0 B6R0.4 C#CCCC(=C)C Amb18634222 [0,0,0,0,0,0|2,0,2]=4 1 B6R0.4 C#CCCC(=O)Cl Amb26949181 [0,0,0,0,0,0|1,0,2]=3 2 B6R0.4 C#CCCC(=O)O Amb33532622 [0,0,0,0,0,0|0,0,2]=2 3 B6R0.4 C#CCCC(=O)[O-] Amb22232009 [0,0,0,0,0,0|0,0,3]=3 4 B6R0.4 C#CCCC(C)=O Amb8869638 [0,0,0,0,0,0|1,0,2]=3 5 B6R0.4 C#CCCC(C)O Amb27175253 [0,0,0,0,0,0|1,0,3]=4 6 B6R0.4 C#CCNC(=O)Br Amb27792816 [0,0,0,0,0,0|2,0,2]=4 7 B6R0.4 C#CCNC(=O)I Amb27838254 [0,0,0,0,0,0|2,0,2]=4 8 B6R0.4 C#CCNC(C)=O Amb20623038 [0,0,0,0,0,0|2,0,2]=4 9 B6R0.4 C#CCNC(N)=O Amb2724225 [0,0,0,0,0,0|2,0,2]=4 10 B6R0.4 C#CCOC(=O)Cl Amb13777322 [0,0,0,0,0,0|2,0,2]=4 11 B6R0.4 C#CCOC(C)=O Amb8517415 [0,0,0,0,0,0|2,0,2]=4 12 B6R0.4 C#CCOC(N)=O Amb26654642 [0,0,0,0,0,0|2,0,2]=4 13 B6R0.4 C#CCSC(C)=O Amb32683409 [0,0,0,0,0,0|2,0,2]=4 14 B6R0.4 C#C\C=C\C(=O)O Amb17593056 [0,0,0,0,0,0|0,0,4]=4 15 B6R0.4 C=C(Br)CCCCl Amb28320778 [0,0,0,0,0,0|3,0,0]=3 16 B6R0.4 C=C(Br)CCCN Amb27219336 [0,0,0,0,0,0|3,0,0]=3 17 B6R0.4 C=C(Br)CCCO Amb27471781 [0,0,0,0,0,0|3,0,0]=3 18 B6R0.4 C=C(Br)CSCC Amb28063803 [0,0,0,0,0,0|3,0,0]=3 19 B6R0.4 C=C(C)C#CCC Amb2721682 [0,0,0,0,0,0|2,0,2]=4 20 B6R0.4 C=C(C)CCC#N Amb2778548 [0,0,0,0,0,0|3,0,1]=4 21 B6R0.4 C=C(C)CCCBr Amb22886717 [0,0,0,0,0,0|3,0,0]=3 22 B6R0.4 C=C(C)CCCC Amb2721685 [0,0,0,0,0,0|2,0,0]=2 23 B6R0.4 C=C(C)CCCCl Amb24089299 [0,0,0,0,0,0|3,0,0]=3 24 B6R0.4 C=C(C)CCCN Amb24761452 [0,0,0,0,0,0|3,0,0]=3 25 B6R0.4 C=C(C)CCCN Amb33534233 [0,0,0,0,0,0|3,0,0]=3 26 B6R0.4 C=C(C)CCCO Amb22886814 [0,0,0,0,0,0|3,0,0]=3 27 B6R0.4 C=C(C)CCCS Amb33198962 [0,0,0,0,0,0|3,0,0]=3 28 B6R0.4 C=C(C)CCNC Amb18993045 [0,0,0,0,0,0|3,0,0]=3 29 B6R0.4 C=C(C)CCOC Amb33546340 [0,0,0,0,0,0|3,0,0]=3 30 B6R0.4 C=C(C)CCON Amb25862621 [0,0,0,0,0,0|4,0,0]=4 31 B6R0.4 C=C(C)CCSC Amb28400079 [0,0,0,0,0,0|3,0,0]=3 32 B6R0.4 C=C(C)CNCC Amb3940049 [0,0,0,0,0,0|3,0,0]=3 33 B6R0.4 C=C(C)COCCl Amb27424965 [0,0,0,0,0,0|4,0,0]=4 34 B6R0.4 C=C(Cl)CCCBr Amb25811643 [0,0,0,0,0,0|3,0,0]=3 35 B6R0.4 C=C(Cl)CCCCl Amb24635037 [0,0,0,0,0,0|3,0,0]=3 36 B6R0.4 C=C(Cl)CCCN Amb27413032 [0,0,0,0,0,0|3,0,0]=3 37 B6R0.4 C=C(Cl)CCCO Amb28065233 [0,0,0,0,0,0|3,0,0]=3 38 B6R0.4 C=C(Cl)CSCC Amb27972493 [0,0,0,0,0,0|3,0,0]=3 39 B6R0.4 C=C(F)CCCO Amb25811029 [0,0,0,0,0,0|3,0,0]=3 40 B6R0.4 C=C(I)CCCCl Amb27239930 [0,0,0,0,0,0|3,0,0]=3 41 B6R0.4 C=C=CCC(=O)O Amb26657414 [0,0,0,0,0,0|0,0,3]=3 42 B6R0.4 C=CCCB(O)O Amb10067042 [0,0,0,0,0,0|1,0,3]=4 43 B6R0.4 C=CCCC(=C)C Amb22228883 [0,0,0,0,0,0|2,0,2]=4 44 B6R0.4 C=CCCC(=N)N Amb25326954 [0,0,0,0,0,0|2,0,2]=4 45 B6R0.4 C=CCCC(=O)Cl Amb3939003 [0,0,0,0,0,0|1,0,2]=3 46 B6R0.4 C=CCCC(=O)O Amb3940112 [0,0,0,0,0,0|0,0,2]=2 47 B6R0.4 C=CCCC(C)=O Amb2721704 [0,0,0,0,0,0|1,0,2]=3 48 B6R0.4 C=CCCC(C)O Amb22059013 [0,0,0,0,0,0|1,0,3]=4 49 B6R0.4 C=CCCC(C)O Amb34915890 [0,0,0,0,0,0|1,0,3]=4 50 B6R0.4 C=CCCC(N)=O Amb28136349 [0,0,0,0,0,0|1,0,2]=3 51 B6R0.4 C=CCCS(=O)[O-] Amb25680826 [0,0,0,0,0,0|1,0,3]=4 52 B6R0.4 C=CCC[C@@H](C)O Amb19929324 [0,0,0,0,0,0|1,0,3]=4 53 B6R0.4 C=CCC[C@H](C)O Amb22226511 [0,0,0,0,0,0|1,0,3]=4 54 B6R0.4 C=CCNC(C)=O Amb5797445 [0,0,0,0,0,0|2,0,2]=4 55 B6R0.4 C=CCNC(N)=O Amb6599864 [0,0,0,0,0,0|2,0,2]=4 56 B6R0.4 C=CCOC(=O)Cl Amb6600570 [0,0,0,0,0,0|2,0,2]=4 57 B6R0.4 C=CCOC(N)=O Amb4017585 [0,0,0,0,0,0|2,0,2]=4 58 B6R0.4 C=CNCC(=O)O Amb28346027 [0,0,0,0,0,0|1,0,2]=3 59 B6R0.4 C=COCC(=O)O Amb27247261 [0,0,0,0,0,0|1,0,2]=3 60 B6R0.4 C=COCC(C)=O Amb27838258 [0,0,0,0,0,0|2,0,2]=4 61 B6R0.4 CC#CCB(O)O Amb27214532 [0,0,0,0,0,0|1,0,3]=4 62 B6R0.4 CC#CCC(=O)O Amb17939740 [0,0,0,0,0,0|0,0,2]=2 63 B6R0.4 CC#CCC(C)=O Amb27648528 [0,0,0,0,0,0|1,0,2]=3 64 B6R0.4 CC#CCC(C)O Amb25747033 [0,0,0,0,0,0|1,0,3]=4 65 B6R0.4 CC(=N)NCCF Amb28123831 [0,0,0,0,0,0|4,0,0]=4 66 B6R0.4 CC(=O)CC#CO Amb27463647 [0,0,0,0,0,0|2,0,2]=4 67 B6R0.4 CC(=O)CCC#N Amb17334046 [0,0,0,0,0,0|2,0,1]=3 68 B6R0.4 CC(=O)CCC=O Amb18639597 [0,0,0,0,0,0|2,0,1]=3 69 B6R0.4 CC(=O)CCCBr Amb8394105 [0,0,0,0,0,0|2,0,0]=2 70 B6R0.4 CC(=O)CCCCl Amb3940272 [0,0,0,0,0,0|2,0,0]=2 71 B6R0.4 CC(=O)CCCF Amb25068187 [0,0,0,0,0,0|2,0,0]=2 72 B6R0.4 CC(=O)CCCN Amb18121547 [0,0,0,0,0,0|2,0,0]=2 73 B6R0.4 CC(=O)CCCN Amb32661221 [0,0,0,0,0,0|2,0,0]=2 74 B6R0.4 CC(=O)CCCN Amb32661286 [0,0,0,0,0,0|2,0,0]=2 75 B6R0.4 CC(=O)CCCO Amb3940340 [0,0,0,0,0,0|2,0,0]=2 76 B6R0.4 CC(=O)CN=C=S Amb27490781 [0,0,0,0,0,0|3,0,1]=4 77 B6R0.4 CC(=O)CN=[N+]=[N-] Amb18114476 [0,0,0,0,0,0|4,0,0]=4 78 B6R0.4 CC(=O)CSC#N Amb9788383 [0,0,0,0,0,0|3,0,1]=4 79 B6R0.4 CC(=O)C\C=N\O Amb27750272 [0,0,0,0,0,0|3,0,1]=4 80 B6R0.4 CC(=O)NCC#N Amb3886527 [0,0,0,0,0,0|3,0,1]=4 81 B6R0.4 CC(=O)NCC=O Amb25757509 [0,0,0,0,0,0|3,0,1]=4 82 B6R0.4 CC(=O)NCCBr Amb4311522 [0,0,0,0,0,0|3,0,0]=3 83 B6R0.4 CC(=O)NCCCl Amb423758 [0,0,0,0,0,0|3,0,0]=3 84 B6R0.4 CC(=O)NCCN Amb1218225 [0,0,0,0,0,0|3,0,0]=3 85 B6R0.4 CC(=O)NCCO Amb2720909 [0,0,0,0,0,0|3,0,0]=3 86 B6R0.4 CC(=O)NCCS Amb22230992 [0,0,0,0,0,0|3,0,0]=3 87 B6R0.4 CC(=O)OCC#N Amb9677308 [0,0,0,0,0,0|3,0,1]=4 88 B6R0.4 CC(=O)OCCBr Amb3940209 [0,0,0,0,0,0|3,0,0]=3 89 B6R0.4 CC(=O)OCCN Amb18121947 [0,0,0,0,0,0|3,0,0]=3 90 B6R0.4 CC(=O)OCCN Amb28827650 [0,0,0,0,0,0|3,0,0]=3 91 B6R0.4 CC(=O)OCCO Amb3941004 [0,0,0,0,0,0|3,0,0]=3 92 B6R0.4 CC(=O)SCC=O Amb27873378 [0,0,0,0,0,0|3,0,1]=4 93 B6R0.4 CC(=O)SCCBr Amb24608039 [0,0,0,0,0,0|3,0,0]=3 94 B6R0.4 CC(=O)SCCN Amb21953963 [0,0,0,0,0,0|3,0,0]=3 95 B6R0.4 CC(=O)SCCN Amb22011516 [0,0,0,0,0,0|3,0,0]=3 96 B6R0.4 CC(=O)SCCN Amb31291049 [0,0,0,0,0,0|3,0,0]=3 97 B6R0.4 CC(=O)SCCO Amb27481182 [0,0,0,0,0,0|3,0,0]=3 98 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [0,0,0,0,0,0|2,0,2]=4 99 B6R0.4 CC(=O)\C=C\CF Amb33379250 [0,0,0,0,0,0|2,0,2]=4 100 B6R0.4 CC(=S)SCCCl Amb27952185 [0,0,0,0,0,0|3,1,0]=4 101 B6R0.4 CC(=S)SCCO Amb28350218 [0,0,0,0,0,0|3,1,0]=4 102 B6R0.4 CC(Br)CCCBr Amb2686750 [0,0,0,0,0,0|3,0,1]=4 103 B6R0.4 CC(Br)CCCF Amb33334194 [0,0,0,0,0,0|3,0,1]=4 104 B6R0.4 CC(C)=CCCBr Amb3941652 [0,0,0,0,0,0|3,0,1]=4 105 B6R0.4 CC(C)=CCCCl Amb27865707 [0,0,0,0,0,0|3,0,1]=4 106 B6R0.4 CC(C)=CCCI Amb22395000 [0,0,0,0,0,0|3,0,1]=4 107 B6R0.4 CC(C)=CCCN Amb18962494 [0,0,0,0,0,0|3,0,1]=4 108 B6R0.4 CC(C)=CCCO Amb22002283 [0,0,0,0,0,0|3,0,1]=4 109 B6R0.4 CC(C)=CCCS Amb35588788 [0,0,0,0,0,0|3,0,1]=4 110 B6R0.4 CC(C)=NCCO Amb27612560 [0,0,0,0,0,0|4,0,0]=4 111 B6R0.4 CC(C)CCCBr Amb3940143 [0,0,0,0,0,0|3,0,1]=4 112 B6R0.4 CC(C)CCCCl Amb33546075 [0,0,0,0,0,0|3,0,1]=4 113 B6R0.4 CC(C)CCCI Amb27814431 [0,0,0,0,0,0|3,0,1]=4 114 B6R0.4 CC(C)CCCN Amb1136518 [0,0,0,0,0,0|3,0,1]=4 115 B6R0.4 CC(C)CCCN Amb13952127 [0,0,0,0,0,0|3,0,1]=4 116 B6R0.4 CC(C)CCCO Amb3939329 [0,0,0,0,0,0|3,0,1]=4 117 B6R0.4 CC(C)CCCS Amb26425936 [0,0,0,0,0,0|3,0,1]=4 118 B6R0.4 CC(Cl)CCCCl Amb19516004 [0,0,0,0,0,0|3,0,1]=4 119 B6R0.4 CC(Cl)CCCO Amb28138028 [0,0,0,0,0,0|3,0,1]=4 120 B6R0.4 CC(F)CCCBr Amb27760484 [0,0,0,0,0,0|3,0,1]=4 121 B6R0.4 CC(F)CCCO Amb27186289 [0,0,0,0,0,0|3,0,1]=4 122 B6R0.4 CC(N)CCCF Amb27612972 [0,0,0,0,0,0|3,0,1]=4 123 B6R0.4 CC(N)CCCN Amb22168271 [0,0,0,0,0,0|3,0,1]=4 124 B6R0.4 CC(N)CCCN Amb28827626 [0,0,0,0,0,0|3,0,1]=4 125 B6R0.4 CC(N)CCCO Amb17569888 [0,0,0,0,0,0|3,0,1]=4 126 B6R0.4 CC(O)CCC#N Amb27974459 [0,0,0,0,0,0|2,0,2]=4 127 B6R0.4 CC(O)CCC=O Amb17593090 [0,0,0,0,0,0|2,0,2]=4 128 B6R0.4 CC(O)CCCBr Amb25889007 [0,0,0,0,0,0|2,0,1]=3 129 B6R0.4 CC(O)CCCCl Amb22270232 [0,0,0,0,0,0|2,0,1]=3 130 B6R0.4 CC(O)CCCF Amb24385806 [0,0,0,0,0,0|2,0,1]=3 131 B6R0.4 CC(O)CCCN Amb8630414 [0,0,0,0,0,0|2,0,1]=3 132 B6R0.4 CC(O)CCCO Amb22227752 [0,0,0,0,0,0|2,0,1]=3 133 B6R0.4 CC(O)COCO Amb27764974 [0,0,0,0,0,0|3,0,1]=4 134 B6R0.4 CC(O)NCCN Amb28128791 [0,0,0,0,0,0|3,0,1]=4 135 B6R0.4 CC(O)OCCO Amb28065279 [0,0,0,0,0,0|3,0,1]=4 136 B6R0.4 CC(O)OCCS Amb25313392 [0,0,0,0,0,0|3,0,1]=4 137 B6R0.4 CC(S)CCCN Amb18251084 [0,0,0,0,0,0|2,1,1]=4 138 B6R0.4 CC(S)CCCO Amb24412207 [0,0,0,0,0,0|2,1,1]=4 139 B6R0.4 CC=C=CC(=O)O Amb17593065 [0,0,0,0,0,0|0,0,3]=3 140 B6R0.4 CC=C=C[PH](=O)O Amb27430355 [0,0,0,0,0,0|1,0,3]=4 141 B6R0.4 CCC#CC(=O)O Amb6336503 [0,0,0,0,0,0|0,0,2]=2 142 B6R0.4 CCC#CC(C)=O Amb2721702 [0,0,0,0,0,0|1,0,2]=3 143 B6R0.4 CCC#CC(C)O Amb8628417 [0,0,0,0,0,0|1,0,3]=4 144 B6R0.4 CCCC=C(C)C Amb4035860 [0,0,0,0,0,0|2,0,1]=3 145 B6R0.4 CCCCB(Cl)Cl Amb22230362 [0,0,0,0,0,0|3,0,0]=3 146 B6R0.4 CCCCB(F)F Amb27268214 [0,0,0,0,0,0|3,0,0]=3 147 B6R0.4 CCCCB(O)O Amb2447142 [0,0,0,0,0,0|1,0,1]=2 148 B6R0.4 CCCCC(=N)N Amb10066937 [0,0,0,0,0,0|2,0,0]=2 149 B6R0.4 CCCCC(=N)N Amb2696360 [0,0,0,0,0,0|2,0,0]=2 150 B6R0.4 CCCCC(=O)Cl Amb3939066 [0,0,0,0,0,0|1,0,0]=1 151 B6R0.4 CCCCC(=O)O Amb3939877 [0,0,0,0,0,0|0,0,0]=0 152 B6R0.4 CCCCC(=O)[O-] Amb22056343 [0,0,0,0,0,0|0,0,1]=1 153 B6R0.4 CCCCC(=S)S Amb27195855 [0,0,0,0,0,0|0,2,0]=2 154 B6R0.4 CCCCC(C)=O Amb6608652 [0,0,0,0,0,0|1,0,0]=1 155 B6R0.4 CCCCC(C)Br Amb4015489 [0,0,0,0,0,0|2,0,1]=3 156 B6R0.4 CCCCC(C)C Amb8513255 [0,0,0,0,0,0|2,0,1]=3 157 B6R0.4 CCCCC(C)I Amb17673919 [0,0,0,0,0,0|2,0,1]=3 158 B6R0.4 CCCCC(C)N Amb33527132 [0,0,0,0,0,0|2,0,1]=3 159 B6R0.4 CCCCC(C)N Amb33532410 [0,0,0,0,0,0|2,0,1]=3 160 B6R0.4 CCCCC(C)O Amb4605977 [0,0,0,0,0,0|1,0,1]=2 161 B6R0.4 CCCCC(C)S Amb26326801 [0,0,0,0,0,0|1,1,1]=3 162 B6R0.4 CCCCC(Cl)Br Amb28050002 [0,0,0,0,0,0|2,0,1]=3 163 B6R0.4 CCCCC(Cl)Cl Amb26420376 [0,0,0,0,0,0|2,0,1]=3 164 B6R0.4 CCCCC(F)Br Amb27211132 [0,0,0,0,0,0|2,0,1]=3 165 B6R0.4 CCCCC(N)=O Amb6891958 [0,0,0,0,0,0|1,0,0]=1 166 B6R0.4 CCCCC(N)=S Amb6249558 [0,0,0,0,0,0|1,1,0]=2 167 B6R0.4 CCCCN(C)N Amb22730468 [0,0,0,0,0,0|3,0,0]=3 168 B6R0.4 CCCCN(C)O Amb33204268 [0,0,0,0,0,0|2,0,0]=2 169 B6R0.4 CCCCP(Cl)Cl Amb25051489 [0,0,0,0,0,0|3,0,0]=3 170 B6R0.4 CCCCS(=O)Cl Amb24551332 [0,0,0,0,0,0|2,0,0]=2 171 B6R0.4 CCCCS(=O)[O-] Amb19889352 [0,0,0,0,0,0|1,0,1]=2 172 B6R0.4 CCCCS(N)=O Amb32720302 [0,0,0,0,0,0|2,0,0]=2 173 B6R0.4 CCCC[C@@H](C)N Amb20242479 [0,0,0,0,0,0|2,0,1]=3 174 B6R0.4 CCCC[C@@H](C)O Amb19929139 [0,0,0,0,0,0|1,0,1]=2 175 B6R0.4 CCCC[C@H](C)N Amb20242478 [0,0,0,0,0,0|2,0,1]=3 176 B6R0.4 CCCC[C@H](C)O Amb8515092 [0,0,0,0,0,0|1,0,1]=2 177 B6R0.4 CCCC[N+](=O)[O-] Amb6298783 [0,0,0,0,0,0|1,0,1]=2 178 B6R0.4 CCCC[PH](=O)O Amb8391286 [0,0,0,0,0,0|1,0,0]=1 179 B6R0.4 CCCC[SiH](C)C Amb9807507 [0,0,0,0,0,0|2,1,0]=3 180 B6R0.4 CCCNC(=N)N Amb10844865 [0,0,0,0,0,0|3,0,0]=3 181 B6R0.4 CCCNC(=N)N Amb20667746 [0,0,0,0,0,0|3,0,0]=3 182 B6R0.4 CCCNC(=O)Cl Amb25688616 [0,0,0,0,0,0|2,0,0]=2 183 B6R0.4 CCCNC(=S)S Amb28128280 [0,0,0,0,0,0|1,2,0]=3 184 B6R0.4 CCCNC(C)=O Amb5835710 [0,0,0,0,0,0|2,0,0]=2 185 B6R0.4 CCCNC(C)C Amb6248300 [0,0,0,0,0,0|3,0,1]=4 186 B6R0.4 CCCNC(N)=O Amb1152241 [0,0,0,0,0,0|2,0,0]=2 187 B6R0.4 CCCNC(N)=S Amb1152085 [0,0,0,0,0,0|2,1,0]=3 188 B6R0.4 CCCNN(C)C Amb25791383 [0,0,0,0,0,0|4,0,0]=4 189 B6R0.4 CCCN[N+](=O)[O-] Amb21953652 [0,0,0,0,0,0|2,0,1]=3 190 B6R0.4 CCCOC(=O)Cl Amb10604123 [0,0,0,0,0,0|2,0,0]=2 191 B6R0.4 CCCOC(=O)F Amb32667886 [0,0,0,0,0,0|2,0,0]=2 192 B6R0.4 CCCOC(=S)[S-] Amb594778 [0,0,0,0,0,0|1,2,0]=3 193 B6R0.4 CCCOC(C)C Amb27234578 [0,0,0,0,0,0|3,0,1]=4 194 B6R0.4 CCCOC(C)Cl Amb26350769 [0,0,0,0,0,0|3,0,1]=4 195 B6R0.4 CCCOC(Cl)Cl Amb28145916 [0,0,0,0,0,0|3,0,1]=4 196 B6R0.4 CCCOC(N)=O Amb6334809 [0,0,0,0,0,0|2,0,0]=2 197 B6R0.4 CCCO[N+](=O)[O-] Amb22732564 [0,0,0,0,0,0|2,0,1]=3 198 B6R0.4 CCCSC(=N)N Amb20676008 [0,0,0,0,0,0|3,0,0]=3 199 B6R0.4 CCCSC(=N)N Amb23482968 [0,0,0,0,0,0|3,0,0]=3 200 B6R0.4 CCCSC(C)=O Amb22043301 [0,0,0,0,0,0|2,0,0]=2 201 B6R0.4 CCCSC(C)C Amb4017934 [0,0,0,0,0,0|3,0,1]=4 202 B6R0.4 CCCSC(N)=O Amb27167907 [0,0,0,0,0,0|2,0,0]=2 203 B6R0.4 CCNCC(=N)N Amb28050789 [0,0,0,0,0,0|3,0,0]=3 204 B6R0.4 CCNCC(=O)Cl Amb27948279 [0,0,0,0,0,0|2,0,0]=2 205 B6R0.4 CCNCC(=O)O Amb10609667 [0,0,0,0,0,0|1,0,0]=1 206 B6R0.4 CCNCC(=O)O Amb7764661 [0,0,0,0,0,0|1,0,0]=1 207 B6R0.4 CCNCC(C)=O Amb24545893 [0,0,0,0,0,0|2,0,0]=2 208 B6R0.4 CCNCC(C)=O Amb32661185 [0,0,0,0,0,0|2,0,0]=2 209 B6R0.4 CCNCC(C)Br Amb35693406 [0,0,0,0,0,0|3,0,1]=4 210 B6R0.4 CCNCC(C)C Amb6247357 [0,0,0,0,0,0|3,0,1]=4 211 B6R0.4 CCNCC(C)C Amb6893129 [0,0,0,0,0,0|3,0,1]=4 212 B6R0.4 CCNCC(C)N Amb18299415 [0,0,0,0,0,0|3,0,1]=4 213 B6R0.4 CCNCC(C)O Amb32666214 [0,0,0,0,0,0|2,0,1]=3 214 B6R0.4 CCNCC(C)O Amb9247475 [0,0,0,0,0,0|2,0,1]=3 215 B6R0.4 CCNCC(C)S Amb18640729 [0,0,0,0,0,0|2,1,1]=4 216 B6R0.4 CCNCC(F)F Amb22896471 [0,0,0,0,0,0|3,0,1]=4 217 B6R0.4 CCNCC(F)F Amb8853687 [0,0,0,0,0,0|3,0,1]=4 218 B6R0.4 CCNCC(N)=O Amb1128676 [0,0,0,0,0,0|2,0,0]=2 219 B6R0.4 CCNCC(N)=O Amb4035424 [0,0,0,0,0,0|2,0,0]=2 220 B6R0.4 CCNC[C@@H](C)N Amb25888487 [0,0,0,0,0,0|3,0,1]=4 221 B6R0.4 CCNC[C@@H](C)O Amb27827890 [0,0,0,0,0,0|2,0,1]=3 222 B6R0.4 CCNC[C@@H](C)O Amb32652513 [0,0,0,0,0,0|2,0,1]=3 223 B6R0.4 CCNC[C@H](C)N Amb24720969 [0,0,0,0,0,0|3,0,1]=4 224 B6R0.4 CCNC[C@H](C)O Amb25785620 [0,0,0,0,0,0|2,0,1]=3 225 B6R0.4 CCNC[C@H](C)O Amb32652535 [0,0,0,0,0,0|2,0,1]=3 226 B6R0.4 CCNNC(N)=S Amb19148042 [0,0,0,0,0,0|3,1,0]=4 227 B6R0.4 CCOC=C(C)C Amb27667358 [0,0,0,0,0,0|3,0,1]=4 228 B6R0.4 CCOCC(=N)N Amb19890012 [0,0,0,0,0,0|3,0,0]=3 229 B6R0.4 CCOCC(=N)N Amb6268669 [0,0,0,0,0,0|3,0,0]=3 230 B6R0.4 CCOCC(=O)Cl Amb33528415 [0,0,0,0,0,0|2,0,0]=2 231 B6R0.4 CCOCC(=O)O Amb3939880 [0,0,0,0,0,0|1,0,0]=1 232 B6R0.4 CCOCC(=O)S Amb27813482 [0,0,0,0,0,0|1,1,0]=2 233 B6R0.4 CCOCC(C)=O Amb9666086 [0,0,0,0,0,0|2,0,0]=2 234 B6R0.4 CCOCC(C)Br Amb4012959 [0,0,0,0,0,0|3,0,1]=4 235 B6R0.4 CCOCC(C)N Amb10610346 [0,0,0,0,0,0|3,0,1]=4 236 B6R0.4 CCOCC(C)N Amb1133021 [0,0,0,0,0,0|3,0,1]=4 237 B6R0.4 CCOCC(C)O Amb33535096 [0,0,0,0,0,0|2,0,1]=3 238 B6R0.4 CCOCC(C)S Amb27451431 [0,0,0,0,0,0|2,1,1]=4 239 B6R0.4 CCOCC(Cl)Cl Amb27776809 [0,0,0,0,0,0|3,0,1]=4 240 B6R0.4 CCOCC(N)=S Amb6276655 [0,0,0,0,0,0|2,1,0]=3 241 B6R0.4 CCOC[C@@H](C)N Amb18016634 [0,0,0,0,0,0|3,0,1]=4 242 B6R0.4 CCOC[C@@H](C)N Amb33483972 [0,0,0,0,0,0|3,0,1]=4 243 B6R0.4 CCOC[C@@H](C)O Amb27203934 [0,0,0,0,0,0|2,0,1]=3 244 B6R0.4 CCOC[C@H](C)N Amb17061642 [0,0,0,0,0,0|3,0,1]=4 245 B6R0.4 CCOC[C@H](C)N Amb33109791 [0,0,0,0,0,0|3,0,1]=4 246 B6R0.4 CCONC(C)=O Amb22230675 [0,0,0,0,0,0|3,0,0]=3 247 B6R0.4 CCONS(C)=O Amb27974850 [0,0,0,0,0,0|4,0,0]=4 248 B6R0.4 CCPCC(=O)O Amb28321137 [0,0,0,0,0,0|1,0,0]=1 249 B6R0.4 CCSCC(=N)N Amb6680834 [0,0,0,0,0,0|3,0,0]=3 250 B6R0.4 CCSCC(=O)O Amb1125185 [0,0,0,0,0,0|1,0,0]=1 251 B6R0.4 CCSCC(C)=O Amb4018179 [0,0,0,0,0,0|2,0,0]=2 252 B6R0.4 CCSCC(C)C Amb22230686 [0,0,0,0,0,0|3,0,1]=4 253 B6R0.4 CCSCC(C)Cl Amb28050300 [0,0,0,0,0,0|3,0,1]=4 254 B6R0.4 CCSCC(C)N Amb19149261 [0,0,0,0,0,0|3,0,1]=4 255 B6R0.4 CCSCC(C)S Amb32788341 [0,0,0,0,0,0|2,1,1]=4 256 B6R0.4 CCSCC(Cl)Cl Amb27657546 [0,0,0,0,0,0|3,0,1]=4 257 B6R0.4 CCSCC(N)=S Amb27188472 [0,0,0,0,0,0|2,1,0]=3 258 B6R0.4 CCSC[C@@H](C)N Amb26396040 [0,0,0,0,0,0|3,0,1]=4 259 B6R0.4 CCSC[C@@H](C)O Amb26059442 [0,0,0,0,0,0|2,0,1]=3 260 B6R0.4 CCSC[C@H](C)N Amb26058583 [0,0,0,0,0,0|3,0,1]=4 261 B6R0.4 CCSC[C@H](C)O Amb25220206 [0,0,0,0,0,0|2,0,1]=3 262 B6R0.4 CCSSC(=N)N Amb27228191 [0,0,0,0,0,0|4,0,0]=4 263 B6R0.4 CC\C=C/C(=O)O Amb28429841 [0,0,0,0,0,0|0,0,2]=2 264 B6R0.4 CC\C=C/C(C)=O Amb27835645 [0,0,0,0,0,0|1,0,2]=3 265 B6R0.4 CC\C=C\B(O)O Amb24078362 [0,0,0,0,0,0|1,0,3]=4 266 B6R0.4 CC\C=C\C(=N)N Amb33171614 [0,0,0,0,0,0|2,0,2]=4 267 B6R0.4 CC\C=C\C(=O)Cl Amb2690073 [0,0,0,0,0,0|1,0,2]=3 268 B6R0.4 CC\C=C\C(=O)O Amb6608967 [0,0,0,0,0,0|0,0,2]=2 269 B6R0.4 CC\C=C\C(C)=O Amb26022886 [0,0,0,0,0,0|1,0,2]=3 270 B6R0.4 CC\C=C\C(C)O Amb25888544 [0,0,0,0,0,0|1,0,3]=4 271 B6R0.4 CC\C=C\C(N)=O Amb25770876 [0,0,0,0,0,0|1,0,2]=3 272 B6R0.4 CC\C=C\C(N)=S Amb33272632 [0,0,0,0,0,0|1,1,2]=4 273 B6R0.4 CC\C=C\[C@@H](C)O Amb33429815 [0,0,0,0,0,0|1,0,3]=4 274 B6R0.4 CC\C=C\[C@H](C)O Amb33449173 [0,0,0,0,0,0|1,0,3]=4 275 B6R0.4 CC\C=C\[N+](=O)[O-] Amb25190046 [0,0,0,0,0,0|1,0,3]=4 276 B6R0.4 CC\C=N\S(C)=O Amb35681661 [0,0,0,0,0,0|3,0,1]=4 277 B6R0.4 CC\N=C\C(=O)O Amb28041425 [0,0,0,0,0,0|1,0,1]=2 278 B6R0.4 CC\N=C\C(C)=O Amb27854982 [0,0,0,0,0,0|2,0,1]=3 279 B6R0.4 CC\N=N\C(C)O Amb27594818 [0,0,0,0,0,0|3,0,1]=4 280 B6R0.4 CN(C)CCCBr Amb10603677 [0,0,0,0,0,0|4,0,0]=4 281 B6R0.4 CN(C)CCCCl Amb33537241 [0,0,0,0,0,0|4,0,0]=4 282 B6R0.4 CN(C)CCCCl Amb8513141 [0,0,0,0,0,0|4,0,0]=4 283 B6R0.4 CN(C)CCCI Amb35781980 [0,0,0,0,0,0|4,0,0]=4 284 B6R0.4 CN(C)CCCN Amb3939839 [0,0,0,0,0,0|4,0,0]=4 285 B6R0.4 CN(C)CCCO Amb3939321 [0,0,0,0,0,0|4,0,0]=4 286 B6R0.4 CN(C)CCCS Amb24078629 [0,0,0,0,0,0|4,0,0]=4 287 B6R0.4 CN(C)CCCS Amb27974610 [0,0,0,0,0,0|4,0,0]=4 288 B6R0.4 CN(O)CCCF Amb33480871 [0,0,0,0,0,0|3,0,0]=3 289 B6R0.4 CNCCC(=O)Cl Amb27422890 [0,0,0,0,0,0|2,0,0]=2 290 B6R0.4 CNCCC(=O)O Amb10609760 [0,0,0,0,0,0|1,0,0]=1 291 B6R0.4 CNCCC(=O)O Amb7766400 [0,0,0,0,0,0|1,0,0]=1 292 B6R0.4 CNCCC(C)=O Amb24560306 [0,0,0,0,0,0|2,0,0]=2 293 B6R0.4 CNCCC(C)=O Amb28827637 [0,0,0,0,0,0|2,0,0]=2 294 B6R0.4 CNCCC(C)C Amb10609494 [0,0,0,0,0,0|3,0,1]=4 295 B6R0.4 CNCCC(C)C Amb1114399 [0,0,0,0,0,0|3,0,1]=4 296 B6R0.4 CNCCC(C)N Amb18288833 [0,0,0,0,0,0|3,0,1]=4 297 B6R0.4 CNCCC(C)O Amb17569889 [0,0,0,0,0,0|2,0,1]=3 298 B6R0.4 CNCCC(C)O Amb34141241 [0,0,0,0,0,0|2,0,1]=3 299 B6R0.4 CNCCC(F)F Amb26515235 [0,0,0,0,0,0|3,0,1]=4 300 B6R0.4 CNCCC(F)F Amb33527624 [0,0,0,0,0,0|3,0,1]=4 301 B6R0.4 CNCCC(N)=O Amb19959913 [0,0,0,0,0,0|2,0,0]=2 302 B6R0.4 CNCCC(N)=O Amb33538309 [0,0,0,0,0,0|2,0,0]=2 303 B6R0.4 CNCCN(C)C Amb19958398 [0,0,0,0,0,0|4,0,0]=4 304 B6R0.4 CNCCN(C)C Amb3939354 [0,0,0,0,0,0|4,0,0]=4 305 B6R0.4 CNCCN(C)O Amb27628863 [0,0,0,0,0,0|3,0,0]=3 306 B6R0.4 CNCCP(C)C Amb28068836 [0,0,0,0,0,0|4,0,0]=4 307 B6R0.4 CNCCS(C)=O Amb21984676 [0,0,0,0,0,0|3,0,0]=3 308 B6R0.4 CNCC[C@@H](C)N Amb28429755 [0,0,0,0,0,0|3,0,1]=4 309 B6R0.4 CNCC[C@H](C)O Amb27801301 [0,0,0,0,0,0|2,0,1]=3 310 B6R0.4 CNCC[N+](=O)[O-] Amb35704404 [0,0,0,0,0,0|2,0,1]=3 311 B6R0.4 CN\C=C\C(C)=O Amb17593076 [0,0,0,0,0,0|2,0,2]=4 312 B6R0.4 COCCB(O)O Amb27173037 [0,0,0,0,0,0|2,0,1]=3 313 B6R0.4 COCCC(=N)N Amb2696283 [0,0,0,0,0,0|3,0,0]=3 314 B6R0.4 COCCC(=N)N Amb8630184 [0,0,0,0,0,0|3,0,0]=3 315 B6R0.4 COCCC(=O)Cl Amb2689274 [0,0,0,0,0,0|2,0,0]=2 316 B6R0.4 COCCC(=O)O Amb3938990 [0,0,0,0,0,0|1,0,0]=1 317 B6R0.4 COCCC(C)=O Amb7764907 [0,0,0,0,0,0|2,0,0]=2 318 B6R0.4 COCCC(C)Br Amb18805533 [0,0,0,0,0,0|3,0,1]=4 319 B6R0.4 COCCC(C)Cl Amb27207909 [0,0,0,0,0,0|3,0,1]=4 320 B6R0.4 COCCC(C)N Amb7772188 [0,0,0,0,0,0|3,0,1]=4 321 B6R0.4 COCCC(C)O Amb20621489 [0,0,0,0,0,0|2,0,1]=3 322 B6R0.4 COCCC(C)S Amb27836211 [0,0,0,0,0,0|2,1,1]=4 323 B6R0.4 COCCC(N)=O Amb33538943 [0,0,0,0,0,0|2,0,0]=2 324 B6R0.4 COCCC(N)=S Amb6250669 [0,0,0,0,0,0|2,1,0]=3 325 B6R0.4 COCCC(O)Br Amb20242943 [0,0,0,0,0,0|2,0,1]=3 326 B6R0.4 COCCC(O)O Amb28410462 [0,0,0,0,0,0|1,0,2]=3 327 B6R0.4 COCCN(C)C Amb16231530 [0,0,0,0,0,0|4,0,0]=4 328 B6R0.4 COCCN(C)N Amb25326276 [0,0,0,0,0,0|4,0,0]=4 329 B6R0.4 COCCN(C)O Amb33428857 [0,0,0,0,0,0|3,0,0]=3 330 B6R0.4 COCCS(=O)Cl Amb25914790 [0,0,0,0,0,0|3,0,0]=3 331 B6R0.4 COCCS(=O)[O-] Amb26874008 [0,0,0,0,0,0|2,0,1]=3 332 B6R0.4 COCCS(N)=O Amb32720336 [0,0,0,0,0,0|3,0,0]=3 333 B6R0.4 COCC[C@@H](C)N Amb25934655 [0,0,0,0,0,0|3,0,1]=4 334 B6R0.4 COCC[C@@H](C)N Amb33620890 [0,0,0,0,0,0|3,0,1]=4 335 B6R0.4 COCC[C@@H](C)O Amb27237141 [0,0,0,0,0,0|2,0,1]=3 336 B6R0.4 COCC[C@H](C)N Amb25888528 [0,0,0,0,0,0|3,0,1]=4 337 B6R0.4 COCC[C@H](C)N Amb33741910 [0,0,0,0,0,0|3,0,1]=4 338 B6R0.4 COCC[C@H](C)O Amb26559043 [0,0,0,0,0,0|2,0,1]=3 339 B6R0.4 COCNC(N)=O Amb25744350 [0,0,0,0,0,0|3,0,0]=3 340 B6R0.4 COCNC(N)=S Amb8387982 [0,0,0,0,0,0|3,1,0]=4 341 B6R0.4 COCOC(=N)N Amb27619817 [0,0,0,0,0,0|4,0,0]=4 342 B6R0.4 CONCC(C)O Amb27607237 [0,0,0,0,0,0|3,0,1]=4 343 B6R0.4 CONCC(N)=O Amb28455463 [0,0,0,0,0,0|3,0,0]=3 344 B6R0.4 CO\C=C/C(C)=O Amb27264758 [0,0,0,0,0,0|2,0,2]=4 345 B6R0.4 CO\C=C\C(=O)Cl Amb25349516 [0,0,0,0,0,0|2,0,2]=4 346 B6R0.4 CO\C=C\C(=O)O Amb18121767 [0,0,0,0,0,0|1,0,2]=3 347 B6R0.4 CO\C=C\C(C)=O Amb8385700 [0,0,0,0,0,0|2,0,2]=4 348 B6R0.4 CO\C=C\C(N)=O Amb27153308 [0,0,0,0,0,0|2,0,2]=4 349 B6R0.4 CO\N=C\C(=O)O Amb10976081 [0,0,0,0,0,0|2,0,1]=3 350 B6R0.4 CP(O)OCCCl Amb28384727 [0,0,0,0,0,0|4,0,0]=4 351 B6R0.4 CS(=O)CCCN Amb18974527 [0,0,0,0,0,0|3,0,0]=3 352 B6R0.4 CS(=O)CCCN Amb32684177 [0,0,0,0,0,0|3,0,0]=3 353 B6R0.4 CS(=O)NCCN Amb25888549 [0,0,0,0,0,0|4,0,0]=4 354 B6R0.4 CS(=O)OCCCl Amb27471823 [0,0,0,0,0,0|4,0,0]=4 355 B6R0.4 CSC#CC(=O)O Amb33309663 [0,0,0,0,0,0|1,0,2]=3 356 B6R0.4 CSCC=C(C)C Amb27594692 [0,0,0,0,0,0|3,0,1]=4 357 B6R0.4 CSCCC(=N)N Amb19373501 [0,0,0,0,0,0|3,0,0]=3 358 B6R0.4 CSCCC(=N)N Amb19516878 [0,0,0,0,0,0|3,0,0]=3 359 B6R0.4 CSCCC(=O)O Amb3939879 [0,0,0,0,0,0|1,0,0]=1 360 B6R0.4 CSCCC(C)=O Amb8392858 [0,0,0,0,0,0|2,0,0]=2 361 B6R0.4 CSCCC(C)Br Amb33007127 [0,0,0,0,0,0|3,0,1]=4 362 B6R0.4 CSCCC(C)C Amb4016370 [0,0,0,0,0,0|3,0,1]=4 363 B6R0.4 CSCCC(C)N Amb19515505 [0,0,0,0,0,0|3,0,1]=4 364 B6R0.4 CSCCC(C)O Amb27860401 [0,0,0,0,0,0|2,0,1]=3 365 B6R0.4 CSCCC(N)=S Amb17307559 [0,0,0,0,0,0|2,1,0]=3 366 B6R0.4 CSCCN(=O)=O Amb24179458 [0,0,0,0,0,0|2,0,1]=3 367 B6R0.4 CSCCN(C)O Amb33272058 [0,0,0,0,0,0|3,0,0]=3 368 B6R0.4 CSCC[C@@H](C)N Amb33200180 [0,0,0,0,0,0|3,0,1]=4 369 B6R0.4 CSCC[C@@H](C)O Amb33198759 [0,0,0,0,0,0|2,0,1]=3 370 B6R0.4 CSCC[C@H](C)N Amb33200178 [0,0,0,0,0,0|3,0,1]=4 371 B6R0.4 CSCC[C@H](C)O Amb33198747 [0,0,0,0,0,0|2,0,1]=3 372 B6R0.4 CSCSC(C)=O Amb27876851 [0,0,0,0,0,0|3,0,0]=3 373 B6R0.4 CSSCC(=O)O Amb25378801 [0,0,0,0,0,0|2,0,0]=2 374 B6R0.4 CS\C=C/C(C)=O Amb27471812 [0,0,0,0,0,0|2,0,2]=4 375 B6R0.4 CS\C=C\C(=O)O Amb30584688 [0,0,0,0,0,0|1,0,2]=3 376 B6R0.4 C[C@@H](Cl)CCCO Amb27233570 [0,0,0,0,0,0|3,0,1]=4 377 B6R0.4 C[C@@H](N)CCCF Amb33377445 [0,0,0,0,0,0|3,0,1]=4 378 B6R0.4 C[C@@H](N)CCCO Amb27602210 [0,0,0,0,0,0|3,0,1]=4 379 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [0,0,0,0,0,0|2,0,1]=3 380 B6R0.4 C[C@@H](O)CCCF Amb33376908 [0,0,0,0,0,0|2,0,1]=3 381 B6R0.4 C[C@@H](O)CCCO Amb28047449 [0,0,0,0,0,0|2,0,1]=3 382 B6R0.4 C[C@H](N)CCCF Amb33377444 [0,0,0,0,0,0|3,0,1]=4 383 B6R0.4 C[C@H](O)CCC=O Amb27188424 [0,0,0,0,0,0|2,0,2]=4 384 B6R0.4 C[C@H](O)CCCF Amb33376887 [0,0,0,0,0,0|2,0,1]=3 385 B6R0.4 C[PH](=O)OCCCl Amb28340992 [0,0,0,0,0,0|4,0,0]=4 386 B6R0.4 C[SiH](C)CCCCl Amb27655852 [0,0,0,0,0,0|3,1,0]=4 387 B6R0.4 C[SiH](Cl)CCCCl Amb28364265 [0,0,0,0,0,0|3,1,0]=4 388 B6R0.4 C\C(Br)=C\CCCl Amb28054738 [0,0,0,0,0,0|3,0,1]=4 389 B6R0.4 C\C(Br)=C\CCN Amb28060834 [0,0,0,0,0,0|3,0,1]=4 390 B6R0.4 C\C(Cl)=C\CCCl Amb27786934 [0,0,0,0,0,0|3,0,1]=4 391 B6R0.4 C\C(Cl)=C\CCO Amb27956430 [0,0,0,0,0,0|3,0,1]=4 392 B6R0.4 C\C(N)=N\CCO Amb26857579 [0,0,0,0,0,0|4,0,0]=4 393 B6R0.4 C\C=C/CB(O)O Amb27620496 [0,0,0,0,0,0|1,0,3]=4 394 B6R0.4 C\C=C\CC(=N)N Amb25176208 [0,0,0,0,0,0|2,0,2]=4 395 B6R0.4 C\C=C\CC(=O)O Amb3941538 [0,0,0,0,0,0|0,0,2]=2 396 B6R0.4 C\C=C\CC(N)=O Amb26589975 [0,0,0,0,0,0|1,0,2]=3 397 B6R0.4 C\C=C\CS(=O)[O-] Amb26887775 [0,0,0,0,0,0|1,0,3]=4 398 B6R0.4 C\C=C\C[C@H](C)O Amb27662307 [0,0,0,0,0,0|1,0,3]=4 399 B6R0.4 C\C=N\NC(N)=O Amb24351023 [0,0,0,0,0,0|3,0,1]=4 400 B6R0.4 C\N=C\CC(C)=O Amb28202181 [0,0,0,0,0,0|2,0,1]=3 401 B6R0.4 ClCCC=C(Cl)Cl Amb27882644 [0,0,0,0,0,0|3,0,1]=4 402 B6R0.4 ClCCCC(Cl)Cl Amb25343250 [0,0,0,0,0,0|3,0,1]=4 403 B6R0.4 ClCCC[SiH](Cl)Cl Amb27831288 [0,0,0,0,0,0|3,1,0]=4 404 B6R0.4 FC(F)=CCCBr Amb10839379 [0,0,0,0,0,0|3,0,1]=4 405 B6R0.4 FC(F)=CCCCl Amb19895470 [0,0,0,0,0,0|3,0,1]=4 406 B6R0.4 FC(F)CCCBr Amb27816901 [0,0,0,0,0,0|3,0,1]=4 407 B6R0.4 FC(F)CCCCl Amb32688139 [0,0,0,0,0,0|3,0,1]=4 408 B6R0.4 FC(F)CCCI Amb35636651 [0,0,0,0,0,0|3,0,1]=4 409 B6R0.4 FC(F)CCCS Amb32812927 [0,0,0,0,0,0|3,0,1]=4 410 B6R0.4 N#CCCC(=O)Cl Amb25106570 [0,0,0,0,0,0|2,0,1]=3 411 B6R0.4 N#CCCC(=O)O Amb2694975 [0,0,0,0,0,0|1,0,1]=2 412 B6R0.4 N#CCCC(N)=O Amb8841150 [0,0,0,0,0,0|2,0,1]=3 413 B6R0.4 N#CCCS(=O)Cl Amb32720334 [0,0,0,0,0,0|3,0,1]=4 414 B6R0.4 N#CCCS(=O)[O-] Amb32754806 [0,0,0,0,0,0|2,0,2]=4 415 B6R0.4 N#CCCS(N)=O Amb32720335 [0,0,0,0,0,0|3,0,1]=4 416 B6R0.4 N#CCNC(N)=O Amb20622301 [0,0,0,0,0,0|3,0,1]=4 417 B6R0.4 N#C\C=C\C(=O)O Amb25853809 [0,0,0,0,0,0|1,0,3]=4 418 B6R0.4 N=C(N)CCCBr Amb4297022 [0,0,0,0,0,0|3,0,0]=3 419 B6R0.4 N=C(N)CCCCl Amb4297061 [0,0,0,0,0,0|3,0,0]=3 420 B6R0.4 N=C(N)CCCF Amb27231400 [0,0,0,0,0,0|3,0,0]=3 421 B6R0.4 N=C(N)CCCN Amb25888970 [0,0,0,0,0,0|3,0,0]=3 422 B6R0.4 N=C(N)CCCN Amb33299271 [0,0,0,0,0,0|3,0,0]=3 423 B6R0.4 N=C(N)CCCO Amb33038287 [0,0,0,0,0,0|3,0,0]=3 424 B6R0.4 N=C(N)NCCN Amb27815372 [0,0,0,0,0,0|4,0,0]=4 425 B6R0.4 N=C(N)NCCN Amb28827645 [0,0,0,0,0,0|4,0,0]=4 426 B6R0.4 N=C(N)NCCO Amb16231403 [0,0,0,0,0,0|4,0,0]=4 427 B6R0.4 N=C(N)NCCO Amb6429694 [0,0,0,0,0,0|4,0,0]=4 428 B6R0.4 N=C(N)SCCCl Amb28282677 [0,0,0,0,0,0|4,0,0]=4 429 B6R0.4 N=C(N)SCCN Amb1146037 [0,0,0,0,0,0|4,0,0]=4 430 B6R0.4 N=C(N)SCCN Amb3940706 [0,0,0,0,0,0|4,0,0]=4 431 B6R0.4 N=C(N)SCCO Amb1160204 [0,0,0,0,0,0|4,0,0]=4 432 B6R0.4 N=C(N)SCCO Amb34916582 [0,0,0,0,0,0|4,0,0]=4 433 B6R0.4 N=CNCC(=O)Cl Amb27216499 [0,0,0,0,0,0|3,0,1]=4 434 B6R0.4 N=CNCC(=O)O Amb24670244 [0,0,0,0,0,0|2,0,1]=3 435 B6R0.4 NC(=O)CCCCl Amb1138237 [0,0,0,0,0,0|2,0,0]=2 436 B6R0.4 NC(=O)CCCF Amb28073400 [0,0,0,0,0,0|2,0,0]=2 437 B6R0.4 NC(=O)CCCO Amb20623438 [0,0,0,0,0,0|2,0,0]=2 438 B6R0.4 NC(=O)CCCS Amb27174778 [0,0,0,0,0,0|2,0,0]=2 439 B6R0.4 NC(=O)CN=C=S Amb6673216 [0,0,0,0,0,0|3,0,1]=4 440 B6R0.4 NC(=O)C\C=C/Cl Amb27593169 [0,0,0,0,0,0|2,0,2]=4 441 B6R0.4 NC(=O)NCCBr Amb28385599 [0,0,0,0,0,0|3,0,0]=3 442 B6R0.4 NC(=O)NCCF Amb27446994 [0,0,0,0,0,0|3,0,0]=3 443 B6R0.4 NC(=O)NCCI Amb27454955 [0,0,0,0,0,0|3,0,0]=3 444 B6R0.4 NC(=O)NCCO Amb1146041 [0,0,0,0,0,0|3,0,0]=3 445 B6R0.4 NC(=O)OCCCl Amb3940645 [0,0,0,0,0,0|3,0,0]=3 446 B6R0.4 NC(=O)OCCO Amb20623788 [0,0,0,0,0,0|3,0,0]=3 447 B6R0.4 NC(=O)SCCCl Amb27619850 [0,0,0,0,0,0|3,0,0]=3 448 B6R0.4 NC(=S)CCCBr Amb33328371 [0,0,0,0,0,0|2,1,0]=3 449 B6R0.4 NC(=S)CCCCl Amb33328364 [0,0,0,0,0,0|2,1,0]=3 450 B6R0.4 NC(=S)CCCO Amb9215001 [0,0,0,0,0,0|2,1,0]=3 451 B6R0.4 NC(=S)NCCBr Amb27760395 [0,0,0,0,0,0|3,1,0]=4 452 B6R0.4 NC(=S)NCCF Amb26580655 [0,0,0,0,0,0|3,1,0]=4 453 B6R0.4 NC(=S)NCCO Amb19515723 [0,0,0,0,0,0|3,1,0]=4 454 B6R0.4 NC(=S)NCCS Amb19374848 [0,0,0,0,0,0|3,1,0]=4 455 B6R0.4 NC(N)=NCCO Amb19374418 [0,0,0,0,0,0|4,0,0]=4 456 B6R0.4 NC(N)=NCCS Amb25127300 [0,0,0,0,0,0|4,0,0]=4 457 B6R0.4 NCC#CC(=O)O Amb25703096 [0,0,0,0,0,0|1,0,2]=3 458 B6R0.4 NCC#CC(=O)O Amb32666878 [0,0,0,0,0,0|1,0,2]=3 459 B6R0.4 NCCCB(O)O Amb25878196 [0,0,0,0,0,0|2,0,1]=3 460 B6R0.4 NCCCB(O)O Amb33339111 [0,0,0,0,0,0|2,0,1]=3 461 B6R0.4 NCCCC(=O)Cl Amb1935063 [0,0,0,0,0,0|2,0,0]=2 462 B6R0.4 NCCCC(=O)O Amb1935210 [0,0,0,0,0,0|1,0,0]=1 463 B6R0.4 NCCCC(F)F Amb20670479 [0,0,0,0,0,0|3,0,1]=4 464 B6R0.4 NCCCC(F)F Amb27763708 [0,0,0,0,0,0|3,0,1]=4 465 B6R0.4 NCCCC(N)=O Amb2099583 [0,0,0,0,0,0|2,0,0]=2 466 B6R0.4 NCCCC(N)=O Amb6543438 [0,0,0,0,0,0|2,0,0]=2 467 B6R0.4 NCCCS(=O)O Amb25185942 [0,0,0,0,0,0|2,0,0]=2 468 B6R0.4 NCCC[N+](=O)[O-] Amb18833132 [0,0,0,0,0,0|2,0,1]=3 469 B6R0.4 NCCC[PH](=O)O Amb22370049 [0,0,0,0,0,0|2,0,0]=2 470 B6R0.4 NCCNB(O)O Amb28074068 [0,0,0,0,0,0|3,0,1]=4 471 B6R0.4 NCCNC(N)=O Amb19374121 [0,0,0,0,0,0|3,0,0]=3 472 B6R0.4 NCCNC(N)=O Amb32665340 [0,0,0,0,0,0|3,0,0]=3 473 B6R0.4 NCCNC(N)=O Amb6254968 [0,0,0,0,0,0|3,0,0]=3 474 B6R0.4 NCCNC(N)=S Amb20619929 [0,0,0,0,0,0|3,1,0]=4 475 B6R0.4 NCCOB(O)O Amb27257443 [0,0,0,0,0,0|3,0,1]=4 476 B6R0.4 NCCOC(N)=O Amb22059480 [0,0,0,0,0,0|3,0,0]=3 477 B6R0.4 NCCOC(N)=O Amb24271076 [0,0,0,0,0,0|3,0,0]=3 478 B6R0.4 NCCOP(O)O Amb28184361 [0,0,0,0,0,0|3,0,1]=4 479 B6R0.4 NCCOS(=O)O Amb25843211 [0,0,0,0,0,0|3,0,0]=3 480 B6R0.4 NCCO[PH](=O)O Amb28046334 [0,0,0,0,0,0|3,0,0]=3 481 B6R0.4 NCCSC(=S)S Amb27407724 [0,0,0,0,0,0|2,2,0]=4 482 B6R0.4 NC\C=C/C(=O)O Amb24117018 [0,0,0,0,0,0|1,0,2]=3 483 B6R0.4 NC\C=C\C(=O)O Amb33422010 [0,0,0,0,0,0|1,0,2]=3 484 B6R0.4 NC\C=C\C(=O)O Amb33422035 [0,0,0,0,0,0|1,0,2]=3 485 B6R0.4 NNCCC(=O)O Amb33756816 [0,0,0,0,0,0|2,0,0]=2 486 B6R0.4 NNCO[PH](=O)O Amb28239913 [0,0,0,0,0,0|4,0,0]=4 487 B6R0.4 NOCCC(=O)O Amb17569891 [0,0,0,0,0,0|2,0,0]=2 488 B6R0.4 NOCCC(=O)O Amb32693437 [0,0,0,0,0,0|2,0,0]=2 489 B6R0.4 NOCCC(N)=O Amb27838275 [0,0,0,0,0,0|3,0,0]=3 490 B6R0.4 NS(=O)CCCBr Amb32720400 [0,0,0,0,0,0|3,0,0]=3 491 B6R0.4 NS(=O)CCCCl Amb32720303 [0,0,0,0,0,0|3,0,0]=3 492 B6R0.4 NS(=O)CCCF Amb32720390 [0,0,0,0,0,0|3,0,0]=3 493 B6R0.4 O=C(Br)CCCBr Amb25724818 [0,0,0,0,0,0|2,0,0]=2 494 B6R0.4 O=C(Cl)CCCBr Amb3940241 [0,0,0,0,0,0|2,0,0]=2 495 B6R0.4 O=C(Cl)CCCCl Amb6608638 [0,0,0,0,0,0|2,0,0]=2 496 B6R0.4 O=C(Cl)NCCBr Amb28123956 [0,0,0,0,0,0|3,0,0]=3 497 B6R0.4 O=C(Cl)NCCCl Amb24479815 [0,0,0,0,0,0|3,0,0]=3 498 B6R0.4 O=C(Cl)NCCF Amb35633248 [0,0,0,0,0,0|3,0,0]=3 499 B6R0.4 O=C(Cl)OCCBr Amb8514406 [0,0,0,0,0,0|3,0,0]=3 500 B6R0.4 O=C(Cl)OCCCl Amb6608837 [0,0,0,0,0,0|3,0,0]=3 501 B6R0.4 O=C(Cl)OCCF Amb21618836 [0,0,0,0,0,0|3,0,0]=3 502 B6R0.4 O=C(Cl)\C=C\CCl Amb33294776 [0,0,0,0,0,0|2,0,2]=4 503 B6R0.4 O=C(O)C#CCCl Amb33544591 [0,0,0,0,0,0|1,0,2]=3 504 B6R0.4 O=C(O)C#CCI Amb27860307 [0,0,0,0,0,0|1,0,2]=3 505 B6R0.4 O=C(O)C#CCO Amb22002375 [0,0,0,0,0,0|1,0,2]=3 506 B6R0.4 O=C(O)CCCBr Amb8393276 [0,0,0,0,0,0|1,0,0]=1 507 B6R0.4 O=C(O)CCCCl Amb3940333 [0,0,0,0,0,0|1,0,0]=1 508 B6R0.4 O=C(O)CCCF Amb17593104 [0,0,0,0,0,0|1,0,0]=1 509 B6R0.4 O=C(O)CCCI Amb22295911 [0,0,0,0,0,0|1,0,0]=1 510 B6R0.4 O=C(O)CCCO Amb18640332 [0,0,0,0,0,0|1,0,0]=1 511 B6R0.4 O=C(O)CCCS Amb16185429 [0,0,0,0,0,0|1,0,0]=1 512 B6R0.4 O=C(O)CCNO Amb28067767 [0,0,0,0,0,0|2,0,0]=2 513 B6R0.4 O=C(O)CCSCl Amb28387511 [0,0,0,0,0,0|2,0,0]=2 514 B6R0.4 O=C(O)COCF Amb33378705 [0,0,0,0,0,0|2,0,0]=2 515 B6R0.4 O=C(O)CPCO Amb28340565 [0,0,0,0,0,0|2,0,0]=2 516 B6R0.4 O=C(O)CSSCl Amb27477882 [0,0,0,0,0,0|3,0,0]=3 517 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [0,0,0,0,0,0|1,0,2]=3 518 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [0,0,0,0,0,0|1,0,2]=3 519 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [0,0,0,0,0,0|1,0,2]=3 520 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [0,0,0,0,0,0|1,0,2]=3 521 B6R0.4 O=C(O)\C=C\CF Amb33470171 [0,0,0,0,0,0|1,0,2]=3 522 B6R0.4 O=C(O)\C=C\CO Amb32662006 [0,0,0,0,0,0|1,0,2]=3 523 B6R0.4 O=C(S)NCCO Amb27430045 [0,0,0,0,0,0|2,1,0]=3 524 B6R0.4 O=C([O-])CCCO Amb3429667 [0,0,0,0,0,0|1,0,1]=2 525 B6R0.4 O=C([O-])CNCO Amb8383630 [0,0,0,0,0,0|2,0,1]=3 526 B6R0.4 O=C([O-])\C=C\CO Amb33542275 [0,0,0,0,0,0|1,0,3]=4 527 B6R0.4 O=CCCC(=O)O Amb17673897 [0,0,0,0,0,0|1,0,1]=2 528 B6R0.4 O=CCCC(O)O Amb27838257 [0,0,0,0,0,0|1,0,3]=4 529 B6R0.4 O=CCC[N+](=O)[O-] Amb24052990 [0,0,0,0,0,0|2,0,2]=4 530 B6R0.4 O=CNCC(=O)O Amb1911508 [0,0,0,0,0,0|2,0,1]=3 531 B6R0.4 O=COCC(=O)O Amb26624011 [0,0,0,0,0,0|2,0,1]=3 532 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [0,0,0,0,0,0|1,0,3]=4 533 B6R0.4 O=S(Br)OCCCl Amb28422386 [0,0,0,0,0,0|4,0,0]=4 534 B6R0.4 O=S(Cl)CCCBr Amb32720399 [0,0,0,0,0,0|3,0,0]=3 535 B6R0.4 O=S(Cl)CCCCl Amb25791632 [0,0,0,0,0,0|3,0,0]=3 536 B6R0.4 O=S(Cl)CCCF Amb32720389 [0,0,0,0,0,0|3,0,0]=3 537 B6R0.4 O=S(Cl)OCCCl Amb27975786 [0,0,0,0,0,0|4,0,0]=4 538 B6R0.4 O=S(O)COCO Amb27410575 [0,0,0,0,0,0|3,0,0]=3 539 B6R0.4 O=S(O)OCCCl Amb27786730 [0,0,0,0,0,0|3,0,0]=3 540 B6R0.4 O=S([O-])CCCBr Amb32754123 [0,0,0,0,0,0|2,0,1]=3 541 B6R0.4 O=S([O-])CCCCl Amb26370094 [0,0,0,0,0,0|2,0,1]=3 542 B6R0.4 O=S([O-])CCCF Amb32754093 [0,0,0,0,0,0|2,0,1]=3 543 B6R0.4 O=S([O-])CCCO Amb27221257 [0,0,0,0,0,0|2,0,1]=3 544 B6R0.4 O=[N+]([O-])CCCCl Amb25267487 [0,0,0,0,0,0|2,0,1]=3 545 B6R0.4 O=[N+]([O-])CCCF Amb25234942 [0,0,0,0,0,0|2,0,1]=3 546 B6R0.4 O=[N+]([O-])CCCO Amb20247690 [0,0,0,0,0,0|2,0,1]=3 547 B6R0.4 O=[N+]([O-])NCCO Amb17618377 [0,0,0,0,0,0|3,0,1]=4 548 B6R0.4 O=[N+]([O-])OCCCl Amb27963893 [0,0,0,0,0,0|3,0,1]=4 549 B6R0.4 O=[PH](O)CCCO Amb28345330 [0,0,0,0,0,0|2,0,0]=2 550 B6R0.4 O=[PH](S)OCCO Amb27981751 [0,0,0,0,0,0|3,1,0]=4 551 B6R0.4 OB(O)CCCBr Amb24480413 [0,0,0,0,0,0|2,0,1]=3 552 B6R0.4 OB(O)CCCCl Amb28347311 [0,0,0,0,0,0|2,0,1]=3 553 B6R0.4 OB(O)CCNCl Amb27978905 [0,0,0,0,0,0|3,0,1]=4 554 B6R0.4 OCCC=C(Cl)Cl Amb17593563 [0,0,0,0,0,0|3,0,1]=4 555 B6R0.4 OCCCB(O)O Amb27391604 [0,0,0,0,0,0|2,0,1]=3 556 B6R0.4 OCCCC(F)F Amb26940819 [0,0,0,0,0,0|3,0,1]=4 557 B6R0.4 OCCOP(O)O Amb28283645 [0,0,0,0,0,0|3,0,1]=4 558 B6R0.4 OP(O)OCCCl Amb27469023 [0,0,0,0,0,0|3,0,1]=4 559 B6R0.4 [C-]#[N+]CCC(=C)C Amb33199608 [0,0,0,0,0,0|3,0,1]=4 560 B6R0.4 [N-]=[N+]=NCC(=O)Cl Amb27267972 [0,0,0,0,0,0|4,0,0]=4 561 B6R0.4 [N-]=[N+]=NCC(=O)F Amb27187200 [0,0,0,0,0,0|4,0,0]=4 562 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [0,0,0,0,0,0|3,0,0]=3 563 B6R0.4 [N-]=[N+]=NCC(=O)[O-] Amb32662603 [0,0,0,0,0,0|3,0,1]=4 564 B6R0.4 [N-]=[N+]=NCC(N)=O Amb26393051 [0,0,0,0,0,0|4,0,0]=4 565 B5R0.1 BC(=O)NCC Amb27430059 [1,0,0,0,0,0|2,0,0]=3 566 B5R0.1 C#CCC(=O)O Amb33532662 [1,0,0,0,0,0|0,0,2]=3 567 B5R0.1 C=C(Br)CCBr Amb25827098 [1,0,0,0,0,0|3,0,0]=4 568 B5R0.1 C=C(Br)CCCl Amb8391241 [1,0,0,0,0,0|3,0,0]=4 569 B5R0.1 C=C(Br)CCO Amb4014497 [1,0,0,0,0,0|3,0,0]=4 570 B5R0.1 C=C(Br)CNC Amb18950247 [1,0,0,0,0,0|3,0,0]=4 571 B5R0.1 C=C(Br)COC Amb25361496 [1,0,0,0,0,0|3,0,0]=4 572 B5R0.1 C=C(Br)CSC Amb28313326 [1,0,0,0,0,0|3,0,0]=4 573 B5R0.1 C=C(C)CCBr Amb21857866 [1,0,0,0,0,0|3,0,0]=4 574 B5R0.1 C=C(C)CCC Amb8513259 [1,0,0,0,0,0|2,0,0]=3 575 B5R0.1 C=C(C)CCCl Amb27810807 [1,0,0,0,0,0|3,0,0]=4 576 B5R0.1 C=C(C)CCI Amb26649317 [1,0,0,0,0,0|3,0,0]=4 577 B5R0.1 C=C(C)CCN Amb17673481 [1,0,0,0,0,0|3,0,0]=4 578 B5R0.1 C=C(C)CCN Amb33543001 [1,0,0,0,0,0|3,0,0]=4 579 B5R0.1 C=C(C)CCO Amb34916534 [1,0,0,0,0,0|3,0,0]=4 580 B5R0.1 C=C(C)CCO Amb8513522 [1,0,0,0,0,0|3,0,0]=4 581 B5R0.1 C=C(C)CCS Amb25887673 [1,0,0,0,0,0|3,0,0]=4 582 B5R0.1 C=C(C)CNC Amb30625043 [1,0,0,0,0,0|3,0,0]=4 583 B5R0.1 C=C(C)CNC Amb3941317 [1,0,0,0,0,0|3,0,0]=4 584 B5R0.1 C=C(C)COC Amb26589016 [1,0,0,0,0,0|3,0,0]=4 585 B5R0.1 C=C(C)CSC Amb20671946 [1,0,0,0,0,0|3,0,0]=4 586 B5R0.1 C=C(C)OCC Amb8393241 [1,0,0,0,0,0|3,0,0]=4 587 B5R0.1 C=C(Cl)CCI Amb28187982 [1,0,0,0,0,0|3,0,0]=4 588 B5R0.1 C=C(Cl)CCN Amb27493165 [1,0,0,0,0,0|3,0,0]=4 589 B5R0.1 C=C(F)CNC Amb28194424 [1,0,0,0,0,0|3,0,0]=4 590 B5R0.1 C=CCC(=O)Cl Amb33543701 [1,0,0,0,0,0|1,0,2]=4 591 B5R0.1 C=CCC(=O)O Amb3940098 [1,0,0,0,0,0|0,0,2]=3 592 B5R0.1 C=CCC(C)=O Amb8396482 [1,0,0,0,0,0|1,0,2]=4 593 B5R0.1 C=CCC(N)=O Amb17610156 [1,0,0,0,0,0|1,0,2]=4 594 B5R0.1 C=CCS(=O)O Amb33534190 [1,0,0,0,0,0|1,0,2]=4 595 B5R0.1 C=CC[PH](=O)O Amb8391287 [1,0,0,0,0,0|1,0,2]=4 596 B5R0.1 C=NCC(N)=O Amb26548445 [1,0,0,0,0,0|2,0,1]=4 597 B5R0.1 CC#CC(=O)Cl Amb27778056 [1,0,0,0,0,0|1,0,2]=4 598 B5R0.1 CC#CC(=O)O Amb2685714 [1,0,0,0,0,0|0,0,2]=3 599 B5R0.1 CC#CC(C)=O Amb17593016 [1,0,0,0,0,0|1,0,2]=4 600 B5R0.1 CC#CC(N)=O Amb10552409 [1,0,0,0,0,0|1,0,2]=4 601 B5R0.1 CC(=O)CC#N Amb1102132 [1,0,0,0,0,0|2,0,1]=4 602 B5R0.1 CC(=O)CC=N Amb28285098 [1,0,0,0,0,0|2,0,1]=4 603 B5R0.1 CC(=O)CCBr Amb24078246 [1,0,0,0,0,0|2,0,0]=3 604 B5R0.1 CC(=O)CCCl Amb2720823 [1,0,0,0,0,0|2,0,0]=3 605 B5R0.1 CC(=O)CCF Amb26427773 [1,0,0,0,0,0|2,0,0]=3 606 B5R0.1 CC(=O)CCN Amb18632933 [1,0,0,0,0,0|2,0,0]=3 607 B5R0.1 CC(=O)CCN Amb33544540 [1,0,0,0,0,0|2,0,0]=3 608 B5R0.1 CC(=O)CCO Amb836357 [1,0,0,0,0,0|2,0,0]=3 609 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [1,0,0,0,0,0|2,0,0]=3 610 B5R0.1 CC(=O)CNO Amb28049954 [1,0,0,0,0,0|3,0,0]=4 611 B5R0.1 CC(=O)CSN Amb28430346 [1,0,0,0,0,0|3,0,0]=4 612 B5R0.1 CC(=O)NCO Amb8516057 [1,0,0,0,0,0|3,0,0]=4 613 B5R0.1 CC(=O)OCBr Amb3941481 [1,0,0,0,0,0|3,0,0]=4 614 B5R0.1 CC(=O)OCCl Amb33542858 [1,0,0,0,0,0|3,0,0]=4 615 B5R0.1 CC(=O)OCI Amb25226851 [1,0,0,0,0,0|3,0,0]=4 616 B5R0.1 CC(=O)SCBr Amb25349900 [1,0,0,0,0,0|3,0,0]=4 617 B5R0.1 CC(=O)SCI Amb33339258 [1,0,0,0,0,0|3,0,0]=4 618 B5R0.1 CC(=O)SCO Amb27255261 [1,0,0,0,0,0|3,0,0]=4 619 B5R0.1 CC(O)CCBr Amb33548043 [1,0,0,0,0,0|2,0,1]=4 620 B5R0.1 CC(O)CCCl Amb24551052 [1,0,0,0,0,0|2,0,1]=4 621 B5R0.1 CC(O)CCF Amb26449397 [1,0,0,0,0,0|2,0,1]=4 622 B5R0.1 CC(O)CCN Amb32666140 [1,0,0,0,0,0|2,0,1]=4 623 B5R0.1 CC(O)CCN Amb33537908 [1,0,0,0,0,0|2,0,1]=4 624 B5R0.1 CC(O)CCO Amb6608662 [1,0,0,0,0,0|2,0,1]=4 625 B5R0.1 CCC=C(Br)Br Amb25887651 [1,0,0,0,0,0|2,0,1]=4 626 B5R0.1 CCC=C(C)C Amb22336412 [1,0,0,0,0,0|2,0,1]=4 627 B5R0.1 CCC=C(F)F Amb10839842 [1,0,0,0,0,0|2,0,1]=4 628 B5R0.1 CCCB(O)O Amb2447105 [1,0,0,0,0,0|1,0,1]=3 629 B5R0.1 CCCC(=N)N Amb10610381 [1,0,0,0,0,0|2,0,0]=3 630 B5R0.1 CCCC(=N)N Amb2695914 [1,0,0,0,0,0|2,0,0]=3 631 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,0,0,0,0|1,0,0]=2 632 B5R0.1 CCCC(=O)Cl Amb2792903 [1,0,0,0,0,0|1,0,0]=2 633 B5R0.1 CCCC(=O)O Amb3939012 [1,0,0,0,0,0|0,0,0]=1 634 B5R0.1 CCCC(=O)[O-] Amb8514901 [1,0,0,0,0,0|0,0,1]=2 635 B5R0.1 CCCC(=S)Cl Amb24626931 [1,0,0,0,0,0|1,1,0]=3 636 B5R0.1 CCCC(Br)Br Amb27801326 [1,0,0,0,0,0|2,0,1]=4 637 B5R0.1 CCCC(C)=O Amb6608910 [1,0,0,0,0,0|1,0,0]=2 638 B5R0.1 CCCC(C)Br Amb3940201 [1,0,0,0,0,0|2,0,1]=4 639 B5R0.1 CCCC(C)Cl Amb4018346 [1,0,0,0,0,0|2,0,1]=4 640 B5R0.1 CCCC(C)I Amb17939400 [1,0,0,0,0,0|2,0,1]=4 641 B5R0.1 CCCC(C)N Amb10609075 [1,0,0,0,0,0|2,0,1]=4 642 B5R0.1 CCCC(C)N Amb3941259 [1,0,0,0,0,0|2,0,1]=4 643 B5R0.1 CCCC(C)O Amb4605839 [1,0,0,0,0,0|1,0,1]=3 644 B5R0.1 CCCC(C)S Amb7784731 [1,0,0,0,0,0|1,1,1]=4 645 B5R0.1 CCCC(Cl)Br Amb27657591 [1,0,0,0,0,0|2,0,1]=4 646 B5R0.1 CCCC(Cl)Cl Amb25062516 [1,0,0,0,0,0|2,0,1]=4 647 B5R0.1 CCCC(F)Br Amb27856781 [1,0,0,0,0,0|2,0,1]=4 648 B5R0.1 CCCC(N)=O Amb3886524 [1,0,0,0,0,0|1,0,0]=2 649 B5R0.1 CCCC(N)=S Amb6245403 [1,0,0,0,0,0|1,1,0]=3 650 B5R0.1 CCCC(N)=[NH2+] Amb8384484 [1,0,0,0,0,0|2,0,0]=3 651 B5R0.1 CCCC(O)=S Amb22229383 [1,0,0,0,0,0|0,1,0]=2 652 B5R0.1 CCCC(O)Cl Amb22552567 [1,0,0,0,0,0|1,0,1]=3 653 B5R0.1 CCCC(O)O Amb26364594 [1,0,0,0,0,0|0,0,2]=3 654 B5R0.1 CCCN(C)C Amb22733186 [1,0,0,0,0,0|3,0,0]=4 655 B5R0.1 CCCN(C)O Amb25024622 [1,0,0,0,0,0|2,0,0]=3 656 B5R0.1 CCCP(Cl)Cl Amb22053969 [1,0,0,0,0,0|3,0,0]=4 657 B5R0.1 CCCS(=O)Cl Amb25025566 [1,0,0,0,0,0|2,0,0]=3 658 B5R0.1 CCCS(=O)[O-] Amb19929119 [1,0,0,0,0,0|1,0,1]=3 659 B5R0.1 CCCS(N)=O Amb24733579 [1,0,0,0,0,0|2,0,0]=3 660 B5R0.1 CCC[C@@H](C)N Amb22898992 [1,0,0,0,0,0|2,0,1]=4 661 B5R0.1 CCC[C@@H](C)N Amb23439500 [1,0,0,0,0,0|2,0,1]=4 662 B5R0.1 CCC[C@@H](C)O Amb8628178 [1,0,0,0,0,0|1,0,1]=3 663 B5R0.1 CCC[C@@H](N)O Amb28074861 [1,0,0,0,0,0|1,0,1]=3 664 B5R0.1 CCC[C@H](C)Br Amb27650565 [1,0,0,0,0,0|2,0,1]=4 665 B5R0.1 CCC[C@H](C)N Amb21618754 [1,0,0,0,0,0|2,0,1]=4 666 B5R0.1 CCC[C@H](C)N Amb31204590 [1,0,0,0,0,0|2,0,1]=4 667 B5R0.1 CCC[C@H](C)O Amb8389338 [1,0,0,0,0,0|1,0,1]=3 668 B5R0.1 CCC[N+](=O)[O-] Amb8513268 [1,0,0,0,0,0|1,0,1]=3 669 B5R0.1 CCNC(=N)N Amb21964689 [1,0,0,0,0,0|3,0,0]=4 670 B5R0.1 CCNC(=N)N Amb22053912 [1,0,0,0,0,0|3,0,0]=4 671 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,0,0,0,0|2,0,0]=3 672 B5R0.1 CCNC(=S)S Amb26505127 [1,0,0,0,0,0|1,2,0]=4 673 B5R0.1 CCNC(C)=O Amb2780415 [1,0,0,0,0,0|2,0,0]=3 674 B5R0.1 CCNC(N)=O Amb6608844 [1,0,0,0,0,0|2,0,0]=3 675 B5R0.1 CCNC(N)=S Amb6608838 [1,0,0,0,0,0|2,1,0]=4 676 B5R0.1 CCNC(N)=[NH2+] Amb22734753 [1,0,0,0,0,0|3,0,0]=4 677 B5R0.1 CCOB(O)O Amb27221375 [1,0,0,0,0,0|2,0,1]=4 678 B5R0.1 CCOC(=N)N Amb16231402 [1,0,0,0,0,0|3,0,0]=4 679 B5R0.1 CCOC(=N)N Amb27173000 [1,0,0,0,0,0|3,0,0]=4 680 B5R0.1 CCOC(=O)Cl Amb2793045 [1,0,0,0,0,0|2,0,0]=3 681 B5R0.1 CCOC(=O)O Amb8393208 [1,0,0,0,0,0|1,0,0]=2 682 B5R0.1 CCOC(=S)Cl Amb26030825 [1,0,0,0,0,0|2,1,0]=4 683 B5R0.1 CCOC(=S)[S-] Amb22729921 [1,0,0,0,0,0|1,2,0]=4 684 B5R0.1 CCOC(=S)[S-] Amb8480129 [1,0,0,0,0,0|1,2,0]=4 685 B5R0.1 CCOC(C)=N Amb8394853 [1,0,0,0,0,0|3,0,0]=4 686 B5R0.1 CCOC(C)=N Amb8514666 [1,0,0,0,0,0|3,0,0]=4 687 B5R0.1 CCOC(C)=O Amb3940488 [1,0,0,0,0,0|2,0,0]=3 688 B5R0.1 CCOC(C)=S Amb22047276 [1,0,0,0,0,0|2,1,0]=4 689 B5R0.1 CCOC(N)=O Amb6608672 [1,0,0,0,0,0|2,0,0]=3 690 B5R0.1 CCOC(N)=S Amb10241338 [1,0,0,0,0,0|2,1,0]=4 691 B5R0.1 CCOS(=O)Cl Amb25239825 [1,0,0,0,0,0|3,0,0]=4 692 B5R0.1 CCO[N+](=O)[O-] Amb22732543 [1,0,0,0,0,0|2,0,1]=4 693 B5R0.1 CCO[PH](=O)O Amb22360741 [1,0,0,0,0,0|2,0,0]=3 694 B5R0.1 CCO[PH](=O)[O-] Amb22731647 [1,0,0,0,0,0|2,0,1]=4 695 B5R0.1 CCO[Si](=O)O Amb26569259 [1,0,0,0,0,0|1,1,0]=3 696 B5R0.1 CCSC(=N)N Amb16205363 [1,0,0,0,0,0|3,0,0]=4 697 B5R0.1 CCSC(=N)N Amb8393903 [1,0,0,0,0,0|3,0,0]=4 698 B5R0.1 CCSC(=N)[NH3+] Amb24113877 [1,0,0,0,0,0|3,0,0]=4 699 B5R0.1 CCSC(=O)Cl Amb8516064 [1,0,0,0,0,0|2,0,0]=3 700 B5R0.1 CCSC(=S)[S-] Amb27247124 [1,0,0,0,0,0|1,2,0]=4 701 B5R0.1 CCSC(C)=S Amb8394854 [1,0,0,0,0,0|2,1,0]=4 702 B5R0.1 CCSC(N)=S Amb25969673 [1,0,0,0,0,0|2,1,0]=4 703 B5R0.1 CC[O+]=C(N)N Amb22492446 [1,0,0,0,0,0|3,0,0]=4 704 B5R0.1 CN(O)CCCl Amb27473361 [1,0,0,0,0,0|3,0,0]=4 705 B5R0.1 CN(O)CCF Amb33377280 [1,0,0,0,0,0|3,0,0]=4 706 B5R0.1 CNCC(=O)O Amb6298808 [1,0,0,0,0,0|1,0,0]=2 707 B5R0.1 CNCC(=O)O Amb6599996 [1,0,0,0,0,0|1,0,0]=2 708 B5R0.1 CNCC(=O)[O-] Amb20246714 [1,0,0,0,0,0|1,0,1]=3 709 B5R0.1 CNCC(C)=O Amb17621974 [1,0,0,0,0,0|2,0,0]=3 710 B5R0.1 CNCC(C)=O Amb21959975 [1,0,0,0,0,0|2,0,0]=3 711 B5R0.1 CNCC(C)O Amb32666238 [1,0,0,0,0,0|2,0,1]=4 712 B5R0.1 CNCC(C)O Amb9247471 [1,0,0,0,0,0|2,0,1]=4 713 B5R0.1 CNCC(N)=O Amb19134307 [1,0,0,0,0,0|2,0,0]=3 714 B5R0.1 CNCC(N)=O Amb3940074 [1,0,0,0,0,0|2,0,0]=3 715 B5R0.1 CNCC(N)=O Amb9151172 [1,0,0,0,0,0|2,0,0]=3 716 B5R0.1 CNC[C@@H](C)O Amb26972484 [1,0,0,0,0,0|2,0,1]=4 717 B5R0.1 CNC[C@@H](C)O Amb32652763 [1,0,0,0,0,0|2,0,1]=4 718 B5R0.1 CNC[C@H](C)O Amb27596614 [1,0,0,0,0,0|2,0,1]=4 719 B5R0.1 CNC[C@H](C)O Amb32652861 [1,0,0,0,0,0|2,0,1]=4 720 B5R0.1 CNOC(N)=O Amb28341734 [1,0,0,0,0,0|3,0,0]=4 721 B5R0.1 COCB(O)O Amb28401589 [1,0,0,0,0,0|2,0,1]=4 722 B5R0.1 COCC(=N)N Amb2696281 [1,0,0,0,0,0|3,0,0]=4 723 B5R0.1 COCC(=N)N Amb33551686 [1,0,0,0,0,0|3,0,0]=4 724 B5R0.1 COCC(=O)Cl Amb3939326 [1,0,0,0,0,0|2,0,0]=3 725 B5R0.1 COCC(=O)O Amb3939876 [1,0,0,0,0,0|1,0,0]=2 726 B5R0.1 COCC(C)=O Amb8513767 [1,0,0,0,0,0|2,0,0]=3 727 B5R0.1 COCC(C)O Amb33544397 [1,0,0,0,0,0|2,0,1]=4 728 B5R0.1 COCC(N)=O Amb1153776 [1,0,0,0,0,0|2,0,0]=3 729 B5R0.1 COCC(N)=S Amb6268129 [1,0,0,0,0,0|2,1,0]=4 730 B5R0.1 COC[C@@H](C)O Amb8383545 [1,0,0,0,0,0|2,0,1]=4 731 B5R0.1 COC[C@H](C)O Amb8515770 [1,0,0,0,0,0|2,0,1]=4 732 B5R0.1 CONC(C)=O Amb25046114 [1,0,0,0,0,0|3,0,0]=4 733 B5R0.1 CONC(N)=O Amb2417193 [1,0,0,0,0,0|3,0,0]=4 734 B5R0.1 CS(=O)CCBr Amb28049280 [1,0,0,0,0,0|3,0,0]=4 735 B5R0.1 CS(=O)CCCl Amb24116979 [1,0,0,0,0,0|3,0,0]=4 736 B5R0.1 CS(=O)CCI Amb27752977 [1,0,0,0,0,0|3,0,0]=4 737 B5R0.1 CS(=O)CCN Amb2786559 [1,0,0,0,0,0|3,0,0]=4 738 B5R0.1 CS(=O)CCN Amb33543191 [1,0,0,0,0,0|3,0,0]=4 739 B5R0.1 CS(=O)CCO Amb28075364 [1,0,0,0,0,0|3,0,0]=4 740 B5R0.1 CSCC(=N)N Amb2696282 [1,0,0,0,0,0|3,0,0]=4 741 B5R0.1 CSCC(=N)N Amb8630183 [1,0,0,0,0,0|3,0,0]=4 742 B5R0.1 CSCC(=O)Cl Amb24528357 [1,0,0,0,0,0|2,0,0]=3 743 B5R0.1 CSCC(=O)O Amb1152425 [1,0,0,0,0,0|1,0,0]=2 744 B5R0.1 CSCC(C)=O Amb20621731 [1,0,0,0,0,0|2,0,0]=3 745 B5R0.1 CSCC(C)O Amb20622311 [1,0,0,0,0,0|2,0,1]=4 746 B5R0.1 CSCC(N)=O Amb19515874 [1,0,0,0,0,0|2,0,0]=3 747 B5R0.1 CSCC(N)=S Amb17503394 [1,0,0,0,0,0|2,1,0]=4 748 B5R0.1 CSCS(C)=O Amb22045140 [1,0,0,0,0,0|3,0,0]=4 749 B5R0.1 CSC[C@@H](C)O Amb24408899 [1,0,0,0,0,0|2,0,1]=4 750 B5R0.1 CSC[C@H](C)O Amb24699036 [1,0,0,0,0,0|2,0,1]=4 751 B5R0.1 CSNC(C)=O Amb22500292 [1,0,0,0,0,0|3,0,0]=4 752 B5R0.1 C[C@@H](O)CCBr Amb27392288 [1,0,0,0,0,0|2,0,1]=4 753 B5R0.1 C[C@@H](O)CCF Amb33376906 [1,0,0,0,0,0|2,0,1]=4 754 B5R0.1 C[C@@H](O)CCI Amb27594639 [1,0,0,0,0,0|2,0,1]=4 755 B5R0.1 C[C@@H](O)CCN Amb22736702 [1,0,0,0,0,0|2,0,1]=4 756 B5R0.1 C[C@@H](O)CCN Amb28555327 [1,0,0,0,0,0|2,0,1]=4 757 B5R0.1 C[C@@H](O)CCO Amb4166294 [1,0,0,0,0,0|2,0,1]=4 758 B5R0.1 C[C@H](O)CCBr Amb28367228 [1,0,0,0,0,0|2,0,1]=4 759 B5R0.1 C[C@H](O)CCF Amb33376900 [1,0,0,0,0,0|2,0,1]=4 760 B5R0.1 C[C@H](O)CCN Amb22736705 [1,0,0,0,0,0|2,0,1]=4 761 B5R0.1 C[C@H](O)CCN Amb34159890 [1,0,0,0,0,0|2,0,1]=4 762 B5R0.1 C[C@H](O)CCO Amb4166300 [1,0,0,0,0,0|2,0,1]=4 763 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [1,0,0,0,0,0|2,0,0]=3 764 B5R0.1 C\C(O)=C\CN Amb33294274 [1,0,0,0,0,0|2,0,1]=4 765 B5R0.1 C\C=C/C(=O)O Amb27779315 [1,0,0,0,0,0|0,0,2]=3 766 B5R0.1 C\C=C/C(C)=O Amb28351405 [1,0,0,0,0,0|1,0,2]=4 767 B5R0.1 C\C=C\C(=O)Br Amb25026006 [1,0,0,0,0,0|1,0,2]=4 768 B5R0.1 C\C=C\C(=O)Cl Amb8517577 [1,0,0,0,0,0|1,0,2]=4 769 B5R0.1 C\C=C\C(=O)O Amb8385856 [1,0,0,0,0,0|0,0,2]=3 770 B5R0.1 C\C=C\C(C)=O Amb33941980 [1,0,0,0,0,0|1,0,2]=4 771 B5R0.1 C\C=C\C(N)=O Amb4025906 [1,0,0,0,0,0|1,0,2]=4 772 B5R0.1 N#CCC(=O)Cl Amb17593096 [1,0,0,0,0,0|2,0,1]=4 773 B5R0.1 N#CCC(=O)O Amb2609022 [1,0,0,0,0,0|1,0,1]=3 774 B5R0.1 N#CCC(N)=O Amb6336473 [1,0,0,0,0,0|2,0,1]=4 775 B5R0.1 N=C(Br)CCBr Amb27653883 [1,0,0,0,0,0|3,0,0]=4 776 B5R0.1 N=C(N)CCBr Amb4297021 [1,0,0,0,0,0|3,0,0]=4 777 B5R0.1 N=C(N)CCCl Amb25839424 [1,0,0,0,0,0|3,0,0]=4 778 B5R0.1 N=C(N)CCF Amb26024692 [1,0,0,0,0,0|3,0,0]=4 779 B5R0.1 N=C(N)CCN Amb27265608 [1,0,0,0,0,0|3,0,0]=4 780 B5R0.1 N=C(N)CCN Amb32687503 [1,0,0,0,0,0|3,0,0]=4 781 B5R0.1 N=C(N)CCN Amb33164129 [1,0,0,0,0,0|3,0,0]=4 782 B5R0.1 N=C(N)CCO Amb2696134 [1,0,0,0,0,0|3,0,0]=4 783 B5R0.1 N=C(N)CCO Amb8630168 [1,0,0,0,0,0|3,0,0]=4 784 B5R0.1 NC(=O)CC=O Amb25777522 [1,0,0,0,0,0|2,0,1]=4 785 B5R0.1 NC(=O)CCBr Amb21618712 [1,0,0,0,0,0|2,0,0]=3 786 B5R0.1 NC(=O)CCCl Amb1127569 [1,0,0,0,0,0|2,0,0]=3 787 B5R0.1 NC(=O)CCF Amb28289353 [1,0,0,0,0,0|2,0,0]=3 788 B5R0.1 NC(=O)CCI Amb27966778 [1,0,0,0,0,0|2,0,0]=3 789 B5R0.1 NC(=O)CCO Amb9421407 [1,0,0,0,0,0|2,0,0]=3 790 B5R0.1 NC(=O)CCS Amb27154802 [1,0,0,0,0,0|2,0,0]=3 791 B5R0.1 NC(=O)CNCl Amb28315673 [1,0,0,0,0,0|3,0,0]=4 792 B5R0.1 NC(=O)NCO Amb17674341 [1,0,0,0,0,0|3,0,0]=4 793 B5R0.1 NC(=O)SCCl Amb26419693 [1,0,0,0,0,0|3,0,0]=4 794 B5R0.1 NC(=S)CCCl Amb33328368 [1,0,0,0,0,0|2,1,0]=4 795 B5R0.1 NC(=S)CCF Amb27950563 [1,0,0,0,0,0|2,1,0]=4 796 B5R0.1 NC(=S)CCO Amb8855295 [1,0,0,0,0,0|2,1,0]=4 797 B5R0.1 NC(=S)CCS Amb17503271 [1,0,0,0,0,0|2,1,0]=4 798 B5R0.1 NC(O)CCO Amb28252327 [1,0,0,0,0,0|2,0,1]=4 799 B5R0.1 NCCB(O)O Amb27859105 [1,0,0,0,0,0|2,0,1]=4 800 B5R0.1 NCCC(=O)Cl Amb24117140 [1,0,0,0,0,0|2,0,0]=3 801 B5R0.1 NCCC(=O)O Amb1935127 [1,0,0,0,0,0|1,0,0]=2 802 B5R0.1 NCCC(=O)[O-] Amb28991330 [1,0,0,0,0,0|1,0,1]=3 803 B5R0.1 NCCC(N)=O Amb1137251 [1,0,0,0,0,0|2,0,0]=3 804 B5R0.1 NCCC(N)=O Amb9147573 [1,0,0,0,0,0|2,0,0]=3 805 B5R0.1 NCCC(N)=S Amb18523221 [1,0,0,0,0,0|2,1,0]=4 806 B5R0.1 NCCC(N)=S Amb33456385 [1,0,0,0,0,0|2,1,0]=4 807 B5R0.1 NCCC(O)O Amb27449145 [1,0,0,0,0,0|1,0,2]=4 808 B5R0.1 NCCS(=O)O Amb6600043 [1,0,0,0,0,0|2,0,0]=3 809 B5R0.1 NCCS(N)=O Amb33512527 [1,0,0,0,0,0|3,0,0]=4 810 B5R0.1 NCC[N+](=O)[O-] Amb18203119 [1,0,0,0,0,0|2,0,1]=4 811 B5R0.1 NCC[PH](=O)O Amb22168066 [1,0,0,0,0,0|2,0,0]=3 812 B5R0.1 NCC[PH](=O)O Amb35788864 [1,0,0,0,0,0|2,0,0]=3 813 B5R0.1 NNCC(=O)O Amb32751165 [1,0,0,0,0,0|2,0,0]=3 814 B5R0.1 NNCC(=O)O Amb6740299 [1,0,0,0,0,0|2,0,0]=3 815 B5R0.1 NNCC(N)=O Amb32990162 [1,0,0,0,0,0|3,0,0]=4 816 B5R0.1 NOCC(=O)O Amb1154237 [1,0,0,0,0,0|2,0,0]=3 817 B5R0.1 NOCC(=O)O Amb4324355 [1,0,0,0,0,0|2,0,0]=3 818 B5R0.1 NOCC(=O)O Amb8513076 [1,0,0,0,0,0|2,0,0]=3 819 B5R0.1 NOCC(N)=O Amb33528973 [1,0,0,0,0,0|3,0,0]=4 820 B5R0.1 NS(=O)CCCl Amb24407159 [1,0,0,0,0,0|3,0,0]=4 821 B5R0.1 NS(=O)CCF Amb32720391 [1,0,0,0,0,0|3,0,0]=4 822 B5R0.1 NS(=O)CCO Amb32720357 [1,0,0,0,0,0|3,0,0]=4 823 B5R0.1 N\C=C\C(=O)O Amb27217920 [1,0,0,0,0,0|1,0,2]=4 824 B5R0.1 O=C(Br)CCBr Amb24624022 [1,0,0,0,0,0|2,0,0]=3 825 B5R0.1 O=C(Cl)CCBr Amb3941484 [1,0,0,0,0,0|2,0,0]=3 826 B5R0.1 O=C(Cl)CCCl Amb3939313 [1,0,0,0,0,0|2,0,0]=3 827 B5R0.1 O=C(Cl)CCF Amb27148631 [1,0,0,0,0,0|2,0,0]=3 828 B5R0.1 O=C(Cl)CCI Amb28454579 [1,0,0,0,0,0|2,0,0]=3 829 B5R0.1 O=C(Cl)CCO Amb27270014 [1,0,0,0,0,0|2,0,0]=3 830 B5R0.1 O=C(Cl)NCCl Amb28315820 [1,0,0,0,0,0|3,0,0]=4 831 B5R0.1 O=C(Cl)OCCl Amb8389474 [1,0,0,0,0,0|3,0,0]=4 832 B5R0.1 O=C(F)CCCl Amb27257545 [1,0,0,0,0,0|2,0,0]=3 833 B5R0.1 O=C(F)OCCl Amb27860169 [1,0,0,0,0,0|3,0,0]=4 834 B5R0.1 O=C(O)C#CBr Amb17593707 [1,0,0,0,0,0|1,0,2]=4 835 B5R0.1 O=C(O)C#CCl Amb17593098 [1,0,0,0,0,0|1,0,2]=4 836 B5R0.1 O=C(O)CCBr Amb2685479 [1,0,0,0,0,0|1,0,0]=2 837 B5R0.1 O=C(O)CCCl Amb5395408 [1,0,0,0,0,0|1,0,0]=2 838 B5R0.1 O=C(O)CCF Amb10603694 [1,0,0,0,0,0|1,0,0]=2 839 B5R0.1 O=C(O)CCI Amb2688882 [1,0,0,0,0,0|1,0,0]=2 840 B5R0.1 O=C(O)CCO Amb2688785 [1,0,0,0,0,0|1,0,0]=2 841 B5R0.1 O=C(O)CCS Amb6608916 [1,0,0,0,0,0|1,0,0]=2 842 B5R0.1 O=C(O)CNO Amb24120360 [1,0,0,0,0,0|2,0,0]=3 843 B5R0.1 O=C(O)\C=C/Br Amb18644453 [1,0,0,0,0,0|1,0,2]=4 844 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [1,0,0,0,0,0|1,0,2]=4 845 B5R0.1 O=C(O)\C=C/I Amb28315824 [1,0,0,0,0,0|1,0,2]=4 846 B5R0.1 O=C(O)\C=C\Br Amb27423608 [1,0,0,0,0,0|1,0,2]=4 847 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [1,0,0,0,0,0|1,0,2]=4 848 B5R0.1 O=C(O)\C=C\I Amb30584673 [1,0,0,0,0,0|1,0,2]=4 849 B5R0.1 O=C(O)\C=C\O Amb26055842 [1,0,0,0,0,0|1,0,2]=4 850 B5R0.1 O=C(O)\C=C\S Amb28401590 [1,0,0,0,0,0|1,0,2]=4 851 B5R0.1 O=C(O)\C=N\O Amb20671938 [1,0,0,0,0,0|2,0,1]=4 852 B5R0.1 O=C(S)CCCl Amb27461454 [1,0,0,0,0,0|1,1,0]=3 853 B5R0.1 O=C([O-])CCO Amb22055495 [1,0,0,0,0,0|1,0,1]=3 854 B5R0.1 O=C([O-])NCCl Amb27777248 [1,0,0,0,0,0|2,0,1]=4 855 B5R0.1 O=CCC(=O)O Amb22169407 [1,0,0,0,0,0|1,0,1]=3 856 B5R0.1 O=CCC(=O)[Na] Amb27949540 [1,0,0,0,0,0|2,0,1]=4 857 B5R0.1 O=S(Cl)CCCl Amb26494051 [1,0,0,0,0,0|3,0,0]=4 858 B5R0.1 O=S(Cl)CCF Amb32720386 [1,0,0,0,0,0|3,0,0]=4 859 B5R0.1 O=S(Cl)CCO Amb32720404 [1,0,0,0,0,0|3,0,0]=4 860 B5R0.1 O=S(O)CCO Amb25937057 [1,0,0,0,0,0|2,0,0]=3 861 B5R0.1 O=S([O-])CCCl Amb27639192 [1,0,0,0,0,0|2,0,1]=4 862 B5R0.1 O=S([O-])CCF Amb27213259 [1,0,0,0,0,0|2,0,1]=4 863 B5R0.1 O=S([O-])CCO Amb32754124 [1,0,0,0,0,0|2,0,1]=4 864 B5R0.1 O=[N+]([O-])CCBr Amb25965752 [1,0,0,0,0,0|2,0,1]=4 865 B5R0.1 O=[N+]([O-])CCCl Amb28381478 [1,0,0,0,0,0|2,0,1]=4 866 B5R0.1 O=[N+]([O-])CCF Amb17674352 [1,0,0,0,0,0|2,0,1]=4 867 B5R0.1 O=[N+]([O-])CCO Amb3940447 [1,0,0,0,0,0|2,0,1]=4 868 B5R0.1 O=[N+]([O-])CCS Amb26620894 [1,0,0,0,0,0|2,0,1]=4 869 B5R0.1 OB(O)CCF Amb27479949 [1,0,0,0,0,0|2,0,1]=4 870 B5R0.1 OC(Br)CCBr Amb27457468 [1,0,0,0,0,0|2,0,1]=4 871 B5R0.1 OC(Cl)CCCl Amb28255432 [1,0,0,0,0,0|2,0,1]=4 872 B5R0.1 OC(O)CCS Amb25746150 [1,0,0,0,0,0|1,0,2]=4 873 B5R0.1 OCCC(O)Cl Amb26052481 [1,0,0,0,0,0|2,0,1]=4 874 B5R0.1 OP(O)CCCl Amb27169424 [1,0,0,0,0,0|2,0,1]=4 875 B5R0.2 BrCCCCBr Amb2686718 [1,0,0,0,0,0|2,0,1]=4 876 B5R0.2 BrCCCCI Amb25861429 [1,0,0,0,0,0|2,0,1]=4 877 B5R0.2 BrCCCNBr Amb27424198 [1,0,0,0,0,0|3,0,0]=4 878 B5R0.2 Br\C=C\CCBr Amb25663040 [1,0,0,0,0,0|2,0,1]=4 879 B5R0.2 C#CCCC=C Amb18117518 [1,0,0,0,0,0|1,0,2]=4 880 B5R0.2 C#CCCC=O Amb28049678 [1,0,0,0,0,0|0,0,2]=3 881 B5R0.2 C#CCCCBr Amb17610060 [1,0,0,0,0,0|2,0,1]=4 882 B5R0.2 C#CCCCC Amb4135448 [1,0,0,0,0,0|1,0,1]=3 883 B5R0.2 C#CCCCCl Amb3940276 [1,0,0,0,0,0|2,0,1]=4 884 B5R0.2 C#CCCCF Amb26904785 [1,0,0,0,0,0|2,0,1]=4 885 B5R0.2 C#CCCCI Amb25843530 [1,0,0,0,0,0|2,0,1]=4 886 B5R0.2 C#CCCCN Amb18962495 [1,0,0,0,0,0|2,0,1]=4 887 B5R0.2 C#CCCCN Amb33532759 [1,0,0,0,0,0|2,0,1]=4 888 B5R0.2 C#CCCCO Amb1219893 [1,0,0,0,0,0|0,0,3]=4 889 B5R0.2 C#CCCCS Amb24333394 [1,0,0,0,0,0|2,0,1]=4 890 B5R0.2 C#CCCNC Amb18962433 [1,0,0,0,0,0|2,0,1]=4 891 B5R0.2 C#CCCNC Amb33339156 [1,0,0,0,0,0|2,0,1]=4 892 B5R0.2 C#CCCNC Amb33611652 [1,0,0,0,0,0|2,0,1]=4 893 B5R0.2 C#CCCOC Amb18117254 [1,0,0,0,0,0|2,0,1]=4 894 B5R0.2 C#CCCSC Amb24579788 [1,0,0,0,0,0|2,0,1]=4 895 B5R0.2 C#CCNCC Amb10610192 [1,0,0,0,0,0|2,0,1]=4 896 B5R0.2 C#CCNCC Amb6683724 [1,0,0,0,0,0|2,0,1]=4 897 B5R0.2 C#CCOCC Amb17673317 [1,0,0,0,0,0|2,0,1]=4 898 B5R0.2 C#CCSCC Amb3941533 [1,0,0,0,0,0|2,0,1]=4 899 B5R0.2 C#NCCCC Amb31132446 [1,0,0,0,0,0|2,0,0]=3 900 B5R0.2 C=C=CCC=O Amb27234481 [1,0,0,0,0,0|0,0,3]=4 901 B5R0.2 C=CC#CCC Amb24333935 [1,0,0,0,0,0|1,0,2]=4 902 B5R0.2 C=CCCC#N Amb10605750 [1,0,0,0,0,0|2,0,1]=4 903 B5R0.2 C=CCCC=C Amb8513514 [1,0,0,0,0,0|1,0,2]=4 904 B5R0.2 C=CCCC=O Amb4358616 [1,0,0,0,0,0|0,0,2]=3 905 B5R0.2 C=CCCCBr Amb3940219 [1,0,0,0,0,0|2,0,0]=3 906 B5R0.2 C=CCCCC Amb3940497 [1,0,0,0,0,0|1,0,0]=2 907 B5R0.2 C=CCCCCl Amb22229585 [1,0,0,0,0,0|2,0,0]=3 908 B5R0.2 C=CCCCF Amb25689705 [1,0,0,0,0,0|2,0,0]=3 909 B5R0.2 C=CCCCI Amb25278794 [1,0,0,0,0,0|2,0,0]=3 910 B5R0.2 C=CCCCN Amb18299670 [1,0,0,0,0,0|2,0,0]=3 911 B5R0.2 C=CCCCN Amb22001451 [1,0,0,0,0,0|2,0,0]=3 912 B5R0.2 C=CCCCO Amb8513439 [1,0,0,0,0,0|2,0,0]=3 913 B5R0.2 C=CCCC[CH2-] Amb32644015 [1,0,0,0,0,0|1,0,1]=3 914 B5R0.2 C=CCCNC Amb18993048 [1,0,0,0,0,0|2,0,0]=3 915 B5R0.2 C=CCCNC Amb33553635 [1,0,0,0,0,0|2,0,0]=3 916 B5R0.2 C=CCCOC Amb28065418 [1,0,0,0,0,0|2,0,0]=3 917 B5R0.2 