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(Cl)CCC(N)=O Amb25843741 [0,0,0,0,0,0|2,0,2]=4 2 B7R0.6 C=C(Cl)CCC(O)=O Amb18642971 [0,0,0,0,0,0|1,0,2]=3 3 B7R0.6 C=C(F)CCC(O)=O Amb25141041 [0,0,0,0,0,0|1,0,2]=3 4 B7R0.6 CC(=C)CCC(=O)Cl Amb24640436 [0,0,0,0,0,0|1,0,2]=3 5 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [0,0,0,0,0,0|0,0,2]=2 6 B7R0.6 CC(=C)CNC(C)C Amb17308679 [0,0,0,0,0,0|3,0,0]=3 7 B7R0.6 CC(=C)CNN(C)C Amb24710720 [0,0,0,0,0,0|4,0,0]=4 8 B7R0.6 CC(=C)\C=C\C(=O)O Amb17593153 [0,0,0,0,0,0|0,0,4]=4 9 B7R0.6 CC(=CCC(=O)C)C Amb17593170 [0,0,0,0,0,0|1,0,2]=3 10 B7R0.6 CC(=N)SCC(O)=O Amb25704672 [0,0,0,0,0,0|2,0,1]=3 11 B7R0.6 CC(=NNC(=O)C)C Amb1047247 [0,0,0,0,0,0|3,0,1]=4 12 B7R0.6 CC(=O)CCB(O)O Amb25095502 [0,0,0,0,0,0|2,0,2]=4 13 B7R0.6 CC(=O)CCC(=C)Br Amb24690678 [0,0,0,0,0,0|2,0,2]=4 14 B7R0.6 CC(=O)CCC(=O)Cl Amb17142859 [0,0,0,0,0,0|2,0,1]=3 15 B7R0.6 CC(=O)CCC(=O)N Amb17142854 [0,0,0,0,0,0|2,0,1]=3 16 B7R0.6 CC(=O)CCC(Cl)Cl Amb25724918 [0,0,0,0,0,0|3,0,0]=3 17 B7R0.6 CC(=O)CCC([O-])=O Amb22350071 [0,0,0,0,0,0|1,0,2]=3 18 B7R0.6 CC(=O)CCP(O)=O Amb24647699 [0,0,0,0,0,0|2,0,1]=3 19 B7R0.6 CC(=O)CCS(=O)=O Amb25730256 [0,0,0,0,0,0|2,0,2]=4 20 B7R0.6 CC(=O)CC[N+]([O-])=O Amb18198961 [0,0,0,0,0,0|2,0,2]=4 21 B7R0.6 CC(=O)CNC(N)=O Amb24697691 [0,0,0,0,0,0|3,0,1]=4 22 B7R0.6 CC(=O)CSC(C)=C Amb25809979 [0,0,0,0,0,0|2,0,2]=4 23 B7R0.6 CC(=O)CSC(C)=N Amb24634756 [0,0,0,0,0,0|3,0,1]=4 24 B7R0.6 CC(=O)NCC(=O)N Amb17231824 [0,0,0,0,0,0|3,0,1]=4 25 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,0,0,0,0,0|2,0,1]=3 26 B7R0.6 CC(=O)NCC(C)=C Amb25126091 [0,0,0,0,0,0|2,0,2]=4 27 B7R0.6 CC(=O)NCC(O)O Amb25378443 [0,0,0,0,0,0|4,0,0]=4 28 B7R0.6 CC(=O)OCC(=C)C Amb16187121 [0,0,0,0,0,0|2,0,2]=4 29 B7R0.6 CC(=O)OCC(=O)Br Amb25032214 [0,0,0,0,0,0|3,0,1]=4 30 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,0,0,0,0,0|2,0,1]=3 31 B7R0.6 CC(=O)OCC(F)Cl Amb25116212 [0,0,0,0,0,0|4,0,0]=4 32 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,0,0,0,0,0|3,0,1]=4 33 B7R0.6 CC(=O)OCS(C)=O Amb24667100 [0,0,0,0,0,0|4,0,0]=4 34 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [0,0,0,0,0,0|3,0,1]=4 35 B7R0.6 CC(=O)SCC(=O)O Amb17607669 [0,0,0,0,0,0|2,0,1]=3 36 B7R0.6 CC(=O)SCC(C)=O Amb25131248 [0,0,0,0,0,0|3,0,1]=4 37 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,0,0,0,0,0|3,0,1]=4 38 B7R0.6 CC(=O)\C=C/C(O)=O Amb24662475 [0,0,0,0,0,0|1,0,3]=4 39 B7R0.6 CC(=S)NCC(O)=O Amb24325138 [0,0,0,0,0,0|2,0,1]=3 40 B7R0.6 CC(Br)CCC(=O)Cl Amb24483133 [0,0,0,0,0,0|2,0,0]=2 41 B7R0.6 CC(Br)CCC(C)Cl Amb25216975 [0,0,0,0,0,0|3,0,1]=4 42 B7R0.6 CC(Br)CCC(N)=O Amb24065438 [0,0,0,0,0,0|2,0,0]=2 43 B7R0.6 CC(Br)CCC(O)=O Amb18124528 [0,0,0,0,0,0|1,0,0]=1 44 B7R0.6 CC(Br)CNC(C)=O Amb24727885 [0,0,0,0,0,0|3,0,0]=3 45 B7R0.6 CC(Br)COC(C)=O Amb25360690 [0,0,0,0,0,0|3,0,0]=3 46 B7R0.6 CC(Br)\C=C\C(=O)Cl Amb24602252 [0,0,0,0,0,0|2,0,2]=4 47 B7R0.6 CC(Br)\C=C\C(C)=O Amb25334067 [0,0,0,0,0,0|2,0,2]=4 48 B7R0.6 CC(Br)\C=C\C(O)=O Amb18648210 [0,0,0,0,0,0|1,0,2]=3 49 B7R0.6 CC(C)=C=CC(C)=O Amb25189061 [0,0,0,0,0,0|1,0,3]=4 50 B7R0.6 CC(C)=CCC([O-])=O Amb22491058 [0,0,0,0,0,0|0,0,3]=3 51 B7R0.6 CC(C)=COC(=O)Cl Amb25174283 [0,0,0,0,0,0|2,0,2]=4 52 B7R0.6 CC(C)=COC(C)=O Amb25349708 [0,0,0,0,0,0|2,0,2]=4 53 B7R0.6 CC(C)=NCC(O)=O Amb24481383 [0,0,0,0,0,0|1,0,1]=2 54 B7R0.6 CC(C)C#CC(C)O Amb25134603 [0,0,0,0,0,0|1,0,3]=4 55 B7R0.6 CC(C)C#C[C@H](C)O Amb24333163 [0,0,0,0,0,0|1,0,3]=4 56 B7R0.6 CC(C)CC=C(C)C Amb22731329 [0,0,0,0,0,0|2,0,1]=3 57 B7R0.6 CC(C)CCB(F)F Amb24655127 [0,0,0,0,0,0|3,0,0]=3 58 B7R0.6 CC(C)CCC(C)=C Amb22734286 [0,0,0,0,0,0|2,0,0]=2 59 B7R0.6 CC(C)CCC(Cl)Cl Amb24483247 [0,0,0,0,0,0|2,0,1]=3 60 B7R0.6 CC(C)CCC(N)=N Amb19890005 [0,0,0,0,0,0|2,0,0]=2 61 B7R0.6 CC(C)CCN(C)C Amb25761687 [0,0,0,0,0,0|3,0,0]=3 62 B7R0.6 CC(C)CCN(C)N Amb25344743 [0,0,0,0,0,0|3,0,0]=3 63 B7R0.6 CC(C)CCS(C)=O Amb24369501 [0,0,0,0,0,0|2,0,0]=2 64 B7R0.6 CC(C)CC[13C](O)=O Amb22337922 [0,0,0,0,0,0|0,0,0]=0 65 B7R0.6 CC(C)CC[13C]([O-])=O Amb22369748 [0,0,0,0,0,0|0,0,1]=1 66 B7R0.6 CC(C)CC[N+]([O-])=O Amb17672612 [0,0,0,0,0,0|1,0,1]=2 67 B7R0.6 CC(C)CC[S+](C)C Amb24581198 [0,0,0,0,0,0|3,0,0]=3 68 B7R0.6 CC(C)CNN(C)C Amb24739829 [0,0,0,0,0,0|4,0,0]=4 69 B7R0.6 CC(C)COB(O)O Amb24711780 [0,0,0,0,0,0|2,0,1]=3 70 B7R0.6 CC(C)COC(C)Cl Amb25337737 [0,0,0,0,0,0|3,0,1]=4 71 B7R0.6 CC(C)COC(N)=N Amb25789367 [0,0,0,0,0,0|3,0,0]=3 72 B7R0.6 CC(C)COC(N)=S Amb25117523 [0,0,0,0,0,0|2,1,0]=3 73 B7R0.6 CC(C)COC([S-])=S Amb22730882 [0,0,0,0,0,0|1,2,0]=3 74 B7R0.6 CC(C)COC([S-])=S Amb22733535 [0,0,0,0,0,0|1,2,0]=3 75 B7R0.6 CC(C)CO[N+]([O-])=O Amb22348027 [0,0,0,0,0,0|2,0,1]=3 76 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [0,0,0,0,0,0|2,0,0]=2 77 B7R0.6 CC(C)CSC(C)Cl Amb25242506 [0,0,0,0,0,0|3,0,1]=4 78 B7R0.6 CC(C)CSC(F)F Amb24520712 [0,0,0,0,0,0|3,0,1]=4 79 B7R0.6 CC(C)CSC(N)=N Amb20676000 [0,0,0,0,0,0|3,0,0]=3 80 B7R0.6 CC(C)N=CC(O)=O Amb25243501 [0,0,0,0,0,0|1,0,1]=2 81 B7R0.6 CC(C)NC=C(C)C Amb24568899 [0,0,0,0,0,0|3,0,1]=4 82 B7R0.6 CC(C)NCC(=C)Br Amb18969561 [0,0,0,0,0,0|3,0,0]=3 83 B7R0.6 CC(C)NCC(=C)Cl Amb18969179 [0,0,0,0,0,0|3,0,0]=3 84 B7R0.6 CC(C)NCC(C)F Amb24518861 [0,0,0,0,0,0|3,0,1]=4 85 B7R0.6 CC(C)NCC(C)N Amb18523807 [0,0,0,0,0,0|3,0,1]=4 86 B7R0.6 CC(C)NCC(C)S Amb18124379 [0,0,0,0,0,0|2,1,1]=4 87 B7R0.6 CC(C)NCC(Cl)Cl Amb24620020 [0,0,0,0,0,0|3,0,1]=4 88 B7R0.6 CC(C)NCC(F)F Amb20626958 [0,0,0,0,0,0|3,0,1]=4 89 B7R0.6 CC(C)NC[C@@H](C)N Amb24641462 [0,0,0,0,0,0|3,0,1]=4 90 B7R0.6 CC(C)NC[C@H](C)N Amb24681286 [0,0,0,0,0,0|3,0,1]=4 91 B7R0.6 CC(C)NC[C@H](C)O Amb25141479 [0,0,0,0,0,0|2,0,1]=3 92 B7R0.6 CC(C)NNC(C)=O Amb22233621 [0,0,0,0,0,0|3,0,0]=3 93 B7R0.6 CC(C)NNC(N)=N Amb25305047 [0,0,0,0,0,0|4,0,0]=4 94 B7R0.6 CC(C)NNC(N)=S Amb24434718 [0,0,0,0,0,0|3,1,0]=4 95 B7R0.6 CC(C)N\N=C(\C)/N Amb25063841 [0,0,0,0,0,0|4,0,0]=4 96 B7R0.6 CC(C)OCC(C)Br Amb24053045 [0,0,0,0,0,0|3,0,1]=4 97 B7R0.6 CC(C)OCC(C)Cl Amb24693935 [0,0,0,0,0,0|3,0,1]=4 98 B7R0.6 CC(C)OCC(N)=N Amb22094742 [0,0,0,0,0,0|3,0,0]=3 99 B7R0.6 CC(C)OCC([O-])=O Amb22754781 [0,0,0,0,0,0|1,0,1]=2 100 B7R0.6 CC(C)OC[C@@H](C)N Amb18016635 [0,0,0,0,0,0|3,0,1]=4 101 B7R0.6 CC(C)OC[C@@H](C)O Amb24689920 [0,0,0,0,0,0|2,0,1]=3 102 B7R0.6 CC(C)OC[C@H](C)O Amb24449028 [0,0,0,0,0,0|2,0,1]=3 103 B7R0.6 CC(C)ONC(C)=O Amb25091857 [0,0,0,0,0,0|3,0,0]=3 104 B7R0.6 CC(C)ONC(N)=N Amb25168665 [0,0,0,0,0,0|4,0,0]=4 105 B7R0.6 CC(C)ONS(C)=O Amb24551355 [0,0,0,0,0,0|4,0,0]=4 106 B7R0.6 CC(C)SCC(=C)Br Amb25847364 [0,0,0,0,0,0|3,0,0]=3 107 B7R0.6 CC(C)SCC(=C)Cl Amb25204248 [0,0,0,0,0,0|3,0,0]=3 108 B7R0.6 CC(C)SCC(C)=C Amb25058431 [0,0,0,0,0,0|3,0,0]=3 109 B7R0.6 CC(C)SCC(C)=O Amb22549127 [0,0,0,0,0,0|2,0,0]=2 110 B7R0.6 CC(C)SCC(C)N Amb24481360 [0,0,0,0,0,0|3,0,1]=4 111 B7R0.6 CC(C)SCC(C)O Amb24382860 [0,0,0,0,0,0|2,0,1]=3 112 B7R0.6 CC(C)SCC(N)=N Amb25337291 [0,0,0,0,0,0|3,0,0]=3 113 B7R0.6 CC(C)SC[C@@H](C)O Amb25283005 [0,0,0,0,0,0|2,0,1]=3 114 B7R0.6 CC(C)SSC(N)=N Amb25744921 [0,0,0,0,0,0|4,0,0]=4 115 B7R0.6 CC(C)\C=C/C(O)=O Amb24481395 [0,0,0,0,0,0|0,0,2]=2 116 B7R0.6 CC(C)\C=C\C(=O)Cl Amb24481563 [0,0,0,0,0,0|1,0,2]=3 117 B7R0.6 CC(C)\C=C\C(C)O Amb25746608 [0,0,0,0,0,0|1,0,3]=4 118 B7R0.6 CC(C)\C=C\C(N)=O Amb24473783 [0,0,0,0,0,0|1,0,2]=3 119 B7R0.6 CC(C)\C=C\[N+]([O-])=O Amb22886991 [0,0,0,0,0,0|1,0,3]=4 120 B7R0.6 CC(CCB(O)O)C Amb13890540 [0,0,0,0,0,0|1,0,1]=2 121 B7R0.6 CC(CCC(=O)O)C Amb1153016 [0,0,0,0,0,0|0,0,0]=0 122 B7R0.6 CC(CCC(=O)O)N Amb17593212 [0,0,0,0,0,0|1,0,0]=1 123 B7R0.6 CC(CNC(=O)N)C Amb1151241 [0,0,0,0,0,0|2,0,0]=2 124 B7R0.6 CC(CNC(=S)N)C Amb2370605 [0,0,0,0,0,0|2,1,0]=3 125 B7R0.6 CC(Cl)=C=CC(O)=O Amb25321565 [0,0,0,0,0,0|1,0,3]=4 126 B7R0.6 CC(Cl)=CCC(N)=O Amb25324975 [0,0,0,0,0,0|2,0,2]=4 127 B7R0.6 CC(Cl)C=NC(N)=O Amb24612038 [0,0,0,0,0,0|3,0,1]=4 128 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,0,0,0,0,0|2,0,0]=2 129 B7R0.6 CC(Cl)CCC(C)O Amb25136164 [0,0,0,0,0,0|2,0,1]=3 130 B7R0.6 CC(Cl)CCC(N)=O Amb24469692 [0,0,0,0,0,0|2,0,0]=2 131 B7R0.6 CC(Cl)CCC(O)=O Amb18124448 [0,0,0,0,0,0|1,0,0]=1 132 B7R0.6 CC(Cl)CCN(C)C Amb25074217 [0,0,0,0,0,0|3,0,1]=4 133 B7R0.6 CC(Cl)CNC(C)=O Amb25702921 [0,0,0,0,0,0|3,0,0]=3 134 B7R0.6 CC(Cl)CNC(N)=O Amb25068414 [0,0,0,0,0,0|3,0,0]=3 135 B7R0.6 CC(Cl)COC(=O)F Amb24470183 [0,0,0,0,0,0|3,0,0]=3 136 B7R0.6 CC(Cl)COC(C)=O Amb25783984 [0,0,0,0,0,0|3,0,0]=3 137 B7R0.6 CC(Cl)CSC(=O)Cl Amb24456190 [0,0,0,0,0,0|3,0,0]=3 138 B7R0.6 CC(Cl)CSC(C)=O Amb24530194 [0,0,0,0,0,0|3,0,0]=3 139 B7R0.6 CC(Cl)\C=C\C(=O)Cl Amb24579654 [0,0,0,0,0,0|2,0,2]=4 140 B7R0.6 CC(Cl)\C=C\C(C)=O Amb25782801 [0,0,0,0,0,0|2,0,2]=4 141 B7R0.6 CC(F)CCC(O)=O Amb24682772 [0,0,0,0,0,0|1,0,0]=1 142 B7R0.6 CC(N)CCC(C)=C Amb18641752 [0,0,0,0,0,0|3,0,0]=3 143 B7R0.6 CC(N)CCC(C)=O Amb24698356 [0,0,0,0,0,0|2,0,0]=2 144 B7R0.6 CC(N)CCC(N)=O Amb18641901 [0,0,0,0,0,0|2,0,0]=2 145 B7R0.6 CC(N)CCC(O)=O Amb19515603 [0,0,0,0,0,0|1,0,0]=1 146 B7R0.6 CC(N)CCS(C)=O Amb19337158 [0,0,0,0,0,0|3,0,0]=3 147 B7R0.6 CC(N)CCS(C)=O Amb22059582 [0,0,0,0,0,0|3,0,0]=3 148 B7R0.6 CC(N)CNC(C)=O Amb18631377 [0,0,0,0,0,0|3,0,0]=3 149 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,0,0,0,0,0|3,0,0]=3 150 B7R0.6 CC(N)CSC(N)=N Amb24423533 [0,0,0,0,0,0|4,0,0]=4 151 B7R0.6 CC(N)\C=C\C(O)=O Amb18641827 [0,0,0,0,0,0|1,0,2]=3 152 B7R0.6 CC(NCC(=O)N)C Amb2370772 [0,0,0,0,0,0|2,0,0]=2 153 B7R0.6 CC(NCC(=O)O)C Amb2372347 [0,0,0,0,0,0|1,0,0]=1 154 B7R0.6 CC(NCC(=S)N)C Amb17231884 [0,0,0,0,0,0|2,1,0]=3 155 B7R0.6 CC(O)CC=C(C)C Amb24645341 [0,0,0,0,0,0|1,0,3]=4 156 B7R0.6 CC(O)CC=C(Cl)Cl Amb25169372 [0,0,0,0,0,0|3,0,1]=4 157 B7R0.6 CC(O)CCB(O)O Amb24594819 [0,0,0,0,0,0|2,0,1]=3 158 B7R0.6 CC(O)CCC(C)=C Amb24062974 [0,0,0,0,0,0|3,0,0]=3 159 B7R0.6 CC(O)CCC(C)=O Amb25829594 [0,0,0,0,0,0|2,0,0]=2 160 B7R0.6 CC(O)CCC(C)N Amb18641930 [0,0,0,0,0,0|2,0,1]=3 161 B7R0.6 CC(O)CCC(O)=O Amb18294804 [0,0,0,0,0,0|1,0,0]=1 162 B7R0.6 CC(O)CCN(C)N Amb24370255 [0,0,0,0,0,0|3,0,1]=4 163 B7R0.6 CC(O)CN=C(C)N Amb24370924 [0,0,0,0,0,0|4,0,0]=4 164 B7R0.6 CC(O)CNN(C)C Amb25773279 [0,0,0,0,0,0|3,0,1]=4 165 B7R0.6 CC(O)CNS(C)=O Amb24536649 [0,0,0,0,0,0|4,0,0]=4 166 B7R0.6 CC(O)COC(C)=O Amb24056158 [0,0,0,0,0,0|3,0,0]=3 167 B7R0.6 CC(O)COP(O)=O Amb24591406 [0,0,0,0,0,0|3,0,0]=3 168 B7R0.6 CC(O)COP(O)O Amb24475185 [0,0,0,0,0,0|3,0,1]=4 169 B7R0.6 CC(O)CSC(N)=N Amb25168714 [0,0,0,0,0,0|4,0,0]=4 170 B7R0.6 CC(O)CSC(N)=S Amb24652391 [0,0,0,0,0,0|3,1,0]=4 171 B7R0.6 CC(O)NCC(O)=O Amb25141558 [0,0,0,0,0,0|2,0,0]=2 172 B7R0.6 CC(O)OCC(C)=C Amb24333382 [0,0,0,0,0,0|4,0,0]=4 173 B7R0.6 CC(O)\C=C\C(C)=O Amb25334941 [0,0,0,0,0,0|2,0,2]=4 174 B7R0.6 CC(O)\C=C\C(N)=O Amb24597646 [0,0,0,0,0,0|2,0,2]=4 175 B7R0.6 CC(O)\C=C\C(O)=O Amb18641876 [0,0,0,0,0,0|1,0,2]=3 176 B7R0.6 CC(OC[C@@H](N)C)C Amb17061649 [0,0,0,0,0,0|3,0,1]=4 177 B7R0.6 CC(S)CNC(C)=O Amb24695989 [0,0,0,0,0,0|3,0,0]=3 178 B7R0.6 CC(S)\C=C\C(O)=O Amb18124362 [0,0,0,0,0,0|1,0,2]=3 179 B7R0.6 CC(SCC(=O)O)C Amb1128460 [0,0,0,0,0,0|1,0,0]=1 180 B7R0.6 CN(C)CCC(Cl)Cl Amb24692739 [0,0,0,0,0,0|3,0,1]=4 181 B7R0.6 CN(C)CCC(O)=O Amb19888182 [0,0,0,0,0,0|1,0,0]=1 182 B7R0.6 CN(C)CCN(C)C Amb22002236 [0,0,0,0,0,0|4,0,0]=4 183 B7R0.6 CN(C)CCN(C)C Amb22337104 [0,0,0,0,0,0|4,0,0]=4 184 B7R0.6 CN(C)CCN(C)C Amb22728764 [0,0,0,0,0,0|4,0,0]=4 185 B7R0.6 CN(C)CCN(C)C Amb24325163 [0,0,0,0,0,0|4,0,0]=4 186 B7R0.6 CN(C)CCN(C)N Amb25070703 [0,0,0,0,0,0|4,0,0]=4 187 B7R0.6 CN(C)CCP(C)C Amb24101277 [0,0,0,0,0,0|4,0,0]=4 188 B7R0.6 CN(C)CNC(S)=S Amb24068964 [0,0,0,0,0,0|2,2,0]=4 189 B7R0.6 CN(C)COC(S)=S Amb24760765 [0,0,0,0,0,0|2,2,0]=4 190 B7R0.6 CN(C)CSC(N)=N Amb24377148 [0,0,0,0,0,0|4,0,0]=4 191 B7R0.6 CN(C)N=CS(O)=O Amb25211020 [0,0,0,0,0,0|3,0,1]=4 192 B7R0.6 CN(C)NCC(N)=O Amb24634715 [0,0,0,0,0,0|3,0,0]=3 193 B7R0.6 CN(C)NCC(O)=O Amb24481366 [0,0,0,0,0,0|2,0,0]=2 194 B7R0.6 CN(C)SCC(N)=O Amb22492532 [0,0,0,0,0,0|3,0,0]=3 195 B7R0.6 CN(C)\C=C\C(N)=O Amb24581127 [0,0,0,0,0,0|2,0,2]=4 196 B7R0.6 CN(C)\C=C\C(O)=O Amb25273624 [0,0,0,0,0,0|1,0,2]=3 197 B7R0.6 CN(CCC(=N)N)C Amb13951664 [0,0,0,0,0,0|3,0,0]=3 198 B7R0.6 CN(CCC(=O)C)C Amb1129203 [0,0,0,0,0,0|2,0,0]=2 199 B7R0.6 CN(CCC(=O)N)C Amb17231825 [0,0,0,0,0,0|2,0,0]=2 200 B7R0.6 CN(CCC(N)C)C Amb1141214 [0,0,0,0,0,0|3,0,1]=4 201 B7R0.6 CN(CCN(C)C)C Amb10554269 [0,0,0,0,0,0|4,0,0]=4 202 B7R0.6 CN(CCN(C)C)C Amb1195988 [0,0,0,0,0,0|4,0,0]=4 203 B7R0.6 CS(=O)CCC(N)=N Amb25248432 [0,0,0,0,0,0|4,0,0]=4 204 B7R0.6 CS(=O)CCC(N)=O Amb24475802 [0,0,0,0,0,0|3,0,0]=3 205 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [0,0,0,0,0,0|2,0,0]=2 206 B7R0.6 CS(=O)NCC(N)=O Amb24589713 [0,0,0,0,0,0|4,0,0]=4 207 B7R0.6 CS(=O)NCC(O)=O Amb25237322 [0,0,0,0,0,0|3,0,0]=3 208 B7R0.6 CS(=O)\C=C\C(O)=O Amb18642965 [0,0,0,0,0,0|2,0,2]=4 209 B7R0.6 C[C@@H](COC(=O)O)O Amb16232417 [0,0,0,0,0,0|2,0,0]=2 210 B7R0.6 C[C@@H](O)C#CC(O)=O Amb24334413 [0,0,0,0,0,0|1,0,2]=3 211 B7R0.6 C[C@@H](O)CCB(O)O Amb25683632 [0,0,0,0,0,0|2,0,1]=3 212 B7R0.6 C[C@@H](O)CCC(C)=C Amb22896943 [0,0,0,0,0,0|3,0,0]=3 213 B7R0.6 C[C@@H](O)CCC(C)=O Amb22351150 [0,0,0,0,0,0|2,0,0]=2 214 B7R0.6 C[C@@H](O)CCC(C)O Amb25846912 [0,0,0,0,0,0|2,0,1]=3 215 B7R0.6 C[C@@H](O)CN=C(C)N Amb25026449 [0,0,0,0,0,0|4,0,0]=4 216 B7R0.6 C[C@@H](O)CNC(C)=O Amb25133822 [0,0,0,0,0,0|3,0,0]=3 217 B7R0.6 C[C@@H](O)CNN(C)C Amb24733710 [0,0,0,0,0,0|3,0,1]=4 218 B7R0.6 C[C@@H](O)COC(C)=O Amb25832756 [0,0,0,0,0,0|3,0,0]=3 219 B7R0.6 C[C@@H](S)CCC(O)=O Amb24587370 [0,0,0,0,0,0|1,0,0]=1 220 B7R0.6 C[C@H](Br)CC[C@@H](C)Br Amb25706509 [0,0,0,0,0,0|3,0,1]=4 221 B7R0.6 C[C@H](Cl)CC[C@@H](C)Cl Amb24390387 [0,0,0,0,0,0|3,0,1]=4 222 B7R0.6 C[C@H](Cl)CC[C@H](C)Cl Amb24532115 [0,0,0,0,0,0|3,0,1]=4 223 B7R0.6 C[C@H](N)CCC(O)=O Amb25047328 [0,0,0,0,0,0|1,0,0]=1 224 B7R0.6 C[C@H](O)CNC(N)=N Amb24501581 [0,0,0,0,0,0|4,0,0]=4 225 B7R0.6 C[C@H](O)CNC(N)=O Amb24384732 [0,0,0,0,0,0|3,0,0]=3 226 B7R0.6 C[C@H](O)CSC(C)=O Amb25256687 [0,0,0,0,0,0|3,0,0]=3 227 B7R0.6 C[S+](C)CCC(O)=O Amb22730539 [0,0,0,0,0,0|1,0,0]=1 228 B7R0.6 C[S+](C)CCC([O-])=O Amb20247306 [0,0,0,0,0,0|1,0,1]=2 229 B7R0.6 C[SiH](CC[SiH](C)C)C Amb10603346 [0,0,0,0,0,0|2,2,0]=4 230 B7R0.6 FC(COC(=O)C)F Amb10839327 [0,0,0,0,0,0|4,0,0]=4 231 B7R0.6 NC(=N)CCC(=O)Cl Amb24565938 [0,0,0,0,0,0|3,0,1]=4 232 B7R0.6 NC(=N)CCC(O)=O Amb25736788 [0,0,0,0,0,0|2,0,1]=3 233 B7R0.6 NC(=N)NCC(=O)O Amb16231404 [0,0,0,0,0,0|3,0,1]=4 234 B7R0.6 NC(=N)N[13CH2][13C](=O)O Amb17614848 [0,0,0,0,0,0|3,0,1]=4 235 B7R0.6 NC(=N)OCC(O)=O Amb24394884 [0,0,0,0,0,0|3,0,1]=4 236 B7R0.6 NC(=N)SCC(O)=O Amb21955777 [0,0,0,0,0,0|3,0,1]=4 237 B7R0.6 NC(=O)CCB(O)O Amb24483052 [0,0,0,0,0,0|4,0,0]=4 238 B7R0.6 NC(=O)CCC(=O)N Amb1353209 [0,0,0,0,0,0|3,0,1]=4 239 B7R0.6 NC(=O)CCC(F)F Amb25271130 [0,0,0,0,0,0|3,0,0]=3 240 B7R0.6 NC(=O)CCC(N)=N Amb25680023 [0,0,0,0,0,0|3,0,1]=4 241 B7R0.6 NC(=O)CCP(O)=O Amb25840251 [0,0,0,0,0,0|3,0,1]=4 242 B7R0.6 NC(=O)CNC(O)=O Amb24705097 [0,0,0,0,0,0|3,0,1]=4 243 B7R0.6 NC(=O)NCC(=O)O Amb16205895 [0,0,0,0,0,0|3,0,1]=4 244 B7R0.6 NC(=O)OCC(Cl)Cl Amb25111164 [0,0,0,0,0,0|4,0,0]=4 245 B7R0.6 NC(=O)OCC(O)=O Amb25777061 [0,0,0,0,0,0|3,0,1]=4 246 B7R0.6 NC(=O)SCC(O)=O Amb24640543 [0,0,0,0,0,0|3,0,1]=4 247 B7R0.6 NC(=S)CCC(O)=O Amb18102382 [0,0,0,0,0,0|2,0,1]=3 248 B7R0.6 NC(=S)OCC(O)=O Amb25340403 [0,0,0,0,0,0|3,0,1]=4 249 B7R0.6 NC(=S)SCC(O)=O Amb25108057 [0,0,0,0,0,0|3,0,1]=4 250 B7R0.6 O=C(Cl)CCC(Cl)Cl Amb24441999 [0,0,0,0,0,0|3,0,0]=3 251 B7R0.6 O=C(F)CCC(=O)F Amb24483270 [0,0,0,0,0,0|3,0,1]=4 252 B7R0.6 OB(O)CCC(O)=O Amb24640288 [0,0,0,0,0,0|3,0,0]=3 253 B7R0.6 OC(=O)C#CC(F)F Amb24455798 [0,0,0,0,0,0|2,0,2]=4 254 B7R0.6 OC(=O)CC=C(Cl)Cl Amb17593875 [0,0,0,0,0,0|2,0,2]=4 255 B7R0.6 OC(=O)CC=C(F)F Amb25127059 [0,0,0,0,0,0|2,0,2]=4 256 B7R0.6 OC(=O)CCC(=O)Cl Amb17593468 [0,0,0,0,0,0|2,0,1]=3 257 B7R0.6 OC(=O)CCC(Cl)Cl Amb25059214 [0,0,0,0,0,0|2,0,0]=2 258 B7R0.6 OC(=O)CCC(F)F Amb20623135 [0,0,0,0,0,0|2,0,0]=2 259 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [0,0,0,0,0,0|2,0,1]=3 260 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [0,0,0,0,0,0|2,0,1]=3 261 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [0,0,0,0,0,0|2,0,1]=3 262 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [0,0,0,0,0,0|2,0,1]=3 263 B7R0.6 OC(=O)CNC(=O)Cl Amb25277149 [0,0,0,0,0,0|3,0,1]=4 264 B7R0.6 OC(=O)CNC(S)=S Amb24739663 [0,0,0,0,0,0|3,0,1]=4 265 B7R0.6 OC(=O)COC(S)=S Amb24739791 [0,0,0,0,0,0|3,0,1]=4 266 B7R0.6 OC(=O)COS(=O)=O Amb25064798 [0,0,0,0,0,0|4,0,0]=4 267 B7R0.6 OC(=O)CSC(S)=S Amb24608205 [0,0,0,0,0,0|3,0,1]=4 268 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [0,0,0,0,0,0|2,0,1]=3 269 B7R0.6 OC(=O)C\C=C(\F)/Cl Amb24599232 [0,0,0,0,0,0|2,0,2]=4 270 B7R0.6 OC(=O)SCC(O)=O Amb24699018 [0,0,0,0,0,0|3,0,1]=4 271 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [0,0,0,0,0,0|2,0,1]=3 272 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [0,0,0,0,0,0|2,0,1]=3 273 B7R0.6 OC(=O)\C=C\C(F)F Amb24340205 [0,0,0,0,0,0|2,0,2]=4 274 B7R0.6 OC(=S)CCC(O)=O Amb24586272 [0,0,0,0,0,0|2,0,1]=3 275 B7R0.6 OC(O)CCC(O)=O Amb25762802 [0,0,0,0,0,0|2,0,0]=2 276 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [0,0,0,0,0,0|2,0,1]=3 277 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [0,0,0,0,0,0|2,0,1]=3 278 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [0,0,0,0,0,0|2,0,1]=3 279 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [0,0,0,0,0,0|1,0,1]=2 280 B7R0.6 [O-]C(=O)CCC(O)=O Amb22730137 [0,0,0,0,0,0|2,0,1]=3 281 B7R0.6 [O-]C(=O)CCC(O)=O Amb22733837 [0,0,0,0,0,0|2,0,1]=3 282 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22230230 [0,0,0,0,0,0|2,0,2]=4 283 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22330623 [0,0,0,0,0,0|2,0,2]=4 284 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22360668 [0,0,0,0,0,0|2,0,2]=4 285 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22731284 [0,0,0,0,0,0|2,0,2]=4 286 B7R0.6 [O-][N+](=O)CCC(=O)Cl Amb24532013 [0,0,0,0,0,0|4,0,0]=4 287 B7R0.6 [O-][N+](=O)CCC(=O)O Amb10843224 [0,0,0,0,0,0|3,0,0]=3 288 B6R0.4 BC(=O)OCCCl Amb25199831 [1,0,0,0,0,0|3,0,0]=4 289 B6R0.4 BrCCCN(C)C Amb10603677 [1,0,0,0,0,0|2,0,1]=4 290 B6R0.4 BrCCOC(C)C Amb1105066 [1,0,0,0,0,0|2,0,1]=4 291 B6R0.4 C#CCCC(N)=O Amb18636026 [1,0,0,0,0,0|1,0,2]=4 292 B6R0.4 C#CCCC([O-])=O Amb22232009 [1,0,0,0,0,0|0,0,3]=4 293 B6R0.4 C=C(Br)CCC=O Amb18645745 [1,0,0,0,0,0|1,0,2]=4 294 B6R0.4 C=C(Cl)CCC=O Amb24525208 [1,0,0,0,0,0|1,0,2]=4 295 B6R0.4 C=C(Cl)CCCBr Amb25811643 [1,0,0,0,0,0|3,0,0]=4 296 B6R0.4 C=C(Cl)CCCCl Amb24635037 [1,0,0,0,0,0|3,0,0]=4 297 B6R0.4 C=C(F)CCCO Amb25811029 [1,0,0,0,0,0|3,0,0]=4 298 B6R0.4 C=C(I)CCCN Amb24581029 [1,0,0,0,0,0|3,0,0]=4 299 B6R0.4 C=CCCC(Cl)Cl Amb25803414 [1,0,0,0,0,0|3,0,0]=4 300 B6R0.4 C=CCNC(C)C Amb10609485 [1,0,0,0,0,0|2,0,0]=3 301 B6R0.4 C=NCCC(O)=O Amb24480865 [1,0,0,0,0,0|1,0,1]=3 302 B6R0.4 CC#CCC(N)=O Amb24761404 [1,0,0,0,0,0|1,0,2]=4 303 B6R0.4 CC#CCC(O)=O Amb17939740 [1,0,0,0,0,0|0,0,2]=3 304 B6R0.4 CC(=C)CCC=C Amb22228883 [1,0,0,0,0,0|1,0,2]=4 305 B6R0.4 CC(=C)CCC=O Amb18120891 [1,0,0,0,0,0|0,0,2]=3 306 B6R0.4 CC(=C)CCCBr Amb22886717 [1,0,0,0,0,0|3,0,0]=4 307 B6R0.4 CC(=C)CCCCl Amb24089299 [1,0,0,0,0,0|3,0,0]=4 308 B6R0.4 CC(=C)CCCN Amb24761452 [1,0,0,0,0,0|3,0,0]=4 309 B6R0.4 CC(=C)CCCO Amb22886814 [1,0,0,0,0,0|0,0,3]=4 310 B6R0.4 CC(=C)CNC=O Amb24448470 [1,0,0,0,0,0|1,0,2]=4 311 B6R0.4 CC(=O)CCC=O Amb18639597 [1,0,0,0,0,0|1,0,1]=3 312 B6R0.4 CC(=O)CCC=S Amb25662155 [1,0,0,0,0,0|1,1,1]=4 313 B6R0.4 CC(=O)CCCF Amb25068187 [1,0,0,0,0,0|2,0,0]=3 314 B6R0.4 CC(=O)CCCI Amb25346994 [1,0,0,0,0,0|2,0,0]=3 315 B6R0.4 CC(=O)CCCN Amb18121547 [1,0,0,0,0,0|2,0,0]=3 316 B6R0.4 CC(=O)CCON Amb25186994 [1,0,0,0,0,0|3,0,0]=4 317 B6R0.4 CC(=O)CNC=O Amb23442787 [1,0,0,0,0,0|2,0,1]=4 318 B6R0.4 CC(=O)COC=O Amb24736861 [1,0,0,0,0,0|2,0,1]=4 319 B6R0.4 CC(=O)NCC=O Amb25757509 [1,0,0,0,0,0|2,0,1]=4 320 B6R0.4 CC(=O)NCCF Amb25832238 [1,0,0,0,0,0|3,0,0]=4 321 B6R0.4 CC(=O)NCCI Amb25761166 [1,0,0,0,0,0|3,0,0]=4 322 B6R0.4 CC(=O)NCCN Amb1218225 [1,0,0,0,0,0|3,0,0]=4 323 B6R0.4 CC(=O)NCCS Amb22230992 [1,0,0,0,0,0|3,0,0]=4 324 B6R0.4 CC(=O)OCCF Amb25123333 [1,0,0,0,0,0|3,0,0]=4 325 B6R0.4 CC(=O)OCCI Amb17673987 [1,0,0,0,0,0|3,0,0]=4 326 B6R0.4 CC(=O)OCCN Amb18121947 [1,0,0,0,0,0|3,0,0]=4 327 B6R0.4 CC(=O)OCCP Amb25810695 [1,0,0,0,0,0|3,0,0]=4 328 B6R0.4 CC(=O)SCCBr Amb24608039 [1,0,0,0,0,0|3,0,0]=4 329 B6R0.4 CC(=O)SCCCl Amb24746776 [1,0,0,0,0,0|3,0,0]=4 330 B6R0.4 CC(=O)SCCN Amb21953963 [1,0,0,0,0,0|3,0,0]=4 331 B6R0.4 CC(=O)SCCN Amb22011516 [1,0,0,0,0,0|3,0,0]=4 332 B6R0.4 CC(Br)CCC#N Amb23599106 [1,0,0,0,0,0|2,0,1]=4 333 B6R0.4 CC(Br)CCC=C Amb20669632 [1,0,0,0,0,0|2,0,0]=3 334 B6R0.4 CC(Br)CCC=O Amb18645866 [1,0,0,0,0,0|1,0,0]=2 335 B6R0.4 CC(Br)CCCN Amb25680649 [1,0,0,0,0,0|2,0,1]=4 336 B6R0.4 CC(Br)CCCS Amb25238249 [1,0,0,0,0,0|1,1,1]=4 337 B6R0.4 CC(Br)CCON Amb25774479 [1,0,0,0,0,0|3,0,0]=4 338 B6R0.4 CC(Br)CN=C=O Amb25060716 [1,0,0,0,0,0|2,0,1]=4 339 B6R0.4 CC(Br)COC=O Amb24634016 [1,0,0,0,0,0|2,0,0]=3 340 B6R0.4 CC(C)=C=CC=O Amb25082892 [1,0,0,0,0,0|0,0,3]=4 341 B6R0.4 CC(C)=CC=CO Amb25746627 [1,0,0,0,0,0|0,0,3]=4 342 B6R0.4 CC(C)=CCC=C Amb22230004 [1,0,0,0,0,0|1,0,2]=4 343 B6R0.4 CC(C)=CCC=O Amb18120881 [1,0,0,0,0,0|0,0,2]=3 344 B6R0.4 CC(C)=CCCO Amb22002283 [1,0,0,0,0,0|0,0,3]=4 345 B6R0.4 CC(C)C#CC=O Amb25081455 [1,0,0,0,0,0|0,0,2]=3 346 B6R0.4 CC(C)C#CCO Amb24757812 [1,0,0,0,0,0|0,0,3]=4 347 B6R0.4 CC(C)C=C=CCl Amb25747188 [1,0,0,0,0,0|1,0,2]=4 348 B6R0.4 CC(C)C=CC=C Amb24062928 [1,0,0,0,0,0|1,0,2]=4 349 B6R0.4 CC(C)CCC=O Amb17673735 [1,0,0,0,0,0|0,0,0]=1 350 B6R0.4 CC(C)CCNN Amb20622972 [1,0,0,0,0,0|2,0,0]=3 351 B6R0.4 CC(C)CC[Zn]Br Amb22000394 [1,0,0,0,0,0|2,0,0]=3 352 B6R0.4 CC(C)CN=[N+]=[N-] Amb25328317 [1,0,0,0,0,0|3,0,0]=4 353 B6R0.4 CC(C)COC=C Amb22338580 [1,0,0,0,0,0|2,0,0]=3 354 B6R0.4 CC(C)COCBr Amb25059167 [1,0,0,0,0,0|2,0,1]=4 355 B6R0.4 CC(C)COCN Amb24377110 [1,0,0,0,0,0|2,0,1]=4 356 B6R0.4 CC(C)CSC#N Amb24663736 [1,0,0,0,0,0|2,0,1]=4 357 B6R0.4 CC(C)NC=S=O Amb25743205 [1,0,0,0,0,0|2,0,1]=4 358 B6R0.4 CC(C)NCCBr Amb20224139 [1,0,0,0,0,0|2,0,1]=4 359 B6R0.4 CC(C)NCCCl Amb22001878 [1,0,0,0,0,0|2,0,1]=4 360 B6R0.4 CC(C)NCCS Amb18640872 [1,0,0,0,0,0|1,1,1]=4 361 B6R0.4 CC(C)N\C=N/O Amb25789619 [1,0,0,0,0,0|2,0,1]=4 362 B6R0.4 CC(C)O/C=C/Cl Amb17689422 [1,0,0,0,0,0|2,0,1]=4 363 B6R0.4 CC(C)OCC=C Amb25362033 [1,0,0,0,0,0|2,0,0]=3 364 B6R0.4 CC(C)OCC=O Amb25820659 [1,0,0,0,0,0|1,0,0]=2 365 B6R0.4 CC(C)OCCN Amb21955181 [1,0,0,0,0,0|2,0,1]=4 366 B6R0.4 CC(C)OCCN Amb22491045 [1,0,0,0,0,0|2,0,1]=4 367 B6R0.4 CC(C)OCCS Amb25107566 [1,0,0,0,0,0|1,1,1]=4 368 B6R0.4 CC(C)ONC=O Amb24735855 [1,0,0,0,0,0|2,0,0]=3 369 B6R0.4 CC(C)O\C=C/Cl Amb24391483 [1,0,0,0,0,0|2,0,1]=4 370 B6R0.4 CC(C)SCC#C Amb24479778 [1,0,0,0,0,0|2,0,1]=4 371 B6R0.4 CC(C)SCC=C Amb17933937 [1,0,0,0,0,0|2,0,0]=3 372 B6R0.4 CC(C)SCC=O Amb24479811 [1,0,0,0,0,0|1,0,0]=2 373 B6R0.4 CC(C)SCCBr Amb18321807 [1,0,0,0,0,0|2,0,1]=4 374 B6R0.4 CC(C)SCCI Amb25706190 [1,0,0,0,0,0|2,0,1]=4 375 B6R0.4 CC(C)SCCN Amb21959653 [1,0,0,0,0,0|2,0,1]=4 376 B6R0.4 CC(C)SCCN Amb22586910 [1,0,0,0,0,0|2,0,1]=4 377 B6R0.4 CC(C)S\C=C/Br Amb24531716 [1,0,0,0,0,0|2,0,1]=4 378 B6R0.4 CC(C)S\C=C\Br Amb24617844 [1,0,0,0,0,0|2,0,1]=4 379 B6R0.4 CC(C)\C=C/C=O Amb25313098 [1,0,0,0,0,0|0,0,2]=3 380 B6R0.4 CC(C)\C=C\CO Amb25802048 [1,0,0,0,0,0|0,0,3]=4 381 B6R0.4 CC(Cl)CCC#C Amb24479028 [1,0,0,0,0,0|2,0,1]=4 382 B6R0.4 CC(Cl)CCC#N Amb24479259 [1,0,0,0,0,0|2,0,1]=4 383 B6R0.4 CC(Cl)CCC=C Amb24355384 [1,0,0,0,0,0|2,0,0]=3 384 B6R0.4 CC(Cl)CCC=O Amb18124284 [1,0,0,0,0,0|1,0,0]=2 385 B6R0.4 CC(Cl)CCCBr Amb24479119 [1,0,0,0,0,0|2,0,1]=4 386 B6R0.4 CC(Cl)CCCCl Amb19516004 [1,0,0,0,0,0|2,0,1]=4 387 B6R0.4 CC(Cl)CCCN Amb24479883 [1,0,0,0,0,0|2,0,1]=4 388 B6R0.4 CC(Cl)CNS=O Amb25210515 [1,0,0,0,0,0|3,0,0]=4 389 B6R0.4 CC(Cl)C\C=C\Cl Amb25294374 [1,0,0,0,0,0|2,0,1]=4 390 B6R0.4 CC(Cl)OCC=C Amb25147324 [1,0,0,0,0,0|3,0,0]=4 391 B6R0.4 CC(Cl)SCC=C Amb25109175 [1,0,0,0,0,0|3,0,0]=4 392 B6R0.4 CC(F)CCCN Amb25127855 [1,0,0,0,0,0|2,0,1]=4 393 B6R0.4 CC(I)CCC=O Amb24333933 [1,0,0,0,0,0|1,0,0]=2 394 B6R0.4 CC(I)CCCO Amb25302406 [1,0,0,0,0,0|1,0,1]=3 395 B6R0.4 CC(N)CCC#N Amb24332598 [1,0,0,0,0,0|2,0,1]=4 396 B6R0.4 CC(N)CCC=C Amb18121283 [1,0,0,0,0,0|2,0,0]=3 397 B6R0.4 CC(N)CCC=O Amb24443883 [1,0,0,0,0,0|1,0,0]=2 398 B6R0.4 CC(N)CCCBr Amb24635757 [1,0,0,0,0,0|2,0,1]=4 399 B6R0.4 CC(N)CCCCl Amb24454593 [1,0,0,0,0,0|2,0,1]=4 400 B6R0.4 CC(N)CCCN Amb22168271 [1,0,0,0,0,0|2,0,1]=4 401 B6R0.4 CC(O)CCC=C Amb22059013 [1,0,0,0,0,0|2,0,0]=3 402 B6R0.4 CC(O)CCCCl Amb22270232 [1,0,0,0,0,0|2,0,1]=4 403 B6R0.4 CC(O)CCCF Amb24385806 [1,0,0,0,0,0|2,0,1]=4 404 B6R0.4 CC(O)CCCO Amb22227752 [1,0,0,0,0,0|1,0,1]=3 405 B6R0.4 CC(O)CCCS Amb25219256 [1,0,0,0,0,0|1,1,1]=4 406 B6R0.4 CC(O)CCNN Amb24447142 [1,0,0,0,0,0|3,0,0]=4 407 B6R0.4 CC(O)CNC=O Amb20622242 [1,0,0,0,0,0|2,0,0]=3 408 B6R0.4 CC(O)CNCO Amb25727260 [1,0,0,0,0,0|2,0,1]=4 409 B6R0.4 CC(O)CON=O Amb24480649 [1,0,0,0,0,0|3,0,0]=4 410 B6R0.4 CC(O)CO[PH2]=O Amb24332262 [1,0,0,0,0,0|3,0,0]=4 411 B6R0.4 CC(O)C\C=C/Br Amb25810811 [1,0,0,0,0,0|2,0,1]=4 412 B6R0.4 CC(O)C\C=C\Cl Amb24479438 [1,0,0,0,0,0|2,0,1]=4 413 B6R0.4 CC(O)OCC=C Amb24397961 [1,0,0,0,0,0|3,0,0]=4 414 B6R0.4 CC(O)\C=C\C=O Amb18639615 [1,0,0,0,0,0|1,0,2]=4 415 B6R0.4 CC(S)CCCO Amb24412207 [1,0,0,0,0,0|1,0,1]=3 416 B6R0.4 CC(S)CNC=O Amb24388784 [1,0,0,0,0,0|2,0,0]=3 417 B6R0.4 CC(SCC#N)C Amb17501743 [1,0,0,0,0,0|2,0,1]=4 418 B6R0.4 CC=C=CC(=O)O Amb17593065 [1,0,0,0,0,0|0,0,3]=4 419 B6R0.4 CC=NCC(C)O Amb25213778 [1,0,0,0,0,0|3,0,0]=4 420 B6R0.4 CCC#CC(=O)Cl Amb25857496 [1,0,0,0,0,0|1,0,2]=4 421 B6R0.4 CCC#CC(N)=O Amb25255265 [1,0,0,0,0,0|1,0,2]=4 422 B6R0.4 CCC=CC(C)=O Amb22731698 [1,0,0,0,0,0|1,0,2]=4 423 B6R0.4 CCCC=C(F)F Amb10840483 [1,0,0,0,0,0|2,0,1]=4 424 B6R0.4 CCCCB(Cl)Cl Amb22230362 [1,0,0,0,0,0|3,0,0]=4 425 B6R0.4 CCCCB(O)O Amb2447142 [1,0,0,0,0,0|1,0,1]=3 426 B6R0.4 CCCCC(=C)Br Amb22583744 [1,0,0,0,0,0|2,0,0]=3 427 B6R0.4 CCCCC(=N)N Amb10066937 [1,0,0,0,0,0|2,0,0]=3 428 B6R0.4 CCCCC(=O)Br Amb22730323 [1,0,0,0,0,0|1,0,0]=2 429 B6R0.4 CCCCC(Br)Br Amb25784787 [1,0,0,0,0,0|2,0,1]=4 430 B6R0.4 CCCCC(C)Cl Amb22228753 [1,0,0,0,0,0|2,0,1]=4 431 B6R0.4 CCCCC(C)F Amb24350567 [1,0,0,0,0,0|2,0,1]=4 432 B6R0.4 CCCCC(C)I Amb17673919 [1,0,0,0,0,0|2,0,1]=4 433 B6R0.4 CCCCC(I)I Amb25186537 [1,0,0,0,0,0|2,0,1]=4 434 B6R0.4 CCCCC(N)O Amb24479887 [1,0,0,0,0,0|1,0,1]=3 435 B6R0.4 CCCCC(O)=S Amb24682342 [1,0,0,0,0,0|0,1,0]=2 436 B6R0.4 CCCCC(O)O Amb24687253 [1,0,0,0,0,0|0,0,2]=3 437 B6R0.4 CCCCC(O)S Amb24480485 [1,0,0,0,0,0|0,1,1]=3 438 B6R0.4 CCCCC([O-])=O Amb19879370 [1,0,0,0,0,0|0,0,1]=2 439 B6R0.4 CCCCC([O-])=O Amb22056343 [1,0,0,0,0,0|0,0,1]=2 440 B6R0.4 CCCCC([O-])=O Amb22729192 [1,0,0,0,0,0|0,0,1]=2 441 B6R0.4 CCCCC([O-])=O Amb22731639 [1,0,0,0,0,0|0,0,1]=2 442 B6R0.4 CCCCN(C)N Amb22730468 [1,0,0,0,0,0|3,0,0]=4 443 B6R0.4 CCCCP(Cl)Cl Amb25051489 [1,0,0,0,0,0|3,0,0]=4 444 B6R0.4 CCCCS(=O)Cl Amb24551332 [1,0,0,0,0,0|2,0,0]=3 445 B6R0.4 CCCCS([O-])=O Amb19889352 [1,0,0,0,0,0|1,0,1]=3 446 B6R0.4 CCCC[13C](O)=O Amb22367454 [1,0,0,0,0,0|0,0,0]=1 447 B6R0.4 CCCC[C@@H](C)Br Amb25146346 [1,0,0,0,0,0|2,0,1]=4 448 B6R0.4 CCCC[C@@H](C)I Amb25785621 [1,0,0,0,0,0|2,0,1]=4 449 B6R0.4 CCCC[C@@H](C)N Amb20242479 [1,0,0,0,0,0|2,0,1]=4 450 B6R0.4 CCCC[C@@H](C)O Amb19929139 [1,0,0,0,0,0|1,0,1]=3 451 B6R0.4 CCCC[C@H](C)Br Amb25374601 [1,0,0,0,0,0|2,0,1]=4 452 B6R0.4 CCCC[C@H](C)N Amb20242478 [1,0,0,0,0,0|2,0,1]=4 453 B6R0.4 CCCC[Sn](=O)S Amb22730994 [1,0,0,0,0,0|1,1,0]=3 454 B6R0.4 CCCC[Sn](O)=O Amb22336393 [1,0,0,0,0,0|1,0,0]=2 455 B6R0.4 CCCNC(=N)N Amb10844865 [1,0,0,0,0,0|3,0,0]=4 456 B6R0.4 CCCNC(=N)N Amb16206147 [1,0,0,0,0,0|3,0,0]=4 457 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,0,0,0,0,0|2,0,0]=3 458 B6R0.4 CCCNC(=O)N Amb1152241 [1,0,0,0,0,0|2,0,0]=3 459 B6R0.4 CCCNC(=S)N Amb1152085 [1,0,0,0,0,0|2,1,0]=4 460 B6R0.4 CCCNC(C)=S Amb25742111 [1,0,0,0,0,0|2,1,0]=4 461 B6R0.4 CCCNC(C)O Amb25821613 [1,0,0,0,0,0|2,0,1]=4 462 B6R0.4 CCCNC(N)=N Amb20667746 [1,0,0,0,0,0|3,0,0]=4 463 B6R0.4 CCCNC(O)=S Amb25302945 [1,0,0,0,0,0|1,1,0]=3 464 B6R0.4 CCCNS(C)=O Amb25024775 [1,0,0,0,0,0|3,0,0]=4 465 B6R0.4 CCCN[N+]([O-])=O Amb21953652 [1,0,0,0,0,0|2,0,1]=4 466 B6R0.4 CCCOC(=O)Cl Amb10604123 [1,0,0,0,0,0|2,0,0]=3 467 B6R0.4 CCCOC(N)=S Amb24382119 [1,0,0,0,0,0|2,1,0]=4 468 B6R0.4 CCCOC([S-])=S Amb22334111 [1,0,0,0,0,0|1,2,0]=4 469 B6R0.4 CCCOP(O)=O Amb25366595 [1,0,0,0,0,0|2,0,0]=3 470 B6R0.4 CCCO[N+]([O-])=O Amb22732564 [1,0,0,0,0,0|2,0,1]=4 471 B6R0.4 CCCSC(C)=O Amb22043301 [1,0,0,0,0,0|2,0,0]=3 472 B6R0.4 CCCSC(N)=N Amb20676008 [1,0,0,0,0,0|3,0,0]=4 473 B6R0.4 CCCSC(N)=N Amb23482968 [1,0,0,0,0,0|3,0,0]=4 474 B6R0.4 CCCSC(N)=S Amb24349580 [1,0,0,0,0,0|2,1,0]=4 475 B6R0.4 CCNCC(=C)Br Amb18969562 [1,0,0,0,0,0|3,0,0]=4 476 B6R0.4 CCNCC(=C)Cl Amb18289297 [1,0,0,0,0,0|3,0,0]=4 477 B6R0.4 CCNCC(=O)N Amb1128676 [1,0,0,0,0,0|2,0,0]=3 478 B6R0.4 CCNCC(=O)O Amb10609667 [1,0,0,0,0,0|1,0,0]=2 479 B6R0.4 CCNCC(=S)N Amb17231834 [1,0,0,0,0,0|2,1,0]=4 480 B6R0.4 CCNCC(C)=O Amb24545893 [1,0,0,0,0,0|2,0,0]=3 481 B6R0.4 CCNC[C@H](C)O Amb25785620 [1,0,0,0,0,0|2,0,1]=4 482 B6R0.4 CCOCB(O)O Amb25356792 [1,0,0,0,0,0|2,0,1]=4 483 B6R0.4 CCOCC(=C)Br Amb24673237 [1,0,0,0,0,0|3,0,0]=4 484 B6R0.4 CCOCC(C)=C Amb25761593 [1,0,0,0,0,0|3,0,0]=4 485 B6R0.4 CCOCC(C)C Amb17673917 [1,0,0,0,0,0|2,0,1]=4 486 B6R0.4 CCOCC(N)=N Amb19890012 [1,0,0,0,0,0|3,0,0]=4 487 B6R0.4 CCOC[C@H](C)O Amb25067464 [1,0,0,0,0,0|2,0,1]=4 488 B6R0.4 CCONC(C)=O Amb22230675 [1,0,0,0,0,0|3,0,0]=4 489 B6R0.4 CCSCC(=O)O Amb1125185 [1,0,0,0,0,0|1,0,0]=2 490 B6R0.4 CCSCC(C)C Amb22230686 [1,0,0,0,0,0|2,0,1]=4 491 B6R0.4 CCSCC(C)O Amb24458211 [1,0,0,0,0,0|2,0,1]=4 492 B6R0.4 CCSCC(N)=O Amb24420234 [1,0,0,0,0,0|2,0,0]=3 493 B6R0.4 CCSC[C@H](C)O Amb25220206 [1,0,0,0,0,0|2,0,1]=4 494 B6R0.4 CCSNC(N)=O Amb24479375 [1,0,0,0,0,0|3,0,0]=4 495 B6R0.4 CC\C=C/C(O)=O Amb22230421 [1,0,0,0,0,0|0,0,2]=3 496 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,0,0,0,0,0|1,0,2]=4 497 B6R0.4 CC\C=N\C(N)=O Amb24479183 [1,0,0,0,0,0|2,0,1]=4 498 B6R0.4 CN(C)CC=C=O Amb22733182 [1,0,0,0,0,0|1,0,2]=4 499 B6R0.4 CN(C)CCC#C Amb24460389 [1,0,0,0,0,0|2,0,1]=4 500 B6R0.4 CN(C)CCC=O Amb22001057 [1,0,0,0,0,0|1,0,0]=2 501 B6R0.4 CN(C)CCCF Amb25719076 [1,0,0,0,0,0|2,0,1]=4 502 B6R0.4 CN(C)CCCS Amb24078629 [1,0,0,0,0,0|1,1,1]=4 503 B6R0.4 CN(C)NCCO Amb24467619 [1,0,0,0,0,0|2,0,1]=4 504 B6R0.4 CN(C)\N=C/C=O Amb25309549 [1,0,0,0,0,0|2,0,1]=4 505 B6R0.4 CN(C)\N=C\C=O Amb25787405 [1,0,0,0,0,0|2,0,1]=4 506 B6R0.4 CN(N)CCCO Amb25236057 [1,0,0,0,0,0|2,0,1]=4 507 B6R0.4 CN=CCC(C)=O Amb25261368 [1,0,0,0,0,0|2,0,1]=4 508 B6R0.4 CNCCC(=O)O Amb10609760 [1,0,0,0,0,0|1,0,0]=2 509 B6R0.4 CNCCC(=S)N Amb17231833 [1,0,0,0,0,0|2,1,0]=4 510 B6R0.4 CNCCC(C)=C Amb18993045 [1,0,0,0,0,0|3,0,0]=4 511 B6R0.4 CNCCC(C)=O Amb24560306 [1,0,0,0,0,0|2,0,0]=3 512 B6R0.4 CNCCC(C)Br Amb25718866 [1,0,0,0,0,0|3,0,0]=4 513 B6R0.4 CNCCC(C)C Amb10609494 [1,0,0,0,0,0|2,0,0]=3 514 B6R0.4 CNCCC(C)C Amb1114399 [1,0,0,0,0,0|2,0,0]=3 515 B6R0.4 CNCCC(C)Cl Amb24479264 [1,0,0,0,0,0|3,0,0]=4 516 B6R0.4 CNCCC(C)N Amb18288833 [1,0,0,0,0,0|3,0,0]=4 517 B6R0.4 CNCCC(N)=O Amb19959913 [1,0,0,0,0,0|2,0,0]=3 518 B6R0.4 CNCCC(O)C Amb17569889 [1,0,0,0,0,0|2,0,1]=4 519 B6R0.4 CNCCN(C)C Amb19958398 [1,0,0,0,0,0|3,0,0]=4 520 B6R0.4 CNCCN(C)C Amb20621873 [1,0,0,0,0,0|3,0,0]=4 521 B6R0.4 CNCCS(C)=O Amb21984676 [1,0,0,0,0,0|3,0,0]=4 522 B6R0.4 CNCC[C@H](C)N Amb25825236 [1,0,0,0,0,0|3,0,0]=4 523 B6R0.4 CNNCC(N)=O Amb25773971 [1,0,0,0,0,0|3,0,0]=4 524 B6R0.4 CNNCC(O)=O Amb21929288 [1,0,0,0,0,0|2,0,0]=3 525 B6R0.4 CNOCC(O)=O Amb25104714 [1,0,0,0,0,0|2,0,0]=3 526 B6R0.4 COCCC(C)Br Amb18805533 [1,0,0,0,0,0|3,0,0]=4 527 B6R0.4 COCCC(C)O Amb20621489 [1,0,0,0,0,0|2,0,1]=4 528 B6R0.4 COCCC(N)O Amb25727188 [1,0,0,0,0,0|2,0,1]=4 529 B6R0.4 COCCC(O)Br Amb20242943 [1,0,0,0,0,0|2,0,1]=4 530 B6R0.4 COCCN(=O)=O Amb24126452 [1,0,0,0,0,0|2,0,1]=4 531 B6R0.4 COCCN(C)C Amb16231530 [1,0,0,0,0,0|3,0,0]=4 532 B6R0.4 COCNC(C)=O Amb24659843 [1,0,0,0,0,0|3,0,0]=4 533 B6R0.4 COCNC(N)=O Amb25744350 [1,0,0,0,0,0|3,0,0]=4 534 B6R0.4 CON=CC(O)=O Amb25292253 [1,0,0,0,0,0|2,0,1]=4 535 B6R0.4 CONCC(C)C Amb24423170 [1,0,0,0,0,0|3,0,0]=4 536 B6R0.4 CO\C=C\C(O)=O Amb18121767 [1,0,0,0,0,0|1,0,2]=4 537 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,0,0,0,0,0|2,0,1]=4 538 B6R0.4 CS(=O)CCCBr Amb24365916 [1,0,0,0,0,0|3,0,0]=4 539 B6R0.4 CS(=O)CCCN Amb18974527 [1,0,0,0,0,0|3,0,0]=4 540 B6R0.4 CSCCC(=S)N Amb17307559 [1,0,0,0,0,0|2,1,0]=4 541 B6R0.4 CSCCC(C)F Amb25853953 [1,0,0,0,0,0|3,0,0]=4 542 B6R0.4 CSCCC(C)N Amb19515505 [1,0,0,0,0,0|3,0,0]=4 543 B6R0.4 CSCCC(N)=N Amb19373501 [1,0,0,0,0,0|3,0,0]=4 544 B6R0.4 CSCCC(N)=N Amb19516878 [1,0,0,0,0,0|3,0,0]=4 545 B6R0.4 CSCCC(N)=O Amb24479809 [1,0,0,0,0,0|2,0,0]=3 546 B6R0.4 CSCCN(=O)=O Amb24179458 [1,0,0,0,0,0|2,0,1]=4 547 B6R0.4 CSCCN(C)C Amb24611721 [1,0,0,0,0,0|3,0,0]=4 548 B6R0.4 CSCNC(C)=O Amb24561383 [1,0,0,0,0,0|3,0,0]=4 549 B6R0.4 CSCNC(C)C Amb24712980 [1,0,0,0,0,0|3,0,0]=4 550 B6R0.4 CSCNC(N)=O Amb24612362 [1,0,0,0,0,0|3,0,0]=4 551 B6R0.4 CSCOC(C)=O Amb19884027 [1,0,0,0,0,0|3,0,0]=4 552 B6R0.4 CSSCC(N)=O Amb24480454 [1,0,0,0,0,0|3,0,0]=4 553 B6R0.4 CSSCC(O)=O Amb25378801 [1,0,0,0,0,0|2,0,0]=3 554 B6R0.4 CS\C=C\C(O)=O Amb18641964 [1,0,0,0,0,0|1,0,2]=4 555 B6R0.4 C[C@@H](Cl)CCC=C Amb25074076 [1,0,0,0,0,0|2,0,0]=3 556 B6R0.4 C[C@@H](I)CCC#N Amb25678351 [1,0,0,0,0,0|2,0,1]=4 557 B6R0.4 C[C@@H](N)CCC#N Amb25357194 [1,0,0,0,0,0|2,0,1]=4 558 B6R0.4 C[C@@H](N)CCC=C Amb24670260 [1,0,0,0,0,0|2,0,0]=3 559 B6R0.4 C[C@@H](O)CCC#N Amb24644182 [1,0,0,0,0,0|2,0,1]=4 560 B6R0.4 C[C@@H](O)CCC=C Amb19929324 [1,0,0,0,0,0|2,0,0]=3 561 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [1,0,0,0,0,0|2,0,1]=4 562 B6R0.4 C[C@@H](O)CCCN Amb24479875 [1,0,0,0,0,0|2,0,1]=4 563 B6R0.4 C[C@@H](O)CCCS Amb25794939 [1,0,0,0,0,0|1,1,1]=4 564 B6R0.4 C[C@@H](O)CNC=O Amb25259151 [1,0,0,0,0,0|2,0,0]=3 565 B6R0.4 C[C@@H](O)C\C=C\Br Amb25783863 [1,0,0,0,0,0|2,0,1]=4 566 B6R0.4 C[C@@H](O)C\C=C\Cl Amb25321937 [1,0,0,0,0,0|2,0,1]=4 567 B6R0.4 C[C@@H](O)\C=C\C=O Amb24404886 [1,0,0,0,0,0|1,0,2]=4 568 B6R0.4 C[C@H](Cl)CCCO Amb24525158 [1,0,0,0,0,0|1,0,1]=3 569 B6R0.4 C[C@H](N)CCC#C Amb24401612 [1,0,0,0,0,0|2,0,1]=4 570 B6R0.4 C[C@H](N)CCC#N Amb24351648 [1,0,0,0,0,0|2,0,1]=4 571 B6R0.4 C[C@H](N)CCC=C Amb24332049 [1,0,0,0,0,0|2,0,0]=3 572 B6R0.4 C[C@H](N)CCON Amb25041043 [1,0,0,0,0,0|3,0,0]=4 573 B6R0.4 C[C@H](O)CCC=C Amb22226511 [1,0,0,0,0,0|2,0,0]=3 574 B6R0.4 C[C@H](O)CCCCl Amb22348392 [1,0,0,0,0,0|2,0,1]=4 575 B6R0.4 C[C@H](O)CNC=O Amb25131739 [1,0,0,0,0,0|2,0,0]=3 576 B6R0.4 C[C@H](O)COC=O Amb25662147 [1,0,0,0,0,0|2,0,0]=3 577 B6R0.4 C[C@H](O)C\C=C/Cl Amb25320946 [1,0,0,0,0,0|2,0,1]=4 578 B6R0.4 C[C@H](O)\C=C\C=O Amb25704114 [1,0,0,0,0,0|1,0,2]=4 579 B6R0.4 C[SiH](C)OCC=C Amb22230575 [1,0,0,0,0,0|2,1,0]=4 580 B6R0.4 C[SiH](C)\C=C/C=O Amb24573956 [1,0,0,0,0,0|0,1,2]=4 581 B6R0.4 C[Si](=O)CCCN Amb22351702 [1,0,0,0,0,0|2,1,0]=4 582 B6R0.4 C\C(\Br)=C/CC=O Amb25811514 [1,0,0,0,0,0|1,0,2]=4 583 B6R0.4 C\C=C/CC(C)=O Amb25723218 [1,0,0,0,0,0|1,0,2]=4 584 B6R0.4 C\C=C/CC(O)=O Amb25692581 [1,0,0,0,0,0|0,0,2]=3 585 B6R0.4 C\C=C\CC(C)=O Amb24359011 [1,0,0,0,0,0|1,0,2]=4 586 B6R0.4 C\C=C\CC(C)Br Amb24333875 [1,0,0,0,0,0|2,0,1]=4 587 B6R0.4 C\C=C\CC(C)Cl Amb25124058 [1,0,0,0,0,0|2,0,1]=4 588 B6R0.4 C\C=C\CC(C)O Amb24480541 [1,0,0,0,0,0|2,0,1]=4 589 B6R0.4 C\C=N\CC(O)=O Amb24618330 [1,0,0,0,0,0|1,0,1]=3 590 B6R0.4 ClCCCC(=O)N Amb1138237 [1,0,0,0,0,0|2,0,0]=3 591 B6R0.4 ClCCNC(C)C Amb17334075 [1,0,0,0,0,0|2,0,1]=4 592 B6R0.4 ClCCSC(C)C Amb15694848 [1,0,0,0,0,0|2,0,1]=4 593 B6R0.4 FCCCC(=O)O Amb17593104 [1,0,0,0,0,0|1,0,0]=2 594 B6R0.4 N#CCCC(=O)C Amb17334046 [1,0,0,0,0,0|2,0,1]=4 595 B6R0.4 N#CCCC(=O)Cl Amb25106570 [1,0,0,0,0,0|2,0,1]=4 596 B6R0.4 N#CNCC(O)=O Amb25173813 [1,0,0,0,0,0|2,0,1]=4 597 B6R0.4 N#CSCC(O)=O Amb24480976 [1,0,0,0,0,0|2,0,1]=4 598 B6R0.4 N=CNCC(O)=O Amb24670244 [1,0,0,0,0,0|2,0,1]=4 599 B6R0.4 NC(=O)CCCBr Amb25779163 [1,0,0,0,0,0|2,0,0]=3 600 B6R0.4 NC(=O)CCCO Amb20623438 [1,0,0,0,0,0|2,0,0]=3 601 B6R0.4 NC(=O)CSCCl Amb25135617 [1,0,0,0,0,0|3,0,0]=4 602 B6R0.4 NC(=O)NCCO Amb1146041 [1,0,0,0,0,0|3,0,0]=4 603 B6R0.4 NC(=O)OCCBr Amb25145573 [1,0,0,0,0,0|3,0,0]=4 604 B6R0.4 NC(=O)OCCO Amb20623788 [1,0,0,0,0,0|3,0,0]=4 605 B6R0.4 NC(=S)CCCF Amb24667655 [1,0,0,0,0,0|2,1,0]=4 606 B6R0.4 NCC#CC(O)=O Amb25703096 [1,0,0,0,0,0|1,0,2]=4 607 B6R0.4 NCCCC(=O)Cl Amb1935063 [1,0,0,0,0,0|2,0,0]=3 608 B6R0.4 NCCCC(=O)N Amb2099583 [1,0,0,0,0,0|2,0,0]=3 609 B6R0.4 NCCCC(=O)O Amb1935210 [1,0,0,0,0,0|1,0,0]=2 610 B6R0.4 NCCCC(C)C Amb1136518 [1,0,0,0,0,0|1,0,1]=3 611 B6R0.4 NCCCC(C)C Amb13952127 [1,0,0,0,0,0|1,0,1]=3 612 B6R0.4 NCCCC(Cl)=O Amb17801145 [1,0,0,0,0,0|2,0,0]=3 613 B6R0.4 NCCCC(N)=S Amb24479598 [1,0,0,0,0,0|2,1,0]=4 614 B6R0.4 NCCCC(N)O Amb25063002 [1,0,0,0,0,0|2,0,1]=4 615 B6R0.4 NCCCP(O)=O Amb22370049 [1,0,0,0,0,0|2,0,0]=3 616 B6R0.4 NCCCS(=O)=O Amb24427014 [1,0,0,0,0,0|2,0,1]=4 617 B6R0.4 NCCCS(O)=O Amb25185942 [1,0,0,0,0,0|2,0,0]=3 618 B6R0.4 NCCC[N+]([O-])=O Amb18833132 [1,0,0,0,0,0|2,0,1]=4 619 B6R0.4 NCCNC(N)=O Amb19374121 [1,0,0,0,0,0|3,0,0]=4 620 B6R0.4 NCCOC(N)=O Amb22059480 [1,0,0,0,0,0|3,0,0]=4 621 B6R0.4 NCCOC(N)=O Amb24271076 [1,0,0,0,0,0|3,0,0]=4 622 B6R0.4 NCCOS(O)=O Amb25843211 [1,0,0,0,0,0|3,0,0]=4 623 B6R0.4 NC\C=C/C(O)=O Amb24117018 [1,0,0,0,0,0|1,0,2]=4 624 B6R0.4 NC\C=C\C(O)=O Amb18639655 [1,0,0,0,0,0|1,0,2]=4 625 B6R0.4 NC\C=C\C(O)=O Amb24325004 [1,0,0,0,0,0|1,0,2]=4 626 B6R0.4 NNCCC(N)=O Amb24406769 [1,0,0,0,0,0|3,0,0]=4 627 B6R0.4 NNCCN(C)C Amb1116628 [1,0,0,0,0,0|3,0,0]=4 628 B6R0.4 NOCCC(=O)O Amb17569891 [1,0,0,0,0,0|2,0,0]=3 629 B6R0.4 NOCCC(C)C Amb17101067 [1,0,0,0,0,0|2,0,0]=3 630 B6R0.4 NOCCN(C)C Amb17104842 [1,0,0,0,0,0|3,0,0]=4 631 B6R0.4 O=C(Br)CCCBr Amb25724818 [1,0,0,0,0,0|2,0,0]=3 632 B6R0.4 O=C(Br)CCCCl Amb25146320 [1,0,0,0,0,0|2,0,0]=3 633 B6R0.4 O=C(Cl)NCCCl Amb24479815 [1,0,0,0,0,0|3,0,0]=4 634 B6R0.4 O=C(Cl)OCCF Amb21618836 [1,0,0,0,0,0|3,0,0]=4 635 B6R0.4 O=C(Cl)SCCCl Amb25272444 [1,0,0,0,0,0|3,0,0]=4 636 B6R0.4 O=C(S)CCCCl Amb24683280 [1,0,0,0,0,0|1,1,0]=3 637 B6R0.4 O=CCCC(Cl)Cl Amb25241164 [1,0,0,0,0,0|2,0,0]=3 638 B6R0.4 O=CCCC(F)F Amb25848573 [1,0,0,0,0,0|2,0,0]=3 639 B6R0.4 O=CCCC(O)C Amb17593090 [1,0,0,0,0,0|1,0,0]=2 640 B6R0.4 O=CCOC(=O)C Amb10070247 [1,0,0,0,0,0|2,0,1]=4 641 B6R0.4 O=CNCC(=O)O Amb1911508 [1,0,0,0,0,0|2,0,1]=4 642 B6R0.4 O=CNCC(Cl)Cl Amb25760256 [1,0,0,0,0,0|3,0,0]=4 643 B6R0.4 O=CNN=C(C)C Amb2419224 [1,0,0,0,0,0|2,0,1]=4 644 B6R0.4 O=COCC(Cl)Cl Amb25778565 [1,0,0,0,0,0|3,0,0]=4 645 B6R0.4 O=COCC(F)F Amb22008000 [1,0,0,0,0,0|3,0,0]=4 646 B6R0.4 O=C\C=C\C(C)C Amb13777283 [1,0,0,0,0,0|0,0,2]=3 647 B6R0.4 O=S(Cl)CCCCl Amb25791632 [1,0,0,0,0,0|3,0,0]=4 648 B6R0.4 OB(O)CCCBr Amb24480413 [1,0,0,0,0,0|2,0,1]=4 649 B6R0.4 OC(=O)CCC=O Amb17673897 [1,0,0,0,0,0|1,0,1]=3 650 B6R0.4 OC(=O)CCCI Amb22295911 [1,0,0,0,0,0|1,0,0]=2 651 B6R0.4 OC(=O)CCCP Amb24717184 [1,0,0,0,0,0|1,0,0]=2 652 B6R0.4 OC(=O)CCNCl Amb24437846 [1,0,0,0,0,0|2,0,0]=3 653 B6R0.4 OC(=O)CN=C=S Amb25024397 [1,0,0,0,0,0|2,0,1]=4 654 B6R0.4 OC(=O)CSN=O Amb24368923 [1,0,0,0,0,0|3,0,0]=4 655 B6R0.4 OC(=O)C\C=C\Br Amb24511491 [1,0,0,0,0,0|1,0,2]=4 656 B6R0.4 OC(=O)C\C=C\Cl Amb25111871 [1,0,0,0,0,0|1,0,2]=4 657 B6R0.4 OC(=O)C\C=C\I Amb24507704 [1,0,0,0,0,0|1,0,2]=4 658 B6R0.4 OC(=O)\C=C\CBr Amb18646194 [1,0,0,0,0,0|1,0,2]=4 659 B6R0.4 OC(=O)\C=C\CCl Amb23399655 [1,0,0,0,0,0|1,0,2]=4 660 B6R0.4 OC(=O)\C=C\CF Amb24117236 [1,0,0,0,0,0|1,0,2]=4 661 B6R0.4 OC(=O)\C=C\CI Amb25350297 [1,0,0,0,0,0|1,0,2]=4 662 B6R0.4 OC(=O)\C=C\CS Amb18285239 [1,0,0,0,0,0|1,0,2]=4 663 B6R0.4 OCC#CC(O)=O Amb22002375 [1,0,0,0,0,0|1,0,2]=4 664 B6R0.4 OCCCC(=O)O Amb17615189 [1,0,0,0,0,0|1,0,0]=2 665 B6R0.4 OCCCC(Cl)Cl Amb25811607 [1,0,0,0,0,0|2,0,1]=4 666 B6R0.4 OCCCC(N)C Amb17569888 [1,0,0,0,0,0|1,0,1]=3 667 B6R0.4 OCCCC(O)=O Amb18640332 [1,0,0,0,0,0|1,0,0]=2 668 B6R0.4 OCCCC(O)O Amb22802459 [1,0,0,0,0,0|1,0,2]=4 669 B6R0.4 OCCNS(O)=O Amb25283153 [1,0,0,0,0,0|3,0,0]=4 670 B6R0.4 OCCOC(=O)S Amb25106059 [1,0,0,0,0,0|2,1,0]=4 671 B6R0.4 OCCOP(O)=O Amb25739645 [1,0,0,0,0,0|3,0,0]=4 672 B6R0.4 OCCOS(O)=O Amb17942859 [1,0,0,0,0,0|3,0,0]=4 673 B6R0.4 ON=NCC(O)=O Amb25204101 [1,0,0,0,0,0|3,0,0]=4 674 B6R0.4 OP(=O)OCCCl Amb24479734 [1,0,0,0,0,0|3,0,0]=4 675 B6R0.4 O[13CH2][13CH2][13CH2][13C](O)=O Amb19132555 [1,0,0,0,0,0|1,0,0]=2 676 B6R0.4 SCCCC(=O)O Amb16185429 [1,0,0,0,0,0|1,0,0]=2 677 B6R0.4 [C-]#[N+]CCC(N)=O Amb24411954 [1,0,0,0,0,0|2,0,1]=4 678 B6R0.4 [C-]#[N+]CCN(C)C Amb1981033 [1,0,0,0,0,0|3,0,0]=4 679 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [1,0,0,0,0,0|3,0,0]=4 680 B6R0.4 [O-]C(=O)OCCBr Amb24394548 [1,0,0,0,0,0|2,0,1]=4 681 B6R0.4 [O-][N+](=O)CCC=O Amb24052990 [1,0,0,0,0,0|3,0,0]=4 682 B6R0.4 [O-][N+](=O)CCCCl Amb25267487 [1,0,0,0,0,0|2,0,1]=4 683 B6R0.4 [O-][N+](=O)CCCF Amb25234942 [1,0,0,0,0,0|2,0,1]=4 684 B6R0.4 [O-][N+](=O)CCCO Amb20247690 [1,0,0,0,0,0|2,0,1]=4 685 B8R0.9 BrCC(=O)NCC(C)C Amb10608023 [0,1,0,0,0,0|2,0,0]=3 686 B8R0.9 C#CC(N)CCC(O)=O Amb22352566 [0,1,0,0,0,0|1,0,1]=3 687 B8R0.9 C=C(CCC(O)=O)C#N Amb24465180 [0,1,0,0,0,0|0,0,3]=4 688 B8R0.9 C=C(CCC(O)=O)C=C Amb18642412 [0,1,0,0,0,0|0,0,3]=4 689 B8R0.9 C=CC(=O)CCC(O)=O Amb22055999 [0,1,0,0,0,0|1,0,2]=4 690 B8R0.9 C=CC(N)CCC(O)=O Amb22056347 [0,1,0,0,0,0|1,0,1]=3 691 B8R0.9 C=CC(O)CCC(O)=O Amb25785193 [0,1,0,0,0,0|1,0,1]=3 692 B8R0.9 C=C[C@H](N)CCC(O)=O Amb25694354 [0,1,0,0,0,0|1,0,1]=3 693 B8R0.9 CC(=C)CCC(N)CO Amb25775333 [0,1,0,0,0,0|3,0,0]=4 694 B8R0.9 CC(=C)CCC(O)CBr Amb25101568 [0,1,0,0,0,0|3,0,0]=4 695 B8R0.9 CC(=C)CCC(O)CCl Amb25378826 [0,1,0,0,0,0|3,0,0]=4 696 B8R0.9 CC(=C)CC[C@@H](O)CO Amb25099425 [0,1,0,0,0,0|3,0,0]=4 697 B8R0.9 CC(=C)CC[C@H](O)CO Amb24732167 [0,1,0,0,0,0|3,0,0]=4 698 B8R0.9 CC(=CCC(O)=O)C#N Amb25175102 [0,1,0,0,0,0|0,0,3]=4 699 B8R0.9 CC(=O)CCC(=C)C=O Amb24640352 [0,1,0,0,0,0|2,0,1]=4 700 B8R0.9 CC(=O)CCC(=C)CC Amb24433642 [0,1,0,0,0,0|1,0,2]=4 701 B8R0.9 CC(=O)CCC(=O)C=C Amb10562681 [0,1,0,0,0,0|2,0,1]=4 702 B8R0.9 CC(=O)CCC(=O)C=O Amb25224384 [0,1,0,0,0,0|1,0,2]=4 703 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,1,0,0,0,0|2,0,1]=4 704 B8R0.9 CC(=O)CCC(Br)CCl Amb24480346 [0,1,0,0,0,0|2,0,0]=3 705 B8R0.9 CC(=O)CCC(Cl)C=O Amb25275061 [0,1,0,0,0,0|2,0,1]=4 706 B8R0.9 CC(=O)CCC(Cl)CO Amb25274671 [0,1,0,0,0,0|2,0,0]=3 707 B8R0.9 CC(=O)CCC(F)CBr Amb25201516 [0,1,0,0,0,0|2,0,0]=3 708 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,1,0,0,0,0|2,0,0]=3 709 B8R0.9 CC(=O)CCC(N)CO Amb25257834 [0,1,0,0,0,0|2,0,0]=3 710 B8R0.9 CC(=O)CCC(O)C=C Amb24614737 [0,1,0,0,0,0|2,0,1]=4 711 B8R0.9 CC(=O)CCC(O)CCl Amb25118823 [0,1,0,0,0,0|2,0,0]=3 712 B8R0.9 CC(=O)COC(=O)OC Amb25177471 [0,1,0,0,0,0|2,0,1]=4 713 B8R0.9 CC(=O)CSC(=O)OC Amb25318847 [0,1,0,0,0,0|2,0,1]=4 714 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [0,1,0,0,0,0|2,0,1]=4 715 B8R0.9 CC(=O)NCC(F)CBr Amb24676009 [0,1,0,0,0,0|3,0,0]=4 716 B8R0.9 CC(=O)NCC(N)CO Amb25276356 [0,1,0,0,0,0|3,0,0]=4 717 B8R0.9 CC(=O)NCC(O)CCl Amb22235217 [0,1,0,0,0,0|3,0,0]=4 718 B8R0.9 CC(=O)NCC(O)CN Amb25139837 [0,1,0,0,0,0|3,0,0]=4 719 B8R0.9 CC(=O)NCC(O)CO Amb24359036 [0,1,0,0,0,0|3,0,0]=4 720 B8R0.9 CC(=O)NC[C@@H](O)CCl Amb22746506 [0,1,0,0,0,0|3,0,0]=4 721 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,1,0,0,0,0|3,0,0]=4 722 B8R0.9 CC(=O)OCC(Br)CCl Amb24713634 [0,1,0,0,0,0|3,0,0]=4 723 B8R0.9 CC(=O)OCC(CCl)O Amb17593815 [0,1,0,0,0,0|3,0,0]=4 724 B8R0.9 CC(=O)OCC(Cl)CBr Amb25113223 [0,1,0,0,0,0|3,0,0]=4 725 B8R0.9 CC(=O)OCC(Cl)CCl Amb24415406 [0,1,0,0,0,0|3,0,0]=4 726 B8R0.9 CC(=O)OCC(F)CBr Amb25275153 [0,1,0,0,0,0|3,0,0]=4 727 B8R0.9 CC(=O)OCC(O)CBr Amb24443015 [0,1,0,0,0,0|3,0,0]=4 728 B8R0.9 CC(=O)OCC(O)CF Amb24386984 [0,1,0,0,0,0|3,0,0]=4 729 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,1,0,0,0,0|3,0,0]=4 730 B8R0.9 CC(=O)OC[C@@H](Cl)CCl Amb24470042 [0,1,0,0,0,0|3,0,0]=4 731 B8R0.9 CC(=O)OC[C@@H](O)CBr Amb25232647 [0,1,0,0,0,0|3,0,0]=4 732 B8R0.9 CC(=O)OC[C@H](Cl)CCl Amb25300289 [0,1,0,0,0,0|3,0,0]=4 733 B8R0.9 CC(=O)SCC(Cl)CCl Amb24572286 [0,1,0,0,0,0|3,0,0]=4 734 B8R0.9 CC(=O)SCC(N)CO Amb25245383 [0,1,0,0,0,0|3,0,0]=4 735 B8R0.9 CC(=O)SCC(O)CO Amb25105864 [0,1,0,0,0,0|3,0,0]=4 736 B8R0.9 CC(Br)COC(=O)CCl Amb25301888 [0,1,0,0,0,0|3,0,0]=4 737 B8R0.9 CC(Br)COC(=O)CS Amb24680305 [0,1,0,0,0,0|2,1,0]=4 738 B8R0.9 CC(C#C)OCC(O)=O Amb25092433 [0,1,0,0,0,0|1,0,1]=3 739 B8R0.9 CC(C#N)NCC(N)=O Amb18981185 [0,1,0,0,0,0|2,0,1]=4 740 B8R0.9 CC(C#N)NCC(O)=O Amb18293465 [0,1,0,0,0,0|1,0,1]=3 741 B8R0.9 CC(C#N)SCC(C)=O Amb25134370 [0,1,0,0,0,0|2,0,1]=4 742 B8R0.9 CC(C#N)SCC(N)=O Amb25691103 [0,1,0,0,0,0|2,0,1]=4 743 B8R0.9 CC(C#N)SCC(O)=O Amb18293809 [0,1,0,0,0,0|1,0,1]=3 744 B8R0.9 CC(C)=CCC(=C)C=O Amb25092965 [0,1,0,0,0,0|1,0,2]=4 745 B8R0.9 CC(C)=CNC(=O)OC Amb25146144 [0,1,0,0,0,0|1,0,2]=4 746 B8R0.9 CC(C)C=C=C(C)CO Amb25358163 [0,1,0,0,0,0|1,0,2]=4 747 B8R0.9 CC(C)CCC(=O)C=C Amb25341966 [0,1,0,0,0,0|1,0,0]=2 748 B8R0.9 CC(C)CCC(=O)CBr Amb24374602 [0,1,0,0,0,0|1,0,0]=2 749 B8R0.9 CC(C)CCC(=O)CCl Amb20668816 [0,1,0,0,0,0|1,0,0]=2 750 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,1,0,0,0,0|0,0,0]=1 751 B8R0.9 CC(C)CCC(Br)C=O Amb24480019 [0,1,0,0,0,0|1,0,1]=3 752 B8R0.9 CC(C)CCC(Br)CC Amb18330345 [0,1,0,0,0,0|2,0,1]=4 753 B8R0.9 CC(C)CCC(C)=CBr Amb24425146 [0,1,0,0,0,0|2,0,0]=3 754 B8R0.9 CC(C)CCC(C)=NN Amb25256965 [0,1,0,0,0,0|2,0,0]=3 755 B8R0.9 CC(C)CCC(C)=NO Amb25235824 [0,1,0,0,0,0|1,0,0]=2 756 B8R0.9 CC(C)CCC(C)C=O Amb24478638 [0,1,0,0,0,0|1,0,1]=3 757 B8R0.9 CC(C)CCC(C)CC Amb22228305 [0,1,0,0,0,0|2,0,1]=4 758 B8R0.9 CC(C)CCC(C)CCl Amb25774761 [0,1,0,0,0,0|2,0,1]=4 759 B8R0.9 CC(C)CCC(C)CO Amb24478637 [0,1,0,0,0,0|1,0,1]=3 760 B8R0.9 CC(C)CCC(C)NO Amb25778747 [0,1,0,0,0,0|1,0,1]=3 761 B8R0.9 CC(C)CCC(Cl)C#N Amb24694555 [0,1,0,0,0,0|2,0,1]=4 762 B8R0.9 CC(C)CCC(Cl)CC Amb25839524 [0,1,0,0,0,0|2,0,1]=4 763 B8R0.9 CC(C)CCC(F)CN Amb24481735 [0,1,0,0,0,0|2,0,1]=4 764 B8R0.9 CC(C)CCC(N)C=C Amb24478663 [0,1,0,0,0,0|2,0,1]=4 765 B8R0.9 CC(C)CCC(N)CN Amb25336845 [0,1,0,0,0,0|2,0,1]=4 766 B8R0.9 CC(C)CCC(N)CO Amb18832528 [0,1,0,0,0,0|1,0,1]=3 767 B8R0.9 CC(C)CCC(O)C#C Amb25207509 [0,1,0,0,0,0|1,0,1]=3 768 B8R0.9 CC(C)CCC(O)C=O Amb24607253 [0,1,0,0,0,0|0,0,1]=2 769 B8R0.9 CC(C)CCC(O)CC Amb19944686 [0,1,0,0,0,0|1,0,1]=3 770 B8R0.9 CC(C)CCC(O)OC Amb25320255 [0,1,0,0,0,0|0,0,2]=3 771 B8R0.9 CC(C)CCN(C)C#N Amb25792786 [0,1,0,0,0,0|3,0,0]=4 772 B8R0.9 CC(C)CCN(C)C=O Amb24725180 [0,1,0,0,0,0|2,0,0]=3 773 B8R0.9 CC(C)CC[C@@H](O)C#C Amb24353164 [0,1,0,0,0,0|1,0,1]=3 774 B8R0.9 CC(C)CC[C@@H](O)CC Amb25267597 [0,1,0,0,0,0|1,0,1]=3 775 B8R0.9 CC(C)CC[C@H](C)CO Amb25781634 [0,1,0,0,0,0|1,0,1]=3 776 B8R0.9 CC(C)CC[C@H](O)C#C Amb24532923 [0,1,0,0,0,0|1,0,1]=3 777 B8R0.9 CC(C)CC\C(\C)=N/O Amb24547350 [0,1,0,0,0,0|1,0,0]=2 778 B8R0.9 CC(C)CC\C(\C)=N\O Amb22732538 [0,1,0,0,0,0|1,0,0]=2 779 B8R0.9 CC(C)CNC(=N)CCl Amb25336484 [0,1,0,0,0,0|3,0,0]=4 780 B8R0.9 CC(C)CNC(=N)CO Amb23515001 [0,1,0,0,0,0|2,0,0]=3 781 B8R0.9 CC(C)CNC(=O)CI Amb23447333 [0,1,0,0,0,0|2,0,0]=3 782 B8R0.9 CC(C)CNC(=O)NCl Amb24465680 [0,1,0,0,0,0|2,0,0]=3 783 B8R0.9 CC(C)CN[C@@H](C)CO Amb24673564 [0,1,0,0,0,0|2,0,1]=4 784 B8R0.9 CC(C)COC(=C)CCl Amb24394716 [0,1,0,0,0,0|3,0,0]=4 785 B8R0.9 CC(C)COC(=O)CBr Amb22036611 [0,1,0,0,0,0|2,0,0]=3 786 B8R0.9 CC(C)COC(=O)CN Amb19011993 [0,1,0,0,0,0|2,0,0]=3 787 B8R0.9 CC(C)COC(=O)NN Amb25145008 [0,1,0,0,0,0|2,0,0]=3 788 B8R0.9 CC(C)COC(=O)NO Amb24481916 [0,1,0,0,0,0|1,0,0]=2 789 B8R0.9 CC(C)COC(C)CO Amb24395755 [0,1,0,0,0,0|2,0,1]=4 790 B8R0.9 CC(C)COC(C)ON Amb24481690 [0,1,0,0,0,0|2,0,1]=4 791 B8R0.9 CC(C)CSC(=S)NN Amb24477801 [0,1,0,0,0,0|2,1,0]=4 792 B8R0.9 CC(C)CSC(C)C=O Amb25695882 [0,1,0,0,0,0|2,0,1]=4 793 B8R0.9 CC(C)CSC(N)=NN Amb25346517 [0,1,0,0,0,0|3,0,0]=4 794 B8R0.9 CC(C)C\C=C(/C)\C=O Amb25055531 [0,1,0,0,0,0|1,0,1]=3 795 B8R0.9 CC(C)C\C=C(/F)\C=O Amb24631174 [0,1,0,0,0,0|1,0,1]=3 796 B8R0.9 CC(C)C\C=C(\C)/C=O Amb24573481 [0,1,0,0,0,0|1,0,1]=3 797 B8R0.9 CC(C)C\C=C(\C)/CBr Amb25288179 [0,1,0,0,0,0|2,0,1]=4 798 B8R0.9 CC(C)NCC(=C)C#N Amb18642251 [0,1,0,0,0,0|3,0,0]=4 799 B8R0.9 CC(C)NCC(=O)C#C Amb24746396 [0,1,0,0,0,0|2,0,0]=3 800 B8R0.9 CC(C)NCC(C)=CBr Amb25065306 [0,1,0,0,0,0|3,0,0]=4 801 B8R0.9 CC(C)NCC(C)OC Amb19025031 [0,1,0,0,0,0|2,0,1]=4 802 B8R0.9 CC(C)NCC(N)CO Amb24570954 [0,1,0,0,0,0|2,0,1]=4 803 B8R0.9 CC(C)NCC(O)C=C Amb24470640 [0,1,0,0,0,0|2,0,1]=4 804 B8R0.9 CC(C)NCC(O)CBr Amb25717709 [0,1,0,0,0,0|2,0,1]=4 805 B8R0.9 CC(C)NCC(O)CC Amb18304016 [0,1,0,0,0,0|2,0,1]=4 806 B8R0.9 CC(C)NCC(O)CCl Amb18644496 [0,1,0,0,0,0|2,0,1]=4 807 B8R0.9 CC(C)NCC(O)CF Amb24709218 [0,1,0,0,0,0|2,0,1]=4 808 B8R0.9 CC(C)NCC(O)CN Amb18560964 [0,1,0,0,0,0|2,0,1]=4 809 B8R0.9 CC(C)NC[C@@H](O)CCl Amb24387963 [0,1,0,0,0,0|2,0,1]=4 810 B8R0.9 CC(C)NC[C@@H](O)CO Amb22225216 [0,1,0,0,0,0|1,0,2]=4 811 B8R0.9 CC(C)NC[C@H](O)CO Amb22226523 [0,1,0,0,0,0|1,0,2]=4 812 B8R0.9 CC(C)NC\C(\C)=C/Cl Amb24340272 [0,1,0,0,0,0|3,0,0]=4 813 B8R0.9 CC(C)NNC(=O)CN Amb25146096 [0,1,0,0,0,0|3,0,0]=4 814 B8R0.9 CC(C)OCC(=C)C=O Amb25294437 [0,1,0,0,0,0|2,0,0]=3 815 B8R0.9 CC(C)OCC(=C)CN Amb24763256 [0,1,0,0,0,0|3,0,0]=4 816 B8R0.9 CC(C)OCC(=C)CS Amb24350998 [0,1,0,0,0,0|2,1,0]=4 817 B8R0.9 CC(C)OCC(=C)NN Amb24528632 [0,1,0,0,0,0|3,0,0]=4 818 B8R0.9 CC(C)OCC(=O)C=C Amb24614526 [0,1,0,0,0,0|2,0,0]=3 819 B8R0.9 CC(C)OCC(=O)CCl Amb24481789 [0,1,0,0,0,0|2,0,0]=3 820 B8R0.9 CC(C)OCC(=O)CN Amb24481788 [0,1,0,0,0,0|2,0,0]=3 821 B8R0.9 CC(C)OCC(Br)C=O Amb25147129 [0,1,0,0,0,0|2,0,1]=4 822 B8R0.9 CC(C)OCC(Br)CO Amb24635733 [0,1,0,0,0,0|2,0,1]=4 823 B8R0.9 CC(C)OCC(F)CO Amb25129541 [0,1,0,0,0,0|2,0,1]=4 824 B8R0.9 CC(C)OCC(N)=NN Amb25776097 [0,1,0,0,0,0|3,0,0]=4 825 B8R0.9 CC(C)OCC(O)CC Amb25372259 [0,1,0,0,0,0|2,0,1]=4 826 B8R0.9 CC(C)OCC(O)CCl Amb22359767 [0,1,0,0,0,0|2,0,1]=4 827 B8R0.9 CC(C)OCC(O)CI Amb20668786 [0,1,0,0,0,0|2,0,1]=4 828 B8R0.9 CC(C)OCC(O)CO Amb24384701 [0,1,0,0,0,0|1,0,2]=4 829 B8R0.9 CC(C)OC[C@@H](O)CCl Amb25189071 [0,1,0,0,0,0|2,0,1]=4 830 B8R0.9 CC(C)OC[C@@H](O)CN Amb25357930 [0,1,0,0,0,0|2,0,1]=4 831 B8R0.9 CC(C)OC[C@@H](O)CO Amb25042803 [0,1,0,0,0,0|1,0,2]=4 832 B8R0.9 CC(C)OC\C(\C)=C/Cl Amb24366067 [0,1,0,0,0,0|3,0,0]=4 833 B8R0.9 CC(C)O\C=C(\Br)/C=O Amb24670208 [0,1,0,0,0,0|2,0,1]=4 834 B8R0.9 CC(C)O\C=C(\Cl)/C=O Amb24666776 [0,1,0,0,0,0|2,0,1]=4 835 B8R0.9 CC(C)SCC(=C)CN Amb24349514 [0,1,0,0,0,0|3,0,0]=4 836 B8R0.9 CC(C)SCC(=O)C#C Amb24479927 [0,1,0,0,0,0|2,0,0]=3 837 B8R0.9 CC(C)SCC(=O)NO Amb25741291 [0,1,0,0,0,0|1,0,0]=2 838 B8R0.9 CC(C)SCC(C)=CCl Amb25115633 [0,1,0,0,0,0|3,0,0]=4 839 B8R0.9 CC(C)SCC(C)CO Amb24739480 [0,1,0,0,0,0|2,0,1]=4 840 B8R0.9 CC(C)SCC(Cl)=CCl Amb25099625 [0,1,0,0,0,0|3,0,0]=4 841 B8R0.9 CC(C)SCC(N)=NN Amb25287684 [0,1,0,0,0,0|3,0,0]=4 842 B8R0.9 CC(C)SCC(N)=NO Amb25771404 [0,1,0,0,0,0|2,0,0]=3 843 B8R0.9 CC(C)SCC(N)CO Amb25092343 [0,1,0,0,0,0|2,0,1]=4 844 B8R0.9 CC(C)SCC(O)CN Amb18303997 [0,1,0,0,0,0|2,0,1]=4 845 B8R0.9 CC(C)SCC(O)CO Amb24379752 [0,1,0,0,0,0|1,0,2]=4 846 B8R0.9 CC(C)SC[C@@H](O)CN Amb24352373 [0,1,0,0,0,0|2,0,1]=4 847 B8R0.9 CC(C)SC[C@H](O)CC Amb24363374 [0,1,0,0,0,0|2,0,1]=4 848 B8R0.9 CC(C)\C=C\C(=C)CO Amb25266823 [0,1,0,0,0,0|1,0,2]=4 849 B8R0.9 CC(C)\C=C\C(=O)CF Amb24395428 [0,1,0,0,0,0|1,0,2]=4 850 B8R0.9 CC(C)\C=C\C(=O)NN Amb25090316 [0,1,0,0,0,0|1,0,2]=4 851 B8R0.9 CC(C=C)NCC(N)=O Amb24592190 [0,1,0,0,0,0|2,0,1]=4 852 B8R0.9 CC(C=C)NCC(O)=O Amb18310594 [0,1,0,0,0,0|1,0,1]=3 853 B8R0.9 CC(C=C)OCC(O)=O Amb18642764 [0,1,0,0,0,0|1,0,1]=3 854 B8R0.9 CC(C=C)SCC(O)=O Amb18311113 [0,1,0,0,0,0|1,0,1]=3 855 B8R0.9 CC(CBr)CCC(O)=O Amb25806134 [0,1,0,0,0,0|0,0,0]=1 856 B8R0.9 CC(CBr)COC(C)=O Amb22386917 [0,1,0,0,0,0|2,0,0]=3 857 B8R0.9 CC(CC)=C=CC(O)=O Amb25378500 [0,1,0,0,0,0|0,0,3]=4 858 B8R0.9 CC(CCC(=C)Cl)C=O Amb24532891 [0,1,0,0,0,0|2,0,1]=4 859 B8R0.9 CC(CCC(C)=C)C=O Amb18642470 [0,1,0,0,0,0|2,0,1]=4 860 B8R0.9 CC(CCC(C)=C)NN Amb24360588 [0,1,0,0,0,0|3,0,0]=4 861 B8R0.9 CC(CCC(C)=O)=CCl Amb24581923 [0,1,0,0,0,0|1,0,2]=4 862 B8R0.9 CC(CCC(C)=O)=NO Amb24760824 [0,1,0,0,0,0|2,0,1]=4 863 B8R0.9 CC(CCC(C)=O)C#N Amb18642304 [0,1,0,0,0,0|1,0,1]=3 864 B8R0.9 CC(CCC(C)=O)C=O Amb18642612 [0,1,0,0,0,0|1,0,1]=3 865 B8R0.9 CC(CCC(C)N)OC Amb25093976 [0,1,0,0,0,0|2,0,1]=4 866 B8R0.9 CC(CCC(C)O)C=C Amb25345251 [0,1,0,0,0,0|1,0,2]=4 867 B8R0.9 CC(CCC(C)O)C=O Amb25781383 [0,1,0,0,0,0|1,0,2]=4 868 B8R0.9 CC(CCC(N)=O)C#N Amb25146074 [0,1,0,0,0,0|1,0,1]=3 869 B8R0.9 CC(CCC(N)=O)CN Amb24745140 [0,1,0,0,0,0|1,0,0]=2 870 B8R0.9 CC(CCC(O)=O)=NN Amb24579336 [0,1,0,0,0,0|1,0,1]=3 871 B8R0.9 CC(CCC(O)=O)=NO Amb25138471 [0,1,0,0,0,0|1,0,1]=3 872 B8R0.9 CC(CCC(O)=O)C#N Amb18642500 [0,1,0,0,0,0|0,0,1]=2 873 B8R0.9 CC(CCC(O)=O)C=C Amb18642631 [0,1,0,0,0,0|0,0,1]=2 874 B8R0.9 CC(CC\C(=N/O)\N)C Amb10608991 [0,1,0,0,0,0|1,0,0]=2 875 B8R0.9 CC(CC\C(=N\O)\N)C Amb10205331 [0,1,0,0,0,0|1,0,0]=2 876 B8R0.9 CC(CCl)CCC(C)=C Amb25068704 [0,1,0,0,0,0|2,0,0]=3 877 B8R0.9 CC(CCl)OCC(C)=O Amb25118198 [0,1,0,0,0,0|2,0,0]=3 878 B8R0.9 CC(CCl)OCC(N)=O Amb25789772 [0,1,0,0,0,0|2,0,0]=3 879 B8R0.9 CC(CN)CCC(O)=O Amb22059189 [0,1,0,0,0,0|0,0,0]=1 880 B8R0.9 CC(CN)CNC(C)=O Amb18300590 [0,1,0,0,0,0|2,0,0]=3 881 B8R0.9 CC(CN)NCC(=C)Cl Amb24732228 [0,1,0,0,0,0|3,0,0]=4 882 B8R0.9 CC(CN)NC[C@H](C)O Amb25044715 [0,1,0,0,0,0|2,0,1]=4 883 B8R0.9 CC(CN)OCC(C)=C Amb18630505 [0,1,0,0,0,0|3,0,0]=4 884 B8R0.9 CC(CN)OCC(C)=O Amb18110559 [0,1,0,0,0,0|2,0,0]=3 885 B8R0.9 CC(CN)OCC(O)=O Amb18629591 [0,1,0,0,0,0|1,0,0]=2 886 B8R0.9 CC(CN)SCC(=C)Br Amb24391885 [0,1,0,0,0,0|3,0,0]=4 887 B8R0.9 CC(CN)SCC(=C)Cl Amb25276051 [0,1,0,0,0,0|3,0,0]=4 888 B8R0.9 CC(CN)SCC(C)O Amb24478776 [0,1,0,0,0,0|2,0,1]=4 889 B8R0.9 CC(CN)SCC(N)=O Amb24753382 [0,1,0,0,0,0|2,0,0]=3 890 B8R0.9 CC(CNC(=O)CBr)O Amb17322852 [0,1,0,0,0,0|3,0,0]=4 891 B8R0.9 CC(CNC(=O)CCl)O Amb17324265 [0,1,0,0,0,0|3,0,0]=4 892 B8R0.9 CC(CNC(N)=O)CN Amb18994081 [0,1,0,0,0,0|2,0,0]=3 893 B8R0.9 CC(CO)CCC(C)=C Amb24389869 [0,1,0,0,0,0|2,0,0]=3 894 B8R0.9 CC(CO)CN=C(C)N Amb24349921 [0,1,0,0,0,0|3,0,0]=4 895 B8R0.9 CC(CO)CNC(C)=O Amb25050315 [0,1,0,0,0,0|2,0,0]=3 896 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,1,0,0,0,0|2,0,0]=3 897 B8R0.9 CC(CO)CSC(C)=O Amb24466300 [0,1,0,0,0,0|2,0,0]=3 898 B8R0.9 CC(CO)NCC(=C)Br Amb18303323 [0,1,0,0,0,0|3,0,0]=4 899 B8R0.9 CC(CO)NCC(=C)Cl Amb18303324 [0,1,0,0,0,0|3,0,0]=4 900 B8R0.9 CC(CO)NCC(C)=C Amb25289088 [0,1,0,0,0,0|3,0,0]=4 901 B8R0.9 CC(CO)OCC(O)=O Amb25675017 [0,1,0,0,0,0|1,0,0]=2 902 B8R0.9 CC(CO)SCC(=C)Br Amb25204830 [0,1,0,0,0,0|3,0,0]=4 903 B8R0.9 CC(CO)SCC(C)=O Amb25195670 [0,1,0,0,0,0|2,0,0]=3 904 B8R0.9 CC(CO)SCC(O)=O Amb18644427 [0,1,0,0,0,0|1,0,0]=2 905 B8R0.9 CC(COC(C)=O)C#N Amb24395253 [0,1,0,0,0,0|2,0,1]=4 906 B8R0.9 CC(COC(C)=O)C=O Amb18642789 [0,1,0,0,0,0|2,0,1]=4 907 B8R0.9 CC(COC(C)=O)NN Amb24439584 [0,1,0,0,0,0|3,0,0]=4 908 B8R0.9 CC(Cl)CNC(=O)CCl Amb24480042 [0,1,0,0,0,0|3,0,0]=4 909 B8R0.9 CC(Cl)COC(=O)CCl Amb24710935 [0,1,0,0,0,0|3,0,0]=4 910 B8R0.9 CC(Cl)COC(=O)CS Amb25061264 [0,1,0,0,0,0|2,1,0]=4 911 B8R0.9 CC(N)CCC(=O)C#C Amb24401215 [0,1,0,0,0,0|2,0,0]=3 912 B8R0.9 CC(N)CCC(C)=CBr Amb24692736 [0,1,0,0,0,0|3,0,0]=4 913 B8R0.9 CC(N)CNC(=O)CN Amb24721129 [0,1,0,0,0,0|3,0,0]=4 914 B8R0.9 CC(O)CCC(=O)NN Amb19748590 [0,1,0,0,0,0|2,0,0]=3 915 B8R0.9 CC(O)CCC(C)=CCl Amb25762077 [0,1,0,0,0,0|3,0,0]=4 916 B8R0.9 CC(O)CCC(C)=NO Amb24749620 [0,1,0,0,0,0|2,0,0]=3 917 B8R0.9 CC(O)CCC(Cl)CC Amb24480214 [0,1,0,0,0,0|2,0,1]=4 918 B8R0.9 CC(O)CCC(O)C=O Amb18642880 [0,1,0,0,0,0|1,0,1]=3 919 B8R0.9 CC(O)CCC(O)CC Amb25090764 [0,1,0,0,0,0|2,0,1]=4 920 B8R0.9 CC(O)CCC(O)CF Amb24536636 [0,1,0,0,0,0|2,0,1]=4 921 B8R0.9 CC(O)CNC(=O)CO Amb25703101 [0,1,0,0,0,0|2,0,0]=3 922 B8R0.9 CC(O)CNC(=O)CS Amb24744011 [0,1,0,0,0,0|2,1,0]=4 923 B8R0.9 CC(O)CNC(C)CO Amb19005093 [0,1,0,0,0,0|2,0,1]=4 924 B8R0.9 CC(O)COC(=O)CBr Amb25253067 [0,1,0,0,0,0|3,0,0]=4 925 B8R0.9 CC(O)COC(C)CO Amb22167327 [0,1,0,0,0,0|2,0,1]=4 926 B8R0.9 CC(O)CO[C@H](C)CO Amb25343738 [0,1,0,0,0,0|2,0,1]=4 927 B8R0.9 CC(O)C\C=C(/Br)\C=O Amb24388944 [0,1,0,0,0,0|2,0,1]=4 928 B8R0.9 CC(ON)CNC(=O)C Amb17138377 [0,1,0,0,0,0|3,0,0]=4 929 B8R0.9 CCC(=N)NCC(C)C Amb25749440 [0,1,0,0,0,0|3,0,0]=4 930 B8R0.9 CCC(=O)C#CC(C)C Amb25320012 [0,1,0,0,0,0|1,0,2]=4 931 B8R0.9 CCC(=O)CCC(=O)C Amb17593347 [0,1,0,0,0,0|2,0,1]=4 932 B8R0.9 CCC(=O)CCC(=O)Cl Amb24420925 [0,1,0,0,0,0|2,0,1]=4 933 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,1,0,0,0,0|1,0,1]=3 934 B8R0.9 CCC(=O)CCC(C)Cl Amb24571703 [0,1,0,0,0,0|2,0,0]=3 935 B8R0.9 CCC(=O)CCC(Cl)Cl Amb24711496 [0,1,0,0,0,0|3,0,0]=4 936 B8R0.9 CCC(=O)CCC(N)=O Amb24669836 [0,1,0,0,0,0|2,0,1]=4 937 B8R0.9 CCC(=O)CCN(C)C Amb24444934 [0,1,0,0,0,0|2,0,0]=3 938 B8R0.9 CCC(=O)CCP(O)=O Amb24748238 [0,1,0,0,0,0|2,0,1]=4 939 B8R0.9 CCC(=O)CO[SiH](C)C Amb24722809 [0,1,0,0,0,0|2,1,0]=4 940 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,1,0,0,0,0|2,0,1]=4 941 B8R0.9 CCC(=O)NCC(C)C Amb17798304 [0,1,0,0,0,0|2,0,0]=3 942 B8R0.9 CCC(=O)NCC(C)N Amb18631378 [0,1,0,0,0,0|3,0,0]=4 943 B8R0.9 CCC(=O)NC[C@@H](C)O Amb25297640 [0,1,0,0,0,0|3,0,0]=4 944 B8R0.9 CCC(=O)NOC(C)C Amb24614549 [0,1,0,0,0,0|3,0,0]=4 945 B8R0.9 CCC(=O)OCC(C)Cl Amb24729543 [0,1,0,0,0,0|3,0,0]=4 946 B8R0.9 CCC(=O)OCC(O)=O Amb18642872 [0,1,0,0,0,0|2,0,1]=4 947 B8R0.9 CCC(=O)SCC(C)Br Amb24398920 [0,1,0,0,0,0|3,0,0]=4 948 B8R0.9 CCC(=O)\C=C\C(C)C Amb24627284 [0,1,0,0,0,0|1,0,2]=4 949 B8R0.9 CCC(=O)\C=N\C(C)C Amb24339763 [0,1,0,0,0,0|2,0,1]=4 950 B8R0.9 CCC(=S)NCC(C)C Amb25840022 [0,1,0,0,0,0|2,1,0]=4 951 B8R0.9 CCC(=S)SCC(O)=O Amb24480232 [0,1,0,0,0,0|2,0,1]=4 952 B8R0.9 CCC(Br)CCC(=O)Cl Amb25352038 [0,1,0,0,0,0|2,0,0]=3 953 B8R0.9 CCC(Br)CCC(C)=O Amb24480025 [0,1,0,0,0,0|2,0,0]=3 954 B8R0.9 CCC(Br)\C=C\C(O)=O Amb18651360 [0,1,0,0,0,0|1,0,2]=4 955 B8R0.9 CCC(C)=CCC(C)=O Amb24736154 [0,1,0,0,0,0|1,0,2]=4 956 B8R0.9 CCC(C)C=CC(C)=O Amb24062970 [0,1,0,0,0,0|1,0,2]=4 957 B8R0.9 CCC(C)CCB(O)O Amb25063737 [0,1,0,0,0,0|1,0,1]=3 958 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,1,0,0,0,0|1,0,0]=2 959 B8R0.9 CCC(C)CCC(C)Br Amb19078823 [0,1,0,0,0,0|2,0,1]=4 960 B8R0.9 CCC(C)CCC(C)Cl Amb25361898 [0,1,0,0,0,0|2,0,1]=4 961 B8R0.9 CCC(C)CCC(C)O Amb22732215 [0,1,0,0,0,0|1,0,1]=3 962 B8R0.9 CCC(C)CCC(O)=O Amb22352932 [0,1,0,0,0,0|0,0,0]=1 963 B8R0.9 CCC(C)CNC(C)=N Amb25770210 [0,1,0,0,0,0|3,0,0]=4 964 B8R0.9 CCC(C)CNC(N)=N Amb25810483 [0,1,0,0,0,0|3,0,0]=4 965 B8R0.9 CCC(C)CNC(N)=S Amb24436213 [0,1,0,0,0,0|2,1,0]=4 966 B8R0.9 CCC(C)COC(=O)Cl Amb20246588 [0,1,0,0,0,0|2,0,0]=3 967 B8R0.9 CCC(C)COC(C)=O Amb20621577 [0,1,0,0,0,0|2,0,0]=3 968 B8R0.9 CCC(C)COC(N)=O Amb25188918 [0,1,0,0,0,0|2,0,0]=3 969 B8R0.9 CCC(C)CSC(N)=N Amb25306741 [0,1,0,0,0,0|3,0,0]=4 970 B8R0.9 CCC(C)NCC(=C)Br Amb19005214 [0,1,0,0,0,0|3,0,0]=4 971 B8R0.9 CCC(C)NCC(=C)Cl Amb19004829 [0,1,0,0,0,0|3,0,0]=4 972 B8R0.9 CCC(C)NCC(C)=O Amb25062894 [0,1,0,0,0,0|2,0,0]=3 973 B8R0.9 CCC(C)OCC(=C)Br Amb24740504 [0,1,0,0,0,0|3,0,0]=4 974 B8R0.9 CCC(C)OCC(N)=N Amb24501524 [0,1,0,0,0,0|3,0,0]=4 975 B8R0.9 CCC(C)OCC(O)=O Amb18307944 [0,1,0,0,0,0|1,0,0]=2 976 B8R0.9 CCC(C)ONC(C)=O Amb24360136 [0,1,0,0,0,0|3,0,0]=4 977 B8R0.9 CCC(C)ONC(N)=O Amb24618660 [0,1,0,0,0,0|3,0,0]=4 978 B8R0.9 CCC(C)SCC(=C)Br Amb25696158 [0,1,0,0,0,0|3,0,0]=4 979 B8R0.9 CCC(C)SCC(C)O Amb24738776 [0,1,0,0,0,0|2,0,1]=4 980 B8R0.9 CCC(C)SC[C@@H](C)O Amb25283171 [0,1,0,0,0,0|2,0,1]=4 981 B8R0.9 CCC(C)\C=C\C(O)=O Amb18988312 [0,1,0,0,0,0|0,0,2]=3 982 B8R0.9 CCC(Cl)=CCC(O)=O Amb24580821 [0,1,0,0,0,0|1,0,2]=4 983 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,1,0,0,0,0|2,0,0]=3 984 B8R0.9 CCC(Cl)CCC(C)=C Amb24387453 [0,1,0,0,0,0|3,0,0]=4 985 B8R0.9 CCC(Cl)CNC(C)=O Amb25292231 [0,1,0,0,0,0|3,0,0]=4 986 B8R0.9 CCC(Cl)COC(N)=O Amb22274267 [0,1,0,0,0,0|3,0,0]=4 987 B8R0.9 CCC(Cl)\C=C\C(O)=O Amb24714953 [0,1,0,0,0,0|1,0,2]=4 988 B8R0.9 CCC(F)COC(C)=O Amb24361428 [0,1,0,0,0,0|3,0,0]=4 989 B8R0.9 CCC(N)CCC(O)=O Amb21961489 [0,1,0,0,0,0|1,0,0]=2 990 B8R0.9 CCC(N)CCS(C)=O Amb25281105 [0,1,0,0,0,0|3,0,0]=4 991 B8R0.9 CCC(N)CNC(C)=O Amb25256213 [0,1,0,0,0,0|3,0,0]=4 992 B8R0.9 CCC(NCC(=C)C)C Amb17308623 [0,1,0,0,0,0|3,0,0]=4 993 B8R0.9 CCC(O)CCB(O)O Amb24353745 [0,1,0,0,0,0|2,0,1]=4 994 B8R0.9 CCC(O)CCC(C)=C Amb25073903 [0,1,0,0,0,0|3,0,0]=4 995 B8R0.9 CCC(O)CCC(C)=O Amb24586292 [0,1,0,0,0,0|2,0,0]=3 996 B8R0.9 CCC(O)CNC(C)=O Amb24715716 [0,1,0,0,0,0|3,0,0]=4 997 B8R0.9 CCC(O)NCC(O)=O Amb24445948 [0,1,0,0,0,0|2,0,0]=3 998 B8R0.9 CCC(O)\C=C\C(O)=O Amb25328660 [0,1,0,0,0,0|1,0,2]=4 999 B8R0.9 CCC(S)\C=C\C(O)=O Amb18124688 [0,1,0,0,0,0|1,0,2]=4 1000 B8R0.9 CCN(C)CCC(C)=C Amb24501501 [0,1,0,0,0,0|3,0,0]=4 1001 B8R0.9 CCN(C)CCC(C)O Amb25306759 [0,1,0,0,0,0|2,0,1]=4 1002 B8R0.9 CCS(=O)CCC(C)=O Amb25765620 [0,1,0,0,0,0|3,0,0]=4 1003 B8R0.9 CCS(=O)CCC(C)C Amb24448788 [0,1,0,0,0,0|2,0,0]=3 1004 B8R0.9 CCS(=O)CCC(C)N Amb24383525 [0,1,0,0,0,0|3,0,0]=4 1005 B8R0.9 CCS(=O)NCC(C)C Amb24597114 [0,1,0,0,0,0|3,0,0]=4 1006 B8R0.9 CC[C@@H](C)CCC(C)=O Amb24749043 [0,1,0,0,0,0|1,0,0]=2 1007 B8R0.9 CC[C@@H](C)CC[C@@H](C)O Amb22896942 [0,1,0,0,0,0|1,0,1]=3 1008 B8R0.9 CC[C@@H](C)CC[C@H](C)O Amb22896941 [0,1,0,0,0,0|1,0,1]=3 1009 B8R0.9 CC[C@@H](C)COC(N)=O Amb24586795 [0,1,0,0,0,0|2,0,0]=3 1010 B8R0.9 CC[C@@H](C)\C=C\C(O)=O Amb24117189 [0,1,0,0,0,0|0,0,2]=3 1011 B8R0.9 CC[C@@H](N)CCC(O)=O Amb25065764 [0,1,0,0,0,0|1,0,0]=2 1012 B8R0.9 CC[C@@H](O)C#CC(O)=O Amb25785824 [0,1,0,0,0,0|1,0,2]=4 1013 B8R0.9 CC[C@H](C)CCN(C)C Amb25263133 [0,1,0,0,0,0|3,0,0]=4 1014 B8R0.9 CC[C@H](C)CC[C@@H](C)O Amb25055436 [0,1,0,0,0,0|1,0,1]=3 1015 B8R0.9 CC[C@H](C)COC(N)=O Amb24333141 [0,1,0,0,0,0|2,0,0]=3 1016 B8R0.9 CC[C@H](C)NCC(O)=O Amb25076151 [0,1,0,0,0,0|1,0,0]=2 1017 B8R0.9 CC[C@H](C)OCC(O)=O Amb25320561 [0,1,0,0,0,0|1,0,0]=2 1018 B8R0.9 CC[C@H](N)CCC(O)=O Amb25835678 [0,1,0,0,0,0|1,0,0]=2 1019 B8R0.9 CC[C@H](O)CCC(N)=O Amb25785287 [0,1,0,0,0,0|2,0,0]=3 1020 B8R0.9 CC[S+](C)CCC(O)=O Amb25794477 [0,1,0,0,0,0|1,0,0]=2 1021 B8R0.9 CC\C(\C)=C/CC(C)=O Amb24333826 [0,1,0,0,0,0|1,0,2]=4 1022 B8R0.9 CC\C(\C)=C\CC(C)=O Amb25773428 [0,1,0,0,0,0|1,0,2]=4 1023 B8R0.9 CN(C)CCC(=O)CS Amb25217335 [0,1,0,0,0,0|1,1,0]=3 1024 B8R0.9 CN(C)CCC(F)C=O Amb25836712 [0,1,0,0,0,0|2,0,1]=4 1025 B8R0.9 CN(C)CCC(O)C=C Amb24649110 [0,1,0,0,0,0|2,0,1]=4 1026 B8R0.9 CN(C)CCC(O)CN Amb18124365 [0,1,0,0,0,0|2,0,1]=4 1027 B8R0.9 CN(C)CCN(C)C=O Amb22344699 [0,1,0,0,0,0|3,0,0]=4 1028 B8R0.9 CN(C)CCN(C)OC Amb25177395 [0,1,0,0,0,0|3,0,0]=4 1029 B8R0.9 CN(C)CC\C(\Cl)=C/Cl Amb25708420 [0,1,0,0,0,0|3,0,0]=4 1030 B8R0.9 CN(C)CNC(=O)C=C Amb25032104 [0,1,0,0,0,0|3,0,0]=4 1031 B8R0.9 CN(C)NCC(N)=NO Amb24434454 [0,1,0,0,0,0|3,0,0]=4 1032 B8R0.9 CN(CCC(N)=O)C=O Amb25146008 [0,1,0,0,0,0|2,0,1]=4 1033 B8R0.9 CN(CCC(O)=O)C=O Amb18984989 [0,1,0,0,0,0|1,0,1]=3 1034 B8R0.9 CN(CCC(O)=O)N=O Amb22729196 [0,1,0,0,0,0|2,0,0]=3 1035 B8R0.9 CN=C(N)SCC(C)C Amb24476741 [0,1,0,0,0,0|3,0,0]=4 1036 B8R0.9 CNC(=N)CCC(C)C Amb25303718 [0,1,0,0,0,0|2,0,0]=3 1037 B8R0.9 CNC(=N)CCN(C)C Amb25827621 [0,1,0,0,0,0|3,0,0]=4 1038 B8R0.9 CNC(=N)COC(C)C Amb25321255 [0,1,0,0,0,0|3,0,0]=4 1039 B8R0.9 CNC(=N)NCC(O)=O Amb24655458 [0,1,0,0,0,0|2,0,1]=4 1040 B8R0.9 CNC(=N)SCC(O)=O Amb24403395 [0,1,0,0,0,0|2,0,1]=4 1041 B8R0.9 CNC(=O)CCC(=O)C Amb17334107 [0,1,0,0,0,0|2,0,1]=4 1042 B8R0.9 CNC(=O)CCC(=O)N Amb17334114 [0,1,0,0,0,0|2,0,1]=4 1043 B8R0.9 CNC(=O)CCC(C)Cl Amb25851798 [0,1,0,0,0,0|2,0,0]=3 1044 B8R0.9 CNC(=O)CCC(C)N Amb24477857 [0,1,0,0,0,0|2,0,0]=3 1045 B8R0.9 CNC(=O)CCC(O)C Amb17334125 [0,1,0,0,0,0|2,0,0]=3 1046 B8R0.9 CNC(=O)CCN(C)C Amb24735586 [0,1,0,0,0,0|2,0,0]=3 1047 B8R0.9 CNC(=O)CCS(C)=O Amb24476726 [0,1,0,0,0,0|3,0,0]=4 1048 B8R0.9 CNC(=O)CNC(O)=O Amb24740399 [0,1,0,0,0,0|2,0,1]=4 1049 B8R0.9 CNC(=O)COC(C)C Amb24481787 [0,1,0,0,0,0|2,0,0]=3 1050 B8R0.9 CNC(=O)CSC(C)C Amb25146039 [0,1,0,0,0,0|2,0,0]=3 1051 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,1,0,0,0,0|2,0,1]=4 1052 B8R0.9 CNC(=O)NCC(C)C Amb2132759 [0,1,0,0,0,0|2,0,0]=3 1053 B8R0.9 CNC(=O)NOC(C)C Amb24432071 [0,1,0,0,0,0|3,0,0]=4 1054 B8R0.9 CNC(=O)SCC(C)C Amb24454948 [0,1,0,0,0,0|2,0,0]=3 1055 B8R0.9 CNC(=O)SCC(O)=O Amb24763198 [0,1,0,0,0,0|2,0,1]=4 1056 B8R0.9 CNC(=S)SCC(O)=O Amb24649902 [0,1,0,0,0,0|2,0,1]=4 1057 B8R0.9 CNC(C)CCC(O)=O Amb25339418 [0,1,0,0,0,0|0,0,0]=1 1058 B8R0.9 CNC(C)CCN(C)C Amb24612965 [0,1,0,0,0,0|3,0,0]=4 1059 B8R0.9 CNC(C)CNC(N)=O Amb24405703 [0,1,0,0,0,0|2,0,0]=3 1060 B8R0.9 CNC(C)CNS(C)=O Amb24753150 [0,1,0,0,0,0|3,0,0]=4 1061 B8R0.9 COC(=N)CCN(C)C Amb25278317 [0,1,0,0,0,0|2,0,0]=3 1062 B8R0.9 COC(=N)COC(C)C Amb25725252 [0,1,0,0,0,0|2,0,0]=3 1063 B8R0.9 COC(=N)CSC(C)C Amb25321840 [0,1,0,0,0,0|2,0,0]=3 1064 B8R0.9 COC(=O)C#CC(C)O Amb24475136 [0,1,0,0,0,0|1,0,2]=4 1065 B8R0.9 COC(=O)CCB(O)O Amb25705142 [0,1,0,0,0,0|3,0,0]=4 1066 B8R0.9 COC(=O)CCC(=O)C Amb13777321 [0,1,0,0,0,0|1,0,1]=3 1067 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,1,0,0,0,0|1,0,0]=2 1068 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,1,0,0,0,0|1,0,0]=2 1069 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,1,0,0,0,0|1,0,0]=2 1070 B8R0.9 COC(=O)CCC(Cl)Cl Amb25295532 [0,1,0,0,0,0|2,0,0]=3 1071 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,1,0,0,0,0|2,0,1]=4 1072 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [0,1,0,0,0,0|2,0,1]=4 1073 B8R0.9 COC(=O)CCS([O-])=O Amb21520328 [0,1,0,0,0,0|3,0,0]=4 1074 B8R0.9 COC(=O)CC[C@@H](C)Cl Amb24480241 [0,1,0,0,0,0|1,0,0]=2 1075 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,1,0,0,0,0|1,0,0]=2 1076 B8R0.9 COC(=O)CC[C@@H](C)O Amb22388487 [0,1,0,0,0,0|1,0,0]=2 1077 B8R0.9 COC(=O)CC[C@H](C)O Amb24351118 [0,1,0,0,0,0|1,0,0]=2 1078 B8R0.9 COC(=O)CNN(C)C Amb24693623 [0,1,0,0,0,0|2,0,0]=3 1079 B8R0.9 COC(=O)CNS(C)=O Amb24536728 [0,1,0,0,0,0|3,0,0]=4 1080 B8R0.9 COC(=O)COC(Cl)Cl Amb22230457 [0,1,0,0,0,0|3,0,0]=4 1081 B8R0.9 COC(=O)CSC(C)O Amb25032211 [0,1,0,0,0,0|2,0,0]=3 1082 B8R0.9 COC(=O)CSC(F)F Amb25834011 [0,1,0,0,0,0|3,0,0]=4 1083 B8R0.9 COC(=O)N=NC(C)N Amb25062994 [0,1,0,0,0,0|3,0,0]=4 1084 B8R0.9 COC(=O)NCC(C)C Amb17861777 [0,1,0,0,0,0|1,0,0]=2 1085 B8R0.9 COC(=O)NCC(F)F Amb24657916 [0,1,0,0,0,0|3,0,0]=4 1086 B8R0.9 COC(=O)NC[C@H](C)O Amb25111936 [0,1,0,0,0,0|2,0,0]=3 1087 B8R0.9 COC(=O)NNC(C)C Amb22496456 [0,1,0,0,0,0|2,0,0]=3 1088 B8R0.9 COC(=O)OCC(C)C Amb24416487 [0,1,0,0,0,0|1,0,0]=2 1089 B8R0.9 COC(=O)OCC(F)F Amb24088551 [0,1,0,0,0,0|3,0,0]=4 1090 B8R0.9 COC(=O)\C=C/C(C)C Amb10842318 [0,1,0,0,0,0|0,0,2]=3 1091 B8R0.9 COC(=O)\C=C\C(C)Br Amb25326817 [0,1,0,0,0,0|1,0,2]=4 1092 B8R0.9 COC(=O)\C=C\C(C)N Amb25212213 [0,1,0,0,0,0|1,0,2]=4 1093 B8R0.9 COC(=O)\C=C\N(C)C Amb15692783 [0,1,0,0,0,0|1,0,2]=4 1094 B8R0.9 COC(=O)\C=C\[C@@H](C)O Amb24446167 [0,1,0,0,0,0|1,0,2]=4 1095 B8R0.9 COC(=O)\C=C\[C@H](C)N Amb25797312 [0,1,0,0,0,0|1,0,2]=4 1096 B8R0.9 COC(=S)NCC(C)C Amb24400051 [0,1,0,0,0,0|1,1,0]=3 1097 B8R0.9 COC(=S)NCC(O)=O Amb25146013 [0,1,0,0,0,0|2,0,1]=4 1098 B8R0.9 COC(=S)SCC(C)O Amb24575769 [0,1,0,0,0,0|2,1,0]=4 1099 B8R0.9 COC(C)CCC(O)=O Amb24271104 [0,1,0,0,0,0|0,0,0]=1 1100 B8R0.9 COC(C)CNC(C)=O Amb24574997 [0,1,0,0,0,0|2,0,0]=3 1101 B8R0.9 COC(C)CNC(N)=N Amb24459639 [0,1,0,0,0,0|3,0,0]=4 1102 B8R0.9 COC(C)CNS(C)=O Amb25359541 [0,1,0,0,0,0|3,0,0]=4 1103 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,1,0,0,0,0|2,0,0]=3 1104 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,1,0,0,0,0|2,0,0]=3 1105 B8R0.9 COC(C)OCC(C)O Amb25284474 [0,1,0,0,0,0|2,0,1]=4 1106 B8R0.9 COC(C)OCC(O)=O Amb24417299 [0,1,0,0,0,0|1,0,0]=2 1107 B8R0.9 COC(Cl)CCN(C)C Amb24547760 [0,1,0,0,0,0|2,0,1]=4 1108 B8R0.9 CON(C)CCC(C)=C Amb24718119 [0,1,0,0,0,0|3,0,0]=4 1109 B8R0.9 CON(C)CCC(C)N Amb24706009 [0,1,0,0,0,0|3,0,0]=4 1110 B8R0.9 COP(O)CCC(O)=O Amb22734636 [0,1,0,0,0,0|2,0,0]=3 1111 B8R0.9 CO[C@H](C)CCC(O)=O Amb24383667 [0,1,0,0,0,0|0,0,0]=1 1112 B8R0.9 CO\C(\O)=C/CN(C)C Amb24100291 [0,1,0,0,0,0|1,0,2]=4 1113 B8R0.9 CSC(=O)CCC(C)C Amb25743840 [0,1,0,0,0,0|0,1,0]=2 1114 B8R0.9 CSC(=O)NCC(C)C Amb24476657 [0,1,0,0,0,0|1,1,0]=3 1115 B8R0.9 CSC(=S)OCC(O)=O Amb25065342 [0,1,0,0,0,0|2,0,1]=4 1116 B8R0.9 CSC(=S)SCC(O)=O Amb24479938 [0,1,0,0,0,0|2,0,1]=4 1117 B8R0.9 CSC(C)CCC(O)=O Amb22059071 [0,1,0,0,0,0|0,0,0]=1 1118 B8R0.9 CSC(C)CNC(C)=O Amb25744770 [0,1,0,0,0,0|2,0,0]=3 1119 B8R0.9 CSC(C)CNC(N)=O Amb25688045 [0,1,0,0,0,0|2,0,0]=3 1120 B8R0.9 C[C@@H](CBr)CCC(O)=O Amb24458738 [0,1,0,0,0,0|0,0,0]=1 1121 B8R0.9 C[C@@H](CBr)COC(C)=O Amb24373843 [0,1,0,0,0,0|2,0,0]=3 1122 B8R0.9 C[C@@H](CC)CCC(=O)O Amb16231507 [0,1,0,0,0,0|0,0,0]=1 1123 B8R0.9 C[C@@H](CCC(C)=O)C=O Amb24441758 [0,1,0,0,0,0|1,0,1]=3 1124 B8R0.9 C[C@@H](CCC(O)=O)C=C Amb25859365 [0,1,0,0,0,0|0,0,1]=2 1125 B8R0.9 C[C@@H](CC[C@@H](C)O)C=C Amb25369343 [0,1,0,0,0,0|1,0,2]=4 1126 B8R0.9 C[C@@H](CC[C@H](C)O)C=C Amb24502362 [0,1,0,0,0,0|1,0,2]=4 1127 B8R0.9 C[C@@H](CO)NCC(C)=O Amb24693447 [0,1,0,0,0,0|2,0,0]=3 1128 B8R0.9 C[C@@H](N)COC(=O)CN Amb25848264 [0,1,0,0,0,0|3,0,0]=4 1129 B8R0.9 C[C@@H](O)CC[C@H](C)CO Amb25271414 [0,1,0,0,0,0|1,0,1]=3 1130 B8R0.9 C[C@@H](O)CC[C@H](O)CO Amb25346392 [0,1,0,0,0,0|1,0,2]=4 1131 B8R0.9 C[C@@H](O)CNC(=O)C#C Amb25185202 [0,1,0,0,0,0|3,0,0]=4 1132 B8R0.9 C[C@@H](O)CN[C@@H](C)CO Amb25112017 [0,1,0,0,0,0|2,0,1]=4 1133 B8R0.9 C[C@H](CCC(O)=O)C#C Amb25250566 [0,1,0,0,0,0|0,0,1]=2 1134 B8R0.9 C[C@H](CO)CC=C(C)C Amb25044656 [0,1,0,0,0,0|2,0,1]=4 1135 B8R0.9 C[C@H](CO)CNC(N)=O Amb25715034 [0,1,0,0,0,0|2,0,0]=3 1136 B8R0.9 C[C@H](CO)COC(C)=O Amb25846526 [0,1,0,0,0,0|2,0,0]=3 1137 B8R0.9 C[C@H](CO)SCC(C)=C Amb25052251 [0,1,0,0,0,0|3,0,0]=4 1138 B8R0.9 C[C@H](O)CCC(=O)NN Amb24395110 [0,1,0,0,0,0|2,0,0]=3 1139 B8R0.9 C[C@H](O)CCC(C)=C=C Amb25256642 [0,1,0,0,0,0|3,0,0]=4 1140 B8R0.9 C[C@H](O)CC[C@H](O)CC Amb25794691 [0,1,0,0,0,0|2,0,1]=4 1141 B8R0.9 C[C@H](O)CC[C@H](O)CO Amb24363660 [0,1,0,0,0,0|1,0,2]=4 1142 B8R0.9 C[C@H](O)CNC(=O)C#C Amb25731135 [0,1,0,0,0,0|3,0,0]=4 1143 B8R0.9 C[C@H](O)CNC(=O)C=C Amb24702296 [0,1,0,0,0,0|3,0,0]=4 1144 B8R0.9 C[C@H](O)CNC(=O)CBr Amb24567754 [0,1,0,0,0,0|3,0,0]=4 1145 B8R0.9 C[C@H](O)CNC(C)CO Amb25700081 [0,1,0,0,0,0|2,0,1]=4 1146 B8R0.9 C[C@H](O)COC(=O)C=C Amb25284367 [0,1,0,0,0,0|3,0,0]=4 1147 B8R0.9 C[C@H](O)CSC(C)CO Amb25032273 [0,1,0,0,0,0|2,0,1]=4 1148 B8R0.9 C\C(\C=C)=C/CC(O)=O Amb25305754 [0,1,0,0,0,0|0,0,3]=4 1149 B8R0.9 C\C(\C=C\C(O)=O)=C/C Amb18642399 [0,1,0,0,0,0|0,0,3]=4 1150 B8R0.9 C\C(\CC)=C/CC(O)=O Amb22011800 [0,1,0,0,0,0|0,0,2]=3 1151 B8R0.9 C\C(\CCC(C)=O)=C/C Amb25768510 [0,1,0,0,0,0|1,0,1]=3 1152 B8R0.9 C\C(\CCC(C)=O)=C\C Amb24610198 [0,1,0,0,0,0|1,0,1]=3 1153 B8R0.9 C\C(\CCC(C)=O)=N/O Amb24422445 [0,1,0,0,0,0|2,0,1]=4 1154 B8R0.9 C\C(\CCC(O)=O)=C\C Amb24681032 [0,1,0,0,0,0|0,0,1]=2 1155 B8R0.9 C\C(\CCC(O)=O)=N\N Amb24382718 [0,1,0,0,0,0|1,0,1]=3 1156 B8R0.9 C\C=C(/Br)\CCC(O)=O Amb25685237 [0,1,0,0,0,0|1,0,1]=3 1157 B8R0.9 C\C=C(\Br)/CCC(O)=O Amb25210030 [0,1,0,0,0,0|1,0,1]=3 1158 B8R0.9 C\C=C(\C)/CCC(C)O Amb24646058 [0,1,0,0,0,0|1,0,2]=4 1159 B8R0.9 C\C=C(\F)/CCC(O)=O Amb24670842 [0,1,0,0,0,0|1,0,1]=3 1160 B8R0.9 ClCC(=O)NCC(C)C Amb1160207 [0,1,0,0,0,0|2,0,0]=3 1161 B8R0.9 NC(=O)CCC(=O)NO Amb24340146 [0,1,0,0,0,0|2,0,1]=4 1162 B8R0.9 NC(=O)NCC(O)CO Amb25146091 [0,1,0,0,0,0|3,0,0]=4 1163 B8R0.9 NC(=O)NCC(S)CS Amb25337646 [0,1,0,0,0,0|3,0,0]=4 1164 B8R0.9 NC(=O)OCC(Br)CBr Amb22732242 [0,1,0,0,0,0|3,0,0]=4 1165 B8R0.9 NC(=O)OCC(O)CO Amb24683881 [0,1,0,0,0,0|3,0,0]=4 1166 B8R0.9 NC(C=C)CCC(=O)O Amb10843623 [0,1,0,0,0,0|1,0,1]=3 1167 B8R0.9 NC(CCC(N)=O)C#N Amb24340237 [0,1,0,0,0,0|2,0,1]=4 1168 B8R0.9 NC(CCC(O)=O)CO Amb18642916 [0,1,0,0,0,0|1,0,0]=2 1169 B8R0.9 NC(CF)CCC(N)=O Amb24599972 [0,1,0,0,0,0|2,0,0]=3 1170 B8R0.9 NC(CF)CCC(O)=O Amb19148378 [0,1,0,0,0,0|1,0,0]=2 1171 B8R0.9 NCC(=O)CC[13C](O)=O Amb22367280 [0,1,0,0,0,0|1,0,1]=3 