0,0]=4 9629 B9R1.152 C=C1CC(C)(C(=O)O)C1 Amb25887446 [0,1,0,1,0,0|0,0,2]=4 9630 B9R1.152 C=C1CC(N)(C(=O)O)C1 Amb34145346 [0,1,0,1,0,0|0,0,2]=4 9631 B9R1.152 C=C1CC(O)(C(=O)O)C1 Amb28201676 [0,1,0,1,0,0|0,0,2]=4 9632 B9R1.152 CC(C)C1(N)CC(O)C1 Amb33360213 [0,1,0,1,0,0|1,0,1]=4 9633 B9R1.152 CC1(C(=O)O)CC(=O)C1 Amb22406208 [0,1,0,1,0,0|1,0,1]=4 9634 B9R1.152 CC1(C(=O)O)CC(Cl)C1 Amb27460159 [0,1,0,1,0,0|1,0,0]=3 9635 B9R1.152 CC1(C(=O)O)CC(F)C1 Amb32906768 [0,1,0,1,0,0|1,0,0]=3 9636 B9R1.152 CC1(C(=O)O)CC(N)C1 Amb25889781 [0,1,0,1,0,0|1,0,0]=3 9637 B9R1.152 CC1(C(=O)O)CC(N)C1 Amb33456976 [0,1,0,1,0,0|1,0,0]=3 9638 B9R1.152 CC1(C(=O)O)CC(O)C1 Amb33361249 [0,1,0,1,0,0|1,0,0]=3 9639 B9R1.152 CC1CC(C)(C(=O)O)C1 Amb23448860 [0,1,0,1,0,0|0,0,0]=2 9640 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb25821754 [0,1,0,1,0,0|0,0,0]=2 9641 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb30585229 [0,1,0,1,0,0|0,0,0]=2 9642 B9R1.152 CC1CC(N)(C(N)=O)C1 Amb27465840 [0,1,0,1,0,0|1,0,0]=3 9643 B9R1.152 CN1CC(C)(C(=O)O)C1 Amb27264651 [0,1,0,1,0,0|1,0,0]=3 9644 B9R1.152 CN1CC(N)(C(=O)O)C1 Amb28312895 [0,1,0,1,0,0|1,0,0]=3 9645 B9R1.152 CN1CC(O)(C(=O)O)C1 Amb28347279 [0,1,0,1,0,0|1,0,0]=3 9646 B9R1.152 C[C@]1(C(=O)O)C[C@@H](N)C1 Amb23440223 [0,1,0,1,0,0|1,0,0]=3 9647 B9R1.152 C[C@]1(C(=O)O)C[C@@H](N)C1 Amb24730954 [0,1,0,1,0,0|1,0,0]=3 9648 B9R1.152 C[C@]1(C(=O)O)C[C@H](N)C1 Amb23439475 [0,1,0,1,0,0|1,0,0]=3 9649 B9R1.152 C[C@]1(C(=O)O)C[C@H](N)C1 Amb25275111 [0,1,0,1,0,0|1,0,0]=3 9650 B9R1.152 NC(=O)[C@]1(N)C[C@@H](O)C1 Amb33328633 [0,1,0,1,0,0|2,0,0]=4 9651 B9R1.152 NC(=O)[C@]1(N)C[C@@H](O)C1 Amb33328634 [0,1,0,1,0,0|2,0,0]=4 9652 B9R1.152 NC1(C(=O)O)CC(F)C1 Amb26579071 [0,1,0,1,0,0|1,0,0]=3 9653 B9R1.152 NC1(C(=O)O)CC(F)C1 Amb30585191 [0,1,0,1,0,0|1,0,0]=3 9654 B9R1.152 NC1(C(=O)O)CC(O)C1 Amb26585144 [0,1,0,1,0,0|1,0,0]=3 9655 B9R1.152 NC1(C(=O)O)CC(O)C1 Amb28992378 [0,1,0,1,0,0|1,0,0]=3 9656 B9R1.152 NC1CC(F)(C(=O)O)C1 Amb25784332 [0,1,0,1,0,0|1,0,0]=3 9657 B9R1.152 NC1CC(F)(C(=O)O)C1 Amb33484269 [0,1,0,1,0,0|1,0,0]=3 9658 B9R1.152 NC1CC(O)(C(=O)O)C1 Amb27194402 [0,1,0,1,0,0|1,0,0]=3 9659 B9R1.152 N[C@]1(C(=O)O)C[C@@H](F)C1 Amb26959446 [0,1,0,1,0,0|1,0,0]=3 9660 B9R1.152 N[C@]1(C(=O)O)C[C@@H](F)C1 Amb32655998 [0,1,0,1,0,0|1,0,0]=3 9661 B9R1.152 N[C@]1(C(=O)O)C[C@H](F)C1 Amb22746505 [0,1,0,1,0,0|1,0,0]=3 9662 B9R1.152 N[C@]1(C(=O)O)C[C@H](O)C1 Amb25297893 [0,1,0,1,0,0|1,0,0]=3 9663 B9R1.152 N[C@]1(C(=O)O)C[C@H](O)C1 Amb32679390 [0,1,0,1,0,0|1,0,0]=3 9664 B9R1.152 O=C(O)C1(F)CC(F)C1 Amb34162941 [0,1,0,1,0,0|1,0,0]=3 9665 B9R1.152 O=C(O)C1(F)CC(O)C1 Amb34142466 [0,1,0,1,0,0|1,0,0]=3 9666 B9R1.152 O=C(O)[C@]1(F)C[C@@H](O)C1 Amb34912853 [0,1,0,1,0,0|1,0,0]=3 9667 B9R1.152 O=C(O)[C@]1(F)C[C@H](O)C1 Amb34161934 [0,1,0,1,0,0|1,0,0]=3 9668 B9R1.152 O=C(O)[C@]1(O)C[C@@H](O)C1 Amb34147022 [0,1,0,1,0,0|1,0,0]=3 9669 B9R1.152 O=C(O)[C@]1(O)C[C@H](O)C1 Amb34136524 [0,1,0,1,0,0|1,0,0]=3 9670 B9R1.152 O=C1CC(F)(C(=O)O)C1 Amb34136578 [0,1,0,1,0,0|1,0,1]=4 9671 B9R1.153 CC1(C)C(N)CS1(=O)=O Amb24705061 [0,1,0,1,0,0|1,0,1]=4 9672 B9R1.153 CC1(C)C(N)CS1(=O)=O Amb32758753 [0,1,0,1,0,0|1,0,1]=4 9673 B9R1.153 CC1(C)[C@@H](N)CS1(=O)=O Amb25930277 [0,1,0,1,0,0|1,0,1]=4 9674 B9R1.153 CC1(C)[C@@H](N)CS1(=O)=O Amb32664092 [0,1,0,1,0,0|1,0,1]=4 9675 B9R1.153 CC1(O)CC(N)C1(C)C Amb30015274 [0,1,0,1,0,0|1,0,1]=4 9676 B9R1.153 CC1(O)CC(O)C1(C)C Amb34913899 [0,1,0,1,0,0|1,0,1]=4 9677 B9R1.164 CC(=O)C1CC(C)(C)C1 Amb24614703 [0,1,0,1,0,0|1,0,0]=3 9678 B9R1.164 CC(=O)C1CC(C)(Cl)C1 Amb26038046 [0,1,0,1,0,0|1,0,0]=3 9679 B9R1.164 CC(=O)C1CC(C)(O)C1 Amb25773446 [0,1,0,1,0,0|1,0,0]=3 9680 B9R1.164 CC(=O)C1CC(F)(F)C1 Amb24517327 [0,1,0,1,0,0|2,0,0]=4 9681 B9R1.164 CC(=O)N1CC(C)(F)C1 Amb28291780 [0,1,0,1,0,0|2,0,0]=4 9682 B9R1.164 CC(=O)N1CC(C)(N)C1 Amb24616829 [0,1,0,1,0,0|2,0,0]=4 9683 B9R1.164 CC(=O)[C@H]1C[C@](C)(Cl)C1 Amb27845269 [0,1,0,1,0,0|1,0,0]=3 9684 B9R1.164 CC(C)C1CC(C)(O)C1 Amb27240675 [0,1,0,1,0,0|1,0,1]=4 9685 B9R1.164 CC(C)C1CS(=O)(=O)O1 Amb24571158 [0,1,0,1,0,0|1,0,0]=3 9686 B9R1.164 CC1(C)C=C(C(=O)O)C1 Amb22405981 [0,1,0,1,0,0|0,0,1]=3 9687 B9R1.164 CC1(C)CC(B(O)O)C1 Amb33714658 [0,1,0,1,0,0|1,0,1]=4 9688 B9R1.164 CC1(C)CC(C(=O)O)C1 Amb33542624 [0,1,0,1,0,0|0,0,0]=2 9689 B9R1.164 CC1(C)CC(C(=O)O)N1 Amb24117447 [0,1,0,1,0,0|0,0,0]=2 9690 B9R1.164 CC1(C)CC(S(=O)Cl)C1 Amb32721003 [0,1,0,1,0,0|2,0,0]=4 9691 B9R1.164 CC1(C)CC(S(=O)[O-])C1 Amb32755817 [0,1,0,1,0,0|1,0,1]=4 9692 B9R1.164 CC1(C)CC(S(N)=O)C1 Amb32721004 [0,1,0,1,0,0|2,0,0]=4 9693 B9R1.164 CC1(C)CC([N+](=O)[O-])C1 Amb33299055 [0,1,0,1,0,0|1,0,1]=4 9694 B9R1.164 CC1(C)CN(C(N)=O)C1 Amb27951004 [0,1,0,1,0,0|2,0,0]=4 9695 B9R1.164 CC1(Cl)CC(C(=O)Cl)C1 Amb25337558 [0,1,0,1,0,0|1,0,0]=3 9696 B9R1.164 CC1(Cl)CC(C(=O)O)C1 Amb28364447 [0,1,0,1,0,0|0,0,0]=2 9697 B9R1.164 CC1(F)CC(C(=O)O)C1 Amb23439467 [0,1,0,1,0,0|0,0,0]=2 9698 B9R1.164 CC1(O)CC(C(=O)O)C1 Amb33545096 [0,1,0,1,0,0|0,0,0]=2 9699 B9R1.164 CC1(O)CN(C(N)=O)C1 Amb27816996 [0,1,0,1,0,0|2,0,0]=4 9700 B9R1.164 C[C@@H](O)[C@H]1CC(C)(C)O1 Amb27652848 [0,1,0,1,0,0|1,0,1]=4 9701 B9R1.164 C[C@H](O)[C@@H]1CC(C)(C)O1 Amb27443605 [0,1,0,1,0,0|1,0,1]=4 9702 B9R1.164 C[C@]1(Cl)C[C@@H](C(=O)O)C1 Amb27170444 [0,1,0,1,0,0|0,0,0]=2 9703 B9R1.164 C[C@]1(F)C[C@@H](C(=O)O)C1 Amb26394027 [0,1,0,1,0,0|0,0,0]=2 9704 B9R1.164 C[C@]1(F)C[C@H](C(=O)O)C1 Amb28350729 [0,1,0,1,0,0|0,0,0]=2 9705 B9R1.164 C[C@]1(O)C[C@@H](C(=O)O)C1 Amb23440037 [0,1,0,1,0,0|0,0,0]=2 9706 B9R1.164 C[C@]1(O)C[C@H](C(=O)O)C1 Amb23440038 [0,1,0,1,0,0|0,0,0]=2 9707 B9R1.164 C[C@]1(O)C[C@H](C(=O)[O-])C1 Amb34913076 [0,1,0,1,0,0|0,0,1]=3 9708 B9R1.164 NC(=O)C1CC(F)(F)C1 Amb22896712 [0,1,0,1,0,0|2,0,0]=4 9709 B9R1.164 O=C(Cl)C1CC(F)(F)C1 Amb26976510 [0,1,0,1,0,0|2,0,0]=4 9710 B9R1.164 O=C(O)C1CC(Br)(Br)C1 Amb32687813 [0,1,0,1,0,0|1,0,0]=3 9711 B9R1.164 O=C(O)C1CC(Cl)(Cl)C1 Amb27759559 [0,1,0,1,0,0|1,0,0]=3 9712 B9R1.164 O=C(O)C1CC(F)(F)C1 Amb6252612 [0,1,0,1,0,0|1,0,0]=3 9713 B9R1.164 O=C(O)C1CC(O)(O)C1 Amb27490909 [0,1,0,1,0,0|1,0,0]=3 9714 B9R1.164 O=C(O)C1CP(=O)(O)C1 Amb4297467 [0,1,0,1,0,0|2,0,0]=4 9715 B9R1.164 O=C(O)C1CS(=O)(=O)C1 Amb8439029 [0,1,0,1,0,0|2,0,0]=4 9716 B9R1.169 C=C(C)C1(N)CC1(C)C Amb33199246 [0,1,0,1,0,0|2,0,0]=4 9717 B9R1.169 CC(=O)C1(C)CC1(C)Cl Amb27669424 [0,1,0,1,0,0|2,0,0]=4 9718 B9R1.169 CC(=O)C1(C)OC1(C)C Amb25320076 [0,1,0,1,0,0|2,0,0]=4 9719 B9R1.169 CC(=O)C1(Cl)OC1(C)C Amb27836812 [0,1,0,1,0,0|2,0,0]=4 9720 B9R1.169 CC(=O)[C@]1(C)C[C@]1(C)Cl Amb27254650 [0,1,0,1,0,0|2,0,0]=4 9721 B9R1.169 CC1(Br)CC1(C)C(=O)O Amb27792919 [0,1,0,1,0,0|1,0,0]=3 9722 B9R1.169 CC1(C(=O)O)CC1(Br)Br Amb589413 [0,1,0,1,0,0|2,0,0]=4 9723 B9R1.169 CC1(C(=O)O)CC1(Cl)Cl Amb9703081 [0,1,0,1,0,0|2,0,0]=4 9724 B9R1.169 CC1(C(=O)O)CC1(F)Cl Amb24429152 [0,1,0,1,0,0|2,0,0]=4 9725 B9R1.169 CC1(C(=O)O)CC1(F)F Amb10606005 [0,1,0,1,0,0|2,0,0]=4 9726 B9R1.169 CC1(C)CC1(N)C(=O)O Amb35788491 [0,1,0,1,0,0|0,0,0]=2 9727 B9R1.169 CC1(C)CC1(N)C(=O)O Amb4296872 [0,1,0,1,0,0|0,0,0]=2 9728 B9R1.169 CC1(C)C[C@@]1(N)C(=O)O Amb4296946 [0,1,0,1,0,0|0,0,0]=2 9729 B9R1.169 CC1(C)C[C@@]1(N)C(N)=O Amb25887316 [0,1,0,1,0,0|1,0,0]=3 9730 B9R1.169 CC1(C)C[C@]1(N)C(N)=O Amb28254983 [0,1,0,1,0,0|1,0,0]=3 9731 B9R1.169 C[C@]1(Br)C[C@@]1(C)C(=O)O Amb27419957 [0,1,0,1,0,0|1,0,0]=3 9732 B9R1.169 NC1(C(=O)O)CC1(F)F Amb25233043 [0,1,0,1,0,0|2,0,0]=4 9733 B9R1.169 N[C@]1(C(=O)O)CC1(F)F Amb25874004 [0,1,0,1,0,0|2,0,0]=4 9734 B9R1.169 O=C(O)C1(F)CC1(F)F Amb27604177 [0,1,0,1,0,0|2,0,0]=4 9735 B9R1.47 CC1CC1CC(C)(C)O