C=CCCON Amb22233632 [1,0,0,0,0,0|3,0,0]=4 918 B5R0.2 C=CCCON Amb22896384 [1,0,0,0,0,0|3,0,0]=4 919 B5R0.2 C=CCCSC Amb24431590 [1,0,0,0,0,0|2,0,0]=3 920 B5R0.2 C=CCNC=O Amb2781857 [1,0,0,0,0,0|1,0,2]=4 921 B5R0.2 C=CCNCC Amb13951161 [1,0,0,0,0,0|2,0,0]=3 922 B5R0.2 C=CCNCC Amb6683951 [1,0,0,0,0,0|2,0,0]=3 923 B5R0.2 C=CCOCBr Amb28384107 [1,0,0,0,0,0|3,0,0]=4 924 B5R0.2 C=CCOCC Amb2684299 [1,0,0,0,0,0|2,0,0]=3 925 B5R0.2 C=CCOCCl Amb28429831 [1,0,0,0,0,0|3,0,0]=4 926 B5R0.2 C=CCONC Amb32411015 [1,0,0,0,0,0|3,0,0]=4 927 B5R0.2 C=CCSCC Amb6366495 [1,0,0,0,0,0|2,0,0]=3 928 B5R0.2 C=CCSCCl Amb25859631 [1,0,0,0,0,0|3,0,0]=4 929 B5R0.2 C=CCSSC Amb22730604 [1,0,0,0,0,0|3,0,0]=4 930 B5R0.2 C=CC\C=C/C Amb26426294 [1,0,0,0,0,0|1,0,2]=4 931 B5R0.2 C=CNCCC Amb27461242 [1,0,0,0,0,0|2,0,0]=3 932 B5R0.2 C=COCCC Amb17940706 [1,0,0,0,0,0|2,0,0]=3 933 B5R0.2 C=COCCI Amb28245341 [1,0,0,0,0,0|3,0,0]=4 934 B5R0.2 C=COCCN Amb17593030 [1,0,0,0,0,0|3,0,0]=4 935 B5R0.2 C=COCCN Amb32409664 [1,0,0,0,0,0|3,0,0]=4 936 B5R0.2 C=COCCO Amb17674184 [1,0,0,0,0,0|3,0,0]=4 937 B5R0.2 C=COCOC Amb28131655 [1,0,0,0,0,0|3,0,0]=4 938 B5R0.2 C=CSCCCl Amb27390785 [1,0,0,0,0,0|3,0,0]=4 939 B5R0.2 C=CSCCO Amb27607172 [1,0,0,0,0,0|3,0,0]=4 940 B5R0.2 C=C\C=C\CC Amb8513434 [1,0,0,0,0,0|1,0,2]=4 941 B5R0.2 C=NCCCCl Amb28346586 [1,0,0,0,0,0|3,0,0]=4 942 B5R0.2 CC#CCC=O Amb27850282 [1,0,0,0,0,0|0,0,2]=3 943 B5R0.2 CC#CCCC Amb8515369 [1,0,0,0,0,0|1,0,2]=4 944 B5R0.2 CC#CCCO Amb2721725 [1,0,0,0,0,0|0,0,3]=4 945 B5R0.2 CCC#CC=O Amb25663194 [1,0,0,0,0,0|0,0,2]=3 946 B5R0.2 CCC#CCO Amb2721726 [1,0,0,0,0,0|0,0,3]=4 947 B5R0.2 CCC=C=CBr Amb27194333 [1,0,0,0,0,0|1,0,2]=4 948 B5R0.2 CCCC#CBr Amb24648680 [1,0,0,0,0,0|1,0,2]=4 949 B5R0.2 CCCC#CI Amb22733682 [1,0,0,0,0,0|1,0,2]=4 950 B5R0.2 CCCCC#N Amb6662839 [1,0,0,0,0,0|1,0,1]=3 951 B5R0.2 CCCCC=O Amb3939655 [1,0,0,0,0,0|0,0,0]=1 952 B5R0.2 CCCCCBr Amb3940084 [1,0,0,0,0,0|1,0,1]=3 953 B5R0.2 CCCCCC Amb2447471 [1,0,0,0,0,0|1,0,1]=3 954 B5R0.2 CCCCCCl Amb8514576 [1,0,0,0,0,0|1,0,1]=3 955 B5R0.2 CCCCCF Amb10838686 [1,0,0,0,0,0|1,0,1]=3 956 B5R0.2 CCCCCI Amb6891946 [1,0,0,0,0,0|1,0,1]=3 957 B5R0.2 CCCCCN Amb3939830 [1,0,0,0,0,0|1,0,1]=3 958 B5R0.2 CCCCCO Amb3939051 [1,0,0,0,0,0|0,0,1]=2 959 B5R0.2 CCCCCS Amb8513287 [1,0,0,0,0,0|0,1,1]=3 960 B5R0.2 CCCCC[SiH3] Amb19893989 [1,0,0,0,0,0|1,0,1]=3 961 B5R0.2 CCCCNC Amb3939351 [1,0,0,0,0,0|2,0,0]=3 962 B5R0.2 CCCCNN Amb1105203 [1,0,0,0,0,0|2,0,0]=3 963 B5R0.2 CCCCNN Amb22230363 [1,0,0,0,0,0|2,0,0]=3 964 B5R0.2 CCCCNN Amb33055062 [1,0,0,0,0,0|2,0,0]=3 965 B5R0.2 CCCCNO Amb24686451 [1,0,0,0,0,0|1,0,0]=2 966 B5R0.2 CCCCNO Amb32687485 [1,0,0,0,0,0|1,0,0]=2 967 B5R0.2 CCCCON Amb17101066 [1,0,0,0,0,0|2,0,0]=3 968 B5R0.2 CCCCON Amb6308542 [1,0,0,0,0,0|2,0,0]=3 969 B5R0.2 CCCCSC Amb4036342 [1,0,0,0,0,0|2,0,0]=3 970 B5R0.2 CCCN=C=O Amb3939331 [1,0,0,0,0,0|1,0,1]=3 971 B5R0.2 CCCN=C=S Amb6572523 [1,0,0,0,0,0|1,1,1]=4 972 B5R0.2 CCCN=[N+]=[N-] Amb25811439 [1,0,0,0,0,0|3,0,0]=4 973 B5R0.2 CCCNC=S Amb27754027 [1,0,0,0,0,0|1,1,0]=3 974 B5R0.2 CCCNCC Amb3939843 [1,0,0,0,0,0|2,0,1]=4 975 B5R0.2 CCCNNC Amb25283190 [1,0,0,0,0,0|3,0,0]=4 976 B5R0.2 CCCOCBr Amb25351883 [1,0,0,0,0,0|2,0,1]=4 977 B5R0.2 CCCOCC Amb17673668 [1,0,0,0,0,0|2,0,1]=4 978 B5R0.2 CCCOCCl Amb22002403 [1,0,0,0,0,0|2,0,1]=4 979 B5R0.2 CCCSCC Amb22168047 [1,0,0,0,0,0|2,0,1]=4 980 B5R0.2 CCCSCCl Amb28146719 [1,0,0,0,0,0|2,0,1]=4 981 B5R0.2 CCC\C=C\Br Amb17673688 [1,0,0,0,0,0|1,0,1]=3 982 B5R0.2 CCC\C=C\Cl Amb25026521 [1,0,0,0,0,0|1,0,1]=3 983 B5R0.2 CCC\C=C\N Amb27217273 [1,0,0,0,0,0|1,0,1]=3 984 B5R0.2 CCC\C=N\O Amb27213413 [1,0,0,0,0,0|1,0,1]=3 985 B5R0.2 CCNCC#N Amb6245416 [1,0,0,0,0,0|2,0,1]=4 986 B5R0.2 CCNCCBr Amb27950012 [1,0,0,0,0,0|2,0,1]=4 987 B5R0.2 CCNCCCl Amb17334050 [1,0,0,0,0,0|2,0,1]=4 988 B5R0.2 CCNCCCl Amb33869917 [1,0,0,0,0,0|2,0,1]=4 989 B5R0.2 CCNCCF Amb27858242 [1,0,0,0,0,0|2,0,1]=4 990 B5R0.2 CCNCCI Amb27856942 [1,0,0,0,0,0|2,0,1]=4 991 B5R0.2 CCNCCN Amb6297789 [1,0,0,0,0,0|2,0,1]=4 992 B5R0.2 CCNCCO Amb19372818 [1,0,0,0,0,0|1,0,1]=3 993 B5R0.2 CCNCCO Amb3940070 [1,0,0,0,0,0|1,0,1]=3 994 B5R0.2 CCNCCP Amb27188285 [1,0,0,0,0,0|2,0,1]=4 995 B5R0.2 CCOCC#N Amb6263119 [1,0,0,0,0,0|2,0,1]=4 996 B5R0.2 CCOCCBr Amb1158671 [1,0,0,0,0,0|2,0,1]=4 997 B5R0.2 CCOCCCl Amb8390350 [1,0,0,0,0,0|2,0,1]=4 998 B5R0.2 CCOCCI Amb25117446 [1,0,0,0,0,0|2,0,1]=4 999 B5R0.2 CCOCCN Amb1130918 [1,0,0,0,0,0|2,0,1]=4 1000 B5R0.2 CCOCCN Amb29844456 [1,0,0,0,0,0|2,0,1]=4 1001 B5R0.2 CCOCCO Amb3939142 [1,0,0,0,0,0|1,0,1]=3 1002 B5R0.2 CCOCCS Amb9316644 [1,0,0,0,0,0|1,1,1]=4 1003 B5R0.2 CCO\C=C/Br Amb2455970 [1,0,0,0,0,0|2,0,1]=4 1004 B5R0.2 CCO\C=C/Cl Amb28315611 [1,0,0,0,0,0|2,0,1]=4 1005 B5R0.2 CCO\C=C\Br Amb10068669 [1,0,0,0,0,0|2,0,1]=4 1006 B5R0.2 CCSCC#N Amb6680684 [1,0,0,0,0,0|2,0,1]=4 1007 B5R0.2 CCSCC=O Amb17940620 [1,0,0,0,0,0|1,0,0]=2 1008 B5R0.2 CCSCCBr Amb2685158 [1,0,0,0,0,0|2,0,1]=4 1009 B5R0.2 CCSCCCl Amb3940261 [1,0,0,0,0,0|2,0,1]=4 1010 B5R0.2 CCSCCN Amb2687948 [1,0,0,0,0,0|2,0,1]=4 1011 B5R0.2 CCSCCN Amb9825826 [1,0,0,0,0,0|2,0,1]=4 1012 B5R0.2 CCSCCO Amb1085958 [1,0,0,0,0,0|1,0,1]=3 1013 B5R0.2 CCSCCS Amb27167723 [1,0,0,0,0,0|1,1,1]=4 1014 B5R0.2 CCS\C=C/Cl Amb28244706 [1,0,0,0,0,0|2,0,1]=4 1015 B5R0.2 CC\C=C/CO Amb10975881 [1,0,0,0,0,0|0,0,3]=4 1016 B5R0.2 CC\C=C\C=O Amb33986391 [1,0,0,0,0,0|0,0,2]=3 1017 B5R0.2 CC\C=C\CO Amb22347892 [1,0,0,0,0,0|0,0,3]=4 1018 B5R0.2 CNCCC#N Amb3939367 [1,0,0,0,0,0|2,0,1]=4 1019 B5R0.2 CNCCCBr Amb28291325 [1,0,0,0,0,0|2,0,1]=4 1020 B5R0.2 CNCCCBr Amb33473632 [1,0,0,0,0,0|2,0,1]=4 1021 B5R0.2 CNCCCCl Amb22002154 [1,0,0,0,0,0|2,0,1]=4 1022 B5R0.2 CNCCCCl Amb3941419 [1,0,0,0,0,0|2,0,1]=4 1023 B5R0.2 CNCCCF Amb27405698 [1,0,0,0,0,0|2,0,1]=4 1024 B5R0.2 CNCCCN Amb2698065 [1,0,0,0,0,0|2,0,1]=4 1025 B5R0.2 CNCCCO Amb9246656 [1,0,0,0,0,0|1,0,1]=3 1026 B5R0.2 CNCCNC Amb4037059 [1,0,0,0,0,0|3,0,0]=4 1027 B5R0.2 CNCCNN Amb24117180 [1,0,0,0,0,0|3,0,0]=4 1028 B5R0.2 CNCCNO Amb27976196 [1,0,0,0,0,0|2,0,0]=3 1029 B5R0.2 CNCCOC Amb10609606 [1,0,0,0,0,0|3,0,0]=4 1030 B5R0.2 CNCCOC Amb2689126 [1,0,0,0,0,0|3,0,0]=4 1031 B5R0.2 CNCCSC Amb15701319 [1,0,0,0,0,0|3,0,0]=4 1032 B5R0.2 CNCCSC Amb20625111 [1,0,0,0,0,0|3,0,0]=4 1033 B5R0.2 CNC\C=C/I Amb23539307 [1,0,0,0,0,0|2,0,1]=4 1034 B5R0.2 CNOCCO Amb27637954 [1,0,0,0,0,0|2,0,1]=4 1035 B5R0.2 CN\C=C\C=O Amb24564349 [1,0,0,0,0,0|1,0,2]=4 1036 B5R0.2 COCCC#N Amb2819688 [1,0,0,0,0,0|2,0,1]=4 1037 B5R0.2 COCCC=O Amb10602324 [1,0,0,0,0,0|1,0,0]=2 1038 B5R0.2 COCCCBr Amb8828205 [1,0,0,0,0,0|2,0,1]=4 1039 B5R0.2 COCCCCl Amb6255994 [1,0,0,0,0,0|2,0,1]=4 1040 B5R0.2 COCCCF Amb22007998 [1,0,0,0,0,0|2,0,1]=4 1041 B5R0.2 COCCCI Amb33546474 [1,0,0,0,0,0|2,0,1]=4 1042 B5R0.2 COCCCN Amb3939346 [1,0,0,0,0,0|2,0,1]=4 1043 B5R0.2 COCCCO Amb8385593 [1,0,0,0,0,0|1,0,1]=3 1044 B5R0.2 COCCCS Amb13952794 [1,0,0,0,0,0|1,1,1]=4 1045 B5R0.2 COCCNN Amb10609107 [1,0,0,0,0,0|3,0,0]=4 1046 B5R0.2 COCCNN Amb19374182 [1,0,0,0,0,0|3,0,0]=4 1047 B5R0.2 COCCNN Amb22233534 [1,0,0,0,0,0|3,0,0]=4 1048 B5R0.2 COCCNN Amb22587527 [1,0,0,0,0,0|3,0,0]=4 1049 B5R0.2 COCCNN Amb6248350 [1,0,0,0,0,0|3,0,0]=4 1050 B5R0.2 COCCNO Amb25284480 [1,0,0,0,0,0|2,0,0]=3 1051 B5R0.2 COCCOC Amb6741456 [1,0,0,0,0,0|3,0,0]=4 1052 B5R0.2 COCCON Amb17194148 [1,0,0,0,0,0|3,0,0]=4 1053 B5R0.2 COCCON Amb20623946 [1,0,0,0,0,0|3,0,0]=4 1054 B5R0.2 COCCSC Amb4020919 [1,0,0,0,0,0|3,0,0]=4 1055 B5R0.2 COCN=C=O Amb6265212 [1,0,0,0,0,0|2,0,1]=4 1056 B5R0.2 COCNC=O Amb28049834 [1,0,0,0,0,0|2,0,0]=3 1057 B5R0.2 CONCCO Amb27658816 [1,0,0,0,0,0|2,0,1]=4 1058 B5R0.2 CO\C=C/C=O Amb28049941 [1,0,0,0,0,0|1,0,2]=4 1059 B5R0.2 CO\C=C\C=O Amb26873964 [1,0,0,0,0,0|1,0,2]=4 1060 B5R0.2 CSCCC#N Amb17307555 [1,0,0,0,0,0|2,0,1]=4 1061 B5R0.2 CSCCC=O Amb3939952 [1,0,0,0,0,0|1,0,0]=2 1062 B5R0.2 CSCCCBr Amb18180189 [1,0,0,0,0,0|2,0,1]=4 1063 B5R0.2 CSCCCCl Amb10602296 [1,0,0,0,0,0|2,0,1]=4 1064 B5R0.2 CSCCCN Amb33801570 [1,0,0,0,0,0|2,0,1]=4 1065 B5R0.2 CSCCCN Amb6718923 [1,0,0,0,0,0|2,0,1]=4 1066 B5R0.2 CSCCCO Amb3939523 [1,0,0,0,0,0|1,0,1]=3 1067 B5R0.2 CSCCCS Amb25744031 [1,0,0,0,0,0|1,1,1]=4 1068 B5R0.2 CSCCNN Amb18640583 [1,0,0,0,0,0|3,0,0]=4 1069 B5R0.2 CSCCNO Amb33272071 [1,0,0,0,0,0|2,0,0]=3 1070 B5R0.2 CSCCON Amb25806571 [1,0,0,0,0,0|3,0,0]=4 1071 B5R0.2 CSCCSC Amb25101746 [1,0,0,0,0,0|3,0,0]=4 1072 B5R0.2 CSC\C=N\O Amb22168142 [1,0,0,0,0,0|2,0,1]=4 1073 B5R0.2 C[SiH2]CCCN Amb28049027 [1,0,0,0,0,0|1,1,1]=4 1074 B5R0.2 C\C=C/CCC Amb6366719 [1,0,0,0,0,0|1,0,1]=3 1075 B5R0.2 C\C=C/CCO Amb19930204 [1,0,0,0,0,0|0,0,3]=4 1076 B5R0.2 C\C=C\CC=O Amb26655030 [1,0,0,0,0,0|0,0,2]=3 1077 B5R0.2 C\C=C\CCBr Amb32667161 [1,0,0,0,0,0|2,0,1]=4 1078 B5R0.2 C\C=C\CCCl Amb26978891 [1,0,0,0,0,0|2,0,1]=4 1079 B5R0.2 C\C=C\CCN Amb19374038 [1,0,0,0,0,0|2,0,1]=4 1080 B5R0.2 C\C=C\CCN Amb33038294 [1,0,0,0,0,0|2,0,1]=4 1081 B5R0.2 C\C=C\CCO Amb24655557 [1,0,0,0,0,0|0,0,3]=4 1082 B5R0.2 C\C=C\CNC Amb28049814 [1,0,0,0,0,0|2,0,1]=4 1083 B5R0.2 C\C=C\OCC Amb8516635 [1,0,0,0,0,0|2,0,1]=4 1084 B5R0.2 C\C=N\CCC Amb27954749 [1,0,0,0,0,0|2,0,0]=3 1085 B5R0.2 C\C=N\CCN Amb27837883 [1,0,0,0,0,0|3,0,0]=4 1086 B5R0.2 ClCCCCBr Amb8391065 [1,0,0,0,0,0|2,0,1]=4 1087 B5R0.2 ClCCCCCl Amb6608890 [1,0,0,0,0,0|2,0,1]=4 1088 B5R0.2 ClCCCCI Amb8517518 [1,0,0,0,0,0|2,0,1]=4 1089 B5R0.2 ClCCCNCl Amb27165116 [1,0,0,0,0,0|3,0,0]=4 1090 B5R0.2 ClCCC[SiH2]Cl Amb27629993 [1,0,0,0,0,0|2,1,0]=4 1091 B5R0.2 Cl\C=C\CCCl Amb25929864 [1,0,0,0,0,0|2,0,1]=4 1092 B5R0.2 Cl\C=C\CCI Amb27647471 [1,0,0,0,0,0|2,0,1]=4 1093 B5R0.2 FCCCCBr Amb2685210 [1,0,0,0,0,0|2,0,1]=4 1094 B5R0.2 FCCCCCl Amb27655616 [1,0,0,0,0,0|2,0,1]=4 1095 B5R0.2 FCCCCF Amb10839858 [1,0,0,0,0,0|2,0,1]=4 1096 B5R0.2 FCCCCI Amb28283837 [1,0,0,0,0,0|2,0,1]=4 1097 B5R0.2 FCCCCS Amb25065453 [1,0,0,0,0,0|1,1,1]=4 1098 B5R0.2 ICCCCI Amb17672573 [1,0,0,0,0,0|2,0,1]=4 1099 B5R0.2 N#CCCC=O Amb3941009 [1,0,0,0,0,0|1,0,1]=3 1100 B5R0.2 N#CCCCBr Amb3940093 [1,0,0,0,0,0|2,0,1]=4 1101 B5R0.2 N#CCCCCl Amb3940298 [1,0,0,0,0,0|2,0,1]=4 1102 B5R0.2 N#CCCCF Amb25146362 [1,0,0,0,0,0|2,0,1]=4 1103 B5R0.2 N#CCCCI Amb8517592 [1,0,0,0,0,0|2,0,1]=4 1104 B5R0.2 N#CCCCN Amb28555321 [1,0,0,0,0,0|2,0,1]=4 1105 B5R0.2 N#CCCCN Amb6271100 [1,0,0,0,0,0|2,0,1]=4 1106 B5R0.2 N#CCCCO Amb4021727 [1,0,0,0,0,0|1,0,2]=4 1107 B5R0.2 N#CCCCS Amb17504257 [1,0,0,0,0,0|2,0,1]=4 1108 B5R0.2 N#CCCNO Amb22748730 [1,0,0,0,0,0|2,0,1]=4 1109 B5R0.2 N#CCOC=O Amb22347946 [1,0,0,0,0,0|2,0,1]=4 1110 B5R0.2 NCCCC=O Amb26851044 [1,0,0,0,0,0|1,0,0]=2 1111 B5R0.2 NCCCCBr Amb21858985 [1,0,0,0,0,0|2,0,1]=4 1112 B5R0.2 NCCCCCl Amb18640687 [1,0,0,0,0,0|2,0,1]=4 1113 B5R0.2 NCCCCCl Amb22233734 [1,0,0,0,0,0|2,0,1]=4 1114 B5R0.2 NCCCCF Amb26017241 [1,0,0,0,0,0|2,0,1]=4 1115 B5R0.2 NCCCCF Amb28555328 [1,0,0,0,0,0|2,0,1]=4 1116 B5R0.2 NCCCCI Amb27837961 [1,0,0,0,0,0|2,0,1]=4 1117 B5R0.2 NCCCCN Amb22489528 [1,0,0,0,0,0|2,0,1]=4 1118 B5R0.2 NCCCCN Amb6608640 [1,0,0,0,0,0|2,0,1]=4 1119 B5R0.2 NCCCCN Amb8514498 [1,0,0,0,0,0|2,0,1]=4 1120 B5R0.2 NCCCCO Amb3939336 [1,0,0,0,0,0|1,0,1]=3 1121 B5R0.2 NCCCCS Amb17500976 [1,0,0,0,0,0|1,1,1]=4 1122 B5R0.2 NCCCCS Amb22546260 [1,0,0,0,0,0|1,1,1]=4 1123 B5R0.2 NCCCN=O Amb28049442 [1,0,0,0,0,0|2,0,0]=3 1124 B5R0.2 NCCCNN Amb27392601 [1,0,0,0,0,0|3,0,0]=4 1125 B5R0.2 NCCCNO Amb27882495 [1,0,0,0,0,0|2,0,0]=3 1126 B5R0.2 NCCCNO Amb32729324 [1,0,0,0,0,0|2,0,0]=3 1127 B5R0.2 NCCOC=O Amb24612320 [1,0,0,0,0,0|2,0,0]=3 1128 B5R0.2 NCCSN=O Amb27950442 [1,0,0,0,0,0|3,0,0]=4 1129 B5R0.2 NCC\C=C\Cl Amb27391191 [1,0,0,0,0,0|2,0,1]=4 1130 B5R0.2 NNCCCF Amb25696672 [1,0,0,0,0,0|3,0,0]=4 1131 B5R0.2 NNCCCO Amb19514839 [1,0,0,0,0,0|2,0,1]=4 1132 B5R0.2 NNCCCO Amb22058994 [1,0,0,0,0,0|2,0,1]=4 1133 B5R0.2 NOCCCF Amb24632017 [1,0,0,0,0,0|3,0,0]=4 1134 B5R0.2 NOCCCO Amb18061671 [1,0,0,0,0,0|2,0,1]=4 1135 B5R0.2 NOCCCS Amb17608230 [1,0,0,0,0,0|3,0,0]=4 1136 B5R0.2 NOCCCS Amb27489799 [1,0,0,0,0,0|3,0,0]=4 1137 B5R0.2 O=BOCCBr Amb27954923 [1,0,0,0,0,0|3,0,0]=4 1138 B5R0.2 O=C=NCCBr Amb17194090 [1,0,0,0,0,0|2,0,1]=4 1139 B5R0.2 O=C=NCCCl Amb535458 [1,0,0,0,0,0|2,0,1]=4 1140 B5R0.2 O=C=NCCF Amb24710430 [1,0,0,0,0,0|2,0,1]=4 1141 B5R0.2 O=C=NCCO Amb27659445 [1,0,0,0,0,0|2,0,1]=4 1142 B5R0.2 O=CCCC=O Amb8395090 [1,0,0,0,0,0|1,0,1]=3 1143 B5R0.2 O=CCCCBr Amb18644189 [1,0,0,0,0,0|1,0,0]=2 1144 B5R0.2 O=CCCCCl Amb8395190 [1,0,0,0,0,0|1,0,0]=2 1145 B5R0.2 O=CCCCF Amb24056028 [1,0,0,0,0,0|1,0,0]=2 1146 B5R0.2 O=CCCCI Amb27249641 [1,0,0,0,0,0|1,0,0]=2 1147 B5R0.2 O=CCCCO Amb24589235 [1,0,0,0,0,0|1,0,0]=2 1148 B5R0.2 O=CCCSS Amb22524519 [1,0,0,0,0,0|2,0,0]=3 1149 B5R0.2 O=CCNC=O Amb26370295 [1,0,0,0,0,0|2,0,1]=4 1150 B5R0.2 O=CC\C=C\Cl Amb24571938 [1,0,0,0,0,0|1,0,2]=4 1151 B5R0.2 O=CNCCF Amb28205988 [1,0,0,0,0,0|2,0,0]=3 1152 B5R0.2 O=COCCBr Amb27816149 [1,0,0,0,0,0|2,0,0]=3 1153 B5R0.2 O=COCCO Amb26625741 [1,0,0,0,0,0|2,0,0]=3 1154 B5R0.2 O=C\C=C\CCl Amb18122401 [1,0,0,0,0,0|1,0,2]=4 1155 B5R0.2 O=C\C=C\CF Amb33475269 [1,0,0,0,0,0|1,0,2]=4 1156 B5R0.2 O=C\C=C\CO Amb24356008 [1,0,0,0,0,0|1,0,2]=4 1157 B5R0.2 O=NOCCCl Amb27205298 [1,0,0,0,0,0|3,0,0]=4 1158 B5R0.2 O=NOCCI Amb28188003 [1,0,0,0,0,0|3,0,0]=4 1159 B5R0.2 O=NOCCO Amb22363071 [1,0,0,0,0,0|3,0,0]=4 1160 B5R0.2 O=S=NCCCl Amb27634384 [1,0,0,0,0,0|3,0,0]=4 1161 B5R0.2 OCCCCBr Amb8395353 [1,0,0,0,0,0|1,0,1]=3 1162 B5R0.2 OCCCCCl Amb1101976 [1,0,0,0,0,0|1,0,1]=3 1163 B5R0.2 OCCCCF Amb17593046 [1,0,0,0,0,0|1,0,1]=3 1164 B5R0.2 OCCCCO Amb2793029 [1,0,0,0,0,0|1,0,1]=3 1165 B5R0.2 OCCNCO Amb22228429 [1,0,0,0,0,0|2,0,1]=4 1166 B5R0.2 OCCOCCl Amb24673634 [1,0,0,0,0,0|2,0,1]=4 1167 B5R0.2 OCC\C=C\Br Amb27425005 [1,0,0,0,0,0|2,0,1]=4 1168 B5R0.2 OCC\C=C\Cl Amb27859286 [1,0,0,0,0,0|2,0,1]=4 1169 B5R0.2 OCC\N=N\O Amb25747385 [1,0,0,0,0,0|3,0,0]=4 1170 B5R0.2 ONCCCF Amb25931859 [1,0,0,0,0,0|2,0,0]=3 1171 B5R0.2 O\C=N\CCCl Amb24684796 [1,0,0,0,0,0|2,0,0]=3 1172 B5R0.2 SCCCCS Amb8513069 [1,0,0,0,0,0|1,1,1]=4 1173 B5R0.2 [C-]#[N+]CCCC Amb2235001 [1,0,0,0,0,0|2,0,0]=3 1174 B5R0.2 [C-]#[N+]CCCF Amb26423847 [1,0,0,0,0,0|3,0,0]=4 1175 B5R0.2 [C-]#[N+]CCOC Amb1981032 [1,0,0,0,0,0|3,0,0]=4 1176 B5R0.2 [C-]#[N+]CCSC Amb27222323 [1,0,0,0,0,0|3,0,0]=4 1177 B5R0.2 [N-]=[N+]=NCC=O Amb26953499 [1,0,0,0,0,0|3,0,0]=4 1178 B7R0.2 C#CC(C)CC(=O)O Amb27246384 [0,1,0,0,0,0|0,0,2]=3 1179 B7R0.2 C#C[C@H](O)CC(=O)O Amb28285208 [0,1,0,0,0,0|0,0,2]=3 1180 B7R0.2 C=C(Br)CC(O)CO Amb27206509 [0,1,0,0,0,0|3,0,0]=4 1181 B7R0.2 C=C(Br)C[C@@H](C)CO Amb28069642 [0,1,0,0,0,0|3,0,0]=4 1182 B7R0.2 C=C(Br)C[C@H](C)CO Amb27196706 [0,1,0,0,0,0|3,0,0]=4 1183 B7R0.2 C=C(C)CC(=O)CC Amb27600284 [0,1,0,0,0,0|2,0,1]=4 1184 B7R0.2 C=C(C)CC(C)CBr Amb32688065 [0,1,0,0,0,0|3,0,0]=4 1185 B7R0.2 C=C(C)CC(C)CC Amb22228340 [0,1,0,0,0,0|2,0,0]=3 1186 B7R0.2 C=C(C)CC(C)CCl Amb32688064 [0,1,0,0,0,0|3,0,0]=4 1187 B7R0.2 C=C(C)CC(F)CO Amb28079110 [0,1,0,0,0,0|3,0,0]=4 1188 B7R0.2 C=C(C)CC(N)CO Amb24665584 [0,1,0,0,0,0|3,0,0]=4 1189 B7R0.2 C=C(C)CC(O)CN Amb33199504 [0,1,0,0,0,0|3,0,0]=4 1190 B7R0.2 C=C(C)C[C@H](N)CO Amb27633094 [0,1,0,0,0,0|3,0,0]=4 1191 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [0,1,0,0,0,0|0,0,1]=2 1192 B7R0.2 C=C(CC)CC(C)O Amb27477686 [0,1,0,0,0,0|1,0,2]=4 1193 B7R0.2 C=C(CC)CC(N)=O Amb27394598 [0,1,0,0,0,0|1,0,1]=3 1194 B7R0.2 C=C(CC)OC(C)=O Amb25202254 [0,1,0,0,0,0|2,0,1]=4 1195 B7R0.2 C=C(Cl)CC(C)CBr Amb32688072 [0,1,0,0,0,0|3,0,0]=4 1196 B7R0.2 C=C(Cl)CC(C)CCl Amb32688071 [0,1,0,0,0,0|3,0,0]=4 1197 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [0,1,0,0,0,0|3,0,0]=4 1198 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [0,1,0,0,0,0|0,0,2]=3 1199 B7R0.2 C=CC(C)CC(C)=O Amb27759897 [0,1,0,0,0,0|1,0,2]=4 1200 B7R0.2 C=CC(C)CC(N)=O Amb27168118 [0,1,0,0,0,0|1,0,2]=4 1201 B7R0.2 C=CC(N)CC(=O)O Amb22641963 [0,1,0,0,0,0|0,0,2]=3 1202 B7R0.2 C=CC(N)CC(=O)O Amb31307621 [0,1,0,0,0,0|0,0,2]=3 1203 B7R0.2 C=CC(O)CC(=O)O Amb18641866 [0,1,0,0,0,0|0,0,2]=3 1204 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [0,1,0,0,0,0|0,0,2]=3 1205 B7R0.2 C=C[C@@H](N)CC(=O)O Amb28315938 [0,1,0,0,0,0|0,0,2]=3 1206 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [0,1,0,0,0,0|0,0,2]=3 1207 B7R0.2 CC(=O)CC(=O)CO Amb28316150 [0,1,0,0,0,0|2,0,1]=4 1208 B7R0.2 CC(=O)CC(C)C#N Amb18124227 [0,1,0,0,0,0|2,0,1]=4 1209 B7R0.2 CC(=O)CC(C)CCl Amb28313530 [0,1,0,0,0,0|2,0,0]=3 1210 B7R0.2 CC(=O)CC(C)CN Amb18251072 [0,1,0,0,0,0|2,0,0]=3 1211 B7R0.2 CC(=O)CC(N)CO Amb27240210 [0,1,0,0,0,0|2,0,0]=3 1212 B7R0.2 CC(=O)CC(O)CCl Amb27827457 [0,1,0,0,0,0|2,0,0]=3 1213 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [0,1,0,0,0,0|2,0,1]=4 1214 B7R0.2 CC(=O)C[C@@H](O)CCl Amb27817734 [0,1,0,0,0,0|2,0,0]=3 1215 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [0,1,0,0,0,0|2,0,1]=4 1216 B7R0.2 CC(=O)C[C@H](O)CO Amb28316148 [0,1,0,0,0,0|2,0,0]=3 1217 B7R0.2 CC(=O)NC(C)CCl Amb33542146 [0,1,0,0,0,0|3,0,0]=4 1218 B7R0.2 CC(=O)NC(C)CO Amb9276356 [0,1,0,0,0,0|3,0,0]=4 1219 B7R0.2 CC(=O)N[C@@H](C)CN Amb27768700 [0,1,0,0,0,0|3,0,0]=4 1220 B7R0.2 CC(=O)N[C@@H](C)CO Amb26515722 [0,1,0,0,0,0|3,0,0]=4 1221 B7R0.2 CC(=O)N[C@H](C)CO Amb24426644 [0,1,0,0,0,0|3,0,0]=4 1222 B7R0.2 CC(=O)OC(Br)CBr Amb21520423 [0,1,0,0,0,0|3,0,0]=4 1223 B7R0.2 CC(=O)OC(C)CBr Amb26477506 [0,1,0,0,0,0|3,0,0]=4 1224 B7R0.2 CC(=O)OC(C)CN Amb27838841 [0,1,0,0,0,0|3,0,0]=4 1225 B7R0.2 CC(=O)OC(F)CBr Amb28239801 [0,1,0,0,0,0|3,0,0]=4 1226 B7R0.2 CC(=O)OC(F)CCl Amb27473993 [0,1,0,0,0,0|3,0,0]=4 1227 B7R0.2 CC(=O)OC(O)CN Amb27839430 [0,1,0,0,0,0|3,0,0]=4 1228 B7R0.2 CC(=O)SC(C)CBr Amb27983834 [0,1,0,0,0,0|3,0,0]=4 1229 B7R0.2 CC(=O)SC(C)CCl Amb27253145 [0,1,0,0,0,0|3,0,0]=4 1230 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,1,0,0,0,0|1,0,1]=3 1231 B7R0.2 CC(C#N)CC(=O)[O-] Amb32952895 [0,1,0,0,0,0|1,0,2]=4 1232 B7R0.2 CC(CC(=O)O)NN Amb28346224 [0,1,0,0,0,0|2,0,0]=3 1233 B7R0.2 CC(CC(=O)O)NN Amb33141007 [0,1,0,0,0,0|2,0,0]=3 1234 B7R0.2 CC(CCl)CC(=O)Cl Amb27949867 [0,1,0,0,0,0|2,0,0]=3 1235 B7R0.2 CC(CCl)CS(=O)Cl Amb32720419 [0,1,0,0,0,0|3,0,0]=4 1236 B7R0.2 CC(CCl)CS(=O)[O-] Amb32754348 [0,1,0,0,0,0|2,0,1]=4 1237 B7R0.2 CC(CCl)CS(N)=O Amb32720421 [0,1,0,0,0,0|3,0,0]=4 1238 B7R0.2 CC(CCl)OC(=O)Cl Amb27482960 [0,1,0,0,0,0|3,0,0]=4 1239 B7R0.2 CC(CCl)OC(=O)F Amb27424209 [0,1,0,0,0,0|3,0,0]=4 1240 B7R0.2 CC(CF)CC(=O)O Amb25990964 [0,1,0,0,0,0|1,0,0]=2 1241 B7R0.2 CC(CN)CB(O)O Amb27166460 [0,1,0,0,0,0|2,0,1]=4 1242 B7R0.2 CC(CN)CC(=O)O Amb18124263 [0,1,0,0,0,0|1,0,0]=2 1243 B7R0.2 CC(CN)CC(=O)O Amb20669501 [0,1,0,0,0,0|1,0,0]=2 1244 B7R0.2 CC(CN)CC(=O)O Amb32752805 [0,1,0,0,0,0|1,0,0]=2 1245 B7R0.2 CC(CN)CC(N)=O Amb18641899 [0,1,0,0,0,0|2,0,0]=3 1246 B7R0.2 CC(CN)CP(O)O Amb27838320 [0,1,0,0,0,0|2,0,1]=4 1247 B7R0.2 CC(CN)NC(N)=O Amb18202682 [0,1,0,0,0,0|3,0,0]=4 1248 B7R0.2 CC(CN)O[PH](=O)O Amb28388782 [0,1,0,0,0,0|3,0,0]=4 1249 B7R0.2 CC(CO)CC(=O)O Amb18198168 [0,1,0,0,0,0|1,0,0]=2 1250 B7R0.2 CC(CO)CC(=O)[O-] Amb33329956 [0,1,0,0,0,0|1,0,1]=3 1251 B7R0.2 CC(CO)OC(N)=O Amb26402233 [0,1,0,0,0,0|3,0,0]=4 1252 B7R0.2 CC(O)CC(C)CN Amb19337142 [0,1,0,0,0,0|2,0,1]=4 1253 B7R0.2 CC(O)CC(O)CF Amb27978648 [0,1,0,0,0,0|2,0,1]=4 1254 B7R0.2 CC(O)C[C@H](C)CO Amb27394893 [0,1,0,0,0,0|2,0,1]=4 1255 B7R0.2 CC(O)C[C@H](O)CO Amb27397070 [0,1,0,0,0,0|2,0,1]=4 1256 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [0,1,0,0,0,0|0,0,1]=2 1257 B7R0.2 CCC(=O)CC(C)=O Amb9775078 [0,1,0,0,0,0|1,0,1]=3 1258 B7R0.2 CCC(=O)CC(N)=O Amb8384375 [0,1,0,0,0,0|1,0,1]=3 1259 B7R0.2 CCC(=O)CC(O)O Amb28316114 [0,1,0,0,0,0|0,0,3]=4 1260 B7R0.2 CCC(=O)CS(C)=O Amb27464042 [0,1,0,0,0,0|2,0,1]=4 1261 B7R0.2 CCC(=O)C[C@@H](C)O Amb28316195 [0,1,0,0,0,0|1,0,2]=4 1262 B7R0.2 CCC(=O)NC(C)=O Amb27800787 [0,1,0,0,0,0|2,0,1]=4 1263 B7R0.2 CCC(=O)NC(N)=O Amb27643460 [0,1,0,0,0,0|2,0,1]=4 1264 B7R0.2 CCC(=O)OC(C)=O Amb21858081 [0,1,0,0,0,0|2,0,1]=4 1265 B7R0.2 CCC(Br)C=C(C)C Amb27831341 [0,1,0,0,0,0|2,0,1]=4 1266 B7R0.2 CCC(C)CB(O)O Amb27591902 [0,1,0,0,0,0|1,0,1]=3 1267 B7R0.2 CCC(C)CC(=N)N Amb10607625 [0,1,0,0,0,0|2,0,0]=3 1268 B7R0.2 CCC(C)CC(=N)N Amb19890168 [0,1,0,0,0,0|2,0,0]=3 1269 B7R0.2 CCC(C)CC(=O)Cl Amb10844649 [0,1,0,0,0,0|1,0,0]=2 1270 B7R0.2 CCC(C)CC(=O)O Amb2689581 [0,1,0,0,0,0|0,0,0]=1 1271 B7R0.2 CCC(C)CC(C)=O Amb10608208 [0,1,0,0,0,0|1,0,0]=2 1272 B7R0.2 CCC(C)CC(C)Br Amb24757470 [0,1,0,0,0,0|2,0,1]=4 1273 B7R0.2 CCC(C)CC(C)C Amb22228298 [0,1,0,0,0,0|2,0,1]=4 1274 B7R0.2 CCC(C)CC(C)Cl Amb27639190 [0,1,0,0,0,0|2,0,1]=4 1275 B7R0.2 CCC(C)CC(C)N Amb10069423 [0,1,0,0,0,0|2,0,1]=4 1276 B7R0.2 CCC(C)CC(C)N Amb3940647 [0,1,0,0,0,0|2,0,1]=4 1277 B7R0.2 CCC(C)CC(C)O Amb4035421 [0,1,0,0,0,0|1,0,1]=3 1278 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,1,0,0,0,0|1,0,0]=2 1279 B7R0.2 CCC(C)CC(N)=S Amb26989527 [0,1,0,0,0,0|1,1,0]=3 1280 B7R0.2 CCC(C)CN(C)O Amb33373890 [0,1,0,0,0,0|2,0,0]=3 1281 B7R0.2 CCC(C)CS(=O)Cl Amb32720505 [0,1,0,0,0,0|2,0,0]=3 1282 B7R0.2 CCC(C)CS(=O)[O-] Amb27408549 [0,1,0,0,0,0|1,0,1]=3 1283 B7R0.2 CCC(C)CS(C)=O Amb27837877 [0,1,0,0,0,0|2,0,0]=3 1284 B7R0.2 CCC(C)CS(N)=O Amb32720506 [0,1,0,0,0,0|2,0,0]=3 1285 B7R0.2 CCC(C)C[C@@H](C)N Amb29854163 [0,1,0,0,0,0|2,0,1]=4 1286 B7R0.2 CCC(C)C[C@@H](C)O Amb33318318 [0,1,0,0,0,0|1,0,1]=3 1287 B7R0.2 CCC(C)C[C@H](C)N Amb29854162 [0,1,0,0,0,0|2,0,1]=4 1288 B7R0.2 CCC(C)C[C@H](C)O Amb33318389 [0,1,0,0,0,0|1,0,1]=3 1289 B7R0.2 CCC(C)C[N+](=O)[O-] Amb25075983 [0,1,0,0,0,0|1,0,1]=3 1290 B7R0.2 CCC(C)NC(=O)Cl Amb27838339 [0,1,0,0,0,0|2,0,0]=3 1291 B7R0.2 CCC(C)NC(C)=O Amb3358085 [0,1,0,0,0,0|2,0,0]=3 1292 B7R0.2 CCC(C)NC(N)=O Amb9702507 [0,1,0,0,0,0|2,0,0]=3 1293 B7R0.2 CCC(C)NC(N)=S Amb378358 [0,1,0,0,0,0|2,1,0]=4 1294 B7R0.2 CCC(C)NS(C)=O Amb27245049 [0,1,0,0,0,0|3,0,0]=4 1295 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [0,1,0,0,0,0|2,0,0]=3 1296 B7R0.2 CCC(C)O[N+](=O)[O-] Amb25088971 [0,1,0,0,0,0|2,0,1]=4 1297 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [0,1,0,0,0,0|2,0,0]=3 1298 B7R0.2 CCC(Cl)CC(C)=O Amb28121450 [0,1,0,0,0,0|1,0,0]=2 1299 B7R0.2 CCC(Cl)CC(C)C Amb28399717 [0,1,0,0,0,0|2,0,1]=4 1300 B7R0.2 CCC(Cl)CC(C)Cl Amb28076666 [0,1,0,0,0,0|2,0,1]=4 1301 B7R0.2 CCC(Cl)OC(C)=O Amb27392214 [0,1,0,0,0,0|2,0,0]=3 1302 B7R0.2 CCC(Cl)SC(=O)Cl Amb27945612 [0,1,0,0,0,0|2,0,0]=3 1303 B7R0.2 CCC(Cl)SC(C)=O Amb27407733 [0,1,0,0,0,0|2,0,0]=3 1304 B7R0.2 CCC(N)C=C(C)C Amb27450297 [0,1,0,0,0,0|2,0,1]=4 1305 B7R0.2 CCC(N)CC(=O)O Amb1993862 [0,1,0,0,0,0|0,0,0]=1 1306 B7R0.2 CCC(N)CC(=O)O Amb8631361 [0,1,0,0,0,0|0,0,0]=1 1307 B7R0.2 CCC(N)CC(C)=O Amb18631696 [0,1,0,0,0,0|1,0,0]=2 1308 B7R0.2 CCC(N)CC(C)=O Amb26895708 [0,1,0,0,0,0|1,0,0]=2 1309 B7R0.2 CCC(N)CC(C)C Amb18523780 [0,1,0,0,0,0|2,0,1]=4 1310 B7R0.2 CCC(N)CC(C)O Amb27604743 [0,1,0,0,0,0|1,0,1]=3 1311 B7R0.2 CCC(N)CC(F)F Amb28200428 [0,1,0,0,0,0|2,0,1]=4 1312 B7R0.2 CCC(N)CC(N)=O Amb25727686 [0,1,0,0,0,0|1,0,0]=2 1313 B7R0.2 CCC(N)CC(N)=S Amb28078345 [0,1,0,0,0,0|1,1,0]=3 1314 B7R0.2 CCC(N)CN(C)C Amb9763888 [0,1,0,0,0,0|3,0,0]=4 1315 B7R0.2 CCC(O)CC(=O)O Amb10844270 [0,1,0,0,0,0|0,0,0]=1 1316 B7R0.2 CCC(O)CC(C)=O Amb25065181 [0,1,0,0,0,0|1,0,0]=2 1317 B7R0.2 CCC(O)CC(C)N Amb35591053 [0,1,0,0,0,0|2,0,1]=4 1318 B7R0.2 CCC(O)CC(C)O Amb26515705 [0,1,0,0,0,0|1,0,1]=3 1319 B7R0.2 CCC(O)CC(C)S Amb27766599 [0,1,0,0,0,0|1,1,1]=4 1320 B7R0.2 CCC(O)CN(C)C Amb9787532 [0,1,0,0,0,0|3,0,0]=4 1321 B7R0.2 CCC(O)CN(C)N Amb27472509 [0,1,0,0,0,0|3,0,0]=4 1322 B7R0.2 CCC(O)CS(C)=O Amb28457838 [0,1,0,0,0,0|2,0,0]=3 1323 B7R0.2 CCC(O)C[N+](=O)[O-] Amb25136685 [0,1,0,0,0,0|1,0,1]=3 1324 B7R0.2 CCC(O)OC(C)=O Amb28256771 [0,1,0,0,0,0|2,0,0]=3 1325 B7R0.2 CCC(S)CN(C)C Amb26512113 [0,1,0,0,0,0|3,0,0]=4 1326 B7R0.2 CCC(S)NC(=N)N Amb27804188 [0,1,0,0,0,0|3,0,0]=4 1327 B7R0.2 CCN(C)CC(=N)N Amb8890870 [0,1,0,0,0,0|3,0,0]=4 1328 B7R0.2 CCN(C)CC(=O)O Amb33620688 [0,1,0,0,0,0|1,0,0]=2 1329 B7R0.2 CCN(C)CC(=O)O Amb8428140 [0,1,0,0,0,0|1,0,0]=2 1330 B7R0.2 CCN(C)CC(C)=O Amb8427987 [0,1,0,0,0,0|2,0,0]=3 1331 B7R0.2 CCN(C)CC(C)=O Amb9173327 [0,1,0,0,0,0|2,0,0]=3 1332 B7R0.2 CCN(C)CC(C)O Amb17334070 [0,1,0,0,0,0|2,0,1]=4 1333 B7R0.2 CCN(C)CC(N)=O Amb27639873 [0,1,0,0,0,0|2,0,0]=3 1334 B7R0.2 CCN(C)C[C@@H](C)O Amb28316159 [0,1,0,0,0,0|2,0,1]=4 1335 B7R0.2 CCN(O)CC(=O)O Amb28195485 [0,1,0,0,0,0|1,0,0]=2 1336 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,1,0,0,0,0|1,0,0]=2 1337 B7R0.2 CCS(=O)CC(C)=O Amb26873160 [0,1,0,0,0,0|2,0,0]=3 1338 B7R0.2 CCS(=O)CC(N)=O Amb27762121 [0,1,0,0,0,0|2,0,0]=3 1339 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [0,1,0,0,0,0|0,0,0]=1 1340 B7R0.2 CC[C@@H](C)NC(C)=S Amb28119994 [0,1,0,0,0,0|2,1,0]=4 1341 B7R0.2 CC[C@@H](C)NC(N)=S Amb27468074 [0,1,0,0,0,0|2,1,0]=4 1342 B7R0.2 CC[C@@H](Cl)C[C@@H](C)Cl Amb27984838 [0,1,0,0,0,0|2,0,1]=4 1343 B7R0.2 CC[C@@H](Cl)C[C@H](C)Cl Amb28118942 [0,1,0,0,0,0|2,0,1]=4 1344 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [0,1,0,0,0,0|0,0,0]=1 1345 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [0,1,0,0,0,0|0,0,0]=1 1346 B7R0.2 CC[C@@H](N)CN(C)C Amb22587558 [0,1,0,0,0,0|3,0,0]=4 1347 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [0,1,0,0,0,0|0,0,0]=1 1348 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [0,1,0,0,0,0|1,0,0]=2 1349 B7R0.2 CC[C@@H](O)CC(C)C Amb27603599 [0,1,0,0,0,0|2,0,1]=4 1350 B7R0.2 CC[C@@H](O)C[C@@H](C)O Amb4166323 [0,1,0,0,0,0|1,0,1]=3 1351 B7R0.2 CC[C@@H](O)C[C@H](C)O Amb27946301 [0,1,0,0,0,0|1,0,1]=3 1352 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [0,1,0,0,0,0|0,0,0]=1 1353 B7R0.2 CC[C@H](C)CC(C)O Amb27437194 [0,1,0,0,0,0|1,0,1]=3 1354 B7R0.2 CC[C@H](C)NC(=N)N Amb27618574 [0,1,0,0,0,0|3,0,0]=4 1355 B7R0.2 CC[C@H](C)NC(N)=S Amb25922529 [0,1,0,0,0,0|2,1,0]=4 1356 B7R0.2 CC[C@H](C)OC(=N)N Amb27985381 [0,1,0,0,0,0|3,0,0]=4 1357 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [0,1,0,0,0,0|0,0,0]=1 1358 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [0,1,0,0,0,0|0,0,0]=1 1359 B7R0.2 CC[C@H](N)CN(C)C Amb22587381 [0,1,0,0,0,0|3,0,0]=4 1360 B7R0.2 CC[C@H](N)CN(C)C Amb23385277 [0,1,0,0,0,0|3,0,0]=4 1361 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [0,1,0,0,0,0|0,0,0]=1 1362 B7R0.2 CC[C@H](O)CC(C)=O Amb26980782 [0,1,0,0,0,0|1,0,0]=2 1363 B7R0.2 CC[C@H](O)C[C@@H](C)O Amb27790287 [0,1,0,0,0,0|1,0,1]=3 1364 B7R0.2 CC\C(Br)=C\C(=O)O Amb27409320 [0,1,0,0,0,0|0,0,2]=3 1365 B7R0.2 CC\C(C)=C/C(=O)O Amb18281014 [0,1,0,0,0,0|0,0,2]=3 