1172 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,1,0,0,0,0|2,0,1]=4 1173 B8R0.9 NCC(=O)NCC(C)C Amb13951745 [0,1,0,0,0,0|2,0,0]=3 1174 B8R0.9 NCC(=O)OCC(O)=O Amb25710415 [0,1,0,0,0,0|2,0,1]=4 1175 B8R0.9 NCC(=O)[13CH2]CC(=O)O Amb17608125 [0,1,0,0,0,0|1,0,1]=3 1176 B8R0.9 NCC(=S)NCC(O)=O Amb25077168 [0,1,0,0,0,0|2,0,1]=4 1177 B8R0.9 NCC(CCN(C)C)C Amb17334118 [0,1,0,0,0,0|3,0,0]=4 1178 B8R0.9 NCC(N)CCC(O)=O Amb19328773 [0,1,0,0,0,0|1,0,0]=2 1179 B8R0.9 NCC(O)CCC(N)=O Amb24340194 [0,1,0,0,0,0|2,0,0]=3 1180 B8R0.9 NCC(O)CCC(O)=O Amb18124376 [0,1,0,0,0,0|1,0,0]=2 1181 B8R0.9 NCC(O)CCP(O)=O Amb24760103 [0,1,0,0,0,0|2,0,0]=3 1182 B8R0.9 NC[C@H](O)CCC(O)=O Amb24383262 [0,1,0,0,0,0|1,0,0]=2 1183 B8R0.9 NNC(=O)CCC(F)F Amb22896655 [0,1,0,0,0,0|3,0,0]=4 1184 B8R0.9 NNC(=O)CCC(O)=O Amb22270256 [0,1,0,0,0,0|2,0,1]=4 1185 B8R0.9 NNC(=O)COC(C)C Amb2089067 [0,1,0,0,0,0|2,0,0]=3 1186 B8R0.9 NNC(=O)COC(C)C Amb2189164 [0,1,0,0,0,0|2,0,0]=3 1187 B8R0.9 N[13CH2]C(=O)CCC(O)=O Amb22367582 [0,1,0,0,0,0|1,0,1]=3 1188 B8R0.9 N[C@@H](CCC(N)=O)C=O Amb25104754 [0,1,0,0,0,0|2,0,1]=4 1189 B8R0.9 N[C@@H](CCC(O)=O)C=O Amb24347675 [0,1,0,0,0,0|1,0,1]=3 1190 B8R0.9 N[C@@H](CCC(O)=O)CO Amb24685421 [0,1,0,0,0,0|1,0,0]=2 1191 B8R0.9 N[C@H](C=C)CCC(=O)O Amb17621248 [0,1,0,0,0,0|1,0,1]=3 1192 B8R0.9 N[C@H](CCC(O)=O)CO Amb25352213 [0,1,0,0,0,0|1,0,0]=2 1193 B8R0.9 N[C@H](CF)CCC(O)=O Amb25339395 [0,1,0,0,0,0|1,0,0]=2 1194 B8R0.9 N[C@H](CO)CCC(N)=O Amb24368577 [0,1,0,0,0,0|2,0,0]=3 1195 B8R0.9 N[C@H](CS)CCC(O)=O Amb25348403 [0,1,0,0,0,0|1,0,0]=2 1196 B8R0.9 O=NN(CCC(=O)O)C Amb17618592 [0,1,0,0,0,0|2,0,0]=3 1197 B8R0.9 OC(=O)CCC(=O)C=O Amb18642737 [0,1,0,0,0,0|1,0,2]=4 1198 B8R0.9 OC(=O)CCC(=O)CBr Amb18652012 [0,1,0,0,0,0|1,0,1]=3 1199 B8R0.9 OC(=O)CCC(=O)CCl Amb25736440 [0,1,0,0,0,0|1,0,1]=3 1200 B8R0.9 OC(=O)CCC(=O)CO Amb18642867 [0,1,0,0,0,0|1,0,1]=3 1201 B8R0.9 OC(=O)CCC(Br)CBr Amb24575822 [0,1,0,0,0,0|1,0,0]=2 1202 B8R0.9 OC(=O)CCC([NH3+])C=C Amb10845648 [0,1,0,0,0,0|1,0,1]=3 1203 B8R0.9 OC(=O)CNC(=O)CBr Amb18130258 [0,1,0,0,0,0|2,0,1]=4 1204 B8R0.9 OC(=O)CNC(=O)CCl Amb1144436 [0,1,0,0,0,0|2,0,1]=4 1205 B8R0.9 OC(=O)CNC(=O)CO Amb18124375 [0,1,0,0,0,0|2,0,1]=4 1206 B8R0.9 OC(=O)COC(=O)CCl Amb18644547 [0,1,0,0,0,0|2,0,1]=4 1207 B8R0.9 OC(CBr)\C=C\C(O)=O Amb18647817 [0,1,0,0,0,0|1,0,2]=4 1208 B8R0.9 OC(CCC(O)=O)=NO Amb24745795 [0,1,0,0,0,0|2,0,1]=4 1209 B8R0.9 OC(CCl)COS(O)=O Amb24726370 [0,1,0,0,0,0|3,0,0]=4 1210 B8R0.9 OC(CS)COP(O)=O Amb24523020 [0,1,0,0,0,0|3,0,0]=4 1211 B8R0.9 OCC(O)CCC(O)=O Amb18124400 [0,1,0,0,0,0|1,0,0]=2 1212 B8R0.9 OCC(O)COP(O)=O Amb25071391 [0,1,0,0,0,0|3,0,0]=4 1213 B8R0.9 OCC(O)\C=C\C(O)=O Amb18642875 [0,1,0,0,0,0|1,0,2]=4 1214 B8R0.9 OC[C@H](O)CCC(O)=O Amb24528896 [0,1,0,0,0,0|1,0,0]=2 1215 B8R0.9 ONC(=O)CCC(F)F Amb24414532 [0,1,0,0,0,0|2,0,0]=3 1216 B8R0.9 ONC(=O)COC(F)F Amb24457485 [0,1,0,0,0,0|3,0,0]=4 1217 B8R0.9 O\N=C(\CCN(C)C)/N Amb1118599 [0,1,0,0,0,0|2,0,0]=3 1218 B8R0.9 [O-][N+](=O)CC[C@H](CO)C Amb13883660 [0,1,0,0,0,0|1,0,1]=3 1219 B8R0.23 BrC(C(=O)O)CC(C)C Amb16233356 [0,1,0,0,0,0|0,0,0]=1 1220 B8R0.23 C=C(Br)C(O)CC(O)=O Amb24648348 [0,1,0,0,0,0|1,0,2]=4 1221 B8R0.23 C=C(Br)CC(N)C(O)=O Amb24557771 [0,1,0,0,0,0|1,0,2]=4 1222 B8R0.23 C=C(Br)C[C@@H](N)C(O)=O Amb22746251 [0,1,0,0,0,0|1,0,2]=4 1223 B8R0.23 C=C(Cl)CC(N)C(O)=O Amb24411473 [0,1,0,0,0,0|1,0,2]=4 1224 B8R0.23 C=C(F)CC(N)C(O)=O Amb24580886 [0,1,0,0,0,0|1,0,2]=4 1225 B8R0.23 C=C(I)CC(N)C(O)=O Amb25842052 [0,1,0,0,0,0|1,0,2]=4 1226 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,1,0,0,0,0|3,0,0]=4 1227 B8R0.23 CC(=C)C(=O)CC(C)C Amb25222433 [0,1,0,0,0,0|2,0,1]=4 1228 B8R0.23 CC(=C)C(C)CC(O)=O Amb18642614 [0,1,0,0,0,0|0,0,2]=3 1229 B8R0.23 CC(=C)C(N)CC(N)=O Amb24401112 [0,1,0,0,0,0|1,0,2]=4 1230 B8R0.23 CC(=C)C(O)CC(O)=O Amb18642756 [0,1,0,0,0,0|0,0,2]=3 1231 B8R0.23 CC(=C)C(O)CN(C)C Amb25226251 [0,1,0,0,0,0|3,0,0]=4 1232 B8R0.23 CC(=C)CC(=C)C(O)=O Amb24669131 [0,1,0,0,0,0|0,0,3]=4 1233 B8R0.23 CC(=C)CC(=O)C(C)C Amb25800567 [0,1,0,0,0,0|2,0,1]=4 1234 B8R0.23 CC(=C)CC(C)C(N)=O Amb24475657 [0,1,0,0,0,0|1,0,2]=4 1235 B8R0.23 CC(=C)CC(C)C(O)=O Amb24471924 [0,1,0,0,0,0|0,0,2]=3 1236 B8R0.23 CC(=C)CC(O)C(O)=O Amb24534477 [0,1,0,0,0,0|0,0,2]=3 1237 B8R0.23 CC(=C)C[C@@H](C(=O)O)C Amb10843988 [0,1,0,0,0,0|0,0,2]=3 1238 B8R0.23 CC(=C)C[C@@H](C)C(O)=O Amb24340253 [0,1,0,0,0,0|0,0,2]=3 1239 B8R0.23 CC(=C)C[C@@H](N)C(O)=O Amb22801689 [0,1,0,0,0,0|0,0,2]=3 1240 B8R0.23 CC(=C)C[C@H](N)C(O)=O Amb25757900 [0,1,0,0,0,0|0,0,2]=3 1241 B8R0.23 CC(=C)[C@@H](O)CC(O)=O Amb25789715 [0,1,0,0,0,0|0,0,2]=3 1242 B8R0.23 CC(=CC(O)=O)C(C)F Amb25108468 [0,1,0,0,0,0|1,0,2]=4 1243 B8R0.23 CC(=CC(O)=O)C(C)N Amb24339945 [0,1,0,0,0,0|1,0,2]=4 1244 B8R0.23 CC(=NN(C)C)C(O)=O Amb25044475 [0,1,0,0,0,0|2,0,1]=4 1245 B8R0.23 CC(=O)C(=C)CC(C)C Amb22277685 [0,1,0,0,0,0|1,0,1]=3 1246 B8R0.23 CC(=O)C(=O)CC(C)C Amb22489717 [0,1,0,0,0,0|1,0,1]=3 1247 B8R0.23 CC(=O)C(=O)CC(C)N Amb25769599 [0,1,0,0,0,0|2,0,1]=4 1248 B8R0.23 CC(=O)C(=O)CN(C)C Amb24694256 [0,1,0,0,0,0|2,0,1]=4 1249 B8R0.23 CC(=O)C(=O)OC(C)C Amb22232277 [0,1,0,0,0,0|2,0,1]=4 1250 B8R0.23 CC(=O)C(C)CC(O)=O Amb18292788 [0,1,0,0,0,0|1,0,1]=3 1251 B8R0.23 CC(=O)C(Cl)=NC(C)C Amb24512410 [0,1,0,0,0,0|2,0,1]=4 1252 B8R0.23 CC(=O)C(Cl)CC(O)=O Amb24426109 [0,1,0,0,0,0|1,0,1]=3 1253 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,1,0,0,0,0|2,0,1]=4 1254 B8R0.23 CC(=O)C(O)CC(O)=O Amb25341886 [0,1,0,0,0,0|1,0,1]=3 1255 B8R0.23 CC(=O)C(O)CN(C)C Amb24571624 [0,1,0,0,0,0|2,0,0]=3 1256 B8R0.23 CC(=O)C=C(Cl)C(C)C Amb24723397 [0,1,0,0,0,0|1,0,2]=4 1257 B8R0.23 CC(=O)CC(=O)C(O)=O Amb18642736 [0,1,0,0,0,0|1,0,2]=4 1258 B8R0.23 CC(=O)CC(=O)N(C)C Amb1152296 [0,1,0,0,0,0|2,0,1]=4 1259 B8R0.23 CC(=O)CC(=S)C(C)C Amb24632255 [0,1,0,0,0,0|1,0,1]=3 1260 B8R0.23 CC(=O)CC(Br)C(O)=O Amb24710683 [0,1,0,0,0,0|1,0,1]=3 1261 B8R0.23 CC(=O)CC(C)C(O)=S Amb24061827 [0,1,0,0,0,0|1,1,1]=4 1262 B8R0.23 CC(=O)CC(N)C(O)=O Amb18832532 [0,1,0,0,0,0|1,0,1]=3 1263 B8R0.23 CC(=O)CC(N)C(O)=O Amb22546289 [0,1,0,0,0,0|1,0,1]=3 1264 B8R0.23 CC(=O)CC(O)C(O)=O Amb22500917 [0,1,0,0,0,0|1,0,1]=3 1265 B8R0.23 CC(=O)C[C@@H](C)C(C)=C Amb25347412 [0,1,0,0,0,0|1,0,2]=4 1266 B8R0.23 CC(=O)C[C@@H](C)C(O)=O Amb24369598 [0,1,0,0,0,0|1,0,1]=3 1267 B8R0.23 CC(=O)C[C@@H](N)C(O)=O Amb22745939 [0,1,0,0,0,0|1,0,1]=3 1268 B8R0.23 CC(=O)C[C@H](O)C(O)=O Amb24358758 [0,1,0,0,0,0|1,0,1]=3 1269 B8R0.23 CC(=O)NC(O)C(O)=O Amb25146184 [0,1,0,0,0,0|2,0,1]=4 1270 B8R0.23 CC(=O)N[C@H](C)C(O)=O Amb19944277 [0,1,0,0,0,0|2,0,1]=4 1271 B8R0.23 CC(=O)OC(C)C(O)=O Amb22360672 [0,1,0,0,0,0|2,0,1]=4 1272 B8R0.23 CC(=O)SC(C)C(O)=O Amb25719066 [0,1,0,0,0,0|2,0,1]=4 1273 B8R0.23 CC(=O)[C@@H](C)CC(O)=O Amb25145964 [0,1,0,0,0,0|1,0,1]=3 1274 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,1,0,0,0,0|1,0,1]=3 1275 B8R0.23 CC(=O)[C@H](C)CC(O)=O Amb25360184 [0,1,0,0,0,0|1,0,1]=3 1276 B8R0.23 CC(=O)\C(\Cl)=N\C(C)C Amb25086712 [0,1,0,0,0,0|2,0,1]=4 1277 B8R0.23 CC(=S)CC(C)C(O)=O Amb24588975 [0,1,0,0,0,0|1,0,1]=3 1278 B8R0.23 CC(=S)N[C@@H](C)C(O)=O Amb24529119 [0,1,0,0,0,0|2,0,1]=4 1279 B8R0.23 CC(Br)CN(C)C(C)=O Amb24672871 [0,1,0,0,0,0|3,0,0]=4 1280 B8R0.23 CC(C(=O)N)CN(C)C Amb17231865 [0,1,0,0,0,0|2,0,0]=3 1281 B8R0.23 CC(C(=O)O)NC(C)C Amb10199874 [0,1,0,0,0,0|1,0,0]=2 1282 B8R0.23 CC(C(=O)O)NC(C)C Amb1110769 [0,1,0,0,0,0|1,0,0]=2 1283 B8R0.23 CC(C(=O)O)OC(C)C Amb10607866 [0,1,0,0,0,0|1,0,0]=2 1284 B8R0.23 CC(C(C)C)CC(=O)O Amb10844380 [0,1,0,0,0,0|0,0,0]=1 1285 B8R0.23 CC(C)=C(Br)CC(N)=O Amb24478813 [0,1,0,0,0,0|1,0,2]=4 1286 B8R0.23 CC(C)=C(C)CC(O)=O Amb18642613 [0,1,0,0,0,0|0,0,2]=3 1287 B8R0.23 CC(C)=C(Cl)CC(N)=O Amb24679667 [0,1,0,0,0,0|1,0,2]=4 1288 B8R0.23 CC(C)=CC(=O)C(O)=O Amb18642579 [0,1,0,0,0,0|0,0,3]=4 1289 B8R0.23 CC(C)=CC(C)C(C)=O Amb25749549 [0,1,0,0,0,0|1,0,2]=4 1290 B8R0.23 CC(C)=C[C@@H](C)C(O)=O Amb25794277 [0,1,0,0,0,0|0,0,2]=3 1291 B8R0.23 CC(C)=C[C@H](N)C(O)=O Amb24629144 [0,1,0,0,0,0|0,0,2]=3 1292 B8R0.23 CC(C)C(/C)=C/C(C)=O Amb17778974 [0,1,0,0,0,0|1,0,2]=4 1293 B8R0.23 CC(C)C(=C)CC(O)=O Amb25074109 [0,1,0,0,0,0|0,0,1]=2 1294 B8R0.23 CC(C)C(=O)CC(C)=O Amb17778966 [0,1,0,0,0,0|1,0,1]=3 1295 B8R0.23 CC(C)C(=O)CC(C)O Amb24416703 [0,1,0,0,0,0|1,0,2]=4 1296 B8R0.23 CC(C)C(=O)NC(N)=O Amb25716051 [0,1,0,0,0,0|2,0,1]=4 1297 B8R0.23 CC(C)C(Br)CC(N)=O Amb25706465 [0,1,0,0,0,0|1,0,0]=2 1298 B8R0.23 CC(C)C(C)CC(C)=O Amb25835876 [0,1,0,0,0,0|1,0,0]=2 1299 B8R0.23 CC(C)C(C)CC(C)C Amb22729265 [0,1,0,0,0,0|2,0,1]=4 1300 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,1,0,0,0,0|1,0,0]=2 1301 B8R0.23 CC(C)C(C)NC(C)=O Amb23329033 [0,1,0,0,0,0|2,0,0]=3 1302 B8R0.23 CC(C)C(C)OC(C)=O Amb24458336 [0,1,0,0,0,0|2,0,0]=3 1303 B8R0.23 CC(C)C(C)O[N+]([O-])=O Amb25032143 [0,1,0,0,0,0|2,0,1]=4 1304 B8R0.23 CC(C)C(Cl)=CC(O)=O Amb24413053 [0,1,0,0,0,0|0,0,2]=3 1305 B8R0.23 CC(C)C(Cl)CC(=O)Cl Amb24479955 [0,1,0,0,0,0|1,0,0]=2 1306 B8R0.23 CC(C)C(Cl)CC(C)C Amb25832848 [0,1,0,0,0,0|2,0,1]=4 1307 B8R0.23 CC(C)C(Cl)SC(C)=O Amb24479957 [0,1,0,0,0,0|2,0,0]=3 1308 B8R0.23 CC(C)C(F)CC(O)=O Amb25854273 [0,1,0,0,0,0|0,0,0]=1 1309 B8R0.23 CC(C)C(N)=CC(O)=O Amb24481870 [0,1,0,0,0,0|0,0,2]=3 1310 B8R0.23 CC(C)C(N)CC(=O)Cl Amb24763731 [0,1,0,0,0,0|1,0,0]=2 1311 B8R0.23 CC(C)C(N)CC(=O)S Amb24477693 [0,1,0,0,0,0|0,1,0]=2 1312 B8R0.23 CC(C)C(N)CC(C)C Amb18993301 [0,1,0,0,0,0|2,0,1]=4 1313 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,1,0,0,0,0|1,0,0]=2 1314 B8R0.23 CC(C)C(N)CS(C)=O Amb25268163 [0,1,0,0,0,0|2,0,0]=3 1315 B8R0.23 CC(C)C(O)=CC(O)=O Amb24548066 [0,1,0,0,0,0|0,0,2]=3 1316 B8R0.23 CC(C)C(O)CC(C)=C Amb22228361 [0,1,0,0,0,0|2,0,0]=3 1317 B8R0.23 CC(C)C(O)CC(C)=O Amb24079595 [0,1,0,0,0,0|1,0,0]=2 1318 B8R0.23 CC(C)C(O)CC(C)Br Amb24480191 [0,1,0,0,0,0|2,0,1]=4 1319 B8R0.23 CC(C)C(O)CC(C)N Amb25328448 [0,1,0,0,0,0|2,0,1]=4 1320 B8R0.23 CC(C)C(O)CC(N)=O Amb24481942 [0,1,0,0,0,0|1,0,0]=2 1321 B8R0.23 CC(C)C(O)C[N+]([O-])=O Amb25176366 [0,1,0,0,0,0|1,0,1]=3 1322 B8R0.23 CC(C)C(S)CC(C)=O Amb24736725 [0,1,0,0,0,0|1,0,0]=2 1323 B8R0.23 CC(C)CC(=C)C(N)=O Amb24369675 [0,1,0,0,0,0|1,0,1]=3 1324 B8R0.23 CC(C)CC(=C)C(O)=O Amb18642603 [0,1,0,0,0,0|0,0,1]=2 1325 B8R0.23 CC(C)CC(=O)C(C)O Amb25808608 [0,1,0,0,0,0|1,0,2]=4 1326 B8R0.23 CC(C)CC(=O)C(N)=N Amb24459793 [0,1,0,0,0,0|2,0,1]=4 1327 B8R0.23 CC(C)CC(=O)C(O)O Amb24524210 [0,1,0,0,0,0|0,0,3]=4 1328 B8R0.23 CC(C)CC(=O)C([O-])=O Amb21962530 [0,1,0,0,0,0|0,0,2]=3 1329 B8R0.23 CC(C)CC(=O)C([O-])=O Amb22360647 [0,1,0,0,0,0|0,0,2]=3 1330 B8R0.23 CC(C)CC(=O)[13C]([O-])=O Amb22353494 [0,1,0,0,0,0|0,0,2]=3 1331 B8R0.23 CC(C)CC(=O)[C@@H](C)O Amb25713683 [0,1,0,0,0,0|1,0,2]=4 1332 B8R0.23 CC(C)CC(Br)C(C)=C Amb24480024 [0,1,0,0,0,0|2,0,0]=3 1333 B8R0.23 CC(C)CC(Br)C(N)=O Amb24423796 [0,1,0,0,0,0|1,0,0]=2 1334 B8R0.23 CC(C)CC(C)C(C)=O Amb24640121 [0,1,0,0,0,0|1,0,0]=2 1335 B8R0.23 CC(C)CC(C)C(C)Br Amb18330279 [0,1,0,0,0,0|2,0,1]=4 1336 B8R0.23 CC(C)CC(C)C(C)Cl Amb24524147 [0,1,0,0,0,0|2,0,1]=4 1337 B8R0.23 CC(C)CC(C)C(C)N Amb18289569 [0,1,0,0,0,0|2,0,1]=4 1338 B8R0.23 CC(C)CC(C)C(N)=N Amb24332069 [0,1,0,0,0,0|2,0,0]=3 1339 B8R0.23 CC(C)CC(C)C(N)=O Amb25733229 [0,1,0,0,0,0|1,0,0]=2 1340 B8R0.23 CC(C)CC(C)C(N)=S Amb24481694 [0,1,0,0,0,0|1,1,0]=3 1341 B8R0.23 CC(C)CC(C)C(O)=O Amb18975244 [0,1,0,0,0,0|0,0,0]=1 1342 B8R0.23 CC(C)CC(C)S([O-])=O Amb24371233 [0,1,0,0,0,0|1,0,1]=3 1343 B8R0.23 CC(C)CC(Cl)C(C)=C Amb25233440 [0,1,0,0,0,0|2,0,0]=3 1344 B8R0.23 CC(C)CC(Cl)C(N)=O Amb24534175 [0,1,0,0,0,0|1,0,0]=2 1345 B8R0.23 CC(C)CC(F)C(O)=O Amb24565634 [0,1,0,0,0,0|0,0,0]=1 1346 B8R0.23 CC(C)CC(N)B(O)O Amb25125820 [0,1,0,0,0,0|1,0,1]=3 1347 B8R0.23 CC(C)CC(N)C(C)=C Amb25764676 [0,1,0,0,0,0|2,0,0]=3 1348 B8R0.23 CC(C)CC(N)C(C)=O Amb18203220 [0,1,0,0,0,0|1,0,0]=2 1349 B8R0.23 CC(C)CC(N)C(C)=O Amb22899479 [0,1,0,0,0,0|1,0,0]=2 1350 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [0,1,0,0,0,0|1,0,1]=3 1351 B8R0.23 CC(C)CC(N)C(F)F Amb24700067 [0,1,0,0,0,0|2,0,1]=4 1352 B8R0.23 CC(C)CC(N)C(O)=O Amb22001061 [0,1,0,0,0,0|0,0,0]=1 1353 B8R0.23 CC(C)CC(N)[13C](O)=O Amb22363198 [0,1,0,0,0,0|0,0,0]=1 1354 B8R0.23 CC(C)CC(O)C(C)=C Amb25142332 [0,1,0,0,0,0|2,0,0]=3 1355 B8R0.23 CC(C)CC(O)C(C)O Amb24570892 [0,1,0,0,0,0|1,0,1]=3 1356 B8R0.23 CC(C)CC(O)C(Cl)Cl Amb25310964 [0,1,0,0,0,0|2,0,1]=4 1357 B8R0.23 CC(C)CC(S)C(O)=O Amb18296292 [0,1,0,0,0,0|0,0,0]=1 1358 B8R0.23 CC(C)CC([15NH2])C(O)=O Amb22351200 [0,1,0,0,0,0|0,0,0]=1 1359 B8R0.23 CC(C)CN(C)C(C)=N Amb25041352 [0,1,0,0,0,0|3,0,0]=4 1360 B8R0.23 CC(C)CN(C)C(C)=O Amb24545444 [0,1,0,0,0,0|2,0,0]=3 1361 B8R0.23 CC(C)C[13CH](N)C(O)=O Amb22351309 [0,1,0,0,0,0|0,0,0]=1 1362 B8R0.23 CC(C)C[13CH](N)[13C](O)=O Amb22367336 [0,1,0,0,0,0|0,0,0]=1 1363 B8R0.23 CC(C)C[C@@H](Br)C(=O)Cl Amb25290167 [0,1,0,0,0,0|1,0,0]=2 1364 B8R0.23 CC(C)C[C@@H](Br)C(N)=O Amb25310991 [0,1,0,0,0,0|1,0,0]=2 1365 B8R0.23 CC(C)C[C@@H](Br)C(O)=O Amb24648832 [0,1,0,0,0,0|0,0,0]=1 1366 B8R0.23 CC(C)C[C@@H](Cl)C(O)=O Amb22800398 [0,1,0,0,0,0|0,0,0]=1 1367 B8R0.23 CC(C)C[C@@H](F)C(O)=O Amb24616998 [0,1,0,0,0,0|0,0,0]=1 1368 B8R0.23 CC(C)C[C@@H](N)C(F)F Amb24682306 [0,1,0,0,0,0|2,0,1]=4 1369 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,1,0,0,0,0|1,0,0]=2 1370 B8R0.23 CC(C)C[C@@H]([15NH2])C(O)=O Amb22801141 [0,1,0,0,0,0|0,0,0]=1 1371 B8R0.23 CC(C)C[C@H](Br)C(O)=O Amb22226489 [0,1,0,0,0,0|0,0,0]=1 1372 B8R0.23 CC(C)C[C@H](Cl)C(N)=O Amb25145996 [0,1,0,0,0,0|1,0,0]=2 1373 B8R0.23 CC(C)C[C@H](Cl)C(O)=O Amb22388637 [0,1,0,0,0,0|0,0,0]=1 1374 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [0,1,0,0,0,0|1,0,1]=3 1375 B8R0.23 CC(C)C[C@H](N)C(=O)Cl Amb25842766 [0,1,0,0,0,0|1,0,0]=2 1376 B8R0.23 CC(C)C[C@H](N)C(O)=O Amb22351113 [0,1,0,0,0,0|0,0,0]=1 1377 B8R0.23 CC(C)C[C@H](N)C(O)O Amb24353011 [0,1,0,0,0,0|0,0,2]=3 1378 B8R0.23 CC(C)C[C@H](N)[C@@H](C)O Amb25851073 [0,1,0,0,0,0|1,0,1]=3 1379 B8R0.23 CC(C)C[C@H](O)C(N)=O Amb24548495 [0,1,0,0,0,0|1,0,0]=2 1380 B8R0.23 CC(C)C[C@H](S)C(O)=O Amb24457027 [0,1,0,0,0,0|0,0,0]=1 1381 B8R0.23 CC(C)N(C)CC(C)=O Amb22587141 [0,1,0,0,0,0|2,0,0]=3 1382 B8R0.23 CC(C)N(C)CC(N)=O Amb24384718 [0,1,0,0,0,0|2,0,0]=3 1383 B8R0.23 CC(C)N(C)C[C@@H](C)O Amb24502340 [0,1,0,0,0,0|2,0,1]=4 1384 B8R0.23 CC(C)N(C)C[C@H](C)O Amb24616788 [0,1,0,0,0,0|2,0,1]=4 1385 B8R0.23 CC(C)N(N)CC(C)O Amb25734247 [0,1,0,0,0,0|2,0,1]=4 1386 B8R0.23 CC(C)N(O)CC(=C)Br Amb24367812 [0,1,0,0,0,0|3,0,0]=4 1387 B8R0.23 CC(C)N(O)CC(C)=C Amb24645766 [0,1,0,0,0,0|3,0,0]=4 1388 B8R0.23 CC(C)N(O)CC(N)=O Amb24481943 [0,1,0,0,0,0|2,0,0]=3 1389 B8R0.23 CC(C)N=C(Cl)C(O)=O Amb25799222 [0,1,0,0,0,0|1,0,1]=3 1390 B8R0.23 CC(C)NC(=O)C(=O)Cl Amb24746768 [0,1,0,0,0,0|2,0,1]=4 1391 B8R0.23 CC(C)NC(C)C(C)=O Amb18642711 [0,1,0,0,0,0|2,0,0]=3 1392 B8R0.23 CC(C)NC(C)C(C)O Amb24712201 [0,1,0,0,0,0|2,0,1]=4 1393 B8R0.23 CC(C)N[C@@H](C)C(N)=O Amb24749342 [0,1,0,0,0,0|2,0,0]=3 1394 B8R0.23 CC(C)N[C@H](C)C(N)=O Amb24680081 [0,1,0,0,0,0|2,0,0]=3 1395 B8R0.23 CC(C)OC(=O)C(O)=O Amb25709215 [0,1,0,0,0,0|1,0,1]=3 1396 B8R0.23 CC(C)SC(F)C(O)=O Amb24671129 [0,1,0,0,0,0|1,0,0]=2 1397 B8R0.23 CC(C)S[C@@H](C)C(O)=O Amb25108429 [0,1,0,0,0,0|1,0,0]=2 1398 B8R0.23 CC(C)[13CH2][13C](=O)[13C]([O-])=O Amb22055839 [0,1,0,0,0,0|0,0,2]=3 1399 B8R0.23 CC(C)[C@@H](N)CC(C)=C Amb25821833 [0,1,0,0,0,0|2,0,0]=3 1400 B8R0.23 CC(C)[C@@H](N)CC(O)=O Amb22226647 [0,1,0,0,0,0|0,0,0]=1 1401 B8R0.23 CC(C)[C@@H](O)CC(C)=C Amb25069574 [0,1,0,0,0,0|2,0,0]=3 1402 B8R0.23 CC(C)[C@@H](O)CC(C)=O Amb25147078 [0,1,0,0,0,0|1,0,0]=2 1403 B8R0.23 CC(C)[C@@H](O)CC(O)=O Amb25761246 [0,1,0,0,0,0|0,0,0]=1 1404 B8R0.23 CC(C)[C@H](C)CC(C)=O Amb25188966 [0,1,0,0,0,0|1,0,0]=2 1405 B8R0.23 CC(C)[C@H](N)CC(C)=C Amb24715099 [0,1,0,0,0,0|2,0,0]=3 1406 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,1,0,0,0,0|1,0,0]=2 1407 B8R0.23 CC(C)[C@H](N)CC(O)=O Amb20240790 [0,1,0,0,0,0|0,0,0]=1 1408 B8R0.23 CC(C)[C@H](N)CN(C)C Amb24578683 [0,1,0,0,0,0|3,0,0]=4 1409 B8R0.23 CC(C)[C@H](O)C=C(C)C Amb25188977 [0,1,0,0,0,0|2,0,1]=4 1410 B8R0.23 CC(C)[C@H](O)CC(C)=C Amb25721776 [0,1,0,0,0,0|2,0,0]=3 1411 B8R0.23 CC(C)[C@H](O)CC(C)=O Amb25135567 [0,1,0,0,0,0|1,0,0]=2 1412 B8R0.23 CC(C)[C@H](O)CC(O)=O Amb24561913 [0,1,0,0,0,0|0,0,0]=1 1413 B8R0.23 CC(C)[C@H](O)CN(C)C Amb25356340 [0,1,0,0,0,0|3,0,0]=4 1414 B8R0.23 CC(C)[C@H](O)C[C@@H](C)O Amb25229464 [0,1,0,0,0,0|1,0,1]=3 1415 B8R0.23 CC(C)\C(\Br)=C\C(O)=O Amb25074552 [0,1,0,0,0,0|0,0,2]=3 1416 B8R0.23 CC(C)\C=C(/F)\C(O)=O Amb18642877 [0,1,0,0,0,0|0,0,2]=3 1417 B8R0.23 CC(CC(C(N)C)O)C Amb17470368 [0,1,0,0,0,0|2,0,1]=4 1418 B8R0.23 CC(CC(C)=C)C(C)N Amb25136931 [0,1,0,0,0,0|3,0,0]=4 1419 B8R0.23 CC(CC(C)=O)C(C)O Amb24339979 [0,1,0,0,0,0|2,0,0]=3 1420 B8R0.23 CC(CC(C)=O)S(C)=O Amb25712236 [0,1,0,0,0,0|3,0,0]=4 1421 B8R0.23 CC(CC(C)N)C(O)=O Amb20620336 [0,1,0,0,0,0|1,0,0]=2 1422 B8R0.23 CC(CC(C)N)S(C)=O Amb24340289 [0,1,0,0,0,0|3,0,0]=4 1423 B8R0.23 CC(CC(C)O)C(C)=O Amb25682085 [0,1,0,0,0,0|2,0,0]=3 1424 B8R0.23 CC(CC(F)F)C(C)=O Amb24360266 [0,1,0,0,0,0|3,0,0]=4 1425 B8R0.23 CC(CC(F)F)C(O)=O Amb22896466 [0,1,0,0,0,0|2,0,0]=3 1426 B8R0.23 CC(CC(O)=O)C(C)N Amb23536744 [0,1,0,0,0,0|1,0,0]=2 1427 B8R0.23 CC(CC(O)=O)C(N)=O Amb25737942 [0,1,0,0,0,0|2,0,1]=4 1428 B8R0.23 CC(CC(O)=O)N(C)N Amb25699365 [0,1,0,0,0,0|2,0,0]=3 1429 B8R0.23 CC(CC(O)=O)S(C)=O Amb18974545 [0,1,0,0,0,0|2,0,0]=3 1430 B8R0.23 CC(CN(C(C)C)C)O Amb17334133 [0,1,0,0,0,0|2,0,1]=4 1431 B8R0.23 CC(CN(C)C)[N+]([O-])=O Amb22274691 [0,1,0,0,0,0|2,0,1]=4 1432 B8R0.23 CC(CN(C)C)[N+]([O-])=O Amb24075543 [0,1,0,0,0,0|2,0,1]=4 1433 B8R0.23 CC(CN(C)O)C(O)=O Amb24540617 [0,1,0,0,0,0|2,0,0]=3 1434 B8R0.23 CC(CS(C)=O)C(O)=O Amb18974546 [0,1,0,0,0,0|2,0,0]=3 1435 B8R0.23 CC(Cl)CC(Cl)C(C)=O Amb25700978 [0,1,0,0,0,0|2,0,0]=3 1436 B8R0.23 CC(Cl)CN(C)C(C)=O Amb25325778 [0,1,0,0,0,0|3,0,0]=4 1437 B8R0.23 CC(F)CC(N)C(O)=O Amb25803619 [0,1,0,0,0,0|1,0,0]=2 1438 B8R0.23 CC(N(C)C)CC(=O)N Amb17231867 [0,1,0,0,0,0|2,0,0]=3 1439 B8R0.23 CC(N(C)C)CC(=S)N Amb17232023 [0,1,0,0,0,0|2,1,0]=4 1440 B8R0.23 CC(N(CC(=O)O)C)C Amb10609863 [0,1,0,0,0,0|1,0,0]=2 1441 B8R0.23 CC(N)C(=O)CC(N)=O Amb24712024 [0,1,0,0,0,0|2,0,1]=4 1442 B8R0.23 CC(N)CN(C)C(C)=O Amb24096452 [0,1,0,0,0,0|3,0,0]=4 1443 B8R0.23 CC(N)CN(C)C(N)=O Amb18203178 [0,1,0,0,0,0|3,0,0]=4 1444 B8R0.23 CC(NC(=O)C(=O)C)C Amb17399820 [0,1,0,0,0,0|2,0,1]=4 1445 B8R0.23 CC(NC(C)=O)C(C)O Amb25188915 [0,1,0,0,0,0|3,0,0]=4 1446 B8R0.23 CC(NC(C)=O)N(C)C Amb25064332 [0,1,0,0,0,0|3,0,0]=4 1447 B8R0.23 CC(NN(C)C)C(O)=O Amb24523085 [0,1,0,0,0,0|2,0,0]=3 1448 B8R0.23 CC(NS(C)=O)C(O)=O Amb25241916 [0,1,0,0,0,0|3,0,0]=4 1449 B8R0.23 CC(O)C(C)CC(C)O Amb25308000 [0,1,0,0,0,0|2,0,1]=4 1450 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [0,1,0,0,0,0|1,0,0]=2 1451 B8R0.23 CC(O)C(N)CN(C)C Amb18203169 [0,1,0,0,0,0|2,0,1]=4 1452 B8R0.23 CC(O)C(O)CC(C)=C Amb24740055 [0,1,0,0,0,0|3,0,0]=4 1453 B8R0.23 CC(O)C(O)CC(C)=O Amb25708226 [0,1,0,0,0,0|2,0,0]=3 1454 B8R0.23 CC(O)CC(=O)C(O)=O Amb25789747 [0,1,0,0,0,0|1,0,1]=3 1455 B8R0.23 CC(O)CC(C)C(O)=O Amb18293277 [0,1,0,0,0,0|1,0,0]=2 1456 B8R0.23 CC(O)CC(N)C(O)=O Amb18642918 [0,1,0,0,0,0|1,0,0]=2 1457 B8R0.23 CC(O)CC(O)C(N)=O Amb24523077 [0,1,0,0,0,0|2,0,0]=3 1458 B8R0.23 CC(O)CN(C)C(C)=O Amb24072011 [0,1,0,0,0,0|3,0,0]=4 1459 B8R0.23 CC(O)CN(C)C(N)=O Amb25214415 [0,1,0,0,0,0|3,0,0]=4 1460 B8R0.23 CC(OC(C)=O)C(C)Br Amb25321799 [0,1,0,0,0,0|3,0,0]=4 1461 B8R0.23 CC(OC(C)=O)C(C)Cl Amb24480182 [0,1,0,0,0,0|3,0,0]=4 1462 B8R0.23 CC(OC(F)F)C(O)=O Amb24358717 [0,1,0,0,0,0|3,0,0]=4 1463 B8R0.23 CC(OC(N)=O)N(C)C Amb24616794 [0,1,0,0,0,0|3,0,0]=4 1464 B8R0.23 CC(S(=O)CC(=O)O)C Amb10608021 [0,1,0,0,0,0|1,0,0]=2 1465 B8R0.23 CC(S)CC(O)C(O)=O Amb25032270 [0,1,0,0,0,0|1,0,0]=2 1466 B8R0.23 CC(\C(=C\C(=O)O)\C)C Amb17506861 [0,1,0,0,0,0|0,0,2]=3 1467 B8R0.23 CN(C(=O)CC(=O)O)C Amb17399822 [0,1,0,0,0,0|1,0,1]=3 1468 B8R0.23 CN(C)C(=O)CC(N)=O Amb17760295 [0,1,0,0,0,0|2,0,1]=4 1469 B8R0.23 CN(C)CC(=C)C(=O)Cl Amb25381232 [0,1,0,0,0,0|2,0,1]=4 1470 B8R0.23 CN(C)CC(F)C(O)=O Amb25178248 [0,1,0,0,0,0|1,0,0]=2 1471 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [0,1,0,0,0,0|2,0,0]=3 1472 B8R0.23 CN(C)CC(N)C(O)=O Amb22352274 [0,1,0,0,0,0|1,0,0]=2 1473 B8R0.23 CN(C)CC(N)C(O)=O Amb23558085 [0,1,0,0,0,0|1,0,0]=2 1474 B8R0.23 CN(C)CC(O)C(=C)Cl Amb25680835 [0,1,0,0,0,0|3,0,0]=4 1475 B8R0.23 CN(C)CC(O)C(N)=O Amb24333804 [0,1,0,0,0,0|2,0,0]=3 1476 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb19889770 [0,1,0,0,0,0|1,0,0]=2 1477 B8R0.23 CN(C)C[C@@H](N)C(O)=O Amb22800468 [0,1,0,0,0,0|1,0,0]=2 1478 B8R0.23 CN(C)C[C@H](N)C(O)=O Amb24078627 [0,1,0,0,0,0|1,0,0]=2 1479 B8R0.23 CN(C)C[C@H](O)C(O)=O Amb24372674 [0,1,0,0,0,0|1,0,0]=2 1480 B8R0.23 CN(CC(C(O)C)C)C Amb17593384 [0,1,0,0,0,0|2,0,1]=4 1481 B8R0.23 CN(N)C(=O)CC(O)=O Amb25326354 [0,1,0,0,0,0|2,0,1]=4 1482 B8R0.23 CS(=N)CC(N)C(O)=O Amb24374643 [0,1,0,0,0,0|2,0,0]=3 1483 B8R0.23 CS(=O)CC(N)C(O)=O Amb18125279 [0,1,0,0,0,0|2,0,0]=3 1484 B8R0.23 CS(=O)CC(O)C(O)=O Amb24692848 [0,1,0,0,0,0|2,0,0]=3 1485 B8R0.23 CS(=O)C[C@@H](C(=O)O)N Amb16232229 [0,1,0,0,0,0|2,0,0]=3 1486 B8R0.23 CS(=O)C[C@@H](N)C(O)=O Amb22745418 [0,1,0,0,0,0|2,0,0]=3 1487 B8R0.23 C[C@@H](C(=O)O)CC(C)C Amb10844070 [0,1,0,0,0,0|0,0,0]=1 1488 B8R0.23 C[C@@H](C(C)C)CC(=O)O Amb10844387 [0,1,0,0,0,0|0,0,0]=1 1489 B8R0.23 C[C@@H](CC(C)=C)[C@H](C)N Amb25267568 [0,1,0,0,0,0|3,0,0]=4 1490 B8R0.23 C[C@@H](CC(O)=O)C(Cl)Cl Amb24480304 [0,1,0,0,0,0|2,0,0]=3 1491 B8R0.23 C[C@@H](CC(O)=O)C(O)=O Amb22226742 [0,1,0,0,0,0|2,0,1]=4 1492 B8R0.23 C[C@@H](Cl)[C@H](C)OC(=O)Cl Amb25765785 [0,1,0,0,0,0|3,0,0]=4 1493 B8R0.23 C[C@@H](N)CN(C)C(C)=O Amb24465078 [0,1,0,0,0,0|3,0,0]=4 1494 B8R0.23 C[C@@H](N)[C@@H](O)CC(O)=O Amb25188895 [0,1,0,0,0,0|1,0,0]=2 1495 B8R0.23 C[C@@H](N)[C@H](O)CP(O)=O Amb25236573 [0,1,0,0,0,0|2,0,0]=3 1496 B8R0.23 C[C@@H](NC(C)=O)[C@@H](C)Br Amb24366649 [0,1,0,0,0,0|3,0,0]=4 1497 B8R0.23 C[C@@H](O)CC(=O)C(O)=O Amb25239377 [0,1,0,0,0,0|1,0,1]=3 1498 B8R0.23 C[C@@H](O)CN(C)C(C)=O Amb24416218 [0,1,0,0,0,0|3,0,0]=4 1499 B8R0.23 C[C@@H](O)C[C@H](N)C(O)=O Amb25162814 [0,1,0,0,0,0|1,0,0]=2 1500 B8R0.23 C[C@@H](O)[C@@H](O)CC(O)=O Amb25267600 [0,1,0,0,0,0|1,0,0]=2 1501 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22168848 [0,1,0,0,0,0|1,0,0]=2 1502 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22756696 [0,1,0,0,0,0|1,0,0]=2 1503 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)Br Amb24480012 [0,1,0,0,0,0|3,0,0]=4 1504 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)Cl Amb25146769 [0,1,0,0,0,0|3,0,0]=4 1505 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)O Amb25333442 [0,1,0,0,0,0|3,0,0]=4 1506 B8R0.23 C[C@@H](OC(C)=O)[C@H](C)Br Amb24432955 [0,1,0,0,0,0|3,0,0]=4 1507 B8R0.23 C[C@@H](OC(C)=O)[C@H](C)Cl Amb24740430 [0,1,0,0,0,0|3,0,0]=4 1508 B8R0.23 C[C@@H](OC(F)F)C(O)=O Amb24389309 [0,1,0,0,0,0|3,0,0]=4 1509 B8R0.23 C[C@H](C(=O)O)CC(C)C Amb10844071 [0,1,0,0,0,0|0,0,0]=1 1510 B8R0.23 C[C@H](C(=O)O)CN(C)C Amb10844031 [0,1,0,0,0,0|1,0,0]=2 1511 B8R0.23 C[C@H](CC(C)=C)[C@@H](C)N Amb25125319 [0,1,0,0,0,0|3,0,0]=4 1512 B8R0.23 C[C@H](CC(C)=C)[C@@H](C)O Amb25113682 [0,1,0,0,0,0|3,0,0]=4 1513 B8R0.23 C[C@H](CC(N)=O)C(O)=O Amb25077589 [0,1,0,0,0,0|2,0,1]=4 1514 B8R0.23 C[C@H](CC(O)=O)C(O)=O Amb22225399 [0,1,0,0,0,0|2,0,1]=4 1515 B8R0.23 C[C@H](Cl)C[C@H](N)C(O)=O Amb25849347 [0,1,0,0,0,0|1,0,0]=2 1516 B8R0.23 C[C@H](N)[C@@H](O)CC(O)=O Amb25727721 [0,1,0,0,0,0|1,0,0]=2 1517 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)Br Amb25075106 [0,1,0,0,0,0|3,0,0]=4 1518 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)O Amb25132762 [0,1,0,0,0,0|3,0,0]=4 1519 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)Br Amb24480158 [0,1,0,0,0,0|3,0,0]=4 1520 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)O Amb24562842 [0,1,0,0,0,0|3,0,0]=4 1521 B8R0.23 C[C@H](O)CC(=O)C(O)=O Amb25859340 [0,1,0,0,0,0|1,0,1]=3 1522 B8R0.23 C[C@H](O)CN(C)C(C)=O Amb24553313 [0,1,0,0,0,0|3,0,0]=4 1523 B8R0.23 C[C@H](O)C[C@@H](C)C(O)=O Amb25114249 [0,1,0,0,0,0|1,0,0]=2 1524 B8R0.23 C[C@H](O)C[C@H](N)C(O)=O Amb24461394 [0,1,0,0,0,0|1,0,0]=2 1525 B8R0.23 C[C@H](O)[C@@H](N)CN(C)C Amb25114644 [0,1,0,0,0,0|2,0,1]=4 1526 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)Br Amb24558149 [0,1,0,0,0,0|3,0,0]=4 1527 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)O Amb24642757 [0,1,0,0,0,0|3,0,0]=4 1528 B8R0.23 C[S+](C)CC(=O)C(O)=O Amb24524581 [0,1,0,0,0,0|1,0,1]=3 1529 B8R0.23 C[S+](C)CC(N)C([O-])=O Amb25242630 [0,1,0,0,0,0|1,0,1]=3 1530 B8R0.23 C[S+](C)CC(O)C(O)=O Amb24373144 [0,1,0,0,0,0|1,0,0]=2 1531 B8R0.23 C\C(=C/C(C)C)\C(O)=O Amb18642616 [0,1,0,0,0,0|0,0,2]=3 1532 B8R0.23 C\C(=C/C(C)O)\C(O)=O Amb18642769 [0,1,0,0,0,0|1,0,2]=4 1533 B8R0.23 C\C(=C/C(O)=O)\C(C)F Amb25331272 [0,1,0,0,0,0|1,0,2]=4 1534 B8R0.23 C\C(=C/C(O)=O)\[C@@H](C)N Amb24477674 [0,1,0,0,0,0|1,0,2]=4 1535 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)N Amb24394205 [0,1,0,0,0,0|1,0,2]=4 1536 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)O Amb24340136 [0,1,0,0,0,0|1,0,2]=4 1537 B8R0.23 C\C(=C/[C@@H](C)N)\C(O)=O Amb24476675 [0,1,0,0,0,0|1,0,2]=4 1538 B8R0.23 C\C(=C\C(C)=O)\C(C)C Amb25706913 [0,1,0,0,0,0|1,0,2]=4 1539 B8R0.23 C\C(=C\C(C)C)\C(C)=O Amb25679812 [0,1,0,0,0,0|1,0,2]=4 1540 B8R0.23 C\C(=C\C(C)N)\C(O)=O Amb25731207 [0,1,0,0,0,0|1,0,2]=4 1541 B8R0.23 C\C(=C\C(C)O)\C(O)=O Amb24548753 [0,1,0,0,0,0|1,0,2]=4 1542 B8R0.23 C\C(=C\N(C)C)\C(O)=O Amb24740153 [0,1,0,0,0,0|1,0,2]=4 1543 B8R0.23 C\C(\Cl)=C\C(Cl)C(O)=O Amb24710290 [0,1,0,0,0,0|1,0,2]=4 1544 B8R0.23 ClC(C(=O)O)CC(C)C Amb17593753 [0,1,0,0,0,0|0,0,0]=1 1545 B8R0.23 F[C@H](C(=O)O)CC(C)C Amb10841083 [0,1,0,0,0,0|0,0,0]=1 1546 B8R0.23 NC(=O)C(Cl)CC(Cl)Cl Amb25724974 [0,1,0,0,0,0|3,0,0]=4 1547 B8R0.23 NC(=O)C(N)CC(O)=O Amb18124347 [0,1,0,0,0,0|2,0,1]=4 1548 B8R0.23 NC(=O)C(O)CC(O)=O Amb25378786 [0,1,0,0,0,0|2,0,1]=4 1549 B8R0.23 NC(=O)C[C@@H](C(=O)O)C Amb10843937 [0,1,0,0,0,0|2,0,1]=4 1550 B8R0.23 NC(=O)C[C@@H](O)C(O)=O Amb24681022 [0,1,0,0,0,0|2,0,1]=4 1551 B8R0.23 NC(=O)C[C@H](Br)C(O)=O Amb25137878 [0,1,0,0,0,0|2,0,1]=4 1552 B8R0.23 NC(=O)C[C@H](C(=O)O)N Amb10071271 [0,1,0,0,0,0|2,0,1]=4 1553 B8R0.23 NC(=O)C[C@H](Cl)C(O)=O Amb24479999 [0,1,0,0,0,0|2,0,1]=4 1554 B8R0.23 NC(=O)C[C@H]([15NH2])C(O)=O Amb22338491 [0,1,0,0,0,0|2,0,1]=4 1555 B8R0.23 NC(=O)[C@@H](N)CC(O)=O Amb19334954 [0,1,0,0,0,0|2,0,1]=4 1556 B8R0.23 NC(=S)CC(N)C(O)=O Amb24728838 [0,1,0,0,0,0|2,0,1]=4 1557 B8R0.23 NC(C(=O)O)CC(F)F Amb13952714 [0,1,0,0,0,0|2,0,0]=3 1558 B8R0.23 NC(C(=O)O)CC(F)F Amb13952720 [0,1,0,0,0,0|2,0,0]=3 1559 B8R0.23 NC(C(C)C)CC(=O)O Amb2436060 [0,1,0,0,0,0|0,0,0]=1 1560 B8R0.23 NC(CC(F)Cl)C(O)=O Amb24339513 [0,1,0,0,0,0|2,0,0]=3 1561 B8R0.23 NC(CC(N)=O)C(Cl)Cl Amb25227960 [0,1,0,0,0,0|3,0,0]=4 1562 B8R0.23 NC(CC(O)=O)C(F)F Amb23570587 [0,1,0,0,0,0|2,0,0]=3 1563 B8R0.23 NC(CC(O)=O)C(O)=O Amb22730002 [0,1,0,0,0,0|2,0,1]=4 1564 B8R0.23 NC(CC(O)=O)C([O-])=O Amb20241398 [0,1,0,0,0,0|2,0,1]=4 1565 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22167994 [0,1,0,0,0,0|2,0,1]=4 1566 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22330537 [0,1,0,0,0,0|2,0,1]=4 1567 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22337568 [0,1,0,0,0,0|2,0,1]=4 1568 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22349433 [0,1,0,0,0,0|2,0,1]=4 1569 B8R0.23 NC(CC(O)=O)[13C](O)=O Amb22351321 [0,1,0,0,0,0|2,0,1]=4 1570 B8R0.23 NC(CC([O-])=O)C(O)=O Amb22731484 [0,1,0,0,0,0|2,0,1]=4 1571 B8R0.23 NC(CN(S)S)C(O)=O Amb24655070 [0,1,0,0,0,0|3,0,0]=4 1572 B8R0.23 NC(CS(=O)=O)C(O)=O Amb24480078 [0,1,0,0,0,0|3,0,0]=4 1573 B8R0.23 NC(CS(N)=O)C(O)=O Amb25139436 [0,1,0,0,0,0|3,0,0]=4 1574 B8R0.23 NC(CS(O)=O)C(O)=O Amb21913242 [0,1,0,0,0,0|3,0,0]=4 1575 B8R0.23 NC(C[13C](O)=O)C(O)=O Amb22362630 [0,1,0,0,0,0|2,0,1]=4 1576 B8R0.23 NC(C[13C](O)=O)[13C](O)=O Amb22353605 [0,1,0,0,0,0|2,0,1]=4 1577 B8R0.23 NC(C[N+]([O-])=O)C(O)=O Amb24642660 [0,1,0,0,0,0|3,0,0]=4 1578 B8R0.23 NC([13CH2]C(O)=O)C(O)=O Amb22336729 [0,1,0,0,0,0|2,0,1]=4 1579 B8R0.23 N[13C@@H](CC(O)=O)[13C](O)=O Amb22353606 [0,1,0,0,0,0|2,0,1]=4 1580 B8R0.23 N[13C](=O)[13CH2][13C@H](N)[13C](O)=O Amb22367522 [0,1,0,0,0,0|2,0,1]=4 1581 B8R0.23 N[C@@H](C(=O)N)CC(C)C Amb16183944 [0,1,0,0,0,0|1,0,0]=2 1582 B8R0.23 N[C@@H](C(C)C)CC(=O)O Amb16184024 [0,1,0,0,0,0|0,0,0]=1 1583 B8R0.23 N[C@@H](CB(O)O)C(O)=O Amb25844412 [0,1,0,0,0,0|3,0,0]=4 1584 B8R0.23 N[C@@H](CC(Cl)Cl)C(O)=O Amb24746791 [0,1,0,0,0,0|2,0,0]=3 1585 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb20241378 [0,1,0,0,0,0|2,0,1]=4 1586 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22337725 [0,1,0,0,0,0|2,0,1]=4 1587 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22352336 [0,1,0,0,0,0|2,0,1]=4 1588 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22748705 [0,1,0,0,0,0|2,0,1]=4 1589 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22801032 [0,1,0,0,0,0|2,0,1]=4 1590 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb20240565 [0,1,0,0,0,0|2,0,1]=4 1591 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb22748769 [0,1,0,0,0,0|2,0,1]=4 1592 B8R0.23 N[C@@H](C[13C](N)=O)C(O)=O Amb22353613 [0,1,0,0,0,0|2,0,1]=4 1593 B8R0.23 N[C@@H](C[N+]([O-])=O)C(O)=O Amb25710255 [0,1,0,0,0,0|3,0,0]=4 1594 B8R0.23 N[C@@H]([13CH2][13C](O)=O)C(O)=O Amb22367550 [0,1,0,0,0,0|2,0,1]=4 1595 B8R0.23 N[C@H](C(=O)N)CC(C)C Amb10670112 [0,1,0,0,0,0|1,0,0]=2 1596 B8R0.23 N[C@H](C(C)C)CC(=O)O Amb16184030 [0,1,0,0,0,0|0,0,0]=1 1597 B8R0.23 N[C@H](CC(F)F)C(O)=O Amb25117310 [0,1,0,0,0,0|2,0,0]=3 1598 B8R0.23 N[C@H](CC(N)=O)C(O)=O Amb17749060 [0,1,0,0,0,0|2,0,1]=4 1599 B8R0.23 N[C@H](CC(O)=O)P(O)=O Amb25838846 [0,1,0,0,0,0|3,0,0]=4 1600 B8R0.23 N[C@H](CN(S)S)C(O)=O Amb24564540 [0,1,0,0,0,0|3,0,0]=4 1601 B8R0.23 N[C@H](CS(O)=O)C(O)=O Amb24366002 [0,1,0,0,0,0|3,0,0]=4 1602 B8R0.23 OC(=O)C(Cl)CC(Cl)Cl Amb25350003 [0,1,0,0,0,0|2,0,0]=3 1603 B8R0.23 OC(=O)C(Cl)CS(O)=O Amb25708099 [0,1,0,0,0,0|3,0,0]=4 1604 B8R0.23 OC(=O)C(F)CC(O)=O Amb25077170 [0,1,0,0,0,0|2,0,1]=4 1605 B8R0.23 OC(=O)C(O)CC(=O)S Amb25690206 [0,1,0,0,0,0|2,0,1]=4 1606 B8R0.23 OC(=O)C(O)CC(O)=O Amb21935660 [0,1,0,0,0,0|2,0,1]=4 1607 B8R0.23 OC(=O)C(S)CC(O)=O Amb22729564 [0,1,0,0,0,0|2,0,1]=4 1608 B8R0.23 OC(=O)CC(=O)C(=O)C Amb17593364 [0,1,0,0,0,0|1,0,2]=4 1609 B8R0.23 OC(=O)CC(C(=O)O)C Amb1935053 [0,1,0,0,0,0|2,0,1]=4 1610 B8R0.23 OC(=O)CC(O)C(=O)Cl Amb25700438 [0,1,0,0,0,0|2,0,1]=4 1611 B8R0.23 OC(=O)CC(O)C(O)=O Amb22734584 [0,1,0,0,0,0|2,0,1]=4 1612 B8R0.23 OC(=O)CC([N+](=O)[O-])O Amb2222216 [0,1,0,0,0,0|3,0,0]=4 1613 B8R0.23 OC(=O)CN(C(=O)C)C Amb1111693 [0,1,0,0,0,0|2,0,1]=4 1614 B8R0.23 OC(=O)CS(=O)C(F)F Amb18979309 [0,1,0,0,0,0|3,0,0]=4 1615 B8R0.23 OC(=O)C[C@@H](C(=O)O)N Amb16232085 [0,1,0,0,0,0|2,0,1]=4 1616 B8R0.23 OC(=O)C[C@@H]([C@@H](O)C)N Amb16184021 [0,1,0,0,0,0|1,0,0]=2 1617 B8R0.23 OC(=O)[13CH](O)CC(O)=O Amb22367337 [0,1,0,0,0,0|2,0,1]=4 1618 B8R0.23 OC(=O)[C@@H](Cl)CC(Cl)Cl Amb25061364 [0,1,0,0,0,0|2,0,0]=3 1619 B8R0.23 OC(=O)[C@@H](Cl)CC(O)=O Amb20242425 [0,1,0,0,0,0|2,0,1]=4 1620 B8R0.23 OC(=O)[C@@H](S)CC(O)=O Amb22504526 [0,1,0,0,0,0|2,0,1]=4 1621 B8R0.23 OC(=O)[C@H](Br)CC(O)=O Amb22504149 [0,1,0,0,0,0|2,0,1]=4 1622 B8R0.23 OC(=O)[C@H](Cl)CC(O)=O Amb20242424 [0,1,0,0,0,0|2,0,1]=4 1623 B8R0.23 OC(=O)[C@H](S)CC(O)=O Amb25124090 [0,1,0,0,0,0|2,0,1]=4 1624 B8R0.23 OC(C(C)C)CC(=O)O Amb17231878 [0,1,0,0,0,0|0,0,0]=1 1625 B8R0.23 OC(CC(F)F)C(O)=O Amb25274709 [0,1,0,0,0,0|2,0,0]=3 1626 B8R0.23 OC(O)C[C@@H](O)C(O)=O Amb24524214 [0,1,0,0,0,0|2,0,0]=3 1627 B8R0.23 O[13C](=O)[13CH2][13CH]([13C](=O)O)O Amb17616665 [0,1,0,0,0,0|2,0,1]=4 1628 B8R0.23 O[C@H](C(=O)O)CC(C)C Amb16232074 [0,1,0,0,0,0|0,0,0]=1 1629 B8R0.23 O[C@H](CC(F)F)C(O)=O Amb24641140 [0,1,0,0,0,0|2,0,0]=3 1630 B8R0.23 [13CH3][13CH]([13CH3])[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337118 [0,1,0,0,0,0|0,0,0]=1 1631 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22337484 [0,1,0,0,0,0|2,0,1]=4 1632 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22351412 [0,1,0,0,0,0|2,0,1]=4 1633 B8R0.23 [15NH2]C(CC(O)=O)C(O)=O Amb22731529 [0,1,0,0,0,0|2,0,1]=4 1634 B8R0.23 [15NH2][13C@@H]([13CH2][13C](O)=O)[13C](O)=O Amb22353584 [0,1,0,0,0,0|2,0,1]=4 1635 B8R0.23 [15NH2][13CH](CC(O)=O)C(O)=O Amb22351286 [0,1,0,0,0,0|2,0,1]=4 1636 B8R0.23 [15NH2][13C](=O)[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337495 [0,1,0,0,0,0|2,0,1]=4 1637 B8R0.23 [15NH2][C@@H](CC(O)=O)[13C](O)=O Amb22367524 [0,1,0,0,0,0|2,0,1]=4 1638 B8R0.23 [O-]C(=O)CC(O)C(O)=O Amb22734911 [0,1,0,0,0,0|2,0,1]=4 1639 B8R0.29 C([2H])(NCC(=O)O)([2H])[2H] Amb17620034 [0,1,0,0,0,0|3,0,0]=4 1640 B8R0.29 CC(=C)CCC(C)(C)C Amb24712961 [0,1,0,0,0,0|2,0,0]=3 1641 B8R0.29 CC(=C)CNC(C)(C)C Amb18988470 [0,1,0,0,0,0|3,0,0]=4 1642 B8R0.29 CC(=C)CSC(C)(C)C Amb25249058 [0,1,0,0,0,0|3,0,0]=4 1643 B8R0.29 CC(=N)NCC(C)(C)C Amb24381819 [0,1,0,0,0,0|3,0,0]=4 1644 B8R0.29 CC(=O)C#CC(C)(C)C Amb25721375 [0,1,0,0,0,0|1,0,2]=4 1645 B8R0.29 CC(=O)C#CC(C)(C)Cl Amb24577769 [0,1,0,0,0,0|1,0,2]=4 1646 B8R0.29 CC(=O)C#CC(C)(C)O Amb25282796 [0,1,0,0,0,0|1,0,2]=4 1647 B8R0.29 CC(=O)CCC(F)(F)F Amb24055935 [0,1,0,0,0,0|3,0,0]=4 1648 B8R0.29 CC(=O)CCS(C)(=O)=O Amb18181020 [0,1,0,0,0,0|3,0,0]=4 1649 B8R0.29 CC(=O)CNC(C)(C)C Amb1091895 [0,1,0,0,0,0|2,0,0]=3 1650 B8R0.29 CC(=O)CNC(C)(C)C Amb22283961 [0,1,0,0,0,0|2,0,0]=3 1651 B8R0.29 CC(=O)NCC(C)(C)C Amb23247439 [0,1,0,0,0,0|2,0,0]=3 1652 B8R0.29 CC(=O)NCC(C)(C)N Amb18642812 [0,1,0,0,0,0|2,0,0]=3 1653 B8R0.29 CC(=O)NCC(C)(C)O Amb25082896 [0,1,0,0,0,0|2,0,0]=3 1654 B8R0.29 CC(=O)NC[Si](C)(C)Cl Amb24709920 [0,1,0,0,0,0|2,1,0]=4 1655 B8R0.29 CC(=O)NNC(C)(C)C Amb25746149 [0,1,0,0,0,0|3,0,0]=4 1656 B8R0.29 CC(=O)OCC(C)(C)F Amb24748637 [0,1,0,0,0,0|2,0,0]=3 1657 B8R0.29 CC(=O)OCC(C)(C)N Amb25843473 [0,1,0,0,0,0|2,0,0]=3 1658 B8R0.29 CC(=O)ONC(C)(C)C Amb22263962 [0,1,0,0,0,0|3,0,0]=4 1659 B8R0.29 CC(=O)ONC(C)(C)C Amb24744725 [0,1,0,0,0,0|3,0,0]=4 1660 B8R0.29 CC(=O)SSC(C)(C)C Amb25080492 [0,1,0,0,0,0|3,0,0]=4 1661 B8R0.29 CC(=O)\C=C\C(C)(C)Cl Amb24619610 [0,1,0,0,0,0|1,0,2]=4 1662 B8R0.29 CC(=O)\C=C\C(C)(C)O Amb25142884 [0,1,0,0,0,0|1,0,2]=4 1663 B8R0.29 CC(=S)NCC(C)(C)C Amb24349663 [0,1,0,0,0,0|2,1,0]=4 1664 B8R0.29 CC(C)(Br)\C=C\C(O)=O Amb25178813 [0,1,0,0,0,0|0,0,2]=3 1665 B8R0.29 CC(C)(C)C#CC(O)=O Amb22496786 [0,1,0,0,0,0|0,0,2]=3 1666 B8R0.29 CC(C)(C)CCB(O)O Amb24502180 [0,1,0,0,0,0|1,0,1]=3 1667 B8R0.29 CC(C)(C)CCC(=O)Cl Amb25105178 [0,1,0,0,0,0|1,0,0]=2 1668 B8R0.29 CC(C)(C)CCC(N)=N Amb24412583 [0,1,0,0,0,0|2,0,0]=3 1669 B8R0.29 CC(C)(C)CNC(N)=N Amb24502295 [0,1,0,0,0,0|3,0,0]=4 1670 B8R0.29 CC(C)(C)CNC(N)=O Amb20623709 [0,1,0,0,0,0|2,0,0]=3 1671 B8R0.29 CC(C)(C)CNC(N)=S Amb24380096 [0,1,0,0,0,0|2,1,0]=4 1672 B8R0.29 CC(C)(C)COC(N)=O Amb25190252 [0,1,0,0,0,0|2,0,0]=3 1673 B8R0.29 CC(C)(C)N=NC(N)=O Amb24452670 [0,1,0,0,0,0|3,0,0]=4 1674 B8R0.29 CC(C)(C)NCC(=C)Br Amb18523760 [0,1,0,0,0,0|3,0,0]=4 1675 B8R0.29 CC(C)(C)NCC(=C)Cl Amb18969565 [0,1,0,0,0,0|3,0,0]=4 1676 B8R0.29 CC(C)(C)NCC(=O)Cl Amb22739730 [0,1,0,0,0,0|2,0,0]=3 1677 B8R0.29 CC(C)(C)NCS([O-])=O Amb24633998 [0,1,0,0,0,0|2,0,1]=4 1678 B8R0.29 CC(C)(C)NNC(N)=O Amb24624658 [0,1,0,0,0,0|3,0,0]=4 1679 B8R0.29 CC(C)(C)OCC(=O)Cl Amb24414017 [0,1,0,0,0,0|2,0,0]=3 1680 B8R0.29 CC(C)(C)OCC(N)=O Amb22228918 [0,1,0,0,0,0|2,0,0]=3 1681 B8R0.29 CC(C)(C)OCC([O-])=O Amb22754771 [0,1,0,0,0,0|1,0,1]=3 1682 B8R0.29 CC(C)(C)ONC(N)=O Amb24387085 [0,1,0,0,0,0|3,0,0]=4 1683 B8R0.29 CC(C)(C)SCC(=C)Br Amb25691631 [0,1,0,0,0,0|3,0,0]=4 1684 B8R0.29 CC(C)(C)SCC(=C)Cl Amb25130393 [0,1,0,0,0,0|3,0,0]=4 1685 B8R0.29 CC(C)(C)\C=C\C(N)=O Amb24477842 [0,1,0,0,0,0|1,0,2]=4 1686 B8R0.29 CC(C)(Cl)CCC(O)=O Amb18644451 [0,1,0,0,0,0|0,0,0]=1 1687 B8R0.29 CC(C)(Cl)COC(N)=O Amb25188841 [0,1,0,0,0,0|2,0,0]=3 1688 B8R0.29 CC(C)(N)CCC(=C)Cl Amb25265259 [0,1,0,0,0,0|2,0,0]=3 1689 B8R0.29 CC(C)(N)CCC(F)F Amb25172484 [0,1,0,0,0,0|2,0,1]=4 1690 B8R0.29 CC(C)(N)CNC(N)=N Amb25146007 [0,1,0,0,0,0|3,0,0]=4 1691 B8R0.29 CC(C)(N)COP(O)=O Amb25111079 [0,1,0,0,0,0|2,0,0]=3 1692 B8R0.29 CC(C)(O)C#CC(N)=O Amb25309417 [0,1,0,0,0,0|1,0,2]=4 1693 B8R0.29 CC(C)(O)CCB(O)O Amb24544502 [0,1,0,0,0,0|1,0,1]=3 1694 B8R0.29 CC(C)(O)CCC(N)=S Amb25777865 [0,1,0,0,0,0|1,1,0]=3 1695 B8R0.29 CC(C)(O)CCC([O-])=O Amb24271108 [0,1,0,0,0,0|0,0,1]=2 1696 B8R0.29 CC(C)(O)CNC(N)=N Amb24436490 [0,1,0,0,0,0|3,0,0]=4 1697 B8R0.29 CC(C)(O)\C=C\C(O)=O Amb18642770 [0,1,0,0,0,0|0,0,2]=3 1698 B8R0.29 CC(C)(S)CCC(O)=O Amb22489759 [0,1,0,0,0,0|0,0,0]=1 1699 B8R0.29 CC(C)([NH3+])CCC(O)=O Amb22372040 [0,1,0,0,0,0|0,0,0]=1 1700 B8R0.29 CC(C)=CCC(C)(C)N Amb25146192 [0,1,0,0,0,0|2,0,1]=4 1701 B8R0.29 CC(C)=CCP(O)(O)=O Amb25308177 [0,1,0,0,0,0|1,0,2]=4 1702 B8R0.29 CC(C)CCC(C)(C)Cl Amb22228727 [0,1,0,0,0,0|2,0,1]=4 1703 B8R0.29 CC(C)CCC(C)(C)N Amb18299832 [0,1,0,0,0,0|2,0,1]=4 1704 B8R0.29 CC(C)CCS(=O)(=O)Br Amb23555504 [0,1,0,0,0,0|1,0,1]=3 1705 B8R0.29 CC(C)CCS(=O)(=O)Cl Amb18289340 [0,1,0,0,0,0|1,0,1]=3 1706 B8R0.29 CC(C)CCS(C)(=O)=O Amb25049892 [0,1,0,0,0,0|1,0,1]=3 1707 B8R0.29 CC(C)CCS(N)(=O)=O Amb18791482 [0,1,0,0,0,0|1,0,1]=3 1708 B8R0.29 CC(C)CNS(N)(=O)=O Amb24462446 [0,1,0,0,0,0|2,0,1]=4 1709 B8R0.29 CC(C)COP(C)(=O)Cl Amb24481755 [0,1,0,0,0,0|3,0,0]=4 1710 B8R0.29 CC(C)COP(C)(C)=O Amb25042087 [0,1,0,0,0,0|3,0,0]=4 1711 B8R0.29 CC(C)COP(C)(O)=O Amb24117879 [0,1,0,0,0,0|2,0,0]=3 1712 B8R0.29 CC(C)COP(O)(O)=O Amb25264732 [0,1,0,0,0,0|2,0,0]=3 1713 B8R0.29 CC(C)COS(C)(=O)=O Amb22388880 [0,1,0,0,0,0|2,0,1]=4 1714 B8R0.29 CC(C)COS(O)(=O)=O Amb25200264 [0,1,0,0,0,0|2,0,0]=3 1715 B8R0.29 CC(CNC(C)(C)C)O Amb17138374 [0,1,0,0,0,0|2,0,1]=4 1716 B8R0.29 CC(CNS(=O)(=O)Cl)C Amb17193918 [0,1,0,0,0,0|2,0,1]=4 1717 B8R0.29 CC(COS(=O)[O-])([NH3+])C Amb10552435 [0,1,0,0,0,0|2,0,1]=4 1718 B8R0.29 CC(Cl)CCC(C)(C)C Amb24659082 [0,1,0,0,0,0|2,0,1]=4 1719 B8R0.29 CC(Cl)CCP(=O)(Cl)Cl Amb24640281 [0,1,0,0,0,0|3,0,0]=4 1720 B8R0.29 CC(Cl)CCS(C)(=O)=O Amb24407021 [0,1,0,0,0,0|2,0,1]=4 1721 B8R0.29 CC(Cl)CCS(N)(=O)=O Amb25774525 [0,1,0,0,0,0|2,0,1]=4 1722 B8R0.29 CC(Cl)COS(O)(=O)=O Amb24479974 [0,1,0,0,0,0|3,0,0]=4 1723 B8R0.29 CC(F)(F)CCC(=O)Cl Amb25086105 [0,1,0,0,0,0|2,0,0]=3 1724 B8R0.29 CC(F)(F)\C=C\C(O)=O Amb22295928 [0,1,0,0,0,0|1,0,2]=4 1725 B8R0.29 CC(N)(F)CCC(O)=O Amb24672870 [0,1,0,0,0,0|1,0,0]=2 1726 B8R0.29 CC(N)CCC(C)(C)C Amb18993576 [0,1,0,0,0,0|2,0,1]=4 1727 B8R0.29 CC(N)CCC(C)(C)O Amb18642846 [0,1,0,0,0,0|2,0,1]=4 1728 B8R0.29 CC(N)CCP(C)(O)=O Amb25765644 [0,1,0,0,0,0|2,0,0]=3 1729 B8R0.29 CC(N)CCS(C)(=O)=O Amb18300587 [0,1,0,0,0,0|2,0,1]=4 1730 B8R0.29 CC(N)CCS(O)(=O)=O Amb24522970 [0,1,0,0,0,0|2,0,0]=3 1731 B8R0.29 CC(N)CSP(O)(O)=O Amb24649696 [0,1,0,0,0,0|3,0,0]=4 1732 B8R0.29 CC(O)(O)NCC(O)=O Amb24715373 [0,1,0,0,0,0|2,0,0]=3 1733 B8R0.29 CC(O)CCC(C)(C)Cl Amb24355214 [0,1,0,0,0,0|1,0,1]=3 1734 B8R0.29 CC(O)CCC(C)(C)F Amb24757018 [0,1,0,0,0,0|1,0,1]=3 1735 B8R0.29 CC(O)CCC(C)(C)N Amb18642848 [0,1,0,0,0,0|1,0,1]=3 1736 B8R0.29 CC(O)CCS(C)(=O)=O Amb18180142 [0,1,0,0,0,0|2,0,1]=4 1737 B8R0.29 CC(O)COP(O)(O)=O Amb17673332 [0,1,0,0,0,0|3,0,0]=4 1738 B8R0.29 CC(S)CCC(C)(C)C Amb25044907 [0,1,0,0,0,0|1,1,1]=4 1739 B8R0.29 CN(C)CCC(C)(C)C Amb24477868 [0,1,0,0,0,0|3,0,0]=4 1740 B8R0.29 CN(C)CCC(C)(C)N Amb18203192 [0,1,0,0,0,0|3,0,0]=4 1741 B8R0.29 CN(C)CCC(C)(C)N Amb22491500 [0,1,0,0,0,0|3,0,0]=4 1742 B8R0.29 CN(C)CCC(C)(C)O Amb24126299 [0,1,0,0,0,0|2,0,1]=4 1743 B8R0.29 CN(C)CCS(=O)(=O)Cl Amb24524149 [0,1,0,0,0,0|2,0,1]=4 1744 B8R0.29 CS(=O)(=O)OCC(O)=O Amb25783884 [0,1,0,0,0,0|3,0,0]=4 1745 B8R0.29 CS(=O)CCC(C)(C)N Amb24538977 [0,1,0,0,0,0|2,0,0]=3 1746 B8R0.29 CS(=O)NCC(C)(C)N Amb25263937 [0,1,0,0,0,0|3,0,0]=4 1747 B8R0.29 CS(=O)NCC(C)(C)O Amb25177000 [0,1,0,0,0,0|3,0,0]=4 1748 B8R0.29 CS(C)(=O)=NCC(N)=O Amb24572132 [0,1,0,0,0,0|3,0,0]=4 1749 B8R0.29 C[C@@H](N)CCC(C)(C)C Amb25780124 [0,1,0,0,0,0|2,0,1]=4 1750 B8R0.29 C[C@@H](N)CCS(O)(=O)=O Amb22799661 [0,1,0,0,0,0|2,0,0]=3 1751 B8R0.29 C[C@@H](O)COC(C)(C)C Amb19929334 [0,1,0,0,0,0|2,0,1]=4 1752 B8R0.29 C[C@H](N)CCS(O)(=O)=O Amb25342455 [0,1,0,0,0,0|2,0,0]=3 1753 B8R0.29 C[C@H](O)COC(C)(C)C Amb19929322 [0,1,0,0,0,0|2,0,1]=4 1754 B8R0.29 C[C@H](O)COP(O)(O)=O Amb25687780 [0,1,0,0,0,0|3,0,0]=4 1755 B8R0.29 C[N+](C)(C)CCC(N)=O Amb24482186 [0,1,0,0,0,0|2,0,0]=3 1756 B8R0.29 C[N+](C)(C)CCC(O)=O Amb24117222 [0,1,0,0,0,0|1,0,0]=2 1757 B8R0.29 C[Si](C)(C)CCC(N)=O Amb25745193 [0,1,0,0,0,0|1,1,0]=3 1758 B8R0.29 C[Si](C)(C)CCC(O)=O Amb19894136 [0,1,0,0,0,0|0,1,0]=2 1759 B8R0.29 C[Si](C)(C)CCC(O)=O Amb22274047 [0,1,0,0,0,0|0,1,0]=2 1760 B8R0.29 C[Si](C)(C)CCC([O-])=O Amb24121542 [0,1,0,0,0,0|0,1,1]=3 1761 B8R0.29 C[Si](C)(C)CNC(N)=O Amb19944636 [0,1,0,0,0,0|2,1,0]=4 1762 B8R0.29 C[Si](C)(C)COC(N)=O Amb25307228 [0,1,0,0,0,0|2,1,0]=4 1763 B8R0.29 C[Si](C)(C)OCC(=O)Cl Amb25281946 [0,1,0,0,0,0|2,1,0]=4 1764 B8R0.29 C[Si](C)(C)\C=C\C(O)=O Amb25380054 [0,1,0,0,0,0|0,1,2]=4 1765 B8R0.29 C[Si](C)(O)CCC(O)=O Amb24680973 [0,1,0,0,0,0|0,1,0]=2 1766 B8R0.29 ClC(=O)OCC(C)(C)C Amb10844667 [0,1,0,0,0,0|2,0,0]=3 1767 B8R0.29 NC(=O)C#CC(C)(C)C Amb10552858 [0,1,0,0,0,0|1,0,2]=4 1768 B8R0.29 O=C(Br)CCC(F)(F)F Amb22360324 [0,1,0,0,0,0|3,0,0]=4 1769 B8R0.29 O=C(Cl)CCC(Cl)(Cl)Cl Amb25342106 [0,1,0,0,0,0|3,0,0]=4 1770 B8R0.29 O=C(Cl)CCC(F)(F)F Amb19737369 [0,1,0,0,0,0|3,0,0]=4 1771 B8R0.29 OC(=O)CCC(Br)(F)F Amb10838819 [0,1,0,0,0,0|2,0,0]=3 1772 B8R0.29 OC(=O)CCC(F)(Cl)Cl Amb25062982 [0,1,0,0,0,0|2,0,0]=3 1773 B8R0.29 OC(=O)CCC(N)(C)C Amb13951332 [0,1,0,0,0,0|0,0,0]=1 1774 B8R0.29 OC(=O)CCP(=O)(O)C Amb1792559 [0,1,0,0,0,0|2,0,0]=3 1775 B8R0.29 OC(=O)CCP(=O)(O)O Amb2228990 [0,1,0,0,0,0|3,0,0]=4 1776 B8R0.29 OC(=O)CCS(=O)(=O)Cl Amb24481869 [0,1,0,0,0,0|3,0,0]=4 1777 B8R0.29 OC(=O)CCS(=O)(=O)O Amb17399954 [0,1,0,0,0,0|3,0,0]=4 1778 B8R0.29 OC(=O)CCS(=O)(=O)S Amb24627680 [0,1,0,0,0,0|3,0,0]=4 1779 B8R0.29 OC(=O)CC[B-](F)(F)F Amb24351210 [0,1,0,0,0,0|3,0,0]=4 1780 B8R0.29 OC(=O)CC[Ge](Cl)(Cl)Cl Amb19930252 [0,1,0,0,0,0|2,1,0]=4 1781 B8R0.29 OC(=O)CC[P](O)(O)O Amb24543829 [0,1,0,0,0,0|3,0,0]=4 1782 B8R0.29 OC(=O)CNC(C)(C)C Amb10610332 [0,1,0,0,0,0|1,0,0]=2 1783 B8R0.29 OC(=O)CNC(O)(O)O Amb24671331 [0,1,0,0,0,0|3,0,0]=4 1784 B8R0.29 OC(=O)CNS(=O)(=O)C Amb1120433 [0,1,0,0,0,0|3,0,0]=4 1785 B8R0.29 OC(=O)CSS(=O)(=O)C Amb17610576 [0,1,0,0,0,0|3,0,0]=4 1786 B8R0.29 OS(=O)(=O)CCC(Cl)Cl Amb24546390 [0,1,0,0,0,0|3,0,0]=4 1787 B8R0.29 [O-]C(=O)CC[Si](C)(C)C Amb10563760 [0,1,0,0,0,0|0,1,1]=3 1788 B8R0.29 [O-]C(=O)CNC(C)(C)C Amb10576193 [0,1,0,0,0,0|1,0,1]=3 1789 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [0,0,0,1,0,0|1,0,2]=4 1790 B8R1.3 C=C1CCC(Br)CC1 Amb25320915 [0,0,0,1,0,0|3,0,0]=4 1791 B8R1.3 C=C1CCC(N)CC1 Amb23599023 [0,0,0,1,0,0|3,0,0]=4 1792 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,0,0,1,0,0|1,0,2]=4 1793 B8R1.3 CC1CC=C(C)CN1 Amb23455589 [0,0,0,1,0,0|3,0,0]=4 1794 B8R1.3 CC1CCC(=C)CC1 Amb24058250 [0,0,0,1,0,0|2,0,0]=3 1795 B8R1.3 CC1CCC(=O)C=C1 Amb24556470 [0,0,0,1,0,0|1,0,1]=3 1796 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,0,0,1,0,0|2,0,0]=3 1797 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,0,0,1,0,0|2,0,0]=3 1798 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,0,0,1,0,0|1,0,0]=2 1799 B8R1.3 CC1CCC(Br)CO1 Amb25808117 [0,0,0,1,0,0|2,0,1]=4 1800 B8R1.3 CC1CCC(CC1)N Amb16236164 [0,0,0,1,0,0|2,0,1]=4 1801 B8R1.3 CC1CCC(CC1)[NH3+] Amb10807415 [0,0,0,1,0,0|2,0,1]=4 1802 B8R1.3 CC1CCC(Cl)CO1 Amb25774457 [0,0,0,1,0,0|2,0,1]=4 1803 B8R1.3 CC1CCC(O)CN1 Amb18641838 [0,0,0,1,0,0|2,0,1]=4 1804 B8R1.3 CC1CCC(O)CS1 Amb23568601 [0,0,0,1,0,0|2,0,1]=4 1805 B8R1.3 CC1CCN(CC1)N Amb17231817 [0,0,0,1,0,0|3,0,0]=4 1806 B8R1.3 CC1CCN(O)CC1 Amb25188076 [0,0,0,1,0,0|2,0,0]=3 1807 B8R1.3 CC1CN=C(N)SC1 Amb25169567 [0,0,0,1,0,0|2,1,0]=4 1808 B8R1.3 CC1CNC(=N)CC1 Amb25680063 [0,0,0,1,0,0|2,0,0]=3 1809 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,0,0,1,0,0|2,0,0]=3 1810 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,0,0,1,0,0|2,0,0]=3 1811 B8R1.3 CC1CNC(C)CC1 Amb18641751 [0,0,0,1,0,0|2,0,1]=4 1812 B8R1.3 CC1CNC(C)CC1 Amb20623339 [0,0,0,1,0,0|2,0,1]=4 1813 B8R1.3 CC1CNC(C)CO1 Amb22751384 [0,0,0,1,0,0|2,0,1]=4 1814 B8R1.3 CC1CNC(N)=NC1 Amb24685625 [0,0,0,1,0,0|3,0,0]=4 1815 B8R1.3 CC1CNC(O)=NC1 Amb25268854 [0,0,0,1,0,0|2,0,0]=3 1816 B8R1.3 CC1CNC(S)=NC1 Amb25211387 [0,0,0,1,0,0|2,1,0]=4 1817 B8R1.3 CC1COC(=O)OC1 Amb21856480 [0,0,0,1,0,0|1,0,0]=2 1818 B8R1.3 CC1COC(C)CO1 Amb25738098 [0,0,0,1,0,0|2,0,1]=4 1819 B8R1.3 CC1SCC(=O)CS1 Amb25086708 [0,0,0,1,0,0|3,0,0]=4 1820 B8R1.3 CC=1CCC(=O)NC1 Amb25078192 [0,0,0,1,0,0|1,0,2]=4 1821 B8R1.3 CC=1CCC(O)CN1 Amb25700893 [0,0,0,1,0,0|3,0,0]=4 1822 B8R1.3 CC=1CC[C@@H](O)CC1 Amb25796430 [0,0,0,1,0,0|3,0,0]=4 1823 B8R1.3 CN1CC=C(Br)CC1 Amb22728686 [0,0,0,1,0,0|3,0,0]=4 1824 B8R1.3 CN1CC=C(N)CC1 Amb25829461 [0,0,0,1,0,0|3,0,0]=4 1825 B8R1.3 CN1CCC(=C)CC1 Amb19514532 [0,0,0,1,0,0|3,0,0]=4 1826 B8R1.3 CN1CCC(=C)CC1 Amb22752768 [0,0,0,1,0,0|3,0,0]=4 1827 B8R1.3 CN1CCC(=CC1)Br Amb13888775 [0,0,0,1,0,0|3,0,0]=4 1828 B8R1.3 CN1CCC(=N)CC1 Amb25824943 [0,0,0,1,0,0|3,0,0]=4 1829 B8R1.3 CN1CCC(=O)C=C1 Amb17593148 [0,0,0,1,0,0|2,0,1]=4 1830 B8R1.3 CP1CCC(=O)CC1 Amb25767035 [0,0,0,1,0,0|2,0,0]=3 1831 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,0,0,1,0,0|2,0,0]=3 1832 B8R1.3 C[C@@H]1CCC(O)C=C1 Amb24362861 [0,0,0,1,0,0|1,0,2]=4 1833 B8R1.3 C[C@@H]1CC[C@@H](Br)CC1 Amb24483210 [0,0,0,1,0,0|2,0,1]=4 1834 B8R1.3 C[C@@H]1CC[C@@H](CC1)N Amb17617288 [0,0,0,1,0,0|2,0,1]=4 1835 B8R1.3 C[C@@H]1CC[C@@H](CC1)O Amb10844735 [0,0,0,1,0,0|1,0,1]=3 1836 B8R1.3 C[C@@H]1CC[C@@H](O)C=C1 Amb25225606 [0,0,0,1,0,0|1,0,2]=4 1837 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb22886214 [0,0,0,1,0,0|2,0,1]=4 1838 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb25175824 [0,0,0,1,0,0|2,0,1]=4 1839 B8R1.3 C[C@@H]1CC[C@@H](O)CO1 Amb25176515 [0,0,0,1,0,0|2,0,1]=4 1840 B8R1.3 C[C@@H]1CC[C@H](Br)CC1 Amb24546453 [0,0,0,1,0,0|2,0,1]=4 1841 B8R1.3 C[C@@H]1CC[C@H](CN1)C Amb15691739 [0,0,0,1,0,0|2,0,1]=4 1842 B8R1.3 C[C@@H]1CC[C@H](Cl)CC1 Amb25858134 [0,0,0,1,0,0|2,0,1]=4 1843 B8R1.3 C[C@@H]1CC[C@H](N)CC1 Amb22747002 [0,0,0,1,0,0|2,0,1]=4 1844 B8R1.3 C[C@@H]1CC[C@H](O)CN1 Amb22886213 [0,0,0,1,0,0|2,0,1]=4 1845 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,0,0,1,0,0|2,0,0]=3 1846 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,0,0,1,0,0|2,0,0]=3 1847 B8R1.3 C[C@@H]1CN[C@@H](C)CO1 Amb22745541 [0,0,0,1,0,0|2,0,1]=4 1848 B8R1.3 C[C@@H]1CN[C@@H](C)CO1 Amb22748917 [0,0,0,1,0,0|2,0,1]=4 1849 B8R1.3 C[C@@H]1CN[C@H](C)CO1 Amb22745542 [0,0,0,1,0,0|2,0,1]=4 1850 B8R1.3 C[C@@H]1CN[C@H](C)CO1 Amb22747293 [0,0,0,1,0,0|2,0,1]=4 1851 B8R1.3 C[C@H]1CCC(=O)CO1 Amb25262664 [0,0,0,1,0,0|2,0,0]=3 1852 B8R1.3 C[C@H]1CC[C@@H](C)CC1 Amb22230414 [0,0,0,1,0,0|2,0,1]=4 1853 B8R1.3 C[C@H]1CC[C@H](O)C=C1 Amb25317220 [0,0,0,1,0,0|1,0,2]=4 1854 B8R1.3 C[C@H]1CC[C@H](O)CN1 Amb24575263 [0,0,0,1,0,0|2,0,1]=4 1855 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,0,0,1,0,0|2,0,0]=3 1856 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,0,0,1,0,0|2,0,0]=3 1857 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,0,0,1,0,0|2,0,0]=3 1858 B8R1.3 C[C@H]1CN[C@@H](C)CO1 Amb24087467 [0,0,0,1,0,0|2,0,1]=4 1859 B8R1.3 C[NH+]1CCC(=O)CC1 Amb10552693 [0,0,0,1,0,0|2,0,0]=3 1860 B8R1.3 ClC1CC=C(Cl)CC1 Amb25210464 [0,0,0,1,0,0|3,0,0]=4 1861 B8R1.3 NC1CCC(=O)CC1 Amb10067105 [0,0,0,1,0,0|2,0,0]=3 1862 B8R1.3 NC1CCC(=O)CC1 Amb21862513 [0,0,0,1,0,0|2,0,0]=3 1863 B8R1.3 NC1CCC(=O)CC1 Amb22831860 [0,0,0,1,0,0|2,0,0]=3 1864 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [0,0,0,1,0,0|2,0,0]=3 1865 B8R1.3 NC1CCC(=O)NN1 Amb24456868 [0,0,0,1,0,0|3,0,0]=4 1866 B8R1.3 NC1CCN(O)CC1 Amb24546360 [0,0,0,1,0,0|3,0,0]=4 1867 B8R1.3 NC1CCS(=O)CC1 Amb18943776 [0,0,0,1,0,0|3,0,0]=4 1868 B8R1.3 NC1CCS(=O)CC1 Amb21988665 [0,0,0,1,0,0|3,0,0]=4 1869 B8R1.3 NC1CNC(=O)CC1 Amb18833034 [0,0,0,1,0,0|2,0,0]=3 1870 B8R1.3 NC1CNC(O)=NC1 Amb25232194 [0,0,0,1,0,0|3,0,0]=4 1871 B8R1.3 NC1COS(=O)OC1 Amb24564500 [0,0,0,1,0,0|3,0,0]=4 1872 B8R1.3 N[C@@H]1CC[C@@H](CC1)O Amb10071293 [0,0,0,1,0,0|2,0,1]=4 1873 B8R1.3 N[C@@H]1CNC(=O)CC1 Amb22748949 [0,0,0,1,0,0|2,0,0]=3 1874 B8R1.3 O=C1CCC(=O)CN1 Amb15692796 [0,0,0,1,0,0|2,0,1]=4 1875 B8R1.3 O=C1CCC(Br)C=C1 Amb24483190 [0,0,0,1,0,0|2,0,1]=4 1876 B8R1.3 O=C1CCC(Cl)NN1 Amb24749762 [0,0,0,1,0,0|3,0,0]=4 1877 B8R1.3 O=C1CCC(F)CC1 Amb20671078 [0,0,0,1,0,0|2,0,0]=3 1878 B8R1.3 O=C1CCC(I)CN1 Amb25341317 [0,0,0,1,0,0|2,0,0]=3 1879 B8R1.3 O=C1CNC(=O)CC1 Amb22491034 [0,0,0,1,0,0|2,0,1]=4 1880 B8R1.3 O=C1CNC(=O)OC1 Amb24481365 [0,0,0,1,0,0|2,0,1]=4 1881 B8R1.3 O=C1NCC(Br)CN1 Amb24749834 [0,0,0,1,0,0|3,0,0]=4 1882 B8R1.3 O=S1CCC(Cl)CC1 Amb21988466 [0,0,0,1,0,0|3,0,0]=4 1883 B8R1.3 OC1CC=C(Br)CC1 Amb24353589 [0,0,0,1,0,0|3,0,0]=4 1884 B8R1.3 OC1CCC(=O)NC1 Amb10066907 [0,0,0,1,0,0|2,0,0]=3 1885 B8R1.3 OC1CCC(Br)CC1 Amb24117124 [0,0,0,1,0,0|2,0,1]=4 1886 B8R1.3 OC1CCC(F)CC1 Amb25698698 [0,0,0,1,0,0|2,0,1]=4 1887 B8R1.3 OC1CCN(O)CC1 Amb25092093 [0,0,0,1,0,0|3,0,0]=4 1888 B8R1.3 OC1CCS(=O)CC1 Amb21988465 [0,0,0,1,0,0|3,0,0]=4 1889 B8R1.3 OC1CNC(=O)NC1 Amb19516674 [0,0,0,1,0,0|3,0,0]=4 1890 B8R1.3 OC1CNC(O)=NC1 Amb20001781 [0,0,0,1,0,0|3,0,0]=4 1891 B8R1.3 O[C@@H]1CC[C@@H](O)CC1 Amb22750651 [0,0,0,1,0,0|2,0,1]=4 1892 B8R1.3 O[C@@H]1CC[C@@H](S)CC1 Amb23400868 [0,0,0,1,0,0|2,0,1]=4 1893 B8R1.3 O[C@@H]1CC[C@H](Br)CC1 Amb24448359 [0,0,0,1,0,0|2,0,1]=4 1894 B8R1.3 O[C@@H]1CC[C@H](Cl)CC1 Amb25708530 [0,0,0,1,0,0|2,0,1]=4 1895 B8R1.3 O[C@@H]1CC[C@H](F)CC1 Amb25341995 [0,0,0,1,0,0|2,0,1]=4 1896 B8R1.3 O[C@@H]1CO[C@@H](O)CC1 Amb25219273 [0,0,0,1,0,0|1,0,2]=4 1897 B8R1.3 O[C@@H]1CS[C@@H](O)CC1 Amb24576460 [0,0,0,1,0,0|1,1,1]=4 1898 B8R1.3 O[C@@H]1CS[C@H](O)CC1 Amb25747081 [0,0,0,1,0,0|1,1,1]=4 1899 B8R1.3 O[C@H]1CCC(=O)C=C1 Amb25707492 [0,0,0,1,0,0|2,0,1]=4 1900 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,0,0,1,0,0|1,0,2]=4 1901 B8R1.20 C=C1C[C@@H]1CC(O)=O Amb25331268 [0,0,0,1,0,0|0,0,2]=3 1902 B8R1.20 C=C1C[C@H]1CC(O)=O Amb24686141 [0,0,0,1,0,0|0,0,2]=3 1903 B8R1.20 CC(C)CC1CC1N Amb18285795 [0,0,0,1,0,0|2,0,1]=4 1904 B8R1.20 CC1CC1=CC(O)=O Amb25256441 [0,0,0,1,0,0|0,0,2]=3 1905 B8R1.20 CC1CC1CB(O)O Amb24641424 [0,0,0,1,0,0|1,0,1]=3 1906 B8R1.20 CC1CC1CC(N)=O Amb25772500 [0,0,0,1,0,0|1,0,0]=2 1907 B8R1.20 CC1CC1CC(O)=O Amb25316515 [0,0,0,1,0,0|0,0,0]=1 1908 B8R1.20 CC1CC1NC(N)=O Amb25074259 [0,0,0,1,0,0|2,0,0]=3 1909 B8R1.20 CC1CC1NC(N)=S Amb25361754 [0,0,0,1,0,0|2,1,0]=4 1910 B8R1.20 CC1OC1CC(O)=O Amb24710388 [0,0,0,1,0,0|1,0,0]=2 1911 B8R1.20 CC1OC1C[N+]([O-])=O Amb25205724 [0,0,0,1,0,0|2,0,1]=4 1912 B8R1.20 C[C@@H]1C[C@H]1CC(C)=O Amb24373459 [0,0,0,1,0,0|1,0,0]=2 1913 B8R1.20 C[C@@H]1C[C@H]1NC(C)=O Amb24619123 [0,0,0,1,0,0|2,0,0]=3 1914 B8R1.20 C[C@@H]1O[C@H]1CC(N)=O Amb24629162 [0,0,0,1,0,0|2,0,0]=3 1915 B8R1.20 C[C@H]1C[C@H]1CC(C)=O Amb25257655 [0,0,0,1,0,0|1,0,0]=2 1916 B8R1.20 C[C@H]1C[C@H]1CC(O)=O Amb25174744 [0,0,0,1,0,0|0,0,0]=1 1917 B8R1.20 C[C@H]1C[C@H]1NC(N)=O Amb24532410 [0,0,0,1,0,0|2,0,0]=3 1918 B8R1.20 C[C@H]1O[C@@H]1CC(C)O Amb25176687 [0,0,0,1,0,0|2,0,1]=4 1919 B8R1.20 C[C@H]1O[C@H]1CC(O)=O Amb25747306 [0,0,0,1,0,0|1,0,0]=2 1920 B8R1.20 N[C@H]1C[C@H]1CC(O)=O Amb24585123 [0,0,0,1,0,0|1,0,0]=2 1921 B8R1.23 C=C1CC(C1)C(N)=O Amb22896664 [0,0,0,1,0,0|1,0,2]=4 1922 B8R1.23 CC(=C)C1CC(=O)C1 Amb25373403 [0,0,0,1,0,0|1,0,2]=4 1923 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,0,0,1,0,0|2,0,0]=3 1924 B8R1.23 CC(=O)N1CC(F)C1 Amb25106122 [0,0,0,1,0,0|3,0,0]=4 1925 B8R1.23 CC(=O)N1CC(N)C1 Amb19329932 [0,0,0,1,0,0|3,0,0]=4 1926 B8R1.23 CC(=O)N1CC(N)C1 Amb22406088 [0,0,0,1,0,0|3,0,0]=4 1927 B8R1.23 CC(=O)N1CC(O)C1 Amb17935746 [0,0,0,1,0,0|3,0,0]=4 1928 B8R1.23 CC(C)C1CC(=O)C1 Amb25806486 [0,0,0,1,0,0|1,0,0]=2 1929 B8R1.23 CC(C)C1CC(N)C1 Amb25222659 [0,0,0,1,0,0|2,0,1]=4 1930 B8R1.23 CC(C)N1CC(O)C1 Amb19516900 [0,0,0,1,0,0|2,0,1]=4 1931 B8R1.23 CC(C)[C@@H]1C[C@H](N)C1 Amb25084600 [0,0,0,1,0,0|2,0,1]=4 1932 B8R1.23 CC(N)C1CC(O)C1 Amb24413900 [0,0,0,1,0,0|2,0,1]=4 1933 B8R1.23 CC(N)[C@@H]1C[C@H](O)C1 Amb22899694 [0,0,0,1,0,0|2,0,1]=4 1934 B8R1.23 CC(O)C1CC(=O)O1 Amb25317296 [0,0,0,1,0,0|1,0,0]=2 1935 B8R1.23 CC(O)C1CN(C)C1 Amb21960300 [0,0,0,1,0,0|2,0,1]=4 1936 B8R1.23 CC1CC(C1)C(=O)Cl Amb24361916 [0,0,0,1,0,0|1,0,0]=2 1937 B8R1.23 CC1CC(C1)C(C)=O Amb23590280 [0,0,0,1,0,0|1,0,0]=2 1938 B8R1.23 CC1CC(C1)C(C)Br Amb25056740 [0,0,0,1,0,0|2,0,1]=4 1939 B8R1.23 CC1CC(C1)C(C)O Amb23590278 [0,0,0,1,0,0|1,0,1]=3 1940 B8R1.23 CC1CC(C1)C(O)=O Amb19515989 [0,0,0,1,0,0|0,0,0]=1 1941 B8R1.23 CC1CC(C1)N(C)C Amb25269706 [0,0,0,1,0,0|3,0,0]=4 1942 B8R1.23 CC1CN(C1)C(C)=O Amb25044287 [0,0,0,1,0,0|2,0,0]=3 1943 B8R1.23 CC=1CC(C1)C(C)=O Amb24676939 [0,0,0,1,0,0|1,0,2]=4 1944 B8R1.23 CN1CC(C1)C(O)=O Amb19958116 [0,0,0,1,0,0|1,0,0]=2 1945 B8R1.23 C[C@@H]1C[C@@H](C1)C(O)=O Amb22746374 [0,0,0,1,0,0|0,0,0]=1 1946 B8R1.23 C[C@@H]1C[C@H](C1)C(O)=O Amb22746375 [0,0,0,1,0,0|0,0,0]=1 1947 B8R1.23 C[C@H](O)[C@@H]1CC(=O)O1 Amb24515159 [0,0,0,1,0,0|1,0,0]=2 1948 B8R1.23 C[C@H]1C[C@H](N1)C(O)=O Amb24514390 [0,0,0,1,0,0|1,0,0]=2 1949 B8R1.23 ClC(=O)C1CC(=C)C1 Amb10071441 [0,0,0,1,0,0|1,0,2]=4 1950 B8R1.23 ClC1CC(C1)C(=O)O Amb16233600 [0,0,0,1,0,0|1,0,0]=2 1951 B8R1.23 NC(=O)C1CC(=O)C1 Amb22896730 [0,0,0,1,0,0|2,0,1]=4 1952 B8R1.23 NC(=O)C1CC(O)C1 Amb23570502 [0,0,0,1,0,0|2,0,0]=3 1953 B8R1.23 NC(=O)N1CC(F)C1 Amb25739433 [0,0,0,1,0,0|3,0,0]=4 1954 B8R1.23 NC1CC(C1)C(=O)O Amb10610660 [0,0,0,1,0,0|1,0,0]=2 1955 B8R1.23 NC1CC(C1)C(N)=O Amb20622654 [0,0,0,1,0,0|2,0,0]=3 1956 B8R1.23 NC1CC(C1)C(O)=O Amb21963541 [0,0,0,1,0,0|1,0,0]=2 1957 B8R1.23 N[C@@H]1C[C@@H](C1)C(=O)O Amb10604131 [0,0,0,1,0,0|1,0,0]=2 1958 B8R1.23 N[C@@H]1C[C@@H](C1)C(N)=O Amb22896793 [0,0,0,1,0,0|2,0,0]=3 1959 B8R1.23 N[C@@H]1C[C@H](C1)C(=O)O Amb10604102 [0,0,0,1,0,0|1,0,0]=2 1960 B8R1.23 N[C@@H]1C[C@H](C1)C(N)=O Amb22896794 [0,0,0,1,0,0|2,0,0]=3 1961 B8R1.23 N[C@@H]1C[C@H](C1)C(O)=O Amb19514893 [0,0,0,1,0,0|1,0,0]=2 1962 B8R1.23 O=C(Cl)C1CC(Cl)C1 Amb24739809 [0,0,0,1,0,0|2,0,0]=3 1963 B8R1.23 O=C1CC(C1)C(=O)Cl Amb16230813 [0,0,0,1,0,0|2,0,1]=4 1964 B8R1.23 O=C1CC(C1)C(=O)O Amb1106387 [0,0,0,1,0,0|1,0,1]=3 1965 B8R1.23 O=C1CC(N1)C(=O)O Amb16232079 [0,0,0,1,0,0|2,0,1]=4 1966 B8R1.23 O=C1C[C@@H](O1)C(Cl)Cl Amb25108146 [0,0,0,1,0,0|2,0,0]=3 1967 B8R1.23 OC(=O)C1CC(F)C1 Amb20621267 [0,0,0,1,0,0|1,0,0]=2 1968 B8R1.23 OC(=O)[C@@H]1CC(=O)N1 Amb22367070 [0,0,0,1,0,0|2,0,1]=4 1969 B8R1.23 OC(=O)[C@@H]1C[C@@H](Br)C1 Amb24339433 [0,0,0,1,0,0|1,0,0]=2 1970 B8R1.23 OC(=O)[C@H]1CC(=O)O1 Amb25705638 [0,0,0,1,0,0|2,0,1]=4 1971 B8R1.23 OC1CC(C1)C(=O)Cl Amb24661280 [0,0,0,1,0,0|2,0,0]=3 1972 B8R1.23 O[C@@H]1C[C@H](C1)C(O)=O Amb19516178 [0,0,0,1,0,0|1,0,0]=2 1973 B8R1.23 O[C@H]1C[C@H](C1)C(O)=O Amb19516179 [0,0,0,1,0,0|1,0,0]=2 1974 B8R1.35 C=C(Br)CNC1CC1 Amb18969560 [0,0,0,1,0,0|3,0,0]=4 1975 B8R1.35 C=C(Cl)CNC1CC1 Amb18969181 [0,0,0,1,0,0|3,0,0]=4 1976 B8R1.35 CC(=C)CNC1CC1 Amb17317871 [0,0,0,1,0,0|3,0,0]=4 1977 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [0,0,0,1,0,0|1,0,0]=2 1978 B8R1.35 CC(=O)NCC1CO1 Amb23557281 [0,0,0,1,0,0|3,0,0]=4 1979 B8R1.35 CC(=O)NC[C@H]1CO1 Amb25068125 [0,0,0,1,0,0|3,0,0]=4 1980 B8R1.35 CC(=O)OCC1CC1 Amb24502182 [0,0,0,1,0,0|2,0,0]=3 1981 B8R1.35 CC(=O)OCC1CO1 Amb10789133 [0,0,0,1,0,0|3,0,0]=4 1982 B8R1.35 CC(=O)SCC1CC1 Amb24623413 [0,0,0,1,0,0|2,0,0]=3 1983 B8R1.35 CC(=O)\C=C\C1CC1 Amb25830492 [0,0,0,1,0,0|1,0,2]=4 1984 B8R1.35 CC(Br)CCC1CC1 Amb25067290 [0,0,0,1,0,0|2,0,1]=4 1985 B8R1.35 CC(C)NCC1CO1 Amb24629694 [0,0,0,1,0,0|2,0,1]=4 1986 B8R1.35 CC(C)OC[C@H]1CO1 Amb24641497 [0,0,0,1,0,0|2,0,1]=4 1987 B8R1.35 CC(C)SCC1CO1 Amb24449627 [0,0,0,1,0,0|2,0,1]=4 1988 B8R1.35 CC(CNC1CC1)O Amb17138364 [0,0,0,1,0,0|2,0,1]=4 1989 B8R1.35 CC(Cl)CCC1CC1 Amb24611649 [0,0,0,1,0,0|2,0,1]=4 1990 B8R1.35 CC(N)CCC1CC1 Amb18203368 [0,0,0,1,0,0|2,0,1]=4 1991 B8R1.35 CC(O)CCC1CC1 Amb25733792 [0,0,0,1,0,0|1,0,1]=3 1992 B8R1.35 CN(C)CCC1CO1 Amb24482563 [0,0,0,1,0,0|2,0,1]=4 1993 B8R1.35 CN(N)CCC1CC1 Amb25072134 [0,0,0,1,0,0|3,0,0]=4 1994 B8R1.35 C[C@@H](N)CCC1CC1 Amb25745640 [0,0,0,1,0,0|2,0,1]=4 1995 B8R1.35 C[C@@H](O)CCC1CC1 Amb24693085 [0,0,0,1,0,0|1,0,1]=3 1996 B8R1.35 C[C@@H](O)CNC1CC1 Amb25083354 [0,0,0,1,0,0|2,0,1]=4 1997 B8R1.35 C[C@H](O)CCC1CC1 Amb25025020 [0,0,0,1,0,0|1,0,1]=3 1998 B8R1.35 C[C@H](O)CC[C@@H]1CO1 Amb25284230 [0,0,0,1,0,0|2,0,1]=4 1999 B8R1.35 C[C@H](O)CNC1CC1 Amb25694355 [0,0,0,1,0,0|2,0,1]=4 2000 B8R1.35 NC(=N)CNC1CC1 Amb24495903 [0,0,0,1,0,0|3,0,0]=4 2001 B8R1.35 NC(=N)NCC1CC1 Amb19748557 [0,0,0,1,0,0|3,0,0]=4 2002 B8R1.35 NC(=N)SCC1CC1 Amb24364813 [0,0,0,1,0,0|3,0,0]=4 2003 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,0,0,1,0,0|2,0,0]=3 2004 B8R1.35 NC(=O)NCC1CC1 Amb1138798 [0,0,0,1,0,0|2,0,0]=3 2005 B8R1.35 NC(=O)\C=C\C1CC1 Amb25226133 [0,0,0,1,0,0|1,0,2]=4 2006 B8R1.35 NC(=S)CCC1CC1 Amb24483097 [0,0,0,1,0,0|1,1,0]=3 2007 B8R1.35 NC(=S)CNC1CC1 Amb17231870 [0,0,0,1,0,0|2,1,0]=4 2008 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [0,0,0,1,0,0|1,0,0]=2 2009 B8R1.35 O=C(Cl)OCC1CC1 Amb24370017 [0,0,0,1,0,0|2,0,0]=3 2010 B8R1.35 O=C(Cl)OCC1CO1 Amb25258534 [0,0,0,1,0,0|3,0,0]=4 2011 B8R1.35 OC(=O)C#CC1CC1 Amb1036650 [0,0,0,1,0,0|0,0,2]=3 2012 B8R1.35 OC(=O)CC=C1CC1 Amb25119812 [0,0,0,1,0,0|0,0,2]=3 2013 B8R1.35 OC(=O)\C=C\C1CC1 Amb18285135 [0,0,0,1,0,0|0,0,2]=3 2014 B8R1.35 OC(=O)\C=C\C1CO1 Amb24548089 [0,0,0,1,0,0|1,0,2]=4 2015 B8R1.35 [O-]S(=O)CCC1CC1 Amb25212503 [0,0,0,1,0,0|1,0,1]=3 2016 B8R1.51 BrC1CCS(=O)(=O)C1 Amb2548437 [0,0,0,1,0,0|2,0,1]=4 2017 B8R1.51 CC1(C)C=CC(=O)N1 Amb25254168 [0,0,0,1,0,0|1,0,2]=4 2018 B8R1.51 CC1(C)C=CC(=O)O1 Amb24099124 [0,0,0,1,0,0|0,0,2]=3 2019 B8R1.51 CC1(C)CC(=O)CC1 Amb19516867 [0,0,0,1,0,0|1,0,0]=2 2020 B8R1.51 CC1(C)CC(=O)CN1 Amb24460323 [0,0,0,1,0,0|2,0,0]=3 2021 B8R1.51 CC1(C)CC(=O)CO1 Amb24083194 [0,0,0,1,0,0|2,0,0]=3 2022 B8R1.51 CC1(C)CC(=O)CS1 Amb21964095 [0,0,0,1,0,0|2,0,0]=3 2023 B8R1.51 CC1(C)CC(=O)NN1 Amb22289371 [0,0,0,1,0,0|3,0,0]=4 2024 B8R1.51 CC1(C)CC(Br)CC1 Amb24531343 [0,0,0,1,0,0|2,0,1]=4 2025 B8R1.51 CC1(C)CC(Cl)CC1 Amb25684314 [0,0,0,1,0,0|2,0,1]=4 2026 B8R1.51 CC1(C)CC(N)CC1 Amb22740161 [0,0,0,1,0,0|2,0,1]=4 2027 B8R1.51 CC1(C)CC(N)CC1 Amb24460775 [0,0,0,1,0,0|2,0,1]=4 2028 B8R1.51 CC1(C)CC(O)CC1 Amb22549345 [0,0,0,1,0,0|1,0,1]=3 2029 B8R1.51 CC1(C)CC(O)CN1 Amb25722225 [0,0,0,1,0,0|2,0,1]=4 2030 B8R1.51 CC1(C)CC(O)CO1 Amb25296086 [0,0,0,1,0,0|2,0,1]=4 2031 B8R1.51 CC1(C)CCC(=N)N1 Amb25733497 [0,0,0,1,0,0|2,0,0]=3 2032 B8R1.51 CC1(C)CCC(=S)N1 Amb25827545 [0,0,0,1,0,0|1,1,0]=3 2033 B8R1.51 CC1(C)CN(N)CC1 Amb25131612 [0,0,0,1,0,0|3,0,0]=4 2034 B8R1.51 CC1(C)CN=C(N)C1 Amb24568278 [0,0,0,1,0,0|3,0,0]=4 2035 B8R1.51 CC1(C)CN=C(N)N1 Amb24454073 [0,0,0,1,0,0|3,0,0]=4 2036 B8R1.51 CC1(C)CN=C(N)O1 Amb25720624 [0,0,0,1,0,0|2,0,0]=3 2037 B8R1.51 CC1(C)COC(=O)C1 Amb22284870 [0,0,0,1,0,0|2,0,0]=3 2038 B8R1.51 CC1(C)COC(=O)N1 Amb19516997 [0,0,0,1,0,0|2,0,0]=3 2039 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,0,0,1,0,0|1,0,0]=2 2040 B8R1.51 CC1(C)COC(Br)=N1 Amb25185353 [0,0,0,1,0,0|3,0,0]=4 2041 B8R1.51 CC1(C)COC(N)=N1 Amb22732038 [0,0,0,1,0,0|3,0,0]=4 2042 B8R1.51 CC1(C)COC(O)C1 Amb24717478 [0,0,0,1,0,0|2,0,1]=4 2043 B8R1.51 CC1(C)CSC(=O)O1 Amb24357776 [0,0,0,1,0,0|1,0,0]=2 2044 B8R1.51 CC1(C)CSC(=S)N1 Amb25189019 [0,0,0,1,0,0|2,1,0]=4 2045 B8R1.51 CC1(C)NC(=O)CO1 Amb25254094 [0,0,0,1,0,0|2,0,0]=3 2046 B8R1.51 CC1(C)NC(=O)N=N1 Amb24481503 [0,0,0,1,0,0|3,0,0]=4 2047 B8R1.51 CC1(C)NC(=O)NN1 Amb25835118 [0,0,0,1,0,0|3,0,0]=4 2048 B8R1.51 CC1(C)NCC(=S)N1 Amb25068482 [0,0,0,1,0,0|2,1,0]=4 2049 B8R1.51 CC1(F)CNC(=O)C1 Amb24454478 [0,0,0,1,0,0|3,0,0]=4 2050 B8R1.51 CC1(N)COC(=O)C1 Amb25288591 [0,0,0,1,0,0|3,0,0]=4 2051 B8R1.51 CC1(O)CC(=O)CC1 Amb25129578 [0,0,0,1,0,0|2,0,0]=3 2052 B8R1.51 CC1(O)CC(N)CC1 Amb24483255 [0,0,0,1,0,0|2,0,1]=4 2053 B8R1.51 CC1(O)CCC(=O)N1 Amb24483013 [0,0,0,1,0,0|2,0,0]=3 2054 B8R1.51 CC1(O)CCC(=O)O1 Amb22338334 [0,0,0,1,0,0|1,0,0]=2 2055 B8R1.51 CC1CC(C)(O)CS1 Amb24332391 [0,0,0,1,0,0|2,0,1]=4 2056 B8R1.51 CC1CCC(C)(C)N1 Amb18833048 [0,0,0,1,0,0|2,0,1]=4 2057 B8R1.51 CC1CCS(=O)(=O)C1 Amb2548451 [0,0,0,1,0,0|1,0,1]=3 2058 B8R1.51 CC1CCS(=O)(=O)N1 Amb24556783 [0,0,0,1,0,0|2,0,1]=4 2059 B8R1.51 CC1CNS(=O)(=O)C1 Amb24117862 [0,0,0,1,0,0|2,0,1]=4 2060 B8R1.51 CC1COC(C)(C)O1 Amb17674077 [0,0,0,1,0,0|2,0,1]=4 2061 B8R1.51 CC1NCC(O1)(C)C Amb17506152 [0,0,0,1,0,0|2,0,1]=4 2062 B8R1.51 CC=1CNC(C)(C)C1 Amb25104519 [0,0,0,1,0,0|3,0,0]=4 2063 B8R1.51 CC=1CSC(C)(C)N1 Amb24733807 [0,0,0,1,0,0|3,0,0]=4 2064 B8R1.51 CN1CC(C)(O)CC1 Amb24529596 [0,0,0,1,0,0|2,0,1]=4 2065 B8R1.51 CP1(=O)CC(=O)CC1 Amb25231314 [0,0,0,1,0,0|3,0,0]=4 2066 B8R1.51 CP1(=O)CCC(=O)O1 Amb22228817 [0,0,0,1,0,0|2,0,0]=3 2067 B8R1.51 CP1(=S)CC(=O)CC1 Amb24388618 [0,0,0,1,0,0|3,0,0]=4 2068 B8R1.51 C[C@@]1(O)CNC(=O)C1 Amb24672065 [0,0,0,1,0,0|3,0,0]=4 2069 B8R1.51 C[N+]1(C)CC(=O)CC1 Amb25735729 [0,0,0,1,0,0|2,0,0]=3 2070 B8R1.51 C[N+]1(C)CC(O)CC1 Amb25782228 [0,0,0,1,0,0|2,0,1]=4 2071 B8R1.51 C[N+]1(C)CCC(O)O1 Amb25721019 [0,0,0,1,0,0|1,0,2]=4 2072 B8R1.51 C[N+]1(C)CCC([O-])=N1 Amb25113848 [0,0,0,1,0,0|2,0,1]=4 2073 B8R1.51 C[Si]1(C)CC(O)CC1 Amb24504254 [0,0,0,1,0,0|1,1,1]=4 2074 B8R1.51 C[Si]1(C)C[C@@H](O)CC1 Amb25251506 [0,0,0,1,0,0|1,1,1]=4 2075 B8R1.51 C[Si]1(C)C[C@H](O)CC1 Amb24354436 [0,0,0,1,0,0|1,1,1]=4 2076 B8R1.51 ClC1CCS(=O)(=O)C1 Amb2505054 [0,0,0,1,0,0|2,0,1]=4 2077 B8R1.51 NC1CCS(=O)(=O)C1 Amb1080886 [0,0,0,1,0,0|2,0,1]=4 2078 B8R1.51 NC1CCS(=O)(=O)C1 Amb1152771 [0,0,0,1,0,0|2,0,1]=4 2079 B8R1.51 NC1CC[S+]([O-])(=O)C1 Amb17726901 [0,0,0,1,0,0|2,0,1]=4 2080 B8R1.51 NC1CP(O)(=O)CC1 Amb25231215 [0,0,0,1,0,0|2,0,0]=3 2081 B8R1.51 NC1CS(=O)(=O)CC1 Amb22345691 [0,0,0,1,0,0|2,0,1]=4 2082 B8R1.51 N[C@@H]1CS(=O)(=O)CC1 Amb24563288 [0,0,0,1,0,0|2,0,1]=4 2083 B8R1.51 O=C1C=CC(C1)(C)C Amb15693471 [0,0,0,1,0,0|1,0,2]=4 2084 B8R1.51 O=C1CC(F)(F)CC1 Amb21963547 [0,0,0,1,0,0|3,0,0]=4 2085 B8R1.51 O=C1CCC(O1)([2H])[2H] Amb17610398 [0,0,0,1,0,0|2,0,0]=3 2086 B8R1.51 O=C1CCS(=O)(=O)O1 Amb17399828 [0,0,0,1,0,0|3,0,0]=4 2087 B8R1.51 O=C1COC(O1)(C)C Amb10601611 [0,0,0,1,0,0|1,0,0]=2 2088 B8R1.51 O=C1NCC(O1)(C)C Amb16202554 [0,0,0,1,0,0|1,0,0]=2 2089 B8R1.51 O=C1OCC(F)(F)O1 Amb24332045 [0,0,0,1,0,0|3,0,0]=4 2090 B8R1.51 O=S1(=O)CC(I)CC1 Amb19517046 [0,0,0,1,0,0|2,0,1]=4 2091 B8R1.51 O=S1(=O)CC([S-])CC1 Amb18526895 [0,0,0,1,0,0|2,0,1]=4 2092 B8R1.51 OC1=N[N+](CC1)(C)C Amb10777461 [0,0,0,1,0,0|2,0,0]=3 2093 B8R1.51 OC1CCS(=O)(=O)C1 Amb1068281 [0,0,0,1,0,0|2,0,1]=4 2094 B8R1.51 OC1CC[S+](=O)(C1)[O-] Amb10236942 [0,0,0,1,0,0|2,0,1]=4 2095 B8R1.51 O[C@@H]1CS(=O)(=O)CC1 Amb25837922 [0,0,0,1,0,0|2,0,1]=4 2096 B8R1.51 [18OH]C1CCS(=O)(=O)C1 Amb2548438 [0,0,0,1,0,0|2,0,1]=4 2097 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 Amb2459236 [0,0,0,1,0,0|2,0,1]=4 2098 B8R1.69 CC1(C)CCC1(C)O Amb25052578 [0,0,0,1,0,0|1,0,1]=3 2099 B8R1.69 CC1(C)CCS1(=O)=O Amb22365064 [0,0,0,1,0,0|1,0,1]=3 2100 B8R1.69 CC1(O)CCC1(C)N Amb24117489 [0,0,0,1,0,0|2,0,1]=4 2101 B8R1.69 CC1(O)CCC1(C)N Amb25843376 [0,0,0,1,0,0|2,0,1]=4 2102 B8R1.77 CC(=O)C1=CC1(C)C Amb24456677 [0,0,0,1,0,0|1,0,2]=4 2103 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,0,0,1,0,0|1,0,0]=2 2104 B8R1.77 CC(=O)C1CC1(F)F Amb25219948 [0,0,0,1,0,0|3,0,0]=4 2105 B8R1.77 CC(N)C1CC1(C)C Amb23590883 [0,0,0,1,0,0|2,0,1]=4 2106 B8R1.77 CC(O)C1CC1(C)C Amb25859391 [0,0,0,1,0,0|1,0,1]=3 2107 B8R1.77 CC(O)[C@H]1CC1(C)C Amb25185137 [0,0,0,1,0,0|1,0,1]=3 2108 B8R1.77 CC1(C)C=C1C(O)=O Amb24746031 [0,0,0,1,0,0|0,0,2]=3 2109 B8R1.77 CC1(C)NC1C(O)=O Amb23401629 [0,0,0,1,0,0|1,0,0]=2 2110 B8R1.77 CC1(C)OC1C(N)=O Amb25324328 [0,0,0,1,0,0|2,0,0]=3 2111 B8R1.77 CC1(C)OC1C(O)=O Amb24481352 [0,0,0,1,0,0|1,0,0]=2 2112 B8R1.77 CC1(C)ON1C(N)=O Amb25745268 [0,0,0,1,0,0|3,0,0]=4 2113 B8R1.77 CC1(C)S[C@H]1C(O)=O Amb24445654 [0,0,0,1,0,0|1,0,0]=2 2114 B8R1.77 CC1(Cl)CC1C(O)=O Amb24629731 [0,0,0,1,0,0|1,0,0]=2 2115 B8R1.77 C[C@@H](N)C1CC1(C)C Amb24434247 [0,0,0,1,0,0|2,0,1]=4 2116 B8R1.77 C[C@@H](O)C1CC1(C)C Amb25074915 [0,0,0,1,0,0|1,0,1]=3 2117 B8R1.77 C[C@H](N)C1CC1(C)C Amb25684599 [0,0,0,1,0,0|2,0,1]=4 2118 B8R1.77 ClC(=O)C1CC1(C)C Amb16230811 [0,0,0,1,0,0|1,0,0]=2 2119 B8R1.77 ClC(=O)C1CC1(Cl)Cl Amb16230810 [0,0,0,1,0,0|3,0,0]=4 2120 B8R1.77 NC(=O)C1CC1(Br)Br Amb22460226 [0,0,0,1,0,0|3,0,0]=4 2121 B8R1.77 NC(=O)C1CC1(F)F Amb24715693 [0,0,0,1,0,0|3,0,0]=4 2122 B8R1.77 NC(=O)[C@@H]1CC1(C)C Amb10072071 [0,0,0,1,0,0|1,0,0]=2 2123 B8R1.77 OC(=O)C1CC1(Br)Br Amb24651946 [0,0,0,1,0,0|2,0,0]=3 2124 B8R1.77 OC(=O)C1CC1(Cl)Cl Amb1106460 [0,0,0,1,0,0|2,0,0]=3 2125 B8R1.77 OC(=O)C1CC1(F)Cl Amb10841879 [0,0,0,1,0,0|2,0,0]=3 2126 B6R0.2 C=C(Br)CC(O)=O Amb24479176 [0,0,0,0,1,0|1,0,2]=4 2127 B6R0.2 CC(=C)CC(=O)C Amb17593075 [0,0,0,0,1,0|1,0,2]=4 2128 B6R0.2 CC(=C)CN(C)C Amb25747292 [0,0,0,0,1,0|3,0,0]=4 2129 B6R0.2 CC(=CC(=O)N)C Amb10561758 [0,0,0,0,1,0|1,0,2]=4 2130 B6R0.2 CC(=CC(=O)O)C Amb1485519 [0,0,0,0,1,0|0,0,2]=3 2131 B6R0.2 CC(=N)CC(N)=O Amb25259783 [0,0,0,0,1,0|2,0,1]=4 2132 B6R0.2 CC(=O)C=S(C)C Amb25370005 [0,0,0,0,1,0|2,0,1]=4 2133 B6R0.2 CC(=O)CC(=O)Br Amb24422459 [0,0,0,0,1,0|2,0,1]=4 2134 B6R0.2 CC(=O)CC(C)=N Amb22345922 [0,0,0,0,1,0|2,0,1]=4 2135 B6R0.2 CC(=O)CC(C)=O Amb22727963 [0,0,0,0,1,0|2,0,1]=4 2136 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [0,0,0,0,1,0|2,0,0]=3 2137 B6R0.2 CC(=O)CC(C)[O-] Amb22729909 [0,0,0,0,1,0|2,0,0]=3 2138 B6R0.2 CC(=O)CC(Cl)Cl Amb24476084 [0,0,0,0,1,0|3,0,0]=4 2139 B6R0.2 CC(=O)CC(F)F Amb24669174 [0,0,0,0,1,0|3,0,0]=4 2140 B6R0.2 CC(=O)CC(O)=O Amb22348460 [0,0,0,0,1,0|1,0,1]=3 2141 B6R0.2 CC(=O)CC(O)=S Amb24689856 [0,0,0,0,1,0|1,1,1]=4 2142 B6R0.2 CC(=O)CC(O)O Amb25273111 [0,0,0,0,1,0|3,0,0]=4 2143 B6R0.2 CC(=O)CC([O-])=O Amb22265051 [0,0,0,0,1,0|1,0,2]=4 2144 B6R0.2 CC(=O)CS(C)=O Amb25025354 [0,0,0,0,1,0|3,0,0]=4 2145 B6R0.2 CC(=O)C[S+](C)C Amb24614662 [0,0,0,0,1,0|2,0,0]=3 2146 B6R0.2 CC(=O)NN(C)C Amb25064806 [0,0,0,0,1,0|3,0,0]=4 2147 B6R0.2 CC(=S)CC(N)=O Amb24479846 [0,0,0,0,1,0|2,0,1]=4 2148 B6R0.2 CC(Br)=CC(O)=O Amb25347173 [0,0,0,0,1,0|1,0,2]=4 2149 B6R0.2 CC(Br)CC(C)=C Amb24365286 [0,0,0,0,1,0|3,0,0]=4 2150 B6R0.2 CC(Br)CC(C)O Amb25139315 [0,0,0,0,1,0|2,0,1]=4 2151 B6R0.2 CC(Br)CC(N)=N Amb25700372 [0,0,0,0,1,0|3,0,0]=4 2152 B6R0.2 CC(Br)CC(N)=O Amb24635749 [0,0,0,0,1,0|2,0,0]=3 2153 B6R0.2 CC(Br)OC(C)=O Amb19958925 [0,0,0,0,1,0|3,0,0]=4 2154 B6R0.2 CC(C)=NC(N)=O Amb24682478 [0,0,0,0,1,0|2,0,1]=4 2155 B6R0.2 CC(C)C=C(Br)Br Amb24736609 [0,0,0,0,1,0|2,0,1]=4 2156 B6R0.2 CC(C)CC(=C)Br Amb22583739 [0,0,0,0,1,0|2,0,0]=3 2157 B6R0.2 CC(C)CC(C)C Amb22045157 [0,0,0,0,1,0|2,0,1]=4 2158 B6R0.2 CC(C)CC(C)I Amb25783778 [0,0,0,0,1,0|2,0,1]=4 2159 B6R0.2 CC(C)CC(Cl)Br Amb24634052 [0,0,0,0,1,0|2,0,1]=4 2160 B6R0.2 CC(C)CC(Cl)Cl Amb17689252 [0,0,0,0,1,0|2,0,1]=4 2161 B6R0.2 CC(C)CC([O-])=O Amb22732147 [0,0,0,0,1,0|0,0,1]=2 2162 B6R0.2 CC(C)CC([O-])=O Amb22732282 [0,0,0,0,1,0|0,0,1]=2 2163 B6R0.2 CC(C)CC([O-])=O Amb22734041 [0,0,0,0,1,0|0,0,1]=2 2164 B6R0.2 CC(C)CC([O-])=O Amb22734425 [0,0,0,0,1,0|0,0,1]=2 2165 B6R0.2 CC(C)CN(C)N Amb25339332 [0,0,0,0,1,0|3,0,0]=4 2166 B6R0.2 CC(C)CS(N)=O Amb24527860 [0,0,0,0,1,0|2,0,0]=3 2167 B6R0.2 CC(C)CS([O-])=O Amb19930010 [0,0,0,0,1,0|1,0,1]=3 2168 B6R0.2 CC(C)C[13C](O)=O Amb22336513 [0,0,0,0,1,0|0,0,0]=1 2169 B6R0.2 CC(C)C[13C]([O-])=O Amb22336662 [0,0,0,0,1,0|0,0,1]=2 2170 B6R0.2 CC(C)C[Al](Cl)Cl Amb22353406 [0,0,0,0,1,0|3,0,0]=4 2171 B6R0.2 CC(C)C[N+]([O-])=O Amb17672613 [0,0,0,0,1,0|1,0,1]=3 2172 B6R0.2 CC(C)C[SiH](Cl)Cl Amb25143964 [0,0,0,0,1,0|2,1,0]=4 2173 B6R0.2 CC(C)NC(=O)F Amb24567697 [0,0,0,0,1,0|2,0,0]=3 2174 B6R0.2 CC(C)NC(C)=C Amb25746179 [0,0,0,0,1,0|3,0,0]=4 2175 B6R0.2 CC(C)NC(C)=N Amb25711699 [0,0,0,0,1,0|3,0,0]=4 2176 B6R0.2 CC(C)NC(C)O Amb25662502 [0,0,0,0,1,0|2,0,1]=4 2177 B6R0.2 CC(C)NC(N)=N Amb24271074 [0,0,0,0,1,0|3,0,0]=4 2178 B6R0.2 CC(C)NC(S)=S Amb24761419 [0,0,0,0,1,0|1,2,0]=4 2179 B6R0.2 CC(C)OC(=C)O Amb24086570 [0,0,0,0,1,0|2,0,0]=3 2180 B6R0.2 CC(C)OC(C)=S Amb24697607 [0,0,0,0,1,0|2,1,0]=4 2181 B6R0.2 CC(C)OC(N)=S Amb25732665 [0,0,0,0,1,0|2,1,0]=4 2182 B6R0.2 CC(C)OC(S)=S Amb22274297 [0,0,0,0,1,0|1,2,0]=4 2183 B6R0.2 CC(C)OC(S)=S Amb24465791 [0,0,0,0,1,0|1,2,0]=4 2184 B6R0.2 CC(C)OC([S-])=S Amb19748282 [0,0,0,0,1,0|1,2,0]=4 2185 B6R0.2 CC(C)OC([S-])=S Amb22729007 [0,0,0,0,1,0|1,2,0]=4 2186 B6R0.2 CC(C)OP(C)=O Amb24592794 [0,0,0,0,1,0|3,0,0]=4 2187 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [0,0,0,0,1,0|2,0,0]=3 2188 B6R0.2 CC(C)SC(N)=N Amb22369433 [0,0,0,0,1,0|3,0,0]=4 2189 B6R0.2 CC(C)SC(N)=O Amb24461669 [0,0,0,0,1,0|2,0,0]=3 2190 B6R0.2 CC(CC(=C)C)O Amb17593083 [0,0,0,0,1,0|3,0,0]=4 2191 B6R0.2 CC(CC(=N)N)C Amb10066934 [0,0,0,0,1,0|2,0,0]=3 2192 B6R0.2 CC(CC(=O)C)Cl Amb17593234 [0,0,0,0,1,0|2,0,0]=3 2193 B6R0.2 CC(CC(=O)C)N Amb2583230 [0,0,0,0,1,0|2,0,0]=3 2194 B6R0.2 CC(CC(=O)C)O Amb17593091 [0,0,0,0,1,0|2,0,0]=3 2195 B6R0.2 CC(CC(Cl)C)O Amb17593253 [0,0,0,0,1,0|2,0,1]=4 2196 B6R0.2 CC(CC(N)C)C Amb1121431 [0,0,0,0,1,0|2,0,1]=4 2197 B6R0.2 CC(CC(O)C)O Amb10068523 [0,0,0,0,1,0|2,0,1]=4 2198 B6R0.2 CC(CN(C)C)C Amb17231805 [0,0,0,0,1,0|3,0,0]=4 2199 B6R0.2 CC(Cl)CC(C)=C Amb24558200 [0,0,0,0,1,0|3,0,0]=4 2200 B6R0.2 CC(Cl)CP(O)O Amb25061243 [0,0,0,0,1,0|2,0,1]=4 2201 B6R0.2 CC(Cl)NC(=O)Cl Amb24480662 [0,0,0,0,1,0|3,0,0]=4 2202 B6R0.2 CC(Cl)OC(C)=O Amb24058273 [0,0,0,0,1,0|3,0,0]=4 2203 B6R0.2 CC(Cl)OC(N)=O Amb24372683 [0,0,0,0,1,0|3,0,0]=4 2204 B6R0.2 CC(Cl)SC(C)=O Amb24625146 [0,0,0,0,1,0|3,0,0]=4 2205 B6R0.2 CC(F)=CC(O)=O Amb24676595 [0,0,0,0,1,0|1,0,2]=4 2206 B6R0.2 CC(F)CC(O)=O Amb24561809 [0,0,0,0,1,0|1,0,0]=2 2207 B6R0.2 CC(F)C[N+]([O-])=O Amb25024317 [0,0,0,0,1,0|2,0,1]=4 2208 B6R0.2 CC(I)=CC(O)=O Amb24668934 [0,0,0,0,1,0|1,0,2]=4 2209 B6R0.2 CC(I)CC(C)O Amb25743469 [0,0,0,0,1,0|2,0,1]=4 2210 B6R0.2 CC(I)CC(N)=O Amb25783800 [0,0,0,0,1,0|2,0,0]=3 2211 B6R0.2 CC(N)=CC(O)=O Amb25856437 [0,0,0,0,1,0|1,0,2]=4 2212 B6R0.2 CC(N)CC(=O)Cl Amb25830663 [0,0,0,0,1,0|2,0,0]=3 2213 B6R0.2 CC(N)CC(C)=C Amb25064223 [0,0,0,0,1,0|3,0,0]=4 2214 B6R0.2 CC(N)CC(C)=O Amb22587050 [0,0,0,0,1,0|2,0,0]=3 2215 B6R0.2 CC(N)CC(N)=N Amb25051498 [0,0,0,0,1,0|3,0,0]=4 2216 B6R0.2 CC(N)CC(N)=O Amb18281237 [0,0,0,0,1,0|2,0,0]=3 2217 B6R0.2 CC(N)CC(N)=S Amb25198821 [0,0,0,0,1,0|2,1,0]=4 2218 B6R0.2 CC(N)CC(O)=O Amb19888354 [0,0,0,0,1,0|1,0,0]=2 2219 B6R0.2 CC(NC(=O)N)C Amb1104587 [0,0,0,0,1,0|2,0,0]=3 2220 B6R0.2 CC(NC(=S)N)C Amb1152626 [0,0,0,0,1,0|2,1,0]=4 2221 B6R0.2 CC(O)CC(=C)Br Amb24618620 [0,0,0,0,1,0|3,0,0]=4 2222 B6R0.2 CC(O)CC(C)N Amb18640217 [0,0,0,0,1,0|2,0,1]=4 2223 B6R0.2 CC(O)CC(N)=S Amb24479794 [0,0,0,0,1,0|2,1,0]=4 2224 B6R0.2 CC(O)CC(O)=O Amb22348403 [0,0,0,0,1,0|1,0,0]=2 2225 B6R0.2 CC(O)CC(O)O Amb25716084 [0,0,0,0,1,0|1,0,2]=4 2226 B6R0.2 CC(O)CC(S)=S Amb25215114 [0,0,0,0,1,0|1,2,0]=4 2227 B6R0.2 CC(O)CP(O)=O Amb24406357 [0,0,0,0,1,0|2,0,0]=3 2228 B6R0.2 CC(O)NC(N)=O Amb25811550 [0,0,0,0,1,0|3,0,0]=4 2229 B6R0.2 CC(O)OC(N)=O Amb24669632 [0,0,0,0,1,0|3,0,0]=4 2230 B6R0.2 CC(O)SC(C)=O Amb24544015 [0,0,0,0,1,0|3,0,0]=4 2231 B6R0.2 CC(OC(=S)[S-])C Amb2371664 [0,0,0,0,1,0|1,2,0]=4 2232 B6R0.2 CC(O[N+](=O)[O-])C Amb2447326 [0,0,0,0,1,0|2,0,1]=4 2233 B6R0.2 CC(P)CC(C)O Amb25792365 [0,0,0,0,1,0|2,0,1]=4 2234 B6R0.2 CC(S)CC(C)=O Amb24600676 [0,0,0,0,1,0|2,0,0]=3 2235 B6R0.2 CC(S)CC(C)O Amb24122653 [0,0,0,0,1,0|2,0,1]=4 2236 B6R0.2 CC(S)CC(N)=O Amb24479823 [0,0,0,0,1,0|2,0,0]=3 2237 B6R0.2 CC(S)CC(O)=O Amb18281031 [0,0,0,0,1,0|1,0,0]=2 2238 B6R0.2 CC(SC(=N)N)C Amb1093763 [0,0,0,0,1,0|3,0,0]=4 2239 B6R0.2 CN(Br)CC(O)=O Amb25745878 [0,0,0,0,1,0|2,0,0]=3 2240 B6R0.2 CN(C)CB(O)O Amb25131560 [0,0,0,0,1,0|2,0,1]=4 2241 B6R0.2 CN(C)CC(=C)Br Amb24699168 [0,0,0,0,1,0|3,0,0]=4 2242 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [0,0,0,0,1,0|2,0,0]=3 2243 B6R0.2 CN(C)CC(N)=S Amb19373088 [0,0,0,0,1,0|2,1,0]=4 2244 B6R0.2 CN(C)CC(O)O Amb25226405 [0,0,0,0,1,0|1,0,2]=4 2245 B6R0.2 CN(C)CC(O)S Amb24610156 [0,0,0,0,1,0|1,1,1]=4 