Amb33144864 [0,1,0,1,0,0|1,0,1]=4 9736 B9R1.47 CC1CC1CS(=O)(=O)Cl Amb25709771 [0,1,0,1,0,0|1,0,1]=4 9737 B9R1.47 CC1CC1CS(=O)(=O)F Amb33352217 [0,1,0,1,0,0|1,0,1]=4 9738 B9R1.47 CC1CC1CS(N)(=O)=O Amb25342147 [0,1,0,1,0,0|1,0,1]=4 9739 B9R1.47 NC1CC1CS(=O)(=O)O Amb28204099 [0,1,0,1,0,0|2,0,0]=4 9740 B9R1.51 CC(C)(C)C1CC(=O)C1 Amb24099390 [0,1,0,1,0,0|1,0,0]=3 9741 B9R1.51 CC(C)(C)C1CC(=O)N1 Amb25868873 [0,1,0,1,0,0|1,0,0]=3 9742 B9R1.51 CC(C)(C)C1CC(O)C1 Amb28042951 [0,1,0,1,0,0|1,0,1]=4 9743 B9R1.51 CC(C)(C)N1CC(=O)C1 Amb28061207 [0,1,0,1,0,0|2,0,0]=4 9744 B9R1.51 CC1CC(S(=O)(=O)Cl)C1 Amb26516207 [0,1,0,1,0,0|1,0,1]=4 9745 B9R1.51 CC1CC(S(=O)(=O)F)C1 Amb33352754 [0,1,0,1,0,0|1,0,1]=4 9746 B9R1.51 CC1CC(S(N)(=O)=O)C1 Amb25850805 [0,1,0,1,0,0|1,0,1]=4 9747 B9R1.51 CP(=O)(O)C1CC(N)C1 Amb27882645 [0,1,0,1,0,0|2,0,0]=4 9748 B9R1.51 O=C1CC(C(Cl)(Cl)Cl)O1 Amb4021864 [0,1,0,1,0,0|2,0,0]=4 9749 B9R1.51 O=C1C[C@@H](C(Cl)(Cl)Cl)O1 Amb27167972 [0,1,0,1,0,0|2,0,0]=4 9750 B9R1.51 O=C1C[C@H](C(Cl)(Cl)Cl)O1 Amb22350593 [0,1,0,1,0,0|2,0,0]=4 9751 B9R1.115 CC(C)(C)CCC1CO1 Amb33380798 [0,1,0,1,0,0|1,0,1]=4 9752 B9R1.115 CC(C)(O)CCC1CC1 Amb25777764 [0,1,0,1,0,0|1,0,1]=4 9753 B9R1.115 CS(=O)(=O)CCC1CC1 Amb27450215 [0,1,0,1,0,0|1,0,1]=4 9754 B9R1.115 NS(=O)(=O)CCC1CC1 Amb24478680 [0,1,0,1,0,0|1,0,1]=4 9755 B9R1.115 O=S(=O)(Cl)CCC1CC1 Amb22059472 [0,1,0,1,0,0|1,0,1]=4 9756 B9R1.115 O=S(=O)(F)CCC1CC1 Amb27598648 [0,1,0,1,0,0|1,0,1]=4 9757 B9R1.142 CC1(C)CC1S(=O)(=O)Cl Amb33803843 [0,1,0,1,0,0|1,0,1]=4 9758 B9R1.146 CC1(C)CCC(C)(C)O1 Amb4477451 [0,1,0,1,0,0|1,0,1]=4 9759 B9R1.146 CC1(N)CCS(=O)(=O)C1 Amb17913039 [0,1,0,1,0,0|1,0,1]=4 9760 B9R1.146 CC1(N)CCS(=O)(=O)C1 Amb5716904 [0,1,0,1,0,0|1,0,1]=4 9761 B9R1.146 CC1(O)CCS(=O)(=O)C1 Amb27465349 [0,1,0,1,0,0|1,0,1]=4 9762 B9R1.146 CC1([NH3+])CCS(=O)(=O)C1 Amb5716910 [0,1,0,1,0,0|1,0,1]=4 9763 B9R1.146 C[C@]1(N)CCS(=O)(=O)C1 Amb30594259 [0,1,0,1,0,0|1,0,1]=4 9764 B9R2.19 O=C1CCC2CC1C2 Amb33547757 [0,0,0,2,0,0|1,0,0]=3 9765 B9R2.19 O=C1CCC2CC1O2 Amb22364973 [0,0,0,2,0,0|2,0,0]=4 9766 B9R2.19 O=C1NCC2CC1C2 Amb25221783 [0,0,0,2,0,0|1,0,0]=3 9767 B9R2.19 O=C1NCC2CC1N2 Amb27801865 [0,0,0,2,0,0|2,0,0]=4 9768 B9R2.19 O=C1NC[C@H]2C[C@@H]1O2 Amb27841075 [0,0,0,2,0,0|2,0,0]=4 9769 B9R2.19 OC1CCC2CC1C2 Amb27423100 [0,0,0,2,0,0|1,0,1]=4 9770 B9R2.19 O[C@@H]1CCC2CC1C2 Amb27461153 [0,0,0,2,0,0|1,0,1]=4 9771 B9R2.21 CC1CCC2OC2C1 Amb1141335 [0,0,0,2,0,0|1,0,1]=4 9772 B9R2.21 O=C1C=CC2CC2C1 Amb28284686 [0,0,0,2,0,0|1,0,1]=4 9773 B9R2.21 O=C1CC2CC2CN1 Amb33716335 [0,0,0,2,0,0|1,0,0]=3 9774 B9R2.21 O=C1CCC2CC2C1 Amb28316224 [0,0,0,2,0,0|1,0,0]=3 9775 B9R2.21 O=C1CCC2CC2N1 Amb27636987 [0,0,0,2,0,0|1,0,0]=3 9776 B9R2.21 O=C1CCC2CC2O1 Amb27422131 [0,0,0,2,0,0|0,0,0]=2 9777 B9R2.21 O=C1NC2CC2CO1 Amb28247932 [0,0,0,2,0,0|1,0,0]=3 9778 B9R2.21 OC1CC2CC2CO1 Amb28065974 [0,0,0,2,0,0|0,0,2]=4 9779 B9R2.21 OC1CC[C@@H]2C[C@@H]2C1 Amb27857686 [0,0,0,2,0,0|1,0,1]=4 9780 B9R2.21 O[C@H]1CC[C@H]2C[C@H]2C1 Amb27978320 [0,0,0,2,0,0|1,0,1]=4 9781 B9R2.35 O=C1NC2C(O)CC12 Amb28368878 [0,0,0,2,0,0|2,0,0]=4 9782 B9R2.40 CC12CCC(=O)C1O2 Amb28048967 [0,0,0,2,0,0|2,0,0]=4 9783 B9R2.40 C[C@@]12CC[C@@H](O)[C@@H]1C2 Amb28079166 [0,0,0,2,0,0|1,0,1]=4 9784 B9R2.40 C[C@@]12CNC(=O)[C@@H]1C2 Amb27975818 [0,0,0,2,0,0|1,0,0]=3 9785 B9R2.54 C[C@@H]1[C@@H]2CC(O)C[C@@H]21 Amb27472588 [0,0,0,2,0,0|1,0,1]=4 9786 B9R2.54 C[C@@H]1[C@@H]2C[C@H](O)C[C@@H]21 Amb28346063 [0,0,0,2,0,0|1,0,1]=4 9787 B9R2.54 C[C@H]1[C@@H]2C[C@@H](O)C[C@H]12 Amb27452356 [0,0,0,2,0,0|1,0,1]=4 9788 B9R2.110 OC12CCC(CC1)C2 Amb22235809 [0,0,0,2,0,0|1,0,1]=4 9789 B9R2.12 CC1CC1CC2CO2 Amb33144969 [0,0,0,2,0,0|1,0,1]=4 9790 B9R2.38 CC12CC(=O)CC1C2 Amb24357249 [0,0,0,2,0,0|1,0,0]=3 9791 B9R2.38 C[C@]12C[C@H]1C[C@@H](O)C2 