1366 B7R0.2 CC\C(C)=C/C(C)=O Amb27424977 [0,1,0,0,0,0|1,0,2]=4 1367 B7R0.2 CC\C(C)=C\C(=O)O Amb33528462 [0,1,0,0,0,0|0,0,2]=3 1368 B7R0.2 CC\C(C)=C\C(C)=O Amb27985733 [0,1,0,0,0,0|1,0,2]=4 1369 B7R0.2 CC\C(F)=C/C(=O)O Amb27780201 [0,1,0,0,0,0|0,0,2]=3 1370 B7R0.2 CC\C(N)=C\C(=O)O Amb28145108 [0,1,0,0,0,0|0,0,2]=3 1371 B7R0.2 CC\C(N)=C\C(N)=O Amb27621383 [0,1,0,0,0,0|1,0,2]=4 1372 B7R0.2 CC\C(N)=N\C(C)=O Amb27391863 [0,1,0,0,0,0|2,0,1]=4 1373 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [0,1,0,0,0,0|0,0,2]=3 1374 B7R0.2 CC\C(S)=C\C(C)=O Amb27775797 [0,1,0,0,0,0|1,0,2]=4 1375 B7R0.2 CC\C([O-])=C\C(C)=O Amb19960031 [0,1,0,0,0,0|1,0,2]=4 1376 B7R0.2 CN(CC(=O)O)N=O Amb17618622 [0,1,0,0,0,0|3,0,0]=4 1377 B7R0.2 CN(CO)CC(=O)O Amb27663224 [0,1,0,0,0,0|2,0,0]=3 1378 B7R0.2 CNC(=O)CC(=O)O Amb33529761 [0,1,0,0,0,0|1,0,1]=3 1379 B7R0.2 CNC(=O)CC(=O)[O-] Amb35747299 [0,1,0,0,0,0|1,0,2]=4 1380 B7R0.2 CNC(=O)CC(C)=O Amb6891968 [0,1,0,0,0,0|2,0,1]=4 1381 B7R0.2 CNC(=S)CC(C)=O Amb24096719 [0,1,0,0,0,0|2,0,1]=4 1382 B7R0.2 CNC(C)CC(=N)N Amb27815687 [0,1,0,0,0,0|3,0,0]=4 1383 B7R0.2 CNC(C)CC(=O)O Amb21959674 [0,1,0,0,0,0|1,0,0]=2 1384 B7R0.2 CNC(C)CC(=O)O Amb9398363 [0,1,0,0,0,0|1,0,0]=2 1385 B7R0.2 CNC(C)CC(C)O Amb27230907 [0,1,0,0,0,0|2,0,1]=4 1386 B7R0.2 CNC(C)CC(N)=O Amb17231826 [0,1,0,0,0,0|2,0,0]=3 1387 B7R0.2 CNC(C)CC(N)=O Amb19960012 [0,1,0,0,0,0|2,0,0]=3 1388 B7R0.2 CNC(C)CS(C)=O Amb24410768 [0,1,0,0,0,0|3,0,0]=4 1389 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [0,1,0,0,0,0|1,0,0]=2 1390 B7R0.2 COC(=O)CC(=O)Cl Amb3939073 [0,1,0,0,0,0|2,0,1]=4 1391 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,1,0,0,0,0|1,0,1]=3 1392 B7R0.2 COC(=O)CC(=O)[O-] Amb2780363 [0,1,0,0,0,0|1,0,2]=4 1393 B7R0.2 COC(=O)CC(=O)[O-] Amb34915950 [0,1,0,0,0,0|1,0,2]=4 1394 B7R0.2 COC(=O)CC(C)=O Amb6608655 [0,1,0,0,0,0|2,0,1]=4 1395 B7R0.2 COC(=O)CC(N)=O Amb22043417 [0,1,0,0,0,0|2,0,1]=4 1396 B7R0.2 COC(=S)CC(N)=O Amb27230798 [0,1,0,0,0,0|2,0,1]=4 1397 B7R0.2 COC(C)CC(=O)O Amb4001695 [0,1,0,0,0,0|1,0,0]=2 1398 B7R0.2 COC(C)CC(C)=O Amb26512071 [0,1,0,0,0,0|2,0,0]=3 1399 B7R0.2 COC(C)CC(C)O Amb22757067 [0,1,0,0,0,0|2,0,1]=4 1400 B7R0.2 COC(C)CC(N)=O Amb27838372 [0,1,0,0,0,0|2,0,0]=3 1401 B7R0.2 COC(C)CS(=O)Cl Amb32720528 [0,1,0,0,0,0|3,0,0]=4 1402 B7R0.2 COC(C)CS(=O)[O-] Amb25690482 [0,1,0,0,0,0|2,0,1]=4 1403 B7R0.2 COC(C)CS(N)=O Amb32720534 [0,1,0,0,0,0|3,0,0]=4 1404 B7R0.2 COC(C)NC(C)=O Amb27839138 [0,1,0,0,0,0|3,0,0]=4 1405 B7R0.2 CON(C)CC(=O)O Amb8010467 [0,1,0,0,0,0|2,0,0]=3 1406 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [0,1,0,0,0,0|1,0,0]=2 1407 B7R0.2 CO[C@H](C)CC(C)=O Amb26494510 [0,1,0,0,0,0|2,0,0]=3 1408 B7R0.2 CO\C(C)=C/C(=O)O Amb2611888 [0,1,0,0,0,0|1,0,2]=4 1409 B7R0.2 CO\C(C)=C\C(=O)O Amb27631657 [0,1,0,0,0,0|1,0,2]=4 1410 B7R0.2 CS(=O)CC(O)CN Amb24482487 [0,1,0,0,0,0|3,0,0]=4 1411 B7R0.2 CS(=O)CC(O)CN Amb32683521 [0,1,0,0,0,0|3,0,0]=4 1412 B7R0.2 CSC(C)CC(=O)O Amb18967824 [0,1,0,0,0,0|1,0,0]=2 1413 B7R0.2 CSC(C)CC(C)=O Amb25714199 [0,1,0,0,0,0|2,0,0]=3 1414 B7R0.2 CSC(C)CC(N)=O Amb27838848 [0,1,0,0,0,0|2,0,0]=3 1415 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [0,1,0,0,0,0|1,0,0]=2 1416 B7R0.2 C[C@@H](CCl)CC(=O)Cl Amb27855839 [0,1,0,0,0,0|2,0,0]=3 1417 B7R0.2 C[C@@H](CF)NC(N)=O Amb27660553 [0,1,0,0,0,0|3,0,0]=4 1418 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [0,1,0,0,0,0|1,0,0]=2 1419 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [0,1,0,0,0,0|1,0,0]=2 1420 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [0,1,0,0,0,0|1,0,0]=2 1421 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [0,1,0,0,0,0|1,0,0]=2 1422 B7R0.2 C[C@H](CN)NC(N)=O Amb28049036 [0,1,0,0,0,0|3,0,0]=4 1423 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [0,1,0,0,0,0|1,0,0]=2 1424 B7R0.2 C[C@H](O)C[C@H](O)CCl Amb27668776 [0,1,0,0,0,0|2,0,1]=4 1425 B7R0.2 C[C@H](O)C[C@H](O)CO Amb27472671 [0,1,0,0,0,0|2,0,1]=4 1426 B7R0.2 C\C(=C/C(=O)O)CO Amb18641871 [0,1,0,0,0,0|1,0,2]=4 1427 B7R0.2 C\C(CC(=O)O)=N/O Amb28388976 [0,1,0,0,0,0|2,0,1]=4 1428 B7R0.2 C\C=C(/C)CC(C)=O Amb28066574 [0,1,0,0,0,0|1,0,2]=4 1429 B7R0.2 C\C=C(\C)CC(C)=O Amb27637813 [0,1,0,0,0,0|1,0,2]=4 1430 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [0,1,0,0,0,0|0,0,2]=3 1431 B7R0.2 N#CC(N)CC(=O)O Amb27985578 [0,1,0,0,0,0|1,0,1]=3 1432 B7R0.2 N#CC(N)CC(N)=O Amb24122907 [0,1,0,0,0,0|2,0,1]=4 1433 B7R0.2 N#CC(O)CC(N)=O Amb28063048 [0,1,0,0,0,0|2,0,1]=4 1434 B7R0.2 NC(=O)CC(=O)CCl Amb27797889 [0,1,0,0,0,0|2,0,1]=4 1435 B7R0.2 NC(=O)CC(Br)CO Amb28384721 [0,1,0,0,0,0|2,0,0]=3 1436 B7R0.2 NC(=O)CC(N)CCl Amb26458731 [0,1,0,0,0,0|2,0,0]=3 1437 B7R0.2 NC(=O)CC(O)CO Amb25662216 [0,1,0,0,0,0|2,0,0]=3 1438 B7R0.2 NC(=O)CN(O)CBr Amb27863565 [0,1,0,0,0,0|3,0,0]=4 1439 B7R0.2 NC(=O)C[C@@H](O)CCl Amb27173051 [0,1,0,0,0,0|2,0,0]=3 1440 B7R0.2 NC(=O)C[C@H](O)CO Amb8388588 [0,1,0,0,0,0|2,0,0]=3 1441 B7R0.2 NC(=S)CC(O)CF Amb26626569 [0,1,0,0,0,0|2,1,0]=4 1442 B7R0.2 NC(=S)CC(O)CO Amb27793984 [0,1,0,0,0,0|2,1,0]=4 1443 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [0,1,0,0,0,0|1,0,1]=3 1444 B7R0.2 NC(CF)CC(=O)O Amb24428065 [0,1,0,0,0,0|1,0,0]=2 1445 B7R0.2 NC(CS)CC(=O)O Amb25090412 [0,1,0,0,0,0|1,0,0]=2 1446 B7R0.2 NCC(=O)C[PH](=O)O Amb27257536 [0,1,0,0,0,0|2,0,1]=4 1447 B7R0.2 NCC(F)C[PH](=O)O Amb28398603 [0,1,0,0,0,0|2,0,0]=3 1448 B7R0.2 NCC(N)CC(=O)O Amb19515145 [0,1,0,0,0,0|1,0,0]=2 1449 B7R0.2 NCC(N)CC(=O)O Amb21858324 [0,1,0,0,0,0|1,0,0]=2 1450 B7R0.2 NCC(N)CC(N)=O Amb27603845 [0,1,0,0,0,0|2,0,0]=3 1451 B7R0.2 NCC(O)CC(=O)O Amb32663899 [0,1,0,0,0,0|1,0,0]=2 1452 B7R0.2 NCC(O)CC(=O)O Amb33544754 [0,1,0,0,0,0|1,0,0]=2 1453 B7R0.2 NCC(O)CS(=O)O Amb27831981 [0,1,0,0,0,0|2,0,0]=3 1454 B7R0.2 NC[C@@H](F)CC(=O)O Amb27481078 [0,1,0,0,0,0|1,0,0]=2 1455 B7R0.2 NC[C@@H](F)CS(=O)O Amb27460870 [0,1,0,0,0,0|2,0,0]=3 1456 B7R0.2 NC[C@@H](F)C[PH](=O)O Amb24481490 [0,1,0,0,0,0|2,0,0]=3 1457 B7R0.2 NC[C@@H](N)CC(=O)O Amb10603267 [0,1,0,0,0,0|1,0,0]=2 1458 B7R0.2 NC[C@@H](O)CC(=O)O Amb32665211 [0,1,0,0,0,0|1,0,0]=2 1459 B7R0.2 NC[C@@H](O)CC(=O)O Amb8386098 [0,1,0,0,0,0|1,0,0]=2 1460 B7R0.2 NC[C@@H](O)CC(N)=O Amb27838875 [0,1,0,0,0,0|2,0,0]=3 1461 B7R0.2 NC[C@@H](O)C[PH](=O)O Amb27596096 [0,1,0,0,0,0|2,0,0]=3 1462 B7R0.2 NC[C@H](F)C[PH](=O)O Amb27216774 [0,1,0,0,0,0|2,0,0]=3 1463 B7R0.2 NC[C@H](O)CC(=O)O Amb8628962 [0,1,0,0,0,0|1,0,0]=2 1464 B7R0.2 NC[C@H](O)CP(=O)=O Amb28249133 [0,1,0,0,0,0|2,0,1]=4 1465 B7R0.2 NC\C(I)=C\C(=O)O Amb28386476 [0,1,0,0,0,0|1,0,2]=4 1466 B7R0.2 NNC(=O)CC(=O)O Amb25073925 [0,1,0,0,0,0|2,0,1]=4 1467 B7R0.2 N[C@@H](CO)CC(=O)O Amb16184020 [0,1,0,0,0,0|1,0,0]=2 1468 B7R0.2 N[C@@H](CO)CC(=O)O Amb22388520 [0,1,0,0,0,0|1,0,0]=2 1469 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [0,1,0,0,0,0|1,0,1]=3 1470 B7R0.2 N[C@H](CO)CC(=O)O Amb2694944 [0,1,0,0,0,0|1,0,0]=2 1471 B7R0.2 N[C@H](CS)CC(=O)O Amb28326106 [0,1,0,0,0,0|1,0,0]=2 1472 B7R0.2 N\C(CC(=O)O)=N/O Amb8384544 [0,1,0,0,0,0|2,0,1]=4 1473 B7R0.2 O=C(Cl)CC(=O)CCl Amb17593874 [0,1,0,0,0,0|2,0,1]=4 1474 B7R0.2 O=C(Cl)OC(Cl)CCl Amb27483797 [0,1,0,0,0,0|3,0,0]=4 1475 B7R0.2 O=C(O)CC(=O)CCl Amb18124484 [0,1,0,0,0,0|1,0,1]=3 1476 B7R0.2 O=C(O)CC(O)CBr Amb27592126 [0,1,0,0,0,0|1,0,0]=2 1477 B7R0.2 O=C(O)CC(O)CF Amb26557587 [0,1,0,0,0,0|1,0,0]=2 1478 B7R0.2 O=C(O)CC(O)CO Amb28120003 [0,1,0,0,0,0|1,0,0]=2 1479 B7R0.2 O=C(O)CC(O)CS Amb27244674 [0,1,0,0,0,0|1,0,0]=2 1480 B7R0.2 O=C(O)C[C@@H](O)CF Amb33377449 [0,1,0,0,0,0|1,0,0]=2 1481 B7R0.2 O=C(O)C[C@H](O)CBr Amb28325607 [0,1,0,0,0,0|1,0,0]=2 1482 B7R0.2 O=C(O)C[C@H](O)CCl Amb27830780 [0,1,0,0,0,0|1,0,0]=2 1483 B7R0.2 O=C(O)C[C@H](O)CF Amb33377451 [0,1,0,0,0,0|1,0,0]=2 1484 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [0,1,0,0,0,0|1,0,0]=2 1485 B7R0.2 O=C(O)C\C(Cl)=C\Cl Amb27812877 [0,1,0,0,0,0|1,0,2]=4 1486 B7R0.2 O=C(O)\C=C(/Br)CO Amb27424808 [0,1,0,0,0,0|1,0,2]=4 1487 B7R0.2 O=C(O)\C=C(\O)CBr Amb28458506 [0,1,0,0,0,0|1,0,2]=4 1488 B7R0.2 O=C([O-])CC(O)CO Amb24117078 [0,1,0,0,0,0|1,0,1]=3 1489 B7R0.2 O=CN(O)CC(=O)O Amb25367291 [0,1,0,0,0,0|2,0,1]=4 1490 B7R0.2 O=[N+]([O-])CC(O)CCl Amb28133599 [0,1,0,0,0,0|2,0,1]=4 1491 B7R0.3 C#CC(=C)CCCO Amb17593132 [0,1,0,0,0,0|3,0,0]=4 1492 B7R0.3 C#CC(=O)CCCC Amb28128200 [0,1,0,0,0,0|1,0,0]=2 1493 B7R0.3 C#CC(=O)CCCCl Amb27669507 [0,1,0,0,0,0|2,0,0]=3 1494 B7R0.3 C#CC(=O)CCCN Amb27631285 [0,1,0,0,0,0|2,0,0]=3 1495 B7R0.3 C#CC(=O)CCCO Amb27593195 [0,1,0,0,0,0|2,0,0]=3 1496 B7R0.3 C#CC(=O)NCCN Amb18950627 [0,1,0,0,0,0|3,0,0]=4 1497 B7R0.3 C#CC(=O)NCCN Amb31188137 [0,1,0,0,0,0|3,0,0]=4 1498 B7R0.3 C#CC(=O)NCCO Amb9361227 [0,1,0,0,0,0|3,0,0]=4 1499 B7R0.3 C#CC(=O)OCCBr Amb27437049 [0,1,0,0,0,0|3,0,0]=4 1500 B7R0.3 C#CC(=O)OCCC Amb27761363 [0,1,0,0,0,0|2,0,0]=3 1501 B7R0.3 C#CC(=O)OCCO Amb27589194 [0,1,0,0,0,0|3,0,0]=4 1502 B7R0.3 C#CC(Br)CCCC Amb27483407 [0,1,0,0,0,0|2,0,1]=4 1503 B7R0.3 C#CC(C)CCCC Amb33169085 [0,1,0,0,0,0|2,0,1]=4 1504 B7R0.3 C#CC(N)CCCC Amb25798992 [0,1,0,0,0,0|2,0,1]=4 1505 B7R0.3 C#CC(O)CCCN Amb30024282 [0,1,0,0,0,0|2,0,1]=4 1506 B7R0.3 C#CC(O)CCNC Amb35583646 [0,1,0,0,0,0|2,0,1]=4 1507 B7R0.3 C#CCCC(=O)NN Amb18636071 [0,1,0,0,0,0|1,0,2]=4 1508 B7R0.3 C#CCCC(=O)OC Amb18115985 [0,1,0,0,0,0|0,0,2]=3 1509 B7R0.3 C#CCCC(O)C=O Amb28246623 [0,1,0,0,0,0|0,0,3]=4 1510 B7R0.3 C#CCNC(=O)OC Amb26516332 [0,1,0,0,0,0|1,0,2]=4 1511 B7R0.3 C#CCOC(=O)OC Amb27148094 [0,1,0,0,0,0|1,0,2]=4 1512 B7R0.3 C#C[C@H](N)CCCC Amb27797061 [0,1,0,0,0,0|2,0,1]=4 1513 B7R0.3 C=C(C=O)CCC#N Amb17593125 [0,1,0,0,0,0|2,0,1]=4 1514 B7R0.3 C=C(C=O)CCCC Amb4025817 [0,1,0,0,0,0|1,0,0]=2 1515 B7R0.3 C=C(C=O)CCCO Amb28128165 [0,1,0,0,0,0|2,0,0]=3 1516 B7R0.3 C=C(C=O)CCOC Amb27948778 [0,1,0,0,0,0|2,0,0]=3 1517 B7R0.3 C=C(C=O)C\C=C\C Amb26441086 [0,1,0,0,0,0|1,0,2]=4 1518 B7R0.3 C=C(CBr)CCCC Amb25249105 [0,1,0,0,0,0|2,0,0]=3 1519 B7R0.3 C=C(CBr)CCCCl Amb27865558 [0,1,0,0,0,0|3,0,0]=4 1520 B7R0.3 C=C(CBr)CCOC Amb33387059 [0,1,0,0,0,0|3,0,0]=4 1521 B7R0.3 C=C(CBr)CCSC Amb33334988 [0,1,0,0,0,0|3,0,0]=4 1522 B7R0.3 C=C(CBr)CSCC Amb33435749 [0,1,0,0,0,0|3,0,0]=4 1523 B7R0.3 C=C(CC)CCCBr Amb27491082 [0,1,0,0,0,0|3,0,0]=4 1524 B7R0.3 C=C(CC)CCCC Amb9787281 [0,1,0,0,0,0|2,0,0]=3 1525 B7R0.3 C=C(CC)CCCCl Amb28397002 [0,1,0,0,0,0|3,0,0]=4 1526 B7R0.3 C=C(CC)CCCN Amb27631266 [0,1,0,0,0,0|3,0,0]=4 1527 B7R0.3 C=C(CC)CCCO Amb26032857 [0,1,0,0,0,0|3,0,0]=4 1528 B7R0.3 C=C(CC)CCNC Amb28325353 [0,1,0,0,0,0|3,0,0]=4 1529 B7R0.3 C=C(CC)CSCC Amb28291726 [0,1,0,0,0,0|3,0,0]=4 1530 B7R0.3 C=C(CCl)CCCC Amb25889368 [0,1,0,0,0,0|2,0,0]=3 1531 B7R0.3 C=C(CCl)CCOC Amb33220591 [0,1,0,0,0,0|3,0,0]=4 1532 B7R0.3 C=C(CCl)CCSC Amb33259848 [0,1,0,0,0,0|3,0,0]=4 1533 B7R0.3 C=C(CCl)CSCC Amb24529097 [0,1,0,0,0,0|3,0,0]=4 1534 B7R0.3 C=C(CN)CCCC Amb27630595 [0,1,0,0,0,0|2,0,0]=3 1535 B7R0.3 C=C(CN)CCOC Amb33377483 [0,1,0,0,0,0|3,0,0]=4 1536 B7R0.3 C=C(CN)CCSC Amb33198280 [0,1,0,0,0,0|3,0,0]=4 1537 B7R0.3 C=C(CN)CSCC Amb27805084 [0,1,0,0,0,0|3,0,0]=4 1538 B7R0.3 C=C=C(C)CCCBr Amb27876055 [0,1,0,0,0,0|3,0,0]=4 1539 B7R0.3 C=C=C(C)CCCN Amb27839400 [0,1,0,0,0,0|3,0,0]=4 1540 B7R0.3 C=C=C(C)CCCO Amb28321385 [0,1,0,0,0,0|3,0,0]=4 1541 B7R0.3 C=CC(=O)CCCC Amb25062494 [0,1,0,0,0,0|1,0,0]=2 1542 B7R0.3 C=CC(=O)CCCCl Amb24568327 [0,1,0,0,0,0|2,0,0]=3 1543 B7R0.3 C=CC(=O)CCOC Amb24744935 [0,1,0,0,0,0|2,0,0]=3 1544 B7R0.3 C=CC(=O)CCSC Amb25334636 [0,1,0,0,0,0|2,0,0]=3 1545 B7R0.3 C=CC(=O)COCC Amb27248148 [0,1,0,0,0,0|2,0,0]=3 1546 B7R0.3 C=CC(=O)CSCC Amb25865187 [0,1,0,0,0,0|2,0,0]=3 1547 B7R0.3 C=CC(=O)C\C=C\C Amb26475455 [0,1,0,0,0,0|1,0,2]=4 1548 B7R0.3 C=CC(=O)NCCBr Amb28325545 [0,1,0,0,0,0|3,0,0]=4 1549 B7R0.3 C=CC(=O)NCCC Amb9480391 [0,1,0,0,0,0|2,0,0]=3 1550 B7R0.3 C=CC(=O)NCCCl Amb20668986 [0,1,0,0,0,0|3,0,0]=4 1551 B7R0.3 C=CC(=O)NCCF Amb27805492 [0,1,0,0,0,0|3,0,0]=4 1552 B7R0.3 C=CC(=O)NCCN Amb18291565 [0,1,0,0,0,0|3,0,0]=4 1553 B7R0.3 C=CC(=O)NCCN Amb19514971 [0,1,0,0,0,0|3,0,0]=4 1554 B7R0.3 C=CC(=O)NCCO Amb9361225 [0,1,0,0,0,0|3,0,0]=4 1555 B7R0.3 C=CC(=O)NCOC Amb27467338 [0,1,0,0,0,0|3,0,0]=4 1556 B7R0.3 C=CC(=O)NCSC Amb27167368 [0,1,0,0,0,0|3,0,0]=4 1557 B7R0.3 C=CC(=O)NOCC Amb27234385 [0,1,0,0,0,0|3,0,0]=4 1558 B7R0.3 C=CC(=O)OCCC Amb22045218 [0,1,0,0,0,0|2,0,0]=3 1559 B7R0.3 C=CC(=O)OCCF Amb2688098 [0,1,0,0,0,0|3,0,0]=4 1560 B7R0.3 C=CC(=O)\C=C\CC Amb27156684 [0,1,0,0,0,0|1,0,2]=4 1561 B7R0.3 C=CC(Br)CCCC Amb25758328 [0,1,0,0,0,0|2,0,1]=4 1562 B7R0.3 C=CC(C)CCCC Amb22641469 [0,1,0,0,0,0|2,0,1]=4 1563 B7R0.3 C=CC(O)CCOC Amb27868318 [0,1,0,0,0,0|2,0,1]=4 1564 B7R0.3 C=CC(O)CCSC Amb28123529 [0,1,0,0,0,0|2,0,1]=4 1565 B7R0.3 C=CC(O)COCC Amb28316201 [0,1,0,0,0,0|2,0,1]=4 1566 B7R0.3 C=CC(O)CSCC Amb24543994 [0,1,0,0,0,0|2,0,1]=4 1567 B7R0.3 C=CCCC(=N)NO Amb26959869 [0,1,0,0,0,0|1,0,2]=4 1568 B7R0.3 C=CCCC(=O)C#N Amb27749803 [0,1,0,0,0,0|1,0,2]=4 1569 B7R0.3 C=CCCC(=O)CBr Amb22059627 [0,1,0,0,0,0|1,0,2]=4 1570 B7R0.3 C=CCCC(=O)CC Amb9031676 [0,1,0,0,0,0|1,0,2]=4 1571 B7R0.3 C=CCCC(=O)CCl Amb22059504 [0,1,0,0,0,0|1,0,2]=4 1572 B7R0.3 C=CCCC(=O)CF Amb28074643 [0,1,0,0,0,0|1,0,2]=4 1573 B7R0.3 C=CCCC(=O)NC Amb25041195 [0,1,0,0,0,0|1,0,2]=4 1574 B7R0.3 C=CCCC(=O)NN Amb27775332 [0,1,0,0,0,0|1,0,2]=4 1575 B7R0.3 C=CCCC(=O)NN Amb27831946 [0,1,0,0,0,0|1,0,2]=4 1576 B7R0.3 C=CCCC(=O)NO Amb28205003 [0,1,0,0,0,0|0,0,2]=3 1577 B7R0.3 C=CCCC(=O)OC Amb2369959 [0,1,0,0,0,0|0,0,2]=3 1578 B7R0.3 C=CCCC(O)C=O Amb27863605 [0,1,0,0,0,0|0,0,3]=4 1579 B7R0.3 C=CCNC(=O)CO Amb33531863 [0,1,0,0,0,0|1,0,2]=4 1580 B7R0.3 C=CCNC(=O)NO Amb28134073 [0,1,0,0,0,0|1,0,2]=4 1581 B7R0.3 C=CCNC(=O)OC Amb17794125 [0,1,0,0,0,0|1,0,2]=4 1582 B7R0.3 C=CCOC(=O)OC Amb8515646 [0,1,0,0,0,0|1,0,2]=4 1583 B7R0.3 C=C[C@@H](Cl)CCCC Amb27954902 [0,1,0,0,0,0|2,0,1]=4 1584 B7R0.3 C=C[C@@H](N)CCCC Amb27477524 [0,1,0,0,0,0|2,0,1]=4 1585 B7R0.3 C=C[C@H](Cl)CCCC Amb27590978 [0,1,0,0,0,0|2,0,1]=4 1586 B7R0.3 C=C[C@H](O)CCCO Amb27423134 [0,1,0,0,0,0|2,0,1]=4 1587 B7R0.3 CC#CCC(=O)OC Amb6336504 [0,1,0,0,0,0|0,0,2]=3 1588 B7R0.3 CC(C=O)CCCBr Amb26526795 [0,1,0,0,0,0|2,0,1]=4 1589 B7R0.3 CC(CO)CCCN Amb17569904 [0,1,0,0,0,0|2,0,1]=4 1590 B7R0.3 CC(CO)CCCN Amb32686956 [0,1,0,0,0,0|2,0,1]=4 1591 B7R0.3 CC(CO)CCCO Amb25098490 [0,1,0,0,0,0|2,0,1]=4 1592 B7R0.3 CC=C=CC(=O)OC Amb26575881 [0,1,0,0,0,0|0,0,3]=4 1593 B7R0.3 CCC#CC(=O)OC Amb27838321 [0,1,0,0,0,0|0,0,2]=3 1594 B7R0.3 CCC(=O)CCC#N Amb25321503 [0,1,0,0,0,0|2,0,1]=4 1595 B7R0.3 CCC(=O)CCCBr Amb25765636 [0,1,0,0,0,0|2,0,0]=3 1596 B7R0.3 CCC(=O)CCCCl Amb17593423 [0,1,0,0,0,0|2,0,0]=3 1597 B7R0.3 CCC(=O)CCCN Amb18833012 [0,1,0,0,0,0|2,0,0]=3 1598 B7R0.3 CCC(=O)CCNC Amb27963044 [0,1,0,0,0,0|2,0,0]=3 1599 B7R0.3 CCC(=O)CCSC Amb25680024 [0,1,0,0,0,0|2,0,0]=3 1600 B7R0.3 CCC(=O)NCCCl Amb17103188 [0,1,0,0,0,0|3,0,0]=4 1601 B7R0.3 CCC(=O)NCCF Amb27972779 [0,1,0,0,0,0|3,0,0]=4 1602 B7R0.3 CCC(=O)NCCN Amb1137732 [0,1,0,0,0,0|3,0,0]=4 1603 B7R0.3 CCC(=O)NCCN Amb32434788 [0,1,0,0,0,0|3,0,0]=4 1604 B7R0.3 CCC(=O)NCCN Amb33741516 [0,1,0,0,0,0|3,0,0]=4 1605 B7R0.3 CCC(=O)NCCO Amb5797470 [0,1,0,0,0,0|3,0,0]=4 1606 B7R0.3 CCC(=O)NCCS Amb24505089 [0,1,0,0,0,0|3,0,0]=4 1607 B7R0.3 CCC(=O)OCCBr Amb27424669 [0,1,0,0,0,0|3,0,0]=4 1608 B7R0.3 CCC(=O)OCCF Amb27981291 [0,1,0,0,0,0|3,0,0]=4 1609 B7R0.3 CCC(=O)OCCO Amb27217859 [0,1,0,0,0,0|3,0,0]=4 1610 B7R0.3 CCC(=O)SCCBr Amb27865550 [0,1,0,0,0,0|3,0,0]=4 1611 B7R0.3 CCC(O)CCCN Amb18202667 [0,1,0,0,0,0|2,0,1]=4 1612 B7R0.3 CCC(O)CCCN Amb19374975 [0,1,0,0,0,0|2,0,1]=4 1613 B7R0.3 CCC(O)CCCO Amb17593216 [0,1,0,0,0,0|2,0,1]=4 1614 B7R0.3 CCC(O)CCOC Amb22058972 [0,1,0,0,0,0|2,0,1]=4 1615 B7R0.3 CCCCC(=N)OC Amb17617956 [0,1,0,0,0,0|1,0,0]=2 1616 B7R0.3 CCCCC(=N)OC Amb25353357 [0,1,0,0,0,0|1,0,0]=2 1617 B7R0.3 CCCCC(=O)C#N Amb22729179 [0,1,0,0,0,0|1,0,0]=2 1618 B7R0.3 CCCCC(=O)CBr Amb24563421 [0,1,0,0,0,0|1,0,0]=2 1619 B7R0.3 CCCCC(=O)CC Amb4605999 [0,1,0,0,0,0|1,0,0]=2 1620 B7R0.3 CCCCC(=O)CCl Amb17593420 [0,1,0,0,0,0|1,0,0]=2 1621 B7R0.3 CCCCC(=O)CN Amb24473062 [0,1,0,0,0,0|1,0,0]=2 1622 B7R0.3 CCCCC(=O)CO Amb26073501 [0,1,0,0,0,0|0,0,0]=1 1623 B7R0.3 CCCCC(=O)NC Amb5797766 [0,1,0,0,0,0|1,0,0]=2 1624 B7R0.3 CCCCC(=O)NN Amb534136 [0,1,0,0,0,0|1,0,0]=2 1625 B7R0.3 CCCCC(=O)NO Amb6269796 [0,1,0,0,0,0|0,0,0]=1 1626 B7R0.3 CCCCC(=S)NC Amb27838397 [0,1,0,0,0,0|1,1,0]=3 1627 B7R0.3 CCCCC(Br)C=O Amb17594581 [0,1,0,0,0,0|1,0,1]=3 1628 B7R0.3 CCCCC(Br)CBr Amb8517633 [0,1,0,0,0,0|2,0,1]=4 1629 B7R0.3 CCCCC(Br)CC Amb18804679 [0,1,0,0,0,0|2,0,1]=4 1630 B7R0.3 CCCCC(Br)CF Amb28410717 [0,1,0,0,0,0|2,0,1]=4 1631 B7R0.3 CCCCC(C)C#N Amb18641663 [0,1,0,0,0,0|2,0,1]=4 1632 B7R0.3 CCCCC(C)C=O Amb17593191 [0,1,0,0,0,0|1,0,1]=3 1633 B7R0.3 CCCCC(C)CBr Amb22227886 [0,1,0,0,0,0|2,0,1]=4 1634 B7R0.3 CCCCC(C)CC Amb10071971 [0,1,0,0,0,0|2,0,1]=4 1635 B7R0.3 CCCCC(C)CCl Amb24481359 [0,1,0,0,0,0|2,0,1]=4 1636 B7R0.3 CCCCC(C)CN Amb18311071 [0,1,0,0,0,0|2,0,1]=4 1637 B7R0.3 CCCCC(C)CO Amb17593205 [0,1,0,0,0,0|1,0,1]=3 1638 B7R0.3 CCCCC(C)NC Amb9620956 [0,1,0,0,0,0|2,0,1]=4 1639 B7R0.3 CCCCC(C)ON Amb33428411 [0,1,0,0,0,0|1,0,1]=3 1640 B7R0.3 CCCCC(Cl)C#N Amb26017572 [0,1,0,0,0,0|2,0,1]=4 1641 B7R0.3 CCCCC(Cl)CBr Amb27490970 [0,1,0,0,0,0|2,0,1]=4 1642 B7R0.3 CCCCC(Cl)CC Amb25361621 [0,1,0,0,0,0|2,0,1]=4 1643 B7R0.3 CCCCC(Cl)CCl Amb9787250 [0,1,0,0,0,0|2,0,1]=4 1644 B7R0.3 CCCCC(Cl)CN Amb31030967 [0,1,0,0,0,0|2,0,1]=4 1645 B7R0.3 CCCCC(F)C=O Amb27838938 [0,1,0,0,0,0|1,0,1]=3 1646 B7R0.3 CCCCC(F)CBr Amb27758689 [0,1,0,0,0,0|2,0,1]=4 1647 B7R0.3 CCCCC(F)CN Amb24117055 [0,1,0,0,0,0|2,0,1]=4 1648 B7R0.3 CCCCC(N)C#N Amb18975861 [0,1,0,0,0,0|2,0,1]=4 1649 B7R0.3 CCCCC(N)C=O Amb28422291 [0,1,0,0,0,0|1,0,1]=3 1650 B7R0.3 CCCCC(N)CC Amb33527796 [0,1,0,0,0,0|2,0,1]=4 1651 B7R0.3 CCCCC(N)CC Amb9031866 [0,1,0,0,0,0|2,0,1]=4 1652 B7R0.3 CCCCC(N)CN Amb19009750 [0,1,0,0,0,0|2,0,1]=4 1653 B7R0.3 CCCCC(N)CO Amb3939373 [0,1,0,0,0,0|1,0,1]=3 1654 B7R0.3 CCCCC(N)CS Amb27961155 [0,1,0,0,0,0|1,1,1]=4 1655 B7R0.3 CCCCC(O)CBr Amb25233429 [0,1,0,0,0,0|1,0,1]=3 1656 B7R0.3 CCCCC(O)CC Amb10844720 [0,1,0,0,0,0|1,0,1]=3 1657 B7R0.3 CCCCC(O)CCl Amb24481415 [0,1,0,0,0,0|1,0,1]=3 1658 B7R0.3 CCCCC(O)CF Amb27807497 [0,1,0,0,0,0|1,0,1]=3 1659 B7R0.3 CCCCC(O)CN Amb8630130 [0,1,0,0,0,0|1,0,1]=3 1660 B7R0.3 CCCCC(O)CO Amb8390318 [0,1,0,0,0,0|0,0,2]=3 1661 B7R0.3 CCCCC(S)CC Amb25314909 [0,1,0,0,0,0|1,1,1]=4 1662 B7R0.3 CCCCC(S)CN Amb27643759 [0,1,0,0,0,0|1,1,1]=4 1663 B7R0.3 CCCCN(C)C#N Amb28048925 [0,1,0,0,0,0|3,0,0]=4 1664 B7R0.3 CCCCN(C)C=O Amb26967032 [0,1,0,0,0,0|2,0,0]=3 1665 B7R0.3 CCCCN(C)N=O Amb22231185 [0,1,0,0,0,0|2,0,0]=3 1666 B7R0.3 CCCCN(N)CC Amb17593206 [0,1,0,0,0,0|3,0,0]=4 1667 B7R0.3 CCCCN(O)CC Amb27230146 [0,1,0,0,0,0|2,0,0]=3 1668 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [0,1,0,0,0,0|1,0,1]=3 1669 B7R0.3 CCCC[C@@H](C)CN Amb27780030 [0,1,0,0,0,0|2,0,1]=4 1670 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [0,1,0,0,0,0|1,0,1]=3 1671 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [0,1,0,0,0,0|1,0,1]=3 1672 B7R0.3 CCCC[C@@H](N)CC Amb28461624 [0,1,0,0,0,0|2,0,1]=4 1673 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [0,1,0,0,0,0|1,0,1]=3 1674 B7R0.3 CCCC[C@@H](O)C#N Amb27798698 [0,1,0,0,0,0|1,0,1]=3 1675 B7R0.3 CCCC[C@@H](O)CN Amb33428417 [0,1,0,0,0,0|1,0,1]=3 1676 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [0,1,0,0,0,0|1,0,1]=3 1677 B7R0.3 CCCC[C@H](C)CN Amb25889982 [0,1,0,0,0,0|2,0,1]=4 1678 B7R0.3 CCCC[C@H](C)CO Amb26370424 [0,1,0,0,0,0|1,0,1]=3 1679 B7R0.3 CCCC[C@H](F)CO Amb28315208 [0,1,0,0,0,0|1,0,1]=3 1680 B7R0.3 CCCC[C@H](N)CO Amb3941478 [0,1,0,0,0,0|1,0,1]=3 1681 B7R0.3 CCCC[C@H](O)CF Amb27656199 [0,1,0,0,0,0|1,0,1]=3 1682 B7R0.3 CCCC[C@H](O)CN Amb33428416 [0,1,0,0,0,0|1,0,1]=3 1683 B7R0.3 CCCC[C@H](S)CO Amb27804425 [0,1,0,0,0,0|0,1,1]=3 1684 B7R0.3 CCCC\C(Br)=C\Cl Amb27484205 [0,1,0,0,0,0|2,0,0]=3 1685 B7R0.3 CCCC\C(C)=N\N Amb27883272 [0,1,0,0,0,0|2,0,0]=3 1686 B7R0.3 CCCC\C(Cl)=N\O Amb28397410 [0,1,0,0,0,0|1,0,0]=2 1687 B7R0.3 CCCC\C(N)=N/O Amb2696577 [0,1,0,0,0,0|1,0,0]=2 1688 B7R0.3 CCCC\C(N)=N\O Amb8391665 [0,1,0,0,0,0|1,0,0]=2 1689 B7R0.3 CCCNC(=N)NC Amb28128375 [0,1,0,0,0,0|3,0,0]=4 1690 B7R0.3 CCCNC(=N)SC Amb27839564 [0,1,0,0,0,0|2,1,0]=4 1691 B7R0.3 CCCNC(=O)CBr Amb17330843 [0,1,0,0,0,0|2,0,0]=3 1692 B7R0.3 CCCNC(=O)CC Amb5797516 [0,1,0,0,0,0|2,0,0]=3 1693 B7R0.3 CCCNC(=O)CCl Amb1207068 [0,1,0,0,0,0|2,0,0]=3 1694 B7R0.3 CCCNC(=O)CI Amb23512283 [0,1,0,0,0,0|2,0,0]=3 1695 B7R0.3 CCCNC(=O)CN Amb10781813 [0,1,0,0,0,0|2,0,0]=3 1696 B7R0.3 CCCNC(=O)CN Amb426858 [0,1,0,0,0,0|2,0,0]=3 1697 B7R0.3 CCCNC(=O)CO Amb5798169 [0,1,0,0,0,0|1,0,0]=2 1698 B7R0.3 CCCNC(=O)NCl Amb28057729 [0,1,0,0,0,0|2,0,0]=3 1699 B7R0.3 CCCNC(=O)NN Amb8854021 [0,1,0,0,0,0|2,0,0]=3 1700 B7R0.3 CCCNC(=S)NC Amb4016503 [0,1,0,0,0,0|2,1,0]=4 1701 B7R0.3 CCCNC(=S)NN Amb1152670 [0,1,0,0,0,0|2,1,0]=4 1702 B7R0.3 CCCNC(C)CO Amb9359690 [0,1,0,0,0,0|2,0,1]=4 1703 B7R0.3 CCCN\C(C)=N\O Amb27234636 [0,1,0,0,0,0|2,0,0]=3 1704 B7R0.3 CCCN\C(N)=N\O Amb28430250 [0,1,0,0,0,0|2,0,0]=3 1705 B7R0.3 CCCOC(=O)C=O Amb18641875 [0,1,0,0,0,0|1,0,1]=3 1706 B7R0.3 CCCOC(=O)CCl Amb9787444 [0,1,0,0,0,0|2,0,0]=3 1707 B7R0.3 CCCOC(=O)CN Amb9826861 [0,1,0,0,0,0|2,0,0]=3 1708 B7R0.3 CCCOC(=O)CO Amb25964379 [0,1,0,0,0,0|1,0,0]=2 1709 B7R0.3 CCCOC(=O)OC Amb27153532 [0,1,0,0,0,0|1,0,0]=2 1710 B7R0.3 CCCOC(=S)NN Amb27768055 [0,1,0,0,0,0|2,1,0]=4 1711 B7R0.3 CCCOC(C)CO Amb26370350 [0,1,0,0,0,0|2,0,1]=4 1712 B7R0.3 CCCOS(=O)CCl Amb27391160 [0,1,0,0,0,0|3,0,0]=4 1713 B7R0.3 CCCSC(=O)CBr Amb28385643 [0,1,0,0,0,0|2,0,0]=3 1714 B7R0.3 CCCSC(=O)CC Amb25882938 [0,1,0,0,0,0|2,0,0]=3 1715 B7R0.3 CCCSC(=O)NC Amb27788550 [0,1,0,0,0,0|2,0,0]=3 1716 B7R0.3 CCCSC(=O)NN Amb27769595 [0,1,0,0,0,0|2,0,0]=3 1717 B7R0.3 CCCSC(C)C=O Amb18124367 [0,1,0,0,0,0|2,0,1]=4 1718 B7R0.3 CCCSC(C)CO Amb27593226 [0,1,0,0,0,0|2,0,1]=4 1719 B7R0.3 CCC\C=C(/C)CC Amb25260956 [0,1,0,0,0,0|2,0,1]=4 1720 B7R0.3 CCC\C=C(/C)CCl Amb27803634 [0,1,0,0,0,0|2,0,1]=4 1721 B7R0.3 CCC\C=C(/Cl)C=O Amb27201672 [0,1,0,0,0,0|1,0,1]=3 1722 B7R0.3 CCC\C=C(\C)CBr Amb27984757 [0,1,0,0,0,0|2,0,1]=4 1723 B7R0.3 CCC\C=C(\C)CN Amb27953132 [0,1,0,0,0,0|2,0,1]=4 1724 B7R0.3 CCC\C=C(\Cl)CCl Amb27656326 [0,1,0,0,0,0|2,0,1]=4 1725 B7R0.3 CCN(O)CCCN Amb27839388 [0,1,0,0,0,0|3,0,0]=4 1726 B7R0.3 CCNCC(=O)NC Amb32680747 [0,1,0,0,0,0|2,0,0]=3 1727 B7R0.3 CCNCC(=O)NC Amb6251820 [0,1,0,0,0,0|2,0,0]=3 1728 B7R0.3 CCNCC(=O)NO Amb27755137 [0,1,0,0,0,0|1,0,0]=2 1729 B7R0.3 CCNCC(=O)OC Amb19514718 [0,1,0,0,0,0|1,0,0]=2 1730 B7R0.3 CCNCC(=O)OC Amb6687125 [0,1,0,0,0,0|1,0,0]=2 1731 B7R0.3 CCNCC(C)OC Amb19025030 [0,1,0,0,0,0|2,0,1]=4 1732 B7R0.3 CCNCC(O)CC Amb9870468 [0,1,0,0,0,0|2,0,1]=4 1733 B7R0.3 CCNCC(O)CCl Amb18124503 [0,1,0,0,0,0|2,0,1]=4 1734 B7R0.3 CCNCC(O)CF Amb26895337 [0,1,0,0,0,0|2,0,1]=4 1735 B7R0.3 CCNCC(O)CN Amb18062380 [0,1,0,0,0,0|2,0,1]=4 1736 B7R0.3 CCNCC(O)CO Amb8856483 [0,1,0,0,0,0|1,0,2]=4 1737 B7R0.3 CCNC[C@@H](O)CC Amb28129052 [0,1,0,0,0,0|2,0,1]=4 1738 B7R0.3 CCNC[C@H](O)CC Amb26984963 [0,1,0,0,0,0|2,0,1]=4 1739 B7R0.3 CCNC[C@H](O)CO Amb27830790 [0,1,0,0,0,0|1,0,2]=4 1740 B7R0.3 CCNC\C(N)=N\O Amb24612871 [0,1,0,0,0,0|2,0,0]=3 1741 B7R0.3 CCOCC(=O)CC Amb27406475 [0,1,0,0,0,0|2,0,0]=3 1742 B7R0.3 CCOCC(=O)CCl Amb25087764 [0,1,0,0,0,0|2,0,0]=3 1743 B7R0.3 CCOCC(=O)CF Amb28316133 [0,1,0,0,0,0|2,0,0]=3 1744 B7R0.3 CCOCC(=O)CN Amb27453616 [0,1,0,0,0,0|2,0,0]=3 1745 B7R0.3 CCOCC(=O)CO Amb28066809 [0,1,0,0,0,0|1,0,0]=2 1746 B7R0.3 CCOCC(=O)NN Amb2111918 [0,1,0,0,0,0|2,0,0]=3 1747 B7R0.3 CCOCC(=O)NN Amb6744505 [0,1,0,0,0,0|2,0,0]=3 1748 B7R0.3 CCOCC(=O)OC Amb7753022 [0,1,0,0,0,0|1,0,0]=2 1749 B7R0.3 CCOCC(Br)CO Amb27791752 [0,1,0,0,0,0|2,0,1]=4 1750 B7R0.3 CCOCC(C)CO Amb25823989 [0,1,0,0,0,0|2,0,1]=4 1751 B7R0.3 CCOCC(Cl)CO Amb27974227 [0,1,0,0,0,0|2,0,1]=4 1752 B7R0.3 CCOCC(Cl)OC Amb26366295 [0,1,0,0,0,0|2,0,1]=4 1753 B7R0.3 CCOCC(N)CO Amb25890491 [0,1,0,0,0,0|2,0,1]=4 1754 B7R0.3 CCOCC(N)CO Amb32666301 [0,1,0,0,0,0|2,0,1]=4 1755 B7R0.3 CCOCC(O)C#N Amb27472427 [0,1,0,0,0,0|2,0,1]=4 1756 B7R0.3 CCOCC(O)C=O Amb27883256 [0,1,0,0,0,0|1,0,1]=3 1757 B7R0.3 CCOCC(O)CF Amb28321363 [0,1,0,0,0,0|2,0,1]=4 1758 B7R0.3 CCOCC(O)CN Amb31202384 [0,1,0,0,0,0|2,0,1]=4 1759 B7R0.3 CCOCC(O)CN Amb9707991 [0,1,0,0,0,0|2,0,1]=4 1760 B7R0.3 CCOCC(O)CO Amb19148881 [0,1,0,0,0,0|1,0,2]=4 1761 B7R0.3 CCOC[C@@H](C)CO Amb33735552 [0,1,0,0,0,0|2,0,1]=4 1762 B7R0.3 CCOC[C@@H](N)CO Amb27838360 [0,1,0,0,0,0|2,0,1]=4 1763 B7R0.3 CCOC[C@@H](N)CO Amb32653631 [0,1,0,0,0,0|2,0,1]=4 1764 B7R0.3 CCOC[C@H](C)CO Amb25999202 [0,1,0,0,0,0|2,0,1]=4 1765 B7R0.3 CCOC[C@H](O)CN Amb27457943 [0,1,0,0,0,0|2,0,1]=4 1766 B7R0.3 CCOC\C(C)=C/Cl Amb27201335 [0,1,0,0,0,0|3,0,0]=4 1767 B7R0.3 CCOC\C(C)=N\O Amb28049034 [0,1,0,0,0,0|2,0,0]=3 1768 B7R0.3 CCOC\C(N)=N\N Amb27456781 [0,1,0,0,0,0|3,0,0]=4 1769 B7R0.3 CCOC\C(N)=N\O Amb6280903 [0,1,0,0,0,0|2,0,0]=3 1770 B7R0.3 CCONC(=O)CN Amb24445788 [0,1,0,0,0,0|3,0,0]=4 1771 B7R0.3 CCONC(=O)CN Amb32664914 [0,1,0,0,0,0|3,0,0]=4 1772 B7R0.3 CCONC(=O)CO Amb27762105 [0,1,0,0,0,0|2,0,0]=3 1773 B7R0.3 CCONC(=O)NC Amb27805073 [0,1,0,0,0,0|3,0,0]=4 1774 B7R0.3 CCO\C=C(/C)C=O Amb8514481 [0,1,0,0,0,0|2,0,1]=4 1775 B7R0.3 CCO\C=C(\C)C=O Amb18641771 [0,1,0,0,0,0|2,0,1]=4 1776 B7R0.3 CCS(=O)CCCCl Amb27188737 [0,1,0,0,0,0|3,0,0]=4 1777 B7R0.3 CCS(=O)CCCN Amb18306016 [0,1,0,0,0,0|3,0,0]=4 1778 B7R0.3 CCS(=O)CCNC Amb21984659 [0,1,0,0,0,0|3,0,0]=4 1779 B7R0.3 CCS(=O)CCOC Amb27838120 [0,1,0,0,0,0|3,0,0]=4 1780 B7R0.3 CCSCC(=O)CCl Amb24545960 [0,1,0,0,0,0|2,0,0]=3 1781 B7R0.3 CCSCC(=O)CN Amb33324079 [0,1,0,0,0,0|2,0,0]=3 1782 B7R0.3 CCSCC(=O)NN Amb2610654 [0,1,0,0,0,0|2,0,0]=3 1783 B7R0.3 CCSCC(=O)OC Amb7753193 [0,1,0,0,0,0|1,0,0]=2 1784 B7R0.3 CCSCC(C)C=O Amb27592961 [0,1,0,0,0,0|2,0,1]=4 1785 B7R0.3 CCSCC(C)ON Amb33223926 [0,1,0,0,0,0|2,0,1]=4 1786 B7R0.3 CCSCC(N)CO Amb18643038 [0,1,0,0,0,0|2,0,1]=4 1787 B7R0.3 CCSCC(O)CBr Amb26957421 [0,1,0,0,0,0|2,0,1]=4 1788 B7R0.3 CCSCC(O)CC Amb27827536 [0,1,0,0,0,0|2,0,1]=4 1789 B7R0.3 CCSCC(O)CCl Amb17593873 [0,1,0,0,0,0|2,0,1]=4 1790 B7R0.3 CCSCC(O)CF Amb28062913 [0,1,0,0,0,0|2,0,1]=4 1791 B7R0.3 CCSCC(O)CN Amb6680865 [0,1,0,0,0,0|2,0,1]=4 1792 B7R0.3 CCSCC(O)CO Amb4019001 [0,1,0,0,0,0|1,0,2]=4 1793 B7R0.3 CCSCS(=O)CC Amb4014439 [0,1,0,0,0,0|3,0,0]=4 1794 B7R0.3 CCSC[C@@H](N)CO Amb26504944 [0,1,0,0,0,0|2,0,1]=4 