2246 B6R0.2 CN(C)CC([O-])=O Amb22002291 [0,0,0,0,1,0|1,0,1]=3 2247 B6R0.2 CN(C)CS(O)=O Amb25376029 [0,0,0,0,1,0|2,0,0]=3 2248 B6R0.2 CN(C)C[SiH](O)O Amb25811267 [0,0,0,0,1,0|1,1,1]=4 2249 B6R0.2 CN(C)NC(N)=O Amb24325231 [0,0,0,0,1,0|3,0,0]=4 2250 B6R0.2 CN(CC(=N)N)C Amb10610521 [0,0,0,0,1,0|3,0,0]=4 2251 B6R0.2 CN(CC(=N)N)C Amb10610536 [0,0,0,0,1,0|3,0,0]=4 2252 B6R0.2 CN(CC(=O)N)C Amb17231806 [0,0,0,0,1,0|2,0,0]=3 2253 B6R0.2 CN(CC(=S)N)C Amb16232219 [0,0,0,0,1,0|2,1,0]=4 2254 B6R0.2 CN(C[C@@H](O)C)C Amb10844893 [0,0,0,0,1,0|2,0,1]=4 2255 B6R0.2 CN(Cl)CC(O)=O Amb24455857 [0,0,0,0,1,0|2,0,0]=3 2256 B6R0.2 CN(N)CC(O)=O Amb23592296 [0,0,0,0,1,0|2,0,0]=3 2257 B6R0.2 CN(O)CC(O)=O Amb24732008 [0,0,0,0,1,0|2,0,0]=3 2258 B6R0.2 CS(=O)CC(N)=O Amb24394100 [0,0,0,0,1,0|3,0,0]=4 2259 B6R0.2 CS(=O)CC(O)=O Amb18957960 [0,0,0,0,1,0|2,0,0]=3 2260 B6R0.2 CS(C)=CC(O)=O Amb25717234 [0,0,0,0,1,0|1,0,1]=3 2261 B6R0.2 C[13CH](O)C[13C]([O-])=O Amb22338641 [0,0,0,0,1,0|1,0,1]=3 2262 B6R0.2 C[C@@H](CC(=O)O)N Amb16184012 [0,0,0,0,1,0|1,0,0]=2 2263 B6R0.2 C[C@@H](Cl)CC(=O)Cl Amb25321802 [0,0,0,0,1,0|2,0,0]=3 2264 B6R0.2 C[C@@H](N)CC(N)=O Amb25789836 [0,0,0,0,1,0|2,0,0]=3 2265 B6R0.2 C[C@@H](O)CC(=C)Br Amb25045702 [0,0,0,0,1,0|3,0,0]=4 2266 B6R0.2 C[C@@H](O)CC(C)O Amb25083401 [0,0,0,0,1,0|2,0,1]=4 2267 B6R0.2 C[C@@H](O)CC(N)=O Amb25746564 [0,0,0,0,1,0|2,0,0]=3 2268 B6R0.2 C[C@@H](O)CN(C)C Amb22746407 [0,0,0,0,1,0|2,0,1]=4 2269 B6R0.2 C[C@@H](O)C[C@@H](C)N Amb24568258 [0,0,0,0,1,0|2,0,1]=4 2270 B6R0.2 C[C@@H](O)C[C@H](C)N Amb24479559 [0,0,0,0,1,0|2,0,1]=4 2271 B6R0.2 C[C@@H](S)CC(O)=O Amb24480921 [0,0,0,0,1,0|1,0,0]=2 2272 B6R0.2 C[C@H](Br)CC(O)=O Amb24432019 [0,0,0,0,1,0|1,0,0]=2 2273 B6R0.2 C[C@H](CC(=O)O)N Amb16184009 [0,0,0,0,1,0|1,0,0]=2 2274 B6R0.2 C[C@H](Cl)CC(=O)Cl Amb25053837 [0,0,0,0,1,0|2,0,0]=3 2275 B6R0.2 C[C@H](Cl)CC(O)=O Amb25259323 [0,0,0,0,1,0|1,0,0]=2 2276 B6R0.2 C[C@H](F)CC(O)=O Amb24586490 [0,0,0,0,1,0|1,0,0]=2 2277 B6R0.2 C[C@H](O)CC(C)=O Amb24334071 [0,0,0,0,1,0|2,0,0]=3 2278 B6R0.2 C[C@H](O)CC(C)N Amb25835759 [0,0,0,0,1,0|2,0,1]=4 2279 B6R0.2 C[C@H](O)CC(C)O Amb25381310 [0,0,0,0,1,0|2,0,1]=4 2280 B6R0.2 C[C@H](O)CC(O)=O Amb22232025 [0,0,0,0,1,0|1,0,0]=2 2281 B6R0.2 C[C@H](O)C[C@@H](C)N Amb24351024 [0,0,0,0,1,0|2,0,1]=4 2282 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [0,0,0,0,1,0|2,0,1]=4 2283 B6R0.2 C[C@H](S)CC(O)=O Amb25190038 [0,0,0,0,1,0|1,0,0]=2 2284 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [0,0,0,0,1,0|2,0,0]=3 2285 B6R0.2 C[NH+](C)CC(O)=O Amb24113881 [0,0,0,0,1,0|1,0,0]=2 2286 B6R0.2 C\C(\Br)=C\C(O)=O Amb25662428 [0,0,0,0,1,0|1,0,2]=4 2287 B6R0.2 C\C(\Cl)=C/C(O)=O Amb18123483 [0,0,0,0,1,0|1,0,2]=4 2288 B6R0.2 C\C(\Cl)=C\C(O)=O Amb23556468 [0,0,0,0,1,0|1,0,2]=4 2289 B6R0.2 C\C(\I)=C\C(O)=O Amb24741877 [0,0,0,0,1,0|1,0,2]=4 2290 B6R0.2 N=C(Cl)CC(O)=O Amb25796071 [0,0,0,0,1,0|2,0,1]=4 2291 B6R0.2 NC(=O)CC(Cl)Cl Amb24479899 [0,0,0,0,1,0|3,0,0]=4 2292 B6R0.2 NC(=O)CC(O)O Amb25810087 [0,0,0,0,1,0|3,0,0]=4 2293 B6R0.2 NC(F)CC(O)=O Amb24479804 [0,0,0,0,1,0|2,0,0]=3 2294 B6R0.2 N[C@@H](CC(=O)O)O Amb16232006 [0,0,0,0,1,0|2,0,0]=3 2295 B6R0.2 N[C@@H](F)CC(O)=O Amb25854307 [0,0,0,0,1,0|2,0,0]=3 2296 B6R0.2 O=C(Cl)CC(Cl)Cl Amb24478549 [0,0,0,0,1,0|3,0,0]=4 2297 B6R0.2 OB(CC(C)C)O Amb2447316 [0,0,0,0,1,0|1,0,1]=3 2298 B6R0.2 OB(O)CC(O)=O Amb24053058 [0,0,0,0,1,0|3,0,0]=4 2299 B6R0.2 OC(=O)CC(=S)N Amb17465742 [0,0,0,0,1,0|2,0,1]=4 2300 B6R0.2 OC(=O)CC(F)Br Amb25336987 [0,0,0,0,1,0|2,0,0]=3 2301 B6R0.2 OC(=O)CC(F)F Amb22001551 [0,0,0,0,1,0|2,0,0]=3 2302 B6R0.2 OC(=O)CC(O)=O Amb21935659 [0,0,0,0,1,0|2,0,1]=4 2303 B6R0.2 OC(=O)CC(O)=O Amb22230690 [0,0,0,0,1,0|2,0,1]=4 2304 B6R0.2 OC(=O)CC(O)=O Amb22230927 [0,0,0,0,1,0|2,0,1]=4 2305 B6R0.2 OC(=O)CN(Cl)Cl Amb25133084 [0,0,0,0,1,0|3,0,0]=4 2306 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [0,0,0,0,1,0|2,0,1]=4 2307 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [0,0,0,0,1,0|2,0,1]=4 2308 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [0,0,0,0,1,0|2,0,1]=4 2309 B6R0.2 [13CH3]C(O)[13CH2]C([O-])=O Amb22351144 [0,0,0,0,1,0|1,0,1]=3 2310 B6R0.2 [BH3-][S+](C)CC(O)=O Amb24480870 [0,0,0,0,1,0|2,0,0]=3 2311 B6R0.2 [O-]C(=O)CC(F)F Amb24117960 [0,0,0,0,1,0|2,0,1]=4 2312 B6R0.2 [O-]C(=O)C[C@@H](O)C Amb10844672 [0,0,0,0,1,0|1,0,1]=3 2313 B8R0.28 C=C(Br)CNCC(O)=O Amb18303844 [0,0,0,0,0,1|1,0,2]=4 2314 B8R0.28 C=C(Br)CSCC(O)=O Amb25369923 [0,0,0,0,0,1|1,0,2]=4 2315 B8R0.28 C=C(F)CCCC(O)=O Amb22641515 [0,0,0,0,0,1|1,0,2]=4 2316 B8R0.28 CC(=C)CCCC(C)=O Amb17739959 [0,0,0,0,0,1|1,0,2]=4 2317 B8R0.28 CC(=C)CCOC(N)=O Amb24760559 [0,0,0,0,0,1|1,0,2]=4 2318 B8R0.28 CC(=C)OCCN(C)C Amb24101317 [0,0,0,0,0,1|3,0,0]=4 2319 B8R0.28 CC(=C)\C=C\CC(O)=O Amb18642409 [0,0,0,0,0,1|0,0,3]=4 2320 B8R0.28 CC(=N)NCCC(O)=O Amb25836109 [0,0,0,0,0,1|1,0,1]=3 2321 B8R0.28 CC(=N)NCCN(C)C Amb25123604 [0,0,0,0,0,1|3,0,0]=4 2322 B8R0.28 CC(=O)CC=C=C(C)C Amb17593280 [0,0,0,0,0,1|1,0,2]=4 2323 B8R0.28 CC(=O)CCCC(=C)O Amb24422924 [0,0,0,0,0,1|2,0,1]=4 2324 B8R0.28 CC(=O)CCCC(=O)Cl Amb24752758 [0,0,0,0,0,1|2,0,1]=4 2325 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,0,0,0,0,1|1,0,1]=3 2326 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [0,0,0,0,0,1|2,0,1]=4 2327 B8R0.28 CC(=O)CCCC(Cl)Cl Amb24480288 [0,0,0,0,0,1|3,0,0]=4 2328 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,0,0,0,0,1|2,0,1]=4 2329 B8R0.28 CC(=O)CCNC(=O)C Amb17102868 [0,0,0,0,0,1|2,0,1]=4 2330 B8R0.28 CC(=O)CCOC(F)F Amb25276866 [0,0,0,0,0,1|3,0,0]=4 2331 B8R0.28 CC(=O)CCO[SiH](C)C Amb25233637 [0,0,0,0,0,1|1,1,0]=3 2332 B8R0.28 CC(=O)CC\C=C(/Cl)\C Amb17593664 [0,0,0,0,0,1|2,0,1]=4 2333 B8R0.28 CC(=O)CNCC(C)=O Amb22168687 [0,0,0,0,0,1|2,0,1]=4 2334 B8R0.28 CC(=O)CNCC(O)=O Amb24375747 [0,0,0,0,0,1|1,0,1]=3 2335 B8R0.28 CC(=O)COCC(F)F Amb24396675 [0,0,0,0,0,1|3,0,0]=4 2336 B8R0.28 CC(=O)COCC(N)=O Amb24070191 [0,0,0,0,0,1|2,0,1]=4 2337 B8R0.28 CC(=O)CSCC(C)=O Amb25244895 [0,0,0,0,0,1|2,0,1]=4 2338 B8R0.28 CC(=O)CSCC([O-])=O Amb20622616 [0,0,0,0,0,1|1,0,2]=4 2339 B8R0.28 CC(=O)C\C=C/N(C)C Amb25335355 [0,0,0,0,0,1|2,0,1]=4 2340 B8R0.28 CC(=O)C\C=C\C(=O)O Amb16232091 [0,0,0,0,0,1|1,0,2]=4 2341 B8R0.28 CC(=O)NCCC(F)F Amb24534489 [0,0,0,0,0,1|3,0,0]=4 2342 B8R0.28 CC(=O)OCCC(O)=O Amb18642866 [0,0,0,0,0,1|1,0,1]=3 2343 B8R0.28 CC(=O)OCCS(C)=O Amb24481662 [0,0,0,0,0,1|3,0,0]=4 2344 B8R0.28 CC(=O)SCC=C(C)C Amb17617246 [0,0,0,0,0,1|1,0,2]=4 2345 B8R0.28 CC(=O)SCCC(N)=O Amb24552735 [0,0,0,0,0,1|2,0,1]=4 2346 B8R0.28 CC(=O)\C=C\CN(C)C Amb24557401 [0,0,0,0,0,1|2,0,1]=4 2347 B8R0.28 CC(=O)\C=N/CC(O)=O Amb25347610 [0,0,0,0,0,1|1,0,2]=4 2348 B8R0.28 CC(=S)NCCC(C)=O Amb24682550 [0,0,0,0,0,1|2,0,1]=4 2349 B8R0.28 CC(=S)SCCC(O)=O Amb24480281 [0,0,0,0,0,1|1,0,1]=3 2350 B8R0.28 CC(Br)=CCCC(O)=O Amb25200944 [0,0,0,0,0,1|1,0,1]=3 2351 B8R0.28 CC(Br)CCCC(=O)Cl Amb25364942 [0,0,0,0,0,1|2,0,0]=3 2352 B8R0.28 CC(Br)CCCC(C)=O Amb24340312 [0,0,0,0,0,1|2,0,0]=3 2353 B8R0.28 CC(Br)CCCC(O)=O Amb24480052 [0,0,0,0,0,1|1,0,0]=2 2354 B8R0.28 CC(Br)CCCS(C)=O Amb24549111 [0,0,0,0,0,1|3,0,0]=4 2355 B8R0.28 CC(Br)CCNC(C)=O Amb24618949 [0,0,0,0,0,1|2,0,0]=3 2356 B8R0.28 CC(Br)CCOC(C)=O Amb24626624 [0,0,0,0,0,1|2,0,0]=3 2357 B8R0.28 CC(C)/C=C/CC(O)=O Amb17844074 [0,0,0,0,0,1|0,0,1]=2 2358 B8R0.28 CC(C)=CC#CC(O)=O Amb24670652 [0,0,0,0,0,1|0,0,3]=4 2359 B8R0.28 CC(C)=CCCC(N)=O Amb24655596 [0,0,0,0,0,1|1,0,1]=3 2360 B8R0.28 CC(C)=CCCN(C)C Amb25208019 [0,0,0,0,0,1|3,0,0]=4 2361 B8R0.28 CC(C)=CCNC(N)=O Amb25858742 [0,0,0,0,0,1|1,0,2]=4 2362 B8R0.28 CC(C)=CCOC(=O)Cl Amb24455011 [0,0,0,0,0,1|1,0,2]=4 2363 B8R0.28 CC(C)=CCOC(C)=O Amb22002433 [0,0,0,0,0,1|1,0,2]=4 2364 B8R0.28 CC(C)=CCOC(N)=O Amb25378568 [0,0,0,0,0,1|1,0,2]=4 2365 B8R0.28 CC(C)=COCC(C)=O Amb24389019 [0,0,0,0,0,1|1,0,2]=4 2366 B8R0.28 CC(C)=C\C=C\C(O)=O Amb18642414 [0,0,0,0,0,1|0,0,3]=4 2367 B8R0.28 CC(C)C=C=CC(C)=O Amb25834315 [0,0,0,0,0,1|1,0,2]=4 2368 B8R0.28 CC(C)C=NNC(C)=O Amb24481921 [0,0,0,0,0,1|2,0,1]=4 2369 B8R0.28 CC(C)CCCB(O)O Amb24593360 [0,0,0,0,0,1|1,0,1]=3 2370 B8R0.28 CC(C)CCCC(=O)Cl Amb24477882 [0,0,0,0,0,1|1,0,0]=2 2371 B8R0.28 CC(C)CCCC(C)=C Amb22228386 [0,0,0,0,0,1|2,0,0]=3 2372 B8R0.28 CC(C)CCCC(C)Br Amb18330330 [0,0,0,0,0,1|2,0,1]=4 2373 B8R0.28 CC(C)CCCC(C)C Amb22228384 [0,0,0,0,0,1|2,0,1]=4 2374 B8R0.28 CC(C)CCCC(N)=N Amb23569433 [0,0,0,0,0,1|2,0,0]=3 2375 B8R0.28 CC(C)CCCC(N)=O Amb24579456 [0,0,0,0,0,1|1,0,0]=2 2376 B8R0.28 CC(C)CCCN(C)C Amb25046219 [0,0,0,0,0,1|3,0,0]=4 2377 B8R0.28 CC(C)CCCS(C)=O Amb24577266 [0,0,0,0,0,1|2,0,0]=3 2378 B8R0.28 CC(C)CCC[C@@H](C)N Amb22232273 [0,0,0,0,0,1|2,0,1]=4 2379 B8R0.28 CC(C)CCC[C@@H](C)O Amb22746847 [0,0,0,0,0,1|1,0,1]=3 2380 B8R0.28 CC(C)CCC[C@H](C)N Amb22225819 [0,0,0,0,0,1|2,0,1]=4 2381 B8R0.28 CC(C)CCNC(=O)Cl Amb25378849 [0,0,0,0,0,1|1,0,0]=2 2382 B8R0.28 CC(C)CCNC(C)=S Amb25298880 [0,0,0,0,0,1|1,1,0]=3 2383 B8R0.28 CC(C)CCNC(N)=N Amb20631267 [0,0,0,0,0,1|2,0,0]=3 2384 B8R0.28 CC(C)CCNC(N)=N Amb24524670 [0,0,0,0,0,1|2,0,0]=3 2385 B8R0.28 CC(C)CCNN(C)C Amb25227745 [0,0,0,0,0,1|3,0,0]=4 2386 B8R0.28 CC(C)CCOC(C)Cl Amb25724972 [0,0,0,0,0,1|2,0,1]=4 2387 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [0,0,0,0,0,1|1,0,0]=2 2388 B8R0.28 CC(C)CCOC(N)=S Amb25785397 [0,0,0,0,0,1|1,1,0]=3 2389 B8R0.28 CC(C)CCOC([S-])=S Amb19748289 [0,0,0,0,0,1|0,2,0]=3 2390 B8R0.28 CC(C)CCOS([O-])=O Amb24524507 [0,0,0,0,0,1|1,0,1]=3 2391 B8R0.28 CC(C)CCSC(N)=N Amb20676007 [0,0,0,0,0,1|2,0,0]=3 2392 B8R0.28 CC(C)CCSC(N)=O Amb24680835 [0,0,0,0,0,1|1,0,0]=2 2393 B8R0.28 CC(C)CNCC(=C)Br Amb19005215 [0,0,0,0,0,1|2,0,0]=3 2394 B8R0.28 CC(C)CNCC(=C)Cl Amb19004837 [0,0,0,0,0,1|2,0,0]=3 2395 B8R0.28 CC(C)CNCC(C)=O Amb25067661 [0,0,0,0,0,1|1,0,0]=2 2396 B8R0.28 CC(C)CNCC(C)Cl Amb25065676 [0,0,0,0,0,1|2,0,1]=4 2397 B8R0.28 CC(C)CNCC(C)N Amb19009717 [0,0,0,0,0,1|2,0,1]=4 2398 B8R0.28 CC(C)CNCC(Cl)Cl Amb25231350 [0,0,0,0,0,1|2,0,1]=4 2399 B8R0.28 CC(C)CNCC(O)=O Amb19373106 [0,0,0,0,0,1|0,0,0]=1 2400 B8R0.28 CC(C)CNCS(O)=O Amb24478690 [0,0,0,0,0,1|1,0,0]=2 2401 B8R0.28 CC(C)CNC[C@@H](C)O Amb25135487 [0,0,0,0,0,1|1,0,1]=3 2402 B8R0.28 CC(C)CNC[C@H](C)O Amb25079110 [0,0,0,0,0,1|1,0,1]=3 2403 B8R0.28 CC(C)CNN=C(C)C Amb24749343 [0,0,0,0,0,1|3,0,0]=4 2404 B8R0.28 CC(C)CNNC(N)=O Amb24359844 [0,0,0,0,0,1|2,0,0]=3 2405 B8R0.28 CC(C)COC[C@@H](C)O Amb24423772 [0,0,0,0,0,1|1,0,1]=3 2406 B8R0.28 CC(C)CONS(C)=O Amb24551950 [0,0,0,0,0,1|3,0,0]=4 2407 B8R0.28 CC(C)CPCC(C)C Amb22734785 [0,0,0,0,0,1|2,0,1]=4 2408 B8R0.28 CC(C)CSCC(C)=C Amb24371809 [0,0,0,0,0,1|2,0,0]=3 2409 B8R0.28 CC(C)CSCC(F)F Amb24481918 [0,0,0,0,0,1|2,0,1]=4 2410 B8R0.28 CC(C)CSCC(N)=O Amb25283648 [0,0,0,0,0,1|1,0,0]=2 2411 B8R0.28 CC(C)CSC[C@@H](C)N Amb24481868 [0,0,0,0,0,1|2,0,1]=4 2412 B8R0.28 CC(C)C[Al+]CC(C)C Amb20240962 [0,0,0,0,0,1|2,0,1]=4 2413 B8R0.28 CC(C)C[Al+]CC(C)C Amb22053726 [0,0,0,0,0,1|2,0,1]=4 2414 B8R0.28 CC(C)C\C=C\B(O)O Amb21856369 [0,0,0,0,0,1|1,0,2]=4 2415 B8R0.28 CC(C)C\C=C\C(N)=O Amb25731688 [0,0,0,0,0,1|1,0,1]=3 2416 B8R0.28 CC(C)C\C=C\[C@@H](C)O Amb25720117 [0,0,0,0,0,1|1,0,2]=4 2417 B8R0.28 CC(C)N=CCC(C)=O Amb25198123 [0,0,0,0,0,1|1,0,1]=3 2418 B8R0.28 CC(C)NCC=C(C)C Amb18642550 [0,0,0,0,0,1|2,0,1]=4 2419 B8R0.28 CC(C)NCCC(C)=C Amb19025196 [0,0,0,0,0,1|2,0,0]=3 2420 B8R0.28 CC(C)NCCC(C)N Amb19008024 [0,0,0,0,0,1|2,0,1]=4 2421 B8R0.28 CC(C)NCCC(C)O Amb24117028 [0,0,0,0,0,1|1,0,1]=3 2422 B8R0.28 CC(C)NCCC(F)F Amb25764203 [0,0,0,0,0,1|2,0,1]=4 2423 B8R0.28 CC(C)NCCC(N)=N Amb25162018 [0,0,0,0,0,1|2,0,0]=3 2424 B8R0.28 CC(C)NCCN(C)N Amb18642857 [0,0,0,0,0,1|3,0,0]=4 2425 B8R0.28 CC(C)NCC[C@@H](C)N Amb24561628 [0,0,0,0,0,1|2,0,1]=4 2426 B8R0.28 CC(C)NCC[C@@H](C)O Amb24351618 [0,0,0,0,0,1|1,0,1]=3 2427 B8R0.28 CC(C)NCSC(C)=O Amb25314413 [0,0,0,0,0,1|2,0,0]=3 2428 B8R0.28 CC(C)NOCC(C)=C Amb24539135 [0,0,0,0,0,1|3,0,0]=4 2429 B8R0.28 CC(C)N\C=C\C(O)=O Amb24623070 [0,0,0,0,0,1|0,0,2]=3 2430 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [0,0,0,0,0,1|1,0,0]=2 2431 B8R0.28 CC(C)OCCC(C)=O Amb22229804 [0,0,0,0,0,1|1,0,0]=2 2432 B8R0.28 CC(C)OCCC(C)N Amb19025758 [0,0,0,0,0,1|2,0,1]=4 2433 B8R0.28 CC(C)OCCC(N)=O Amb25783535 [0,0,0,0,0,1|1,0,0]=2 2434 B8R0.28 CC(C)OCCS(O)=O Amb24551322 [0,0,0,0,0,1|1,0,0]=2 2435 B8R0.28 CC(C)OCC[C@H](C)O Amb25090046 [0,0,0,0,0,1|1,0,1]=3 2436 B8R0.28 CC(C)OCSC(N)=N Amb25366389 [0,0,0,0,0,1|3,0,0]=4 2437 B8R0.28 CC(C)ONCC(=C)Br Amb24600754 [0,0,0,0,0,1|3,0,0]=4 2438 B8R0.28 CC(C)ONCC(=C)Cl Amb24432081 [0,0,0,0,0,1|3,0,0]=4 2439 B8R0.28 CC(C)ONCC(C)=C Amb25279062 [0,0,0,0,0,1|3,0,0]=4 2440 B8R0.28 CC(C)ONCC(C)O Amb25272674 [0,0,0,0,0,1|2,0,1]=4 2441 B8R0.28 CC(C)ONCC(O)=O Amb24690245 [0,0,0,0,0,1|1,0,0]=2 2442 B8R0.28 CC(C)O\C=C\C(O)=O Amb25731158 [0,0,0,0,0,1|0,0,2]=3 2443 B8R0.28 CC(C)SCCC(C)N Amb24716948 [0,0,0,0,0,1|2,0,1]=4 2444 B8R0.28 CC(C)SCCC(N)=O Amb25739954 [0,0,0,0,0,1|1,0,0]=2 2445 B8R0.28 CC(C)SCC[N+]([O-])=O Amb24407962 [0,0,0,0,0,1|1,0,1]=3 2446 B8R0.28 CC(C)SNCC(N)=O Amb25118863 [0,0,0,0,0,1|2,0,0]=3 2447 B8R0.28 CC(C)SSCC(O)=O Amb24425479 [0,0,0,0,0,1|1,0,0]=2 2448 B8R0.28 CC(C)\C=C\CC(C)O Amb25700152 [0,0,0,0,0,1|1,0,2]=4 2449 B8R0.28 CC(C)\C=C\NC(C)=O Amb24761262 [0,0,0,0,0,1|1,0,2]=4 2450 B8R0.28 CC(C)\C=C\NC(N)=O Amb24578881 [0,0,0,0,0,1|1,0,2]=4 2451 B8R0.28 CC(C)\N=C\CC(C)=O Amb25773461 [0,0,0,0,0,1|1,0,1]=3 2452 B8R0.28 CC(CCCC(=O)O)O Amb2371277 [0,0,0,0,0,1|1,0,0]=2 2453 B8R0.28 CC(CCCC(=O)[O-])O Amb17615415 [0,0,0,0,0,1|1,0,1]=3 2454 B8R0.28 CC(CCNC(=O)N)C Amb1104833 [0,0,0,0,0,1|1,0,0]=2 2455 B8R0.28 CC(CCOC(=S)[S-])C Amb13777309 [0,0,0,0,0,1|0,2,0]=3 2456 B8R0.28 CC(CNCC(=C)C)C Amb17308640 [0,0,0,0,0,1|2,0,0]=3 2457 B8R0.28 CC(CNCC(=C)C)O Amb17308667 [0,0,0,0,0,1|3,0,0]=4 2458 B8R0.28 CC(CNCC(=O)N)C Amb1118171 [0,0,0,0,0,1|1,0,0]=2 2459 B8R0.28 CC(CNSC(=S)N)C Amb10565824 [0,0,0,0,0,1|2,1,0]=4 2460 B8R0.28 CC(COCC(=O)N)C Amb2131093 [0,0,0,0,0,1|1,0,0]=2 2461 B8R0.28 CC(COCC(N)C)C Amb13952731 [0,0,0,0,0,1|2,0,1]=4 2462 B8R0.28 CC(CSCC(=O)O)C Amb1134811 [0,0,0,0,0,1|0,0,0]=1 2463 B8R0.28 CC(Cl)=CCCC(C)=O Amb25274421 [0,0,0,0,0,1|2,0,1]=4 2464 B8R0.28 CC(Cl)CCC=C(C)C Amb25032126 [0,0,0,0,0,1|3,0,0]=4 2465 B8R0.28 CC(Cl)CCCC(C)=O Amb25724389 [0,0,0,0,0,1|2,0,0]=3 2466 B8R0.28 CC(Cl)CCCC(O)=O Amb24740888 [0,0,0,0,0,1|1,0,0]=2 2467 B8R0.28 CC(Cl)CCSC(C)=O Amb25146226 [0,0,0,0,0,1|2,0,0]=3 2468 B8R0.28 CC(Cl)COCC(O)=O Amb24480258 [0,0,0,0,0,1|1,0,0]=2 2469 B8R0.28 CC(F)CCOC(C)=O Amb24481945 [0,0,0,0,0,1|2,0,0]=3 2470 B8R0.28 CC(F)COCC(C)=O Amb25178543 [0,0,0,0,0,1|2,0,0]=3 2471 B8R0.28 CC(I)CCSC(N)=N Amb22364948 [0,0,0,0,0,1|3,0,0]=4 2472 B8R0.28 CC(I)CCSC(N)=N Amb24542719 [0,0,0,0,0,1|3,0,0]=4 2473 B8R0.28 CC(N)CCCC(O)=O Amb22059416 [0,0,0,0,0,1|1,0,0]=2 2474 B8R0.28 CC(N)CCNC(C)=O Amb24384456 [0,0,0,0,0,1|2,0,0]=3 2475 B8R0.28 CC(N)COCC(O)=O Amb25368702 [0,0,0,0,0,1|1,0,0]=2 2476 B8R0.28 CC(N)CSCC(=C)Cl Amb24653169 [0,0,0,0,0,1|3,0,0]=4 2477 B8R0.28 CC(N)CSCC(C)=C Amb24478766 [0,0,0,0,0,1|3,0,0]=4 2478 B8R0.28 CC(NCCC(=O)O)C Amb1106349 [0,0,0,0,0,1|0,0,0]=1 2479 B8R0.28 CC(NCCC(=S)N)C Amb17232016 [0,0,0,0,0,1|1,1,0]=3 2480 B8R0.28 CC(O)CCCB(O)O Amb24389636 [0,0,0,0,0,1|2,0,1]=4 2481 B8R0.28 CC(O)CCCC(=C)Br Amb25058566 [0,0,0,0,0,1|3,0,0]=4 2482 B8R0.28 CC(O)CCCC(C)=C Amb24478673 [0,0,0,0,0,1|3,0,0]=4 2483 B8R0.28 CC(O)CCCC(C)=O Amb24340114 [0,0,0,0,0,1|2,0,0]=3 2484 B8R0.28 CC(O)CCCC(N)=O Amb24622764 [0,0,0,0,0,1|2,0,0]=3 2485 B8R0.28 CC(O)CCCN(C)C Amb24271102 [0,0,0,0,0,1|2,0,1]=4 2486 B8R0.28 CC(O)CCNC(N)=N Amb24726602 [0,0,0,0,0,1|3,0,0]=4 2487 B8R0.28 CC(O)CCNN(C)C Amb24614960 [0,0,0,0,0,1|2,0,1]=4 2488 B8R0.28 CC(O)CCNS(C)=O Amb25176978 [0,0,0,0,0,1|3,0,0]=4 2489 B8R0.28 CC(O)CCOC(N)=O Amb25293990 [0,0,0,0,0,1|2,0,0]=3 2490 B8R0.28 CC(O)CCSC(C)=O Amb25846896 [0,0,0,0,0,1|2,0,0]=3 2491 B8R0.28 CC(O)CC\C=C(\C)/Br Amb24430963 [0,0,0,0,0,1|3,0,0]=4 2492 B8R0.28 CC(O)CNCC(=C)Br Amb18303322 [0,0,0,0,0,1|3,0,0]=4 2493 B8R0.28 CC(O)CNCC(=C)Cl Amb19004839 [0,0,0,0,0,1|3,0,0]=4 2494 B8R0.28 CC(O)CNCC(C)=O Amb24589662 [0,0,0,0,0,1|2,0,0]=3 2495 B8R0.28 CC(O)CNCC(C)N Amb24117888 [0,0,0,0,0,1|2,0,1]=4 2496 B8R0.28 CC(O)CONC(N)=O Amb24604387 [0,0,0,0,0,1|3,0,0]=4 2497 B8R0.28 CC(O)CSCC(C)O Amb25144450 [0,0,0,0,0,1|2,0,1]=4 2498 B8R0.28 CC(O)CSCC(N)=O Amb25690591 [0,0,0,0,0,1|2,0,0]=3 2499 B8R0.28 CC(O)CSCC(O)=O Amb19005278 [0,0,0,0,0,1|1,0,0]=2 2500 B8R0.28 CC(O)C\C=C\C(O)=O Amb18642771 [0,0,0,0,0,1|1,0,1]=3 2501 B8R0.28 CC(O)NCCC(N)=O Amb24446895 [0,0,0,0,0,1|2,0,0]=3 2502 B8R0.28 CC(S)CCOC(C)=O Amb25077156 [0,0,0,0,0,1|2,0,0]=3 2503 B8R0.28 CC(S)\C=C/CC(O)=O Amb18644289 [0,0,0,0,0,1|1,0,1]=3 2504 B8R0.28 CC(S)\C=C\CC(O)=O Amb24514919 [0,0,0,0,0,1|1,0,1]=3 2505 B8R0.28 CC(SCCC(=S)N)C Amb17307561 [0,0,0,0,0,1|1,1,0]=3 2506 B8R0.28 CN(C)C=NCC(O)=O Amb24740176 [0,0,0,0,0,1|1,0,1]=3 2507 B8R0.28 CN(C)CC#CC(O)=O Amb24471923 [0,0,0,0,0,1|1,0,1]=3 2508 B8R0.28 CN(C)CCCB(O)O Amb24069054 [0,0,0,0,0,1|2,0,1]=4 2509 B8R0.28 CN(C)CCCC(O)O Amb24544945 [0,0,0,0,0,1|1,0,2]=4 2510 B8R0.28 CN(C)CCC[SiH](O)O Amb24739265 [0,0,0,0,0,1|1,1,1]=4 2511 B8R0.28 CN(C)CCNC(N)=N Amb19515467 [0,0,0,0,0,1|3,0,0]=4 2512 B8R0.28 CN(C)CCNC(N)=N Amb22058753 [0,0,0,0,0,1|3,0,0]=4 2513 B8R0.28 CN(C)CCNC(O)=S Amb25106929 [0,0,0,0,0,1|1,1,0]=3 2514 B8R0.28 CN(C)CCNC(S)=S Amb22264565 [0,0,0,0,0,1|1,2,0]=4 2515 B8R0.28 CN(C)CCOC([S-])=S Amb20671933 [0,0,0,0,0,1|1,2,0]=4 2516 B8R0.28 CN(C)CCSC(N)=N Amb22730143 [0,0,0,0,0,1|3,0,0]=4 2517 B8R0.28 CN(C)CCSC(N)=N Amb25314717 [0,0,0,0,0,1|3,0,0]=4 2518 B8R0.28 CN(C)CCSC([S-])=S Amb22264561 [0,0,0,0,0,1|1,2,0]=4 2519 B8R0.28 CN(C)C\C=C\C(=O)Cl Amb22274553 [0,0,0,0,0,1|2,0,1]=4 2520 B8R0.28 CN(C)C\C=C\C(N)=O Amb24476695 [0,0,0,0,0,1|2,0,1]=4 2521 B8R0.28 CN(C)NCCC(N)=S Amb24113763 [0,0,0,0,0,1|2,1,0]=4 2522 B8R0.28 CN(C)NCCC(O)=O Amb24113891 [0,0,0,0,0,1|1,0,0]=2 2523 B8R0.28 CN(C)N\C=C\C(O)=O Amb24383674 [0,0,0,0,0,1|1,0,2]=4 2524 B8R0.28 CN(CCNC(=O)N)C Amb1129425 [0,0,0,0,0,1|2,0,0]=3 2525 B8R0.28 CN(CCNC(=S)N)C Amb16205369 [0,0,0,0,0,1|2,1,0]=4 2526 B8R0.28 CN(CCNC(C)C)C Amb1111866 [0,0,0,0,0,1|3,0,0]=4 2527 B8R0.28 CN(C\C=C\C(=O)O)C Amb15695416 [0,0,0,0,0,1|1,0,1]=3 2528 B8R0.28 CS(=O)CCCC(O)=O Amb18306076 [0,0,0,0,0,1|2,0,0]=3 2529 B8R0.28 CS(=O)C\C=C\C(O)=O Amb24586059 [0,0,0,0,0,1|2,0,1]=4 2530 B8R0.28 CS(=O)NOCC(O)=O Amb24588744 [0,0,0,0,0,1|3,0,0]=4 2531 B8R0.28 C[C@@H](N)CCCC(O)=O Amb24435680 [0,0,0,0,0,1|1,0,0]=2 2532 B8R0.28 C[C@@H](N)COCC(O)=O Amb24641471 [0,0,0,0,0,1|1,0,0]=2 2533 B8R0.28 C[C@@H](O)CCC=C(C)C Amb22049561 [0,0,0,0,0,1|1,0,2]=4 2534 B8R0.28 C[C@@H](O)CCCC(C)O Amb24412846 [0,0,0,0,0,1|2,0,1]=4 2535 B8R0.28 C[C@@H](O)CCOC(C)=O Amb25357488 [0,0,0,0,0,1|2,0,0]=3 2536 B8R0.28 C[C@@H](O)CNCC(C)O Amb25032285 [0,0,0,0,0,1|2,0,1]=4 2537 B8R0.28 C[C@@H](O)CNCC(N)=O Amb25260382 [0,0,0,0,0,1|2,0,0]=3 2538 B8R0.28 C[C@@H](O)COCC(C)O Amb25796323 [0,0,0,0,0,1|2,0,1]=4 2539 B8R0.28 C[C@@H](O)CSCC(N)=O Amb25799456 [0,0,0,0,0,1|2,0,0]=3 2540 B8R0.28 C[C@@H](O)C\C=C\C(O)=O Amb25250610 [0,0,0,0,0,1|1,0,1]=3 2541 B8R0.28 C[C@H](Br)CCC=C(C)C Amb25374451 [0,0,0,0,0,1|3,0,0]=4 2542 B8R0.28 C[C@H](N)COCC(O)=O Amb25305053 [0,0,0,0,0,1|1,0,0]=2 2543 B8R0.28 C[C@H](N)CSCC(N)=O Amb25054209 [0,0,0,0,0,1|2,0,0]=3 2544 B8R0.28 C[C@H](O)CC#CC(O)=O Amb24627681 [0,0,0,0,0,1|1,0,1]=3 2545 B8R0.28 C[C@H](O)CCC=C(C)C Amb22049564 [0,0,0,0,0,1|1,0,2]=4 2546 B8R0.28 C[C@H](O)CCCC(O)=O Amb25842809 [0,0,0,0,0,1|1,0,0]=2 2547 B8R0.28 C[C@H](O)CCC[C@@H](C)O Amb25803331 [0,0,0,0,0,1|2,0,1]=4 2548 B8R0.28 C[C@H](O)CCC[C@H](C)O Amb25097837 [0,0,0,0,0,1|2,0,1]=4 2549 B8R0.28 C[C@H](O)CCNC(N)=O Amb25272281 [0,0,0,0,0,1|2,0,0]=3 2550 B8R0.28 C[C@H](O)COC[C@@H](C)O Amb25801708 [0,0,0,0,0,1|2,0,1]=4 2551 B8R0.28 C[C@H](O)CSCC(N)=O Amb25202527 [0,0,0,0,0,1|2,0,0]=3 2552 B8R0.28 NC(=N)CCCC(O)=O Amb25757878 [0,0,0,0,0,1|2,0,1]=4 2553 B8R0.28 NC(=N)CNCC(O)=O Amb25062019 [0,0,0,0,0,1|2,0,1]=4 2554 B8R0.28 NC(=O)CNCC(F)F Amb25325661 [0,0,0,0,0,1|3,0,0]=4 2555 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [0,0,0,0,0,1|2,0,1]=4 2556 B8R0.28 NC(=O)NCCC(F)F Amb25369231 [0,0,0,0,0,1|3,0,0]=4 2557 B8R0.28 O=C(Cl)CCCC(Cl)Cl Amb24602174 [0,0,0,0,0,1|3,0,0]=4 2558 B8R0.28 OC(=O)CCC=C(C)C Amb10601609 [0,0,0,0,0,1|0,0,1]=2 2559 B8R0.28 OC(=O)CCC=C(F)F Amb25224993 [0,0,0,0,0,1|2,0,1]=4 2560 B8R0.28 OC(=O)CCCC(=O)Br Amb24480005 [0,0,0,0,0,1|2,0,1]=4 2561 B8R0.28 OC(=O)CCCC(Cl)Cl Amb24479944 [0,0,0,0,0,1|2,0,0]=3 2562 B8R0.28 OC(=O)CCCC(F)F Amb24117996 [0,0,0,0,0,1|2,0,0]=3 2563 B8R0.28 OC(=O)CCCC(O)=O Amb22351480 [0,0,0,0,0,1|2,0,1]=4 2564 B8R0.28 OC(=O)CCCC(O)=O Amb22351829 [0,0,0,0,0,1|2,0,1]=4 2565 B8R0.28 OC(=O)CCCP(O)=O Amb24480161 [0,0,0,0,0,1|3,0,0]=4 2566 B8R0.28 OC(=O)CCNC(=O)C Amb1104704 [0,0,0,0,0,1|1,0,1]=3 2567 B8R0.28 OC(=O)CCNC(S)=S Amb25765722 [0,0,0,0,0,1|2,0,1]=4 2568 B8R0.28 OC(=O)CCOC(F)F Amb25342869 [0,0,0,0,0,1|2,0,0]=3 2569 B8R0.28 OC(=O)CCSC(=N)N Amb1043190 [0,0,0,0,0,1|2,0,1]=4 2570 B8R0.28 OC(=O)CCSC(=O)C Amb17607685 [0,0,0,0,0,1|1,0,1]=3 2571 B8R0.28 OC(=O)CNCC(F)F Amb24433048 [0,0,0,0,0,1|2,0,0]=3 2572 B8R0.28 OC(=O)CNCP(O)=O Amb24557425 [0,0,0,0,0,1|3,0,0]=4 2573 B8R0.28 OC(=O)COCC(=O)Cl Amb25372456 [0,0,0,0,0,1|2,0,1]=4 2574 B8R0.28 OC(=O)CSCC(F)F Amb18791606 [0,0,0,0,0,1|2,0,0]=3 2575 B8R0.28 OC(=O)CSSC(Cl)Cl Amb24390437 [0,0,0,0,0,1|3,0,0]=4 2576 B8R0.28 OC(=S)COCC(O)=O Amb22262972 [0,0,0,0,0,1|2,0,1]=4 2577 B8R0.28 OC(O)CCCC(O)=O Amb25205498 [0,0,0,0,0,1|2,0,0]=3 2578 B8R0.28 O[13C](=O)CCC[13C](=O)O Amb17614793 [0,0,0,0,0,1|2,0,1]=4 2579 B8R0.28 [O-][N+](=O)CCCC(O)=O Amb24711043 [0,0,0,0,0,1|3,0,0]=4 2580 B8R0.28 [O-][N+](=O)OCCC(O)=O Amb21953424 [0,0,0,0,0,1|3,0,0]=4 2581 B5R0.1 BC(=O)NCC Amb22343194 [2,0,0,0,0,0|2,0,0]=4 2582 B5R0.1 BrCCN(C)C Amb10603116 [2,0,0,0,0,0|2,0,0]=4 2583 B5R0.1 BrCCN(C)C Amb10608907 [2,0,0,0,0,0|2,0,0]=4 2584 B5R0.1 CC(=O)CC=O Amb17666764 [2,0,0,0,0,0|1,0,1]=4 2585 B5R0.1 CC(=O)CCBr Amb24078246 [2,0,0,0,0,0|2,0,0]=4 2586 B5R0.1 CC(=O)CCN Amb10067110 [2,0,0,0,0,0|2,0,0]=4 2587 B5R0.1 CC(=O)CCN Amb18632933 [2,0,0,0,0,0|2,0,0]=4 2588 B5R0.1 CC(Br)CC=O Amb25074611 [2,0,0,0,0,0|1,0,0]=3 2589 B5R0.1 CC(Br)CCN Amb24476717 [2,0,0,0,0,0|2,0,0]=4 2590 B5R0.1 CC(C)C#CO Amb22492599 [2,0,0,0,0,0|0,0,2]=4 2591 B5R0.1 CC(C)CCF Amb24117499 [2,0,0,0,0,0|1,0,0]=3 2592 B5R0.1 CC(C)CCN Amb22337707 [2,0,0,0,0,0|1,0,0]=3 2593 B5R0.1 CC(C)CNN Amb22886984 [2,0,0,0,0,0|2,0,0]=4 2594 B5R0.1 CC(C)CON Amb19889788 [2,0,0,0,0,0|2,0,0]=4 2595 B5R0.1 CC(C)C[13CH]=O Amb22353955 [2,0,0,0,0,0|0,0,0]=2 2596 B5R0.1 CC(C)C[Mg]Br Amb22336608 [2,0,0,0,0,0|2,0,0]=4 2597 B5R0.1 CC(C)C[Mg]Cl Amb22351464 [2,0,0,0,0,0|2,0,0]=4 2598 B5R0.1 CC(C)C[Zn]Br Amb22000395 [2,0,0,0,0,0|2,0,0]=4 2599 B5R0.1 CC(C)NCO Amb24384251 [2,0,0,0,0,0|1,0,0]=3 2600 B5R0.1 CC(C)OC=C Amb22230777 [2,0,0,0,0,0|1,0,1]=4 2601 B5R0.1 CC(C)OC=N Amb22337834 [2,0,0,0,0,0|2,0,0]=4 2602 B5R0.1 CC(C)OC=N Amb25248353 [2,0,0,0,0,0|2,0,0]=4 2603 B5R0.1 CC(C)OCCl Amb22168148 [2,0,0,0,0,0|2,0,0]=4 2604 B5R0.1 CC(C)ON=O Amb17938692 [2,0,0,0,0,0|2,0,0]=4 2605 B5R0.1 CC(C)O[PH2]=O Amb24599573 [2,0,0,0,0,0|2,0,0]=4 2606 B5R0.1 CC(C)SC=C Amb24599592 [2,0,0,0,0,0|1,0,1]=4 2607 B5R0.1 CC(C)SCCl Amb25807978 [2,0,0,0,0,0|2,0,0]=4 2608 B5R0.1 CC(C)\C=C/C Amb22731717 [2,0,0,0,0,0|1,0,1]=4 2609 B5R0.1 CC(C)\C=C\Br Amb25690202 [2,0,0,0,0,0|1,0,1]=4 2610 B5R0.1 CC(C)\C=C\Cl Amb25793515 [2,0,0,0,0,0|1,0,1]=4 2611 B5R0.1 CC(CC#N)C Amb1162737 [2,0,0,0,0,0|1,0,1]=4 2612 B5R0.1 CC(Cl)CC=O Amb18640602 [2,0,0,0,0,0|1,0,0]=3 2613 B5R0.1 CC(Cl)CCI Amb25091805 [2,0,0,0,0,0|2,0,0]=4 2614 B5R0.1 CC(Cl)OC=O Amb25811235 [2,0,0,0,0,0|2,0,0]=4 2615 B5R0.1 CC(Cl)\C=C\O Amb22734803 [2,0,0,0,0,0|1,0,1]=4 2616 B5R0.1 CC(F)CCF Amb25146337 [2,0,0,0,0,0|2,0,0]=4 2617 B5R0.1 CC(F)CCI Amb25146599 [2,0,0,0,0,0|2,0,0]=4 2618 B5R0.1 CC(F)CCO Amb21951900 [2,0,0,0,0,0|1,0,0]=3 2619 B5R0.1 CC(I)CCCl Amb25241583 [2,0,0,0,0,0|2,0,0]=4 2620 B5R0.1 CC(N)CC=C Amb17673480 [2,0,0,0,0,0|1,0,1]=4 2621 B5R0.1 CC(N)CC=C Amb19515336 [2,0,0,0,0,0|1,0,1]=4 2622 B5R0.1 CC(N)CC=O Amb25292247 [2,0,0,0,0,0|1,0,0]=3 2623 B5R0.1 CC(N)CCF Amb25811370 [2,0,0,0,0,0|2,0,0]=4 2624 B5R0.1 CC(N)CCN Amb18951361 [2,0,0,0,0,0|2,0,0]=4 2625 B5R0.1 CC(N)CCN Amb19338152 [2,0,0,0,0,0|2,0,0]=4 2626 B5R0.1 CC(O)CCCl Amb24551052 [2,0,0,0,0,0|2,0,0]=4 2627 B5R0.1 CC(O)CCO Amb22227721 [2,0,0,0,0,0|1,0,0]=3 2628 B5R0.1 CC(O)CCO Amb22232248 [2,0,0,0,0,0|1,0,0]=3 2629 B5R0.1 CC(O)CCS Amb22359316 [2,0,0,0,0,0|1,1,0]=4 2630 B5R0.1 CC(O)CN=O Amb25746175 [2,0,0,0,0,0|2,0,0]=4 2631 B5R0.1 CC(O)CNO Amb24333693 [2,0,0,0,0,0|2,0,0]=4 2632 B5R0.1 CC(S)CC=O Amb18122380 [2,0,0,0,0,0|1,0,0]=3 2633 B5R0.1 CC(S)CCN Amb18908261 [2,0,0,0,0,0|2,0,0]=4 2634 B5R0.1 CC(S)CCO Amb19148316 [2,0,0,0,0,0|1,0,0]=3 2635 B5R0.1 CC(S)CCS Amb22227722 [2,0,0,0,0,0|1,1,0]=4 2636 B5R0.1 CC(S)NC=O Amb25835741 [2,0,0,0,0,0|2,0,0]=4 2637 B5R0.1 CC(\C=N\O)C Amb2455920 [2,0,0,0,0,0|1,0,1]=4 2638 B5R0.1 CCCB(O)O Amb2447105 [2,0,0,0,0,0|1,0,1]=4 2639 B5R0.1 CCCC(=C)Br Amb22583743 [2,0,0,0,0,0|2,0,0]=4 2640 B5R0.1 CCCC(=N)N Amb10610381 [2,0,0,0,0,0|2,0,0]=4 2641 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,0]=3 2642 B5R0.1 CCCC(=S)Cl Amb24626931 [2,0,0,0,0,0|1,1,0]=4 2643 B5R0.1 CCCC(C)F Amb22008011 [2,0,0,0,0,0|1,0,1]=4 2644 B5R0.1 CCCC(C)I Amb17939400 [2,0,0,0,0,0|1,0,1]=4 2645 B5R0.1 CCCC(N)C Amb10609075 [2,0,0,0,0,0|1,0,1]=4 2646 B5R0.1 CCCC(N)O Amb25147414 [2,0,0,0,0,0|1,0,1]=4 2647 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|0,1,0]=3 2648 B5R0.1 CCCC(O)Br Amb25106743 [2,0,0,0,0,0|1,0,1]=4 2649 B5R0.1 CCCC(O)Cl Amb22552567 [2,0,0,0,0,0|1,0,1]=4 2650 B5R0.1 CCCC([O-])=O Amb17772223 [2,0,0,0,0,0|0,0,1]=3 2651 B5R0.1 CCCC([O-])=O Amb22732283 [2,0,0,0,0,0|0,0,1]=3 2652 B5R0.1 CCCC([O-])=O Amb22732651 [2,0,0,0,0,0|0,0,1]=3 2653 B5R0.1 CCCN(C)C Amb22336514 [2,0,0,0,0,0|1,0,1]=4 2654 B5R0.1 CCCN(C)C Amb22733186 [2,0,0,0,0,0|1,0,1]=4 2655 B5R0.1 CCCN(C)O Amb25024622 [2,0,0,0,0,0|2,0,0]=4 2656 B5R0.1 CCCS(=O)Cl Amb25025566 [2,0,0,0,0,0|2,0,0]=4 2657 B5R0.1 CCCS(N)=O Amb24733579 [2,0,0,0,0,0|2,0,0]=4 2658 B5R0.1 CCCS(O)=O Amb24615072 [2,0,0,0,0,0|1,0,0]=3 2659 B5R0.1 CCCS([O-])=O Amb19929119 [2,0,0,0,0,0|1,0,1]=4 2660 B5R0.1 CCC[13C](O)=O Amb22337992 [2,0,0,0,0,0|0,0,0]=2 2661 B5R0.1 CCC[13C](O)=O Amb22338339 [2,0,0,0,0,0|0,0,0]=2 2662 B5R0.1 CCC[C@@H](C)Br Amb24373894 [2,0,0,0,0,0|1,0,1]=4 2663 B5R0.1 CCC[C@@H](C)Cl Amb24711432 [2,0,0,0,0,0|1,0,1]=4 2664 B5R0.1 CCC[C@@H](C)I Amb24432363 [2,0,0,0,0,0|1,0,1]=4 2665 B5R0.1 CCC[C@@H](C)N Amb22898992 [2,0,0,0,0,0|1,0,1]=4 2666 B5R0.1 CCC[C@@H](C)N Amb23439500 [2,0,0,0,0,0|1,0,1]=4 2667 B5R0.1 CCC[C@H](C)I Amb25237438 [2,0,0,0,0,0|1,0,1]=4 2668 B5R0.1 CCC[C@H](C)N Amb21618754 [2,0,0,0,0,0|1,0,1]=4 2669 B5R0.1 CCNC(=O)Br Amb24563760 [2,0,0,0,0,0|2,0,0]=4 2670 B5R0.1 CCNC(=O)Cl Amb25791793 [2,0,0,0,0,0|2,0,0]=4 2671 B5R0.1 CCNC(O)=S Amb24612743 [2,0,0,0,0,0|1,1,0]=4 2672 B5R0.1 CCOC(C)C Amb22230687 [2,0,0,0,0,0|1,0,1]=4 2673 B5R0.1 CCOC([13CH3])=O Amb22363103 [2,0,0,0,0,0|2,0,0]=4 2674 B5R0.1 CCOP(O)=O Amb22360741 [2,0,0,0,0,0|2,0,0]=4 2675 B5R0.1 CCO[13C](C)=O Amb22363160 [2,0,0,0,0,0|2,0,0]=4 2676 B5R0.1 CCO[13C]([13CH3])=O Amb22351310 [2,0,0,0,0,0|2,0,0]=4 2677 B5R0.1 CCO[14C](N)=O Amb22732757 [2,0,0,0,0,0|2,0,0]=4 2678 B5R0.1 CCSC(C)C Amb22731934 [2,0,0,0,0,0|1,0,1]=4 2679 B5R0.1 CCSC(N)=O Amb24394612 [2,0,0,0,0,0|2,0,0]=4 2680 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [2,0,0,0,0,0|0,0,0]=2 2681 B5R0.1 CC[13CH2]C([O-])=O Amb22351787 [2,0,0,0,0,0|0,0,1]=3 2682 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [2,0,0,0,0,0|0,0,0]=2 2683 B5R0.1 CN(C)CC=O Amb22002191 [2,0,0,0,0,0|1,0,0]=3 2684 B5R0.1 CN(C)CC=O Amb22491245 [2,0,0,0,0,0|1,0,0]=3 2685 B5R0.1 CN(C)CC=O Amb22491584 [2,0,0,0,0,0|1,0,0]=3 2686 B5R0.1 CN(C)CC=O Amb22756473 [2,0,0,0,0,0|1,0,0]=3 2687 B5R0.1 CN(C)CC=O Amb23440511 [2,0,0,0,0,0|1,0,0]=3 2688 B5R0.1 CN(C)CCBr Amb22756040 [2,0,0,0,0,0|2,0,0]=4 2689 B5R0.1 CN(C)CCCl Amb22233801 [2,0,0,0,0,0|2,0,0]=4 2690 B5R0.1 CN(C)CC[O-] Amb22731918 [2,0,0,0,0,0|1,0,1]=4 2691 B5R0.1 CN(C)CC[O-] Amb22734831 [2,0,0,0,0,0|1,0,1]=4 2692 B5R0.1 CN(O)CCO Amb25234570 [2,0,0,0,0,0|2,0,0]=4 2693 B5R0.1 CNCC(=O)C Amb17621974 [2,0,0,0,0,0|2,0,0]=4 2694 B5R0.1 CNCC(=O)N Amb10610205 [2,0,0,0,0,0|2,0,0]=4 2695 B5R0.1 CNCC(C)=O Amb21959975 [2,0,0,0,0,0|2,0,0]=4 2696 B5R0.1 CNCC(C)C Amb1119103 [2,0,0,0,0,0|1,0,1]=4 2697 B5R0.1 CNCC(C)C Amb13951443 [2,0,0,0,0,0|1,0,1]=4 2698 B5R0.1 CNCC([O-])=O Amb20246714 [2,0,0,0,0,0|1,0,1]=4 2699 B5R0.1 CNCP(O)=O Amb24478116 [2,0,0,0,0,0|2,0,0]=4 2700 B5R0.1 COCC(=O)Br Amb25282928 [2,0,0,0,0,0|2,0,0]=4 2701 B5R0.1 COCC(=O)N Amb1153776 [2,0,0,0,0,0|2,0,0]=4 2702 B5R0.1 CS(=O)CC=O Amb25173706 [2,0,0,0,0,0|2,0,0]=4 2703 B5R0.1 CSCC(=O)Cl Amb24528357 [2,0,0,0,0,0|2,0,0]=4 2704 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|1,0,0]=3 2705 B5R0.1 CSCC(C)=O Amb20621731 [2,0,0,0,0,0|2,0,0]=4 2706 B5R0.1 CSCC(N)=O Amb19515874 [2,0,0,0,0,0|2,0,0]=4 2707 B5R0.1 C[13CH2]CC([O-])=O Amb22367521 [2,0,0,0,0,0|0,0,1]=3 2708 B5R0.1 C[C@@H](Cl)CC=C Amb25123337 [2,0,0,0,0,0|1,0,1]=4 2709 B5R0.1 C[C@@H](Cl)CCCl Amb25072661 [2,0,0,0,0,0|2,0,0]=4 2710 B5R0.1 C[C@@H](Cl)CCO Amb24478443 [2,0,0,0,0,0|1,0,0]=3 2711 B5R0.1 C[C@@H](F)CCBr Amb24552891 [2,0,0,0,0,0|2,0,0]=4 2712 B5R0.1 C[C@@H](N)CCBr Amb25690979 [2,0,0,0,0,0|2,0,0]=4 2713 B5R0.1 C[C@@H](N)CCCl Amb24550613 [2,0,0,0,0,0|2,0,0]=4 2714 B5R0.1 C[C@@H](N)CCO Amb19515999 [2,0,0,0,0,0|1,0,0]=3 2715 B5R0.1 C[C@@H](N)CCO Amb22746127 [2,0,0,0,0,0|1,0,0]=3 2716 B5R0.1 C[C@@H](O)CC=C Amb22225370 [2,0,0,0,0,0|1,0,1]=4 2717 B5R0.1 C[C@@H](O)CC=O Amb24356009 [2,0,0,0,0,0|1,0,0]=3 2718 B5R0.1 C[C@@H](O)CCCl Amb24565032 [2,0,0,0,0,0|2,0,0]=4 2719 B5R0.1 C[C@@H](O)CCN Amb22736702 [2,0,0,0,0,0|2,0,0]=4 2720 B5R0.1 C[C@H](Br)CCBr Amb24528250 [2,0,0,0,0,0|2,0,0]=4 2721 B5R0.1 C[C@H](Cl)CC=C Amb24626620 [2,0,0,0,0,0|1,0,1]=4 2722 B5R0.1 C[C@H](Cl)CCCl Amb25745563 [2,0,0,0,0,0|2,0,0]=4 2723 B5R0.1 C[C@H](N)CCBr Amb24634172 [2,0,0,0,0,0|2,0,0]=4 2724 B5R0.1 C[C@H](N)CCN Amb24393216 [2,0,0,0,0,0|2,0,0]=4 2725 B5R0.1 C[C@H](N)CCO Amb19515998 [2,0,0,0,0,0|1,0,0]=3 2726 B5R0.1 C[C@H](N)CCO Amb24055217 [2,0,0,0,0,0|1,0,0]=3 2727 B5R0.1 C[C@H](O)CC=C Amb22226758 [2,0,0,0,0,0|1,0,1]=4 2728 B5R0.1 C[C@H](O)CCI Amb24675161 [2,0,0,0,0,0|2,0,0]=4 2729 B5R0.1 C[C@H](O)CCN Amb22736705 [2,0,0,0,0,0|2,0,0]=4 2730 B5R0.1 C[NH+](C)CCO Amb22493791 [2,0,0,0,0,0|1,0,0]=3 2731 B5R0.1 C[S+](C)CCCl Amb22496543 [2,0,0,0,0,0|2,0,0]=4 2732 B5R0.1 C[S+](C)CCO Amb24420852 [2,0,0,0,0,0|1,0,0]=3 2733 B5R0.1 C[SiH](C)CC=C Amb19930034 [2,0,0,0,0,0|0,1,1]=4 2734 B5R0.1 C[SiH](C)CCO Amb25184701 [2,0,0,0,0,0|0,1,0]=3 2735 B5R0.1 C\C=C/C(C)C Amb20618870 [2,0,0,0,0,0|1,0,1]=4 2736 B5R0.1 ClCCN(C)C Amb1152528 [2,0,0,0,0,0|2,0,0]=4 2737 B5R0.1 ClCCN(C)C Amb2519363 [2,0,0,0,0,0|2,0,0]=4 2738 B5R0.1 N#CCC(O)=O Amb20247050 [2,0,0,0,0,0|1,0,1]=4 2739 B5R0.1 NC(=O)CCBr Amb21618712 [2,0,0,0,0,0|2,0,0]=4 2740 B5R0.1 NC(=O)CCCl Amb1127569 [2,0,0,0,0,0|2,0,0]=4 2741 B5R0.1 NCCC(=O)Cl Amb24117140 [2,0,0,0,0,0|2,0,0]=4 2742 B5R0.1 NCCC(=O)N Amb1137251 [2,0,0,0,0,0|2,0,0]=4 2743 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|1,0,0]=3 2744 B5R0.1 NCCP(O)=O Amb22168066 [2,0,0,0,0,0|2,0,0]=4 2745 B5R0.1 NNCC(C)C Amb1105732 [2,0,0,0,0,0|2,0,0]=4 2746 B5R0.1 NOCC(=O)O Amb1154237 [2,0,0,0,0,0|2,0,0]=4 2747 B5R0.1 N[C@H](O)CCO Amb24421109 [2,0,0,0,0,0|2,0,0]=4 2748 B5R0.1 O=C(Br)CCBr Amb24624022 [2,0,0,0,0,0|2,0,0]=4 2749 B5R0.1 O=C(Br)CCCl Amb24474527 [2,0,0,0,0,0|2,0,0]=4 2750 B5R0.1 O=C(I)CCCl Amb25146462 [2,0,0,0,0,0|2,0,0]=4 2751 B5R0.1 O=CCC(Br)Br Amb25026607 [2,0,0,0,0,0|2,0,0]=4 2752 B5R0.1 O=CNN(C)C Amb1930732 [2,0,0,0,0,0|2,0,0]=4 2753 B5R0.1 OC(=O)CC=O Amb22169407 [2,0,0,0,0,0|1,0,1]=4 2754 B5R0.1 OC(=O)CCF Amb10603694 [2,0,0,0,0,0|1,0,0]=3 2755 B5R0.1 OC(=O)CI=O Amb25146428 [2,0,0,0,0,0|2,0,0]=4 2756 B5R0.1 OC(=O)CNBr Amb25053433 [2,0,0,0,0,0|2,0,0]=4 2757 B5R0.1 OC(=O)CNCl Amb24653229 [2,0,0,0,0,0|2,0,0]=4 2758 B5R0.1 OC(=O)CNI Amb25216175 [2,0,0,0,0,0|2,0,0]=4 2759 B5R0.1 OC(=O)CSCl Amb24597301 [2,0,0,0,0,0|2,0,0]=4 2760 B5R0.1 OC(=O)C[Hg]Cl Amb22347659 [2,0,0,0,0,0|2,0,0]=4 2761 B5R0.1 OCCC(Cl)Cl Amb24563836 [2,0,0,0,0,0|2,0,0]=4 2762 B5R0.1 ONCC(O)=O Amb24120360 [2,0,0,0,0,0|2,0,0]=4 2763 B5R0.1 OP(=O)CCBr Amb24634095 [2,0,0,0,0,0|2,0,0]=4 2764 B5R0.1 OP(=O)CCCl Amb24465178 [2,0,0,0,0,0|2,0,0]=4 2765 B5R0.1 [13CH3]CCC([O-])=O Amb22351845 [2,0,0,0,0,0|0,0,1]=3 2766 B5R0.1 [13CH3]C[13CH2]C([O-])=O Amb22351704 [2,0,0,0,0,0|0,0,1]=3 2767 B5R0.1 [13CH3][13CH2][13CH2][13C]([O-])=O Amb22353296 [2,0,0,0,0,0|0,0,1]=3 2768 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [2,0,0,0,0,0|1,0,0]=3 2769 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [2,0,0,0,0,0|1,0,0]=3 2770 B5R0.1 [2H]C(=O)OCC Amb22336312 [2,0,0,0,0,0|2,0,0]=4 2771 B5R0.1 [C-]#[N+]CC(C)C Amb22900913 [2,0,0,0,0,0|1,0,1]=4 2772 B5R0.1 [O-]C(=O)CCBr Amb22229633 [2,0,0,0,0,0|1,0,1]=4 2773 B5R0.1 [O-]C(=O)CCCl Amb10604124 [2,0,0,0,0,0|1,0,1]=4 2774 B5R0.1 [O-]C(=O)CCCl Amb22051669 [2,0,0,0,0,0|1,0,1]=4 2775 B5R0.1 [O-]C(=O)CCO Amb22055495 [2,0,0,0,0,0|1,0,1]=4 2776 B5R0.2 BSCCCC Amb25339480 [2,0,0,0,0,0|2,0,0]=4 2777 B5R0.2 C=CCCCCl Amb22229585 [2,0,0,0,0,0|2,0,0]=4 2778 B5R0.2 C=CCCCF Amb25689705 [2,0,0,0,0,0|2,0,0]=4 2779 B5R0.2 C=CCCCI Amb25278794 [2,0,0,0,0,0|2,0,0]=4 2780 B5R0.2 C=CCCCN Amb18299670 [2,0,0,0,0,0|2,0,0]=4 2781 B5R0.2 C=CCCCN Amb22001451 [2,0,0,0,0,0|2,0,0]=4 2782 B5R0.2 CCC#CC=O Amb25663194 [2,0,0,0,0,0|0,0,2]=4 2783 B5R0.2 CCC/C=C/Br Amb17673688 [2,0,0,0,0,0|1,0,1]=4 2784 B5R0.2 CCCCC=C Amb22338530 [2,0,0,0,0,0|1,0,0]=3 2785 B5R0.2 CCCCCC Amb2447471 [2,0,0,0,0,0|1,0,1]=4 2786 B5R0.2 CCCCCF Amb10838686 [2,0,0,0,0,0|1,0,1]=4 2787 B5R0.2 CCCCC[13CH3] Amb22353529 [2,0,0,0,0,0|1,0,1]=4 2788 B5R0.2 CCCCC[Mg+] Amb22045757 [2,0,0,0,0,0|1,0,1]=4 2789 B5R0.2 CCCCC[SiH3] Amb19893989 [2,0,0,0,0,0|1,0,1]=4 2790 B5R0.2 CCCCNN Amb1105203 [2,0,0,0,0,0|2,0,0]=4 2791 B5R0.2 CCCCNN Amb22230363 [2,0,0,0,0,0|2,0,0]=4 2792 B5R0.2 CCCCNN Amb22732372 [2,0,0,0,0,0|2,0,0]=4 2793 B5R0.2 CCCCNO Amb24686451 [2,0,0,0,0,0|1,0,0]=3 2794 B5R0.2 CCCCON Amb17101066 [2,0,0,0,0,0|2,0,0]=4 2795 B5R0.2 CCCCO[2H] Amb16185547 [2,0,0,0,0,0|2,0,0]=4 2796 B5R0.2 CCCCS[Na] Amb22360783 [2,0,0,0,0,0|2,0,0]=4 2797 B5R0.2 CCCC[Hg]Cl Amb22366548 [2,0,0,0,0,0|2,0,0]=4 2798 B5R0.2 CCCC[Mg]Br Amb17666637 [2,0,0,0,0,0|2,0,0]=4 2799 B5R0.2 CCCC[Zn]Br Amb22000415 [2,0,0,0,0,0|2,0,0]=4 2800 B5R0.2 CCCN=C=O Amb22338287 [2,0,0,0,0,0|1,0,1]=4 2801 B5R0.2 CCCNCO Amb25746089 [2,0,0,0,0,0|1,0,1]=4 2802 B5R0.2 CCCOC=C Amb17940706 [2,0,0,0,0,0|2,0,0]=4 2803 B5R0.2 CCCON=O Amb22732190 [2,0,0,0,0,0|2,0,0]=4 2804 B5R0.2 CCCSCO Amb24466323 [2,0,0,0,0,0|1,0,1]=4 2805 B5R0.2 CCC\C=C\Cl Amb25026521 [2,0,0,0,0,0|1,0,1]=4 2806 B5R0.2 CCC\C=C\I Amb24333664 [2,0,0,0,0,0|1,0,1]=4 2807 B5R0.2 CCNCC=C Amb13951161 [2,0,0,0,0,0|2,0,0]=4 2808 B5R0.2 CCNCCO Amb19372818 [2,0,0,0,0,0|1,0,1]=4 2809 B5R0.2 CCNCCO Amb22284537 [2,0,0,0,0,0|1,0,1]=4 2810 B5R0.2 CCNCN=O Amb24382131 [2,0,0,0,0,0|2,0,0]=4 2811 B5R0.2 CCSCC=O Amb17940620 [2,0,0,0,0,0|1,0,0]=3 2812 B5R0.2 CNCCC=C Amb18993048 [2,0,0,0,0,0|2,0,0]=4 2813 B5R0.2 COCCC=O Amb10602324 [2,0,0,0,0,0|1,0,0]=3 2814 B5R0.2 COCCNO Amb25284480 [2,0,0,0,0,0|2,0,0]=4 2815 B5R0.2 CSCCC=C Amb24431590 [2,0,0,0,0,0|2,0,0]=4 2816 B5R0.2 CSCNC=O Amb24421815 [2,0,0,0,0,0|2,0,0]=4 2817 B5R0.2 C\C=C/CC=O Amb24728871 [2,0,0,0,0,0|0,0,2]=4 2818 B5R0.2 NCCNC=O Amb25213948 [2,0,0,0,0,0|2,0,0]=4 2819 B5R0.2 NCCOC=O Amb24612320 [2,0,0,0,0,0|2,0,0]=4 2820 B5R0.2 O=CCCC=O Amb22231966 [2,0,0,0,0,0|1,0,1]=4 2821 B5R0.2 O=CCCCBr Amb18644189 [2,0,0,0,0,0|1,0,0]=3 2822 B5R0.2 O=CCCCF Amb24056028 [2,0,0,0,0,0|1,0,0]=3 2823 B5R0.2 O=CCCSCl Amb25146622 [2,0,0,0,0,0|2,0,0]=4 2824 B5R0.2 O=CCCSS Amb22524519 [2,0,0,0,0,0|2,0,0]=4 2825 B5R0.2 O=CCOCBr Amb25765436 [2,0,0,0,0,0|2,0,0]=4 2826 B5R0.2 O=CCOCC Amb24052108 [2,0,0,0,0,0|1,0,0]=3 2827 B5R0.2 O=CCOCCl Amb24671305 [2,0,0,0,0,0|2,0,0]=4 2828 B5R0.2 O=COCCCl Amb22345927 [2,0,0,0,0,0|2,0,0]=4 2829 B5R0.2 O=CSCCCl Amb25808568 [2,0,0,0,0,0|2,0,0]=4 2830 B5R0.2 OC=NCCCl Amb24684796 [2,0,0,0,0,0|2,0,0]=4 2831 B5R0.2 OCCCC=O Amb24589235 [2,0,0,0,0,0|1,0,0]=3 2832 B5R0.2 OCCCCCl Amb1101976 [2,0,0,0,0,0|1,0,1]=4 2833 B5R0.2 OCCCCF Amb17593046 [2,0,0,0,0,0|1,0,1]=4 2834 B5R0.2 OCCCCI Amb25689806 [2,0,0,0,0,0|1,0,1]=4 2835 B5R0.2 OCCCCS Amb22229807 [2,0,0,0,0,0|1,0,1]=4 2836 B5R0.2 OCCCNO Amb24719785 [2,0,0,0,0,0|2,0,0]=4 2837 B5R0.2 OCCSCC Amb1085958 [2,0,0,0,0,0|1,0,1]=4 2838 B5R0.2 O\C=C\CCO Amb24333503 [2,0,0,0,0,0|1,0,1]=4 2839 B5R0.2 SCCCC=C Amb17939241 [2,0,0,0,0,0|2,0,0]=4 2840 B5R0.2 [C-]#[N+]CCC=O Amb24706723 [2,0,0,0,0,0|1,0,1]=4 2841 B5R0.2 [C-]#[N+]CCCC Amb2235001 [2,0,0,0,0,0|2,0,0]=4 2842 B7R0.2 C#CC(N)CC(O)=O Amb24529562 [1,1,0,0,0,0|0,0,2]=4 2843 B7R0.2 C#CC(O)CC(O)=O Amb25737576 [1,1,0,0,0,0|0,0,2]=4 2844 B7R0.2 C=CC(Br)CC(O)=O Amb18125534 [1,1,0,0,0,0|0,0,2]=4 2845 B7R0.2 C=CC(Cl)CC(O)=O Amb18124408 [1,1,0,0,0,0|0,0,2]=4 2846 B7R0.2 C=CC(F)CC(O)=O Amb25359137 [1,1,0,0,0,0|0,0,2]=4 2847 B7R0.2 C=CC(N)CC(O)=O Amb22641963 [1,1,0,0,0,0|0,0,2]=4 2848 B7R0.2 C=CC(O)CC(O)=O Amb18641866 [1,1,0,0,0,0|0,0,2]=4 2849 B7R0.2 C=C[C@@H](O)CC(O)=O Amb25314661 [1,1,0,0,0,0|0,0,2]=4 2850 B7R0.2 C=C[C@H](O)CC(O)=O Amb25844309 [1,1,0,0,0,0|0,0,2]=4 2851 B7R0.2 CC(=O)CC(=S)CC Amb24378474 [1,1,0,0,0,0|1,0,1]=4 2852 B7R0.2 CC(=O)CC(Cl)CCl Amb25335495 [1,1,0,0,0,0|2,0,0]=4 2853 B7R0.2 CC(=O)CC(O)C=O Amb24481554 [1,1,0,0,0,0|1,0,1]=4 2854 B7R0.2 CC(=O)CC(O)CO Amb25304727 [1,1,0,0,0,0|2,0,0]=4 2855 B7R0.2 CC(=O)CC(S)C=O Amb25838806 [1,1,0,0,0,0|1,0,1]=4 2856 B7R0.2 CC(=O)C[C@@H](O)CO Amb24640954 [1,1,0,0,0,0|2,0,0]=4 2857 B7R0.2 CC(=O)C[C@H](O)CCl Amb25810138 [1,1,0,0,0,0|2,0,0]=4 2858 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [1,1,0,0,0,0|1,0,1]=4 2859 B7R0.2 CC(C)CC(=C)C=O Amb24481535 [1,1,0,0,0,0|0,0,1]=3 2860 B7R0.2 CC(C)CC(=O)C=O Amb25189904 [1,1,0,0,0,0|0,0,1]=3 2861 B7R0.2 CC(C)CC(=O)CO Amb18559774 [1,1,0,0,0,0|0,0,2]=4 2862 B7R0.2 CC(C)CC(Br)CC Amb24346666 [1,1,0,0,0,0|1,0,1]=4 2863 B7R0.2 CC(C)CC(C)=CBr Amb24692942 [1,1,0,0,0,0|1,0,1]=4 2864 B7R0.2 CC(C)CC(C)=CCl Amb24692762 [1,1,0,0,0,0|1,0,1]=4 2865 B7R0.2 CC(C)CC(C)C#C Amb24334125 [1,1,0,0,0,0|1,0,1]=4 2866 B7R0.2 CC(C)CC(C)C=C Amb22229087 [1,1,0,0,0,0|1,0,0]=3 2867 B7R0.2 CC(C)CC(C)C=O Amb18641813 [1,1,0,0,0,0|0,0,0]=2 2868 B7R0.2 CC(C)CC(C)CBr Amb22641845 [1,1,0,0,0,0|1,0,1]=4 2869 B7R0.2 CC(C)CC(C)CC Amb22228298 [1,1,0,0,0,0|1,0,1]=4 2870 B7R0.2 CC(C)CC(C)CCl Amb25741744 [1,1,0,0,0,0|1,0,1]=4 2871 B7R0.2 CC(C)CC(C)CO Amb22228341 [1,1,0,0,0,0|0,0,1]=3 2872 B7R0.2 CC(C)CC(C)ON Amb24412592 [1,1,0,0,0,0|2,0,0]=4 2873 B7R0.2 CC(C)CC(C)[Mg]Br Amb22897340 [1,1,0,0,0,0|2,0,0]=4 2874 B7R0.2 CC(C)CC(C)[Zn]Br Amb22897526 [1,1,0,0,0,0|2,0,0]=4 2875 B7R0.2 CC(C)CC(Cl)C=C Amb25295466 [1,1,0,0,0,0|1,0,0]=3 2876 B7R0.2 CC(C)CC(Cl)C=O Amb24482192 [1,1,0,0,0,0|0,0,0]=2 2877 B7R0.2 CC(C)CC(Cl)CCl Amb25840482 [1,1,0,0,0,0|1,0,1]=4 2878 B7R0.2 CC(C)CC(Cl)CN Amb25794707 [1,1,0,0,0,0|1,0,1]=4 2879 B7R0.2 CC(C)CC(Cl)CO Amb25783978 [1,1,0,0,0,0|0,0,1]=3 2880 B7R0.2 CC(C)CC(F)CN Amb24387968 [1,1,0,0,0,0|1,0,1]=4 2881 B7R0.2 CC(C)CC(F)CO Amb25189048 [1,1,0,0,0,0|0,0,1]=3 2882 B7R0.2 CC(C)CC(N)C=C Amb25743094 [1,1,0,0,0,0|1,0,0]=3 2883 B7R0.2 CC(C)CC(N)CBr Amb22493735 [1,1,0,0,0,0|1,0,1]=4 2884 B7R0.2 CC(C)CC(N)CC Amb18523780 [1,1,0,0,0,0|1,0,1]=4 2885 B7R0.2 CC(C)CC(N)CO Amb18015118 [1,1,0,0,0,0|0,0,1]=3 2886 B7R0.2 CC(C)CC(O)C=C Amb24532138 [1,1,0,0,0,0|1,0,0]=3 2887 B7R0.2 CC(C)CC(O)CBr Amb24483137 [1,1,0,0,0,0|1,0,1]=4 2888 B7R0.2 CC(C)CC(O)CN Amb19515652 [1,1,0,0,0,0|1,0,1]=4 2889 B7R0.2 CC(C)CC(O)CO Amb24731733 [1,1,0,0,0,0|0,0,1]=3 2890 B7R0.2 CC(C)CC(O)CS Amb24718446 [1,1,0,0,0,0|0,1,1]=4 2891 B7R0.2 CC(C)CC(S)CN Amb18251146 [1,1,0,0,0,0|1,0,1]=4 2892 B7R0.2 CC(C)CN(C)C=O Amb25707804 [1,1,0,0,0,0|1,0,0]=3 2893 B7R0.2 CC(C)C[C@@H](N)C#N Amb18542350 [1,1,0,0,0,0|1,0,1]=4 2894 B7R0.2 CC(C)C[C@@H](N)C=O Amb25698367 [1,1,0,0,0,0|0,0,0]=2 2895 B7R0.2 CC(C)C[C@@H](N)CBr Amb25189716 [1,1,0,0,0,0|1,0,1]=4 2896 B7R0.2 CC(C)C[C@@H](N)CC Amb24675860 [1,1,0,0,0,0|1,0,1]=4 2897 B7R0.2 CC(C)C[C@@H](N)CN Amb25345853 [1,1,0,0,0,0|1,0,1]=4 2898 B7R0.2 CC(C)C[C@@H](N)CO Amb22746869 [1,1,0,0,0,0|0,0,1]=3 2899 B7R0.2 CC(C)C[C@@H](O)C=O Amb25104909 [1,1,0,0,0,0|0,0,0]=2 2900 B7R0.2 CC(C)C[C@@H](O)CC Amb25795362 [1,1,0,0,0,0|1,0,1]=4 2901 B7R0.2 CC(C)C[C@H](Cl)C=O Amb24661911 [1,1,0,0,0,0|0,0,0]=2 2902 B7R0.2 CC(C)C[C@H](Cl)CO Amb25334028 [1,1,0,0,0,0|0,0,1]=3 2903 B7R0.2 CC(C)C[C@H](N)C#C Amb25378790 [1,1,0,0,0,0|1,0,1]=4 2904 B7R0.2 CC(C)C[C@H](N)C=C Amb25745886 [1,1,0,0,0,0|1,0,0]=3 2905 B7R0.2 CC(C)C[C@H](N)CBr Amb24462739 [1,1,0,0,0,0|1,0,1]=4 2906 B7R0.2 CC(C)C[C@H](N)CO Amb22504556 [1,1,0,0,0,0|0,0,1]=3 2907 B7R0.2 CC(C)C[C@H](N)CS Amb24392884 [1,1,0,0,0,0|0,1,1]=4 2908 B7R0.2 CC(C)C[C@H](O)C#C Amb24363712 [1,1,0,0,0,0|1,0,1]=4 2909 B7R0.2 CC(C)C[C@H](O)C#N Amb25855769 [1,1,0,0,0,0|1,0,1]=4 2910 B7R0.2 CC(C)C\C(\C)=N\O Amb22729223 [1,1,0,0,0,0|1,0,1]=4 2911 B7R0.2 CC(C)NC(C)C=C Amb24653707 [1,1,0,0,0,0|2,0,0]=4 2912 B7R0.2 CC(C)N[C@@H](C)C=C Amb25141485 [1,1,0,0,0,0|2,0,0]=4 2913 B7R0.2 CC(C)N[C@H](C)CO Amb25041061 [1,1,0,0,0,0|1,0,1]=4 2914 B7R0.2 CC(C)OC(=O)C=O Amb18641865 [1,1,0,0,0,0|1,0,1]=4 2915 B7R0.2 CC(C)OC(C)C=O Amb25243083 [1,1,0,0,0,0|1,0,0]=3 2916 B7R0.2 CC(C)OC(C)CO Amb22733844 [1,1,0,0,0,0|1,0,1]=4 2917 B7R0.2 CC(C)SC(C)C=O Amb18642905 [1,1,0,0,0,0|1,0,0]=3 2918 B7R0.2 CC(C)\C=C(/C)\C=O Amb24678645 [1,1,0,0,0,0|0,0,2]=4 2919 B7R0.2 CC(C)\C=C(/F)\C=O Amb25376490 [1,1,0,0,0,0|0,0,2]=4 2920 B7R0.2 CC(C)\C=C(\C)/C=O Amb18641702 [1,1,0,0,0,0|0,0,2]=4 2921 B7R0.2 CC(C=O)C=C(C)C Amb18641696 [1,1,0,0,0,0|0,0,2]=4 2922 B7R0.2 CC(CBr)CC(C)=O Amb24365894 [1,1,0,0,0,0|2,0,0]=4 2923 B7R0.2 CC(CC(C)=C)C=O Amb18641711 [1,1,0,0,0,0|0,0,2]=4 2924 B7R0.2 CC(CC(C)=O)C=O Amb18641789 [1,1,0,0,0,0|1,0,1]=4 2925 B7R0.2 CC(CC(C)Cl)C=C Amb24483206 [1,1,0,0,0,0|2,0,0]=4 2926 B7R0.2 CC(CC(N)=O)CN Amb18641899 [1,1,0,0,0,0|2,0,0]=4 2927 B7R0.2 CC(CC(O)=O)C=C Amb18641774 [1,1,0,0,0,0|0,0,2]=4 2928 B7R0.2 CC(CC(O)=O)C=O Amb25836603 [1,1,0,0,0,0|1,0,1]=4 2929 B7R0.2 CC(CC(O)=O)CO Amb18198168 [1,1,0,0,0,0|1,0,0]=3 2930 B7R0.2 CC(CC(O)=O)SCl Amb24483173 [1,1,0,0,0,0|2,0,0]=4 2931 B7R0.2 CC(CC)CC(=N)N Amb10607625 [1,1,0,0,0,0|2,0,0]=4 2932 B7R0.2 CC(CC)CC(=O)Cl Amb10844649 [1,1,0,0,0,0|1,0,0]=3 2933 B7R0.2 CC(CN)CC(C)=O Amb18251072 [1,1,0,0,0,0|2,0,0]=4 2934 B7R0.2 CC(CN)CC(O)=O Amb18124263 [1,1,0,0,0,0|1,0,0]=3 2935 B7R0.2 CC(CN)CC(O)=O Amb20669501 [1,1,0,0,0,0|1,0,0]=3 2936 B7R0.2 CC(CN)CP(O)=O Amb25757942 [1,1,0,0,0,0|2,0,0]=4 2937 B7R0.2 CC(CO)CC(C)=O Amb24606485 [1,1,0,0,0,0|2,0,0]=4 2938 B7R0.2 CC(CO)CC(N)=O Amb24452895 [1,1,0,0,0,0|2,0,0]=4 2939 B7R0.2 CC(N)CC(O)CO Amb18124268 [1,1,0,0,0,0|1,0,1]=4 2940 B7R0.2 CC(NC(=O)N)CC Amb1105272 [1,1,0,0,0,0|2,0,0]=4 2941 B7R0.2 CC(NC)CC(=O)N Amb17231826 [1,1,0,0,0,0|2,0,0]=4 2942 B7R0.2 CC(O)CC(=O)C=O Amb24666713 [1,1,0,0,0,0|1,0,1]=4 2943 B7R0.2 CC(O)CC(C)CO Amb25262806 [1,1,0,0,0,0|1,0,1]=4 2944 B7R0.2 CC(O)CC(Cl)C=C Amb25731114 [1,1,0,0,0,0|2,0,0]=4 2945 B7R0.2 CC(O)CC(N)CO Amb25828018 [1,1,0,0,0,0|1,0,1]=4 2946 B7R0.2 CC(O)CC(O)C=C Amb24397089 [1,1,0,0,0,0|2,0,0]=4 2947 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [1,1,0,0,0,0|0,0,1]=3 2948 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [1,1,0,0,0,0|0,0,1]=3 2949 B7R0.2 CCC(Br)CC(C)=C Amb24355903 [1,1,0,0,0,0|2,0,0]=4 2950 B7R0.2 CCC(Br)CC(O)=O Amb24370499 [1,1,0,0,0,0|0,0,0]=2 2951 B7R0.2 CCC(C)CC(C)=C Amb22228340 [1,1,0,0,0,0|2,0,0]=4 2952 B7R0.2 CCC(C)CC(N)=N Amb19890168 [1,1,0,0,0,0|2,0,0]=4 2953 B7R0.2 CCC(C)CC(N)=O Amb25230669 [1,1,0,0,0,0|1,0,0]=3 2954 B7R0.2 CCC(C)C[N+]([O-])=O Amb25075983 [1,1,0,0,0,0|1,0,1]=4 2955 B7R0.2 CCC(C)NC(O)=S Amb25368326 [1,1,0,0,0,0|1,1,0]=4 2956 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [1,1,0,0,0,0|2,0,0]=4 2957 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [1,1,0,0,0,0|2,0,0]=4 2958 B7R0.2 CCC(CC(=O)C)C Amb10608208 [1,1,0,0,0,0|1,0,0]=3 2959 B7R0.2 CCC(CC(=O)O)N Amb1993862 [1,1,0,0,0,0|0,0,0]=2 2960 B7R0.2 CCC(CC(=O)O)O Amb10844270 [1,1,0,0,0,0|0,0,0]=2 2961 B7R0.2 CCC(Cl)CC(=O)Cl Amb24390220 [1,1,0,0,0,0|1,0,0]=3 2962 B7R0.2 CCC(Cl)CC(C)=C Amb24735482 [1,1,0,0,0,0|2,0,0]=4 2963 B7R0.2 CCC(Cl)OC(=O)Cl Amb25853933 [1,1,0,0,0,0|2,0,0]=4 2964 B7R0.2 CCC(F)=CC(O)=O Amb24674138 [1,1,0,0,0,0|0,0,2]=4 2965 B7R0.2 CCC(N)CC(C)=C Amb24367516 [1,1,0,0,0,0|2,0,0]=4 2966 B7R0.2 CCC(N)CC(C)=O Amb18631696 [1,1,0,0,0,0|1,0,0]=3 2967 B7R0.2 CCC(N)CC(N)=O Amb25727686 [1,1,0,0,0,0|1,0,0]=3 2968 B7R0.2 CCC(N)CS(C)=O Amb24481377 [1,1,0,0,0,0|2,0,0]=4 2969 B7R0.2 CCC(N)NC(C)=O Amb25062531 [1,1,0,0,0,0|2,0,0]=4 2970 B7R0.2 CCC(O)CC(C)=C Amb24062975 [1,1,0,0,0,0|2,0,0]=4 2971 B7R0.2 CCC(O)CC(C)=O Amb25065181 [1,1,0,0,0,0|1,0,0]=3 2972 B7R0.2 CCC(O)CC(N)=O Amb24616660 [1,1,0,0,0,0|1,0,0]=3 2973 B7R0.2 CCC(O)CC(O)=O Amb22363067 [1,1,0,0,0,0|0,0,0]=2 2974 B7R0.2 CCC(O)C[N+]([O-])=O Amb25136685 [1,1,0,0,0,0|1,0,1]=4 2975 B7R0.2 CCC(S)CC(O)=O Amb18303084 [1,1,0,0,0,0|0,0,0]=2 2976 B7R0.2 CCN(N)CC(O)=O Amb25738005 [1,1,0,0,0,0|1,0,0]=3 2977 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [1,1,0,0,0,0|1,0,0]=3 2978 B7R0.2 CC[C@@H](Br)CC(O)=O Amb24467852 [1,1,0,0,0,0|0,0,0]=2 2979 B7R0.2 CC[C@@H](C)CC(=O)Cl Amb23425123 [1,1,0,0,0,0|1,0,0]=3 2980 B7R0.2 CC[C@@H](C)CC(N)=O Amb25310922 [1,1,0,0,0,0|1,0,0]=3 2981 B7R0.2 CC[C@@H](C)NC(C)=O Amb25169508 [1,1,0,0,0,0|2,0,0]=4 2982 B7R0.2 CC[C@@H](N)CC(O)=O Amb22225305 [1,1,0,0,0,0|0,0,0]=2 2983 B7R0.2 CC[C@@H](O)CC(C)=C Amb25136335 [1,1,0,0,0,0|2,0,0]=4 2984 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [1,1,0,0,0,0|1,0,0]=3 2985 B7R0.2 CC[C@@H](S)CC(O)=O Amb24481337 [1,1,0,0,0,0|0,0,0]=2 2986 B7R0.2 CC[C@H](C)CC(C)=O Amb24614519 [1,1,0,0,0,0|1,0,0]=3 2987 B7R0.2 CC[C@H](C)CC(N)=N Amb24409491 [1,1,0,0,0,0|2,0,0]=4 2988 B7R0.2 CC[C@H](C)NC(C)=O Amb25823467 [1,1,0,0,0,0|2,0,0]=4 2989 B7R0.2 CC[C@H](N)CC(O)=O Amb22226650 [1,1,0,0,0,0|0,0,0]=2 2990 B7R0.2 CC[C@H](O)C[N+]([O-])=O Amb25854053 [1,1,0,0,0,0|1,0,1]=4 2991 B7R0.2 CC[S+](C)CC(O)=O Amb24710040 [1,1,0,0,0,0|1,0,0]=3 2992 B7R0.2 CN(C)CC(=O)C=O Amb25348685 [1,1,0,0,0,0|1,0,1]=4 2993 B7R0.2 CN(C)CC(N)CO Amb25742525 [1,1,0,0,0,0|1,0,1]=4 2994 B7R0.2 CN(C)CC(O)C=O Amb25233179 [1,1,0,0,0,0|1,0,0]=3 2995 B7R0.2 CN(C)C[C@@H](N)CO Amb24411936 [1,1,0,0,0,0|1,0,1]=4 2996 B7R0.2 CNC(C)CC(N)=O Amb19960012 [1,1,0,0,0,0|2,0,0]=4 2997 B7R0.2 CNC(C)CC(O)=O Amb21959674 [1,1,0,0,0,0|1,0,0]=3 2998 B7R0.2 CNC(CC(C)C)C Amb1119789 [1,1,0,0,0,0|2,0,0]=4 2999 B7R0.2 CN[C@@H](C)CC(O)=O Amb25255193 [1,1,0,0,0,0|1,0,0]=3 3000 B7R0.2 CN[C@H](C)CC(O)=O Amb25339129 [1,1,0,0,0,0|1,0,0]=3 3001 B7R0.2 COC(=O)CC(=O)O Amb16232032 [1,1,0,0,0,0|1,0,1]=4 3002 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [1,1,0,0,0,0|1,0,0]=3 3003 B7R0.2 CO[C@@H](O)CC(C)=O Amb24450127 [1,1,0,0,0,0|2,0,0]=4 3004 B7R0.2 CSC(C)CC(C)=O Amb25714199 [1,1,0,0,0,0|2,0,0]=4 3005 B7R0.2 CSC(C)CC(O)=O Amb18967824 [1,1,0,0,0,0|1,0,0]=3 3006 B7R0.2 C[C@@H](C=O)C=C(C)C Amb24333258 [1,1,0,0,0,0|0,0,2]=4 3007 B7R0.2 C[C@@H](CC(C)=C)C=O Amb24375353 [1,1,0,0,0,0|0,0,2]=4 3008 B7R0.2 C[C@@H](CC(C)=O)C=O Amb24379584 [1,1,0,0,0,0|1,0,1]=4 3009 B7R0.2 C[C@@H](CC(O)=O)ON Amb25189045 [1,1,0,0,0,0|2,0,0]=4 3010 B7R0.2 C[C@@H](CO)CC(C)=O Amb25072788 [1,1,0,0,0,0|2,0,0]=4 3011 B7R0.2 C[C@@H](C[C@H](C)O)C=C Amb25763927 [1,1,0,0,0,0|2,0,0]=4 3012 B7R0.2 C[C@@H](N)C[C@H](O)CO Amb24351981 [1,1,0,0,0,0|1,0,1]=4 3013 B7R0.2 C[C@@H](O)CC(O)C=C Amb25207943 [1,1,0,0,0,0|2,0,0]=4 3014 B7R0.2 C[C@@H](O)C[C@H](C)CO Amb24642405 [1,1,0,0,0,0|1,0,1]=4 3015 B7R0.2 C[C@@H](O)C[C@H](O)C=C Amb25381234 [1,1,0,0,0,0|2,0,0]=4 3016 B7R0.2 C[C@H](C=O)C=C(C)C Amb25293775 [1,1,0,0,0,0|0,0,2]=4 3017 B7R0.2 C[C@H](CC(O)=O)C=C Amb25791667 [1,1,0,0,0,0|0,0,2]=4 3018 B7R0.2 C[C@H](O)C[C@@H](C)CO Amb25845280 [1,1,0,0,0,0|1,0,1]=4 3019 B7R0.2 C[C@H](O)C[C@@H](N)CO Amb25105060 [1,1,0,0,0,0|1,0,1]=4 3020 B7R0.2 C[S+](C)CC(O)CO Amb24493510 [1,1,0,0,0,0|1,0,1]=4 3021 B7R0.2 C\C(\CC(O)=O)=C\C Amb24481339 [1,1,0,0,0,0|0,0,2]=4 3022 B7R0.2 C\C(\CC)=C\C(O)=O Amb18281014 [1,1,0,0,0,0|0,0,2]=4 3023 B7R0.2 C\C=C(\C)/CC(C)C Amb24566930 [1,1,0,0,0,0|1,0,1]=4 3024 B7R0.2 C\C=C(\Cl)/CC(O)=O Amb25174797 [1,1,0,0,0,0|0,0,2]=4 3025 B7R0.2 NC(=O)CC(O)CO Amb25662216 [1,1,0,0,0,0|2,0,0]=4 3026 B7R0.2 NC(=O)C[C@H](O)CCl Amb25791271 [1,1,0,0,0,0|2,0,0]=4 3027 B7R0.2 NC(C#N)CC(C)C Amb10203324 [1,1,0,0,0,0|1,0,1]=4 3028 B7R0.2 NC(C#N)CC(C)C Amb1137462 [1,1,0,0,0,0|1,0,1]=4 3029 B7R0.2 NC(CF)CC(O)=O Amb24428065 [1,1,0,0,0,0|1,0,0]=3 3030 B7R0.2 NC(CO)CC(N)=O Amb24384089 [1,1,0,0,0,0|2,0,0]=4 3031 B7R0.2 NC(CS)CC(O)=O Amb25090412 [1,1,0,0,0,0|1,0,0]=3 3032 B7R0.2 NCC(F)CC(O)=O Amb24550169 [1,1,0,0,0,0|1,0,0]=3 3033 B7R0.2 NCC(N)CC(O)=O Amb19515145 [1,1,0,0,0,0|1,0,0]=3 3034 B7R0.2 NCC(N)CC(O)=O Amb21858324 [1,1,0,0,0,0|1,0,0]=3 3035 B7R0.2 NCC(N)CC(O)=O Amb22751661 [1,1,0,0,0,0|1,0,0]=3 3036 B7R0.2 NCC(O)CC(N)=O Amb18641952 [1,1,0,0,0,0|2,0,0]=4 3037 B7R0.2 NCC(O)CP(O)=O Amb24714285 [1,1,0,0,0,0|2,0,0]=4 3038 B7R0.2 NC[C@@H](F)CP(O)=O Amb24481490 [1,1,0,0,0,0|2,0,0]=4 3039 B7R0.2 NC[C@@H](N)CC(O)=O Amb22751651 [1,1,0,0,0,0|1,0,0]=3 3040 B7R0.2 NC[C@@H](N)CC(O)=O Amb25829509 [1,1,0,0,0,0|1,0,0]=3 3041 B7R0.2 NC[C@H](CC(=O)O)N Amb10603267 [1,1,0,0,0,0|1,0,0]=3 3042 B7R0.2 NC[C@H](F)CS(O)=O Amb25068064 [1,1,0,0,0,0|2,0,0]=4 3043 B7R0.2 NC[C@H](N)CC(O)=O Amb25378712 [1,1,0,0,0,0|1,0,0]=3 3044 B7R0.2 NC[C@H](O)CP(O)=O Amb25324060 [1,1,0,0,0,0|2,0,0]=4 3045 B7R0.2 N[C@@H](CC(O)=O)C#N Amb25757887 [1,1,0,0,0,0|1,0,1]=4 3046 B7R0.2 N[C@@H](CO)CC(N)=O Amb24704927 [1,1,0,0,0,0|2,0,0]=4 3047 B7R0.2 N[C@H](C#N)CC(C)C Amb17399794 [1,1,0,0,0,0|1,0,1]=4 3048 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [1,1,0,0,0,0|1,0,1]=4 3049 B7R0.2 N[C@H](CC(O)=O)CO Amb22388520 [1,1,0,0,0,0|1,0,0]=3 3050 B7R0.2 N[C@H](CO)CC(N)=O Amb24599306 [1,1,0,0,0,0|2,0,0]=4 3051 B7R0.2 O=C(Cl)CC(Cl)CCl Amb25138703 [1,1,0,0,0,0|2,0,0]=4 3052 B7R0.2 OC(=O)CC(=O)CCl Amb18124484 [1,1,0,0,0,0|1,0,1]=4 3053 B7R0.2 OC(=O)CC(Br)CCl Amb25834578 [1,1,0,0,0,0|1,0,0]=3 3054 B7R0.2 OC(=O)CC(Cl)CCl Amb25335414 [1,1,0,0,0,0|1,0,0]=3 3055 B7R0.2 OC(=O)CC(F)C=O Amb25114270 [1,1,0,0,0,0|1,0,1]=4 3056 B7R0.2 OC(CC(=O)Cl)CCl Amb25806118 [1,1,0,0,0,0|2,0,0]=4 3057 B7R0.2 OC(CCl)CC(O)=O Amb18643354 [1,1,0,0,0,0|1,0,0]=3 3058 B7R0.2 OCC(O)CP(O)=O Amb25316128 [1,1,0,0,0,0|2,0,0]=4 3059 B7R0.2 OC[C@@H](CC(=O)O)N Amb16184020 [1,1,0,0,0,0|1,0,0]=3 3060 B7R0.2 OC[C@H](O)CC(O)=O Amb25326979 [1,1,0,0,0,0|1,0,0]=3 3061 B7R0.2 O[C@H](CBr)CC(O)=O Amb22265826 [1,1,0,0,0,0|1,0,0]=3 3062 B7R0.2 [C-]#[N+]C(C)CC(C)C Amb19944627 [1,1,0,0,0,0|2,0,0]=4 3063 B7R0.2 [O-]C(=O)CC(O)CO Amb24117078 [1,1,0,0,0,0|1,0,1]=4 3064 B7R0.3 BrCC(Br)CCC=C Amb17779511 [1,1,0,0,0,0|2,0,0]=4 3065 B7R0.3 C=C(CO)CCCN Amb25747319 [1,1,0,0,0,0|2,0,0]=4 3066 B7R0.3 C=CC(=O)CCCBr Amb24726349 [1,1,0,0,0,0|2,0,0]=4 3067 B7R0.3 C=CC(=O)CCCCl Amb24568327 [1,1,0,0,0,0|2,0,0]=4 3068 B7R0.3 C=CC(=O)CCCN Amb25662517 [1,1,0,0,0,0|2,0,0]=4 3069 B7R0.3 C=CC(=O)CCCO Amb25284731 [1,1,0,0,0,0|2,0,0]=4 3070 B7R0.3 C=CC(O)CCC=O Amb24573986 [1,1,0,0,0,0|1,0,1]=4 3071 B7R0.3 C=CCCC(=O)CO Amb25763185 [1,1,0,0,0,0|0,0,2]=4 3072 B7R0.3 C=CCCC(Cl)CO Amb24425971 [1,1,0,0,0,0|2,0,0]=4 3073 B7R0.3 C=CCCC(F)CO Amb25127775 [1,1,0,0,0,0|2,0,0]=4 3074 B7R0.3 C=CCCC(N)CF Amb25691515 [1,1,0,0,0,0|2,0,0]=4 3075 B7R0.3 C=CCCC(N)CN Amb20667712 [1,1,0,0,0,0|2,0,0]=4 3076 B7R0.3 C=CCCC(N)CO Amb25083009 [1,1,0,0,0,0|2,0,0]=4 3077 B7R0.3 C=CCCC(O)CCl Amb21962025 [1,1,0,0,0,0|2,0,0]=4 3078 B7R0.3 C=CCC[C@@H](O)CCl Amb25757947 [1,1,0,0,0,0|2,0,0]=4 3079 B7R0.3 C=CCC[C@H](O)CCl Amb24387324 [1,1,0,0,0,0|2,0,0]=4 3080 B7R0.3 C=CCC[C@H](O)CO Amb25847350 [1,1,0,0,0,0|2,0,0]=4 3081 B7R0.3 CC(C#N)OCC=O Amb24429384 [1,1,0,0,0,0|1,0,1]=4 3082 B7R0.3 CC(C=O)CCCC Amb17593191 [1,1,0,0,0,0|1,0,1]=4 3083 B7R0.3 CC(CBr)CCCN Amb25851758 [1,1,0,0,0,0|1,0,1]=4 3084 B7R0.3 CC(CBr)NCC=C Amb24339231 [1,1,0,0,0,0|2,0,0]=4 3085 B7R0.3 CC(CBr)OCC=C Amb25258900 [1,1,0,0,0,0|2,0,0]=4 3086 B7R0.3 CC(CCC=C)C=O Amb25100921 [1,1,0,0,0,0|1,0,1]=4 3087 B7R0.3 CC(CCC=C)NN Amb25343108 [1,1,0,0,0,0|2,0,0]=4 3088 B7R0.3 CC(CCC=C)NO Amb25058311 [1,1,0,0,0,0|2,0,0]=4 3089 B7R0.3 CC(CCC=O)=C=C Amb24481520 [1,1,0,0,0,0|0,0,2]=4 3090 B7R0.3 CC(CCC=O)C#N Amb18641636 [1,1,0,0,0,0|0,0,1]=3 3091 B7R0.3 CC(CCC=O)C=C Amb18641704 [1,1,0,0,0,0|0,0,1]=3 3092 B7R0.3 CC(CCCCl)=NO Amb24353583 [1,1,0,0,0,0|2,0,0]=4 3093 B7R0.3 CC(CCCO)C=C Amb22641468 [1,1,0,0,0,0|0,0,2]=4 3094 B7R0.3 CC(CCCO)C=O Amb24690170 [1,1,0,0,0,0|0,0,2]=4 3095 B7R0.3 CC(CCCO)CO Amb25098490 [1,1,0,0,0,0|0,0,1]=3 3096 B7R0.3 CC(CCCO)NN Amb24462745 [1,1,0,0,0,0|1,0,1]=4 3097 B7R0.3 CC(CCl)CCC=C Amb24481361 [1,1,0,0,0,0|1,0,0]=3 3098 B7R0.3 CC(CCl)OCC=C Amb25703271 [1,1,0,0,0,0|2,0,0]=4 3099 B7R0.3 CC(CCl)SCC=C Amb24714255 [1,1,0,0,0,0|2,0,0]=4 3100 B7R0.3 CC(CN)CCC=C Amb25189032 [1,1,0,0,0,0|1,0,0]=3 3101 B7R0.3 CC(CN)CCCCl Amb25338606 [1,1,0,0,0,0|1,0,1]=4 3102 B7R0.3 CC(CN)CCNC Amb17334066 [1,1,0,0,0,0|2,0,0]=4 3103 B7R0.3 CC(CN)CCOC Amb17569915 [1,1,0,0,0,0|2,0,0]=4 3104 B7R0.3 CC(CN)NCCO Amb24738477 [1,1,0,0,0,0|1,0,1]=4 3105 B7R0.3 CC(CN)OCC=C Amb18523837 [1,1,0,0,0,0|2,0,0]=4 3106 B7R0.3 CC(CN)SCC=C Amb25104670 [1,1,0,0,0,0|2,0,0]=4 3107 B7R0.3 CC(CN)SCCO Amb25104065 [1,1,0,0,0,0|1,0,1]=4 3108 B7R0.3 CC(CO)CCC#C Amb24481197 [1,1,0,0,0,0|1,0,1]=4 3109 B7R0.3 CC(CO)CCC=O Amb25693017 [1,1,0,0,0,0|0,0,0]=2 3110 B7R0.3 CC(CO)CCCBr Amb25173843 [1,1,0,0,0,0|1,0,1]=4 3111 B7R0.3 CC(CO)CCNC Amb17569900 [1,1,0,0,0,0|2,0,0]=4 3112 B7R0.3 CC(CO)\C=C\C=O Amb24744749 [1,1,0,0,0,0|0,0,2]=4 3113 B7R0.3 CC(C\C=C\C)CC Amb22730660 [1,1,0,0,0,0|1,0,1]=4 3114 B7R0.3 CC(NC)CCCO Amb17569902 [1,1,0,0,0,0|0,0,1]=3 3115 B7R0.3 CC(OC)CCCN Amb17569913 [1,1,0,0,0,0|1,0,1]=4 3116 B7R0.3 CCC#CC(=O)CO Amb25705398 [1,1,0,0,0,0|0,0,2]=4 3117 B7R0.3 CCC(=O)CCC=O Amb18641783 [1,1,0,0,0,0|1,0,1]=4 3118 B7R0.3 CCC(=O)CCCBr Amb25765636 [1,1,0,0,0,0|2,0,0]=4 3119 B7R0.3 CCC(=O)CCCF Amb25101437 [1,1,0,0,0,0|2,0,0]=4 3120 B7R0.3 CCC(=O)CCCN Amb18833012 [1,1,0,0,0,0|2,0,0]=4 3121 B7R0.3 CCC(=O)CCCO Amb24629709 [1,1,0,0,0,0|2,0,0]=4 3122 B7R0.3 CCC(=O)CCSC Amb25680024 [1,1,0,0,0,0|2,0,0]=4 3123 B7R0.3 CCC(=O)CNCC Amb25032080 [1,1,0,0,0,0|2,0,0]=4 3124 B7R0.3 CCC(=O)CSCC Amb24715230 [1,1,0,0,0,0|2,0,0]=4 3125 B7R0.3 CCC(Br)CCCO Amb24627076 [1,1,0,0,0,0|1,0,1]=4 3126 B7R0.3 CCC(C)CCC=O Amb25125664 [1,1,0,0,0,0|0,0,0]=2 3127 B7R0.3 CCC(C)CCCBr Amb18184302 [1,1,0,0,0,0|1,0,1]=4 3128 B7R0.3 CCC(C)CCCCl Amb25094579 [1,1,0,0,0,0|1,0,1]=4 3129 B7R0.3 CCC(C)CCNC Amb18523839 [1,1,0,0,0,0|2,0,0]=4 3130 B7R0.3 CCC(C)CN=C=O Amb25783333 [1,1,0,0,0,0|1,0,1]=4 3131 B7R0.3 CCC(C)OCC=O Amb25169598 [1,1,0,0,0,0|1,0,0]=3 3132 B7R0.3 CCC(C)OCCO Amb19516036 [1,1,0,0,0,0|1,0,1]=4 3133 B7R0.3 CCC(C)\C=C\C=O Amb18641694 [1,1,0,0,0,0|0,0,2]=4 3134 B7R0.3 CCC(Cl)CCCO Amb24526635 [1,1,0,0,0,0|1,0,1]=4 3135 B7R0.3 CCC(Cl)COC=O Amb24483209 [1,1,0,0,0,0|2,0,0]=4 3136 B7R0.3 CCC(N)CCC=C Amb24434717 [1,1,0,0,0,0|2,0,0]=4 3137 B7R0.3 CCC(N)CCCO Amb18641929 [1,1,0,0,0,0|1,0,1]=4 3138 B7R0.3 CCC(O)CCC=C Amb22052608 [1,1,0,0,0,0|2,0,0]=4 3139 B7R0.3 CCC(O)COC=O Amb24642387 [1,1,0,0,0,0|2,0,0]=4 3140 B7R0.3 CCC(S)CCCO Amb24534037 [1,1,0,0,0,0|1,0,1]=4 3141 B7R0.3 CCCCC(=C)CBr Amb25249105 [1,1,0,0,0,0|2,0,0]=4 3142 B7R0.3 CCCCC(=C)CO Amb25079813 [1,1,0,0,0,0|1,0,0]=3 3143 B7R0.3 CCCCC(=N)NC Amb24377157 [1,1,0,0,0,0|2,0,0]=4 3144 B7R0.3 CCCCC(=N)OC Amb17617956 [1,1,0,0,0,0|1,0,0]=3 3145 B7R0.3 CCCCC(=N)OC Amb25353357 [1,1,0,0,0,0|1,0,0]=3 3146 B7R0.3 CCCCC(=O)C#N Amb22729179 [1,1,0,0,0,0|1,0,0]=3 3147 B7R0.3 CCCCC(=O)C=C Amb25062494 [1,1,0,0,0,0|1,0,0]=3 3148 B7R0.3 CCCCC(=O)C=O Amb18124252 [1,1,0,0,0,0|0,0,1]=3 3149 B7R0.3 CCCCC(=O)CBr Amb24563421 [1,1,0,0,0,0|1,0,0]=3 3150 B7R0.3 CCCCC(=O)CCl Amb17593420 [1,1,0,0,0,0|1,0,0]=3 3151 B7R0.3 CCCCC(=O)CF Amb24483296 [1,1,0,0,0,0|1,0,0]=3 3152 B7R0.3 CCCCC(=O)CN Amb24473062 [1,1,0,0,0,0|1,0,0]=3 3153 B7R0.3 CCCCC(=O)SC Amb25225724 [1,1,0,0,0,0|0,1,0]=3 3154 B7R0.3 CCCCC(C)=CC Amb22229367 [1,1,0,0,0,0|2,0,0]=4 3155 B7R0.3 CCCCC(C)=NO Amb19515982 [1,1,0,0,0,0|1,0,0]=3 3156 B7R0.3 CCCCC(C)CBr Amb22227886 [1,1,0,0,0,0|1,0,1]=4 3157 B7R0.3 CCCCC(C)CCl Amb24481359 [1,1,0,0,0,0|1,0,1]=4 3158 B7R0.3 CCCCC(C)CN Amb18311071 [1,1,0,0,0,0|1,0,1]=4 3159 B7R0.3 CCCCC(C=O)Br Amb17594581 [1,1,0,0,0,0|1,0,1]=4 3160 B7R0.3 CCCCC(CC)C Amb10071971 [1,1,0,0,0,0|1,0,1]=4 3161 B7R0.3 CCCCC(CC)O Amb10844720 [1,1,0,0,0,0|1,0,1]=4 3162 B7R0.3 CCCCC(CO)C Amb17593205 [1,1,0,0,0,0|1,0,1]=4 3163 B7R0.3 CCCCC(CO)N Amb2236185 [1,1,0,0,0,0|1,0,1]=4 3164 B7R0.3 CCCCC(Cl)=CBr Amb24552431 [1,1,0,0,0,0|2,0,0]=4 3165 B7R0.3 CCCCC(Cl)=CCl Amb24512078 [1,1,0,0,0,0|2,0,0]=4 3166 B7R0.3 CCCCC(Cl)C=O Amb18642973 [1,1,0,0,0,0|1,0,1]=4 3167 B7R0.3 CCCCC(Cl)CO Amb25760827 [1,1,0,0,0,0|1,0,1]=4 3168 B7R0.3 CCCCC(Cl)OC Amb24433133 [1,1,0,0,0,0|1,0,1]=4 3169 B7R0.3 CCCCC(F)=CBr Amb24483089 [1,1,0,0,0,0|2,0,0]=4 3170 B7R0.3 CCCCC(F)CO Amb25134893 [1,1,0,0,0,0|1,0,1]=4 3171 B7R0.3 CCCCC(N)=NN Amb25781596 [1,1,0,0,0,0|2,0,0]=4 3172 B7R0.3 CCCCC(O)C#N Amb23454545 [1,1,0,0,0,0|1,0,1]=4 3173 B7R0.3 CCCCC(O)CBr Amb25233429 [1,1,0,0,0,0|1,0,1]=4 3174 B7R0.3 CCCCC(O)CCl Amb24481415 [1,1,0,0,0,0|1,0,1]=4 3175 B7R0.3 CCCCC(O)CS Amb24554468 [1,1,0,0,0,0|0,1,1]=4 3176 B7R0.3 CCCCC(O)OC Amb24448002 [1,1,0,0,0,0|0,0,2]=4 3177 B7R0.3 CCCCN(C)N=O Amb22231185 [1,1,0,0,0,0|2,0,0]=4 3178 B7R0.3 CCCCN(C)OC Amb24354551 [1,1,0,0,0,0|2,0,0]=4 3179 B7R0.3 CCCC[14C](=O)O[Na] Amb22734535 [1,1,0,0,0,0|0,0,0]=2 3180 B7R0.3 CCCC[C@@H](C)CBr Amb25322055 [1,1,0,0,0,0|1,0,1]=4 3181 B7R0.3 CCCC[C@@H](N)CO Amb23440322 [1,1,0,0,0,0|1,0,1]=4 3182 B7R0.3 CCCC[C@@H](O)C=C Amb24731913 [1,1,0,0,0,0|1,0,1]=4 3183 B7R0.3 CCCC[C@@H](O)C=O Amb24481527 [1,1,0,0,0,0|0,0,1]=3 3184 B7R0.3 CCCC[C@@H](O)CC Amb25675670 [1,1,0,0,0,0|1,0,1]=4 3185 B7R0.3 CCCC[C@@H](O)CO Amb25315976 [1,1,0,0,0,0|0,0,2]=4 3186 B7R0.3 CCCC[C@H](C)NC Amb25745887 [1,1,0,0,0,0|1,0,1]=4 3187 B7R0.3 CCCC[C@H](F)C=O Amb25143375 [1,1,0,0,0,0|1,0,1]=4 3188 B7R0.3 CCCC[C@H](O)C=C Amb24591765 [1,1,0,0,0,0|1,0,1]=4 3189 B7R0.3 CCCC[C@H](O)CCl Amb24561798 [1,1,0,0,0,0|1,0,1]=4 3190 B7R0.3 CCCC\C(\Br)=C/Cl Amb25663235 [1,1,0,0,0,0|2,0,0]=4 3191 B7R0.3 CCCC\C(\C)=C/Cl Amb24627150 [1,1,0,0,0,0|2,0,0]=4 3192 B7R0.3 CCCC\C(\C)=N\O Amb21520448 [1,1,0,0,0,0|1,0,0]=3 3193 B7R0.3 CCCC\C(\Cl)=C/Cl Amb25745924 [1,1,0,0,0,0|2,0,0]=4 3194 B7R0.3 CCCNC(=N)CO Amb23514974 [1,1,0,0,0,0|2,0,0]=4 3195 B7R0.3 CCCNC(=O)C#C Amb25101832 [1,1,0,0,0,0|2,0,0]=4 3196 B7R0.3 CCCNC(=O)CBr Amb17330843 [1,1,0,0,0,0|2,0,0]=4 3197 B7R0.3 CCCNC(=O)CCl Amb1207068 [1,1,0,0,0,0|2,0,0]=4 3198 B7R0.3 CCCNC(=O)CF Amb25141943 [1,1,0,0,0,0|2,0,0]=4 3199 B7R0.3 CCCNC(=O)CI Amb23512283 [1,1,0,0,0,0|2,0,0]=4 3200 B7R0.3 CCCNC(=O)CN Amb10781813 [1,1,0,0,0,0|2,0,0]=4 3201 B7R0.3 CCCNC(=O)OC Amb17797997 [1,1,0,0,0,0|1,0,0]=3 3202 B7R0.3 CCCNC(=O)SC Amb24746599 [1,1,0,0,0,0|1,1,0]=4 3203 B7R0.3 CCCOC(=C)C=O Amb24483012 [1,1,0,0,0,0|2,0,0]=4 3204 B7R0.3 CCCOC(=O)C=C Amb22045218 [1,1,0,0,0,0|2,0,0]=4 3205 B7R0.3 CCCOC(=O)C=O Amb18641875 [1,1,0,0,0,0|1,0,1]=4 3206 B7R0.3 CCCOC(=O)NO Amb24630559 [1,1,0,0,0,0|1,0,0]=3 3207 B7R0.3 CCCOC(N)=NO Amb24358642 [1,1,0,0,0,0|2,0,0]=4 3208 B7R0.3 CCCSC(=C)CO Amb25694154 [1,1,0,0,0,0|2,0,0]=4 3209 B7R0.3 CCCSC(=S)OC Amb25758079 [1,1,0,0,0,0|1,1,0]=4 3210 B7R0.3 CCCSC(N)=NO Amb24655353 [1,1,0,0,0,0|2,0,0]=4 3211 B7R0.3 CCC\C=C(/C)\C=O Amb25194656 [1,1,0,0,0,0|1,0,1]=4 3212 B7R0.3 CCC\C=C(/F)\C=O Amb24653634 [1,1,0,0,0,0|1,0,1]=4 3213 B7R0.3 CCC\C=C(\Br)/CO Amb25306515 [1,1,0,0,0,0|1,0,1]=4 3214 B7R0.3 CCC\C=C(\C)/C=O Amb18641699 [1,1,0,0,0,0|1,0,1]=4 3215 B7R0.3 CCC\C=C(\C)/CO Amb25206584 [1,1,0,0,0,0|1,0,1]=4 3216 B7R0.3 CCC\C=C(\Cl)/C=O Amb18124371 [1,1,0,0,0,0|1,0,1]=4 3217 B7R0.3 CCC\C=C(\F)/C=O Amb18641881 [1,1,0,0,0,0|1,0,1]=4 3218 B7R0.3 CCC\C=C(\F)/CO Amb25093759 [1,1,0,0,0,0|1,0,1]=4 3219 B7R0.3 CCNCC(=O)C#C Amb25062852 [1,1,0,0,0,0|2,0,0]=4 3220 B7R0.3 CCNCC(=O)OC Amb19514718 [1,1,0,0,0,0|1,0,0]=3 3221 B7R0.3 CCNCC(N)=NO Amb24612871 [1,1,0,0,0,0|2,0,0]=4 3222 B7R0.3 CCNCC(O)C=O Amb24399473 [1,1,0,0,0,0|1,0,1]=4 3223 B7R0.3 CCNNC(=O)OC Amb25191868 [1,1,0,0,0,0|2,0,0]=4 3224 B7R0.3 CCOCC(=C)CO Amb25222257 [1,1,0,0,0,0|2,0,0]=4 3225 B7R0.3 CCOCC(=O)C#C Amb24483100 [1,1,0,0,0,0|2,0,0]=4 3226 B7R0.3 CCOCC(=O)CBr Amb25261639 [1,1,0,0,0,0|2,0,0]=4 3227 B7R0.3 CCOCC(=O)CCl Amb25087764 [1,1,0,0,0,0|2,0,0]=4 3228 B7R0.3 CCOCC(=O)CS Amb24406072 [1,1,0,0,0,0|1,1,0]=4 3229 B7R0.3 CCOCC(=O)NN Amb2111918 [1,1,0,0,0,0|2,0,0]=4 3230 B7R0.3 CCO\C=C(/O)\C=O Amb25326136 [1,1,0,0,0,0|1,0,1]=4 3231 B7R0.3 CCO\C=C(\O)/C=O Amb25195281 [1,1,0,0,0,0|1,0,1]=4 3232 B7R0.3 CCSCC(=C)C=O Amb18642813 [1,1,0,0,0,0|2,0,0]=4 3233 B7R0.3 CCSCC(=O)C#C Amb25068174 [1,1,0,0,0,0|2,0,0]=4 3234 B7R0.3 CCSCC(=O)C=O Amb24741839 [1,1,0,0,0,0|1,0,1]=4 3235 B7R0.3 CCSCC(=O)CCl Amb24545960 [1,1,0,0,0,0|2,0,0]=4 3236 B7R0.3 CCSCC(=O)CO Amb25686953 [1,1,0,0,0,0|1,0,0]=3 3237 B7R0.3 CCSCC(=O)NC Amb24333216 [1,1,0,0,0,0|2,0,0]=4 3238 B7R0.3 CCSCC(C)=NO Amb25066024 [1,1,0,0,0,0|2,0,0]=4 3239 B7R0.3 CCSC[C@H](O)C=O Amb25844429 [1,1,0,0,0,0|1,0,1]=4 3240 B7R0.3 CCSNC(=O)CO Amb24631959 [1,1,0,0,0,0|2,0,0]=4 3241 B7R0.3 CC[C@@H](C)CCCBr Amb24740782 [1,1,0,0,0,0|1,0,1]=4 3242 B7R0.3 CC[C@@H](C)CCCO Amb22799989 [1,1,0,0,0,0|0,0,1]=3 3243 B7R0.3 CC[C@H](C)C#CC=O Amb25714235 [1,1,0,0,0,0|0,0,2]=4 3244 B7R0.3 CC[C@H](C)CCC=O Amb25102725 [1,1,0,0,0,0|0,0,0]=2 3245 B7R0.3 CC[C@H](C)CCCO Amb22226203 [1,1,0,0,0,0|0,0,1]=3 3246 B7R0.3 CC[C@H](C)CNC=O Amb24481319 [1,1,0,0,0,0|1,0,0]=3 3247 B7R0.3 CC\C(\C)=C/CC=O Amb24657093 [1,1,0,0,0,0|0,0,2]=4 3248 B7R0.3 CC\C=C/C(=O)OC Amb10071549 [1,1,0,0,0,0|0,0,2]=4 3249 B7R0.3 CNC(=O)CCCBr Amb24552452 [1,1,0,0,0,0|2,0,0]=4 3250 B7R0.3 CNC(=O)CCCCl Amb1137464 [1,1,0,0,0,0|2,0,0]=4 3251 B7R0.3 CNC(=O)CCCO Amb17231829 [1,1,0,0,0,0|2,0,0]=4 3252 B7R0.3 CNC(C)CCC=C Amb18641747 [1,1,0,0,0,0|1,0,0]=3 3253 B7R0.3 CNC(C)CCCCl Amb25340216 [1,1,0,0,0,0|1,0,1]=4 3254 B7R0.3 CNC(C)CCCS Amb24548498 [1,1,0,0,0,0|0,1,1]=4 3255 B7R0.3 CNC(C)CCSC Amb19515468 [1,1,0,0,0,0|2,0,0]=4 3256 B7R0.3 CNCCC(=O)C#C Amb24528728 [1,1,0,0,0,0|2,0,0]=4 3257 B7R0.3 CNCCC(=O)NC Amb19959924 [1,1,0,0,0,0|2,0,0]=4 3258 B7R0.3 CNCCC(=O)OC Amb22168213 [1,1,0,0,0,0|1,0,0]=3 3259 B7R0.3 CNCCC(C)NC Amb24622487 [1,1,0,0,0,0|2,0,0]=4 3260 B7R0.3 CNCCC(C)SC Amb24458812 [1,1,0,0,0,0|2,0,0]=4 3261 B7R0.3 CNCCC(OC)C Amb17569916 [1,1,0,0,0,0|2,0,0]=4 3262 B7R0.3 CNCC\C(\N)=N/O Amb19981296 [1,1,0,0,0,0|2,0,0]=4 3263 B7R0.3 CNCC\C(\N)=N\O Amb22410480 [1,1,0,0,0,0|2,0,0]=4 3264 B7R0.3 CN[C@@H](C)CCCN Amb25746510 [1,1,0,0,0,0|1,0,1]=4 3265 B7R0.3 COC(=C)CCC=O Amb18641791 [1,1,0,0,0,0|0,0,2]=4 3266 B7R0.3 COC(=C)CCCCl Amb25703575 [1,1,0,0,0,0|2,0,0]=4 3267 B7R0.3 COC(=N)CCCCl Amb16231406 [1,1,0,0,0,0|2,0,0]=4 3268 B7R0.3 COC(=N)COCC Amb25315918 [1,1,0,0,0,0|2,0,0]=4 3269 B7R0.3 COC(=O)CCC#C Amb18115985 [1,1,0,0,0,0|0,0,2]=4 3270 B7R0.3 COC(=O)CCC=C Amb2369959 [1,1,0,0,0,0|0,0,2]=4 3271 B7R0.3 COC(=O)CCC=O Amb18124259 [1,1,0,0,0,0|1,0,1]=4 3272 B7R0.3 COC(=O)CCCS Amb19373761 [1,1,0,0,0,0|1,0,0]=3 3273 B7R0.3 COC(=O)CCNN Amb24524272 [1,1,0,0,0,0|2,0,0]=4 3274 B7R0.3 COC(=O)CCNO Amb24644523 [1,1,0,0,0,0|2,0,0]=4 3275 B7R0.3 COC(=O)CCON Amb18641968 [1,1,0,0,0,0|2,0,0]=4 3276 B7R0.3 COC(=O)CC[Zn]Br Amb22898090 [1,1,0,0,0,0|2,0,0]=4 3277 B7R0.3 COC(=O)CNCO Amb25369412 [1,1,0,0,0,0|2,0,0]=4 3278 B7R0.3 COC(=O)CNOC Amb25725740 [1,1,0,0,0,0|2,0,0]=4 3279 B7R0.3 COC(=O)COCBr Amb25288082 [1,1,0,0,0,0|2,0,0]=4 3280 B7R0.3 COC(=O)CSCCl Amb25689724 [1,1,0,0,0,0|2,0,0]=4 3281 B7R0.3 COC(=O)NCCBr Amb10608897 [1,1,0,0,0,0|2,0,0]=4 3282 B7R0.3 COC(=O)NCCCl Amb24526396 [1,1,0,0,0,0|2,0,0]=4 3283 B7R0.3 COC(=O)NCCN Amb18970459 [1,1,0,0,0,0|2,0,0]=4 3284 B7R0.3 COC(=O)NOCC Amb24735360 [1,1,0,0,0,0|2,0,0]=4 3285 B7R0.3 COC(=O)OCCCl Amb25261257 [1,1,0,0,0,0|2,0,0]=4 3286 B7R0.3 COC(C)CCNN Amb25300620 [1,1,0,0,0,0|2,0,0]=4 3287 B7R0.3 COC(C)CN=C=O Amb25262746 [1,1,0,0,0,0|1,0,1]=4 3288 B7R0.3 COC(C)CNC=O Amb25127774 [1,1,0,0,0,0|1,0,0]=3 3289 B7R0.3 COC(C)OCCO Amb25823344 [1,1,0,0,0,0|1,0,1]=4 3290 B7R0.3 COC(C)\C=C/C=O Amb25770506 [1,1,0,0,0,0|0,0,2]=4 3291 B7R0.3 COC(O)CCCO Amb24619181 [1,1,0,0,0,0|1,0,1]=4 3292 B7R0.3 COCCC(=N)OC Amb24334438 [1,1,0,0,0,0|2,0,0]=4 3293 B7R0.3 COCCC(=O)C#N Amb24645428 [1,1,0,0,0,0|2,0,0]=4 3294 B7R0.3 COCCC(=O)C=C Amb24744935 [1,1,0,0,0,0|2,0,0]=4 3295 B7R0.3 COCCC(=O)C=O Amb24722152 [1,1,0,0,0,0|1,0,1]=4 3296 B7R0.3 COCCC(=O)CBr Amb25708389 [1,1,0,0,0,0|2,0,0]=4 3297 B7R0.3 COCCC(=O)CCl Amb20622320 [1,1,0,0,0,0|2,0,0]=4 3298 B7R0.3 COCCC(=O)CO Amb25049164 [1,1,0,0,0,0|1,0,0]=3 3299 B7R0.3 COCCC(=O)CS Amb24646143 [1,1,0,0,0,0|1,1,0]=4 3300 B7R0.3 COCCC(C)OC Amb24060657 [1,1,0,0,0,0|2,0,0]=4 3301 B7R0.3 COCCC(NC)C Amb17569918 [1,1,0,0,0,0|2,0,0]=4 3302 B7R0.3 COCC[C@@H](C)CO Amb24412889 [1,1,0,0,0,0|2,0,0]=4 3303 B7R0.3 COCC[C@H](C)CO Amb25333737 [1,1,0,0,0,0|2,0,0]=4 3304 B7R0.3 COCC\C(\N)=N/O Amb19890177 [1,1,0,0,0,0|2,0,0]=4 3305 B7R0.3 COCC\C(\N)=N\O Amb22490466 [1,1,0,0,0,0|2,0,0]=4 3306 B7R0.3 CO[C@@H](C)CCCCl Amb25323981 [1,1,0,0,0,0|1,0,1]=4 3307 B7R0.3 CO[C@@H](C)CCCO Amb25306514 [1,1,0,0,0,0|0,0,1]=3 3308 B7R0.3 CO[C@@H](C)OCCO Amb24386800 [1,1,0,0,0,0|1,0,1]=4 3309 B7R0.3 CO[C@@H](C)\C=C\C=O Amb25043129 [1,1,0,0,0,0|0,0,2]=4 3310 B7R0.3 CO\C(\C)=C\CC=O Amb25365197 [1,1,0,0,0,0|0,0,2]=4 3311 B7R0.3 CSC(C)CCC#N Amb25726462 [1,1,0,0,0,0|1,0,1]=4 3312 B7R0.3 CSC(C)CCCN Amb18642560 [1,1,0,0,0,0|1,0,1]=4 3313 B7R0.3 CSC(C)CNC=O Amb24741113 [1,1,0,0,0,0|1,0,0]=3 3314 B7R0.3 CSCCC(=O)C#C Amb24402673 [1,1,0,0,0,0|2,0,0]=4 3315 B7R0.3 CSCCC(=O)C#N Amb25730124 [1,1,0,0,0,0|2,0,0]=4 3316 B7R0.3 CSCCC(=O)C=C Amb25334636 [1,1,0,0,0,0|2,0,0]=4 3317 B7R0.3 CSCCC(=O)NO Amb25756883 [1,1,0,0,0,0|1,0,0]=3 3318 B7R0.3 CSCCC(C)CO Amb25338794 [1,1,0,0,0,0|2,0,0]=4 3319 B7R0.3 CSCCC(N)=NO Amb25127504 [1,1,0,0,0,0|2,0,0]=4 3320 B7R0.3 CSCCC(O)C=O Amb25107714 [1,1,0,0,0,0|1,0,1]=4 3321 B7R0.3 CSCC[C@@H](O)C=O Amb24481522 [1,1,0,0,0,0|1,0,1]=4 3322 B7R0.3 C[C@@H](CCC=O)C=C Amb25025116 [1,1,0,0,0,0|0,0,1]=3 3323 B7R0.3 C[C@@H](CCCO)CO Amb24475366 [1,1,0,0,0,0|0,0,1]=3 3324 B7R0.3 C[C@@H](CN)NCCO Amb25099589 [1,1,0,0,0,0|1,0,1]=4 3325 B7R0.3 C[C@@H](CO)CCC=C Amb25700125 [1,1,0,0,0,0|1,0,0]=3 3326 B7R0.3 C[C@@H](CO)CCC=O Amb24602985 [1,1,0,0,0,0|0,0,0]=2 3327 B7R0.3 C[C@@H](CO)CNC=O Amb25180638 [1,1,0,0,0,0|1,0,0]=3 3328 B7R0.3 C[C@@H](CO)OCC=C Amb25228448 [1,1,0,0,0,0|2,0,0]=4 3329 B7R0.3 C[C@H](CCC=C)C=O Amb25790613 [1,1,0,0,0,0|1,0,1]=4 3330 B7R0.3 C[C@H](CCC=O)C=C Amb25810817 [1,1,0,0,0,0|0,0,1]=3 3331 B7R0.3 C[C@H](CCC=O)C=O Amb24707164 [1,1,0,0,0,0|0,0,1]=3 3332 B7R0.3 C[C@H](CCCO)C=C Amb25675669 [1,1,0,0,0,0|0,0,2]=4 3333 B7R0.3 C[C@H](CN)CCCO Amb24426785 [1,1,0,0,0,0|0,0,1]=3 3334 B7R0.3 C[C@H](CO)CCC#C Amb25306457 [1,1,0,0,0,0|1,0,1]=4 3335 B7R0.3 C[C@H](CO)CCCBr Amb24632762 [1,1,0,0,0,0|1,0,1]=4 3336 B7R0.3 C\C(\CCCC)=C/C Amb22731328 [1,1,0,0,0,0|2,0,0]=4 3337 B7R0.3 C\C=C(/C)\CCC=O Amb18641710 [1,1,0,0,0,0|0,0,1]=3 3338 B7R0.3 C\C=C(\C)/CCC=O Amb24425599 [1,1,0,0,0,0|0,0,1]=3 3339 B7R0.3 C\C=C(\C)/CCCO Amb25080181 [1,1,0,0,0,0|0,0,2]=4 3340 B7R0.3 ClCCCC(=O)CC Amb17593423 [1,1,0,0,0,0|2,0,0]=4 3341 B7R0.3 NC(CCCF)=NO Amb25263373 [1,1,0,0,0,0|2,0,0]=4 3342 B7R0.3 NC(CCCO)CO Amb18641979 [1,1,0,0,0,0|1,0,1]=4 3343 B7R0.3 NCC(=O)CCCO Amb24471240 [1,1,0,0,0,0|2,0,0]=4 3344 B7R0.3 NCC(O)CCCO Amb18124267 [1,1,0,0,0,0|1,0,1]=4 3345 B7R0.3 NCCCC(=O)NN Amb18061734 [1,1,0,0,0,0|2,0,0]=4 3346 B7R0.3 NCCCC(CC)C Amb17569898 [1,1,0,0,0,0|1,0,1]=4 3347 B7R0.3 NCCCC(CO)C Amb17569904 [1,1,0,0,0,0|1,0,1]=4 3348 B7R0.3 NCCNC(=O)CO Amb18973279 [1,1,0,0,0,0|2,0,0]=4 3349 B7R0.3 NNC(=O)CCCS Amb24706258 [1,1,0,0,0,0|2,0,0]=4 3350 B7R0.3 N[C@@H](CCCO)CO Amb24117047 [1,1,0,0,0,0|1,0,1]=4 3351 B7R0.3 O=C(CCCCl)CCl Amb22395285 [1,1,0,0,0,0|2,0,0]=4 3352 B7R0.3 O=C(CCl)CCCBr Amb22395325 [1,1,0,0,0,0|2,0,0]=4 3353 B7R0.3 O=CC(=O)CCCCl Amb24385284 [1,1,0,0,0,0|1,0,1]=4 3354 B7R0.3 O=CCCN(N=O)C Amb17617679 [1,1,0,0,0,0|2,0,0]=4 3355 B7R0.3 O=COCC(Cl)CCl Amb24481388 [1,1,0,0,0,0|2,0,0]=4 3356 B7R0.3 O=COCC(Cl)CF Amb25725025 [1,1,0,0,0,0|2,0,0]=4 3357 B7R0.3 OC(CBr)CCC=O Amb24559224 [1,1,0,0,0,0|1,0,0]=3 3358 B7R0.3 OC(CCl)CNC=O Amb25137565 [1,1,0,0,0,0|2,0,0]=4 3359 B7R0.3 OC(CCl)COC=O Amb25315901 [1,1,0,0,0,0|2,0,0]=4 3360 B7R0.3 OC(CO)CCC=C Amb10071251 [1,1,0,0,0,0|2,0,0]=4 3361 B7R0.3 OC(CS)SCC=O Amb24574024 [1,1,0,0,0,0|2,0,0]=4 3362 B7R0.3 OCC(=O)CCCCl Amb24481374 [1,1,0,0,0,0|1,0,0]=3 3363 B7R0.3 OCC(O)CCC=O Amb24669095 [1,1,0,0,0,0|1,0,0]=3 3364 B7R0.3 OCC(O)COC=O Amb25787203 [1,1,0,0,0,0|2,0,0]=4 3365 B7R0.3 OCC(O)OCC=O Amb25046498 [1,1,0,0,0,0|2,0,0]=4 3366 B7R0.3 OCCCC(CC)O Amb17593216 [1,1,0,0,0,0|1,0,1]=4 3367 B7R0.3 OCCCC(CN)C Amb17569906 [1,1,0,0,0,0|0,0,1]=3 3368 B7R0.3 OCCCC(CO)O Amb17593225 [1,1,0,0,0,0|1,0,1]=4 3369 B7R0.3 OCCCC(Cl)CO Amb25275096 [1,1,0,0,0,0|1,0,1]=4 3370 B7R0.3 OCCCC(F)CO Amb25051440 [1,1,0,0,0,0|1,0,1]=4 3371 B7R0.3 OCCCC(O)C=O Amb18641948 [1,1,0,0,0,0|1,0,1]=4 3372 B7R0.3 OCCCC(O)CBr Amb24533940 [1,1,0,0,0,0|1,0,1]=4 3373 B7R0.3 OCCCC(O)CCl Amb24725283 [1,1,0,0,0,0|1,0,1]=4 3374 B7R0.3 OCCC[C@H](O)C=O Amb24570447 [1,1,0,0,0,0|1,0,1]=4 3375 B7R0.3 OCCC[C@H](O)CO Amb24687288 [1,1,0,0,0,0|1,0,1]=4 3376 B7R0.3 OC[C@@H](O)CCC=O Amb24482301 [1,1,0,0,0,0|1,0,0]=3 3377 B7R0.3 OC[C@H](O)CCC=O Amb25123219 [1,1,0,0,0,0|1,0,0]=3 3378 B7R0.3 OC[C@H](O)COC=O Amb25831941 [1,1,0,0,0,0|2,0,0]=4 3379 B7R0.3 O[C@@H](CBr)CCC=O Amb24390114 [1,1,0,0,0,0|1,0,0]=3 3380 B7R0.4 BrCCCCC(=O)C Amb16234126 [1,1,0,0,0,0|1,0,0]=3 3381 B7R0.4 C#CCSCC(=O)O Amb2372297 [1,1,0,0,0,0|0,0,2]=4 3382 B7R0.4 C=C(Br)CCCCCl Amb24703183 [1,1,0,0,0,0|2,0,0]=4 3383 B7R0.4 C=C(Br)CCCCO Amb25381428 [1,1,0,0,0,0|2,0,0]=4 3384 B7R0.4 C=C(Cl)CCCCO Amb25064782 [1,1,0,0,0,0|2,0,0]=4 3385 B7R0.4 C=C(F)CCCCBr Amb24635488 [1,1,0,0,0,0|2,0,0]=4 3386 B7R0.4 C=C(F)CCCCO Amb22641473 [1,1,0,0,0,0|2,0,0]=4 3387 B7R0.4 C=CCCCC(=O)C Amb17593171 [1,1,0,0,0,0|1,0,1]=4 3388 B7R0.4 C=CCCCC(N)=O Amb24579642 [1,1,0,0,0,0|1,0,1]=4 3389 B7R0.4 C=CCNCC(O)C Amb17138365 [1,1,0,0,0,0|2,0,0]=4 3390 B7R0.4 C=CCSCC(=O)O Amb1110888 [1,1,0,0,0,0|0,0,2]=4 3391 B7R0.4 CC#CCCC(C)=O Amb24471185 [1,1,0,0,0,0|1,0,1]=4 3392 B7R0.4 CC#CCCC(C)C Amb22052677 [1,1,0,0,0,0|1,0,1]=4 3393 B7R0.4 CC(=C)CCCC=O Amb18641705 [1,1,0,0,0,0|0,0,2]=4 3394 B7R0.4 CC(=C)CCCCBr Amb25129478 [1,1,0,0,0,0|2,0,0]=4 3395 B7R0.4 CC(=C)CCCCCl Amb24481468 [1,1,0,0,0,0|2,0,0]=4 3396 B7R0.4 CC(=C)CCCCN Amb25142976 [1,1,0,0,0,0|2,0,0]=4 3397 B7R0.4 CC(=N)CCCCN Amb25076530 [1,1,0,0,0,0|2,0,0]=4 3398 B7R0.4 CC(=O)CCCC#C Amb18115312 [1,1,0,0,0,0|1,0,1]=4 3399 B7R0.4 CC(=O)CCCC=O Amb18641775 [1,1,0,0,0,0|1,0,1]=4 3400 B7R0.4 CC(=O)CCNC=O Amb25075578 [1,1,0,0,0,0|1,0,1]=4 3401 B7R0.4 CC(=O)CCOC=O Amb24408302 [1,1,0,0,0,0|1,0,1]=4 3402 B7R0.4 CC(=O)CNCCO Amb18108527 [1,1,0,0,0,0|2,0,0]=4 3403 B7R0.4 CC(=O)CNCCS Amb25328157 [1,1,0,0,0,0|2,0,0]=4 3404 B7R0.4 CC(=O)COCC=O Amb18641868 [1,1,0,0,0,0|1,0,1]=4 3405 B7R0.4 CC(=O)COCCCl Amb25346574 [1,1,0,0,0,0|2,0,0]=4 3406 B7R0.4 CC(=O)COCCN Amb18630459 [1,1,0,0,0,0|2,0,0]=4 3407 B7R0.4 CC(=O)CSCCCl Amb25110707 [1,1,0,0,0,0|2,0,0]=4 3408 B7R0.4 CC(=O)CSCCF Amb24621173 [1,1,0,0,0,0|2,0,0]=4 3409 B7R0.4 CC(=O)NCCCF Amb25048794 [1,1,0,0,0,0|2,0,0]=4 3410 B7R0.4 CC(=O)NCCCI Amb24733809 [1,1,0,0,0,0|2,0,0]=4 3411 B7R0.4 CC(=O)NCCCN Amb10610286 [1,1,0,0,0,0|2,0,0]=4 3412 B7R0.4 CC(=O)OCCC=O Amb18641862 [1,1,0,0,0,0|1,0,1]=4 3413 B7R0.4 CC(=O)OCCCF Amb22008199 [1,1,0,0,0,0|2,0,0]=4 3414 B7R0.4 CC(=O)OCCCI Amb24532815 [1,1,0,0,0,0|2,0,0]=4 3415 B7R0.4 CC(=O)OCCCN Amb18641920 [1,1,0,0,0,0|2,0,0]=4 3416 B7R0.4 CC(=O)OCCCO Amb25854267 [1,1,0,0,0,0|2,0,0]=4 3417 B7R0.4 CC(=O)SCCC=O Amb25101351 [1,1,0,0,0,0|1,0,1]=4 3418 B7R0.4 CC(=O)SCCCBr Amb17610077 [1,1,0,0,0,0|2,0,0]=4 3419 B7R0.4 CC(=O)SCCCF Amb25240055 [1,1,0,0,0,0|2,0,0]=4 3420 B7R0.4 CC(=O)SCCCN Amb25368304 [1,1,0,0,0,0|2,0,0]=4 3421 B7R0.4 CC(Br)CCCCO Amb25859232 [1,1,0,0,0,0|1,0,1]=4 3422 B7R0.4 CC(Br)CCOC=O Amb25109882 [1,1,0,0,0,0|1,0,0]=3 3423 B7R0.4 CC(C)=C=CCC=O Amb24444474 [1,1,0,0,0,0|0,0,2]=4 3424 B7R0.4 CC(C)=CCCC=C Amb25789441 [1,1,0,0,0,0|1,0,1]=4 3425 B7R0.4 CC(C)C=C=CC=O Amb24728431 [1,1,0,0,0,0|0,0,2]=4 3426 B7R0.4 CC(C)C=NCCO Amb25205175 [1,1,0,0,0,0|0,0,2]=4 3427 B7R0.4 CC(C)CC#CC=O Amb25309641 [1,1,0,0,0,0|0,0,1]=3 3428 B7R0.4 CC(C)CCC=NN Amb24459314 [1,1,0,0,0,0|1,0,0]=3 3429 B7R0.4 CC(C)CCC=NO Amb24531460 [1,1,0,0,0,0|0,0,0]=2 3430 B7R0.4 CC(C)CCCC#C Amb18635315 [1,1,0,0,0,0|1,0,1]=4 3431 B7R0.4 CC(C)CCCC#N Amb21811944 [1,1,0,0,0,0|1,0,1]=4 3432 B7R0.4 CC(C)CCCC=C Amb25127926 [1,1,0,0,0,0|1,0,0]=3 3433 B7R0.4 CC(C)CCCC=O Amb17940235 [1,1,0,0,0,0|0,0,0]=2 3434 B7R0.4 CC(C)CCCCCl Amb20670590 [1,1,0,0,0,0|1,0,1]=4 3435 B7R0.4 CC(C)CCCCN Amb19374781 [1,1,0,0,0,0|1,0,1]=4 3436 B7R0.4 CC(C)CCCNO Amb25232356 [1,1,0,0,0,0|0,0,1]=3 3437 B7R0.4 CC(C)CCC[Mg]Br Amb22897339 [1,1,0,0,0,0|1,0,1]=4 3438 B7R0.4 CC(C)CCC[Zn]Br Amb22897392 [1,1,0,0,0,0|1,0,1]=4 3439 B7R0.4 CC(C)CCN=[N+]=[N-] Amb20622300 [1,1,0,0,0,0|2,0,0]=4 3440 B7R0.4 CC(C)CCNC#N Amb25824474 [1,1,0,0,0,0|1,0,1]=4 3441 B7R0.4 CC(C)CCOC=C Amb17940027 [1,1,0,0,0,0|1,0,0]=3 3442 B7R0.4 CC(C)CCO[15N]=O Amb22351359 [1,1,0,0,0,0|1,0,0]=3 3443 B7R0.4 CC(C)CCSC#N Amb25707952 [1,1,0,0,0,0|1,0,1]=4 3444 B7R0.4 CC(C)CCSCCl Amb24481232 [1,1,0,0,0,0|1,0,1]=4 3445 B7R0.4 CC(C)CCSCO Amb24450091 [1,1,0,0,0,0|0,0,1]=3 3446 B7R0.4 CC(C)CNCC#C Amb21953896 [1,1,0,0,0,0|1,0,1]=4 3447 B7R0.4 CC(C)CNCCBr Amb25801102 [1,1,0,0,0,0|1,0,1]=4 3448 B7R0.4 CC(C)CNCCF Amb24366225 [1,1,0,0,0,0|1,0,1]=4 3449 B7R0.4 CC(C)CNCCO Amb22587152 [1,1,0,0,0,0|0,0,1]=3 3450 B7R0.4 CC(C)CNCCS Amb24616771 [1,1,0,0,0,0|0,1,1]=4 3451 B7R0.4 CC(C)COCCS Amb24589392 [1,1,0,0,0,0|0,1,1]=4 3452 B7R0.4 CC(C)CONC=O Amb24524289 [1,1,0,0,0,0|1,0,0]=3 3453 B7R0.4 CC(C)CSCC#C Amb24610491 [1,1,0,0,0,0|1,0,1]=4 3454 B7R0.4 CC(C)C\C=C\C#N Amb25046875 [1,1,0,0,0,0|1,0,1]=4 3455 B7R0.4 CC(C)C\C=C\C=O Amb18641698 [1,1,0,0,0,0|0,0,1]=3 3456 B7R0.4 CC(C)C\C=C\CN Amb24615023 [1,1,0,0,0,0|1,0,1]=4 3457 B7R0.4 CC(C)C\C=C\CO Amb25851501 [1,1,0,0,0,0|0,0,1]=3 3458 B7R0.4 CC(C)NCCC#C Amb18299435 [1,1,0,0,0,0|1,0,1]=4 3459 B7R0.4 CC(C)NCCC#N Amb17720404 [1,1,0,0,0,0|1,0,1]=4 3460 B7R0.4 CC(C)NCCC=C Amb18312589 [1,1,0,0,0,0|1,0,0]=3 3461 B7R0.4 CC(C)NCCCBr Amb24483135 [1,1,0,0,0,0|1,0,1]=4 3462 B7R0.4 CC(C)NCCCCl Amb18124442 [1,1,0,0,0,0|1,0,1]=4 3463 B7R0.4 CC(C)NCCCI Amb24733808 [1,1,0,0,0,0|1,0,1]=4 3464 B7R0.4 CC(C)NCCCO Amb22492397 [1,1,0,0,0,0|0,0,1]=3 3465 B7R0.4 CC(C)NC\C=C\Cl Amb25045079 [1,1,0,0,0,0|1,0,1]=4 3466 B7R0.4 CC(C)NNCCO Amb25740609 [1,1,0,0,0,0|1,0,1]=4 3467 B7R0.4 CC(C)N\C=C/C=O Amb24419139 [1,1,0,0,0,0|0,0,2]=4 3468 B7R0.4 CC(C)OCCCS Amb24551906 [1,1,0,0,0,0|0,1,1]=4 3469 B7R0.4 CC(C)OCCON Amb25113499 [1,1,0,0,0,0|1,0,1]=4 3470 B7R0.4 CC(C)OCN=C=O Amb25766748 [1,1,0,0,0,0|1,0,1]=4 3471 B7R0.4 CC(C)ONCC=C Amb25169539 [1,1,0,0,0,0|2,0,0]=4 3472 B7R0.4 CC(C)O\C=C\C=O Amb24724708 [1,1,0,0,0,0|0,0,2]=4 3473 B7R0.4 CC(C)O\C=C\CO Amb25115938 [1,1,0,0,0,0|1,0,1]=4 3474 B7R0.4 CC(C)SCCCBr Amb19053955 [1,1,0,0,0,0|1,0,1]=4 3475 B7R0.4 CC(C)SCCCCl Amb18179463 [1,1,0,0,0,0|1,0,1]=4 3476 B7R0.4 CC(C)SCCCS Amb24483199 [1,1,0,0,0,0|0,1,1]=4 3477 B7R0.4 CC(C)SCCNN Amb24688364 [1,1,0,0,0,0|2,0,0]=4 3478 B7R0.4 CC(C)\C=C\CCO Amb25117403 [1,1,0,0,0,0|0,0,2]=4 3479 B7R0.4 CC(Cl)CCCCO Amb24532074 [1,1,0,0,0,0|1,0,1]=4 3480 B7R0.4 CC(Cl)COCC=C Amb24739587 [1,1,0,0,0,0|2,0,0]=4 3481 B7R0.4 CC(F)CCCCO Amb24414878 [1,1,0,0,0,0|1,0,1]=4 3482 B7R0.4 CC(F)CCN=C=O Amb25241061 [1,1,0,0,0,0|1,0,1]=4 3483 B7R0.4 CC(F)CNCCO Amb24518852 [1,1,0,0,0,0|1,0,1]=4 3484 B7R0.4 CC(N)CCC=C=C Amb25084412 [1,1,0,0,0,0|2,0,0]=4 3485 B7R0.4 CC(N)CNCC=C Amb18312621 [1,1,0,0,0,0|2,0,0]=4 3486 B7R0.4 CC(N)CNCCO Amb24668970 [1,1,0,0,0,0|1,0,1]=4 3487 B7R0.4 CC(N)CSCC=C Amb25726471 [1,1,0,0,0,0|2,0,0]=4 3488 B7R0.4 CC(N)CSCCO Amb25101466 [1,1,0,0,0,0|1,0,1]=4 3489 B7R0.4 CC(O)CCC=C=C Amb25284488 [1,1,0,0,0,0|2,0,0]=4 3490 B7R0.4 CC(O)CCCC=C Amb22059432 [1,1,0,0,0,0|2,0,0]=4 3491 B7R0.4 CC(O)CCCC=O Amb18641887 [1,1,0,0,0,0|1,0,0]=3 3492 B7R0.4 CC(O)CCCCBr Amb24552945 [1,1,0,0,0,0|1,0,1]=4 3493 B7R0.4 CC(O)CCCCCl Amb24462574 [1,1,0,0,0,0|1,0,1]=4 3494 B7R0.4 CC(O)CCCCO Amb22227757 [1,1,0,0,0,0|1,0,1]=4 3495 B7R0.4 CC(O)CCCON Amb24412992 [1,1,0,0,0,0|1,0,1]=4 3496 B7R0.4 CC(O)CCNC=O Amb24533830 [1,1,0,0,0,0|1,0,0]=3 3497 B7R0.4 CC(O)CCOC=C Amb25739848 [1,1,0,0,0,0|2,0,0]=4 3498 B7R0.4 CC(O)CC\C=C\Br Amb24443050 [1,1,0,0,0,0|2,0,0]=4 3499 B7R0.4 CC(O)COCC=C Amb22733640 [1,1,0,0,0,0|2,0,0]=4 3500 B7R0.4 CC(O)COCCO Amb24590103 [1,1,0,0,0,0|1,0,1]=4 3501 B7R0.4 CC(O)CSCCO Amb22055428 [1,1,0,0,0,0|1,0,1]=4 3502 B7R0.4 CC(O)C\C=C\C=O Amb18641799 [1,1,0,0,0,0|1,0,1]=4 3503 B7R0.4 CC(OCC[N+]#[C-])C Amb1981101 [1,1,0,0,0,0|2,0,0]=4 3504 B7R0.4 CC(S)CNCC=C Amb18642864 [1,1,0,0,0,0|2,0,0]=4 3505 B7R0.4 CC(S)CSCCO Amb24476156 [1,1,0,0,0,0|1,0,1]=4 3506 B7R0.4 CC(SCCC#N)C Amb17307556 [1,1,0,0,0,0|1,0,1]=4 3507 B7R0.4 CC=C=CCC(O)=O Amb25118481 [1,1,0,0,0,0|0,0,2]=4 3508 B7R0.4 CCCC#CC(=O)Cl Amb25250583 [1,1,0,0,0,0|1,0,1]=4 3509 B7R0.4 CCCC=NC(N)=O Amb24411468 [1,1,0,0,0,0|1,0,1]=4 3510 B7R0.4 CCCCC=C(C)C Amb22228888 [1,1,0,0,0,0|2,0,0]=4 3511 B7R0.4 CCCCC=C(F)F Amb10840485 [1,1,0,0,0,0|2,0,0]=4 3512 B7R0.4 CCCCCB(O)O Amb2447470 [1,1,0,0,0,0|1,0,1]=4 3513 B7R0.4 CCCCCC(N)=N Amb19890171 [1,1,0,0,0,0|2,0,0]=4 3514 B7R0.4 CCCCCC(N)O Amb24673933 [1,1,0,0,0,0|1,0,1]=4 3515 B7R0.4 CCCCCC([O-])=O Amb22337624 [1,1,0,0,0,0|0,0,1]=3 3516 B7R0.4 CCCCCC([O-])=O Amb22525161 [1,1,0,0,0,0|0,0,1]=3 3517 B7R0.4 CCCCCC([O-])=O Amb22730527 [1,1,0,0,0,0|0,0,1]=3 3518 B7R0.4 CCCCCC([O-])=O Amb22731343 [1,1,0,0,0,0|0,0,1]=3 3519 B7R0.4 CCCCC[13C](O)=O Amb22353417 [1,1,0,0,0,0|0,0,0]=2 3520 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [1,1,0,0,0,0|1,0,1]=4 3521 B7R0.4 CCCCC[N+]([O-])=O Amb22227991 [1,1,0,0,0,0|1,0,1]=4 3522 B7R0.4 CCCCNC(=N)N Amb16206158 [1,1,0,0,0,0|2,0,0]=4 3523 B7R0.4 CCCCNC(=O)Cl Amb24574309 [1,1,0,0,0,0|1,0,0]=3 3524 B7R0.4 CCCCNC(=S)N Amb1152044 [1,1,0,0,0,0|1,1,0]=4 3525 B7R0.4 CCCCNC(C)=C Amb25291695 [1,1,0,0,0,0|2,0,0]=4 3526 B7R0.4 CCCCNC(C)C Amb2111112 [1,1,0,0,0,0|1,0,1]=4 3527 B7R0.4 CCCCNC(C)O Amb24715795 [1,1,0,0,0,0|1,0,1]=4 3528 B7R0.4 CCCCNC(N)=N Amb19748357 [1,1,0,0,0,0|2,0,0]=4 3529 B7R0.4 CCCCOB(O)O Amb25687500 [1,1,0,0,0,0|1,0,1]=4 3530 B7R0.4 CCCCOC(=O)F Amb24710483 [1,1,0,0,0,0|1,0,0]=3 3531 B7R0.4 CCCCOC(C)=S Amb22230357 [1,1,0,0,0,0|1,1,0]=4 3532 B7R0.4 CCCCOC(N)=N Amb24579254 [1,1,0,0,0,0|2,0,0]=4 3533 B7R0.4 CCCCOC(N)=S Amb24761515 [1,1,0,0,0,0|1,1,0]=4 3534 B7R0.4 CCCCSC(=N)N Amb10552525 [1,1,0,0,0,0|2,0,0]=4 3535 B7R0.4 CCCCSC(=O)C Amb10552685 [1,1,0,0,0,0|1,0,0]=3 3536 B7R0.4 CCCCSC(=O)Cl Amb22352826 [1,1,0,0,0,0|1,0,0]=3 3537 B7R0.4 CCCCSC(N)=O Amb24533653 [1,1,0,0,0,0|1,0,0]=3 3538 B7R0.4 CCCCSC([O-])=S Amb25359489 [1,1,0,0,0,0|0,1,1]=4 3539 B7R0.4 CCCC[13CH2][13C](O)=O Amb22367381 [1,1,0,0,0,0|0,0,0]=2 3540 B7R0.4 CCCNCC(=C)Br Amb18303968 [1,1,0,0,0,0|2,0,0]=4 3541 B7R0.4 CCCNCC(=C)C Amb17308631 [1,1,0,0,0,0|2,0,0]=4 3542 B7R0.4 CCCNCC(=C)Cl Amb19004838 [1,1,0,0,0,0|2,0,0]=4 3543 B7R0.4 CCCNCC(=O)N Amb1124632 [1,1,0,0,0,0|1,0,0]=3 3544 B7R0.4 CCCNCC(=O)O Amb10609640 [1,1,0,0,0,0|0,0,0]=2 3545 B7R0.4 CCCNCC(=O)O Amb1110628 [1,1,0,0,0,0|0,0,0]=2 3546 B7R0.4 CCCNCC(=S)N Amb17231883 [1,1,0,0,0,0|1,1,0]=4 3547 B7R0.4 CCCNCC(C)O Amb22292467 [1,1,0,0,0,0|1,0,1]=4 3548 B7R0.4 CCCNC[C@@H](C)O Amb25042630 [1,1,0,0,0,0|1,0,1]=4 3549 B7R0.4 CCCNC[C@H](C)O Amb24473274 [1,1,0,0,0,0|1,0,1]=4 3550 B7R0.4 CCCOC[C@H](C)O Amb24575974 [1,1,0,0,0,0|1,0,1]=4 3551 B7R0.4 CCCSCC(=C)Br Amb25206483 [1,1,0,0,0,0|2,0,0]=4 3552 B7R0.4 CCCSCC(=C)Cl Amb24476596 [1,1,0,0,0,0|2,0,0]=4 3553 B7R0.4 CCCSCC(=O)O Amb1137113 [1,1,0,0,0,0|0,0,0]=2 3554 B7R0.4 CCCSC[C@H](C)O Amb24526704 [1,1,0,0,0,0|1,0,1]=4 3555 B7R0.4 CCC\C=C/C(=O)C Amb17593161 [1,1,0,0,0,0|1,0,1]=4 3556 B7R0.4 CCC\C=C\C(=C)O Amb24332587 [1,1,0,0,0,0|1,0,1]=4 3557 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [1,1,0,0,0,0|1,0,1]=4 3558 B7R0.4 CCNCCC(=S)N Amb17231882 [1,1,0,0,0,0|1,1,0]=4 3559 B7R0.4 CCNCCC(C)=C Amb18312576 [1,1,0,0,0,0|2,0,0]=4 3560 B7R0.4 CCNCCC(C)=O Amb18641851 [1,1,0,0,0,0|1,0,0]=3 3561 B7R0.4 CCNCCC(N)=N Amb25112934 [1,1,0,0,0,0|2,0,0]=4 3562 B7R0.4 CCNCC[C@H](C)O Amb25757479 [1,1,0,0,0,0|1,0,1]=4 3563 B7R0.4 CCNCNC(C)=O Amb25809446 [1,1,0,0,0,0|2,0,0]=4 3564 B7R0.4 CCNOCC(N)=O Amb24505259 [1,1,0,0,0,0|2,0,0]=4 3565 B7R0.4 CCOCCC(=O)Cl Amb20672027 [1,1,0,0,0,0|1,0,0]=3 3566 B7R0.4 CCOCCS(=O)Cl Amb24625733 [1,1,0,0,0,0|2,0,0]=4 3567 B7R0.4 CCOCCS(C)=O Amb25206909 [1,1,0,0,0,0|2,0,0]=4 3568 B7R0.4 CCOCC[C@@H](C)O Amb24524285 [1,1,0,0,0,0|1,0,1]=4 3569 B7R0.4 CCOCNC(C)=O Amb24334070 [1,1,0,0,0,0|2,0,0]=4 3570 B7R0.4 CCOCNC(N)=O Amb25765493 [1,1,0,0,0,0|2,0,0]=4 3571 B7R0.4 CCOCOC(C)=O Amb25191864 [1,1,0,0,0,0|2,0,0]=4 3572 B7R0.4 CCONCC(N)=O Amb25745510 [1,1,0,0,0,0|2,0,0]=4 3573 B7R0.4 CCSC#CC(O)=O Amb25793529 [1,1,0,0,0,0|0,0,2]=4 3574 B7R0.4 CCSCCC(=S)N Amb17307560 [1,1,0,0,0,0|1,1,0]=4 3575 B7R0.4 CCSCCC(C)=C Amb25236682 [1,1,0,0,0,0|2,0,0]=4 3576 B7R0.4 CCSCCC(C)C Amb22230685 [1,1,0,0,0,0|1,0,1]=4 3577 B7R0.4 CCSSCC(O)=O Amb25233433 [1,1,0,0,0,0|1,0,0]=3 3578 B7R0.4 CCS\C=C/C(O)=O Amb25200140 [1,1,0,0,0,0|0,0,2]=4 3579 B7R0.4 CCS\C=C\C(O)=O Amb18642902 [1,1,0,0,0,0|0,0,2]=4 3580 B7R0.4 CC\C=C\CC(N)=O Amb24595892 [1,1,0,0,0,0|1,0,1]=4 3581 B7R0.4 CN(C)CCCC=O Amb22753951 [1,1,0,0,0,0|1,0,0]=3 3582 B7R0.4 CN(C)CCCC=O Amb24117840 [1,1,0,0,0,0|1,0,0]=3 3583 B7R0.4 CN(C)CCN=C=O Amb19649310 [1,1,0,0,0,0|1,0,1]=4 3584 B7R0.4 CN(C)CCNC=O Amb21858796 [1,1,0,0,0,0|1,0,0]=3 3585 B7R0.4 CN(C)CCOC=C Amb21618684 [1,1,0,0,0,0|2,0,0]=4 3586 B7R0.4 CN(C)CC\C=C/Cl Amb25227494 [1,1,0,0,0,0|2,0,0]=4 3587 B7R0.4 CN(C)C\C=C/C=O Amb24518026 [1,1,0,0,0,0|1,0,1]=4 3588 B7R0.4 CN(C)C\C=C\CO Amb25697504 [1,1,0,0,0,0|1,0,1]=4 3589 B7R0.4 CNCCCC(=O)O Amb1153115 [1,1,0,0,0,0|0,0,0]=2 3590 B7R0.4 CNCCCC(C)=C Amb25742210 [1,1,0,0,0,0|2,0,0]=4 3591 B7R0.4 CNCCCC(N)=O Amb18303611 [1,1,0,0,0,0|1,0,0]=3 3592 B7R0.4 CNCCCC(O)C Amb17569899 [1,1,0,0,0,0|1,0,1]=4 3593 B7R0.4 CNCCCS(O)=O Amb24656214 [1,1,0,0,0,0|1,0,0]=3 3594 B7R0.4 CNCCNC(N)=O Amb18299975 [1,1,0,0,0,0|2,0,0]=4 3595 B7R0.4 CNCCOC(C)=O Amb18124262 [1,1,0,0,0,0|2,0,0]=4 3596 B7R0.4 CNCCOC(C)C Amb19024604 [1,1,0,0,0,0|2,0,0]=4 3597 B7R0.4 CNCCOC(N)=O Amb25136928 [1,1,0,0,0,0|2,0,0]=4 3598 B7R0.4 CNCCSC(C)C Amb19024679 [1,1,0,0,0,0|2,0,0]=4 3599 B7R0.4 CNC\C=C\C(O)=O Amb25368293 [1,1,0,0,0,0|0,0,2]=4 3600 B7R0.4 COCCCC(=O)Cl Amb24481572 [1,1,0,0,0,0|1,0,0]=3 3601 B7R0.4 COCCCC(C)Br Amb18185551 [1,1,0,0,0,0|1,0,1]=4 3602 B7R0.4 COCCCC(C)S Amb25810805 [1,1,0,0,0,0|1,0,1]=4 3603 B7R0.4 COCCCC(N)=N Amb19269156 [1,1,0,0,0,0|2,0,0]=4 3604 B7R0.4 COCCCC(N)=O Amb24670109 [1,1,0,0,0,0|1,0,0]=3 3605 B7R0.4 COCCC[C@@H](C)N Amb24749054 [1,1,0,0,0,0|1,0,1]=4 3606 B7R0.4 COCCNC(=O)N Amb1104938 [1,1,0,0,0,0|2,0,0]=4 3607 B7R0.4 COCCOC(N)=O Amb25054225 [1,1,0,0,0,0|2,0,0]=4 3608 B7R0.4 COCCSC(C)C Amb24333320 [1,1,0,0,0,0|1,0,1]=4 3609 B7R0.4 COCSCC(C)=O Amb24717297 [1,1,0,0,0,0|2,0,0]=4 3610 B7R0.4 COC\C=C\C(O)=O Amb18296423 [1,1,0,0,0,0|0,0,2]=4 3611 B7R0.4 CON=CCC(C)C Amb25315521 [1,1,0,0,0,0|1,0,1]=4 3612 B7R0.4 CONCCC(C)=O Amb25342369 [1,1,0,0,0,0|2,0,0]=4 3613 B7R0.4 CONCCC(C)C Amb20669574 [1,1,0,0,0,0|1,0,0]=3 3614 B7R0.4 CONCCC(C)C Amb22058740 [1,1,0,0,0,0|1,0,0]=3 3615 B7R0.4 CONCCC(N)=O Amb24481431 [1,1,0,0,0,0|2,0,0]=4 3616 B7R0.4 CONCCC(O)=O Amb24441275 [1,1,0,0,0,0|1,0,0]=3 3617 B7R0.4 CONCCN(C)C Amb24481430 [1,1,0,0,0,0|2,0,0]=4 3618 B7R0.4 CO\C=C\CC(O)=O Amb25174889 [1,1,0,0,0,0|0,0,2]=4 3619 B7R0.4 CS(=O)CCNC=O Amb24350245 [1,1,0,0,0,0|2,0,0]=4 3620 B7R0.4 CSCCCC(=O)O Amb17503622 [1,1,0,0,0,0|0,0,0]=2 3621 B7R0.4 CSCCCC(C)=O Amb25122381 [1,1,0,0,0,0|1,0,0]=3 3622 B7R0.4 CSCCCC(N)=O Amb19129736 [1,1,0,0,0,0|1,0,0]=3 3623 B7R0.4 CSCCNC(C)C Amb18523836 [1,1,0,0,0,0|2,0,0]=4 3624 B7R0.4 CSCCOC(=O)Cl Amb25857013 [1,1,0,0,0,0|2,0,0]=4 3625 B7R0.4 CSCCSC(C)C Amb25041305 [1,1,0,0,0,0|2,0,0]=4 3626 B7R0.4 CSC\C=C\C(O)=O Amb18291627 [1,1,0,0,0,0|0,0,2]=4 3627 B7R0.4 C[C@@H](O)CCC=C=C Amb25134224 [1,1,0,0,0,0|2,0,0]=4 3628 B7R0.4 C[C@@H](O)CCCC=O Amb22896885 [1,1,0,0,0,0|1,0,0]=3 3629 B7R0.4 C[C@@H](O)CCCCN Amb22896886 [1,1,0,0,0,0|1,0,1]=4 3630 B7R0.4 C[C@@H](O)CSCCO Amb24643786 [1,1,0,0,0,0|1,0,1]=4 3631 B7R0.4 C[C@@H](O)C\C=C\C=O Amb25310809 [1,1,0,0,0,0|1,0,1]=4 3632 B7R0.4 C[C@@H](O)C\C=C\CO Amb25852295 [1,1,0,0,0,0|1,0,1]=4 3633 B7R0.4 C[C@H](N)CSCCO Amb24434353 [1,1,0,0,0,0|1,0,1]=4 3634 B7R0.4 C[C@H](O)CCCC=C Amb24704360 [1,1,0,0,0,0|2,0,0]=4 3635 B7R0.4 C[C@H](O)CCCCCl Amb25715881 [1,1,0,0,0,0|1,0,1]=4 3636 B7R0.4 C[Se]CCCC(O)=O Amb22347334 [1,1,0,0,0,0|0,0,0]=2 3637 B7R0.4 C\C(\F)=C\CCC=O Amb25290222 [1,1,0,0,0,0|1,0,1]=4 3638 B7R0.4 C\C=C/CCC(C)=O Amb24333832 [1,1,0,0,0,0|1,0,1]=4 3639 B7R0.4 C\C=C/CC[C@H](C)N Amb24617340 [1,1,0,0,0,0|2,0,0]=4 3640 B7R0.4 C\C=C\CCC(=O)Cl Amb25246754 [1,1,0,0,0,0|1,0,1]=4 3641 B7R0.4 C\C=C\CCC(=O)O Amb10071500 [1,1,0,0,0,0|0,0,1]=3 3642 B7R0.4 C\C=C\CCC(C)C Amb24401080 [1,1,0,0,0,0|1,0,0]=3 3643 B7R0.4 C\C=C\CCC(N)=O Amb25343167 [1,1,0,0,0,0|1,0,1]=4 3644 B7R0.4 C\C=C\CNC(C)C Amb18641745 [1,1,0,0,0,0|1,0,1]=4 3645 B7R0.4 ClCCCOC(=O)Cl Amb10844795 [1,1,0,0,0,0|2,0,0]=4 3646 B7R0.4 ClCCNCC(C)C Amb17334145 [1,1,0,0,0,0|1,0,1]=4 3647 B7R0.4 ClCCOCC(=O)Cl Amb17610887 [1,1,0,0,0,0|2,0,0]=4 3648 B7R0.4 N#CCCCC(=O)C Amb17106756 [1,1,0,0,0,0|1,0,1]=4 3649 B7R0.4 N#CCCCC(O)=O Amb18560874 [1,1,0,0,0,0|0,0,1]=3 3650 B7R0.4 N#CSCCC(O)=O Amb24481186 [1,1,0,0,0,0|1,0,1]=4 3651 B7R0.4 NC(=O)CCCC#N Amb25337207 [1,1,0,0,0,0|1,0,1]=4 3652 B7R0.4 NC(=O)CCCCI Amb25788033 [1,1,0,0,0,0|1,0,0]=3 3653 B7R0.4 NC(=O)CNCCF Amb24443361 [1,1,0,0,0,0|2,0,0]=4 3654 B7R0.4 NC(=O)COCCBr Amb25133475 [1,1,0,0,0,0|2,0,0]=4 3655 B7R0.4 NC(=O)CSCCCl Amb25846245 [1,1,0,0,0,0|2,0,0]=4 3656 B7R0.4 NC(=O)OCCCCl Amb24635478 [1,1,0,0,0,0|2,0,0]=4 3657 B7R0.4 NC(=O)SCCCCl Amb24481372 [1,1,0,0,0,0|2,0,0]=4 3658 B7R0.4 NC(=S)CCCCCl Amb25177620 [1,1,0,0,0,0|1,1,0]=4 3659 B7R0.4 NC(=S)CCCCF Amb24613464 [1,1,0,0,0,0|1,1,0]=4 3660 B7R0.4 NCCCCC(N)=N Amb25714813 [1,1,0,0,0,0|2,0,0]=4 3661 B7R0.4 NCCCCC(N)=O Amb18641897 [1,1,0,0,0,0|1,0,0]=3 3662 B7R0.4 NCCCCC(N)=S Amb24481404 [1,1,0,0,0,0|1,1,0]=4 3663 B7R0.4 NCCCCC(N)O Amb24333310 [1,1,0,0,0,0|1,0,1]=4 3664 B7R0.4 NCCCCC(O)C Amb17569903 [1,1,0,0,0,0|1,0,1]=4 3665 B7R0.4 NCCCCC([O-])=O Amb22753853 [1,1,0,0,0,0|0,0,1]=3 3666 B7R0.4 NCCCCP(O)=O Amb24520720 [1,1,0,0,0,0|1,0,0]=3 3667 B7R0.4 NCCCCS(=O)C Amb17617794 [1,1,0,0,0,0|2,0,0]=4 3668 B7R0.4 NCCCNC(N)=O Amb18296186 [1,1,0,0,0,0|2,0,0]=4 3669 B7R0.4 NCCCNC(N)=O Amb20622408 [1,1,0,0,0,0|2,0,0]=4 3670 B7R0.4 NCCCNC(O)=O Amb24093884 [1,1,0,0,0,0|1,0,0]=3 3671 B7R0.4 NCCCSC(C)C Amb10075505 [1,1,0,0,0,0|1,0,1]=4 3672 B7R0.4 NCCNCC(=O)O Amb17608063 [1,1,0,0,0,0|1,0,0]=3 3673 B7R0.4 NCCNCC(C)C Amb17091016 [1,1,0,0,0,0|1,0,1]=4 3674 B7R0.4 NCCNCC(O)=O Amb19958818 [1,1,0,0,0,0|1,0,0]=3 3675 B7R0.4 NCCOCC(C)C Amb10609251 [1,1,0,0,0,0|1,0,1]=4 3676 B7R0.4 NCCOCC(N)=O Amb18523830 [1,1,0,0,0,0|2,0,0]=4 3677 B7R0.4 NCCOCC(N)=O Amb20631066 [1,1,0,0,0,0|2,0,0]=4 3678 B7R0.4 NCCOCC(O)=O Amb18630146 [1,1,0,0,0,0|1,0,0]=3 3679 B7R0.4 NCCOCC(O)=O Amb22751540 [1,1,0,0,0,0|1,0,0]=3 3680 B7R0.4 NCCSCC(=O)C Amb17500454 [1,1,0,0,0,0|2,0,0]=4 3681 B7R0.4 NCCSCC(=O)O Amb17500446 [1,1,0,0,0,0|1,0,0]=3 3682 B7R0.4 NCCSCC(O)=O Amb20622325 [1,1,0,0,0,0|1,0,0]=3 3683 B7R0.4 NCC\C=C\C(O)=O Amb25266868 [1,1,0,0,0,0|0,0,2]=4 3684 B7R0.4 NC\C=C\CC(O)=O Amb18641825 [1,1,0,0,0,0|0,0,2]=4 3685 B7R0.4 NNCCCC(O)=O Amb24455803 [1,1,0,0,0,0|1,0,0]=3 3686 B7R0.4 NOCCCC(=O)O Amb10975956 [1,1,0,0,0,0|1,0,0]=3 3687 B7R0.4 NOCCCC(O)=O Amb22011795 [1,1,0,0,0,0|1,0,0]=3 3688 B7R0.4 NOCCCN(C)C Amb17104868 [1,1,0,0,0,0|1,0,1]=4 3689 B7R0.4 O=C(Cl)OCCCBr Amb25137067 [1,1,0,0,0,0|2,0,0]=4 3690 B7R0.4 O=C(F)CCCCCl Amb24472276 [1,1,0,0,0,0|1,0,0]=3 3691 B7R0.4 O=C(F)OCCCCl Amb25122991 [1,1,0,0,0,0|2,0,0]=4 3692 B7R0.4 O=CCCC=C(C)C Amb17593168 [1,1,0,0,0,0|0,0,1]=3 3693 B7R0.4 O=CCCCC(=O)O Amb17593198 [1,1,0,0,0,0|0,0,1]=3 3694 B7R0.4 O=CCCCC(F)F Amb25243487 [1,1,0,0,0,0|2,0,0]=4 3695 B7R0.4 O=CCCNC(=O)C Amb17102165 [1,1,0,0,0,0|1,0,1]=4 3696 B7R0.4 OB(O)CCCCBr Amb20171450 [1,1,0,0,0,0|1,0,1]=4 3697 B7R0.4 OB(O)CCCCCl Amb25184744 [1,1,0,0,0,0|1,0,1]=4 3698 B7R0.4 OC(=O)CCC=C=C Amb10605299 [1,1,0,0,0,0|0,0,2]=4 3699 B7R0.4 OC(=O)CCN=C=S Amb24562253 [1,1,0,0,0,0|1,0,1]=4 3700 B7R0.4 OC(=O)CCNC=O Amb18290434 [1,1,0,0,0,0|1,0,1]=4 3701 B7R0.4 OC(=O)CC\C=C\Br Amb25238247 [1,1,0,0,0,0|0,0,2]=4 3702 B7R0.4 OC(=O)CC\C=C\Cl Amb25803087 [1,1,0,0,0,0|0,0,2]=4 3703 B7R0.4 OC(=O)CNCCS Amb18124468 [1,1,0,0,0,0|1,0,0]=3 3704 B7R0.4 OC(=O)COCCBr Amb24057760 [1,1,0,0,0,0|1,0,0]=3 3705 B7R0.4 OC(=O)COCCCl Amb21857870 [1,1,0,0,0,0|1,0,0]=3 3706 B7R0.4 OC(=O)CSCC=O Amb24628311 [1,1,0,0,0,0|1,0,1]=4 3707 B7R0.4 OC(=O)CSCCCl Amb18644703 [1,1,0,0,0,0|1,0,0]=3 3708 B7R0.4 OC(=O)CSCCS Amb24711400 [1,1,0,0,0,0|1,0,0]=3 3709 B7R0.4 OC(=O)C\C=C/CS Amb18124361 [1,1,0,0,0,0|0,0,2]=4 3710 B7R0.4 OC(=O)C\C=C\CBr Amb18125611 [1,1,0,0,0,0|0,0,2]=4 3711 B7R0.4 OC(=O)C\C=C\CCl Amb18124409 [1,1,0,0,0,0|0,0,2]=4 3712 B7R0.4 OC(=O)C\C=C\CS Amb24693621 [1,1,0,0,0,0|0,0,2]=4 3713 B7R0.4 OC(=O)\C=C\CCBr Amb25702661 [1,1,0,0,0,0|0,0,2]=4 3714 B7R0.4 OCC#CCC(O)=O Amb24395623 [1,1,0,0,0,0|0,0,2]=4 3715 B7R0.4 OCCC#CC(O)=O Amb25844914 [1,1,0,0,0,0|0,0,2]=4 3716 B7R0.4 OCCCCB(O)O Amb25351122 [1,1,0,0,0,0|1,0,1]=4 3717 B7R0.4 OCCCCC(=O)C Amb10603864 [1,1,0,0,0,0|1,0,0]=3 3718 B7R0.4 OCCCCC(=O)[O-] Amb13952763 [1,1,0,0,0,0|0,0,1]=3 3719 B7R0.4 OCCCCC(N)C Amb17569907 [1,1,0,0,0,0|1,0,1]=4 3720 B7R0.4 OCCCCC(O)=O Amb22351244 [1,1,0,0,0,0|0,0,0]=2 3721 B7R0.4 OCCCCC(O)O Amb25204642 [1,1,0,0,0,0|0,0,2]=4 3722 B7R0.4 OCCCC[C@H](O)C Amb10605245 [1,1,0,0,0,0|1,0,1]=4 3723 B7R0.4 OCCCOC(C)C Amb10608350 [1,1,0,0,0,0|0,0,1]=3 3724 B7R0.4 OCCCSC(C)C Amb17502841 [1,1,0,0,0,0|0,0,1]=3 3725 B7R0.4 OCCSCC(=O)O Amb1110090 [1,1,0,0,0,0|1,0,0]=3 3726 B7R0.4 OCC\C=C\C(O)=O Amb21929352 [1,1,0,0,0,0|0,0,2]=4 3727 B7R0.4 OP(=O)OCCCCl Amb24562481 [1,1,0,0,0,0|2,0,0]=4 3728 B7R0.4 SCCCCC(=O)O Amb17503767 [1,1,0,0,0,0|0,0,0]=2 3729 B7R0.4 [N-]=[N+]=NCCC(O)=O Amb20622326 [1,1,0,0,0,0|2,0,0]=4 3730 B7R0.4 [O-]C(=O)CCCCO Amb22749314 [1,1,0,0,0,0|0,0,1]=3 3731 B7R0.4 [O-][N+](=O)CCCCO Amb25739830 [1,1,0,0,0,0|1,0,1]=4 3732 B7R0.4 [O-][N+](=O)NCCCC Amb10552431 [1,1,0,0,0,0|1,0,1]=4 3733 B7R0.4 [O-][N+](=O)OCCCC Amb17610378 [1,1,0,0,0,0|1,0,1]=4 3734 B7R0.4 [S-]C(=S)OCCCC Amb16186572 [1,1,0,0,0,0|0,2,0]=4 3735 B7R0.5 C#CCC(N)C(O)=O Amb19944472 [1,1,0,0,0,0|0,0,2]=4 3736 B7R0.5 C#CC[C@@H](N)C(O)=O Amb22748688 [1,1,0,0,0,0|0,0,2]=4 3737 B7R0.5 C#CC[C@@H](O)C(O)=O Amb25189884 [1,1,0,0,0,0|0,0,2]=4 3738 B7R0.5 C=CCC(Br)C(O)=O Amb18648213 [1,1,0,0,0,0|0,0,2]=4 3739 B7R0.5 C=CCC(Cl)C(O)=O Amb25056173 [1,1,0,0,0,0|0,0,2]=4 3740 B7R0.5 C=CCC(N)C(O)=O Amb21856826 [1,1,0,0,0,0|0,0,2]=4 3741 B7R0.5 C=CC[C@@H](F)C(O)=O Amb24481338 [1,1,0,0,0,0|0,0,2]=4 3742 B7R0.5 C=CC[C@@H](N)C(O)=O Amb22745310 [1,1,0,0,0,0|0,0,2]=4 3743 B7R0.5 C=CC[C@@H](O)C(O)=O Amb24548731 [1,1,0,0,0,0|0,0,2]=4 3744 B7R0.5 CC#CC(C)C(O)=O Amb22748425 [1,1,0,0,0,0|0,0,2]=4 3745 B7R0.5 CC(=C)C(O)CC=O Amb24481571 [1,1,0,0,0,0|0,0,2]=4 3746 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [1,1,0,0,0,0|1,0,1]=4 3747 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [1,1,0,0,0,0|2,0,0]=4 3748 B7R0.5 CC(=O)C(N)CCO Amb25087112 [1,1,0,0,0,0|2,0,0]=4 3749 B7R0.5 CC(=O)C(O)CCS Amb24516694 [1,1,0,0,0,0|2,0,0]=4 3750 B7R0.5 CC(=O)C(S)CCO Amb25831127 [1,1,0,0,0,0|2,0,0]=4 3751 B7R0.5 CC(=O)[C@@H](O)CC=O Amb25839860 [1,1,0,0,0,0|1,0,1]=4 3752 B7R0.5 CC(C(=O)C)CCO Amb13881368 [1,1,0,0,0,0|2,0,0]=4 3753 B7R0.5 CC(C(=O)O)CC#N Amb17334056 [1,1,0,0,0,0|1,0,1]=4 3754 B7R0.5 CC(C(=O)O)CNC Amb13952364 [1,1,0,0,0,0|1,0,0]=3 3755 B7R0.5 CC(C)C(=C)CCO Amb24468914 [1,1,0,0,0,0|0,0,2]=4 3756 B7R0.5 CC(C)C(=O)CC=O Amb25771325 [1,1,0,0,0,0|0,0,1]=3 3757 B7R0.5 CC(C)C(=O)CCO Amb20669209 [1,1,0,0,0,0|0,0,2]=4 3758 B7R0.5 CC(C)C(=O)OC=O Amb25207900 [1,1,0,0,0,0|1,0,1]=4 3759 B7R0.5 CC(C)C(Br)CCBr Amb23455600 [1,1,0,0,0,0|1,0,1]=4 3760 B7R0.5 CC(C)C(Br)CCC Amb18184742 [1,1,0,0,0,0|1,0,1]=4 3761 B7R0.5 CC(C)C(Br)\C=C\C Amb24333001 [1,1,0,0,0,0|1,0,1]=4 3762 B7R0.5 CC(C)C(C)=CC=O Amb24716010 [1,1,0,0,0,0|0,0,2]=4 3763 B7R0.5 CC(C)C(C)CC=C Amb22229588 [1,1,0,0,0,0|1,0,0]=3 3764 B7R0.5 CC(C)C(C)CC=O Amb18641816 [1,1,0,0,0,0|0,0,0]=2 3765 B7R0.5 CC(C)C(C)CCBr Amb24425543 [1,1,0,0,0,0|1,0,1]=4 3766 B7R0.5 CC(C)C(C)CCCl Amb25315867 [1,1,0,0,0,0|1,0,1]=4 3767 B7R0.5 CC(C)C(C)CCN Amb18293552 [1,1,0,0,0,0|1,0,1]=4 3768 B7R0.5 CC(C)C(C)CNC Amb18523788 [1,1,0,0,0,0|2,0,0]=4 3769 B7R0.5 CC(C)C(C)CNO Amb24747759 [1,1,0,0,0,0|1,0,0]=3 3770 B7R0.5 CC(C)C(C)N=C=O Amb25235166 [1,1,0,0,0,0|1,0,1]=4 3771 B7R0.5 CC(C)C(C)NC=O Amb24631907 [1,1,0,0,0,0|1,0,0]=3 3772 B7R0.5 CC(C)C(C)OC=C Amb24483239 [1,1,0,0,0,0|2,0,0]=4 3773 B7R0.5 CC(C)C(Cl)=CC=O Amb24483105 [1,1,0,0,0,0|0,0,2]=4 3774 B7R0.5 CC(C)C(Cl)CC=C Amb24624776 [1,1,0,0,0,0|1,0,0]=3 3775 B7R0.5 CC(C)C(Cl)CCO Amb25108657 [1,1,0,0,0,0|0,0,1]=3 3776 B7R0.5 CC(C)C(Cl)COC Amb25211240 [1,1,0,0,0,0|2,0,0]=4 3777 B7R0.5 CC(C)C(Cl)CSC Amb24650486 [1,1,0,0,0,0|2,0,0]=4 3778 B7R0.5 CC(C)C(Cl)OC=O Amb24533537 [1,1,0,0,0,0|1,0,0]=3 3779 B7R0.5 CC(C)C(Cl)\C=C\C Amb24633838 [1,1,0,0,0,0|1,0,1]=4 3780 B7R0.5 CC(C)C(F)CC#N Amb25298218 [1,1,0,0,0,0|1,0,1]=4 3781 B7R0.5 CC(C)C(F)CCN Amb25356457 [1,1,0,0,0,0|1,0,1]=4 3782 B7R0.5 CC(C)C(N)C=CC Amb23536816 [1,1,0,0,0,0|1,0,1]=4 3783 B7R0.5 CC(C)C(N)CC#C Amb18959774 [1,1,0,0,0,0|1,0,1]=4 3784 B7R0.5 CC(C)C(N)CC=C Amb18292096 [1,1,0,0,0,0|1,0,0]=3 3785 B7R0.5 CC(C)C(N)CCBr Amb25796417 [1,1,0,0,0,0|1,0,1]=4 3786 B7R0.5 CC(C)C(N)CCCl Amb25189909 [1,1,0,0,0,0|1,0,1]=4 3787 B7R0.5 CC(C)C(N)CCN Amb24533844 [1,1,0,0,0,0|1,0,1]=4 3788 B7R0.5 CC(C)C(N)CNC Amb18290164 [1,1,0,0,0,0|2,0,0]=4 3789 B7R0.5 CC(C)C(N)COC Amb18202679 [1,1,0,0,0,0|2,0,0]=4 3790 B7R0.5 CC(C)C(N)COC Amb21954041 [1,1,0,0,0,0|2,0,0]=4 3791 B7R0.5 CC(C)C(N)CSC Amb18995347 [1,1,0,0,0,0|2,0,0]=4 3792 B7R0.5 CC(C)C(N)NC=O Amb25804048 [1,1,0,0,0,0|1,0,0]=3 3793 B7R0.5 CC(C)C(N)\C=C\C Amb24473868 [1,1,0,0,0,0|1,0,1]=4 3794 B7R0.5 CC(C)C(N)\C=C\I Amb25731035 [1,1,0,0,0,0|1,0,1]=4 3795 B7R0.5 CC(C)C(O)CC#C Amb20623629 [1,1,0,0,0,0|1,0,1]=4 3796 B7R0.5 CC(C)C(O)CC=C Amb22052662 [1,1,0,0,0,0|1,0,0]=3 3797 B7R0.5 CC(C)C(O)CC=O Amb24584440 [1,1,0,0,0,0|0,0,0]=2 3798 B7R0.5 CC(C)C(O)CCCl Amb24643325 [1,1,0,0,0,0|1,0,1]=4 3799 B7R0.5 CC(C)C(O)CNC Amb18523805 [1,1,0,0,0,0|2,0,0]=4 3800 B7R0.5 CC(C)C(O)CNN Amb25746156 [1,1,0,0,0,0|2,0,0]=4 3801 B7R0.5 CC(C)C(O)COC Amb20623562 [1,1,0,0,0,0|2,0,0]=4 3802 B7R0.5 CC(C)C(O)\C=C\C Amb22231665 [1,1,0,0,0,0|1,0,1]=4 3803 B7R0.5 CC(C)C(S)CCO Amb24752250 [1,1,0,0,0,0|0,0,1]=3 3804 B7R0.5 CC(C)C(S)COC Amb25809664 [1,1,0,0,0,0|2,0,0]=4 3805 B7R0.5 CC(C)N(C)CC=O Amb24372300 [1,1,0,0,0,0|1,0,0]=3 3806 B7R0.5 CC(C)N(N)CCO Amb24483202 [1,1,0,0,0,0|1,0,1]=4 3807 B7R0.5 CC(C)[C@@H](C)N=C=O Amb22045305 [1,1,0,0,0,0|1,0,1]=4 3808 B7R0.5 CC(C)[C@@H](N)CC#N Amb25771100 [1,1,0,0,0,0|1,0,1]=4 3809 B7R0.5 CC(C)[C@@H](N)CC=C Amb22831776 [1,1,0,0,0,0|1,0,0]=3 3810 B7R0.5 CC(C)[C@@H](N)CNC Amb24534039 [1,1,0,0,0,0|2,0,0]=4 3811 B7R0.5 CC(C)[C@@H](N)COC Amb18016631 [1,1,0,0,0,0|2,0,0]=4 3812 B7R0.5 CC(C)[C@@H](O)CC=C Amb25203918 [1,1,0,0,0,0|1,0,0]=3 3813 B7R0.5 CC(C)[C@@H](O)CCC Amb25043106 [1,1,0,0,0,0|1,0,1]=4 3814 B7R0.5 CC(C)[C@@H](O)CCN Amb24474145 [1,1,0,0,0,0|1,0,1]=4 3815 B7R0.5 CC(C)[C@@H](O)CCO Amb25136289 [1,1,0,0,0,0|0,0,1]=3 3816 B7R0.5 CC(C)[C@@H](O)\C=C\C Amb25316008 [1,1,0,0,0,0|1,0,1]=4 3817 B7R0.5 CC(C)[C@@H](S)CCO Amb24576998 [1,1,0,0,0,0|0,0,1]=3 3818 B7R0.5 CC(C)[C@H](C)CC=O Amb25253560 [1,1,0,0,0,0|0,0,0]=2 3819 B7R0.5 CC(C)[C@H](C)N=C=O Amb22053850 [1,1,0,0,0,0|1,0,1]=4 3820 B7R0.5 CC(C)[C@H](N)CC#N Amb25727691 [1,1,0,0,0,0|1,0,1]=4 3821 B7R0.5 CC(C)[C@H](N)CCCl Amb24760816 [1,1,0,0,0,0|1,0,1]=4 3822 B7R0.5 CC(C)[C@H](N)CNC Amb25063840 [1,1,0,0,0,0|2,0,0]=4 3823 B7R0.5 CC(C)[C@H](N)\C=C\I Amb25821343 [1,1,0,0,0,0|1,0,1]=4 3824 B7R0.5 CC(C)[C@H](O)CC=C Amb25730329 [1,1,0,0,0,0|1,0,0]=3 3825 B7R0.5 CC(C)[C@H](O)CC=O Amb24481570 [1,1,0,0,0,0|0,0,0]=2 3826 B7R0.5 CC(C)[C@H](O)CCC Amb25693041 [1,1,0,0,0,0|1,0,1]=4 3827 B7R0.5 CC(C)[C@H](O)CCO Amb25169342 [1,1,0,0,0,0|0,0,1]=3 3828 B7R0.5 CC(C)\C(\C)=C\C=O Amb18641697 [1,1,0,0,0,0|0,0,2]=4 3829 B7R0.5 CC(CC#C)C(O)=O Amb18633959 [1,1,0,0,0,0|0,0,2]=4 3830 B7R0.5 CC(CC=C)C(C)Br Amb25225842 [1,1,0,0,0,0|2,0,0]=4 3831 B7R0.5 CC(CC=C)C(C)Cl Amb24483218 [1,1,0,0,0,0|2,0,0]=4 3832 B7R0.5 CC(CC=C)C(C)N Amb25727321 [1,1,0,0,0,0|2,0,0]=4 3833 B7R0.5 CC(CC=O)C(C)=O Amb18641772 [1,1,0,0,0,0|1,0,1]=4 3834 B7R0.5 CC(CC=O)N(C)C Amb18203067 [1,1,0,0,0,0|1,0,0]=3 3835 B7R0.5 CC(CCBr)C(=O)Cl Amb25798925 [1,1,0,0,0,0|2,0,0]=4 3836 B7R0.5 CC(CCC)C(O)O Amb25380752 [1,1,0,0,0,0|0,0,2]=4 3837 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [1,1,0,0,0,0|2,0,0]=4 3838 B7R0.5 CC(CCCl)C(=O)F Amb25839945 [1,1,0,0,0,0|2,0,0]=4 3839 B7R0.5 CC(CCF)C(O)=O Amb24678386 [1,1,0,0,0,0|1,0,0]=3 3840 B7R0.5 CC(CCN)C(C)=O Amb18251071 [1,1,0,0,0,0|2,0,0]=4 3841 B7R0.5 CC(CCN)C(N)=O Amb18641900 [1,1,0,0,0,0|2,0,0]=4 3842 B7R0.5 CC(CCN)C(O)=O Amb20667970 [1,1,0,0,0,0|1,0,0]=3 3843 B7R0.5 CC(CCO)C(C)N Amb23555790 [1,1,0,0,0,0|1,0,1]=4 3844 B7R0.5 CC(CCO)C(O)=O Amb18641949 [1,1,0,0,0,0|1,0,0]=3 3845 B7R0.5 CC(CCS)C(O)=O Amb25133689 [1,1,0,0,0,0|1,0,0]=3 3846 B7R0.5 CC(Cl)C(C)CCO Amb24563830 [1,1,0,0,0,0|1,0,1]=4 3847 B7R0.5 CC(N)C(O)CC=C Amb18124257 [1,1,0,0,0,0|2,0,0]=4 3848 B7R0.5 CC(NC=O)C(C)O Amb25347778 [1,1,0,0,0,0|2,0,0]=4 3849 B7R0.5 CC(O)C(Cl)CC=C Amb25109284 [1,1,0,0,0,0|2,0,0]=4 3850 B7R0.5 CC(O)C(Cl)CCC Amb25700952 [1,1,0,0,0,0|1,0,1]=4 3851 B7R0.5 CC(O)C(N)CCC Amb24656798 [1,1,0,0,0,0|1,0,1]=4 3852 B7R0.5 CC(O)C(O)CC=C Amb24734248 [1,1,0,0,0,0|2,0,0]=4 3853 B7R0.5 CC(O)C(O)CC=O Amb25745503 [1,1,0,0,0,0|1,0,0]=3 3854 B7R0.5 CC(O)C(O)CCO Amb25851421 [1,1,0,0,0,0|1,0,1]=4 3855 B7R0.5 CC(O)[C@@H](C)CCO Amb24431016 [1,1,0,0,0,0|1,0,1]=4 3856 B7R0.5 CC(O)[C@@H](N)CC=C Amb24367846 [1,1,0,0,0,0|2,0,0]=4 3857 B7R0.5 CC(O)[C@H](N)CC=C Amb25336245 [1,1,0,0,0,0|2,0,0]=4 3858 B7R0.5 CCCC(=C)C(=O)Cl Amb25081936 [1,1,0,0,0,0|1,0,1]=4 3859 B7R0.5 CCCC(=C)C(N)=O Amb25189878 [1,1,0,0,0,0|1,0,1]=4 3860 B7R0.5 CCCC(=C)C(O)=O Amb18641779 [1,1,0,0,0,0|0,0,1]=3 3861 B7R0.5 CCCC(=O)C(=O)Cl Amb24690783 [1,1,0,0,0,0|1,0,1]=4 3862 B7R0.5 CCCC(=O)C(N)=O Amb24473081 [1,1,0,0,0,0|1,0,1]=4 3863 B7R0.5 CCCC(=O)C(O)=O Amb22347924 [1,1,0,0,0,0|0,0,1]=3 3864 B7R0.5 CCCC(=O)C(O)=O Amb22733540 [1,1,0,0,0,0|0,0,1]=3 3865 B7R0.5 CCCC(Br)C(=O)Br Amb24369503 [1,1,0,0,0,0|1,0,0]=3 3866 B7R0.5 CCCC(Br)C(N)=S Amb25805593 [1,1,0,0,0,0|1,1,0]=4 3867 B7R0.5 CCCC(Br)[N+]([O-])=O Amb17949822 [1,1,0,0,0,0|1,0,1]=4 3868 B7R0.5 CCCC(C(=O)Cl)Br Amb17569837 [1,1,0,0,0,0|1,0,0]=3 3869 B7R0.5 CCCC(C(=O)O)Cl Amb17593470 [1,1,0,0,0,0|0,0,0]=2 3870 B7R0.5 CCCC(C(=O)O)O Amb2582532 [1,1,0,0,0,0|0,0,0]=2 3871 B7R0.5 CCCC(C)C(C)=C Amb22730210 [1,1,0,0,0,0|2,0,0]=4 3872 B7R0.5 CCCC(C)C(N)=S Amb25138492 [1,1,0,0,0,0|1,1,0]=4 3873 B7R0.5 CCCC(C)[N+]([O-])=O Amb17940330 [1,1,0,0,0,0|1,0,1]=4 3874 B7R0.5 CCCC(Cl)C(N)=O Amb25024550 [1,1,0,0,0,0|1,0,0]=3 3875 B7R0.5 CCCC(Cl)S(C)=O Amb25101399 [1,1,0,0,0,0|2,0,0]=4 3876 B7R0.5 CCCC(F)C(O)=O Amb25842008 [1,1,0,0,0,0|0,0,0]=2 3877 B7R0.5 CCCC(N)C(=O)S Amb25378817 [1,1,0,0,0,0|0,1,0]=3 3878 B7R0.5 CCCC(N)C(C)=C Amb24643425 [1,1,0,0,0,0|2,0,0]=4 3879 B7R0.5 CCCC(N)C(N)=O Amb22284825 [1,1,0,0,0,0|1,0,0]=3 3880 B7R0.5 CCCC(N)P(O)O Amb24401110 [1,1,0,0,0,0|1,0,1]=4 3881 B7R0.5 CCCC(O)C(=C)Cl Amb25346262 [1,1,0,0,0,0|2,0,0]=4 3882 B7R0.5 CCCC(O)C(C)=C Amb25141736 [1,1,0,0,0,0|2,0,0]=4 3883 B7R0.5 CCCC(O)C(C)=O Amb22495823 [1,1,0,0,0,0|1,0,0]=3 3884 B7R0.5 CCCC(O)C(N)=O Amb24116553 [1,1,0,0,0,0|1,0,0]=3 3885 B7R0.5 CCCC(O)C([O-])=O Amb22731263 [1,1,0,0,0,0|0,0,1]=3 3886 B7R0.5 CCCC(O)P(O)=O Amb25143218 [1,1,0,0,0,0|1,0,0]=3 3887 B7R0.5 CCCC(S)C(C)=O Amb24689502 [1,1,0,0,0,0|1,0,0]=3 3888 B7R0.5 CCCC(S)C(O)=O Amb18124440 [1,1,0,0,0,0|0,0,0]=2 3889 B7R0.5 CCCN(C)C(C)=O Amb24451102 [1,1,0,0,0,0|2,0,0]=4 3890 B7R0.5 CCC[C@@H](C)C(C)=O Amb24631887 [1,1,0,0,0,0|1,0,0]=3 3891 B7R0.5 CCC[C@@H](C)C(N)=O Amb25257881 [1,1,0,0,0,0|1,0,0]=3 3892 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [1,1,0,0,0,0|1,0,0]=3 3893 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [1,1,0,0,0,0|1,0,0]=3 3894 B7R0.5 CCC[C@@H](O)C(C)=O Amb24432580 [1,1,0,0,0,0|1,0,0]=3 3895 B7R0.5 CCC[C@@H](O)C(O)=O Amb22746731 [1,1,0,0,0,0|0,0,0]=2 3896 B7R0.5 CCC[C@H](C)C(C)O Amb25662135 [1,1,0,0,0,0|1,0,1]=4 3897 B7R0.5 CCC[C@H](C)C(N)=O Amb25305606 [1,1,0,0,0,0|1,0,0]=3 3898 B7R0.5 CCC[C@H](F)C(O)=O Amb24657412 [1,1,0,0,0,0|0,0,0]=2 3899 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [1,1,0,0,0,0|1,0,0]=3 3900 B7R0.5 CCC[C@H](O)C(N)=O Amb25082239 [1,1,0,0,0,0|1,0,0]=3 3901 B7R0.5 CCC[C@H](O)C(O)=O Amb22226514 [1,1,0,0,0,0|0,0,0]=2 3902 B7R0.5 CCNC(=N)C(O)=O Amb18641879 [1,1,0,0,0,0|1,0,1]=4 3903 B7R0.5 CCNC(C)C(N)=O Amb21959648 [1,1,0,0,0,0|2,0,0]=4 3904 B7R0.5 CCN[C@H](C)C(O)=O Amb24351099 [1,1,0,0,0,0|1,0,0]=3 3905 B7R0.5 CCOC(=C)C(O)=O Amb18641872 [1,1,0,0,0,0|1,0,1]=4 3906 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [1,1,0,0,0,0|1,0,1]=4 3907 B7R0.5 CCOC(C)C(N)=O Amb19960053 [1,1,0,0,0,0|2,0,0]=4 3908 B7R0.5 CCOC(O)C(C)=O Amb25189063 [1,1,0,0,0,0|2,0,0]=4 3909 B7R0.5 CCOC(O)C(O)=O Amb24680848 [1,1,0,0,0,0|1,0,0]=3 3910 B7R0.5 CCO[C@@H](O)C(C)=O Amb25092956 [1,1,0,0,0,0|2,0,0]=4 3911 B7R0.5 CCO[C@H](C)C(O)=O Amb24660035 [1,1,0,0,0,0|1,0,0]=3 3912 B7R0.5 CCSC(=S)C(O)=O Amb25210892 [1,1,0,0,0,0|1,0,1]=4 3913 B7R0.5 CCSC(O)C(O)=O Amb24444218 [1,1,0,0,0,0|1,0,0]=3 3914 B7R0.5 CCS[C@@H](C)C(O)=O Amb25083211 [1,1,0,0,0,0|1,0,0]=3 3915 B7R0.5 CCS[C@H](C)C(O)=O Amb25259517 [1,1,0,0,0,0|1,0,0]=3 3916 B7R0.5 CC\C=C(\Br)/C(O)=O Amb18125610 [1,1,0,0,0,0|0,0,2]=4 3917 B7R0.5 CC\C=C(\F)/C(O)=O Amb25326985 [1,1,0,0,0,0|0,0,2]=4 3918 B7R0.5 CC\C=C(\N)/C(O)=O Amb24349496 [1,1,0,0,0,0|0,0,2]=4 3919 B7R0.5 CN(C)C(=O)CC=O Amb25119226 [1,1,0,0,0,0|1,0,1]=4 3920 B7R0.5 CNCC(=C)C(O)=O Amb24561619 [1,1,0,0,0,0|1,0,1]=4 3921 B7R0.5 CNCC(C(=O)O)N Amb10071505 [1,1,0,0,0,0|1,0,0]=3 3922 B7R0.5 CNCC(C(=O)O)N Amb10845350 [1,1,0,0,0,0|1,0,0]=3 3923 B7R0.5 CNCC(C)C(C)=O Amb25340555 [1,1,0,0,0,0|2,0,0]=4 3924 B7R0.5 CNCC(F)C(O)=O Amb24666017 [1,1,0,0,0,0|1,0,0]=3 3925 B7R0.5 CNCC(N)C(N)=O Amb25316352 [1,1,0,0,0,0|2,0,0]=4 3926 B7R0.5 CNC[C@@H](C(=O)O)N Amb17617148 [1,1,0,0,0,0|1,0,0]=3 3927 B7R0.5 CNC[C@@H](N)C(O)=O Amb19133072 [1,1,0,0,0,0|1,0,0]=3 3928 B7R0.5 CNC[C@@H](N)C(O)=O Amb22746009 [1,1,0,0,0,0|1,0,0]=3 3929 B7R0.5 CNC[C@@H](N)C(O)=O Amb22748835 [1,1,0,0,0,0|1,0,0]=3 3930 B7R0.5 CNC[C@H](N)C(O)=O Amb19892230 [1,1,0,0,0,0|1,0,0]=3 3931 B7R0.5 CNC[C@H](O)C(O)=O Amb25689188 [1,1,0,0,0,0|1,0,0]=3 3932 B7R0.5 CNNC(C)C(O)=O Amb24070183 [1,1,0,0,0,0|2,0,0]=4 3933 B7R0.5 COCC(=O)C(O)=O Amb25304863 [1,1,0,0,0,0|1,0,1]=4 3934 B7R0.5 COCC(Br)C(C)=O Amb24483184 [1,1,0,0,0,0|2,0,0]=4 3935 B7R0.5 COCC(Br)C(N)=O Amb24740751 [1,1,0,0,0,0|2,0,0]=4 3936 B7R0.5 COCC(C(=O)O)Br Amb17594709 [1,1,0,0,0,0|1,0,0]=3 3937 B7R0.5 COCC(C(=O)O)Cl Amb10068384 [1,1,0,0,0,0|1,0,0]=3 3938 B7R0.5 COCC(C)C(C)=O Amb24683449 [1,1,0,0,0,0|2,0,0]=4 3939 B7R0.5 COCC(C)S(O)=O Amb25280974 [1,1,0,0,0,0|2,0,0]=4 3940 B7R0.5 COCC(Cl)C(C)=O Amb25073897 [1,1,0,0,0,0|2,0,0]=4 3941 B7R0.5 COCC(F)C(O)=O Amb24526772 [1,1,0,0,0,0|1,0,0]=3 3942 B7R0.5 COCC(N)C(N)=O Amb18984372 [1,1,0,0,0,0|2,0,0]=4 3943 B7R0.5 COCC(O)C(C)=O Amb25072841 [1,1,0,0,0,0|2,0,0]=4 3944 B7R0.5 COCC(O)C(O)=O Amb18124273 [1,1,0,0,0,0|1,0,0]=3 3945 B7R0.5 COC[C@@H](N)C(N)=O Amb25211762 [1,1,0,0,0,0|2,0,0]=4 3946 B7R0.5 COC[C@@H](N)C(O)=O Amb22744762 [1,1,0,0,0,0|1,0,0]=3 3947 B7R0.5 COC[C@@H](O)C(O)=O Amb25829059 [1,1,0,0,0,0|1,0,0]=3 3948 B7R0.5 COC[C@H](C(=O)O)N Amb10604051 [1,1,0,0,0,0|1,0,0]=3 3949 B7R0.5 COC[C@H](C(C)C)N Amb17061638 [1,1,0,0,0,0|2,0,0]=4 3950 B7R0.5 CSCC(C)C(=O)Cl Amb20247150 [1,1,0,0,0,0|2,0,0]=4 3951 B7R0.5 CSCC(C)C(C)=O Amb25268934 [1,1,0,0,0,0|2,0,0]=4 3952 B7R0.5 CSCC(C)C(N)=O Amb24475326 [1,1,0,0,0,0|2,0,0]=4 3953 B7R0.5 CSCC(C)C(O)=O Amb18967825 [1,1,0,0,0,0|1,0,0]=3 3954 B7R0.5 CSCC(N)C(N)=O Amb18294390 [1,1,0,0,0,0|2,0,0]=4 3955 B7R0.5 CSCC(O)C(O)=O Amb25131873 [1,1,0,0,0,0|1,0,0]=3 3956 B7R0.5 CSC[C@H](O)C(O)=O Amb24435256 [1,1,0,0,0,0|1,0,0]=3 3957 B7R0.5 CSSC(C)C(O)=O Amb25701741 [1,1,0,0,0,0|2,0,0]=4 3958 B7R0.5 C[C@@H](C(=O)O)CC#C Amb10844029 [1,1,0,0,0,0|0,0,2]=4 3959 B7R0.5 C[C@@H](C(=O)O)CC=C Amb10844040 [1,1,0,0,0,0|0,0,2]=4 3960 B7R0.5 C[C@@H](C(=O)O)CCC Amb10844028 [1,1,0,0,0,0|0,0,0]=2 3961 B7R0.5 C[C@@H](CC=O)C(Cl)Cl Amb25321996 [1,1,0,0,0,0|2,0,0]=4 3962 B7R0.5 C[C@@H](CCS)C(O)=O Amb25786376 [1,1,0,0,0,0|1,0,0]=3 3963 B7R0.5 C[C@@H](N)C(O)CC=C Amb25367750 [1,1,0,0,0,0|2,0,0]=4 3964 B7R0.5 C[C@@H](O)C(N)CC=C Amb24332662 [1,1,0,0,0,0|2,0,0]=4 3965 B7R0.5 C[C@@H](O)C(O)CC=C Amb25344994 [1,1,0,0,0,0|2,0,0]=4 3966 B7R0.5 C[C@@H](O)[C@@H](C)CCO Amb24475865 [1,1,0,0,0,0|1,0,1]=4 3967 B7R0.5 C[C@@H](O)[C@@H](O)CCC Amb25686304 [1,1,0,0,0,0|1,0,1]=4 3968 B7R0.5 C[C@@H](O)[C@H](C)CCO Amb25206314 [1,1,0,0,0,0|1,0,1]=4 3969 B7R0.5 C[C@@H](O)[C@H](F)CC=C Amb24420825 [1,1,0,0,0,0|2,0,0]=4 3970 B7R0.5 C[C@@H](O)[C@H](N)CCC Amb25328641 [1,1,0,0,0,0|1,0,1]=4 3971 B7R0.5 C[C@@H](O)[C@H](O)CC=C Amb25106054 [1,1,0,0,0,0|2,0,0]=4 3972 B7R0.5 C[C@@H](OC=O)[C@H](C)Br Amb25701559 [1,1,0,0,0,0|2,0,0]=4 3973 B7R0.5 C[C@H](C(=O)O)CC#C Amb10844036 [1,1,0,0,0,0|0,0,2]=4 3974 B7R0.5 C[C@H](C(=O)O)CC=C Amb10844033 [1,1,0,0,0,0|0,0,2]=4 3975 B7R0.5 C[C@H](C(=O)O)CCC Amb10844037 [1,1,0,0,0,0|0,0,0]=2 3976 B7R0.5 C[C@H](C(=O)O)CCN Amb10844043 [1,1,0,0,0,0|1,0,0]=3 3977 B7R0.5 C[C@H](C(=O)O)COC Amb10844266 [1,1,0,0,0,0|1,0,0]=3 3978 B7R0.5 C[C@H](CC#N)C(O)=O Amb24725603 [1,1,0,0,0,0|1,0,1]=4 3979 B7R0.5 C[C@H](CC=C)[C@@H](C)O Amb25072004 [1,1,0,0,0,0|2,0,0]=4 3980 B7R0.5 C[C@H](CC=C)[C@H](C)O Amb24717463 [1,1,0,0,0,0|2,0,0]=4 3981 B7R0.5 C[C@H](CC=O)C(Cl)Cl Amb25363179 [1,1,0,0,0,0|2,0,0]=4 3982 B7R0.5 C[C@H](CCO)C(O)=O Amb24483065 [1,1,0,0,0,0|1,0,0]=3 3983 B7R0.5 C[C@H](NCO)C(O)=O Amb24401217 [1,1,0,0,0,0|2,0,0]=4 3984 B7R0.5 C[C@H](O)[C@@H](Cl)CCC Amb25111275 [1,1,0,0,0,0|1,0,1]=4 3985 B7R0.5 C[C@H](O)[C@@H](N)CC=C Amb25264318 [1,1,0,0,0,0|2,0,0]=4 3986 B7R0.5 C[C@H](O)[C@H](C)CCO Amb25143027 [1,1,0,0,0,0|1,0,1]=4 3987 B7R0.5 C[C@H](O)[C@H](N)CC=C Amb24454742 [1,1,0,0,0,0|2,0,0]=4 3988 B7R0.5 C[C@H](O)[C@H](N)CCC Amb24604367 [1,1,0,0,0,0|1,0,1]=4 3989 B7R0.5 C[C@H](O)[C@H](O)CCC Amb24671438 [1,1,0,0,0,0|1,0,1]=4 3990 B7R0.5 C[C@H](OC=O)[C@H](C)Br Amb25061373 [1,1,0,0,0,0|2,0,0]=4 3991 B7R0.5 C[Se]CC(=O)C(=O)O Amb17617778 [1,1,0,0,0,0|1,0,1]=4 3992 B7R0.5 C[Se]C[C@@H](C(=O)O)N Amb10601626 [1,1,0,0,0,0|1,0,0]=3 3993 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22350259 [1,1,0,0,0,0|1,0,0]=3 3994 B7R0.5 C[Se]C[C@@H](N)C(O)=O Amb22745692 [1,1,0,0,0,0|1,0,0]=3 3995 B7R0.5 C\C=C\C(C)C(O)=O Amb18641786 [1,1,0,0,0,0|0,0,2]=4 3996 B7R0.5 C\C=C\C(N)C(O)=O Amb24481451 [1,1,0,0,0,0|0,0,2]=4 3997 B7R0.5 C\C=C\C(O)C(O)=O Amb24481382 [1,1,0,0,0,0|0,0,2]=4 3998 B7R0.5 C\C=C\[C@@H](C)C(O)=O Amb25719907 [1,1,0,0,0,0|0,0,2]=4 3999 B7R0.5 C\C=C\[C@H](C)C(O)=O Amb24481336 [1,1,0,0,0,0|0,0,2]=4 4000 B7R0.5 N#CCC(O)C(O)=O Amb25678609 [1,1,0,0,0,0|1,0,1]=4 4001 B7R0.5 NC(=O)C(Br)CCBr Amb25174083 [1,1,0,0,0,0|2,0,0]=4 4002 B7R0.5 NC(=O)C(O)CCO Amb25703294 [1,1,0,0,0,0|2,0,0]=4 4003 B7R0.5 NC(=O)C(S)CCO Amb24525295 [1,1,0,0,0,0|2,0,0]=4 4004 B7R0.5 NC(C(=O)O)CCBr Amb10576584 [1,1,0,0,0,0|1,0,0]=3 4005 B7R0.5 NC(CC#N)C(O)=O Amb18641766 [1,1,0,0,0,0|1,0,1]=4 4006 B7R0.5 NC(CCBr)C(O)=O Amb21858417 [1,1,0,0,0,0|1,0,0]=3 4007 B7R0.5 NC(CCF)C(N)=O Amb24391278 [1,1,0,0,0,0|2,0,0]=4 4008 B7R0.5 NC(CCI)C(O)=O Amb25339674 [1,1,0,0,0,0|1,0,0]=3 4009 B7R0.5 NC(CCO)C(N)=O Amb24481392 [1,1,0,0,0,0|2,0,0]=4 4010 B7R0.5 NC(CCS)C(N)=O Amb24599383 [1,1,0,0,0,0|2,0,0]=4 4011 B7R0.5 NC(CCS)C(O)=O Amb19267093 [1,1,0,0,0,0|1,0,0]=3 4012 B7R0.5 NC(CS=O)C(O)=O Amb24557184 [1,1,0,0,0,0|2,0,0]=4 4013 B7R0.5 NC(CSCl)C(O)=O Amb24482298 [1,1,0,0,0,0|2,0,0]=4 4014 B7R0.5 NC(CSO)C(O)=O Amb24746797 [1,1,0,0,0,0|2,0,0]=4 4015 B7R0.5 NC(CSS)C(O)=O Amb24614616 [1,1,0,0,0,0|2,0,0]=4 4016 B7R0.5 NCCC(=O)C(O)=O Amb25724685 [1,1,0,0,0,0|1,0,1]=4 4017 B7R0.5 NCCC(C(=O)O)F Amb10838221 [1,1,0,0,0,0|1,0,0]=3 4018 B7R0.5 NCCC(C(=O)O)O Amb16232090 [1,1,0,0,0,0|1,0,0]=3 4019 B7R0.5 NCCC(C(C)C)O Amb17231832 [1,1,0,0,0,0|1,0,1]=4 4020 B7R0.5 NCCC(Cl)C(O)=O Amb18124502 [1,1,0,0,0,0|1,0,0]=3 4021 B7R0.5 NCCC(F)C(O)=O Amb22229524 [1,1,0,0,0,0|1,0,0]=3 4022 B7R0.5 NCCC(N)C(N)=O Amb24634873 [1,1,0,0,0,0|2,0,0]=4 4023 B7R0.5 NCCC(N)C(O)=O Amb17678762 [1,1,0,0,0,0|1,0,0]=3 4024 B7R0.5 NCCC(N)C(O)=O Amb22348212 [1,1,0,0,0,0|1,0,0]=3 4025 B7R0.5 NCCC(S)C(O)=O Amb25083375 [1,1,0,0,0,0|1,0,0]=3 4026 B7R0.5 NCC[C@@H](Cl)C(O)=O Amb24481492 [1,1,0,0,0,0|1,0,0]=3 4027 B7R0.5 NCC[C@@H](F)C(O)=O Amb24055858 [1,1,0,0,0,0|1,0,0]=3 4028 B7R0.5 NCC[C@@H](N)C(O)=O Amb22750574 [1,1,0,0,0,0|1,0,0]=3 4029 B7R0.5 NCC[C@@H](N)C(O)=O Amb23438994 [1,1,0,0,0,0|1,0,0]=3 4030 B7R0.5 NCC[C@@H](O)C(O)=O Amb22225364 [1,1,0,0,0,0|1,0,0]=3 4031 B7R0.5 NCC[C@@H](O)C(O)=O Amb22748225 [1,1,0,0,0,0|1,0,0]=3 4032 B7R0.5 NCC[C@H](F)C(O)=O Amb24055857 [1,1,0,0,0,0|1,0,0]=3 4033 B7R0.5 NCC[C@H](N)C(O)=O Amb22886961 [1,1,0,0,0,0|1,0,0]=3 4034 B7R0.5 NOCC(N)C(O)=O Amb24184086 [1,1,0,0,0,0|2,0,0]=4 4035 B7R0.5 NOC[C@@H](N)C(O)=O Amb25791301 [1,1,0,0,0,0|2,0,0]=4 4036 B7R0.5 NOC[C@H](N)C(O)=O Amb24548229 [1,1,0,0,0,0|2,0,0]=4 4037 B7R0.5 N[C@@H](C(=O)O)CC#C Amb16183954 [1,1,0,0,0,0|0,0,2]=4 4038 B7R0.5 N[C@@H](C(=O)O)CCN Amb16183852 [1,1,0,0,0,0|1,0,0]=3 4039 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22746780 [1,1,0,0,0,0|1,0,1]=4 4040 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22748768 [1,1,0,0,0,0|1,0,1]=4 4041 B7R0.5 N[C@@H](CCBr)C(O)=O Amb22748283 [1,1,0,0,0,0|1,0,0]=3 4042 B7R0.5 N[C@@H](CCO)C(O)=O Amb20242705 [1,1,0,0,0,0|1,0,0]=3 4043 B7R0.5 N[C@@H](CCS)P(O)=O Amb24594746 [1,1,0,0,0,0|2,0,0]=4 4044 B7R0.5 N[C@@H](CCS)S(O)=O Amb25784628 [1,1,0,0,0,0|2,0,0]=4 4045 B7R0.5 N[C@@H](CNO)C(O)=O Amb24481412 [1,1,0,0,0,0|2,0,0]=4 4046 B7R0.5 N[C@@H](CO[SiH3])C(O)=O Amb24526864 [1,1,0,0,0,0|1,1,0]=4 4047 B7R0.5 N[C@@H](CSCl)C(O)=O Amb25055747 [1,1,0,0,0,0|2,0,0]=4 4048 B7R0.5 N[C@@H](CSO)C(O)=O Amb24481432 [1,1,0,0,0,0|2,0,0]=4 4049 B7R0.5 N[C@H](C(=O)O)CC#N Amb16183916 [1,1,0,0,0,0|1,0,1]=4 4050 B7R0.5 N[C@H](C(=O)O)CC=C Amb10982568 [1,1,0,0,0,0|0,0,2]=4 4051 B7R0.5 N[C@H](C(=O)O)CCN Amb16183862 [1,1,0,0,0,0|1,0,0]=3 4052 B7R0.5 N[C@H](CCS)C(O)=O Amb22230515 [1,1,0,0,0,0|1,0,0]=3 4053 B7R0.5 N[C@H](CNO)C(O)=O Amb24745929 [1,1,0,0,0,0|2,0,0]=4 4054 B7R0.5 O=C(Br)C(Br)CCBr Amb22234970 [1,1,0,0,0,0|2,0,0]=4 4055 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [1,1,0,0,0,0|2,0,0]=4 4056 B7R0.5 O=C(Cl)C(Cl)CCCl Amb24423919 [1,1,0,0,0,0|2,0,0]=4 4057 B7R0.5 O=CCC(C(=O)O)N Amb16232081 [1,1,0,0,0,0|1,0,1]=4 4058 B7R0.5 OC(=O)C(=O)CCCl Amb24592167 [1,1,0,0,0,0|1,0,1]=4 4059 B7R0.5 OC(=O)C(=O)CCO Amb25677024 [1,1,0,0,0,0|1,0,1]=4 4060 B7R0.5 OC(=O)C(Br)CCBr Amb19889695 [1,1,0,0,0,0|1,0,0]=3 4061 B7R0.5 OC(=O)C(Br)CCF Amb25073798 [1,1,0,0,0,0|1,0,0]=3 4062 B7R0.5 OC(=O)C(Cl)CCCl Amb18126030 [1,1,0,0,0,0|1,0,0]=3 4063 B7R0.5 OC(=O)[C@H](S)CCS Amb24483251 [1,1,0,0,0,0|1,0,0]=3 4064 B7R0.5 OC(C(C)C)CC#N Amb17231814 [1,1,0,0,0,0|1,0,1]=4 4065 B7R0.5 OC(CC=O)C(O)=O Amb25225249 [1,1,0,0,0,0|1,0,1]=4 4066 B7R0.5 OC(CCS)C(O)=O Amb24586206 [1,1,0,0,0,0|1,0,0]=3 4067 B7R0.5 OCCC(C(C)C)N Amb1993950 [1,1,0,0,0,0|0,0,1]=3 4068 B7R0.5 OCCC(O)C(O)=O Amb24689942 [1,1,0,0,0,0|1,0,0]=3 4069 B7R0.5 O[15NH]CC(C(=O)O)N Amb17608097 [1,1,0,0,0,0|2,0,0]=4 4070 B7R0.5 O[C@@H](CCF)C(O)=O Amb24481351 [1,1,0,0,0,0|1,0,0]=3 4071 B7R0.8 C=CCC[Si](C)(C)C Amb10071973 [1,1,0,0,0,0|1,1,0]=4 4072 B7R0.8 CC(C)(Br)CCCCl Amb25295516 [1,1,0,0,0,0|1,0,1]=4 4073 B7R0.8 CC(C)(Br)CN=C=O Amb24483056 [1,1,0,0,0,0|1,0,1]=4 4074 B7R0.8 CC(C)(C)CC=NO Amb24532423 [1,1,0,0,0,0|1,0,1]=4 4075 B7R0.8 CC(C)(C)CCC=C Amb24687786 [1,1,0,0,0,0|1,0,0]=3 4076 B7R0.8 CC(C)(C)CCC=O Amb18641814 [1,1,0,0,0,0|0,0,0]=2 4077 B7R0.8 CC(C)(C)CCCBr Amb22227840 [1,1,0,0,0,0|1,0,1]=4 4078 B7R0.8 CC(C)(C)CCCCl Amb25705668 [1,1,0,0,0,0|1,0,1]=4 4079 B7R0.8 CC(C)(C)CCCS Amb25110303 [1,1,0,0,0,0|0,1,1]=4 4080 B7R0.8 CC(C)(C)CC[Mg]Cl Amb19886363 [1,1,0,0,0,0|2,0,0]=4 4081 B7R0.8 CC(C)(C)CC[Zn]Cl Amb22897763 [1,1,0,0,0,0|2,0,0]=4 4082 B7R0.8 CC(C)(C)CNC=O Amb25187006 [1,1,0,0,0,0|1,0,0]=3 4083 B7R0.8 CC(C)(C)CNC=S Amb25702305 [1,1,0,0,0,0|1,1,0]=4 4084 B7R0.8 CC(C)(C)NCC=C Amb18986065 [1,1,0,0,0,0|2,0,0]=4 4085 B7R0.8 CC(C)(C)SCC=C Amb22731571 [1,1,0,0,0,0|2,0,0]=4 4086 B7R0.8 CC(C)(C)\C=C/C=O Amb25253578 [1,1,0,0,0,0|0,0,2]=4 4087 B7R0.8 CC(C)(C)\C=C\C=O Amb18641695 [1,1,0,0,0,0|0,0,2]=4 4088 B7R0.8 CC(C)(C)\N=C\C=O Amb24680291 [1,1,0,0,0,0|1,0,1]=4 4089 B7R0.8 CC(C)(Cl)CCC=C Amb25068240 [1,1,0,0,0,0|1,0,0]=3 4090 B7R0.8 CC(C)(Cl)CCCBr Amb24618976 [1,1,0,0,0,0|1,0,1]=4 4091 B7R0.8 CC(C)(Cl)CN=C=O Amb24694153 [1,1,0,0,0,0|1,0,1]=4 4092 B7R0.8 CC(C)(F)CCC=O Amb25223234 [1,1,0,0,0,0|0,0,0]=2 4093 B7R0.8 CC(C)(F)CCCBr Amb25227493 [1,1,0,0,0,0|1,0,1]=4 4094 B7R0.8 CC(C)(F)CCCO Amb24639473 [1,1,0,0,0,0|0,0,1]=3 4095 B7R0.8 CC(C)(F)CN=C=O Amb24513700 [1,1,0,0,0,0|1,0,1]=4 4096 B7R0.8 CC(C)(N)C#CC=O Amb24657217 [1,1,0,0,0,0|0,0,2]=4 4097 B7R0.8 CC(C)(N)CCC=C Amb18641750 [1,1,0,0,0,0|1,0,0]=3 4098 B7R0.8 CC(C)(N)CCCN Amb18641912 [1,1,0,0,0,0|1,0,1]=4 4099 B7R0.8 CC(C)(N)CCNO Amb24747165 [1,1,0,0,0,0|1,0,0]=3 4100 B7R0.8 CC(C)(O)C#CC=O Amb25084561 [1,1,0,0,0,0|0,0,2]=4 4101 B7R0.8 CC(C)(O)CCC#N Amb18641739 [1,1,0,0,0,0|1,0,1]=4 4102 B7R0.8 CC(C)(O)CCCCl Amb24333123 [1,1,0,0,0,0|1,0,1]=4 4103 B7R0.8 CC(C)(O)CCCO Amb20668492 [1,1,0,0,0,0|0,0,1]=3 4104 B7R0.8 CC(C)(O)CCNN Amb25303050 [1,1,0,0,0,0|2,0,0]=4 4105 B7R0.8 CC(C)(O)C\C=C\Cl Amb24632308 [1,1,0,0,0,0|1,0,1]=4 4106 B7R0.8 CC(C)(O)NCCO Amb24426843 [1,1,0,0,0,0|1,0,1]=4 4107 B7R0.8 CC(C)(S)CCCN Amb25293351 [1,1,0,0,0,0|1,0,1]=4 4108 B7R0.8 CC=CCC(C)(C)C Amb22229915 [1,1,0,0,0,0|1,0,1]=4 4109 B7R0.8 CCCCB(O)(O)O Amb24422846 [1,1,0,0,0,0|1,0,1]=4 4110 B7R0.8 CCCCC(C)(C)Br Amb24401418 [1,1,0,0,0,0|1,0,1]=4 4111 B7R0.8 CCCCC(C)(C)C Amb22045826 [1,1,0,0,0,0|1,0,1]=4 4112 B7R0.8 CCCCC(C)(C)C Amb22228234 [1,1,0,0,0,0|1,0,1]=4 4113 B7R0.8 CCCCC(C)(C)Cl Amb22052659 [1,1,0,0,0,0|1,0,1]=4 4114 B7R0.8 CCCCC(C)(C)N Amb18993512 [1,1,0,0,0,0|1,0,1]=4 4115 B7R0.8 CCCCP(O)(O)=O Amb22053921 [1,1,0,0,0,0|1,0,0]=3 4116 B7R0.8 CCCCS(=O)(=O)Br Amb23555505 [1,1,0,0,0,0|1,0,1]=4 4117 B7R0.8 CCCCS(=O)(=O)F Amb10610096 [1,1,0,0,0,0|1,0,1]=4 4118 B7R0.8 CCCCS(=O)(=O)N Amb1132715 [1,1,0,0,0,0|1,0,1]=4 4119 B7R0.8 CCCCS(=O)(=O)O Amb10844727 [1,1,0,0,0,0|1,0,0]=3 4120 B7R0.8 CCCCS(C)(=O)=O Amb24643027 [1,1,0,0,0,0|1,0,1]=4 4121 B7R0.8 CCCCS(O)(=O)=O Amb22269868 [1,1,0,0,0,0|1,0,0]=3 4122 B7R0.8 CCCC[B-](O)(O)O Amb24457030 [1,1,0,0,0,0|1,0,1]=4 4123 B7R0.8 CCCC[Sn](O)(O)Cl Amb19894194 [1,1,0,0,0,0|1,0,1]=4 4124 B7R0.8 CCCOP(C)(O)=O Amb24553958 [1,1,0,0,0,0|2,0,0]=4 4125 B7R0.8 CCNCP(=O)(O)O Amb2233009 [1,1,0,0,0,0|2,0,0]=4 4126 B7R0.8 CCNCS(O)(=O)=O Amb25324324 [1,1,0,0,0,0|2,0,0]=4 4127 B7R0.8 CNCCC(C)(C)C Amb19959916 [1,1,0,0,0,0|2,0,0]=4 4128 B7R0.8 CNCCC(C)(C)F Amb24679513 [1,1,0,0,0,0|2,0,0]=4 4129 B7R0.8 CNCCC(C)(C)N Amb23400851 [1,1,0,0,0,0|2,0,0]=4 4130 B7R0.8 CNCCC(C)(C)N Amb23402091 [1,1,0,0,0,0|2,0,0]=4 4131 B7R0.8 CNCCC(O)(C)C Amb10607875 [1,1,0,0,0,0|2,0,0]=4 4132 B7R0.8 COCCC(C)(C)N Amb20623585 [1,1,0,0,0,0|2,0,0]=4 4133 B7R0.8 COCCC(C)(C)S Amb24120341 [1,1,0,0,0,0|2,0,0]=4 4134 B7R0.8 COCCC(N)(C)C Amb17569920 [1,1,0,0,0,0|2,0,0]=4 4135 B7R0.8 CP(O)(=O)CCCO Amb24448096 [1,1,0,0,0,0|2,0,0]=4 4136 B7R0.8 CSCCC(C)(C)C Amb25092537 [1,1,0,0,0,0|2,0,0]=4 4137 B7R0.8 CSCCC(C)(C)N Amb24435204 [1,1,0,0,0,0|2,0,0]=4 4138 B7R0.8 CSCCC(C)(C)O Amb24483080 [1,1,0,0,0,0|2,0,0]=4 4139 B7R0.8 CSCCS(O)(=O)=O Amb25200266 [1,1,0,0,0,0|2,0,0]=4 4140 B7R0.8 C[N+](C)(C)CCC=O Amb25831387 [1,1,0,0,0,0|1,0,0]=3 4141 B7R0.8 C[N+](C)(C)CNC=O Amb24529034 [1,1,0,0,0,0|2,0,0]=4 4142 B7R0.8 C[N+](C)(N)CCCO Amb25725225 [1,1,0,0,0,0|1,0,1]=4 4143 B7R0.8 C[P+](C)(C)CCCO Amb25319824 [1,1,0,0,0,0|1,0,1]=4 4144 B7R0.8 C[Si](C)(C)CCC=O Amb24374948 [1,1,0,0,0,0|0,1,0]=3 4145 B7R0.8 C[Si](C)(C)CNC=O Amb25169355 [1,1,0,0,0,0|1,1,0]=4 4146 B7R0.8 C[Si](C)(C)C\C=C\O Amb24054162 [1,1,0,0,0,0|0,1,1]=4 4147 B7R0.8 C[Si](C)(O)CCCO Amb25296399 [1,1,0,0,0,0|0,1,1]=4 4148 B7R0.8 N#CCCC(C)(C)C Amb15701560 [1,1,0,0,0,0|1,0,1]=4 4149 B7R0.8 NCCCC(C)(C)C Amb15701618 [1,1,0,0,0,0|1,0,1]=4 4150 B7R0.8 NCCCC(C)(C)C Amb17078776 [1,1,0,0,0,0|1,0,1]=4 4151 B7R0.8 NCCCC(O)(C)C Amb17569908 [1,1,0,0,0,0|1,0,1]=4 4152 B7R0.8 NCCCS(O)(=O)=O Amb22349635 [1,1,0,0,0,0|2,0,0]=4 4153 B7R0.8 O=CC#CC(C)(C)C Amb17593130 [1,1,0,0,0,0|0,0,2]=4 4154 B7R0.8 O=CCCC(Cl)(Cl)Cl Amb24666719 [1,1,0,0,0,0|2,0,0]=4 4155 B7R0.8 O=CCCC(F)(F)F Amb10602378 [1,1,0,0,0,0|2,0,0]=4 4156 B7R0.8 O=CCCC(F)(F)F Amb24056014 [1,1,0,0,0,0|2,0,0]=4 4157 B7R0.8 OCCCC(C)(C)C Amb15701555 [1,1,0,0,0,0|0,0,1]=3 4158 B7R0.8 OCCCS(O)(=O)=O Amb22002051 [1,1,0,0,0,0|2,0,0]=4 4159 B7R0.8 OCCCS(O)(=O)=O Amb22360758 [1,1,0,0,0,0|2,0,0]=4 4160 B7R0.8 OP(O)(=O)CCCCl Amb22388825 [1,1,0,0,0,0|2,0,0]=4 4161 B7R0.8 OS(=O)(=O)CCCS Amb20620653 [1,1,0,0,0,0|2,0,0]=4 4162 B7R0.8 OS(=O)(=O)CCCS Amb22360759 [1,1,0,0,0,0|2,0,0]=4 4163 B7R0.9 CC(=C)CC(C)(C)O Amb22052674 [0,1,0,0,1,0|2,0,0]=4 4164 B7R0.9 CC(=O)CC(C)(C)F Amb25758912 [0,1,0,0,1,0|1,0,0]=3 4165 B7R0.9 CC(=O)CC(C)(F)F Amb21951914 [0,1,0,0,1,0|2,0,0]=4 4166 B7R0.9 CC(=O)CC(C)(S)S Amb25767704 [0,1,0,0,1,0|2,0,0]=4 4167 B7R0.9 CC(=O)CC(S)(C)C Amb17593394 [0,1,0,0,1,0|1,0,0]=3 4168 B7R0.9 CC(=O)CP(C)(C)=O Amb25370726 [0,1,0,0,1,0|2,0,0]=4 4169 B7R0.9 CC(=O)C[Si](C)(C)C Amb24411725 [0,1,0,0,1,0|1,1,0]=4 4170 B7R0.9 CC(=O)SC(C)(C)C Amb22231459 [0,1,0,0,1,0|2,0,0]=4 4171 B7R0.9 CC(C)(C)CC(N)=N Amb25336905 [0,1,0,0,1,0|2,0,0]=4 4172 B7R0.9 CC(C)(C)CS(O)=O Amb24614665 [0,1,0,0,1,0|1,0,0]=3 4173 B7R0.9 CC(C)(C)NC(=O)Cl Amb25770497 [0,1,0,0,1,0|2,0,0]=4 4174 B7R0.9 CC(C)(C)NC(=O)F Amb25350572 [0,1,0,0,1,0|2,0,0]=4 4175 B7R0.9 CC(C)(C)OC(=O)F Amb25241785 [0,1,0,0,1,0|2,0,0]=4 4176 B7R0.9 CC(C)(C)OC([O-])=O Amb22731240 [0,1,0,0,1,0|1,0,1]=4 4177 B7R0.9 CC(C)(C)SC(=O)Cl Amb22353785 [0,1,0,0,1,0|2,0,0]=4 4178 B7R0.9 CC(C)(C)SC(N)=O Amb25365837 [0,1,0,0,1,0|2,0,0]=4 4179 B7R0.9 CC(C)(N)CC(N)=O Amb23402094 [0,1,0,0,1,0|1,0,0]=3 4180 B7R0.9 CC(C)(N)CC(N)=O Amb24271090 [0,1,0,0,1,0|1,0,0]=3 4181 B7R0.9 CC(C)(N)CC(O)=O Amb19267108 [0,1,0,0,1,0|0,0,0]=2 4182 B7R0.9 CC(C)(O)CC(N)=S Amb24711517 [0,1,0,0,1,0|1,1,0]=4 4183 B7R0.9 CC(C)(O)CC(O)O Amb25115429 [0,1,0,0,1,0|0,0,2]=4 4184 B7R0.9 CC(C)(O)CC([O-])=O Amb17678748 [0,1,0,0,1,0|0,0,1]=3 4185 B7R0.9 CC(C)(O)CC([O-])=O Amb22729769 [0,1,0,0,1,0|0,0,1]=3 4186 B7R0.9 CC(C)CS(=O)(=O)Br Amb23555503 [0,1,0,0,1,0|1,0,1]=4 4187 B7R0.9 CC(C)CS(=O)(=O)F Amb19893332 [0,1,0,0,1,0|1,0,1]=4 4188 B7R0.9 CC(C)CS(C)(=O)=O Amb25106217 [0,1,0,0,1,0|1,0,1]=4 4189 B7R0.9 CC(C)CS([O-])(=O)=O Amb24423773 [0,1,0,0,1,0|1,0,1]=4 4190 B7R0.9 CC(C)OP(O)(O)=O Amb22493772 [0,1,0,0,1,0|2,0,0]=4 4191 B7R0.9 CC(CS(=O)(=O)N)C Amb13951979 [0,1,0,0,1,0|1,0,1]=4 4192 B7R0.9 CC(CS(=O)(=O)O)O Amb17593541 [0,1,0,0,1,0|2,0,0]=4 4193 B7R0.9 CC(Cl)CP(O)(O)=O Amb25169519 [0,1,0,0,1,0|2,0,0]=4 4194 B7R0.9 CC(N)CP(C)(O)=O Amb24482995 [0,1,0,0,1,0|2,0,0]=4 4195 B7R0.9 CC(O)CC(C)(C)Br Amb25842064 [0,1,0,0,1,0|1,0,1]=4 4196 B7R0.9 CC(O)CC(C)(C)C Amb22337936 [0,1,0,0,1,0|1,0,1]=4 4197 B7R0.9 CC(O)CC(C)(C)Cl Amb25234407 [0,1,0,0,1,0|1,0,1]=4 4198 B7R0.9 CC(O)CC(C)(C)S Amb22047633 [0,1,0,0,1,0|1,0,1]=4 4199 B7R0.9 CC(OP(=O)(O)C)C Amb10842159 [0,1,0,0,1,0|2,0,0]=4 4200 B7R0.9 CC(S)CS(O)(=O)=O Amb24543740 [0,1,0,0,1,0|2,0,0]=4 4201 B7R0.9 CN(C)(C)CC(O)=O Amb22343422 [0,1,0,0,1,0|1,0,0]=3 4202 B7R0.9 CP(C)(=O)CC(O)=O Amb25197683 [0,1,0,0,1,0|1,0,0]=3 4203 B7R0.9 CS(C)(Br)CC(O)=O Amb25829058 [0,1,0,0,1,0|1,0,0]=3 4204 B7R0.9 C[As+](C)(C)CC([O-])=O Amb22347917 [0,1,0,0,1,0|1,0,1]=4 4205 B7R0.9 C[C@@H](N)CP(C)(O)=O Amb24460368 [0,1,0,0,1,0|2,0,0]=4 4206 B7R0.9 C[C@@H](N)CP(O)(O)=O Amb25338674 [0,1,0,0,1,0|2,0,0]=4 4207 B7R0.9 C[C@@H](N)CS(O)(=O)=O Amb24670475 [0,1,0,0,1,0|2,0,0]=4 4208 B7R0.9 C[C@@H](O)CC(C)(C)C Amb24544035 [0,1,0,0,1,0|1,0,1]=4 4209 B7R0.9 C[C@@H](O)CC(C)(C)S Amb25333750 [0,1,0,0,1,0|1,0,1]=4 4210 B7R0.9 C[C@@H](O)CP(O)(O)=O Amb24334038 [0,1,0,0,1,0|2,0,0]=4 4211 B7R0.9 C[C@H](CC(O)(C)C)O Amb10606102 [0,1,0,0,1,0|1,0,1]=4 4212 B7R0.9 C[C@H](N)CS(O)(=O)=O Amb25760668 [0,1,0,0,1,0|2,0,0]=4 4213 B7R0.9 C[C@H](O)CC(C)(C)C Amb24672407 [0,1,0,0,1,0|1,0,1]=4 4214 B7R0.9 C[C@H](O)CC(C)(C)O Amb20669803 [0,1,0,0,1,0|1,0,1]=4 4215 B7R0.9 C[C@H](O)CC(C)(C)S Amb24457778 [0,1,0,0,1,0|1,0,1]=4 4216 B7R0.9 C[C@H](O)CP(O)(O)=O Amb25715996 [0,1,0,0,1,0|2,0,0]=4 4217 B7R0.9 C[N+](C)(C)CC(O)=O Amb22734051 [0,1,0,0,1,0|1,0,0]=3 4218 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22002454 [0,1,0,0,1,0|1,0,1]=4 4219 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22167465 [0,1,0,0,1,0|1,0,1]=4 4220 B7R0.9 C[N+](C)(C)CC([O-])=O Amb22584414 [0,1,0,0,1,0|1,0,1]=4 4221 B7R0.9 C[N+](C)(N)CC(N)=O Amb25361686 [0,1,0,0,1,0|2,0,0]=4 4222 B7R0.9 C[P+](C)(C)CC(O)=O Amb24753800 [0,1,0,0,1,0|1,0,0]=3 4223 B7R0.9 C[Si](C)(C)CC(N)=O Amb24574114 [0,1,0,0,1,0|1,1,0]=4 4224 B7R0.9 C[Si](C)(C)CC(O)=O Amb19894126 [0,1,0,0,1,0|0,1,0]=3 4225 B7R0.9 NC(=O)OC(C)(C)C Amb2236390 [0,1,0,0,1,0|2,0,0]=4 4226 B7R0.9 OB(CC(C)(C)C)O Amb13890355 [0,1,0,0,1,0|1,0,1]=4 4227 B7R0.9 OC(=O)CC(F)(F)Br Amb24373833 [0,1,0,0,1,0|2,0,0]=4 4228 B7R0.9 OC(=O)CC(O)(C)C Amb10605560 [0,1,0,0,1,0|0,0,0]=2 4229 B7R0.9 OC(=O)C[As+](C)(C)C Amb17608518 [0,1,0,0,1,0|1,0,0]=3 4230 B7R0.9 [2H]C([2H])([2H])CC(O)=O Amb22338080 [0,1,0,0,1,0|2,0,0]=4 4231 B7R0.9 [O-]C(=O)C[N+](C)(C)C Amb10843741 [0,1,0,0,1,0|1,0,1]=4 4232 B7R0.16 BrC(C(=O)Cl)C(C)C Amb17569838 [0,1,0,0,1,0|1,0,0]=3 4233 B7R0.16 CC(=C(C(=O)O)Br)C Amb17594579 [0,1,0,0,1,0|0,0,2]=4 4234 B7R0.16 CC(=C(C(=O)O)C)C Amb17593186 [0,1,0,0,1,0|0,0,2]=4 4235 B7R0.16 CC(=C)C(C)C(O)=O Amb18641781 [0,1,0,0,1,0|0,0,2]=4 4236 B7R0.16 CC(=C)C(N)C(O)=O Amb18641831 [0,1,0,0,1,0|0,0,2]=4 4237 B7R0.16 CC(=C)[C@@H](C)C(O)=O Amb25355239 [0,1,0,0,1,0|0,0,2]=4 4238 B7R0.16 CC(=O)C(=C)C(C)C Amb25713676 [0,1,0,0,1,0|1,0,1]=4 4239 B7R0.16 CC(=O)C(N)C(O)=O Amb21962887 [0,1,0,0,1,0|1,0,1]=4 4240 B7R0.16 CC(Br)C(=O)C(O)=O Amb23400913 [0,1,0,0,1,0|1,0,1]=4 4241 B7R0.16 CC(Br)C(N)C(O)=O Amb25775046 [0,1,0,0,1,0|1,0,0]=3 4242 B7R0.16 CC(C(=C)C(=O)O)C Amb17593189 [0,1,0,0,1,0|0,0,1]=3 4243 B7R0.16 CC(C(=O)O)C(=O)C Amb10601660 [0,1,0,0,1,0|1,0,1]=4 4244 B7R0.16 CC(C(=O)O)C(C)C Amb17087469 [0,1,0,0,1,0|0,0,0]=2 4245 B7R0.16 CC(C(C(=O)C)Br)C Amb2389580 [0,1,0,0,1,0|1,0,0]=3 4246 B7R0.16 CC(C(C(=O)C)C)O Amb17593202 [0,1,0,0,1,0|2,0,0]=4 4247 B7R0.16 CC(C(C(=O)O)Br)O Amb17594710 [0,1,0,0,1,0|1,0,0]=3 4248 B7R0.16 CC(C(C(=O)O)C)O Amb17615515 [0,1,0,0,1,0|1,0,0]=3 4249 B7R0.16 CC(C(C(=O)O)Cl)O Amb17593522 [0,1,0,0,1,0|1,0,0]=3 4250 B7R0.16 CC(C(C(=O)O)N)F Amb10838661 [0,1,0,0,1,0|1,0,0]=3 4251 B7R0.16 CC(C(C(=O)O)N)S Amb17593434 [0,1,0,0,1,0|1,0,0]=3 4252 B7R0.16 CC(C(C)Br)C(O)=O Amb25111271 [0,1,0,0,1,0|1,0,0]=3 4253 B7R0.16 CC(C(C)Cl)C(N)=O Amb25785669 [0,1,0,0,1,0|2,0,0]=4 4254 B7R0.16 CC(C(C)N)C(C)=O Amb24411022 [0,1,0,0,1,0|2,0,0]=4 4255 B7R0.16 CC(C(C)N)C(O)=O Amb18124261 [0,1,0,0,1,0|1,0,0]=3 4256 B7R0.16 CC(C(C)O)C(N)=O Amb24481579 [0,1,0,0,1,0|2,0,0]=4 4257 B7R0.16 CC(C(C)S)C(O)=O Amb25842057 [0,1,0,0,1,0|1,0,0]=3 4258 B7R0.16 CC(C(N)=O)N(C)C Amb25679024 [0,1,0,0,1,0|2,0,0]=4 4259 B7R0.16 CC(C(O)=O)N(C)Br Amb24743147 [0,1,0,0,1,0|2,0,0]=4 4260 B7R0.16 CC(C(O)=O)N(C)C Amb21955631 [0,1,0,0,1,0|1,0,0]=3 4261 B7R0.16 CC(C(O)=O)N(C)N Amb22372039 [0,1,0,0,1,0|2,0,0]=4 4262 B7R0.16 CC(C(O)=O)N(C)O Amb24714002 [0,1,0,0,1,0|2,0,0]=4 4263 B7R0.16 CC(C(O)=O)S(C)=O Amb18950743 [0,1,0,0,1,0|2,0,0]=4 4264 B7R0.16 CC(C)=C(Cl)C(O)=O Amb18642954 [0,1,0,0,1,0|0,0,2]=4 4265 B7R0.16 CC(C)=C(F)C(O)=O Amb20669103 [0,1,0,0,1,0|0,0,2]=4 4266 B7R0.16 CC(C)=C(S)C(O)=O Amb25360161 [0,1,0,0,1,0|0,0,2]=4 4267 B7R0.16 CC(C)C(=C)C(N)=O Amb24709685 [0,1,0,0,1,0|1,0,1]=4 4268 B7R0.16 CC(C)C(=S)C(O)=O Amb25244596 [0,1,0,0,1,0|0,0,1]=3 4269 B7R0.16 CC(C)C(Br)C(Br)=O Amb17666947 [0,1,0,0,1,0|1,0,0]=3 4270 B7R0.16 CC(C)C(Br)C(N)=S Amb24524277 [0,1,0,0,1,0|1,1,0]=4 4271 B7R0.16 CC(C)C(C)C(C)=C Amb24649761 [0,1,0,0,1,0|2,0,0]=4 4272 B7R0.16 CC(C)C(C)C(C)=O Amb17940267 [0,1,0,0,1,0|1,0,0]=3 4273 B7R0.16 CC(C)C(C)C(C)O Amb24640694 [0,1,0,0,1,0|1,0,1]=4 4274 B7R0.16 CC(C)C(C)C(N)=O Amb25810126 [0,1,0,0,1,0|1,0,0]=3 4275 B7R0.16 CC(C)C(C)S(C)=O Amb24528110 [0,1,0,0,1,0|2,0,0]=4 4276 B7R0.16 CC(C)C(C)S([O-])=O Amb25685559 [0,1,0,0,1,0|1,0,1]=4 4277 B7R0.16 CC(C)C(Cl)C(=C)Cl Amb25360075 [0,1,0,0,1,0|2,0,0]=4 4278 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,1,0,0,1,0|1,0,0]=3 4279 B7R0.16 CC(C)C(Cl)C(C)=C Amb24483132 [0,1,0,0,1,0|2,0,0]=4 4280 B7R0.16 CC(C)C(Cl)C(C)=O Amb24483197 [0,1,0,0,1,0|1,0,0]=3 4281 B7R0.16 CC(C)C(Cl)C(C)O Amb25124794 [0,1,0,0,1,0|1,0,1]=4 4282 B7R0.16 CC(C)C(Cl)C(N)=O Amb25337426 [0,1,0,0,1,0|1,0,0]=3 4283 B7R0.16 CC(C)C(Cl)S(C)=O Amb24482117 [0,1,0,0,1,0|2,0,0]=4 4284 B7R0.16 CC(C)C(F)C(=O)Cl Amb25142402 [0,1,0,0,1,0|1,0,0]=3 4285 B7R0.16 CC(C)C(F)C(N)=O Amb24616703 [0,1,0,0,1,0|1,0,0]=3 4286 B7R0.16 CC(C)C(F)C(O)=O Amb19957386 [0,1,0,0,1,0|0,0,0]=2 4287 B7R0.16 CC(C)C(N)B(O)O Amb24482349 [0,1,0,0,1,0|1,0,1]=4 4288 B7R0.16 CC(C)C(N)C(=O)S Amb25064101 [0,1,0,0,1,0|0,1,0]=3 4289 B7R0.16 CC(C)C(N)C(C)=C Amb18641748 [0,1,0,0,1,0|2,0,0]=4 4290 B7R0.16 CC(C)C(N)C(C)=O Amb23536905 [0,1,0,0,1,0|1,0,0]=3 4291 B7R0.16 CC(C)C(N)C(C)O Amb18641932 [0,1,0,0,1,0|1,0,1]=4 4292 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,1,0,0,1,0|1,0,0]=3 4293 B7R0.16 CC(C)C(N)C(N)=S Amb19148044 [0,1,0,0,1,0|1,1,0]=4 4294 B7R0.16 CC(C)C(N)[13C](O)=O Amb22338653 [0,1,0,0,1,0|0,0,0]=2 4295 B7R0.16 CC(C)C(O)C(C)=O Amb25087800 [0,1,0,0,1,0|1,0,0]=3 4296 B7R0.16 CC(C)C(O)C(N)=N Amb24447862 [0,1,0,0,1,0|2,0,0]=4 4297 B7R0.16 CC(C)C(O)C(N)=O Amb25124434 [0,1,0,0,1,0|1,0,0]=3 4298 B7R0.16 CC(C)C(S)C(N)=O Amb25315643 [0,1,0,0,1,0|1,0,0]=3 4299 B7R0.16 CC(C)C(S)C(O)=O Amb18282761 [0,1,0,0,1,0|0,0,0]=2 4300 B7R0.16 CC(C)C([15NH2])C(O)=O Amb22363191 [0,1,0,0,1,0|0,0,0]=2 4301 B7R0.16 CC(C)N(C)C(=O)Cl Amb25807313 [0,1,0,0,1,0|2,0,0]=4 4302 B7R0.16 CC(C)N(N)C(N)=O Amb24679360 [0,1,0,0,1,0|2,0,0]=4 4303 B7R0.16 CC(C)N(O)C(N)=O Amb18202545 [0,1,0,0,1,0|2,0,0]=4 4304 B7R0.16 CC(C)[13CH](N)C(O)=O Amb22367349 [0,1,0,0,1,0|0,0,0]=2 4305 B7R0.16 CC(C)[C@@H](Br)C(=O)Cl Amb25708357 [0,1,0,0,1,0|1,0,0]=3 4306 B7R0.16 CC(C)[C@@H](C)C(C)=O Amb24753185 [0,1,0,0,1,0|1,0,0]=3 4307 B7R0.16 CC(C)[C@@H](Cl)B(O)O Amb25109627 [0,1,0,0,1,0|1,0,1]=4 4308 B7R0.16 CC(C)[C@@H](Cl)C(O)=O Amb22353101 [0,1,0,0,1,0|0,0,0]=2 4309 B7R0.16 CC(C)[C@@H](F)C(O)=O Amb25083215 [0,1,0,0,1,0|0,0,0]=2 4310 B7R0.16 CC(C)[C@@H](N)C(C)=O Amb25757023 [0,1,0,0,1,0|1,0,0]=3 4311 B7R0.16 CC(C)[C@@H](N)C(C)O Amb24575417 [0,1,0,0,1,0|1,0,1]=4 4312 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,1,0,0,1,0|1,0,0]=3 4313 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,1,0,0,1,0|1,0,0]=3 4314 B7R0.16 CC(C)[C@@H](N)C(O)=O Amb22746777 [0,1,0,0,1,0|0,0,0]=2 4315 B7R0.16 CC(C)[C@@H](N)[C@@H](C)O Amb24540375 [0,1,0,0,1,0|1,0,1]=4 4316 B7R0.16 CC(C)[C@@H](O)C(C)=O Amb24379445 [0,1,0,0,1,0|1,0,0]=3 4317 B7R0.16 CC(C)[C@@H](O)[C@H](C)O Amb24332475 [0,1,0,0,1,0|1,0,1]=4 4318 B7R0.16 CC(C)[C@@H](S)C(O)=O Amb25320674 [0,1,0,0,1,0|0,0,0]=2 4319 B7R0.16 CC(C)[C@H](N)C(=O)Cl Amb25679283 [0,1,0,0,1,0|1,0,0]=3 4320 B7R0.16 CC(C)[C@H](N)C(=O)S Amb24427323 [0,1,0,0,1,0|0,1,0]=3 4321 B7R0.16 CC(C)[C@H](N)C(N)=S Amb24714667 [0,1,0,0,1,0|1,1,0]=4 4322 B7R0.16 CC(C)[C@H](N)C(O)=O Amb22351111 [0,1,0,0,1,0|0,0,0]=2 4323 B7R0.16 CC(C)[C@H](N)[13C](O)=O Amb22354046 [0,1,0,0,1,0|0,0,0]=2 4324 B7R0.16 CC(C)[C@H](N)[C@@H](C)O Amb24611787 [0,1,0,0,1,0|1,0,1]=4 4325 B7R0.16 CC(C)[C@H](O)C(=O)Cl Amb25285621 [0,1,0,0,1,0|1,0,0]=3 4326 B7R0.16 CC(C)[C@H](O)C(C)=O Amb25723739 [0,1,0,0,1,0|1,0,0]=3 4327 B7R0.16 CC(C)[C@H](O)[C@@H](C)O Amb24591386 [0,1,0,0,1,0|1,0,1]=4 4328 B7R0.16 CC(C)[C@H](O)[C@H](C)O Amb25043671 [0,1,0,0,1,0|1,0,1]=4 4329 B7R0.16 CC(C)[C@H](S)C(O)=O Amb25662094 [0,1,0,0,1,0|0,0,0]=2 4330 B7R0.16 CC(Cl)C(=C)C(O)=O Amb24701921 [0,1,0,0,1,0|1,0,1]=4 4331 B7R0.16 CC(Cl)C(C)C(=O)Cl Amb25209986 [0,1,0,0,1,0|2,0,0]=4 4332 B7R0.16 CC(Cl)C(Cl)C(C)=O Amb25713717 [0,1,0,0,1,0|2,0,0]=4 4333 B7R0.16 CC(Cl)C(Cl)C(N)=O Amb24357982 [0,1,0,0,1,0|2,0,0]=4 4334 B7R0.16 CC(Cl)C(N)C(O)=O Amb25269614 [0,1,0,0,1,0|1,0,0]=3 4335 B7R0.16 CC(Cl)C(O)C(O)=O Amb25222028 [0,1,0,0,1,0|1,0,0]=3 4336 B7R0.16 CC(F)C(Br)C(O)=O Amb25304346 [0,1,0,0,1,0|1,0,0]=3 4337 B7R0.16 CC(F)C(F)C(O)=O Amb24687273 [0,1,0,0,1,0|1,0,0]=3 4338 B7R0.16 CC(F)C(O)C(O)=O Amb24385715 [0,1,0,0,1,0|1,0,0]=3 4339 B7R0.16 CC(N(C(=O)N)C)C Amb1132046 [0,1,0,0,1,0|2,0,0]=4 4340 B7R0.16 CC(N)C(N)C(O)=O Amb17678795 [0,1,0,0,1,0|1,0,0]=3 4341 B7R0.16 CC(N)C(N)C(O)=O Amb22728051 [0,1,0,0,1,0|1,0,0]=3 4342 B7R0.16 CC(N)C(O)C(O)=O Amb18641970 [0,1,0,0,1,0|1,0,0]=3 4343 B7R0.16 CC(N)[C@H](N)C(O)=O Amb25083113 [0,1,0,0,1,0|1,0,0]=3 4344 B7R0.16 CC(O)C(=O)C(O)=O Amb24481396 [0,1,0,0,1,0|1,0,1]=4 4345 B7R0.16 CC(O)C(N)C(C)=O Amb25026434 [0,1,0,0,1,0|2,0,0]=4 4346 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,1,0,0,1,0|2,0,0]=4 4347 B7R0.16 CC(O)C(N)P(O)=O Amb24428649 [0,1,0,0,1,0|2,0,0]=4 4348 B7R0.16 CC(O)C(O)C(O)=O Amb18124272 [0,1,0,0,1,0|1,0,0]=3 4349 B7R0.16 CC(O)N(C)C(O)=O Amb22641864 [0,1,0,0,1,0|2,0,0]=4 4350 B7R0.16 CC(O)[C@@H](C)C(O)=O Amb25857406 [0,1,0,0,1,0|1,0,0]=3 4351 B7R0.16 CC(S)C(Cl)C(N)=O Amb24483091 [0,1,0,0,1,0|2,0,0]=4 4352 B7R0.16 CC(S)[C@@H](N)C(O)=O Amb24606864 [0,1,0,0,1,0|1,0,0]=3 4353 B7R0.16 CC(S)[C@H](N)C(O)=O Amb25684204 [0,1,0,0,1,0|1,0,0]=3 4354 B7R0.16 CC([C@@H](C)N)C(O)=O Amb24680995 [0,1,0,0,1,0|1,0,0]=3 4355 B7R0.16 CN(C)C(=N)C(O)=O Amb18641880 [0,1,0,0,1,0|1,0,1]=4 4356 B7R0.16 CN(C)C(=S)C(O)=O Amb24068793 [0,1,0,0,1,0|1,0,1]=4 4357 B7R0.16 CN(C)C(N)C(O)=O Amb24746695 [0,1,0,0,1,0|1,0,0]=3 4358 B7R0.16 C[C@@H](C(=O)O)C(C)C Amb10844600 [0,1,0,0,1,0|0,0,0]=2 4359 B7R0.16 C[C@@H](C(N)=O)N(C)C Amb25031426 [0,1,0,0,1,0|2,0,0]=4 4360 B7R0.16 C[C@@H](C(O)=O)N(C)C Amb22587534 [0,1,0,0,1,0|1,0,0]=3 4361 B7R0.16 C[C@@H](C(O)=O)N(C)Cl Amb24640409 [0,1,0,0,1,0|2,0,0]=4 4362 B7R0.16 C[C@@H](Cl)[C@@H](Br)C(O)=O Amb24526448 [0,1,0,0,1,0|1,0,0]=3 4363 B7R0.16 C[C@@H](Cl)[C@@H](O)C(O)=O Amb24445574 [0,1,0,0,1,0|1,0,0]=3 4364 B7R0.16 C[C@@H](F)[C@H](N)C(O)=O Amb25789807 [0,1,0,0,1,0|1,0,0]=3 4365 B7R0.16 C[C@@H](N)[C@@H](N)C(O)=O Amb22745396 [0,1,0,0,1,0|1,0,0]=3 4366 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb22745441 [0,1,0,0,1,0|1,0,0]=3 4367 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb24481409 [0,1,0,0,1,0|1,0,0]=3 4368 B7R0.16 C[C@@H](O)C(C)C(O)=O Amb24469914 [0,1,0,0,1,0|1,0,0]=3 4369 B7R0.16 C[C@@H](O)[13C@H](N)[13C](O)=O Amb22336905 [0,1,0,0,1,0|1,0,0]=3 4370 B7R0.16 C[C@@H](O)[C@@H](C)C(O)=O Amb24481394 [0,1,0,0,1,0|1,0,0]=3 4371 B7R0.16 C[C@@H](O)[C@@H](N)C(C)=O Amb25238428 [0,1,0,0,1,0|2,0,0]=4 4372 B7R0.16 C[C@@H](O)[C@@H](O)C(C)=O Amb24701454 [0,1,0,0,1,0|2,0,0]=4 4373 B7R0.16 C[C@@H](O)[C@H](F)C(O)=O Amb24470562 [0,1,0,0,1,0|1,0,0]=3 4374 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,1,0,0,1,0|2,0,0]=4 4375 B7R0.16 C[C@@H](O)[C@H](N)C(O)=O Amb22351168 [0,1,0,0,1,0|1,0,0]=3 4376 B7R0.16 C[C@@H](O)[C@H](O)C(C)=O Amb24481484 [0,1,0,0,1,0|2,0,0]=4 4377 B7R0.16 C[C@@H](O)[C@H]([15NH2])C(O)=O Amb22353591 [0,1,0,0,1,0|1,0,0]=3 4378 B7R0.16 C[C@@H](S)[C@@H](N)C(O)=O Amb24333717 [0,1,0,0,1,0|1,0,0]=3 4379 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24117242 [0,1,0,0,1,0|1,0,0]=3 4380 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24726915 [0,1,0,0,1,0|1,0,0]=3 4381 B7R0.16 C[C@@H]([C@@H](C)N)C(O)=O Amb24410324 [0,1,0,0,1,0|1,0,0]=3 4382 B7R0.16 C[C@@H]([C@H](C(=O)O)C)O Amb10844569 [0,1,0,0,1,0|1,0,0]=3 4383 B7R0.16 C[C@H](Br)[C@H](N)C(O)=O Amb24711401 [0,1,0,0,1,0|1,0,0]=3 4384 B7R0.16 C[C@H](C(=O)O)C(C)C Amb10844601 [0,1,0,0,1,0|0,0,0]=2 4385 B7R0.16 C[C@H](C(N)=O)N(C)C Amb24687546 [0,1,0,0,1,0|2,0,0]=4 4386 B7R0.16 C[C@H](C(O)=O)N(C)C Amb22586633 [0,1,0,0,1,0|1,0,0]=3 4387 B7R0.16 C[C@H](F)[C@H](N)C(O)=O Amb25805291 [0,1,0,0,1,0|1,0,0]=3 4388 B7R0.16 C[C@H](N)C(=C)C(O)=O Amb24631906 [0,1,0,0,1,0|1,0,1]=4 4389 B7R0.16 C[C@H](N)C(O)C(N)=O Amb24431514 [0,1,0,0,1,0|2,0,0]=4 4390 B7R0.16 C[C@H](N)C(O)C(O)=O Amb24649032 [0,1,0,0,1,0|1,0,0]=3 4391 B7R0.16 C[C@H](N)[C@@H](F)C(N)=O Amb25825111 [0,1,0,0,1,0|2,0,0]=4 4392 B7R0.16 C[C@H](N)[C@@H](F)C(O)=O Amb25293984 [0,1,0,0,1,0|1,0,0]=3 4393 B7R0.16 C[C@H](N)[C@@H](N)C(O)=O Amb17678796 [0,1,0,0,1,0|1,0,0]=3 4394 B7R0.16 C[C@H](N)[C@H](F)C(N)=O Amb24483015 [0,1,0,0,1,0|2,0,0]=4 4395 B7R0.16 C[C@H](N)[C@H](N)C(O)=O Amb17678797 [0,1,0,0,1,0|1,0,0]=3 4396 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb19929490 [0,1,0,0,1,0|1,0,0]=3 4397 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb24407396 [0,1,0,0,1,0|1,0,0]=3 4398 B7R0.16 C[C@H](O)C(N)C(O)=O Amb24377632 [0,1,0,0,1,0|1,0,0]=3 4399 B7R0.16 C[C@H](O)[C@@H](O)C(O)=O Amb25844932 [0,1,0,0,1,0|1,0,0]=3 4400 B7R0.16 C[C@H](O)[C@H](N)C(N)=O Amb25746274 [0,1,0,0,1,0|2,0,0]=4 4401 B7R0.16 C[C@H](S)[C@H](N)C(O)=O Amb25131648 [0,1,0,0,1,0|1,0,0]=3 4402 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O Amb16183845 [0,1,0,0,1,0|2,0,0]=4 4403 B7R0.16 C[C@H]([C@@H](C(=O)O)C)O Amb10844572 [0,1,0,0,1,0|1,0,0]=3 4404 B7R0.16 C[C@H]([C@@H](C)N)C(C)=O Amb25254240 [0,1,0,0,1,0|2,0,0]=4 4405 B7R0.16 C[C@H]([C@@H](C)N)C(O)=O Amb25679842 [0,1,0,0,1,0|1,0,0]=3 4406 B7R0.16 C[C@H]([C@@H](C)O)C(C)=O Amb25144117 [0,1,0,0,1,0|2,0,0]=4 4407 B7R0.16 C[C@H]([C@@H]([13C](=O)O)N)O Amb17620634 [0,1,0,0,1,0|1,0,0]=3 4408 B7R0.16 C[C@H]([C@H](C)S)C(O)=O Amb24481380 [0,1,0,0,1,0|1,0,0]=3 4409 B7R0.16 Cl[C@H](C(=O)O)C(C)C Amb16232072 [0,1,0,0,1,0|0,0,0]=2 4410 B7R0.16 NC(C(Cl)Cl)C(O)=O Amb24433439 [0,1,0,0,1,0|2,0,0]=4 4411 B7R0.16 NC(C(F)F)C(O)=O Amb24713127 [0,1,0,0,1,0|2,0,0]=4 4412 B7R0.16 NC(C(O)O)C(O)=O Amb25682498 [0,1,0,0,1,0|2,0,0]=4 4413 B7R0.16 N[C@@H](C(Cl)Cl)C(O)=O Amb25101008 [0,1,0,0,1,0|2,0,0]=4 4414 B7R0.16 N[C@@H](C(F)F)C(O)=O Amb24433723 [0,1,0,0,1,0|2,0,0]=4 4415 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16183986 [0,1,0,0,1,0|1,0,0]=3 4416 B7R0.16 N[C@H](C(=O)N)C(C)C Amb16231400 [0,1,0,0,1,0|1,0,0]=3 4417 B7R0.16 N[C@H](C(F)F)C(O)=O Amb24659125 [0,1,0,0,1,0|2,0,0]=4 4418 B7R0.16 OC(=O)C(Cl)C(Cl)Cl Amb24426145 [0,1,0,0,1,0|2,0,0]=4 4419 B7R0.16 OC(C(=O)O)C(C)C Amb2582547 [0,1,0,0,1,0|0,0,0]=2 4420 B7R0.16 OC(C(F)F)C(O)=O Amb25074883 [0,1,0,0,1,0|2,0,0]=4 4421 B7R0.16 O[C@@H](C(=O)O)C(C)C Amb10071589 [0,1,0,0,1,0|0,0,0]=2 4422 B7R0.16 [13CH3]C([13CH3])C(=O)C([O-])=O Amb22353581 [0,1,0,0,1,0|0,0,2]=4 4423 B7R0.16 [13CH3]C([13CH3])[13C](=O)[13C]([O-])=O Amb22338387 [0,1,0,0,1,0|0,0,2]=4 4424 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](O)=O Amb22353590 [0,1,0,0,1,0|1,0,0]=3 4425 B7R0.16 [13CH3][13CH]([13CH3])[13C@H]([15NH2])[13C](O)=O Amb22338876 [0,1,0,0,1,0|0,0,0]=2 4426 B7R0.16 [14CH3][14CH](O)[14CH](N)[14C](O)=O Amb22352529 [0,1,0,0,1,0|1,0,0]=3 4427 B9R0.1 BrCC(=O)NCCC(C)C Amb17325046 [0,1,0,0,0,1|1,0,0]=3 4428 B9R0.1 BrCC(=O)NCCN(C)C Amb17331884 [0,1,0,0,0,1|2,0,0]=4 4429 B9R0.1 C#CC(F)CCCC(O)=O Amb25340465 [0,1,0,0,0,1|1,0,1]=4 4430 B9R0.1 C#C[C@H](F)CCCC(O)=O Amb25113496 [0,1,0,0,0,1|1,0,1]=4 4431 B9R0.1 C=CC(O)CCCC(O)=O Amb25137244 [0,1,0,0,0,1|1,0,1]=4 4432 B9R0.1 C=CC(O)CSCC(O)=O Amb25092349 [0,1,0,0,0,1|1,0,1]=4 4433 B9R0.1 C=C[C@@H](O)CCCC(O)=O Amb24352126 [0,1,0,0,0,1|1,0,1]=4 4434 B9R0.1 C=C[C@H](O)CSCC(O)=O Amb24482220 [0,1,0,0,0,1|1,0,1]=4 4435 B9R0.1 CC(=C)CNCC(=O)OC Amb25139895 [0,1,0,0,0,1|0,0,2]=4 4436 B9R0.1 CC(=O)CCOC(=O)CO Amb24482823 [0,1,0,0,0,1|1,0,1]=4 4437 B9R0.1 CC(=O)NCC[C@H](N)CN Amb24505131 [0,1,0,0,0,1|2,0,0]=4 4438 B9R0.1 CC(=O)OCCC(Cl)CCl Amb24709893 [0,1,0,0,0,1|2,0,0]=4 4439 B9R0.1 CC(=O)OCC[C@H](O)CCl Amb24480674 [0,1,0,0,0,1|2,0,0]=4 4440 B9R0.1 CC(C#C)NCCC(N)=O Amb25774260 [0,1,0,0,0,1|1,0,1]=4 4441 B9R0.1 CC(C#N)SCCC(N)=O Amb24602315 [0,1,0,0,0,1|1,0,1]=4 4442 B9R0.1 CC(C#N)SCCC(O)=O Amb18800092 [0,1,0,0,0,1|0,0,1]=3 4443 B9R0.1 CC(C)=CCCC(=O)C#C Amb25233784 [0,1,0,0,0,1|1,0,1]=4 4444 B9R0.1 CC(C)=CCCC(=O)C=C Amb25720660 [0,1,0,0,0,1|1,0,1]=4 4445 B9R0.1 CC(C)=CCCC(=O)CBr Amb25826520 [0,1,0,0,0,1|1,0,1]=4 4446 B9R0.1 CC(C)=CCCC(C)NC Amb22055566 [0,1,0,0,0,1|2,0,0]=4 4447 B9R0.1 CC(C)=CCOC(=O)CO Amb24445096 [0,1,0,0,0,1|0,0,2]=4 4448 B9R0.1 CC(C)=NOCC(=O)OC Amb24478437 [0,1,0,0,0,1|1,0,1]=4 4449 B9R0.1 CC(C)C=NNC(=O)CO Amb24429428 [0,1,0,0,0,1|1,0,1]=4 4450 B9R0.1 CC(C)CCCC(=O)CBr Amb25243040 [0,1,0,0,0,1|1,0,0]=3 4451 B9R0.1 CC(C)CCCC(C)=NN Amb25285502 [0,1,0,0,0,1|2,0,0]=4 4452 B9R0.1 CC(C)CCCC(C)C=O Amb18124610 [0,1,0,0,0,1|1,0,1]=4 4453 B9R0.1 CC(C)CCCC(C)CO Amb24082368 [0,1,0,0,0,1|1,0,1]=4 4454 B9R0.1 CC(C)CCCC(F)CO Amb25105959 [0,1,0,0,0,1|1,0,1]=4 4455 B9R0.1 CC(C)CCCC(O)C=O Amb24479252 [0,1,0,0,0,1|0,0,1]=3 4456 B9R0.1 CC(C)CCCC(O)CC Amb24478002 [0,1,0,0,0,1|1,0,1]=4 4457 B9R0.1 CC(C)CCCC(O)CCl Amb24502306 [0,1,0,0,0,1|1,0,1]=4 4458 B9R0.1 CC(C)CCC[C@@H](O)C=C Amb24630692 [0,1,0,0,0,1|1,0,1]=4 4459 B9R0.1 CC(C)CCC[C@@H](O)CCl Amb24505277 [0,1,0,0,0,1|1,0,1]=4 4460 B9R0.1 CC(C)CCC[C@H](O)CO Amb25069735 [0,1,0,0,0,1|0,0,2]=4 4461 B9R0.1 CC(C)CCNC(=O)C#C Amb24482628 [0,1,0,0,0,1|1,0,0]=3 4462 B9R0.1 CC(C)CCNC(=O)CF Amb25733429 [0,1,0,0,0,1|1,0,0]=3 4463 B9R0.1 CC(C)CCNC(=O)CS Amb24757445 [0,1,0,0,0,1|0,1,0]=3 4464 B9R0.1 CC(C)CCNC(N)=NN Amb25677668 [0,1,0,0,0,1|2,0,0]=4 4465 B9R0.1 CC(C)CCNC(N)=NO Amb25224367 [0,1,0,0,0,1|1,0,0]=3 4466 B9R0.1 CC(C)CCN[C@@H](C)CO Amb25686264 [0,1,0,0,0,1|1,0,1]=4 4467 B9R0.1 CC(C)CCOC(=O)C=C Amb17933945 [0,1,0,0,0,1|1,0,0]=3 4468 B9R0.1 CC(C)CCOC(=O)CBr Amb25828483 [0,1,0,0,0,1|1,0,0]=3 4469 B9R0.1 CC(C)CCOC(=O)CS Amb22230770 [0,1,0,0,0,1|0,1,0]=3 4470 B9R0.1 CC(C)CCOC(=O)NN Amb24374172 [0,1,0,0,0,1|1,0,0]=3 4471 B9R0.1 CC(C)CCO[C@@H](C)CO Amb25357520 [0,1,0,0,0,1|1,0,1]=4 4472 B9R0.1 CC(C)CCSC(N)=NN Amb25749055 [0,1,0,0,0,1|2,0,0]=4 4473 B9R0.1 CC(C)CNCC(Cl)=CCl Amb24717337 [0,1,0,0,0,1|2,0,0]=4 4474 B9R0.1 CC(C)CNCC(O)C=C Amb25749065 [0,1,0,0,0,1|1,0,1]=4 4475 B9R0.1 CC(C)CNCC(O)CC Amb24558054 [0,1,0,0,0,1|1,0,1]=4 4476 B9R0.1 CC(C)CNCC(O)CF Amb24551238 [0,1,0,0,0,1|1,0,1]=4 4477 B9R0.1 CC(C)CNC[C@@H](O)CC Amb24425124 [0,1,0,0,0,1|1,0,1]=4 4478 B9R0.1 CC(C)CNC[C@H](C)CO Amb25071769 [0,1,0,0,0,1|1,0,1]=4 4479 B9R0.1 CC(C)COCC(=O)NN Amb19960441 [0,1,0,0,0,1|1,0,0]=3 4480 B9R0.1 CC(C)COCC(C)CO Amb25718715 [0,1,0,0,0,1|1,0,1]=4 4481 B9R0.1 CC(C)COCC(O)C#N Amb25846269 [0,1,0,0,0,1|1,0,1]=4 4482 B9R0.1 CC(C)COCC(O)CC Amb25728347 [0,1,0,0,0,1|1,0,1]=4 4483 B9R0.1 CC(C)COC[C@@H](O)CN Amb24659665 [0,1,0,0,0,1|1,0,1]=4 4484 B9R0.1 CC(C)COC[C@H](O)CN Amb24383911 [0,1,0,0,0,1|1,0,1]=4 4485 B9R0.1 CC(C)CONC(=O)C=C Amb24739284 [0,1,0,0,0,1|2,0,0]=4 4486 B9R0.1 CC(C)CONC(=O)CCl Amb25169313 [0,1,0,0,0,1|2,0,0]=4 4487 B9R0.1 CC(C)CONC(=O)CN Amb24415654 [0,1,0,0,0,1|2,0,0]=4 4488 B9R0.1 CC(C)CSCC(=C)CCl Amb25306863 [0,1,0,0,0,1|2,0,0]=4 4489 B9R0.1 CC(C)CSCC(=O)C=C Amb25353956 [0,1,0,0,0,1|1,0,0]=3 4490 B9R0.1 CC(C)CSCC(=O)NO Amb24380503 [0,1,0,0,0,1|0,0,0]=2 4491 B9R0.1 CC(C)CSCC(C)=NO Amb24522981 [0,1,0,0,0,1|1,0,0]=3 4492 B9R0.1 CC(C)CSCC(O)C=C Amb24649041 [0,1,0,0,0,1|1,0,1]=4 4493 B9R0.1 CC(C)CSCC(O)CC Amb18792450 [0,1,0,0,0,1|1,0,1]=4 4494 B9R0.1 CC(C)CSCC(O)CCl Amb24692833 [0,1,0,0,0,1|1,0,1]=4 4495 B9R0.1 CC(C)CSCC(O)CF Amb24608548 [0,1,0,0,0,1|1,0,1]=4 4496 B9R0.1 CC(C)CSCC(O)CO Amb24704716 [0,1,0,0,0,1|0,0,2]=4 4497 B9R0.1 CC(C)CSC[C@@H](O)CC Amb25272476 [0,1,0,0,0,1|1,0,1]=4 4498 B9R0.1 CC(C)CSC[C@@H](O)CN Amb24334228 [0,1,0,0,0,1|1,0,1]=4 4499 B9R0.1 CC(C)NCCC(=O)C#C Amb24524424 [0,1,0,0,0,1|1,0,0]=3 4500 B9R0.1 CC(C)NCCC(=O)C=C Amb25027994 [0,1,0,0,0,1|1,0,0]=3 4501 B9R0.1 CC(C)NCCC(C)OC Amb24476925 [0,1,0,0,0,1|1,0,1]=4 4502 B9R0.1 CC(C)NCCC(O)CC Amb24458822 [0,1,0,0,0,1|1,0,1]=4 4503 B9R0.1 CC(C)NCC\C(\N)=N/O Amb19981282 [0,1,0,0,0,1|1,0,0]=3 4504 B9R0.1 CC(C)OCCC(=O)C#C Amb24520902 [0,1,0,0,0,1|1,0,0]=3 4505 B9R0.1 CC(C)OCCC(=O)NN Amb20076066 [0,1,0,0,0,1|1,0,0]=3 4506 B9R0.1 CC(C)OCCC(N)CO Amb24592118 [0,1,0,0,0,1|1,0,1]=4 4507 B9R0.1 CC(C)OCNC(=O)CCl Amb25698281 [0,1,0,0,0,1|2,0,0]=4 4508 B9R0.1 CC(C)OCOC(=O)CCl Amb24401503 [0,1,0,0,0,1|2,0,0]=4 4509 B9R0.1 CC(C)SCCC(=O)NN Amb24477909 [0,1,0,0,0,1|1,0,0]=3 4510 B9R0.1 CC(C)SCCC(C)CO Amb24371727 [0,1,0,0,0,1|1,0,1]=4 4511 B9R0.1 CC(C)SCCC(N)CO Amb24743364 [0,1,0,0,0,1|1,0,1]=4 4512 B9R0.1 CC(C)SCC\C(\N)=N\O Amb18792441 [0,1,0,0,0,1|1,0,0]=3 4513 B9R0.1 CC(C=C)NCCC(O)=O Amb24662882 [0,1,0,0,0,1|0,0,1]=3 4514 B9R0.1 CC(C=C)OCCC(C)=O Amb25318884 [0,1,0,0,0,1|1,0,1]=4 4515 B9R0.1 CC(C=C)ONCC(O)=O Amb24658665 [0,1,0,0,0,1|1,0,1]=4 4516 B9R0.1 CC(C=C)SCCC(O)=O Amb18182545 [0,1,0,0,0,1|0,0,1]=3 4517 B9R0.1 CC(C=C)\C=C\CC(O)=O Amb18643542 [0,1,0,0,0,1|0,0,2]=4 4518 B9R0.1 CC(CBr)=NOCC(O)=O Amb24747167 [0,1,0,0,0,1|1,0,1]=4 4519 B9R0.1 CC(CBr)CCC=C(C)C Amb24548827 [0,1,0,0,0,1|2,0,0]=4 4520 B9R0.1 CC(CBr)CCCC(C)=C Amb25357871 [0,1,0,0,0,1|2,0,0]=4 4521 B9R0.1 CC(CBr)NCCS(C)=O Amb24538833 [0,1,0,0,0,1|2,0,0]=4 4522 B9R0.1 CC(CC)=NNCC(O)=O Amb25162373 [0,1,0,0,0,1|1,0,1]=4 4523 B9R0.1 CC(CC)=NOCC(O)=O Amb25266480 [0,1,0,0,0,1|1,0,1]=4 4524 B9R0.1 CC(CCCC(C)=O)C#N Amb18124539 [0,1,0,0,0,1|1,0,1]=4 4525 B9R0.1 CC(CCCC(C)=O)C=O Amb24453385 [0,1,0,0,0,1|1,0,1]=4 4526 B9R0.1 CC(CCCC(O)=O)C#N Amb18643710 [0,1,0,0,0,1|0,0,1]=3 4527 B9R0.1 CC(CCCC(O)=O)C=C Amb24716210 [0,1,0,0,0,1|0,0,1]=3 4528 B9R0.1 CC(CCCC(O)=O)CO Amb25068017 [0,1,0,0,0,1|0,0,0]=2 4529 B9R0.1 CC(CCCN(C)C)=NO Amb25287390 [0,1,0,0,0,1|2,0,0]=4 4530 B9R0.1 CC(CCl)CCCC(O)=O Amb18646189 [0,1,0,0,0,1|0,0,0]=2 4531 B9R0.1 CC(CCl)CCOC(C)=O Amb25757561 [0,1,0,0,0,1|1,0,0]=3 4532 B9R0.1 CC(CCl)NCCS(C)=O Amb25243809 [0,1,0,0,0,1|2,0,0]=4 4533 B9R0.1 CC(CCl)SCCS(C)=O Amb24563154 [0,1,0,0,0,1|2,0,0]=4 4534 B9R0.1 CC(CN)CCCC(C)=C Amb25338731 [0,1,0,0,0,1|2,0,0]=4 4535 B9R0.1 CC(CN)CNCC(=C)Br Amb25717917 [0,1,0,0,0,1|2,0,0]=4 4536 B9R0.1 CC(CN)CNCC(C)O Amb25372424 [0,1,0,0,0,1|1,0,1]=4 4537 B9R0.1 CC(CN)CNCC(O)=O Amb25773527 [0,1,0,0,0,1|0,0,0]=2 4538 B9R0.1 CC(CN)CSCC(=C)Cl Amb25771008 [0,1,0,0,0,1|2,0,0]=4 4539 B9R0.1 CC(CN)CSCC(C)=C Amb24586090 [0,1,0,0,0,1|2,0,0]=4 4540 B9R0.1 CC(CN)CSCC(C)O Amb25704682 [0,1,0,0,0,1|1,0,1]=4 4541 B9R0.1 CC(CN)NCCC(C)O Amb25028008 [0,1,0,0,0,1|1,0,1]=4 4542 B9R0.1 CC(CN)NCCC(N)=O Amb24602322 [0,1,0,0,0,1|1,0,0]=3 4543 B9R0.1 CC(CN)NCCC(O)=O Amb24520910 [0,1,0,0,0,1|0,0,0]=2 4544 B9R0.1 CC(CN)NCCS(C)=O Amb25028006 [0,1,0,0,0,1|2,0,0]=4 4545 B9R0.1 CC(CN)OCCC(C)=C Amb24431935 [0,1,0,0,0,1|2,0,0]=4 4546 B9R0.1 CC(CN)OCCC(C)=O Amb18630514 [0,1,0,0,0,1|1,0,0]=3 