Amb28053792 [0,0,0,2,0,0|1,0,1]=4 9792 B9R2.119 CC1(C)CC2OC2C1 Amb28137746 [0,0,0,2,0,0|1,0,1]=4 9793 B9R2.119 O=S1(=O)CC2CC2C1 Amb32679441 [0,0,0,2,0,0|1,0,1]=4 9794 B9R2.119 O=S1(=O)C[C@H]2C[C@H]2C1 Amb32680426 [0,0,0,2,0,0|1,0,1]=4 9795 B9R2.150 CC(=O)[C@@H]1C[C@@H]2C[C@@H]21 Amb25179150 [0,0,0,2,0,0|1,0,0]=3 9796 B9R2.150 CC(=O)[C@H]1C[C@@H]2C[C@@H]21 Amb27640618 [0,0,0,2,0,0|1,0,0]=3 9797 B9R2.150 O=C(O)C1CC2CC21 Amb25049722 [0,0,0,2,0,0|0,0,0]=2 9798 B9R2.41 O=C1CC(C2CC2)C1 Amb25370879 [0,0,0,2,0,0|1,0,0]=3 9799 B9R2.41 O=C1CC(C2CO2)O1 Amb28250347 [0,0,0,2,0,0|1,0,0]=3 9800 B9R2.133 O=C1CC2(Cl)CC1C2 Amb28316134 [0,0,0,2,0,0|2,0,0]=4 9801 B9R2.142 CC(=O)C12CC1(C)C2 Amb27948643 [0,0,0,2,0,0|1,0,0]=3 9802 B9R2.145 CC(=O)C12CC(C1)C2 Amb25093716 [0,0,0,2,0,0|1,0,0]=3 9803 B9R2.145 N=C(N)C12CC(C1)C2 Amb34141186 [0,0,0,2,0,0|2,0,0]=4 9804 B9R2.145 NC(=O)C12CC(C1)C2 Amb24058180 [0,0,0,2,0,0|1,0,0]=3 9805 B9R2.145 O=C(O)C12CC(C1)C2 Amb22493631 [0,0,0,2,0,0|0,0,0]=2 9806 B9R2.69 C1CC1CCC2CO2 Amb27427391 [0,0,0,2,0,0|1,0,1]=4 9807 B9R2.120 O=S1(=O)CCC2CC21 Amb32676812 [0,0,0,2,0,0|1,0,1]=4 9808 B9R2.120 O=S1(=O)CC[C@@H]2C[C@@H]21 Amb32679242 [0,0,0,2,0,0|1,0,1]=4 9809 B9R2.139 CC1CCC2(CO2)C1 Amb25678922 [0,0,0,2,0,0|1,0,1]=4 9810 B9R2.139 O=C1CC2(CC2)CN1 Amb25935275 [0,0,0,2,0,0|2,0,0]=4 9811 B9R2.139 O=C1CC2(CC2)CO1 Amb25662215 [0,0,0,2,0,0|2,0,0]=4 9812 B9R2.139 O=C1CCC2(CC2)N1 Amb16186647 [0,0,0,2,0,0|1,0,0]=3 9813 B9R2.139 O=C1COC2(CC2)C1 Amb35693021 [0,0,0,2,0,0|2,0,0]=4 9814 B9R2.139 O=C1NC2(CC2)CO1 Amb24572471 [0,0,0,2,0,0|2,0,0]=4 9815 B9R2.143 CC(=O)C1CC12CC2 Amb24725286 [0,0,0,2,0,0|1,0,0]=3 9816 B9R2.143 CC(=O)C1OC12CC2 Amb26338327 [0,0,0,2,0,0|2,0,0]=4 9817 B9R2.143 CC(O)C1CC12CC2 Amb28344703 [0,0,0,2,0,0|1,0,1]=4 9818 B9R2.143 C[C@@H](O)C1CC12CC2 Amb32675111 [0,0,0,2,0,0|1,0,1]=4 9819 B9R2.143 C[C@H](O)C1CC12CC2 Amb35607819 [0,0,0,2,0,0|1,0,1]=4 9820 B9R2.143 N=C(N)C1CC12CC2 Amb26566671 [0,0,0,2,0,0|2,0,0]=4 9821 B9R2.143 N=C(N)C1CC12CC2 Amb33804152 [0,0,0,2,0,0|2,0,0]=4 9822 B9R2.143 NC(=S)C1CC12CC2 Amb33328378 [0,0,0,2,0,0|1,1,0]=4 9823 B9R2.143 O=C(O)C1CC12CC2 Amb8010165 [0,0,0,2,0,0|0,0,0]=2 9824 B9R2.143 O=C(O)[C@@H]1CC12CC2 Amb28071386 [0,0,0,2,0,0|0,0,0]=2 9825 B5R0.5 C=C(Br)C(C)C Amb22583736 [0,0,0,0,2,0|2,0,0]=4 9826 B5R0.5 C=C(C)C(=O)O Amb6608998 [0,0,0,0,2,0|0,0,2]=4 9827 B5R0.5 C=C(C)C(C)C Amb8513830 [0,0,0,0,2,0|2,0,0]=4 9828 B5R0.5 CC(=O)C(=O)O Amb932807 [0,0,0,0,2,0|1,0,1]=4 9829 B5R0.5 CC(=O)C(C)Br Amb8384405 [0,0,0,0,2,0|2,0,0]=4 9830 B5R0.5 CC(=O)C(C)C Amb4605987 [0,0,0,0,2,0|1,0,0]=3 9831 B5R0.5 CC(=O)C(C)Cl Amb9702838 [0,0,0,0,2,0|2,0,0]=4 9832 B5R0.5 CC(=O)C(C)F Amb10841897 [0,0,0,0,2,0|2,0,0]=4 9833 B5R0.5 CC(=O)C(C)I Amb28315734 [0,0,0,0,2,0|2,0,0]=4 9834 B5R0.5 CC(=O)C(C)N Amb17593029 [0,0,0,0,2,0|2,0,0]=4 9835 B5R0.5 CC(=O)C(C)N Amb19148817 [0,0,0,0,2,0|2,0,0]=4 9836 B5R0.5 CC(=O)C(C)O Amb6608962 [0,0,0,0,2,0|2,0,0]=4 9837 B5R0.5 CC(=O)C(C)S Amb8393169 [0,0,0,0,2,0|2,0,0]=4 9838 B5R0.5 CC(=O)N(C)C Amb24323347 [0,0,0,0,2,0|2,0,0]=4 9839 B5R0.5 CC(=O)N(C)C Amb2793066 [0,0,0,0,2,0|2,0,0]=4 9840 B5R0.5 CC(=O)[C@@H](C)N Amb22748924 [0,0,0,0,2,0|2,0,0]=4 9841 B5R0.5 CC(=O)[C@H](C)N Amb26418661 [0,0,0,0,2,0|2,0,0]=4 9842 B5R0.5 CC(=S)C(=O)O Amb27424126 [0,0,0,0,2,0|1,0,1]=4 9843 B5R0.5 CC(Br)C(=O)Br Amb7969424 [0,0,0,0,2,0|2,0,0]=4 9844 B5R0.5 CC(Br)C(=O)Cl Amb6296592 [0,0,0,0,2,0|2,0,0]=4 9845 B5R0.5 CC(Br)C(=O)O Amb2795764 [0,0,0,0,2,0|1,0,0]=3 9846 B5R0.5 CC(Br)C(N)=O Amb2779903 [0,0,0,0,2,0|2,0,0]=4 9847 B5R0.5 CC(C)B(O)O Amb2447044 [0,0,0,0,2,0|1,0,1]=4 9848 B5R0.5 CC(C)C(=N)N Amb2695035 [0,0,0,0,2,0|2,0,0]=4 9849 B5R0.5 CC(C)C(=N)N Amb2725173 [0,0,0,0,2,0|2,0,0]=4 9850 B5R0.5 CC(C)C(=O)Br Amb22731066 [0,0,0,0,2,0|1,0,0]=3 