1795 B7R0.3 CCSC[C@@H](O)CN Amb26370394 [0,1,0,0,0,0|2,0,1]=4 1796 B7R0.3 CCSC[C@H](N)CO Amb26564857 [0,1,0,0,0,0|2,0,1]=4 1797 B7R0.3 CCSC[C@H](O)CN Amb27213896 [0,1,0,0,0,0|2,0,1]=4 1798 B7R0.3 CCSC\C(N)=N\O Amb6680779 [0,1,0,0,0,0|2,0,0]=3 1799 B7R0.3 CCS\C=C(\O)C=O Amb27412581 [0,1,0,0,0,0|1,0,1]=3 1800 B7R0.3 CC\C=C\C(=O)CBr Amb25251595 [0,1,0,0,0,0|1,0,2]=4 1801 B7R0.3 CC\C=C\C(=O)CC Amb25283354 [0,1,0,0,0,0|1,0,2]=4 1802 B7R0.3 CC\C=C\C(=O)CCl Amb33057661 [0,1,0,0,0,0|1,0,2]=4 1803 B7R0.3 CC\C=C\C(=O)CN Amb33268678 [0,1,0,0,0,0|1,0,2]=4 1804 B7R0.3 CC\C=C\C(=O)OC Amb2689583 [0,1,0,0,0,0|0,0,2]=3 1805 B7R0.3 CN(C=O)CCCCl Amb24589375 [0,1,0,0,0,0|3,0,0]=4 1806 B7R0.3 CN(C=O)CCCO Amb17593211 [0,1,0,0,0,0|3,0,0]=4 1807 B7R0.3 CN(CCCO)N=O Amb25934136 [0,1,0,0,0,0|3,0,0]=4 1808 B7R0.3 CNC(=N)CCOC Amb24526950 [0,1,0,0,0,0|3,0,0]=4 1809 B7R0.3 CNC(=N)CCOC Amb30585093 [0,1,0,0,0,0|3,0,0]=4 1810 B7R0.3 CNC(=N)CCSC Amb35595278 [0,1,0,0,0,0|3,0,0]=4 1811 B7R0.3 CNC(=O)CCC#N Amb17334052 [0,1,0,0,0,0|2,0,1]=4 1812 B7R0.3 CNC(=O)CCCCl Amb1137464 [0,1,0,0,0,0|2,0,0]=3 1813 B7R0.3 CNC(=O)CCCI Amb27625606 [0,1,0,0,0,0|2,0,0]=3 1814 B7R0.3 CNC(=O)CCCN Amb6263864 [0,1,0,0,0,0|2,0,0]=3 1815 B7R0.3 CNC(=O)CCCN Amb9176288 [0,1,0,0,0,0|2,0,0]=3 1816 B7R0.3 CNC(=O)CCCO Amb17231829 [0,1,0,0,0,0|2,0,0]=3 1817 B7R0.3 CNC(=O)CCCS Amb27259921 [0,1,0,0,0,0|2,0,0]=3 1818 B7R0.3 CNC(=O)CCNN Amb26936043 [0,1,0,0,0,0|3,0,0]=4 1819 B7R0.3 CNC(=O)CCOC Amb27655430 [0,1,0,0,0,0|2,0,0]=3 1820 B7R0.3 CNC(=O)NCCCl Amb27148870 [0,1,0,0,0,0|3,0,0]=4 1821 B7R0.3 CNC(=O)NCCN Amb17231831 [0,1,0,0,0,0|3,0,0]=4 1822 B7R0.3 CNC(=O)NCCN Amb28934877 [0,1,0,0,0,0|3,0,0]=4 1823 B7R0.3 CNC(=O)NCCN Amb32663759 [0,1,0,0,0,0|3,0,0]=4 1824 B7R0.3 CNC(=O)NCCO Amb24376074 [0,1,0,0,0,0|3,0,0]=4 1825 B7R0.3 CNC(=O)NCCS Amb28350549 [0,1,0,0,0,0|3,0,0]=4 1826 B7R0.3 CNC(=O)OCCCl Amb22363563 [0,1,0,0,0,0|3,0,0]=4 1827 B7R0.3 CNC(=O)OCCF Amb28071923 [0,1,0,0,0,0|3,0,0]=4 1828 B7R0.3 CNC(=O)OCCO Amb3939460 [0,1,0,0,0,0|3,0,0]=4 1829 B7R0.3 CNCCC(=N)OC Amb28411188 [0,1,0,0,0,0|2,0,0]=3 1830 B7R0.3 CNCCC(=O)NC Amb19959924 [0,1,0,0,0,0|2,0,0]=3 1831 B7R0.3 CNCCC(=O)NC Amb8428200 [0,1,0,0,0,0|2,0,0]=3 1832 B7R0.3 CNCCC(=O)NN Amb28143068 [0,1,0,0,0,0|2,0,0]=3 1833 B7R0.3 CNCCC(=O)NO Amb27763537 [0,1,0,0,0,0|1,0,0]=2 1834 B7R0.3 CNCCC(=O)OC Amb22168213 [0,1,0,0,0,0|1,0,0]=2 1835 B7R0.3 CNCCC(=O)OC Amb7969878 [0,1,0,0,0,0|1,0,0]=2 1836 B7R0.3 CNCCC(C)CO Amb17569900 [0,1,0,0,0,0|2,0,1]=4 1837 B7R0.3 CNCCC(C)OC Amb17569916 [0,1,0,0,0,0|2,0,1]=4 1838 B7R0.3 CNCCC(O)CN Amb27881647 [0,1,0,0,0,0|2,0,1]=4 1839 B7R0.3 CNCC\C(C)=C\Cl Amb27594199 [0,1,0,0,0,0|3,0,0]=4 1840 B7R0.3 CNCC\C(N)=N/O Amb19981296 [0,1,0,0,0,0|2,0,0]=3 1841 B7R0.3 CNCC\C(N)=N\O Amb22410480 [0,1,0,0,0,0|2,0,0]=3 1842 B7R0.3 CNOCC(=O)OC Amb32662920 [0,1,0,0,0,0|2,0,0]=3 1843 B7R0.3 CNOCC(=O)OC Amb33067971 [0,1,0,0,0,0|2,0,0]=3 1844 B7R0.3 COC(=N)CCC#N Amb17593155 [0,1,0,0,0,0|2,0,1]=4 1845 B7R0.3 COC(=N)CCCCl Amb16231406 [0,1,0,0,0,0|2,0,0]=3 1846 B7R0.3 COC(=N)CCCCl Amb27631457 [0,1,0,0,0,0|2,0,0]=3 1847 B7R0.3 COC(=N)CCCS Amb27628992 [0,1,0,0,0,0|2,0,0]=3 1848 B7R0.3 COC(=O)C#CCCl Amb17673855 [0,1,0,0,0,0|1,0,2]=4 1849 B7R0.3 COC(=O)C#CCN Amb24581713 [0,1,0,0,0,0|1,0,2]=4 1850 B7R0.3 COC(=O)C#CCN Amb33038300 [0,1,0,0,0,0|1,0,2]=4 1851 B7R0.3 COC(=O)C#CCO Amb16233601 [0,1,0,0,0,0|1,0,2]=4 1852 B7R0.3 COC(=O)CCC#N Amb2689406 [0,1,0,0,0,0|1,0,1]=3 1853 B7R0.3 COC(=O)CCC=O Amb18124259 [0,1,0,0,0,0|1,0,1]=3 1854 B7R0.3 COC(=O)CCCBr Amb8516943 [0,1,0,0,0,0|1,0,0]=2 1855 B7R0.3 COC(=O)CCCCl Amb3940271 [0,1,0,0,0,0|1,0,0]=2 1856 B7R0.3 COC(=O)CCCI Amb3941711 [0,1,0,0,0,0|1,0,0]=2 1857 B7R0.3 COC(=O)CCCN Amb402626 [0,1,0,0,0,0|1,0,0]=2 1858 B7R0.3 COC(=O)CCCS Amb19373761 [0,1,0,0,0,0|1,0,0]=2 1859 B7R0.3 COC(=O)CCC[NH3+] Amb2778689 [0,1,0,0,0,0|1,0,0]=2 1860 B7R0.3 COC(=O)CCON Amb29848091 [0,1,0,0,0,0|2,0,0]=3 1861 B7R0.3 COC(=O)CCSC Amb8393179 [0,1,0,0,0,0|1,0,0]=2 1862 B7R0.3 COC(=O)CN=C=O Amb3905407 [0,1,0,0,0,0|2,0,1]=4 1863 B7R0.3 COC(=O)CN=C=S Amb2371376 [0,1,0,0,0,0|2,0,1]=4 1864 B7R0.3 COC(=O)CN=[N+]=[N-] Amb1101953 [0,1,0,0,0,0|3,0,0]=4 1865 B7R0.3 COC(=O)CNC=O Amb22000868 [0,1,0,0,0,0|2,0,1]=4 1866 B7R0.3 COC(=O)CNC=S Amb27839121 [0,1,0,0,0,0|2,0,1]=4 1867 B7R0.3 COC(=O)CSCBr Amb28458464 [0,1,0,0,0,0|2,0,0]=3 1868 B7R0.3 COC(=O)C\C=C\Cl Amb28458363 [0,1,0,0,0,0|1,0,2]=4 1869 B7R0.3 COC(=O)NCC=O Amb27839038 [0,1,0,0,0,0|2,0,1]=4 1870 B7R0.3 COC(=O)NCCN Amb18970459 [0,1,0,0,0,0|2,0,0]=3 1871 B7R0.3 COC(=O)NCCN Amb28934803 [0,1,0,0,0,0|2,0,0]=3 1872 B7R0.3 COC(=O)NCCO Amb9285601 [0,1,0,0,0,0|2,0,0]=3 1873 B7R0.3 COC(=O)NCSC Amb28398191 [0,1,0,0,0,0|2,0,0]=3 1874 B7R0.3 COC(=O)OCC=O Amb28208420 [0,1,0,0,0,0|2,0,1]=4 1875 B7R0.3 COC(=O)OCCBr Amb27228663 [0,1,0,0,0,0|2,0,0]=3 1876 B7R0.3 COC(=O)SCCCl Amb27640237 [0,1,0,0,0,0|2,0,0]=3 1877 B7R0.3 COC(=O)\C=C\CBr Amb8513243 [0,1,0,0,0,0|1,0,2]=4 1878 B7R0.3 COC(=O)\C=C\CF Amb35747826 [0,1,0,0,0,0|1,0,2]=4 1879 B7R0.3 COC(=O)\C=C\CN Amb24117125 [0,1,0,0,0,0|1,0,2]=4 1880 B7R0.3 COC(=O)\C=C\CN Amb30634316 [0,1,0,0,0,0|1,0,2]=4 1881 B7R0.3 COC(=O)\C=C\SC Amb33473626 [0,1,0,0,0,0|1,0,2]=4 1882 B7R0.3 COC(=S)SCCF Amb27458294 [0,1,0,0,0,0|2,1,0]=4 1883 B7R0.3 COC(C)CCCBr Amb27198618 [0,1,0,0,0,0|2,0,1]=4 1884 B7R0.3 COC(C)CCCCl Amb28397922 [0,1,0,0,0,0|2,0,1]=4 1885 B7R0.3 COC(C)CCCN Amb17569913 [0,1,0,0,0,0|2,0,1]=4 1886 B7R0.3 COCCC(=O)CCl Amb20622320 [0,1,0,0,0,0|2,0,0]=3 1887 B7R0.3 COCCC(=O)CN Amb26515688 [0,1,0,0,0,0|2,0,0]=3 1888 B7R0.3 COCCC(=O)NN Amb2689273 [0,1,0,0,0,0|2,0,0]=3 1889 B7R0.3 COCCC(=O)OC Amb6296150 [0,1,0,0,0,0|1,0,0]=2 1890 B7R0.3 COCCC(C)C=O Amb26896518 [0,1,0,0,0,0|2,0,1]=4 1891 B7R0.3 COCCC(C)ON Amb26551644 [0,1,0,0,0,0|2,0,1]=4 1892 B7R0.3 COCCC(N)C=O Amb28397866 [0,1,0,0,0,0|2,0,1]=4 1893 B7R0.3 COCCC(N)CO Amb32952892 [0,1,0,0,0,0|2,0,1]=4 1894 B7R0.3 COCCC(N)CO Amb33532817 [0,1,0,0,0,0|2,0,1]=4 1895 B7R0.3 COCCC(O)CBr Amb33227254 [0,1,0,0,0,0|2,0,1]=4 1896 B7R0.3 COCCC(O)CCl Amb27457414 [0,1,0,0,0,0|2,0,1]=4 1897 B7R0.3 COCCC(O)CF Amb33377484 [0,1,0,0,0,0|2,0,1]=4 1898 B7R0.3 COCCC(O)CN Amb27966623 [0,1,0,0,0,0|2,0,1]=4 1899 B7R0.3 COCCC(O)CO Amb28128880 [0,1,0,0,0,0|1,0,2]=4 1900 B7R0.3 COCCN(C)N=O Amb26370374 [0,1,0,0,0,0|3,0,0]=4 1901 B7R0.3 COCC[C@@H](C)C=O Amb28351588 [0,1,0,0,0,0|2,0,1]=4 1902 B7R0.3 COCC[C@@H](N)CO Amb33377807 [0,1,0,0,0,0|2,0,1]=4 1903 B7R0.3 COCC[C@@H](O)CN Amb33377809 [0,1,0,0,0,0|2,0,1]=4 1904 B7R0.3 COCC[C@H](N)CO Amb25937729 [0,1,0,0,0,0|2,0,1]=4 1905 B7R0.3 COCC[C@H](O)CN Amb33377791 [0,1,0,0,0,0|2,0,1]=4 1906 B7R0.3 COCC\C(N)=C\O Amb28364926 [0,1,0,0,0,0|2,0,0]=3 1907 B7R0.3 COCC\C(N)=N/O Amb19890177 [0,1,0,0,0,0|2,0,0]=3 1908 B7R0.3 COCC\C(N)=N/O Amb2696139 [0,1,0,0,0,0|2,0,0]=3 1909 B7R0.3 COCC\C(N)=N\O Amb22490466 [0,1,0,0,0,0|2,0,0]=3 1910 B7R0.3 COCC\C(N)=N\O Amb8384548 [0,1,0,0,0,0|2,0,0]=3 1911 B7R0.3 COCNC(=O)CF Amb28045827 [0,1,0,0,0,0|3,0,0]=4 1912 B7R0.3 COCNC(=O)OC Amb27253203 [0,1,0,0,0,0|2,0,0]=3 1913 B7R0.3 COCOC(=O)CCl Amb27952135 [0,1,0,0,0,0|3,0,0]=4 1914 B7R0.3 COCOC(=O)NN Amb28386033 [0,1,0,0,0,0|3,0,0]=4 1915 B7R0.3 COCSC(=S)OC Amb27837931 [0,1,0,0,0,0|2,1,0]=4 1916 B7R0.3 CON(C)CCCF Amb28285235 [0,1,0,0,0,0|3,0,0]=4 1917 B7R0.3 CON(C)CCCN Amb24697678 [0,1,0,0,0,0|3,0,0]=4 1918 B7R0.3 CON(C)CCCN Amb32665371 [0,1,0,0,0,0|3,0,0]=4 1919 B7R0.3 CON(C)CCCO Amb26370515 [0,1,0,0,0,0|3,0,0]=4 1920 B7R0.3 CONC\C(N)=N\O Amb28285234 [0,1,0,0,0,0|3,0,0]=4 1921 B7R0.3 COS(=O)OCCO Amb27835054 [0,1,0,0,0,0|3,0,0]=4 1922 B7R0.3 CO\C=C\C(=O)OC Amb6600489 [0,1,0,0,0,0|1,0,2]=4 1923 B7R0.3 CSC(=O)CCCCl Amb27249585 [0,1,0,0,0,0|1,1,0]=3 1924 B7R0.3 CSCCC(=O)CCl Amb25910902 [0,1,0,0,0,0|2,0,0]=3 1925 B7R0.3 CSCCC(=O)CF Amb28316167 [0,1,0,0,0,0|2,0,0]=3 1926 B7R0.3 CSCCC(=O)CN Amb33199125 [0,1,0,0,0,0|2,0,0]=3 1927 B7R0.3 CSCCC(C)C=O Amb26624792 [0,1,0,0,0,0|2,0,1]=4 1928 B7R0.3 CSCCC(C)ON Amb33198297 [0,1,0,0,0,0|2,0,1]=4 1929 B7R0.3 CSCCC(N)CO Amb4036829 [0,1,0,0,0,0|2,0,1]=4 1930 B7R0.3 CSCCC(O)CBr Amb25824128 [0,1,0,0,0,0|2,0,1]=4 1931 B7R0.3 CSCCC(O)CCl Amb25067893 [0,1,0,0,0,0|2,0,1]=4 1932 B7R0.3 CSCCC(O)CF Amb33198282 [0,1,0,0,0,0|2,0,1]=4 1933 B7R0.3 CSCCC(O)CN Amb25785761 [0,1,0,0,0,0|2,0,1]=4 1934 B7R0.3 CSCCC(O)CO Amb26019209 [0,1,0,0,0,0|1,0,2]=4 1935 B7R0.3 CSCC[C@@H](N)CO Amb8516106 [0,1,0,0,0,0|2,0,1]=4 1936 B7R0.3 CSCC[C@@H](O)CN Amb26515632 [0,1,0,0,0,0|2,0,1]=4 1937 B7R0.3 CSCC[C@H](N)CO Amb2720562 [0,1,0,0,0,0|2,0,1]=4 1938 B7R0.3 CSCC[C@H](O)C#N Amb27594841 [0,1,0,0,0,0|2,0,1]=4 1939 B7R0.3 CSCC[C@H](O)CN Amb33198735 [0,1,0,0,0,0|2,0,1]=4 1940 B7R0.3 CSCC\C(N)=N\O Amb25127504 [0,1,0,0,0,0|2,0,0]=3 1941 B7R0.3 C[C@@H](CO)CCCBr Amb28128316 [0,1,0,0,0,0|2,0,1]=4 1942 B7R0.3 C[C@@H](CO)CCCO Amb27664197 [0,1,0,0,0,0|2,0,1]=4 1943 B7R0.3 C\C(=C/CCBr)CO Amb27454855 [0,1,0,0,0,0|2,0,1]=4 1944 B7R0.3 C\C(=C/CCCl)CO Amb27600969 [0,1,0,0,0,0|2,0,1]=4 1945 B7R0.3 C\C(C=O)=C/CCO Amb28255738 [0,1,0,0,0,0|2,0,1]=4 1946 B7R0.3 C\C(CCCO)=N/O Amb28207168 [0,1,0,0,0,0|2,0,0]=3 1947 B7R0.3 C\C=C(/C)CCCC Amb22229367 [0,1,0,0,0,0|2,0,0]=3 1948 B7R0.3 C\C=C(/C)NCCC Amb27881221 [0,1,0,0,0,0|3,0,0]=4 1949 B7R0.3 C\C=C(/Cl)CCCCl Amb27832144 [0,1,0,0,0,0|3,0,0]=4 1950 B7R0.3 C\C=C(\C)CCCBr Amb28325651 [0,1,0,0,0,0|3,0,0]=4 1951 B7R0.3 C\C=C(\C)CCCN Amb27412873 [0,1,0,0,0,0|3,0,0]=4 1952 B7R0.3 C\C=C(\Cl)CCCCl Amb27421928 [0,1,0,0,0,0|3,0,0]=4 1953 B7R0.3 C\C=C\CC(=N)NO Amb26582540 [0,1,0,0,0,0|1,0,2]=4 1954 B7R0.3 C\C=C\CC(=N)OC Amb28058157 [0,1,0,0,0,0|1,0,2]=4 1955 B7R0.3 C\C=C\CC(=O)OC Amb8394879 [0,1,0,0,0,0|0,0,2]=3 1956 B7R0.3 C\C=C\NC(=O)OC Amb27838402 [0,1,0,0,0,0|1,0,2]=4 1957 B7R0.3 N#CC(=O)CCCCl Amb28410737 [0,1,0,0,0,0|2,0,0]=3 1958 B7R0.3 N#CCCC(=O)C#N Amb28049016 [0,1,0,0,0,0|2,0,1]=4 1959 B7R0.3 N#CCCC(=O)C=O Amb27792293 [0,1,0,0,0,0|1,0,2]=4 1960 B7R0.3 N#CCCC(=O)CN Amb27240440 [0,1,0,0,0,0|2,0,1]=4 1961 B7R0.3 N#C[C@H](O)CCCBr Amb27981129 [0,1,0,0,0,0|2,0,1]=4 1962 B7R0.3 NC(CO)CCCF Amb28069002 [0,1,0,0,0,0|2,0,1]=4 1963 B7R0.3 NC(CO)CCCO Amb18641979 [0,1,0,0,0,0|2,0,1]=4 1964 B7R0.3 NCC(=O)NCCF Amb27659897 [0,1,0,0,0,0|3,0,0]=4 1965 B7R0.3 NCC(=O)NCCF Amb33473629 [0,1,0,0,0,0|3,0,0]=4 1966 B7R0.3 NCC(=O)NCCO Amb9023087 [0,1,0,0,0,0|3,0,0]=4 1967 B7R0.3 NCC(=O)OCCCl Amb4244115 [0,1,0,0,0,0|3,0,0]=4 1968 B7R0.3 NCC(=O)OCCF Amb27964557 [0,1,0,0,0,0|3,0,0]=4 1969 B7R0.3 NCC(O)CCCF Amb33196094 [0,1,0,0,0,0|2,0,1]=4 1970 B7R0.3 NCCCC(=O)NN Amb18061734 [0,1,0,0,0,0|2,0,0]=3 1971 B7R0.3 NCCCC(N)CO Amb27665423 [0,1,0,0,0,0|2,0,1]=4 1972 B7R0.3 NCCCC(O)CO Amb27759884 [0,1,0,0,0,0|1,0,2]=4 1973 B7R0.3 NCCC[C@H](N)C=O Amb27838296 [0,1,0,0,0,0|2,0,1]=4 1974 B7R0.3 NCCC\C(N)=N\O Amb25889843 [0,1,0,0,0,0|2,0,0]=3 1975 B7R0.3 NCCNC(=O)CS Amb27413124 [0,1,0,0,0,0|2,1,0]=4 1976 B7R0.3 NCCNC(=O)NN Amb19514735 [0,1,0,0,0,0|3,0,0]=4 1977 B7R0.3 NCCNC(=O)NN Amb26370529 [0,1,0,0,0,0|3,0,0]=4 1978 B7R0.3 NCCSC(=O)CCl Amb28284347 [0,1,0,0,0,0|3,0,0]=4 1979 B7R0.3 NC[C@H](O)CCCO Amb27632965 [0,1,0,0,0,0|2,0,1]=4 1980 B7R0.3 NNC(=O)CCCCl Amb9818914 [0,1,0,0,0,0|2,0,0]=3 1981 B7R0.3 NNC(=O)CCCO Amb535400 [0,1,0,0,0,0|2,0,0]=3 1982 B7R0.3 NNC(=O)CCNO Amb25128022 [0,1,0,0,0,0|3,0,0]=4 1983 B7R0.3 NNC(=O)OCCO Amb4020372 [0,1,0,0,0,0|3,0,0]=4 1984 B7R0.3 N[C@@H](CO)CCCO Amb28254525 [0,1,0,0,0,0|2,0,1]=4 1985 B7R0.3 N[C@H](CO)CCCO Amb24117047 [0,1,0,0,0,0|2,0,1]=4 1986 B7R0.3 N\C(CCCBr)=N/O Amb4297023 [0,1,0,0,0,0|2,0,0]=3 1987 B7R0.3 N\N=C(/N)CCCCl Amb2696495 [0,1,0,0,0,0|3,0,0]=4 1988 B7R0.3 O=C(CBr)CCCBr Amb27153779 [0,1,0,0,0,0|2,0,0]=3 1989 B7R0.3 O=C(CBr)CCCCl Amb27875989 [0,1,0,0,0,0|2,0,0]=3 1990 B7R0.3 O=C(CBr)NCCBr Amb24104073 [0,1,0,0,0,0|3,0,0]=4 1991 B7R0.3 O=C(CBr)NCCCl Amb29848056 [0,1,0,0,0,0|3,0,0]=4 1992 B7R0.3 O=C(CCCCl)NO Amb28061167 [0,1,0,0,0,0|1,0,0]=2 1993 B7R0.3 O=C(CCCF)NO Amb28185008 [0,1,0,0,0,0|1,0,0]=2 1994 B7R0.3 O=C(CCl)CCCBr Amb22395325 [0,1,0,0,0,0|2,0,0]=3 1995 B7R0.3 O=C(CCl)CCCCl Amb22395285 [0,1,0,0,0,0|2,0,0]=3 1996 B7R0.3 O=C(CCl)NCCBr Amb26055016 [0,1,0,0,0,0|3,0,0]=4 1997 B7R0.3 O=C(CCl)NCCCl Amb22261518 [0,1,0,0,0,0|3,0,0]=4 1998 B7R0.3 O=C(CCl)NCCF Amb28048272 [0,1,0,0,0,0|3,0,0]=4 1999 B7R0.3 O=C(CCl)NCCO Amb5716292 [0,1,0,0,0,0|3,0,0]=4 2000 B7R0.3 O=C(CCl)NCCS Amb25350349 [0,1,0,0,0,0|3,0,0]=4 2001 B7R0.3 O=C(CCl)SCCCl Amb28396574 [0,1,0,0,0,0|3,0,0]=4 2002 B7R0.3 O=C(CF)OCCCl Amb25112007 [0,1,0,0,0,0|3,0,0]=4 2003 B7R0.3 O=C(CO)CCCO Amb27227084 [0,1,0,0,0,0|1,0,0]=2 2004 B7R0.3 O=C(CO)NCCO Amb5798091 [0,1,0,0,0,0|2,0,0]=3 2005 B7R0.3 O=C(CO)OCCF Amb28049311 [0,1,0,0,0,0|2,0,0]=3 2006 B7R0.3 O=C(CS)NCCF Amb28204076 [0,1,0,0,0,0|2,1,0]=4 2007 B7R0.3 O=C(CS)OCCO Amb26476359 [0,1,0,0,0,0|2,1,0]=4 2008 B7R0.3 O=C(NCl)OCCCl Amb27220875 [0,1,0,0,0,0|3,0,0]=4 2009 B7R0.3 O=CC(=O)CCCO Amb27751348 [0,1,0,0,0,0|1,0,1]=3 2010 B7R0.3 O=CC(Cl)CCCO Amb27831369 [0,1,0,0,0,0|2,0,1]=4 2011 B7R0.3 O=CCCC(=O)CO Amb27799816 [0,1,0,0,0,0|1,0,1]=3 2012 B7R0.3 O=CCC\C(Cl)=N\O Amb27751320 [0,1,0,0,0,0|2,0,1]=4 2013 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [0,1,0,0,0,0|1,0,1]=3 2014 B7R0.3 O=C\C(Br)=C/CCO Amb27841266 [0,1,0,0,0,0|2,0,1]=4 2015 B7R0.3 O=C\C(F)=C\CCO Amb27798298 [0,1,0,0,0,0|2,0,1]=4 2016 B7R0.3 OC(CBr)CCCBr Amb27268592 [0,1,0,0,0,0|2,0,1]=4 2017 B7R0.3 OC(CCl)CCCCl Amb26019455 [0,1,0,0,0,0|2,0,1]=4 2018 B7R0.3 OCC(O)CCCCl Amb17593523 [0,1,0,0,0,0|1,0,2]=4 2019 B7R0.3 OCCCC(O)CO Amb17593225 [0,1,0,0,0,0|1,0,2]=4 2020 B7R0.3 OCCC[C@@H](O)CO Amb27213939 [0,1,0,0,0,0|1,0,2]=4 2021 B7R0.3 OCCC[C@H](Cl)CO Amb27165705 [0,1,0,0,0,0|2,0,1]=4 2022 B7R0.3 OC[C@@H](O)CCCCl Amb27235461 [0,1,0,0,0,0|1,0,2]=4 2023 B7R0.3 [C-]#[N+]C(C)CCCC Amb3973080 [0,1,0,0,0,0|2,0,1]=4 2024 B7R0.3 [C-]#[N+]CCC(=O)OC Amb2689499 [0,1,0,0,0,0|1,0,1]=3 2025 B7R0.4 C#CCCCC(=N)N Amb27429454 [0,1,0,0,0,0|2,0,1]=4 2026 B7R0.4 C#CCCCC(=O)Cl Amb2688725 [0,1,0,0,0,0|1,0,1]=3 2027 B7R0.4 C#CCCCC(=O)O Amb2721705 [0,1,0,0,0,0|0,0,1]=2 2028 B7R0.4 C#CCCCC(C)=O Amb18115312 [0,1,0,0,0,0|1,0,1]=3 2029 B7R0.4 C#CCCCC(C)O Amb24360348 [0,1,0,0,0,0|1,0,2]=4 2030 B7R0.4 C#CCCCC(N)=O Amb27590599 [0,1,0,0,0,0|1,0,1]=3 2031 B7R0.4 C#CCCC[C@@H](C)O Amb26936874 [0,1,0,0,0,0|1,0,2]=4 2032 B7R0.4 C#CCCC[C@H](C)O Amb27809722 [0,1,0,0,0,0|1,0,2]=4 2033 B7R0.4 C#CCCNC(C)=O Amb21942373 [0,1,0,0,0,0|1,0,2]=4 2034 B7R0.4 C#CCCNC(N)=O Amb26993283 [0,1,0,0,0,0|1,0,2]=4 2035 B7R0.4 C#CCCOC(=O)Cl Amb22360631 [0,1,0,0,0,0|1,0,2]=4 2036 B7R0.4 C#CCCOC(N)=O Amb28364943 [0,1,0,0,0,0|1,0,2]=4 2037 B7R0.4 C#CCNCC(=O)O Amb33551387 [0,1,0,0,0,0|0,0,2]=3 2038 B7R0.4 C#CCNCC(=O)O Amb6740302 [0,1,0,0,0,0|0,0,2]=3 2039 B7R0.4 C#CCOCC(=O)O Amb9208655 [0,1,0,0,0,0|0,0,2]=3 2040 B7R0.4 C#CCOCC(C)=O Amb3987398 [0,1,0,0,0,0|1,0,2]=4 2041 B7R0.4 C#CCSCC(=O)O Amb2372297 [0,1,0,0,0,0|0,0,2]=3 2042 B7R0.4 C=C(Br)CCCC#N Amb6298900 [0,1,0,0,0,0|2,0,1]=4 2043 B7R0.4 C=C(Br)CCCCBr Amb4035450 [0,1,0,0,0,0|2,0,0]=3 2044 B7R0.4 C=C(Br)CNCCN Amb18180845 [0,1,0,0,0,0|3,0,0]=4 2045 B7R0.4 C=C(Br)COCCN Amb19020783 [0,1,0,0,0,0|3,0,0]=4 2046 B7R0.4 C=C(Br)COCCO Amb28453509 [0,1,0,0,0,0|3,0,0]=4 2047 B7R0.4 C=C(C)C#CCCC Amb22228884 [0,1,0,0,0,0|2,0,1]=4 2048 B7R0.4 C=C(C)CCCC#N Amb6298905 [0,1,0,0,0,0|2,0,1]=4 2049 B7R0.4 C=C(C)CCCCC Amb6298938 [0,1,0,0,0,0|2,0,0]=3 2050 B7R0.4 C=C(C)CCCCO Amb26872404 [0,1,0,0,0,0|2,0,0]=3 2051 B7R0.4 C=C(C)CCCNN Amb28345747 [0,1,0,0,0,0|3,0,0]=4 2052 B7R0.4 C=C(C)CCOCCl Amb28366369 [0,1,0,0,0,0|3,0,0]=4 2053 B7R0.4 C=C(C)CC\C=C\C Amb25746764 [0,1,0,0,0,0|2,0,1]=4 2054 B7R0.4 C=C(C)CNCCC Amb17308631 [0,1,0,0,0,0|2,0,0]=3 2055 B7R0.4 C=C(C)CNCCF Amb28316183 [0,1,0,0,0,0|3,0,0]=4 2056 B7R0.4 C=C(C)CNOCC Amb27254563 [0,1,0,0,0,0|3,0,0]=4 2057 B7R0.4 C=C(C)COCCN Amb19020764 [0,1,0,0,0,0|3,0,0]=4 2058 B7R0.4 C=C(C)COCCN Amb20631068 [0,1,0,0,0,0|3,0,0]=4 2059 B7R0.4 C=C(C)COCCO Amb27452088 [0,1,0,0,0,0|3,0,0]=4 2060 B7R0.4 C=C(C)COCOC Amb27213685 [0,1,0,0,0,0|3,0,0]=4 2061 B7R0.4 C=C(C)CSCCC Amb27449649 [0,1,0,0,0,0|2,0,0]=3 2062 B7R0.4 C=C(C)CSCCN Amb6259178 [0,1,0,0,0,0|3,0,0]=4 2063 B7R0.4 C=C(Cl)CCCC=O Amb27751311 [0,1,0,0,0,0|2,0,1]=4 2064 B7R0.4 C=C(Cl)CNCCC Amb19004838 [0,1,0,0,0,0|2,0,0]=3 2065 B7R0.4 C=C(Cl)CNCCN Amb27394577 [0,1,0,0,0,0|3,0,0]=4 2066 B7R0.4 C=C(Cl)CNOCC Amb27657345 [0,1,0,0,0,0|3,0,0]=4 2067 B7R0.4 C=C(Cl)COCCN Amb19020765 [0,1,0,0,0,0|3,0,0]=4 2068 B7R0.4 C=C(Cl)CSCCO Amb9273887 [0,1,0,0,0,0|3,0,0]=4 2069 B7R0.4 C=C(F)CCCCO Amb22641473 [0,1,0,0,0,0|2,0,0]=3 2070 B7R0.4 C=C=CCCC(C)=O Amb28315801 [0,1,0,0,0,0|1,0,2]=4 2071 B7R0.4 C=C=CSCC(=O)O Amb27812092 [0,1,0,0,0,0|0,0,3]=4 2072 B7R0.4 C=CC#CCC(=O)O Amb27162652 [0,1,0,0,0,0|0,0,3]=4 2073 B7R0.4 C=CCC#CC(=O)O Amb28252724 [0,1,0,0,0,0|0,0,3]=4 2074 B7R0.4 C=CCCCB(O)O Amb22169115 [0,1,0,0,0,0|1,0,2]=4 2075 B7R0.4 C=CCCCC(=O)Cl Amb8392411 [0,1,0,0,0,0|1,0,1]=3 2076 B7R0.4 C=CCCCC(=O)O Amb3941675 [0,1,0,0,0,0|0,0,1]=2 2077 B7R0.4 C=CCCCC(C)=O Amb17593171 [0,1,0,0,0,0|1,0,1]=3 2078 B7R0.4 C=CCCCC(C)O Amb22059432 [0,1,0,0,0,0|1,0,2]=4 2079 B7R0.4 C=CCCNC(N)=O Amb25789999 [0,1,0,0,0,0|1,0,2]=4 2080 B7R0.4 C=CCCOC(=O)Cl Amb10844792 [0,1,0,0,0,0|1,0,2]=4 2081 B7R0.4 C=CCCOC(C)=O Amb3940828 [0,1,0,0,0,0|1,0,2]=4 2082 B7R0.4 C=CCCSC(C)=O Amb24117956 [0,1,0,0,0,0|1,0,2]=4 2083 B7R0.4 C=CCNCC(=O)O Amb7766404 [0,1,0,0,0,0|0,0,2]=3 2084 B7R0.4 C=CCNCC(=O)O Amb8631497 [0,1,0,0,0,0|0,0,2]=3 2085 B7R0.4 C=CCNCC(N)=O Amb6706481 [0,1,0,0,0,0|1,0,2]=4 2086 B7R0.4 C=CCOCC(=O)O Amb9208694 [0,1,0,0,0,0|0,0,2]=3 2087 B7R0.4 C=CCOCC(C)=O Amb27829146 [0,1,0,0,0,0|1,0,2]=4 2088 B7R0.4 C=CCOCC(N)=O Amb26859258 [0,1,0,0,0,0|1,0,2]=4 2089 B7R0.4 C=CCSCC(=O)O Amb33526723 [0,1,0,0,0,0|0,0,2]=3 2090 B7R0.4 C=CNCCC(=O)O Amb27429817 [0,1,0,0,0,0|0,0,2]=3 2091 B7R0.4 C=COCCC(=O)O Amb28350126 [0,1,0,0,0,0|0,0,2]=3 2092 B7R0.4 C=C\C=C\CC(=O)O Amb34916435 [0,1,0,0,0,0|0,0,3]=4 2093 B7R0.4 CC#CC#CC(=O)O Amb25230912 [0,1,0,0,0,0|0,0,3]=4 2094 B7R0.4 CC#CCCB(O)O Amb28137368 [0,1,0,0,0,0|1,0,2]=4 2095 B7R0.4 CC#CCCC(=O)O Amb3987196 [0,1,0,0,0,0|0,0,1]=2 2096 B7R0.4 CC#CCNC(C)=O Amb27758151 [0,1,0,0,0,0|1,0,2]=4 2097 B7R0.4 CC#CCOC(=O)Cl Amb22001616 [0,1,0,0,0,0|1,0,2]=4 2098 B7R0.4 CC(=N)NCCCO Amb27967298 [0,1,0,0,0,0|3,0,0]=4 2099 B7R0.4 CC(=O)C#CCCO Amb28316149 [0,1,0,0,0,0|1,0,2]=4 2100 B7R0.4 CC(=O)CCCC#N Amb17106756 [0,1,0,0,0,0|1,0,1]=3 2101 B7R0.4 CC(=O)CCCCBr Amb16234126 [0,1,0,0,0,0|1,0,0]=2 2102 B7R0.4 CC(=O)CCCCCl Amb3941549 [0,1,0,0,0,0|1,0,0]=2 2103 B7R0.4 CC(=O)CCCCF Amb27490855 [0,1,0,0,0,0|1,0,0]=2 2104 B7R0.4 CC(=O)CCCCN Amb27401218 [0,1,0,0,0,0|1,0,0]=2 2105 B7R0.4 CC(=O)CCCCO Amb10603864 [0,1,0,0,0,0|1,0,0]=2 2106 B7R0.4 CC(=O)CCN=[N+]=[N-] Amb18522048 [0,1,0,0,0,0|3,0,0]=4 2107 B7R0.4 CC(=O)CCSC#N Amb28062990 [0,1,0,0,0,0|2,0,1]=4 2108 B7R0.4 CC(=O)CC\C=N\O Amb27656180 [0,1,0,0,0,0|2,0,1]=4 2109 B7R0.4 CC(=O)CNOCO Amb27244723 [0,1,0,0,0,0|3,0,0]=4 2110 B7R0.4 CC(=O)COCCCl Amb25346574 [0,1,0,0,0,0|2,0,0]=3 2111 B7R0.4 CC(=O)COCCF Amb27463527 [0,1,0,0,0,0|2,0,0]=3 2112 B7R0.4 CC(=O)COCCO Amb28122841 [0,1,0,0,0,0|2,0,0]=3 2113 B7R0.4 CC(=O)CSCCF Amb24621173 [0,1,0,0,0,0|2,0,0]=3 2114 B7R0.4 CC(=O)CSCCN Amb17500454 [0,1,0,0,0,0|2,0,0]=3 2115 B7R0.4 CC(=O)CSCCO Amb4165952 [0,1,0,0,0,0|2,0,0]=3 2116 B7R0.4 CC(=O)NCCC#N Amb5787037 [0,1,0,0,0,0|2,0,1]=4 2117 B7R0.4 CC(=O)NCCC=O Amb17102165 [0,1,0,0,0,0|2,0,1]=4 2118 B7R0.4 CC(=O)NCCCBr Amb8826231 [0,1,0,0,0,0|2,0,0]=3 2119 B7R0.4 CC(=O)NCCCCl Amb3886559 [0,1,0,0,0,0|2,0,0]=3 2120 B7R0.4 CC(=O)NCCCN Amb10610286 [0,1,0,0,0,0|2,0,0]=3 2121 B7R0.4 CC(=O)NCCCN Amb6664982 [0,1,0,0,0,0|2,0,0]=3 2122 B7R0.4 CC(=O)NCCCO Amb3429354 [0,1,0,0,0,0|2,0,0]=3 2123 B7R0.4 CC(=O)NCCNN Amb24117179 [0,1,0,0,0,0|3,0,0]=4 2124 B7R0.4 CC(=O)NCCON Amb17138368 [0,1,0,0,0,0|3,0,0]=4 2125 B7R0.4 CC(=O)NOCCO Amb27484242 [0,1,0,0,0,0|3,0,0]=4 2126 B7R0.4 CC(=O)OCCCBr Amb26515737 [0,1,0,0,0,0|2,0,0]=3 2127 B7R0.4 CC(=O)OCCCCl Amb3940269 [0,1,0,0,0,0|2,0,0]=3 2128 B7R0.4 CC(=O)OCCCO Amb25854267 [0,1,0,0,0,0|2,0,0]=3 2129 B7R0.4 CC(=O)OCCCS Amb4018773 [0,1,0,0,0,0|2,0,0]=3 2130 B7R0.4 CC(=O)OCCNN Amb27769313 [0,1,0,0,0,0|3,0,0]=4 2131 B7R0.4 CC(=O)OCOCCl Amb27656207 [0,1,0,0,0,0|3,0,0]=4 2132 B7R0.4 CC(=O)SCCC#N Amb22351951 [0,1,0,0,0,0|2,0,1]=4 2133 B7R0.4 CC(=O)SCCC=O Amb25101351 [0,1,0,0,0,0|2,0,1]=4 2134 B7R0.4 CC(=O)SCCCBr Amb17610077 [0,1,0,0,0,0|2,0,0]=3 2135 B7R0.4 CC(=O)SCCCCl Amb3940270 [0,1,0,0,0,0|2,0,0]=3 2136 B7R0.4 CC(=O)\C=C\CCF Amb33196081 [0,1,0,0,0,0|1,0,2]=4 2137 B7R0.4 CC(=O)\C=C\CCO Amb26479998 [0,1,0,0,0,0|1,0,2]=4 2138 B7R0.4 CC(=S)OCCCO Amb28381661 [0,1,0,0,0,0|2,1,0]=4 2139 B7R0.4 CC(Br)CCCCCl Amb27858670 [0,1,0,0,0,0|2,0,1]=4 2140 B7R0.4 CC(C)=CCCCN Amb18641749 [0,1,0,0,0,0|2,0,1]=4 2141 B7R0.4 CC(C)=CCCCO Amb26478086 [0,1,0,0,0,0|2,0,1]=4 2142 B7R0.4 CC(C)=NCCCN Amb28126946 [0,1,0,0,0,0|3,0,0]=4 2143 B7R0.4 CC(C)CCCCBr Amb2721514 [0,1,0,0,0,0|2,0,1]=4 2144 B7R0.4 CC(C)CCCCCl Amb20670590 [0,1,0,0,0,0|2,0,1]=4 2145 B7R0.4 CC(C)CCCCN Amb33548422 [0,1,0,0,0,0|2,0,1]=4 2146 B7R0.4 CC(C)CCCCN Amb9304907 [0,1,0,0,0,0|2,0,1]=4 2147 B7R0.4 CC(C)CCCCO Amb3939382 [0,1,0,0,0,0|2,0,1]=4 2148 B7R0.4 CC(C)CCCCS Amb32788388 [0,1,0,0,0,0|2,0,1]=4 2149 B7R0.4 CC(F)CCCCCl Amb27596141 [0,1,0,0,0,0|2,0,1]=4 2150 B7R0.4 CC(N)CCCCBr Amb27814547 [0,1,0,0,0,0|2,0,1]=4 2151 B7R0.4 CC(N)CCCCCl Amb27867737 [0,1,0,0,0,0|2,0,1]=4 2152 B7R0.4 CC(N)CCCCF Amb25954668 [0,1,0,0,0,0|2,0,1]=4 2153 B7R0.4 CC(N)CCCCN Amb25214697 [0,1,0,0,0,0|2,0,1]=4 2154 B7R0.4 CC(N)CCCCN Amb33551364 [0,1,0,0,0,0|2,0,1]=4 2155 B7R0.4 CC(N)CCCCO Amb17569907 [0,1,0,0,0,0|2,0,1]=4 2156 B7R0.4 CC(N)CCCCO Amb28934868 [0,1,0,0,0,0|2,0,1]=4 2157 B7R0.4 CC(O)CCCC=O Amb18641887 [0,1,0,0,0,0|1,0,2]=4 2158 B7R0.4 CC(O)CCCCF Amb27486303 [0,1,0,0,0,0|1,0,1]=3 2159 B7R0.4 CC(O)CCCCN Amb17569903 [0,1,0,0,0,0|1,0,1]=3 2160 B7R0.4 CC(O)CCCCO Amb22227757 [0,1,0,0,0,0|1,0,1]=3 2161 B7R0.4 CC(O)CCCC[SiH3] Amb28322353 [0,1,0,0,0,0|1,0,1]=3 2162 B7R0.4 CC(O)CNCCN Amb4034606 [0,1,0,0,0,0|2,0,1]=4 2163 B7R0.4 CC(O)CNCCO Amb4020001 [0,1,0,0,0,0|2,0,1]=4 2164 B7R0.4 CC(O)CNCCS Amb27838396 [0,1,0,0,0,0|2,0,1]=4 2165 B7R0.4 CC(O)COCCCl Amb27410199 [0,1,0,0,0,0|2,0,1]=4 2166 B7R0.4 CC(O)COCCN Amb27404532 [0,1,0,0,0,0|2,0,1]=4 2167 B7R0.4 CC(O)CSCCO Amb22055428 [0,1,0,0,0,0|2,0,1]=4 2168 B7R0.4 CC(O)CSCCS Amb28074830 [0,1,0,0,0,0|2,0,1]=4 2169 B7R0.4 CC(S)CCCCN Amb32788406 [0,1,0,0,0,0|1,1,1]=4 2170 B7R0.4 CCC#CCC(=O)O Amb26515701 [0,1,0,0,0,0|0,0,1]=2 2171 B7R0.4 CCC#CCC(C)=O Amb28040888 [0,1,0,0,0,0|1,0,1]=3 2172 B7R0.4 CCC#CCC(C)O Amb22045231 [0,1,0,0,0,0|1,0,2]=4 2173 B7R0.4 CCC#CC[C@@H](C)O Amb27659866 [0,1,0,0,0,0|1,0,2]=4 2174 B7R0.4 CCC=C=CC(C)=O Amb25830543 [0,1,0,0,0,0|1,0,2]=4 2175 B7R0.4 CCCC#CC(=O)O Amb2721706 [0,1,0,0,0,0|0,0,1]=2 2176 B7R0.4 CCCC#CC(C)=O Amb26844271 [0,1,0,0,0,0|1,0,1]=3 2177 B7R0.4 CCCC#CC(C)O Amb24273363 [0,1,0,0,0,0|1,0,2]=4 2178 B7R0.4 CCCC#CC(N)=O Amb27175227 [0,1,0,0,0,0|1,0,1]=3 2179 B7R0.4 CCCC#CC(O)O Amb27879620 [0,1,0,0,0,0|0,0,3]=4 2180 B7R0.4 CCCC#C[C@@H](C)O Amb27826359 [0,1,0,0,0,0|1,0,2]=4 2181 B7R0.4 CCCCC=C(C)C Amb22228888 [0,1,0,0,0,0|2,0,0]=3 2182 B7R0.4 CCCCCB(O)O Amb2447470 [0,1,0,0,0,0|1,0,1]=3 2183 B7R0.4 CCCCCC(=N)N Amb19890171 [0,1,0,0,0,0|2,0,0]=3 2184 B7R0.4 CCCCCC(=N)N Amb2696574 [0,1,0,0,0,0|2,0,0]=3 2185 B7R0.4 CCCCCC(=N)N Amb35747068 [0,1,0,0,0,0|2,0,0]=3 2186 B7R0.4 CCCCCC(=O)F Amb26061517 [0,1,0,0,0,0|1,0,0]=2 2187 B7R0.4 CCCCCC(=O)O Amb3939846 [0,1,0,0,0,0|0,0,0]=1 2188 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [0,1,0,0,0,0|0,0,1]=2 2189 B7R0.4 CCCCCC(C)=O Amb6608885 [0,1,0,0,0,0|1,0,0]=2 2190 B7R0.4 CCCCCC(C)Br Amb3940202 [0,1,0,0,0,0|2,0,1]=4 2191 B7R0.4 CCCCCC(C)C Amb8513253 [0,1,0,0,0,0|2,0,1]=4 2192 B7R0.4 CCCCCC(C)Cl Amb22228752 [0,1,0,0,0,0|2,0,1]=4 2193 B7R0.4 CCCCCC(C)N Amb21962698 [0,1,0,0,0,0|2,0,1]=4 2194 B7R0.4 CCCCCC(C)N Amb3939364 [0,1,0,0,0,0|2,0,1]=4 2195 B7R0.4 CCCCCC(C)O Amb8383668 [0,1,0,0,0,0|1,0,1]=3 2196 B7R0.4 CCCCCC(C)S Amb17939452 [0,1,0,0,0,0|1,1,1]=4 2197 B7R0.4 CCCCCC(Cl)Cl Amb27206941 [0,1,0,0,0,0|2,0,1]=4 2198 B7R0.4 CCCCCC(F)Br Amb24641242 [0,1,0,0,0,0|2,0,1]=4 2199 B7R0.4 CCCCCC(N)=S Amb6246072 [0,1,0,0,0,0|1,1,0]=3 2200 B7R0.4 CCCCCC(O)Cl Amb27232933 [0,1,0,0,0,0|1,0,1]=3 2201 B7R0.4 CCCCCC(O)O Amb25921998 [0,1,0,0,0,0|0,0,2]=3 2202 B7R0.4 CCCCCN(C)O Amb33428427 [0,1,0,0,0,0|2,0,0]=3 2203 B7R0.4 CCCCCS(=O)Cl Amb32720370 [0,1,0,0,0,0|2,0,0]=3 2204 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [0,1,0,0,0,0|1,0,1]=3 2205 B7R0.4 CCCCCS(C)=O Amb27457494 [0,1,0,0,0,0|2,0,0]=3 2206 B7R0.4 CCCCCS(N)=O Amb32720371 [0,1,0,0,0,0|2,0,0]=3 2207 B7R0.4 CCCCC[C@@H](C)N Amb3941400 [0,1,0,0,0,0|2,0,1]=4 2208 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [0,1,0,0,0,0|1,0,1]=3 2209 B7R0.4 CCCCC[C@H](C)N Amb8516349 [0,1,0,0,0,0|2,0,1]=4 2210 B7R0.4 CCCCC[C@H](C)O Amb8395591 [0,1,0,0,0,0|1,0,1]=3 2211 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [0,1,0,0,0,0|1,0,1]=3 2212 B7R0.4 CCCCNC(=N)N Amb19748357 [0,1,0,0,0,0|2,0,0]=3 2213 B7R0.4 CCCCNC(=N)N Amb32653258 [0,1,0,0,0,0|2,0,0]=3 2214 B7R0.4 CCCCNC(=O)Cl Amb24574309 [0,1,0,0,0,0|1,0,0]=2 2215 B7R0.4 CCCCNC(C)=N Amb27663050 [0,1,0,0,0,0|2,0,0]=3 2216 B7R0.4 CCCCNC(C)=O Amb5835711 [0,1,0,0,0,0|1,0,0]=2 2217 B7R0.4 CCCCNC(C)C Amb2111112 [0,1,0,0,0,0|2,0,1]=4 2218 B7R0.4 CCCCNC(C)C Amb6251422 [0,1,0,0,0,0|2,0,1]=4 2219 B7R0.4 CCCCNC(N)=O Amb6663202 [0,1,0,0,0,0|1,0,0]=2 2220 B7R0.4 CCCCNC(N)=S Amb1152044 [0,1,0,0,0,0|1,1,0]=3 2221 B7R0.4 CCCCOB(O)O Amb25687500 [0,1,0,0,0,0|1,0,1]=3 2222 B7R0.4 CCCCOC(=O)Cl Amb6608833 [0,1,0,0,0,0|1,0,0]=2 2223 B7R0.4 CCCCOC(=S)[S-] Amb16186572 [0,1,0,0,0,0|0,2,0]=3 2224 B7R0.4 CCCCOC(C)=O Amb6608782 [0,1,0,0,0,0|1,0,0]=2 2225 B7R0.4 CCCCOC(C)Cl Amb17689402 [0,1,0,0,0,0|2,0,1]=4 2226 B7R0.4 CCCCOC(C)O Amb26537694 [0,1,0,0,0,0|1,0,1]=3 2227 B7R0.4 CCCCOC(N)=O Amb4136361 [0,1,0,0,0,0|1,0,0]=2 2228 B7R0.4 CCCCOP(Cl)Cl Amb4297340 [0,1,0,0,0,0|3,0,0]=4 2229 B7R0.4 CCCCO[PH](=O)O Amb26035392 [0,1,0,0,0,0|1,0,0]=2 2230 B7R0.4 CCCCSC(=N)N Amb10552525 [0,1,0,0,0,0|2,0,0]=3 2231 B7R0.4 CCCCSC(=N)N Amb4007584 [0,1,0,0,0,0|2,0,0]=3 2232 B7R0.4 CCCCSC(=O)Cl Amb22352826 [0,1,0,0,0,0|1,0,0]=2 2233 B7R0.4 CCCCSC(C)C Amb4020661 [0,1,0,0,0,0|2,0,1]=4 2234 B7R0.4 CCCCSC(C)O Amb27191967 [0,1,0,0,0,0|1,0,1]=3 