4547 B9R0.1 CC(CN)OCCC(O)=O Amb18629690 [0,1,0,0,0,1|0,0,0]=2 4548 B9R0.1 CC(CN)SCCC(C)=C Amb25075504 [0,1,0,0,0,1|2,0,0]=4 4549 B9R0.1 CC(CN)SCCC(C)O Amb25826259 [0,1,0,0,0,1|1,0,1]=4 4550 B9R0.1 CC(CNCC(C)O)OC Amb25859050 [0,1,0,0,0,1|1,0,1]=4 4551 B9R0.1 CC(CNCC(C)O)SC Amb24520789 [0,1,0,0,0,1|1,0,1]=4 4552 B9R0.1 CC(CNCC(N)=O)CN Amb25185175 [0,1,0,0,0,1|1,0,0]=3 4553 B9R0.1 CC(CNCC(O)=O)=CCl Amb24482539 [0,1,0,0,0,1|0,0,2]=4 4554 B9R0.1 CC(CNCC(O)=O)C#N Amb25027854 [0,1,0,0,0,1|0,0,1]=3 4555 B9R0.1 CC(CNC[C@H](C)O)OC Amb24360707 [0,1,0,0,0,1|1,0,1]=4 4556 B9R0.1 CC(CNC[C@H](C)O)SC Amb25110537 [0,1,0,0,0,1|1,0,1]=4 4557 B9R0.1 CC(CO)CCNC(N)=N Amb25341289 [0,1,0,0,0,1|2,0,0]=4 4558 B9R0.1 CC(CO)CNCC(=C)Br Amb24637572 [0,1,0,0,0,1|2,0,0]=4 4559 B9R0.1 CC(CO)CNCC(=C)Cl Amb24466435 [0,1,0,0,0,1|2,0,0]=4 4560 B9R0.1 CC(CO)CNCC(C)=C Amb24529752 [0,1,0,0,0,1|2,0,0]=4 4561 B9R0.1 CC(CO)COCC(C)=C Amb24422310 [0,1,0,0,0,1|2,0,0]=4 4562 B9R0.1 CC(CO)CSCC(C)=C Amb25794414 [0,1,0,0,0,1|2,0,0]=4 4563 B9R0.1 CC(CO)CSCC(C)=O Amb24702606 [0,1,0,0,0,1|1,0,0]=3 4564 B9R0.1 CC(CO)NCCC(O)=O Amb17719769 [0,1,0,0,0,1|0,0,0]=2 4565 B9R0.1 CC(CO)SCCC(C)=O Amb24393859 [0,1,0,0,0,1|1,0,0]=3 4566 B9R0.1 CC(CO)SCCC(N)=O Amb25146975 [0,1,0,0,0,1|1,0,0]=3 4567 B9R0.1 CC(COCC(O)=O)=CCl Amb24482508 [0,1,0,0,0,1|0,0,2]=4 4568 B9R0.1 CC(C\C=C\C(O)=O)C#N Amb24670837 [0,1,0,0,0,1|0,0,2]=4 4569 B9R0.1 CC(C\C=C\C(O)=O)C=C Amb24598302 [0,1,0,0,0,1|0,0,2]=4 4570 B9R0.1 CC(Cl)CCOC(=O)CCl Amb24482285 [0,1,0,0,0,1|2,0,0]=4 4571 B9R0.1 CC(N)CCCC(=O)C#C Amb24738059 [0,1,0,0,0,1|2,0,0]=4 4572 B9R0.1 CC(N)CCCC(=O)C=C Amb24504987 [0,1,0,0,0,1|2,0,0]=4 4573 B9R0.1 CC(N)CCCC(=O)NN Amb24365195 [0,1,0,0,0,1|2,0,0]=4 4574 B9R0.1 CC(N)CCNC(=O)CN Amb24416462 [0,1,0,0,0,1|2,0,0]=4 4575 B9R0.1 CC(O)CCCC(=O)C=C Amb24478307 [0,1,0,0,0,1|2,0,0]=4 4576 B9R0.1 CC(O)CCCC(=O)NN Amb24352284 [0,1,0,0,0,1|2,0,0]=4 4577 B9R0.1 CC(O)CCCC(C)CO Amb24420267 [0,1,0,0,0,1|1,0,1]=4 4578 B9R0.1 CC(O)CCNC(=O)C#C Amb24718699 [0,1,0,0,0,1|2,0,0]=4 4579 B9R0.1 CC(O)CCNC(=O)CN Amb21958786 [0,1,0,0,0,1|2,0,0]=4 4580 B9R0.1 CC(O)CCNC(=O)CO Amb24482704 [0,1,0,0,0,1|1,0,0]=3 4581 B9R0.1 CC(O)CCNC(C)CO Amb25147813 [0,1,0,0,0,1|1,0,1]=4 4582 B9R0.1 CC(O)CCOC(=O)C=C Amb25317488 [0,1,0,0,0,1|2,0,0]=4 4583 B9R0.1 CC(O)CCSC(C)CO Amb24437913 [0,1,0,0,0,1|1,0,1]=4 4584 B9R0.1 CC(O)CC\C=C(\C)/CO Amb25761912 [0,1,0,0,0,1|2,0,0]=4 4585 B9R0.1 CC(O)CNCC(C)CO Amb25742842 [0,1,0,0,0,1|1,0,1]=4 4586 B9R0.1 CC(O)COCC(=O)CO Amb24371356 [0,1,0,0,0,1|1,0,0]=3 4587 B9R0.1 CCC(=C)CNCC(C)C Amb25848729 [0,1,0,0,0,1|2,0,0]=4 4588 B9R0.1 CCC(=N)NCCC(C)C Amb24677149 [0,1,0,0,0,1|2,0,0]=4 4589 B9R0.1 CCC(=O)CCC[C@H](C)O Amb25723337 [0,1,0,0,0,1|2,0,0]=4 4590 B9R0.1 CCC(=O)CSCC(C)C Amb18800475 [0,1,0,0,0,1|1,0,0]=3 4591 B9R0.1 CCC(=O)NCCC(=O)O Amb1120326 [0,1,0,0,0,1|1,0,1]=4 4592 B9R0.1 CCC(=O)NCCC(C)C Amb17738423 [0,1,0,0,0,1|1,0,0]=3 4593 B9R0.1 CCC(=O)NCCN(C)C Amb1207104 [0,1,0,0,0,1|2,0,0]=4 4594 B9R0.1 CCC(=O)NCC[C@@H](C)O Amb25795858 [0,1,0,0,0,1|2,0,0]=4 4595 B9R0.1 CCC(=O)NCC[C@H](C)O Amb24386638 [0,1,0,0,0,1|2,0,0]=4 4596 B9R0.1 CCC(=O)NCOC(C)C Amb10562770 [0,1,0,0,0,1|2,0,0]=4 4597 B9R0.1 CCC(=O)OCCC(C)O Amb24735173 [0,1,0,0,0,1|2,0,0]=4 4598 B9R0.1 CCC(=O)OCCN(C)C Amb25802700 [0,1,0,0,0,1|2,0,0]=4 4599 B9R0.1 CCC(=O)SCCN(C)C Amb25084328 [0,1,0,0,0,1|2,0,0]=4 4600 B9R0.1 CCC(Br)CCNC(C)=O Amb24388776 [0,1,0,0,0,1|2,0,0]=4 4601 B9R0.1 CCC(C)C#CCC(C)=O Amb25047884 [0,1,0,0,0,1|1,0,1]=4 4602 B9R0.1 CCC(C)CC#CC(O)=O Amb24661749 [0,1,0,0,0,1|0,0,1]=3 4603 B9R0.1 CCC(C)CCC=C(C)C Amb25076343 [0,1,0,0,0,1|2,0,0]=4 4604 B9R0.1 CCC(C)CCCC(C)=O Amb24424926 [0,1,0,0,0,1|1,0,0]=3 4605 B9R0.1 CCC(C)CCCC(N)=O Amb24350177 [0,1,0,0,0,1|1,0,0]=3 4606 B9R0.1 CCC(C)CCCC(O)=O Amb18124682 [0,1,0,0,0,1|0,0,0]=2 4607 B9R0.1 CCC(C)CCOC(C)=O Amb24325171 [0,1,0,0,0,1|1,0,0]=3 4608 B9R0.1 CCC(C)CCOC(N)=O Amb24478211 [0,1,0,0,0,1|1,0,0]=3 4609 B9R0.1 CCC(C)CNCC(=C)Br Amb25044418 [0,1,0,0,0,1|2,0,0]=4 4610 B9R0.1 CCC(C)CNCC(=C)Cl Amb18182593 [0,1,0,0,0,1|2,0,0]=4 4611 B9R0.1 CCC(C)CNCC(C)=C Amb24434834 [0,1,0,0,0,1|2,0,0]=4 4612 B9R0.1 CCC(C)CNC[C@@H](C)O Amb25045168 [0,1,0,0,0,1|1,0,1]=4 4613 B9R0.1 CCC(C)CONC(C)=O Amb25097564 [0,1,0,0,0,1|2,0,0]=4 4614 B9R0.1 CCC(C)CSCC(=C)Cl Amb24449060 [0,1,0,0,0,1|2,0,0]=4 4615 B9R0.1 CCC(C)CSCC(C)=C Amb25209723 [0,1,0,0,0,1|2,0,0]=4 4616 B9R0.1 CCC(C)CSCC(C)O Amb25733215 [0,1,0,0,0,1|1,0,1]=4 4617 B9R0.1 CCC(C)CSCC(N)=N Amb25115224 [0,1,0,0,0,1|2,0,0]=4 4618 B9R0.1 CCC(C)CSCC(N)=O Amb25218767 [0,1,0,0,0,1|1,0,0]=3 4619 B9R0.1 CCC(C)CSCC(O)=O Amb18800668 [0,1,0,0,0,1|0,0,0]=2 4620 B9R0.1 CCC(C)NCCC(C)O Amb25093108 [0,1,0,0,0,1|1,0,1]=4 4621 B9R0.1 CCC(C)NCCC(N)=O Amb19960042 [0,1,0,0,0,1|1,0,0]=3 4622 B9R0.1 CCC(C)NCC[C@@H](C)O Amb25796571 [0,1,0,0,0,1|1,0,1]=4 4623 B9R0.1 CCC(C)NCC[C@H](C)O Amb25769129 [0,1,0,0,0,1|1,0,1]=4 4624 B9R0.1 CCC(C)OCCC(C)=O Amb22229878 [0,1,0,0,0,1|1,0,0]=3 4625 B9R0.1 CCC(C)OCCC(N)=N Amb25769907 [0,1,0,0,0,1|2,0,0]=4 4626 B9R0.1 CCC(C)OCCC(N)=S Amb18180036 [0,1,0,0,0,1|1,1,0]=4 4627 B9R0.1 CCC(C)SCCC(N)=O Amb18798042 [0,1,0,0,0,1|1,0,0]=3 4628 B9R0.1 CCC(C)S\C=C\C(O)=O Amb24431541 [0,1,0,0,0,1|0,0,2]=4 4629 B9R0.1 CCC(C)\C=C/CC(C)=O Amb24708353 [0,1,0,0,0,1|1,0,1]=4 4630 B9R0.1 CCC(C)\C=C\CC(C)=O Amb24518460 [0,1,0,0,0,1|1,0,1]=4 4631 B9R0.1 CCC(Cl)CCCC(=O)Cl Amb25088358 [0,1,0,0,0,1|2,0,0]=4 4632 B9R0.1 CCC(Cl)CCNC(C)=O Amb24407934 [0,1,0,0,0,1|2,0,0]=4 4633 B9R0.1 CCC(F)CCCC(C)=O Amb25320248 [0,1,0,0,0,1|2,0,0]=4 4634 B9R0.1 CCC(N)CCNC(C)=O Amb25369840 [0,1,0,0,0,1|2,0,0]=4 4635 B9R0.1 CCC(N)COCC(C)=O Amb18103858 [0,1,0,0,0,1|2,0,0]=4 4636 B9R0.1 CCC(N)COCC(N)=O Amb25776983 [0,1,0,0,0,1|2,0,0]=4 4637 B9R0.1 CCC(N)COCC(O)=O Amb18630610 [0,1,0,0,0,1|1,0,0]=3 4638 B9R0.1 CCC(O)CCCC(C)=O Amb25146602 [0,1,0,0,0,1|2,0,0]=4 4639 B9R0.1 CCC(O)CCCC(O)=O Amb18644263 [0,1,0,0,0,1|1,0,0]=3 4640 B9R0.1 CCC(O)CCOC(C)=O Amb25345386 [0,1,0,0,0,1|2,0,0]=4 4641 B9R0.1 CCC(O)CCSC(C)=O Amb24379978 [0,1,0,0,0,1|2,0,0]=4 4642 B9R0.1 CCC(O)COCC(O)=O Amb25805810 [0,1,0,0,0,1|1,0,0]=3 4643 B9R0.1 CCC(O)CSCC(O)=O Amb18792573 [0,1,0,0,0,1|1,0,0]=3 4644 B9R0.1 CCN(C)CCNC(N)=O Amb25187364 [0,1,0,0,0,1|2,0,0]=4 4645 B9R0.1 CCN(C)C\C=C\C(O)=O Amb19020698 [0,1,0,0,0,1|1,0,1]=4 4646 B9R0.1 CCS(=O)CCCC(O)=O Amb18788302 [0,1,0,0,0,1|2,0,0]=4 4647 B9R0.1 CCS(=O)CCNC(C)C Amb25823367 [0,1,0,0,0,1|2,0,0]=4 4648 B9R0.1 CC[C@H](C)CCCC(C)=O Amb25128211 [0,1,0,0,0,1|1,0,0]=3 4649 B9R0.1 CC[C@H](O)CNCC(N)=O Amb24658160 [0,1,0,0,0,1|2,0,0]=4 4650 B9R0.1 CC\C(\C)=C/CCC(C)=O Amb25138109 [0,1,0,0,0,1|1,0,1]=4 4651 B9R0.1 CN(C)CCCC(N)=NO Amb20668517 [0,1,0,0,0,1|2,0,0]=4 4652 B9R0.1 CN(C)CCNC(=O)C#C Amb24404462 [0,1,0,0,0,1|2,0,0]=4 4653 B9R0.1 CN(C)CCNC(=O)CN Amb21958846 [0,1,0,0,0,1|2,0,0]=4 4654 B9R0.1 CN(C)CCNC(=O)CS Amb24073112 [0,1,0,0,0,1|1,1,0]=4 4655 B9R0.1 CN(C)CCNC(=O)NN Amb18064496 [0,1,0,0,0,1|2,0,0]=4 4656 B9R0.1 CN(C)CCNC(N)=NO Amb25765331 [0,1,0,0,0,1|2,0,0]=4 4657 B9R0.1 CN(C)CCOC(=O)C=C Amb22049493 [0,1,0,0,0,1|2,0,0]=4 4658 B9R0.1 CN(C)CCOC(=O)CCl Amb25215533 [0,1,0,0,0,1|2,0,0]=4 4659 B9R0.1 CN(C)CCOC(=O)CN Amb25305213 [0,1,0,0,0,1|2,0,0]=4 4660 B9R0.1 CN(C)CCOC(=O)NN Amb25101793 [0,1,0,0,0,1|2,0,0]=4 4661 B9R0.1 CN(C)NCCC(N)=NO Amb24479544 [0,1,0,0,0,1|2,0,0]=4 4662 B9R0.1 CN(CCCC(O)=O)C=O Amb19010086 [0,1,0,0,0,1|1,0,1]=4 4663 B9R0.1 CN=C(N)SCCC(C)C Amb24458483 [0,1,0,0,0,1|2,0,0]=4 4664 B9R0.1 CN=C(N)SCCC(C)C Amb24458939 [0,1,0,0,0,1|2,0,0]=4 4665 B9R0.1 CNC(=N)NCCC(C)C Amb20631268 [0,1,0,0,0,1|2,0,0]=4 4666 B9R0.1 CNC(=O)CCCN(C)C Amb24696256 [0,1,0,0,0,1|2,0,0]=4 4667 B9R0.1 CNC(=O)CCNC(C)C Amb20171905 [0,1,0,0,0,1|1,0,0]=3 4668 B9R0.1 CNC(=O)CN=CC(C)C Amb25786125 [0,1,0,0,0,1|1,0,1]=4 4669 B9R0.1 CNC(=O)CNOC(C)C Amb25279054 [0,1,0,0,0,1|2,0,0]=4 4670 B9R0.1 CNC(=O)COCC(=O)O Amb17232024 [0,1,0,0,0,1|1,0,1]=4 4671 B9R0.1 CNC(=O)CSCC(C)N Amb24446135 [0,1,0,0,0,1|2,0,0]=4 4672 B9R0.1 CNC(=O)CSCC(C)O Amb24402730 [0,1,0,0,0,1|2,0,0]=4 4673 B9R0.1 CNC(=O)CSC[C@H](C)O Amb25169392 [0,1,0,0,0,1|2,0,0]=4 4674 B9R0.1 CNC(=O)NCCC(=O)O Amb1127025 [0,1,0,0,0,1|1,0,1]=4 4675 B9R0.1 CNC(=O)NCCC(C)C Amb24720484 [0,1,0,0,0,1|1,0,0]=3 4676 B9R0.1 CNC(=O)NCCN(C)C Amb24715836 [0,1,0,0,0,1|2,0,0]=4 4677 B9R0.1 CNC(=O)NCC[C@@H](C)O Amb24482616 [0,1,0,0,0,1|2,0,0]=4 4678 B9R0.1 CNC(=O)OCCN(C)C Amb24478918 [0,1,0,0,0,1|2,0,0]=4 4679 B9R0.1 CNC(=O)SCCC(O)=O Amb25240640 [0,1,0,0,0,1|1,0,1]=4 4680 B9R0.1 CNC(=S)NCCC(C)C Amb25040131 [0,1,0,0,0,1|1,1,0]=4 4681 B9R0.1 CNC(=S)NCCC(O)=O Amb24482274 [0,1,0,0,0,1|1,0,1]=4 4682 B9R0.1 CNC(=S)OCCC(C)C Amb25274339 [0,1,0,0,0,1|1,1,0]=4 4683 B9R0.1 CNC(=S)SCCC(O)=O Amb25794447 [0,1,0,0,0,1|1,0,1]=4 4684 B9R0.1 CNC(C)CCCC(C)=C Amb24625063 [0,1,0,0,0,1|2,0,0]=4 4685 B9R0.1 CNC(CCC=C(C)C)C Amb17593577 [0,1,0,0,0,1|2,0,0]=4 4686 B9R0.1 COC(=O)CCCC(C)=O Amb17846860 [0,1,0,0,0,1|1,0,1]=4 4687 B9R0.1 COC(=O)CCCC(C)Br Amb24346809 [0,1,0,0,0,1|1,0,0]=3 4688 B9R0.1 COC(=O)CCCC(C)C Amb22586581 [0,1,0,0,0,1|0,0,0]=2 4689 B9R0.1 COC(=O)CCCC(C)Cl Amb24626627 [0,1,0,0,0,1|1,0,0]=3 4690 B9R0.1 COC(=O)CCCC(C)O Amb24414468 [0,1,0,0,0,1|1,0,0]=3 4691 B9R0.1 COC(=O)CCCS(C)=O Amb18788307 [0,1,0,0,0,1|2,0,0]=4 4692 B9R0.1 COC(=O)CCNC(=O)C Amb15691935 [0,1,0,0,0,1|1,0,1]=4 4693 B9R0.1 COC(=O)CCNN(C)C Amb24113609 [0,1,0,0,0,1|1,0,0]=3 4694 B9R0.1 COC(=O)CCSC(C)C Amb18800665 [0,1,0,0,0,1|0,0,0]=2 4695 B9R0.1 COC(=O)CCSC(F)F Amb25714489 [0,1,0,0,0,1|2,0,0]=4 4696 B9R0.1 COC(=O)CNCC(F)F Amb18179465 [0,1,0,0,0,1|2,0,0]=4 4697 B9R0.1 COC(=O)CNC[C@H](C)O Amb25773564 [0,1,0,0,0,1|1,0,0]=3 4698 B9R0.1 COC(=O)CNOC(C)C Amb25707401 [0,1,0,0,0,1|1,0,0]=3 4699 B9R0.1 COC(=O)COCC(C)Cl Amb25257984 [0,1,0,0,0,1|1,0,0]=3 4700 B9R0.1 COC(=O)COCC(O)=O Amb25305044 [0,1,0,0,0,1|1,0,1]=4 4701 B9R0.1 COC(=O)CSCC(=O)C Amb2444691 [0,1,0,0,0,1|1,0,1]=4 4702 B9R0.1 COC(=O)CSCC(C)O Amb18792574 [0,1,0,0,0,1|1,0,0]=3 4703 B9R0.1 COC(=O)CSC[C@@H](C)O Amb24375131 [0,1,0,0,0,1|1,0,0]=3 4704 B9R0.1 COC(=O)CSC[C@H](C)N Amb24396440 [0,1,0,0,0,1|1,0,0]=3 4705 B9R0.1 COC(=O)CSC[C@H](C)O Amb24375132 [0,1,0,0,0,1|1,0,0]=3 4706 B9R0.1 COC(=O)C\C=C\C(C)N Amb24726991 [0,1,0,0,0,1|1,0,1]=4 4707 B9R0.1 COC(=O)NCCC(C)C Amb17793051 [0,1,0,0,0,1|0,0,0]=2 4708 B9R0.1 COC(=O)NCCC(C)N Amb25736003 [0,1,0,0,0,1|1,0,0]=3 4709 B9R0.1 COC(=O)NCCC(C)O Amb24747341 [0,1,0,0,0,1|1,0,0]=3 4710 B9R0.1 COC(=O)NCCC(F)F Amb25075026 [0,1,0,0,0,1|2,0,0]=4 4711 B9R0.1 COC(=O)NCCN(C)C Amb25229032 [0,1,0,0,0,1|1,0,0]=3 4712 B9R0.1 COC(=O)NCC[C@@H](C)O Amb24353280 [0,1,0,0,0,1|1,0,0]=3 4713 B9R0.1 COC(=O)NOCC(C)C Amb25093309 [0,1,0,0,0,1|1,0,0]=3 4714 B9R0.1 COC(=O)\C=C/CC(C)C Amb10071548 [0,1,0,0,0,1|0,0,1]=3 4715 B9R0.1 COC(=O)\C=C\CC(C)N Amb24741139 [0,1,0,0,0,1|1,0,1]=4 4716 B9R0.1 COC(=O)\C=C\CC(C)O Amb24396746 [0,1,0,0,0,1|1,0,1]=4 4717 B9R0.1 COC(=O)\C=C\CN(C)C Amb17612878 [0,1,0,0,0,1|1,0,1]=4 4718 B9R0.1 COC(=O)\C=C\C[S+](C)C Amb25313396 [0,1,0,0,0,1|1,0,1]=4 4719 B9R0.1 COC(=O)\C=C\NC(C)C Amb24479661 [0,1,0,0,0,1|0,0,2]=4 4720 B9R0.1 COC(=S)SCCC(C)F Amb25712581 [0,1,0,0,0,1|1,1,0]=4 4721 B9R0.1 COC(=S)SCCN(C)C Amb25169423 [0,1,0,0,0,1|1,1,0]=4 4722 B9R0.1 COC(C)CCCC(C)=O Amb25146522 [0,1,0,0,0,1|1,0,0]=3 4723 B9R0.1 COC(C)CCCC(O)=O Amb25728362 [0,1,0,0,0,1|0,0,0]=2 4724 B9R0.1 COC(C)CCNC(C)=N Amb24421944 [0,1,0,0,0,1|2,0,0]=4 4725 B9R0.1 COC(C)CCNC(N)=S Amb24645534 [0,1,0,0,0,1|1,1,0]=4 4726 B9R0.1 COC(C)CCOC(=O)Cl Amb22168236 [0,1,0,0,0,1|1,0,0]=3 4727 B9R0.1 COC(C)CCOC(C)=O Amb19958959 [0,1,0,0,0,1|1,0,0]=3 4728 B9R0.1 COC(C)CCOC(N)=O Amb25679672 [0,1,0,0,0,1|1,0,0]=3 4729 B9R0.1 COC(C)CNCC(O)=O Amb25695493 [0,1,0,0,0,1|0,0,0]=2 4730 B9R0.1 COC(C)COCC(C)O Amb22729718 [0,1,0,0,0,1|1,0,1]=4 4731 B9R0.1 CON(C)CCCC(C)C Amb25787865 [0,1,0,0,0,1|2,0,0]=4 4732 B9R0.1 CON(C)CCNC(C)C Amb25079212 [0,1,0,0,0,1|2,0,0]=4 4733 B9R0.1 CON(C)CCOC(N)=O Amb24478870 [0,1,0,0,0,1|2,0,0]=4 4734 B9R0.1 CON(C)CCSC(C)C Amb25796126 [0,1,0,0,0,1|2,0,0]=4 4735 B9R0.1 CO[13C](=O)CCC[13C](=O)O Amb17618084 [0,1,0,0,0,1|1,0,1]=4 4736 B9R0.1 CO[13C](=O)CCC[13C](=O)[13CH3] Amb17617715 [0,1,0,0,0,1|1,0,1]=4 4737 B9R0.1 CSC(=S)NCCC(O)=O Amb25708472 [0,1,0,0,0,1|1,0,1]=4 4738 B9R0.1 CSC(C)CCCC(O)=O Amb25265803 [0,1,0,0,0,1|0,0,0]=2 4739 B9R0.1 CSC(C)CCNC(C)=N Amb25690539 [0,1,0,0,0,1|2,0,0]=4 4740 B9R0.1 CSC(C)CCNC(N)=O Amb25685722 [0,1,0,0,0,1|1,0,0]=3 4741 B9R0.1 CSC(C)CCNC(N)=S Amb24536228 [0,1,0,0,0,1|1,1,0]=4 4742 B9R0.1 CSC(C)CNCC(C)=C Amb24734376 [0,1,0,0,0,1|2,0,0]=4 4743 B9R0.1 CSC(C)CNCC(N)=O Amb25766612 [0,1,0,0,0,1|1,0,0]=3 4744 B9R0.1 CSC(C)CNCC(O)=O Amb25137618 [0,1,0,0,0,1|0,0,0]=2 4745 B9R0.1 CSC(C)\C=C\CC(O)=O Amb18645413 [0,1,0,0,0,1|0,0,1]=3 4746 B9R0.1 C[C@@H](CBr)CCC=C(C)C Amb25054445 [0,1,0,0,0,1|2,0,0]=4 4747 B9R0.1 C[C@@H](CCCC(C)=O)C=C Amb24379305 [0,1,0,0,0,1|1,0,1]=4 4748 B9R0.1 C[C@@H](CCCC(O)=O)C=C Amb24447465 [0,1,0,0,0,1|0,0,1]=3 4749 B9R0.1 C[C@@H](CO)CCOC(C)=O Amb24464645 [0,1,0,0,0,1|1,0,0]=3 4750 B9R0.1 C[C@@H](O)CCNC(=O)C#C Amb24370494 [0,1,0,0,0,1|2,0,0]=4 4751 B9R0.1 C[C@@H](O)CCNC(=O)CCl Amb25143749 [0,1,0,0,0,1|2,0,0]=4 4752 B9R0.1 C[C@@H](O)CCNC(=O)CO Amb24570702 [0,1,0,0,0,1|1,0,0]=3 4753 B9R0.1 C[C@H](CCCC(C)=O)C=O Amb25119261 [0,1,0,0,0,1|1,0,1]=4 4754 B9R0.1 C[C@H](CCCC(O)=O)C=C Amb25367325 [0,1,0,0,0,1|0,0,1]=3 4755 B9R0.1 C[C@H](CN)CCC=C(C)C Amb24478120 [0,1,0,0,0,1|2,0,0]=4 4756 B9R0.1 C[C@H](CO)CCCC(C)=O Amb25335279 [0,1,0,0,0,1|1,0,0]=3 4757 B9R0.1 C[C@H](CO)CCNC(C)=O Amb24502371 [0,1,0,0,0,1|1,0,0]=3 4758 B9R0.1 C[C@H](O)CCNC(=O)CO Amb25358407 [0,1,0,0,0,1|1,0,0]=3 4759 B9R0.1 C[C@H](O)CNCC(C)CO Amb25303273 [0,1,0,0,0,1|1,0,1]=4 4760 B9R0.1 C[C@H](O)CSCC(C)CO Amb25683518 [0,1,0,0,0,1|1,0,1]=4 4761 B9R0.1 C\C(=C\CCC(O)=O)\C=C Amb18643583 [0,1,0,0,0,1|0,0,2]=4 4762 B9R0.1 C\C(\CBr)=N/OCC(O)=O Amb25350489 [0,1,0,0,0,1|1,0,1]=4 4763 B9R0.1 C\C(\CCCC(O)=O)=C\C Amb25063828 [0,1,0,0,0,1|0,0,1]=3 4764 B9R0.1 C\C(\CCCN(C)C)=N\O Amb24480641 [0,1,0,0,0,1|2,0,0]=4 4765 B9R0.1 C\C(\CF)=C/CCC(C)=O Amb25205662 [0,1,0,0,0,1|1,0,1]=4 4766 B9R0.1 C\C(\CF)=C\CCC(C)=O Amb24512770 [0,1,0,0,0,1|1,0,1]=4 4767 B9R0.1 C\C(\CNCC(O)=O)=C/C Amb24351586 [0,1,0,0,0,1|0,0,1]=3 4768 B9R0.1 C\C(\CNCC(O)=O)=C\C Amb25175094 [0,1,0,0,0,1|0,0,1]=3 4769 B9R0.1 C\C(\CO)=C\CCC(C)=O Amb24545611 [0,1,0,0,0,1|1,0,1]=4 4770 B9R0.1 C\C(\COCC(O)=O)=C\C Amb25293393 [0,1,0,0,0,1|0,0,1]=3 4771 B9R0.1 ClCC(=O)NCCC(C)C Amb1643484 [0,1,0,0,0,1|1,0,0]=3 4772 B9R0.1 ClCC(=O)NCCN(C)C Amb1137595 [0,1,0,0,0,1|2,0,0]=4 4773 B9R0.1 ClCC(=O)NCCN(C)C Amb13951935 [0,1,0,0,0,1|2,0,0]=4 4774 B9R0.1 NC(=O)CNCC(O)CO Amb25096977 [0,1,0,0,0,1|2,0,0]=4 4775 B9R0.1 NC(=O)COCC(O)CCl Amb24675285 [0,1,0,0,0,1|2,0,0]=4 4776 B9R0.1 NC(=O)CSCC(O)CBr Amb25169390 [0,1,0,0,0,1|2,0,0]=4 4777 B9R0.1 NC(=O)CSCC(O)CCl Amb25169389 [0,1,0,0,0,1|2,0,0]=4 4778 B9R0.1 NC(CCCC(O)=O)C=O Amb25075707 [0,1,0,0,0,1|1,0,1]=4 4779 B9R0.1 NC(CO)COCC(N)=O Amb24555209 [0,1,0,0,0,1|2,0,0]=4 4780 B9R0.1 NC(CS)CCCC(N)=O Amb24477264 [0,1,0,0,0,1|2,0,0]=4 4781 B9R0.1 NC(CS)CCCC(O)=O Amb25706315 [0,1,0,0,0,1|1,0,0]=3 4782 B9R0.1 NCC(=O)CCCC(O)=O Amb18202122 [0,1,0,0,0,1|1,0,1]=4 4783 B9R0.1 NCC(=O)CCCC(O)=O Amb22035333 [0,1,0,0,0,1|1,0,1]=4 4784 B9R0.1 NCC(=O)OCCC(C)C Amb17569860 [0,1,0,0,0,1|1,0,0]=3 4785 B9R0.1 NCC(N)CCCC(O)=O Amb24375177 [0,1,0,0,0,1|1,0,0]=3 4786 B9R0.1 NCC(N)COCC(O)=O Amb24677956 [0,1,0,0,0,1|1,0,0]=3 4787 B9R0.1 NC[C@@H](N)CCCC(O)=O Amb25147297 [0,1,0,0,0,1|1,0,0]=3 4788 B9R0.1 NNC(=O)CCNC(C)C Amb17604770 [0,1,0,0,0,1|1,0,0]=3 4789 B9R0.1 NNC(=S)NCCC(C)C Amb1152525 [0,1,0,0,0,1|1,1,0]=4 4790 B9R0.1 N[C@@H](CO)COCC(N)=O Amb24537982 [0,1,0,0,0,1|2,0,0]=4 4791 B9R0.1 N[C@@H](CS)CCCC(O)=O Amb25288626 [0,1,0,0,0,1|1,0,0]=3 4792 B9R0.1 N[C@H](CS)CCCC(O)=O Amb24482180 [0,1,0,0,0,1|1,0,0]=3 4793 B9R0.1 O=NN(CCCC(=O)O)C Amb17618588 [0,1,0,0,0,1|2,0,0]=4 4794 B9R0.1 OC(=O)CCCC(Cl)CCl Amb18649051 [0,1,0,0,0,1|1,0,0]=3 4795 B9R0.1 OC(=O)CCNC(=O)CBr Amb17609911 [0,1,0,0,0,1|1,0,1]=4 4796 B9R0.1 OC(=O)CCNC(=O)CO Amb24478846 [0,1,0,0,0,1|1,0,1]=4 4797 B9R0.1 OC(=O)CCNC(=O)CS Amb24754483 [0,1,0,0,0,1|1,0,1]=4 4798 B9R0.1 OC(=O)CNCC(S)C=O Amb24482295 [0,1,0,0,0,1|1,0,1]=4 4799 B9R0.1 OC(=O)COCC(S)CS Amb18129098 [0,1,0,0,0,1|1,0,0]=3 4800 B9R0.1 OCC(CNCC(C)C)O Amb17308639 [0,1,0,0,0,1|0,0,2]=4 4801 B9R0.1 OCC(O)C=NCC(O)=O Amb25113464 [0,1,0,0,0,1|1,0,1]=4 4802 B9R0.1 OCC(O)CNCC(O)=O Amb24360971 [0,1,0,0,0,1|1,0,0]=3 4803 B9R0.1 OCC(O)COCC(O)=O Amb24534716 [0,1,0,0,0,1|1,0,0]=3 4804 B9R0.7 CC(=C)C(=O)CCC(C)C Amb25741534 [0,1,0,0,0,1|2,0,0]=4 4805 B9R0.7 CC(=C)CCC(C)C(O)=O Amb25809141 [0,1,0,0,0,1|0,0,2]=4 4806 B9R0.7 CC(=C)CC[C@@H](C)C(O)=O Amb25685103 [0,1,0,0,0,1|0,0,2]=4 4807 B9R0.7 CC(=C)CC[C@@H](N)C(O)=O Amb25775219 [0,1,0,0,0,1|0,0,2]=4 4808 B9R0.7 CC(=C)COC(C)C(O)=O Amb24549744 [0,1,0,0,0,1|0,0,2]=4 4809 B9R0.7 CC(=C)CO[C@@H](C)C(O)=O Amb24505175 [0,1,0,0,0,1|0,0,2]=4 4810 B9R0.7 CC(=C)CO[C@H](C)C(O)=O Amb25772492 [0,1,0,0,0,1|0,0,2]=4 4811 B9R0.7 CC(=N)SCC(Cl)C(O)=O Amb18648569 [0,1,0,0,0,1|1,0,1]=4 4812 B9R0.7 CC(=O)C(=C)COC(C)C Amb24546081 [0,1,0,0,0,1|1,0,1]=4 4813 B9R0.7 CC(=O)C(=O)CCC(O)=O Amb24359327 [0,1,0,0,0,1|1,0,1]=4 4814 B9R0.7 CC(=O)C(Br)CCC(O)=O Amb25733508 [0,1,0,0,0,1|1,0,1]=4 4815 B9R0.7 CC(=O)CCC(=O)C(C)C Amb19515553 [0,1,0,0,0,1|1,0,0]=3 4816 B9R0.7 CC(=O)CCC(=O)N(C)C Amb17334213 [0,1,0,0,0,1|2,0,0]=4 4817 B9R0.7 CC(=O)CCC(C)C(O)=O Amb18644099 [0,1,0,0,0,1|1,0,1]=4 4818 B9R0.7 CC(=O)CCC(N)C(O)=O Amb20669473 [0,1,0,0,0,1|1,0,1]=4 4819 B9R0.7 CC(=O)CCC(N)C(O)=O Amb22157242 [0,1,0,0,0,1|1,0,1]=4 4820 B9R0.7 CC(=O)CC[C@@H](N)C(O)=O Amb19130479 [0,1,0,0,0,1|1,0,1]=4 4821 B9R0.7 CC(=O)CC[C@H](N)C(O)=O Amb25147501 [0,1,0,0,0,1|1,0,1]=4 4822 B9R0.7 CC(=O)COC(=C)C(C)C Amb25146600 [0,1,0,0,0,1|1,0,1]=4 4823 B9R0.7 CC(=O)CSC(C(=O)O)C Amb17501621 [0,1,0,0,0,1|1,0,1]=4 4824 B9R0.7 CC(=O)NCC(=O)C(C)C Amb23555718 [0,1,0,0,0,1|1,0,1]=4 4825 B9R0.7 CC(=O)NCC(C)C(O)=O Amb18300085 [0,1,0,0,0,1|1,0,1]=4 4826 B9R0.7 CC(=O)NCC(F)C(O)=O Amb25356174 [0,1,0,0,0,1|1,0,1]=4 4827 B9R0.7 CC(=O)NCC(O)C(O)=O Amb25374579 [0,1,0,0,0,1|1,0,1]=4 4828 B9R0.7 CC(=O)NC[C@H](N)C(O)=O Amb25772091 [0,1,0,0,0,1|1,0,1]=4 4829 B9R0.7 CC(=O)NC[C@H](O)C(O)=O Amb24480830 [0,1,0,0,0,1|1,0,1]=4 4830 B9R0.7 CC(=O)OCC(=O)C(C)C Amb24456861 [0,1,0,0,0,1|1,0,1]=4 4831 B9R0.7 CC(=O)OCC(C(=O)O)N Amb17593668 [0,1,0,0,0,1|1,0,1]=4 4832 B9R0.7 CC(=O)OCC(Cl)C(O)=O Amb24425506 [0,1,0,0,0,1|1,0,1]=4 4833 B9R0.7 CC(=O)OC[C@@H](C)C(O)=O Amb25187888 [0,1,0,0,0,1|1,0,1]=4 4834 B9R0.7 CC(=O)OC[C@@H](N)C(O)=O Amb22756697 [0,1,0,0,0,1|1,0,1]=4 4835 B9R0.7 CC(=O)SCC(Cl)C(O)=O Amb24423824 [0,1,0,0,0,1|1,0,1]=4 4836 B9R0.7 CC(=O)SCC(N)C(O)=O Amb22490452 [0,1,0,0,0,1|1,0,1]=4 4837 B9R0.7 CC(=O)SC[C@@H](C(=O)O)N Amb16185419 [0,1,0,0,0,1|1,0,1]=4 4838 B9R0.7 CC(=O)[C@@H](C)CCC(O)=O Amb25333003 [0,1,0,0,0,1|1,0,1]=4 4839 B9R0.7 CC(=O)[C@@H](N)CCC(O)=O Amb24386065 [0,1,0,0,0,1|1,0,1]=4 4840 B9R0.7 CC(=O)[C@H](C)CCC(O)=O Amb24671283 [0,1,0,0,0,1|1,0,1]=4 4841 B9R0.7 CC(Br)C(Br)\C=C\C(O)=O Amb22347457 [0,1,0,0,0,1|1,0,1]=4 4842 B9R0.7 CC(Br)C(O)\C=C\C(O)=O Amb24611190 [0,1,0,0,0,1|1,0,1]=4 4843 B9R0.7 CC(C(=O)NCC(=O)N)C Amb17231981 [0,1,0,0,0,1|1,0,1]=4 4844 B9R0.7 CC(C(=O)NCC(=O)O)C Amb1112853 [0,1,0,0,0,1|0,0,1]=3 4845 B9R0.7 CC(C(C)C)NCC(=O)N Amb1113849 [0,1,0,0,0,1|1,0,0]=3 4846 B9R0.7 CC(C)=C(C)CCC(O)=O Amb24505016 [0,1,0,0,0,1|0,0,1]=3 4847 B9R0.7 CC(C)=C=CC(C)C(O)=O Amb25063829 [0,1,0,0,0,1|0,0,2]=4 4848 B9R0.7 CC(C)=CCC(=C)C(O)=O Amb25312869 [0,1,0,0,0,1|0,0,2]=4 4849 B9R0.7 CC(C)=CCC(C)C(C)=O Amb24727108 [0,1,0,0,0,1|1,0,1]=4 4850 B9R0.7 CC(C)=CCC(C)C(O)=O Amb18643879 [0,1,0,0,0,1|0,0,1]=3 4851 B9R0.7 CC(C)=CCC(Cl)C(C)=O Amb24372865 [0,1,0,0,0,1|1,0,1]=4 4852 B9R0.7 CC(C)=CCC(F)C(O)=O Amb24480809 [0,1,0,0,0,1|0,0,1]=3 4853 B9R0.7 CC(C)=CCC(N)C(N)=O Amb24697159 [0,1,0,0,0,1|1,0,1]=4 4854 B9R0.7 CC(C)=CCC(O)C(C)=O Amb24356685 [0,1,0,0,0,1|1,0,1]=4 4855 B9R0.7 CC(C)=CC[C@@H](C)C(O)=O Amb24698988 [0,1,0,0,0,1|0,0,1]=3 4856 B9R0.7 CC(C)=CC[C@@H](O)C(C)=O Amb24662470 [0,1,0,0,0,1|1,0,1]=4 4857 B9R0.7 CC(C)=CC[C@H](N)C(O)=O Amb25836895 [0,1,0,0,0,1|0,0,1]=3 4858 B9R0.7 CC(C)=CC[C@H](O)C(C)=O Amb24648883 [0,1,0,0,0,1|1,0,1]=4 4859 B9R0.7 CC(C)=NO[C@@H](C)C(O)=O Amb24349833 [0,1,0,0,0,1|1,0,1]=4 4860 B9R0.7 CC(C)C#CC(=O)C(O)=O Amb24529280 [0,1,0,0,0,1|0,0,2]=4 4861 B9R0.7 CC(C)C(=N)NCC(N)=O Amb24369661 [0,1,0,0,0,1|1,0,1]=4 4862 B9R0.7 CC(C)C(=O)CCC(C)O Amb24605182 [0,1,0,0,0,1|1,0,1]=4 4863 B9R0.7 CC(C)C(=O)\C=C\C(O)=O Amb25117573 [0,1,0,0,0,1|0,0,2]=4 4864 B9R0.7 CC(C)C(Br)CCC(O)=O Amb24640345 [0,1,0,0,0,1|0,0,0]=2 4865 B9R0.7 CC(C)C(Br)CNC(C)=O Amb25717188 [0,1,0,0,0,1|1,0,0]=3 4866 B9R0.7 CC(C)C(Br)COC(C)=O Amb24633343 [0,1,0,0,0,1|1,0,0]=3 4867 B9R0.7 CC(C)C(Br)\C=C\C(O)=O Amb25733509 [0,1,0,0,0,1|0,0,1]=3 4868 B9R0.7 CC(C)C(C)CCC(C)=O Amb24423995 [0,1,0,0,0,1|1,0,0]=3 4869 B9R0.7 CC(C)C(C)CCC(C)O Amb25788195 [0,1,0,0,0,1|1,0,1]=4 4870 B9R0.7 CC(C)C(C)CCC(O)=O Amb25843702 [0,1,0,0,0,1|0,0,0]=2 4871 B9R0.7 CC(C)C(C)CNC(N)=N Amb25278437 [0,1,0,0,0,1|2,0,0]=4 4872 B9R0.7 CC(C)C(C)CNC(N)=S Amb25074449 [0,1,0,0,0,1|1,1,0]=4 4873 B9R0.7 CC(C)C(C)NCC(=C)Br Amb18303973 [0,1,0,0,0,1|2,0,0]=4 4874 B9R0.7 CC(C)C(C)NCC(=C)Cl Amb19004844 [0,1,0,0,0,1|2,0,0]=4 4875 B9R0.7 CC(C)C(C)NCC(C)=C Amb25288686 [0,1,0,0,0,1|2,0,0]=4 4876 B9R0.7 CC(C)C(C)NC[C@H](C)O Amb25147782 [0,1,0,0,0,1|1,0,1]=4 4877 B9R0.7 CC(C)C(C)OCC(=C)Br Amb24386814 [0,1,0,0,0,1|2,0,0]=4 4878 B9R0.7 CC(C)C(C)OCC(N)=N Amb24357152 [0,1,0,0,0,1|2,0,0]=4 4879 B9R0.7 CC(C)C(C)OCC(O)=O Amb24479217 [0,1,0,0,0,1|0,0,0]=2 4880 B9R0.7 CC(C)C(C)OC[C@@H](C)O Amb24373041 [0,1,0,0,0,1|1,0,1]=4 4881 B9R0.7 CC(C)C(C)SCC(=C)Br Amb24482674 [0,1,0,0,0,1|2,0,0]=4 4882 B9R0.7 CC(C)C(C)SCC(C)=C Amb24482847 [0,1,0,0,0,1|2,0,0]=4 4883 B9R0.7 CC(C)C(C)SCC(N)=N Amb25325713 [0,1,0,0,0,1|2,0,0]=4 4884 B9R0.7 CC(C)C(C)SCC(N)=O Amb25769868 [0,1,0,0,0,1|1,0,0]=3 4885 B9R0.7 CC(C)C(C)SC[C@H](C)O Amb25726045 [0,1,0,0,0,1|1,0,1]=4 4886 B9R0.7 CC(C)C(C)\C=C\C(C)=O Amb25063008 [0,1,0,0,0,1|1,0,1]=4 4887 B9R0.7 CC(C)C(Cl)CCC(O)=O Amb24413514 [0,1,0,0,0,1|0,0,0]=2 4888 B9R0.7 CC(C)C(F)CCC(O)=O Amb24480880 [0,1,0,0,0,1|0,0,0]=2 4889 B9R0.7 CC(C)C(N)CCC(C)=C Amb24520722 [0,1,0,0,0,1|2,0,0]=4 4890 B9R0.7 CC(C)C(N)CCC(O)=O Amb18124745 [0,1,0,0,0,1|0,0,0]=2 4891 B9R0.7 CC(C)C(N)CNC(C)=O Amb24757730 [0,1,0,0,0,1|1,0,0]=3 4892 B9R0.7 CC(C)C(N)\C=C\C(O)=O Amb24397928 [0,1,0,0,0,1|0,0,1]=3 4893 B9R0.7 CC(C)C(O)C#CC(O)=O Amb17779780 [0,1,0,0,0,1|0,0,1]=3 4894 B9R0.7 CC(C)C(O)CC=C(C)C Amb25848459 [0,1,0,0,0,1|2,0,0]=4 4895 B9R0.7 CC(C)C(O)CCB(O)O Amb24745634 [0,1,0,0,0,1|1,0,1]=4 4896 B9R0.7 CC(C)C(O)CCC(C)=O Amb24380845 [0,1,0,0,0,1|1,0,0]=3 4897 B9R0.7 CC(C)C(O)CCC(C)O Amb24717102 [0,1,0,0,0,1|1,0,1]=4 4898 B9R0.7 CC(C)C(O)CCC(O)=O Amb25252592 [0,1,0,0,0,1|0,0,0]=2 4899 B9R0.7 CC(C)C(O)CC[C@H](C)O Amb25346139 [0,1,0,0,0,1|1,0,1]=4 4900 B9R0.7 CC(C)C(O)CNS(C)=O Amb25177235 [0,1,0,0,0,1|2,0,0]=4 4901 B9R0.7 CC(C)C(O)CSC(N)=N Amb24481165 [0,1,0,0,0,1|2,0,0]=4 4902 B9R0.7 CC(C)C(O)\C=C\C(C)=O Amb24477028 [0,1,0,0,0,1|1,0,1]=4 4903 B9R0.7 CC(C)C(S)CCC(C)=O Amb25723213 [0,1,0,0,0,1|1,0,0]=3 4904 B9R0.7 CC(C)C(S)CCC(O)=O Amb25723893 [0,1,0,0,0,1|0,0,0]=2 4905 B9R0.7 CC(C)C=NC(C)C(O)=O Amb24356117 [0,1,0,0,0,1|0,0,1]=3 4906 B9R0.7 CC(C)CCC(=O)C(=O)Cl Amb24722777 [0,1,0,0,0,1|1,0,0]=3 4907 B9R0.7 CC(C)CCC(Br)C(C)=O Amb25828882 [0,1,0,0,0,1|1,0,0]=3 4908 B9R0.7 CC(C)CCC(Br)C(O)=O Amb18131059 [0,1,0,0,0,1|0,0,0]=2 4909 B9R0.7 CC(C)CCC(C)C(C)=O Amb24392384 [0,1,0,0,0,1|1,0,0]=3 4910 B9R0.7 CC(C)CCC(C)C(C)O Amb25262988 [0,1,0,0,0,1|1,0,1]=4 4911 B9R0.7 CC(C)CCC(C)C(O)=O Amb19033547 [0,1,0,0,0,1|0,0,0]=2 4912 B9R0.7 CC(C)CCC(C)[N+]([O-])=O Amb24555516 [0,1,0,0,0,1|1,0,1]=4 4913 B9R0.7 CC(C)CCC(Cl)C(=O)Cl Amb25225638 [0,1,0,0,0,1|1,0,0]=3 4914 B9R0.7 CC(C)CCC(Cl)C(N)=O Amb25362428 [0,1,0,0,0,1|1,0,0]=3 4915 B9R0.7 CC(C)CCC(F)C(C)=O Amb24383731 [0,1,0,0,0,1|1,0,0]=3 4916 B9R0.7 CC(C)CCC(N)C(C)=C Amb25765968 [0,1,0,0,0,1|2,0,0]=4 4917 B9R0.7 CC(C)CCC(N)C(C)=O Amb18831542 [0,1,0,0,0,1|1,0,0]=3 4918 B9R0.7 CC(C)CCC(N)C(C)O Amb18124763 [0,1,0,0,0,1|1,0,1]=4 4919 B9R0.7 CC(C)CCC(N)C(O)=O Amb19269152 [0,1,0,0,0,1|0,0,0]=2 4920 B9R0.7 CC(C)CCC(O)C(C)=C Amb25043418 [0,1,0,0,0,1|2,0,0]=4 4921 B9R0.7 CC(C)CCC(O)C(C)=O Amb24502166 [0,1,0,0,0,1|1,0,0]=3 4922 B9R0.7 CC(C)CCC(O)C(C)O Amb25235411 [0,1,0,0,0,1|1,0,1]=4 4923 B9R0.7 CC(C)CCC(O)C(N)=O Amb25210125 [0,1,0,0,0,1|1,0,0]=3 4924 B9R0.7 CC(C)CCN(C)C(C)=N Amb25792554 [0,1,0,0,0,1|2,0,0]=4 4925 B9R0.7 CC(C)CCN(C)C(N)=S Amb18792302 [0,1,0,0,0,1|1,1,0]=4 4926 B9R0.7 CC(C)CC[C@@H](N)C(=O)Cl Amb25086091 [0,1,0,0,0,1|1,0,0]=3 4927 B9R0.7 CC(C)CC[C@@H](N)C(O)=O Amb19133196 [0,1,0,0,0,1|0,0,0]=2 4928 B9R0.7 CC(C)CC[C@@H](N)C(O)=O Amb22899130 [0,1,0,0,0,1|0,0,0]=2 4929 B9R0.7 CC(C)CC[C@H](Cl)C(=O)Cl Amb24544198 [0,1,0,0,0,1|1,0,0]=3 4930 B9R0.7 CC(C)CC[C@H](F)C(C)=O Amb25050234 [0,1,0,0,0,1|1,0,0]=3 4931 B9R0.7 CC(C)CC[C@H](O)C(C)=O Amb25059211 [0,1,0,0,0,1|1,0,0]=3 4932 B9R0.7 CC(C)CNC(=O)C(N)=O Amb25041667 [0,1,0,0,0,1|1,0,1]=4 4933 B9R0.7 CC(C)CNC(C)C(C)=O Amb24480697 [0,1,0,0,0,1|1,0,0]=3 4934 B9R0.7 CC(C)CN[C@H](C)C(N)=O Amb25052017 [0,1,0,0,0,1|1,0,0]=3 4935 B9R0.7 CC(C)CN[C@H](C)C(O)=O Amb25300819 [0,1,0,0,0,1|0,0,0]=2 4936 B9R0.7 CC(C)COC(=O)C(O)=O Amb25064282 [0,1,0,0,0,1|0,0,1]=3 4937 B9R0.7 CC(C)COC(C)C(N)=N Amb25724251 [0,1,0,0,0,1|2,0,0]=4 4938 B9R0.7 CC(C)COC(C)C(N)=O Amb19960054 [0,1,0,0,0,1|1,0,0]=3 4939 B9R0.7 CC(C)COC(C)C(N)=S Amb18798043 [0,1,0,0,0,1|1,1,0]=4 4940 B9R0.7 CC(C)COC(C)[C@H](C)O Amb24407122 [0,1,0,0,0,1|1,0,1]=4 4941 B9R0.7 CC(C)CSC(C)C(C)O Amb25264045 [0,1,0,0,0,1|1,0,1]=4 4942 B9R0.7 CC(C)CSC(C)C(N)=N Amb18797919 [0,1,0,0,0,1|2,0,0]=4 4943 B9R0.7 CC(C)CSC(C)C(N)=O Amb18183474 [0,1,0,0,0,1|1,0,0]=3 4944 B9R0.7 CC(C)CSN(C)C(N)=O Amb24399292 [0,1,0,0,0,1|2,0,0]=4 4945 B9R0.7 CC(C)C\C=C(/F)\C(O)=O Amb18124770 [0,1,0,0,0,1|0,0,1]=3 4946 B9R0.7 CC(C)N(C)CCC(C)=C Amb24449256 [0,1,0,0,0,1|2,0,0]=4 4947 B9R0.7 CC(C)N(C)CCC(N)=O Amb25216072 [0,1,0,0,0,1|1,0,0]=3 4948 B9R0.7 CC(C)NCC(=C)C(O)=O Amb25825537 [0,1,0,0,0,1|0,0,1]=3 4949 B9R0.7 CC(C)NCC(N)C(O)=O Amb25790256 [0,1,0,0,0,1|0,0,0]=2 4950 B9R0.7 CC(C)NCC(O)C(C)=C Amb25221200 [0,1,0,0,0,1|2,0,0]=4 4951 B9R0.7 CC(C)NC[C@H](N)C(O)=O Amb24682685 [0,1,0,0,0,1|0,0,0]=2 4952 B9R0.7 CC(C)NC[C@H](O)C(O)=O Amb24479668 [0,1,0,0,0,1|0,0,0]=2 4953 B9R0.7 CC(C)NNC(C)C(O)=O Amb24070154 [0,1,0,0,0,1|1,0,0]=3 4954 B9R0.7 CC(C)OCC(C)C(C)=O Amb24646230 [0,1,0,0,0,1|1,0,0]=3 4955 B9R0.7 CC(C)OCC(N)C(C)=C Amb24428467 [0,1,0,0,0,1|2,0,0]=4 4956 B9R0.7 CC(C)OCC(N)C(N)=O Amb25104507 [0,1,0,0,0,1|1,0,0]=3 4957 B9R0.7 CC(C)OCC(O)C(C)O Amb25126696 [0,1,0,0,0,1|1,0,1]=4 4958 B9R0.7 CC(C)OCC(O)C(O)=O Amb24583914 [0,1,0,0,0,1|0,0,0]=2 4959 B9R0.7 CC(C)OC[C@@H](N)C(N)=O Amb25267850 [0,1,0,0,0,1|1,0,0]=3 4960 B9R0.7 CC(C)OC[C@@H](N)C(O)=O Amb24479342 [0,1,0,0,0,1|0,0,0]=2 4961 B9R0.7 CC(C)OC[C@H](O)C(O)=O Amb24480796 [0,1,0,0,0,1|0,0,0]=2 4962 B9R0.7 CC(C)S(=O)CCC(O)=O Amb18312508 [0,1,0,0,0,1|0,0,0]=2 4963 B9R0.7 CC(C)S(=O)NCC(O)=O Amb25177225 [0,1,0,0,0,1|1,0,0]=3 4964 B9R0.7 CC(C)SCC(=C)C(O)=O Amb25727239 [0,1,0,0,0,1|0,0,1]=3 4965 B9R0.7 CC(C)SCC(C)C(N)=N Amb18792298 [0,1,0,0,0,1|2,0,0]=4 4966 B9R0.7 CC(C)SCC(C)C(O)=O Amb18303880 [0,1,0,0,0,1|0,0,0]=2 4967 B9R0.7 CC(C)SCC(N)C(N)=O Amb18788147 [0,1,0,0,0,1|1,0,0]=3 4968 B9R0.7 CC(C)SCC(O)C(O)=O Amb24728812 [0,1,0,0,0,1|0,0,0]=2 4969 B9R0.7 CC(C)SC[C@@H](N)C(O)=O Amb18792510 [0,1,0,0,0,1|0,0,0]=2 4970 B9R0.7 CC(C)SC[C@H](N)C(O)=O Amb25087870 [0,1,0,0,0,1|0,0,0]=2 4971 B9R0.7 CC(C)SC[C@H](O)C(O)=O Amb25362660 [0,1,0,0,0,1|0,0,0]=2 4972 B9R0.7 CC(C)[C@@H](C)CCC(O)=O Amb25076667 [0,1,0,0,0,1|0,0,0]=2 4973 B9R0.7 CC(C)[C@@H](O)C#CC(O)=O Amb25849331 [0,1,0,0,0,1|0,0,1]=3 4974 B9R0.7 CC(C)[C@@H](O)CC[C@H](C)O Amb24748359 [0,1,0,0,0,1|1,0,1]=4 4975 B9R0.7 CC(C)[C@H](N)C#CC(O)=O Amb25147536 [0,1,0,0,0,1|0,0,1]=3 4976 B9R0.7 CC(C)[C@H](N)CCC(O)=O Amb24452899 [0,1,0,0,0,1|0,0,0]=2 4977 B9R0.7 CC(C)[C@H](O)CC[C@H](C)O Amb25185408 [0,1,0,0,0,1|1,0,1]=4 4978 B9R0.7 CC(C)\C=C\C(=O)C(O)=O Amb24711964 [0,1,0,0,0,1|0,0,2]=4 4979 B9R0.7 CC(C)\C=N\[C@@H](C)C(O)=O Amb24446744 [0,1,0,0,0,1|0,0,1]=3 4980 B9R0.7 CC(C)\C=N\[C@H](C)C(O)=O Amb25264740 [0,1,0,0,0,1|0,0,1]=3 4981 B9R0.7 CC(CCC(C)Br)C(O)=O Amb24452260 [0,1,0,0,0,1|1,0,0]=3 4982 B9R0.7 CC(CNC(=O)C(=O)C)C Amb17399879 [0,1,0,0,0,1|1,0,1]=4 4983 B9R0.7 CC(CNC(C)=O)N(C)C Amb24479027 [0,1,0,0,0,1|2,0,0]=4 4984 B9R0.7 CC(CNC(N)=O)N(C)C Amb24374971 [0,1,0,0,0,1|2,0,0]=4 4985 B9R0.7 CC(CNN(C)C)C(N)=O Amb24740251 [0,1,0,0,0,1|2,0,0]=4 4986 B9R0.7 CC(COC(C)=O)C(C)O Amb24719537 [0,1,0,0,0,1|2,0,0]=4 4987 B9R0.7 CC(COC(F)F)C(O)=O Amb24514001 [0,1,0,0,0,1|2,0,0]=4 4988 B9R0.7 CC(CSC(F)F)C(O)=O Amb24685869 [0,1,0,0,0,1|2,0,0]=4 4989 B9R0.7 CC(Cl)=CCC(N)C(O)=O Amb25326840 [0,1,0,0,0,1|1,0,1]=4 4990 B9R0.7 CC(Cl)=CC[C@H](N)C(O)=O Amb24518555 [0,1,0,0,0,1|1,0,1]=4 4991 B9R0.7 CC(Cl)C(=O)CCC(O)=O Amb25362323 [0,1,0,0,0,1|1,0,0]=3 4992 B9R0.7 CC(Cl)C(O)CCC(O)=O Amb24677604 [0,1,0,0,0,1|1,0,0]=3 4993 B9R0.7 CC(Cl)C(O)\C=C\C(O)=O Amb24739825 [0,1,0,0,0,1|1,0,1]=4 4994 B9R0.7 CC(Cl)CCC(N)C(O)=O Amb24692699 [0,1,0,0,0,1|1,0,0]=3 4995 B9R0.7 CC(Cl)CC[C@H](N)C(O)=O Amb24692939 [0,1,0,0,0,1|1,0,0]=3 4996 B9R0.7 CC(F)=CCC(N)C(O)=O Amb24354283 [0,1,0,0,0,1|1,0,1]=4 4997 B9R0.7 CC(F)C(O)CCC(O)=O Amb25831840 [0,1,0,0,0,1|1,0,0]=3 4998 B9R0.7 CC(N)C(=O)CCC(O)=O Amb25709431 [0,1,0,0,0,1|1,0,0]=3 4999 B9R0.7 CC(N)C(N)CCC(O)=O Amb24377171 [0,1,0,0,0,1|1,0,0]=3 5000 B9R0.7 CC(N)C(O)CSC(C)=O Amb25286278 [0,1,0,0,0,1|2,0,0]=4 5001 B9R0.7 CC(N)CCN(C)C(C)=O Amb24421216 [0,1,0,0,0,1|2,0,0]=4 5002 B9R0.7 CC(N)CSC(C)C(N)=O Amb24628478 [0,1,0,0,0,1|2,0,0]=4 5003 B9R0.7 CC(NCC(C)N)C(O)=O Amb24599775 [0,1,0,0,0,1|1,0,0]=3 5004 B9R0.7 CC(NCC(F)F)C(O)=O Amb18789168 [0,1,0,0,0,1|2,0,0]=4 5005 B9R0.7 CC(NCC(O)=O)C(C)N Amb24637505 [0,1,0,0,0,1|1,0,0]=3 5006 B9R0.7 CC(NCC(O)=O)C(F)F Amb25696710 [0,1,0,0,0,1|2,0,0]=4 5007 B9R0.7 CC(NC[C@@H](C)O)C(N)=O Amb25702192 [0,1,0,0,0,1|2,0,0]=4 5008 B9R0.7 CC(O)C(=O)CCC(O)=O Amb25825263 [0,1,0,0,0,1|1,0,0]=3 5009 B9R0.7 CC(O)C(=O)NCC(O)=O Amb24640434 [0,1,0,0,0,1|1,0,1]=4 5010 B9R0.7 CC(O)C(C)C#CC(O)=O Amb25310844 [0,1,0,0,0,1|1,0,1]=4 5011 B9R0.7 CC(O)C(C)OCC(O)=O Amb25185257 [0,1,0,0,0,1|1,0,0]=3 5012 B9R0.7 CC(O)C(N)CNC(N)=O Amb25809645 [0,1,0,0,0,1|2,0,0]=4 5013 B9R0.7 CC(O)C(O)CCC(O)=O Amb25054706 [0,1,0,0,0,1|1,0,0]=3 5014 B9R0.7 CC(O)C(O)\C=C\C(O)=O Amb24470539 [0,1,0,0,0,1|1,0,1]=4 5015 B9R0.7 CC(O)CCC(=C)C(O)=O Amb24375911 [0,1,0,0,0,1|1,0,0]=3 5016 B9R0.7 CC(O)CCC(C)C(O)=O Amb25848509 [0,1,0,0,0,1|1,0,0]=3 5017 B9R0.7 CC(O)CCC(F)C(C)=O Amb25093785 [0,1,0,0,0,1|2,0,0]=4 5018 B9R0.7 CC(O)CCN(C)C(N)=O Amb24444738 [0,1,0,0,0,1|2,0,0]=4 5019 B9R0.7 CC(O)CNC(C)C(O)=O Amb18523859 [0,1,0,0,0,1|1,0,0]=3 5020 B9R0.7 CC(O)CN[C@@H](C)C(O)=O Amb25129862 [0,1,0,0,0,1|1,0,0]=3 5021 B9R0.7 CC(O)COC(C)C(O)=O Amb25146942 [0,1,0,0,0,1|1,0,0]=3 5022 B9R0.7 CC(O)CSC(C)C(O)=O Amb18303285 [0,1,0,0,0,1|1,0,0]=3 5023 B9R0.7 CC(O)NC[C@H](N)C(O)=O Amb24575047 [0,1,0,0,0,1|1,0,0]=3 5024 B9R0.7 CC(OCC(C)F)C(O)=O Amb25350495 [0,1,0,0,0,1|1,0,0]=3 5025 B9R0.7 CC(SCC(C)N)C(O)=O Amb25224815 [0,1,0,0,0,1|1,0,0]=3 5026 B9R0.7 CC(SCC(F)F)C(O)=O Amb18793589 [0,1,0,0,0,1|2,0,0]=4 5027 B9R0.7 CC(SCC(N)=O)C(C)O Amb24426482 [0,1,0,0,0,1|2,0,0]=4 5028 B9R0.7 CC([S-])C(=O)NCC(O)=O Amb22730461 [0,1,0,0,0,1|1,0,1]=4 5029 B9R0.7 CC(\C=C\C(C)N)C(O)=O Amb24374810 [0,1,0,0,0,1|1,0,1]=4 5030 B9R0.7 CC(\C=C\[C@@H](C)N)C(O)=O Amb24401528 [0,1,0,0,0,1|1,0,1]=4 5031 B9R0.7 CN(C(=O)CCC(=O)N)C Amb17334218 [0,1,0,0,0,1|2,0,0]=4 5032 B9R0.7 CN(C(=O)CCC(=O)O)C Amb1135807 [0,1,0,0,0,1|1,0,0]=3 5033 B9R0.7 CN(C)C(=O)OCC(O)=O Amb24409484 [0,1,0,0,0,1|1,0,1]=4 5034 B9R0.7 CN(C)C(=S)NCC(O)=O Amb25708504 [0,1,0,0,0,1|1,0,1]=4 5035 B9R0.7 CN(C)CCC(N)C(N)=O Amb19036813 [0,1,0,0,0,1|2,0,0]=4 5036 B9R0.7 CN(C)CCN(C)C(N)=O Amb25728332 [0,1,0,0,0,1|2,0,0]=4 5037 B9R0.7 CN(C)CC[C@H](N)C(O)=O Amb25108550 [0,1,0,0,0,1|1,0,0]=3 5038 B9R0.7 CN(C)N(C)CCC(N)=O Amb25760880 [0,1,0,0,0,1|2,0,0]=4 5039 B9R0.7 CN(C)NCC(=C)C(O)=O Amb25139679 [0,1,0,0,0,1|1,0,1]=4 5040 B9R0.7 CN(C)NCC(N)C(N)=O Amb25782297 [0,1,0,0,0,1|2,0,0]=4 5041 B9R0.7 CN(C)NCC(O)C(O)=O Amb24683018 [0,1,0,0,0,1|1,0,0]=3 5042 B9R0.7 CP(=O)OCC(N)C(O)=O Amb24724745 [0,1,0,0,0,1|2,0,0]=4 5043 B9R0.7 CP(=O)OC[C@H](N)C(O)=O Amb25362185 [0,1,0,0,0,1|2,0,0]=4 5044 B9R0.7 CP(O)CCC(N)C(O)=O Amb25295427 [0,1,0,0,0,1|2,0,0]=4 5045 B9R0.7 CS(=N)CCC(N)C(O)=O Amb25243030 [0,1,0,0,0,1|2,0,0]=4 5046 B9R0.7 CS(=N)CC[C@H](N)C(O)=O Amb25100927 [0,1,0,0,0,1|2,0,0]=4 5047 B9R0.7 CS(=O)CC[C@@H](N)C(O)=O Amb19133021 [0,1,0,0,0,1|2,0,0]=4 5048 B9R0.7 CS(=O)NCC(O)C(O)=O Amb25177159 [0,1,0,0,0,1|2,0,0]=4 5049 B9R0.7 CS(=O)NC[C@H](N)C(O)=O Amb25798536 [0,1,0,0,0,1|2,0,0]=4 5050 B9R0.7 CS(C)CCC(N)C(O)=O Amb25695887 [0,1,0,0,0,1|1,0,0]=3 5051 B9R0.7 CS(C)CC[C@H](N)C(O)=O Amb24440849 [0,1,0,0,0,1|1,0,0]=3 5052 B9R0.7 C[C@@H](CCC(C)=O)[C@@H](C)O Amb22747043 [0,1,0,0,0,1|2,0,0]=4 5053 B9R0.7 C[C@@H](F)[C@H](N)CCC(O)=O Amb25042508 [0,1,0,0,0,1|1,0,0]=3 5054 B9R0.7 C[C@@H](N)C(=O)NCC(O)=O Amb22756673 [0,1,0,0,0,1|1,0,1]=4 5055 B9R0.7 C[C@@H](O)[C@H](C)SCC(O)=O Amb25774489 [0,1,0,0,0,1|1,0,0]=3 5056 B9R0.7 C[C@@H](OCC(F)F)C(O)=O Amb25060997 [0,1,0,0,0,1|2,0,0]=4 5057 B9R0.7 C[C@H](N)C(=O)CCC(O)=O Amb25851449 [0,1,0,0,0,1|1,0,0]=3 5058 B9R0.7 C[C@H](N)C(O)CSC(C)=O Amb24678280 [0,1,0,0,0,1|2,0,0]=4 5059 B9R0.7 C[C@H](N)CC[C@@H](N)C(O)=O Amb25199121 [0,1,0,0,0,1|1,0,0]=3 5060 B9R0.7 C[C@H](NCC(F)F)C(O)=O Amb25234396 [0,1,0,0,0,1|2,0,0]=4 5061 B9R0.7 C[C@H](O)CC[C@@H](C)C(O)=O Amb25378744 [0,1,0,0,0,1|1,0,0]=3 5062 B9R0.7 C[C@H](O)CNC(=O)C(O)=O Amb25853206 [0,1,0,0,0,1|1,0,1]=4 5063 B9R0.7 C[C@H](O)[C@H](C)CCC(O)=O Amb25340448 [0,1,0,0,0,1|1,0,0]=3 5064 B9R0.7 C[C@H](O)[C@H](O)CCC(N)=O Amb25138530 [0,1,0,0,0,1|2,0,0]=4 5065 B9R0.7 C[C@H](OCC(F)F)C(O)=O Amb25355140 [0,1,0,0,0,1|2,0,0]=4 5066 B9R0.7 C[C@H](S)C(=O)NCC(O)=O Amb24442955 [0,1,0,0,0,1|1,0,1]=4 5067 B9R0.7 C[S+](C)CC[C@@H](N)C(O)=O Amb22800534 [0,1,0,0,0,1|1,0,0]=3 5068 B9R0.7 C[S+](C)CC[C@@H](N)C(O)=O Amb22800551 [0,1,0,0,0,1|1,0,0]=3 5069 B9R0.7 C[S+](C)CC[C@H](O)C([O-])=O Amb24407452 [0,1,0,0,0,1|1,0,1]=4 5070 B9R0.7 C\C(=C/CC(C)=O)\C(C)C Amb24725292 [0,1,0,0,0,1|1,0,1]=4 5071 B9R0.7 C\C(=C/CC(C)C)\C(C)=O Amb24478340 [0,1,0,0,0,1|1,0,1]=4 5072 B9R0.7 C\C(=C\CC(C(=O)O)Cl)\Cl Amb17594711 [0,1,0,0,0,1|1,0,1]=4 5073 B9R0.7 C\C(=C\CC(C)=O)\C(C)C Amb24408897 [0,1,0,0,0,1|1,0,1]=4 5074 B9R0.7 C\C(=C\CC(C)O)\C(O)=O Amb25368118 [0,1,0,0,0,1|1,0,1]=4 5075 B9R0.7 C\C(=N/CC(C)C)\C(C)=O Amb24424901 [0,1,0,0,0,1|1,0,1]=4 5076 B9R0.7 C\C(=N\CC(C)C)\C(O)=O Amb24068330 [0,1,0,0,0,1|0,0,1]=3 5077 B9R0.7 C\C(\Cl)=C\CC(C)C(O)=O Amb18126350 [0,1,0,0,0,1|1,0,1]=4 5078 B9R0.7 C\C(\Cl)=C\CC(N)C(O)=O Amb24692752 [0,1,0,0,0,1|1,0,1]=4 5079 B9R0.7 C\C(\Cl)=C\C[C@H](N)C(O)=O Amb24629700 [0,1,0,0,0,1|1,0,1]=4 5080 B9R0.7 NC(CCC(O)=O)C(F)F Amb19148415 [0,1,0,0,0,1|2,0,0]=4 5081 B9R0.7 N[C@@H](CSC(F)F)C(O)=O Amb18180315 [0,1,0,0,0,1|2,0,0]=4 5082 B9R0.7 N[C@H](C(=O)O)CCC(C)C Amb16183866 [0,1,0,0,0,1|0,0,0]=2 5083 B9R0.7 N[C@H](C(=O)O)CC[S+](C)C Amb10601599 [0,1,0,0,0,1|1,0,0]=3 5084 B9R0.7 OC(=O)CCS(=O)C(F)F Amb19007168 [0,1,0,0,0,1|2,0,0]=4 5085 B9R0.53 CC(=C)CC(=O)CC(C)C Amb25827965 [0,1,0,0,0,1|2,0,0]=4 5086 B9R0.53 CC(=C)CC(C)CC(O)=O Amb18643943 [0,1,0,0,0,1|0,0,2]=4 5087 B9R0.53 CC(=CC(O)=O)NC(C)C Amb25360223 [0,1,0,0,0,1|0,0,2]=4 5088 B9R0.53 CC(=O)CC(=N)CC(C)C Amb24706662 [0,1,0,0,0,1|1,0,0]=3 5089 B9R0.53 CC(=O)CC(=O)CC(O)=O Amb18644062 [0,1,0,0,0,1|1,0,1]=4 5090 B9R0.53 CC(=O)CC(=O)CN(C)C Amb25358908 [0,1,0,0,0,1|2,0,0]=4 5091 B9R0.53 CC(=O)CC(C)CC(O)=O Amb18644106 [0,1,0,0,0,1|1,0,1]=4 5092 B9R0.53 CC(=O)C[C@@H](CC(=O)O)C Amb10844399 [0,1,0,0,0,1|1,0,1]=4 5093 B9R0.53 CC(=O)NC(=O)CC(C)C Amb24333719 [0,1,0,0,0,1|1,0,1]=4 5094 B9R0.53 CC(=O)OC(C)CC(O)=O Amb18644244 [0,1,0,0,0,1|1,0,1]=4 5095 B9R0.53 CC(=O)O[C@H](C)CC(O)=O Amb25062672 [0,1,0,0,0,1|1,0,1]=4 5096 B9R0.53 CC(=O)\C=C(/O)\CC(C)C Amb24524653 [0,1,0,0,0,1|1,0,1]=4 5097 B9R0.53 CC(C)=CC(=C)CC(O)=O Amb25799390 [0,1,0,0,0,1|0,0,2]=4 5098 B9R0.53 CC(C)=CC(C)CC(C)=O Amb25093185 [0,1,0,0,0,1|1,0,1]=4 5099 B9R0.53 CC(C)=CC(C)CC(O)=O Amb24480766 [0,1,0,0,0,1|0,0,1]=3 5100 B9R0.53 CC(C)=CC(N)CC(N)=O Amb25805588 [0,1,0,0,0,1|1,0,1]=4 5101 B9R0.53 CC(C)=CC(O)CC(O)=O Amb18644102 [0,1,0,0,0,1|0,0,1]=3 5102 B9R0.53 CC(C)=C[C@@H](O)CC(O)=O Amb24393168 [0,1,0,0,0,1|0,0,1]=3 5103 B9R0.53 CC(C)CC(=C)CC(O)=O Amb18643897 [0,1,0,0,0,1|0,0,0]=2 5104 B9R0.53 CC(C)CC(=O)CC(N)=S Amb25210023 [0,1,0,0,0,1|1,1,0]=4 5105 B9R0.53 CC(C)CC(=O)CS(C)=O Amb24676845 [0,1,0,0,0,1|2,0,0]=4 5106 B9R0.53 CC(C)CC(=O)NC(N)=O Amb25352091 [0,1,0,0,0,1|1,0,1]=4 5107 B9R0.53 CC(C)CC(C)C=C(Br)Br Amb24606092 [0,1,0,0,0,1|2,0,0]=4 5108 B9R0.53 CC(C)CC(C)CC(C)=O Amb20621119 [0,1,0,0,0,1|1,0,0]=3 5109 B9R0.53 CC(C)CC(C)CC(C)O Amb24271139 [0,1,0,0,0,1|1,0,1]=4 5110 B9R0.53 CC(C)CC(C)CC(N)=N Amb24479387 [0,1,0,0,0,1|2,0,0]=4 5111 B9R0.53 CC(C)CC(C)CC(N)=S Amb24565637 [0,1,0,0,0,1|1,1,0]=4 5112 B9R0.53 CC(C)CC(C)NC(C)=O Amb25824393 [0,1,0,0,0,1|1,0,0]=3 5113 B9R0.53 CC(C)CC(C)NC(N)=N Amb24467365 [0,1,0,0,0,1|2,0,0]=4 5114 B9R0.53 CC(C)CC(C)OC(C)=O Amb22733405 [0,1,0,0,0,1|1,0,0]=3 5115 B9R0.53 CC(C)CC(Cl)CC(=O)Cl Amb25241016 [0,1,0,0,0,1|1,0,0]=3 5116 B9R0.53 CC(C)CC(Cl)CC(C)=C Amb24579888 [0,1,0,0,0,1|2,0,0]=4 5117 B9R0.53 CC(C)CC(Cl)NC(=O)Cl Amb25177573 [0,1,0,0,0,1|1,0,0]=3 5118 B9R0.53 CC(C)CC(Cl)OC(C)=O Amb24424956 [0,1,0,0,0,1|1,0,0]=3 5119 B9R0.53 CC(C)CC(N)C=C(C)C Amb25822562 [0,1,0,0,0,1|2,0,0]=4 5120 B9R0.53 CC(C)CC(N)CC(N)=O Amb25785407 [0,1,0,0,0,1|1,0,0]=3 5121 B9R0.53 CC(C)CC(O)C=C(C)C Amb25364031 [0,1,0,0,0,1|2,0,0]=4 5122 B9R0.53 CC(C)CC(O)CC(C)=O Amb25054426 [0,1,0,0,0,1|1,0,0]=3 5123 B9R0.53 CC(C)CC(O)CC(C)O Amb25787141 [0,1,0,0,0,1|1,0,1]=4 5124 B9R0.53 CC(C)CN(C)CC(=C)Cl Amb25847426 [0,1,0,0,0,1|2,0,0]=4 5125 B9R0.53 CC(C)CN(C)C[C@@H](C)O Amb24479585 [0,1,0,0,0,1|1,0,1]=4 5126 B9R0.53 CC(C)CN(C)NC(N)=O Amb25809406 [0,1,0,0,0,1|2,0,0]=4 5127 B9R0.53 CC(C)CS(=O)CC(C)=O Amb25052491 [0,1,0,0,0,1|1,0,0]=3 5128 B9R0.53 CC(C)CS(=O)CC(O)=O Amb18792576 [0,1,0,0,0,1|0,0,0]=2 5129 B9R0.53 CC(C)C[C@@H](C)CC(C)=O Amb24480437 [0,1,0,0,0,1|1,0,0]=3 5130 B9R0.53 CC(C)C[C@@H](C)CC(O)=O Amb24455134 [0,1,0,0,0,1|0,0,0]=2 5131 B9R0.53 CC(C)C[C@@H](O)CC(C)=C Amb25788084 [0,1,0,0,0,1|2,0,0]=4 5132 B9R0.53 CC(C)C[C@@H](O)CC(C)=O Amb24480617 [0,1,0,0,0,1|1,0,0]=3 5133 B9R0.53 CC(C)C[C@@H](O)C[C@@H](C)O Amb24475825 [0,1,0,0,0,1|1,0,1]=4 5134 B9R0.53 CC(C)C[C@H](C)CC(C)=O Amb25707831 [0,1,0,0,0,1|1,0,0]=3 5135 B9R0.53 CC(C)C[C@H](N)CC(O)=O Amb19944305 [0,1,0,0,0,1|0,0,0]=2 5136 B9R0.53 CC(C)C[C@H](O)CC(O)=O Amb24505145 [0,1,0,0,0,1|0,0,0]=2 5137 B9R0.53 CC(C)NC(C)CC(C)O Amb24587728 [0,1,0,0,0,1|1,0,1]=4 5138 B9R0.53 CC(C)NC(C)NC(C)=O Amb24553224 [0,1,0,0,0,1|2,0,0]=4 5139 B9R0.53 CC(C)N[C@H](C)C[C@@H](C)O Amb24695074 [0,1,0,0,0,1|1,0,1]=4 5140 B9R0.53 CC(C)N[C@H](C)C[C@H](C)O Amb24742191 [0,1,0,0,0,1|1,0,1]=4 5141 B9R0.53 CC(C)OC(C)NC(C)=O Amb22729317 [0,1,0,0,0,1|2,0,0]=4 5142 B9R0.53 CC(C)O[C@H](C)CC(O)=O Amb24463494 [0,1,0,0,0,1|0,0,0]=2 5143 B9R0.53 CC(C)SC(=O)CC(O)=O Amb25743447 [0,1,0,0,0,1|0,0,1]=3 5144 B9R0.53 CC(C)SC(C)CC(C)=O Amb25126446 [0,1,0,0,0,1|1,0,0]=3 5145 B9R0.53 CC(C)SC(C)CC(N)=N Amb18792301 [0,1,0,0,0,1|2,0,0]=4 5146 B9R0.53 CC(C)SC(C)CC(O)=O Amb18303284 [0,1,0,0,0,1|0,0,0]=2 5147 B9R0.53 CC(CC(=O)C[N+](=O)[O-])C Amb10573995 [0,1,0,0,0,1|1,0,1]=4 5148 B9R0.53 CC(CC(=O)N)NC(C)C Amb17231987 [0,1,0,0,0,1|1,0,0]=3 5149 B9R0.53 CC(CC(C)O)NC(C)=O Amb25211368 [0,1,0,0,0,1|2,0,0]=4 5150 B9R0.53 CC(CC(CC(=O)O)N)C Amb2438867 [0,1,0,0,0,1|0,0,0]=2 5151 B9R0.53 CC(CC(CC(=O)O)O)C Amb17232005 [0,1,0,0,0,1|0,0,0]=2 5152 B9R0.53 CC(CC(O)=O)NS(C)=O Amb25347318 [0,1,0,0,0,1|2,0,0]=4 5153 B9R0.53 CC(CC(O)=O)OC(F)F Amb24536176 [0,1,0,0,0,1|2,0,0]=4 5154 B9R0.53 CC(CN(C)C)=CC(O)=O Amb24390419 [0,1,0,0,0,1|1,0,1]=4 5155 B9R0.53 CC(CN(C)C)NC(C)=O Amb25127012 [0,1,0,0,0,1|2,0,0]=4 5156 B9R0.53 CC(CN(CC(=C)Br)C)C Amb14915914 [0,1,0,0,0,1|2,0,0]=4 5157 B9R0.53 CC(CN(CC(O)C)C)C Amb17334256 [0,1,0,0,0,1|1,0,1]=4 5158 B9R0.53 CC(C[C@@H](CC(=O)O)C)C Amb10844383 [0,1,0,0,0,1|0,0,0]=2 5159 B9R0.53 CC(C[C@@H](CC(=O)O)N)C Amb16184017 [0,1,0,0,0,1|0,0,0]=2 5160 B9R0.53 CC(N)CC(C)NC(N)=O Amb25828986 [0,1,0,0,0,1|2,0,0]=4 5161 B9R0.53 CC(N)CN(C)CC(N)=O Amb25060268 [0,1,0,0,0,1|2,0,0]=4 5162 B9R0.53 CC(N)CN(C)CC(O)=O Amb25140627 [0,1,0,0,0,1|1,0,0]=3 5163 B9R0.53 CC(NC(=O)CC(=O)O)C Amb17399889 [0,1,0,0,0,1|0,0,1]=3 5164 B9R0.53 CC(O)CN(C)CC(C)=O Amb24441836 [0,1,0,0,0,1|2,0,0]=4 5165 B9R0.53 CC(O)CN(C)CC(O)=O Amb18312778 [0,1,0,0,0,1|1,0,0]=3 5166 B9R0.53 CN(C)CC(N)CC(O)=O Amb18644281 [0,1,0,0,0,1|1,0,0]=3 5167 B9R0.53 CN(C)CC(O)CC(N)=O Amb24744547 [0,1,0,0,0,1|2,0,0]=4 5168 B9R0.53 CN(C)C[C@@H](O)CC(O)=O Amb25084529 [0,1,0,0,0,1|1,0,0]=3 5169 B9R0.53 CN(C)NC(=O)CC(O)=O Amb20246800 [0,1,0,0,0,1|1,0,1]=4 5170 B9R0.53 CN(CC(F)F)CC(O)=O Amb18177927 [0,1,0,0,0,1|2,0,0]=4 5171 B9R0.53 CN(C[C@@H](CC(=O)O)O)C Amb10069803 [0,1,0,0,0,1|1,0,0]=3 5172 B9R0.53 CN(O)CC(O)CC(O)=O Amb24611959 [0,1,0,0,0,1|2,0,0]=4 5173 B9R0.53 CS(=O)CC(N)CC(O)=O Amb25766509 [0,1,0,0,0,1|2,0,0]=4 5174 B9R0.53 CS(=O)C[C@@H](N)CC(O)=O Amb25321945 [0,1,0,0,0,1|2,0,0]=4 5175 B9R0.53 C[C@@H](CN(C)C)NC(N)=O Amb25129953 [0,1,0,0,0,1|2,0,0]=4 5176 B9R0.53 C[C@@H](CN(C)C)OC(N)=O Amb24678456 [0,1,0,0,0,1|2,0,0]=4 5177 B9R0.53 C[C@@H](C[C@@H](C)O)OC(C)=O Amb25722158 [0,1,0,0,0,1|2,0,0]=4 5178 B9R0.53 C[C@H](CN(C)C)NC(N)=O Amb24734199 [0,1,0,0,0,1|2,0,0]=4 5179 B9R0.53 C[C@H](C[C@@H](C)O)NC(C)=O Amb24597644 [0,1,0,0,0,1|2,0,0]=4 5180 B9R0.53 C[C@H](C[C@@H](C)O)OC(C)=O Amb24386965 [0,1,0,0,0,1|2,0,0]=4 5181 B9R0.53 C[C@H](C[C@H](C)O)OC(C)=O Amb24474272 [0,1,0,0,0,1|2,0,0]=4 5182 B9R0.53 C[C@H](N)C[C@H](N)CC(O)=O Amb24418565 [0,1,0,0,0,1|1,0,0]=3 5183 B9R0.53 C\C(\CC(C)=O)=C\C(C)C Amb24614276 [0,1,0,0,0,1|1,0,1]=4 5184 B9R0.53 C\C(\CC(C)=O)=N/C(C)C Amb25833982 [0,1,0,0,0,1|1,0,1]=4 5185 B9R0.53 C\C(\O)=C/C(=O)CC(C)C Amb25146560 [0,1,0,0,0,1|1,0,1]=4 5186 B9R0.53 C\C(\O)=C\C(=O)CC(C)C Amb25146659 [0,1,0,0,0,1|1,0,1]=4 5187 B9R0.53 OC(=O)CS(=O)CC(F)F Amb18180309 [0,1,0,0,0,1|2,0,0]=4 5188 B9R0.53 OC(=O)C[C@@H](NC(=O)C)C Amb2372568 [0,1,0,0,0,1|1,0,1]=4 5189 B9R0.53 OC(=O)C[C@H](NC(=O)C)C Amb2372567 [0,1,0,0,0,1|1,0,1]=4 5190 B9R0.56 CC(=C)CCCC(C)(C)O Amb22353103 [0,1,0,0,0,1|2,0,0]=4 5191 B9R0.56 CC(=C)CCNC(C)(C)C Amb19025233 [0,1,0,0,0,1|2,0,0]=4 5192 B9R0.56 CC(=C)CNCC(C)(C)N Amb24607722 [0,1,0,0,0,1|2,0,0]=4 5193 B9R0.56 CC(=C)CNCC(C)(C)O Amb24662791 [0,1,0,0,0,1|2,0,0]=4 5194 B9R0.56 CC(=C)COCC(C)(C)N Amb18630818 [0,1,0,0,0,1|2,0,0]=4 5195 B9R0.56 CC(=C)CSCC(C)(C)C Amb24482671 [0,1,0,0,0,1|2,0,0]=4 5196 B9R0.56 CC(=O)CC#CC(C)(C)O Amb24380834 [0,1,0,0,0,1|1,0,1]=4 5197 B9R0.56 CC(=O)CCCC(C)(C)Cl Amb25146588 [0,1,0,0,0,1|1,0,0]=3 5198 B9R0.56 CC(=O)CCCC(C)(C)F Amb25694464 [0,1,0,0,0,1|1,0,0]=3 5199 B9R0.56 CC(=O)CCCC(O)(C)C Amb17593627 [0,1,0,0,0,1|1,0,0]=3 5200 B9R0.56 CC(=O)CCC[N+](C)(C)C Amb25150329 [0,1,0,0,0,1|2,0,0]=4 5201 B9R0.56 CC(=O)CCNC(C)(C)C Amb24478983 [0,1,0,0,0,1|1,0,0]=3 5202 B9R0.56 CC(=O)CCO[Si](C)(C)C Amb24723895 [0,1,0,0,0,1|1,1,0]=4 5203 B9R0.56 CC(=O)COCC(C)(C)N Amb18106342 [0,1,0,0,0,1|1,0,0]=3 5204 B9R0.56 CC(=O)CSCC(C)(C)F Amb25212458 [0,1,0,0,0,1|1,0,0]=3 5205 B9R0.56 CC(=O)CSC[Si](C)(C)C Amb24504841 [0,1,0,0,0,1|1,1,0]=4 5206 B9R0.56 CC(=O)CSSC(C)(C)C Amb24402807 [0,1,0,0,0,1|2,0,0]=4 5207 B9R0.56 CC(=O)C\C=C\C(C)(C)C Amb25320062 [0,1,0,0,0,1|1,0,1]=4 5208 B9R0.56 CC(=O)NCCC(C)(C)C Amb24351644 [0,1,0,0,0,1|1,0,0]=3 5209 B9R0.56 CC(=O)NCCC(C)(F)F Amb25059540 [0,1,0,0,0,1|2,0,0]=4 5210 B9R0.56 CC(=O)NCSC(C)(C)C Amb10559955 [0,1,0,0,0,1|2,0,0]=4 5211 B9R0.56 CC(=O)NNCC(C)(C)O Amb25741973 [0,1,0,0,0,1|2,0,0]=4 5212 B9R0.56 CC(=O)NOCC(C)(C)O Amb25734130 [0,1,0,0,0,1|2,0,0]=4 5213 B9R0.56 CC(=O)OCCC(C)(F)F Amb25296921 [0,1,0,0,0,1|2,0,0]=4 5214 B9R0.56 CC(=O)OCC[N+](C)(C)C Amb22350025 [0,1,0,0,0,1|2,0,0]=4 5215 B9R0.56 CC(=O)OCC[Si](C)(C)Cl Amb19893511 [0,1,0,0,0,1|1,1,0]=4 5216 B9R0.56 CC(=O)O[Hg]CC(C)(C)C Amb22347654 [0,1,0,0,0,1|2,0,0]=4 5217 B9R0.56 CC(=O)SCC[N+](C)(C)C Amb17940581 [0,1,0,0,0,1|2,0,0]=4 5218 B9R0.56 CC(=O)SCC[N+](C)(C)C Amb22264795 [0,1,0,0,0,1|2,0,0]=4 5219 B9R0.56 CC(=O)SCC[N+](C)(C)C Amb22729102 [0,1,0,0,0,1|2,0,0]=4 5220 B9R0.56 CC(=O)\C=C\CC(C)(C)C Amb24614709 [0,1,0,0,0,1|1,0,1]=4 5221 B9R0.56 CC(C)(C)C#CCC(O)=O Amb25785842 [0,1,0,0,0,1|0,0,1]=3 5222 B9R0.56 CC(C)(C)CC#CC(O)=O Amb25342948 [0,1,0,0,0,1|0,0,1]=3 5223 B9R0.56 CC(C)(C)CCCB(O)O Amb24335286 [0,1,0,0,0,1|1,0,1]=4 5224 B9R0.56 CC(C)(C)CCCC(N)=O Amb25268901 [0,1,0,0,0,1|1,0,0]=3 5225 B9R0.56 CC(C)(C)CCCC(N)=S Amb24479423 [0,1,0,0,0,1|1,1,0]=4 5226 B9R0.56 CC(C)(C)CCCC(O)=O Amb18307485 [0,1,0,0,0,1|0,0,0]=2 5227 B9R0.56 CC(C)(C)CCNC(N)=N Amb24351200 [0,1,0,0,0,1|2,0,0]=4 5228 B9R0.56 CC(C)(C)CCNC(N)=O Amb24618143 [0,1,0,0,0,1|1,0,0]=3 5229 B9R0.56 CC(C)(C)CCOC(=O)Cl Amb24705073 [0,1,0,0,0,1|1,0,0]=3 5230 B9R0.56 CC(C)(C)CCOC(N)=O Amb24575181 [0,1,0,0,0,1|1,0,0]=3 5231 B9R0.56 CC(C)(C)CNCC(=C)Br Amb19010383 [0,1,0,0,0,1|2,0,0]=4 5232 B9R0.56 CC(C)(C)CNCC(=C)Cl Amb18305401 [0,1,0,0,0,1|2,0,0]=4 5233 B9R0.56 CC(C)(C)CNCC(N)=O Amb18315719 [0,1,0,0,0,1|1,0,0]=3 5234 B9R0.56 CC(C)(C)CNCC(O)=O Amb19012829 [0,1,0,0,0,1|0,0,0]=2 5235 B9R0.56 CC(C)(C)COCC(=O)Cl Amb21964966 [0,1,0,0,0,1|1,0,0]=3 5236 B9R0.56 CC(C)(C)COCC(O)=O Amb25079059 [0,1,0,0,0,1|0,0,0]=2 5237 B9R0.56 CC(C)(C)CSCC(=C)Br Amb25370151 [0,1,0,0,0,1|2,0,0]=4 5238 B9R0.56 CC(C)(C)CSCC(=C)Cl Amb25130303 [0,1,0,0,0,1|2,0,0]=4 5239 B9R0.56 CC(C)(C)CSCC(N)=O Amb25333192 [0,1,0,0,0,1|1,0,0]=3 5240 B9R0.56 CC(C)(C)C\C=C/C(N)=O Amb25147257 [0,1,0,0,0,1|1,0,1]=4 5241 B9R0.56 CC(C)(C)N\C=C\C(O)=O Amb25330866 [0,1,0,0,0,1|0,0,2]=4 5242 B9R0.56 CC(C)(C)ONCC(O)=O Amb25767797 [0,1,0,0,0,1|1,0,0]=3 5243 B9R0.56 CC(C)(C)O\C=C\C(O)=O Amb24763807 [0,1,0,0,0,1|0,0,2]=4 5244 B9R0.56 CC(C)(C)SCCC(N)=O Amb18800586 [0,1,0,0,0,1|1,0,0]=3 5245 B9R0.56 CC(C)(C)SSCC(O)=O Amb25702370 [0,1,0,0,0,1|1,0,0]=3 5246 B9R0.56 CC(C)(C)S\C=C\C(O)=O Amb25220884 [0,1,0,0,0,1|0,0,2]=4 5247 B9R0.56 CC(C)(C)\C=C\CC(O)=O Amb24608675 [0,1,0,0,0,1|0,0,1]=3 5248 B9R0.56 CC(C)(F)CCCC(O)=O Amb25270576 [0,1,0,0,0,1|0,0,0]=2 5249 B9R0.56 CC(C)(F)COCC(O)=O Amb25234238 [0,1,0,0,0,1|0,0,0]=2 5250 B9R0.56 CC(C)(F)CSCC(O)=O Amb24596449 [0,1,0,0,0,1|0,0,0]=2 5251 B9R0.56 CC(C)(N)CCCC(O)=O Amb25839402 [0,1,0,0,0,1|0,0,0]=2 5252 B9R0.56 CC(C)(N)CNCC(=C)Cl Amb25703997 [0,1,0,0,0,1|2,0,0]=4 5253 B9R0.56 CC(C)(N)CNCC(O)=O Amb24415937 [0,1,0,0,0,1|0,0,0]=2 5254 B9R0.56 CC(C)(N)COCC(=C)Cl Amb24746442 [0,1,0,0,0,1|2,0,0]=4 5255 B9R0.56 CC(C)(N)COCC(N)=O Amb25228927 [0,1,0,0,0,1|1,0,0]=3 5256 B9R0.56 CC(C)(N)COCC(O)=O Amb18630788 [0,1,0,0,0,1|0,0,0]=2 5257 B9R0.56 CC(C)(N)CSCC(=C)Br Amb25349260 [0,1,0,0,0,1|2,0,0]=4 5258 B9R0.56 CC(C)(N)CSCC(O)=O Amb25831613 [0,1,0,0,0,1|0,0,0]=2 5259 B9R0.56 CC(C)(N)C\C=C\C(O)=O Amb24351647 [0,1,0,0,0,1|0,0,1]=3 5260 B9R0.56 CC(C)(O)CCCC(O)=O Amb24340189 [0,1,0,0,0,1|0,0,0]=2 5261 B9R0.56 CC(C)(O)CCNC(N)=S Amb25351722 [0,1,0,0,0,1|1,1,0]=4 5262 B9R0.56 CC(C)(O)CCSC(N)=N Amb25728259 [0,1,0,0,0,1|2,0,0]=4 5263 B9R0.56 CC(C)(O)CNCC(=C)Br Amb25336430 [0,1,0,0,0,1|2,0,0]=4 5264 B9R0.56 CC(C)(O)CNCC(=C)Cl Amb25741693 [0,1,0,0,0,1|2,0,0]=4 5265 B9R0.56 CC(C)(O)CNCC(N)=O Amb18304038 [0,1,0,0,0,1|1,0,0]=3 5266 B9R0.56 CC(C)(O)CNCC(O)=O Amb18304065 [0,1,0,0,0,1|0,0,0]=2 5267 B9R0.56 CC(C)(O)CSCC(O)=O Amb18307056 [0,1,0,0,0,1|0,0,0]=2 5268 B9R0.56 CC(C)(O)C\C=C\C(O)=O Amb18644104 [0,1,0,0,0,1|0,0,1]=3 5269 B9R0.56 CC(C)=CCCC(C)(C)O Amb22228370 [0,1,0,0,0,1|2,0,0]=4 5270 B9R0.56 CC(C)=CCCP(O)(O)=O Amb25048391 [0,1,0,0,0,1|1,0,1]=4 5271 B9R0.56 CC(C)CCCC(C)(C)O Amb22043432 [0,1,0,0,0,1|1,0,1]=4 5272 B9R0.56 CC(C)CCCS(=O)(=O)Cl Amb24478902 [0,1,0,0,0,1|1,0,1]=4 5273 B9R0.56 CC(C)CCCS(N)(=O)=O Amb24479274 [0,1,0,0,0,1|1,0,1]=4 5274 B9R0.56 CC(C)CCNS(O)(=O)=O Amb25378775 [0,1,0,0,0,1|1,0,0]=3 5275 B9R0.56 CC(C)CCOS(C)(=O)=O Amb24451339 [0,1,0,0,0,1|1,0,1]=4 5276 B9R0.56 CC(C)CCOS(O)(=O)=O Amb24541607 [0,1,0,0,0,1|1,0,0]=3 5277 B9R0.56 CC(C)CNCP(O)(O)=O Amb25685379 [0,1,0,0,0,1|1,0,0]=3 5278 B9R0.56 CC(C)CSCC(C)(C)O Amb18792451 [0,1,0,0,0,1|1,0,1]=4 5279 B9R0.56 CC(C)NCCS(C)(=O)=O Amb18800964 [0,1,0,0,0,1|1,0,1]=4 5280 B9R0.56 CC(C)NCCS(O)(=O)=O Amb25323890 [0,1,0,0,0,1|1,0,0]=3 5281 B9R0.56 CC(C)OCCS(=O)(=O)Cl Amb18307388 [0,1,0,0,0,1|1,0,1]=4 5282 B9R0.56 CC(C)OCCS(N)(=O)=O Amb18792944 [0,1,0,0,0,1|1,0,1]=4 5283 B9R0.56 CC(C)SCCS(=O)(=O)Cl Amb24621162 [0,1,0,0,0,1|1,0,1]=4 5284 B9R0.56 CC(C)SCCS(C)(=O)=O Amb24482904 [0,1,0,0,0,1|1,0,1]=4 5285 B9R0.56 CC(C)SCCS(N)(=O)=O Amb24406339 [0,1,0,0,0,1|1,0,1]=4 5286 B9R0.56 CC(CCNS(=O)(=O)C)C Amb1777719 [0,1,0,0,0,1|1,0,1]=4 5287 B9R0.56 CC(CCNS(=O)(=O)Cl)C Amb17193922 [0,1,0,0,0,1|1,0,1]=4 5288 B9R0.56 CC(CNCC(O)(C)C)C Amb17138403 [0,1,0,0,0,1|1,0,1]=4 5289 B9R0.56 CC(N)=NCCC(C)(C)O Amb24464457 [0,1,0,0,0,1|2,0,0]=4 5290 B9R0.56 CC(O)CCCC(C)(C)N Amb25265263 [0,1,0,0,0,1|1,0,1]=4 5291 B9R0.56 CC(O)CCNC(C)(C)C Amb18124759 [0,1,0,0,0,1|1,0,1]=4 5292 B9R0.56 CC(O)CCOC(C)(C)C Amb25683681 [0,1,0,0,0,1|1,0,1]=4 5293 B9R0.56 CC(O)CCSC(C)(C)C Amb24685426 [0,1,0,0,0,1|1,0,1]=4 5294 B9R0.56 CC(O)CNCC(C)(C)C Amb19012828 [0,1,0,0,0,1|1,0,1]=4 5295 B9R0.56 CC(O)CNCC(C)(C)N Amb24478855 [0,1,0,0,0,1|1,0,1]=4 5296 B9R0.56 CC(O)CNCC(C)(C)O Amb18304051 [0,1,0,0,0,1|1,0,1]=4 5297 B9R0.56 CC(O)CSCC(C)(C)N Amb24753421 [0,1,0,0,0,1|1,0,1]=4 5298 B9R0.56 CN(C)(C)CCCC(O)=O Amb22732541 [0,1,0,0,0,1|1,0,0]=3 5299 B9R0.56 CN(C)CCOS(O)(=O)=O Amb19988267 [0,1,0,0,0,1|2,0,0]=4 5300 B9R0.56 CP(C)(=O)CNCC(O)=O Amb25339632 [0,1,0,0,0,1|1,0,0]=3 5301 B9R0.56 CP(O)(=O)CCCC(O)=O Amb24524573 [0,1,0,0,0,1|2,0,0]=4 5302 B9R0.56 CP(O)(=O)CNCC(O)=O Amb25772534 [0,1,0,0,0,1|2,0,0]=4 5303 B9R0.56 CS(=O)(=O)OCCC(O)=O Amb25288145 [0,1,0,0,0,1|2,0,0]=4 5304 B9R0.56 CS(=O)CCNC(C)(C)C Amb25826903 [0,1,0,0,0,1|2,0,0]=4 5305 B9R0.56 CS(=O)NCCC(C)(C)O Amb24589633 [0,1,0,0,0,1|2,0,0]=4 5306 B9R0.56 C[C@@H](O)CNCC(C)(C)C Amb25070301 [0,1,0,0,0,1|1,0,1]=4 5307 B9R0.56 C[C@@H](O)CNCC(C)(C)N Amb24369751 [0,1,0,0,0,1|1,0,1]=4 5308 B9R0.56 C[C@H](O)CCCC(C)(C)O Amb25027992 [0,1,0,0,0,1|1,0,1]=4 5309 B9R0.56 C[C@H](O)CNCC(C)(C)O Amb24555845 [0,1,0,0,0,1|1,0,1]=4 5310 B9R0.56 C[N+](C)(C)CC#CC(O)=O Amb24390874 [0,1,0,0,0,1|1,0,1]=4 5311 B9R0.56 C[N+](C)(C)CCCC(N)=O Amb24365354 [0,1,0,0,0,1|2,0,0]=4 5312 B9R0.56 C[N+](C)(C)CCCC([O-])=O Amb22054610 [0,1,0,0,0,1|1,0,1]=4 5313 B9R0.56 C[N+](C)(C)NCCC(O)=O Amb22395996 [0,1,0,0,0,1|1,0,0]=3 5314 B9R0.56 C[Si](C)(C)C#CCC(O)=O Amb25273592 [0,1,0,0,0,1|0,1,1]=4 5315 B9R0.56 C[Si](C)(C)CCCC(N)=O Amb24482275 [0,1,0,0,0,1|1,1,0]=4 5316 B9R0.56 C[Si](C)(C)CCOC(N)=O Amb24739734 [0,1,0,0,0,1|1,1,0]=4 5317 B9R0.56 C[Si](C)(C)CNCC(O)=O Amb24711223 [0,1,0,0,0,1|0,1,0]=3 5318 B9R0.56 C[Si](C)(C)CSCC(O)=O Amb25321941 [0,1,0,0,0,1|0,1,0]=3 5319 B9R0.56 C[Si](C)(C)NCCC(O)=O Amb24433951 [0,1,0,0,0,1|0,1,0]=3 5320 B9R0.56 C[Si](C)(C)\C=C\CC(O)=O Amb24658468 [0,1,0,0,0,1|0,1,1]=4 5321 B9R0.56 NC(=O)OCC[N](C)(C)C Amb10241337 [0,1,0,0,0,1|2,0,0]=4 5322 B9R0.56 OC(=O)C=C=CC(C)(C)C Amb17593545 [0,1,0,0,0,1|0,0,2]=4 5323 B9R0.56 OC(=O)CCCC(F)(F)C Amb17593778 [0,1,0,0,0,1|1,0,0]=3 5324 B9R0.56 OC(=O)CCCC(F)(F)F Amb10839991 [0,1,0,0,0,1|2,0,0]=4 5325 B9R0.56 OC(=O)CCCS(=O)(=O)C Amb17503668 [0,1,0,0,0,1|2,0,0]=4 5326 B9R0.56 OC(=O)CCNC(C)(C)C Amb1106324 [0,1,0,0,0,1|0,0,0]=2 5327 B9R0.56 OC(=O)CCNC([2H])([2H])[2H] Amb17617139 [0,1,0,0,0,1|2,0,0]=4 5328 B9R0.56 OC(=O)CCNS(=O)(=O)C Amb1116751 [0,1,0,0,0,1|2,0,0]=4 5329 B9R0.56 OC(=O)CCSS(=O)(=O)C Amb10071647 [0,1,0,0,0,1|2,0,0]=4 5330 B9R0.56 OC(=O)CNCC(F)(F)F Amb19372984 [0,1,0,0,0,1|2,0,0]=4 5331 B9R0.56 OC(=O)CNCC(O)(O)O Amb24482160 [0,1,0,0,0,1|2,0,0]=4 5332 B9R0.56 OC(=O)COCC(Cl)(Cl)Cl Amb24680182 [0,1,0,0,0,1|2,0,0]=4 5333 B9R0.56 OC(=O)CSCC(F)(F)F Amb1135874 [0,1,0,0,0,1|2,0,0]=4 5334 B9R0.56 [O-]C(=O)CCN[N+](C)(C)C Amb2099568 [0,1,0,0,0,1|1,0,1]=4 5335 B9R0.21 CC(C)(C)CCC(=O)C#C Amb25073134 [0,2,0,0,0,0|1,0,0]=3 5336 B9R0.21 CC(C)(C)CCC(=O)C=C Amb24692107 [0,2,0,0,0,0|1,0,0]=3 5337 B9R0.21 CC(C)(C)CCC(=O)CBr Amb24644243 [0,2,0,0,0,0|1,0,0]=3 5338 B9R0.21 CC(C)(C)CCC(N)=NN Amb24737577 [0,2,0,0,0,0|2,0,0]=4 5339 B9R0.21 CC(C)(C)CCC(N)=NO Amb24356913 [0,2,0,0,0,0|1,0,0]=3 5340 B9R0.21 CC(C)(C)CCC(N)CO Amb18201750 [0,2,0,0,0,0|1,0,1]=4 5341 B9R0.21 CC(C)(C)CCC(O)C#C Amb24479417 [0,2,0,0,0,0|1,0,1]=4 5342 B9R0.21 CC(C)(C)CNC(=O)CBr Amb24116139 [0,2,0,0,0,0|2,0,0]=4 5343 B9R0.21 CC(C)(C)CNC(=O)CCl Amb18792529 [0,2,0,0,0,0|2,0,0]=4 5344 B9R0.21 CC(C)(C)CNC(=O)CF Amb24745674 [0,2,0,0,0,0|2,0,0]=4 5345 B9R0.21 CC(C)(C)CNC(=O)CN Amb18290491 [0,2,0,0,0,0|2,0,0]=4 5346 B9R0.21 CC(C)(C)CNC(=O)CO Amb25725267 [0,2,0,0,0,0|1,0,0]=3 5347 B9R0.21 CC(C)(C)CNC(=O)CS Amb25103529 [0,2,0,0,0,0|1,1,0]=4 5348 B9R0.21 CC(C)(C)CNC(=O)NN Amb24398575 [0,2,0,0,0,0|2,0,0]=4 5349 B9R0.21 CC(C)(C)CNC(N)=NO Amb25831281 [0,2,0,0,0,0|2,0,0]=4 5350 B9R0.21 CC(C)(C)COC(=O)C=C Amb17934127 [0,2,0,0,0,0|2,0,0]=4 5351 B9R0.21 CC(C)(C)COC(=O)CO Amb24733296 [0,2,0,0,0,0|1,0,0]=3 5352 B9R0.21 CC(C)(C)NCC(=O)NN Amb20224033 [0,2,0,0,0,0|2,0,0]=4 5353 B9R0.21 CC(C)(C)NCC(N)=NO Amb25363906 [0,2,0,0,0,0|2,0,0]=4 5354 B9R0.21 CC(C)(C)OCC(=O)C#C Amb25739305 [0,2,0,0,0,0|2,0,0]=4 5355 B9R0.21 CC(C)(C)OCC(=O)C=C Amb25027988 [0,2,0,0,0,0|2,0,0]=4 5356 B9R0.21 CC(C)(C)OCC(=O)NN Amb24537166 [0,2,0,0,0,0|2,0,0]=4 5357 B9R0.21 CC(C)(C)SCC(=O)C#C Amb24698290 [0,2,0,0,0,0|2,0,0]=4 5358 B9R0.21 CC(C)(F)COC(=O)CO Amb25788604 [0,2,0,0,0,0|1,0,0]=3 5359 B9R0.21 CC(C)(N)CCC(=O)C=C Amb24761226 [0,2,0,0,0,0|1,0,0]=3 5360 B9R0.21 CC(C)(N)CNC(=O)C#C Amb24559386 [0,2,0,0,0,0|2,0,0]=4 5361 B9R0.21 CC(C)(O)CNC(=O)C=C Amb25032624 [0,2,0,0,0,0|2,0,0]=4 5362 B9R0.21 CC(C)(O)CNC(=O)CBr Amb25301199 [0,2,0,0,0,0|2,0,0]=4 5363 B9R0.21 CC(C)(O)CNC(=O)CO Amb24675191 [0,2,0,0,0,0|1,0,0]=3 5364 B9R0.21 CC(C)(O)COC(=O)C=C Amb25174176 [0,2,0,0,0,0|2,0,0]=4 5365 B9R0.21 CC(CBr)CCS(C)(=O)=O Amb25796734 [0,2,0,0,0,0|1,0,1]=4 5366 B9R0.21 CC(CCC(C)(C)C)=NN Amb24431651 [0,2,0,0,0,0|2,0,0]=4 5367 B9R0.21 CC(CCC(C)(C)C)NO Amb25857291 [0,2,0,0,0,0|1,0,1]=4 5368 B9R0.21 CC(CCC(C)(C)O)CO Amb24364330 [0,2,0,0,0,0|1,0,1]=4 5369 B9R0.21 CC(CCl)CCS(C)(=O)=O Amb24363403 [0,2,0,0,0,0|1,0,1]=4 5370 B9R0.21 CC(CN)CCS(C)(=O)=O Amb18312080 [0,2,0,0,0,0|1,0,1]=4 5371 B9R0.21 CC(CO)=CCC(C)(C)O Amb25318080 [0,2,0,0,0,0|1,0,1]=4 5372 B9R0.21 CC(CO)CCC(C)(C)C Amb25075048 [0,2,0,0,0,0|1,0,1]=4 5373 B9R0.21 CC(CO)CCS(C)(=O)=O Amb25302914 [0,2,0,0,0,0|1,0,1]=4 5374 B9R0.21 CC(COP(O)(O)=O)CO Amb25788118 [0,2,0,0,0,0|2,0,0]=4 5375 B9R0.21 CC(F)(F)CCC(=O)NN Amb25107531 [0,2,0,0,0,0|2,0,0]=4 5376 B9R0.21 CC(F)(F)CCC(=O)NO Amb24673183 [0,2,0,0,0,0|1,0,0]=3 5377 B9R0.21 CCC(=O)CCC(C)(C)C Amb25732079 [0,2,0,0,0,0|1,0,0]=3 5378 B9R0.21 CCC(=O)CCC(C)(C)N Amb24763459 [0,2,0,0,0,0|1,0,0]=3 5379 B9R0.21 CCC(=O)CNC(C)(C)C Amb1091987 [0,2,0,0,0,0|2,0,0]=4 5380 B9R0.21 CCC(=O)CNC(C)(C)C Amb22283971 [0,2,0,0,0,0|2,0,0]=4 5381 B9R0.21 CCC(=O)COC(C)(C)C Amb24591427 [0,2,0,0,0,0|2,0,0]=4 5382 B9R0.21 CCC(=O)NCC(C)(C)C Amb23247447 [0,2,0,0,0,0|2,0,0]=4 5383 B9R0.21 CCC(=O)NCC(C)(C)N Amb24355970 [0,2,0,0,0,0|2,0,0]=4 5384 B9R0.21 CCC(=O)NCC(C)(C)O Amb25805076 [0,2,0,0,0,0|2,0,0]=4 5385 B9R0.21 CCC(=O)OCC(C)(C)C Amb24404431 [0,2,0,0,0,0|2,0,0]=4 5386 B9R0.21 CCC(=O)OCC(C)(C)F Amb25058215 [0,2,0,0,0,0|2,0,0]=4 5387 B9R0.21 CCC(C)CCS(N)(=O)=O Amb25371078 [0,2,0,0,0,0|1,0,1]=4 5388 B9R0.21 CNC(=O)CCC(C)(C)C Amb25805105 [0,2,0,0,0,0|1,0,0]=3 5389 B9R0.21 CNC(=O)CCC(C)(C)N Amb21959824 [0,2,0,0,0,0|1,0,0]=3 5390 B9R0.21 CNC(=O)CCC(C)(C)N Amb22587380 [0,2,0,0,0,0|1,0,0]=3 5391 B9R0.21 CNC(=O)CCC(N)(C)C Amb15701576 [0,2,0,0,0,0|1,0,0]=3 5392 B9R0.21 CNC(=O)COC(C)(C)C Amb25732107 [0,2,0,0,0,0|2,0,0]=4 5393 B9R0.21 CNC(=O)NCC(C)(C)O Amb24593415 [0,2,0,0,0,0|2,0,0]=4 5394 B9R0.21 CNC(=O)OCC(C)(C)N Amb25187260 [0,2,0,0,0,0|2,0,0]=4 5395 B9R0.21 CNC(C)CCC(C)(C)O Amb24654539 [0,2,0,0,0,0|1,0,1]=4 5396 B9R0.21 CNC(C)CCS(C)(=O)=O Amb18313524 [0,2,0,0,0,0|1,0,1]=4 5397 B9R0.21 CN[C@H](C)COS(O)(=O)=O Amb25046891 [0,2,0,0,0,0|2,0,0]=4 5398 B9R0.21 COC(=O)CCC(C)(C)N Amb19415866 [0,2,0,0,0,0|0,0,0]=2 5399 B9R0.21 COC(=O)CCC(C)(C)N Amb24383846 [0,2,0,0,0,0|0,0,0]=2 5400 B9R0.21 COC(=O)CCC(C)(C)O Amb25687794 [0,2,0,0,0,0|0,0,0]=2 5401 B9R0.21 COC(=O)CCC(F)(F)F Amb10840427 [0,2,0,0,0,0|2,0,0]=4 5402 B9R0.21 COC(=O)CCS(C)(=O)=O Amb18177820 [0,2,0,0,0,0|2,0,0]=4 5403 B9R0.21 COC(=O)CC[Si](C)(C)C Amb25681301 [0,2,0,0,0,0|0,1,0]=3 5404 B9R0.21 COC(=O)CC[Si](C)(Cl)Cl Amb19893679 [0,2,0,0,0,0|1,1,0]=4 5405 B9R0.21 COC(=O)NCC(C)(C)N Amb18831451 [0,2,0,0,0,0|1,0,0]=3 5406 B9R0.21 COC(=O)NC[Si](C)(C)C Amb19944641 [0,2,0,0,0,0|1,1,0]=4 5407 B9R0.21 COC(=O)OCC(C)(C)N Amb25303714 [0,2,0,0,0,0|1,0,0]=3 5408 B9R0.21 COC(=O)\N=N\C(C)(C)N Amb25147532 [0,2,0,0,0,0|2,0,0]=4 5409 B9R0.21 COC(=S)SCC(C)(C)O Amb25834014 [0,2,0,0,0,0|1,1,0]=4 5410 B9R0.21 COC(C)CCS(=O)(=O)Cl Amb24683435 [0,2,0,0,0,0|1,0,1]=4 5411 B9R0.21 COC(C)CCS(N)(=O)=O Amb25841411 [0,2,0,0,0,0|1,0,1]=4 5412 B9R0.21 CON(C)CCC(C)(C)O Amb24482793 [0,2,0,0,0,0|2,0,0]=4 5413 B9R0.21 C[N+](C)(C)CCC(=O)CN Amb25808357 [0,2,0,0,0,0|2,0,0]=4 5414 B9R0.21 NC(CS)CCP(O)(O)=O Amb24520508 [0,2,0,0,0,0|2,0,0]=4 5415 B9R0.21 OC[C@@H](O)CCP(O)(O)=O Amb25047616 [0,2,0,0,0,0|2,0,0]=4 5416 B9R0.23 CC(=C)CC(C)C(=O)NO Amb24751825 [0,2,0,0,0,0|0,0,2]=4 5417 B9R0.23 CC(=C)CC(O)C(=O)OC Amb24464009 [0,2,0,0,0,0|0,0,2]=4 5418 B9R0.23 CC(=C)C[C@H](N)C(=O)OC Amb25200054 [0,2,0,0,0,0|0,0,2]=4 5419 B9R0.23 CC(=CC(O)=O)C(C)OC Amb25045184 [0,2,0,0,0,0|0,0,2]=4 5420 B9R0.23 CC(=O)CC(=O)C(C)CC Amb24544654 [0,2,0,0,0,0|1,0,1]=4 5421 B9R0.23 CC(=O)CC(N)C(=O)OC Amb25367296 [0,2,0,0,0,0|1,0,1]=4 5422 B9R0.23 CC(=O)CC(O)C(O)CO Amb24737444 [0,2,0,0,0,0|2,0,0]=4 5423 B9R0.23 CC(=O)C[C@@H](O)C(=O)OC Amb24408458 [0,2,0,0,0,0|1,0,1]=4 5424 B9R0.23 CC(=O)C[C@@H](O)[C@@H](O)CO Amb25767917 [0,2,0,0,0,0|2,0,0]=4 5425 B9R0.23 CC(=O)C[C@H](O)C(=O)OC Amb25146504 [0,2,0,0,0,0|1,0,1]=4 5426 B9R0.23 CC(C#N)N(C)CC(O)=O Amb18985045 [0,2,0,0,0,0|1,0,1]=4 5427 B9R0.23 CC(C#N)S(=O)CC(O)=O Amb18293472 [0,2,0,0,0,0|1,0,1]=4 5428 B9R0.23 CC(C(CC(=O)O)N)CC Amb2438880 [0,2,0,0,0,0|0,0,0]=2 5429 B9R0.23 CC(C)=CC(O)C(=O)CO Amb24582992 [0,2,0,0,0,0|0,0,2]=4 5430 B9R0.23 CC(C)=CC(O)C(=O)OC Amb24600119 [0,2,0,0,0,0|0,0,2]=4 5431 B9R0.23 CC(C)=C[C@H](O)C(=O)CO Amb24437372 [0,2,0,0,0,0|0,0,2]=4 5432 B9R0.23 CC(C)CC(=O)C(=N)NO Amb24726579 [0,2,0,0,0,0|1,0,1]=4 5433 B9R0.23 CC(C)CC(Br)C(=O)OC Amb22490955 [0,2,0,0,0,0|0,0,0]=2 5434 B9R0.23 CC(C)CC(C)C(=N)OC Amb24479177 [0,2,0,0,0,0|1,0,0]=3 5435 B9R0.23 CC(C)CC(C)C(=S)NC Amb25732567 [0,2,0,0,0,0|1,1,0]=4 5436 B9R0.23 CC(C)CC(C)C(C)C=O Amb25733465 [0,2,0,0,0,0|1,0,1]=4 5437 B9R0.23 CC(C)CC(C)C(C)CO Amb24415190 [0,2,0,0,0,0|1,0,1]=4 5438 B9R0.23 CC(C)CC(C)C(Cl)=NO Amb24479366 [0,2,0,0,0,0|1,0,0]=3 5439 B9R0.23 CC(C)CC(C)C(N)CO Amb25288264 [0,2,0,0,0,0|1,0,1]=4 5440 B9R0.23 CC(C)CC(C)C(O)C#C Amb24479386 [0,2,0,0,0,0|1,0,1]=4 5441 B9R0.23 CC(C)CC(C)C(O)C#N Amb24627399 [0,2,0,0,0,0|1,0,1]=4 5442 B9R0.23 CC(C)CC(C)N(C)C=O Amb24096747 [0,2,0,0,0,0|2,0,0]=4 5443 B9R0.23 CC(C)CC(Cl)C(=O)NC Amb18800739 [0,2,0,0,0,0|1,0,0]=3 5444 B9R0.23 CC(C)CC(Cl)C(=O)OC Amb18800856 [0,2,0,0,0,0|0,0,0]=2 5445 B9R0.23 CC(C)CC(F)C(=O)OC Amb24405963 [0,2,0,0,0,0|0,0,0]=2 5446 B9R0.23 CC(C)CC(N)C(=O)CC Amb18202462 [0,2,0,0,0,0|1,0,0]=3 5447 B9R0.23 CC(C)CC(N)C(=O)NN Amb18559331 [0,2,0,0,0,0|1,0,0]=3 5448 B9R0.23 CC(C)CC(N)C(=O)OC Amb22489476 [0,2,0,0,0,0|0,0,0]=2 5449 B9R0.23 CC(C)CC(N)C(=O)SC Amb25774431 [0,2,0,0,0,0|0,1,0]=3 5450 B9R0.23 CC(C)CC(N)C(=S)NC Amb24482442 [0,2,0,0,0,0|1,1,0]=4 5451 B9R0.23 CC(C)CC(N)C(C)OC Amb24647192 [0,2,0,0,0,0|1,0,1]=4 5452 B9R0.23 CC(C)CC(N)C(O)C=C Amb18644029 [0,2,0,0,0,0|1,0,1]=4 5453 B9R0.23 CC(C)CC(N)C(O)CC Amb18201587 [0,2,0,0,0,0|1,0,1]=4 5454 B9R0.23 CC(C)CC(N)C(O)CCl Amb24618539 [0,2,0,0,0,0|1,0,1]=4 5455 B9R0.23 CC(C)CC(O)C(=C)C#N Amb18643433 [0,2,0,0,0,0|2,0,0]=4 5456 B9R0.23 CC(C)CC(O)C(=C)SC Amb24648130 [0,2,0,0,0,0|1,1,0]=4 5457 B9R0.23 CC(C)CC(O)C(=O)NC Amb25708055 [0,2,0,0,0,0|1,0,0]=3 5458 B9R0.23 CC(C)CC(O)C(=O)NN Amb25704655 [0,2,0,0,0,0|1,0,0]=3 5459 B9R0.23 CC(C)CC(O)C(=O)OC Amb19306745 [0,2,0,0,0,0|0,0,0]=2 5460 B9R0.23 CC(C)CC(O)C(C)C=O Amb24433287 [0,2,0,0,0,0|1,0,1]=4 5461 B9R0.23 CC(C)CC(O)C(Cl)CO Amb24417893 [0,2,0,0,0,0|1,0,1]=4 5462 B9R0.23 CC(C)CC(O)C(N)CO Amb18831413 [0,2,0,0,0,0|1,0,1]=4 5463 B9R0.23 CC(C)CC(O)C(O)CN Amb24428662 [0,2,0,0,0,0|1,0,1]=4 5464 B9R0.23 CC(C)CC(O)\C(\Cl)=C/C Amb25058519 [0,2,0,0,0,0|2,0,0]=4 5465 B9R0.23 CC(C)CC(O)\C(\N)=N\O Amb24409808 [0,2,0,0,0,0|1,0,0]=3 5466 B9R0.23 CC(C)CN(C)C(=O)CBr Amb25826071 [0,2,0,0,0,0|2,0,0]=4 5467 B9R0.23 CC(C)CN(C)C(=O)CO Amb25052595 [0,2,0,0,0,0|1,0,0]=3 5468 B9R0.23 CC(C)C[C@@H](C)[C@H](N)CO Amb25077418 [0,2,0,0,0,0|1,0,1]=4 5469 B9R0.23 CC(C)C[C@@H](N)C(=O)CCl Amb22750583 [0,2,0,0,0,0|1,0,0]=3 5470 B9R0.23 CC(C)C[C@@H](N)C(=O)CCl Amb25200016 [0,2,0,0,0,0|1,0,0]=3 5471 B9R0.23 CC(C)C[C@@H](N)C(=O)NC Amb18035928 [0,2,0,0,0,0|1,0,0]=3 5472 B9R0.23 CC(C)C[C@@H](N)C(=O)NN Amb22800071 [0,2,0,0,0,0|1,0,0]=3 5473 B9R0.23 CC(C)C[C@@H](N)C(=O)NO Amb22800473 [0,2,0,0,0,0|0,0,0]=2 5474 B9R0.23 CC(C)C[C@@H](N)[C@@H](O)C=C Amb25294340 [0,2,0,0,0,0|1,0,1]=4 5475 B9R0.23 CC(C)C[C@@H](O)C(C)=C=C Amb25192111 [0,2,0,0,0,0|2,0,0]=4 5476 B9R0.23 CC(C)C[C@@H](O)[C@@H](Cl)CO Amb25321968 [0,2,0,0,0,0|1,0,1]=4 5477 B9R0.23 CC(C)C[C@@H](O)[C@H](C)CO Amb25191989 [0,2,0,0,0,0|1,0,1]=4 5478 B9R0.23 CC(C)C[C@@H](O)[C@H](O)C#C Amb25261753 [0,2,0,0,0,0|1,0,1]=4 5479 B9R0.23 CC(C)C[C@H](Cl)C(=O)OC Amb25101463 [0,2,0,0,0,0|0,0,0]=2 5480 B9R0.23 CC(C)C[C@H](N)C(=O)CC Amb25791564 [0,2,0,0,0,0|1,0,0]=3 5481 B9R0.23 CC(C)C[C@H](N)C(=O)NN Amb25146434 [0,2,0,0,0,0|1,0,0]=3 5482 B9R0.23 CC(C)C[C@H](N)C(=O)NO Amb24440728 [0,2,0,0,0,0|0,0,0]=2 5483 B9R0.23 CC(C)C[C@H](N)C(O)C=C Amb24699963 [0,2,0,0,0,0|1,0,1]=4 5484 B9R0.23 CC(C)C[C@H](N)C(O)CC Amb25324435 [0,2,0,0,0,0|1,0,1]=4 5485 B9R0.23 CC(C)C[C@H](N)[C@@H](C)CO Amb25229023 [0,2,0,0,0,0|1,0,1]=4 5486 B9R0.23 CC(C)C[C@H](N)[C@@H](O)CC Amb25378738 [0,2,0,0,0,0|1,0,1]=4 5487 B9R0.23 CC(C)C[C@H](N)[C@H](C)CO Amb25147421 [0,2,0,0,0,0|1,0,1]=4 5488 B9R0.23 CC(C)C[C@H](N)[C@H](O)CC Amb25147537 [0,2,0,0,0,0|1,0,1]=4 5489 B9R0.23 CC(C)C[C@H](N)[C@H](O)CCl Amb25366593 [0,2,0,0,0,0|1,0,1]=4 5490 B9R0.23 CC(C)C[C@H](N)[C@H](O)CO Amb24681017 [0,2,0,0,0,0|0,0,2]=4 5491 B9R0.23 CC(C)C[C@H](O)C(=O)OC Amb25299357 [0,2,0,0,0,0|0,0,0]=2 5492 B9R0.23 CC(C)C[C@H](O)[C@H](C)C=O Amb25352311 [0,2,0,0,0,0|1,0,1]=4 5493 B9R0.23 CC(C)C[C@H](O)[C@H](F)CO Amb25256684 [0,2,0,0,0,0|1,0,1]=4 5494 B9R0.23 CC(C)C[C@H](O)[C@H](O)C=C Amb25717312 [0,2,0,0,0,0|1,0,1]=4 5495 B9R0.23 CC(C)NC(C)C(=O)NN Amb25727178 [0,2,0,0,0,0|2,0,0]=4 5496 B9R0.23 CC(C)NC(C)C(=O)OC Amb19003119 [0,2,0,0,0,0|1,0,0]=3 5497 B9R0.23 CC(C)OC(C)C(=O)C=O Amb25732941 [0,2,0,0,0,0|1,0,1]=4 5498 B9R0.23 CC(C)OC(C)C(=O)OC Amb24621367 [0,2,0,0,0,0|1,0,0]=3 5499 B9R0.23 CC(C)O[C@@H](C)C(=O)OC Amb25831283 [0,2,0,0,0,0|1,0,0]=3 5500 B9R0.23 CC(C)SC(C)C(=O)NN Amb24548835 [0,2,0,0,0,0|2,0,0]=4 5501 B9R0.23 CC(C)SC(C)C(=O)OC Amb18798145 [0,2,0,0,0,0|1,0,0]=3 5502 B9R0.23 CC(C)SC(C)C(N)=NO Amb18798158 [0,2,0,0,0,0|2,0,0]=4 5503 B9R0.23 CC(C=C)C(C)CC(O)=O Amb18643924 [0,2,0,0,0,0|0,0,1]=3 5504 B9R0.23 CC(C=C)C(O)CC(C)=O Amb24592151 [0,2,0,0,0,0|1,0,1]=4 5505 B9R0.23 CC(C=C)N(C)CC(O)=O Amb19023076 [0,2,0,0,0,0|1,0,1]=4 5506 B9R0.23 CC(CC(C)O)C(=O)OC Amb25781081 [0,2,0,0,0,0|1,0,0]=3 5507 B9R0.23 CC(CC(O)=O)C(=O)CN Amb25072734 [0,2,0,0,0,0|1,0,1]=4 5508 B9R0.23 CC(CC(O)=O)C(N)CC Amb25820735 [0,2,0,0,0,0|1,0,0]=3 5509 B9R0.23 CC(CC(O)=O)N(C)C=O Amb24670439 [0,2,0,0,0,0|1,0,1]=4 5510 B9R0.23 CC(CC)C(Cl)OC(C)=O Amb24509719 [0,2,0,0,0,0|2,0,0]=4 5511 B9R0.23 CC(CC)C(N)CC(N)=O Amb25312995 [0,2,0,0,0,0|1,0,0]=3 5512 B9R0.23 CC(CC)C(O)CC(O)=O Amb18310690 [0,2,0,0,0,0|0,0,0]=2 5513 B9R0.23 CC(CC)[C@@H](N)CC(N)=O Amb25823252 [0,2,0,0,0,0|1,0,0]=3 5514 B9R0.23 CC(CC)[C@H](N)CC(O)=O Amb25117039 [0,2,0,0,0,0|0,0,0]=2 5515 B9R0.23 CC(CC)[C@H](O)CC(C)=C Amb25085716 [0,2,0,0,0,0|2,0,0]=4 5516 B9R0.23 CC(CN)N(C)CC(N)=O Amb24651827 [0,2,0,0,0,0|2,0,0]=4 5517 B9R0.23 CC(CN)S(=O)CC(N)=O Amb24410849 [0,2,0,0,0,0|2,0,0]=4 5518 B9R0.23 CC(CO)C(O)CC(C)=C Amb25333528 [0,2,0,0,0,0|2,0,0]=4 5519 B9R0.23 CC(CO)N(C)CC(N)=O Amb24357000 [0,2,0,0,0,0|2,0,0]=4 5520 B9R0.23 CC(CO)N(C)CC(O)=O Amb24419908 [0,2,0,0,0,0|1,0,0]=3 5521 B9R0.23 CC(Cl)CC(Cl)C(=O)OC Amb25724873 [0,2,0,0,0,0|1,0,0]=3 5522 B9R0.23 CC(N)CC(O)C(=O)NO Amb25276417 [0,2,0,0,0,0|1,0,0]=3 5523 B9R0.23 CC(N)CC(O)C(=O)OC Amb24587361 [0,2,0,0,0,0|1,0,0]=3 5524 B9R0.23 CC(NC(C)=O)C(C)CBr Amb24723278 [0,2,0,0,0,0|2,0,0]=4 5525 B9R0.23 CC(NC(C)=O)C(C)CCl Amb25147745 [0,2,0,0,0,0|2,0,0]=4 5526 B9R0.23 CC(NC(N)=O)C(C)CN Amb25205914 [0,2,0,0,0,0|2,0,0]=4 5527 B9R0.23 CC(O)CC(O)C(O)C=O Amb25713186 [0,2,0,0,0,0|1,0,1]=4 5528 B9R0.23 CC(O)C[C@H](O)C(=O)CO Amb25146805 [0,2,0,0,0,0|1,0,0]=3 5529 B9R0.23 CC(OC(C)=O)[C@H](C)CCl Amb24480603 [0,2,0,0,0,0|2,0,0]=4 5530 B9R0.23 CC(OC)C(C)CC(O)=O Amb18202340 [0,2,0,0,0,0|0,0,0]=2 5531 B9R0.23 CC(OC)C(N)CC(C)=C Amb24745048 [0,2,0,0,0,0|2,0,0]=4 5532 B9R0.23 CC(OC)[C@@H](C)NC(N)=O Amb25271787 [0,2,0,0,0,0|2,0,0]=4 5533 B9R0.23 CC(OC)[C@H](C)NC(N)=O Amb24676126 [0,2,0,0,0,0|2,0,0]=4 5534 B9R0.23 CCC(=C)C(N)CC(O)=O Amb25068441 [0,2,0,0,0,0|0,0,2]=4 5535 B9R0.23 CCC(=O)C(CN(C)C)C Amb10603104 [0,2,0,0,0,0|2,0,0]=4 5536 B9R0.23 CCC(=O)[C@@H](C)CC(O)=O Amb24504994 [0,2,0,0,0,0|1,0,1]=4 5537 B9R0.23 CCC(=O)[C@H](C)CC(O)=O Amb24426900 [0,2,0,0,0,0|1,0,1]=4 5538 B9R0.23 CCC(C)C(=C)CC(O)=O Amb24451006 [0,2,0,0,0,0|0,0,1]=3 5539 B9R0.23 CCC(C)C(C)CC(O)=O Amb18304200 [0,2,0,0,0,0|0,0,0]=2 5540 B9R0.23 CCC(C)C(C)NC(N)=O Amb25261427 [0,2,0,0,0,0|2,0,0]=4 5541 B9R0.23 CCC(C)C(C)OC(N)=O Amb25732527 [0,2,0,0,0,0|2,0,0]=4 5542 B9R0.23 CCC(C)C(O)CC(C)O Amb25796350 [0,2,0,0,0,0|1,0,1]=4 5543 B9R0.23 CCC(C)S(=O)CC(O)=O Amb18523822 [0,2,0,0,0,0|1,0,0]=3 5544 B9R0.23 CCC(Cl)C(O)CC(C)=O Amb25321887 [0,2,0,0,0,0|2,0,0]=4 5545 B9R0.23 CCC(Cl)C(O)CC(O)=O Amb25111208 [0,2,0,0,0,0|1,0,0]=3 5546 B9R0.23 CCC(O)C(O)CC(O)=O Amb25132101 [0,2,0,0,0,0|1,0,0]=3 5547 B9R0.23 CCN(C)C(=O)CC(O)=O Amb18987423 [0,2,0,0,0,0|1,0,1]=4 5548 B9R0.23 CCN(C)C(C)CC(O)=O Amb22587145 [0,2,0,0,0,0|1,0,0]=3 5549 B9R0.23 CCN(O)C(C)CC(O)=O Amb25379050 [0,2,0,0,0,0|2,0,0]=4 5550 B9R0.23 CCS(=O)C(C)CC(O)=O Amb19012075 [0,2,0,0,0,0|2,0,0]=4 5551 B9R0.23 CC[C@@H](C)[C@H](C)CC(O)=O Amb24715562 [0,2,0,0,0,0|0,0,0]=2 5552 B9R0.23 CC[C@H](O)[C@H](N)CC(O)=O Amb25204323 [0,2,0,0,0,0|1,0,0]=3 5553 B9R0.23 CNC(=O)C(C)CN(C)C Amb25093436 [0,2,0,0,0,0|2,0,0]=4 5554 B9R0.23 CNC(=O)C(N)CC(O)=O Amb18862479 [0,2,0,0,0,0|1,0,1]=4 5555 B9R0.23 CNC(=O)[C@@H](N)CC(O)=O Amb25694374 [0,2,0,0,0,0|1,0,1]=4 5556 B9R0.23 CNC(=O)[C@H](CC(C)C)N Amb17231992 [0,2,0,0,0,0|1,0,0]=3 5557 B9R0.23 COC(=O)C(=O)CC(C)C Amb17740021 [0,2,0,0,0,0|0,0,1]=3 5558 B9R0.23 COC(=O)C(Br)CC(O)=O Amb18656999 [0,2,0,0,0,0|1,0,1]=4 5559 B9R0.23 COC(=O)C(C)CC(O)=O Amb18644248 [0,2,0,0,0,0|1,0,1]=4 5560 B9R0.23 COC(=O)C(C)CS(C)=O Amb18788308 [0,2,0,0,0,0|2,0,0]=4 5561 B9R0.23 COC(=O)C(CC(=O)O)O Amb17615865 [0,2,0,0,0,0|1,0,1]=4 5562 B9R0.23 COC(=O)C(CC(C)C)N Amb1152419 [0,2,0,0,0,0|0,0,0]=2 5563 B9R0.23 COC(=O)C(N)CC(F)F Amb22059458 [0,2,0,0,0,0|2,0,0]=4 5564 B9R0.23 COC(=O)C(N)CC(O)=O Amb18644309 [0,2,0,0,0,0|1,0,1]=4 5565 B9R0.23 COC(=O)C(N)CN(C)C Amb24715537 [0,2,0,0,0,0|1,0,0]=3 5566 B9R0.23 COC(=O)C(O)CN(C)C Amb25212253 [0,2,0,0,0,0|1,0,0]=3 5567 B9R0.23 COC(=O)C(O)CN(C)O Amb24713209 [0,2,0,0,0,0|2,0,0]=4 5568 B9R0.23 COC(=O)C(O)CS(C)=O Amb25369004 [0,2,0,0,0,0|2,0,0]=4 5569 B9R0.23 COC(=O)N(C)CC(C)C Amb25833290 [0,2,0,0,0,0|1,0,0]=3 5570 B9R0.23 COC(=O)N(C)NC(C)C Amb25119846 [0,2,0,0,0,0|2,0,0]=4 5571 B9R0.23 COC(=O)[C@@H](C)CC(O)=O Amb22226152 [0,2,0,0,0,0|1,0,1]=4 5572 B9R0.23 COC(=O)[C@@H](CC(=O)O)O Amb17615866 [0,2,0,0,0,0|1,0,1]=4 5573 B9R0.23 COC(=O)[C@@H](N)CC(O)=O Amb22746069 [0,2,0,0,0,0|1,0,1]=4 5574 B9R0.23 COC(=O)[C@H](C)CC(O)=O Amb24561954 [0,2,0,0,0,0|1,0,1]=4 5575 B9R0.23 COC(=O)[C@H](CC(=O)O)O Amb17615867 [0,2,0,0,0,0|1,0,1]=4 5576 B9R0.23 COC(=O)[C@H](Cl)CC(Cl)Cl Amb25827142 [0,2,0,0,0,0|2,0,0]=4 5577 B9R0.23 COC(=O)[C@H](N)CC(O)=O Amb19944281 [0,2,0,0,0,0|1,0,1]=4 5578 B9R0.23 COC(=O)\C(\I)=C\C(C)C Amb24395961 [0,2,0,0,0,0|0,0,2]=4 5579 B9R0.23 COC(O)C(O)CC(O)=O Amb24650997 [0,2,0,0,0,0|1,0,0]=3 5580 B9R0.23 CON(C)C(=O)CC(O)=O Amb18295925 [0,2,0,0,0,0|1,0,1]=4 5581 B9R0.23 C[C@@H](C=C)[C@H](C)CC(C)=O Amb25859239 [0,2,0,0,0,0|1,0,1]=4 5582 B9R0.23 C[C@@H](C=C)[C@H](C)CC(O)=O Amb25843885 [0,2,0,0,0,0|0,0,1]=3 5583 B9R0.23 C[C@@H](CC([O-])=O)C(O)CO Amb24334935 [0,2,0,0,0,0|1,0,1]=4 5584 B9R0.23 C[C@@H](CC)[C@@H](O)CC(O)=O Amb25068472 [0,2,0,0,0,0|0,0,0]=2 5585 B9R0.23 C[C@@H](CC)[C@H](N)CC(O)=O Amb19944304 [0,2,0,0,0,0|0,0,0]=2 5586 B9R0.23 C[C@@H](CC)[C@H](N)CC(O)=O Amb25068405 [0,2,0,0,0,0|0,0,0]=2 5587 B9R0.23 C[C@@H](CC)[C@H](O)CC(O)=O Amb24409363 [0,2,0,0,0,0|0,0,0]=2 5588 B9R0.23 C[C@@H](CO)N(C)CC(N)=O Amb25189238 [0,2,0,0,0,0|2,0,0]=4 5589 B9R0.23 C[C@@H]([C@@H](CC(=O)O)N)CC Amb16184028 [0,2,0,0,0,0|0,0,0]=2 5590 B9R0.23 C[C@H](C=C)[C@@H](O)CC(C)=O Amb25846221 [0,2,0,0,0,0|1,0,1]=4 5591 B9R0.23 C[C@H](CC(O)=O)[C@H](O)CN Amb25131743 [0,2,0,0,0,0|1,0,0]=3 5592 B9R0.23 C[C@H](CC)[C@@H](N)CC(O)=O Amb25689818 [0,2,0,0,0,0|0,0,0]=2 5593 B9R0.23 C[C@H](CO)[C@H](O)CC(C)=C Amb25760423 [0,2,0,0,0,0|2,0,0]=4 5594 B9R0.23 C[C@H]([C@H](CC(=O)O)N)CC Amb16184016 [0,2,0,0,0,0|0,0,0]=2 5595 B9R0.23 C\C(=C/C(O)=O)\C(C)CC Amb18969883 [0,2,0,0,0,0|0,0,2]=4 5596 B9R0.23 C\C(=C/C)\C(N)CC(N)=O Amb24667328 [0,2,0,0,0,0|1,0,1]=4 5597 B9R0.23 C\C(=C/C)\C(N)CC(O)=O Amb24377592 [0,2,0,0,0,0|0,0,1]=3 5598 B9R0.23 C\C(=C/C)\C(O)CC(C)=O Amb24578333 [0,2,0,0,0,0|1,0,1]=4 5599 B9R0.23 C\C(=C/C)\C(O)CC(O)=O Amb18644100 [0,2,0,0,0,0|0,0,1]=3 5600 B9R0.23 C\C(=C/N)\C(N)CC(O)=O Amb25761855 [0,2,0,0,0,0|0,0,2]=4 5601 B9R0.23 C\C(=C/O)\C(=O)CC(C)C Amb24584532 [0,2,0,0,0,0|1,0,1]=4 5602 B9R0.23 C\C(=C\C)\C(O)CC(C)=O Amb24686498 [0,2,0,0,0,0|1,0,1]=4 5603 B9R0.23 C\C(\C=O)=C(/O)\CC(C)C Amb25857392 [0,2,0,0,0,0|1,0,1]=4 5604 B9R0.23 NC(=O)CC(O)C(O)CO Amb25139467 [0,2,0,0,0,0|2,0,0]=4 5605 B9R0.23 NC(CC(N)=O)C(O)CO Amb24460353 [0,2,0,0,0,0|2,0,0]=4 5606 B9R0.23 NCC(=O)C(N)CC(O)=O Amb24745663 [0,2,0,0,0,0|1,0,1]=4 5607 B9R0.23 NNC(=O)C(OC(C)C)C Amb2089066 [0,2,0,0,0,0|2,0,0]=4 5608 B9R0.23 N[C@@H](CC(O)=O)[C@@H](N)CO Amb25788533 [0,2,0,0,0,0|1,0,0]=3 5609 B9R0.23 OC(=O)CC(C(=O)CBr)Br Amb15772353 [0,2,0,0,0,0|1,0,1]=4 5610 B9R0.23 OC(=O)CC(Cl)C(=O)CCl Amb24426203 [0,2,0,0,0,0|1,0,1]=4 5611 B9R0.23 OC(=O)CC(O)C(=O)CO Amb25124913 [0,2,0,0,0,0|1,0,1]=4 5612 B9R0.23 OC(=O)C[C@H](O)C(=O)CO Amb25259211 [0,2,0,0,0,0|1,0,1]=4 5613 B9R0.23 OC[C@@H](O)[C@@H](O)CC(O)=O Amb24509722 [0,2,0,0,0,0|1,0,0]=3 5614 B9R0.23 OC[C@@H](O)[C@H](O)CC(O)=O Amb25258026 [0,2,0,0,0,0|1,0,0]=3 5615 B9R0.23 OC[C@H](O)[C@H](O)CC(O)=O Amb24726353 [0,2,0,0,0,0|1,0,0]=3 5616 B9R0.24 BrCC(=O)CCC(=O)OC Amb17403793 [0,2,0,0,0,0|1,0,1]=4 5617 B9R0.24 CC(C#N)NCC(=O)OC Amb17044888 [0,2,0,0,0,0|1,0,1]=4 5618 B9R0.24 CC(CC)SCC(=O)CC Amb18800476 [0,2,0,0,0,0|2,0,0]=4 5619 B9R0.24 CC(CCC(=O)CBr)C#N Amb24477335 [0,2,0,0,0,0|1,0,1]=4 5620 B9R0.24 CC(CCC(=O)NN)CN Amb25287777 [0,2,0,0,0,0|1,0,0]=3 5621 B9R0.24 CC(CCC(C)CO)CO Amb25232821 [0,2,0,0,0,0|1,0,1]=4 5622 B9R0.24 CC(CCC(O)C#C)OC Amb25831991 [0,2,0,0,0,0|1,0,1]=4 5623 B9R0.24 CC(CCC(O)CC)CC Amb24388933 [0,2,0,0,0,0|1,0,1]=4 5624 B9R0.24 CC(CCC(O)CC)CO Amb25206034 [0,2,0,0,0,0|1,0,1]=4 5625 B9R0.24 CC(CCC(O)CC)OC Amb25147754 [0,2,0,0,0,0|1,0,1]=4 5626 B9R0.24 CC(CN)CCC(=O)C#C Amb25138223 [0,2,0,0,0,0|1,0,0]=3 5627 B9R0.24 CC(CN)CCC(=O)C=C Amb24601148 [0,2,0,0,0,0|1,0,0]=3 5628 B9R0.24 CC(CN)CCC(=O)NO Amb25145597 [0,2,0,0,0,0|0,0,0]=2 5629 B9R0.24 CC(CNC(=O)CC)CC Amb24628624 [0,2,0,0,0,0|2,0,0]=4 5630 B9R0.24 CC(CNC(=O)CN)CN Amb25806994 [0,2,0,0,0,0|2,0,0]=4 5631 B9R0.24 CC(CNC(=O)CO)CO Amb25127228 [0,2,0,0,0,0|1,0,0]=3 5632 B9R0.24 CC(CNC(=O)NC)NC Amb24379217 [0,2,0,0,0,0|2,0,0]=4 5633 B9R0.24 CC(CNC(=O)OC)OC Amb24333803 [0,2,0,0,0,0|1,0,0]=3 5634 B9R0.24 CC(CO)CNC(=O)C#C Amb24509725 [0,2,0,0,0,0|2,0,0]=4 5635 B9R0.24 CC(CO)COC(=O)C=C Amb24632595 [0,2,0,0,0,0|2,0,0]=4 5636 B9R0.24 CC(CO)NCC(N)=NO Amb24566953 [0,2,0,0,0,0|2,0,0]=4 5637 B9R0.24 CC(CO)SCC(=O)NN Amb25245928 [0,2,0,0,0,0|2,0,0]=4 5638 B9R0.24 CC(COC(=O)CC)CC Amb24061296 [0,2,0,0,0,0|2,0,0]=4 5639 B9R0.24 CC(COC(=O)CO)C#N Amb24354132 [0,2,0,0,0,0|1,0,1]=4 5640 B9R0.24 CC(\C=C\C(=O)OC)OC Amb24608486 [0,2,0,0,0,0|0,0,2]=4 5641 B9R0.24 CCC(=C)CCC(C)CBr Amb24360356 [0,2,0,0,0,0|2,0,0]=4 5642 B9R0.24 CCC(=C)CCC(C)CCl Amb24455179 [0,2,0,0,0,0|2,0,0]=4 5643 B9R0.24 CCC(=C)CCC(C)CN Amb25135629 [0,2,0,0,0,0|2,0,0]=4 5644 B9R0.24 CCC(=C)CC[C@@H](C)CO Amb25782256 [0,2,0,0,0,0|2,0,0]=4 5645 B9R0.24 CCC(=O)CCC(=O)OC Amb24369355 [0,2,0,0,0,0|1,0,1]=4 5646 B9R0.24 CCC(=O)CCC(C)C#N Amb24648520 [0,2,0,0,0,0|1,0,1]=4 5647 B9R0.24 CCC(=O)CCC(C)CO Amb25146971 [0,2,0,0,0,0|1,0,0]=3 5648 B9R0.24 CCC(=O)CCC(C)OC Amb25147751 [0,2,0,0,0,0|1,0,0]=3 5649 B9R0.24 CCC(=O)CC[C@@H](C)C=O Amb24478247 [0,2,0,0,0,0|1,0,1]=4 5650 B9R0.24 CCC(=O)COC(C)CCl Amb25111994 [0,2,0,0,0,0|2,0,0]=4 5651 B9R0.24 CCC(=O)NCC(C)CN Amb19027064 [0,2,0,0,0,0|2,0,0]=4 5652 B9R0.24 CCC(=O)NCC(C)OC Amb25692806 [0,2,0,0,0,0|2,0,0]=4 5653 B9R0.24 CCC(=O)OCC(C)CCl Amb25367344 [0,2,0,0,0,0|2,0,0]=4 5654 B9R0.24 CCC(=O)OCC(C)CO Amb24541857 [0,2,0,0,0,0|2,0,0]=4 5655 B9R0.24 CCC(=O)OC[C@H](C)CO Amb25345171 [0,2,0,0,0,0|2,0,0]=4 5656 B9R0.24 CCC(C)C#CC(=O)OC Amb25333980 [0,2,0,0,0,0|0,0,2]=4 5657 B9R0.24 CCC(C)CCC(=O)NC Amb24482921 [0,2,0,0,0,0|1,0,0]=3 5658 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [0,2,0,0,0,0|0,0,0]=2 5659 B9R0.24 CCC(C)CCC(C)CO Amb22641860 [0,2,0,0,0,0|1,0,1]=4 5660 B9R0.24 CCC(C)CNC(=O)C=C Amb25238655 [0,2,0,0,0,0|2,0,0]=4 5661 B9R0.24 CCC(C)CNC(=O)CBr Amb23512819 [0,2,0,0,0,0|2,0,0]=4 5662 B9R0.24 CCC(C)CNC(=O)CCl Amb18798260 [0,2,0,0,0,0|2,0,0]=4 5663 B9R0.24 CCC(C)CNC(=O)CN Amb19028765 [0,2,0,0,0,0|2,0,0]=4 5664 B9R0.24 CCC(C)CNC(=O)CS Amb24445028 [0,2,0,0,0,0|1,1,0]=4 5665 B9R0.24 CCC(C)CNC(=O)NN Amb24442838 [0,2,0,0,0,0|2,0,0]=4 5666 B9R0.24 CCC(C)CNC(=O)OC Amb25054721 [0,2,0,0,0,0|1,0,0]=3 5667 B9R0.24 CCC(C)COC(=O)C=C Amb17934097 [0,2,0,0,0,0|2,0,0]=4 5668 B9R0.24 CCC(C)COC(=O)CBr Amb25799480 [0,2,0,0,0,0|2,0,0]=4 5669 B9R0.24 CCC(C)C\C=C(/C)\C=O Amb24646940 [0,2,0,0,0,0|1,0,1]=4 5670 B9R0.24 CCC(C)NCC(=O)C#C Amb25679968 [0,2,0,0,0,0|2,0,0]=4 5671 B9R0.24 CCC(C)NCC(=O)C=C Amb24411222 [0,2,0,0,0,0|2,0,0]=4 5672 B9R0.24 CCC(C)NCC(=O)NN Amb25338630 [0,2,0,0,0,0|2,0,0]=4 5673 B9R0.24 CCC(C)NCC(=O)NO Amb24668363 [0,2,0,0,0,0|1,0,0]=3 5674 B9R0.24 CCC(C)NCC(N)=NO Amb25055504 [0,2,0,0,0,0|2,0,0]=4 5675 B9R0.24 CCC(C)OCC(=O)NC Amb24482829 [0,2,0,0,0,0|2,0,0]=4 5676 B9R0.24 CCC(C)OCC(=O)NN Amb19960445 [0,2,0,0,0,0|2,0,0]=4 5677 B9R0.24 CCC(C)OCC(=O)NO Amb25220786 [0,2,0,0,0,0|1,0,0]=3 5678 B9R0.24 CCC(C)ONC(=O)CO Amb24705434 [0,2,0,0,0,0|2,0,0]=4 5679 B9R0.24 CCC(C)SCC(=O)C#C Amb25809269 [0,2,0,0,0,0|2,0,0]=4 5680 B9R0.24 CCC(C)SCC(=O)NN Amb24658136 [0,2,0,0,0,0|2,0,0]=4 5681 B9R0.24 CCC(N)CCC(=O)C=C Amb25201206 [0,2,0,0,0,0|2,0,0]=4 5682 B9R0.24 CCC(N)CCC(=O)NN Amb24726520 [0,2,0,0,0,0|2,0,0]=4 5683 B9R0.24 CCC(N)CNC(=O)OC Amb24427801 [0,2,0,0,0,0|2,0,0]=4 5684 B9R0.24 CCC(O)CCC(=O)OC Amb25850223 [0,2,0,0,0,0|1,0,0]=3 5685 B9R0.24 CCN(C)CCC(=O)NN Amb24549267 [0,2,0,0,0,0|2,0,0]=4 5686 B9R0.24 CCN(O)CCC(=O)OC Amb24763933 [0,2,0,0,0,0|2,0,0]=4 5687 B9R0.24 CCS(=O)CCC(=O)OC Amb18788300 [0,2,0,0,0,0|2,0,0]=4 5688 B9R0.24 CCS(=O)CCC(C)NC Amb25833015 [0,2,0,0,0,0|2,0,0]=4 5689 B9R0.24 CC[C@@H](O)CCC(=O)OC Amb24561650 [0,2,0,0,0,0|1,0,0]=3 5690 B9R0.24 CC[C@H](C)CCC(=C)C=O Amb25075582 [0,2,0,0,0,0|1,0,0]=3 5691 B9R0.24 CC[C@H](C)CCC(C)CO Amb25676351 [0,2,0,0,0,0|1,0,1]=4 5692 B9R0.24 CC[C@H](C)CNC(=O)OC Amb24549768 [0,2,0,0,0,0|1,0,0]=3 5693 B9R0.24 CC[C@H](C)COC(=O)CBr Amb24477461 [0,2,0,0,0,0|2,0,0]=4 5694 B9R0.24 CC[C@H](O)CCC(=O)OC Amb24377641 [0,2,0,0,0,0|1,0,0]=3 5695 B9R0.24 CN(CCC(=O)CC)CC Amb25225879 [0,2,0,0,0,0|2,0,0]=4 5696 B9R0.24 CNC(=O)CCC(=O)OC Amb17399893 [0,2,0,0,0,0|1,0,1]=4 5697 B9R0.24 CNC(=O)CCC(C)OC Amb25337100 [0,2,0,0,0,0|1,0,0]=3 5698 B9R0.24 CNC(=O)CCC(C)SC Amb25720834 [0,2,0,0,0,0|1,0,0]=3 5699 B9R0.24 CNC(=O)CSC(C)CO Amb24623354 [0,2,0,0,0,0|2,0,0]=4 5700 B9R0.24 CNC(=O)NCC(C)CN Amb18908393 [0,2,0,0,0,0|2,0,0]=4 5701 B9R0.24 CNC(=O)NCC(C)OC Amb25704552 [0,2,0,0,0,0|2,0,0]=4 5702 B9R0.24 CNC(=O)NCC(C)SC Amb25706035 [0,2,0,0,0,0|2,0,0]=4 5703 B9R0.24 CNC(=O)OCC(C)CBr Amb25680259 [0,2,0,0,0,0|2,0,0]=4 5704 B9R0.24 CNC(C)CCC(C)OC Amb25298979 [0,2,0,0,0,0|1,0,1]=4 5705 B9R0.24 CNC(C)CNC(=O)C#C Amb25101228 [0,2,0,0,0,0|2,0,0]=4 5706 B9R0.24 CNC(C)CNC(=O)C=C Amb25027841 [0,2,0,0,0,0|2,0,0]=4 5707 B9R0.24 CNC(C)CNC(=O)CC Amb25047872 [0,2,0,0,0,0|2,0,0]=4 5708 B9R0.24 CNC(C)CNC(=O)OC Amb24601169 [0,2,0,0,0,0|1,0,0]=3 5709 B9R0.24 COC(=N)CCC(=O)OC Amb17673181 [0,2,0,0,0,0|1,0,1]=4 5710 B9R0.24 COC(=O)CCC(=O)CN Amb18202127 [0,2,0,0,0,0|1,0,1]=4 5711 B9R0.24 COC(=O)CCC(Br)C=O Amb24680272 [0,2,0,0,0,0|1,0,1]=4 5712 B9R0.24 COC(=O)CCC(Br)CBr Amb25343381 [0,2,0,0,0,0|1,0,0]=3 5713 B9R0.24 COC(=O)CCC(C)C=O Amb18644121 [0,2,0,0,0,0|0,0,1]=3 5714 B9R0.24 COC(=O)CCC(C)CBr Amb25032347 [0,2,0,0,0,0|0,0,0]=2 5715 B9R0.24 COC(=O)CCC(C)SC Amb24709195 [0,2,0,0,0,0|0,0,0]=2 5716 B9R0.24 COC(=O)CCC(Cl)C#N Amb24650009 [0,2,0,0,0,0|1,0,1]=4 5717 B9R0.24 COC(=O)CCC(Cl)CCl Amb25241534 [0,2,0,0,0,0|1,0,0]=3 5718 B9R0.24 COC(=O)CCC(N)C#C Amb24433501 [0,2,0,0,0,0|1,0,1]=4 5719 B9R0.24 COC(=O)CCC(N)C=C Amb18124639 [0,2,0,0,0,0|1,0,1]=4 5720 B9R0.24 COC(=O)CCC(N)CF Amb24517084 [0,2,0,0,0,0|1,0,0]=3 5721 B9R0.24 COC(=O)CCC(O)C=C Amb25127861 [0,2,0,0,0,0|1,0,1]=4 5722 B9R0.24 COC(=O)CCC(O)CBr Amb25044783 [0,2,0,0,0,0|1,0,0]=3 5723 B9R0.24 COC(=O)CCC(O)CN Amb25857935 [0,2,0,0,0,0|1,0,0]=3 5724 B9R0.24 COC(=O)CCC(O)CO Amb25204294 [0,2,0,0,0,0|1,0,0]=3 5725 B9R0.24 COC(=O)CCN(C)C#N Amb25049700 [0,2,0,0,0,0|1,0,1]=4 5726 B9R0.24 COC(=O)CC[C@@H](C)C=O Amb25104821 [0,2,0,0,0,0|0,0,1]=3 5727 B9R0.24 COC(=O)CC[C@@H](O)C#C Amb25343842 [0,2,0,0,0,0|1,0,1]=4 5728 B9R0.24 COC(=O)CC[C@@H](O)CN Amb24744697 [0,2,0,0,0,0|1,0,0]=3 5729 B9R0.24 COC(=O)CC[C@H](Cl)C=O Amb25100997 [0,2,0,0,0,0|1,0,1]=4 5730 B9R0.24 COC(=O)CC[C@H](N)C#C Amb25147453 [0,2,0,0,0,0|1,0,1]=4 5731 B9R0.24 COC(=O)CC[C@H](O)C=C Amb24481290 [0,2,0,0,0,0|1,0,1]=4 5732 B9R0.24 COC(=O)CNC(C)C=C Amb25693636 [0,2,0,0,0,0|1,0,1]=4 5733 B9R0.24 COC(=O)CNC(C)CN Amb25299776 [0,2,0,0,0,0|1,0,0]=3 5734 B9R0.24 COC(=O)COC(C)CN Amb24480966 [0,2,0,0,0,0|1,0,0]=3 5735 B9R0.24 COC(=O)CSC(C)C#N Amb18800109 [0,2,0,0,0,0|1,0,1]=4 5736 B9R0.24 COC(=O)CSC(C)CO Amb25070989 [0,2,0,0,0,0|1,0,0]=3 5737 B9R0.24 COC(=O)NCC(C)CN Amb18313166 [0,2,0,0,0,0|1,0,0]=3 5738 B9R0.24 COC(=O)NCC(C)SC Amb25206873 [0,2,0,0,0,0|1,0,0]=3 5739 B9R0.24 COC(=O)NCC(Cl)CCl Amb25106564 [0,2,0,0,0,0|2,0,0]=4 5740 B9R0.24 COC(=O)NCC(O)CN Amb24589991 [0,2,0,0,0,0|2,0,0]=4 5741 B9R0.24 COC(=O)NOC(C)CC Amb24524318 [0,2,0,0,0,0|2,0,0]=4 5742 B9R0.24 COC(=O)OCC(Cl)CF Amb25211615 [0,2,0,0,0,0|2,0,0]=4 5743 B9R0.24 COC(=O)OCC(F)CCl Amb25774919 [0,2,0,0,0,0|2,0,0]=4 5744 B9R0.24 COC(=O)\C=C\C(C)CN Amb25229568 [0,2,0,0,0,0|0,0,2]=4 5745 B9R0.24 COC(=O)\C=C\[C@H](C)CO Amb24749656 [0,2,0,0,0,0|0,0,2]=4 5746 B9R0.24 COC(=S)SCC(C)CO Amb24723366 [0,2,0,0,0,0|1,1,0]=4 5747 B9R0.24 COC(C)CCC(N)=NN Amb25310238 [0,2,0,0,0,0|2,0,0]=4 5748 B9R0.24 COC(C)CNC(=O)C=C Amb24471961 [0,2,0,0,0,0|2,0,0]=4 5749 B9R0.24 COC(C)CNC(=O)CCl Amb24700874 [0,2,0,0,0,0|2,0,0]=4 5750 B9R0.24 COC(C)CNC(=O)NN Amb24446351 [0,2,0,0,0,0|2,0,0]=4 5751 B9R0.24 COC(C)COC(=O)CO Amb24752113 [0,2,0,0,0,0|1,0,0]=3 5752 B9R0.24 CON(C)CCC(C)CN Amb25056725 [0,2,0,0,0,0|2,0,0]=4 5753 B9R0.24 COP(=O)CCC(=O)OC Amb25187314 [0,2,0,0,0,0|2,0,0]=4 5754 B9R0.24 COS(=O)CCC(=O)OC Amb22728623 [0,2,0,0,0,0|2,0,0]=4 5755 B9R0.24 CSC(C)CCC(=O)NN Amb25340735 [0,2,0,0,0,0|1,0,0]=3 5756 B9R0.24 CSC(C)CCC(=O)NO Amb24538243 [0,2,0,0,0,0|0,0,0]=2 5757 B9R0.24 CSC(C)CNC(=O)CN Amb25360470 [0,2,0,0,0,0|2,0,0]=4 5758 B9R0.24 CSC(C)CNC(=O)CO Amb25322962 [0,2,0,0,0,0|1,0,0]=3 5759 B9R0.24 CSC(C)CNC(=O)CS Amb24738132 [0,2,0,0,0,0|1,1,0]=4 5760 B9R0.24 CSC(C)CNC(N)=NO Amb25759979 [0,2,0,0,0,0|2,0,0]=4 5761 B9R0.24 C[C@@H](CCC(=O)CC)CC Amb24645778 [0,2,0,0,0,0|1,0,0]=3 5762 B9R0.24 C[C@@H](CCC(O)CC)CC Amb25686198 [0,2,0,0,0,0|1,0,1]=4 5763 B9R0.24 C[C@H](CCC(=O)CC)CC Amb25094462 [0,2,0,0,0,0|1,0,0]=3 5764 B9R0.24 C[C@H](CCC(O)CO)CC Amb25332161 [0,2,0,0,0,0|0,0,2]=4 5765 B9R0.24 C[C@H](CC[C@@H](C)CO)CO Amb25236144 [0,2,0,0,0,0|1,0,1]=4 5766 B9R0.24 C[C@H](CC[C@@H](O)CO)CC Amb24592097 [0,2,0,0,0,0|0,0,2]=4 5767 B9R0.24 O=NN(CCC(=O)OC)C Amb17618594 [0,2,0,0,0,0|2,0,0]=4 5768 B9R0.24 OC(COC(=O)CO)CO Amb25854328 [0,2,0,0,0,0|2,0,0]=4 5769 B9R0.24 OCC(=O)CCC(=O)CO Amb25358920 [0,2,0,0,0,0|1,0,1]=4 5770 B9R0.24 OCC(O)CCC(O)C=O Amb25713052 [0,2,0,0,0,0|1,0,1]=4 5771 B9R0.24 OC[C@H](O)CC[C@@H](O)C=O Amb25059567 [0,2,0,0,0,0|1,0,1]=4 5772 B9R0.24 OC[C@H](O)CC[C@H](O)C=O Amb24456857 [0,2,0,0,0,0|1,0,1]=4 5773 B9R0.42 C=C(CC(N)CN)C(O)=O Amb24502423 [0,2,0,0,0,0|1,0,1]=4 5774 B9R0.42 CC(=O)C(=O)CC(C)CC Amb24707036 [0,2,0,0,0,0|1,0,1]=4 5775 B9R0.42 CC(=O)C(Cl)CC(=O)OC Amb25061154 [0,2,0,0,0,0|1,0,1]=4 5776 B9R0.42 CC(=O)C(N)CC(=O)OC Amb24529258 [0,2,0,0,0,0|1,0,1]=4 5777 B9R0.42 CC(=O)C(O)CC(=O)OC Amb25146688 [0,2,0,0,0,0|1,0,1]=4 5778 B9R0.42 CC(C)C(C)CC(=O)NC Amb25334529 [0,2,0,0,0,0|1,0,0]=3 5779 B9R0.42 CC(C)C(C)CC(=O)NN Amb25668927 [0,2,0,0,0,0|1,0,0]=3 5780 B9R0.42 CC(C)C(C)CC(=O)OC Amb24482543 [0,2,0,0,0,0|0,0,0]=2 5781 B9R0.42 CC(C)C(C)CC(=S)NC Amb24741655 [0,2,0,0,0,0|1,1,0]=4 5782 B9R0.42 CC(C)C(C)CC(C)CO Amb24501555 [0,2,0,0,0,0|1,0,1]=4 5783 B9R0.42 CC(C)C(C)CC(O)CCl Amb25061593 [0,2,0,0,0,0|1,0,1]=4 5784 B9R0.42 CC(C)C(C)CN(C)C=O Amb24548962 [0,2,0,0,0,0|2,0,0]=4 5785 B9R0.42 CC(C)C(C)NC(=O)C#C Amb25144682 [0,2,0,0,0,0|2,0,0]=4 5786 B9R0.42 CC(C)C(C)NC(=O)C#N Amb24744359 [0,2,0,0,0,0|2,0,0]=4 5787 B9R0.42 CC(C)C(C)NC(=O)CC Amb23329699 [0,2,0,0,0,0|2,0,0]=4 5788 B9R0.42 CC(C)C(C)NC(=O)CS Amb24748150 [0,2,0,0,0,0|1,1,0]=4 5789 B9R0.42 CC(C)C(C)NC(=O)NC Amb25297080 [0,2,0,0,0,0|2,0,0]=4 5790 B9R0.42 CC(C)C(C)NC(=O)NO Amb24478867 [0,2,0,0,0,0|1,0,0]=3 5791 B9R0.42 CC(C)C(C)NC(N)=NO Amb24476877 [0,2,0,0,0,0|2,0,0]=4 5792 B9R0.42 CC(C)C(C)OC(=O)C=O Amb24422244 [0,2,0,0,0,0|1,0,1]=4 5793 B9R0.42 CC(C)C(C)OC(=O)CBr Amb25288205 [0,2,0,0,0,0|2,0,0]=4 5794 B9R0.42 CC(C)C(C)OC(=O)CC Amb25057592 [0,2,0,0,0,0|2,0,0]=4 5795 B9R0.42 CC(C)C(C)OC(=O)CO Amb25209163 [0,2,0,0,0,0|1,0,0]=3 5796 B9R0.42 CC(C)C(C)OC(=O)CS Amb24453645 [0,2,0,0,0,0|1,1,0]=4 5797 B9R0.42 CC(C)C(Cl)CC(=C)CC Amb25254565 [0,2,0,0,0,0|2,0,0]=4 5798 B9R0.42 CC(C)C(N)CC(=C)CC Amb24735244 [0,2,0,0,0,0|2,0,0]=4 5799 B9R0.42 CC(C)C(N)CC(=O)C=C Amb25231795 [0,2,0,0,0,0|1,0,0]=3 5800 B9R0.42 CC(C)C(N)CC(=O)CC Amb25783213 [0,2,0,0,0,0|1,0,0]=3 5801 B9R0.42 CC(C)C(N)CC(=O)NO Amb24502300 [0,2,0,0,0,0|0,0,0]=2 5802 B9R0.42 CC(C)C(N)CC(=O)OC Amb22168224 [0,2,0,0,0,0|0,0,0]=2 5803 B9R0.42 CC(C)C(N)CN(C)OC Amb24687993 [0,2,0,0,0,0|2,0,0]=4 5804 B9R0.42 CC(C)C(O)C=C(C)OC Amb24429509 [0,2,0,0,0,0|1,0,1]=4 5805 B9R0.42 CC(C)C(O)CC(=C)C=C Amb25240125 [0,2,0,0,0,0|2,0,0]=4 5806 B9R0.42 CC(C)C(O)CC(=C)CO Amb24386718 [0,2,0,0,0,0|1,0,0]=3 5807 B9R0.42 CC(C)C(O)CC(=O)CC Amb25134271 [0,2,0,0,0,0|1,0,0]=3 5808 B9R0.42 CC(C)C(O)CC(=O)NC Amb25343488 [0,2,0,0,0,0|1,0,0]=3 5809 B9R0.42 CC(C)C(O)CC(=O)NN Amb24463640 [0,2,0,0,0,0|1,0,0]=3 5810 B9R0.42 CC(C)C(O)CC(=O)OC Amb24423234 [0,2,0,0,0,0|0,0,0]=2 5811 B9R0.42 CC(C)C(O)CC(C)CO Amb24733289 [0,2,0,0,0,0|1,0,1]=4 5812 B9R0.42 CC(C)C(O)CN(O)N=O Amb25199876 [0,2,0,0,0,0|1,0,0]=3 5813 B9R0.42 CC(C)N(C)CC(=O)CN Amb25269136 [0,2,0,0,0,0|2,0,0]=4 5814 B9R0.42 CC(C)N(C)CC(=O)NN Amb25244044 [0,2,0,0,0,0|2,0,0]=4 5815 B9R0.42 CC(C)[C@@H](C)CC(=O)CC Amb25717762 [0,2,0,0,0,0|1,0,0]=3 5816 B9R0.42 CC(C)[C@@H](C)NC(=O)CBr Amb22896650 [0,2,0,0,0,0|2,0,0]=4 5817 B9R0.42 CC(C)[C@@H](N)CC(=O)OC Amb23401522 [0,2,0,0,0,0|0,0,0]=2 5818 B9R0.42 CC(C)[C@@H](N)CN(C)OC Amb25028023 [0,2,0,0,0,0|2,0,0]=4 5819 B9R0.42 CC(C)[C@@H](N)C[C@H](O)CC Amb19929610 [0,2,0,0,0,0|1,0,1]=4 5820 B9R0.42 CC(C)[C@@H](O)CC(=C)C=C Amb24509168 [0,2,0,0,0,0|2,0,0]=4 5821 B9R0.42 CC(C)[C@@H](O)CC(=O)C=C Amb25718385 [0,2,0,0,0,0|1,0,0]=3 5822 B9R0.42 CC(C)[C@@H](O)CC(=O)NC Amb25721056 [0,2,0,0,0,0|1,0,0]=3 5823 B9R0.42 CC(C)[C@@H](O)C[C@@H](O)C=C Amb24482520 [0,2,0,0,0,0|1,0,1]=4 5824 B9R0.42 CC(C)[C@@H](O)C[C@H](C)CO Amb24412173 [0,2,0,0,0,0|1,0,1]=4 5825 B9R0.42 CC(C)[C@H](N)\C=C(/C)\CO Amb24716799 [0,2,0,0,0,0|1,0,1]=4 5826 B9R0.42 CC(C)[C@H](O)CC(=C)C=C Amb24463969 [0,2,0,0,0,0|2,0,0]=4 5827 B9R0.42 CC(C)[C@H](O)CC(=O)OC Amb25847717 [0,2,0,0,0,0|0,0,0]=2 5828 B9R0.42 CC(CC(=O)CCl)C(O)=O Amb24585160 [0,2,0,0,0,0|1,0,1]=4 5829 B9R0.42 CC(CC(=O)CN)C(O)=O Amb25758299 [0,2,0,0,0,0|1,0,1]=4 5830 B9R0.42 CC(CC(=O)NC)C(C)N Amb23536745 [0,2,0,0,0,0|2,0,0]=4 5831 B9R0.42 CC(CC(=O)NN)C(C)O Amb24412186 [0,2,0,0,0,0|2,0,0]=4 5832 B9R0.42 CC(CC(=O)NN)N(C)C Amb24717727 [0,2,0,0,0,0|2,0,0]=4 5833 B9R0.42 CC(CC(=O)OC)C(C)N Amb25296644 [0,2,0,0,0,0|1,0,0]=3 5834 B9R0.42 CC(CC(=O)OC)C(C)O Amb25260435 [0,2,0,0,0,0|1,0,0]=3 5835 B9R0.42 CC(CC(Br)C(O)=O)CN Amb24478240 [0,2,0,0,0,0|0,0,0]=2 5836 B9R0.42 CC(CC(C)C#N)C(C)=O Amb18643436 [0,2,0,0,0,0|1,0,1]=4 5837 B9R0.42 CC(CC(C)C#N)C(O)=O Amb25694006 [0,2,0,0,0,0|0,0,1]=3 5838 B9R0.42 CC(CC(C)C=C)C(O)=O Amb18643935 [0,2,0,0,0,0|0,0,1]=3 5839 B9R0.42 CC(CC(C)C=O)C(O)=O Amb18644134 [0,2,0,0,0,0|0,0,1]=3 5840 B9R0.42 CC(CC(F)C(O)=O)CN Amb25265347 [0,2,0,0,0,0|0,0,0]=2 5841 B9R0.42 CC(CC(F)C(O)=O)OC Amb25298262 [0,2,0,0,0,0|0,0,0]=2 5842 B9R0.42 CC(CC(N)=NO)N(C)C Amb24549714 [0,2,0,0,0,0|2,0,0]=4 5843 B9R0.42 CC(CC(N)C(C)=C)OC Amb25851059 [0,2,0,0,0,0|2,0,0]=4 5844 B9R0.42 CC(CC(N)C(C)=O)CC Amb25747386 [0,2,0,0,0,0|1,0,0]=3 5845 B9R0.42 CC(CC(N)C(N)=O)OC Amb25349298 [0,2,0,0,0,0|1,0,0]=3 5846 B9R0.42 CC(CC(N)C(O)=O)=C=C Amb24409576 [0,2,0,0,0,0|0,0,2]=4 5847 B9R0.42 CC(CC(N)C(O)=O)C#C Amb25067277 [0,2,0,0,0,0|0,0,1]=3 5848 B9R0.42 CC(CC(N)C(O)=O)C#N Amb25262927 [0,2,0,0,0,0|0,0,1]=3 5849 B9R0.42 CC(CC(N)C(O)=O)C=C Amb25778211 [0,2,0,0,0,0|0,0,1]=3 5850 B9R0.42 CC(CC(N)C(O)=O)CC Amb18313985 [0,2,0,0,0,0|0,0,0]=2 5851 B9R0.42 CC(CC(N)C(O)=O)CC Amb20667726 [0,2,0,0,0,0|0,0,0]=2 5852 B9R0.42 CC(CC(N)C(O)=O)CCl Amb24480574 [0,2,0,0,0,0|0,0,0]=2 5853 B9R0.42 CC(CC(N)C(O)=O)CO Amb25147300 [0,2,0,0,0,0|0,0,0]=2 5854 B9R0.42 CC(CC(N)C(O)=O)NC Amb24711878 [0,2,0,0,0,0|0,0,0]=2 5855 B9R0.42 CC(CC(N)C(O)=O)OC Amb25147752 [0,2,0,0,0,0|0,0,0]=2 5856 B9R0.42 CC(CC(N)C(O)=O)SC Amb24365891 [0,2,0,0,0,0|0,0,0]=2 5857 B9R0.42 CC(CC(O)C(O)=O)=NO Amb25291967 [0,2,0,0,0,0|1,0,1]=4 5858 B9R0.42 CC(CC(O)C(O)=O)CC Amb25849308 [0,2,0,0,0,0|0,0,0]=2 5859 B9R0.42 CC(CC(O)CN)C(O)=O Amb25375725 [0,2,0,0,0,0|1,0,0]=3 5860 B9R0.42 CC(CC(S)C(O)=O)CC Amb18798152 [0,2,0,0,0,0|0,0,0]=2 5861 B9R0.42 CC(CC(S)C(O)=O)OC Amb24641528 [0,2,0,0,0,0|0,0,0]=2 5862 B9R0.42 CC(CC)OC(F)C(O)=O Amb25043871 [0,2,0,0,0,0|1,0,0]=3 5863 B9R0.42 CC(CF)NC(=O)C(O)=O Amb24591520 [0,2,0,0,0,0|1,0,1]=4 5864 B9R0.42 CC(CN(C)C(N)=O)CN Amb18292980 [0,2,0,0,0,0|2,0,0]=4 5865 B9R0.42 CC(CN(C)C=O)C(O)=O Amb18292993 [0,2,0,0,0,0|1,0,1]=4 5866 B9R0.42 CC(CN)CC(C)C(O)=O Amb24717285 [0,2,0,0,0,0|0,0,0]=2 5867 B9R0.42 CC(CN)CN(C)C(C)=O Amb18523773 [0,2,0,0,0,0|2,0,0]=4 5868 B9R0.42 CC(CN)\C=C(\F)/C(O)=O Amb25213358 [0,2,0,0,0,0|0,0,2]=4 5869 B9R0.42 CC(CO)CN(C)C(C)=O Amb25136734 [0,2,0,0,0,0|2,0,0]=4 5870 B9R0.42 CC(CO)NC(=O)C(O)=O Amb25106609 [0,2,0,0,0,0|1,0,1]=4 5871 B9R0.42 CC(C[C@@H](N)C(O)=O)CC Amb25127143 [0,2,0,0,0,0|0,0,0]=2 5872 B9R0.42 CC(C[C@@H](N)C(O)=O)OC Amb24412403 [0,2,0,0,0,0|0,0,0]=2 5873 B9R0.42 CC(C[C@@H](N)C(O)=O)SC Amb24692660 [0,2,0,0,0,0|0,0,0]=2 5874 B9R0.42 CC(C[C@H](N)C(O)=O)C#C Amb25214668 [0,2,0,0,0,0|0,0,1]=3 5875 B9R0.42 CC(C[C@H](N)C(O)=O)CCl Amb24479195 [0,2,0,0,0,0|0,0,0]=2 5876 B9R0.42 CC(Cl)C(Cl)CC(=O)OC Amb24613883 [0,2,0,0,0,0|1,0,0]=3 5877 B9R0.42 CC(NC(C)C#C)C(O)=O Amb25088637 [0,2,0,0,0,0|1,0,1]=4 5878 B9R0.42 CC(NC(C)C=C)C(O)=O Amb18310595 [0,2,0,0,0,0|1,0,1]=4 5879 B9R0.42 CC(NC(C)CF)C(N)=O Amb25333137 [0,2,0,0,0,0|2,0,0]=4 5880 B9R0.42 CC(NC(C)CO)C(O)=O Amb18315378 [0,2,0,0,0,0|1,0,0]=3 5881 B9R0.42 CC(O)C(N)CC(=O)OC Amb24466348 [0,2,0,0,0,0|1,0,0]=3 5882 B9R0.42 CC(O)C(O)CC(O)C=O Amb25729199 [0,2,0,0,0,0|1,0,1]=4 5883 B9R0.42 CC(O)[C@@H](N)CC(=O)OC Amb25315361 [0,2,0,0,0,0|1,0,0]=3 5884 B9R0.42 CC(OC(C)C#N)C(O)=O Amb25185255 [0,2,0,0,0,0|1,0,1]=4 5885 B9R0.42 CC(OC(C)CN)C(C)=O Amb18110684 [0,2,0,0,0,0|2,0,0]=4 5886 B9R0.42 CC(OC(C)CN)C(N)=O Amb24359073 [0,2,0,0,0,0|2,0,0]=4 5887 B9R0.42 CC(OC(C)CN)C(O)=O Amb18110542 [0,2,0,0,0,0|1,0,0]=3 5888 B9R0.42 CC(SC(C)C#N)C(O)=O Amb18292357 [0,2,0,0,0,0|1,0,1]=4 5889 B9R0.42 CC(SC(C)C=C)C(O)=O Amb18310581 [0,2,0,0,0,0|1,0,1]=4 5890 B9R0.42 CC(SC(C)CN)C(N)=O Amb25707956 [0,2,0,0,0,0|2,0,0]=4 5891 B9R0.42 CC(SC(C)CN)C(O)=O Amb25096975 [0,2,0,0,0,0|1,0,0]=3 5892 B9R0.42 CC(SC(C)CO)C(O)=O Amb24687156 [0,2,0,0,0,0|1,0,0]=3 5893 B9R0.42 CCC(=C)CC(C)C(O)=O Amb25342029 [0,2,0,0,0,0|0,0,2]=4 5894 B9R0.42 CCC(=C)CC(O)C(O)=O Amb25200851 [0,2,0,0,0,0|0,0,2]=4 5895 B9R0.42 CCC(=C)C[C@H](C)C(O)=O Amb24384990 [0,2,0,0,0,0|0,0,2]=4 5896 B9R0.42 CCC(=C)C[C@H](N)C(O)=O Amb25694434 [0,2,0,0,0,0|0,0,2]=4 5897 B9R0.42 CCC(=O)CC(C)C(C)O Amb25298744 [0,2,0,0,0,0|2,0,0]=4 5898 B9R0.42 CCC(=O)CC(N)C(O)=O Amb22546324 [0,2,0,0,0,0|1,0,1]=4 5899 B9R0.42 CCC(=O)CC(N)C(O)=O Amb24479073 [0,2,0,0,0,0|1,0,1]=4 5900 B9R0.42 CCC(=O)CN(C)C(C)C Amb25692826 [0,2,0,0,0,0|2,0,0]=4 5901 B9R0.42 CCC(=O)C[C@@H](C)C(O)=O Amb24680887 [0,2,0,0,0,0|1,0,1]=4 5902 B9R0.42 CCC(=O)C[C@H](N)C(O)=O Amb24479266 [0,2,0,0,0,0|1,0,1]=4 5903 B9R0.42 CCC(C)CC(C)C(C)=O Amb25056188 [0,2,0,0,0,0|1,0,0]=3 5904 B9R0.42 CCC(C)CC(C)C(C)O Amb24478003 [0,2,0,0,0,0|1,0,1]=4 5905 B9R0.42 CCC(C)CC(C)C(O)=O Amb22228338 [0,2,0,0,0,0|0,0,0]=2 5906 B9R0.42 CCC(C)CC(O)C(C)O Amb25265593 [0,2,0,0,0,0|1,0,1]=4 5907 B9R0.42 CCC(C)NC(=N)C(O)=O Amb25366732 [0,2,0,0,0,0|1,0,1]=4 5908 B9R0.42 CCC(C)N[C@@H](C)C(O)=O Amb25691180 [0,2,0,0,0,0|1,0,0]=3 5909 B9R0.42 CCC(C)N[C@H](C)C(O)=O Amb24375136 [0,2,0,0,0,0|1,0,0]=3 5910 B9R0.42 CCC(C)OC(=O)C(O)=O Amb24629707 [0,2,0,0,0,0|1,0,1]=4 5911 B9R0.42 CCC(C)OC(C)C(O)=O Amb25357779 [0,2,0,0,0,0|1,0,0]=3 5912 B9R0.42 CCC(C)SC(C)C(N)=O Amb18800585 [0,2,0,0,0,0|2,0,0]=4 5913 B9R0.42 CCC(C)\C=C(/Cl)\C(O)=O Amb24650875 [0,2,0,0,0,0|0,0,2]=4 5914 B9R0.42 CCC(C)\C=C(\F)/C(O)=O Amb25376745 [0,2,0,0,0,0|0,0,2]=4 5915 B9R0.42 CCC(Cl)CC(N)C(O)=O Amb24374416 [0,2,0,0,0,0|1,0,0]=3 5916 B9R0.42 CCC(O)CC(N)C(O)=O Amb24117068 [0,2,0,0,0,0|1,0,0]=3 5917 B9R0.42 CCC(O)C[C@H](N)C(O)=O Amb24759913 [0,2,0,0,0,0|1,0,0]=3 5918 B9R0.42 CCN(C)CC(=C)C(O)=O Amb24681944 [0,2,0,0,0,0|1,0,1]=4 5919 B9R0.42 CCN(C)CC(Cl)C(O)=O Amb25713950 [0,2,0,0,0,0|1,0,0]=3 5920 B9R0.42 CCN(C)CC(O)C(O)=O Amb25367420 [0,2,0,0,0,0|1,0,0]=3 5921 B9R0.42 CCN(O)CC(O)C(O)=O Amb24699297 [0,2,0,0,0,0|2,0,0]=4 5922 B9R0.42 CCS(=N)CC(N)C(O)=O Amb25046702 [0,2,0,0,0,0|2,0,0]=4 5923 B9R0.42 CCS(=N)C[C@H](N)C(O)=O Amb24502175 [0,2,0,0,0,0|2,0,0]=4 5924 B9R0.42 CCS(=O)CC(C)C(O)=O Amb19012076 [0,2,0,0,0,0|2,0,0]=4 5925 B9R0.42 CC[C@@H](C)C[C@H](C)C(O)=O Amb24426532 [0,2,0,0,0,0|0,0,0]=2 5926 B9R0.42 CC[C@@H](F)C[C@H](N)C(O)=O Amb25147291 [0,2,0,0,0,0|1,0,0]=3 5927 B9R0.42 CC[C@H](C)CC(=C)C(O)=O Amb25367282 [0,2,0,0,0,0|0,0,1]=3 5928 B9R0.42 CC[C@H](C)CC(C)C(C)=O Amb25821401 [0,2,0,0,0,0|1,0,0]=3 5929 B9R0.42 CC[C@H](C)C[C@@H](C)C(O)=O Amb24480420 [0,2,0,0,0,0|0,0,0]=2 5930 B9R0.42 CN(C)C(=O)CC(=O)NO Amb25345646 [0,2,0,0,0,0|1,0,1]=4 5931 B9R0.42 CNC(=O)C[C@@H](N)C(O)=O Amb20240891 [0,2,0,0,0,0|1,0,1]=4 5932 B9R0.42 CNC(=O)C[C@H](N)C(O)=O Amb20242140 [0,2,0,0,0,0|1,0,1]=4 5933 B9R0.42 CNC(C)CC(C)C(O)=O Amb25291515 [0,2,0,0,0,0|0,0,0]=2 5934 B9R0.42 CNC(C)CN(C)C(C)=O Amb24096771 [0,2,0,0,0,0|2,0,0]=4 5935 B9R0.42 COC(=O)CC(=O)C(C)Br Amb19888842 [0,2,0,0,0,0|1,0,1]=4 5936 B9R0.42 COC(=O)CC(=O)C(C)F Amb24589068 [0,2,0,0,0,0|1,0,1]=4 5937 B9R0.42 COC(=O)CC(=O)N(C)C Amb17399891 [0,2,0,0,0,0|1,0,1]=4 5938 B9R0.42 COC(=O)CC(Br)C(O)=O Amb18656998 [0,2,0,0,0,0|1,0,1]=4 5939 B9R0.42 COC(=O)CC(C(=O)C)Br Amb17403794 [0,2,0,0,0,0|1,0,1]=4 5940 B9R0.42 COC(=O)CC(C)C(O)=O Amb18644239 [0,2,0,0,0,0|1,0,1]=4 5941 B9R0.42 COC(=O)CC(C)S(C)=O Amb18788309 [0,2,0,0,0,0|2,0,0]=4 5942 B9R0.42 COC(=O)CC(N)C(O)=O Amb22489498 [0,2,0,0,0,0|1,0,1]=4 5943 B9R0.42 COC(=O)CC(O)C(O)=O Amb25786182 [0,2,0,0,0,0|1,0,1]=4 5944 B9R0.42 COC(=O)CS(=O)C(C)C Amb18788304 [0,2,0,0,0,0|1,0,0]=3 5945 B9R0.42 COC(=O)C[C@@H](C(=O)O)N Amb13884879 [0,2,0,0,0,0|1,0,1]=4 5946 B9R0.42 COC(=O)C[C@@H](N)C(O)=O Amb22745861 [0,2,0,0,0,0|1,0,1]=4 5947 B9R0.42 COC(=O)C[C@@H](O)C(O)=O Amb23603858 [0,2,0,0,0,0|1,0,1]=4 5948 B9R0.42 COC(=O)C[C@H](O)C(O)=O Amb25367304 [0,2,0,0,0,0|1,0,1]=4 5949 B9R0.42 COC(=O)C[C@H]([NH3+])C(=O)O Amb10574406 [0,2,0,0,0,0|1,0,1]=4 5950 B9R0.42 COC(=O)NC(C(C)C)C Amb10568210 [0,2,0,0,0,0|1,0,0]=3 5951 B9R0.42 COC(=O)\C=C(/N)\C(C)C Amb21858861 [0,2,0,0,0,0|0,0,2]=4 5952 B9R0.42 COC(=O)\C=C(\N)/C(C)C Amb25135602 [0,2,0,0,0,0|0,0,2]=4 5953 B9R0.42 COC(=O)\N=C(/N)\C(C)C Amb25147336 [0,2,0,0,0,0|1,0,1]=4 5954 B9R0.42 COC(C)CC(C)C(C)O Amb25139781 [0,2,0,0,0,0|1,0,1]=4 5955 B9R0.42 COC(C)\C=C(\F)/C(O)=O Amb25263824 [0,2,0,0,0,0|0,0,2]=4 5956 B9R0.42 CO[C@@H](C)C[C@H](C)C(O)=O Amb24691586 [0,2,0,0,0,0|0,0,0]=2 5957 B9R0.42 C[C@@H](CC(=O)OC)[C@H](C)O Amb25206323 [0,2,0,0,0,0|1,0,0]=3 5958 B9R0.42 C[C@@H](CF)NC(=O)C(O)=O Amb25213683 [0,2,0,0,0,0|1,0,1]=4 5959 B9R0.42 C[C@@H](C[C@@H](C)C=C)C(O)=O Amb25756960 [0,2,0,0,0,0|0,0,1]=3 5960 B9R0.42 C[C@@H](C[C@@H](N)C(O)=O)CC Amb25844637 [0,2,0,0,0,0|0,0,0]=2 5961 B9R0.42 C[C@@H](C[C@H](C)C=C)C(O)=O Amb25757917 [0,2,0,0,0,0|0,0,1]=3 5962 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)C=C Amb25727679 [0,2,0,0,0,0|0,0,1]=3 5963 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)CC Amb24619367 [0,2,0,0,0,0|0,0,0]=2 5964 B9R0.42 C[C@@H](C[C@H](N)C(O)=O)CF Amb25147611 [0,2,0,0,0,0|0,0,0]=2 5965 B9R0.42 C[C@@H](C[C@H](O)CN)C(O)=O Amb24447195 [0,2,0,0,0,0|1,0,0]=3 5966 B9R0.42 C[C@@H](NC(C)CN)C(O)=O Amb25291159 [0,2,0,0,0,0|1,0,0]=3 5967 B9R0.42 C[C@@H](N[C@@H](C)C#N)C(O)=O Amb24479136 [0,2,0,0,0,0|1,0,1]=4 5968 B9R0.42 C[C@@H](O)[C@@H](O)C[C@@H](O)C=O Amb24524335 [0,2,0,0,0,0|1,0,1]=4 5969 B9R0.42 C[C@@H](O)[C@H](C)C[C@H](C)CO Amb25220608 [0,2,0,0,0,0|1,0,1]=4 5970 B9R0.42 C[C@@H](O)[C@H](O)C[C@@H](O)C=O Amb25277248 [0,2,0,0,0,0|1,0,1]=4 5971 B9R0.42 C[C@H](C[C@@H](N)C(O)=O)CC Amb25738618 [0,2,0,0,0,0|0,0,0]=2 5972 B9R0.42 C[C@H](C[C@H](C)C=C)C(C)=O Amb24640833 [0,2,0,0,0,0|1,0,1]=4 5973 B9R0.42 C[C@H](C[C@H](C)C=C)C(O)=O Amb24352097 [0,2,0,0,0,0|0,0,1]=3 5974 B9R0.42 C[C@H](C[C@H](C)C=O)C(C)=O Amb25043958 [0,2,0,0,0,0|1,0,1]=4 5975 B9R0.42 C[C@H](C[C@H](C)CO)C(O)=O Amb24480419 [0,2,0,0,0,0|0,0,0]=2 5976 B9R0.42 C[C@H](C[C@H](N)C(O)=O)C#N Amb24529159 [0,2,0,0,0,0|0,0,1]=3 5977 B9R0.42 C[C@H](C[C@H](N)C(O)=O)C=C Amb24561660 [0,2,0,0,0,0|0,0,1]=3 5978 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CC Amb25662528 [0,2,0,0,0,0|0,0,0]=2 5979 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CF Amb25378691 [0,2,0,0,0,0|0,0,0]=2 5980 B9R0.42 C[C@H](C[C@H](N)C(O)=O)CO Amb25378739 [0,2,0,0,0,0|0,0,0]=2 5981 B9R0.42 C[C@H](C[C@H](N)C(O)=O)SC Amb25848560 [0,2,0,0,0,0|0,0,0]=2 5982 B9R0.42 C[C@H](C[C@H](O)C(O)=O)CC Amb24446982 [0,2,0,0,0,0|0,0,0]=2 5983 B9R0.42 C[C@H](O)[C@@H](O)C[C@H](O)C=O Amb25131111 [0,2,0,0,0,0|1,0,1]=4 5984 B9R0.42 C[C@H](O)[C@H](O)CC(=O)C=O Amb25313074 [0,2,0,0,0,0|1,0,1]=4 5985 B9R0.42 C[C@H](OC(C)C#N)C(O)=O Amb25265720 [0,2,0,0,0,0|1,0,1]=4 5986 B9R0.42 C[C@H](OC(C)C=C)C(O)=O Amb25185256 [0,2,0,0,0,0|1,0,1]=4 5987 B9R0.42 C\C(=C/C(C)CC)\C(O)=O Amb18643945 [0,2,0,0,0,0|0,0,2]=4 5988 B9R0.42 C\C(\CC(=C)C(O)=O)=C/C Amb24746757 [0,2,0,0,0,0|0,0,2]=4 5989 B9R0.42 C\C(\CC(N)C(O)=O)=C/C Amb24587021 [0,2,0,0,0,0|0,0,1]=3 5990 B9R0.42 C\C(\CCl)=C/[C@H](C)C(O)=O Amb25313581 [0,2,0,0,0,0|0,0,2]=4 5991 B9R0.42 C\C(\C[C@H](N)C(O)=O)=C\C Amb24746992 [0,2,0,0,0,0|0,0,1]=3 5992 B9R0.42 NC(CC(=O)CBr)C(O)=O Amb24477386 [0,2,0,0,0,0|1,0,1]=4 5993 B9R0.42 NC(CC(=O)CCl)C(O)=O Amb24061070 [0,2,0,0,0,0|1,0,1]=4 5994 B9R0.42 NC(CC(=O)CO)C(O)=O Amb18644310 [0,2,0,0,0,0|1,0,1]=4 5995 B9R0.42 NC(CC(F)CN)C(O)=O Amb24709973 [0,2,0,0,0,0|1,0,0]=3 5996 B9R0.42 NC(CC(O)CCl)C(O)=O Amb20179638 [0,2,0,0,0,0|1,0,0]=3 5997 B9R0.42 NC(CC(O)CO)C(O)=O Amb18644388 [0,2,0,0,0,0|1,0,0]=3 5998 B9R0.42 NC(CC(O)CO)C(O)=O Amb24117285 [0,2,0,0,0,0|1,0,0]=3 5999 B9R0.42 NCC(=O)CC(F)C(O)=O Amb25367166 [0,2,0,0,0,0|1,0,1]=4 6000 B9R0.42 NCC(=O)CC(N)C(O)=O Amb24462002 [0,2,0,0,0,0|1,0,1]=4 6001 B9R0.42 NCC(=O)C[C@H](N)C(O)=O Amb25757838 [0,2,0,0,0,0|1,0,1]=4 6002 B9R0.42 NC[C@H](O)C[C@H](O)C(O)=O Amb24383534 [0,2,0,0,0,0|1,0,0]=3 6003 B9R0.42 N[C@@H](CC(=O)CBr)C(O)=O Amb24477399 [0,2,0,0,0,0|1,0,1]=4 6004 B9R0.42 N[C@@H](CC(F)CO)C(O)=O Amb24079182 [0,2,0,0,0,0|1,0,0]=3 6005 B9R0.42 N[C@@H](CC(O)CN)C(O)=O Amb24455060 [0,2,0,0,0,0|1,0,0]=3 6006 B9R0.42 N[C@@H](C[C@@H](O)C=O)C(O)=O Amb25367252 [0,2,0,0,0,0|1,0,1]=4 6007 B9R0.42 N[C@@H](C[C@@H](O)CN)C(O)=O Amb25320209 [0,2,0,0,0,0|1,0,0]=3 6008 B9R0.42 N[C@@H](C[C@@H](O)CO)C(O)=O Amb24680903 [0,2,0,0,0,0|1,0,0]=3 6009 B9R0.42 N[C@@H](C[C@H](O)CCl)C(O)=O Amb25265266 [0,2,0,0,0,0|1,0,0]=3 6010 B9R0.42 N[C@@H](C[C@H](O)CN)C(O)=O Amb24446199 [0,2,0,0,0,0|1,0,0]=3 6011 B9R0.42 N[C@H](C[C@@H](O)CN)C(O)=O Amb24480730 [0,2,0,0,0,0|1,0,0]=3 6012 B9R0.42 N[C@H](C[C@H](O)CN)C(O)=O Amb25147418 [0,2,0,0,0,0|1,0,0]=3 6013 B9R0.42 OC(=O)C(=O)CC(O)CO Amb25733244 [0,2,0,0,0,0|1,0,1]=4 6014 B9R0.42 OC(=O)C(O)CC(=O)CBr Amb24477419 [0,2,0,0,0,0|1,0,1]=4 6015 B9R0.42 OCC(O)CC(O)C(O)=O Amb18644410 [0,2,0,0,0,0|1,0,0]=3 6016 B9R0.42 OC[C@@H](O)C[C@@H](O)C(O)=O Amb25227512 [0,2,0,0,0,0|1,0,0]=3 6017 B9R0.42 OC[C@@H](O)C[C@H](O)C(O)=O Amb25336564 [0,2,0,0,0,0|1,0,0]=3 6018 B9R0.42 OC[C@H](O)C[C@@H](O)C(O)=O Amb25774509 [0,2,0,0,0,0|1,0,0]=3 6019 B9R0.43 CC(=O)CCC(CC)=CC Amb24518433 [0,2,0,0,0,0|1,0,1]=4 6020 B9R0.43 CC(=O)CCC(OC)OC Amb25146554 [0,2,0,0,0,0|1,0,0]=3 6021 B9R0.43 CC(=O)CC\C(\CC)=C\C Amb25857597 [0,2,0,0,0,0|1,0,1]=4 6022 B9R0.43 CC(=O)CSC(CC)CC Amb24431275 [0,2,0,0,0,0|2,0,0]=4 6023 B9R0.43 CC(=O)OCC(CCl)CCl Amb24726208 [0,2,0,0,0,0|2,0,0]=4 6024 B9R0.43 CC(C)CCC(C=O)OC Amb24496589 [0,2,0,0,0,0|0,0,1]=3 6025 B9R0.43 CC(C)CCC(CBr)OC Amb24398752 [0,2,0,0,0,0|1,0,1]=4 6026 B9R0.43 CC(C)CCC(CO)C#N Amb25107220 [0,2,0,0,0,0|1,0,1]=4 6027 B9R0.43 CC(C)CCC(CO)C=C Amb25285573 [0,2,0,0,0,0|1,0,1]=4 6028 B9R0.43 CC(O)CCC(OC)OC Amb25348063 [0,2,0,0,0,0|1,0,1]=4 6029 B9R0.43 CCC(C#N)SCC(O)=O Amb18182420 [0,2,0,0,0,0|1,0,1]=4 6030 B9R0.43 CCC(CBr)CCS(C)=O Amb25292711 [0,2,0,0,0,0|2,0,0]=4 6031 B9R0.43 CCC(CC)=CCC(O)=O Amb24358562 [0,2,0,0,0,0|0,0,2]=4 6032 B9R0.43 CCC(CC)SCC(N)=O Amb25769020 [0,2,0,0,0,0|2,0,0]=4 6033 B9R0.43 CCC(CC)\C=C\C(O)=O Amb24375784 [0,2,0,0,0,0|0,0,2]=4 6034 B9R0.43 CCC(CCC(C)=O)C#N Amb18643428 [0,2,0,0,0,0|1,0,1]=4 6035 B9R0.43 CCC(CCC(C)=O)C=C Amb24354954 [0,2,0,0,0,0|1,0,1]=4 6036 B9R0.43 CCC(CCC(C)=O)C=O Amb18643911 [0,2,0,0,0,0|1,0,1]=4 6037 B9R0.43 CCC(CCC(N)=O)CC Amb25784811 [0,2,0,0,0,0|1,0,0]=3 6038 B9R0.43 CCC(CCC(O)=O)=CC Amb24480728 [0,2,0,0,0,0|0,0,1]=3 6039 B9R0.43 CCC(CCC(O)=O)C#N Amb18643712 [0,2,0,0,0,0|0,0,1]=3 6040 B9R0.43 CCC(CCC(O)=O)C=O Amb25378745 [0,2,0,0,0,0|0,0,1]=3 6041 B9R0.43 CCC(CCC(O)=O)NN Amb24478238 [0,2,0,0,0,0|1,0,0]=3 6042 B9R0.43 CCC(CCl)CCS(C)=O Amb24617545 [0,2,0,0,0,0|2,0,0]=4 6043 B9R0.43 CCC(CCl)COC(C)=O Amb24480383 [0,2,0,0,0,0|2,0,0]=4 6044 B9R0.43 CCC(CN)CCS(C)=O Amb24699721 [0,2,0,0,0,0|2,0,0]=4 6045 B9R0.43 CCC(CNC(C)=O)OC Amb25852654 [0,2,0,0,0,0|2,0,0]=4 6046 B9R0.43 CCC(CNC(N)=O)CC Amb25789490 [0,2,0,0,0,0|2,0,0]=4 6047 B9R0.43 CCC(CO)COC(N)=O Amb25840638 [0,2,0,0,0,0|2,0,0]=4 6048 B9R0.43 CCC(COC(=O)Cl)CC Amb25142812 [0,2,0,0,0,0|2,0,0]=4 6049 B9R0.43 CCC(NCC(=O)N)CC Amb1121177 [0,2,0,0,0,0|2,0,0]=4 6050 B9R0.43 CCC(\C=C\C(O)=O)OC Amb24707577 [0,2,0,0,0,0|0,0,2]=4 6051 B9R0.43 CCN(CCC(=O)N)CC Amb17231985 [0,2,0,0,0,0|2,0,0]=4 6052 B9R0.43 CCN(CCC(C)C)OC Amb24524482 [0,2,0,0,0,0|2,0,0]=4 6053 B9R0.43 CCN(CCC(O)=O)C=O Amb19010092 [0,2,0,0,0,0|1,0,1]=4 6054 B9R0.43 CCN(CCC(O)=O)N=O Amb24659873 [0,2,0,0,0,0|2,0,0]=4 6055 B9R0.43 CCP(CCC(O)=O)CC Amb24390842 [0,2,0,0,0,0|1,0,0]=3 6056 B9R0.43 CC[C@@H](CBr)COC(C)=O Amb24441456 [0,2,0,0,0,0|2,0,0]=4 6057 B9R0.43 CC[C@@H](CCC(C)=O)C=O Amb24573990 [0,2,0,0,0,0|1,0,1]=4 6058 B9R0.43 CC[C@@H](CCC(O)=O)NN Amb24640349 [0,2,0,0,0,0|1,0,0]=3 6059 B9R0.43 CC[S+](CCC(O)=O)CC Amb24702750 [0,2,0,0,0,0|1,0,0]=3 6060 B9R0.43 CC\C(\C=O)=C/CC(C)C Amb25371823 [0,2,0,0,0,0|1,0,1]=4 6061 B9R0.43 CNC(=NC)SCC(O)=O Amb24623623 [0,2,0,0,0,0|1,0,1]=4 6062 B9R0.43 CNC(CCC(C)C)=NN Amb24513804 [0,2,0,0,0,0|2,0,0]=4 6063 B9R0.43 CNC(NC)=NCC(O)=O Amb24478941 [0,2,0,0,0,0|1,0,1]=4 6064 B9R0.43 CNC(NCC(C)C)=NO Amb25851770 [0,2,0,0,0,0|2,0,0]=4 6065 B9R0.43 CN[C@H](CS)CCC(O)=O Amb24482183 [0,2,0,0,0,0|0,0,0]=2 6066 B9R0.43 COC(CBr)CNC(N)=O Amb25726341 [0,2,0,0,0,0|2,0,0]=4 6067 B9R0.43 COC(CCC(N)=O)OC Amb25843468 [0,2,0,0,0,0|1,0,0]=3 6068 B9R0.43 COC(CCC(O)=O)OC Amb24657204 [0,2,0,0,0,0|0,0,0]=2 6069 B9R0.43 COC(CCN(=O)=O)OC Amb20619407 [0,2,0,0,0,0|1,0,1]=4 6070 B9R0.43 COC(CC[N+](=O)[O-])OC Amb1088901 [0,2,0,0,0,0|1,0,1]=4 6071 B9R0.43 COC(CNC(=O)C)OC Amb10808671 [0,2,0,0,0,0|2,0,0]=4 6072 B9R0.43 COC(CNC(=O)N)OC Amb16244926 [0,2,0,0,0,0|2,0,0]=4 6073 B9R0.43 COC(COC(C)=O)CC Amb24323241 [0,2,0,0,0,0|2,0,0]=4 6074 B9R0.43 CO[C@H](CN)CCC(O)=O Amb24544386 [0,2,0,0,0,0|0,0,0]=2 6075 B9R0.43 CO[C@H](CO)COC(C)=O Amb25271459 [0,2,0,0,0,0|2,0,0]=4 6076 B9R0.43 CS(=O)CCC(CO)CO Amb24538997 [0,2,0,0,0,0|2,0,0]=4 6077 B9R0.43 NC(=O)CNC(CO)CO Amb24402052 [0,2,0,0,0,0|2,0,0]=4 6078 B9R0.43 NCC(CCC(O)=O)=NO Amb24591142 [0,2,0,0,0,0|1,0,1]=4 6079 B9R0.43 NCC(CCC(O)=O)CN Amb25062561 [0,2,0,0,0,0|0,0,0]=2 6080 B9R0.43 OC(=O)COC(CF)CF Amb25095931 [0,2,0,0,0,0|1,0,0]=3 6081 B9R0.48 BrCCC(=O)NCC(C)C Amb17324139 [0,2,0,0,0,0|2,0,0]=4 6082 B9R0.48 C#CCC(O)CCC(O)=O Amb25077171 [0,2,0,0,0,0|1,0,0]=3 6083 B9R0.48 C#CCN(CCC(=O)O)C Amb17561257 [0,2,0,0,0,0|1,0,0]=3 6084 B9R0.48 C=C=C[C@@H](N)CCC(O)=O Amb24480739 [0,2,0,0,0,0|1,0,1]=4 6085 B9R0.48 C=CCC(=O)CCC(O)=O Amb18643852 [0,2,0,0,0,0|1,0,1]=4 6086 B9R0.48 C=CCC(=O)OCC(C)C Amb10807377 [0,2,0,0,0,0|2,0,0]=4 6087 B9R0.48 C=CCC(N)CCC(O)=O Amb25132628 [0,2,0,0,0,0|1,0,0]=3 6088 B9R0.48 C=CCN(CCC(=O)O)C Amb17334214 [0,2,0,0,0,0|1,0,0]=3 6089 B9R0.48 C=CCS(=O)CCC(O)=O Amb25032474 [0,2,0,0,0,0|2,0,0]=4 6090 B9R0.48 C=CC[C@@H](N)CCC(O)=O Amb25308063 [0,2,0,0,0,0|1,0,0]=3 6091 B9R0.48 CC#CC(C)SCC(O)=O Amb24482141 [0,2,0,0,0,0|1,0,0]=3 6092 B9R0.48 CC(=C)CCC(=O)COC Amb24371466 [0,2,0,0,0,0|0,0,2]=4 6093 B9R0.48 CC(=C)CCC(=O)OCC Amb22270105 [0,2,0,0,0,0|0,0,2]=4 6094 B9R0.48 CC(=O)CCC(=O)COC Amb24724049 [0,2,0,0,0,0|1,0,1]=4 6095 B9R0.48 CC(=O)CCC(=O)NOC Amb24478126 [0,2,0,0,0,0|1,0,1]=4 6096 B9R0.48 CC(=O)CCC(=O)OC=C Amb24633305 [0,2,0,0,0,0|1,0,1]=4 6097 B9R0.48 CC(=O)CCC(O)CC#N Amb18643714 [0,2,0,0,0,0|2,0,0]=4 6098 B9R0.48 CC(=O)CCN(C)CC#N Amb25026489 [0,2,0,0,0,0|2,0,0]=4 6099 B9R0.48 CC(C)CCC(=O)CC#C Amb25337433 [0,2,0,0,0,0|1,0,0]=3 6100 B9R0.48 CC(C)CCC(=O)CC=C Amb25850789 [0,2,0,0,0,0|1,0,0]=3 6101 B9R0.48 CC(C)CCC(=O)CC=O Amb24640237 [0,2,0,0,0,0|0,0,1]=3 6102 B9R0.48 CC(C)CCC(=O)N=C=O Amb25202030 [0,2,0,0,0,0|0,0,1]=3 6103 B9R0.48 CC(C)CCC(=O)N=[N+]=[N-] Amb25350467 [0,2,0,0,0,0|1,0,0]=3 6104 B9R0.48 CC(C)CCC(=O)OCCl Amb24480678 [0,2,0,0,0,0|0,0,0]=2 6105 B9R0.48 CC(C)CCC(C)=CCCl Amb24610076 [0,2,0,0,0,0|2,0,0]=4 6106 B9R0.48 CC(C)CCC(C)=CCN Amb25227753 [0,2,0,0,0,0|2,0,0]=4 6107 B9R0.48 CC(C)CCC(C)CC=O Amb24366723 [0,2,0,0,0,0|1,0,1]=4 6108 B9R0.48 CC(C)CCC(C)NC=O Amb25095296 [0,2,0,0,0,0|1,0,1]=4 6109 B9R0.48 CC(C)CCC(Cl)=CCO Amb25126989 [0,2,0,0,0,0|1,0,0]=3 6110 B9R0.48 CC(C)CCC(Cl)COC Amb18798380 [0,2,0,0,0,0|1,0,1]=4 6111 B9R0.48 CC(C)CCC(N)CCO Amb18831259 [0,2,0,0,0,0|1,0,1]=4 6112 B9R0.48 CC(C)CCC(O)CC#C Amb24478109 [0,2,0,0,0,0|1,0,1]=4 6113 B9R0.48 CC(C)CCC(O)CCN Amb25254667 [0,2,0,0,0,0|1,0,1]=4 6114 B9R0.48 CC(C)CCC(O)CCO Amb23456160 [0,2,0,0,0,0|0,0,2]=4 6115 B9R0.48 CC(C)CCC(O)CNC Amb25141272 [0,2,0,0,0,0|1,0,1]=4 6116 B9R0.48 CC(C)CCC(O)CSC Amb18798166 [0,2,0,0,0,0|0,1,1]=4 6117 B9R0.48 CC(C)CCN(C)CC=O Amb24529242 [0,2,0,0,0,0|2,0,0]=4 6118 B9R0.48 CC(C)CCS(=O)CC#N Amb24554477 [0,2,0,0,0,0|2,0,0]=4 6119 B9R0.48 CC(C)CCS(=O)CC=O Amb24387124 [0,2,0,0,0,0|1,0,1]=4 6120 B9R0.48 CC(C)CC[C@H](C)CCO Amb24719731 [0,2,0,0,0,0|1,0,1]=4 6121 B9R0.48 CC(C)CNC(=O)CCN Amb21957035 [0,2,0,0,0,0|2,0,0]=4 6122 B9R0.48 CC(C)CNC(=O)OCCl Amb24680976 [0,2,0,0,0,0|1,0,0]=3 6123 B9R0.48 CC(C)COC(=O)CC=O Amb24730671 [0,2,0,0,0,0|1,0,1]=4 6124 B9R0.48 CC(C)COC(=O)CCO Amb24378616 [0,2,0,0,0,0|1,0,0]=3 6125 B9R0.48 CC(C)COC(=O)N=[N+]=[N-] Amb24566154 [0,2,0,0,0,0|2,0,0]=4 6126 B9R0.48 CC(C)COC(=O)NC#N Amb24619419 [0,2,0,0,0,0|2,0,0]=4 6127 B9R0.48 CC(C)NCC(=O)NC#N Amb25690525 [0,2,0,0,0,0|2,0,0]=4 6128 B9R0.48 CC(C)OCC(=O)CCN Amb24550934 [0,2,0,0,0,0|2,0,0]=4 6129 B9R0.48 CC(C)OCC(=O)N=C=S Amb25090539 [0,2,0,0,0,0|1,1,0]=4 6130 B9R0.48 CC(C)SCC(=O)CC=C Amb25770382 [0,2,0,0,0,0|2,0,0]=4 6131 B9R0.48 CC(C)\C=C\C(=O)\C=C/O Amb25730081 [0,2,0,0,0,0|0,0,2]=4 6132 B9R0.48 CC(CC#C)CCC(O)=O Amb25331115 [0,2,0,0,0,0|0,0,0]=2 6133 B9R0.48 CC(CC#N)=CCC(O)=O Amb24480771 [0,2,0,0,0,0|0,0,2]=4 6134 B9R0.48 CC(CC#N)CCC(C)=O Amb18124541 [0,2,0,0,0,0|1,0,0]=3 6135 B9R0.48 CC(CC#N)CCC(O)=O Amb25826195 [0,2,0,0,0,0|0,0,0]=2 6136 B9R0.48 CC(CC#N)NCC(N)=O Amb19006655 [0,2,0,0,0,0|2,0,0]=4 6137 B9R0.48 CC(CC=C)CNC(C)=O Amb24351217 [0,2,0,0,0,0|2,0,0]=4 6138 B9R0.48 CC(CC=C)NCC(O)=O Amb25096722 [0,2,0,0,0,0|1,0,0]=3 6139 B9R0.48 CC(CC=C)OCC(O)=O Amb25064284 [0,2,0,0,0,0|1,0,0]=3 6140 B9R0.48 CC(CC=O)COC(C)=O Amb18644137 [0,2,0,0,0,0|2,0,0]=4 6141 B9R0.48 CC(CCBr)COC(C)=O Amb24759472 [0,2,0,0,0,0|2,0,0]=4 6142 B9R0.48 CC(CCC(C)=O)=CCO Amb24656003 [0,2,0,0,0,0|1,0,1]=4 6143 B9R0.48 CC(CCC(C)=O)=NOC Amb24583507 [0,2,0,0,0,0|1,0,1]=4 6144 B9R0.48 CC(CCC(C)O)COC Amb25378257 [0,2,0,0,0,0|1,0,1]=4 6145 B9R0.48 CC(CCC(O)=O)=CC#C Amb24629994 [0,2,0,0,0,0|0,0,2]=4 6146 B9R0.48 CC(CCC(O)=O)=CC#N Amb25069291 [0,2,0,0,0,0|0,0,2]=4 6147 B9R0.48 CC(CCC(O)=O)NC=O Amb24602293 [0,2,0,0,0,0|0,0,1]=3 6148 B9R0.48 CC(CCCl)COC(C)=O Amb25757525 [0,2,0,0,0,0|2,0,0]=4 6149 B9R0.48 CC(CCN)CCC(C)=C Amb25067186 [0,2,0,0,0,0|2,0,0]=4 6150 B9R0.48 CC(CCN)CCC(N)=O Amb19515543 [0,2,0,0,0,0|1,0,0]=3 6151 B9R0.48 CC(CCN)CCC(O)=O Amb18124749 [0,2,0,0,0,0|0,0,0]=2 6152 B9R0.48 CC(CCN)CCS(C)=O Amb24585879 [0,2,0,0,0,0|2,0,0]=4 6153 B9R0.48 CC(CCO)COC(C)=O Amb24524456 [0,2,0,0,0,0|2,0,0]=4 6154 B9R0.48 CC(CCO)SCC(N)=O Amb25122527 [0,2,0,0,0,0|2,0,0]=4 6155 B9R0.48 CC(CCO)SCC(O)=O Amb25056289 [0,2,0,0,0,0|1,0,0]=3 6156 B9R0.48 CC(COC(C)=O)OCCl Amb24746780 [0,2,0,0,0,0|2,0,0]=4 6157 B9R0.48 CC(CSC)=CCC(O)=O Amb25238257 [0,2,0,0,0,0|0,0,2]=4 6158 B9R0.48 CC(N)CCC(=O)CC=C Amb24655721 [0,2,0,0,0,0|2,0,0]=4 6159 B9R0.48 CC(O)CCC(=O)NC#N Amb25208277 [0,2,0,0,0,0|2,0,0]=4 6160 B9R0.48 CCCC(=O)CSC(C)C Amb18800478 [0,2,0,0,0,0|2,0,0]=4 6161 B9R0.48 CCCC(=O)NCC(C)C Amb17775257 [0,2,0,0,0,0|2,0,0]=4 6162 B9R0.48 CCCC(Br)CCC(O)=O Amb24469305 [0,2,0,0,0,0|1,0,0]=3 6163 B9R0.48 CCCC(C)CCB(O)O Amb25104756 [0,2,0,0,0,0|1,0,1]=4 6164 B9R0.48 CCCC(C)COC(=O)Cl Amb25783542 [0,2,0,0,0,0|2,0,0]=4 6165 B9R0.48 CCCC(C)COC(C)=O Amb22735194 [0,2,0,0,0,0|2,0,0]=4 6166 B9R0.48 CCCC(C)OCC(N)=O Amb25227310 [0,2,0,0,0,0|2,0,0]=4 6167 B9R0.48 CCCC(C)OCC(O)=O Amb18124782 [0,2,0,0,0,0|1,0,0]=3 6168 B9R0.48 CCCC(CCC(=O)C)C Amb10807385 [0,2,0,0,0,0|1,0,0]=3 6169 B9R0.48 CCCC(CCC(=O)N)O Amb17593642 [0,2,0,0,0,0|2,0,0]=4 6170 B9R0.48 CCCC(CCC(=O)O)N Amb1014101 [0,2,0,0,0,0|1,0,0]=3 6171 B9R0.48 CCCC(CCC(=O)[O-])O Amb2386295 [0,2,0,0,0,0|1,0,1]=4 6172 B9R0.48 CCCC(Cl)CCC(O)=O Amb23590328 [0,2,0,0,0,0|1,0,0]=3 6173 B9R0.48 CCCC(F)CCC(C)=O Amb25723377 [0,2,0,0,0,0|2,0,0]=4 6174 B9R0.48 CCCC(O)CCC(O)=O Amb17689110 [0,2,0,0,0,0|1,0,0]=3 6175 B9R0.48 CCCC(O)CCC([O-])=O Amb17778117 [0,2,0,0,0,0|1,0,1]=4 6176 B9R0.48 CCCN(C)CCC(O)=O Amb19280988 [0,2,0,0,0,0|1,0,0]=3 6177 B9R0.48 CCCS(=O)CCC(O)=O Amb18792575 [0,2,0,0,0,0|2,0,0]=4 6178 B9R0.48 CCC[C@@H](C)CCC(C)O Amb25806670 [0,2,0,0,0,0|1,0,1]=4 6179 B9R0.48 CCC[C@@H](C)CCC(O)=O Amb24548514 [0,2,0,0,0,0|0,0,0]=2 6180 B9R0.48 CCC[C@H](C)CCC(O)=O Amb24446759 [0,2,0,0,0,0|0,0,0]=2 6181 B9R0.48 CCC[C@H](N)CCC(O)=O Amb25211817 [0,2,0,0,0,0|1,0,0]=3 6182 B9R0.48 CCNC(=O)CCC(O)C Amb17334243 [0,2,0,0,0,0|2,0,0]=4 6183 B9R0.48 CCNC(=O)CCN(C)C Amb25356603 [0,2,0,0,0,0|2,0,0]=4 6184 B9R0.48 CCNC(=O)CSC(C)C Amb24401133 [0,2,0,0,0,0|2,0,0]=4 6185 B9R0.48 CCNC(=O)SCC(C)C Amb24505238 [0,2,0,0,0,0|2,0,0]=4 6186 B9R0.48 CCNC(C)CCC(O)=O Amb24394614 [0,2,0,0,0,0|0,0,0]=2 6187 B9R0.48 CCN[C@@H](C)CNC(N)=O Amb25811109 [0,2,0,0,0,0|2,0,0]=4 6188 B9R0.48 CCN[C@H](C)CNC(N)=O Amb24570937 [0,2,0,0,0,0|2,0,0]=4 6189 B9R0.48 CCOC(=N)CCN(C)C Amb25678428 [0,2,0,0,0,0|2,0,0]=4 6190 B9R0.48 CCOC(=N)CSC(C)C Amb25209292 [0,2,0,0,0,0|2,0,0]=4 6191 B9R0.48 CCOC(=O)C#CC(C)C Amb10604567 [0,2,0,0,0,0|0,0,2]=4 6192 B9R0.48 CCOC(=O)C=CC(C)C Amb24101030 [0,2,0,0,0,0|0,0,2]=4 6193 B9R0.48 CCOC(=O)CCC(=O)O Amb1151260 [0,2,0,0,0,0|1,0,1]=4 6194 B9R0.48 CCOC(=O)CCC(C)Br Amb20618752 [0,2,0,0,0,0|1,0,0]=3 6195 B9R0.48 CCOC(=O)CCC(C)Cl Amb22229742 [0,2,0,0,0,0|1,0,0]=3 6196 B9R0.48 CCOC(=O)CCC(C)N Amb25690130 [0,2,0,0,0,0|1,0,0]=3 6197 B9R0.48 CCOC(=O)CCC(Cl)Cl Amb25663054 [0,2,0,0,0,0|2,0,0]=4 6198 B9R0.48 CCOC(=O)CCC(F)F Amb22896370 [0,2,0,0,0,0|2,0,0]=4 6199 B9R0.48 CCOC(=O)CCS(C)=O Amb18788306 [0,2,0,0,0,0|2,0,0]=4 6200 B9R0.48 CCOC(=O)CC[C@@H](C)N Amb24505134 [0,2,0,0,0,0|1,0,0]=3 6201 B9R0.48 CCOC(=O)CC[S+](C)C Amb25719451 [0,2,0,0,0,0|1,0,0]=3 6202 B9R0.48 CCOC(=O)CNC(C)C Amb19887458 [0,2,0,0,0,0|1,0,0]=3 6203 B9R0.48 CCOC(=O)CSC(C)C Amb18800664 [0,2,0,0,0,0|1,0,0]=3 6204 B9R0.48 CCOC(=O)NCC(C)C Amb17862254 [0,2,0,0,0,0|1,0,0]=3 6205 B9R0.48 CCOC(=O)NCN(C)C Amb25147405 [0,2,0,0,0,0|2,0,0]=4 6206 B9R0.48 CCOC(=O)NC[C@H](C)O Amb25368250 [0,2,0,0,0,0|2,0,0]=4 6207 B9R0.48 CCOC(=O)OC[C@@H](C)O Amb24583968 [0,2,0,0,0,0|2,0,0]=4 6208 B9R0.48 CCOC(=O)\C=C\C(C)C Amb20247117 [0,2,0,0,0,0|0,0,2]=4 6209 B9R0.48 CCOC(C)C#CC(O)=O Amb24480724 [0,2,0,0,0,0|0,0,2]=4 6210 B9R0.48 CCOC(C)CCC(O)=O Amb24690847 [0,2,0,0,0,0|0,0,0]=2 6211 B9R0.48 CCOC(C)OCC(C)=O Amb24752470 [0,2,0,0,0,0|2,0,0]=4 6212 B9R0.48 CCOC(C)SCC(O)=O Amb24443054 [0,2,0,0,0,0|1,0,0]=3 6213 B9R0.48 CCSC(=O)CCC(O)=O Amb24482232 [0,2,0,0,0,0|1,0,1]=4 6214 B9R0.48 CCSC(=O)NCC(C)C Amb24360706 [0,2,0,0,0,0|1,1,0]=4 6215 B9R0.48 CCSC(C)CCC(O)=O Amb18800669 [0,2,0,0,0,0|0,0,0]=2 6216 B9R0.48 CC\C=C(\C)/CCC(C)=O Amb24511429 [0,2,0,0,0,0|1,0,1]=4 6217 B9R0.48 CN(C)CCC(=O)CC#C Amb25032249 [0,2,0,0,0,0|2,0,0]=4 6218 B9R0.48 CN(C)CCC(=O)CC#N Amb25709726 [0,2,0,0,0,0|2,0,0]=4 6219 B9R0.48 CN(C)CCC(=O)NC#N Amb24362259 [0,2,0,0,0,0|2,0,0]=4 6220 B9R0.48 CN(C)CNC(=O)CCO Amb25202342 [0,2,0,0,0,0|2,0,0]=4 6221 B9R0.48 CN(CC#C)CCC(N)=O Amb25307264 [0,2,0,0,0,0|2,0,0]=4 6222 B9R0.48 CN(CC#N)CCC(N)=O Amb25139274 [0,2,0,0,0,0|2,0,0]=4 6223 B9R0.48 CN(CCF)CCC(N)=O Amb25681499 [0,2,0,0,0,0|2,0,0]=4 6224 B9R0.48 CN(CCF)CCC(O)=O Amb25054517 [0,2,0,0,0,0|1,0,0]=3 6225 B9R0.48 CN(CCN)CCC(N)=O Amb24355517 [0,2,0,0,0,0|2,0,0]=4 6226 B9R0.48 CNCC(=O)COC(C)C Amb25302659 [0,2,0,0,0,0|2,0,0]=4 6227 B9R0.48 CNCC(=O)NCC(C)C Amb21958765 [0,2,0,0,0,0|2,0,0]=4 6228 B9R0.48 CNCC(=O)OCC(C)C Amb24696299 [0,2,0,0,0,0|2,0,0]=4 6229 B9R0.48 CNCC(C)CCC(C)=C Amb24353317 [0,2,0,0,0,0|2,0,0]=4 6230 B9R0.48 CNCC(C)CCS(C)=O Amb24538764 [0,2,0,0,0,0|2,0,0]=4 6231 B9R0.48 CNCC(O)CCC(O)=O Amb24745159 [0,2,0,0,0,0|1,0,0]=3 6232 B9R0.48 CNN=C(C)CCC(C)C Amb24509205 [0,2,0,0,0,0|2,0,0]=4 6233 B9R0.48 COCC(=N)NCC(C)C Amb25838234 [0,2,0,0,0,0|2,0,0]=4 6234 B9R0.48 COCC(=O)CCC(C)N Amb24763448 [0,2,0,0,0,0|1,0,0]=3 6235 B9R0.48 COCC(=O)COC(C)C Amb24470863 [0,2,0,0,0,0|1,0,0]=3 6236 B9R0.48 COCC(=O)NCC(C)C Amb23247498 [0,2,0,0,0,0|1,0,0]=3 6237 B9R0.48 COCC(=O)NCC(C)N Amb18112477 [0,2,0,0,0,0|2,0,0]=4 6238 B9R0.48 COCC(=O)NCC(C)O Amb25330115 [0,2,0,0,0,0|2,0,0]=4 6239 B9R0.48 COCC(=O)NC[C@@H](C)O Amb25318377 [0,2,0,0,0,0|2,0,0]=4 6240 B9R0.48 COCC(=O)NC[C@H](C)O Amb25098985 [0,2,0,0,0,0|2,0,0]=4 6241 B9R0.48 COCC(=O)NOC(C)C Amb24364041 [0,2,0,0,0,0|2,0,0]=4 6242 B9R0.48 COCC(=O)OCC(C)C Amb25806226 [0,2,0,0,0,0|1,0,0]=3 6243 B9R0.48 COCC(=O)OCC(C)O Amb24482899 [0,2,0,0,0,0|2,0,0]=4 6244 B9R0.48 COCC(C)CCC(O)=O Amb25340432 [0,2,0,0,0,0|0,0,0]=2 6245 B9R0.48 COCC(C)CNC(C)=O Amb25099602 [0,2,0,0,0,0|2,0,0]=4 6246 B9R0.48 COCC(C)CNC(N)=O Amb25809151 [0,2,0,0,0,0|2,0,0]=4 6247 B9R0.48 COCC(C)NCC(O)=O Amb19408155 [0,2,0,0,0,0|1,0,0]=3 6248 B9R0.48 COCC(C)OCC(N)=O Amb25146467 [0,2,0,0,0,0|2,0,0]=4 6249 B9R0.48 COCC(O)CCC(C)=O Amb24438108 [0,2,0,0,0,0|2,0,0]=4 6250 B9R0.48 COCS(=O)CCC(C)N Amb25836431 [0,2,0,0,0,0|2,0,0]=4 6251 B9R0.48 CON=C(C)CCN(C)C Amb24482691 [0,2,0,0,0,0|2,0,0]=4 6252 B9R0.48 CON=C(N)CCC(C)C Amb24450830 [0,2,0,0,0,0|1,0,0]=3 6253 B9R0.48 CON=C(N)COC(C)C Amb25787851 [0,2,0,0,0,0|2,0,0]=4 6254 B9R0.48 CONC(=N)NCC(C)C Amb24367437 [0,2,0,0,0,0|2,0,0]=4 6255 B9R0.48 CONC(=O)CCC(C)N Amb24739232 [0,2,0,0,0,0|1,0,0]=3 6256 B9R0.48 CONC(=O)CCC(C)O Amb24340509 [0,2,0,0,0,0|1,0,0]=3 6257 B9R0.48 CONC(=O)CCC(F)F Amb25305913 [0,2,0,0,0,0|2,0,0]=4 6258 B9R0.48 CONC(=O)CCN(C)C Amb25740107 [0,2,0,0,0,0|1,0,0]=3 6259 B9R0.48 CONC(=O)CNC(C)C Amb25310802 [0,2,0,0,0,0|1,0,0]=3 6260 B9R0.48 CONC(=O)COC(C)C Amb24478434 [0,2,0,0,0,0|1,0,0]=3 6261 B9R0.48 CONC(=O)NCC(C)C Amb25845982 [0,2,0,0,0,0|1,0,0]=3 6262 B9R0.48 CONC(=O)NC[C@@H](C)O Amb25027015 [0,2,0,0,0,0|2,0,0]=4 6263 B9R0.48 CSCC(=O)CCC(C)C Amb18182561 [0,2,0,0,0,0|0,1,0]=3 6264 B9R0.48 CSCC(C)COC(=O)Cl Amb25370807 [0,2,0,0,0,0|2,0,0]=4 6265 B9R0.48 CSCC(C)NCC(O)=O Amb25701279 [0,2,0,0,0,0|1,0,0]=3 6266 B9R0.48 CSS[C@@H](C)CCC(O)=O Amb25798967 [0,2,0,0,0,0|0,0,0]=2 6267 B9R0.48 CSS[C@H](C)CCC(O)=O Amb24652619 [0,2,0,0,0,0|0,0,0]=2 6268 B9R0.48 C[C@@H](CC=O)CCC(O)=O Amb24505022 [0,2,0,0,0,0|0,0,0]=2 6269 B9R0.48 C[C@@H](CCS)CCC(O)=O Amb24693959 [0,2,0,0,0,0|0,0,0]=2 6270 B9R0.48 C[C@H](CCBr)CCC(O)=O Amb24585993 [0,2,0,0,0,0|0,0,0]=2 6271 B9R0.48 C[C@H](CCO)CCC(C)=O Amb25319945 [0,2,0,0,0,0|1,0,0]=3 6272 B9R0.48 C\C(\CC=C)=C\CC(O)=O Amb24707088 [0,2,0,0,0,0|0,0,2]=4 6273 B9R0.48 C\C(\CCC(C)=O)=C/CO Amb25142674 [0,2,0,0,0,0|1,0,1]=4 6274 B9R0.48 C\C(\CCC(C)=O)=C\CO Amb25172142 [0,2,0,0,0,0|1,0,1]=4 6275 B9R0.48 C\C(\CCC(O)=O)=C/C#C Amb24460669 [0,2,0,0,0,0|0,0,2]=4 6276 B9R0.48 C\C(\CCC(O)=O)=C/CO Amb25694396 [0,2,0,0,0,0|0,0,1]=3 6277 B9R0.48 C\C(\CCC(O)=O)=C\SC Amb24520805 [0,2,0,0,0,0|0,0,1]=3 6278 B9R0.48 C\C(\CSC)=C\CC(O)=O Amb18126246 [0,2,0,0,0,0|0,0,2]=4 6279 B9R0.48 C\C=C/[C@@H](O)CCC(C)=O Amb25146706 [0,2,0,0,0,0|2,0,0]=4 6280 B9R0.48 C\C=C\C(=O)CCC(C)C Amb25713700 [0,2,0,0,0,0|1,0,0]=3 6281 B9R0.48 C\C=C\C(=O)CCC(O)=O Amb24620816 [0,2,0,0,0,0|1,0,1]=4 6282 B9R0.48 C\C=C\C(=O)CCN(C)C Amb24550530 [0,2,0,0,0,0|2,0,0]=4 6283 B9R0.48 C\C=C\C(=O)COC(C)C Amb24359955 [0,2,0,0,0,0|2,0,0]=4 6284 B9R0.48 C\C=C\C(=O)NCC(C)C Amb25138088 [0,2,0,0,0,0|2,0,0]=4 6285 B9R0.48 C\C=C\C(=O)OCC(C)C Amb15692586 [0,2,0,0,0,0|2,0,0]=4 6286 B9R0.48 C\C=C\C(C)C=CC(O)=O Amb25340463 [0,2,0,0,0,0|0,0,2]=4 6287 B9R0.48 C\C=C\C(C)CNC(N)=O Amb22365219 [0,2,0,0,0,0|2,0,0]=4 6288 B9R0.48 C\C=C\C(O)CCC(C)=O Amb25142677 [0,2,0,0,0,0|2,0,0]=4 6289 B9R0.48 C\C=C\C(O)CCC(O)=O Amb25275755 [0,2,0,0,0,0|1,0,0]=3 6290 B9R0.48 C\C=C\[C@H](O)CCC(C)=O Amb24749626 [0,2,0,0,0,0|2,0,0]=4 6291 B9R0.48 C\C=C\[C@H](O)CCC(O)=O Amb24538051 [0,2,0,0,0,0|1,0,0]=3 6292 B9R0.48 ClCCC(=O)NCC(C)C Amb1139656 [0,2,0,0,0,0|2,0,0]=4 6293 B9R0.48 Cl\C=C\C(=O)CCC(C)C Amb17594013 [0,2,0,0,0,0|1,0,0]=3 6294 B9R0.48 N#CCC(=O)CCC(O)=O Amb24053663 [0,2,0,0,0,0|1,0,1]=4 6295 B9R0.48 N#CCC(=O)NCC(C)C Amb1673126 [0,2,0,0,0,0|2,0,0]=4 6296 B9R0.48 N#CCN(CCC(=O)O)C Amb17561163 [0,2,0,0,0,0|1,0,0]=3 6297 B9R0.48 N#CCS(=O)CCC(O)=O Amb19007165 [0,2,0,0,0,0|2,0,0]=4 6298 B9R0.48 NC(CC#N)CCC(O)=O Amb24595715 [0,2,0,0,0,0|1,0,0]=3 6299 B9R0.48 NC(CCS)CCC(O)=O Amb24453471 [0,2,0,0,0,0|1,0,0]=3 6300 B9R0.48 NCCC(=O)CCC(O)=O Amb25790735 [0,2,0,0,0,0|1,0,1]=4 6301 B9R0.48 NCCC(=O)NCC(C)C Amb1131997 [0,2,0,0,0,0|2,0,0]=4 6302 B9R0.48 NN(CCO)CCC(O)=O Amb25259231 [0,2,0,0,0,0|2,0,0]=4 6303 B9R0.48 N[C@@H](CCO)CCC(O)=O Amb25756968 [0,2,0,0,0,0|1,0,0]=3 6304 B9R0.48 N[C@H](CC#N)CCC(O)=O Amb24541852 [0,2,0,0,0,0|1,0,0]=3 6305 B9R0.48 OC(=O)CCC(=O)CC=O Amb18644074 [0,2,0,0,0,0|1,0,1]=4 6306 B9R0.48 OC(=O)CCC(=O)CCO Amb25265246 [0,2,0,0,0,0|1,0,1]=4 6307 B9R0.48 OC(=O)CCS(=O)CCF Amb25040432 [0,2,0,0,0,0|2,0,0]=4 6308 B9R0.48 OC(CCS)CCC(O)=O Amb25320980 [0,2,0,0,0,0|1,0,0]=3 6309 B9R0.48 OCCC(=O)NCC(C)C Amb17334239 [0,2,0,0,0,0|1,0,0]=3 6310 B9R0.48 OCCN(CCC(=O)Cl)C Amb17142907 [0,2,0,0,0,0|2,0,0]=4 6311 B9R0.48 OCCN(CCC(=O)N)C Amb17142868 [0,2,0,0,0,0|2,0,0]=4 6312 B9R0.48 OCC[C@H](O)CCC(O)=O Amb25843738 [0,2,0,0,0,0|1,0,0]=3 6313 B9R0.64 C#CC(F)(F)CCC(O)=O Amb24447354 [0,2,0,0,0,0|1,0,1]=4 6314 B9R0.64 C#CC(NCC(=O)C)(C)C Amb1088982 [0,2,0,0,0,0|2,0,0]=4 6315 B9R0.64 CC(=C)CCC(C)(C)C=O Amb18643634 [0,2,0,0,0,0|2,0,0]=4 6316 B9R0.64 CC(=O)CCC(C)(C)C#N Amb18124540 [0,2,0,0,0,0|1,0,0]=3 6317 B9R0.64 CC(=O)CCC(C)(C)C=O Amb18643910 [0,2,0,0,0,0|1,0,0]=3 6318 B9R0.64 CC(=O)CCC(C)(Cl)C#N Amb18645254 [0,2,0,0,0,0|1,0,1]=4 6319 B9R0.64 CC(=O)CCC(C)(O)C=C Amb25087724 [0,2,0,0,0,0|1,0,1]=4 6320 B9R0.64 CC(=O)CCC(C)(O)CO Amb25713212 [0,2,0,0,0,0|1,0,0]=3 6321 B9R0.64 CC(=O)CNC(C)(C)C#C Amb22283919 [0,2,0,0,0,0|2,0,0]=4 6322 B9R0.64 CC(=O)COC(C)(C)CCl Amb25739312 [0,2,0,0,0,0|2,0,0]=4 6323 B9R0.64 CC(=O)NCC(C)(C)CN Amb25810145 [0,2,0,0,0,0|2,0,0]=4 6324 B9R0.64 CC(=O)NCC(C)(O)CO Amb25685703 [0,2,0,0,0,0|2,0,0]=4 6325 B9R0.64 CC(=O)OCC(C)(C)C#N Amb25711754 [0,2,0,0,0,0|2,0,0]=4 6326 B9R0.64 CC(=O)OCC(C)(C)C=O Amb18644119 [0,2,0,0,0,0|2,0,0]=4 6327 B9R0.64 CC(=O)OCC(C)(C)CBr Amb25350030 [0,2,0,0,0,0|2,0,0]=4 6328 B9R0.64 CC(=O)OCC(C)(C)CCl Amb24560912 [0,2,0,0,0,0|2,0,0]=4 6329 B9R0.64 CC(C)(C#C)NCC(O)=O Amb25146466 [0,2,0,0,0,0|1,0,0]=3 6330 B9R0.64 CC(C)(C#N)NCC(O)=O Amb25699825 [0,2,0,0,0,0|1,0,0]=3 6331 B9R0.64 CC(C)(C=C)OCC(O)=O Amb25359044 [0,2,0,0,0,0|1,0,0]=3 6332 B9R0.64 CC(C)(C=C)\C=C\C(O)=O Amb24377722 [0,2,0,0,0,0|0,0,2]=4 6333 B9R0.64 CC(C)(CCC(O)=O)C#C Amb24480418 [0,2,0,0,0,0|0,0,0]=2 6334 B9R0.64 CC(C)(CCC(O)=O)C=O Amb18644118 [0,2,0,0,0,0|0,0,0]=2 6335 B9R0.64 CC(C)(CCC(O)=O)N=O Amb24428514 [0,2,0,0,0,0|0,0,0]=2 6336 B9R0.64 CC(C)(CNC(N)=O)C#N Amb25220879 [0,2,0,0,0,0|2,0,0]=4 6337 B9R0.64 CC(C)(CNC(N)=O)C=C Amb25231579 [0,2,0,0,0,0|2,0,0]=4 6338 B9R0.64 CC(C)(CO)CNC(N)=O Amb18831448 [0,2,0,0,0,0|2,0,0]=4 6339 B9R0.64 CC(C)(CO)SCC(O)=O Amb24659002 [0,2,0,0,0,0|1,0,0]=3 6340 B9R0.64 CC(C)(\C=C\C(O)=O)C=O Amb18643830 [0,2,0,0,0,0|0,0,2]=4 6341 B9R0.64 CC(C)CCC(C)(C)C=O Amb24746190 [0,2,0,0,0,0|1,0,1]=4 6342 B9R0.64 CC(C)CCC(C)(N)CO Amb19009003 [0,2,0,0,0,0|1,0,1]=4 6343 B9R0.64 CC(C)CCC(C)(O)C=C Amb24674405 [0,2,0,0,0,0|1,0,1]=4 6344 B9R0.64 CC(C)CCC(C)(O)C=O Amb25133387 [0,2,0,0,0,0|0,0,1]=3 6345 B9R0.64 CC(C)CCC(C)(O)CBr Amb24557163 [0,2,0,0,0,0|1,0,1]=4 6346 B9R0.64 CC(C)CCS(=O)(=O)CCl Amb25803430 [0,2,0,0,0,0|1,0,1]=4 6347 B9R0.64 CC(C)CCS(=O)(=O)CO Amb24620912 [0,2,0,0,0,0|1,0,0]=3 6348 B9R0.64 CC(C)CCS(=O)(=O)NN Amb24538018 [0,2,0,0,0,0|1,0,1]=4 6349 B9R0.64 CC(C)OCC(C)(O)C=O Amb24412345 [0,2,0,0,0,0|1,0,1]=4 6350 B9R0.64 CC(Cl)(CCC(O)=O)N=O Amb24423829 [0,2,0,0,0,0|1,0,0]=3 6351 B9R0.64 CC(O)(CCC(O)=O)CO Amb25108439 [0,2,0,0,0,0|0,0,0]=2 6352 B9R0.64 CC(O)(CNC(N)=O)CO Amb24391888 [0,2,0,0,0,0|2,0,0]=4 6353 B9R0.64 CC(O)CCC(C)(C)C#N Amb24429540 [0,2,0,0,0,0|1,0,1]=4 6354 B9R0.64 CC(O)CCC(C)(C)C=O Amb25101824 [0,2,0,0,0,0|1,0,1]=4 6355 B9R0.64 CCC(C)(C)CCC(C)O Amb25168708 [0,2,0,0,0,0|1,0,1]=4 6356 B9R0.64 CCC(C)(C)CCC(O)=O Amb18644164 [0,2,0,0,0,0|0,0,0]=2 6357 B9R0.64 CCC(C)(C)\C=C\C(O)=O Amb24576545 [0,2,0,0,0,0|0,0,2]=4 6358 B9R0.64 CCC(C)(O)C#CC(O)=O Amb24480767 [0,2,0,0,0,0|0,0,2]=4 6359 B9R0.64 CCC(C)(O)CCB(O)O Amb25326403 [0,2,0,0,0,0|1,0,1]=4 6360 B9R0.64 CCC(C)(O)CCC(N)=O Amb25723101 [0,2,0,0,0,0|1,0,0]=3 6361 B9R0.64 CCC(C)(O)CCC(O)=O Amb25317242 [0,2,0,0,0,0|0,0,0]=2 6362 B9R0.64 CC[C@@](C)(O)CCC(O)=O Amb24461550 [0,2,0,0,0,0|0,0,0]=2 6363 B9R0.64 CC[Si](C)(C)CCC(O)=O Amb24482202 [0,2,0,0,0,0|0,1,0]=3 6364 B9R0.64 CNC(C)(C)COC(C)=O Amb24712887 [0,2,0,0,0,0|2,0,0]=4 6365 B9R0.64 CNS(=O)(=O)CCC(C)C Amb24505094 [0,2,0,0,0,0|1,0,1]=4 6366 B9R0.64 COC(C)(C)C#CC(O)=O Amb25777780 [0,2,0,0,0,0|0,0,2]=4 6367 B9R0.64 COC(C)(C)CCC(C)=O Amb25767114 [0,2,0,0,0,0|1,0,0]=3 6368 B9R0.64 COC(C)(C)CCC(C)O Amb25737740 [0,2,0,0,0,0|1,0,1]=4 6369 B9R0.64 COC(C)(C)CCC(N)=S Amb24732987 [0,2,0,0,0,0|1,1,0]=4 6370 B9R0.64 COC(C)(C)CCS([O-])=O Amb24504769 [0,2,0,0,0,0|1,0,1]=4 6371 B9R0.64 COC(C)(C)COC(=O)Cl Amb24647421 [0,2,0,0,0,0|2,0,0]=4 6372 B9R0.64 COC(C)(C)OCC(C)=O Amb24564909 [0,2,0,0,0,0|2,0,0]=4 6373 B9R0.64 COC(C)(C)\C=C\C(O)=O Amb24391131 [0,2,0,0,0,0|0,0,2]=4 6374 B9R0.64 COP(C)(=O)CCC(C)=O Amb25707535 [0,2,0,0,0,0|2,0,0]=4 6375 B9R0.64 COP(C)(=O)CCC(N)=O Amb24633997 [0,2,0,0,0,0|2,0,0]=4 6376 B9R0.64 COP(C)(=O)CCC(O)=O Amb25288153 [0,2,0,0,0,0|1,0,0]=3 6377 B9R0.64 CS(=O)CCC(C)(C)C=O Amb25229657 [0,2,0,0,0,0|2,0,0]=4 6378 B9R0.64 CS(=O)CCC(C)(C)CBr Amb25292710 [0,2,0,0,0,0|2,0,0]=4 6379 B9R0.64 CS(=O)CCC(C)(C)CO Amb24538996 [0,2,0,0,0,0|2,0,0]=4 6380 B9R0.64 C[Si](C)(CCl)CCC(O)=O Amb25337752 [0,2,0,0,0,0|0,1,0]=3 6381 B9R0.64 NCC(O)(O)CCC(O)=O Amb24401314 [0,2,0,0,0,0|1,0,0]=3 6382 B9R0.64 NCP(=O)(CCC(=O)O)O Amb1807904 [0,2,0,0,0,0|2,0,0]=4 6383 B9R0.64 OC(=O)CCC(F)(F)CBr Amb25766479 [0,2,0,0,0,0|1,0,0]=3 6384 B9R0.64 OCP(O)(=O)CCC(O)=O Amb24482433 [0,2,0,0,0,0|2,0,0]=4 6385 B9R0.10 CC(=O)CC(N)C(C)(C)C Amb24465193 [0,2,0,0,0,0|1,0,0]=3 6386 B9R0.10 CC(=O)CN(C)C(C)(C)C Amb24619991 [0,2,0,0,0,0|2,0,0]=4 6387 B9R0.10 CC(C)(C)C(Br)CC(O)=O Amb25075478 [0,2,0,0,0,0|0,0,0]=2 6388 B9R0.10 CC(C)(C)C(F)CC(O)=O Amb25282886 [0,2,0,0,0,0|0,0,0]=2 6389 B9R0.10 CC(C)(C)C(N)CC(N)=O Amb25304992 [0,2,0,0,0,0|1,0,0]=3 6390 B9R0.10 CC(C)(C)N(O)CC(O)=O Amb25744258 [0,2,0,0,0,0|1,0,0]=3 6391 B9R0.10 CC(C)(C)S(=O)CC(O)=O Amb18974534 [0,2,0,0,0,0|1,0,0]=3 6392 B9R0.10 CC(C)(C)[C@@H](N)CC(O)=O Amb19888358 [0,2,0,0,0,0|0,0,0]=2 6393 B9R0.10 CC(C)(C)[C@@H](O)CC(O)=O Amb24505172 [0,2,0,0,0,0|0,0,0]=2 6394 B9R0.10 CC(C)(C)[C@H](N)CC(N)=O Amb24541681 [0,2,0,0,0,0|1,0,0]=3 6395 B9R0.10 CC(C)(C)[C@H](N)CC(O)=O Amb19887644 [0,2,0,0,0,0|0,0,0]=2 6396 B9R0.10 CC(C)(C)[C@H]([NH3+])CC([O-])=O Amb22224981 [0,2,0,0,0,0|0,0,1]=3 6397 B9R0.10 CC(C)(O)C(O)=CC(O)=O Amb25225351 [0,2,0,0,0,0|0,0,2]=4 6398 B9R0.10 CC(C)(O)C(O)CC(O)=O Amb25808868 [0,2,0,0,0,0|0,0,0]=2 6399 B9R0.10 CC(C)CC(C)C(C)(C)O Amb25073047 [0,2,0,0,0,0|1,0,1]=4 6400 B9R0.10 CC(C)CC(C)S(=O)(=O)Cl Amb18324761 [0,2,0,0,0,0|1,0,1]=4 6401 B9R0.10 CC(C)CC(C)S(N)(=O)=O Amb18183520 [0,2,0,0,0,0|1,0,1]=4 6402 B9R0.10 CC(C)CC(Cl)C(C)(C)O Amb24366031 [0,2,0,0,0,0|1,0,1]=4 6403 B9R0.10 CC(C)CC(Cl)P(O)(O)=O Amb24440820 [0,2,0,0,0,0|1,0,0]=3 6404 B9R0.10 CC(C)CC(Cl)S(=O)(=O)Cl Amb24426946 [0,2,0,0,0,0|1,0,1]=4 6405 B9R0.10 CC(C)CC(F)P(O)(O)=O Amb24744595 [0,2,0,0,0,0|1,0,0]=3 6406 B9R0.10 CC(C)CC(N)S(O)(=O)=O Amb24390196 [0,2,0,0,0,0|1,0,0]=3 6407 B9R0.10 CC(C)CC(O)S([O-])(=O)=O Amb22475705 [0,2,0,0,0,0|1,0,1]=4 6408 B9R0.10 CC(C)C[C@H](N)C(C)(C)O Amb24378172 [0,2,0,0,0,0|1,0,1]=4 6409 B9R0.10 CC(C)NC(C)P(O)(O)=O Amb24482027 [0,2,0,0,0,0|2,0,0]=4 6410 B9R0.10 CC(CC(C)=O)[Si](C)(C)C Amb24577740 [0,2,0,0,0,0|1,1,0]=4 6411 B9R0.10 CC(CC(C)N)P(O)(O)=O Amb24692810 [0,2,0,0,0,0|2,0,0]=4 6412 B9R0.10 CC(CC(C)O)C(C)(C)C Amb24529284 [0,2,0,0,0,0|1,0,1]=4 6413 B9R0.10 CC(CC(O)=O)C(C)(C)N Amb19651352 [0,2,0,0,0,0|0,0,0]=2 6414 B9R0.10 CC(CC(O)=O)C(C)(C)N Amb21961488 [0,2,0,0,0,0|0,0,0]=2 6415 B9R0.10 CC(CC(O)=O)C(C)(F)F Amb25241872 [0,2,0,0,0,0|1,0,0]=3 6416 B9R0.10 CC(CC(O)=O)P(C)(O)=O Amb25059136 [0,2,0,0,0,0|2,0,0]=4 6417 B9R0.10 CC(CC(O)=O)S(C)(=O)=O Amb18971621 [0,2,0,0,0,0|2,0,0]=4 6418 B9R0.10 CC(NC(C)=O)C(C)(C)C Amb25082334 [0,2,0,0,0,0|2,0,0]=4 6419 B9R0.10 CC(NC(N)=O)C(C)(C)O Amb25120603 [0,2,0,0,0,0|2,0,0]=4 6420 B9R0.10 CC(O)CC(C)S(O)(=O)=O Amb24509369 [0,2,0,0,0,0|2,0,0]=4 6421 B9R0.10 CC(O)CC(N)P(O)(O)=O Amb25844516 [0,2,0,0,0,0|2,0,0]=4 6422 B9R0.10 CN(C(C)(C)C)CC(=O)O Amb17334246 [0,2,0,0,0,0|1,0,0]=3 6423 B9R0.10 CN(CC(N)=O)C(C)(C)C Amb24482395 [0,2,0,0,0,0|2,0,0]=4 6424 B9R0.10 CS(=O)CC(O)C(C)(C)C Amb25788117 [0,2,0,0,0,0|2,0,0]=4 6425 B9R0.10 CS(=O)C[C@@H](O)C(C)(C)C Amb25688626 [0,2,0,0,0,0|2,0,0]=4 6426 B9R0.10 C[C@@H](CC(O)=O)C(F)(F)F Amb25238266 [0,2,0,0,0,0|2,0,0]=4 6427 B9R0.10 C[C@@H](O)C[C@@H](O)C(C)(C)C Amb25295386 [0,2,0,0,0,0|1,0,1]=4 6428 B9R0.10 C[C@H](CC(O)=O)C(C)(C)C Amb24409482 [0,2,0,0,0,0|0,0,0]=2 6429 B9R0.10 C[C@H](CC(O)=O)C(Cl)(Cl)Cl Amb25075604 [0,2,0,0,0,0|2,0,0]=4 6430 B9R0.10 C[C@H](CC(O)=O)C(F)(F)F Amb24482309 [0,2,0,0,0,0|2,0,0]=4 6431 B9R0.10 C[C@H](NC(C)=O)C(C)(C)C Amb24760244 [0,2,0,0,0,0|2,0,0]=4 6432 B9R0.10 C[N+](C)(C)[C@H](O)CC([O-])=O Amb25795584 [0,2,0,0,0,0|1,0,1]=4 6433 B9R0.10 C\C(=C/C(O)=O)\C(C)(C)C Amb24639757 [0,2,0,0,0,0|0,0,2]=4 6434 B9R0.10 NC(C(F)(F)F)CC(=O)O Amb1091770 [0,2,0,0,0,0|2,0,0]=4 6435 B9R0.10 NC(C(F)(F)F)CC(=O)O Amb1146904 [0,2,0,0,0,0|2,0,0]=4 6436 B9R0.10 N[C@@H](CC(O)=O)C(F)(F)F Amb22388421 [0,2,0,0,0,0|2,0,0]=4 6437 B9R0.10 N[C@H](CC(O)=O)C(F)(F)F Amb20670844 [0,2,0,0,0,0|2,0,0]=4 6438 B9R0.10 N[C@H](CC(O)=O)C(F)(F)F Amb22738680 [0,2,0,0,0,0|2,0,0]=4 6439 B9R0.10 OC(=O)CC(F)C(F)(F)F Amb24472441 [0,2,0,0,0,0|2,0,0]=4 6440 B9R0.10 OC(=O)CC(S)C(F)(F)F Amb18790270 [0,2,0,0,0,0|2,0,0]=4 6441 B9R0.10 OC(C(C)(C)C)CC(=O)O Amb17232006 [0,2,0,0,0,0|0,0,0]=2 6442 B9R0.10 O[C@@H](C(F)(F)F)CC(=O)O Amb10838309 [0,2,0,0,0,0|2,0,0]=4 6443 B9R0.10 O[C@@H](CC(O)=O)C(Cl)(Cl)Cl Amb24412058 [0,2,0,0,0,0|2,0,0]=4 6444 B9R0.10 O[C@H](C(F)(F)F)CC(=O)O Amb10838307 [0,2,0,0,0,0|2,0,0]=4 6445 B9R0.11 CC(=C)C(C)(C)CC(O)=O Amb25703730 [0,2,0,0,0,0|0,0,2]=4 6446 B9R0.11 CC(=C)C(C)(N)CC(O)=O Amb22641962 [0,2,0,0,0,0|0,0,2]=4 6447 B9R0.11 CC(=C)CC(C)(O)C(O)=O Amb24763776 [0,2,0,0,0,0|0,0,2]=4 6448 B9R0.11 CC(=C)C[C@@](C)(F)C(O)=O Amb25378746 [0,2,0,0,0,0|0,0,2]=4 6449 B9R0.11 CC(=O)C(C)(Br)CC(O)=O Amb24682759 [0,2,0,0,0,0|1,0,1]=4 6450 B9R0.11 CC(=O)C(C)(C)CN(C)C Amb19267109 [0,2,0,0,0,0|2,0,0]=4 6451 B9R0.11 CC(=O)C(C)(O)CC(O)=O Amb25733298 [0,2,0,0,0,0|1,0,1]=4 6452 B9R0.11 CC(=O)C(C)(O)CN(C)C Amb24422547 [0,2,0,0,0,0|2,0,0]=4 6453 B9R0.11 CC(=O)CC(C)(C)C(O)=O Amb18644092 [0,2,0,0,0,0|1,0,1]=4 6454 B9R0.11 CC(=O)CC(C)(C)N(C)C Amb24480612 [0,2,0,0,0,0|2,0,0]=4 6455 B9R0.11 CC(=S)C(C)(C)CC(O)=O Amb25227469 [0,2,0,0,0,0|1,0,1]=4 6456 B9R0.11 CC(C)(CC(F)F)C(O)=O Amb24395430 [0,2,0,0,0,0|2,0,0]=4 6457 B9R0.11 CC(C)=CC(C)(O)C(O)=O Amb24666586 [0,2,0,0,0,0|0,0,2]=4 6458 B9R0.11 CC(C)C(C)(C)CC(C)=O Amb24387871 [0,2,0,0,0,0|1,0,0]=3 6459 B9R0.11 CC(C)C(C)(C)CC(O)=O Amb18124695 [0,2,0,0,0,0|0,0,0]=2 6460 B9R0.11 CC(C)C(C)(C)NC(C)=O Amb22723319 [0,2,0,0,0,0|2,0,0]=4 6461 B9R0.11 CC(C)C(C)(F)CC(O)=O Amb24665956 [0,2,0,0,0,0|0,0,0]=2 6462 B9R0.11 CC(C)C(C)(O)CC(N)=S Amb25129958 [0,2,0,0,0,0|1,1,0]=4 6463 B9R0.11 CC(C)C(C)(O)CC(O)=O Amb18991699 [0,2,0,0,0,0|0,0,0]=2 6464 B9R0.11 CC(C)CC(C)(C)[N+]([O-])=O Amb25224520 [0,2,0,0,0,0|1,0,1]=4 6465 B9R0.11 CC(C)CC(C)(N)C(N)=O Amb18288986 [0,2,0,0,0,0|1,0,0]=3 6466 B9R0.11 CC(C)CC(C)(O)C(C)=C Amb25147809 [0,2,0,0,0,0|2,0,0]=4 6467 B9R0.11 CC(C)CC(C)(O)C(N)=O Amb25686400 [0,2,0,0,0,0|1,0,0]=3 6468 B9R0.11 CC(C)CC(C)(O)C(O)=O Amb18523766 [0,2,0,0,0,0|0,0,0]=2 6469 B9R0.11 CC(C)CC(F)(F)C(O)=O Amb25773701 [0,2,0,0,0,0|0,0,0]=2 6470 B9R0.11 CC(C)C[C@@](C)(O)C(O)=O Amb25744207 [0,2,0,0,0,0|0,0,0]=2 6471 B9R0.11 CC(C)C[C@](C)(O)C(O)=O Amb24763710 [0,2,0,0,0,0|0,0,0]=2 6472 B9R0.11 CC(C)NC(C)(C)C(C)=O Amb25710340 [0,2,0,0,0,0|2,0,0]=4 6473 B9R0.11 CC(C)NC(C)(C)C(N)=O Amb18970336 [0,2,0,0,0,0|2,0,0]=4 6474 B9R0.11 CC(C)OC(C)(C)C(C)=O Amb25026501 [0,2,0,0,0,0|2,0,0]=4 6475 B9R0.11 CC(C)OC(C)(C)C(O)=O Amb18976739 [0,2,0,0,0,0|1,0,0]=3 6476 B9R0.11 CC(C)OC(F)(F)C(O)=O Amb18987261 [0,2,0,0,0,0|1,0,0]=3 6477 B9R0.11 CC(C)SC(F)(F)C(O)=O Amb23586507 [0,2,0,0,0,0|1,0,0]=3 6478 B9R0.11 CC(C)[C@@](C)(N)CC(O)=O Amb19929555 [0,2,0,0,0,0|0,0,0]=2 6479 B9R0.11 CC(C)[C@](C)(N)CC(O)=O Amb19929556 [0,2,0,0,0,0|0,0,0]=2 6480 B9R0.11 CC(C)[N+](C)(C)CC(O)=O Amb24740673 [0,2,0,0,0,0|1,0,0]=3 6481 B9R0.11 CC(CC(C(=O)C)(O)C)C Amb17593631 [0,2,0,0,0,0|1,0,0]=3 6482 B9R0.11 CC(CC(C(=O)O)(C)C)C Amb10843993 [0,2,0,0,0,0|0,0,0]=2 6483 B9R0.11 CC(CC(C(O)C)(O)C)C Amb17593663 [0,2,0,0,0,0|1,0,1]=4 6484 B9R0.11 CC(C[C@@](C(=O)O)(N)C)C Amb10066904 [0,2,0,0,0,0|0,0,0]=2 6485 B9R0.11 CC(O)CC(C)(C)C(O)=O Amb25230577 [0,2,0,0,0,0|1,0,0]=3 6486 B9R0.11 CC(O)CC(C)(O)C(O)=O Amb25265252 [0,2,0,0,0,0|1,0,0]=3 6487 B9R0.11 CC(SC(C(=O)O)(C)C)C Amb17501486 [0,2,0,0,0,0|1,0,0]=3 6488 B9R0.11 CN(C)CC(C)(C)C(N)=O Amb25147373 [0,2,0,0,0,0|2,0,0]=4 6489 B9R0.11 CN(C)CC(C)(N)C(N)=O Amb18292672 [0,2,0,0,0,0|2,0,0]=4 6490 B9R0.11 CN(C)CC(C)(N)C(O)=O Amb18294465 [0,2,0,0,0,0|1,0,0]=3 6491 B9R0.11 CN(C)CC(C)(O)C(N)=O Amb25305273 [0,2,0,0,0,0|2,0,0]=4 6492 B9R0.11 CN(C)CC(C)(O)C(O)=O Amb24480768 [0,2,0,0,0,0|1,0,0]=3 6493 B9R0.11 CN(C)CC(F)(F)C(O)=O Amb25857752 [0,2,0,0,0,0|1,0,0]=3 6494 B9R0.11 CN(C)C[C@](C)(O)C(O)=O Amb24460062 [0,2,0,0,0,0|1,0,0]=3 6495 B9R0.11 CN(C)NC(C)(C)C(O)=O Amb24701797 [0,2,0,0,0,0|2,0,0]=4 6496 B9R0.11 CN(CC(C(=O)O)(C)C)C Amb17334247 [0,2,0,0,0,0|1,0,0]=3 6497 B9R0.39 CC(=C)CC(CC)C(O)=O Amb24480742 [0,2,0,0,0,0|0,0,2]=4 6498 B9R0.39 CC(=O)C(CC(C)C)=CO Amb24676877 [0,2,0,0,0,0|1,0,1]=4 6499 B9R0.39 CC(=O)C(CC(C)C)=NO Amb24598980 [0,2,0,0,0,0|1,0,1]=4 6500 B9R0.39 CC(=O)C(CC(O)=O)CC Amb24410015 [0,2,0,0,0,0|1,0,1]=4 6501 B9R0.39 CC(=O)C(CC(O)=O)NC Amb18611382 [0,2,0,0,0,0|1,0,1]=4 6502 B9R0.39 CC(=O)CC(CC)C(O)=O Amb18644109 [0,2,0,0,0,0|1,0,1]=4 6503 B9R0.39 CC(=O)CC(NC)C(O)=O Amb25690263 [0,2,0,0,0,0|1,0,1]=4 6504 B9R0.39 CC(=O)C\C(=C\C)\C(C)C Amb25265231 [0,2,0,0,0,0|1,0,1]=4 6505 B9R0.39 CC(=O)\C(\CC(C)C)=N/O Amb25348566 [0,2,0,0,0,0|1,0,1]=4 6506 B9R0.39 CC(C)=C(CC(O)=O)C#N Amb25848479 [0,2,0,0,0,0|0,0,2]=4 6507 B9R0.39 CC(C)=C(CC(O)=O)C=O Amb18643815 [0,2,0,0,0,0|0,0,2]=4 6508 B9R0.39 CC(C)=CC(OC)C(O)=O Amb20621506 [0,2,0,0,0,0|0,0,2]=4 6509 B9R0.39 CC(C)C(C#C)OC(N)=O Amb25147606 [0,2,0,0,0,0|2,0,0]=4 6510 B9R0.39 CC(C)C(C#N)NC(N)=O Amb25785816 [0,2,0,0,0,0|2,0,0]=4 6511 B9R0.39 CC(C)C(C#N)OC(C)=O Amb25711523 [0,2,0,0,0,0|2,0,0]=4 6512 B9R0.39 CC(C)C(C=C)NC(C)=O Amb25275509 [0,2,0,0,0,0|2,0,0]=4 6513 B9R0.39 CC(C)C(C=O)NC(C)=O Amb24374925 [0,2,0,0,0,0|2,0,0]=4 6514 B9R0.39 CC(C)C(C=O)OC(C)=O Amb18644098 [0,2,0,0,0,0|2,0,0]=4 6515 B9R0.39 CC(C)C(CC(C)=C)C=O Amb24461761 [0,2,0,0,0,0|2,0,0]=4 6516 B9R0.39 CC(C)C(CC(C)=C)NN Amb24643631 [0,2,0,0,0,0|2,0,0]=4 6517 B9R0.39 CC(C)C(CC(C)=O)CC Amb25041005 [0,2,0,0,0,0|1,0,0]=3 6518 B9R0.39 CC(C)C(CC(C)=O)OC Amb24478344 [0,2,0,0,0,0|1,0,0]=3 6519 B9R0.39 CC(C)C(CC(C)O)CO Amb25051409 [0,2,0,0,0,0|1,0,1]=4 6520 B9R0.39 CC(C)C(CC(C)O)NC Amb24445614 [0,2,0,0,0,0|1,0,1]=4 6521 B9R0.39 CC(C)C(CC(N)=N)OC Amb24671878 [0,2,0,0,0,0|2,0,0]=4 6522 B9R0.39 CC(C)C(CC(N)=O)CN Amb25177753 [0,2,0,0,0,0|1,0,0]=3 6523 B9R0.39 CC(C)C(CC(N)=O)NC Amb25738895 [0,2,0,0,0,0|1,0,0]=3 6524 B9R0.39 CC(C)C(CC(N)=S)OC Amb25094283 [0,2,0,0,0,0|1,1,0]=4 6525 B9R0.39 CC(C)C(CC(O)=O)C#N Amb25818234 [0,2,0,0,0,0|0,0,0]=2 6526 B9R0.39 CC(C)C(CC(O)=O)C=C Amb18643903 [0,2,0,0,0,0|0,0,0]=2 6527 B9R0.39 CC(C)C(CC(O)=O)CC Amb18304202 [0,2,0,0,0,0|0,0,0]=2 6528 B9R0.39 CC(C)C(CC(O)=O)SC Amb25858344 [0,2,0,0,0,0|0,0,0]=2 6529 B9R0.39 CC(C)C(CC([O-])=O)C=O Amb25094387 [0,2,0,0,0,0|0,0,1]=3 6530 B9R0.39 CC(C)C(CC)NC(C)=O Amb24382327 [0,2,0,0,0,0|2,0,0]=4 6531 B9R0.39 CC(C)C(CC)NC(N)=O Amb24478066 [0,2,0,0,0,0|2,0,0]=4 6532 B9R0.39 CC(C)C(CC)OC(N)=O Amb25793071 [0,2,0,0,0,0|2,0,0]=4 6533 B9R0.39 CC(C)C(CN)CC(C)O Amb25709727 [0,2,0,0,0,0|1,0,1]=4 6534 B9R0.39 CC(C)C(CN)NC(C)=O Amb18251274 [0,2,0,0,0,0|2,0,0]=4 6535 B9R0.39 CC(C)C(CN)NC(N)=O Amb18251283 [0,2,0,0,0,0|2,0,0]=4 6536 B9R0.39 CC(C)C(CO)NC(N)=O Amb24479041 [0,2,0,0,0,0|2,0,0]=4 6537 B9R0.39 CC(C)C(CS(C)=O)C#N Amb24699438 [0,2,0,0,0,0|2,0,0]=4 6538 B9R0.39 CC(C)C(CS(C)=O)ON Amb24569206 [0,2,0,0,0,0|2,0,0]=4 6539 B9R0.39 CC(C)C(CS)NC(C)=O Amb24624696 [0,2,0,0,0,0|2,0,0]=4 6540 B9R0.39 CC(C)CC(=NO)C(O)=O Amb24669467 [0,2,0,0,0,0|0,0,1]=3 6541 B9R0.39 CC(C)CC(C#N)C(C)=O Amb24731730 [0,2,0,0,0,0|1,0,0]=3 6542 B9R0.39 CC(C)CC(C#N)C(O)=O Amb23558965 [0,2,0,0,0,0|0,0,0]=2 6543 B9R0.39 CC(C)CC(CC)C(=O)Cl Amb24383278 [0,2,0,0,0,0|1,0,0]=3 6544 B9R0.39 CC(C)CC(CC)C(C)=O Amb25805780 [0,2,0,0,0,0|1,0,0]=3 6545 B9R0.39 CC(C)CC(CC)C(C)O Amb24747320 [0,2,0,0,0,0|1,0,1]=4 6546 B9R0.39 CC(C)CC(CC)C(O)=O Amb19014184 [0,2,0,0,0,0|0,0,0]=2 6547 B9R0.39 CC(C)CC(CF)C(O)=O Amb24596212 [0,2,0,0,0,0|0,0,0]=2 6548 B9R0.39 CC(C)CC(CN)C(N)=O Amb24333087 [0,2,0,0,0,0|1,0,0]=3 6549 B9R0.39 CC(C)CC(CN)C(O)=O Amb19021764 [0,2,0,0,0,0|0,0,0]=2 6550 B9R0.39 CC(C)CC(CO)C(O)=O Amb18124780 [0,2,0,0,0,0|0,0,0]=2 6551 B9R0.39 CC(C)CC(CS)C(N)=O Amb24695162 [0,2,0,0,0,0|1,0,0]=3 6552 B9R0.39 CC(C)CC(NC)C(C)=C Amb24353318 [0,2,0,0,0,0|2,0,0]=4 6553 B9R0.39 CC(C)CC(NC)C(N)=O Amb19006600 [0,2,0,0,0,0|1,0,0]=3 6554 B9R0.39 CC(C)CC(NC)C(O)=O Amb22274694 [0,2,0,0,0,0|0,0,0]=2 6555 B9R0.39 CC(C)CC(NN)C(C)=C Amb25281261 [0,2,0,0,0,0|2,0,0]=4 6556 B9R0.39 CC(C)CC(NN)C(O)=O Amb18644273 [0,2,0,0,0,0|0,0,0]=2 6557 B9R0.39 CC(C)CC(NO)C(N)=O Amb25294339 [0,2,0,0,0,0|1,0,0]=3 6558 B9R0.39 CC(C)CC(ON)C(O)=O Amb18644321 [0,2,0,0,0,0|0,0,0]=2 6559 B9R0.39 CC(C)CN(N=O)C(N)=O Amb25809440 [0,2,0,0,0,0|2,0,0]=4 6560 B9R0.39 CC(C)C[C@@H](CN)C(O)=O Amb22756732 [0,2,0,0,0,0|0,0,0]=2 6561 B9R0.39 CC(C)C[C@@H](CN)C(O)=O Amb22756740 [0,2,0,0,0,0|0,0,0]=2 6562 B9R0.39 CC(C)C[C@@H](NC)C(O)=O Amb22745995 [0,2,0,0,0,0|0,0,0]=2 6563 B9R0.39 CC(C)C[C@H](CO)C(O)=O Amb25214140 [0,2,0,0,0,0|0,0,0]=2 6564 B9R0.39 CC(C)C[C@H](NC)C(N)=O Amb24550819 [0,2,0,0,0,0|1,0,0]=3 6565 B9R0.39 CC(C)C[C@H](NCl)C(O)=O Amb24563420 [0,2,0,0,0,0|0,0,0]=2 6566 B9R0.39 CC(C)C[C@H](ON)C(O)=O Amb24505012 [0,2,0,0,0,0|0,0,0]=2 6567 B9R0.39 CC(C)N(CC(N)=O)C#N Amb24731187 [0,2,0,0,0,0|2,0,0]=4 6568 B9R0.39 CC(C)N(CC(N)=O)C=O Amb24616190 [0,2,0,0,0,0|2,0,0]=4 6569 B9R0.39 CC(C)N(CC(O)=O)C=O Amb18972732 [0,2,0,0,0,0|1,0,0]=3 6570 B9R0.39 CC(C)NC(C=C)C(O)=O Amb24481162 [0,2,0,0,0,0|1,0,0]=3 6571 B9R0.39 CC(C)NC(CC)C(N)=O Amb19006566 [0,2,0,0,0,0|2,0,0]=4 6572 B9R0.39 CC(C)N[C@@H](CO)C(O)=O Amb24587694 [0,2,0,0,0,0|1,0,0]=3 6573 B9R0.39 CC(C)N[C@@H](CS)C(O)=O Amb25299344 [0,2,0,0,0,0|1,0,0]=3 6574 B9R0.39 CC(C)N[C@H](CO)C(N)=O Amb24451366 [0,2,0,0,0,0|2,0,0]=4 6575 B9R0.39 CC(C)N[C@H](CO)C(O)=O Amb25099258 [0,2,0,0,0,0|1,0,0]=3 6576 B9R0.39 CC(C)N[C@H](CS)C(O)=O Amb25851404 [0,2,0,0,0,0|1,0,0]=3 6577 B9R0.39 CC(C)OC(C=C)C(O)=O Amb18644139 [0,2,0,0,0,0|1,0,0]=3 6578 B9R0.39 CC(C)OC(CC)C(O)=O Amb25723566 [0,2,0,0,0,0|1,0,0]=3 6579 B9R0.39 CC(C)SC(CC)C(N)=O Amb18788099 [0,2,0,0,0,0|2,0,0]=4 6580 B9R0.39 CC(C)SC(CO)C(O)=O Amb25172117 [0,2,0,0,0,0|1,0,0]=3 6581 B9R0.39 CC(C)[C@@H](C#N)NC(N)=O Amb24478993 [0,2,0,0,0,0|2,0,0]=4 6582 B9R0.39 CC(C)[C@@H](C=C)NC(C)=O Amb24370357 [0,2,0,0,0,0|2,0,0]=4 6583 B9R0.39 CC(C)[C@@H](C=O)OC(C)=O Amb24679764 [0,2,0,0,0,0|2,0,0]=4 6584 B9R0.39 CC(C)[C@@H](CBr)OC(C)=O Amb24505068 [0,2,0,0,0,0|2,0,0]=4 6585 B9R0.39 CC(C)[C@@H](CC(C)=O)CC Amb24758695 [0,2,0,0,0,0|1,0,0]=3 6586 B9R0.39 CC(C)[C@@H](CS)NC(C)=O Amb25260420 [0,2,0,0,0,0|2,0,0]=4 6587 B9R0.39 CC(C)\C=C(\C#N)/C(O)=O Amb18285132 [0,2,0,0,0,0|0,0,2]=4 6588 B9R0.39 CC(N)C(CC(O)=O)CC Amb23536772 [0,2,0,0,0,0|1,0,0]=3 6589 B9R0.39 CC(N)NC(CO)C(O)=O Amb25367822 [0,2,0,0,0,0|2,0,0]=4 6590 B9R0.39 CC(O)C(CC(O)=O)CC Amb18831453 [0,2,0,0,0,0|1,0,0]=3 6591 B9R0.39 CC(O)C(CC(O)=O)NC Amb24400678 [0,2,0,0,0,0|1,0,0]=3 6592 B9R0.39 CCC(=CC(C)C)C(O)=O Amb25174738 [0,2,0,0,0,0|0,0,2]=4 6593 B9R0.39 CCC(C(=O)O)SC(C)C Amb17501347 [0,2,0,0,0,0|1,0,0]=3 6594 B9R0.39 CCC(CC(F)F)C(O)=O Amb25709926 [0,2,0,0,0,0|2,0,0]=4 6595 B9R0.39 CCC(CC(O)=O)N(C)C Amb18316272 [0,2,0,0,0,0|1,0,0]=3 6596 B9R0.39 CCC(NN(C)C)C(O)=O Amb24479538 [0,2,0,0,0,0|2,0,0]=4 6597 B9R0.39 CCN(CC(N)=O)C(C)C Amb24455864 [0,2,0,0,0,0|2,0,0]=4 6598 B9R0.39 CC\C(=C/C(O)=O)\C(C)C Amb18967765 [0,2,0,0,0,0|0,0,2]=4 6599 B9R0.39 CC\C(=C\C(C)C)\C(O)=O Amb25368298 [0,2,0,0,0,0|0,0,2]=4 6600 B9R0.39 CN(C)C(CC(N)=O)CN Amb25718298 [0,2,0,0,0,0|2,0,0]=4 6601 B9R0.39 CN(C)C(CC(O)=O)CO Amb18202308 [0,2,0,0,0,0|1,0,0]=3 6602 B9R0.39 CN(C)CC(CN)C(N)=O Amb24383057 [0,2,0,0,0,0|2,0,0]=4 6603 B9R0.39 CN(C)NC(C=C)C(O)=O Amb25846525 [0,2,0,0,0,0|2,0,0]=4 6604 B9R0.39 CNC(CN(C)C)C(N)=O Amb24351287 [0,2,0,0,0,0|2,0,0]=4 6605 B9R0.39 CN[C@@H](C(=O)O)CC(C)C Amb10842218 [0,2,0,0,0,0|0,0,0]=2 6606 B9R0.39 CN[C@H](C(=O)O)CC(C)C Amb16183858 [0,2,0,0,0,0|0,0,0]=2 6607 B9R0.39 C[C@H](O)[C@@H](CC(O)=O)NC Amb24460369 [0,2,0,0,0,0|1,0,0]=3 6608 B9R0.39 C[SiH](C)NC(CO)C(O)=O Amb24557183 [0,2,0,0,0,0|1,1,0]=4 6609 B9R0.39 C[SiH](C)N[C@@H](CO)C(O)=O Amb25061339 [0,2,0,0,0,0|1,1,0]=4 6610 B9R0.39 C\C=C(\CC(C)C)/C(O)=O Amb18643920 [0,2,0,0,0,0|0,0,1]=3 6611 B9R0.39 C\C=C(\OC(C)C)/C(O)=O Amb24597294 [0,2,0,0,0,0|1,0,1]=4 6612 B9R0.39 N#CC(C(C)C)NC(=O)C Amb17399848 [0,2,0,0,0,0|2,0,0]=4 6613 B9R0.39 OC(=O)CC(CF)C(F)F Amb24513956 [0,2,0,0,0,0|2,0,0]=4 6614 B9R0.39 OCC(C(C)C)NC(=O)C Amb17102545 [0,2,0,0,0,0|2,0,0]=4 6615 B9R0.39 OCC(CC(F)F)C(O)=O Amb24514099 [0,2,0,0,0,0|2,0,0]=4 6616 B9R0.57 BrC(C(=O)O)CC(F)(F)F Amb10841945 [0,2,0,0,0,0|2,0,0]=4 6617 B9R0.57 C([2H])(CC(C(=O)O)N)([2H])[2H] Amb17607913 [0,2,0,0,0,0|2,0,0]=4 6618 B9R0.57 CC(=C)C(F)CC(C)(C)N Amb25730565 [0,2,0,0,0,0|2,0,0]=4 6619 B9R0.57 CC(=C)C(N)CC(C)(C)C Amb24714274 [0,2,0,0,0,0|2,0,0]=4 6620 B9R0.57 CC(=NC(C)(C)C)C(O)=O Amb25736250 [0,2,0,0,0,0|1,0,1]=4 6621 B9R0.57 CC(=O)C(=O)CC(C)(C)C Amb24478141 [0,2,0,0,0,0|1,0,1]=4 6622 B9R0.57 CC(=O)C(Cl)CC(C)(C)C Amb25280760 [0,2,0,0,0,0|1,0,0]=3 6623 B9R0.57 CC(=O)C(N)OC(C)(C)C Amb24718655 [0,2,0,0,0,0|2,0,0]=4 6624 B9R0.57 CC(=O)C(NC(C)(C)C)C Amb2370009 [0,2,0,0,0,0|2,0,0]=4 6625 B9R0.57 CC(=O)N(C)CC(C)(C)O Amb24392062 [0,2,0,0,0,0|2,0,0]=4 6626 B9R0.57 CC(=O)[C@H](N)OC(C)(C)C Amb25042352 [0,2,0,0,0,0|2,0,0]=4 6627 B9R0.57 CC(C(=O)O)CC(F)(F)F Amb10605557 [0,2,0,0,0,0|2,0,0]=4 6628 B9R0.57 CC(C(=O)O)NC(C)(C)C Amb17399895 [0,2,0,0,0,0|1,0,0]=3 6629 B9R0.57 CC(C)(C)CC(Br)C(O)=O Amb25324184 [0,2,0,0,0,0|0,0,0]=2 6630 B9R0.57 CC(C)(C)CC(Cl)C(N)=O Amb18788248 [0,2,0,0,0,0|1,0,0]=3 6631 B9R0.57 CC(C)(C)CC(Cl)C(O)=O Amb25281140 [0,2,0,0,0,0|0,0,0]=2 6632 B9R0.57 CC(C)(C)CC(F)C(O)=O Amb25107249 [0,2,0,0,0,0|0,0,0]=2 6633 B9R0.57 CC(C)(C)CC(N)C(N)=O Amb19000296 [0,2,0,0,0,0|1,0,0]=3 6634 B9R0.57 CC(C)(C)CC(N)P(O)=O Amb24695250 [0,2,0,0,0,0|1,0,0]=3 6635 B9R0.57 CC(C)(C)CC(O)C(O)=O Amb18302187 [0,2,0,0,0,0|0,0,0]=2 6636 B9R0.57 CC(C)(C)C[C@@H](N)C(N)=O Amb24457334 [0,2,0,0,0,0|1,0,0]=3 6637 B9R0.57 CC(C)(C)C[C@@H](O)C(O)=O Amb22057813 [0,2,0,0,0,0|0,0,0]=2 6638 B9R0.57 CC(C)(C)C[C@H](O)C(O)=O Amb25727583 [0,2,0,0,0,0|0,0,0]=2 6639 B9R0.57 CC(C)(C)NC(O)C(O)=O Amb24641288 [0,2,0,0,0,0|1,0,0]=3 6640 B9R0.57 CC(C)(C)OC(=C)C(O)=O Amb18644144 [0,2,0,0,0,0|1,0,1]=4 6641 B9R0.57 CC(C)(C)OC(=O)C(O)=O Amb18644247 [0,2,0,0,0,0|1,0,1]=4 6642 B9R0.57 CC(C)(C)\C=C(\F)/C(O)=O Amb25350683 [0,2,0,0,0,0|0,0,2]=4 6643 B9R0.57 CC(C)(Cl)C[C@H](N)C(O)=O Amb24711368 [0,2,0,0,0,0|0,0,0]=2 6644 B9R0.57 CC(C)(F)C[C@@H](N)C(O)=O Amb24055873 [0,2,0,0,0,0|0,0,0]=2 6645 B9R0.57 CC(C)(N)CC(N)C(O)=O Amb25195464 [0,2,0,0,0,0|0,0,0]=2 6646 B9R0.57 CC(C)(O)CC(N)C(O)=O Amb18644326 [0,2,0,0,0,0|0,0,0]=2 6647 B9R0.57 CC(C)(O)C[C@@H](N)C(O)=O Amb24479570 [0,2,0,0,0,0|0,0,0]=2 6648 B9R0.57 CC(C)C(C)CS(=O)(=O)Cl Amb25300919 [0,2,0,0,0,0|1,0,1]=4 6649 B9R0.57 CC(C)C(C)OP(C)(O)=O Amb25104688 [0,2,0,0,0,0|2,0,0]=4 6650 B9R0.57 CC(C)C(N)CP(C)(O)=O Amb24663118 [0,2,0,0,0,0|1,0,0]=3 6651 B9R0.57 CC(C)C(N)CS(C)(=O)=O Amb18991419 [0,2,0,0,0,0|1,0,1]=4 6652 B9R0.57 CC(C)C(N)CS(N)(=O)=O Amb24669729 [0,2,0,0,0,0|1,0,1]=4 6653 B9R0.57 CC(C)C(O)CC(C)(C)O Amb25283197 [0,2,0,0,0,0|1,0,1]=4 6654 B9R0.57 CC(C)C(O)CS(C)(=O)=O Amb18801119 [0,2,0,0,0,0|1,0,1]=4 6655 B9R0.57 CC(C)C(O)CS([O-])(=O)=O Amb25150760 [0,2,0,0,0,0|1,0,1]=4 6656 B9R0.57 CC(C)[C@@H](N)CP(O)(O)=O Amb24626120 [0,2,0,0,0,0|1,0,0]=3 6657 B9R0.57 CC(C)[C@@H](N)CS(O)(=O)=O Amb24509501 [0,2,0,0,0,0|1,0,0]=3 6658 B9R0.57 CC(C)[C@H](N)CS(O)(=O)=O Amb24529309 [0,2,0,0,0,0|1,0,0]=3 6659 B9R0.57 CC(CC(C)(C)C)C(C)=O Amb25044332 [0,2,0,0,0,0|1,0,0]=3 6660 B9R0.57 CC(CC(C)(C)C)C(N)=O Amb25147579 [0,2,0,0,0,0|1,0,0]=3 6661 B9R0.57 CC(CC(C)(C)C)C(O)=O Amb18124693 [0,2,0,0,0,0|0,0,0]=2 6662 B9R0.57 CC(CC(C)(C)N)C(O)=O Amb22364426 [0,2,0,0,0,0|0,0,0]=2 6663 B9R0.57 CC(CC(C)(C)O)C(C)=O Amb25141586 [0,2,0,0,0,0|1,0,0]=3 6664 B9R0.57 CC(CC(C)(C)O)C(O)=O Amb24529313 [0,2,0,0,0,0|0,0,0]=2 6665 B9R0.57 CC(CS(C)(=O)=O)C(O)=O Amb18971622 [0,2,0,0,0,0|2,0,0]=4 6666 B9R0.57 CC(F)(F)CC(S)C(O)=O Amb24677777 [0,2,0,0,0,0|1,0,0]=3 6667 B9R0.57 CC(O)C(C)CC(C)(C)O Amb25266535 [0,2,0,0,0,0|1,0,1]=4 6668 B9R0.57 CC(SC(C)(C)C)C(O)=O Amb25341387 [0,2,0,0,0,0|1,0,0]=3 6669 B9R0.57 CN(CC(C)(C)C)C(N)=O Amb25341123 [0,2,0,0,0,0|2,0,0]=4 6670 B9R0.57 CN(CC(C)(C)O)C(N)=O Amb24513578 [0,2,0,0,0,0|2,0,0]=4 6671 B9R0.57 CS(=N)(=O)CC(N)C(O)=O Amb24732321 [0,2,0,0,0,0|2,0,0]=4 6672 B9R0.57 CS(=O)(=O)CC(O)C(O)=O Amb24398186 [0,2,0,0,0,0|2,0,0]=4 6673 B9R0.57 C[C@@H](CS(C)(=O)=O)C(O)=O Amb24652197 [0,2,0,0,0,0|2,0,0]=4 6674 B9R0.57 C[C@@H](N)C(O)CP(O)(O)=O Amb25117717 [0,2,0,0,0,0|2,0,0]=4 6675 B9R0.57 C[C@@H](OC(C)(C)C)C(O)=O Amb25700452 [0,2,0,0,0,0|1,0,0]=3 6676 B9R0.57 C[C@H](CS(C)(=O)=O)C(O)=O Amb24436447 [0,2,0,0,0,0|2,0,0]=4 6677 B9R0.57 C[C@H](N[Si](C)(C)C)C(O)=O Amb25765675 [0,2,0,0,0,0|1,1,0]=4 6678 B9R0.57 C[C@H](OC(C)(C)C)C(O)=O Amb25111514 [0,2,0,0,0,0|1,0,0]=3 6679 B9R0.57 C[C@H](SC(C)(C)C)C(O)=O Amb25074461 [0,2,0,0,0,0|1,0,0]=3 6680 B9R0.57 C[N+](C)(C)CC(Br)C(O)=O Amb24079933 [0,2,0,0,0,0|1,0,0]=3 6681 B9R0.57 C[N+](C)(C)C[C@H](O)C([O-])=O Amb25763983 [0,2,0,0,0,0|1,0,1]=4 6682 B9R0.57 C[S@](=N)(=O)C[C@H](N)C(O)=O Amb25749061 [0,2,0,0,0,0|2,0,0]=4 6683 B9R0.57 C[Si](C)(C)CC(=C)C(O)=O Amb25774813 [0,2,0,0,0,0|0,1,1]=4 6684 B9R0.57 C[Si](C)(C)CC(Cl)C(=O)Cl Amb24563743 [0,2,0,0,0,0|1,1,0]=4 6685 B9R0.57 C[Si](C)(C)C[C@H](N)C(O)=O Amb24482244 [0,2,0,0,0,0|0,1,0]=3 6686 B9R0.57 C[Si](C)(O)CC(N)C(O)=O Amb25060652 [0,2,0,0,0,0|0,1,0]=3 6687 B9R0.57 C\C(=C/C(C)(C)C)\C(O)=O Amb18643948 [0,2,0,0,0,0|0,0,2]=4 6688 B9R0.57 NC(C(=O)O)CC(F)(F)F Amb10603542 [0,2,0,0,0,0|2,0,0]=4 6689 B9R0.57 NC(CC(Cl)(Cl)Cl)C(O)=O Amb24399501 [0,2,0,0,0,0|2,0,0]=4 6690 B9R0.57 N[C@@H](C(=O)O)CC(C)(C)C Amb16184025 [0,2,0,0,0,0|0,0,0]=2 6691 B9R0.57 N[C@@H](CC(F)(F)F)C(O)=O Amb19889287 [0,2,0,0,0,0|2,0,0]=4 6692 B9R0.57 N[C@H](CC(F)(F)F)C(O)=O Amb19889286 [0,2,0,0,0,0|2,0,0]=4 6693 B9R0.57 OC(=O)C(Cl)CC(F)(F)Cl Amb24683924 [0,2,0,0,0,0|2,0,0]=4 6694 