9851 B5R0.5 CC(C)C(=O)Cl Amb3939052 [0,0,0,0,2,0|1,0,0]=3 9852 B5R0.5 CC(C)C(=O)F Amb25848493 [0,0,0,0,2,0|1,0,0]=3 9853 B5R0.5 CC(C)C(=O)I Amb26992316 [0,0,0,0,2,0|1,0,0]=3 9854 B5R0.5 CC(C)C(=O)O Amb3939822 [0,0,0,0,2,0|0,0,0]=2 9855 B5R0.5 CC(C)C(=O)S Amb33482574 [0,0,0,0,2,0|0,1,0]=3 9856 B5R0.5 CC(C)C(C)O Amb9748261 [0,0,0,0,2,0|1,0,1]=4 9857 B5R0.5 CC(C)C(N)=O Amb1153145 [0,0,0,0,2,0|1,0,0]=3 9858 B5R0.5 CC(C)C(N)=S Amb6242688 [0,0,0,0,2,0|1,1,0]=4 9859 B5R0.5 CC(C)N(=O)=O Amb8395293 [0,0,0,0,2,0|1,0,1]=4 9860 B5R0.5 CC(C)N(=O)O Amb33789630 [0,0,0,0,2,0|1,0,0]=3 9861 B5R0.5 CC(C)S(=O)Cl Amb27859539 [0,0,0,0,2,0|2,0,0]=4 9862 B5R0.5 CC(C)S(=O)O Amb27245066 [0,0,0,0,2,0|1,0,0]=3 9863 B5R0.5 CC(C)S(=O)[O-] Amb19929129 [0,0,0,0,2,0|1,0,1]=4 9864 B5R0.5 CC(C)S(N)=O Amb25675545 [0,0,0,0,2,0|2,0,0]=4 9865 B5R0.5 CC(C)[C@@H](C)O Amb13952942 [0,0,0,0,2,0|1,0,1]=4 9866 B5R0.5 CC(C)[C@H](C)O Amb6366846 [0,0,0,0,2,0|1,0,1]=4 9867 B5R0.5 CC(C)[N+](=O)[O-] Amb6608812 [0,0,0,0,2,0|1,0,1]=4 9868 B5R0.5 CC(Cl)C(=O)Cl Amb9703139 [0,0,0,0,2,0|2,0,0]=4 9869 B5R0.5 CC(Cl)C(=O)F Amb27863699 [0,0,0,0,2,0|2,0,0]=4 9870 B5R0.5 CC(Cl)C(=O)O Amb3940363 [0,0,0,0,2,0|1,0,0]=3 9871 B5R0.5 CC(Cl)C(N)=O Amb9745753 [0,0,0,0,2,0|2,0,0]=4 9872 B5R0.5 CC(Cl)S(=O)O Amb27983761 [0,0,0,0,2,0|2,0,0]=4 9873 B5R0.5 CC(F)C(=O)O Amb10605770 [0,0,0,0,2,0|1,0,0]=3 9874 B5R0.5 CC(F)C(N)=O Amb28248497 [0,0,0,0,2,0|2,0,0]=4 9875 B5R0.5 CC(I)C(=O)O Amb26450528 [0,0,0,0,2,0|1,0,0]=3 9876 B5R0.5 CC(I)C(N)=O Amb25684673 [0,0,0,0,2,0|2,0,0]=4 9877 B5R0.5 CC(N)C(=O)O Amb32724352 [0,0,0,0,2,0|1,0,0]=3 9878 B5R0.5 CC(N)C(=O)O Amb5716847 [0,0,0,0,2,0|1,0,0]=3 9879 B5R0.5 CC(N)C(=O)S Amb27175379 [0,0,0,0,2,0|1,1,0]=4 9880 B5R0.5 CC(N)C(N)=O Amb21958673 [0,0,0,0,2,0|2,0,0]=4 9881 B5R0.5 CC(N)C(N)=O Amb33532935 [0,0,0,0,2,0|2,0,0]=4 9882 B5R0.5 CC(O)C(=O)O Amb9703100 [0,0,0,0,2,0|1,0,0]=3 9883 B5R0.5 CC(O)C(=O)[O-] Amb3499440 [0,0,0,0,2,0|1,0,1]=4 9884 B5R0.5 CC(O)C(=O)[O-] Amb9787591 [0,0,0,0,2,0|1,0,1]=4 9885 B5R0.5 CC(O)C(N)=O Amb6394657 [0,0,0,0,2,0|2,0,0]=4 9886 B5R0.5 CC(S)C(=O)O Amb6608753 [0,0,0,0,2,0|1,0,0]=3 9887 B5R0.5 CN(C)C(=O)Cl Amb2793056 [0,0,0,0,2,0|2,0,0]=4 9888 B5R0.5 CN(C)C(=O)O Amb22348477 [0,0,0,0,2,0|1,0,0]=3 9889 B5R0.5 CN(C)C(N)=O Amb2604398 [0,0,0,0,2,0|2,0,0]=4 9890 B5R0.5 C[C@@H](Br)C(=O)Br Amb27455066 [0,0,0,0,2,0|2,0,0]=4 9891 B5R0.5 C[C@@H](Br)C(=O)Cl Amb26395930 [0,0,0,0,2,0|2,0,0]=4 9892 B5R0.5 C[C@@H](Br)C(=O)O Amb8515030 [0,0,0,0,2,0|1,0,0]=3 9893 B5R0.5 C[C@@H](Cl)C(=O)Cl Amb28140701 [0,0,0,0,2,0|2,0,0]=4 9894 B5R0.5 C[C@@H](Cl)C(=O)O Amb2725594 [0,0,0,0,2,0|1,0,0]=3 9895 B5R0.5 C[C@@H](I)C(=O)O Amb27878762 [0,0,0,0,2,0|1,0,0]=3 9896 B5R0.5 C[C@@H](I)C(N)=O Amb27863419 [0,0,0,0,2,0|2,0,0]=4 9897 B5R0.5 C[C@@H](N)C(=O)O Amb3940457 [0,0,0,0,2,0|1,0,0]=3 9898 B5R0.5 C[C@@H](N)C(N)=O Amb2371905 [0,0,0,0,2,0|2,0,0]=4 9899 B5R0.5 C[C@@H](N)C(N)=O Amb2778751 [0,0,0,0,2,0|2,0,0]=4 9900 B5R0.5 C[C@@H](O)C(=O)Cl Amb28350419 [0,0,0,0,2,0|2,0,0]=4 9901 B5R0.5 C[C@@H](O)C(=O)O Amb6600026 [0,0,0,0,2,0|1,0,0]=3 9902 B5R0.5 C[C@@H](O)C(=O)[O-] Amb22350432 [0,0,0,0,2,0|1,0,1]=4 9903 B5R0.5 C[C@@H](O)C(=O)[O-] Amb8514494 [0,0,0,0,2,0|1,0,1]=4 9904 B5R0.5 C[C@@H](O)C(N)=O Amb3939680 [0,0,0,0,2,0|2,0,0]=4 9905 B5R0.5 C[C@H](Br)C(=O)O Amb8515029 [0,0,0,0,2,0|1,0,0]=3 9906 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [0,0,0,0,2,0|2,0,0]=4 9907 B5R0.5 C[C@H](Cl)C(=O)F Amb28138044 [0,0,0,0,2,0|2,0,0]=4 9908 B5R0.5 C[C@H](Cl)C(=O)O Amb17776586 [0,0,0,0,2,0|1,0,0]=3 9909 B5R0.5 C[C@H](F)C(=O)O Amb27216697 [0,0,0,0,2,0|1,0,0]=3 9910 B5R0.5 C[C@H](N)C(=O)O Amb33780861 [0,0,0,0,2,0|1,0,0]=3 9911 B5R0.5 C[C@H](N)C(=O)O Amb6298336 [0,0,0,0,2,0|1,0,0]=3 9912 B5R0.5 C[C@H](N)C(=O)S Amb28315892 [0,0,0,0,2,0|1,1,0]=4 9913 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [0,0,0,0,2,0|2,0,0]=4 9914 B5R0.5 C[C@H](N)C(N)=O Amb2371522 [0,0,0,0,2,0|2,0,0]=4 9915 B5R0.5 C[C@H](N)C(N)=O Amb2778752 [0,0,0,0,2,0|2,0,0]=4 9916 B5R0.5 C[C@H](N)C(N)=O Amb33822632 [0,0,0,0,2,0|2,0,0]=4 9917 B5R0.5 C[C@H](O)C(=O)O Amb8386374 [0,0,0,0,2,0|1,0,0]=3 9918 B5R0.5 C[C@H](O)C(=O)[O-] Amb17772234 [0,0,0,0,2,0|1,0,1]=4 9919 B5R0.5 C[C@H](O)C(=O)[O-] Amb8515200 [0,0,0,0,2,0|1,0,1]=4 9920 B5R0.5 C[C@H](O)C(N)=O Amb3939676 [0,0,0,0,2,0|2,0,0]=4 9921 B5R0.5 C[C@H](S)C(=O)O Amb25147510 [0,0,0,0,2,0|1,0,0]=3 9922 B5R0.5 NC(Br)C(=O)O Amb25724348 [0,0,0,0,2,0|2,0,0]=4 9923 B5R0.5 NC(O)C(=O)O Amb24663706 [0,0,0,0,2,0|2,0,0]=4 9924 B5R0.5 NC(S)C(=O)O Amb27253385 [0,0,0,0,2,0|2,0,0]=4 9925 B5R0.5 N[C@@H](S)C(=O)O Amb27788398 [0,0,0,0,2,0|2,0,0]=4 9926 B5R0.5 O=C(O)C(Br)I Amb17610018 [0,0,0,0,2,0|2,0,0]=4 9927 B5R0.5 O=C(O)C(Cl)Cl Amb6891960 [0,0,0,0,2,0|2,0,0]=4 9928 B5R0.5 O=C(O)C(Cl)I Amb17610937 [0,0,0,0,2,0|2,0,0]=4 9929 B5R0.5 O=C(O)C(F)Br Amb10841090 [0,0,0,0,2,0|2,0,0]=4 9930 B5R0.5 O=C(O)C(F)Cl Amb10838714 [0,0,0,0,2,0|2,0,0]=4 9931 B5R0.5 O=C(O)C(F)F Amb1953492 [0,0,0,0,2,0|2,0,0]=4 9932 B5R0.5 O=C(O)C(F)I Amb10838458 [0,0,0,0,2,0|2,0,0]=4 9933 B5R0.5 O=C(O)C(I)I Amb17612865 [0,0,0,0,2,0|2,0,0]=4 9934 B5R0.5 O=C(O)C(O)O Amb6608986 [0,0,0,0,2,0|2,0,0]=4 9935 B5R0.5 O=C(O)[C@@H](F)Cl Amb26559563 [0,0,0,0,2,0|2,0,0]=4 9936 B5R0.5 O=C(O)[C@@H](F)I Amb27827825 [0,0,0,0,2,0|2,0,0]=4 9937 B5R0.5 O=C(O)[C@H](F)Br Amb28200717 [0,0,0,0,2,0|2,0,0]=4 9938 B9R0.55 C=C(Br)CNOCC(C)C Amb27760290 [0,0,0,0,0,2|2,0,0]=4 9939 B9R0.55 C=C(Br)CSCCC(C)C Amb27254768 [0,0,0,0,0,2|2,0,0]=4 9940 B9R0.55 C=C(C)C#CCCC(C)C Amb2721457 [0,0,0,0,0,2|2,0,0]=4 9941 B9R0.55 C=C(C)CCCNC(C)C Amb27806611 [0,0,0,0,0,2|2,0,0]=4 9942 B9R0.55 C=C(C)CC\C=C\C(=O)O Amb27253611 [0,0,0,0,0,2|0,0,2]=4 9943 B9R0.55 C=C(C)COCCC(=O)O Amb27882463 [0,0,0,0,0,2|0,0,2]=4 9944 B9R0.55 C=C(C)CONCC(=O)O Amb27969663 [0,0,0,0,0,2|0,0,2]=4 9945 B9R0.55 C=C(Cl)CNCCC(C)C Amb18800600 [0,0,0,0,0,2|2,0,0]=4 9946 B9R0.55 CC(=N)NCCCC(C)C Amb27260700 [0,0,0,0,0,2|2,0,0]=4 9947 B9R0.55 CC(=O)CCCC=C(C)C Amb28053965 [0,0,0,0,0,2|1,0,1]=4 9948 B9R0.55 CC(=O)CCCCC(=O)O Amb3939946 [0,0,0,0,0,2|1,0,1]=4 9949 B9R0.55 CC(=O)CCCCC(C)O Amb27838002 [0,0,0,0,0,2|2,0,0]=4 9950 B9R0.55 CC(=O)CCCCN(C)C Amb9659130 [0,0,0,0,0,2|2,0,0]=4 9951 B9R0.55 CC(=O)CCCNC(C)C Amb27856985 [0,0,0,0,0,2|1,0,0]=3 9952 B9R0.55 CC(=O)CCCOC(C)C Amb9659686 [0,0,0,0,0,2|1,0,0]=3 9953 B9R0.55 CC(=O)CCNCC(=O)O Amb32675828 [0,0,0,0,0,2|1,0,1]=4 9954 B9R0.55 CC(=O)CCNCC(C)C Amb26410166 [0,0,0,0,0,2|1,0,0]=3 9955 B9R0.55 CC(=O)CCOCC(=O)O Amb27241199 [0,0,0,0,0,2|1,0,1]=4 9956 B9R0.55 CC(=O)CCOCC(C)C Amb7764634 [0,0,0,0,0,2|1,0,0]=3 9957 B9R0.55 CC(=O)CCSCC(=O)O Amb24443138 [0,0,0,0,0,2|1,0,1]=4 9958 B9R0.55 CC(=O)CCSCC(C)C Amb9283499 [0,0,0,0,0,2|1,0,0]=3 9959 B9R0.55 CC(=O)CC\C=C\C(=O)O Amb17593589 [0,0,0,0,0,2|1,0,1]=4 9960 B9R0.55 CC(=O)COCC=C(C)C Amb27951594 [0,0,0,0,0,2|1,0,1]=4 9961 B9R0.55 CC(=O)CSCC=C(C)C Amb28340640 [0,0,0,0,0,2|1,0,1]=4 9962 B9R0.55 CC(=O)CSCCC(C)C Amb27614926 [0,0,0,0,0,2|1,0,0]=3 9963 B9R0.55 CC(=O)CSCCN(C)C Amb27485248 [0,0,0,0,0,2|2,0,0]=4 9964 B9R0.55 CC(=O)NCCCC(=O)O Amb2778749 [0,0,0,0,0,2|1,0,1]=4 9965 B9R0.55 CC(=O)NCCCC(C)O Amb28076577 [0,0,0,0,0,2|2,0,0]=4 9966 B9R0.55 CC(=O)NCCCN(C)C Amb3358094 [0,0,0,0,0,2|2,0,0]=4 9967 B9R0.55 CC(=O)NCCNC(C)C Amb6732592 [0,0,0,0,0,2|1,0,0]=3 9968 B9R0.55 CC(=O)NCOCC(C)C Amb28199237 [0,0,0,0,0,2|1,0,0]=3 9969 B9R0.55 CC(=O)NOCCC(=O)O Amb27252126 [0,0,0,0,0,2|1,0,1]=4 9970 B9R0.55 CC(=O)OCCCC(=O)O Amb24480808 [0,0,0,0,0,2|1,0,1]=4 9971 B9R0.55 CC(=O)OCCCC(C)Br Amb27643403 [0,0,0,0,0,2|2,0,0]=4 9972 B9R0.55 