2235 B7R0.4 CCCC\N=[N+](/C)[O-] Amb28135976 [0,1,0,0,0,0|2,0,1]=4 2236 B7R0.4 CCCNCC(=O)O Amb10609640 [0,1,0,0,0,0|0,0,0]=1 2237 B7R0.4 CCCNCC(=O)O Amb1110628 [0,1,0,0,0,0|0,0,0]=1 2238 B7R0.4 CCCNCC(C)=O Amb26954588 [0,1,0,0,0,0|1,0,0]=2 2239 B7R0.4 CCCNCC(C)C Amb6258024 [0,1,0,0,0,0|2,0,1]=4 2240 B7R0.4 CCCNCC(C)O Amb9359420 [0,1,0,0,0,0|1,0,1]=3 2241 B7R0.4 CCCNCC(C)S Amb18124358 [0,1,0,0,0,0|1,1,1]=4 2242 B7R0.4 CCCNCC(Cl)Cl Amb28064059 [0,1,0,0,0,0|2,0,1]=4 2243 B7R0.4 CCCNCC(F)F Amb13951924 [0,1,0,0,0,0|2,0,1]=4 2244 B7R0.4 CCCNCC(F)F Amb8853727 [0,1,0,0,0,0|2,0,1]=4 2245 B7R0.4 CCCNCC(N)=O Amb1124632 [0,1,0,0,0,0|1,0,0]=2 2246 B7R0.4 CCCNCC(N)=O Amb28934788 [0,1,0,0,0,0|1,0,0]=2 2247 B7R0.4 CCCNC[C@@H](C)N Amb27835548 [0,1,0,0,0,0|2,0,1]=4 2248 B7R0.4 CCCNNC(N)=O Amb27405031 [0,1,0,0,0,0|2,0,0]=3 2249 B7R0.4 CCCNNC(N)=S Amb19514593 [0,1,0,0,0,0|2,1,0]=4 2250 B7R0.4 CCCN\N=C(\C)N Amb27421320 [0,1,0,0,0,0|3,0,0]=4 2251 B7R0.4 CCCOCB(O)O Amb27461328 [0,1,0,0,0,0|1,0,1]=3 2252 B7R0.4 CCCOCC(=O)Cl Amb27260778 [0,1,0,0,0,0|1,0,0]=2 2253 B7R0.4 CCCOCC(=O)O Amb8874504 [0,1,0,0,0,0|0,0,0]=1 2254 B7R0.4 CCCOCC(N)=O Amb27844884 [0,1,0,0,0,0|1,0,0]=2 2255 B7R0.4 CCCOCC(N)=S Amb8874828 [0,1,0,0,0,0|1,1,0]=3 2256 B7R0.4 CCCOC[C@@H](C)N Amb28048953 [0,1,0,0,0,0|2,0,1]=4 2257 B7R0.4 CCCOC[C@@H](C)O Amb28048955 [0,1,0,0,0,0|1,0,1]=3 2258 B7R0.4 CCCONC(C)=O Amb27764366 [0,1,0,0,0,0|2,0,0]=3 2259 B7R0.4 CCCONC(N)=O Amb2899788 [0,1,0,0,0,0|2,0,0]=3 2260 B7R0.4 CCCSCC(=O)O Amb1137113 [0,1,0,0,0,0|0,0,0]=1 2261 B7R0.4 CCCSCC(C)=O Amb9668676 [0,1,0,0,0,0|1,0,0]=2 2262 B7R0.4 CCCSCC(C)C Amb4017817 [0,1,0,0,0,0|2,0,1]=4 2263 B7R0.4 CCCSCC(C)O Amb27463818 [0,1,0,0,0,0|1,0,1]=3 2264 B7R0.4 CCCSCC(C)S Amb32788151 [0,1,0,0,0,0|1,1,1]=4 2265 B7R0.4 CCCSCC(N)=O Amb27424658 [0,1,0,0,0,0|1,0,0]=2 2266 B7R0.4 CCCSC[C@@H](C)O Amb27641885 [0,1,0,0,0,0|1,0,1]=3 2267 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [0,1,0,0,0,0|1,0,1]=3 2268 B7R0.4 CCC\C=C\C(=N)N Amb33358507 [0,1,0,0,0,0|2,0,1]=4 2269 B7R0.4 CCC\C=C\C(=O)Cl Amb2688716 [0,1,0,0,0,0|1,0,1]=3 2270 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [0,1,0,0,0,0|0,0,1]=2 2271 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [0,1,0,0,0,0|1,0,1]=3 2272 B7R0.4 CCC\C=C\C(C)O Amb25083446 [0,1,0,0,0,0|1,0,2]=4 2273 B7R0.4 CCC\C=C\C(N)=O Amb26397290 [0,1,0,0,0,0|1,0,1]=3 2274 B7R0.4 CCC\C=C\[C@@H](C)O Amb33429966 [0,1,0,0,0,0|1,0,2]=4 2275 B7R0.4 CCC\C=C\[C@H](C)O Amb27857282 [0,1,0,0,0,0|1,0,2]=4 2276 B7R0.4 CCC\C=C\[N+](=O)[O-] Amb24558342 [0,1,0,0,0,0|1,0,2]=4 2277 B7R0.4 CCC\C=N\S(C)=O Amb29858759 [0,1,0,0,0,0|2,0,1]=4 2278 B7R0.4 CCN=C=CC(C)=O Amb24481402 [0,1,0,0,0,0|1,0,2]=4 2279 B7R0.4 CCNCC=C(Cl)Cl Amb35684045 [0,1,0,0,0,0|2,0,1]=4 2280 B7R0.4 CCNCCC(=O)O Amb28934794 [0,1,0,0,0,0|0,0,0]=1 2281 B7R0.4 CCNCCC(=O)O Amb7766402 [0,1,0,0,0,0|0,0,0]=1 2282 B7R0.4 CCNCCC(C)=O Amb18641851 [0,1,0,0,0,0|1,0,0]=2 2283 B7R0.4 CCNCCC(C)C Amb6244455 [0,1,0,0,0,0|2,0,1]=4 2284 B7R0.4 CCNCCC(C)O Amb27239293 [0,1,0,0,0,0|1,0,1]=3 2285 B7R0.4 CCNCCC(N)=O Amb33533384 [0,1,0,0,0,0|1,0,0]=2 2286 B7R0.4 CCNCCC(N)=O Amb35749820 [0,1,0,0,0,0|1,0,0]=2 2287 B7R0.4 CCNCCC(N)=S Amb17231882 [0,1,0,0,0,0|1,1,0]=3 2288 B7R0.4 CCNCCN(C)C Amb1128271 [0,1,0,0,0,0|3,0,0]=4 2289 B7R0.4 CCNNCC(=O)O Amb28326075 [0,1,0,0,0,0|1,0,0]=2 2290 B7R0.4 CCOCCC(=N)N Amb2696677 [0,1,0,0,0,0|2,0,0]=3 2291 B7R0.4 CCOCCC(=N)N Amb33551393 [0,1,0,0,0,0|2,0,0]=3 2292 B7R0.4 CCOCCC(=O)Cl Amb20672027 [0,1,0,0,0,0|1,0,0]=2 2293 B7R0.4 CCOCCC(=O)O Amb3939859 [0,1,0,0,0,0|0,0,0]=1 2294 B7R0.4 CCOCCC(C)=O Amb7764636 [0,1,0,0,0,0|1,0,0]=2 2295 B7R0.4 CCOCCC(C)Cl Amb28422675 [0,1,0,0,0,0|2,0,1]=4 2296 B7R0.4 CCOCCC(C)N Amb7772189 [0,1,0,0,0,0|2,0,1]=4 2297 B7R0.4 CCOCCC(C)O Amb27852957 [0,1,0,0,0,0|1,0,1]=3 2298 B7R0.4 CCOCCC(Cl)Cl Amb27984892 [0,1,0,0,0,0|2,0,1]=4 2299 B7R0.4 CCOCCC(N)=S Amb6263797 [0,1,0,0,0,0|1,1,0]=3 2300 B7R0.4 CCOCCS(=O)Cl Amb24625733 [0,1,0,0,0,0|2,0,0]=3 2301 B7R0.4 CCOCCS(=O)[O-] Amb26001359 [0,1,0,0,0,0|1,0,1]=3 2302 B7R0.4 CCOCCS(N)=O Amb32720346 [0,1,0,0,0,0|2,0,0]=3 2303 B7R0.4 CCOCC[C@H](C)N Amb24439507 [0,1,0,0,0,0|2,0,1]=4 2304 B7R0.4 CCOCC[C@H](C)O Amb27946039 [0,1,0,0,0,0|1,0,1]=3 2305 B7R0.4 CCOCNC(N)=O Amb25765493 [0,1,0,0,0,0|2,0,0]=3 2306 B7R0.4 CCOCOC(=O)Cl Amb27623794 [0,1,0,0,0,0|2,0,0]=3 2307 B7R0.4 CCO\C=C\C(=O)Cl Amb33943049 [0,1,0,0,0,0|1,0,2]=4 2308 B7R0.4 CCO\C=C\C(=O)O Amb2725260 [0,1,0,0,0,0|0,0,2]=3 2309 B7R0.4 CCO\C=C\C(C)=O Amb25330041 [0,1,0,0,0,0|1,0,2]=4 2310 B7R0.4 CCO\N=C\C(=O)O Amb27468748 [0,1,0,0,0,0|1,0,1]=3 2311 B7R0.4 CCO\N=C\C(N)=O Amb27949484 [0,1,0,0,0,0|2,0,1]=4 2312 B7R0.4 CCSCCC(=N)N Amb6680836 [0,1,0,0,0,0|2,0,0]=3 2313 B7R0.4 CCSCCC(=O)O Amb6273140 [0,1,0,0,0,0|0,0,0]=1 2314 B7R0.4 CCSCCC(C)=O Amb9655821 [0,1,0,0,0,0|1,0,0]=2 2315 B7R0.4 CCSCCC(C)Br Amb33435746 [0,1,0,0,0,0|2,0,1]=4 2316 B7R0.4 CCSCCC(C)C Amb22230685 [0,1,0,0,0,0|2,0,1]=4 2317 B7R0.4 CCSCCC(C)Cl Amb28458510 [0,1,0,0,0,0|2,0,1]=4 2318 B7R0.4 CCSCCC(C)N Amb19149259 [0,1,0,0,0,0|2,0,1]=4 2319 B7R0.4 CCSCCC(C)O Amb28048927 [0,1,0,0,0,0|1,0,1]=3 2320 B7R0.4 CCSCCC(N)=O Amb27258252 [0,1,0,0,0,0|1,0,0]=2 2321 B7R0.4 CCSCCC(N)=S Amb17307560 [0,1,0,0,0,0|1,1,0]=3 2322 B7R0.4 CCSCCN(C)C Amb27198418 [0,1,0,0,0,0|3,0,0]=4 2323 B7R0.4 CCSCCN(C)O Amb33324043 [0,1,0,0,0,0|2,0,0]=3 2324 B7R0.4 CCSCC[C@@H](C)N Amb33323734 [0,1,0,0,0,0|2,0,1]=4 2325 B7R0.4 CCSCC[C@@H](C)O Amb33223925 [0,1,0,0,0,0|1,0,1]=3 2326 B7R0.4 CCSCC[C@H](C)N Amb33323728 [0,1,0,0,0,0|2,0,1]=4 2327 B7R0.4 CCSCC[C@H](C)O Amb33323733 [0,1,0,0,0,0|1,0,1]=3 2328 B7R0.4 CCSCC[N+](=O)[O-] Amb27838043 [0,1,0,0,0,0|1,0,1]=3 2329 B7R0.4 CCSSCC(C)=O Amb28316151 [0,1,0,0,0,0|2,0,0]=3 2330 B7R0.4 CCS\C=C/C(C)=O Amb28122375 [0,1,0,0,0,0|1,0,2]=4 2331 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [0,1,0,0,0,0|0,0,1]=2 2332 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [0,1,0,0,0,0|1,0,1]=3 2333 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [0,1,0,0,0,0|1,0,1]=3 2334 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [0,1,0,0,0,0|0,0,1]=2 2335 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [0,1,0,0,0,0|1,0,1]=3 2336 B7R0.4 CC\C=C\CC(C)O Amb33079090 [0,1,0,0,0,0|1,0,2]=4 2337 B7R0.4 CC\C=C\CC(N)=S Amb33225501 [0,1,0,0,0,0|1,1,1]=4 2338 B7R0.4 CC\C=C\CN(C)O Amb33268704 [0,1,0,0,0,0|2,0,1]=4 2339 B7R0.4 CC\C=C\C[C@@H](C)O Amb33359513 [0,1,0,0,0,0|1,0,2]=4 2340 B7R0.4 CC\C=C\C[C@H](C)O Amb33474377 [0,1,0,0,0,0|1,0,2]=4 2341 B7R0.4 CC\C=C\C[N+](=O)[O-] Amb33267962 [0,1,0,0,0,0|1,0,2]=4 2342 B7R0.4 CC\C=C\C[PH](=O)O Amb8391288 [0,1,0,0,0,0|1,0,1]=3 2343 B7R0.4 CC\C=N\NC(N)=O Amb26899579 [0,1,0,0,0,0|2,0,1]=4 2344 B7R0.4 CN(C)CCCCBr Amb18178257 [0,1,0,0,0,0|3,0,0]=4 2345 B7R0.4 CN(C)CCCCBr Amb19148184 [0,1,0,0,0,0|3,0,0]=4 2346 B7R0.4 CN(C)CCCCCl Amb17334150 [0,1,0,0,0,0|3,0,0]=4 2347 B7R0.4 CN(C)CCCCCl Amb20668164 [0,1,0,0,0,0|3,0,0]=4 2348 B7R0.4 CN(C)CCCCN Amb2687444 [0,1,0,0,0,0|3,0,0]=4 2349 B7R0.4 CN(C)CCCCO Amb9273966 [0,1,0,0,0,0|3,0,0]=4 2350 B7R0.4 CN(C)CCCCS Amb26480331 [0,1,0,0,0,0|3,0,0]=4 2351 B7R0.4 CN(N)CCCCO Amb28133877 [0,1,0,0,0,0|3,0,0]=4 2352 B7R0.4 CNCC#CC(=O)O Amb27218273 [0,1,0,0,0,0|0,0,2]=3 2353 B7R0.4 CNCCC=C(Cl)Cl Amb35710754 [0,1,0,0,0,0|2,0,1]=4 2354 B7R0.4 CNCCCC(=O)O Amb1153115 [0,1,0,0,0,0|0,0,0]=1 2355 B7R0.4 CNCCCC(=O)O Amb4521435 [0,1,0,0,0,0|0,0,0]=1 2356 B7R0.4 CNCCCC(C)=O Amb27838406 [0,1,0,0,0,0|1,0,0]=2 2357 B7R0.4 CNCCCC(C)C Amb32757651 [0,1,0,0,0,0|2,0,1]=4 2358 B7R0.4 CNCCCC(C)C Amb8853654 [0,1,0,0,0,0|2,0,1]=4 2359 B7R0.4 CNCCCC(C)O Amb17569899 [0,1,0,0,0,0|1,0,1]=3 2360 B7R0.4 CNCCCC(N)=O Amb18303611 [0,1,0,0,0,0|1,0,0]=2 2361 B7R0.4 CNCCCC(N)=O Amb31307731 [0,1,0,0,0,0|1,0,0]=2 2362 B7R0.4 CNCCCN(C)C Amb3939356 [0,1,0,0,0,0|3,0,0]=4 2363 B7R0.4 CNCCCS(C)=O Amb27827686 [0,1,0,0,0,0|2,0,0]=3 2364 B7R0.4 CNCCC[C@@H](C)O Amb27784601 [0,1,0,0,0,0|1,0,1]=3 2365 B7R0.4 CNCCNC(=S)S Amb28397261 [0,1,0,0,0,0|1,2,0]=4 2366 B7R0.4 CNCCNC(C)=O Amb28934797 [0,1,0,0,0,0|2,0,0]=3 2367 B7R0.4 CNCCNC(C)=O Amb9256137 [0,1,0,0,0,0|2,0,0]=3 2368 B7R0.4 CNCCNC(N)=O Amb18299975 [0,1,0,0,0,0|2,0,0]=3 2369 B7R0.4 CNCCNS(C)=O Amb28286115 [0,1,0,0,0,0|3,0,0]=4 2370 B7R0.4 CNCCOC(C)=O Amb18124262 [0,1,0,0,0,0|2,0,0]=3 2371 B7R0.4 CNCCOC(C)=O Amb33621071 [0,1,0,0,0,0|2,0,0]=3 2372 B7R0.4 CNCCOC(N)=O Amb25136928 [0,1,0,0,0,0|2,0,0]=3 2373 B7R0.4 CNCCOC(N)=O Amb32693459 [0,1,0,0,0,0|2,0,0]=3 2374 B7R0.4 CNCCSC(=N)N Amb23590673 [0,1,0,0,0,0|3,0,0]=4 2375 B7R0.4 CNC\C=C\C(=O)O Amb25368293 [0,1,0,0,0,0|0,0,2]=3 2376 B7R0.4 COCC#CC(=O)O Amb33544473 [0,1,0,0,0,0|0,0,2]=3 2377 B7R0.4 COCC#CC(C)=O Amb28053950 [0,1,0,0,0,0|1,0,2]=4 2378 B7R0.4 COCC#CC(N)=O Amb33495809 [0,1,0,0,0,0|1,0,2]=4 2379 B7R0.4 COCCCB(O)O Amb27754195 [0,1,0,0,0,0|1,0,1]=3 2380 B7R0.4 COCCCC(=N)N Amb19269156 [0,1,0,0,0,0|2,0,0]=3 2381 B7R0.4 COCCCC(=N)N Amb6266770 [0,1,0,0,0,0|2,0,0]=3 2382 B7R0.4 COCCCC(=O)O Amb6275629 [0,1,0,0,0,0|0,0,0]=1 2383 B7R0.4 COCCCC(C)=O Amb9031556 [0,1,0,0,0,0|1,0,0]=2 2384 B7R0.4 COCCCC(C)Br Amb18185551 [0,1,0,0,0,0|2,0,1]=4 2385 B7R0.4 COCCCC(C)Cl Amb26489622 [0,1,0,0,0,0|2,0,1]=4 2386 B7R0.4 COCCCC(C)N Amb9031757 [0,1,0,0,0,0|2,0,1]=4 2387 B7R0.4 COCCCC(C)O Amb4020863 [0,1,0,0,0,0|1,0,1]=3 2388 B7R0.4 COCCCC(C)S Amb25810805 [0,1,0,0,0,0|1,1,1]=4 2389 B7R0.4 COCCCC(Cl)Cl Amb28396614 [0,1,0,0,0,0|2,0,1]=4 2390 B7R0.4 COCCCC(N)=S Amb6270649 [0,1,0,0,0,0|1,1,0]=3 2391 B7R0.4 COCCCN(C)C Amb2779456 [0,1,0,0,0,0|3,0,0]=4 2392 B7R0.4 COCCCN(C)C Amb30585124 [0,1,0,0,0,0|3,0,0]=4 2393 B7R0.4 COCCCN(C)O Amb33377831 [0,1,0,0,0,0|2,0,0]=3 2394 B7R0.4 COCCCS(=O)Cl Amb26013061 [0,1,0,0,0,0|2,0,0]=3 2395 B7R0.4 COCCCS(=O)[O-] Amb27974844 [0,1,0,0,0,0|1,0,1]=3 2396 B7R0.4 COCCCS(N)=O Amb32720360 [0,1,0,0,0,0|2,0,0]=3 2397 B7R0.4 COCCC[C@@H](C)Cl Amb27590769 [0,1,0,0,0,0|2,0,1]=4 2398 B7R0.4 COCCC[C@@H](C)N Amb24749054 [0,1,0,0,0,0|2,0,1]=4 2399 B7R0.4 COCCC[C@@H](C)O Amb33428680 [0,1,0,0,0,0|1,0,1]=3 2400 B7R0.4 COCCC[C@H](C)N Amb27164382 [0,1,0,0,0,0|2,0,1]=4 2401 B7R0.4 COCCC[C@H](C)O Amb27396064 [0,1,0,0,0,0|1,0,1]=3 2402 B7R0.4 COCCC[N+](=O)[O-] Amb33428678 [0,1,0,0,0,0|1,0,1]=3 2403 B7R0.4 COCCNC(=N)N Amb22587024 [0,1,0,0,0,0|3,0,0]=4 2404 B7R0.4 COCCNC(=N)N Amb33547913 [0,1,0,0,0,0|3,0,0]=4 2405 B7R0.4 COCCNC(=N)N Amb845676 [0,1,0,0,0,0|3,0,0]=4 2406 B7R0.4 COCCNC(C)=O Amb3358082 [0,1,0,0,0,0|2,0,0]=3 2407 B7R0.4 COCCNC(N)=O Amb1104938 [0,1,0,0,0,0|2,0,0]=3 2408 B7R0.4 COCCNC(N)=S Amb379929 [0,1,0,0,0,0|2,1,0]=4 2409 B7R0.4 COCCOC(=O)Cl Amb2689125 [0,1,0,0,0,0|2,0,0]=3 2410 B7R0.4 COCCOC(=S)[S-] Amb20671928 [0,1,0,0,0,0|1,2,0]=4 2411 B7R0.4 COCCOC(C)=O Amb4037074 [0,1,0,0,0,0|2,0,0]=3 2412 B7R0.4 COCCOC(N)=O Amb25054225 [0,1,0,0,0,0|2,0,0]=3 2413 B7R0.4 COCCSC(=N)N Amb20675994 [0,1,0,0,0,0|3,0,0]=4 2414 B7R0.4 COCOCC(=N)N Amb27259902 [0,1,0,0,0,0|3,0,0]=4 2415 B7R0.4 COCOCC(=N)N Amb28934863 [0,1,0,0,0,0|3,0,0]=4 2416 B7R0.4 COCOCC(=O)O Amb28059312 [0,1,0,0,0,0|1,0,0]=2 2417 B7R0.4 COCSCC(=O)O Amb27466837 [0,1,0,0,0,0|1,0,0]=2 2418 B7R0.4 COC\C=C\C(=O)O Amb33986212 [0,1,0,0,0,0|0,0,2]=3 2419 B7R0.4 COC\C=C\C(C)=O Amb33359822 [0,1,0,0,0,0|1,0,2]=4 2420 B7R0.4 CONCCS(C)=O Amb27469149 [0,1,0,0,0,0|3,0,0]=4 2421 B7R0.4 CP(O)OCCCCl Amb28254545 [0,1,0,0,0,0|3,0,0]=4 2422 B7R0.4 CS(=O)CCCC#N Amb26007802 [0,1,0,0,0,0|2,0,1]=4 2423 B7R0.4 CS(=O)CCCCBr Amb27874454 [0,1,0,0,0,0|2,0,0]=3 2424 B7R0.4 CS(=O)CCCCCl Amb27253421 [0,1,0,0,0,0|2,0,0]=3 2425 B7R0.4 CS(=O)CCCCN Amb17617794 [0,1,0,0,0,0|2,0,0]=3 2426 B7R0.4 CS(=O)CCCON Amb28324081 [0,1,0,0,0,0|3,0,0]=4 2427 B7R0.4 CS(=O)NCCCCl Amb27265745 [0,1,0,0,0,0|3,0,0]=4 2428 B7R0.4 CSCCCC(=N)N Amb27829199 [0,1,0,0,0,0|2,0,0]=3 2429 B7R0.4 CSCCCC(=O)O Amb17503622 [0,1,0,0,0,0|0,0,0]=1 2430 B7R0.4 CSCCCC(C)=O Amb25122381 [0,1,0,0,0,0|1,0,0]=2 2431 B7R0.4 CSCCCC(C)Br Amb27798199 [0,1,0,0,0,0|2,0,1]=4 2432 B7R0.4 CSCCCC(C)C Amb28289938 [0,1,0,0,0,0|2,0,1]=4 2433 B7R0.4 CSCCCC(C)N Amb18124381 [0,1,0,0,0,0|2,0,1]=4 2434 B7R0.4 CSCCCC(C)O Amb25958947 [0,1,0,0,0,0|1,0,1]=3 2435 B7R0.4 CSCCCC(N)=S Amb28048945 [0,1,0,0,0,0|1,1,0]=3 2436 B7R0.4 CSCCCN(C)O Amb33198763 [0,1,0,0,0,0|2,0,0]=3 2437 B7R0.4 CSCCC[C@@H](C)N Amb33200177 [0,1,0,0,0,0|2,0,1]=4 2438 B7R0.4 CSCCC[C@@H](C)O Amb33198286 [0,1,0,0,0,0|1,0,1]=3 2439 B7R0.4 CSCCC[C@H](C)N Amb33200176 [0,1,0,0,0,0|2,0,1]=4 2440 B7R0.4 CSCCC[C@H](C)O Amb33198288 [0,1,0,0,0,0|1,0,1]=3 2441 B7R0.4 CSCCC[N+](=O)[O-] Amb33200220 [0,1,0,0,0,0|1,0,1]=3 2442 B7R0.4 CSCCNC(=O)Cl Amb29882959 [0,1,0,0,0,0|2,0,0]=3 2443 B7R0.4 CSCCNC(C)=O Amb8504699 [0,1,0,0,0,0|2,0,0]=3 2444 B7R0.4 CSCCNC(N)=O Amb27424586 [0,1,0,0,0,0|2,0,0]=3 2445 B7R0.4 CSCCNC(N)=S Amb24414359 [0,1,0,0,0,0|2,1,0]=4 2446 B7R0.4 CSCCSC(=N)N Amb27984752 [0,1,0,0,0,0|3,0,0]=4 2447 B7R0.4 CSCCSC(C)=O Amb27635033 [0,1,0,0,0,0|2,0,0]=3 2448 B7R0.4 CSCSCC(=O)O Amb27858824 [0,1,0,0,0,0|1,0,0]=2 2449 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [0,1,0,0,0,0|1,0,2]=4 2450 B7R0.4 CSC\C=C\C(C)=O Amb33359530 [0,1,0,0,0,0|1,0,2]=4 2451 B7R0.4 CSSCCC(=O)O Amb26848465 [0,1,0,0,0,0|1,0,0]=2 2452 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [0,1,0,0,0,0|0,0,2]=3 2453 B7R0.4 C[C@@H](N)CCCCF Amb33196127 [0,1,0,0,0,0|2,0,1]=4 2454 B7R0.4 C[C@@H](O)CCCCBr Amb28343132 [0,1,0,0,0,0|1,0,1]=3 2455 B7R0.4 C[C@@H](O)CCCCCl Amb8517538 [0,1,0,0,0,0|1,0,1]=3 2456 B7R0.4 C[C@@H](O)CCCCF Amb33196128 [0,1,0,0,0,0|1,0,1]=3 2457 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [0,1,0,0,0,0|1,0,1]=3 2458 B7R0.4 C[C@@H](O)CNCCF Amb27486911 [0,1,0,0,0,0|2,0,1]=4 2459 B7R0.4 C[C@H](F)CCCCO Amb27945000 [0,1,0,0,0,0|2,0,1]=4 2460 B7R0.4 C[C@H](N)CCCCF Amb33480694 [0,1,0,0,0,0|2,0,1]=4 2461 B7R0.4 C[C@H](O)CCCC#N Amb27979195 [0,1,0,0,0,0|1,0,2]=4 2462 B7R0.4 C[C@H](O)CCCCF Amb33196129 [0,1,0,0,0,0|1,0,1]=3 2463 B7R0.4 C[C@H](O)CCCCO Amb28381637 [0,1,0,0,0,0|1,0,1]=3 2464 B7R0.4 C\C(Br)=C\CCCBr Amb22347606 [0,1,0,0,0,0|2,0,1]=4 2465 B7R0.4 C\C(Cl)=C\CCCO Amb27211291 [0,1,0,0,0,0|2,0,1]=4 2466 B7R0.4 C\C=C\C#CC(=O)O Amb17593127 [0,1,0,0,0,0|0,0,3]=4 2467 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [0,1,0,0,0,0|0,0,3]=4 2468 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [0,1,0,0,0,0|0,0,1]=2 2469 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [0,1,0,0,0,0|1,0,1]=3 2470 B7R0.4 C\C=C\CCC(C)O Amb32665057 [0,1,0,0,0,0|1,0,2]=4 2471 B7R0.4 C\C=C\CC[C@@H](C)O Amb27652940 [0,1,0,0,0,0|1,0,2]=4 2472 B7R0.4 C\C=C\CNC(=O)S Amb26417290 [0,1,0,0,0,0|0,1,2]=4 2473 B7R0.4 C\C=C\COC(C)=O Amb6366590 [0,1,0,0,0,0|1,0,2]=4 2474 B7R0.4 ClCCCC=C(Cl)Cl Amb28284505 [0,1,0,0,0,0|2,0,1]=4 2475 B7R0.4 N#CCCCC(=O)O Amb33542831 [0,1,0,0,0,0|0,0,1]=2 2476 B7R0.4 N#CCCCS(=O)Cl Amb32720313 [0,1,0,0,0,0|2,0,1]=4 2477 B7R0.4 N#CCCCS(=O)[O-] Amb32753961 [0,1,0,0,0,0|1,0,2]=4 2478 B7R0.4 N#CCCCS(N)=O Amb32720314 [0,1,0,0,0,0|2,0,1]=4 2479 B7R0.4 N#CCCC[N+](=O)[O-] Amb27437950 [0,1,0,0,0,0|1,0,2]=4 2480 B7R0.4 N#CCSCC(=O)O Amb6243720 [0,1,0,0,0,0|1,0,1]=3 2481 B7R0.4 N#CNCCC(=O)O Amb30031691 [0,1,0,0,0,0|1,0,1]=3 2482 B7R0.4 N#CNOCC(=O)O Amb35634483 [0,1,0,0,0,0|2,0,1]=4 2483 B7R0.4 N=C(N)CCCCBr Amb4297024 [0,1,0,0,0,0|2,0,0]=3 2484 B7R0.4 N=C(N)CCCCCl Amb4297063 [0,1,0,0,0,0|2,0,0]=3 2485 B7R0.4 N=C(N)CCCCF Amb27486600 [0,1,0,0,0,0|2,0,0]=3 2486 B7R0.4 N=C(N)CCCCN Amb25714813 [0,1,0,0,0,0|2,0,0]=3 2487 B7R0.4 N=C(N)CCCCN Amb33299438 [0,1,0,0,0,0|2,0,0]=3 2488 B7R0.4 N=C(N)SCCCBr Amb27970087 [0,1,0,0,0,0|3,0,0]=4 2489 B7R0.4 NC(=O)CCCCBr Amb27875083 [0,1,0,0,0,0|1,0,0]=2 2490 B7R0.4 NC(=O)CCCCCl Amb7782532 [0,1,0,0,0,0|1,0,0]=2 2491 B7R0.4 NC(=O)CCCCO Amb3939470 [0,1,0,0,0,0|1,0,0]=2 2492 B7R0.4 NC(=O)CCCCS Amb27839239 [0,1,0,0,0,0|1,0,0]=2 2493 B7R0.4 NC(=O)CCSCCl Amb27430706 [0,1,0,0,0,0|2,0,0]=3 2494 B7R0.4 NC(=O)CC\C=C\Cl Amb25173831 [0,1,0,0,0,0|1,0,2]=4 2495 B7R0.4 NC(=O)CNCCO Amb6714605 [0,1,0,0,0,0|2,0,0]=3 2496 B7R0.4 NC(=O)COCCBr Amb25133475 [0,1,0,0,0,0|2,0,0]=3 2497 B7R0.4 NC(=O)COCCCl Amb5722397 [0,1,0,0,0,0|2,0,0]=3 2498 B7R0.4 NC(=O)CSCCBr Amb28193514 [0,1,0,0,0,0|2,0,0]=3 2499 B7R0.4 NC(=O)CSCCO Amb6754148 [0,1,0,0,0,0|2,0,0]=3 2500 B7R0.4 NC(=O)CSCCS Amb27651871 [0,1,0,0,0,0|2,0,0]=3 2501 B7R0.4 NC(=O)NCCCF Amb27396406 [0,1,0,0,0,0|2,0,0]=3 2502 B7R0.4 NC(=O)NCCCO Amb9248133 [0,1,0,0,0,0|2,0,0]=3 2503 B7R0.4 NC(=O)NCCN=O Amb27796959 [0,1,0,0,0,0|3,0,0]=4 2504 B7R0.4 NC(=O)OCCCBr Amb28316236 [0,1,0,0,0,0|2,0,0]=3 2505 B7R0.4 NC(=S)CCCCBr Amb27622634 [0,1,0,0,0,0|1,1,0]=3 2506 B7R0.4 NC(=S)CCCCCl Amb25177620 [0,1,0,0,0,0|1,1,0]=3 2507 B7R0.4 NCC#CCC(=O)O Amb27976019 [0,1,0,0,0,0|0,0,2]=3 2508 B7R0.4 NCCC#CC(=O)O Amb32656225 [0,1,0,0,0,0|0,0,2]=3 2509 B7R0.4 NCCCC=C(Cl)Cl Amb27400339 [0,1,0,0,0,0|2,0,1]=4 2510 B7R0.4 NCCCCB(O)O Amb27436221 [0,1,0,0,0,0|1,0,1]=3 2511 B7R0.4 NCCCCC(=O)Cl Amb26599615 [0,1,0,0,0,0|1,0,0]=2 2512 B7R0.4 NCCCCC(=O)O Amb2780021 [0,1,0,0,0,0|0,0,0]=1 2513 B7R0.4 NCCCCC(=O)O Amb3941646 [0,1,0,0,0,0|0,0,0]=1 2514 B7R0.4 NCCCCC(=O)O Amb9825855 [0,1,0,0,0,0|0,0,0]=1 2515 B7R0.4 NCCCCC(F)F Amb32812804 [0,1,0,0,0,0|2,0,1]=4 2516 B7R0.4 NCCCCC(N)=O Amb18641897 [0,1,0,0,0,0|1,0,0]=2 2517 B7R0.4 NCCCCC(N)=O Amb33552086 [0,1,0,0,0,0|1,0,0]=2 2518 B7R0.4 NCCCCS(=O)O Amb27882127 [0,1,0,0,0,0|1,0,0]=2 2519 B7R0.4 NCCCNC(=O)O Amb24093884 [0,1,0,0,0,0|1,0,0]=2 2520 B7R0.4 NCCCNC(=O)S Amb27839485 [0,1,0,0,0,0|1,1,0]=3 2521 B7R0.4 NCCCNC(=S)S Amb27772303 [0,1,0,0,0,0|1,2,0]=4 2522 B7R0.4 NCCCNC(N)=O Amb18296186 [0,1,0,0,0,0|2,0,0]=3 2523 B7R0.4 NCCCNC(N)=O Amb20622408 [0,1,0,0,0,0|2,0,0]=3 2524 B7R0.4 NCCCOC(N)=O Amb26334419 [0,1,0,0,0,0|2,0,0]=3 2525 B7R0.4 NCCCOC(N)=O Amb33299259 [0,1,0,0,0,0|2,0,0]=3 2526 B7R0.4 NCCCOS(=O)O Amb26007874 [0,1,0,0,0,0|2,0,0]=3 2527 B7R0.4 NCCNCC(=O)O Amb17608063 [0,1,0,0,0,0|1,0,0]=2 2528 B7R0.4 NCCNCC(=O)O Amb33339058 [0,1,0,0,0,0|1,0,0]=2 2529 B7R0.4 NCCNCC(N)=O Amb28388338 [0,1,0,0,0,0|2,0,0]=3 2530 B7R0.4 NCCOCC(=O)O Amb18630146 [0,1,0,0,0,0|1,0,0]=2 2531 B7R0.4 NCCOCC(=O)O Amb33550947 [0,1,0,0,0,0|1,0,0]=2 2532 B7R0.4 NCCOCC(N)=O Amb18523830 [0,1,0,0,0,0|2,0,0]=3 2533 B7R0.4 NCCOCC(N)=O Amb33549549 [0,1,0,0,0,0|2,0,0]=3 2534 B7R0.4 NCCSCC(=O)O Amb17500446 [0,1,0,0,0,0|1,0,0]=2 2535 B7R0.4 NCCSCC(=O)O Amb20622325 [0,1,0,0,0,0|1,0,0]=2 2536 B7R0.4 NCCSCC(N)=O Amb6266329 [0,1,0,0,0,0|2,0,0]=3 2537 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [0,1,0,0,0,0|0,0,2]=3 2538 B7R0.4 NOCCCC(=O)O Amb10975956 [0,1,0,0,0,0|1,0,0]=2 2539 B7R0.4 NOCCCC(=O)O Amb22011795 [0,1,0,0,0,0|1,0,0]=2 2540 B7R0.4 NOCCCC(=O)O Amb31283653 [0,1,0,0,0,0|1,0,0]=2 2541 B7R0.4 NS(=O)CCCCCl Amb32720307 [0,1,0,0,0,0|2,0,0]=3 2542 B7R0.4 NS(=O)CCCCF Amb32720393 [0,1,0,0,0,0|2,0,0]=3 2543 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [0,1,0,0,0,0|1,0,0]=2 2544 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [0,1,0,0,0,0|1,0,0]=2 2545 B7R0.4 O=C(Cl)COCCCl Amb17610887 [0,1,0,0,0,0|2,0,0]=3 2546 B7R0.4 O=C(Cl)NCCCCl Amb27856097 [0,1,0,0,0,0|2,0,0]=3 2547 B7R0.4 O=C(Cl)NCCCF Amb35633310 [0,1,0,0,0,0|2,0,0]=3 2548 B7R0.4 O=C(Cl)OCCCCl Amb10844795 [0,1,0,0,0,0|2,0,0]=3 2549 B7R0.4 O=C(Cl)OCCCF Amb26994902 [0,1,0,0,0,0|2,0,0]=3 2550 B7R0.4 O=C(Cl)\C=C\CCCl Amb27413542 [0,1,0,0,0,0|1,0,2]=4 2551 B7R0.4 O=C(O)C#CCCO Amb25844914 [0,1,0,0,0,0|0,0,2]=3 2552 B7R0.4 O=C(O)CCCCBr Amb6608763 [0,1,0,0,0,0|0,0,0]=1 2553 B7R0.4 O=C(O)CCCCCl Amb3940369 [0,1,0,0,0,0|0,0,0]=1 2554 B7R0.4 O=C(O)CCCCF Amb26639920 [0,1,0,0,0,0|0,0,0]=1 2555 B7R0.4 O=C(O)CCCCO Amb9214971 [0,1,0,0,0,0|0,0,0]=1 2556 B7R0.4 O=C(O)CCCCS Amb17503767 [0,1,0,0,0,0|0,0,0]=1 2557 B7R0.4 O=C(O)CCCNCl Amb27173950 [0,1,0,0,0,0|1,0,0]=2 2558 B7R0.4 O=C(O)CCN=C=S Amb24562253 [0,1,0,0,0,0|1,0,1]=3 2559 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [0,1,0,0,0,0|0,0,2]=3 2560 B7R0.4 O=C(O)CC\C=N\O Amb27211579 [0,1,0,0,0,0|1,0,1]=3 2561 B7R0.4 O=C(O)CNCCF Amb28076282 [0,1,0,0,0,0|1,0,0]=2 2562 B7R0.4 O=C(O)CNCCO Amb9325653 [0,1,0,0,0,0|1,0,0]=2 2563 B7R0.4 O=C(O)COCCCl Amb21857870 [0,1,0,0,0,0|1,0,0]=2 2564 B7R0.4 O=C(O)COCCF Amb27866609 [0,1,0,0,0,0|1,0,0]=2 2565 B7R0.4 O=C(O)COCCO Amb6680914 [0,1,0,0,0,0|1,0,0]=2 2566 B7R0.4 O=C(O)CSCCCl Amb18644703 [0,1,0,0,0,0|1,0,0]=2 2567 B7R0.4 O=C(O)CSSCCl Amb27983630 [0,1,0,0,0,0|2,0,0]=3 2568 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [0,1,0,0,0,0|0,0,2]=3 2569 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [0,1,0,0,0,0|0,0,2]=3 2570 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [0,1,0,0,0,0|0,0,2]=3 2571 B7R0.4 O=C(O)\C=C\CCBr Amb25702661 [0,1,0,0,0,0|0,0,2]=3 2572 B7R0.4 O=C(O)\C=C\CCF Amb33196445 [0,1,0,0,0,0|0,0,2]=3 2573 B7R0.4 O=C([O-])CCCCF Amb33527827 [0,1,0,0,0,0|0,0,1]=2 2574 B7R0.4 O=C([O-])CCCCO Amb13952763 [0,1,0,0,0,0|0,0,1]=2 2575 B7R0.4 O=C([O-])CCCCO Amb22749314 [0,1,0,0,0,0|0,0,1]=2 2576 B7R0.4 O=C([O-])COCCO Amb33553026 [0,1,0,0,0,0|1,0,1]=3 2577 B7R0.4 O=C=NCCC(=O)Cl Amb17593404 [0,1,0,0,0,0|2,0,1]=4 2578 B7R0.4 O=C=NCCC(=O)O Amb26053417 [0,1,0,0,0,0|1,0,1]=3 2579 B7R0.4 O=CCCCC(=O)O Amb17593198 [0,1,0,0,0,0|0,0,1]=2 2580 B7R0.4 O=CCCCC(O)O Amb25889261 [0,1,0,0,0,0|0,0,3]=4 2581 B7R0.4 O=CNCCC(=O)O Amb18290434 [0,1,0,0,0,0|1,0,1]=3 2582 B7R0.4 O=CNOCC(=O)O Amb27477273 [0,1,0,0,0,0|2,0,1]=4 2583 B7R0.4 O=NSCCC(=O)O Amb28429846 [0,1,0,0,0,0|2,0,0]=3 2584 B7R0.4 O=S(Cl)CCCCCl Amb32720306 [0,1,0,0,0,0|2,0,0]=3 2585 B7R0.4 O=S(Cl)CCCCF Amb32720392 [0,1,0,0,0,0|2,0,0]=3 2586 B7R0.4 O=S(Cl)OCCCF Amb34916628 [0,1,0,0,0,0|3,0,0]=4 2587 B7R0.4 O=S([O-])CCCCCl Amb28400114 [0,1,0,0,0,0|1,0,1]=3 2588 B7R0.4 O=S([O-])CCCCF Amb32754733 [0,1,0,0,0,0|1,0,1]=3 2589 B7R0.4 O=S([O-])CCCCO Amb27181023 [0,1,0,0,0,0|1,0,1]=3 2590 B7R0.4 O=[N+]([O-])CCCCF Amb33171716 [0,1,0,0,0,0|1,0,1]=3 2591 B7R0.4 O=[N+]([O-])CCCCO Amb25739830 [0,1,0,0,0,0|1,0,1]=3 2592 B7R0.4 O=[N+]([O-])OCCCBr Amb21953589 [0,1,0,0,0,0|2,0,1]=4 2593 B7R0.4 OB(O)CCCCBr Amb20171450 [0,1,0,0,0,0|1,0,1]=3 2594 B7R0.4 OC(Cl)CCCCCl Amb27410884 [0,1,0,0,0,0|1,0,1]=3 2595 B7R0.4 OC(O)CCCSS Amb27978339 [0,1,0,0,0,0|1,0,2]=4 2596 B7R0.4 OCCCC=C(F)F Amb28287397 [0,1,0,0,0,0|2,0,1]=4 2597 B7R0.4 OCCCCB(O)O Amb25351122 [0,1,0,0,0,0|1,0,1]=3 2598 B7R0.4 OCCCOB(O)O Amb27491736 [0,1,0,0,0,0|2,0,1]=4 2599 B7R0.4 [N-]=[N+]=NCCC(=O)Cl Amb27831534 [0,1,0,0,0,0|3,0,0]=4 2600 B7R0.4 [N-]=[N+]=NCCC(=O)O Amb20622326 [0,1,0,0,0,0|2,0,0]=3 2601 B7R0.5 C#CCC(=O)C(=O)O Amb27601316 [0,1,0,0,0,0|0,0,3]=4 2602 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [0,1,0,0,0,0|0,0,2]=3 2603 B7R0.5 C#CCC(C)C(C)=O Amb27465169 [0,1,0,0,0,0|1,0,2]=4 2604 B7R0.5 C#CCC(F)C(C)=O Amb28249962 [0,1,0,0,0,0|1,0,2]=4 2605 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [0,1,0,0,0,0|0,0,2]=3 2606 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [0,1,0,0,0,0|0,0,2]=3 2607 B7R0.5 C#CCC(N)C(C)=O Amb27228190 [0,1,0,0,0,0|1,0,2]=4 2608 B7R0.5 C#CCC(N)C(N)=O Amb22059485 [0,1,0,0,0,0|1,0,2]=4 2609 B7R0.5 C#CCC(N)C(N)=O Amb33543329 [0,1,0,0,0,0|1,0,2]=4 2610 B7R0.5 C#CCC(N)[PH](=O)O Amb27838345 [0,1,0,0,0,0|1,0,2]=4 2611 B7R0.5 C#CCC(O)C(=O)O Amb27154881 [0,1,0,0,0,0|0,0,2]=3 2612 B7R0.5 C#CCC(O)C(C)=O Amb27442415 [0,1,0,0,0,0|1,0,2]=4 2613 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [0,1,0,0,0,0|0,0,2]=3 2614 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [0,1,0,0,0,0|0,0,2]=3 2615 B7R0.5 C#CC[C@@H](N)C(N)=O Amb27473309 [0,1,0,0,0,0|1,0,2]=4 2616 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [0,1,0,0,0,0|0,0,2]=3 2617 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [0,1,0,0,0,0|0,0,2]=3 2618 B7R0.5 C#CC[C@H](N)C(N)=O Amb28345609 [0,1,0,0,0,0|1,0,2]=4 2619 B7R0.5 C=C(C)C(=O)CCC Amb25862437 [0,1,0,0,0,0|2,0,1]=4 2620 B7R0.5 C=C(C)C(C)CCN Amb33199933 [0,1,0,0,0,0|3,0,0]=4 2621 B7R0.5 C=C(C)C(C)CCO Amb27766618 [0,1,0,0,0,0|3,0,0]=4 2622 B7R0.5 C=C(C)C(Cl)CCC Amb28121399 [0,1,0,0,0,0|2,0,0]=3 2623 B7R0.5 C=C(C)C(F)CCN Amb28401279 [0,1,0,0,0,0|3,0,0]=4 2624 B7R0.5 C=C(C)C(N)CCO Amb27391185 [0,1,0,0,0,0|3,0,0]=4 2625 B7R0.5 C=C(C)C(O)CCN Amb25929797 [0,1,0,0,0,0|3,0,0]=4 2626 B7R0.5 C=C(C)C(O)CNC Amb24716760 [0,1,0,0,0,0|3,0,0]=4 2627 B7R0.5 C=C(C)C(O)COC Amb27662970 [0,1,0,0,0,0|3,0,0]=4 2628 B7R0.5 C=C(C)C(O)CSC Amb27795952 [0,1,0,0,0,0|3,0,0]=4 2629 B7R0.5 C=C(C)[C@@H](O)CCN Amb33199602 [0,1,0,0,0,0|3,0,0]=4 2630 B7R0.5 C=C(C)[C@H](O)CCN Amb33199603 [0,1,0,0,0,0|3,0,0]=4 2631 B7R0.5 C=C(CCC)B(O)O Amb28184986 [0,1,0,0,0,0|1,0,2]=4 2632 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [0,1,0,0,0,0|0,0,1]=2 2633 B7R0.5 C=C(CCC)[N+](=O)[O-] Amb28189815 [0,1,0,0,0,0|1,0,2]=4 2634 B7R0.5 C=C(CCF)C(=O)O Amb33480692 [0,1,0,0,0,0|1,0,1]=3 2635 B7R0.5 C=C(CCN)C(=O)O Amb27267272 [0,1,0,0,0,0|1,0,1]=3 2636 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [0,1,0,0,0,0|1,0,1]=3 2637 B7R0.5 C=C(COC)C(=O)O Amb26978134 [0,1,0,0,0,0|1,0,1]=3 2638 B7R0.5 C=C(CSC)C(=O)O Amb26953041 [0,1,0,0,0,0|1,0,1]=3 2639 B7R0.5 C=C(Cl)C(O)CSC Amb27660824 [0,1,0,0,0,0|3,0,0]=4 2640 B7R0.5 C=C(F)C(O)CCC Amb27833609 [0,1,0,0,0,0|2,0,0]=3 2641 B7R0.5 C=C(O)C(O)\C=C\C Amb28140639 [0,1,0,0,0,0|1,0,2]=4 2642 B7R0.5 C=CCC(=C)C(=O)O Amb18641687 [0,1,0,0,0,0|0,0,3]=4 2643 B7R0.5 C=CCC(=O)C(=O)O Amb25890017 [0,1,0,0,0,0|0,0,3]=4 2644 B7R0.5 C=CCC(Br)C(C)=O Amb27760403 [0,1,0,0,0,0|1,0,2]=4 2645 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [0,1,0,0,0,0|0,0,2]=3 2646 B7R0.5 C=CCC(C)C(C)=O Amb19373098 [0,1,0,0,0,0|1,0,2]=4 2647 B7R0.5 C=CCC(C)C(N)=O Amb27788519 [0,1,0,0,0,0|1,0,2]=4 2648 B7R0.5 C=CCC(Cl)C(=O)Cl Amb27463323 [0,1,0,0,0,0|1,0,2]=4 2649 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [0,1,0,0,0,0|0,0,2]=3 2650 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [0,1,0,0,0,0|0,0,2]=3 2651 B7R0.5 C=CCC(F)C(C)=O Amb19889753 [0,1,0,0,0,0|1,0,2]=4 2652 B7R0.5 C=CCC(N)C(=O)Cl Amb27413912 [0,1,0,0,0,0|1,0,2]=4 2653 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [0,1,0,0,0,0|0,0,2]=3 2654 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [0,1,0,0,0,0|0,0,2]=3 2655 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [0,1,0,0,0,0|1,0,2]=4 2656 B7R0.5 C=CCC(N)C(N)=O Amb26585896 [0,1,0,0,0,0|1,0,2]=4 2657 B7R0.5 C=CCC(O)C(C)=O Amb26451431 [0,1,0,0,0,0|1,0,2]=4 2658 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [0,1,0,0,0,0|0,0,2]=3 2659 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [0,1,0,0,0,0|0,0,2]=3 