B9R0.57 OC(=O)C(F)CC(F)(F)F Amb25701547 [0,2,0,0,0,0|2,0,0]=4 6695 B9R0.57 OC(=O)C(S)CC(F)(F)F Amb25257404 [0,2,0,0,0,0|2,0,0]=4 6696 B9R0.57 OC(=O)[C@H](C[C](=O)(O)C)N Amb10604178 [0,2,0,0,0,0|1,0,1]=4 6697 B9R0.57 OC(CC(F)(F)F)C(O)=O Amb24482207 [0,2,0,0,0,0|2,0,0]=4 6698 B9R0.57 O[C@@H](CC(F)(F)F)C(O)=O Amb24594513 [0,2,0,0,0,0|2,0,0]=4 6699 B9R0.57 [2H]C([2H])([2H])C[C@@H](N)C(O)=O Amb19130400 [0,2,0,0,0,0|2,0,0]=4 6700 B9R0.79 CC(=C)C(O)C(C)C(O)=O Amb18644101 [0,2,0,0,0,0|0,0,2]=4 6701 B9R0.79 CC(=C)[C@@H](C)[C@H](C)C(O)=O Amb24480381 [0,2,0,0,0,0|0,0,2]=4 6702 B9R0.79 CC(=C)[C@@H](O)[C@H](C)C(O)=O Amb24599978 [0,2,0,0,0,0|0,0,2]=4 6703 B9R0.79 CC(=C)[C@H](C)[C@H](C)C(O)=O Amb25122106 [0,2,0,0,0,0|0,0,2]=4 6704 B9R0.79 CC(=C)[C@H](O)[C@@H](C)C(O)=O Amb25111582 [0,2,0,0,0,0|0,0,2]=4 6705 B9R0.79 CC(=O)C(C)C(C)C(O)=O Amb24401092 [0,2,0,0,0,0|1,0,1]=4 6706 B9R0.79 CC(=O)C(C)C(C)N(C)C Amb24597999 [0,2,0,0,0,0|2,0,0]=4 6707 B9R0.79 CC(=O)C(C)C(N)C(O)=O Amb18202116 [0,2,0,0,0,0|1,0,1]=4 6708 B9R0.79 CC(=O)C(C)C(O)C(O)=O Amb25341155 [0,2,0,0,0,0|1,0,1]=4 6709 B9R0.79 CC(=O)C(O)C(C)C(O)=O Amb25255327 [0,2,0,0,0,0|1,0,1]=4 6710 B9R0.79 CC(=O)C(O)C(O)C(O)=O Amb25292189 [0,2,0,0,0,0|1,0,1]=4 6711 B9R0.79 CC(=O)[C@@H](C)[C@H](C)C(O)=O Amb25771163 [0,2,0,0,0,0|1,0,1]=4 6712 B9R0.79 CC(=O)[C@@H](C)[C@H](N)C(O)=O Amb25703453 [0,2,0,0,0,0|1,0,1]=4 6713 B9R0.79 CC(=O)[C@@H](O)[C@H](C)C(O)=O Amb25077192 [0,2,0,0,0,0|1,0,1]=4 6714 B9R0.79 CC(=O)[C@H](C)[C@H](C)C(O)=O Amb25805859 [0,2,0,0,0,0|1,0,1]=4 6715 B9R0.79 CC(=O)[C@H](C)[C@H](O)C(O)=O Amb24376865 [0,2,0,0,0,0|1,0,1]=4 6716 B9R0.79 CC(=O)[C@H](O)C(=O)C(C)C Amb25831913 [0,2,0,0,0,0|1,0,1]=4 6717 B9R0.79 CC(C(C)C)=C(Cl)C(O)=O Amb25138708 [0,2,0,0,0,0|0,0,2]=4 6718 B9R0.79 CC(C(C)O)C(=O)C(O)=O Amb24454984 [0,2,0,0,0,0|1,0,1]=4 6719 B9R0.79 CC(C(N)C(O)=O)C(Cl)Cl Amb24412209 [0,2,0,0,0,0|2,0,0]=4 6720 B9R0.79 CC(C(O)=O)=C(Cl)C(C)C Amb25348348 [0,2,0,0,0,0|0,0,2]=4 6721 B9R0.79 CC(C(O)=O)C(=O)N(C)C Amb24454556 [0,2,0,0,0,0|1,0,1]=4 6722 B9R0.79 CC(C(O)C(O)=O)N(C)C Amb25274735 [0,2,0,0,0,0|1,0,0]=3 6723 B9R0.79 CC(C)C(=C)C(C)C(O)=O Amb24581229 [0,2,0,0,0,0|0,0,1]=3 6724 B9R0.79 CC(C)C(=O)C(C)C(C)=O Amb17778960 [0,2,0,0,0,0|1,0,1]=4 6725 B9R0.79 CC(C)C(Br)C(=O)C(O)=O Amb18131027 [0,2,0,0,0,0|0,0,1]=3 6726 B9R0.79 CC(C)C(C)=C(C)C(O)=O Amb25111837 [0,2,0,0,0,0|0,0,2]=4 6727 B9R0.79 CC(C)C(C)C(C)C(C)=O Amb24432176 [0,2,0,0,0,0|1,0,0]=3 6728 B9R0.79 CC(C)C(C)C(C)C(N)=O Amb24650558 [0,2,0,0,0,0|1,0,0]=3 6729 B9R0.79 CC(C)C(C)C(C)C(O)=O Amb18124692 [0,2,0,0,0,0|0,0,0]=2 6730 B9R0.79 CC(C)C(C)C(Cl)C(N)=O Amb25117886 [0,2,0,0,0,0|1,0,0]=3 6731 B9R0.79 CC(C)C(C)C(F)C(O)=O Amb25853148 [0,2,0,0,0,0|0,0,0]=2 6732 B9R0.79 CC(C)C(C)C(N)C(C)=C Amb24718751 [0,2,0,0,0,0|2,0,0]=4 6733 B9R0.79 CC(C)C(C)C(O)C(C)=C Amb25260008 [0,2,0,0,0,0|2,0,0]=4 6734 B9R0.79 CC(C)C(C)C(O)C(C)O Amb24672656 [0,2,0,0,0,0|1,0,1]=4 6735 B9R0.79 CC(C)C(C)C(O)C(N)=O Amb25099713 [0,2,0,0,0,0|1,0,0]=3 6736 B9R0.79 CC(C)C(C)N(C)C(C)=O Amb25338435 [0,2,0,0,0,0|2,0,0]=4 6737 B9R0.79 CC(C)C(C)[C@H](O)[C@H](C)O Amb24475831 [0,2,0,0,0,0|1,0,1]=4 6738 B9R0.79 CC(C)C(Cl)C(=O)C(O)=O Amb18646182 [0,2,0,0,0,0|0,0,1]=3 6739 B9R0.79 CC(C)C(Cl)C(N)C(O)=O Amb25779528 [0,2,0,0,0,0|0,0,0]=2 6740 B9R0.79 CC(C)C(O)C(=C)C(N)=O Amb24753645 [0,2,0,0,0,0|1,0,1]=4 6741 B9R0.79 CC(C)C(O)C(Br)C(C)O Amb24382660 [0,2,0,0,0,0|1,0,1]=4 6742 B9R0.79 CC(C)C(O)C(Br)C(O)=O Amb25313138 [0,2,0,0,0,0|0,0,0]=2 6743 B9R0.79 CC(C)C(O)C(Br)[N+]([O-])=O Amb25280179 [0,2,0,0,0,0|1,0,1]=4 6744 B9R0.79 CC(C)C(O)C(C)C(=O)Cl Amb24555045 [0,2,0,0,0,0|1,0,0]=3 6745 B9R0.79 CC(C)C(O)C(C)C(O)=O Amb18990636 [0,2,0,0,0,0|0,0,0]=2 6746 B9R0.79 CC(C)C(O)C(Cl)C(O)=O Amb25275308 [0,2,0,0,0,0|0,0,0]=2 6747 B9R0.79 CC(C)C(O)C(N)C(O)=O Amb23399656 [0,2,0,0,0,0|0,0,0]=2 6748 B9R0.79 CC(C)C(O)C(O)C(C)=O Amb25834304 [0,2,0,0,0,0|1,0,0]=3 6749 B9R0.79 CC(C)C(O)[C@@H](N)C(O)=O Amb19130451 [0,2,0,0,0,0|0,0,0]=2 6750 B9R0.79 CC(C)C(O)[C@H](N)C(O)=O Amb24509492 [0,2,0,0,0,0|0,0,0]=2 6751 B9R0.79 CC(C)N(C)[C@H](C)C(N)=O Amb25822771 [0,2,0,0,0,0|2,0,0]=4 6752 B9R0.79 CC(C)N(O)C(=O)C(O)=O Amb24671329 [0,2,0,0,0,0|1,0,1]=4 6753 B9R0.79 CC(C)S(=O)C(C)C(O)=O Amb18289811 [0,2,0,0,0,0|1,0,0]=3 6754 B9R0.79 CC(C)[C@@H](C)[C@@H](C)C(C)=O Amb25146697 [0,2,0,0,0,0|1,0,0]=3 6755 B9R0.79 CC(C)[C@@H](C)[C@@H](N)C(O)=O Amb24670804 [0,2,0,0,0,0|0,0,0]=2 6756 B9R0.79 CC(C)[C@@H](C)[C@H](N)C(O)=O Amb25061907 [0,2,0,0,0,0|0,0,0]=2 6757 B9R0.79 CC(C)[C@@H](C)[C@H](O)C(O)=O Amb24447350 [0,2,0,0,0,0|0,0,0]=2 6758 B9R0.79 CC(C)[C@@H](F)[C@@H](N)C(O)=O Amb22802115 [0,2,0,0,0,0|0,0,0]=2 6759 B9R0.79 CC(C)[C@@H](N)C(O)C(O)=O Amb25258947 [0,2,0,0,0,0|0,0,0]=2 6760 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(C)=C Amb25787142 [0,2,0,0,0,0|2,0,0]=4 6761 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(N)=O Amb25202092 [0,2,0,0,0,0|1,0,0]=3 6762 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(O)=O Amb22224932 [0,2,0,0,0,0|0,0,0]=2 6763 B9R0.79 CC(C)[C@@H](O)[C@@H](O)C(O)=O Amb25222321 [0,2,0,0,0,0|0,0,0]=2 6764 B9R0.79 CC(C)[C@@H](O)[C@H](C)C(N)=O Amb24383930 [0,2,0,0,0,0|1,0,0]=3 6765 B9R0.79 CC(C)[C@@H](O)[C@H](O)C(C)=O Amb24378529 [0,2,0,0,0,0|1,0,0]=3 6766 B9R0.79 CC(C)[C@@H](O)[C@H](O)C(O)=O Amb24550312 [0,2,0,0,0,0|0,0,0]=2 6767 B9R0.79 CC(C)[C@@H](S)[C@H](N)C(O)=O Amb25302326 [0,2,0,0,0,0|0,0,0]=2 6768 B9R0.79 CC(C)[C@H](C)[C@@H](N)C(O)=O Amb25147401 [0,2,0,0,0,0|0,0,0]=2 6769 B9R0.79 CC(C)[C@H](C)[C@H](C)C(N)=O Amb24746183 [0,2,0,0,0,0|1,0,0]=3 6770 B9R0.79 CC(C)[C@H](C)[C@H](O)C(O)=O Amb24548143 [0,2,0,0,0,0|0,0,0]=2 6771 B9R0.79 CC(C)[C@H](N)C(O)C(O)=O Amb24744520 [0,2,0,0,0,0|0,0,0]=2 6772 B9R0.79 CC(C)[C@H](N)[C@@H](F)C(O)=O Amb24629885 [0,2,0,0,0,0|0,0,0]=2 6773 B9R0.79 CC(C)[C@H](N)[C@@H](O)C(O)=O Amb24428177 [0,2,0,0,0,0|0,0,0]=2 6774 B9R0.79 CC(C)[C@H](N)[C@H](O)C(O)=O Amb25147282 [0,2,0,0,0,0|0,0,0]=2 6775 B9R0.79 CC(C)[C@H](O)[C@@H](Br)C(O)=O Amb24598278 [0,2,0,0,0,0|0,0,0]=2 6776 B9R0.79 CC(Cl)C(Cl)C(C)C(C)=O Amb24649937 [0,2,0,0,0,0|2,0,0]=4 6777 B9R0.79 CC(N)C(C)C(C)C(O)=O Amb25828384 [0,2,0,0,0,0|1,0,0]=3 6778 B9R0.79 CC(O)C(C)C(N)C(O)=O Amb21953714 [0,2,0,0,0,0|1,0,0]=3 6779 B9R0.79 CC(O)C(C)[C@@H](N)C(O)=O Amb22800202 [0,2,0,0,0,0|1,0,0]=3 6780 B9R0.79 CC(O)C(O)C(O)C(C)=O Amb25145498 [0,2,0,0,0,0|2,0,0]=4 6781 B9R0.79 CC(O)[C@@H](C)[C@@H](N)C(O)=O Amb24052812 [0,2,0,0,0,0|1,0,0]=3 6782 B9R0.79 CC([C@@H]([C@@H](C(=O)O)N)C)O Amb10603785 [0,2,0,0,0,0|1,0,0]=3 6783 B9R0.79 CC([C@@H]([C@H](C(=O)O)C)O)C Amb10844253 [0,2,0,0,0,0|0,0,0]=2 6784 B9R0.79 CC([C@@H]([C@H](C(=O)O)N)O)C Amb10807407 [0,2,0,0,0,0|0,0,0]=2 6785 B9R0.79 CN(C)C(=O)C(Br)C(O)=O Amb25323784 [0,2,0,0,0,0|1,0,1]=4 6786 B9R0.79 CN(O)C(C)C(C)C(O)=O Amb24540667 [0,2,0,0,0,0|2,0,0]=4 6787 B9R0.79 C[C@@H](O)C(O)[C@H](N)C(O)=O Amb24435507 [0,2,0,0,0,0|1,0,0]=3 6788 B9R0.79 C[C@@H](O)[C@@H](C)[C@@H](N)C(O)=O Amb25693814 [0,2,0,0,0,0|1,0,0]=3 6789 B9R0.79 C[C@@H](O)[C@@H](C)[C@H](N)C(O)=O Amb24340188 [0,2,0,0,0,0|1,0,0]=3 6790 B9R0.79 C[C@@H](O)[C@@H](O)[C@@H](O)C(C)=O Amb24661092 [0,2,0,0,0,0|2,0,0]=4 6791 B9R0.79 C[C@@H](O)[C@H](O)[C@@H](O)C(O)=O Amb24482345 [0,2,0,0,0,0|1,0,0]=3 6792 B9R0.79 C[C@@H](O)[C@H](O)[C@H](O)C(O)=O Amb24711187 [0,2,0,0,0,0|1,0,0]=3 6793 B9R0.79 C[C@@H]([C@H](O)C(O)=O)N(C)C Amb24480709 [0,2,0,0,0,0|1,0,0]=3 6794 B9R0.79 C[C@@H]([C@H](O)[C@H](C)N)C(O)=O Amb24563136 [0,2,0,0,0,0|1,0,0]=3 6795 B9R0.79 C[C@H](O)C(C)[C@H](N)C(O)=O Amb22735316 [0,2,0,0,0,0|1,0,0]=3 6796 B9R0.79 C[C@H](O)[C@@H](O)[C@@H](O)C(N)=O Amb24712923 [0,2,0,0,0,0|2,0,0]=4 6797 B9R0.79 C[C@H](O)[C@@H](O)[C@@H](O)C(O)=O Amb25374422 [0,2,0,0,0,0|1,0,0]=3 6798 B9R0.79 C[C@H]([C@@H]([C@@H](C(=O)O)N)C)O Amb17615448 [0,2,0,0,0,0|1,0,0]=3 6799 B9R0.79 C[C@H]([C@H](N)C(O)=O)C(C)Cl Amb25363328 [0,2,0,0,0,0|1,0,0]=3 6800 B9R0.79 NC(C(Cl)C(Cl)Cl)C(O)=O Amb24375729 [0,2,0,0,0,0|2,0,0]=4 6801 B9R0.79 NC(C(F)C(O)=O)C(F)F Amb24482391 [0,2,0,0,0,0|2,0,0]=4 6802 B9R0.79 NC(C(O)C(F)F)C(O)=O Amb19148422 [0,2,0,0,0,0|2,0,0]=4 6803 B9R0.79 OC(C(O)C(F)F)C(O)=O Amb24639614 [0,2,0,0,0,0|2,0,0]=4 6804 B9R0.77 CC(C)(C)CCC(C)(C)O Amb24729070 [0,2,0,0,0,0|1,0,1]=4 6805 B9R0.77 CC(C)(C)CCS(=O)(=O)Br Amb24431289 [0,2,0,0,0,0|1,0,1]=4 6806 B9R0.77 CC(C)(C)CCS(=O)(=O)F Amb19373790 [0,2,0,0,0,0|1,0,1]=4 6807 B9R0.77 CC(C)(C)CCS(N)(=O)=O Amb18792708 [0,2,0,0,0,0|1,0,1]=4 6808 B9R0.77 CC(C)(N)CCS(C)(=O)=O Amb18993537 [0,2,0,0,0,0|1,0,1]=4 6809 B9R0.77 CC(C)(N)CSP(O)(O)=O Amb25320964 [0,2,0,0,0,0|2,0,0]=4 6810 B9R0.77 CC(C)(N)CSS(O)(=O)=O Amb24373871 [0,2,0,0,0,0|2,0,0]=4 6811 B9R0.77 CC(CCS(=O)(=O)Cl)(C)C Amb17505558 [0,2,0,0,0,0|1,0,1]=4 6812 B9R0.77 C[Si](C)(C)CCS(O)(=O)=O Amb22288916 [0,2,0,0,0,0|1,1,0]=4 6813 B9R0.77 C[Si](C)(C)CCS(O)(=O)=O Amb24669597 [0,2,0,0,0,0|1,1,0]=4 6814 B7R1.2 C=C1CC(Br)CC1 Amb25135798 [1,0,0,1,0,0|2,0,0]=4 6815 B7R1.2 C=C1CC(N)CC1 Amb24352464 [1,0,0,1,0,0|2,0,0]=4 6816 B7R1.2 C=C1CC(O)CC1 Amb25246529 [1,0,0,1,0,0|2,0,0]=4 6817 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [1,0,0,1,0,0|0,0,2]=4 6818 B7R1.2 CC1CC(=O)CS1 Amb23598370 [1,0,0,1,0,0|1,0,0]=3 6819 B7R1.2 CC1CC(=O)NC1 Amb10608004 [1,0,0,1,0,0|1,0,0]=3 6820 B7R1.2 CC1CC(Cl)CC1 Amb25129430 [1,0,0,1,0,0|1,0,1]=4 6821 B7R1.2 CC1CC(N)CC1 Amb20669202 [1,0,0,1,0,0|1,0,1]=4 6822 B7R1.2 CC1CC(N)CC1 Amb24062164 [1,0,0,1,0,0|1,0,1]=4 6823 B7R1.2 CC1CC(O)CN1 Amb20668139 [1,0,0,1,0,0|1,0,1]=4 6824 B7R1.2 CC1CC(O)CS1 Amb24660406 [1,0,0,1,0,0|1,0,1]=4 6825 B7R1.2 CC1CC(S)CC1 Amb25829470 [1,0,0,1,0,0|0,1,1]=4 6826 B7R1.2 CC1CC=C(C)C1 Amb17674172 [1,0,0,1,0,0|1,0,1]=4 6827 B7R1.2 CC1CCC(=N)N1 Amb24479850 [1,0,0,1,0,0|2,0,0]=4 6828 B7R1.2 CC1CCC(=O)N1 Amb19267101 [1,0,0,1,0,0|1,0,0]=3 6829 B7R1.2 CC1CCC(=S)O1 Amb25361484 [1,0,0,1,0,0|0,1,0]=3 6830 B7R1.2 CC1CCC(C)=C1 Amb24479860 [1,0,0,1,0,0|1,0,1]=4 6831 B7R1.2 CC1CCC(C)=N1 Amb24598049 [1,0,0,1,0,0|2,0,0]=4 6832 B7R1.2 CC1CCC(O)O1 Amb22295909 [1,0,0,1,0,0|0,0,2]=4 6833 B7R1.2 CC1CCC(O1)C Amb10602551 [1,0,0,1,0,0|1,0,1]=4 6834 B7R1.2 CC1CN(N)CC1 Amb24385963 [1,0,0,1,0,0|2,0,0]=4 6835 B7R1.2 CC1CN=C(C)O1 Amb25360042 [1,0,0,1,0,0|2,0,0]=4 6836 B7R1.2 CC1CN=C(S)O1 Amb25196024 [1,0,0,1,0,0|1,1,0]=4 6837 B7R1.2 CC1CNC(=O)N1 Amb17506853 [1,0,0,1,0,0|2,0,0]=4 6838 B7R1.2 CC1CNC(=O)O1 Amb19651732 [1,0,0,1,0,0|1,0,0]=3 6839 B7R1.2 CC1CNC(=O)S1 Amb25367335 [1,0,0,1,0,0|1,1,0]=4 6840 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,0,0,1,0,0|1,0,0]=3 6841 B7R1.2 CC1COC(=O)N1 Amb19517037 [1,0,0,1,0,0|2,0,0]=4 6842 B7R1.2 CC1COS(=O)O1 Amb22346070 [1,0,0,1,0,0|2,0,0]=4 6843 B7R1.2 CC1CS(=O)CC1 Amb24333540 [1,0,0,1,0,0|1,0,0]=3 6844 B7R1.2 CC1CSC(=O)C1 Amb25136024 [1,0,0,1,0,0|1,0,0]=3 6845 B7R1.2 CC1CSC(=O)S1 Amb22055765 [1,0,0,1,0,0|1,1,0]=4 6846 B7R1.2 CC1NNC(=O)C1 Amb2371659 [1,0,0,1,0,0|2,0,0]=4 6847 B7R1.2 CC1NNC(=O)O1 Amb25832289 [1,0,0,1,0,0|2,0,0]=4 6848 B7R1.2 CC1OC(=O)CS1 Amb25314322 [1,0,0,1,0,0|1,0,0]=3 6849 B7R1.2 CC=1CC(=O)CC1 Amb25319016 [1,0,0,1,0,0|0,0,2]=4 6850 B7R1.2 CN1CC(=O)CC1 Amb22236123 [1,0,0,1,0,0|1,0,0]=3 6851 B7R1.2 CN1CCC(=O)N1 Amb24064860 [1,0,0,1,0,0|2,0,0]=4 6852 B7R1.2 CN1CCC(O)=C1 Amb24079726 [1,0,0,1,0,0|1,0,1]=4 6853 B7R1.2 CN1CC[C@@H](C1)O Amb10070789 [1,0,0,1,0,0|1,0,1]=4 6854 B7R1.2 CN1CNC(=O)C1 Amb24733801 [1,0,0,1,0,0|2,0,0]=4 6855 B7R1.2 CN1C[C@@H](O)CC1 Amb22748868 [1,0,0,1,0,0|1,0,1]=4 6856 B7R1.2 CP1CC(O)CC1 Amb24661188 [1,0,0,1,0,0|1,0,1]=4 6857 B7R1.2 C[C@@H]1C=CC(=O)O1 Amb25114434 [1,0,0,1,0,0|0,0,2]=4 6858 B7R1.2 C[C@@H]1CC(=O)CC1 Amb22801305 [1,0,0,1,0,0|0,0,0]=2 6859 B7R1.2 C[C@@H]1CC(O)OC1 Amb25795468 [1,0,0,1,0,0|1,0,1]=4 6860 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,0,0,1,0,0|0,0,0]=2 6861 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [1,0,0,1,0,0|1,0,0]=3 6862 B7R1.2 C[C@@H]1CCC(O)O1 Amb25369337 [1,0,0,1,0,0|0,0,2]=4 6863 B7R1.2 C[C@@H]1CC[C@@H](O)O1 Amb25176141 [1,0,0,1,0,0|0,0,2]=4 6864 B7R1.2 C[C@@H]1CC[C@H](C)O1 Amb22799402 [1,0,0,1,0,0|1,0,1]=4 6865 B7R1.2 C[C@@H]1CC[C@H](O)O1 Amb25175220 [1,0,0,1,0,0|0,0,2]=4 6866 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,0,0,1,0,0|1,0,0]=3 6867 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [1,0,0,1,0,0|1,0,0]=3 6868 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,0,0,1,0,0|1,0,0]=3 6869 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [1,0,0,1,0,0|2,0,0]=4 6870 B7R1.2 C[C@@H]1C[C@@H](C)CC1 Amb22747863 [1,0,0,1,0,0|1,0,1]=4 6871 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22745222 [1,0,0,1,0,0|1,0,1]=4 6872 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22746400 [1,0,0,1,0,0|1,0,1]=4 6873 B7R1.2 C[C@@H]1C[C@H](Br)CC1 Amb25026616 [1,0,0,1,0,0|1,0,1]=4 6874 B7R1.2 C[C@@H]1C[C@H](C)CC1 Amb22230412 [1,0,0,1,0,0|1,0,1]=4 6875 B7R1.2 C[C@@H]1C[C@H](I)CC1 Amb24561074 [1,0,0,1,0,0|1,0,1]=4 6876 B7R1.2 C[C@@H]1C[C@H](N)CC1 Amb25179651 [1,0,0,1,0,0|1,0,1]=4 6877 B7R1.2 C[C@@H]1C[C@H](O)CC1 Amb25241408 [1,0,0,1,0,0|0,0,1]=3 6878 B7R1.2 C[C@@H]1C[C@H](O)CN1 Amb22886268 [1,0,0,1,0,0|1,0,1]=4 6879 B7R1.2 C[C@H]1C=CC(=O)O1 Amb13887292 [1,0,0,1,0,0|0,0,2]=4 6880 B7R1.2 C[C@H]1CC(=O)CN1 Amb25746539 [1,0,0,1,0,0|1,0,0]=3 6881 B7R1.2 C[C@H]1CCC(O)O1 Amb25796315 [1,0,0,1,0,0|0,0,2]=4 6882 B7R1.2 C[C@H]1CC[C@H](C)O1 Amb25810674 [1,0,0,1,0,0|1,0,1]=4 6883 B7R1.2 C[C@H]1CNC(=O)O1 Amb24480854 [1,0,0,1,0,0|1,0,0]=3 6884 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,0,0,1,0,0|1,0,0]=3 6885 B7R1.2 C[C@H]1C[C@@H](O)CN1 Amb24560197 [1,0,0,1,0,0|1,0,1]=4 6886 B7R1.2 C[C@H]1C[C@H](C)CC1 Amb25176920 [1,0,0,1,0,0|1,0,1]=4 6887 B7R1.2 C[C@H]1C[C@H](I)CC1 Amb25338105 [1,0,0,1,0,0|1,0,1]=4 6888 B7R1.2 C[C@H]1C[C@H](O)CC1 Amb25241604 [1,0,0,1,0,0|0,0,1]=3 6889 B7R1.2 C[C@H]1C[C@H](O)CN1 Amb24523959 [1,0,0,1,0,0|1,0,1]=4 6890 B7R1.2 C[C@H]1C[C@H](O)CO1 Amb25212245 [1,0,0,1,0,0|1,0,1]=4 6891 B7R1.2 ClC1COC(=O)O1 Amb10842117 [1,0,0,1,0,0|2,0,0]=4 6892 B7R1.2 FC1COC(=O)O1 Amb10841016 [1,0,0,1,0,0|2,0,0]=4 6893 B7R1.2 NC1CC(=O)CC1 Amb22236085 [1,0,0,1,0,0|1,0,0]=3 6894 B7R1.2 NC1CC(=O)CC1 Amb22494268 [1,0,0,1,0,0|1,0,0]=3 6895 B7R1.2 NC1CC(=O)CS1 Amb25090377 [1,0,0,1,0,0|2,0,0]=4 6896 B7R1.2 NC1CC(O)CC1 Amb18561405 [1,0,0,1,0,0|1,0,1]=4 6897 B7R1.2 NC1CC(O)CC1 Amb19958405 [1,0,0,1,0,0|1,0,1]=4 6898 B7R1.2 NC1CCC(=O)N1 Amb24480433 [1,0,0,1,0,0|2,0,0]=4 6899 B7R1.2 NC1CCC(=O)O1 Amb17593085 [1,0,0,1,0,0|1,0,0]=3 6900 B7R1.2 NC1CCC(=O)S1 Amb24479819 [1,0,0,1,0,0|1,1,0]=4 6901 B7R1.2 NC1CNC(=O)C1 Amb17760661 [1,0,0,1,0,0|2,0,0]=4 6902 B7R1.2 NC1CS(=O)CC1 Amb19149072 [1,0,0,1,0,0|2,0,0]=4 6903 B7R1.2 NC1CS(=O)CC1 Amb25133789 [1,0,0,1,0,0|2,0,0]=4 6904 B7R1.2 N[C@@H]1CC[C@@H](C1)O Amb10066973 [1,0,0,1,0,0|1,0,1]=4 6905 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb10066961 [1,0,0,1,0,0|1,0,1]=4 6906 B7R1.2 N[C@@H]1CC[C@H](C1)O Amb16233749 [1,0,0,1,0,0|1,0,1]=4 6907 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [1,0,0,1,0,0|2,0,0]=4 6908 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [1,0,0,1,0,0|2,0,0]=4 6909 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22386861 [1,0,0,1,0,0|1,0,1]=4 6910 B7R1.2 N[C@@H]1C[C@@H](O)CC1 Amb22746957 [1,0,0,1,0,0|1,0,1]=4 6911 B7R1.2 N[C@@H]1C[C@H](O)CC1 Amb22274622 [1,0,0,1,0,0|1,0,1]=4 6912 B7R1.2 N[C@H]1CC(=O)OC1 Amb16233747 [1,0,0,1,0,0|2,0,0]=4 6913 B7R1.2 N[C@H]1CC[C@@H](C1)O Amb10066972 [1,0,0,1,0,0|1,0,1]=4 6914 B7R1.2 N[C@H]1CC[C@H](C1)O Amb10066971 [1,0,0,1,0,0|1,0,1]=4 6915 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [1,0,0,1,0,0|2,0,0]=4 6916 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [1,0,0,1,0,0|2,0,0]=4 6917 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [1,0,0,1,0,0|2,0,0]=4 6918 B7R1.2 N[C@H]1C[C@@H](O)CC1 Amb22406236 [1,0,0,1,0,0|1,0,1]=4 6919 B7R1.2 O=C1CC(Br)CC1 Amb24334292 [1,0,0,1,0,0|1,0,0]=3 6920 B7R1.2 O=C1CC(Br)CO1 Amb25803413 [1,0,0,1,0,0|2,0,0]=4 6921 B7R1.2 O=C1CC(Cl)CO1 Amb24608923 [1,0,0,1,0,0|2,0,0]=4 6922 B7R1.2 O=C1CC(F)CC1 Amb21963553 [1,0,0,1,0,0|1,0,0]=3 6923 B7R1.2 O=C1CC(F)CO1 Amb24431109 [1,0,0,1,0,0|2,0,0]=4 6924 B7R1.2 O=C1CC(I)CC1 Amb22001809 [1,0,0,1,0,0|1,0,0]=3 6925 B7R1.2 O=C1CC(S)CN1 Amb25685875 [1,0,0,1,0,0|2,0,0]=4 6926 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [1,0,0,1,0,0|1,0,0]=3 6927 B7R1.2 O=C1CCC(Cl)N1 Amb24689591 [1,0,0,1,0,0|2,0,0]=4 6928 B7R1.2 O=C1CC[C@@H](Cl)O1 Amb24710047 [1,0,0,1,0,0|1,0,0]=3 6929 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [1,0,0,1,0,0|2,0,0]=4 6930 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [1,0,0,1,0,0|2,0,0]=4 6931 B7R1.2 O=C1OCC(I)O1 Amb25681787 [1,0,0,1,0,0|2,0,0]=4 6932 B7R1.2 O=C1[14CH2][14CH2]C(=O)O1 Amb22729170 [1,0,0,1,0,0|1,0,1]=4 6933 B7R1.2 O=[13C]1CC[13C](=O)O1 Amb20243426 [1,0,0,1,0,0|1,0,1]=4 6934 B7R1.2 O=[13C]1[13CH2][13CH2][13C](=O)O1 Amb22056174 [1,0,0,1,0,0|1,0,1]=4 6935 B7R1.2 OC1CC(=O)CC1 Amb22057378 [1,0,0,1,0,0|1,0,0]=3 6936 B7R1.2 OC1CC(Br)CC1 Amb25275238 [1,0,0,1,0,0|1,0,1]=4 6937 B7R1.2 OC1CC(S)CC1 Amb25051687 [1,0,0,1,0,0|1,0,1]=4 6938 B7R1.2 OC1CCC(=O)N1 Amb21963236 [1,0,0,1,0,0|2,0,0]=4 6939 B7R1.2 OC1CCC(=O)O1 Amb22740957 [1,0,0,1,0,0|1,0,0]=3 6940 B7R1.2 OC1CNC(=O)C1 Amb19958404 [1,0,0,1,0,0|2,0,0]=4 6941 B7R1.2 O[C@@H]1CC(=O)NC1 Amb15691722 [1,0,0,1,0,0|2,0,0]=4 6942 B7R1.2 O[C@@H]1CN(O)CC1 Amb25025106 [1,0,0,1,0,0|2,0,0]=4 6943 B7R1.2 O[C@H]1C[C@H](O)CC1 Amb24519755 [1,0,0,1,0,0|1,0,1]=4 6944 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [1,0,0,1,0,0|2,0,0]=4 6945 B7R1.3 BrC1=CCCCO1 Amb24322651 [1,0,0,1,0,0|1,0,1]=4 6946 B7R1.3 BrC1CC=CCC1 Amb22229671 [1,0,0,1,0,0|2,0,0]=4 6947 B7R1.3 BrC1CCCCO1 Amb24322575 [1,0,0,1,0,0|1,0,1]=4 6948 B7R1.3 BrC=1CCCCC1 Amb21856761 [1,0,0,1,0,0|2,0,0]=4 6949 B7R1.3 C=C1CNCCO1 Amb25800394 [1,0,0,1,0,0|2,0,0]=4 6950 B7R1.3 C=C1OCCCO1 Amb25734089 [1,0,0,1,0,0|2,0,0]=4 6951 B7R1.3 CC1=CCCCO1 Amb24480530 [1,0,0,1,0,0|1,0,1]=4 6952 B7R1.3 CC1CC=CCC1 Amb22729698 [1,0,0,1,0,0|1,0,0]=3 6953 B7R1.3 CC1CC=CCO1 Amb25719582 [1,0,0,1,0,0|2,0,0]=4 6954 B7R1.3 CC1CCNCC1 Amb22549250 [1,0,0,1,0,0|2,0,0]=4 6955 B7R1.3 CC1CCOCC1 Amb22043825 [1,0,0,1,0,0|2,0,0]=4 6956 B7R1.3 CC1CNCCC1 Amb22491688 [1,0,0,1,0,0|1,0,1]=4 6957 B7R1.3 CC1COCCC1 Amb22347806 [1,0,0,1,0,0|0,0,1]=3 6958 B7R1.3 CC1COCCN1 Amb22728071 [1,0,0,1,0,0|1,0,1]=4 6959 B7R1.3 CC1COCOC1 Amb24587149 [1,0,0,1,0,0|1,0,1]=4 6960 B7R1.3 CN1CC=CCC1 Amb22734271 [1,0,0,1,0,0|2,0,0]=4 6961 B7R1.3 C[C@@H]1CNCCC1 Amb22745835 [1,0,0,1,0,0|1,0,1]=4 6962 B7R1.3 C[C@@H]1COCCN1 Amb10066948 [1,0,0,1,0,0|1,0,1]=4 6963 B7R1.3 C[C@@H]1COCCN1 Amb22169654 [1,0,0,1,0,0|1,0,1]=4 6964 B7R1.3 C[C@H]1CNCCC1 Amb24461444 [1,0,0,1,0,0|1,0,1]=4 6965 B7R1.3 C[C@H]1COCCN1 Amb10066947 [1,0,0,1,0,0|1,0,1]=4 6966 B7R1.3 C[C@H]1COCCN1 Amb19516190 [1,0,0,1,0,0|1,0,1]=4 6967 B7R1.3 ClC1CC=CCC1 Amb22229749 [1,0,0,1,0,0|2,0,0]=4 6968 B7R1.3 ClC1CCCCO1 Amb17673285 [1,0,0,1,0,0|1,0,1]=4 6969 B7R1.3 ClC1COCCC1 Amb20622589 [1,0,0,1,0,0|1,0,1]=4 6970 B7R1.3 Cl[C@H]1CCCCO1 Amb24479760 [1,0,0,1,0,0|1,0,1]=4 6971 B7R1.3 FC1CCCCO1 Amb24322826 [1,0,0,1,0,0|1,0,1]=4 6972 B7R1.3 FC1COCCC1 Amb24322825 [1,0,0,1,0,0|1,0,1]=4 6973 B7R1.3 IC1COCCC1 Amb22831295 [1,0,0,1,0,0|1,0,1]=4 6974 B7R1.3 N=C1CCCCN1 Amb17616049 [1,0,0,1,0,0|2,0,0]=4 6975 B7R1.3 N=C1NCCCO1 Amb23597225 [1,0,0,1,0,0|2,0,0]=4 6976 B7R1.3 NC1CC=CCC1 Amb18639038 [1,0,0,1,0,0|2,0,0]=4 6977 B7R1.3 NC1CC=CCC1 Amb19515491 [1,0,0,1,0,0|2,0,0]=4 6978 B7R1.3 NC1CCCCO1 Amb25137158 [1,0,0,1,0,0|1,0,1]=4 6979 B7R1.3 NC1CCCOC1 Amb1091859 [1,0,0,1,0,0|1,0,1]=4 6980 B7R1.3 NC1COCCC1 Amb19889218 [1,0,0,1,0,0|1,0,1]=4 6981 B7R1.3 N[C@@H]1CCCCO1 Amb25146492 [1,0,0,1,0,0|1,0,1]=4 6982 B7R1.3 N[C@@H]1COCCC1 Amb19516313 [1,0,0,1,0,0|1,0,1]=4 6983 B7R1.3 N[C@@H]1COCCC1 Amb20241266 [1,0,0,1,0,0|1,0,1]=4 6984 B7R1.3 N[C@H]1COCCC1 Amb19516292 [1,0,0,1,0,0|1,0,1]=4 6985 B7R1.3 N[C@H]1COCCC1 Amb20241267 [1,0,0,1,0,0|1,0,1]=4 6986 B7R1.3 O=C1CCCC=C1 Amb17843126 [1,0,0,1,0,0|1,0,1]=4 6987 B7R1.3 O=C1CCCCS1 Amb25186924 [1,0,0,1,0,0|0,1,0]=3 6988 B7R1.3 O=C1CCCNC1 Amb10070944 [1,0,0,1,0,0|2,0,0]=4 6989 B7R1.3 O=C1CCCNC1 Amb10602349 [1,0,0,1,0,0|2,0,0]=4 6990 B7R1.3 O=C1CCCNN1 Amb18061622 [1,0,0,1,0,0|2,0,0]=4 6991 B7R1.3 O=C1CCCSC1 Amb13952257 [1,0,0,1,0,0|2,0,0]=4 6992 B7R1.3 O=C1CCSCC1 Amb1154265 [1,0,0,1,0,0|2,0,0]=4 6993 B7R1.3 O=C1CCSCN1 Amb24479868 [1,0,0,1,0,0|2,0,0]=4 6994 B7R1.3 O=C1CNCCC1 Amb19958010 [1,0,0,1,0,0|2,0,0]=4 6995 B7R1.3 O=C1CNCCO1 Amb19958702 [1,0,0,1,0,0|1,0,0]=3 6996 B7R1.3 O=C1COCCC1 Amb19373430 [1,0,0,1,0,0|2,0,0]=4 6997 B7R1.3 O=C1COCCN1 Amb15691115 [1,0,0,1,0,0|2,0,0]=4 6998 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,1,0,0|1,0,0]=3 6999 B7R1.3 O=C1CSCCS1 Amb24539369 [1,0,0,1,0,0|1,1,0]=4 7000 B7R1.3 O=C1NCCCO1 Amb10608499 [1,0,0,1,0,0|1,0,0]=3 7001 B7R1.3 O=C1NCCCS1 Amb24117134 [1,0,0,1,0,0|1,1,0]=4 7002 B7R1.3 O=C1OCCC=C1 Amb15693457 [1,0,0,1,0,0|0,0,2]=4 7003 B7R1.3 O=S1OCCCO1 Amb20240777 [1,0,0,1,0,0|2,0,0]=4 7004 B7R1.3 O=[13C]1CCCCC1 Amb22367406 [1,0,0,1,0,0|1,0,0]=3 7005 B7R1.3 OC1CC=CCC1 Amb24089165 [1,0,0,1,0,0|2,0,0]=4 7006 B7R1.3 OC1CC=COC1 Amb25663138 [1,0,0,1,0,0|1,0,1]=4 7007 B7R1.3 OC1CCCCN1 Amb20247437 [1,0,0,1,0,0|1,0,1]=4 7008 B7R1.3 OC1CCCCS1 Amb17615672 [1,0,0,1,0,0|0,1,1]=4 7009 B7R1.3 OC1CCCOC1 Amb16192108 [1,0,0,1,0,0|1,0,1]=4 7010 B7R1.3 OC=1CNCCN1 Amb22330543 [1,0,0,1,0,0|2,0,0]=4 7011 B7R1.3 O[13CH]1CCCCC1 Amb22336567 [1,0,0,1,0,0|1,0,1]=4 7012 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [1,0,0,1,0,0|1,0,1]=4 7013 B7R1.3 O[C@@H]1COCCC1 Amb20241306 [1,0,0,1,0,0|1,0,1]=4 7014 B7R1.3 O[C@H]1CC=COC1 Amb25272017 [1,0,0,1,0,0|1,0,1]=4 7015 B7R1.3 S=C1CCCCC1 Amb24565839 [1,0,0,1,0,0|1,1,0]=4 7016 B7R1.3 S=C1NCCCO1 Amb22524560 [1,0,0,1,0,0|1,1,0]=4 7017 B7R1.3 SC1COCCC1 Amb24066221 [1,0,0,1,0,0|1,0,1]=4 7018 B7R1.5 C=C1C[C@@H]1CC=O Amb24574015 [1,0,0,1,0,0|0,0,2]=4 7019 B7R1.5 C=C1C[C@H]1CC=O Amb25326113 [1,0,0,1,0,0|0,0,2]=4 7020 B7R1.5 C=CCC1CC1Cl Amb24634288 [1,0,0,1,0,0|2,0,0]=4 7021 B7R1.5 C=CC[C@@H]1C[C@H]1O Amb25215350 [1,0,0,1,0,0|2,0,0]=4 7022 B7R1.5 CC1CC1CC=O Amb25737156 [1,0,0,1,0,0|0,0,0]=2 7023 B7R1.5 CC1CC1CCC Amb24699677 [1,0,0,1,0,0|1,0,1]=4 7024 B7R1.5 CC1CC1CCO Amb25026465 [1,0,0,1,0,0|0,0,1]=3 7025 B7R1.5 CC1OC1CCO Amb24471660 [1,0,0,1,0,0|1,0,1]=4 7026 B7R1.5 CCCC1CC1O Amb25811022 [1,0,0,1,0,0|1,0,1]=4 7027 B7R1.5 CCCC1ON1C Amb22232363 [1,0,0,1,0,0|2,0,0]=4 7028 B7R1.5 C[C@@H]1C[C@@H]1CCC Amb24544739 [1,0,0,1,0,0|1,0,1]=4 7029 B7R1.5 C[C@@H]1C[C@H]1CCO Amb24593150 [1,0,0,1,0,0|0,0,1]=3 7030 B7R1.5 C[C@@H]1O[C@@H]1CCO Amb25176735 [1,0,0,1,0,0|1,0,1]=4 7031 B7R1.5 C[C@H]1C[C@H]1CCBr Amb24587326 [1,0,0,1,0,0|1,0,1]=4 7032 B7R1.5 C[C@H]1C[C@H]1CCC Amb25302063 [1,0,0,1,0,0|1,0,1]=4 7033 B7R1.5 C[C@H]1C[C@H]1CCO Amb25810215 [1,0,0,1,0,0|0,0,1]=3 7034 B7R1.5 C[C@H]1O[C@@H]1CCO Amb25226333 [1,0,0,1,0,0|1,0,1]=4 7035 B7R1.5 C[C@H]1O[C@H]1CCO Amb25025230 [1,0,0,1,0,0|1,0,1]=4 7036 B7R1.5 NNCC1CC1C Amb10610283 [1,0,0,1,0,0|2,0,0]=4 7037 B7R1.5 N[C@H]1C[C@@H]1CCO Amb24681172 [1,0,0,1,0,0|1,0,1]=4 7038 B7R1.5 N[C@H]1C[C@H]1CCO Amb24562303 [1,0,0,1,0,0|1,0,1]=4 7039 B7R1.7 BrCCCC1CC1 Amb24606733 [1,0,0,1,0,0|1,0,1]=4 7040 B7R1.7 C=CCC[C@H]1CO1 Amb24429350 [1,0,0,1,0,0|2,0,0]=4 7041 B7R1.7 C=CCNC1CC1 Amb17309103 [1,0,0,1,0,0|2,0,0]=4 7042 B7R1.7 C=COCC1CC1 Amb25025455 [1,0,0,1,0,0|2,0,0]=4 7043 B7R1.7 CCCCC1CO1 Amb17771532 [1,0,0,1,0,0|1,0,1]=4 7044 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [1,0,0,1,0,0|1,0,1]=4 7045 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [1,0,0,1,0,0|1,0,1]=4 7046 B7R1.7 CNCCC1CC1 Amb18979588 [1,0,0,1,0,0|2,0,0]=4 7047 B7R1.7 CNCCC1CC1 Amb20667659 [1,0,0,1,0,0|2,0,0]=4 7048 B7R1.7 NCCCC1CC1 Amb18296303 [1,0,0,1,0,0|1,0,1]=4 7049 B7R1.7 NCCCC1CC1 Amb19374503 [1,0,0,1,0,0|1,0,1]=4 7050 B7R1.7 O=C=NCC1CC1 Amb18955466 [1,0,0,1,0,0|1,0,1]=4 7051 B7R1.7 O=CC#CC1CC1 Amb25350458 [1,0,0,1,0,0|0,0,2]=4 7052 B7R1.7 O=CCCC1CC1 Amb21864768 [1,0,0,1,0,0|0,0,0]=2 7053 B7R1.7 O=CCCC1CO1 Amb25054703 [1,0,0,1,0,0|1,0,0]=3 7054 B7R1.7 O=COCC1CO1 Amb24632689 [1,0,0,1,0,0|2,0,0]=4 7055 B7R1.7 OCCCC1CC1 Amb19888792 [1,0,0,1,0,0|0,0,1]=3 7056 B7R1.7 OCCC[C@H]1CO1 Amb24661078 [1,0,0,1,0,0|1,0,1]=4 7057 B7R1.7 OCCSC1CC1 Amb25167463 [1,0,0,1,0,0|1,0,1]=4 7058 B7R1.7 ON=CCC1CC1 Amb24627412 [1,0,0,1,0,0|1,0,1]=4 7059 B7R1.10 C=C1CC(C1)C=O Amb22896623 [1,0,0,1,0,0|0,0,2]=4 7060 B7R1.10 C=CC1CC(O)C1 Amb25746805 [1,0,0,1,0,0|2,0,0]=4 7061 B7R1.10 CC1CC(C1)=NO Amb25173820 [1,0,0,1,0,0|1,0,1]=4 7062 B7R1.10 CC1CC(C1)C#N Amb24506611 [1,0,0,1,0,0|1,0,1]=4 7063 B7R1.10 CC1CC(C1)NC Amb22886204 [1,0,0,1,0,0|2,0,0]=4 7064 B7R1.10 CC1CC(C1)NC Amb25824077 [1,0,0,1,0,0|2,0,0]=4 7065 B7R1.10 CC1CC(C1)NN Amb24412655 [1,0,0,1,0,0|2,0,0]=4 7066 B7R1.10 CC1CC(CBr)C1 Amb23537768 [1,0,0,1,0,0|1,0,1]=4 7067 B7R1.10 CC1CC(CCl)C1 Amb23556405 [1,0,0,1,0,0|1,0,1]=4 7068 B7R1.10 CC1CC(CI)C1 Amb23512997 [1,0,0,1,0,0|1,0,1]=4 7069 B7R1.10 CC1CC(CN)C1 Amb22886186 [1,0,0,1,0,0|1,0,1]=4 7070 B7R1.10 CC1CC(CN)C1 Amb23580259 [1,0,0,1,0,0|1,0,1]=4 7071 B7R1.10 CC1CC(CO)C1 Amb23556375 [1,0,0,1,0,0|0,0,1]=3 7072 B7R1.10 CC1CC(CO)O1 Amb24413015 [1,0,0,1,0,0|1,0,1]=4 7073 B7R1.10 CCC1CC(=C)C1 Amb25719578 [1,0,0,1,0,0|2,0,0]=4 7074 B7R1.10 CCC1CC(=O)C1 Amb24406738 [1,0,0,1,0,0|1,0,0]=3 7075 B7R1.10 CCC1CC(O)C1 Amb24654646 [1,0,0,1,0,0|1,0,1]=4 7076 B7R1.10 CC[C@H]1CC(=O)N1 Amb24479784 [1,0,0,1,0,0|1,0,0]=3 7077 B7R1.10 COC1CC(=O)C1 Amb22754340 [1,0,0,1,0,0|2,0,0]=4 7078 B7R1.10 CSC1CC(=O)N1 Amb25265230 [1,0,0,1,0,0|2,0,0]=4 7079 B7R1.10 ClCC1CC(=O)C1 Amb10610581 [1,0,0,1,0,0|2,0,0]=4 7080 B7R1.10 NC1CC(C1)NO Amb24376134 [1,0,0,1,0,0|2,0,0]=4 7081 B7R1.10 NC1CC(CO)C1 Amb21960726 [1,0,0,1,0,0|1,0,1]=4 7082 B7R1.10 NC1CC(CO)C1 Amb23570501 [1,0,0,1,0,0|1,0,1]=4 7083 B7R1.10 NCC1CC(=O)C1 Amb18251063 [1,0,0,1,0,0|2,0,0]=4 7084 B7R1.10 NCC1CC(=O)C1 Amb22406094 [1,0,0,1,0,0|2,0,0]=4 7085 B7R1.10 NCC1CC(=O)N1 Amb25230632 [1,0,0,1,0,0|2,0,0]=4 7086 B7R1.10 NC[C@@H]1CC(=O)N1 Amb24120375 [1,0,0,1,0,0|2,0,0]=4 7087 B7R1.10 N[C@@H]1C[C@@H](CO)C1 Amb23439196 [1,0,0,1,0,0|1,0,1]=4 7088 B7R1.10 N[C@@H]1C[C@@H](CO)C1 Amb25124019 [1,0,0,1,0,0|1,0,1]=4 7089 B7R1.10 N[C@@H]1C[C@H](CO)C1 Amb22745997 [1,0,0,1,0,0|1,0,1]=4 7090 B7R1.10 N[C@@H]1C[C@H](CO)C1 Amb22747308 [1,0,0,1,0,0|1,0,1]=4 7091 B7R1.10 O=C1CC(CBr)C1 Amb20671344 [1,0,0,1,0,0|2,0,0]=4 7092 B7R1.10 O=C1CC(CBr)N1 Amb25779168 [1,0,0,1,0,0|2,0,0]=4 7093 B7R1.10 O=C1CC(CI)O1 Amb25169535 [1,0,0,1,0,0|1,0,0]=3 7094 B7R1.10 OC1CC(C1)CO Amb22284484 [1,0,0,1,0,0|1,0,1]=4 7095 B7R1.10 OC1CN(C1)C=O Amb24479855 [1,0,0,1,0,0|2,0,0]=4 7096 B7R1.10 OCC1CC(=O)C1 Amb16231082 [1,0,0,1,0,0|2,0,0]=4 7097 B7R1.10 OCC1CC(=O)N1 Amb22388379 [1,0,0,1,0,0|2,0,0]=4 7098 B7R1.10 OCC1CC(=O)O1 Amb25706008 [1,0,0,1,0,0|1,0,0]=3 7099 B7R1.10 OCC1CC(Cl)C1 Amb21962428 [1,0,0,1,0,0|1,0,1]=4 7100 B7R1.10 OCC1CC(F)C1 Amb22886692 [1,0,0,1,0,0|1,0,1]=4 7101 B7R1.10 OC[C@@H]1CC(=O)N1 Amb24578924 [1,0,0,1,0,0|2,0,0]=4 7102 B7R1.10 OC[C@H]1CC(=O)O1 Amb25769462 [1,0,0,1,0,0|1,0,0]=3 7103 B7R1.10 O[C@H]1C[C@H](C1)CO Amb24665713 [1,0,0,1,0,0|1,0,1]=4 7104 B7R1.12 C=C1C[C@@H]1C(O)=O Amb24683036 [1,0,0,1,0,0|0,0,2]=4 7105 B7R1.12 C=C1C[C@H]1C(O)=O Amb24368112 [1,0,0,1,0,0|0,0,2]=4 7106 B7R1.12 CC(=O)C1CC1Br Amb24426068 [1,0,0,1,0,0|2,0,0]=4 7107 B7R1.12 CC(=O)C1CC1Cl Amb25321894 [1,0,0,1,0,0|2,0,0]=4 7108 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Br Amb25745820 [1,0,0,1,0,0|2,0,0]=4 7109 B7R1.12 CC(=O)[C@@H]1C[C@@H]1Cl Amb24595358 [1,0,0,1,0,0|2,0,0]=4 7110 B7R1.12 CC(=O)[C@@H]1C[C@H]1Br Amb25110221 [1,0,0,1,0,0|2,0,0]=4 7111 B7R1.12 CC(=O)[C@@H]1C[C@H]1Cl Amb25179033 [1,0,0,1,0,0|2,0,0]=4 7112 B7R1.12 CC(C)C1CC1N Amb18280885 [1,0,0,1,0,0|1,0,1]=4 7113 B7R1.12 CC(C)C1CC1O Amb25355248 [1,0,0,1,0,0|0,0,1]=3 7114 B7R1.12 CC(C)[C@@H]1C[C@H]1N Amb24470295 [1,0,0,1,0,0|1,0,1]=4 7115 B7R1.12 CC1CC1C(C)=C Amb25694889 [1,0,0,1,0,0|2,0,0]=4 7116 B7R1.12 CC1CC1C(C)=O Amb25720437 [1,0,0,1,0,0|1,0,0]=3 7117 B7R1.12 CC1CC1C(C)O Amb25849677 [1,0,0,1,0,0|1,0,1]=4 7118 B7R1.12 CC1CC1C(N)=N Amb25139920 [1,0,0,1,0,0|2,0,0]=4 7119 B7R1.12 CC1CC1C(N)=S Amb25302556 [1,0,0,1,0,0|1,1,0]=4 7120 B7R1.12 CC1CC1[C@@H](C)O Amb24683424 [1,0,0,1,0,0|1,0,1]=4 7121 B7R1.12 CC1CC1[C@H](C)O Amb25271040 [1,0,0,1,0,0|1,0,1]=4 7122 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|1,0,0]=3 7123 B7R1.12 CC1SC1C(C)=O Amb24333031 [1,0,0,1,0,0|2,0,0]=4 7124 B7R1.12 C[C@@H]1C[C@@H]1B(O)O Amb24329037 [1,0,0,1,0,0|1,0,1]=4 7125 B7R1.12 C[C@@H]1C[C@@H]1C(C)=O Amb24670522 [1,0,0,1,0,0|1,0,0]=3 7126 B7R1.12 C[C@@H]1C[C@@H]1C(N)=O Amb25745425 [1,0,0,1,0,0|1,0,0]=3 7127 B7R1.12 C[C@@H]1C[C@@H]1C(O)=O Amb25851678 [1,0,0,1,0,0|0,0,0]=2 7128 B7R1.12 C[C@@H]1C[C@H]1B(O)O Amb24330179 [1,0,0,1,0,0|1,0,1]=4 7129 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [1,0,0,1,0,0|1,0,0]=3 7130 B7R1.12 C[C@@H]1C[C@H]1C(C)O Amb24714696 [1,0,0,1,0,0|1,0,1]=4 7131 B7R1.12 C[C@@H]1C[C@H]1C(O)=O Amb22735875 [1,0,0,1,0,0|0,0,0]=2 7132 B7R1.12 C[C@@H]1N[C@H]1C(O)=O Amb24120621 [1,0,0,1,0,0|1,0,0]=3 7133 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [1,0,0,1,0,0|1,0,0]=3 7134 B7R1.12 C[C@@H]1S[C@H]1C(C)=O Amb24374150 [1,0,0,1,0,0|2,0,0]=4 7135 B7R1.12 C[C@H]1C[C@@H]1B(O)O Amb24608885 [1,0,0,1,0,0|1,0,1]=4 7136 B7R1.12 C[C@H]1C[C@@H]1C(O)=O Amb22735974 [1,0,0,1,0,0|0,0,0]=2 7137 B7R1.12 C[C@H]1C[C@H]1B(O)O Amb24515113 [1,0,0,1,0,0|1,0,1]=4 7138 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|0,0,0]=2 7139 B7R1.12 C[C@H]1C[C@H]1C(C)=O Amb25236374 [1,0,0,1,0,0|1,0,0]=3 7140 B7R1.12 C[C@H]1C[C@H]1C(C)O Amb24593507 [1,0,0,1,0,0|1,0,1]=4 7141 B7R1.12 C[C@H]1C[C@H]1[C@@H](C)O Amb25026747 [1,0,0,1,0,0|1,0,1]=4 7142 B7R1.12 NC(=O)[C@@H]1C[C@@H]1Br Amb24519223 [1,0,0,1,0,0|2,0,0]=4 7143 B7R1.12 NC1CC1C(N)=O Amb18279694 [1,0,0,1,0,0|2,0,0]=4 7144 B7R1.12 N[C@@H]1C[C@@H]1C(O)=O Amb25708637 [1,0,0,1,0,0|1,0,0]=3 7145 B7R1.12 N[C@@H]1C[C@H]1C(=O)O Amb2372566 [1,0,0,1,0,0|1,0,0]=3 7146 B7R1.12 N[C@H]1C[C@@H]1C(O)=O Amb25204284 [1,0,0,1,0,0|1,0,0]=3 7147 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1Cl Amb25320863 [1,0,0,1,0,0|2,0,0]=4 7148 B7R1.12 O=C(Cl)[C@@H]1C[C@H]1F Amb24403332 [1,0,0,1,0,0|2,0,0]=4 7149 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [1,0,0,1,0,0|2,0,0]=4 7150 B7R1.12 OC(=O)C1CC1F Amb22490547 [1,0,0,1,0,0|1,0,0]=3 7151 B7R1.12 OC(=O)C1CC1S Amb20246988 [1,0,0,1,0,0|1,0,0]=3 7152 B7R1.12 OC(=O)[C@@H]1C[C@@H]1Cl Amb25209184 [1,0,0,1,0,0|1,0,0]=3 7153 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F Amb22737600 [1,0,0,1,0,0|1,0,0]=3 7154 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I Amb22756600 [1,0,0,1,0,0|1,0,0]=3 7155 B7R1.12 OC(=O)[C@@H]1C[C@H]1Br Amb24570997 [1,0,0,1,0,0|1,0,0]=3 7156 B7R1.12 OC(=O)[C@@H]1C[C@H]1F Amb22737604 [1,0,0,1,0,0|1,0,0]=3 7157 B7R1.12 OC(=O)[C@H]1C[C@@H]1F Amb22736113 [1,0,0,1,0,0|1,0,0]=3 7158 B7R1.12 OC(=O)[C@H]1C[C@H]1F Amb22738580 [1,0,0,1,0,0|1,0,0]=3 7159 B7R1.12 OC(=O)[C@H]1C[C@H]1I Amb22736654 [1,0,0,1,0,0|1,0,0]=3 7160 B7R1.12 OC1CC1C(O)=O Amb24360896 [1,0,0,1,0,0|1,0,0]=3 7161 B7R1.14 CC1(C)CC=CC1 Amb24118063 [1,0,0,1,0,0|1,0,1]=4 7162 B7R1.14 CC1(C)CC=CN1 Amb24720216 [1,0,0,1,0,0|1,0,1]=4 7163 B7R1.14 CC1(C)CCC=N1 Amb23589194 [1,0,0,1,0,0|1,0,0]=3 7164 B7R1.14 CC1(C)CCCO1 Amb22053786 [1,0,0,1,0,0|0,0,1]=3 7165 B7R1.14 CC1(C)CCC[Cl+]1 Amb24483149 [1,0,0,1,0,0|1,0,1]=4 7166 B7R1.14 CC1(C)CCSS1 Amb25358324 [1,0,0,1,0,0|1,1,0]=4 7167 B7R1.14 CC1(C)CNCC1 Amb10607828 [1,0,0,1,0,0|2,0,0]=4 7168 B7R1.14 CC1(C)CNCC1 Amb19308490 [1,0,0,1,0,0|2,0,0]=4 7169 B7R1.14 CC1(C)COC=C1 Amb25091019 [1,0,0,1,0,0|2,0,0]=4 7170 B7R1.14 CC1(C)N=CCS1 Amb25782720 [1,0,0,1,0,0|2,0,0]=4 7171 B7R1.14 CC1(C)NCCO1 Amb25083606 [1,0,0,1,0,0|1,0,1]=4 7172 B7R1.14 CC1(C)OCNC1 Amb17506151 [1,0,0,1,0,0|1,0,1]=4 7173 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [1,0,0,1,0,0|2,0,0]=4 7174 B7R1.14 NC1(O)CCCC1 Amb24465053 [1,0,0,1,0,0|1,0,1]=4 7175 B7R1.17 CC1(C)CCC1S Amb25719512 [1,0,0,1,0,0|0,1,1]=4 7176 B7R1.17 CC1(C)OCC1O Amb24479212 [1,0,0,1,0,0|1,0,1]=4 7177 B7R1.17 CC1(N)COC1=O Amb24626106 [1,0,0,1,0,0|2,0,0]=4 7178 B7R1.17 CC1(O)CC[C@H]1O Amb25107621 [1,0,0,1,0,0|1,0,1]=4 7179 B7R1.17 CC1(O)CNC1=O Amb24560284 [1,0,0,1,0,0|2,0,0]=4 7180 B7R1.17 CC1CCC1(C)O Amb24620558 [1,0,0,1,0,0|1,0,1]=4 7181 B7R1.17 CC1CCS1(=O)=O Amb22364950 [1,0,0,1,0,0|1,0,1]=4 7182 B7R1.17 O=C1OCC1(C)C Amb17619458 [1,0,0,1,0,0|1,0,0]=3 7183 B7R1.18 CC(=C)C1CCC1 Amb25662691 [1,0,0,1,0,0|2,0,0]=4 7184 B7R1.18 CC(=O)C1CCO1 Amb25745997 [1,0,0,1,0,0|2,0,0]=4 7185 B7R1.18 CC(=O)C1CCS1 Amb24105980 [1,0,0,1,0,0|2,0,0]=4 7186 B7R1.18 CC(=O)C1CNC1 Amb23400009 [1,0,0,1,0,0|2,0,0]=4 7187 B7R1.18 CC(=O)C1CNC1 Amb23401240 [1,0,0,1,0,0|2,0,0]=4 7188 B7R1.18 CC(=O)N1CCC1 Amb22008358 [1,0,0,1,0,0|2,0,0]=4 7189 B7R1.18 CC(C)C1CCC1 Amb24479859 [1,0,0,1,0,0|1,0,1]=4 7190 B7R1.18 CC(C)C1CNC1 Amb22059801 [1,0,0,1,0,0|2,0,0]=4 7191 B7R1.18 CC(C1CCC1)O Amb10603414 [1,0,0,1,0,0|1,0,1]=4 7192 B7R1.18 CC(N)C1CCO1 Amb25377427 [1,0,0,1,0,0|1,0,1]=4 7193 B7R1.18 C[C@@H](O)C1CCC1 Amb24478546 [1,0,0,1,0,0|1,0,1]=4 7194 B7R1.18 C[C@H](O)C1CCC1 Amb25145632 [1,0,0,1,0,0|1,0,1]=4 7195 B7R1.18 C[C@H](O)[C@@H]1CCO1 Amb25745486 [1,0,0,1,0,0|1,0,1]=4 7196 B7R1.18 C[C@H](O)[C@H]1CCO1 Amb25256565 [1,0,0,1,0,0|1,0,1]=4 7197 B7R1.18 NC(=N)C1CCC1 Amb19894979 [1,0,0,1,0,0|2,0,0]=4 7198 B7R1.18 NC(=O)C1CCN1 Amb22230240 [1,0,0,1,0,0|2,0,0]=4 7199 B7R1.18 NC(=O)C1CCN1 Amb22491865 [1,0,0,1,0,0|2,0,0]=4 7200 B7R1.18 NC(=O)C1CCO1 Amb24478900 [1,0,0,1,0,0|2,0,0]=4 7201 B7R1.18 NC(=O)C1CNC1 Amb10976072 [1,0,0,1,0,0|2,0,0]=4 7202 B7R1.18 NC(=O)C1CNC1 Amb20061301 [1,0,0,1,0,0|2,0,0]=4 7203 B7R1.18 NC(=O)C1CNC1 Amb21960249 [1,0,0,1,0,0|2,0,0]=4 7204 B7R1.18 NC(=O)N1CCC1 Amb25326782 [1,0,0,1,0,0|2,0,0]=4 7205 B7R1.18 NC(=S)C1CCC1 Amb18108358 [1,0,0,1,0,0|1,1,0]=4 7206 B7R1.18 O=C(Cl)C1COC1 Amb25201101 [1,0,0,1,0,0|2,0,0]=4 7207 B7R1.18 OB(C1CCC1)O Amb10071491 [1,0,0,1,0,0|1,0,1]=4 7208 B7R1.18 OC(=O)C1=CCC1 Amb17593068 [1,0,0,1,0,0|0,0,2]=4 7209 B7R1.18 OC(=O)C1CCN1 Amb2371568 [1,0,0,1,0,0|1,0,0]=3 7210 B7R1.18 OC(=O)C1CCO1 Amb2383526 [1,0,0,1,0,0|1,0,0]=3 7211 B7R1.18 OC(=O)C1CNC1 Amb2444164 [1,0,0,1,0,0|1,0,0]=3 7212 B7R1.18 OC(=O)C1CSC1 Amb20171470 [1,0,0,1,0,0|1,0,0]=3 7213 B7R1.18 OP(=O)C1CNC1 Amb25212879 [1,0,0,1,0,0|2,0,0]=4 7214 B7R1.18 [O-][N+](=O)C1CCC1 Amb13883563 [1,0,0,1,0,0|1,0,1]=4 7215 B7R1.20 CC(=O)CC1CC1 Amb10603417 [1,0,0,1,0,0|1,0,0]=3 7216 B7R1.20 CC(=O)CC1CO1 Amb25718439 [1,0,0,1,0,0|2,0,0]=4 7217 B7R1.20 CC(=O)OC1CC1 Amb24334499 [1,0,0,1,0,0|2,0,0]=4 7218 B7R1.20 CC(C)CC1CN1 Amb22228397 [1,0,0,1,0,0|1,0,1]=4 7219 B7R1.20 CC(C)CC1CO1 Amb24631080 [1,0,0,1,0,0|0,0,1]=3 7220 B7R1.20 CC(O)CC1CO1 Amb25745084 [1,0,0,1,0,0|1,0,1]=4 7221 B7R1.20 CN(C)C[C@H]1CO1 Amb24449903 [1,0,0,1,0,0|1,0,1]=4 7222 B7R1.20 CN(CC1OC1)C Amb1139214 [1,0,0,1,0,0|1,0,1]=4 7223 B7R1.20 C[C@@H](O)CC1CC1 Amb22896775 [1,0,0,1,0,0|1,0,1]=4 7224 B7R1.20 C[C@@H](O)CC1CO1 Amb24644146 [1,0,0,1,0,0|1,0,1]=4 7225 B7R1.20 C[C@@H](O)C[C@@H]1CO1 Amb24630371 [1,0,0,1,0,0|1,0,1]=4 7226 B7R1.20 C[C@H](O)CC1CO1 Amb25687860 [1,0,0,1,0,0|1,0,1]=4 7227 B7R1.20 NC(=N)CC1CC1 Amb21964664 [1,0,0,1,0,0|2,0,0]=4 7228 B7R1.20 NC(=O)CC1CO1 Amb24654802 [1,0,0,1,0,0|2,0,0]=4 7229 B7R1.20 NC(=O)NC1CC1 Amb1152776 [1,0,0,1,0,0|2,0,0]=4 7230 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [1,0,0,1,0,0|1,0,0]=3 7231 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [1,0,0,1,0,0|2,0,0]=4 7232 B7R1.20 OC(=O)CC1CO1 Amb25244347 [1,0,0,1,0,0|1,0,0]=3 7233 B7R1.20 [O-][N+](=O)CC1CC1 Amb23589308 [1,0,0,1,0,0|1,0,1]=4 7234 B7R1.23 CC1(Br)CC1C=O Amb25679179 [1,0,0,1,0,0|1,0,0]=3 7235 B7R1.23 CC1(Br)CC1CO Amb25169573 [1,0,0,1,0,0|1,0,1]=4 7236 B7R1.23 CC1(C)CC1CI Amb22011874 [1,0,0,1,0,0|1,0,1]=4 7237 B7R1.23 CC1(C)CC1CN Amb19515077 [1,0,0,1,0,0|1,0,1]=4 7238 B7R1.23 CC1(C)OC1C=C Amb25070612 [1,0,0,1,0,0|2,0,0]=4 7239 B7R1.23 CC1(C)OC1C=O Amb24724709 [1,0,0,1,0,0|1,0,0]=3 7240 B7R1.23 CC1(Cl)CC1C=C Amb24528572 [1,0,0,1,0,0|2,0,0]=4 7241 B7R1.23 CC1(Cl)CC1CO Amb24332500 [1,0,0,1,0,0|1,0,1]=4 7242 B7R1.23 CCC1CC1(C)C Amb24333362 [1,0,0,1,0,0|1,0,1]=4 7243 B7R1.23 CCC1CC1(C)O Amb24334471 [1,0,0,1,0,0|1,0,1]=4 7244 B7R1.23 CNC1CC1(C)C Amb18279475 [1,0,0,1,0,0|2,0,0]=4 7245 B7R1.23 C[C@@]1(Br)C[C@H]1CO Amb25215743 [1,0,0,1,0,0|1,0,1]=4 7246 B7R1.23 NCC1CC1(C)C Amb10608232 [1,0,0,1,0,0|1,0,1]=4 7247 B7R1.23 O=CC1CC1(Cl)Cl Amb25187914 [1,0,0,1,0,0|2,0,0]=4 7248 B7R1.23 O=CC1CC1(F)F Amb22002395 [1,0,0,1,0,0|2,0,0]=4 7249 B7R1.23 OCC1CC1(C)C Amb10608336 [1,0,0,1,0,0|0,0,1]=3 7250 B7R1.16 CC1(C)CC(=O)C1 Amb24117921 [0,0,0,1,1,0|1,0,0]=3 7251 B7R1.16 CC1(C)CC(=O)N1 Amb19515692 [0,0,0,1,1,0|1,0,0]=3 7252 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [0,0,0,1,1,0|0,0,0]=2 7253 B7R1.16 CC1(C)CC(O)S1 Amb24431332 [0,0,0,1,1,0|0,1,1]=4 7254 B7R1.16 CC1CC(C)(O)C1 Amb25769307 [0,0,0,1,1,0|1,0,1]=4 7255 B7R1.16 OC1CP(O)(=O)C1 Amb25811046 [0,0,0,1,1,0|2,0,0]=4 7256 B9R1.35 C=C1CNC(C1)C(O)=O Amb24594868 [0,0,0,1,0,1|0,0,2]=4 7257 B9R1.35 CC(=O)C1CC(Br)CO1 Amb24391544 [0,0,0,1,0,1|2,0,0]=4 7258 B9R1.35 CC(=O)C1CCC(Cl)C1 Amb24064130 [0,0,0,1,0,1|2,0,0]=4 7259 B9R1.35 CC(=O)C1CCC(O)C1 Amb24364135 [0,0,0,1,0,1|2,0,0]=4 7260 B9R1.35 CC(=O)C=1CC[C@H](C)C1 Amb24689488 [0,0,0,1,0,1|1,0,1]=4 7261 B9R1.35 CC(=O)N1CC(Br)CC1 Amb21861126 [0,0,0,1,0,1|2,0,0]=4 7262 B9R1.35 CC(=O)N1CC(Cl)CC1 Amb21861140 [0,0,0,1,0,1|2,0,0]=4 7263 B9R1.35 CC(=O)N1CC(I)CC1 Amb21861147 [0,0,0,1,0,1|2,0,0]=4 7264 B9R1.35 CC(=O)N1CC(N)CC1 Amb20669217 [0,0,0,1,0,1|2,0,0]=4 7265 B9R1.35 CC(=O)N1CC(O)CC1 Amb20622704 [0,0,0,1,0,1|2,0,0]=4 7266 B9R1.35 CC(=O)N1CCC(N)C1 Amb17739841 [0,0,0,1,0,1|2,0,0]=4 7267 B9R1.35 CC(=O)N1CC[C@@H](O)C1 Amb17935744 [0,0,0,1,0,1|2,0,0]=4 7268 B9R1.35 CC(=O)N1CC[C@H](O)C1 Amb17935745 [0,0,0,1,0,1|2,0,0]=4 7269 B9R1.35 CC(=O)N1C[C@@H](Br)CC1 Amb22227522 [0,0,0,1,0,1|2,0,0]=4 7270 B9R1.35 CC(=O)N1C[C@@H](Cl)CC1 Amb22227524 [0,0,0,1,0,1|2,0,0]=4 7271 B9R1.35 CC(=O)N1C[C@@H](I)CC1 Amb22227531 [0,0,0,1,0,1|2,0,0]=4 7272 B9R1.35 CC(=O)N1C[C@@H](N)CC1 Amb19890016 [0,0,0,1,0,1|2,0,0]=4 7273 B9R1.35 CC(=O)N1C[C@@H](N)CC1 Amb22227520 [0,0,0,1,0,1|2,0,0]=4 7274 B9R1.35 CC(=O)N1C[C@H](Br)CC1 Amb22227483 [0,0,0,1,0,1|2,0,0]=4 7275 B9R1.35 CC(=O)N1C[C@H](Cl)CC1 Amb22227481 [0,0,0,1,0,1|2,0,0]=4 7276 B9R1.35 CC(=O)N1C[C@H](I)CC1 Amb22227495 [0,0,0,1,0,1|2,0,0]=4 7277 B9R1.35 CC(=O)N1C[C@H](N)CC1 Amb19891343 [0,0,0,1,0,1|2,0,0]=4 7278 B9R1.35 CC(=O)N1C[C@H](N)CC1 Amb22227487 [0,0,0,1,0,1|2,0,0]=4 7279 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [0,0,0,1,0,1|1,0,1]=4 7280 B9R1.35 CC(=O)[C@H]1CCC(=O)O1 Amb24524212 [0,0,0,1,0,1|1,0,1]=4 7281 B9R1.35 CC(Br)C1CCC(=O)O1 Amb25074658 [0,0,0,1,0,1|1,0,0]=3 7282 B9R1.35 CC(C)=C1CC(=O)CC1 Amb25370822 [0,0,0,1,0,1|1,0,1]=4 7283 B9R1.35 CC(C)=C1CCC(=O)N1 Amb25147121 [0,0,0,1,0,1|1,0,1]=4 7284 B9R1.35 CC(C)C1=NCC(=O)O1 Amb25174180 [0,0,0,1,0,1|0,0,1]=3 7285 B9R1.35 CC(C)C1=NNC(=O)O1 Amb20246867 [0,0,0,1,0,1|1,0,1]=4 7286 B9R1.35 CC(C)C1CC(=O)CC1 Amb25147190 [0,0,0,1,0,1|1,0,0]=3 7287 B9R1.35 CC(C)C1CC(=O)CO1 Amb25851479 [0,0,0,1,0,1|1,0,0]=3 7288 B9R1.35 CC(C)C1CC(=O)CS1 Amb25263073 [0,0,0,1,0,1|1,0,0]=3 7289 B9R1.35 CC(C)C1CC(=O)NC1 Amb19305356 [0,0,0,1,0,1|1,0,0]=3 7290 B9R1.35 CC(C)C1CC(=O)NN1 Amb24071475 [0,0,0,1,0,1|2,0,0]=4 7291 B9R1.35 CC(C)C1CC(O)CC1 Amb25795756 [0,0,0,1,0,1|1,0,1]=4 7292 B9R1.35 CC(C)C1CC=C(C)N1 Amb24376657 [0,0,0,1,0,1|2,0,0]=4 7293 B9R1.35 CC(C)C1CCC(=O)N1 Amb24120594 [0,0,0,1,0,1|1,0,0]=3 7294 B9R1.35 CC(C)C1CCC(O)O1 Amb24370027 [0,0,0,1,0,1|0,0,2]=4 7295 B9R1.35 CC(C)C1CN=C(Cl)O1 Amb25223968 [0,0,0,1,0,1|1,0,0]=3 7296 B9R1.35 CC(C)C1CN=C(N)N1 Amb25805876 [0,0,0,1,0,1|2,0,0]=4 7297 B9R1.35 CC(C)C1CN=C(S)O1 Amb24708340 [0,0,0,1,0,1|0,1,0]=3 7298 B9R1.35 CC(C)C1CNC(=S)S1 Amb24679022 [0,0,0,1,0,1|0,2,0]=4 7299 B9R1.35 CC(C)C1COC(N)=N1 Amb23449373 [0,0,0,1,0,1|2,0,0]=4 7300 B9R1.35 CC(C)C1NNC(=O)O1 Amb25241817 [0,0,0,1,0,1|1,0,0]=3 7301 B9R1.35 CC(C)N1CC(=O)CC1 Amb22587607 [0,0,0,1,0,1|1,0,0]=3 7302 B9R1.35 CC(C)N1CCC(Cl)=N1 Amb24679506 [0,0,0,1,0,1|2,0,0]=4 7303 B9R1.35 CC(C)N1CCC(O)C1 Amb21618751 [0,0,0,1,0,1|1,0,1]=4 7304 B9R1.35 CC(C)N1CC[C@H](O)C1 Amb25347097 [0,0,0,1,0,1|1,0,1]=4 7305 B9R1.35 CC(C)[C@@H]1CC(=O)C=C1 Amb25712979 [0,0,0,1,0,1|1,0,1]=4 7306 B9R1.35 CC(C)[C@@H]1CC(O)OC1 Amb25740671 [0,0,0,1,0,1|1,0,1]=4 7307 B9R1.35 CC(C)[C@@H]1CCC(=O)N1 Amb24476688 [0,0,0,1,0,1|1,0,0]=3 7308 B9R1.35 CC(C)[C@@H]1COC(=S)N1 Amb22338994 [0,0,0,1,0,1|1,1,0]=4 7309 B9R1.35 CC(C)[C@@H]1COC(N)=N1 Amb25111610 [0,0,0,1,0,1|2,0,0]=4 7310 B9R1.35 CC(C)[C@H]1CC(=O)NC1 Amb24446919 [0,0,0,1,0,1|1,0,0]=3 7311 B9R1.35 CC(C)[C@H]1CNC(=O)N1 Amb25679662 [0,0,0,1,0,1|1,0,0]=3 7312 B9R1.35 CC(C)[C@H]1CNC(=O)O1 Amb25770277 [0,0,0,1,0,1|0,0,0]=2 7313 B9R1.35 CC(C)[C@H]1COC(=S)N1 Amb22338996 [0,0,0,1,0,1|1,1,0]=4 7314 B9R1.35 CC(C)[C@H]1CSC(=O)N1 Amb25804129 [0,0,0,1,0,1|1,0,0]=3 7315 B9R1.35 CC(C)[C@H]1C[C@@H](O)CC1 Amb24661016 [0,0,0,1,0,1|1,0,1]=4 7316 B9R1.35 CC(C1CNC(=O)N1)C Amb17506854 [0,0,0,1,0,1|1,0,0]=3 7317 B9R1.35 CC(C1COC(=O)N1)C Amb10071773 [0,0,0,1,0,1|1,0,0]=3 7318 B9R1.35 CC(C1COC(=S)N1)C Amb10068057 [0,0,0,1,0,1|1,1,0]=4 7319 B9R1.35 CC(C1CSC(=S)N1)C Amb10068056 [0,0,0,1,0,1|1,1,0]=4 7320 B9R1.35 CC(Cl)C1CCC(=O)O1 Amb25060676 [0,0,0,1,0,1|1,0,0]=3 7321 B9R1.35 CC(N)C1CC(=O)NC1 Amb24456534 [0,0,0,1,0,1|2,0,0]=4 7322 B9R1.35 CC(N)C1CCC(=O)O1 Amb24477799 [0,0,0,1,0,1|1,0,0]=3 7323 B9R1.35 CC(O)C1=CCC(=O)O1 Amb24756799 [0,0,0,1,0,1|1,0,1]=4 7324 B9R1.35 CC(O)C1CC(=O)CS1 Amb25087194 [0,0,0,1,0,1|2,0,0]=4 7325 B9R1.35 CC(O)C1CC(=O)OC1 Amb25739837 [0,0,0,1,0,1|2,0,0]=4 7326 B9R1.35 CC(O)C1CC(=O)SC1 Amb24703668 [0,0,0,1,0,1|2,0,0]=4 7327 B9R1.35 CC(O)C1CCC(=O)N1 Amb24386014 [0,0,0,1,0,1|2,0,0]=4 7328 B9R1.35 CC(O)C1COC(=O)O1 Amb24592152 [0,0,0,1,0,1|1,0,0]=3 7329 B9R1.35 CC1=CC(SC1)C(=O)O Amb10809142 [0,0,0,1,0,1|0,0,2]=4 7330 B9R1.35 CC1=NC(CO1)C(O)=O Amb20621597 [0,0,0,1,0,1|1,0,1]=4 7331 B9R1.35 CC1=NC(CS1)C(O)=O Amb18124720 [0,0,0,1,0,1|1,0,1]=4 7332 B9R1.35 CC1C=CC(O1)C(O)=O Amb18642586 [0,0,0,1,0,1|1,0,1]=4 7333 B9R1.35 CC1C=CC(S1)C(O)=O Amb18644111 [0,0,0,1,0,1|1,0,1]=4 7334 B9R1.35 CC1CC(=CC1)C(O)=O Amb18642398 [0,0,0,1,0,1|0,0,1]=3 7335 B9R1.35 CC1CC(=NO1)C(O)=O Amb25694020 [0,0,0,1,0,1|1,0,1]=4 7336 B9R1.35 CC1CC(CC1)C(N)=N Amb25825672 [0,0,0,1,0,1|2,0,0]=4 7337 B9R1.35 CC1CC(CC1)C(N)=O Amb24763749 [0,0,0,1,0,1|1,0,0]=3 7338 B9R1.35 CC1CC(CC1)C(N)=S Amb25140648 [0,0,0,1,0,1|1,1,0]=4 7339 B9R1.35 CC1CC(CC1)C(O)=O Amb18642624 [0,0,0,1,0,1|0,0,0]=2 7340 B9R1.35 CC1CC(CN1)C(O)=O Amb18832566 [0,0,0,1,0,1|0,0,0]=2 7341 B9R1.35 CC1CC(CO1)B(O)O Amb24314281 [0,0,0,1,0,1|1,0,1]=4 7342 B9R1.35 CC1CC(CO1)C(=O)Cl Amb25832627 [0,0,0,1,0,1|1,0,0]=3 7343 B9R1.35 CC1CC(CO1)C(C)O Amb25732800 [0,0,0,1,0,1|1,0,1]=4 7344 B9R1.35 CC1CC(N=C1)C(O)=O Amb24650545 [0,0,0,1,0,1|0,0,1]=3 7345 B9R1.35 CC1CCC(=C1)C(O)=O Amb18642397 [0,0,0,1,0,1|0,0,1]=3 7346 B9R1.35 CC1CCC(C1)C(C)=O Amb25077503 [0,0,0,1,0,1|1,0,0]=3 7347 B9R1.35 CC1CCC(C1)C(C)O Amb24447243 [0,0,0,1,0,1|1,0,1]=4 7348 B9R1.35 CC1CCC(N1)C(N)=O Amb18642667 [0,0,0,1,0,1|2,0,0]=4 7349 B9R1.35 CC1CCC(N1)C(O)=O Amb18832572 [0,0,0,1,0,1|1,0,0]=3 7350 B9R1.35 CC1CCC(O1)C(=O)O Amb17593370 [0,0,0,1,0,1|1,0,0]=3 7351 B9R1.35 CC1CCC(O1)C(C)=O Amb24580538 [0,0,0,1,0,1|2,0,0]=4 7352 B9R1.35 CC1CCC(S1)C(O)=O Amb25719281 [0,0,0,1,0,1|1,0,0]=3 7353 B9R1.35 CC1CCC([NH2+]1)C(O)=O Amb22372047 [0,0,0,1,0,1|1,0,0]=3 7354 B9R1.35 CC1CC[C@@H](N1)C(O)=O Amb22748252 [0,0,0,1,0,1|1,0,0]=3 7355 B9R1.35 CC1CC[C@H](N1)C(N)=O Amb24696154 [0,0,0,1,0,1|2,0,0]=4 7356 B9R1.35 CC1CN(CC1)C(C)=N Amb25055962 [0,0,0,1,0,1|2,0,0]=4 7357 B9R1.35 CC1CN(CC1)C(N)=O Amb25692037 [0,0,0,1,0,1|1,0,0]=3 7358 B9R1.35 CC1CN(CO1)C(=O)Cl Amb25839832 [0,0,0,1,0,1|2,0,0]=4 7359 B9R1.35 CC1CNC(O1)C(C)C Amb17506164 [0,0,0,1,0,1|1,0,1]=4 7360 B9R1.35 CC1CNC(O1)C(O)=O Amb25737834 [0,0,0,1,0,1|1,0,0]=3 7361 B9R1.35 CC1CSC(=C1)C(O)=O Amb25044433 [0,0,0,1,0,1|0,0,2]=4 7362 B9R1.35 CC1CSC(S1)C(C)=O Amb24676738 [0,0,0,1,0,1|2,0,0]=4 7363 B9R1.35 CC1CSC(S1)C(O)=O Amb24608602 [0,0,0,1,0,1|1,0,0]=3 7364 B9R1.35 CC1C[C@H](N=C1)C(O)=O Amb24394037 [0,0,0,1,0,1|0,0,1]=3 7365 B9R1.35 CC1N=C(CS1)C(O)=O Amb24099770 [0,0,0,1,0,1|1,0,1]=4 7366 B9R1.35 CC1N[C@@H](CS1)C(=O)O Amb16203706 [0,0,0,1,0,1|1,0,0]=3 7367 B9R1.35 CC=1CC(CC1)C(O)=O Amb18642425 [0,0,0,1,0,1|0,0,1]=3 7368 B9R1.35 CC=1CC(NC1)C(O)=O Amb25772613 [0,0,0,1,0,1|0,0,2]=4 7369 B9R1.35 CC=1CCC(N1)C(O)=O Amb23438203 [0,0,0,1,0,1|1,0,1]=4 7370 B9R1.35 CC=1CCC([NH+]1)C(O)=O Amb22372048 [0,0,0,1,0,1|1,0,1]=4 7371 B9R1.35 CC=1C[C@H](CC1)C(N)=O Amb24547973 [0,0,0,1,0,1|1,0,1]=4 7372 B9R1.35 CC=1C[C@H](CC1)C(O)=O Amb24350803 [0,0,0,1,0,1|0,0,1]=3 7373 B9R1.35 CC=1C[C@H](ON1)C(O)=O Amb25189709 [0,0,0,1,0,1|1,0,1]=4 7374 B9R1.35 CC=1NC(CN1)C(O)=O Amb24599993 [0,0,0,1,0,1|1,0,1]=4 7375 B9R1.35 CN(C)C1CC(=O)CC1 Amb24445836 [0,0,0,1,0,1|2,0,0]=4 7376 B9R1.35 CN1CC(=CC1)C(O)=O Amb25032089 [0,0,0,1,0,1|1,0,1]=4 7377 B9R1.35 CN1CC(CC1)C(N)=O Amb25144200 [0,0,0,1,0,1|2,0,0]=4 7378 B9R1.35 CN1CCC(N1)C(O)=O Amb25854311 [0,0,0,1,0,1|2,0,0]=4 7379 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22746030 [0,0,0,1,0,1|1,0,0]=3 7380 B9R1.35 CN1C[C@@H](CC1)C(O)=O Amb22756448 [0,0,0,1,0,1|1,0,0]=3 7381 B9R1.35 C[C@@H](Br)[C@@H]1C=CC(=O)O1 Amb24552862 [0,0,0,1,0,1|1,0,1]=4 7382 B9R1.35 C[C@@H](N)[C@@H]1CC(=O)NC1 Amb25251199 [0,0,0,1,0,1|2,0,0]=4 7383 B9R1.35 C[C@@H](O)C=1CCC(=O)C1 Amb25093670 [0,0,0,1,0,1|2,0,0]=4 7384 B9R1.35 C[C@@H](O)[C@@H]1C=CC(=O)O1 Amb25373835 [0,0,0,1,0,1|1,0,1]=4 7385 B9R1.35 C[C@@H](O)[C@@H]1CC(=O)NC1 Amb25251245 [0,0,0,1,0,1|2,0,0]=4 7386 B9R1.35 C[C@@H](O)[C@@H]1CCC(=O)N1 Amb25305303 [0,0,0,1,0,1|2,0,0]=4 7387 B9R1.35 C[C@@H](O)[C@H]1C=CC(=O)O1 Amb24691316 [0,0,0,1,0,1|1,0,1]=4 7388 B9R1.35 C[C@@H](O)[C@H]1CC(=O)OC1 Amb25215452 [0,0,0,1,0,1|2,0,0]=4 7389 B9R1.35 C[C@@H]1CC[C@@H](C1)C(=O)O Amb10843961 [0,0,0,1,0,1|0,0,0]=2 7390 B9R1.35 C[C@@H]1CC[C@@H](N1)C(N)=O Amb24572556 [0,0,0,1,0,1|2,0,0]=4 7391 B9R1.35 C[C@@H]1CC[C@@H](N1)C(O)=O Amb24399449 [0,0,0,1,0,1|1,0,0]=3 7392 B9R1.35 C[C@@H]1CC[C@@H](O1)C(O)=O Amb22886534 [0,0,0,1,0,1|1,0,0]=3 7393 B9R1.35 C[C@@H]1CS[C@H](S1)C(=O)Cl Amb25110654 [0,0,0,1,0,1|2,0,0]=4 7394 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb19887682 [0,0,0,1,0,1|0,0,0]=2 7395 B9R1.35 C[C@@H]1C[C@@H](NC1)C(O)=O Amb23439040 [0,0,0,1,0,1|0,0,0]=2 7396 B9R1.35 C[C@@H]1C[C@@H](ON1)C(O)=O Amb24680946 [0,0,0,1,0,1|1,0,0]=3 7397 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22008683 [0,0,0,1,0,1|0,0,0]=2 7398 B9R1.35 C[C@@H]1C[C@H](NC1)C(O)=O Amb22752452 [0,0,0,1,0,1|0,0,0]=2 7399 B9R1.35 C[C@@H]1N[C@H](CS1)C(O)=O Amb25294278 [0,0,0,1,0,1|1,0,0]=3 7400 B9R1.35 C[C@H](N)[C@@H]1CCC(=O)O1 Amb24514821 [0,0,0,1,0,1|1,0,0]=3 7401 B9R1.35 C[C@H](O)C=1CCC(=O)C1 Amb24722795 [0,0,0,1,0,1|2,0,0]=4 7402 B9R1.35 C[C@H](O)[C@@H]1CCC(=O)O1 Amb25240058 [0,0,0,1,0,1|1,0,0]=3 7403 B9R1.35 C[C@H](O)[C@H]1CCC(=O)O1 Amb25236263 [0,0,0,1,0,1|1,0,0]=3 7404 B9R1.35 C[C@H]1CC[C@@H](N1)C(O)=O Amb25260830 [0,0,0,1,0,1|1,0,0]=3 7405 B9R1.35 C[C@H]1CC[C@H](C1)C(=O)O Amb10843955 [0,0,0,1,0,1|0,0,0]=2 7406 B9R1.35 C[C@H]1CC[C@H](N1)C(O)=O Amb24598417 [0,0,0,1,0,1|1,0,0]=3 7407 B9R1.35 C[C@H]1CC[C@H](O1)C(O)=O Amb24651587 [0,0,0,1,0,1|1,0,0]=3 7408 B9R1.35 C[C@H]1C[C@@H](CC1)C(N)=O Amb24612116 [0,0,0,1,0,1|1,0,0]=3 7409 B9R1.35 C[C@H]1C[C@@H](NC1)C(O)=O Amb24752952 [0,0,0,1,0,1|0,0,0]=2 7410 B9R1.35 C[C@H]1C[C@H](CN1)C(O)=O Amb24715999 [0,0,0,1,0,1|0,0,0]=2 7411 B9R1.35 C[C@H]1C[C@H](NC1)C(O)=O Amb19888348 [0,0,0,1,0,1|0,0,0]=2 7412 B9R1.35 C[C@H]1N[C@@H](CS1)C(O)=O Amb25347352 [0,0,0,1,0,1|1,0,0]=3 7413 B9R1.35 C[C@H]1O[C@H](CS1)C(O)=O Amb24625718 [0,0,0,1,0,1|1,0,0]=3 7414 B9R1.35 NC(=O)C1CC(CN1)O Amb1152420 [0,0,0,1,0,1|2,0,0]=4 7415 B9R1.35 NC(=O)C1CC(F)CN1 Amb21963545 [0,0,0,1,0,1|2,0,0]=4 7416 B9R1.35 NC(=O)C1CCC(O)C1 Amb25230928 [0,0,0,1,0,1|2,0,0]=4 7417 B9R1.35 NC(=O)N1CC(O)CC1 Amb24635585 [0,0,0,1,0,1|2,0,0]=4 7418 B9R1.35 NC(=O)N1C[C@@H](O)CC1 Amb24478790 [0,0,0,1,0,1|2,0,0]=4 7419 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22747998 [0,0,0,1,0,1|2,0,0]=4 7420 B9R1.35 NC(=O)[C@@H]1CC(F)CN1 Amb22748232 [0,0,0,1,0,1|2,0,0]=4 7421 B9R1.35 NC(=O)[C@@H]1CC[C@H](S)C1 Amb25290990 [0,0,0,1,0,1|2,0,0]=4 7422 B9R1.35 NC(=O)[C@@H]1C[C@@H](CN1)F Amb10808100 [0,0,0,1,0,1|2,0,0]=4 7423 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745766 [0,0,0,1,0,1|2,0,0]=4 7424 B9R1.35 NC(=O)[C@@H]1C[C@@H](F)CN1 Amb22745768 [0,0,0,1,0,1|2,0,0]=4 7425 B9R1.35 NC(=O)[C@@H]1C[C@@H](O)CN1 Amb24061354 [0,0,0,1,0,1|2,0,0]=4 7426 B9R1.35 NC(=O)[C@@H]1C[C@H](F)CN1 Amb22745753 [0,0,0,1,0,1|2,0,0]=4 7427 B9R1.35 NC(=O)[C@H]1C[C@@H](F)CN1 Amb25256284 [0,0,0,1,0,1|2,0,0]=4 7428 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24575802 [0,0,0,1,0,1|2,0,0]=4 7429 B9R1.35 NC(=O)[C@H]1C[C@H](O)CN1 Amb24586279 [0,0,0,1,0,1|2,0,0]=4 7430 B9R1.35 NC1CC(=CC1)C(O)=O Amb18642495 [0,0,0,1,0,1|1,0,1]=4 7431 B9R1.35 NC1CC(C=C1)C(O)=O Amb20622377 [0,0,0,1,0,1|1,0,1]=4 7432 B9R1.35 NC1CC(C=C1)C(O)=O Amb20623555 [0,0,0,1,0,1|1,0,1]=4 7433 B9R1.35 NC1CC(NC1)C(=O)O Amb10608922 [0,0,0,1,0,1|1,0,0]=3 7434 B9R1.35 NC1CC(OC1)C(O)=O Amb18642828 [0,0,0,1,0,1|1,0,0]=3 7435 B9R1.35 NC1CC(SC1)C(O)=O Amb18831415 [0,0,0,1,0,1|1,0,0]=3 7436 B9R1.35 NC1CCC(=C1)C(O)=O Amb18642496 [0,0,0,1,0,1|1,0,1]=4 7437 B9R1.35 NC1CCC(C1)C(=O)O Amb10066880 [0,0,0,1,0,1|1,0,0]=3 7438 B9R1.35 NC1CCC(C1)C(N)=O Amb25104222 [0,0,0,1,0,1|2,0,0]=4 7439 B9R1.35 NC1CN(CC1)C(N)=O Amb18943828 [0,0,0,1,0,1|2,0,0]=4 7440 B9R1.35 NC1CN(CC1)C(N)=O Amb19373727 [0,0,0,1,0,1|2,0,0]=4 7441 B9R1.35 NC1CSC(C1)C(N)=O Amb24638225 [0,0,0,1,0,1|2,0,0]=4 7442 B9R1.35 NC1NC(CS1)C(O)=O Amb25703132 [0,0,0,1,0,1|2,0,0]=4 7443 B9R1.35 N[C@@H]1CC(=CC1)C(O)=O Amb25143919 [0,0,0,1,0,1|1,0,1]=4 7444 B9R1.35 N[C@@H]1CC(CC1)C(O)=O Amb25700807 [0,0,0,1,0,1|1,0,0]=3 7445 B9R1.35 N[C@@H]1CC[C@@H](C1)C(N)=O Amb25321319 [0,0,0,1,0,1|2,0,0]=4 7446 B9R1.35 N[C@@H]1CC[C@H](C1)C(=O)O Amb10066881 [0,0,0,1,0,1|1,0,0]=3 7447 B9R1.35 N[C@@H]1CN[C@@H](C1)C(=O)O Amb10070446 [0,0,0,1,0,1|1,0,0]=3 7448 B9R1.35 N[C@@H]1C[C@@H](C=C1)C(=O)O Amb16232675 [0,0,0,1,0,1|1,0,1]=4 7449 B9R1.35 N[C@@H]1C[C@@H](C=C1)C(O)=O Amb19515761 [0,0,0,1,0,1|1,0,1]=4 7450 B9R1.35 N[C@@H]1C[C@@H](CC1)C(O)=O Amb22746692 [0,0,0,1,0,1|1,0,0]=3 7451 B9R1.35 N[C@@H]1C[C@@H](NC1)C(O)=O Amb22008702 [0,0,0,1,0,1|1,0,0]=3 7452 B9R1.35 N[C@@H]1C[C@@H](OC1)C(O)=O Amb24548389 [0,0,0,1,0,1|1,0,0]=3 7453 B9R1.35 N[C@@H]1C[C@H](C=C1)C(O)=O Amb22746212 [0,0,0,1,0,1|1,0,1]=4 7454 B9R1.35 N[C@@H]1C[C@H](CC1)C(O)=O Amb22756038 [0,0,0,1,0,1|1,0,0]=3 7455 B9R1.35 N[C@@H]1C[C@H](NC1)C(=O)O Amb10603131 [0,0,0,1,0,1|1,0,0]=3 7456 B9R1.35 N[C@@H]1C[C@H](NC1)C(O)=O Amb22224945 [0,0,0,1,0,1|1,0,0]=3 7457 B9R1.35 N[C@@H]1C[C@H](OC1)C(O)=O Amb24117069 [0,0,0,1,0,1|1,0,0]=3 7458 B9R1.35 N[C@H]1CC(=CC1)C(O)=O Amb25824589 [0,0,0,1,0,1|1,0,1]=4 7459 B9R1.35 N[C@H]1CC[C@@H](C1)C(=O)O Amb10066883 [0,0,0,1,0,1|1,0,0]=3 7460 B9R1.35 N[C@H]1CN(CC1)C(N)=O Amb25688167 [0,0,0,1,0,1|2,0,0]=4 7461 B9R1.35 N[C@H]1CN[C@@H](C1)C(=O)O Amb10070445 [0,0,0,1,0,1|1,0,0]=3 7462 B9R1.35 N[C@H]1C[C@@H](C=C1)C(O)=O Amb24632574 [0,0,0,1,0,1|1,0,1]=4 7463 B9R1.35 N[C@H]1C[C@@H](NC1)C(O)=O Amb19515889 [0,0,0,1,0,1|1,0,0]=3 7464 B9R1.35 N[C@H]1C[C@@H](OC1)C(O)=O Amb25691536 [0,0,0,1,0,1|1,0,0]=3 7465 B9R1.35 N[C@H]1C[C@H](C=C1)C(O)=O Amb22232858 [0,0,0,1,0,1|1,0,1]=4 7466 B9R1.35 N[C@H]1C[C@H](NC1)C(=O)O Amb10603136 [0,0,0,1,0,1|1,0,0]=3 7467 B9R1.35 N[C@H]1C[C@H](NC1)C(O)=O Amb22386834 [0,0,0,1,0,1|1,0,0]=3 7468 B9R1.35 N[C@H]1C[C@H](OC1)C(O)=O Amb25799075 [0,0,0,1,0,1|1,0,0]=3 7469 B9R1.35 O=C(Cl)C1CC(Cl)CC1 Amb24707520 [0,0,0,1,0,1|2,0,0]=4 7470 B9R1.35 O=C(Cl)C1CCC(F)C1 Amb25071689 [0,0,0,1,0,1|2,0,0]=4 7471 B9R1.35 O=C1NCC(C1)C(=O)O Amb1129202 [0,0,0,1,0,1|1,0,1]=4 7472 B9R1.35 O=C1NCC(O1)C(Cl)Cl Amb24480275 [0,0,0,1,0,1|2,0,0]=4 7473 B9R1.35 O=C1OCC(O1)C(F)F Amb22387067 [0,0,0,1,0,1|2,0,0]=4 7474 B9R1.35 O=C1OC[C@@H](O1)C(Cl)Cl Amb25250604 [0,0,0,1,0,1|2,0,0]=4 7475 B9R1.35 O=C1SCC(C1)C(=O)O Amb10073724 [0,0,0,1,0,1|1,0,1]=4 7476 B9R1.35 OC(=O)C1CC(=O)CS1 Amb24061425 [0,0,0,1,0,1|1,0,1]=4 7477 B9R1.35 OC(=O)C1CC(=O)OC1 Amb22642307 [0,0,0,1,0,1|1,0,1]=4 7478 B9R1.35 OC(=O)C1CC(Br)CN1 Amb25239348 [0,0,0,1,0,1|1,0,0]=3 7479 B9R1.35 OC(=O)C1CC(CN1)F Amb10608925 [0,0,0,1,0,1|1,0,0]=3 7480 B9R1.35 OC(=O)C1CC(CN1)S Amb10608928 [0,0,0,1,0,1|1,0,0]=3 7481 B9R1.35 OC(=O)C1CC(Cl)=CC1 Amb23594523 [0,0,0,1,0,1|1,0,1]=4 7482 B9R1.35 OC(=O)C1CCC(F)C1 Amb22886545 [0,0,0,1,0,1|1,0,0]=3 7483 B9R1.35 OC(=O)C1CCC(F)N1 Amb24423850 [0,0,0,1,0,1|2,0,0]=4 7484 B9R1.35 OC(=O)C1CCC(I)C1 Amb23456141 [0,0,0,1,0,1|1,0,0]=3 7485 B9R1.35 OC(=O)C1C[C@H](F)CN1 Amb24598689 [0,0,0,1,0,1|1,0,0]=3 7486 B9R1.35 OC(=O)C=1CC(O)CN1 Amb25141429 [0,0,0,1,0,1|1,0,1]=4 7487 B9R1.35 OC(=O)[C@@H]1CC(=O)CC1 Amb22746923 [0,0,0,1,0,1|1,0,1]=4 7488 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb19516117 [0,0,0,1,0,1|1,0,1]=4 7489 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb22747440 [0,0,0,1,0,1|1,0,1]=4 7490 B9R1.35 OC(=O)[C@@H]1CC(=O)NC1 Amb23439643 [0,0,0,1,0,1|1,0,1]=4 7491 B9R1.35 OC(=O)[C@@H]1CC(F)CN1 Amb25123838 [0,0,0,1,0,1|1,0,0]=3 7492 B9R1.35 OC(=O)[C@@H]1CCC(F)N1 Amb25032254 [0,0,0,1,0,1|2,0,0]=4 7493 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)Br Amb10603137 [0,0,0,1,0,1|1,0,0]=3 7494 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)F Amb10603139 [0,0,0,1,0,1|1,0,0]=3 7495 B9R1.35 OC(=O)[C@@H]1C[C@@H](CN1)I Amb10603140 [0,0,0,1,0,1|1,0,0]=3 7496 B9R1.35 OC(=O)[C@@H]1C[C@@H](Cl)CN1 Amb24582915 [0,0,0,1,0,1|1,0,0]=3 7497 B9R1.35 OC(=O)[C@@H]1C[C@@H](S)CN1 Amb22831348 [0,0,0,1,0,1|1,0,0]=3 7498 B9R1.35 OC(=O)[C@@H]1C[C@@H](S)CN1 Amb25245369 [0,0,0,1,0,1|1,0,0]=3 7499 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)Br Amb10603132 [0,0,0,1,0,1|1,0,0]=3 7500 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)F Amb16232298 [0,0,0,1,0,1|1,0,0]=3 7501 B9R1.35 OC(=O)[C@@H]1C[C@H](CN1)I Amb10603134 [0,0,0,1,0,1|1,0,0]=3 7502 B9R1.35 OC(=O)[C@@H]1C[C@H](F)CN1 Amb22757085 [0,0,0,1,0,1|1,0,0]=3 7503 B9R1.35 OC(=O)[C@H]1CC(=O)CN1 Amb25360885 [0,0,0,1,0,1|1,0,1]=4 7504 B9R1.35 OC(=O)[C@H]1C[C@@H](CN1)F Amb10067741 [0,0,0,1,0,1|1,0,0]=3 7505 B9R1.35 OC(=O)[C@H]1C[C@H](CN1)F Amb10839999 [0,0,0,1,0,1|1,0,0]=3 7506 B9R1.35 OC(O)C1CNC(=O)O1 Amb24120430 [0,0,0,1,0,1|2,0,0]=4 7507 B9R1.35 OC1CC(C=C1)C(O)=O Amb25078348 [0,0,0,1,0,1|1,0,1]=4 7508 B9R1.35 OC1CC(N=C1)C(O)=O Amb24083052 [0,0,0,1,0,1|1,0,1]=4 7509 B9R1.35 OC1CCC(C1)C(O)=O Amb21963572 [0,0,0,1,0,1|1,0,0]=3 7510 B9R1.35 OC1CN(CC1)C(=O)Cl Amb25740939 [0,0,0,1,0,1|2,0,0]=4 7511 B9R1.35 OC1CNC(C1)C(=O)O Amb1151287 [0,0,0,1,0,1|1,0,0]=3 7512 B9R1.35 OC1CN[C@@H](C1)C(O)=O Amb25743296 [0,0,0,1,0,1|1,0,0]=3 7513 B9R1.35 OC1COC(C1)C(O)=O Amb18642869 [0,0,0,1,0,1|1,0,0]=3 7514 B9R1.35 OC1CSC(O1)C(=O)O Amb2432252 [0,0,0,1,0,1|2,0,0]=4 7515 B9R1.35 OC1NC(CS1)C(O)=O Amb25759113 [0,0,0,1,0,1|2,0,0]=4 7516 B9R1.35 O[C@@H]1CC[C@@H](C1)C(O)=O Amb22746073 [0,0,0,1,0,1|1,0,0]=3 7517 B9R1.35 O[C@@H]1CC[C@H](C1)C(O)=O Amb22746558 [0,0,0,1,0,1|1,0,0]=3 7518 B9R1.35 O[C@@H]1CC[C@H](N1)C(O)=O Amb24515622 [0,0,0,1,0,1|2,0,0]=4 7519 B9R1.35 O[C@@H]1CNC(C1)C(O)=O Amb25118054 [0,0,0,1,0,1|1,0,0]=3 7520 B9R1.35 O[C@@H]1CN[C@@H](C1)C(O)=O Amb22748218 [0,0,0,1,0,1|1,0,0]=3 7521 B9R1.35 O[C@@H]1CN[C@H](C1)C(=O)O Amb16230723 [0,0,0,1,0,1|1,0,0]=3 7522 B9R1.35 O[C@@H]1CO[C@@H](C1)C(O)=O Amb24501449 [0,0,0,1,0,1|1,0,0]=3 7523 B9R1.35 O[C@@H]1CO[C@H](C1)C(O)=O Amb24501448 [0,0,0,1,0,1|1,0,0]=3 7524 B9R1.35 O[C@@H]1CS[C@H](O1)C(O)=O Amb25288477 [0,0,0,1,0,1|2,0,0]=4 7525 B9R1.35 O[C@@H]1C[C@H](NC1)C(=O)Cl Amb25174893 [0,0,0,1,0,1|2,0,0]=4 7526 B9R1.35 O[C@H]1CNC(C1)C(O)=O Amb24682710 [0,0,0,1,0,1|1,0,0]=3 7527 B9R1.35 O[C@H]1CN[C@@H](C1)C(=O)O Amb1994991 [0,0,0,1,0,1|1,0,0]=3 7528 B9R1.35 O[C@H]1C[C@@H](NC1)C(=O)Cl Amb25175003 [0,0,0,1,0,1|2,0,0]=4 7529 B9R1.46 C=C1CC1NCC(O)=O Amb24402024 [0,0,0,1,0,1|0,0,2]=4 7530 B9R1.46 CC1CC1C#CC(O)=O Amb24390173 [0,0,0,1,0,1|0,0,1]=3 7531 B9R1.46 CC1CC1CNC(C)=O Amb25851867 [0,0,0,1,0,1|1,0,0]=3 7532 B9R1.46 CC1CC1CNC(N)=N Amb25716226 [0,0,0,1,0,1|2,0,0]=4 7533 B9R1.46 CC1CC1CNC(N)=O Amb25185082 [0,0,0,1,0,1|1,0,0]=3 7534 B9R1.46 CC1CC1CNC(N)=S Amb25847200 [0,0,0,1,0,1|1,1,0]=4 7535 B9R1.46 CC1CC1NCC(=C)Br Amb18990743 [0,0,0,1,0,1|2,0,0]=4 7536 B9R1.46 CC1CC1NCC(=C)Cl Amb18990744 [0,0,0,1,0,1|2,0,0]=4 7537 B9R1.46 CC1CC1NCC(C)=C Amb18990737 [0,0,0,1,0,1|2,0,0]=4 7538 B9R1.46 CC1CC1NCC(C)O Amb25139772 [0,0,0,1,0,1|1,0,1]=4 7539 B9R1.46 CC1CC1NCC(N)=O Amb18990531 [0,0,0,1,0,1|1,0,0]=3 7540 B9R1.46 CC1CC1NCC(O)=O Amb18993215 [0,0,0,1,0,1|0,0,0]=2 7541 B9R1.46 CC1CC1NC[C@@H](C)O Amb24644247 [0,0,0,1,0,1|1,0,1]=4 7542 B9R1.46 CC1OC1\C=C\C(O)=O Amb24475226 [0,0,0,1,0,1|1,0,1]=4 7543 B9R1.46 C[C@@H]1C[C@@H]1CCC(C)=O Amb25834668 [0,0,0,1,0,1|1,0,0]=3 7544 B9R1.46 C[C@@H]1C[C@H]1CCC(C)=O Amb25163844 [0,0,0,1,0,1|1,0,0]=3 7545 B9R1.49 CC1CCC(=O)CC=C1 Amb24340212 [0,0,0,1,0,1|1,0,1]=4 7546 B9R1.49 CC1CCC(O)OCC1 Amb24697549 [0,0,0,1,0,1|1,0,1]=4 7547 B9R1.49 CC1CCCC(=C)CC1 Amb22364866 [0,0,0,1,0,1|2,0,0]=4 7548 B9R1.49 CC1CCCC(O)CC1 Amb25146901 [0,0,0,1,0,1|1,0,1]=4 7549 B9R1.49 CC1CCNC(=N)CC1 Amb24460651 [0,0,0,1,0,1|2,0,0]=4 7550 B9R1.49 CC1CCNC(=S)CC1 Amb25230099 [0,0,0,1,0,1|1,1,0]=4 7551 B9R1.49 CC1CCOC(=O)CC1 Amb24059359 [0,0,0,1,0,1|1,0,0]=3 7552 B9R1.49 CC1CCS(=O)CCN1 Amb24413310 [0,0,0,1,0,1|2,0,0]=4 7553 B9R1.49 CC1CNC(=N)CCC1 Amb25080544 [0,0,0,1,0,1|2,0,0]=4 7554 B9R1.49 CC1CNC(=N)CCS1 Amb25732879 [0,0,0,1,0,1|2,0,0]=4 7555 B9R1.49 CC1CNC(=O)CCN1 Amb22587019 [0,0,0,1,0,1|1,0,0]=3 7556 B9R1.49 CC1CNCC(=O)NC1 Amb25372388 [0,0,0,1,0,1|1,0,0]=3 7557 B9R1.49 CC1COC(=O)NCC1 Amb24393355 [0,0,0,1,0,1|0,0,0]=2 7558 B9R1.49 CC1CSCC(=O)CS1 Amb25024961 [0,0,0,1,0,1|2,0,0]=4 7559 B9R1.49 CC1NCCC(=O)NC1 Amb10607813 [0,0,0,1,0,1|1,0,0]=3 7560 B9R1.49 CN1CCNC(=O)CC1 Amb21857545 [0,0,0,1,0,1|2,0,0]=4 7561 B9R1.49 CN1CCOC(=O)CC1 Amb25376750 [0,0,0,1,0,1|2,0,0]=4 7562 B9R1.49 CN1CNC(=O)CCC1 Amb25118592 [0,0,0,1,0,1|2,0,0]=4 7563 B9R1.49 C[C@@H]1CCC[C@@H](O)CC1 Amb24623728 [0,0,0,1,0,1|1,0,1]=4 7564 B9R1.49 C[C@@H]1CCC[C@H](O)CC1 Amb24515396 [0,0,0,1,0,1|1,0,1]=4 7565 B9R1.49 C[C@H]1CCC(O)OCC1 Amb25051811 [0,0,0,1,0,1|1,0,1]=4 7566 B9R1.49 C[C@H]1CCCC(=O)C=C1 Amb24513554 [0,0,0,1,0,1|1,0,1]=4 7567 B9R1.49 C[C@H]1CCNC(=O)CC1 Amb25146079 [0,0,0,1,0,1|1,0,0]=3 7568 B9R1.49 C[C@H]1CNC(=N)CCC1 Amb25146115 [0,0,0,1,0,1|2,0,0]=4 7569 B9R1.49 NC1CCCC(=O)CC1 Amb25259225 [0,0,0,1,0,1|2,0,0]=4 7570 B9R1.49 NC1CCNC(=O)CC1 Amb24689800 [0,0,0,1,0,1|2,0,0]=4 7571 B9R1.49 NC1CCOC(=O)CC1 Amb23598291 [0,0,0,1,0,1|2,0,0]=4 7572 B9R1.49 NC1CNC(=O)CCC1 Amb22230053 [0,0,0,1,0,1|2,0,0]=4 7573 B9R1.49 NC1CNC(=O)COC1 Amb24532819 [0,0,0,1,0,1|2,0,0]=4 7574 B9R1.49 O=C1CCC(Br)CCO1 Amb25188931 [0,0,0,1,0,1|2,0,0]=4 7575 B9R1.49 O=C1CCC(Cl)CCO1 Amb24480302 [0,0,0,1,0,1|2,0,0]=4 7576 B9R1.49 O=C1CC[C@@H](Cl)CCO1 Amb24518083 [0,0,0,1,0,1|2,0,0]=4 7577 B9R1.49 O=C1CC[C@H](Cl)CCO1 Amb25123845 [0,0,0,1,0,1|2,0,0]=4 7578 B9R1.49 OC1CCOC(=O)CC1 Amb23598292 [0,0,0,1,0,1|2,0,0]=4 7579 B9R1.49 OC1CNC(=O)CCC1 Amb22491274 [0,0,0,1,0,1|2,0,0]=4 7580 B9R1.49 O[C@@H]1CCCC(=O)CC1 Amb24689806 [0,0,0,1,0,1|2,0,0]=4 7581 B9R1.53 CC(=O)CC1CN(C)C1 Amb25249609 [0,0,0,1,0,1|2,0,0]=4 7582 B9R1.53 CC(=O)CN1CC(O)C1 Amb25231501 [0,0,0,1,0,1|2,0,0]=4 7583 B9R1.53 CC(=O)OC1CC(Cl)C1 Amb25123136 [0,0,0,1,0,1|2,0,0]=4 7584 B9R1.53 CC(=O)O[C@@H]1C[C@@H](Cl)C1 Amb25725070 [0,0,0,1,0,1|2,0,0]=4 7585 B9R1.53 CC(=O)O[C@@H]1C[C@@H](O)C1 Amb25777769 [0,0,0,1,0,1|2,0,0]=4 7586 B9R1.53 CC(=O)O[C@H]1C[C@@H](Cl)C1 Amb25109325 [0,0,0,1,0,1|2,0,0]=4 7587 B9R1.53 CC(=O)SC1CC(O)C1 Amb24732003 [0,0,0,1,0,1|2,0,0]=4 7588 B9R1.53 CC(=O)S[C@@H]1C[C@@H](O)C1 Amb25344944 [0,0,0,1,0,1|2,0,0]=4 7589 B9R1.53 CC(C)CC1CC(O)C1 Amb24679530 [0,0,0,1,0,1|1,0,1]=4 7590 B9R1.53 CC(C)CN1CC(=O)C1 Amb25340866 [0,0,0,1,0,1|1,0,0]=3 7591 B9R1.53 CC(C)CN1CC(O)C1 Amb19516880 [0,0,0,1,0,1|1,0,1]=4 7592 B9R1.53 CC(C)CN1CC(O)C1 Amb22587408 [0,0,0,1,0,1|1,0,1]=4 7593 B9R1.53 CC(C)OC1CC(=O)N1 Amb25145976 [0,0,0,1,0,1|1,0,0]=3 7594 B9R1.53 CC(C)OC1CC(O)C1 Amb24478808 [0,0,0,1,0,1|1,0,1]=4 7595 B9R1.53 CC(C)O[C@@H]1C[C@@H](O)C1 Amb25188953 [0,0,0,1,0,1|1,0,1]=4 7596 B9R1.53 CC(C)O[C@H]1C[C@@H](O)C1 Amb24670140 [0,0,0,1,0,1|1,0,1]=4 7597 B9R1.53 CC1CC(C1)=CC(O)=O Amb25134976 [0,0,0,1,0,1|0,0,1]=3 7598 B9R1.53 CC1CC(C1)NC(C)=N Amb25090700 [0,0,0,1,0,1|2,0,0]=4 7599 B9R1.53 CC1CC(C1)NC(N)=N Amb25687082 [0,0,0,1,0,1|2,0,0]=4 7600 B9R1.53 CC1CC(C1)NC(N)=O Amb23538249 [0,0,0,1,0,1|1,0,0]=3 7601 B9R1.53 CC1CN(C1)CC(C)O Amb24586470 [0,0,0,1,0,1|1,0,1]=4 7602 B9R1.53 C[C@@H]1C[C@H](CC(O)=O)C1 Amb24372826 [0,0,0,1,0,1|0,0,0]=2 7603 B9R1.53 C[C@H]1C[C@H](C1)CC(C)=O Amb24722132 [0,0,0,1,0,1|1,0,0]=3 7604 B9R1.53 NC(=O)CN1CC(O)C1 Amb24761040 [0,0,0,1,0,1|2,0,0]=4 7605 B9R1.53 NC1CC(C1)OC(N)=O Amb25040399 [0,0,0,1,0,1|2,0,0]=4 7606 B9R1.53 NC1CC(CC(O)=O)C1 Amb23440231 [0,0,0,1,0,1|1,0,0]=3 7607 B9R1.53 NC1CN(C1)CC(O)=O Amb25347187 [0,0,0,1,0,1|1,0,0]=3 7608 B9R1.53 N[C@@H]1C[C@@H](CC(O)=O)C1 Amb23440233 [0,0,0,1,0,1|1,0,0]=3 7609 B9R1.53 N[C@@H]1C[C@H](CC(O)=O)C1 Amb23440232 [0,0,0,1,0,1|1,0,0]=3 7610 B9R1.53 N[C@@H]1C[C@H](CC(O)=O)C1 Amb24056536 [0,0,0,1,0,1|1,0,0]=3 7611 B9R1.53 O=C(Cl)CC1CC(Cl)C1 Amb25708345 [0,0,0,1,0,1|2,0,0]=4 7612 B9R1.53 OC(=O)CC1CC(=O)N1 Amb24351879 [0,0,0,1,0,1|1,0,1]=4 7613 B9R1.53 OC(=O)CC1CC(Cl)C1 Amb25145965 [0,0,0,1,0,1|1,0,0]=3 7614 B9R1.53 OC1CC(C1)CC(O)=O Amb24481941 [0,0,0,1,0,1|1,0,0]=3 7615 B9R1.53 OC1CN(C1)CC(O)=O Amb25339150 [0,0,0,1,0,1|1,0,0]=3 7616 B9R1.53 O[C@@H]1C[C@H](C1)CC(O)=O Amb25204858 [0,0,0,1,0,1|1,0,0]=3 7617 B9R1.66 CC1(C)CC(=C)CCO1 Amb24478632 [0,0,0,1,0,1|2,0,0]=4 7618 B9R1.66 CC1(C)CC(=N)NCC1 Amb24481893 [0,0,0,1,0,1|2,0,0]=4 7619 B9R1.66 CC1(C)CC(=O)CCN1 Amb18832677 [0,0,0,1,0,1|1,0,0]=3 7620 B9R1.66 CC1(C)CC(=O)CCN1 Amb22756378 [0,0,0,1,0,1|1,0,0]=3 7621 B9R1.66 CC1(C)CC(=O)NCC1 Amb24451332 [0,0,0,1,0,1|1,0,0]=3 7622 B9R1.66 CC1(C)CC(O)CCN1 Amb22270194 [0,0,0,1,0,1|1,0,1]=4 7623 B9R1.66 CC1(C)CC(O)CCO1 Amb17843537 [0,0,0,1,0,1|1,0,1]=4 7624 B9R1.66 CC1(C)CC(O)CCS1 Amb18202259 [0,0,0,1,0,1|1,0,1]=4 7625 B9R1.66 CC1(C)CCCC(N)=N1 Amb25694929 [0,0,0,1,0,1|2,0,0]=4 7626 B9R1.66 CC1(C)CCN=C(N)S1 Amb24655882 [0,0,0,1,0,1|1,1,0]=4 7627 B9R1.66 CC1(C)CCNC(=O)O1 Amb25083672 [0,0,0,1,0,1|0,0,0]=2 7628 B9R1.66 CC1(C)CCNC(N)=N1 Amb24600476 [0,0,0,1,0,1|2,0,0]=4 7629 B9R1.66 CC1(C)CCNC(S)=N1 Amb25242279 [0,0,0,1,0,1|1,1,0]=4 7630 B9R1.66 CC1(C)CNCC(=O)N1 Amb25858036 [0,0,0,1,0,1|1,0,0]=3 7631 B9R1.66 CC1(C)COCC(N)O1 Amb24403091 [0,0,0,1,0,1|1,0,1]=4 7632 B9R1.66 CC1(C)CS(=O)CCN1 Amb24271114 [0,0,0,1,0,1|2,0,0]=4 7633 B9R1.66 CC1(C)CSCC(=O)C1 Amb21927887 [0,0,0,1,0,1|1,0,0]=3 7634 B9R1.66 CC1(C)CSCC(O)C1 Amb24450554 [0,0,0,1,0,1|1,0,1]=4 7635 B9R1.66 CC1(C)C[C@@H](O)CCC1 Amb24675497 [0,0,0,1,0,1|1,0,1]=4 7636 B9R1.66 CC1(C)C[C@H](O)CCC1 Amb24735248 [0,0,0,1,0,1|1,0,1]=4 7637 B9R1.66 CC1(N)CC(=O)CCC1 Amb25290133 [0,0,0,1,0,1|2,0,0]=4 7638 B9R1.66 CC1(O)CC(=O)NCC1 Amb24548836 [0,0,0,1,0,1|2,0,0]=4 7639 B9R1.66 CC1(O)CCCC(=O)N1 Amb25373927 [0,0,0,1,0,1|2,0,0]=4 7640 B9R1.66 CC1(O)CCOC(=O)[13CH2]1 Amb22353493 [0,0,0,1,0,1|2,0,0]=4 7641 B9R1.66 CC1(O)C[13CH2]CC(=O)C1 Amb22367566 [0,0,0,1,0,1|2,0,0]=4 7642 B9R1.66 CC1(S)CC(=O)CCC1 Amb24339898 [0,0,0,1,0,1|2,0,0]=4 7643 B9R1.66 CC1=NC(C)(C)CCO1 Amb22396066 [0,0,0,1,0,1|2,0,0]=4 7644 B9R1.66 CC1CC(C)(O)CCN1 Amb25303339 [0,0,0,1,0,1|1,0,1]=4 7645 B9R1.66 CC1CCCC(C)(C)O1 Amb24477890 [0,0,0,1,0,1|1,0,1]=4 7646 B9R1.66 CC1CS(=O)(=O)CCN1 Amb19515399 [0,0,0,1,0,1|1,0,1]=4 7647 B9R1.66 CC=1CC(C)(C)CCC1 Amb24683640 [0,0,0,1,0,1|2,0,0]=4 7648 B9R1.66 CC=1CCCC(C)(C)C1 Amb24622005 [0,0,0,1,0,1|2,0,0]=4 7649 B9R1.66 CC=1CCCC(C)(C)N1 Amb24101420 [0,0,0,1,0,1|2,0,0]=4 7650 B9R1.66 C[C@@H]1CS(=O)(=O)CCN1 Amb24652818 [0,0,0,1,0,1|1,0,1]=4 7651 B9R1.66 C[C@@H]1CS(=O)(=O)CCO1 Amb25072952 [0,0,0,1,0,1|1,0,1]=4 7652 B9R1.66 C[C@@]1(O)CC(=O)OCC1 Amb22800043 [0,0,0,1,0,1|2,0,0]=4 7653 B9R1.66 C[C@H]1CS(=O)(=O)CCN1 Amb25246713 [0,0,0,1,0,1|1,0,1]=4 7654 B9R1.66 C[C@]1(O)CC(=O)OCC1 Amb22388612 [0,0,0,1,0,1|2,0,0]=4 7655 B9R1.66 O=C1CCCC(C1)(C)C Amb13883565 [0,0,0,1,0,1|1,0,0]=3 7656 B9R1.66 O=C1CCSC(C1)(C)C Amb17593636 [0,0,0,1,0,1|1,0,0]=3 7657 B9R1.66 [13CH3]C1(O)CC(=O)OCC1 Amb22367288 [0,0,0,1,0,1|2,0,0]=4 7658 B9R1.85 C=C(Br)CNCC1CC1 Amb19005216 [0,0,0,1,0,1|2,0,0]=4 7659 B9R1.85 C=C(Br)COCC1CC1 Amb25047572 [0,0,0,1,0,1|2,0,0]=4 7660 B9R1.85 C=C(Br)CSCC1CC1 Amb24529083 [0,0,0,1,0,1|2,0,0]=4 7661 B9R1.85 C=C(Cl)CNCC1CC1 Amb18303258 [0,0,0,1,0,1|2,0,0]=4 7662 B9R1.85 CC(=C)CCNC1CC1 Amb18523840 [0,0,0,1,0,1|2,0,0]=4 7663 B9R1.85 CC(=O)C#CCC1CC1 Amb24357190 [0,0,0,1,0,1|1,0,1]=4 7664 B9R1.85 CC(=O)CCCC1CC1 Amb25303589 [0,0,0,1,0,1|1,0,0]=3 7665 B9R1.85 CC(=O)CCNC1CC1 Amb24377194 [0,0,0,1,0,1|1,0,0]=3 7666 B9R1.85 CC(=O)NCCC1CC1 Amb25749460 [0,0,0,1,0,1|1,0,0]=3 7667 B9R1.85 CC(=O)OCCC1CC1 Amb25091905 [0,0,0,1,0,1|1,0,0]=3 7668 B9R1.85 CC(C)OCCC1CO1 Amb25138542 [0,0,0,1,0,1|1,0,1]=4 7669 B9R1.85 CC(O)CCNC1CC1 Amb24693766 [0,0,0,1,0,1|1,0,1]=4 7670 B9R1.85 CC(O)CSCC1CC1 Amb24524245 [0,0,0,1,0,1|1,0,1]=4 7671 B9R1.85 C[C@@H](O)CCNC1CC1 Amb25191935 [0,0,0,1,0,1|1,0,1]=4 7672 B9R1.85 C[C@@H](O)COCC1CC1 Amb24711074 [0,0,0,1,0,1|1,0,1]=4 7673 B9R1.85 C[C@H](O)CNCC1CC1 Amb25781762 [0,0,0,1,0,1|1,0,1]=4 7674 B9R1.85 NC(=N)NCCC1CC1 Amb24360276 [0,0,0,1,0,1|2,0,0]=4 7675 B9R1.85 NC(=O)COCC1CC1 Amb19411503 [0,0,0,1,0,1|1,0,0]=3 7676 B9R1.85 NC(=O)CONC1CC1 Amb24456756 [0,0,0,1,0,1|2,0,0]=4 7677 B9R1.85 NC(=O)CSC[C@@H]1CO1 Amb25098193 [0,0,0,1,0,1|2,0,0]=4 7678 B9R1.85 NC(=O)CSC[C@H]1CO1 Amb24395150 [0,0,0,1,0,1|2,0,0]=4 7679 B9R1.85 NC(=O)NCCC1CC1 Amb24478666 [0,0,0,1,0,1|1,0,0]=3 7680 B9R1.85 NC(=S)CCNC1CC1 Amb17231993 [0,0,0,1,0,1|1,1,0]=4 7681 B9R1.85 NC(=S)NCCC1CC1 Amb24495275 [0,0,0,1,0,1|1,1,0]=4 7682 B9R1.85 OC(=O)C#CCC1CC1 Amb25147203 [0,0,0,1,0,1|0,0,1]=3 7683 B9R1.85 OC(=O)CCCC1CC1 Amb18832629 [0,0,0,1,0,1|0,0,0]=2 7684 B9R1.85 OC(=O)CCC[C@H]1CO1 Amb24427275 [0,0,0,1,0,1|1,0,0]=3 7685 B9R1.85 OC(=O)CCNC1CC1 Amb1106410 [0,0,0,1,0,1|0,0,0]=2 7686 B9R1.85 OC(=O)CCSC1CC1 Amb25221891 [0,0,0,1,0,1|0,0,0]=2 7687 B9R1.85 OC(=O)\C=C\NC1CC1 Amb22363623 [0,0,0,1,0,1|0,0,2]=4 7688 B9R1.150 CC1(C)COCC1(C)O Amb25074713 [0,0,0,1,0,1|1,0,1]=4 7689 B9R1.161 CC(=C)[C@@H]1C[C@@H]1C(O)=O Amb24514832 [0,0,0,1,0,1|0,0,2]=4 7690 B9R1.161 CC(=O)C1C=C1C(C)C Amb24722808 [0,0,0,1,0,1|1,0,1]=4 7691 B9R1.161 CC(=O)C1OC1C(O)=O Amb25233192 [0,0,0,1,0,1|1,0,1]=4 7692 B9R1.161 CC(C)C1CC1C(O)=O Amb18285139 [0,0,0,1,0,1|0,0,0]=2 7693 B9R1.161 CC(C)C1OC1C(C)O Amb24688120 [0,0,0,1,0,1|1,0,1]=4 7694 B9R1.161 CC(C)[C@@H]1C[C@@H]1C(C)=O Amb24610096 [0,0,0,1,0,1|1,0,0]=3 7695 B9R1.161 CC(C)[C@@H]1C[C@H]1C(C)=O Amb24621711 [0,0,0,1,0,1|1,0,0]=3 7696 B9R1.161 CC(C)[C@@H]1O[C@@H]1C(O)=O Amb24546994 [0,0,0,1,0,1|0,0,0]=2 7697 B9R1.161 CC(C)[C@H]1O[C@@H]1C(C)=O Amb25204929 [0,0,0,1,0,1|1,0,0]=3 7698 B9R1.161 CC(C)[C@H]1O[C@@H]1C(O)=O Amb25229035 [0,0,0,1,0,1|0,0,0]=2 7699 B9R1.161 CC(O)C1OC1C(O)=O Amb25227852 [0,0,0,1,0,1|1,0,0]=3 7700 B9R1.161 C[C@@H](O)[C@H]1O[C@@H]1C(O)=O Amb25224671 [0,0,0,1,0,1|1,0,0]=3 7701 B9R1.161 C[C@H](O)[C@@H]1O[C@@H]1C(O)=O Amb25368573 [0,0,0,1,0,1|1,0,0]=3 7702 B9R1.161 OC(=O)C1CC1C(F)F Amb25338314 [0,0,0,1,0,1|2,0,0]=4 7703 B9R1.161 OC(=O)[C@@H]1C[C@H]1C(F)F Amb24654017 [0,0,0,1,0,1|2,0,0]=4 7704 B9R1.161 OC(=O)[C@H]1C[C@@H]1C(F)F Amb25360822 [0,0,0,1,0,1|2,0,0]=4 7705 B9R1.166 CC(=O)C1CCC1(C)F Amb24582230 [0,0,0,1,0,1|2,0,0]=4 7706 B9R1.166 CC(=O)N1CCC1(C)C Amb24481904 [0,0,0,1,0,1|1,0,0]=3 7707 B9R1.166 CC(O)C1CCC1(C)C Amb24518053 [0,0,0,1,0,1|1,0,1]=4 7708 B9R1.166 CC1(C)CCC1C(O)=O Amb25032090 [0,0,0,1,0,1|0,0,0]=2 7709 B9R1.166 CC1(C)CCN1C(N)=O Amb24354806 [0,0,0,1,0,1|1,0,0]=3 7710 B9R1.166 CC1(C)CNC1C(O)=O Amb24117326 [0,0,0,1,0,1|0,0,0]=2 7711 B9R1.166 OC(=O)C1CCC1(F)F Amb24452747 [0,0,0,1,0,1|2,0,0]=4 7712 B9R1.170 CC(=O)CC1CC1(C)C Amb24722807 [0,0,0,1,0,1|1,0,0]=3 7713 B9R1.170 CC(=O)NC1CC1(C)C Amb25237099 [0,0,0,1,0,1|1,0,0]=3 7714 B9R1.170 CC1(C)CC1=CC(O)=O Amb25056977 [0,0,0,1,0,1|0,0,1]=3 7715 B9R1.170 CC1(C)CC1CC(O)=O Amb25145962 [0,0,0,1,0,1|0,0,0]=2 7716 B9R1.170 CC1(C)CC1NC(N)=N Amb24418413 [0,0,0,1,0,1|2,0,0]=4 7717 B9R1.170 CC1(C)CC1NC(N)=O Amb25800580 [0,0,0,1,0,1|1,0,0]=3 7718 B9R1.170 CC1(C)O[C@H]1CC(O)=O Amb25719083 [0,0,0,1,0,1|0,0,0]=2 7719 B9R1.170 OC(=O)CC1CC1(F)F Amb22411507 [0,0,0,1,0,1|2,0,0]=4 7720 B9R1.1 BrCC1CCC(=C)CC1 Amb15695263 [0,1,0,1,0,0|2,0,0]=4 7721 B9R1.1 CC1CC=C(CBr)CC1 Amb24480141 [0,1,0,1,0,0|2,0,0]=4 7722 B9R1.1 CC1CC=C(CC1)C#N Amb18642016 [0,1,0,1,0,0|2,0,0]=4 7723 B9R1.1 CC1CC=C(CS1)C=O Amb18643966 [0,1,0,1,0,0|2,0,0]=4 7724 B9R1.1 CC1CCC(CC1)=CBr Amb22227652 [0,1,0,1,0,0|2,0,0]=4 7725 B9R1.1 CC1CCC(CC1)=NN Amb24751844 [0,1,0,1,0,0|2,0,0]=4 7726 B9R1.1 CC1CCC(CC1)C=O Amb18642467 [0,1,0,1,0,0|1,0,1]=4 7727 B9R1.1 CC1CCC(CC1)OC Amb24323754 [0,1,0,1,0,0|1,0,1]=4 7728 B9R1.1 CC1CCC(CC1)ON Amb24594236 [0,1,0,1,0,0|1,0,1]=4 7729 B9R1.1 CC1CCC(CO)CC1 Amb22229834 [0,1,0,1,0,0|1,0,1]=4 7730 B9R1.1 CC1CCC(CO)NC1 Amb22886337 [0,1,0,1,0,0|1,0,1]=4 7731 B9R1.1 CC1CCC(CO)NC1 Amb24745499 [0,1,0,1,0,0|1,0,1]=4 7732 B9R1.1 CC1CCC(OC1)OC Amb24742805 [0,1,0,1,0,0|0,0,2]=4 7733 B9R1.1 CC1CCN(CC1)C=O Amb22730628 [0,1,0,1,0,0|2,0,0]=4 7734 B9R1.1 CC1CCN(CC1)N=O Amb24601452 [0,1,0,1,0,0|2,0,0]=4 7735 B9R1.1 CC=1CCC(CBr)CC1 Amb25298144 [0,1,0,1,0,0|2,0,0]=4 7736 B9R1.1 CC=1CCC(CN)CC1 Amb18642352 [0,1,0,1,0,0|2,0,0]=4 7737 B9R1.1 CCC1CCC(=S)CC1 Amb24478607 [0,1,0,1,0,0|1,1,0]=4 7738 B9R1.1 CCC1CCC(O)OC1 Amb24593816 [0,1,0,1,0,0|0,0,2]=4 7739 B9R1.1 CCC1CNC(=O)CC1 Amb25727228 [0,1,0,1,0,0|1,0,0]=3 7740 B9R1.1 CCC1CNC(=O)CN1 Amb18832614 [0,1,0,1,0,0|2,0,0]=4 7741 B9R1.1 CCC1CNC(=O)CS1 Amb24597647 [0,1,0,1,0,0|2,0,0]=4 7742 B9R1.1 CCC1CNC(=O)OC1 Amb24645209 [0,1,0,1,0,0|1,0,0]=3 7743 B9R1.1 CC[C@@H]1CCC(=O)C=C1 Amb24736307 [0,1,0,1,0,0|1,0,1]=4 7744 B9R1.1 CC[C@@H]1CC[C@@H](O)CC1 Amb22231677 [0,1,0,1,0,0|1,0,1]=4 7745 B9R1.1 CN1CC=C(CC1)C=O Amb24424850 [0,1,0,1,0,0|2,0,0]=4 7746 B9R1.1 CN1CC=C(CO)CC1 Amb22754040 [0,1,0,1,0,0|2,0,0]=4 7747 B9R1.1 CNC1CCC(=O)CC1 Amb10602371 [0,1,0,1,0,0|1,0,0]=3 7748 B9R1.1 CNC1CCC(=O)CC1 Amb22170247 [0,1,0,1,0,0|1,0,0]=3 7749 B9R1.1 CNC1CCC(O)CC1 Amb18642719 [0,1,0,1,0,0|1,0,1]=4 7750 B9R1.1 CNC1CCS(=O)CC1 Amb18948971 [0,1,0,1,0,0|2,0,0]=4 7751 B9R1.1 CNC1CCS(=O)CC1 Amb19374966 [0,1,0,1,0,0|2,0,0]=4 7752 B9R1.1 CN[C@@H]1CC[C@@H](O)CC1 Amb22745615 [0,1,0,1,0,0|1,0,1]=4 7753 B9R1.1 CN[C@@H]1CC[C@H](O)CC1 Amb22744978 [0,1,0,1,0,0|1,0,1]=4 7754 B9R1.1 CN[C@@H]1CC[C@H](O)CC1 Amb22747298 [0,1,0,1,0,0|1,0,1]=4 7755 B9R1.1 COC1CC=C(C)CC1 Amb25279365 [0,1,0,1,0,0|2,0,0]=4 7756 B9R1.1 COC1CCC(=C)CC1 Amb24481794 [0,1,0,1,0,0|2,0,0]=4 7757 B9R1.1 COC1CCC(=O)CC1 Amb2385260 [0,1,0,1,0,0|1,0,0]=3 7758 B9R1.1 COC1CCC(CC1)O Amb17593378 [0,1,0,1,0,0|1,0,1]=4 7759 B9R1.1 COC1CNC(O)=NC1 Amb25304325 [0,1,0,1,0,0|2,0,0]=4 7760 B9R1.1 COC=1CCC(O)CC1 Amb21858056 [0,1,0,1,0,0|2,0,0]=4 7761 B9R1.1 CON1CCC(=O)CC1 Amb20670427 [0,1,0,1,0,0|2,0,0]=4 7762 B9R1.1 CO[C@@H]1CC[C@@H](O)CC1 Amb22746104 [0,1,0,1,0,0|1,0,1]=4 7763 B9R1.1 CO[C@H]1CC[C@@H](O)CC1 Amb24502360 [0,1,0,1,0,0|1,0,1]=4 7764 B9R1.1 CSC1CCC(=O)CC1 Amb25707895 [0,1,0,1,0,0|1,0,0]=3 7765 B9R1.1 CS[C@@H]1CC[C@@H](CC1)O Amb15693040 [0,1,0,1,0,0|1,0,1]=4 7766 B9R1.1 CS[C@@H]1CC[C@@H](O)CC1 Amb25806767 [0,1,0,1,0,0|1,0,1]=4 7767 B9R1.1 C[C@@H]1CC[C@@H](CO)CC1 Amb22886817 [0,1,0,1,0,0|1,0,1]=4 7768 B9R1.1 C[C@@H]1CC[C@H](CC1)C=O Amb25075627 [0,1,0,1,0,0|1,0,1]=4 7769 B9R1.1 C[C@H]1CC[C@@H](CO)OC1 Amb25245499 [0,1,0,1,0,0|0,0,2]=4 7770 B9R1.1 N#CC1CCC(=O)CC1 Amb16231535 [0,1,0,1,0,0|1,0,1]=4 7771 B9R1.1 N#CC1CNC(=O)CC1 Amb25314394 [0,1,0,1,0,0|1,0,1]=4 