CC(=O)OCCCC(C)Cl Amb27645429 [0,0,0,0,0,2|2,0,0]=4 9973 B9R0.55 CC(=O)OCCC[C@@H](C)O Amb27775430 [0,0,0,0,0,2|2,0,0]=4 9974 B9R0.55 CC(=O)OCCNC(C)C Amb28344226 [0,0,0,0,0,2|1,0,0]=3 9975 B9R0.55 CC(=O)OCCOC(C)C Amb25662885 [0,0,0,0,0,2|1,0,0]=3 9976 B9R0.55 CC(=O)OCCOC(C)Cl Amb27433920 [0,0,0,0,0,2|2,0,0]=4 9977 B9R0.55 CC(=O)SCCCC(=O)O Amb26356321 [0,0,0,0,0,2|1,0,1]=4 9978 B9R0.55 CC(=O)\C=C/NCC(C)C Amb26887251 [0,0,0,0,0,2|1,0,1]=4 9979 B9R0.55 CC(=O)\C=C\CCC(C)C Amb25111718 [0,0,0,0,0,2|1,0,0]=3 9980 B9R0.55 CC(=O)\C=C\CCN(C)C Amb33271941 [0,0,0,0,0,2|2,0,0]=4 9981 B9R0.55 CC(=O)\C=C\COC(C)C Amb33274083 [0,0,0,0,0,2|1,0,1]=4 9982 B9R0.55 CC(=O)\C=C\NCC(C)C Amb25961808 [0,0,0,0,0,2|1,0,1]=4 9983 B9R0.55 CC(Br)COCCC(=O)O Amb28255646 [0,0,0,0,0,2|1,0,0]=3 9984 B9R0.55 CC(C)=CCCCC(N)=O Amb27390535 [0,0,0,0,0,2|1,0,1]=4 9985 B9R0.55 CC(C)=CCCNC(N)=O Amb27596311 [0,0,0,0,0,2|1,0,1]=4 9986 B9R0.55 CC(C)=CCOCC(=O)O Amb18644115 [0,0,0,0,0,2|0,0,1]=3 9987 B9R0.55 CC(C)=CCSCC(N)=O Amb27832078 [0,0,0,0,0,2|1,0,1]=4 9988 B9R0.55 CC(C)=C\C=C\CC(=O)O Amb27473342 [0,0,0,0,0,2|0,0,2]=4 9989 B9R0.55 CC(C)=NOCCC(=O)O Amb27596064 [0,0,0,0,0,2|0,0,1]=3 9990 B9R0.55 CC(C)C#C\C=C/C(=O)O Amb27392234 [0,0,0,0,0,2|0,0,2]=4 9991 B9R0.55 CC(C)C=C=CCC(=O)O Amb27952365 [0,0,0,0,0,2|0,0,1]=3 9992 B9R0.55 CC(C)CC#CCC(=O)O Amb27754079 [0,0,0,0,0,2|0,0,0]=2 9993 B9R0.55 CC(C)CCC#CC(=O)O Amb27494024 [0,0,0,0,0,2|0,0,0]=2 9994 B9R0.55 CC(C)CCCCB(O)O Amb27615027 [0,0,0,0,0,2|1,0,1]=4 9995 B9R0.55 CC(C)CCCCC(=O)Cl Amb25067489 [0,0,0,0,0,2|1,0,0]=3 9996 B9R0.55 CC(C)CCCCC(=O)O Amb10576144 [0,0,0,0,0,2|0,0,0]=2 9997 B9R0.55 CC(C)CCCCC(N)=O Amb2613088 [0,0,0,0,0,2|1,0,0]=3 9998 B9R0.55 CC(C)CCCCC(O)O Amb27761556 [0,0,0,0,0,2|0,0,2]=4 9999 B9R0.55 CC(C)CCCNC(=N)N Amb27784893 [0,0,0,0,0,2|2,0,0]=4 10000 B9R0.55 CC(C)CCCOC(=O)Cl Amb25885760 [0,0,0,0,0,2|1,0,0]=3 10001 B9R0.55 CC(C)CCNCC(=O)O Amb1111021 [0,0,0,0,0,2|0,0,0]=2 10002 B9R0.55 CC(C)CCNCC(N)=O Amb1112311 [0,0,0,0,0,2|1,0,0]=3 10003 B9R0.55 CC(C)CCNC[C@@H](C)O Amb27812132 [0,0,0,0,0,2|1,0,1]=4 10004 B9R0.55 CC(C)CCOCC(=O)Cl Amb27441228 [0,0,0,0,0,2|1,0,0]=3 10005 B9R0.55 CC(C)CCOCC(=O)O Amb6268007 [0,0,0,0,0,2|0,0,0]=2 10006 B9R0.55 CC(C)CCOCC(N)=S Amb6262163 [0,0,0,0,0,2|1,1,0]=4 10007 B9R0.55 CC(C)CCOC[C@@H](C)O Amb28145728 [0,0,0,0,0,2|1,0,1]=4 10008 B9R0.55 CC(C)CCONC(N)=O Amb2899786 [0,0,0,0,0,2|1,0,0]=3 10009 B9R0.55 CC(C)CCSCC(=O)O Amb1137397 [0,0,0,0,0,2|0,0,0]=2 10010 B9R0.55 CC(C)CC\C=C\B(O)O Amb22168996 [0,0,0,0,0,2|1,0,1]=4 10011 B9R0.55 CC(C)CC\C=C\C(=O)O Amb17593603 [0,0,0,0,0,2|0,0,0]=2 10012 B9R0.55 CC(C)CNCCC(=O)O Amb10609230 [0,0,0,0,0,2|0,0,0]=2 10013 B9R0.55 CC(C)CNCCC(=O)O Amb2372367 [0,0,0,0,0,2|0,0,0]=2 10014 B9R0.55 CC(C)CNCCC(N)=S Amb17232337 [0,0,0,0,0,2|1,1,0]=4 10015 B9R0.55 CC(C)COCCC(=N)N Amb6267452 [0,0,0,0,0,2|2,0,0]=4 10016 B9R0.55 CC(C)COCCC(=O)O Amb6280020 [0,0,0,0,0,2|0,0,0]=2 10017 B9R0.55 CC(C)COCCC(N)=O Amb27463674 [0,0,0,0,0,2|1,0,0]=3 10018 B9R0.55 CC(C)COCCC(N)=S Amb6265253 [0,0,0,0,0,2|1,1,0]=4 10019 B9R0.55 CC(C)COCSC(=N)N Amb27598002 [0,0,0,0,0,2|2,0,0]=4 10020 B9R0.55 CC(C)CONC[C@@H](C)O Amb28200140 [0,0,0,0,0,2|1,0,1]=4 10021 B9R0.55 CC(C)CONC[C@H](C)O Amb27859515 [0,0,0,0,0,2|1,0,1]=4 10022 B9R0.55 CC(C)CSCCC(=N)N Amb7787496 [0,0,0,0,0,2|2,0,0]=4 10023 B9R0.55 CC(C)CSCCC(=O)O Amb6278798 [0,0,0,0,0,2|0,0,0]=2 10024 B9R0.55 CC(C)CSCCC(N)=S Amb17503256 [0,0,0,0,0,2|1,1,0]=4 10025 B9R0.55 CC(C)CSSCC(=O)O Amb27865411 [0,0,0,0,0,2|0,0,0]=2 10026 B9R0.55 CC(C)C\C=C\CC(C)O Amb27968433 [0,0,0,0,0,2|1,0,1]=4 10027 B9R0.55 CC(C)NCCCC(=O)O Amb1111231 [0,0,0,0,0,2|0,0,0]=2 10028 B9R0.55 CC(C)NCCCC(=O)O Amb528115 [0,0,0,0,0,2|0,0,0]=2 10029 B9R0.55 CC(C)NC\C=C\C(=O)O Amb27601688 [0,0,0,0,0,2|0,0,1]=3 