2660 B7R0.5 C=CC[C@@H](N)C(N)=O Amb27838370 [0,1,0,0,0,0|1,0,2]=4 2661 B7R0.5 C=CC[C@H](C)C(C)=O Amb26641913 [0,1,0,0,0,0|1,0,2]=4 2662 B7R0.5 C=CC[C@H](N)C(=O)Cl Amb28120452 [0,1,0,0,0,0|1,0,2]=4 2663 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [0,1,0,0,0,0|0,0,2]=3 2664 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [0,1,0,0,0,0|0,0,2]=3 2665 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [0,1,0,0,0,0|0,0,2]=3 2666 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [0,1,0,0,0,0|0,0,2]=3 2667 B7R0.5 CC#CC(O)C(C)=O Amb25950589 [0,1,0,0,0,0|1,0,2]=4 2668 B7R0.5 CC(=O)C(=O)CCCl Amb28077243 [0,1,0,0,0,0|2,0,1]=4 2669 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [0,1,0,0,0,0|2,0,1]=4 2670 B7R0.5 CC(=O)C(Br)CCBr Amb26442822 [0,1,0,0,0,0|2,0,0]=3 2671 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [0,1,0,0,0,0|2,0,0]=3 2672 B7R0.5 CC(=O)C(C)CC#N Amb27403110 [0,1,0,0,0,0|2,0,1]=4 2673 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [0,1,0,0,0,0|2,0,0]=3 2674 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [0,1,0,0,0,0|2,0,0]=3 2675 B7R0.5 CC(=O)C(C)CCO Amb13881368 [0,1,0,0,0,0|2,0,0]=3 2676 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [0,1,0,0,0,0|2,0,1]=4 2677 B7R0.5 CC(=O)C(Cl)CCBr Amb27259779 [0,1,0,0,0,0|2,0,0]=3 2678 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [0,1,0,0,0,0|2,0,0]=3 2679 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [0,1,0,0,0,0|2,0,0]=3 2680 B7R0.5 CC(=O)C(F)CCBr Amb28429129 [0,1,0,0,0,0|2,0,0]=3 2681 B7R0.5 CC(=O)C(F)CCCl Amb27390864 [0,1,0,0,0,0|2,0,0]=3 2682 B7R0.5 CC(=O)C(N)CCO Amb25087112 [0,1,0,0,0,0|2,0,0]=3 2683 B7R0.5 CC(=O)C(S)CCO Amb25831127 [0,1,0,0,0,0|2,0,0]=3 2684 B7R0.5 CC(=O)N(C)CCBr Amb27592204 [0,1,0,0,0,0|3,0,0]=4 2685 B7R0.5 CC(=O)N(C)CCCl Amb27480683 [0,1,0,0,0,0|3,0,0]=4 2686 B7R0.5 CC(=O)N(C)CCN Amb17046786 [0,1,0,0,0,0|3,0,0]=4 2687 B7R0.5 CC(=O)N(C)CCN Amb34137491 [0,1,0,0,0,0|3,0,0]=4 2688 B7R0.5 CC(=O)N(C)CCO Amb5797447 [0,1,0,0,0,0|3,0,0]=4 2689 B7R0.5 CC(=O)[C@@H](C)CC#N Amb26887655 [0,1,0,0,0,0|2,0,1]=4 2690 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [0,1,0,0,0,0|2,0,0]=3 2691 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [0,1,0,0,0,0|2,0,1]=4 2692 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [0,1,0,0,0,0|1,0,1]=3 2693 B7R0.5 CC(CC#N)C(N)=O Amb8944748 [0,1,0,0,0,0|2,0,1]=4 2694 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [0,1,0,0,0,0|1,0,1]=3 2695 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [0,1,0,0,0,0|2,0,0]=3 2696 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [0,1,0,0,0,0|1,0,0]=2 2697 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [0,1,0,0,0,0|2,0,0]=3 2698 B7R0.5 CC(CCF)C(=O)O Amb24678386 [0,1,0,0,0,0|1,0,0]=2 2699 B7R0.5 CC(CCN)B(O)O Amb27592499 [0,1,0,0,0,0|2,0,1]=4 2700 B7R0.5 CC(CCN)C(=O)O Amb20667970 [0,1,0,0,0,0|1,0,0]=2 2701 B7R0.5 CC(CCN)C(=O)O Amb538221 [0,1,0,0,0,0|1,0,0]=2 2702 B7R0.5 CC(CCN)S(C)=O Amb20668090 [0,1,0,0,0,0|3,0,0]=4 2703 B7R0.5 CC(CCO)C(=O)O Amb18641949 [0,1,0,0,0,0|1,0,0]=2 2704 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [0,1,0,0,0,0|1,0,1]=3 2705 B7R0.5 CC(CCO)C(N)=O Amb28280962 [0,1,0,0,0,0|2,0,0]=3 2706 B7R0.5 CC(CCO)S(=O)[O-] Amb28315550 [0,1,0,0,0,0|2,0,1]=4 2707 B7R0.5 CC(CNO)C(=O)O Amb28315956 [0,1,0,0,0,0|2,0,0]=3 2708 B7R0.5 CC(CSS)C(=O)O Amb27437183 [0,1,0,0,0,0|2,0,0]=3 2709 B7R0.5 CC(N=C=O)C(=O)O Amb33471295 [0,1,0,0,0,0|2,0,1]=4 2710 B7R0.5 CC(N=C=S)C(=O)O Amb25945785 [0,1,0,0,0,0|2,0,1]=4 2711 B7R0.5 CC(N=[N+]=[N-])C(=O)O Amb27202649 [0,1,0,0,0,0|3,0,0]=4 2712 B7R0.5 CC(NC=O)C(=O)O Amb1144629 [0,1,0,0,0,0|2,0,1]=4 2713 B7R0.5 CC(NCO)C(=O)O Amb27468253 [0,1,0,0,0,0|2,0,0]=3 2714 B7R0.5 CC(O)C(C)CCBr Amb27878805 [0,1,0,0,0,0|2,0,1]=4 2715 B7R0.5 CC(O)C(C)CCF Amb28120971 [0,1,0,0,0,0|2,0,1]=4 2716 B7R0.5 CC(O)C(C)CCN Amb18202662 [0,1,0,0,0,0|2,0,1]=4 2717 B7R0.5 CC(O)C(Cl)CCCl Amb28195866 [0,1,0,0,0,0|2,0,1]=4 2718 B7R0.5 CC(OC=O)C(=O)O Amb27872094 [0,1,0,0,0,0|2,0,1]=4 2719 B7R0.5 CC(\N=N\O)C(=O)O Amb28251041 [0,1,0,0,0,0|3,0,0]=4 2720 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [0,1,0,0,0,0|0,0,1]=2 2721 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [0,1,0,0,0,0|1,0,1]=3 2722 B7R0.5 CCCC(=O)C(C)O Amb24481443 [0,1,0,0,0,0|1,0,2]=4 2723 B7R0.5 CCCC(=O)N(C)O Amb27229047 [0,1,0,0,0,0|2,0,1]=4 2724 B7R0.5 CCCC(=O)[C@H](C)O Amb24546365 [0,1,0,0,0,0|1,0,2]=4 2725 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [0,1,0,0,0,0|1,0,0]=2 2726 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [0,1,0,0,0,0|0,0,0]=1 2727 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [0,1,0,0,0,0|1,0,0]=2 2728 B7R0.5 CCCC(Br)C(C)Br Amb22732685 [0,1,0,0,0,0|2,0,1]=4 2729 B7R0.5 CCCC(Br)C(C)N Amb27614467 [0,1,0,0,0,0|2,0,1]=4 2730 B7R0.5 CCCC(Br)S(C)=O Amb27471989 [0,1,0,0,0,0|2,0,0]=3 2731 B7R0.5 CCCC(C)=C(C)C Amb4019545 [0,1,0,0,0,0|2,0,1]=4 2732 B7R0.5 CCCC(C)C(=N)N Amb27810844 [0,1,0,0,0,0|2,0,0]=3 2733 B7R0.5 CCCC(C)C(=N)N Amb33212650 [0,1,0,0,0,0|2,0,0]=3 2734 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [0,1,0,0,0,0|1,0,0]=2 2735 B7R0.5 CCCC(C)C(=O)O Amb3938958 [0,1,0,0,0,0|0,0,0]=1 2736 B7R0.5 CCCC(C)C(C)=O Amb4034597 [0,1,0,0,0,0|1,0,0]=2 2737 B7R0.5 CCCC(C)C(C)C Amb4019539 [0,1,0,0,0,0|2,0,1]=4 2738 B7R0.5 CCCC(C)C(C)N Amb18289572 [0,1,0,0,0,0|2,0,1]=4 2739 B7R0.5 CCCC(C)C(C)N Amb29083224 [0,1,0,0,0,0|2,0,1]=4 2740 B7R0.5 CCCC(C)C(C)O Amb4036337 [0,1,0,0,0,0|1,0,1]=3 2741 B7R0.5 CCCC(C)C(N)=O Amb3886535 [0,1,0,0,0,0|1,0,0]=2 2742 B7R0.5 CCCC(C)C(N)=S Amb25138492 [0,1,0,0,0,0|1,1,0]=3 2743 B7R0.5 CCCC(C)S(=O)Cl Amb32720536 [0,1,0,0,0,0|2,0,0]=3 2744 B7R0.5 CCCC(C)S(=O)[O-] Amb32754802 [0,1,0,0,0,0|1,0,1]=3 2745 B7R0.5 CCCC(C)S(N)=O Amb32720511 [0,1,0,0,0,0|2,0,0]=3 2746 B7R0.5 CCCC(C)[C@@H](C)N Amb33322349 [0,1,0,0,0,0|2,0,1]=4 2747 B7R0.5 CCCC(C)[C@@H](C)O Amb33322347 [0,1,0,0,0,0|1,0,1]=3 2748 B7R0.5 CCCC(C)[C@H](C)N Amb33322348 [0,1,0,0,0,0|2,0,1]=4 2749 B7R0.5 CCCC(C)[C@H](C)O Amb33322346 [0,1,0,0,0,0|1,0,1]=3 2750 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [0,1,0,0,0,0|0,0,0]=1 2751 B7R0.5 CCCC(Cl)C(C)Cl Amb25889191 [0,1,0,0,0,0|2,0,1]=4 2752 B7R0.5 CCCC(F)=C(F)F Amb10838535 [0,1,0,0,0,0|2,0,1]=4 2753 B7R0.5 CCCC(F)C(=O)O Amb25842008 [0,1,0,0,0,0|0,0,0]=1 2754 B7R0.5 CCCC(F)C(C)=O Amb28316211 [0,1,0,0,0,0|1,0,0]=2 2755 B7R0.5 CCCC(F)C(N)=O Amb28127390 [0,1,0,0,0,0|1,0,0]=2 2756 B7R0.5 CCCC(N)C(=N)N Amb27222841 [0,1,0,0,0,0|2,0,0]=3 2757 B7R0.5 CCCC(N)C(=O)O Amb6262055 [0,1,0,0,0,0|0,0,0]=1 2758 B7R0.5 CCCC(N)C(C)=O Amb27838289 [0,1,0,0,0,0|1,0,0]=2 2759 B7R0.5 CCCC(N)C(C)C Amb9031899 [0,1,0,0,0,0|2,0,1]=4 2760 B7R0.5 CCCC(N)C(F)F Amb25355340 [0,1,0,0,0,0|2,0,1]=4 2761 B7R0.5 CCCC(N)C(N)=O Amb22284825 [0,1,0,0,0,0|1,0,0]=2 2762 B7R0.5 CCCC(N)C(N)=O Amb9514970 [0,1,0,0,0,0|1,0,0]=2 2763 B7R0.5 CCCC(N)C(N)=S Amb28121515 [0,1,0,0,0,0|1,1,0]=3 2764 B7R0.5 CCCC(O)C(=N)N Amb27881736 [0,1,0,0,0,0|2,0,0]=3 2765 B7R0.5 CCCC(O)C(=O)O Amb2818222 [0,1,0,0,0,0|0,0,0]=1 2766 B7R0.5 CCCC(O)C(C)=O Amb22495823 [0,1,0,0,0,0|1,0,0]=2 2767 B7R0.5 CCCC(O)C(C)Br Amb27781536 [0,1,0,0,0,0|2,0,1]=4 2768 B7R0.5 CCCC(O)C(C)C Amb8513256 [0,1,0,0,0,0|2,0,1]=4 2769 B7R0.5 CCCC(O)C(Cl)Cl Amb27811832 [0,1,0,0,0,0|2,0,1]=4 2770 B7R0.5 CCCC(O)C(F)F Amb25266847 [0,1,0,0,0,0|2,0,1]=4 2771 B7R0.5 CCCC(O)C(N)=O Amb24116553 [0,1,0,0,0,0|1,0,0]=2 2772 B7R0.5 CCCC(O)N(C)C Amb28400462 [0,1,0,0,0,0|3,0,0]=4 2773 B7R0.5 CCCC(O)[C@@H](C)N Amb35618098 [0,1,0,0,0,0|2,0,1]=4 2774 B7R0.5 CCCC(O)[C@H](C)N Amb35737168 [0,1,0,0,0,0|2,0,1]=4 2775 B7R0.5 CCCC(S)C(=O)O Amb18124440 [0,1,0,0,0,0|0,0,0]=1 2776 B7R0.5 CCCN(C)C(=N)N Amb8899100 [0,1,0,0,0,0|3,0,0]=4 2777 B7R0.5 CCCN(C)C(=O)Cl Amb26478280 [0,1,0,0,0,0|2,0,0]=3 2778 B7R0.5 CCCN(C)C(=S)Cl Amb27428964 [0,1,0,0,0,0|2,1,0]=4 2779 B7R0.5 CCCN(C)C(N)=O Amb8898960 [0,1,0,0,0,0|2,0,0]=3 2780 B7R0.5 CCCN(N)C(C)=O Amb18641903 [0,1,0,0,0,0|2,0,0]=3 2781 B7R0.5 CCCN(O)C(=N)N Amb27838407 [0,1,0,0,0,0|3,0,0]=4 2782 B7R0.5 CCCN(O)C(N)=O Amb28347092 [0,1,0,0,0,0|2,0,0]=3 2783 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [0,1,0,0,0,0|0,0,0]=1 2784 B7R0.5 CCC[C@@H](C)C(C)O Amb28187641 [0,1,0,0,0,0|1,0,1]=3 2785 B7R0.5 CCC[C@@H](C)[C@@H](C)O Amb27181050 [0,1,0,0,0,0|1,0,1]=3 2786 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [0,1,0,0,0,0|0,0,0]=1 2787 B7R0.5 CCC[C@@H](Cl)[C@H](C)O Amb27668868 [0,1,0,0,0,0|1,0,1]=3 2788 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [0,1,0,0,0,0|0,0,0]=1 2789 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [0,1,0,0,0,0|1,0,0]=2 2790 B7R0.5 CCC[C@@H](N)C(C)O Amb29849610 [0,1,0,0,0,0|1,0,1]=3 2791 B7R0.5 CCC[C@@H](N)C(F)F Amb27806404 [0,1,0,0,0,0|2,0,1]=4 2792 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [0,1,0,0,0,0|1,0,0]=2 2793 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [0,1,0,0,0,0|1,0,0]=2 2794 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [0,1,0,0,0,0|0,0,0]=1 2795 B7R0.5 CCC[C@@H](O)[C@@H](C)N Amb28198280 [0,1,0,0,0,0|2,0,1]=4 2796 B7R0.5 CCC[C@@H](O)[C@@H](C)O Amb27457775 [0,1,0,0,0,0|1,0,1]=3 2797 B7R0.5 CCC[C@@H](O)[C@H](C)N Amb27392138 [0,1,0,0,0,0|2,0,1]=4 2798 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [0,1,0,0,0,0|0,0,0]=1 2799 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [0,1,0,0,0,0|0,0,0]=1 2800 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [0,1,0,0,0,0|1,0,0]=2 2801 B7R0.5 CCC[C@H](C)[C@@H](C)N Amb27839498 [0,1,0,0,0,0|2,0,1]=4 2802 B7R0.5 CCC[C@H](C)[C@H](C)O Amb28065150 [0,1,0,0,0,0|1,0,1]=3 2803 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [0,1,0,0,0,0|0,0,0]=1 2804 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [0,1,0,0,0,0|0,0,0]=1 2805 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [0,1,0,0,0,0|0,0,0]=1 2806 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [0,1,0,0,0,0|1,0,0]=2 2807 B7R0.5 CCC[C@H](N)C(C)C Amb27229389 [0,1,0,0,0,0|2,0,1]=4 2808 B7R0.5 CCC[C@H](N)C(C)O Amb35664016 [0,1,0,0,0,0|1,0,1]=3 2809 B7R0.5 CCC[C@H](N)C(F)F Amb28049026 [0,1,0,0,0,0|2,0,1]=4 2810 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [0,1,0,0,0,0|1,0,0]=2 2811 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [0,1,0,0,0,0|1,0,0]=2 2812 B7R0.5 CCC[C@H](N)[C@H](C)O Amb27883481 [0,1,0,0,0,0|1,0,1]=3 2813 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [0,1,0,0,0,0|0,0,0]=1 2814 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [0,1,0,0,0,0|1,0,0]=2 2815 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [0,1,0,0,0,0|0,0,0]=1 2816 B7R0.5 CCC\[N+](N)=C(/C)N Amb27207661 [0,1,0,0,0,0|3,0,0]=4 2817 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [0,1,0,0,0,0|1,0,1]=3 2818 B7R0.5 CCNC(=O)C(C)=O Amb17399798 [0,1,0,0,0,0|2,0,1]=4 2819 B7R0.5 CCNC(=O)C(N)=O Amb27969146 [0,1,0,0,0,0|2,0,1]=4 2820 B7R0.5 CCNC(C)C(=O)O Amb33527634 [0,1,0,0,0,0|1,0,0]=2 2821 B7R0.5 CCNC(C)C(=O)O Amb9326962 [0,1,0,0,0,0|1,0,0]=2 2822 B7R0.5 CCNC(C)C(N)=O Amb21959648 [0,1,0,0,0,0|2,0,0]=3 2823 B7R0.5 CCNC(C)C(N)=O Amb7758139 [0,1,0,0,0,0|2,0,0]=3 2824 B7R0.5 CCNC(O)C(=O)O Amb27259098 [0,1,0,0,0,0|1,0,0]=2 2825 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [0,1,0,0,0,0|1,0,0]=2 2826 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [0,1,0,0,0,0|1,0,0]=2 2827 B7R0.5 CCOC(=O)C(=O)Cl Amb932808 [0,1,0,0,0,0|2,0,1]=4 2828 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [0,1,0,0,0,0|1,0,1]=3 2829 B7R0.5 CCOC(=O)C(=O)[O-] Amb16192061 [0,1,0,0,0,0|1,0,2]=4 2830 B7R0.5 CCOC(=O)C(C)=O Amb2793051 [0,1,0,0,0,0|2,0,1]=4 2831 B7R0.5 CCOC(=O)C(N)=O Amb3886540 [0,1,0,0,0,0|2,0,1]=4 2832 B7R0.5 CCOC(=S)C(N)=O Amb10604171 [0,1,0,0,0,0|2,0,1]=4 2833 B7R0.5 CCOC(C)C(=N)N Amb19375380 [0,1,0,0,0,0|3,0,0]=4 2834 B7R0.5 CCOC(C)C(=N)N Amb22059005 [0,1,0,0,0,0|3,0,0]=4 2835 B7R0.5 CCOC(C)C(=O)O Amb9725271 [0,1,0,0,0,0|1,0,0]=2 2836 B7R0.5 CCOC(C)C(C)=O Amb9666103 [0,1,0,0,0,0|2,0,0]=3 2837 B7R0.5 CCOC(C)C(N)=O Amb19960053 [0,1,0,0,0,0|2,0,0]=3 2838 B7R0.5 CCOC(C)C(N)=S Amb19148903 [0,1,0,0,0,0|2,1,0]=4 2839 B7R0.5 CCOC(C)[C@@H](C)O Amb25910898 [0,1,0,0,0,0|2,0,1]=4 2840 B7R0.5 CCOC(C)[C@H](C)O Amb27828215 [0,1,0,0,0,0|2,0,1]=4 2841 B7R0.5 CCOC(Cl)C(=O)Cl Amb27659279 [0,1,0,0,0,0|2,0,0]=3 2842 B7R0.5 CCOC(Cl)C(N)=O Amb27468650 [0,1,0,0,0,0|2,0,0]=3 2843 B7R0.5 CCOC(F)C(=O)O Amb27210743 [0,1,0,0,0,0|1,0,0]=2 2844 B7R0.5 CCON(C)C(N)=O Amb27829816 [0,1,0,0,0,0|3,0,0]=4 2845 B7R0.5 CCO[C@@H](C)[C@@H](C)O Amb27484522 [0,1,0,0,0,0|2,0,1]=4 2846 B7R0.5 CCO[C@H](C)[C@@H](C)O Amb27456387 [0,1,0,0,0,0|2,0,1]=4 2847 B7R0.5 CCSC(=O)C(=O)O Amb28410577 [0,1,0,0,0,0|1,0,1]=3 2848 B7R0.5 CCSC(=O)C(C)=O Amb27972957 [0,1,0,0,0,0|2,0,1]=4 2849 B7R0.5 CCSC(C)C(=N)N Amb28854108 [0,1,0,0,0,0|3,0,0]=4 2850 B7R0.5 CCSC(C)C(=O)O Amb9721554 [0,1,0,0,0,0|1,0,0]=2 2851 B7R0.5 CCSC(C)C(N)=O Amb27830179 [0,1,0,0,0,0|2,0,0]=3 2852 B7R0.5 CCSC(C)C(N)=S Amb24468518 [0,1,0,0,0,0|2,1,0]=4 2853 B7R0.5 CCSC(Cl)C(C)=O Amb27862346 [0,1,0,0,0,0|2,0,0]=3 2854 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [0,1,0,0,0,0|0,0,2]=3 2855 B7R0.5 CC\C=C(/C)C(N)=O Amb27985331 [0,1,0,0,0,0|1,0,2]=4 2856 B7R0.5 CC\C=C(/Cl)C(C)=O Amb27199134 [0,1,0,0,0,0|1,0,2]=4 2857 B7R0.5 CC\C=C(/F)C(=O)O Amb27968785 [0,1,0,0,0,0|0,0,2]=3 2858 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [0,1,0,0,0,0|0,0,2]=3 2859 B7R0.5 CC\C=C(\Cl)C(C)=O Amb27486079 [0,1,0,0,0,0|1,0,2]=4 2860 B7R0.5 CN(CCBr)C(=O)Cl Amb33296909 [0,1,0,0,0,0|3,0,0]=4 2861 B7R0.5 CN(CCCl)C(=O)Cl Amb25285023 [0,1,0,0,0,0|3,0,0]=4 2862 B7R0.5 CN(CCN)C(N)=O Amb18953297 [0,1,0,0,0,0|3,0,0]=4 2863 B7R0.5 CNCC(C)C(=N)N Amb28073850 [0,1,0,0,0,0|3,0,0]=4 2864 B7R0.5 CNCC(C)C(=O)O Amb13952364 [0,1,0,0,0,0|1,0,0]=2 2865 B7R0.5 CNCC(C)C(=O)O Amb9400281 [0,1,0,0,0,0|1,0,0]=2 2866 B7R0.5 CNCC(C)C(N)=O Amb8943991 [0,1,0,0,0,0|2,0,0]=3 2867 B7R0.5 CNCC(C)N(C)O Amb28364294 [0,1,0,0,0,0|3,0,0]=4 2868 B7R0.5 CNCC(N)C(=O)O Amb10845350 [0,1,0,0,0,0|1,0,0]=2 2869 B7R0.5 CNCC(O)C(=O)O Amb26894610 [0,1,0,0,0,0|1,0,0]=2 2870 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [0,1,0,0,0,0|1,0,0]=2 2871 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [0,1,0,0,0,0|1,0,0]=2 2872 B7R0.5 CN\N=C(/C)C(=O)O Amb27489531 [0,1,0,0,0,0|2,0,1]=4 2873 B7R0.5 COCC(=O)C(C)=O Amb24694271 [0,1,0,0,0,0|2,0,1]=4 2874 B7R0.5 COCC(Br)C(=O)Cl Amb27797270 [0,1,0,0,0,0|2,0,0]=3 2875 B7R0.5 COCC(Br)C(=O)O Amb17594709 [0,1,0,0,0,0|1,0,0]=2 2876 B7R0.5 COCC(C)C(=O)O Amb33545090 [0,1,0,0,0,0|1,0,0]=2 2877 B7R0.5 COCC(C)C(C)=O Amb24683449 [0,1,0,0,0,0|2,0,0]=3 2878 B7R0.5 COCC(C)C(C)O Amb24746662 [0,1,0,0,0,0|2,0,1]=4 2879 B7R0.5 COCC(C)C(N)=O Amb27401584 [0,1,0,0,0,0|2,0,0]=3 2880 B7R0.5 COCC(C)C(N)=S Amb9029622 [0,1,0,0,0,0|2,1,0]=4 2881 B7R0.5 COCC(C)S(=O)Cl Amb26920252 [0,1,0,0,0,0|3,0,0]=4 2882 B7R0.5 COCC(C)S(=O)[O-] Amb24481940 [0,1,0,0,0,0|2,0,1]=4 2883 B7R0.5 COCC(C)S(N)=O Amb32720388 [0,1,0,0,0,0|3,0,0]=4 2884 B7R0.5 COCC(Cl)C(=N)N Amb22493750 [0,1,0,0,0,0|3,0,0]=4 2885 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [0,1,0,0,0,0|1,0,0]=2 2886 B7R0.5 COCC(N)C(=O)O Amb33551350 [0,1,0,0,0,0|1,0,0]=2 2887 B7R0.5 COCC(N)C(=O)O Amb6752055 [0,1,0,0,0,0|1,0,0]=2 2888 B7R0.5 COCC(N)C(C)=O Amb27468401 [0,1,0,0,0,0|2,0,0]=3 2889 B7R0.5 COCC(N)C(C)O Amb18124266 [0,1,0,0,0,0|2,0,1]=4 2890 B7R0.5 COCC(N)C(N)=O Amb18984372 [0,1,0,0,0,0|2,0,0]=3 2891 B7R0.5 COCC(N)C(N)=O Amb32693410 [0,1,0,0,0,0|2,0,0]=3 2892 B7R0.5 COCC(O)C(=N)N Amb27444847 [0,1,0,0,0,0|3,0,0]=4 2893 B7R0.5 COCC(O)C(=O)O Amb18124273 [0,1,0,0,0,0|1,0,0]=2 2894 B7R0.5 COCC(O)C(N)=O Amb28069186 [0,1,0,0,0,0|2,0,0]=3 2895 B7R0.5 COCC(S)C(=O)O Amb27763656 [0,1,0,0,0,0|1,0,0]=2 2896 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [0,1,0,0,0,0|1,0,0]=2 2897 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [0,1,0,0,0,0|1,0,0]=2 2898 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [0,1,0,0,0,0|1,0,0]=2 2899 B7R0.5 COC[C@@H](N)[C@H](C)O Amb27843279 [0,1,0,0,0,0|2,0,1]=4 2900 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [0,1,0,0,0,0|1,0,0]=2 2901 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [0,1,0,0,0,0|1,0,0]=2 2902 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [0,1,0,0,0,0|1,0,0]=2 2903 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [0,1,0,0,0,0|1,0,0]=2 2904 B7R0.5 CONC(C)C(N)=O Amb27657313 [0,1,0,0,0,0|3,0,0]=4 2905 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [0,1,0,0,0,0|2,0,0]=3 2906 B7R0.5 CO\C=C(/C)C(=O)O Amb18641867 [0,1,0,0,0,0|1,0,2]=4 2907 B7R0.5 CO\C=C(/F)C(=O)O Amb28369284 [0,1,0,0,0,0|1,0,2]=4 2908 B7R0.5 CO\C=C(\F)C(=O)O Amb22641708 [0,1,0,0,0,0|1,0,2]=4 2909 B7R0.5 CO\C=C(\I)C(=O)O Amb27228187 [0,1,0,0,0,0|1,0,2]=4 2910 B7R0.5 CO\C=C(\N)C(=O)O Amb27390812 [0,1,0,0,0,0|1,0,2]=4 2911 B7R0.5 CO\N=C(/C)C(=O)O Amb28203933 [0,1,0,0,0,0|2,0,1]=4 2912 B7R0.5 CSCC(C)C(=O)O Amb18967825 [0,1,0,0,0,0|1,0,0]=2 2913 B7R0.5 CSCC(Cl)C(=O)Cl Amb27801927 [0,1,0,0,0,0|2,0,0]=3 2914 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [0,1,0,0,0,0|1,0,0]=2 2915 B7R0.5 CSCC(N)C(=O)O Amb33804791 [0,1,0,0,0,0|1,0,0]=2 2916 B7R0.5 CSCC(N)C(=O)O Amb6280829 [0,1,0,0,0,0|1,0,0]=2 2917 B7R0.5 CSCC(O)C(=O)O Amb25131873 [0,1,0,0,0,0|1,0,0]=2 2918 B7R0.5 CSCC(O)C(C)=O Amb25983211 [0,1,0,0,0,0|2,0,0]=3 2919 B7R0.5 CSCC(O)C(N)=O Amb27168145 [0,1,0,0,0,0|2,0,0]=3 2920 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [0,1,0,0,0,0|1,0,0]=2 2921 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [0,1,0,0,0,0|1,0,0]=2 2922 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [0,1,0,0,0,0|1,0,0]=2 2923 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [0,1,0,0,0,0|2,0,0]=3 2924 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [0,1,0,0,0,0|1,0,0]=2 2925 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [0,1,0,0,0,0|1,0,0]=2 2926 B7R0.5 C[C@@H](N=C=O)C(=O)O Amb33189209 [0,1,0,0,0,0|2,0,1]=4 2927 B7R0.5 C[C@@H](N=C=S)C(=O)O Amb33471579 [0,1,0,0,0,0|2,0,1]=4 2928 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O Amb28325865 [0,1,0,0,0,0|3,0,0]=4 2929 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O Amb32620194 [0,1,0,0,0,0|3,0,0]=4 2930 B7R0.5 C[C@@H](NC#N)C(=O)O Amb35634494 [0,1,0,0,0,0|2,0,1]=4 2931 B7R0.5 C[C@@H](O)[C@H](Cl)CCCl Amb27173783 [0,1,0,0,0,0|2,0,1]=4 2932 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [0,1,0,0,0,0|1,0,0]=2 2933 B7R0.5 C[C@H](N=C=O)C(=O)O Amb33471333 [0,1,0,0,0,0|2,0,1]=4 2934 B7R0.5 C[C@H](N=C=S)C(=O)O Amb33471562 [0,1,0,0,0,0|2,0,1]=4 2935 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O Amb32620189 [0,1,0,0,0,0|3,0,0]=4 2936 B7R0.5 C[C@H](NC#N)C(=O)O Amb30031667 [0,1,0,0,0,0|2,0,1]=4 2937 B7R0.5 C[C@H](NC=O)C(=O)O Amb28323701 [0,1,0,0,0,0|2,0,1]=4 2938 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [0,1,0,0,0,0|2,0,0]=3 2939 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [0,1,0,0,0,0|1,0,0]=2 2940 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [0,1,0,0,0,0|1,0,0]=2 2941 B7R0.5 C\C(=C/CCl)C(=O)O Amb25844891 [0,1,0,0,0,0|1,0,2]=4 2942 B7R0.5 C\C(=C/CN)C(=O)O Amb25845292 [0,1,0,0,0,0|1,0,2]=4 2943 B7R0.5 C\C(=C/CS)C(=O)O Amb28041309 [0,1,0,0,0,0|1,0,2]=4 2944 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [0,1,0,0,0,0|0,0,2]=3 2945 B7R0.5 C\C=C\C(C)C(C)=O Amb26585088 [0,1,0,0,0,0|1,0,2]=4 2946 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [0,1,0,0,0,0|0,0,2]=3 2947 B7R0.5 C\C=C\C(O)C(C)=O Amb25912951 [0,1,0,0,0,0|1,0,2]=4 2948 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [0,1,0,0,0,0|0,0,2]=3 2949 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [0,1,0,0,0,0|0,0,2]=3 2950 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [0,1,0,0,0,0|0,0,2]=3 2951 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [0,1,0,0,0,0|1,0,1]=3 2952 B7R0.5 N#CCC(N)C(N)=O Amb33308724 [0,1,0,0,0,0|2,0,1]=4 2953 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [0,1,0,0,0,0|1,0,1]=3 2954 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [0,1,0,0,0,0|1,0,1]=3 2955 B7R0.5 NC(=O)C(Br)CCCl Amb27954931 [0,1,0,0,0,0|2,0,0]=3 2956 B7R0.5 NC(=O)C(N)CCF Amb24391278 [0,1,0,0,0,0|2,0,0]=3 2957 B7R0.5 NC(=O)C(N)CCO Amb24481392 [0,1,0,0,0,0|2,0,0]=3 2958 B7R0.5 NC(=O)C(N)CNO Amb27396201 [0,1,0,0,0,0|3,0,0]=4 2959 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [0,1,0,0,0,0|1,0,0]=2 2960 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [0,1,0,0,0,0|1,0,0]=2 2961 B7R0.5 NC(CCF)C(=O)O Amb25889337 [0,1,0,0,0,0|1,0,0]=2 2962 B7R0.5 NC(CCF)C(=O)O Amb28934889 [0,1,0,0,0,0|1,0,0]=2 2963 B7R0.5 NC(CCO)C(=O)O Amb8514287 [0,1,0,0,0,0|1,0,0]=2 2964 B7R0.5 NC(CCS)C(=O)O Amb19267093 [0,1,0,0,0,0|1,0,0]=2 2965 B7R0.5 NC(CCS)C(=O)O Amb3499433 [0,1,0,0,0,0|1,0,0]=2 2966 B7R0.5 NC(CCS)[PH](=O)O Amb27409002 [0,1,0,0,0,0|2,0,0]=3 2967 B7R0.5 NC(CNO)C(=O)O Amb4092732 [0,1,0,0,0,0|2,0,0]=3 2968 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [0,1,0,0,0,0|1,1,0]=3 2969 B7R0.5 NC(\C=C\F)C(=O)O Amb27666430 [0,1,0,0,0,0|1,0,2]=4 2970 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [0,1,0,0,0,0|1,0,0]=2 2971 B7R0.5 NCCC(F)C(=O)O Amb10838221 [0,1,0,0,0,0|1,0,0]=2 2972 B7R0.5 NCCC(F)C(=O)O Amb22229524 [0,1,0,0,0,0|1,0,0]=2 2973 B7R0.5 NCCC(F)[PH](=O)O Amb27639139 [0,1,0,0,0,0|2,0,0]=3 2974 B7R0.5 NCCC(N)C(=O)O Amb2697841 [0,1,0,0,0,0|1,0,0]=2 2975 B7R0.5 NCCC(N)C(=O)O Amb8514694 [0,1,0,0,0,0|1,0,0]=2 2976 B7R0.5 NCCC(O)C(=O)O Amb16232090 [0,1,0,0,0,0|1,0,0]=2 2977 B7R0.5 NCCC(O)C(N)=O Amb28121985 [0,1,0,0,0,0|2,0,0]=3 2978 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [0,1,0,0,0,0|1,0,0]=2 2979 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [0,1,0,0,0,0|1,0,0]=2 2980 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [0,1,0,0,0,0|1,0,0]=2 2981 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [0,1,0,0,0,0|1,0,0]=2 2982 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [0,1,0,0,0,0|2,0,0]=3 2983 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [0,1,0,0,0,0|1,0,0]=2 2984 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [0,1,0,0,0,0|1,0,0]=2 2985 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [0,1,0,0,0,0|1,0,0]=2 2986 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [0,1,0,0,0,0|1,0,0]=2 2987 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [0,1,0,0,0,0|1,0,0]=2 2988 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [0,1,0,0,0,0|1,0,0]=2 2989 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [0,1,0,0,0,0|1,0,0]=2 2990 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [0,1,0,0,0,0|2,0,0]=3 2991 B7R0.5 NC\C=C(/F)C(=O)O Amb33802627 [0,1,0,0,0,0|1,0,2]=4 2992 B7R0.5 NC\C=C(\F)C(=O)O Amb28340962 [0,1,0,0,0,0|1,0,2]=4 2993 B7R0.5 NNCC(O)C(=O)[O-] Amb27956514 [0,1,0,0,0,0|2,0,1]=4 2994 B7R0.5 NOCC(N)C(=O)O Amb24184086 [0,1,0,0,0,0|2,0,0]=3 2995 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [0,1,0,0,0,0|1,0,0]=2 2996 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [0,1,0,0,0,0|1,0,0]=2 2997 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [0,1,0,0,0,0|1,0,0]=2 2998 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [0,1,0,0,0,0|1,0,0]=2 2999 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [0,1,0,0,0,0|1,0,0]=2 3000 B7R0.5 N[C@@H](OCS)C(=O)O Amb27591629 [0,1,0,0,0,0|2,0,0]=3 3001 B7R0.5 N[C@@H](\C=C/F)C(=O)O Amb27447269 [0,1,0,0,0,0|1,0,2]=4 3002 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [0,1,0,0,0,0|1,0,1]=3 3003 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [0,1,0,0,0,0|1,0,0]=2 3004 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [0,1,0,0,0,0|1,0,0]=2 3005 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [0,1,0,0,0,0|1,0,0]=2 3006 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [0,1,0,0,0,0|2,0,0]=3 3007 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [0,1,0,0,0,0|2,0,0]=3 3008 B7R0.5 O=C(Cl)C(Br)CCCl Amb26515711 [0,1,0,0,0,0|2,0,0]=3 3009 B7R0.5 O=C(Cl)C(Cl)CSCl Amb28138021 [0,1,0,0,0,0|3,0,0]=4 3010 B7R0.5 O=C(O)C(=O)CCF Amb33377241 [0,1,0,0,0,0|1,0,1]=3 3011 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [0,1,0,0,0,0|1,0,1]=3 3012 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [0,1,0,0,0,0|1,0,0]=2 3013 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [0,1,0,0,0,0|1,0,0]=2 3014 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [0,1,0,0,0,0|1,0,0]=2 3015 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [0,1,0,0,0,0|1,0,0]=2 3016 B7R0.5 O=C(O)C(O)CCF Amb28071189 [0,1,0,0,0,0|1,0,0]=2 3017 B7R0.5 O=C(O)C(O)CCO Amb24689942 [0,1,0,0,0,0|1,0,0]=2 3018 B7R0.5 O=C(O)C(O)CNO Amb27405525 [0,1,0,0,0,0|2,0,0]=3 3019 B7R0.5 O=C(O)C(S)CCS Amb27634893 [0,1,0,0,0,0|1,0,0]=2 3020 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [0,1,0,0,0,0|1,0,0]=2 3021 B7R0.5 O=C(O)\C(Br)=C\CO Amb28291530 [0,1,0,0,0,0|1,0,2]=4 3022 B7R0.5 O=C(O)\C(Cl)=C\CBr Amb27875077 [0,1,0,0,0,0|1,0,2]=4 3023 B7R0.5 O=CCC(=O)C(=O)O Amb26326260 [0,1,0,0,0,0|1,0,2]=4 3024 B7R0.5 OCC\C(Br)=C(/O)Br Amb27967773 [0,1,0,0,0,0|2,0,1]=4 3025 B7R0.5 [NH3+]CCC([NH3+])C(=O)[O-] Amb33513240 [0,1,0,0,0,0|1,0,1]=3 3026 B7R0.6 C=C(Br)CCC(=O)O Amb18648212 [0,1,0,0,0,0|0,0,2]=3 3027 B7R0.6 C=C(Br)COC(C)C Amb27197438 [0,1,0,0,0,0|3,0,0]=4 3028 B7R0.6 C=C(C)CCB(O)O Amb28316164 [0,1,0,0,0,0|1,0,2]=4 3029 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [0,1,0,0,0,0|0,0,1]=2 3030 B7R0.6 C=C(C)CCC(C)=O Amb9024770 [0,1,0,0,0,0|1,0,1]=3 3031 B7R0.6 C=C(C)CCC(C)Br Amb27878705 [0,1,0,0,0,0|2,0,0]=3 3032 B7R0.6 C=C(C)CCC(C)N Amb18641752 [0,1,0,0,0,0|2,0,0]=3 3033 B7R0.6 C=C(C)CCC(C)O Amb24062974 [0,1,0,0,0,0|2,0,0]=3 3034 B7R0.6 C=C(C)CCC(N)=O Amb27838318 [0,1,0,0,0,0|1,0,1]=3 3035 B7R0.6 C=C(C)CCN(C)C Amb28187650 [0,1,0,0,0,0|3,0,0]=4 3036 B7R0.6 C=C(C)CC[C@@H](C)N Amb33199549 [0,1,0,0,0,0|2,0,0]=3 3037 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [0,1,0,0,0,0|2,0,0]=3 3038 B7R0.6 C=C(C)CC[C@H](C)N Amb33199548 [0,1,0,0,0,0|2,0,0]=3 3039 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [0,1,0,0,0,0|2,0,0]=3 3040 B7R0.6 C=C(C)CC[N+](=O)[O-] Amb33199531 [0,1,0,0,0,0|1,0,2]=4 3041 B7R0.6 C=C(C)CNC(N)=O Amb28385347 [0,1,0,0,0,0|2,0,1]=4 3042 B7R0.6 C=C(C)CNC(O)=S Amb28240718 [0,1,0,0,0,0|1,1,1]=4 3043 B7R0.6 C=C(C)COC(C)=O Amb16187121 [0,1,0,0,0,0|2,0,1]=4 3044 B7R0.6 C=C(C)COC(N)=O