7772 B9R1.1 NCC1CC=C(F)CC1 Amb25354297 [0,1,0,1,0,0|2,0,0]=4 7773 B9R1.1 NCC1CCC(=C)CC1 Amb13882965 [0,1,0,1,0,0|2,0,0]=4 7774 B9R1.1 NCC1CCC(=O)CC1 Amb20247631 [0,1,0,1,0,0|1,0,0]=3 7775 B9R1.1 NCC1CCC(O)CC1 Amb20669423 [0,1,0,1,0,0|1,0,1]=4 7776 B9R1.1 NCC1CNC(=O)CC1 Amb18832607 [0,1,0,1,0,0|1,0,0]=3 7777 B9R1.1 NCC1CNC(=O)CN1 Amb25194789 [0,1,0,1,0,0|2,0,0]=4 7778 B9R1.1 NCC1CNC(=O)CO1 Amb22235660 [0,1,0,1,0,0|2,0,0]=4 7779 B9R1.1 NCC1CNC(=O)CO1 Amb24682214 [0,1,0,1,0,0|2,0,0]=4 7780 B9R1.1 NCC1CNC(=O)CS1 Amb25242244 [0,1,0,1,0,0|2,0,0]=4 7781 B9R1.1 NC[C@@H]1CC[C@@H](O)CC1 Amb23439293 [0,1,0,1,0,0|1,0,1]=4 7782 B9R1.1 NC[C@@H]1CC[C@@H](O)CC1 Amb25075878 [0,1,0,1,0,0|1,0,1]=4 7783 B9R1.1 NC[C@@H]1CC[C@H](O)CC1 Amb24183403 [0,1,0,1,0,0|1,0,1]=4 7784 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 Amb25323044 [0,1,0,1,0,0|1,0,1]=4 7785 B9R1.1 O=C1CCC(CBr)CN1 Amb23597460 [0,1,0,1,0,0|1,0,0]=3 7786 B9R1.1 O=C1CCC(CF)CC1 Amb25217167 [0,1,0,1,0,0|1,0,0]=3 7787 B9R1.1 OC1CCC(CBr)CC1 Amb24697955 [0,1,0,1,0,0|1,0,1]=4 7788 B9R1.1 OC1CCC(CCl)CC1 Amb24480360 [0,1,0,1,0,0|1,0,1]=4 7789 B9R1.1 OC1CCC(CI)CC1 Amb25728551 [0,1,0,1,0,0|1,0,1]=4 7790 B9R1.1 OCC1CCC(=C)CC1 Amb10975464 [0,1,0,1,0,0|2,0,0]=4 7791 B9R1.1 OCC1CCC(=O)CC1 Amb10071596 [0,1,0,1,0,0|1,0,0]=3 7792 B9R1.1 OCC1CCC(=O)CN1 Amb25207554 [0,1,0,1,0,0|2,0,0]=4 7793 B9R1.1 OCC1CCC(CC1)O Amb13883568 [0,1,0,1,0,0|1,0,1]=4 7794 B9R1.1 OCC1CNC(=O)CC1 Amb19958990 [0,1,0,1,0,0|1,0,0]=3 7795 B9R1.1 OCC1CNC(=O)CN1 Amb25187358 [0,1,0,1,0,0|2,0,0]=4 7796 B9R1.1 OCC1CNC(=O)CO1 Amb22236094 [0,1,0,1,0,0|2,0,0]=4 7797 B9R1.1 OCC1CNC(=O)CS1 Amb25374316 [0,1,0,1,0,0|2,0,0]=4 7798 B9R1.1 OCC1CNC(=O)NC1 Amb25291682 [0,1,0,1,0,0|2,0,0]=4 7799 B9R1.1 OCC1CNC(=O)OC1 Amb25247634 [0,1,0,1,0,0|1,0,0]=3 7800 B9R1.1 OC[C@@H]1CNC(=O)CO1 Amb10067153 [0,1,0,1,0,0|2,0,0]=4 7801 B9R1.1 ON=C1CCC(Cl)CC1 Amb25288088 [0,1,0,1,0,0|2,0,0]=4 7802 B9R1.1 ON=C1CCC(O)CC1 Amb24456954 [0,1,0,1,0,0|2,0,0]=4 7803 B9R1.1 ON=C1CCN(CC1)C Amb1934546 [0,1,0,1,0,0|2,0,0]=4 7804 B9R1.1 O[C@@H]1CC[C@H](CC1)CO Amb25320791 [0,1,0,1,0,0|1,0,1]=4 7805 B9R1.1 O[C@@H]1CC[C@H](CCl)CC1 Amb25745432 [0,1,0,1,0,0|1,0,1]=4 7806 B9R1.1 [C-]#[N+]C1CCC(=O)CC1 Amb25783347 [0,1,0,1,0,0|1,0,1]=4 7807 B9R1.10 CC1(C)CC=C(Br)CC1 Amb22227865 [0,1,0,1,0,0|2,0,0]=4 7808 B9R1.10 CC1(C)CCC(=C)CC1 Amb24058249 [0,1,0,1,0,0|2,0,0]=4 7809 B9R1.10 CC1(C)CCC(=O)CO1 Amb22489817 [0,1,0,1,0,0|0,0,0]=2 7810 B9R1.10 CC1(C)CCC(N)CO1 Amb22504670 [0,1,0,1,0,0|1,0,1]=4 7811 B9R1.10 CC1(C)CCC(O)CO1 Amb24524888 [0,1,0,1,0,0|0,0,2]=4 7812 B9R1.10 CC1(C)CC[C@H](O)C=C1 Amb25246214 [0,1,0,1,0,0|1,0,1]=4 7813 B9R1.10 CC1(C)CN=C(N)CC1 Amb24432942 [0,1,0,1,0,0|2,0,0]=4 7814 B9R1.10 CC1(C)CNC(=O)C=C1 Amb25250662 [0,1,0,1,0,0|2,0,0]=4 7815 B9R1.10 CC1(C)CNC(=O)CC1 Amb22234759 [0,1,0,1,0,0|1,0,0]=3 7816 B9R1.10 CC1(C)CNC(=O)CN1 Amb18832615 [0,1,0,1,0,0|2,0,0]=4 7817 B9R1.10 CC1(C)CNC(O)=NC1 Amb25320550 [0,1,0,1,0,0|2,0,0]=4 7818 B9R1.10 CC1(C)COP(=O)OC1 Amb22369714 [0,1,0,1,0,0|2,0,0]=4 7819 B9R1.10 CC1(C)COS(=O)OC1 Amb22741141 [0,1,0,1,0,0|2,0,0]=4 7820 B9R1.10 CC1(N)CCC(=O)CC1 Amb23589791 [0,1,0,1,0,0|1,0,0]=3 7821 B9R1.10 CC1(N)CCC(O)CC1 Amb23589778 [0,1,0,1,0,0|1,0,1]=4 7822 B9R1.10 CC1(N)CCS(=O)CC1 Amb25140040 [0,1,0,1,0,0|2,0,0]=4 7823 B9R1.10 CC1(N)COC(=O)OC1 Amb24446029 [0,1,0,1,0,0|1,0,0]=3 7824 B9R1.10 CC1(O)CCC(=C)CC1 Amb24613129 [0,1,0,1,0,0|2,0,0]=4 7825 B9R1.10 CC1(O)CCC(=O)CC1 Amb22235468 [0,1,0,1,0,0|1,0,0]=3 7826 B9R1.10 CC1(O)CCC(O)CC1 Amb25674827 [0,1,0,1,0,0|1,0,1]=4 7827 B9R1.10 CC1(O)CNC(=O)CC1 Amb22728074 [0,1,0,1,0,0|1,0,0]=3 7828 B9R1.10 CC1COC(C)(C)CC1 Amb25049137 [0,1,0,1,0,0|1,0,1]=4 7829 B9R1.10 C[C@@H]1CC[C@](C)(O)CC1 Amb24593240 [0,1,0,1,0,0|1,0,1]=4 7830 B9R1.10 C[C@@]1(N)CC[C@@H](O)CC1 Amb23440251 [0,1,0,1,0,0|1,0,1]=4 7831 B9R1.10 C[C@@]1(N)CC[C@H](O)CC1 Amb23440250 [0,1,0,1,0,0|1,0,1]=4 7832 B9R1.10 C[C@]1(N)CC[C@@H](O)CC1 Amb24645739 [0,1,0,1,0,0|1,0,1]=4 7833 B9R1.10 C[C@]1(O)CCC(=O)C=C1 Amb25031859 [0,1,0,1,0,0|1,0,1]=4 7834 B9R1.10 C[C@]1(O)CC[C@@H](O)CC1 Amb24643905 [0,1,0,1,0,0|1,0,1]=4 7835 B9R1.10 C[Si]1(C)CCC(=O)C=C1 Amb24575940 [0,1,0,1,0,0|1,1,0]=4 7836 B9R1.10 C[Si]1(C)CNC(=O)CC1 Amb25702664 [0,1,0,1,0,0|1,1,0]=4 7837 B9R1.10 NC1(N)CCC(=O)CC1 Amb25695419 [0,1,0,1,0,0|2,0,0]=4 7838 B9R1.10 O=C1CCC(CC1)(C)C Amb15692607 [0,1,0,1,0,0|1,0,0]=3 7839 B9R1.10 O=C1CCC(CC1)(F)F Amb10982553 [0,1,0,1,0,0|2,0,0]=4 7840 B9R1.10 O=C1CCC(F)(F)CN1 Amb23439794 [0,1,0,1,0,0|2,0,0]=4 7841 B9R1.10 O=C1CC[N+](CC1)(C)C Amb10552886 [0,1,0,1,0,0|2,0,0]=4 7842 B9R1.10 O=C1CC[N+](CC1)(C)C Amb10555001 [0,1,0,1,0,0|2,0,0]=4 7843 B9R1.55 CC(=O)C1CC(Cl)C1Cl Amb25689885 [0,1,0,1,0,0|2,0,0]=4 7844 B9R1.55 CC(=O)[C@@H]1C[C@@H](Cl)[C@@H]1Cl Amb24552931 [0,1,0,1,0,0|2,0,0]=4 7845 B9R1.55 CC(C)C1CC(=O)C1C Amb24356653 [0,1,0,1,0,0|1,0,0]=3 7846 B9R1.55 CC(C)C1CC(O)C1O Amb24672752 [0,1,0,1,0,0|0,0,2]=4 7847 B9R1.55 CC(C)C1NC(=O)C1N Amb18832616 [0,1,0,1,0,0|1,0,0]=3 7848 B9R1.55 CC(C)C1OC(=O)C1O Amb25680475 [0,1,0,1,0,0|0,0,0]=2 7849 B9R1.55 CC(C)[C@@H]1NC(=O)[C@@H]1O Amb24657269 [0,1,0,1,0,0|1,0,0]=3 7850 B9R1.55 CC(O)C1NC(=O)C1O Amb24557165 [0,1,0,1,0,0|2,0,0]=4 7851 B9R1.55 CC(O)[C@@H]1NC(=O)[C@@H]1O Amb24515157 [0,1,0,1,0,0|2,0,0]=4 7852 B9R1.55 CC1C(CC1C)C(C)=O Amb24476715 [0,1,0,1,0,0|1,0,0]=3 7853 B9R1.55 CC1C(CC1C)C(O)=O Amb23456159 [0,1,0,1,0,0|0,0,0]=2 7854 B9R1.55 CC1C(OC1=O)C(C)O Amb25177629 [0,1,0,1,0,0|1,0,0]=3 7855 B9R1.55 CN1C(CC1=O)C(O)=O Amb22011579 [0,1,0,1,0,0|1,0,1]=4 7856 B9R1.55 CN1CC(C1=O)C(=O)O Amb17593354 [0,1,0,1,0,0|1,0,1]=4 7857 B9R1.55 C[C@@H]1C[C@@H](C(=O)Cl)N1C Amb25336470 [0,1,0,1,0,0|1,0,0]=3 7858 B9R1.55 C[C@@H]1C[C@@H](C(O)=O)N1C Amb24683087 [0,1,0,1,0,0|0,0,0]=2 7859 B9R1.55 C[C@H]1[C@@H](C[C@H]1C)C(O)=O Amb24745807 [0,1,0,1,0,0|0,0,0]=2 7860 B9R1.55 C[C@H]1[C@H](C[C@@H]1C)C(O)=O Amb24629706 [0,1,0,1,0,0|0,0,0]=2 7861 B9R1.55 N[C@@H]1[C@H](C[C@@H]1O)C(O)=O Amb24514844 [0,1,0,1,0,0|1,0,0]=3 7862 B9R1.67 CC(=O)C[C@@H]1CC[C@@H]1F Amb24440447 [0,1,0,1,0,0|2,0,0]=4 7863 B9R1.67 CC(=O)C[C@H]1CC[C@H]1F Amb25246392 [0,1,0,1,0,0|2,0,0]=4 7864 B9R1.67 CC(C)CN1C=NC1=O Amb25114702 [0,1,0,1,0,0|2,0,0]=4 7865 B9R1.67 CC(C)OC1CCC1=O Amb22897039 [0,1,0,1,0,0|2,0,0]=4 7866 B9R1.67 CC1CCC1CC(O)=O Amb24466547 [0,1,0,1,0,0|0,0,0]=2 7867 B9R1.67 N[C@H]1CC[C@@H]1CC(O)=O Amb24700074 [0,1,0,1,0,0|1,0,0]=3 7868 B9R1.69 C=C1CC[C@@H](O)C[C@@H]1O Amb24562283 [0,1,0,1,0,0|2,0,0]=4 7869 B9R1.69 C=C1CC[C@@H](O)C[C@H]1O Amb25221454 [0,1,0,1,0,0|2,0,0]=4 7870 B9R1.69 CC1=CC(=O)CCC1C Amb25128835 [0,1,0,1,0,0|1,0,0]=3 7871 B9R1.69 CC1=CC(=O)CCC1O Amb24519337 [0,1,0,1,0,0|2,0,0]=4 7872 B9R1.69 CC1=CC(=O)NCC1C Amb25083025 [0,1,0,1,0,0|2,0,0]=4 7873 B9R1.69 CC1=CC(C)CCC1=O Amb25829538 [0,1,0,1,0,0|1,0,1]=4 7874 B9R1.69 CC1=CC[C@@H](C)CC1=O Amb25749539 [0,1,0,1,0,0|1,0,1]=4 7875 B9R1.69 CC1=NC(=O)CCC1C Amb24070883 [0,1,0,1,0,0|1,0,0]=3 7876 B9R1.69 CC1CC(=O)C(=O)CC1 Amb25735257 [0,1,0,1,0,0|0,0,1]=3 7877 B9R1.69 CC1CC(=O)C(C)CC1 Amb22228357 [0,1,0,1,0,0|1,0,1]=4 7878 B9R1.69 CC1CC(=O)C(N)CC1 Amb25291675 [0,1,0,1,0,0|1,0,1]=4 7879 B9R1.69 CC1CC(=O)CCC1C Amb22732216 [0,1,0,1,0,0|1,0,0]=3 7880 B9R1.69 CC1CC(=O)CCC1Cl Amb24391486 [0,1,0,1,0,0|2,0,0]=4 7881 B9R1.69 CC1CC(=O)CCC1O Amb20171463 [0,1,0,1,0,0|2,0,0]=4 7882 B9R1.69 CC1CC(=O)CCN1C Amb19148128 [0,1,0,1,0,0|2,0,0]=4 7883 B9R1.69 CC1CC(=O)N(O)CC1 Amb25146341 [0,1,0,1,0,0|1,0,0]=3 7884 B9R1.69 CC1CC(=O)NCC1N Amb24496285 [0,1,0,1,0,0|2,0,0]=4 7885 B9R1.69 CC1CC(Br)C(=O)CC1 Amb18325312 [0,1,0,1,0,0|1,0,0]=3 7886 B9R1.69 CC1CC(Br)C(=O)NN1 Amb25783239 [0,1,0,1,0,0|2,0,0]=4 7887 B9R1.69 CC1CC(C)C(=C)CC1 Amb25712253 [0,1,0,1,0,0|2,0,0]=4 7888 B9R1.69 CC1CC(Cl)C(=C)CC1 Amb24453376 [0,1,0,1,0,0|2,0,0]=4 7889 B9R1.69 CC1CC(Cl)C(=O)NC1 Amb24476704 [0,1,0,1,0,0|1,0,0]=3 7890 B9R1.69 CC1CC(I)C(=O)CC1 Amb25692069 [0,1,0,1,0,0|1,0,0]=3 7891 B9R1.69 CC1CC(N)C(=O)CC1 Amb18278099 [0,1,0,1,0,0|1,0,0]=3 7892 B9R1.69 CC1CC(N)C(=O)NC1 Amb23586257 [0,1,0,1,0,0|1,0,0]=3 7893 B9R1.69 CC1CC(O)C(=O)C=C1 Amb25347756 [0,1,0,1,0,0|0,0,2]=4 7894 B9R1.69 CC1CC(O)C(=O)CC1 Amb25333970 [0,1,0,1,0,0|0,0,0]=2 7895 B9R1.69 CC1CC(O)CCC1=O Amb25086312 [0,1,0,1,0,0|2,0,0]=4 7896 B9R1.69 CC1CC(O)CNC1=O Amb25068458 [0,1,0,1,0,0|2,0,0]=4 7897 B9R1.69 CC1CCC(=C)CC1Br Amb24635906 [0,1,0,1,0,0|2,0,0]=4 7898 B9R1.69 CC1CCC(=C)CC1O Amb25333669 [0,1,0,1,0,0|2,0,0]=4 7899 B9R1.69 CC1CCC(=O)C(=C)C1 Amb25686144 [0,1,0,1,0,0|1,0,0]=3 7900 B9R1.69 CC1CCC(=O)C(=O)N1 Amb24745568 [0,1,0,1,0,0|1,0,1]=4 7901 B9R1.69 CC1CCC(=O)C(=O)O1 Amb24621712 [0,1,0,1,0,0|1,0,1]=4 7902 B9R1.69 CC1CCC(=O)C(C)N1 Amb24480355 [0,1,0,1,0,0|2,0,0]=4 7903 B9R1.69 CC1CCC(=O)C(Cl)=C1 Amb25706941 [0,1,0,1,0,0|1,0,1]=4 7904 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [0,1,0,1,0,0|1,0,1]=4 7905 B9R1.69 CC1CCC(=O)CC1Br Amb24398782 [0,1,0,1,0,0|1,0,0]=3 7906 B9R1.69 CC1CCC(=O)CN1C Amb25792971 [0,1,0,1,0,0|1,0,0]=3 7907 B9R1.69 CC1CCC(=O)NC1=O Amb21963732 [0,1,0,1,0,0|1,0,1]=4 7908 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [0,1,0,1,0,0|0,0,1]=3 7909 B9R1.69 CC1CCC(C)=CC1C Amb25048711 [0,1,0,1,0,0|2,0,0]=4 7910 B9R1.69 CC1CCC(C)=CC1O Amb25056479 [0,1,0,1,0,0|2,0,0]=4 7911 B9R1.69 CC1CCC(C)OC1O Amb24464497 [0,1,0,1,0,0|1,0,1]=4 7912 B9R1.69 CC1CCC(O)=CC1=O Amb24532888 [0,1,0,1,0,0|1,0,1]=4 7913 B9R1.69 CC1CCC(O)C(=O)N1 Amb24427022 [0,1,0,1,0,0|1,0,1]=4 7914 B9R1.69 CC1CCC(O)C(N)C1 Amb18832563 [0,1,0,1,0,0|1,0,1]=4 7915 B9R1.69 CC1CCC(O)C(O)C1 Amb17939305 [0,1,0,1,0,0|0,0,2]=4 7916 B9R1.69 CC1CCC(O)CC1O Amb25847038 [0,1,0,1,0,0|1,0,1]=4 7917 B9R1.69 CC1CCC(O)CN1C Amb24667440 [0,1,0,1,0,0|1,0,1]=4 7918 B9R1.69 CC1CN(C)C(=O)CC1 Amb22733056 [0,1,0,1,0,0|1,0,0]=3 7919 B9R1.69 CC1CN(C)C(=O)CN1 Amb22227754 [0,1,0,1,0,0|2,0,0]=4 7920 B9R1.69 CC1CNC(=O)C(C)C1 Amb20670731 [0,1,0,1,0,0|1,0,0]=3 7921 B9R1.69 CC1CNC(=O)CC1=O Amb19958593 [0,1,0,1,0,0|1,0,1]=4 7922 B9R1.69 CC1CNC(=O)CC1C Amb25124566 [0,1,0,1,0,0|1,0,0]=3 7923 B9R1.69 CC1COC(=O)C(=O)N1 Amb25216504 [0,1,0,1,0,0|1,0,1]=4 7924 B9R1.69 CC1COC(=O)C(C)C1 Amb24354559 [0,1,0,1,0,0|0,0,0]=2 7925 B9R1.69 CC1COC(=O)CC1O Amb25781910 [0,1,0,1,0,0|0,0,0]=2 7926 B9R1.69 CC1COC(O)C(C)C1 Amb25740656 [0,1,0,1,0,0|0,0,2]=4 7927 B9R1.69 CC1COC(O)CC1C Amb24333809 [0,1,0,1,0,0|0,0,2]=4 7928 B9R1.69 CC1C[C@@H](C)C(=O)CC1 Amb25032160 [0,1,0,1,0,0|1,0,0]=3 7929 B9R1.69 CC1C[C@@H](O)[C@@H](O)CC1 Amb25241376 [0,1,0,1,0,0|0,0,2]=4 7930 B9R1.69 CC1C[C@@H](O)[C@H](O)CC1 Amb25175409 [0,1,0,1,0,0|0,0,2]=4 7931 B9R1.69 CC1C[C@@H](S)[C@H](O)CC1 Amb25266569 [0,1,0,1,0,0|0,1,1]=4 7932 B9R1.69 CC1C[C@H](O)[C@@H](O)CC1 Amb25240222 [0,1,0,1,0,0|0,0,2]=4 7933 B9R1.69 CC1NC(=O)CCC1N Amb25276175 [0,1,0,1,0,0|2,0,0]=4 7934 B9R1.69 CC1NC(=O)CCC1O Amb22229985 [0,1,0,1,0,0|2,0,0]=4 7935 B9R1.69 CC1NC(C)CNC1=O Amb25255409 [0,1,0,1,0,0|2,0,0]=4 7936 B9R1.69 CC1OC(=O)CCC1O Amb24524239 [0,1,0,1,0,0|1,0,0]=3 7937 B9R1.69 CC1OC(=S)NCC1C Amb24477731 [0,1,0,1,0,0|1,1,0]=4 7938 B9R1.69 CC1OC(C)CNC1=O Amb25831184 [0,1,0,1,0,0|2,0,0]=4 7939 B9R1.69 CC1SCC(=O)NC1C Amb24655776 [0,1,0,1,0,0|2,0,0]=4 7940 B9R1.69 CC1SCC(=O)OC1=O Amb2431035 [0,1,0,1,0,0|1,0,1]=4 7941 B9R1.69 CC=1COC(=O)C(C)N1 Amb24353611 [0,1,0,1,0,0|1,0,1]=4 7942 B9R1.69 CN1CC(Br)C(=O)CC1 Amb24740860 [0,1,0,1,0,0|2,0,0]=4 7943 B9R1.69 CN1CC(C)CNC1=O Amb15701562 [0,1,0,1,0,0|2,0,0]=4 7944 B9R1.69 CN1CC(F)C(=O)CC1 Amb22386895 [0,1,0,1,0,0|2,0,0]=4 7945 B9R1.69 CN1CC(N)C(=O)CC1 Amb18832618 [0,1,0,1,0,0|2,0,0]=4 7946 B9R1.69 CN1CC(N)CCC1=O Amb22405964 [0,1,0,1,0,0|2,0,0]=4 7947 B9R1.69 CN1CC(N)CCC1=O Amb22586977 [0,1,0,1,0,0|2,0,0]=4 7948 B9R1.69 CN1CC(O)CCC1=O Amb22304825 [0,1,0,1,0,0|2,0,0]=4 7949 B9R1.69 CN1CCC(=O)C(C1)C Amb1039009 [0,1,0,1,0,0|2,0,0]=4 7950 B9R1.69 CN1CCC(=O)CC1Cl Amb22496675 [0,1,0,1,0,0|2,0,0]=4 7951 B9R1.69 C[C@@H]1CC(=O)CC[C@H]1C Amb22231666 [0,1,0,1,0,0|1,0,0]=3 7952 B9R1.69 C[C@@H]1CC(=O)[C@@H](Br)CC1 Amb23592295 [0,1,0,1,0,0|1,0,1]=4 7953 B9R1.69 C[C@@H]1CC(=O)[C@@H](C)CC1 Amb24619935 [0,1,0,1,0,0|1,0,1]=4 7954 B9R1.69 C[C@@H]1CC(=O)[C@H](Cl)CC1 Amb24694008 [0,1,0,1,0,0|1,0,1]=4 7955 B9R1.69 C[C@@H]1CC(O)CC[C@@H]1C Amb25215758 [0,1,0,1,0,0|1,0,1]=4 7956 B9R1.69 C[C@@H]1CC=C(C)O[C@H]1O Amb25236121 [0,1,0,1,0,0|1,0,1]=4 7957 B9R1.69 C[C@@H]1CCC(=C)C[C@H]1O Amb24666635 [0,1,0,1,0,0|2,0,0]=4 7958 B9R1.69 C[C@@H]1CCC(C)=C[C@H]1O Amb25206333 [0,1,0,1,0,0|2,0,0]=4 7959 B9R1.69 C[C@@H]1CC[C@@H](O)C(=O)N1 Amb25175096 [0,1,0,1,0,0|1,0,1]=4 7960 B9R1.69 C[C@@H]1CC[C@H](O)CN1C Amb25369433 [0,1,0,1,0,0|1,0,1]=4 7961 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 Amb22225141 [0,1,0,1,0,0|2,0,0]=4 7962 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 Amb24184039 [0,1,0,1,0,0|2,0,0]=4 7963 B9R1.69 C[C@@H]1COC(O)C[C@@H]1C Amb25266294 [0,1,0,1,0,0|0,0,2]=4 7964 B9R1.69 C[C@@H]1C[C@@H](C)[C@@H](O)CC1 Amb24520434 [0,1,0,1,0,0|1,0,1]=4 7965 B9R1.69 C[C@@H]1C[C@@H](C)[C@H](O)CC1 Amb25315496 [0,1,0,1,0,0|1,0,1]=4 7966 B9R1.69 C[C@@H]1C[C@@H](O)CC[C@H]1C Amb24705627 [0,1,0,1,0,0|1,0,1]=4 7967 B9R1.69 C[C@@H]1C[C@@H](O)[C@@H](C)CC1 Amb25276352 [0,1,0,1,0,0|1,0,1]=4 7968 B9R1.69 C[C@@H]1C[C@@H](O)[C@@H](O)CC1 Amb24515640 [0,1,0,1,0,0|0,0,2]=4 7969 B9R1.69 C[C@@H]1C[C@@H](O)[C@H](C)CC1 Amb24589067 [0,1,0,1,0,0|1,0,1]=4 7970 B9R1.69 C[C@@H]1C[C@@H](O)[C@H](O)CC1 Amb25258757 [0,1,0,1,0,0|0,0,2]=4 7971 B9R1.69 C[C@@H]1C[C@H](O)C(=O)CC1 Amb25286475 [0,1,0,1,0,0|0,0,0]=2 7972 B9R1.69 C[C@@H]1C[C@H](O)[C@H](C)CC1 Amb25239717 [0,1,0,1,0,0|1,0,1]=4 7973 B9R1.69 C[C@@H]1NC(=O)CC[C@@H]1O Amb25081565 [0,1,0,1,0,0|2,0,0]=4 7974 B9R1.69 C[C@@H]1NC(=O)CC[C@H]1N Amb24100133 [0,1,0,1,0,0|2,0,0]=4 7975 B9R1.69 C[C@@H]1NC(=O)CC[C@H]1O Amb24710524 [0,1,0,1,0,0|2,0,0]=4 7976 B9R1.69 C[C@@H]1NC(C)CNC1=O Amb18832613 [0,1,0,1,0,0|2,0,0]=4 7977 B9R1.69 C[C@@H]1N[C@@H](C)CNC1=O Amb24602366 [0,1,0,1,0,0|2,0,0]=4 7978 B9R1.69 C[C@@H]1N[C@H](C)CNC1=O Amb24546409 [0,1,0,1,0,0|2,0,0]=4 7979 B9R1.69 C[C@@H]1OC(=O)NC[C@H]1Br Amb24571741 [0,1,0,1,0,0|2,0,0]=4 7980 B9R1.69 C[C@@H]1OC(=O)NC[C@H]1C Amb24679479 [0,1,0,1,0,0|1,0,0]=3 7981 B9R1.69 C[C@@H]1O[C@@H](C)CNC1=O Amb24629269 [0,1,0,1,0,0|2,0,0]=4 7982 B9R1.69 C[C@@H]1O[C@H](C)CNC1=O Amb24561641 [0,1,0,1,0,0|2,0,0]=4 7983 B9R1.69 C[C@H]1CC(=O)C(Br)CC1 Amb25774507 [0,1,0,1,0,0|1,0,1]=4 7984 B9R1.69 C[C@H]1CC(=O)C(F)CC1 Amb24690818 [0,1,0,1,0,0|1,0,1]=4 7985 B9R1.69 C[C@H]1CC(=O)CC[C@@H]1O Amb25202720 [0,1,0,1,0,0|2,0,0]=4 7986 B9R1.69 C[C@H]1CC(=O)CC[C@H]1C Amb25363978 [0,1,0,1,0,0|1,0,0]=3 7987 B9R1.69 C[C@H]1CC(=O)[C@H](Br)CC1 Amb25366783 [0,1,0,1,0,0|1,0,1]=4 7988 B9R1.69 C[C@H]1CC(Cl)C(=C)CC1 Amb25116271 [0,1,0,1,0,0|2,0,0]=4 7989 B9R1.69 C[C@H]1CC(O)C(Br)=CC1 Amb24718886 [0,1,0,1,0,0|1,0,1]=4 7990 B9R1.69 C[C@H]1CC=C(C)O[C@H]1O Amb25175541 [0,1,0,1,0,0|1,0,1]=4 7991 B9R1.69 C[C@H]1CCC(=O)CS1=O Amb25782562 [0,1,0,1,0,0|2,0,0]=4 7992 B9R1.69 C[C@H]1CCC(=O)C[C@@H]1Cl Amb25179045 [0,1,0,1,0,0|1,0,0]=3 7993 B9R1.69 C[C@H]1CCC(=O)C[C@H]1Br Amb25178854 [0,1,0,1,0,0|1,0,0]=3 7994 B9R1.69 C[C@H]1CCC(=O)C[C@H]1Cl Amb25179044 [0,1,0,1,0,0|1,0,0]=3 7995 B9R1.69 C[C@H]1CCC(=O)NC1=O Amb24478802 [0,1,0,1,0,0|1,0,1]=4 7996 B9R1.69 C[C@H]1CCC(C)=CC1O Amb24340096 [0,1,0,1,0,0|2,0,0]=4 7997 B9R1.69 C[C@H]1CCC(C)=C[C@H]1O Amb24733593 [0,1,0,1,0,0|2,0,0]=4 7998 B9R1.69 C[C@H]1CN(C)C(=O)CN1 Amb20670247 [0,1,0,1,0,0|2,0,0]=4 7999 B9R1.69 C[C@H]1CN(C)C(=O)CN1 Amb22225454 [0,1,0,1,0,0|2,0,0]=4 8000 B9R1.69 C[C@H]1CN(C)CCC1=O Amb24472489 [0,1,0,1,0,0|2,0,0]=4 8001 B9R1.69 C[C@H]1COC(=O)C[C@H]1O Amb24516166 [0,1,0,1,0,0|0,0,0]=2 8002 B9R1.69 C[C@H]1COC(O)C[C@@H]1O Amb24646262 [0,1,0,1,0,0|0,0,2]=4 8003 B9R1.69 C[C@H]1C[C@@H](C)[C@H](O)CC1 Amb25258776 [0,1,0,1,0,0|1,0,1]=4 8004 B9R1.69 C[C@H]1C[C@@H](O)C(=C)CC1 Amb25176540 [0,1,0,1,0,0|1,0,0]=3 8005 B9R1.69 C[C@H]1C[C@@H](O)C(Br)=CC1 Amb25175133 [0,1,0,1,0,0|1,0,1]=4 8006 B9R1.69 C[C@H]1C[C@@H](S)[C@H](O)CC1 Amb24520438 [0,1,0,1,0,0|0,1,1]=4 8007 B9R1.69 C[C@H]1C[C@H](C)C(=O)CC1 Amb25233717 [0,1,0,1,0,0|1,0,0]=3 8008 B9R1.69 C[C@H]1C[C@H](C)[C@H](O)CC1 Amb25234825 [0,1,0,1,0,0|1,0,1]=4 8009 B9R1.69 C[C@H]1C[C@H](O)C(Br)=CC1 Amb25307819 [0,1,0,1,0,0|1,0,1]=4 8010 B9R1.69 C[C@H]1C[C@H](O)CC[C@H]1C Amb24620750 [0,1,0,1,0,0|1,0,1]=4 8011 B9R1.69 C[C@H]1NC(=O)CC[C@H]1N Amb24622058 [0,1,0,1,0,0|2,0,0]=4 8012 B9R1.69 C[C@H]1NC(=O)CC[C@H]1O Amb24598792 [0,1,0,1,0,0|2,0,0]=4 8013 B9R1.69 C[C@H]1OC(=O)CCC1=O Amb25749526 [0,1,0,1,0,0|1,0,1]=4 8014 B9R1.69 C[C@H]1OC(=O)CC[C@@H]1O Amb25350343 [0,1,0,1,0,0|1,0,0]=3 8015 B9R1.69 C[C@H]1O[C@@H](C)CNC1=O Amb24580740 [0,1,0,1,0,0|2,0,0]=4 8016 B9R1.69 NC1CC(O)CNC1=O Amb25076949 [0,1,0,1,0,0|2,0,0]=4 8017 B9R1.69 NC1CCC(=O)N(C1)C Amb15701238 [0,1,0,1,0,0|2,0,0]=4 8018 B9R1.69 NC1CN(P)C(=O)CC1 Amb25303528 [0,1,0,1,0,0|2,0,0]=4 8019 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22745558 [0,1,0,1,0,0|2,0,0]=4 8020 B9R1.69 N[C@@H]1C[C@H](O)CNC1=O Amb22755435 [0,1,0,1,0,0|2,0,0]=4 8021 B9R1.69 N[C@H]1CCC(=O)OC1=O Amb24680533 [0,1,0,1,0,0|1,0,1]=4 8022 B9R1.69 N[C@H]1C[C@@H](O)CNC1=O Amb25277394 [0,1,0,1,0,0|2,0,0]=4 8023 B9R1.69 O=C1CC(Br)C(F)CN1 Amb25823142 [0,1,0,1,0,0|2,0,0]=4 8024 B9R1.69 O=C1CCC(Br)C(=O)O1 Amb25680134 [0,1,0,1,0,0|1,0,1]=4 8025 B9R1.69 O=C1CCC(Cl)C(=O)O1 Amb25060552 [0,1,0,1,0,0|1,0,1]=4 8026 B9R1.69 O=C1CCC(Cl)CC1Br Amb24674230 [0,1,0,1,0,0|2,0,0]=4 8027 B9R1.69 OC1CC(=O)CCC1O Amb24384658 [0,1,0,1,0,0|2,0,0]=4 8028 B9R1.69 OC1CCC(=O)OC1=O Amb25728114 [0,1,0,1,0,0|1,0,1]=4 8029 B9R1.69 OC1CCC(C(C1)C)C Amb10844787 [0,1,0,1,0,0|1,0,1]=4 8030 B9R1.69 OC1CNC(=O)CC1O Amb25090826 [0,1,0,1,0,0|2,0,0]=4 8031 B9R1.69 OC1COC(=O)CC1O Amb25057673 [0,1,0,1,0,0|1,0,0]=3 8032 B9R1.69 O[C@@H]1CNC(=O)C[C@@H]1O Amb24517387 [0,1,0,1,0,0|2,0,0]=4 8033 B9R1.69 O[C@H]1CNC(=O)C(O)C1 Amb24382736 [0,1,0,1,0,0|2,0,0]=4 8034 B9R1.69 O[C@H]1CNC(=O)C[C@H]1O Amb25211306 [0,1,0,1,0,0|2,0,0]=4 8035 B9R1.78 CC1CC1CC(=C)CO Amb25333398 [0,1,0,1,0,0|1,0,0]=3 8036 B9R1.78 CC1CC1CN(C)C=O Amb25072554 [0,1,0,1,0,0|2,0,0]=4 8037 B9R1.78 CC1CC1NC(=O)CN Amb18285971 [0,1,0,1,0,0|2,0,0]=4 8038 B9R1.78 CC1CC1NC(=O)CO Amb24375769 [0,1,0,1,0,0|1,0,0]=3 8039 B9R1.78 CC1CC1NC(=O)NC Amb24725580 [0,1,0,1,0,0|2,0,0]=4 8040 B9R1.78 C[C@@H]1C[C@H]1NC(=O)CC Amb24619545 [0,1,0,1,0,0|2,0,0]=4 8041 B9R1.80 C#CC(=O)NCC1CC1 Amb25084096 [0,1,0,1,0,0|2,0,0]=4 8042 B9R1.80 C#C[C@@H](O)CCC1CC1 Amb24693064 [0,1,0,1,0,0|1,0,1]=4 8043 B9R1.80 C=CC(=O)CNC1CC1 Amb25369017 [0,1,0,1,0,0|2,0,0]=4 8044 B9R1.80 CC(CCC1CC1)=NN Amb25136817 [0,1,0,1,0,0|2,0,0]=4 8045 B9R1.80 CC(CCC1CO1)CC Amb24595175 [0,1,0,1,0,0|1,0,1]=4 8046 B9R1.80 CC(CO)=CCC1CC1 Amb25032203 [0,1,0,1,0,0|1,0,1]=4 8047 B9R1.80 CCC(=O)CCC1CC1 Amb25132591 [0,1,0,1,0,0|1,0,0]=3 8048 B9R1.80 CCC(=O)CNC1CC1 Amb25245788 [0,1,0,1,0,0|2,0,0]=4 8049 B9R1.80 CCC(O)CCC1CC1 Amb25845587 [0,1,0,1,0,0|1,0,1]=4 8050 B9R1.80 CCS(=O)CCC1CC1 Amb24476724 [0,1,0,1,0,0|2,0,0]=4 8051 B9R1.80 CNC(=N)CCC1CC1 Amb24709583 [0,1,0,1,0,0|2,0,0]=4 8052 B9R1.80 CNC(=O)NCC1CC1 Amb25085395 [0,1,0,1,0,0|2,0,0]=4 8053 B9R1.80 COC(=N)CCC1CC1 Amb24606272 [0,1,0,1,0,0|1,0,0]=3 8054 B9R1.80 COC(=O)C#CC1CC1 Amb1036567 [0,1,0,1,0,0|0,0,2]=4 8055 B9R1.80 COC(=O)CCC1CC1 Amb24615342 [0,1,0,1,0,0|0,0,0]=2 8056 B9R1.80 COC(=O)CCC1CO1 Amb25377501 [0,1,0,1,0,0|1,0,0]=3 8057 B9R1.80 COC(=O)CNC1CC1 Amb20622332 [0,1,0,1,0,0|1,0,0]=3 8058 B9R1.80 COC(=O)NCC1CC1 Amb24562243 [0,1,0,1,0,0|1,0,0]=3 8059 B9R1.80 COC(=O)\C=C\C1CC1 Amb20621590 [0,1,0,1,0,0|0,0,2]=4 8060 B9R1.80 NC(CCC1CC1)=NO Amb25848987 [0,1,0,1,0,0|1,0,0]=3 8061 B9R1.80 NC(CO)CCC1CC1 Amb24715971 [0,1,0,1,0,0|1,0,1]=4 8062 B9R1.80 NCC(=O)CCC1CC1 Amb25245782 [0,1,0,1,0,0|1,0,0]=3 8063 B9R1.80 NCC(=O)OCC1CC1 Amb13952550 [0,1,0,1,0,0|2,0,0]=4 8064 B9R1.80 NCC(=O)OCC1CC1 Amb18305119 [0,1,0,1,0,0|2,0,0]=4 8065 B9R1.80 NCC(O)CCC1CC1 Amb25136180 [0,1,0,1,0,0|1,0,1]=4 8066 B9R1.80 NNC(=O)CCC1CC1 Amb25231267 [0,1,0,1,0,0|1,0,0]=3 8067 B9R1.80 O=C(CBr)NCC1CC1 Amb22059289 [0,1,0,1,0,0|2,0,0]=4 8068 B9R1.80 O=C(CBr)OCC1CC1 Amb24392877 [0,1,0,1,0,0|2,0,0]=4 8069 B9R1.80 O=C(CI)NCC1CC1 Amb24660173 [0,1,0,1,0,0|2,0,0]=4 8070 B9R1.80 O=CC(Br)CCC1CC1 Amb24480149 [0,1,0,1,0,0|1,0,1]=4 8071 B9R1.80 OC(CCC1CC1)C=O Amb25846669 [0,1,0,1,0,0|0,0,1]=3 8072 B9R1.80 OC(CCl)CCC1CC1 Amb24398131 [0,1,0,1,0,0|1,0,1]=4 8073 B9R1.82 CC(C=C)C1CC(=O)N1 Amb24471795 [0,1,0,1,0,0|1,0,1]=4 8074 B9R1.82 CC(C=O)C1CC(=O)N1 Amb24374664 [0,1,0,1,0,0|1,0,1]=4 8075 B9R1.82 CC(C=O)[C@H]1CC(=O)N1 Amb25797916 [0,1,0,1,0,0|1,0,1]=4 8076 B9R1.82 CC(CO)C1CC(=O)N1 Amb24598373 [0,1,0,1,0,0|1,0,0]=3 8077 B9R1.82 CC1CC(C1)C(=O)CC Amb23589656 [0,1,0,1,0,0|1,0,0]=3 8078 B9R1.82 CC1CC(C1)C(=O)NC Amb24633011 [0,1,0,1,0,0|1,0,0]=3 8079 B9R1.82 CC1CC(C1)C(=O)NN Amb25275433 [0,1,0,1,0,0|1,0,0]=3 8080 B9R1.82 CC1CC(C1)C(=O)NN Amb25717377 [0,1,0,1,0,0|1,0,0]=3 8081 B9R1.82 CC1CC(C1)C(=O)OC Amb25771219 [0,1,0,1,0,0|0,0,0]=2 8082 B9R1.82 CC1CC(C1)C(O)CC Amb23590269 [0,1,0,1,0,0|1,0,1]=4 8083 B9R1.82 CC1CC(O1)C(=O)OC Amb22737249 [0,1,0,1,0,0|1,0,0]=3 8084 B9R1.82 CC1CN(C1)C(=O)CBr Amb25177495 [0,1,0,1,0,0|2,0,0]=4 8085 B9R1.82 CC1CN(C1)C(=O)CO Amb25115577 [0,1,0,1,0,0|1,0,0]=3 8086 B9R1.82 CCC(Cl)C1CC(=O)O1 Amb24433017 [0,1,0,1,0,0|1,0,0]=3 8087 B9R1.82 CCC(O)C1CC(=O)O1 Amb24420833 [0,1,0,1,0,0|1,0,0]=3 8088 B9R1.82 CNC(=O)C1CC(N)C1 Amb25690251 [0,1,0,1,0,0|2,0,0]=4 8089 B9R1.82 CNC(=O)C1CC(O)C1 Amb19888985 [0,1,0,1,0,0|2,0,0]=4 8090 B9R1.82 COC(=O)C1CC(=C)C1 Amb21962131 [0,1,0,1,0,0|0,0,2]=4 8091 B9R1.82 COC(=O)C1CC(=O)C1 Amb17597687 [0,1,0,1,0,0|1,0,1]=4 8092 B9R1.82 COC(=O)C1CC(Br)C1 Amb23439345 [0,1,0,1,0,0|1,0,0]=3 8093 B9R1.82 COC(=O)C1CC(Cl)C1 Amb21962427 [0,1,0,1,0,0|1,0,0]=3 8094 B9R1.82 COC(=O)C1CC(F)C1 Amb24480349 [0,1,0,1,0,0|1,0,0]=3 8095 B9R1.82 COC(=O)C1CC(N)C1 Amb20622659 [0,1,0,1,0,0|1,0,0]=3 8096 B9R1.82 COC(=O)C1CC(N)C1 Amb21963494 [0,1,0,1,0,0|1,0,0]=3 8097 B9R1.82 COC(=O)C1CC(O)C1 Amb19516177 [0,1,0,1,0,0|1,0,0]=3 8098 B9R1.82 COC(=O)C=1CC(C)C1 Amb24432731 [0,1,0,1,0,0|0,0,2]=4 8099 B9R1.82 COC(=O)N1CC(F)C1 Amb24476710 [0,1,0,1,0,0|2,0,0]=4 8100 B9R1.82 COC(=O)N1CC(N)C1 Amb20668343 [0,1,0,1,0,0|2,0,0]=4 8101 B9R1.82 COC(=O)N1CC(O)C1 Amb24056451 [0,1,0,1,0,0|2,0,0]=4 8102 B9R1.82 COC(=O)[C@@H]1C[C@@H](Br)C1 Amb23439405 [0,1,0,1,0,0|1,0,0]=3 8103 B9R1.82 COC(=O)[C@@H]1C[C@@H](N)C1 Amb19148540 [0,1,0,1,0,0|1,0,0]=3 8104 B9R1.82 COC(=O)[C@@H]1C[C@@H](N)C1 Amb22747954 [0,1,0,1,0,0|1,0,0]=3 8105 B9R1.82 COC(=O)[C@@H]1C[C@@H](O)C1 Amb22746996 [0,1,0,1,0,0|1,0,0]=3 8106 B9R1.82 COC(=O)[C@@H]1C[C@H](N)C1 Amb22757971 [0,1,0,1,0,0|1,0,0]=3 8107 B9R1.82 COC(=O)[C@@H]1C[C@H](O)C1 Amb22754751 [0,1,0,1,0,0|1,0,0]=3 8108 B9R1.82 COC(=O)[C@H]1C[C@@H](Br)C1 Amb24361749 [0,1,0,1,0,0|1,0,0]=3 8109 B9R1.82 COC(=O)[C@H]1C[C@@H](Cl)C1 Amb25032105 [0,1,0,1,0,0|1,0,0]=3 8110 B9R1.82 C[C@@H](C=C)[C@@H]1CC(=O)N1 Amb24580176 [0,1,0,1,0,0|1,0,1]=4 8111 B9R1.82 C[C@@H](CO)[C@H]1CC(=O)O1 Amb24675614 [0,1,0,1,0,0|0,0,0]=2 8112 B9R1.82 C[C@@H]1C[C@H](O1)C(=O)OC Amb24056487 [0,1,0,1,0,0|1,0,0]=3 8113 B9R1.82 C[C@H](CO)[C@@H]1CC(=O)N1 Amb24517111 [0,1,0,1,0,0|1,0,0]=3 8114 B9R1.82 NC(CO)C1CC(=O)N1 Amb24573644 [0,1,0,1,0,0|2,0,0]=4 8115 B9R1.84 CC(=O)CCC1CCC1 Amb24534447 [0,1,0,1,0,0|1,0,0]=3 8116 B9R1.84 CC(=O)CCC=1CCC1 Amb25358814 [0,1,0,1,0,0|1,0,1]=4 8117 B9R1.84 CC(=O)CSC1CCC1 Amb24481902 [0,1,0,1,0,0|2,0,0]=4 8118 B9R1.84 CC(=O)CSC1COC1 Amb25853147 [0,1,0,1,0,0|2,0,0]=4 8119 B9R1.84 CC(O)CCC1CSC1 Amb25377027 [0,1,0,1,0,0|1,0,1]=4 8120 B9R1.84 CS(=O)CCC1CNC1 Amb25844183 [0,1,0,1,0,0|2,0,0]=4 8121 B9R1.84 NC(=O)CCC1CNC1 Amb24627864 [0,1,0,1,0,0|1,0,0]=3 8122 B9R1.84 NC(=O)CCN1CCC1 Amb25081700 [0,1,0,1,0,0|2,0,0]=4 8123 B9R1.84 NC(=O)CNC1CCC1 Amb18989288 [0,1,0,1,0,0|2,0,0]=4 8124 B9R1.84 NC(=O)COC1CCC1 Amb24714151 [0,1,0,1,0,0|2,0,0]=4 8125 B9R1.84 NC(=O)COC1CNC1 Amb20623915 [0,1,0,1,0,0|2,0,0]=4 8126 B9R1.84 NC(=O)COC1CNC1 Amb22059197 [0,1,0,1,0,0|2,0,0]=4 8127 B9R1.84 NC(=O)OCC1CCC1 Amb24642121 [0,1,0,1,0,0|2,0,0]=4 8128 B9R1.84 O=C(Cl)OCC1CCC1 Amb24551352 [0,1,0,1,0,0|2,0,0]=4 8129 B9R1.84 O=S(Cl)CCC1CCC1 Amb25179912 [0,1,0,1,0,0|2,0,0]=4 8130 B9R1.84 OC(=O)C=CC1CCC1 Amb20624021 [0,1,0,1,0,0|0,0,2]=4 8131 B9R1.84 OC(=O)CCN1CCC1 Amb22292346 [0,1,0,1,0,0|1,0,0]=3 8132 B9R1.84 OC(=O)CNC1CCC1 Amb18982434 [0,1,0,1,0,0|1,0,0]=3 8133 B9R1.84 OC(=O)CNC1CNC1 Amb25254651 [0,1,0,1,0,0|1,0,0]=3 8134 B9R1.84 OC(=O)CNC1COC1 Amb22737320 [0,1,0,1,0,0|1,0,0]=3 8135 B9R1.84 OC(=O)COC1CCC1 Amb18295877 [0,1,0,1,0,0|1,0,0]=3 8136 B9R1.84 OC(=O)COC1CNC1 Amb24454311 [0,1,0,1,0,0|1,0,0]=3 8137 B9R1.84 OC(=O)COC1COC1 Amb24539538 [0,1,0,1,0,0|1,0,0]=3 8138 B9R1.84 OC(=O)CSC1CCC1 Amb24439698 [0,1,0,1,0,0|1,0,0]=3 8139 B9R1.84 OC(=O)CSC1CNC1 Amb24759226 [0,1,0,1,0,0|1,0,0]=3 8140 B9R1.84 OC(=O)CSC1CSC1 Amb24569012 [0,1,0,1,0,0|1,0,0]=3 8141 B9R1.84 [O-][N+](=O)CCC1CCC1 Amb15692934 [0,1,0,1,0,0|1,0,1]=4 8142 B9R1.86 C=CC1OC1CC(O)=O Amb25701827 [0,1,0,1,0,0|1,0,1]=4 8143 B9R1.86 C=C[C@H]1O[C@@H]1CC(O)=O Amb25217275 [0,1,0,1,0,0|1,0,1]=4 8144 B9R1.86 CC(=O)NC1CC1CO Amb25846832 [0,1,0,1,0,0|2,0,0]=4 8145 B9R1.86 CC(C)CC1CC1C=O Amb25251564 [0,1,0,1,0,0|1,0,1]=4 8146 B9R1.86 CC(C)CC1CC1CO Amb25756770 [0,1,0,1,0,0|1,0,1]=4 8147 B9R1.86 CC(C)C[C@H]1O[C@H]1CO Amb24620586 [0,1,0,1,0,0|0,0,2]=4 8148 B9R1.86 CC(O)CC1CC1CC Amb24356232 [0,1,0,1,0,0|1,0,1]=4 8149 B9R1.86 CCC1CC1NC(C)=O Amb25208251 [0,1,0,1,0,0|2,0,0]=4 8150 B9R1.86 CCC1CC1NC(N)=O Amb25208250 [0,1,0,1,0,0|2,0,0]=4 8151 B9R1.86 C[C@@H](O)C[C@@H]1C[C@@H]1CC Amb25204804 [0,1,0,1,0,0|1,0,1]=4 8152 B9R1.86 C[C@@H](O)C[C@@H]1O[C@@H]1C=O Amb24515298 [0,1,0,1,0,0|1,0,1]=4 8153 B9R1.86 OC(=O)CC1CC1CBr Amb25269489 [0,1,0,1,0,0|0,0,0]=2 8154 B9R1.86 OC(=O)CN1CC1C=O Amb24078335 [0,1,0,1,0,0|1,0,1]=4 8155 B9R1.95 CC(=O)N1CC(CCl)C1 Amb25332330 [0,1,0,1,0,0|2,0,0]=4 8156 B9R1.95 CC(C)C1CC(C1)=NO Amb25221796 [0,1,0,1,0,0|1,0,0]=3 8157 B9R1.95 CC(C)C1CC(C1)NO Amb25698799 [0,1,0,1,0,0|1,0,1]=4 8158 B9R1.95 CC(C)C1CC(CO)C1 Amb22497609 [0,1,0,1,0,0|1,0,1]=4 8159 B9R1.95 CC(O)C1CC(C1)OC Amb25738082 [0,1,0,1,0,0|1,0,1]=4 8160 B9R1.95 CCC1CC(=C1)C(O)=O Amb25238748 [0,1,0,1,0,0|0,0,2]=4 8161 B9R1.95 CCC1CC(C1)C(=O)Cl Amb25791521 [0,1,0,1,0,0|1,0,0]=3 8162 B9R1.95 CCC1CC(C1)C(C)=O Amb25046444 [0,1,0,1,0,0|1,0,0]=3 8163 B9R1.95 CCC1CC(C1)C(N)=O Amb25690385 [0,1,0,1,0,0|1,0,0]=3 8164 B9R1.95 CCC1CC(C1)C(O)=O Amb23456004 [0,1,0,1,0,0|0,0,0]=2 8165 B9R1.95 CCN1CC(C1)C(O)=O Amb24117130 [0,1,0,1,0,0|1,0,0]=3 8166 B9R1.95 CC[C@@H]1C[C@@H](C1)C(O)=O Amb25129624 [0,1,0,1,0,0|0,0,0]=2 8167 B9R1.95 CNC1CC(C1)C(O)=O Amb20622656 [0,1,0,1,0,0|0,0,0]=2 8168 B9R1.95 CNC1CN(C1)C(C)=O Amb23598676 [0,1,0,1,0,0|2,0,0]=4 8169 B9R1.95 CNC1CN(C1)C(N)=O Amb23598671 [0,1,0,1,0,0|2,0,0]=4 8170 B9R1.95 COC1CC(C1)C(C)=O Amb24595933 [0,1,0,1,0,0|1,0,0]=3 8171 B9R1.95 COC1CC(C1)C(N)=N Amb24733631 [0,1,0,1,0,0|2,0,0]=4 8172 B9R1.95 CO[C@@H]1C[C@@H](C1)C(O)=O Amb23440276 [0,1,0,1,0,0|0,0,0]=2 8173 B9R1.95 CO[C@@H]1C[C@H](C1)C(O)=O Amb23440277 [0,1,0,1,0,0|0,0,0]=2 8174 B9R1.95 NC(=O)N1CC(CO)C1 Amb24478714 [0,1,0,1,0,0|2,0,0]=4 8175 B9R1.95 NN=C1CC(C1)C(O)=O Amb23570285 [0,1,0,1,0,0|1,0,1]=4 8176 B9R1.95 OC(=O)C1CC(C1)=NO Amb23452648 [0,1,0,1,0,0|1,0,1]=4 8177 B9R1.95 OC(=O)C1CC(CBr)C1 Amb19958667 [0,1,0,1,0,0|0,0,0]=2 8178 B9R1.95 OC(=O)[C@H]1C[C@@H](CBr)C1 Amb25116147 [0,1,0,1,0,0|0,0,0]=2 8179 B9R1.95 OCC1CC(C1)C(O)=O Amb22002175 [0,1,0,1,0,0|0,0,0]=2 8180 B9R1.95 OC[C@@H]1C[C@@H](N1)C(O)=O Amb24556421 [0,1,0,1,0,0|1,0,0]=3 8181 B9R1.121 CC1(C)CCC1(O)C#C Amb24610456 [0,1,0,1,0,0|1,0,1]=4 8182 B9R1.121 CC1(C)CCC1(O)C#N Amb24661472 [0,1,0,1,0,0|1,0,1]=4 8183 B9R1.121 CC1(C)CCC1(O)C=C Amb25826574 [0,1,0,1,0,0|1,0,1]=4 8184 B9R1.121 CC1(C)CCC1(O)CC Amb24689751 [0,1,0,1,0,0|1,0,1]=4 8185 B9R1.121 CC1(C)CCC1(O)CO Amb25662448 [0,1,0,1,0,0|0,0,2]=4 8186 B9R1.125 CC1(CBr)CNC(=O)O1 Amb24753177 [0,1,0,1,0,0|1,0,0]=3 8187 B9R1.125 CC1(CBr)CNC(=O)S1 Amb25163395 [0,1,0,1,0,0|1,1,0]=4 8188 B9R1.125 CC1(CC(=O)CC1)C#N Amb24722939 [0,1,0,1,0,0|1,0,1]=4 8189 B9R1.125 CC1(CC(=O)CC1)C=C Amb25718906 [0,1,0,1,0,0|1,0,1]=4 8190 B9R1.125 CC1(CCC(=O)N1)C#N Amb10608311 [0,1,0,1,0,0|1,0,1]=4 8191 B9R1.125 CC1(CCC(=O)O1)C#C Amb25277305 [0,1,0,1,0,0|0,0,1]=3 8192 B9R1.125 CC1(CCl)CNC(=O)C1 Amb24384917 [0,1,0,1,0,0|2,0,0]=4 8193 B9R1.125 CC1(CCl)CNC(=O)S1 Amb25032092 [0,1,0,1,0,0|1,1,0]=4 8194 B9R1.125 CC1(CCl)COC(=O)N1 Amb25793609 [0,1,0,1,0,0|2,0,0]=4 8195 B9R1.125 CC1(CN)CCC(=O)N1 Amb25253003 [0,1,0,1,0,0|1,0,0]=3 8196 B9R1.125 CC1(CN)CNC(=O)C1 Amb24677517 [0,1,0,1,0,0|2,0,0]=4 8197 B9R1.125 CC1(CO)CCC(=O)N1 Amb25796503 [0,1,0,1,0,0|1,0,0]=3 8198 B9R1.125 CC1(CO)CCC(=O)O1 Amb24424055 [0,1,0,1,0,0|0,0,0]=2 8199 B9R1.125 CC1(CO)CNC(=O)C1 Amb22546426 [0,1,0,1,0,0|2,0,0]=4 8200 B9R1.125 CC1(CO)COC(=O)C1 Amb24748377 [0,1,0,1,0,0|2,0,0]=4 8201 B9R1.125 CC1(CS)COC(=O)N1 Amb24666773 [0,1,0,1,0,0|2,0,0]=4 8202 B9R1.125 CC1CC(C)(CC1)C=O Amb23454036 [0,1,0,1,0,0|1,0,1]=4 8203 B9R1.125 CC1CC(C)(CO)CC1 Amb23453964 [0,1,0,1,0,0|1,0,1]=4 8204 B9R1.125 CC1CC(O)(CC1)C#C Amb25795719 [0,1,0,1,0,0|1,0,1]=4 8205 B9R1.125 CC1CC(O)(CC1)C=C Amb25180477 [0,1,0,1,0,0|1,0,1]=4 8206 B9R1.125 CC1CCC(C)(CCl)O1 Amb24753894 [0,1,0,1,0,0|1,0,1]=4 8207 B9R1.125 CCC1(C)CC(=O)CC1 Amb24706768 [0,1,0,1,0,0|1,0,0]=3 8208 B9R1.125 CCC1(C)CC(O)CC1 Amb25109111 [0,1,0,1,0,0|1,0,1]=4 8209 B9R1.125 CCC1(C)CNC(=O)C1 Amb24655544 [0,1,0,1,0,0|2,0,0]=4 8210 B9R1.125 CCC1(C)CNC(=O)O1 Amb25228455 [0,1,0,1,0,0|1,0,0]=3 8211 B9R1.125 CCC1(C)NC(=O)CS1 Amb24452202 [0,1,0,1,0,0|2,0,0]=4 8212 B9R1.125 CCC1(O)CC(C)CC1 Amb25132617 [0,1,0,1,0,0|1,0,1]=4 8213 B9R1.125 CC[C@@]1(C)CCC(=O)N1 Amb24356520 [0,1,0,1,0,0|1,0,0]=3 8214 B9R1.125 CC[C@@]1(C)COC(=O)N1 Amb24587770 [0,1,0,1,0,0|2,0,0]=4 8215 B9R1.125 CC[C@]1(C)CC(=O)CC1 Amb25706157 [0,1,0,1,0,0|1,0,0]=3 8216 B9R1.125 CC[C@]1(C)COC(=O)N1 Amb25253542 [0,1,0,1,0,0|2,0,0]=4 8217 B9R1.125 CN1CCC(C)(CO)O1 Amb24632272 [0,1,0,1,0,0|2,0,0]=4 8218 B9R1.125 C[C@@]1(CBr)CCC(=O)O1 Amb24480303 [0,1,0,1,0,0|0,0,0]=2 8219 B9R1.125 C[C@@]1(CBr)CNC(=O)O1 Amb25264424 [0,1,0,1,0,0|1,0,0]=3 8220 B9R1.125 C[C@]1(CBr)CCC(=O)O1 Amb24425525 [0,1,0,1,0,0|0,0,0]=2 8221 B9R1.125 C[C@]1(CCC(=O)N1)C=O Amb25207935 [0,1,0,1,0,0|1,0,1]=4 8222 B9R1.125 C[C@]1(CCl)CNC(=O)O1 Amb24480106 [0,1,0,1,0,0|1,0,0]=3 8223 B9R1.125 C[C@]1(CO)C=CC(=O)O1 Amb24404816 [0,1,0,1,0,0|0,0,2]=4 8224 B9R1.127 CC(=O)C1CC1(C)CCl Amb25141665 [0,1,0,1,0,0|1,0,0]=3 8225 B9R1.127 CC(=O)C1OC1(C)CCl Amb24670937 [0,1,0,1,0,0|2,0,0]=4 8226 B9R1.127 CC(=O)C1OC1(C)CO Amb24662478 [0,1,0,1,0,0|2,0,0]=4 8227 B9R1.127 CC(C)C1CC1(N)CO Amb24638729 [0,1,0,1,0,0|1,0,1]=4 8228 B9R1.127 CC1(CC1C(O)=O)CO Amb24529046 [0,1,0,1,0,0|0,0,0]=2 8229 B9R1.127 CCC1(C)CC1C(N)=O Amb24377068 [0,1,0,1,0,0|1,0,0]=3 8230 B9R1.127 CCC1(C)CC1C(O)=O Amb18285802 [0,1,0,1,0,0|0,0,0]=2 8231 B9R1.127 C[C@@]1(CN)C[C@H]1C(O)=O Amb24517240 [0,1,0,1,0,0|0,0,0]=2 8232 B9R1.127 OC[C@@]1(Cl)C[C@H]1C(O)=O Amb24511974 [0,1,0,1,0,0|1,0,0]=3 8233 B9R1.127 OC[C@]1(Cl)C[C@H]1C(O)=O Amb25201489 [0,1,0,1,0,0|1,0,0]=3 8234 B9R1.133 CC1(C)CC(CC1)C=O Amb24418196 [0,1,0,1,0,0|1,0,1]=4 8235 B9R1.133 CC1(C)CC=C(C1)C=O Amb18642223 [0,1,0,1,0,0|1,0,1]=4 8236 B9R1.133 CC1(C)CCC(C=O)=C1 Amb18642225 [0,1,0,1,0,0|1,0,0]=3 8237 B9R1.133 CC1(C)CCC(CBr)O1 Amb25108584 [0,1,0,1,0,0|1,0,1]=4 8238 B9R1.133 CC1(C)CCC(CO)N1 Amb24400098 [0,1,0,1,0,0|1,0,1]=4 8239 B9R1.133 CC1(C)CC[C@@H](CO)O1 Amb22886789 [0,1,0,1,0,0|0,0,2]=4 8240 B9R1.133 CC1(C)CN(CC1)C=O Amb25737042 [0,1,0,1,0,0|2,0,0]=4 8241 B9R1.133 CC1(C)CNC(CO)=N1 Amb25055034 [0,1,0,1,0,0|2,0,0]=4 8242 B9R1.133 CC1(C)COC(=CO)N1 Amb24612033 [0,1,0,1,0,0|2,0,0]=4 8243 B9R1.133 CC1(C)COC(C=O)O1 Amb25377194 [0,1,0,1,0,0|1,0,1]=4 8244 B9R1.133 CC1(C)N=C(CO)CO1 Amb24419406 [0,1,0,1,0,0|2,0,0]=4 8245 B9R1.133 CC1(C)O[C@@H](CO1)C=O Amb22747142 [0,1,0,1,0,0|1,0,1]=4 8246 B9R1.133 CCC1CC(C)(O)CC1 Amb25147188 [0,1,0,1,0,0|1,0,1]=4 8247 B9R1.133 CNC1CCS(=O)(=O)C1 Amb1152562 [0,1,0,1,0,0|1,0,1]=4 8248 B9R1.133 CNC1CCS(=O)(=O)C1 Amb1290363 [0,1,0,1,0,0|1,0,1]=4 8249 B9R1.133 CNC1CC[S+](=O)(C1)[O-] Amb10237058 [0,1,0,1,0,0|1,0,1]=4 8250 B9R1.133 CSC1CCS(=O)(=O)C1 Amb2548452 [0,1,0,1,0,0|1,0,1]=4 8251 B9R1.133 ClCC1CC[S+](=O)(C1)[O-] Amb10238774 [0,1,0,1,0,0|1,0,1]=4 8252 B9R1.133 NCC1CS(=O)(=O)CC1 Amb19204939 [0,1,0,1,0,0|1,0,1]=4 8253 B9R1.133 O=S1(=O)CC(CBr)CC1 Amb25321623 [0,1,0,1,0,0|1,0,1]=4 8254 B9R1.133 O=S1(=O)CC(CS)CC1 Amb18062508 [0,1,0,1,0,0|1,0,1]=4 8255 B9R1.133 OCC1CCS(=O)(=O)C1 Amb2548453 [0,1,0,1,0,0|1,0,1]=4 8256 B9R1.138 CC1(C)CCC(=N)N1O Amb24674771 [0,1,0,1,0,0|1,0,0]=3 8257 B9R1.138 CC1(C)CCC(=O)C1O Amb24422474 [0,1,0,1,0,0|0,0,0]=2 8258 B9R1.138 CC1(C)CCC(Br)C1=O Amb25306183 [0,1,0,1,0,0|1,0,1]=4 8259 B9R1.138 CC1(C)CCC(N)C1O Amb24695584 [0,1,0,1,0,0|1,0,1]=4 8260 B9R1.138 CC1(C)CCC(O)C1=C Amb25107629 [0,1,0,1,0,0|1,0,1]=4 8261 B9R1.138 CC1(C)CCC(O)C1=O Amb25032072 [0,1,0,1,0,0|0,0,1]=3 8262 B9R1.138 CC1(C)CNC(=O)C1=O Amb22295904 [0,1,0,1,0,0|1,0,1]=4 8263 B9R1.138 CC1(C)CNC(=O)C1N Amb25224596 [0,1,0,1,0,0|2,0,0]=4 8264 B9R1.138 CC1(C)CNC(=O)[C@@H]1N Amb24715876 [0,1,0,1,0,0|2,0,0]=4 8265 B9R1.138 CC1(C)CNC(=O)[C@@H]1O Amb25083101 [0,1,0,1,0,0|1,0,0]=3 8266 B9R1.138 CC1(C)COC(=N)C1O Amb24732570 [0,1,0,1,0,0|2,0,0]=4 8267 B9R1.138 CC1(C)COC(=O)C1Br Amb25060181 [0,1,0,1,0,0|2,0,0]=4 8268 B9R1.138 CC1(C)COC(=O)C1N Amb18642696 [0,1,0,1,0,0|2,0,0]=4 8269 B9R1.138 CC1(C)COC(=O)[C@@H]1Br Amb22747532 [0,1,0,1,0,0|2,0,0]=4 8270 B9R1.138 CC1(C)COC(=O)[C@@H]1N Amb25083661 [0,1,0,1,0,0|2,0,0]=4 8271 B9R1.138 CC1(C)COC(=O)[C@H]1N Amb24589212 [0,1,0,1,0,0|2,0,0]=4 8272 B9R1.138 CC1(C)OCC(=O)C1O Amb24645408 [0,1,0,1,0,0|1,0,0]=3 8273 B9R1.138 CC1(C)OCC(=O)[C@H]1O Amb25807640 [0,1,0,1,0,0|1,0,0]=3 8274 B9R1.138 CC1(O)CCC(=O)C1Cl Amb24480148 [0,1,0,1,0,0|2,0,0]=4 8275 B9R1.138 CC1C(=O)CCC1(C)C Amb25093160 [0,1,0,1,0,0|1,0,0]=3 8276 B9R1.138 CC1C(=O)CCC1(C)O Amb25263522 [0,1,0,1,0,0|2,0,0]=4 8277 B9R1.138 CC1CCC(C)(C)C1=O Amb22228221 [0,1,0,1,0,0|1,0,1]=4 8278 B9R1.138 CN1C(=O)CCC1(C)O Amb25221199 [0,1,0,1,0,0|2,0,0]=4 8279 B9R1.138 CN1C(=O)CNC1(C)C Amb25742107 [0,1,0,1,0,0|2,0,0]=4 8280 B9R1.138 C[C@@H]1C(=O)CC[C@@]1(C)O Amb25358833 [0,1,0,1,0,0|2,0,0]=4 8281 B9R1.138 C[C@@]1(O)CC[C@@H](O)C1=O Amb25366452 [0,1,0,1,0,0|1,0,1]=4 8282 B9R1.138 C[C@]1(O)CC=C(O)C1=O Amb25066353 [0,1,0,1,0,0|1,0,1]=4 8283 B9R1.138 C[C@]1(O)CCC(=O)C1=O Amb24602913 [0,1,0,1,0,0|1,0,1]=4 8284 B9R1.138 C[C@]1(O)CC[C@@H](O)C1=O Amb24744789 [0,1,0,1,0,0|1,0,1]=4 8285 B9R1.138 C[C@]1(O)COC(=O)[C@H]1O Amb24515250 [0,1,0,1,0,0|2,0,0]=4 8286 B9R1.138 OC1C(=O)NCC1(C)C Amb16203297 [0,1,0,1,0,0|1,0,0]=3 8287 B9R1.147 CC(=O)CCC1(O)CC1 Amb25278414 [0,1,0,1,0,0|1,0,0]=3 8288 B9R1.147 CC(C)CCC1(O)CC1 Amb24642189 [0,1,0,1,0,0|1,0,1]=4 8289 B9R1.147 CC1(CC1)C#CC(O)=O Amb25662631 [0,1,0,1,0,0|0,0,2]=4 8290 B9R1.147 CC1(CCC(O)=O)N=N1 Amb25840850 [0,1,0,1,0,0|1,0,0]=3 8291 B9R1.147 CC1(CNC(N)=O)CC1 Amb24733644 [0,1,0,1,0,0|2,0,0]=4 8292 B9R1.147 NC(=O)CCC1(N)CC1 Amb24756880 [0,1,0,1,0,0|1,0,0]=3 8293 B9R1.147 NC1(CC1)C#CC(O)=O Amb24558280 [0,1,0,1,0,0|0,0,2]=4 8294 B9R1.147 NC1(CC1)\C=C\C(O)=O Amb24460594 [0,1,0,1,0,0|0,0,2]=4 8295 B9R1.147 NC1(CCC(O)=O)CC1 Amb18832570 [0,1,0,1,0,0|0,0,0]=2 8296 B9R1.147 NC1(CCS(=O)=O)CC1 Amb25212533 [0,1,0,1,0,0|1,0,1]=4 8297 B9R1.147 OC(=O)C#CC1(Cl)CC1 Amb25133518 [0,1,0,1,0,0|0,0,2]=4 8298 B9R1.185 CC(C=O)C1CC1(C)C Amb25282715 [0,1,0,1,0,0|1,0,1]=4 8299 B9R1.185 CC(CO)[C@@H]1C[C@]1(C)O Amb25369390 [0,1,0,1,0,0|1,0,1]=4 8300 B9R1.185 CC1(C)CC1C(=O)CBr Amb25781761 [0,1,0,1,0,0|1,0,0]=3 8301 B9R1.185 CC1(C)CC1C(=O)NN Amb19890094 [0,1,0,1,0,0|1,0,0]=3 8302 B9R1.185 CC1(C)CC1C(N)=NO Amb25376693 [0,1,0,1,0,0|1,0,0]=3 8303 B9R1.185 CC1(C)CC1[C@H](O)C#C Amb25212190 [0,1,0,1,0,0|1,0,1]=4 8304 B9R1.185 CC1(C)C[C@@H]1C(=O)NN Amb25318317 [0,1,0,1,0,0|1,0,0]=3 8305 B9R1.185 CC1(C)C[C@@H]1C(=O)NO Amb25686884 [0,1,0,1,0,0|0,0,0]=2 8306 B9R1.185 CCC(=O)C1CC1(C)C Amb10608271 [0,1,0,1,0,0|1,0,0]=3 8307 B9R1.185 CCC(=O)C1OC1(C)C Amb25032300 [0,1,0,1,0,0|2,0,0]=4 8308 B9R1.185 CC[C@H](O)C1CC1(C)C Amb25849671 [0,1,0,1,0,0|1,0,1]=4 8309 B9R1.185 CNC(=O)C1CC1(C)C Amb25807724 [0,1,0,1,0,0|1,0,0]=3 8310 B9R1.185 CNC(=O)[C@H]1CC1(C)C Amb25821260 [0,1,0,1,0,0|1,0,0]=3 8311 B9R1.185 COC(=N)C1CC1(C)C Amb25720677 [0,1,0,1,0,0|1,0,0]=3 8312 B9R1.185 COC(=O)C1CC1(C)C Amb25762943 [0,1,0,1,0,0|0,0,0]=2 8313 B9R1.185 COC(=O)C1CC1(Cl)Cl Amb24721204 [0,1,0,1,0,0|2,0,0]=4 8314 B9R1.185 COC(=O)C1NC1(C)C Amb23401628 [0,1,0,1,0,0|1,0,0]=3 8315 B9R1.185 COC(=O)[C@H]1CC1(C)C Amb25297242 [0,1,0,1,0,0|0,0,0]=2 8316 B9R1.185 NNC(=O)C1CC1(C)C Amb10608316 [0,1,0,1,0,0|1,0,0]=3 8317 B9R1.36 CC1(C)CC(=O)C(=C)C1 Amb25031983 [0,1,0,1,0,0|1,0,1]=4 8318 B9R1.36 CC1(C)CC(=O)C(=O)O1 Amb24723785 [0,1,0,1,0,0|0,0,1]=3 8319 B9R1.36 CC1(C)CC(=O)C(O)=C1 Amb25093633 [0,1,0,1,0,0|1,0,1]=4 8320 B9R1.36 CC1(C)CC(=O)N(N)C1 Amb24433391 [0,1,0,1,0,0|2,0,0]=4 8321 B9R1.36 CC1(C)CC(Br)C(=O)O1 Amb24340074 [0,1,0,1,0,0|0,0,0]=2 8322 B9R1.36 CC1(C)CC(Br)C(=O)S1 Amb25063134 [0,1,0,1,0,0|0,1,0]=3 8323 B9R1.36 CC1(C)CC(Cl)C(=O)O1 Amb24513845 [0,1,0,1,0,0|0,0,0]=2 8324 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb18124322 [0,1,0,1,0,0|0,0,0]=2 8325 B9R1.36 CC1(C)CC(O)C(=O)N1 Amb24475313 [0,1,0,1,0,0|1,0,0]=3 8326 B9R1.36 CC1(C)CC(O)C(=O)O1 Amb25245118 [0,1,0,1,0,0|0,0,0]=2 8327 B9R1.36 CC1(C)CC(O)C(Br)=C1 Amb25676107 [0,1,0,1,0,0|2,0,0]=4 8328 B9R1.36 CC1(C)CC(O)C(N)C1 Amb24743875 [0,1,0,1,0,0|1,0,1]=4 8329 B9R1.36 CC1(C)CC(O)C(O)C1 Amb24478613 [0,1,0,1,0,0|1,0,1]=4 8330 B9R1.36 CC1(C)C[C@H](Cl)C(=O)O1 Amb25743067 [0,1,0,1,0,0|0,0,0]=2 8331 B9R1.36 CC1(C)C[C@H](N)C(=O)O1 Amb24476611 [0,1,0,1,0,0|0,0,0]=2 8332 B9R1.36 CC1(C)C[C@H](O)[C@@H](O)C1 Amb25176292 [0,1,0,1,0,0|1,0,1]=4 8333 B9R1.36 CC1(O)CC(C)C(C)C1 Amb24477851 [0,1,0,1,0,0|1,0,1]=4 8334 B9R1.36 CC1=NC(C)(C)CC1Cl Amb24633954 [0,1,0,1,0,0|2,0,0]=4 8335 B9R1.36 CC1CC(C)(C)CC1=C Amb25846674 [0,1,0,1,0,0|2,0,0]=4 8336 B9R1.36 CC1CC(C)(C)CC1=S Amb25373919 [0,1,0,1,0,0|1,1,0]=4 8337 B9R1.36 CC1CC(C)(C)CN1O Amb25338281 [0,1,0,1,0,0|2,0,0]=4 8338 B9R1.36 CC1CC(C)(C)NC1=N Amb25286010 [0,1,0,1,0,0|2,0,0]=4 8339 B9R1.36 CC1CC(C)(C)NC1=O Amb19149267 [0,1,0,1,0,0|1,0,0]=3 8340 B9R1.36 CC1CC(C)(C)NC1=S Amb24404856 [0,1,0,1,0,0|1,1,0]=4 8341 B9R1.36 CC1CC(C)(C)OC1=O Amb24444118 [0,1,0,1,0,0|0,0,0]=2 8342 B9R1.36 CC1CC(C)(C)OC1O Amb25214654 [0,1,0,1,0,0|0,0,2]=4 8343 B9R1.36 CC1CS(=O)(=O)CC1N Amb24340271 [0,1,0,1,0,0|1,0,1]=4 8344 B9R1.36 CC1NC(C)(C)NC1=O Amb25178054 [0,1,0,1,0,0|2,0,0]=4 8345 B9R1.36 CC1NC(C)(C)OC1=O Amb25824700 [0,1,0,1,0,0|1,0,0]=3 8346 B9R1.36 CN1CC(C)(C)CC1=O Amb25692350 [0,1,0,1,0,0|2,0,0]=4 8347 B9R1.36 C[C@@H]1CC(C)(C)CC1=O Amb25086441 [0,1,0,1,0,0|1,0,0]=3 8348 B9R1.36 C[C@@H]1CC(C)(C)C[C@H]1O Amb25356450 [0,1,0,1,0,0|1,0,1]=4 8349 B9R1.36 C[C@@H]1CS(=O)(=O)C[C@@H]1N Amb25124954 [0,1,0,1,0,0|1,0,1]=4 8350 B9R1.36 C[C@@H]1CS(=O)(=O)C[C@H]1N Amb24587782 [0,1,0,1,0,0|1,0,1]=4 8351 B9R1.36 C[C@@H]1NC(C)(C)OC1=O Amb25229559 [0,1,0,1,0,0|1,0,0]=3 8352 B9R1.36 C[C@@H]1OC(C)(C)C[C@H]1O Amb24515424 [0,1,0,1,0,0|1,0,1]=4 8353 B9R1.36 C[C@@H]1OC(C)(C)NC1=O Amb24410132 [0,1,0,1,0,0|2,0,0]=4 8354 B9R1.36 C[C@H]1CC(C)(C)C[C@@H]1O Amb24576599 [0,1,0,1,0,0|1,0,1]=4 8355 B9R1.36 C[C@H]1CC(C)(C)C[C@H]1O Amb24618231 [0,1,0,1,0,0|1,0,1]=4 8356 B9R1.36 C[C@H]1CS(=O)(=O)C[C@H]1N Amb25222669 [0,1,0,1,0,0|1,0,1]=4 8357 B9R1.36 C[C@H]1OC(C)(C)C[C@@H]1O Amb24734144 [0,1,0,1,0,0|1,0,1]=4 8358 B9R1.36 O=C1CC(CC1C)(C)C Amb15693405 [0,1,0,1,0,0|1,0,0]=3 8359 B9R1.36 O=C1OC(SC1C)(C)C Amb15691646 [0,1,0,1,0,0|1,0,0]=3 8360 B9R1.36 OC1CS(=O)(=O)CC1C Amb2233406 [0,1,0,1,0,0|1,0,1]=4 8361 B9R1.38 CC1(Br)OC(=O)CC1Br Amb25126951 [0,1,0,1,0,0|1,0,0]=3 8362 B9R1.38 CC1(C)C=C(Br)C[C@@H]1O Amb25032344 [0,1,0,1,0,0|2,0,0]=4 8363 B9R1.38 CC1(C)C=C(Br)C[C@H]1O Amb25147101 [0,1,0,1,0,0|2,0,0]=4 8364 B9R1.38 CC1(C)CC(=C)CC1O Amb25316151 [0,1,0,1,0,0|2,0,0]=4 8365 B9R1.38 CC1(C)CC(=O)CC1O Amb25730215 [0,1,0,1,0,0|1,0,0]=3 8366 B9R1.38 CC1(C)NC(=O)CC1=O Amb18832699 [0,1,0,1,0,0|1,0,1]=4 8367 B9R1.38 CC1(C)OC(=O)CC1Br Amb25831430 [0,1,0,1,0,0|0,0,0]=2 8368 B9R1.38 CC1(C)OC(=O)CC1Cl Amb24552388 [0,1,0,1,0,0|0,0,0]=2 8369 B9R1.38 CC1(C)OC(=O)CC1O Amb25198591 [0,1,0,1,0,0|0,0,0]=2 8370 B9R1.38 CC1(C)OC(=O)N=C1N Amb23515141 [0,1,0,1,0,0|1,0,1]=4 8371 B9R1.38 CC1(C)OC(=O)NC1=S Amb24694572 [0,1,0,1,0,0|1,0,1]=4 8372 B9R1.38 CC1(C)OC(=O)NC1N Amb24561447 [0,1,0,1,0,0|1,0,0]=3 8373 B9R1.38 CC1CC(=O)NC1(C)C Amb19516972 [0,1,0,1,0,0|1,0,0]=3 8374 B9R1.38 CC1CC(N)P(O)(=O)O1 Amb25843150 [0,1,0,1,0,0|2,0,0]=4 8375 B9R1.38 CC1CC(O)OC1(C)C Amb25271492 [0,1,0,1,0,0|0,0,2]=4 8376 B9R1.38 CC1CC(S(=O)(=O)C1)C Amb2227622 [0,1,0,1,0,0|1,0,1]=4 8377 B9R1.38 CC1NC(=O)CC1(C)C Amb24618176 [0,1,0,1,0,0|2,0,0]=4 8378 B9R1.38 CC1OC(=O)NC1(C)C Amb24481994 [0,1,0,1,0,0|2,0,0]=4 8379 B9R1.38 CN1CC(=O)NC1(C)C Amb24354186 [0,1,0,1,0,0|2,0,0]=4 8380 B9R1.38 C[C@@H]1NC(=O)OC1(C)C Amb24553743 [0,1,0,1,0,0|1,0,0]=3 8381 B9R1.38 C[C@H]1NC(=O)OC1(C)C Amb25268161 [0,1,0,1,0,0|1,0,0]=3 8382 B9R1.38 O=C1OC(=C)C(O1)(C)C Amb1033029 [0,1,0,1,0,0|1,0,1]=4 8383 B9R1.44 CC1C[C@]1(N)CC(O)=O Amb25844887 [0,1,0,1,0,0|0,0,0]=2 8384 B9R1.44 C[C@@H]1C[C@@]1(N)CC(O)=O Amb24540980 [0,1,0,1,0,0|0,0,0]=2 8385 B9R1.45 C=C1CC1C(N)C(O)=O Amb24117258 [0,1,0,1,0,0|0,0,2]=4 8386 B9R1.45 CC(=O)C(=O)C1CC1C Amb25775771 [0,1,0,1,0,0|1,0,1]=4 8387 B9R1.45 CC(C)[C@H](O)[C@H]1CC1=C Amb24609983 [0,1,0,1,0,0|2,0,0]=4 8388 B9R1.45 CC(C1CC1C)C(C)=O Amb24529060 [0,1,0,1,0,0|1,0,0]=3 8389 B9R1.45 CC(C1CC1C)C(O)=O Amb25708709 [0,1,0,1,0,0|0,0,0]=2 8390 B9R1.45 CC/1C\C1=C(\Cl)/C(O)=O Amb24340255 [0,1,0,1,0,0|0,0,2]=4 8391 B9R1.45 CC1CC1C(=O)C(O)=O Amb24760671 [0,1,0,1,0,0|0,0,1]=3 8392 B9R1.45 CC1CC1C(N)C(C)=C Amb24478683 [0,1,0,1,0,0|2,0,0]=4 8393 B9R1.45 CC1CC1C(O)C(C)=C Amb25300998 [0,1,0,1,0,0|2,0,0]=4 8394 B9R1.45 NC([C@H]1C[C@@H]1N)C(O)=O Amb25245366 [0,1,0,1,0,0|1,0,0]=3 8395 B9R1.112 C=C(CC1CC1)C(O)=O Amb24700361 [0,1,0,1,0,0|0,0,1]=3 8396 B9R1.112 CC(=C)C(O)CC1CC1 Amb25313698 [0,1,0,1,0,0|2,0,0]=4 8397 B9R1.112 CC(=O)N(C)CC1CC1 Amb25060737 [0,1,0,1,0,0|2,0,0]=4 8398 B9R1.112 CC(C)C(C)CC1CO1 Amb24501686 [0,1,0,1,0,0|1,0,1]=4 8399 B9R1.112 CC(CC1CC1)C(C)=O Amb25188950 [0,1,0,1,0,0|1,0,0]=3 8400 B9R1.112 CC(CC1CC1)C(C)O Amb24429505 [0,1,0,1,0,0|1,0,1]=4 8401 B9R1.112 CC(NC1CC1)C(C)=O Amb25119978 [0,1,0,1,0,0|2,0,0]=4 8402 B9R1.112 CC(SC1CC1)C(O)=O Amb25337757 [0,1,0,1,0,0|1,0,0]=3 8403 B9R1.112 C[C@@H](NC1CC1)C(O)=O Amb24398132 [0,1,0,1,0,0|1,0,0]=3 8404 B9R1.112 NC(CC1CC1)C(N)=O Amb25767604 [0,1,0,1,0,0|1,0,0]=3 8405 B9R1.112 NC(CC1CC1)C(O)=O Amb23399727 [0,1,0,1,0,0|0,0,0]=2 8406 B9R1.112 NC(CC1CO1)C(O)=O Amb25800055 [0,1,0,1,0,0|1,0,0]=3 8407 B9R1.112 N[C@@H](CC1CC1)C(N)=O Amb25317927 [0,1,0,1,0,0|1,0,0]=3 8408 B9R1.112 N[C@@H](CC1CC1)C(O)=O Amb24329024 [0,1,0,1,0,0|0,0,0]=2 8409 B9R1.112 N[C@@H](CC1CO1)C(O)=O Amb25709170 [0,1,0,1,0,0|1,0,0]=3 8410 B9R1.112 N[C@H](CC1CC1)C(N)=O Amb24410138 [0,1,0,1,0,0|1,0,0]=3 8411 B9R1.112 OC(=O)C(=O)CC1CC1 Amb18988329 [0,1,0,1,0,0|0,0,1]=3 8412 B9R1.112 OC(=O)C(Cl)=NC1CC1 Amb25697417 [0,1,0,1,0,0|1,0,1]=4 8413 B9R1.112 OC(=O)C(F)=CC1CC1 Amb25102827 [0,1,0,1,0,0|0,0,2]=4 8414 B9R1.112 OC(=O)C(S)CC1CC1 Amb18296302 [0,1,0,1,0,0|0,0,0]=2 8415 B9R1.112 OC(=O)[C@H](Br)CC1CC1 Amb24480301 [0,1,0,1,0,0|0,0,0]=2 8416 B9R1.112 OC(CC1CC1)C(O)=O Amb25082516 [0,1,0,1,0,0|0,0,0]=2 8417 B9R1.112 O[C@@H](CC1CC1)C(O)=O Amb23401512 [0,1,0,1,0,0|0,0,0]=2 8418 B9R1.137 CC(=C)CC(N)C1CC1 Amb24532851 [0,1,0,1,0,0|2,0,0]=4 8419 B9R1.137 CC(=C)CC(O)C1CC1 Amb24478669 [0,1,0,1,0,0|2,0,0]=4 8420 B9R1.137 CC(=O)CC(O)C1CC1 Amb25274131 [0,1,0,1,0,0|1,0,0]=3 8421 B9R1.137 CC(C)CC(Br)C1CO1 Amb25837477 [0,1,0,1,0,0|1,0,1]=4 8422 B9R1.137 CC(C)C[C@H](O)[C@@H]1CO1 Amb24576918 [0,1,0,1,0,0|1,0,1]=4 8423 B9R1.137 CC(C)C[C@H](O)[C@H]1CO1 Amb24576480 [0,1,0,1,0,0|1,0,1]=4 8424 B9R1.137 CC(CC(C)O)C1CC1 Amb25117501 [0,1,0,1,0,0|1,0,1]=4 8425 B9R1.137 CC(NC(C)=O)C1CC1 Amb25355157 [0,1,0,1,0,0|2,0,0]=4 8426 B9R1.137 CN(CC(N)=O)C1CC1 Amb25342036 [0,1,0,1,0,0|2,0,0]=4 8427 B9R1.137 CS(=O)CC(N)C1CC1 Amb24391211 [0,1,0,1,0,0|2,0,0]=4 8428 B9R1.137 C[C@H](OC(C)=O)C1CC1 Amb25767468 [0,1,0,1,0,0|2,0,0]=4 8429 B9R1.137 C\C(=C/C(=O)O)\C1CC1 Amb10609547 [0,1,0,1,0,0|0,0,2]=4 8430 B9R1.137 C\C(=C\C(=O)O)\C1CC1 Amb10718081 [0,1,0,1,0,0|0,0,2]=4 8431 B9R1.137 NC(CC(N)=O)C1CC1 Amb18988331 [0,1,0,1,0,0|1,0,0]=3 8432 B9R1.137 NC(CC(N)=O)C1CC1 Amb19307935 [0,1,0,1,0,0|1,0,0]=3 8433 B9R1.137 N[C@H](CC(N)=O)C1CC1 Amb25259754 [0,1,0,1,0,0|1,0,0]=3 8434 B9R1.137 N[C@H](CC(O)=O)C1CC1 Amb24349802 [0,1,0,1,0,0|0,0,0]=2 8435 B9R1.137 O=C(C1CC1)CC(=O)O Amb10576272 [0,1,0,1,0,0|0,0,1]=3 8436 B9R1.137 OC(=O)CS(=O)C1CC1 Amb25272361 [0,1,0,1,0,0|1,0,0]=3 8437 B9R1.137 OC(=O)\C=C(\Cl)/C1CC1 Amb25272142 [0,1,0,1,0,0|0,0,2]=4 8438 B9R1.137 OC(C1CC1)CC(=O)O Amb17231863 [0,1,0,1,0,0|0,0,0]=2 8439 B9R1.137 OC(CC(O)=O)C1CO1 Amb25854287 [0,1,0,1,0,0|1,0,0]=3 8440 B9R1.137 O[C@H](CC(O)=O)C1CC1 Amb25367343 [0,1,0,1,0,0|0,0,0]=2 8441 B9R1.137 [O-]C(=O)C[C@@H](O)[C@H]1CO1 Amb25302277 [0,1,0,1,0,0|1,0,1]=4 8442 B9R1.137 [O-][N+](=O)CC(O)C1CC1 Amb22262975 [0,1,0,1,0,0|1,0,1]=4 8443 B9R1.139 CC(=O)C1C(Cl)C1(C)C Amb25685934 [0,1,0,1,0,0|1,0,0]=3 8444 B9R1.139 CC(=O)[C@@H]1[C@@H](Cl)C1(C)C Amb24356148 [0,1,0,1,0,0|1,0,0]=3 8445 B9R1.139 CC(=O)[C@@H]1[C@H](Br)C1(C)C Amb25372498 [0,1,0,1,0,0|1,0,0]=3 8446 B9R1.139 CC(=O)[C@@H]1[C@H](Cl)C1(C)C Amb25696574 [0,1,0,1,0,0|1,0,0]=3 8447 B9R1.139 CC(O)C1C(Br)C1(C)C Amb24399213 [0,1,0,1,0,0|1,0,1]=4 8448 B9R1.139 CC1(C)C(C1=C)C(O)=O Amb25188905 [0,1,0,1,0,0|0,0,1]=3 8449 B9R1.139 CC1(C)C(Cl)C1C(O)=O Amb25772915 [0,1,0,1,0,0|0,0,0]=2 8450 B9R1.139 CC1(C)[C@@H](Br)[C@H]1C(O)=O Amb24593888 [0,1,0,1,0,0|0,0,0]=2 8451 B9R1.139 CC1(C)[C@H](Cl)[C@@H]1C(O)=O Amb24674137 [0,1,0,1,0,0|0,0,0]=2 8452 B9R1.139 CC1=C(C(O)=O)C1(C)C Amb24393001 [0,1,0,1,0,0|0,0,2]=4 8453 B9R1.139 CC1C(C(=O)Cl)C1(C)C Amb25088892 [0,1,0,1,0,0|1,0,0]=3 8454 B9R1.139 CC1C(C(C)=O)C1(C)Cl Amb25701016 [0,1,0,1,0,0|2,0,0]=4 8455 B9R1.139 CC1C(C(C)O)C1(C)C Amb25722239 [0,1,0,1,0,0|1,0,1]=4 8456 B9R1.139 CC1C(C(N)=O)C1(C)C Amb24700436 [0,1,0,1,0,0|1,0,0]=3 8457 B9R1.139 CC1C(C(O)=O)C1(C)C Amb25296484 [0,1,0,1,0,0|0,0,0]=2 8458 B9R1.139 CC1C(C(O)=O)C1(F)F Amb19515667 [0,1,0,1,0,0|2,0,0]=4 8459 B9R1.139 C[C@@H]1[C@@H](C(=O)Cl)C1(C)C Amb24691335 [0,1,0,1,0,0|1,0,0]=3 8460 B9R1.139 C[C@@H]1[C@@H](C(C)=O)[C@]1(C)Cl Amb24577773 [0,1,0,1,0,0|2,0,0]=4 8461 B9R1.139 C[C@@H]1[C@H](C(C)O)C1(C)C Amb24515422 [0,1,0,1,0,0|1,0,1]=4 8462 B9R1.139 C[C@H]1[C@H](C(O)=O)C1(Cl)Cl Amb25275824 [0,1,0,1,0,0|2,0,0]=4 8463 B9R1.152 CC(=O)[C@]1(C)CC(=O)O1 Amb24340260 [0,1,0,1,0,0|1,0,1]=4 8464 B9R1.152 CC(Cl)C1(C)CC(=O)O1 Amb25701611 [0,1,0,1,0,0|1,0,0]=3 8465 B9R1.152 CC1(CC(=O)C1)C(O)=O Amb22406208 [0,1,0,1,0,0|1,0,1]=4 8466 B9R1.152 CC1CC(C)(C1)C(O)=O Amb23448860 [0,1,0,1,0,0|0,0,0]=2 8467 B9R1.152 CC1CC(N)(C1)C(O)=O Amb25821754 [0,1,0,1,0,0|0,0,0]=2 8468 B9R1.152 CC1CC(O)(C1)C(N)=O Amb25314653 [0,1,0,1,0,0|1,0,0]=3 8469 B9R1.152 CC1CC(O)(C1)C(O)=O Amb24522784 [0,1,0,1,0,0|0,0,0]=2 8470 B9R1.152 C[C@@]1(C[C@@H](N)C1)C(O)=O Amb23440223 [0,1,0,1,0,0|1,0,0]=3 8471 B9R1.152 C[C@@]1(C[C@@H](N)C1)C(O)=O Amb24730954 [0,1,0,1,0,0|1,0,0]=3 8472 B9R1.152 C[C@@]1(C[C@H](N)C1)C(O)=O Amb23439475 [0,1,0,1,0,0|1,0,0]=3 8473 B9R1.152 C[C@]1(C[C@@H](N)C1)C(O)=O Amb25275111 [0,1,0,1,0,0|1,0,0]=3 8474 B9R1.152 NC1CC(F)(C1)C(O)=O Amb25784332 [0,1,0,1,0,0|1,0,0]=3 8475 B9R1.152 N[C@@]1(C[C@H](F)C1)C(O)=O Amb22746505 [0,1,0,1,0,0|1,0,0]=3 8476 B9R1.152 N[C@]1(C[C@@H](O)C1)C(O)=O Amb25297893 [0,1,0,1,0,0|1,0,0]=3 8477 B9R1.153 CC1(C)C(N)CS1(=O)=O Amb24705061 [0,1,0,1,0,0|1,0,1]=4 8478 B9R1.153 CC1(C)[C@H](N)CS1(=O)=O Amb25200639 [0,1,0,1,0,0|1,0,1]=4 8479 B9R1.164 CC(=O)C1CC(C)(C)C1 Amb24614703 [0,1,0,1,0,0|1,0,0]=3 8480 B9R1.164 CC(=O)C1CC(C)(O)C1 Amb25773446 [0,1,0,1,0,0|1,0,0]=3 8481 B9R1.164 CC(=O)C1CC(F)(F)C1 Amb24517327 [0,1,0,1,0,0|2,0,0]=4 8482 B9R1.164 CC(=O)N1CC(C)(C)C1 Amb25107425 [0,1,0,1,0,0|2,0,0]=4 8483 B9R1.164 CC(=O)N1CC(C)(N)C1 Amb24616829 [0,1,0,1,0,0|2,0,0]=4 8484 B9R1.164 CC(=O)[C@@H]1C[C@@](C)(O)C1 Amb25320013 [0,1,0,1,0,0|1,0,0]=3 8485 B9R1.164 CC(=O)[C@@H]1C[C@](C)(O)C1 Amb25735730 [0,1,0,1,0,0|1,0,0]=3 8486 B9R1.164 CC(C)C1CS(=O)(=O)O1 Amb24571158 [0,1,0,1,0,0|1,0,0]=3 8487 B9R1.164 CC(O)C1CC(C)(C)C1 Amb24560680 [0,1,0,1,0,0|1,0,1]=4 8488 B9R1.164 CC(O)C1CC(C)(C)O1 Amb25763811 [0,1,0,1,0,0|1,0,1]=4 8489 B9R1.164 CC1(C)CC(=C1)C(O)=O Amb22405981 [0,1,0,1,0,0|0,0,1]=3 8490 B9R1.164 CC1(C)CC(C1)C(=O)Cl Amb22642158 [0,1,0,1,0,0|1,0,0]=3 8491 B9R1.164 CC1(C)CC(C1)C(N)=O Amb22643161 [0,1,0,1,0,0|1,0,0]=3 8492 B9R1.164 CC1(C)CC(N1)C(O)=O Amb24117447 [0,1,0,1,0,0|0,0,0]=2 8493 B9R1.164 CC1(C)CN(C1)C(=O)Cl Amb24702254 [0,1,0,1,0,0|2,0,0]=4 8494 B9R1.164 CC1(Cl)CC(C1)C(=O)Cl Amb25337558 [0,1,0,1,0,0|1,0,0]=3 8495 B9R1.164 CC1(F)CC(C1)C(O)=O Amb23439467 [0,1,0,1,0,0|0,0,0]=2 8496 B9R1.164 CC1(N)CN(C1)C(N)=O Amb24478699 [0,1,0,1,0,0|2,0,0]=4 8497 B9R1.164 CC1(O)CC(C1)C(O)=O Amb19958862 [0,1,0,1,0,0|0,0,0]=2 8498 B9R1.164 C[C@@]1(O)C[C@@H](C1)C(O)=O Amb23440037 [0,1,0,1,0,0|0,0,0]=2 8499 B9R1.164 C[C@@]1(O)C[C@H](C1)C(O)=O Amb23440038 [0,1,0,1,0,0|0,0,0]=2 8500 B9R1.164 C[C@H](O)[C@H]1CC(C)(C)O1 Amb25177045 [0,1,0,1,0,0|1,0,1]=4 8501 B9R1.164 NC(=O)C1CC(F)(F)C1 Amb22896712 [0,1,0,1,0,0|2,0,0]=4 8502 B9R1.169 CC1(C)CC1(C)B(O)O Amb24329484 [0,1,0,1,0,0|1,0,1]=4 8503 B9R1.169 CC1(C)CC1(C)C(N)=O Amb25112463 [0,1,0,1,0,0|1,0,0]=3 8504 B9R1.169 CC1(C)CC1(C)C(O)=O Amb25793545 [0,1,0,1,0,0|0,0,0]=2 8505 B9R1.169 CC1(C)CC1(N)C(N)=O Amb24741207 [0,1,0,1,0,0|1,0,0]=3 8506 B9R1.169 CC1(C)OC1(C)C(=O)Cl Amb24665650 [0,1,0,1,0,0|2,0,0]=4 8507 B9R1.169 CC1(C)OC1(C)C(C)=O Amb25320076 [0,1,0,1,0,0|2,0,0]=4 8508 B9R1.169 CC1(CC1(F)Br)C(O)=O Amb24524180 [0,1,0,1,0,0|2,0,0]=4 8509 B9R1.169 CC1(CC1(F)Cl)C(O)=O Amb24429152 [0,1,0,1,0,0|2,0,0]=4 8510 B9R1.169 C[C@]1(CC1(Cl)Cl)C(O)=O Amb24433910 [0,1,0,1,0,0|2,0,0]=4 8511 B9R1.169 C[C@]1(C[C@@]1(C)Cl)C(C)=O Amb24512617 [0,1,0,1,0,0|2,0,0]=4 8512 B9R1.169 NC1(CC1(F)F)C(O)=O Amb25233043 [0,1,0,1,0,0|2,0,0]=4 8513 B9R1.169 N[C@]1(CC1(F)F)C(O)=O Amb25097067 [0,1,0,1,0,0|2,0,0]=4 8514 B9R1.169 OC(=O)C1(C)CC1(Cl)Cl Amb1885007 [0,1,0,1,0,0|2,0,0]=4 8515 B9R1.169 OC(=O)C1(C)CC1(F)F Amb10606005 [0,1,0,1,0,0|2,0,0]=4 8516 B9R1.169 OC(=O)C1(Cl)CC1(Cl)Cl Amb24480037 [0,1,0,1,0,0|2,0,0]=4 8517 B9R1.47 CC1CC1CS(=O)(=O)Cl Amb25709771 [0,1,0,1,0,0|1,0,1]=4 8518 B9R1.47 CC1CC1CS(N)(=O)=O Amb25342147 [0,1,0,1,0,0|1,0,1]=4 8519 B9R1.51 CC(C)(C)C1CC(=O)C1 Amb24099390 [0,1,0,1,0,0|1,0,0]=3 8520 B9R1.51 CC(C)(C)C=1CC(=O)C1 Amb24643721 [0,1,0,1,0,0|1,0,1]=4 8521 B9R1.51 CC1CC(C1)S(N)(=O)=O Amb25850805 [0,1,0,1,0,0|1,0,1]=4 8522 B9R1.51 C[Si](C)(C)C1CC(=O)N1 Amb24572753 [0,1,0,1,0,0|1,1,0]=4 8523 B9R1.51 NC1CC(C1)P(O)(O)=O Amb25328470 [0,1,0,1,0,0|2,0,0]=4 8524 B9R1.51 O=C1C[C@@H](O1)C(Cl)(Cl)Cl Amb22350593 [0,1,0,1,0,0|2,0,0]=4 8525 B9R1.115 CC(C)(O)CCC1CC1 Amb25777764 [0,1,0,1,0,0|1,0,1]=4 8526 B9R1.115 NS(=O)(=O)CCC1CC1 Amb24478680 [0,1,0,1,0,0|1,0,1]=4 8527 B9R1.115 O=S(=O)(Br)CCC1CC1 Amb25042976 [0,1,0,1,0,0|1,0,1]=4 8528 B9R1.115 O=S(=O)(Cl)CCC1CC1 Amb22059472 [0,1,0,1,0,0|1,0,1]=4 8529 B9R1.115 OS(=O)(=O)NCC1CC1 Amb24068796 [0,1,0,1,0,0|2,0,0]=4 8530 B9R1.146 CC1(Br)CCS(=O)(=O)C1 Amb2548450 [0,1,0,1,0,0|1,0,1]=4 8531 B9R1.146 CC1(C)CCC(C)(O)C1 Amb25103316 [0,1,0,1,0,0|1,0,1]=4 8532 B9R1.146 CC1(C)CCS(=O)(=O)N1 Amb25225572 [0,1,0,1,0,0|1,0,1]=4 8533 B9R1.146 CC1(N)CCS(=O)(=O)C1 Amb1152696 [0,1,0,1,0,0|1,0,1]=4 8534 B9R1.146 CC1(N)CCS(=O)(=O)C1 Amb17913039 [0,1,0,1,0,0|1,0,1]=4 8535 B9R1.146 C[C@]1(N)CS(=O)(=O)CC1 Amb24745885 [0,1,0,1,0,0|1,0,1]=4 8536 B9R1.146 [O-][S+]1(=O)CCC(C1)(C)[NH3+] Amb10236889 [0,1,0,1,0,0|1,0,1]=4 8537 B9R2.19 O=C1C=C[C@H]2C[C@@H]1C2 Amb24691695 [0,0,0,2,0,0|1,0,1]=4 8538 B9R2.19 O=C1CCC2CC1C2 Amb22499413 [0,0,0,2,0,0|1,0,0]=3 8539 B9R2.19 O=C1CCC2CC1O2 Amb22364973 [0,0,0,2,0,0|2,0,0]=4 8540 B9R2.19 O=C1CC[C@H]2C[C@@H]1C2 Amb25128839 [0,0,0,2,0,0|1,0,0]=3 8541 B9R2.19 O=C1NCC2CC1C2 Amb25221783 [0,0,0,2,0,0|1,0,0]=3 8542 B9R2.21 CC1CCC2C(C1)O2 Amb1141335 [0,0,0,2,0,0|1,0,1]=4 8543 B9R2.21 O=C1CC2OC2CC1 Amb24408509 [0,0,0,2,0,0|2,0,0]=4 8544 B9R2.21 O=C1C[C@@H]2C[C@H]2CC1 Amb25294409 [0,0,0,2,0,0|1,0,0]=3 8545 B9R2.21 O=C1N[C@H]2C[C@H]2CO1 Amb24630201 [0,0,0,2,0,0|1,0,0]=3 8546 B9R2.21 OC1CC2CC2CC1 Amb25169523 [0,0,0,2,0,0|1,0,1]=4 8547 B9R2.21 OC1C[C@@H]2C[C@H]2CC1 Amb25307522 [0,0,0,2,0,0|1,0,1]=4 8548 B9R2.21 O[C@@H]1C[C@H]2C[C@H]2CC1 Amb25288224 [0,0,0,2,0,0|1,0,1]=4 8549 B9R2.21 O[C@H]1C[C@@H]2C[C@@H]2CC1 Amb25024733 [0,0,0,2,0,0|1,0,1]=4 8550 B9R2.21 O[C@H]1C[C@H]2C[C@H]2CC1 Amb24556801 [0,0,0,2,0,0|1,0,1]=4 8551 B9R2.40 CC12CC1C(=O)CC2 Amb25723296 [0,0,0,2,0,0|1,0,0]=3 8552 B9R2.40 CC12CNC(=O)C1C2 Amb24481580 [0,0,0,2,0,0|1,0,0]=3 8553 B9R2.40 C[C@]12C[C@H]1[C@@H](O)CC2 Amb25324967 [0,0,0,2,0,0|1,0,1]=4 8554 B9R2.54 CC1C2CC(O)CC21 Amb24705654 [0,0,0,2,0,0|1,0,1]=4 8555 B9R2.54 C[C@@H]1[C@@H]2CC(=O)C[C@@H]21 Amb24602923 [0,0,0,2,0,0|1,0,0]=3 8556 B9R2.54 C[C@@H]1[C@H]2CC(=O)C[C@H]21 Amb24645439 [0,0,0,2,0,0|1,0,0]=3 8557 B9R2.110 OC12CC(CC1)CC2 Amb22235809 [0,0,0,2,0,0|1,0,1]=4 8558 B9R2.38 CC12CC1CC(=O)C2 Amb24357249 [0,0,0,2,0,0|1,0,0]=3 8559 B9R2.150 CC(=O)[C@@H]1C[C@@H]2C[C@@H]21 Amb25179150 [0,0,0,2,0,0|1,0,0]=3 8560 B9R2.150 OC(=O)C1CC2CC21 Amb25049722 [0,0,0,2,0,0|0,0,0]=2 8561 B9R2.150 OC(=O)C1NC2CC12 Amb25376606 [0,0,0,2,0,0|1,0,0]=3 8562 B9R2.41 O=C1CC(C1)C2CC2 Amb25370879 [0,0,0,2,0,0|1,0,0]=3 8563 B9R2.41 OC1CC(C1)C2CC2 Amb24679999 [0,0,0,2,0,0|1,0,1]=4 8564 B9R2.133 C[C@]12C[C@H](C1)C(=O)C2 Amb25271021 [0,0,0,2,0,0|1,0,0]=3 8565 B9R2.145 CC(=O)C12CC(C1)C2 Amb25093716 [0,0,0,2,0,0|1,0,0]=3 8566 B9R2.145 NC(=O)C12CC(C1)C2 Amb24058180 [0,0,0,2,0,0|1,0,0]=3 8567 B9R2.145 OC(=O)C12CC(C1)C2 Amb22493631 [0,0,0,2,0,0|0,0,0]=2 8568 B9R2.120 CC1(C)CCC2OC12 Amb24524271 [0,0,0,2,0,0|1,0,1]=4 8569 B9R2.120 CC1(O)CCC2CC12 Amb25696393 [0,0,0,2,0,0|1,0,1]=4 8570 B9R2.139 C=C1CC2(CC1)CC2 Amb24483142 [0,0,0,2,0,0|2,0,0]=4 8571 B9R2.139 CC1CC2(CO2)CC1 Amb25678922 [0,0,0,2,0,0|1,0,1]=4 8572 B9R2.139 O=C1CC2(CO1)CC2 Amb25662215 [0,0,0,2,0,0|2,0,0]=4 8573 B9R2.139 O=C1CCC2(N1)CC2 Amb16186647 [0,0,0,2,0,0|1,0,0]=3 8574 B9R2.139 O=C1NC2(CN1)CC2 Amb24482030 [0,0,0,2,0,0|2,0,0]=4 8575 B9R2.139 O=C1NC2(CO1)CC2 Amb24572471 [0,0,0,2,0,0|2,0,0]=4 8576 B9R2.139 O=C1NCC2(CC2)O1 Amb25789822 [0,0,0,2,0,0|1,0,0]=3 8577 B9R2.143 CC(=O)C1CC12CC2 Amb24725286 [0,0,0,2,0,0|1,0,0]=3 8578 B9R2.143 C[C@@H](O)[C@@H]1CC12CC2 Amb25345029 [0,0,0,2,0,0|1,0,1]=4 8579 B9R2.143 C[C@H](O)[C@@H]1CC12CC2 Amb25266779 [0,0,0,2,0,0|1,0,1]=4 8580 B5R0.5 C(=O)([2H])N(C)C Amb16185565 [0,0,0,0,2,0|2,0,0]=4 8581 B5R0.5 CC(=C)C(O)=O Amb22230681 [0,0,0,0,2,0|0,0,2]=4 8582 B5R0.5 CC(=C)C(O)=O Amb22337777 [0,0,0,0,2,0|0,0,2]=4 8583 B5R0.5 CC(=C)C(O)=O Amb22351305 [0,0,0,0,2,0|0,0,2]=4 8584 B5R0.5 CC(=C)C(O)=O Amb22351871 [0,0,0,0,2,0|0,0,2]=4 8585 B5R0.5 CC(=C)C(O)=O Amb22351927 [0,0,0,0,2,0|0,0,2]=4 8586 B5R0.5 CC(=O)C(F)C Amb10841897 [0,0,0,0,2,0|2,0,0]=4 8587 B5R0.5 CC(=O)C(N)C Amb17593029 [0,0,0,0,2,0|2,0,0]=4 8588 B5R0.5 CC(Br)C(N)=O Amb22491874 [0,0,0,0,2,0|2,0,0]=4 8589 B5R0.5 CC(Br)[13C](O)=O Amb22351913 [0,0,0,0,2,0|1,0,0]=3 8590 B5R0.5 CC(C(=O)N)C Amb1153145 [0,0,0,0,2,0|1,0,0]=3 8591 B5R0.5 CC(C(=O)N)Cl Amb1151918 [0,0,0,0,2,0|2,0,0]=4 8592 B5R0.5 CC(C(=O)O)F Amb10605770 [0,0,0,0,2,0|1,0,0]=3 8593 B5R0.5 CC(C)C(=C)Br Amb22583736 [0,0,0,0,2,0|2,0,0]=4 8594 B5R0.5 CC(C)C(=O)Br Amb22731066 [0,0,0,0,2,0|1,0,0]=3 8595 B5R0.5 CC(C)C(=O)F Amb25848493 [0,0,0,0,2,0|1,0,0]=3 8596 B5R0.5 CC(C)C(O)O Amb25662421 [0,0,0,0,2,0|0,0,2]=4 8597 B5R0.5 CC(C)C(S)=S Amb25200225 [0,0,0,0,2,0|0,2,0]=4 8598 B5R0.5 CC(C)C([O-])=O Amb22045473 [0,0,0,0,2,0|0,0,1]=3 8599 B5R0.5 CC(C)C([O-])=O Amb22730398 [0,0,0,0,2,0|0,0,1]=3 8600 B5R0.5 CC(C)C([O-])=O Amb22734686 [0,0,0,0,2,0|0,0,1]=3 8601 B5R0.5 CC(C)S(N)=O Amb25675545 [0,0,0,0,2,0|2,0,0]=4 8602 B5R0.5 CC(C)S([O-])=O Amb19929129 [0,0,0,0,2,0|1,0,1]=4 8603 B5R0.5 CC(Cl)C(=O)Br Amb24602442 [0,0,0,0,2,0|2,0,0]=4 8604 B5R0.5 CC(F)C(=O)Cl Amb24472500 [0,0,0,0,2,0|2,0,0]=4 8605 B5R0.5 CC(I)C(=O)Cl Amb24559615 [0,0,0,0,2,0|2,0,0]=4 8606 B5R0.5 CC(I)C(N)=O Amb25684673 [0,0,0,0,2,0|2,0,0]=4 8607 B5R0.5 CC(N)C(=O)Br Amb25184851 [0,0,0,0,2,0|2,0,0]=4 8608 B5R0.5 CC(N)C(C)=O Amb19148817 [0,0,0,0,2,0|2,0,0]=4 8609 B5R0.5 CC(N)C(N)=O Amb21958673 [0,0,0,0,2,0|2,0,0]=4 8610 B5R0.5 CC(N)P(O)=O Amb25147710 [0,0,0,0,2,0|2,0,0]=4 8611 B5R0.5 CC(N)[13C](O)=O Amb22336671 [0,0,0,0,2,0|1,0,0]=3 8612 B5R0.5 CC(O)C(=O)Cl Amb25045690 [0,0,0,0,2,0|2,0,0]=4 8613 B5R0.5 CC(O)C(O)=O Amb22350027 [0,0,0,0,2,0|1,0,0]=3 8614 B5R0.5 CC(O)C([O-])=O Amb17942960 [0,0,0,0,2,0|1,0,1]=4 8615 B5R0.5 CC(O)C([O-])=O Amb17943079 [0,0,0,0,2,0|1,0,1]=4 8616 B5R0.5 CC(O)C([O-])=O Amb20246816 [0,0,0,0,2,0|1,0,1]=4 8617 B5R0.5 CC(O)C([O-])=O Amb21936112 [0,0,0,0,2,0|1,0,1]=4 8618 B5R0.5 CC(O)C([O-])=O Amb22002445 [0,0,0,0,2,0|1,0,1]=4 8619 B5R0.5 CC(O)C([O-])=O Amb22054134 [0,0,0,0,2,0|1,0,1]=4 8620 B5R0.5 CC(O)C([O-])=O Amb22055552 [0,0,0,0,2,0|1,0,1]=4 8621 B5R0.5 CC(O)C([O-])=O Amb22167842 [0,0,0,0,2,0|1,0,1]=4 8622 B5R0.5 CC(O)C([O-])=O Amb22350448 [0,0,0,0,2,0|1,0,1]=4 8623 B5R0.5 CC(O)C([O-])=O Amb22730128 [0,0,0,0,2,0|1,0,1]=4 8624 B5R0.5 CC(O)C([O-])=O Amb22730326 [0,0,0,0,2,0|1,0,1]=4 8625 B5R0.5 CC(O)C([O-])=O Amb22731947 [0,0,0,0,2,0|1,0,1]=4 8626 B5R0.5 CC(O)C([O-])=O Amb22732237 [0,0,0,0,2,0|1,0,1]=4 8627 B5R0.5 CC(O)C([O-])=O Amb22732420 [0,0,0,0,2,0|1,0,1]=4 8628 B5R0.5 CC(O)C([O-])=O Amb22732487 [0,0,0,0,2,0|1,0,1]=4 8629 B5R0.5 CC(O)C([O-])=O Amb22732889 [0,0,0,0,2,0|1,0,1]=4 8630 B5R0.5 CC(O)C([O-])=O Amb22733874 [0,0,0,0,2,0|1,0,1]=4 8631 B5R0.5 CC(O)C([O-])=O Amb22733995 [0,0,0,0,2,0|1,0,1]=4 8632 B5R0.5 CC(O)P(O)=O Amb24333635 [0,0,0,0,2,0|2,0,0]=4 8633 B5R0.5 CC(O)[14C]([O-])=O Amb22362798 [0,0,0,0,2,0|1,0,1]=4 8634 B5R0.5 CC(P)C(N)=O Amb24715877 [0,0,0,0,2,0|2,0,0]=4 8635 B5R0.5 CC([15NH2])C(O)=O Amb22353286 [0,0,0,0,2,0|1,0,0]=3 8636 B5R0.5 CC([O-])C([O-])=O Amb22045882 [0,0,0,0,2,0|1,0,1]=4 8637 B5R0.5 CN(C)C(=O)F Amb24660451 [0,0,0,0,2,0|2,0,0]=4 8638 B5R0.5 CN(C)C(C)=O Amb24323347 [0,0,0,0,2,0|2,0,0]=4 8639 B5R0.5 CN(C)C(N)=O Amb22739731 [0,0,0,0,2,0|2,0,0]=4 8640 B5R0.5 CN(C)C(O)=O Amb22348477 [0,0,0,0,2,0|1,0,0]=3 8641 B5R0.5 CN(C)C(O)=S Amb24477978 [0,0,0,0,2,0|1,1,0]=4 8642 B5R0.5 CN(C)[13C]([13CH3])=O Amb22367402 [0,0,0,0,2,0|2,0,0]=4 8643 B5R0.5 C[13C@@H]([15NH2])C(O)=O Amb22363357 [0,0,0,0,2,0|1,0,0]=3 8644 B5R0.5 C[13CH](N)C(O)=O Amb22367246 [0,0,0,0,2,0|1,0,0]=3 8645 B5R0.5 C[C@@H](Cl)C(=O)F Amb25811184 [0,0,0,0,2,0|2,0,0]=4 8646 B5R0.5 C[C@@H](F)C(O)=O Amb24376099 [0,0,0,0,2,0|1,0,0]=3 8647 B5R0.5 C[C@@H](N)C(C)=O Amb22748924 [0,0,0,0,2,0|2,0,0]=4 8648 B5R0.5 C[C@@H](N)C(C)=O Amb22748925 [0,0,0,0,2,0|2,0,0]=4 8649 B5R0.5 C[C@@H](N)C(N)=O Amb22746786 [0,0,0,0,2,0|2,0,0]=4 8650 B5R0.5 C[C@@H](N)P(O)=O Amb24640370 [0,0,0,0,2,0|2,0,0]=4 8651 B5R0.5 C[C@@H](O)C(C)=O Amb25120774 [0,0,0,0,2,0|2,0,0]=4 8652 B5R0.5 C[C@@H](O)C(O)=O Amb22799466 [0,0,0,0,2,0|1,0,0]=3 8653 B5R0.5 C[C@@H](O)C([O-])=O Amb22350432 [0,0,0,0,2,0|1,0,1]=4 8654 B5R0.5 C[C@@H](O)C([O-])=O Amb22801669 [0,0,0,0,2,0|1,0,1]=4 8655 B5R0.5 C[C@@H](O)P(O)=O Amb25129822 [0,0,0,0,2,0|2,0,0]=4 8656 B5R0.5 C[C@@H](S)C(N)=O Amb25065854 [0,0,0,0,2,0|2,0,0]=4 8657 B5R0.5 C[C@@H]([15NH2])C(O)=O Amb22800337 [0,0,0,0,2,0|1,0,0]=3 8658 B5R0.5 C[C@H](Br)C(=O)Br Amb25780155 [0,0,0,0,2,0|2,0,0]=4 8659 B5R0.5 C[C@H](Br)C(=O)Cl Amb24449131 [0,0,0,0,2,0|2,0,0]=4 8660 B5R0.5 C[C@H](C(C)C)O Amb13952942 [0,0,0,0,2,0|1,0,1]=4 8661 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [0,0,0,0,2,0|2,0,0]=4 8662 B5R0.5 C[C@H](Cl)C(O)=O Amb17776586 [0,0,0,0,2,0|1,0,0]=3 8663 B5R0.5 C[C@H](I)C(O)=O Amb25724908 [0,0,0,0,2,0|1,0,0]=3 8664 B5R0.5 C[C@H](N)C(=O)Cl Amb24333765 [0,0,0,0,2,0|2,0,0]=4 8665 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [0,0,0,0,2,0|2,0,0]=4 8666 B5R0.5 C[C@H](N)P(O)=O Amb25101926 [0,0,0,0,2,0|2,0,0]=4 8667 B5R0.5 C[C@H](O)C(C)=O Amb24625154 [0,0,0,0,2,0|2,0,0]=4 8668 B5R0.5 C[C@H](O)C([O-])=O Amb17772234 [0,0,0,0,2,0|1,0,1]=4 8669 B5R0.5 C[C@H](O)C([O-])=O Amb22338062 [0,0,0,0,2,0|1,0,1]=4 8670 B5R0.5 C[C@H](O)C([O-])=O Amb22369005 [0,0,0,0,2,0|1,0,1]=4 8671 B5R0.5 C[C@H](O)[13C]([O-])=O Amb22353664 [0,0,0,0,2,0|1,0,1]=4 8672 B5R0.5 C[C@H](S)C(O)=O Amb25147510 [0,0,0,0,2,0|1,0,0]=3 8673 B5R0.5 C[C@H]([15NH2])C(O)=O Amb22351686 [0,0,0,0,2,0|1,0,0]=3 8674 B5R0.5 FC(C(=O)O)F Amb1953492 [0,0,0,0,2,0|2,0,0]=4 8675 B5R0.5 IC(C(=O)O)I Amb17612865 [0,0,0,0,2,0|2,0,0]=4 8676 B5R0.5 NC(=O)C(N)C Amb1156937 [0,0,0,0,2,0|2,0,0]=4 8677 B5R0.5 NC(=O)[C@@H](N)C Amb2371522 [0,0,0,0,2,0|2,0,0]=4 8678 B5R0.5 NC(=O)[C@H](N)C Amb2371905 [0,0,0,0,2,0|2,0,0]=4 8679 B5R0.5 NC(Br)C(O)=O Amb25724348 [0,0,0,0,2,0|2,0,0]=4 8680 B5R0.5 NC(O)C(O)=O Amb24663706 [0,0,0,0,2,0|2,0,0]=4 8681 B5R0.5 N[C@H](S)C(O)=O Amb25289119 [0,0,0,0,2,0|2,0,0]=4 8682 B5R0.5 OB(C(C)C)O Amb2447044 [0,0,0,0,2,0|1,0,1]=4 8683 B5R0.5 OC(=O)C(Br)F Amb10841090 [0,0,0,0,2,0|2,0,0]=4 8684 B5R0.5 OC(=O)C(Cl)Br Amb22002468 [0,0,0,0,2,0|2,0,0]=4 8685 B5R0.5 OC(=O)C(Cl)Cl Amb22338543 [0,0,0,0,2,0|2,0,0]=4 8686 B5R0.5 OC(=O)C(Cl)F Amb10838714 [0,0,0,0,2,0|2,0,0]=4 8687 B5R0.5 OC(=O)C(F)S Amb25272480 [0,0,0,0,2,0|2,0,0]=4 8688 B5R0.5 OC(=O)C(I)Br Amb17610018 [0,0,0,0,2,0|2,0,0]=4 8689 B5R0.5 OC(=O)C(I)Cl Amb17610937 [0,0,0,0,2,0|2,0,0]=4 8690 B5R0.5 OC(=O)C(I)F Amb10838458 [0,0,0,0,2,0|2,0,0]=4 8691 B5R0.5 OC(=O)[13CH](Cl)Cl Amb22336527 [0,0,0,0,2,0|2,0,0]=4 8692 B5R0.5 OC(=O)[C@@H](F)Br Amb25147695 [0,0,0,0,2,0|2,0,0]=4 8693 B5R0.5 OC(=O)[C@H](Cl)Br Amb25857711 [0,0,0,0,2,0|2,0,0]=4 8694 B5R0.5 OC(=O)[C@H](F)I Amb24561039 [0,0,0,0,2,0|2,0,0]=4 8695 B5R0.5 O[13C](=O)C(Br)Br Amb22367565 [0,0,0,0,2,0|2,0,0]=4 8696 B5R0.5 O[13C](=O)C(Cl)Br Amb22367326 [0,0,0,0,2,0|2,0,0]=4 8697 B5R0.5 [12CH3][12C@H](N)[12C](O)=O Amb22367004 [0,0,0,0,2,0|1,0,0]=3 8698 B5R0.5 [13CH3]C(N)C(O)=O Amb22351250 [0,0,0,0,2,0|1,0,0]=3 8699 B5R0.5 [13CH3][13CH](N)C(O)=O Amb22338584 [0,0,0,0,2,0|1,0,0]=3 8700 B5R0.5 [13CH3][13CH](N)[13C](O)=O Amb22353501 [0,0,0,0,2,0|1,0,0]=3 8701 B5R0.5 [13CH3][C@@H](O)C([O-])=O Amb22350379 [0,0,0,0,2,0|1,0,1]=4 8702 B9R0.55 CC(=C)CCOCC(O)=O Amb18644114 [0,0,0,0,0,2|0,0,2]=4 8703 B9R0.55 CC(=C)\C=C\CCC(O)=O Amb24565556 [0,0,0,0,0,2|0,0,2]=4 8704 B9R0.55 CC(=O)CCSCC(O)=O Amb24443138 [0,0,0,0,0,2|1,0,1]=4 8705 B9R0.55 CC(=O)CC\C=C\C(=O)O Amb17593589 [0,0,0,0,0,2|1,0,1]=4 8706 B9R0.55 CC(=O)CC\C=N\N(C)C Amb25320156 [0,0,0,0,0,2|2,0,0]=4 8707 B9R0.55 CC(=O)NCCNN(C)C Amb25720722 [0,0,0,0,0,2|2,0,0]=4 8708 B9R0.55 CC(=O)NNCCN(C)C Amb24073114 [0,0,0,0,0,2|2,0,0]=4 8709 B9R0.55 CC(=O)OCCCC(O)=O Amb24480808 [0,0,0,0,0,2|1,0,1]=4 8710 B9R0.55 CC(=O)OCCCN(C)C Amb24541474 [0,0,0,0,0,2|2,0,0]=4 8711 B9R0.55 CC(=O)SCCCN(C)C Amb25288482 [0,0,0,0,0,2|2,0,0]=4 8712 B9R0.55 CC(Br)=CCCCC(O)=O Amb25289201 [0,0,0,0,0,2|1,0,1]=4 8713 B9R0.55 CC(Br)CCCCC(O)=O Amb25309392 [0,0,0,0,0,2|1,0,0]=3 8714 B9R0.55 CC(Br)CCCNC(C)=O Amb25784406 [0,0,0,0,0,2|2,0,0]=4 8715 B9R0.55 CC(C)=C=CCCC(O)=O Amb25758070 [0,0,0,0,0,2|0,0,1]=3 8716 B9R0.55 CC(C)=CCCCC(O)=O Amb18643939 [0,0,0,0,0,2|0,0,1]=3 8717 B9R0.55 CC(C)=CCOCC(O)=O Amb18644115 [0,0,0,0,0,2|0,0,1]=3 8718 B9R0.55 CC(C)=COCCC(C)=O Amb25718461 [0,0,0,0,0,2|1,0,1]=4 8719 B9R0.55 CC(C)C#C\C=C\C(O)=O Amb24622479 [0,0,0,0,0,2|0,0,2]=4 8720 B9R0.55 CC(C)C=NNCC(N)=O Amb24751806 [0,0,0,0,0,2|1,0,1]=4 8721 B9R0.55 CC(C)C=NOCC(O)=O Amb24456702 [0,0,0,0,0,2|0,0,1]=3 8722 B9R0.55 CC(C)CC=C=CC(O)=O Amb25063138 [0,0,0,0,0,2|0,0,1]=3 8723 B9R0.55 CC(C)CC=NNC(N)=O Amb24482913 [0,0,0,0,0,2|1,0,1]=4 8724 B9R0.55 CC(C)CCCCC(=O)Cl Amb25067489 [0,0,0,0,0,2|1,0,0]=3 8725 B9R0.55 CC(C)CCCCC(C)O Amb24334713 [0,0,0,0,0,2|1,0,1]=4 8726 B9R0.55 CC(C)CCCCC([O-])=O Amb22732968 [0,0,0,0,0,2|0,0,1]=3 8727 B9R0.55 CC(C)CCCNC(C)=O Amb25756283 [0,0,0,0,0,2|1,0,0]=3 8728 B9R0.55 CC(C)CCCNC(N)=S Amb18788022 [0,0,0,0,0,2|1,1,0]=4 8729 B9R0.55 CC(C)CCCNC(S)=S Amb25238686 [0,0,0,0,0,2|0,2,0]=4 8730 B9R0.55 CC(C)CCCOC(C)=O Amb24401009 [0,0,0,0,0,2|1,0,0]=3 8731 B9R0.55 CC(C)CCNCC(=C)Br Amb25079702 [0,0,0,0,0,2|2,0,0]=4 8732 B9R0.55 CC(C)CCNCC(=C)Cl Amb18800600 [0,0,0,0,0,2|2,0,0]=4 8733 B9R0.55 CC(C)CCNC[C@H](C)O Amb25125982 [0,0,0,0,0,2|1,0,1]=4 8734 B9R0.55 CC(C)CCOCC(=C)Br Amb25829671 [0,0,0,0,0,2|2,0,0]=4 8735 B9R0.55 CC(C)CCOCC(C)O Amb24478035 [0,0,0,0,0,2|1,0,1]=4 8736 B9R0.55 CC(C)CCOCC(N)=O Amb25055946 [0,0,0,0,0,2|1,0,0]=3 8737 B9R0.55 CC(C)CCOC[C@H](C)O Amb25295154 [0,0,0,0,0,2|1,0,1]=4 8738 B9R0.55 CC(C)CCONC(C)=O Amb25822328 [0,0,0,0,0,2|1,0,0]=3 8739 B9R0.55 CC(C)CCSCC(=C)Cl Amb25130313 [0,0,0,0,0,2|2,0,0]=4 8740 B9R0.55 CC(C)CC\C=C\B(O)O Amb22168996 [0,0,0,0,0,2|1,0,1]=4 8741 B9R0.55 CC(C)CC\C=C\C(C)=O Amb25111718 [0,0,0,0,0,2|1,0,0]=3 8742 B9R0.55 CC(C)CNCCC(C)=C Amb24477971 [0,0,0,0,0,2|2,0,0]=4 8743 B9R0.55 CC(C)CNCCC(N)=N Amb25088996 [0,0,0,0,0,2|2,0,0]=4 8744 B9R0.55 CC(C)CNCCS(C)=O Amb24717669 [0,0,0,0,0,2|2,0,0]=4 8745 B9R0.55 CC(C)CNCC[C@H](C)O Amb25730715 [0,0,0,0,0,2|1,0,1]=4 8746 B9R0.55 CC(C)CNOCC(C)=O Amb24478134 [0,0,0,0,0,2|1,0,0]=3 8747 B9R0.55 CC(C)CNOCC(N)=O Amb24667538 [0,0,0,0,0,2|1,0,0]=3 8748 B9R0.55 CC(C)COCCC(C)O Amb24478037 [0,0,0,0,0,2|1,0,1]=4 8749 B9R0.55 CC(C)CONCC(=C)Cl Amb25736129 [0,0,0,0,0,2|2,0,0]=4 8750 B9R0.55 CC(C)CONCC(O)=O Amb24740299 [0,0,0,0,0,2|0,0,0]=2 8751 B9R0.55 CC(C)CO\C=C\C(C)=O Amb24569665 [0,0,0,0,0,2|1,0,1]=4 8752 B9R0.55 CC(C)CO\C=C\C(O)=O Amb18644129 [0,0,0,0,0,2|0,0,1]=3 8753 B9R0.55 CC(C)CSCC=C(C)C Amb25235968 [0,0,0,0,0,2|2,0,0]=4 8754 B9R0.55 CC(C)CSCCC(C)=C Amb24660945 [0,0,0,0,0,2|2,0,0]=4 8755 B9R0.55 CC(C)CSCCC(C)O Amb25353802 [0,0,0,0,0,2|1,0,1]=4 8756 B9R0.55 CC(C)CSCCC(N)=O Amb18798041 [0,0,0,0,0,2|1,0,0]=3 8757 B9R0.55 CC(C)CSCC[N+]([O-])=O Amb25256909 [0,0,0,0,0,2|1,0,1]=4 8758 B9R0.55 CC(C)C\C=C\CC(O)=O Amb24681011 [0,0,0,0,0,2|0,0,0]=2 8759 B9R0.55 CC(C)C\C=N\NC(N)=O Amb25063241 [0,0,0,0,0,2|1,0,1]=4 8760 B9R0.55 CC(C)NCCC=C(C)C Amb19025197 [0,0,0,0,0,2|2,0,0]=4 8761 B9R0.55 CC(C)NCCCC(C)O Amb24478897 [0,0,0,0,0,2|1,0,1]=4 8762 B9R0.55 CC(C)NCCCC(N)=O Amb25138205 [0,0,0,0,0,2|1,0,0]=3 8763 B9R0.55 CC(C)NCCCS(C)=O Amb25236669 [0,0,0,0,0,2|2,0,0]=4 8764 B9R0.55 CC(C)NCCNC(N)=O Amb19026215 [0,0,0,0,0,2|1,0,0]=3 8765 B9R0.55 CC(C)NCCNS(C)=O Amb24588854 [0,0,0,0,0,2|2,0,0]=4 8766 B9R0.55 CC(C)OCCCC(C)O Amb24450979 [0,0,0,0,0,2|1,0,1]=4 8767 B9R0.55 CC(C)OCCCC(N)=O Amb25221235 [0,0,0,0,0,2|1,0,0]=3 8768 B9R0.55 CC(C)OCCNC(C)=N Amb25064986 [0,0,0,0,0,2|2,0,0]=4 8769 B9R0.55 CC(C)OCCNC(C)=O Amb25719823 [0,0,0,0,0,2|1,0,0]=3 8770 B9R0.55 CC(C)OCCNC(N)=O Amb24432984 [0,0,0,0,0,2|1,0,0]=3 8771 B9R0.55 CC(C)OCCOC(=O)Cl Amb24465716 [0,0,0,0,0,2|1,0,0]=3 8772 B9R0.55 CC(C)OCCOC(C)=O Amb25662885 [0,0,0,0,0,2|1,0,0]=3 8773 B9R0.55 CC(C)OCCOC(N)=O Amb24436664 [0,0,0,0,0,2|1,0,0]=3 8774 B9R0.55 CC(C)OCCSC(N)=N Amb24731474 [0,0,0,0,0,2|2,0,0]=4 8775 B9R0.55 CC(C)OC\C=C\C(O)=O Amb18308396 [0,0,0,0,0,2|0,0,1]=3 8776 B9R0.55 CC(C)ONCCC(O)=O Amb24619964 [0,0,0,0,0,2|0,0,0]=2 8777 B9R0.55 CC(C)SCCCC(C)=O Amb18792293 [0,0,0,0,0,2|1,0,0]=3 8778 B9R0.55 CC(C)SCCCC(N)=N Amb18792297 [0,0,0,0,0,2|2,0,0]=4 8779 B9R0.55 CC(C)SCCNC(C)=O Amb25306690 [0,0,0,0,0,2|1,0,0]=3 8780 B9R0.55 CC(C)SCCNC(N)=N Amb25221585 [0,0,0,0,0,2|2,0,0]=4 8781 B9R0.55 CC(C)SCCNC(N)=S Amb25356677 [0,0,0,0,0,2|1,1,0]=4 8782 B9R0.55 CC(C)SCCOC(C)=O Amb24482200 [0,0,0,0,0,2|1,0,0]=3 8783 B9R0.55 CC(C)SCCSC(N)=N Amb24734504 [0,0,0,0,0,2|2,0,0]=4 8784 B9R0.55 CC(C)SC\C=C\C(O)=O Amb19020662 [0,0,0,0,0,2|0,0,1]=3 8785 B9R0.55 CC(C)\C=C\C=C\C(O)=O Amb25367977 [0,0,0,0,0,2|0,0,2]=4 8786 B9R0.55 CC(C)\C=C\CCC(O)=O Amb25082805 [0,0,0,0,0,2|0,0,0]=2 8787 B9R0.55 CC(C)\C=C\OCC(C)=O Amb24736419 [0,0,0,0,0,2|1,0,1]=4 8788 B9R0.55 CC(CCCCC(=O)O)C Amb10576144 [0,0,0,0,0,2|0,0,0]=2 8789 B9R0.55 CC(CCNCC(=C)C)C Amb17317917 [0,0,0,0,0,2|2,0,0]=4 8790 B9R0.55 CC(CCNCC(=O)N)C Amb1112311 [0,0,0,0,0,2|1,0,0]=3 8791 B9R0.55 CC(CCNCC(=O)O)C Amb1111021 [0,0,0,0,0,2|0,0,0]=2 8792 B9R0.55 CC(CCSCC(=O)O)C Amb1137397 [0,0,0,0,0,2|0,0,0]=2 8793 B9R0.55 CC(CC\C=C\C(=O)O)C Amb17593603 [0,0,0,0,0,2|0,0,0]=2 8794 B9R0.55 CC(CNCCC(=O)O)C Amb10609230 [0,0,0,0,0,2|0,0,0]=2 8795 B9R0.55 CC(CNCCC(=O)O)C Amb2372367 [0,0,0,0,0,2|0,0,0]=2 8796 B9R0.55 CC(CNCCC(=S)N)C Amb17232337 [0,0,0,0,0,2|1,1,0]=4 8797 B9R0.55 CC(CSCCC(=S)N)C Amb17503256 [0,0,0,0,0,2|1,1,0]=4 8798 B9R0.55 CC(Cl)=CCSCC(O)=O Amb25295452 [0,0,0,0,0,2|1,0,1]=4 8799 B9R0.55 CC(Cl)CCCCC(=O)Cl Amb24633993 [0,0,0,0,0,2|2,0,0]=4 8800 B9R0.55 CC(Cl)CCCCC(O)=O Amb18646185 [0,0,0,0,0,2|1,0,0]=3 8801 B9R0.55 CC(Cl)CCCNC(C)=O Amb25275384 [0,0,0,0,0,2|2,0,0]=4 8802 B9R0.55 CC(F)CCCCC(C)=O Amb25145595 [0,0,0,0,0,2|2,0,0]=4 8803 B9R0.55 CC(F)CCONC(C)=O Amb24747985 [0,0,0,0,0,2|2,0,0]=4 8804 B9R0.55 CC(F)CCONC(N)=O Amb25761182 [0,0,0,0,0,2|2,0,0]=4 8805 B9R0.55 CC(F)CCSCC(C)=O Amb25097655 [0,0,0,0,0,2|2,0,0]=4 8806 B9R0.55 CC(F)COCCC(O)=O Amb25268355 [0,0,0,0,0,2|1,0,0]=3 8807 B9R0.55 CC(N)CCCCC(N)=O Amb19515544 [0,0,0,0,0,2|2,0,0]=4 8808 B9R0.55 CC(N)CCCCC(O)=O Amb18644199 [0,0,0,0,0,2|1,0,0]=3 8809 B9R0.55 CC(N)CCCCC(O)=O Amb19515386 [0,0,0,0,0,2|1,0,0]=3 8810 B9R0.55 CC(N)CCCNC(C)=O Amb24481145 [0,0,0,0,0,2|2,0,0]=4 8811 B9R0.55 CC(N)CCCNC(N)=O Amb25136886 [0,0,0,0,0,2|2,0,0]=4 8812 B9R0.55 CC(N)CSCCC(O)=O Amb24435179 [0,0,0,0,0,2|1,0,0]=3 8813 B9R0.55 CC(NCCCC(=O)O)C Amb1111231 [0,0,0,0,0,2|0,0,0]=2 8814 B9R0.55 CC(O)CCCCC(O)=O Amb18644264 [0,0,0,0,0,2|1,0,0]=3 8815 B9R0.55 CC(O)CCNCC(O)=O Amb25369892 [0,0,0,0,0,2|1,0,0]=3 8816 B9R0.55 CC(O)CC\C=C\C(O)=O Amb24680771 [0,0,0,0,0,2|1,0,0]=3 8817 B9R0.55 CC(O)CN\C=C\C(O)=O Amb24479663 [0,0,0,0,0,2|1,0,1]=4 8818 B9R0.55 CC(O)COCCC(O)=O Amb24746704 [0,0,0,0,0,2|1,0,0]=3 8819 B9R0.55 CC(O)CSCCC(O)=O Amb18792572 [0,0,0,0,0,2|1,0,0]=3 8820 B9R0.55 CC(O)\C=C\CCC(O)=O Amb24453133 [0,0,0,0,0,2|1,0,0]=3 8821 B9R0.55 CN(C)CCCCC(N)=O Amb24715012 [0,0,0,0,0,2|2,0,0]=4 8822 B9R0.55 CN(C)CCCCC(O)=O Amb19275569 [0,0,0,0,0,2|1,0,0]=3 8823 B9R0.55 CN(C)CCCOC(=O)Cl Amb25216228 [0,0,0,0,0,2|2,0,0]=4 8824 B9R0.55 CN(C)CCCOC(N)=O Amb24383394 [0,0,0,0,0,2|2,0,0]=4 8825 B9R0.55 CN(C)CCNNC(N)=O Amb25101912 [0,0,0,0,0,2|2,0,0]=4 8826 B9R0.55 CN(C)CCOCC(N)=O Amb25688629 [0,0,0,0,0,2|2,0,0]=4 8827 B9R0.55 CN(C)CCOCC(O)=O Amb20667765 [0,0,0,0,0,2|1,0,0]=3 8828 B9R0.55 CN(C)CCOCC(O)=O Amb22059502 [0,0,0,0,0,2|1,0,0]=3 8829 B9R0.55 CN(C)CCSCC(N)=O Amb21983542 [0,0,0,0,0,2|2,0,0]=4 8830 B9R0.55 CN(C)NC\C=C\C(O)=O Amb24391795 [0,0,0,0,0,2|1,0,1]=4 8831 B9R0.55 CN(C)OCCOC(N)=O Amb24618189 [0,0,0,0,0,2|2,0,0]=4 8832 B9R0.55 CN(CCCNC(=O)N)C Amb1125203 [0,0,0,0,0,2|2,0,0]=4 8833 B9R0.55 CN(CCCNC(=O)N)C Amb13951597 [0,0,0,0,0,2|2,0,0]=4 8834 B9R0.55 CN(CCSCC(=O)O)C Amb1138164 [0,0,0,0,0,2|1,0,0]=3 8835 B9R0.55 CP(=O)CCCCC(O)=O Amb25765822 [0,0,0,0,0,2|2,0,0]=4 8836 B9R0.55 CS(=O)CCCCC(O)=O Amb18788305 [0,0,0,0,0,2|2,0,0]=4 8837 B9R0.55 CS(=O)CCNCC(O)=O Amb24396496 [0,0,0,0,0,2|2,0,0]=4 8838 B9R0.55 CS(=O)CCOCC(O)=O Amb24600087 [0,0,0,0,0,2|2,0,0]=4 8839 B9R0.55 CS(=O)NCCCC(O)=O Amb24753135 [0,0,0,0,0,2|2,0,0]=4 8840 B9R0.55 C[C@@H](O)CCCCC(C)=O Amb25114746 [0,0,0,0,0,2|2,0,0]=4 8841 B9R0.55 C[C@@H](O)CCCCC(O)=O Amb24427549 [0,0,0,0,0,2|1,0,0]=3 8842 B9R0.55 C[C@@H](O)CNCCC(N)=O Amb24447126 [0,0,0,0,0,2|2,0,0]=4 8843 B9R0.55 C[C@H](N)CCCCC(O)=O Amb25229790 [0,0,0,0,0,2|1,0,0]=3 8844 B9R0.55 C[C@H](O)CCCCC(O)=O Amb24671333 [0,0,0,0,0,2|1,0,0]=3 8845 B9R0.55 C[C@H](O)\C=C\CCC(C)=O Amb24722887 [0,0,0,0,0,2|2,0,0]=4 8846 B9R0.55 OC(=O)CCCCC(Cl)Cl Amb24482330 [0,0,0,0,0,2|2,0,0]=4 8847 B9R0.55 OC(=O)CCCSC(C)C Amb17503621 [0,0,0,0,0,2|0,0,0]=2 8848 B9R0.55 OC(=O)CCNCC(F)F Amb18179466 [0,0,0,0,0,2|2,0,0]=4 8849 B9R0.55 OC(=O)CCSCC(F)F Amb18793590 [0,0,0,0,0,2|2,0,0]=4 8850 B9R0.55 OC(=O)CNCCC(F)F Amb24721262 [0,0,0,0,0,2|2,0,0]=4