10030 B9R0.55 CC(C)OCC#CC(N)=O Amb33495812 [0,0,0,0,0,2|1,0,1]=4 10031 B9R0.55 CC(C)OCCCC(=N)N Amb6270622 [0,0,0,0,0,2|2,0,0]=4 10032 B9R0.55 CC(C)OCCCC(=O)O Amb6274334 [0,0,0,0,0,2|0,0,0]=2 10033 B9R0.55 CC(C)OCCC[C@@H](C)O Amb33274398 [0,0,0,0,0,2|1,0,1]=4 10034 B9R0.55 CC(C)OCCC[C@H](C)O Amb33274415 [0,0,0,0,0,2|1,0,1]=4 10035 B9R0.55 CC(C)OCCC[N+](=O)[O-] Amb33274120 [0,0,0,0,0,2|1,0,1]=4 10036 B9R0.55 CC(C)OCCNC(N)=S Amb27770479 [0,0,0,0,0,2|1,1,0]=4 10037 B9R0.55 CC(C)OCCOC(=O)Cl Amb24465716 [0,0,0,0,0,2|1,0,0]=3 10038 B9R0.55 CC(C)OCOCC(=O)O Amb26370232 [0,0,0,0,0,2|0,0,0]=2 10039 B9R0.55 CC(C)OCSCC(=O)O Amb28241661 [0,0,0,0,0,2|0,0,0]=2 10040 B9R0.55 CC(C)OC\C=C\C(=O)O Amb33475206 [0,0,0,0,0,2|0,0,1]=3 10041 B9R0.55 CC(C)ONCCS(C)=O Amb27795989 [0,0,0,0,0,2|2,0,0]=4 10042 B9R0.55 CC(C)SCCCC(=O)O Amb17503621 [0,0,0,0,0,2|0,0,0]=2 10043 B9R0.55 CC(C)SC\C=C\C(=O)O Amb19020662 [0,0,0,0,0,2|0,0,1]=3 10044 B9R0.55 CC(C)\C=C\C=C\C(=O)O Amb25367977 [0,0,0,0,0,2|0,0,2]=4 10045 B9R0.55 CC(C)\C=N\CCC(=O)O Amb27759498 [0,0,0,0,0,2|0,0,0]=2 10046 B9R0.55 CC(F)CCOCC(=O)O Amb27613091 [0,0,0,0,0,2|1,0,0]=3 10047 B9R0.55 CC(F)CCSCC(=O)O Amb27777659 [0,0,0,0,0,2|1,0,0]=3 10048 B9R0.55 CC(N)CCC#CC(=O)O Amb33169012 [0,0,0,0,0,2|1,0,0]=3 10049 B9R0.55 CC(N)CCCCC(=O)O Amb18644199 [0,0,0,0,0,2|1,0,0]=3 10050 B9R0.55 CC(N)CCCCC(=O)O Amb19515386 [0,0,0,0,0,2|1,0,0]=3 10051 B9R0.55 CC(N)CCCCC(N)=O Amb19515544 [0,0,0,0,0,2|2,0,0]=4 10052 B9R0.55 CC(N)CCSCC(=O)O Amb27436369 [0,0,0,0,0,2|1,0,0]=3 10053 B9R0.55 CC(N)CS\C=C\C(=O)O Amb27772740 [0,0,0,0,0,2|1,0,1]=4 10054 B9R0.55 CC(O)C#CCCC(C)C Amb27457739 [0,0,0,0,0,2|1,0,1]=4 10055 B9R0.55 CC(O)CCCOC(C)C Amb24450979 [0,0,0,0,0,2|1,0,1]=4 10056 B9R0.55 CC(O)CCCSC(C)C Amb27472017 [0,0,0,0,0,2|1,0,1]=4 10057 B9R0.55 CC(O)CSCCC(=O)O Amb18792572 [0,0,0,0,0,2|1,0,0]=3 10058 B9R0.55 CC(O)CSCCC(N)=O Amb27976132 [0,0,0,0,0,2|2,0,0]=4 10059 B9R0.55 CC(O)\C=C\CCC(=O)O Amb24453133 [0,0,0,0,0,2|1,0,0]=3 10060 B9R0.55 CN(C)CCC#CC(=O)O Amb27948335 [0,0,0,0,0,2|1,0,0]=3 10061 B9R0.55 CN(C)CCC#CC(=O)[O-] Amb33038206 [0,0,0,0,0,2|1,0,1]=4 10062 B9R0.55 CN(C)CCCCC(=O)O Amb19275569 [0,0,0,0,0,2|1,0,0]=3 10063 B9R0.55 CN(C)CCCCC(=O)O Amb7783201 [0,0,0,0,0,2|1,0,0]=3 10064 B9R0.55 CN(C)CCCNC(=O)S Amb27823578 [0,0,0,0,0,2|1,1,0]=4 10065 B9R0.55 CN(C)CCCNC(N)=O Amb1125203 [0,0,0,0,0,2|2,0,0]=4 10066 B9R0.55 CN(C)CCCNC(N)=O Amb33552022 [0,0,0,0,0,2|2,0,0]=4 10067 B9R0.55 CN(C)CCNCC(=O)O Amb31292878 [0,0,0,0,0,2|1,0,0]=3 10068 B9R0.55 CN(C)CCOCC(=O)O Amb20667765 [0,0,0,0,0,2|1,0,0]=3 10069 B9R0.55 CN(C)CCOCC(=O)O Amb22059502 [0,0,0,0,0,2|1,0,0]=3 10070 B9R0.55 CN(C)CCSCC(=O)O Amb1138164 [0,0,0,0,0,2|1,0,0]=3 10071 B9R0.55 CN(C)CCSCC(=O)O Amb33329916 [0,0,0,0,0,2|1,0,0]=3 10072 B9R0.55 CN(C)CC\C=C/C(=O)O Amb27815066 [0,0,0,0,0,2|1,0,0]=3 10073 B9R0.55 CN(C)CC\C=C\C(=O)O Amb32954654 [0,0,0,0,0,2|1,0,0]=3 10074 B9R0.55 CS(=O)CCCCC(=O)O Amb18788305 [0,0,0,0,0,2|2,0,0]=4 10075 B9R0.55 CS(=O)CCSCC(=O)O Amb27236300 [0,0,0,0,0,2|2,0,0]=4 10076 B9R0.55 C[C@@H](N)CCCCC(=O)O Amb25877255 [0,0,0,0,0,2|1,0,0]=3 10077 B9R0.55 C[C@@H](O)CSCCC(N)=O Amb27795743 [0,0,0,0,0,2|2,0,0]=4 10078 B9R0.55 C[C@H](N)CSCCC(N)=O Amb28367266 [0,0,0,0,0,2|2,0,0]=4 10079 B9R0.55 C[C@H](O)CNCCC(N)=O Amb27464472 [0,0,0,0,0,2|2,0,0]=4 10080 B9R0.55 C[C@H](O)CSCCC(N)=O Amb28195669 [0,0,0,0,0,2|2,0,0]=4 10081 B9R0.55 C\C(Br)=C/CCCC(=O)O Amb27798317 [0,0,0,0,0,2|1,0,1]=4 10082 B9R0.55 C\C(Cl)=C/CSCC(=O)O Amb27865640 [0,0,0,0,0,2|1,0,1]=4 10083 B9R0.55 O=C(O)CCCCC(O)O Amb28143854 [0,0,0,0,0,2|2,0,0]=4 10084 B9R0.55 O=C(O)CCCOC(F)F Amb27861059 [0,0,0,0,0,2|2,0,0]=4 10085 B9R0.55 O=C(O)CCOCC(F)F Amb26539468 [0,0,0,0,0,2|2,0,0]=4 10086 B9R0.55 O=C(O)COCCC(F)F Amb27848670 [0,0,0,0,0,2|2,0,0]=4