Amb4017509 [0,1,0,0,0,0|2,0,1]=4 3045 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [0,1,0,0,0,0|1,0,1]=3 3046 B7R0.6 C=C(C)OCC(C)=O Amb27802616 [0,1,0,0,0,0|2,0,1]=4 3047 B7R0.6 C=C(C)\C=C\C(=O)O Amb17593153 [0,1,0,0,0,0|0,0,3]=4 3048 B7R0.6 C=C(Cl)CCC(=O)O Amb18642971 [0,1,0,0,0,0|0,0,2]=3 3049 B7R0.6 C=C(Cl)CCC(C)=O Amb28316194 [0,1,0,0,0,0|1,0,2]=4 3050 B7R0.6 C=C(N)CCC(=O)O Amb27629351 [0,1,0,0,0,0|0,0,2]=3 3051 B7R0.6 CC(=N)NCC(C)C Amb27865850 [0,1,0,0,0,0|3,0,0]=4 3052 B7R0.6 CC(=N)NCC(N)=O Amb27601983 [0,1,0,0,0,0|2,0,1]=4 3053 B7R0.6 CC(=O)C#C[C@@H](C)O Amb27854924 [0,1,0,0,0,0|1,0,2]=4 3054 B7R0.6 CC(=O)CC=C(C)C Amb17593170 [0,1,0,0,0,0|1,0,2]=4 3055 B7R0.6 CC(=O)CCB(O)O Amb25095502 [0,1,0,0,0,0|1,0,2]=4 3056 B7R0.6 CC(=O)CCC(=O)O Amb534169 [0,1,0,0,0,0|0,0,1]=2 3057 B7R0.6 CC(=O)CCC(=S)Cl Amb28049019 [0,1,0,0,0,0|1,1,1]=4 3058 B7R0.6 CC(=O)CCC(C)=O Amb2793010 [0,1,0,0,0,0|1,0,1]=3 3059 B7R0.6 CC(=O)CCC(C)=S Amb27226729 [0,1,0,0,0,0|1,0,1]=3 3060 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [0,1,0,0,0,0|1,0,0]=2 3061 B7R0.6 CC(=O)CCC(C)C Amb4605991 [0,1,0,0,0,0|1,0,0]=2 3062 B7R0.6 CC(=O)CCC(C)O Amb25829594 [0,1,0,0,0,0|1,0,0]=2 3063 B7R0.6 CC(=O)CCC(F)F Amb27413848 [0,1,0,0,0,0|2,0,0]=3 3064 B7R0.6 CC(=O)CCC(N)=O Amb17142854 [0,1,0,0,0,0|1,0,1]=3 3065 B7R0.6 CC(=O)CCC(O)=S Amb27267983 [0,1,0,0,0,0|0,1,1]=3 3066 B7R0.6 CC(=O)CCN(C)C Amb1129203 [0,1,0,0,0,0|2,0,0]=3 3067 B7R0.6 CC(=O)CCN(C)C Amb343601 [0,1,0,0,0,0|2,0,0]=3 3068 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [0,1,0,0,0,0|1,0,0]=2 3069 B7R0.6 CC(=O)CC[N+](=O)[O-] Amb18198961 [0,1,0,0,0,0|1,0,2]=4 3070 B7R0.6 CC(=O)CNC(C)=O Amb6297294 [0,1,0,0,0,0|2,0,1]=4 3071 B7R0.6 CC(=O)CNC(C)C Amb28126943 [0,1,0,0,0,0|2,0,0]=3 3072 B7R0.6 CC(=O)CNC(C)C Amb32661638 [0,1,0,0,0,0|2,0,0]=3 3073 B7R0.6 CC(=O)CNS(C)=O Amb27243778 [0,1,0,0,0,0|3,0,0]=4 3074 B7R0.6 CC(=O)COC(C)=O Amb8517567 [0,1,0,0,0,0|2,0,1]=4 3075 B7R0.6 CC(=O)COC(C)C Amb9665256 [0,1,0,0,0,0|2,0,0]=3 3076 B7R0.6 CC(=O)COC(F)F Amb27636211 [0,1,0,0,0,0|3,0,0]=4 3077 B7R0.6 CC(=O)CSC(C)C Amb22549127 [0,1,0,0,0,0|2,0,0]=3 3078 B7R0.6 CC(=O)C\C=C(\C)Cl Amb27880641 [0,1,0,0,0,0|1,0,2]=4 3079 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,1,0,0,0,0|1,0,1]=3 3080 B7R0.6 CC(=O)NCC(C)C Amb3364211 [0,1,0,0,0,0|2,0,0]=3 3081 B7R0.6 CC(=O)NCC(C)N Amb18631377 [0,1,0,0,0,0|2,0,0]=3 3082 B7R0.6 CC(=O)NCC(C)O Amb9276316 [0,1,0,0,0,0|2,0,0]=3 3083 B7R0.6 CC(=O)NCC(Cl)Cl Amb27978268 [0,1,0,0,0,0|3,0,0]=4 3084 B7R0.6 CC(=O)NCC(F)F Amb27961410 [0,1,0,0,0,0|3,0,0]=4 3085 B7R0.6 CC(=O)NCC(N)=O Amb17231824 [0,1,0,0,0,0|2,0,1]=4 3086 B7R0.6 CC(=O)NCN(C)C Amb27838840 [0,1,0,0,0,0|3,0,0]=4 3087 B7R0.6 CC(=O)NNC(C)C Amb22233621 [0,1,0,0,0,0|3,0,0]=4 3088 B7R0.6 CC(=O)OCC(=O)Cl Amb3939160 [0,1,0,0,0,0|2,0,1]=4 3089 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,1,0,0,0,0|1,0,1]=3 3090 B7R0.6 CC(=O)OCC(C)Br Amb25360690 [0,1,0,0,0,0|2,0,0]=3 3091 B7R0.6 CC(=O)OCC(C)O Amb24056158 [0,1,0,0,0,0|2,0,0]=3 3092 B7R0.6 CC(=O)OCC(F)F Amb10839327 [0,1,0,0,0,0|3,0,0]=4 3093 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,1,0,0,0,0|2,0,1]=4 3094 B7R0.6 CC(=O)OC[C@H](C)Br Amb27878701 [0,1,0,0,0,0|2,0,0]=3 3095 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [0,1,0,0,0,0|2,0,0]=3 3096 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [0,1,0,0,0,0|2,0,1]=4 3097 B7R0.6 CC(=O)SCC(C)O Amb27801534 [0,1,0,0,0,0|2,0,0]=3 3098 B7R0.6 CC(=O)SCC(Cl)Cl Amb4012737 [0,1,0,0,0,0|3,0,0]=4 3099 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,1,0,0,0,0|2,0,1]=4 3100 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [0,1,0,0,0,0|0,0,3]=4 3101 B7R0.6 CC(=O)\C=C\C(C)C Amb28524833 [0,1,0,0,0,0|1,0,2]=4 3102 B7R0.6 CC(=O)\C=C\C(C)Cl Amb25782801 [0,1,0,0,0,0|1,0,2]=4 3103 B7R0.6 CC(=O)\N=C\C(=O)O Amb27262053 [0,1,0,0,0,0|1,0,2]=4 3104 B7R0.6 CC(=O)\N=C\C(C)O Amb27457691 [0,1,0,0,0,0|2,0,1]=4 3105 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [0,1,0,0,0,0|1,0,1]=3 3106 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [0,1,0,0,0,0|1,0,1]=3 3107 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [0,1,0,0,0,0|0,0,0]=1 3108 B7R0.6 CC(Br)CCC(F)F Amb27636046 [0,1,0,0,0,0|2,0,1]=4 3109 B7R0.6 CC(Br)CCN(C)C Amb28122888 [0,1,0,0,0,0|3,0,0]=4 3110 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [0,1,0,0,0,0|0,0,2]=3 3111 B7R0.6 CC(C)=CCC(=O)[O-] Amb22491058 [0,1,0,0,0,0|0,0,3]=4 3112 B7R0.6 CC(C)=CCC(C)C Amb22731329 [0,1,0,0,0,0|2,0,1]=4 3113 B7R0.6 CC(C)=CCC(C)Cl Amb27590455 [0,1,0,0,0,0|2,0,1]=4 3114 B7R0.6 CC(C)=CCC(C)N Amb27391176 [0,1,0,0,0,0|2,0,1]=4 3115 B7R0.6 CC(C)=CC[C@@H](C)O Amb28315798 [0,1,0,0,0,0|2,0,1]=4 3116 B7R0.6 CC(C)=NCC(N)=O Amb27489401 [0,1,0,0,0,0|2,0,1]=4 3117 B7R0.6 CC(C)C#CC(=O)O Amb33544341 [0,1,0,0,0,0|0,0,2]=3 3118 B7R0.6 CC(C)CCB(O)O Amb13890540 [0,1,0,0,0,0|1,0,1]=3 3119 B7R0.6 CC(C)CCC(=N)N Amb19890005 [0,1,0,0,0,0|2,0,0]=3 3120 B7R0.6 CC(C)CCC(=N)N Amb6266403 [0,1,0,0,0,0|2,0,0]=3 3121 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [0,1,0,0,0,0|1,0,0]=2 3122 B7R0.6 CC(C)CCC(=O)O Amb1153016 [0,1,0,0,0,0|0,0,0]=1 3123 B7R0.6 CC(C)CCC(C)Br Amb8835419 [0,1,0,0,0,0|2,0,1]=4 3124 B7R0.6 CC(C)CCC(C)C Amb8513431 [0,1,0,0,0,0|2,0,1]=4 3125 B7R0.6 CC(C)CCC(C)N Amb32405136 [0,1,0,0,0,0|2,0,1]=4 3126 B7R0.6 CC(C)CCC(C)N Amb9703135 [0,1,0,0,0,0|2,0,1]=4 3127 B7R0.6 CC(C)CCC(C)O Amb9748244 [0,1,0,0,0,0|1,0,1]=3 3128 B7R0.6 CC(C)CCC(C)S Amb7784741 [0,1,0,0,0,0|1,1,1]=4 3129 B7R0.6 CC(C)CCC(N)=O Amb8997711 [0,1,0,0,0,0|1,0,0]=2 3130 B7R0.6 CC(C)CCC(N)=S Amb6248593 [0,1,0,0,0,0|1,1,0]=3 3131 B7R0.6 CC(C)CCN(C)O Amb33361677 [0,1,0,0,0,0|2,0,0]=3 3132 B7R0.6 CC(C)CCP(Cl)Cl Amb27793518 [0,1,0,0,0,0|3,0,0]=4 3133 B7R0.6 CC(C)CCS(=O)Cl Amb27201771 [0,1,0,0,0,0|2,0,0]=3 3134 B7R0.6 CC(C)CCS(=O)[O-] Amb25914733 [0,1,0,0,0,0|1,0,1]=3 3135 B7R0.6 CC(C)CCS(N)=O Amb32720359 [0,1,0,0,0,0|2,0,0]=3 3136 B7R0.6 CC(C)CC[C@@H](C)N Amb26479301 [0,1,0,0,0,0|2,0,1]=4 3137 B7R0.6 CC(C)CC[C@@H](C)O Amb26500468 [0,1,0,0,0,0|1,0,1]=3 3138 B7R0.6 CC(C)CC[C@H](C)N Amb3941458 [0,1,0,0,0,0|2,0,1]=4 3139 B7R0.6 CC(C)CC[C@H](C)O Amb27768728 [0,1,0,0,0,0|1,0,1]=3 3140 B7R0.6 CC(C)CC[N+](=O)[O-] Amb17672612 [0,1,0,0,0,0|1,0,1]=3 3141 B7R0.6 CC(C)CNC(=N)N Amb26326628 [0,1,0,0,0,0|3,0,0]=4 3142 B7R0.6 CC(C)CNC(=O)Cl Amb35637064 [0,1,0,0,0,0|2,0,0]=3 3143 B7R0.6 CC(C)CNC(N)=O Amb1151241 [0,1,0,0,0,0|2,0,0]=3 3144 B7R0.6 CC(C)CNC(N)=S Amb2370605 [0,1,0,0,0,0|2,1,0]=4 3145 B7R0.6 CC(C)CNC(O)=S Amb27597328 [0,1,0,0,0,0|1,1,0]=3 3146 B7R0.6 CC(C)COC(=O)Cl Amb3940231 [0,1,0,0,0,0|2,0,0]=3 3147 B7R0.6 CC(C)COC(=S)S Amb27804114 [0,1,0,0,0,0|1,2,0]=4 3148 B7R0.6 CC(C)COC(N)=O Amb4020010 [0,1,0,0,0,0|2,0,0]=3 3149 B7R0.6 CC(C)COC(O)O Amb28120630 [0,1,0,0,0,0|1,0,2]=4 3150 B7R0.6 CC(C)CON(=O)O Amb33780821 [0,1,0,0,0,0|2,0,0]=3 3151 B7R0.6 CC(C)CO[N+](=O)[O-] Amb22348027 [0,1,0,0,0,0|2,0,1]=4 3152 B7R0.6 CC(C)CO[PH](=O)O Amb27252350 [0,1,0,0,0,0|2,0,0]=3 3153 B7R0.6 CC(C)CSC(=N)N Amb20676000 [0,1,0,0,0,0|3,0,0]=4 3154 B7R0.6 CC(C)CSC(=N)N Amb27875967 [0,1,0,0,0,0|3,0,0]=4 3155 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [0,1,0,0,0,0|2,0,0]=3 3156 B7R0.6 CC(C)NCC(=N)N Amb27186805 [0,1,0,0,0,0|3,0,0]=4 3157 B7R0.6 CC(C)NCC(=O)Cl Amb27441169 [0,1,0,0,0,0|2,0,0]=3 3158 B7R0.6 CC(C)NCC(=O)O Amb2372347 [0,1,0,0,0,0|1,0,0]=2 3159 B7R0.6 CC(C)NCC(=O)O Amb6892753 [0,1,0,0,0,0|1,0,0]=2 3160 B7R0.6 CC(C)NCC(N)=O Amb2370772 [0,1,0,0,0,0|2,0,0]=3 3161 B7R0.6 CC(C)NCC(N)=O Amb399843 [0,1,0,0,0,0|2,0,0]=3 3162 B7R0.6 CC(C)NCC(N)=S Amb17231884 [0,1,0,0,0,0|2,1,0]=4 3163 B7R0.6 CC(C)NC[C@@H](C)O Amb27641886 [0,1,0,0,0,0|2,0,1]=4 3164 B7R0.6 CC(C)NNC(N)=O Amb27409411 [0,1,0,0,0,0|3,0,0]=4 3165 B7R0.6 CC(C)OCB(O)O Amb28058696 [0,1,0,0,0,0|2,0,1]=4 3166 B7R0.6 CC(C)OCC(=N)N Amb33551035 [0,1,0,0,0,0|3,0,0]=4 3167 B7R0.6 CC(C)OCC(=N)N Amb6268584 [0,1,0,0,0,0|3,0,0]=4 3168 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [0,1,0,0,0,0|2,0,0]=3 3169 B7R0.6 CC(C)OCC(=O)O Amb6275796 [0,1,0,0,0,0|1,0,0]=2 3170 B7R0.6 CC(C)OCC(N)=O Amb26515707 [0,1,0,0,0,0|2,0,0]=3 3171 B7R0.6 CC(C)OCC(N)=S Amb6267503 [0,1,0,0,0,0|2,1,0]=4 3172 B7R0.6 CC(C)OC[C@@H](C)O Amb24689920 [0,1,0,0,0,0|2,0,1]=4 3173 B7R0.6 CC(C)OC[C@H](C)O Amb24449028 [0,1,0,0,0,0|2,0,1]=4 3174 B7R0.6 CC(C)ONC(N)=O Amb2899784 [0,1,0,0,0,0|3,0,0]=4 3175 B7R0.6 CC(C)SCC(=O)O Amb1128460 [0,1,0,0,0,0|1,0,0]=2 3176 B7R0.6 CC(C)\C=C\C(=O)Cl Amb24481563 [0,1,0,0,0,0|1,0,2]=4 3177 B7R0.6 CC(C)\C=C\C(=O)O Amb8517064 [0,1,0,0,0,0|0,0,2]=3 3178 B7R0.6 CC(C)\N=C\C(N)=O Amb28388359 [0,1,0,0,0,0|2,0,1]=4 3179 B7R0.6 CC(Cl)C#CC(=O)O Amb28410751 [0,1,0,0,0,0|0,0,2]=3 3180 B7R0.6 CC(Cl)CCB(O)O Amb26366806 [0,1,0,0,0,0|1,0,1]=3 3181 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,1,0,0,0,0|1,0,0]=2 3182 B7R0.6 CC(Cl)CCC(C)Cl Amb27263593 [0,1,0,0,0,0|2,0,1]=4 3183 B7R0.6 CC(Cl)CCC(F)F Amb32672187 [0,1,0,0,0,0|2,0,1]=4 3184 B7R0.6 CC(Cl)CCS(=O)Cl Amb32720414 [0,1,0,0,0,0|2,0,0]=3 3185 B7R0.6 CC(Cl)CCS(=O)[O-] Amb32755731 [0,1,0,0,0,0|1,0,1]=3 3186 B7R0.6 CC(Cl)CCS(N)=O Amb32720415 [0,1,0,0,0,0|2,0,0]=3 3187 B7R0.6 CC(Cl)\C=C\C(=O)Cl Amb24579654 [0,1,0,0,0,0|1,0,2]=4 3188 B7R0.6 CC(F)CCC(F)F Amb32672189 [0,1,0,0,0,0|2,0,1]=4 3189 B7R0.6 CC(F)CCS(=O)Cl Amb32720694 [0,1,0,0,0,0|2,0,0]=3 3190 B7R0.6 CC(F)CCS(=O)[O-] Amb32754854 [0,1,0,0,0,0|1,0,1]=3 3191 B7R0.6 CC(F)CCS(N)=O Amb32720695 [0,1,0,0,0,0|2,0,0]=3 3192 B7R0.6 CC(I)CCC(=O)O Amb25938596 [0,1,0,0,0,0|0,0,0]=1 3193 B7R0.6 CC(I)CCC(F)F Amb32672188 [0,1,0,0,0,0|2,0,1]=4 3194 B7R0.6 CC(N)C#CC(=O)O Amb27876109 [0,1,0,0,0,0|0,0,2]=3 3195 B7R0.6 CC(N)CC=C(Cl)Cl Amb29870254 [0,1,0,0,0,0|2,0,1]=4 3196 B7R0.6 CC(N)CCC(=O)O Amb17593212 [0,1,0,0,0,0|0,0,0]=1 3197 B7R0.6 CC(N)CCC(=O)O Amb19515603 [0,1,0,0,0,0|0,0,0]=1 3198 B7R0.6 CC(N)CCC(C)N Amb27251969 [0,1,0,0,0,0|2,0,1]=4 3199 B7R0.6 CC(N)CCC(C)O Amb18641930 [0,1,0,0,0,0|1,0,1]=3 3200 B7R0.6 CC(N)CCC(F)F Amb32659595 [0,1,0,0,0,0|2,0,1]=4 3201 B7R0.6 CC(N)CCC(F)F Amb32659596 [0,1,0,0,0,0|2,0,1]=4 3202 B7R0.6 CC(N)CCN(C)C Amb7969829 [0,1,0,0,0,0|3,0,0]=4 3203 B7R0.6 CC(N)CCN(C)C Amb9711596 [0,1,0,0,0,0|3,0,0]=4 3204 B7R0.6 CC(N)CCP(O)O Amb27468069 [0,1,0,0,0,0|1,0,1]=3 3205 B7R0.6 CC(N)CCS(=O)O Amb27839082 [0,1,0,0,0,0|1,0,0]=2 3206 B7R0.6 CC(N)CCS(C)=O Amb19337158 [0,1,0,0,0,0|2,0,0]=3 3207 B7R0.6 CC(N)CCS(C)=O Amb22059582 [0,1,0,0,0,0|2,0,0]=3 3208 B7R0.6 CC(N)CC[N+](=O)[O-] Amb33745572 [0,1,0,0,0,0|1,0,1]=3 3209 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [0,1,0,0,0,0|1,0,0]=2 3210 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,1,0,0,0,0|2,0,0]=3 3211 B7R0.6 CC(N)COC(N)=O Amb29849466 [0,1,0,0,0,0|2,0,0]=3 3212 B7R0.6 CC(N)SCC(=O)O Amb27401691 [0,1,0,0,0,0|1,0,0]=2 3213 B7R0.6 CC(N)\C=C\C(=O)O Amb33804531 [0,1,0,0,0,0|0,0,2]=3 3214 B7R0.6 CC(O)C#CC(=O)O Amb27803065 [0,1,0,0,0,0|0,0,2]=3 3215 B7R0.6 CC(O)CCB(O)O Amb24594819 [0,1,0,0,0,0|1,0,1]=3 3216 B7R0.6 CC(O)CCC(=N)N Amb29849256 [0,1,0,0,0,0|2,0,0]=3 3217 B7R0.6 CC(O)CCC(=O)O Amb18294804 [0,1,0,0,0,0|0,0,0]=1 3218 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [0,1,0,0,0,0|0,0,1]=2 3219 B7R0.6 CC(O)CCC(C)O Amb2688714 [0,1,0,0,0,0|1,0,1]=3 3220 B7R0.6 CC(O)CCC(F)F Amb28252655 [0,1,0,0,0,0|2,0,1]=4 3221 B7R0.6 CC(O)CCC(N)=S Amb28078352 [0,1,0,0,0,0|1,1,0]=3 3222 B7R0.6 CC(O)CCN(C)C Amb26489582 [0,1,0,0,0,0|2,0,1]=4 3223 B7R0.6 CC(O)CCS(=O)[O-] Amb27662317 [0,1,0,0,0,0|1,0,1]=3 3224 B7R0.6 CC(O)CNC(=N)N Amb27759521 [0,1,0,0,0,0|3,0,0]=4 3225 B7R0.6 CC(O)CNC(C)C Amb9247472 [0,1,0,0,0,0|2,0,1]=4 3226 B7R0.6 CC(O)COB(O)O Amb28206200 [0,1,0,0,0,0|2,0,1]=4 3227 B7R0.6 CC(O)COC(N)=O Amb26359577 [0,1,0,0,0,0|2,0,0]=3 3228 B7R0.6 CC(O)COS(C)=O Amb27982299 [0,1,0,0,0,0|3,0,0]=4 3229 B7R0.6 CC(S)CCC(=O)O Amb8471198 [0,1,0,0,0,0|0,0,0]=1 3230 B7R0.6 CC(S)CCC(N)=O Amb28399630 [0,1,0,0,0,0|1,0,0]=2 3231 B7R0.6 CC(S)CCN(C)C Amb32788207 [0,1,0,0,0,0|3,0,0]=4 3232 B7R0.6 CN(C)CCB(O)O Amb27787216 [0,1,0,0,0,0|2,0,1]=4 3233 B7R0.6 CN(C)CCC(=N)N Amb2695941 [0,1,0,0,0,0|3,0,0]=4 3234 B7R0.6 CN(C)CCC(=N)N Amb33551563 [0,1,0,0,0,0|3,0,0]=4 3235 B7R0.6 CN(C)CCC(=O)Cl Amb26050113 [0,1,0,0,0,0|2,0,0]=3 3236 B7R0.6 CN(C)CCC(=O)Cl Amb32652940 [0,1,0,0,0,0|2,0,0]=3 3237 B7R0.6 CN(C)CCC(=O)O Amb19888182 [0,1,0,0,0,0|1,0,0]=2 3238 B7R0.6 CN(C)CCC(=O)O Amb6633385 [0,1,0,0,0,0|1,0,0]=2 3239 B7R0.6 CN(C)CCC(N)=O Amb17231825 [0,1,0,0,0,0|2,0,0]=3 3240 B7R0.6 CN(C)CCC(N)=S Amb6268885 [0,1,0,0,0,0|2,1,0]=4 3241 B7R0.6 CN(C)CCC(N)=S Amb6893069 [0,1,0,0,0,0|2,1,0]=4 3242 B7R0.6 CN(C)CCS(=O)[O-] Amb32754654 [0,1,0,0,0,0|2,0,1]=4 3243 B7R0.6 CN(C)CCS(C)=O Amb27811384 [0,1,0,0,0,0|3,0,0]=4 3244 B7R0.6 CN(C)OCC(=O)O Amb28120004 [0,1,0,0,0,0|2,0,0]=3 3245 B7R0.6 CN(C)SCC(N)=O Amb27838357 [0,1,0,0,0,0|3,0,0]=4 3246 B7R0.6 CN(C)\C=C\C(=O)O Amb25273624 [0,1,0,0,0,0|1,0,2]=4 3247 B7R0.6 CN(N)CCC(=O)O Amb2698078 [0,1,0,0,0,0|1,0,0]=2 3248 B7R0.6 CN(O)CCC(N)=O Amb27390605 [0,1,0,0,0,0|2,0,0]=3 3249 B7R0.6 CN(O)\C=C\C(=O)O Amb27788003 [0,1,0,0,0,0|1,0,2]=4 3250 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [0,1,0,0,0,0|1,0,0]=2 3251 B7R0.6 CS(=O)CCS(C)=O Amb26455659 [0,1,0,0,0,0|3,0,0]=4 3252 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [0,1,0,0,0,0|2,0,0]=3 3253 B7R0.6 CS(=O)\C=C\C(=O)O Amb18642965 [0,1,0,0,0,0|1,0,2]=4 3254 B7R0.6 C[C@@H](Br)CO[N+](=O)[O-] Amb27880933 [0,1,0,0,0,0|2,0,1]=4 3255 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [0,1,0,0,0,0|0,0,0]=1 3256 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [0,1,0,0,0,0|0,0,0]=1 3257 B7R0.6 C[C@@H](N)CCC(F)F Amb32811584 [0,1,0,0,0,0|2,0,1]=4 3258 B7R0.6 C[C@@H](N)CCN(C)C Amb28126846 [0,1,0,0,0,0|3,0,0]=4 3259 B7R0.6 C[C@@H](N)CC[N+](=O)[O-] Amb33731289 [0,1,0,0,0,0|1,0,1]=3 3260 B7R0.6 C[C@@H](O)CCC(F)F Amb33337801 [0,1,0,0,0,0|2,0,1]=4 3261 B7R0.6 C[C@@H](O)CCN(C)C Amb33272289 [0,1,0,0,0,0|2,0,1]=4 3262 B7R0.6 C[C@@H](O)CC[C@@H](C)O Amb4166310 [0,1,0,0,0,0|1,0,1]=3 3263 B7R0.6 C[C@@H](O)CNC(N)=O Amb28315793 [0,1,0,0,0,0|2,0,0]=3 3264 B7R0.6 C[C@H](Br)CO[N+](=O)[O-] Amb27843578 [0,1,0,0,0,0|2,0,1]=4 3265 B7R0.6 C[C@H](N)C#CC(=O)O Amb27644755 [0,1,0,0,0,0|0,0,2]=3 3266 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [0,1,0,0,0,0|0,0,0]=1 3267 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [0,1,0,0,0,0|0,0,0]=1 3268 B7R0.6 C[C@H](N)CCC(F)F Amb32811585 [0,1,0,0,0,0|2,0,1]=4 3269 B7R0.6 C[C@H](N)CCN(C)C Amb26640371 [0,1,0,0,0,0|3,0,0]=4 3270 B7R0.6 C[C@H](N)CC[C@H](C)N Amb27838291 [0,1,0,0,0,0|2,0,1]=4 3271 B7R0.6 C[C@H](N)CC[N+](=O)[O-] Amb33729333 [0,1,0,0,0,0|1,0,1]=3 3272 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [0,1,0,0,0,0|0,0,0]=1 3273 B7R0.6 C[C@H](O)CCC(F)F Amb33485344 [0,1,0,0,0,0|2,0,1]=4 3274 B7R0.6 C[C@H](O)CCN(C)C Amb33272277 [0,1,0,0,0,0|2,0,1]=4 3275 B7R0.6 C[C@H](O)CC[C@@H](C)O Amb26407371 [0,1,0,0,0,0|1,0,1]=3 3276 B7R0.6 C[C@H](O)CC[C@H](C)O Amb4166315 [0,1,0,0,0,0|1,0,1]=3 3277 B7R0.6 C[C@H](O)CNC(=N)N Amb28135994 [0,1,0,0,0,0|3,0,0]=4 3278 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [0,1,0,0,0,0|0,0,0]=1 3279 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [0,1,0,0,0,0|1,0,0]=2 3280 B7R0.6 C[S+](C)CCC(=O)[O-] Amb20247306 [0,1,0,0,0,0|1,0,1]=3 3281 B7R0.6 C\C(Cl)=C/CC(N)=O Amb27750566 [0,1,0,0,0,0|1,0,2]=4 3282 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [0,1,0,0,0,0|0,0,2]=3 3283 B7R0.6 C\C(N)=N/C[C@H](C)O Amb28049584 [0,1,0,0,0,0|3,0,0]=4 3284 B7R0.6 N=C(N)CCC(N)=O Amb25680023 [0,1,0,0,0,0|2,0,1]=4 3285 B7R0.6 N=C(N)NCC(=O)O Amb16231404 [0,1,0,0,0,0|2,0,1]=4 3286 B7R0.6 N=C(N)NCC(=O)O Amb2781642 [0,1,0,0,0,0|2,0,1]=4 3287 B7R0.6 N=C(N)SCC(=O)O Amb33544354 [0,1,0,0,0,0|2,0,1]=4 3288 B7R0.6 NC(=O)CCC(=O)Cl Amb28240580 [0,1,0,0,0,0|2,0,1]=4 3289 B7R0.6 NC(=O)CCC(=O)O Amb2967294 [0,1,0,0,0,0|1,0,1]=3 3290 B7R0.6 NC(=O)CCC(Cl)Cl Amb32671996 [0,1,0,0,0,0|2,0,0]=3 3291 B7R0.6 NC(=O)CCC(N)=O Amb1353209 [0,1,0,0,0,0|2,0,1]=4 3292 B7R0.6 NC(=O)CCC(O)O Amb27254204 [0,1,0,0,0,0|2,0,0]=3 3293 B7R0.6 NC(=O)NCC(=O)O Amb6366364 [0,1,0,0,0,0|2,0,1]=4 3294 B7R0.6 NC(=O)NCC(Cl)Cl Amb27763808 [0,1,0,0,0,0|3,0,0]=4 3295 B7R0.6 NC(=O)NCC(F)F Amb27827918 [0,1,0,0,0,0|3,0,0]=4 3296 B7R0.6 NC(=S)CCC(=O)O Amb18102382 [0,1,0,0,0,0|1,0,1]=3 3297 B7R0.6 NC(=S)NCC(=O)O Amb9786290 [0,1,0,0,0,0|2,0,1]=4 3298 B7R0.6 O=C(Cl)CCC(=O)Cl Amb3940240 [0,1,0,0,0,0|2,0,1]=4 3299 B7R0.6 O=C(Cl)NCC(F)F Amb35625623 [0,1,0,0,0,0|3,0,0]=4 3300 B7R0.6 O=C(Cl)OCC(Cl)Cl Amb27634817 [0,1,0,0,0,0|3,0,0]=4 3301 B7R0.6 O=C(Cl)OCC(F)F Amb27431456 [0,1,0,0,0,0|3,0,0]=4 3302 B7R0.6 O=C(O)C#CC(F)F Amb24455798 [0,1,0,0,0,0|1,0,2]=4 3303 B7R0.6 O=C(O)CC=C(Cl)Cl Amb17593875 [0,1,0,0,0,0|1,0,2]=4 3304 B7R0.6 O=C(O)CCB(O)O Amb24640288 [0,1,0,0,0,0|2,0,0]=3 3305 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [0,1,0,0,0,0|1,0,1]=3 3306 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [0,1,0,0,0,0|1,0,1]=3 3307 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [0,1,0,0,0,0|1,0,0]=2 3308 B7R0.6 O=C(O)CCC(F)F Amb20623135 [0,1,0,0,0,0|1,0,0]=2 3309 B7R0.6 O=C(O)CCN(F)F Amb28370344 [0,1,0,0,0,0|2,0,0]=3 3310 B7R0.6 O=C(O)CCP(O)O Amb27424479 [0,1,0,0,0,0|2,0,0]=3 3311 B7R0.6 O=C(O)CCS(=O)O Amb27144832 [0,1,0,0,0,0|2,0,0]=3 3312 B7R0.6 O=C(O)CC[N+](=O)[O-] Amb10843224 [0,1,0,0,0,0|2,0,0]=3 3313 B7R0.6 O=C(O)CC[SH](=O)=O Amb27410689 [0,1,0,0,0,0|2,0,0]=3 3314 B7R0.6 O=C(O)CNC(=O)S Amb27424662 [0,1,0,0,0,0|2,0,1]=4 3315 B7R0.6 O=C(O)CN[N+](=O)[O-] Amb26397226 [0,1,0,0,0,0|3,0,0]=4 3316 B7R0.6 O=C(O)COC(=O)Cl Amb27199161 [0,1,0,0,0,0|2,0,1]=4 3317 B7R0.6 O=C(O)COC(F)F Amb26635492 [0,1,0,0,0,0|2,0,0]=3 3318 B7R0.6 O=C(O)CSC(F)F Amb9215372 [0,1,0,0,0,0|2,0,0]=3 3319 B7R0.6 O=C(O)\C=C\C(Cl)Cl Amb26464246 [0,1,0,0,0,0|1,0,2]=4 3320 B7R0.6 O=C(O)\C=C\C(F)F Amb24340205 [0,1,0,0,0,0|1,0,2]=4 3321 B7R0.6 O=C([O-])CCC(=O)[O-] Amb33512742 [0,1,0,0,0,0|1,0,2]=4 3322 B7R0.6 O=C([O-])CCC(=O)[O-] Amb8514379 [0,1,0,0,0,0|1,0,2]=4 3323 B7R0.6 O=C([O-])CSC(F)F Amb33719493 [0,1,0,0,0,0|2,0,1]=4 3324 B7R0.6 O=S([O-])CCC(F)F Amb32755037 [0,1,0,0,0,0|2,0,1]=4 3325 B7R0.6 O=[N+]([O-])CCC(F)F Amb33485345 [0,1,0,0,0,0|2,0,1]=4 3326 B7R0.6 OC(O)CCC(O)O Amb26000162 [0,1,0,0,0,0|1,0,2]=4 3327 B7R0.6 [BH3-]C(=O)NCC(=O)O Amb27478291 [0,1,0,0,0,0|2,0,1]=4 3328 B7R0.8 CC(C)(O)CCCF Amb33196444 [0,1,0,0,0,0|2,0,1]=4 3329 B7R0.8 CC(C)(O)CCCN Amb17569908 [0,1,0,0,0,0|2,0,1]=4 3330 B7R0.8 CC(C)(O)CCCO Amb20668492 [0,1,0,0,0,0|2,0,1]=4 3331 B7R0.8 CCCCC(C)(Br)Br Amb15692624 [0,1,0,0,0,0|2,0,1]=4 3332 B7R0.8 CCCCC(C)(C)Br Amb24401418 [0,1,0,0,0,0|2,0,1]=4 3333 B7R0.8 CCCCC(C)(C)C Amb22228234 [0,1,0,0,0,0|2,0,1]=4 3334 B7R0.8 CCCCC(C)(C)N Amb18993512 [0,1,0,0,0,0|2,0,1]=4 3335 B7R0.8 CCCCC(C)(C)O Amb8513443 [0,1,0,0,0,0|1,0,1]=3 3336 B7R0.8 CCCCC(C)(C)S Amb27397079 [0,1,0,0,0,0|1,1,1]=4 3337 B7R0.8 CCCCC(F)(F)F Amb22008013 [0,1,0,0,0,0|2,0,1]=4 3338 B7R0.8 CCCCP(=O)(Cl)Cl Amb8515452 [0,1,0,0,0,0|2,0,0]=3 3339 B7R0.8 CCCCP(=O)(O)O Amb22053921 [0,1,0,0,0,0|1,0,0]=2 3340 B7R0.8 CCCCP(=S)(Cl)Cl Amb27398624 [0,1,0,0,0,0|2,1,0]=4 3341 B7R0.8 CCCCS(=O)(=O)Cl Amb3939750 [0,1,0,0,0,0|1,0,1]=3 3342 B7R0.8 CCCCS(=O)(=O)F Amb10610096 [0,1,0,0,0,0|1,0,1]=3 3343 B7R0.8 CCCCS(=O)(=O)O Amb10844727 [0,1,0,0,0,0|1,0,0]=2 3344 B7R0.8 CCCCS(=O)(=O)[O-] Amb8514323 [0,1,0,0,0,0|1,0,1]=3 3345 B7R0.8 CCCCS(=O)(=O)[O-] Amb9871422 [0,1,0,0,0,0|1,0,1]=3 3346 B7R0.8 CCCCS(N)(=O)=O Amb1132715 [0,1,0,0,0,0|1,0,1]=3 3347 B7R0.8 CCCC[B-](F)(F)F Amb20242702 [0,1,0,0,0,0|3,0,0]=4 3348 B7R0.8 CCCC[N+](C)(C)C Amb8384382 [0,1,0,0,0,0|3,0,0]=4 3349 B7R0.8 CCCC[Si](C)(C)C Amb22360219 [0,1,0,0,0,0|2,1,0]=4 3350 B7R0.8 CCCC[Si](C)(C)Cl Amb2685633 [0,1,0,0,0,0|2,1,0]=4 3351 B7R0.8 CCCC[Si](C)(Cl)Cl Amb19893670 [0,1,0,0,0,0|2,1,0]=4 3352 B7R0.8 CCCC[Si](Cl)(Cl)Cl Amb19893673 [0,1,0,0,0,0|2,1,0]=4 3353 B7R0.8 CCCC[Sn](O)(O)Cl Amb19894194 [0,1,0,0,0,0|1,0,1]=3 3354 B7R0.8 CCCNS(=O)(=O)Cl Amb17193915 [0,1,0,0,0,0|2,0,1]=4 3355 B7R0.8 CCCNS(=O)(=O)F Amb28400472 [0,1,0,0,0,0|2,0,1]=4 3356 B7R0.8 CCCNS(=O)(=O)O Amb27430064 [0,1,0,0,0,0|2,0,0]=3 3357 B7R0.8 CCCNS(C)(=N)=O Amb35687835 [0,1,0,0,0,0|3,0,0]=4 3358 B7R0.8 CCCNS(C)(=N)=O Amb35789640 [0,1,0,0,0,0|3,0,0]=4 3359 B7R0.8 CCCNS(N)(=O)=O Amb22232401 [0,1,0,0,0,0|2,0,1]=4 3360 B7R0.8 CCCNS(N)(=O)=O Amb33719190 [0,1,0,0,0,0|2,0,1]=4 3361 B7R0.8 CCCNS(N)(=O)=O Amb33719199 [0,1,0,0,0,0|2,0,1]=4 3362 B7R0.8 CCCNS([NH-])(=O)=O Amb30982056 [0,1,0,0,0,0|2,0,1]=4 3363 B7R0.8 CCCNS([NH-])(O)O Amb22007976 [0,1,0,0,0,0|2,0,1]=4 3364 B7R0.8 CCCOP(=O)(O)O Amb27789994 [0,1,0,0,0,0|2,0,0]=3 3365 B7R0.8 CCCOP(C)(=O)O Amb24553958 [0,1,0,0,0,0|2,0,0]=3 3366 B7R0.8 CCCOS(=O)(=O)Cl Amb22739823 [0,1,0,0,0,0|2,0,1]=4 3367 B7R0.8 CCCOS(=O)(=O)[O-] Amb22641874 [0,1,0,0,0,0|2,0,1]=4 3368 B7R0.8 CCCOS(C)(=O)=O Amb22388704 [0,1,0,0,0,0|2,0,1]=4 3369 B7R0.8 CCCOS(N)(=O)=O Amb33055018 [0,1,0,0,0,0|2,0,1]=4 3370 B7R0.8 CCCSS(C)(=O)=O Amb17619610 [0,1,0,0,0,0|2,0,1]=4 3371 B7R0.8 CCNCC(C)(C)O Amb17138366 [0,1,0,0,0,0|2,0,1]=4 3372 B7R0.8 CCNCC(C)(C)O Amb4012780 [0,1,0,0,0,0|2,0,1]=4 3373 B7R0.8 CCOCC(C)(C)O Amb17940394 [0,1,0,0,0,0|2,0,1]=4 3374 B7R0.8 CCOCP(=O)(Cl)Cl Amb26515772 [0,1,0,0,0,0|3,0,0]=4 3375 B7R0.8 CCOCS(=O)(=O)Cl Amb32715200 [0,1,0,0,0,0|2,0,1]=4 3376 B7R0.8 CCOCS(N)(=O)=O Amb32715343 [0,1,0,0,0,0|2,0,1]=4 3377 B7R0.8 CCSCC(C)(C)O Amb24757304 [0,1,0,0,0,0|2,0,1]=4 3378 B7R0.8 CC\C=C\P(=O)(O)O Amb22388769 [0,1,0,0,0,0|1,0,2]=4 3379 B7R0.8 CNCCC(C)(C)O Amb10607875 [0,1,0,0,0,0|2,0,1]=4 3380 B7R0.8 CNCCP(=O)(O)O Amb27751957 [0,1,0,0,0,0|2,0,0]=3 3381 B7R0.8 CNCCS(=O)(=O)F Amb32675095 [0,1,0,0,0,0|2,0,1]=4 3382 B7R0.8 CNCCS(=O)(=O)O Amb6825625 [0,1,0,0,0,0|2,0,0]=3 3383 B7R0.8 CNCCS(=O)(=O)[O-] Amb21858847 [0,1,0,0,0,0|2,0,1]=4 3384 B7R0.8 CNCCS(C)(=O)=O Amb33535362 [0,1,0,0,0,0|2,0,1]=4 3385 B7R0.8 CNCCS(C)(=O)=O Amb33801511 [0,1,0,0,0,0|2,0,1]=4 3386 B7R0.8 CNCCS(N)(=O)=O Amb18292520 [0,1,0,0,0,0|2,0,1]=4 3387 B7R0.8 CNCCS(N)(=O)=O Amb30585088 [0,1,0,0,0,0|2,0,1]=4 3388 B7R0.8 COCCC(C)(C)O Amb25940052 [0,1,0,0,0,0|2,0,1]=4 3389 B7R0.8 COCCS(=O)(=O)Br Amb23555508 [0,1,0,0,0,0|2,0,1]=4 3390 B7R0.8 COCCS(=O)(=O)Cl Amb9271774 [0,1,0,0,0,0|2,0,1]=4 3391 B7R0.8 COCCS(=O)(=O)F Amb19514633 [0,1,0,0,0,0|2,0,1]=4 3392 B7R0.8 COCCS(=O)(=O)[O-] Amb22496266 [0,1,0,0,0,0|2,0,1]=4 3393 B7R0.8 COCCS(C)(=N)=O Amb33457324 [0,1,0,0,0,0|3,0,0]=4 3394 B7R0.8 COCCS(C)(=N)=O Amb33483244 [0,1,0,0,0,0|3,0,0]=4 3395 B7R0.8 COCCS(N)(=O)=O Amb9316792 [0,1,0,0,0,0|2,0,1]=4 3396 B7R0.8 COCC[S@](C)(=N)=O Amb33744012 [0,1,0,0,0,0|3,0,0]=4 3397 B7R0.8 CP(=O)(O)CCC=O Amb27643443 [0,1,0,0,0,0|2,0,1]=4 3398 B7R0.8 CP(=O)(O)CCCN Amb634789 [0,1,0,0,0,0|2,0,0]=3 3399 B7R0.8 CP(=O)(O)NCCO Amb27652858 [0,1,0,0,0,0|3,0,0]=4 3400 B7R0.8 CP(=O)(O)OCCO Amb27397295 [0,1,0,0,0,0|3,0,0]=4 3401 B7R0.8 CP(=O)(O)SCCN Amb27227981 [0,1,0,0,0,0|3,0,0]=4 3402 B7R0.8 CP(C)(=O)CCCCl Amb27947970 [0,1,0,0,0,0|3,0,0]=4 3403 B7R0.8 CP(C)(=O)CCCN Amb24481153 [0,1,0,0,0,0|3,0,0]=4 3404 B7R0.8 CP(C)(=O)CCCN Amb33620909 [0,1,0,0,0,0|3,0,0]=4 3405 B7R0.8 CS(=N)(=O)CCCO Amb35788140 [0,1,0,0,0,0|3,0,0]=4 3406 B7R0.8 CS(=O)(=O)CCCBr Amb18320185 [0,1,0,0,0,0|2,0,1]=4 3407 B7R0.8 CS(=O)(=O)CCCCl Amb18034011 [0,1,0,0,0,0|2,0,1]=4 3408 B7R0.8 CS(=O)(=O)CCCI Amb20623053 [0,1,0,0,0,0|2,0,1]=4 3409 B7R0.8 CS(=O)(=O)CCCN Amb10609368 [0,1,0,0,0,0|2,0,1]=4 3410 B7R0.8 CS(=O)(=O)CCCN Amb6718802 [0,1,0,0,0,0|2,0,1]=4 3411 B7R0.8 CS(=O)(=O)CCCO Amb10608209 [0,1,0,0,0,0|2,0,1]=4 3412 B7R0.8 CS(=O)(=O)CCCS Amb25092985 [0,1,0,0,0,0|2,0,1]=4 3413 B7R0.8 CS(=O)(=O)CCC[NH3+] Amb13883038 [0,1,0,0,0,0|2,0,1]=4 3414 B7R0.8 CSCCC(C)(C)O Amb24483080 [0,1,0,0,0,0|2,0,1]=4 3415 B7R0.8 CSCCS(=O)(=O)Cl Amb27474654 [0,1,0,0,0,0|2,0,1]=4 3416 B7R0.8 CSCCS(=O)(=O)F Amb33053731 [0,1,0,0,0,0|2,0,1]=4 3417 B7R0.8 CSCCS(C)(=O)=O Amb28049319 [0,1,0,0,0,0|2,0,1]=4 3418 B7R0.8 CSCCS(N)(=O)=O Amb27622120 [0,1,0,0,0,0|2,0,1]=4 3419 B7R0.8 C[Si](C)(O)CCCN Amb27831951 [0,1,0,0,0,0|2,1,0]=4 3420 B7R0.8 NCCCP(=O)(O)O Amb2714831 [0,1,0,0,0,0|2,0,0]=3 3421 B7R0.8 NCCCS(=O)(=O)F Amb33456377 [0,1,0,0,0,0|2,0,1]=4 3422 B7R0.8 NCCCS(=O)(=O)F Amb33463754 [0,1,0,0,0,0|2,0,1]=4 3423 B7R0.8 NCCCS(=O)(=O)O Amb3940464 [0,1,0,0,0,0|2,0,0]=3 3424 B7R0.8 NCCCS(=O)(=O)S Amb28436886 [0,1,0,0,0,0|2,0,1]=4 3425 B7R0.8 NCCCS(=O)(=O)[O-] Amb22002055 [0,1,0,0,0,0|2,0,1]=4 3426 B7R0.8 NCCCS(N)(=O)=O Amb10609522 [0,1,0,0,0,0|2,0,1]=4 3427 B7R0.8 NCCCS(N)(=O)=O Amb10609652 [0,1,0,0,0,0|2,0,1]=4 3428 B7R0.8 NCCC[Si](O)(O)O Amb19894212 [0,1,0,0,0,0|1,1,1]=4 3429 B7R0.8 NCCOP(=O)(O)O Amb3941645 [0,1,0,0,0,0|3,0,0]=4 3430 B7R0.8 NCCOS(=O)(=O)O Amb8513052 [0,1,0,0,0,0|3,0,0]=4 3431 B7R0.8 NCCO[P-](=O)(=O)O Amb27394652 [0,1,0,0,0,0|3,0,0]=4 3432 B7R0.8 NCCSS(=O)(=O)O Amb534608 [0,1,0,0,0,0|3,0,0]=4 3433 B7R0.8 NS(=O)(=O)CCCBr Amb19374293 [0,1,0,0,0,0|2,0,1]=4 3434 B7R0.8 NS(=O)(=O)CCCCl Amb9518876 [0,1,0,0,0,0|2,0,1]=4 3435 B7R0.8 NS(=O)(=O)CCCF Amb19148047 [0,1,0,0,0,0|2,0,1]=4 3436 B7R0.8 NS(=O)(=O)CCCO Amb27867209 [0,1,0,0,0,0|2,0,1]=4 3437 B7R0.8 O=P(O)(O)CCCCl Amb22388825 [0,1,0,0,0,0|2,0,0]=3 3438 B7R0.8 O=P(O)(O)CCCO Amb28207371 [0,1,0,0,0,0|2,0,0]=3 3439 B7R0.8 O=P(O)(O)OCCO Amb26068184 [0,1,0,0,0,0|3,0,0]=4 3440 B7R0.8 O=S(=O)(Br)CCCBr Amb27982877 [0,1,0,0,0,0|2,0,1]=4 3441 B7R0.8 O=S(=O)(Cl)CCCBr Amb19338138 [0,1,0,0,0,0|2,0,1]=4 3442 B7R0.8 O=S(=O)(Cl)CCCCl Amb3939749 [0,1,0,0,0,0|2,0,1]=4 3443 B7R0.8 O=S(=O)(Cl)CCCF Amb19374916 [0,1,0,0,0,0|2,0,1]=4 3444 B7R0.8 O=S(=O)(Cl)CCCO Amb20667916 [0,1,0,0,0,0|2,0,1]=4 3445 B7R0.8 O=S(=O)(F)CCCBr Amb32716936 [0,1,0,0,0,0|2,0,1]=4 3446 B7R0.8 O=S(=O)(F)CCCCl Amb13952588 [0,1,0,0,0,0|2,0,1]=4 3447 B7R0.8 O=S(=O)(F)CCCF Amb19374915 [0,1,0,0,0,0|2,0,1]=4 3448 B7R0.8 O=S(=O)(F)CCCO Amb24739291 [0,1,0,0,0,0|2,0,1]=4 3449 B7R0.8 O=S(=O)(O)CCCBr Amb27391135 [0,1,0,0,0,0|2,0,0]=3 3450 B7R0.8 O=S(=O)(O)CCCI Amb29859913 [0,1,0,0,0,0|2,0,0]=3 3451 B7R0.8 O=S(=O)(O)CCCS Amb20620653 [0,1,0,0,0,0|2,0,0]=3 3452 B7R0.8 O=S(=O)(O)OCCCl Amb25064355 [0,1,0,0,0,0|3,0,0]=4 3453 B7R0.8 O=S(=O)(O)SCCCl Amb27233401 [0,1,0,0,0,0|3,0,0]=4 3454 B7R0.8 O=S(=O)(O)SCCO Amb27594594 [0,1,0,0,0,0|3,0,0]=4 3455 B7R0.8 O=S(=O)([O-])CCCBr Amb32646077 [0,1,0,0,0,0|2,0,1]=4 3456 B7R0.8 O=S(=O)([O-])CCCBr Amb6366415 [0,1,0,0,0,0|2,0,1]=4 3457 B7R0.8 O=S(=O)([O-])CCCO Amb22002047 [0,1,0,0,0,0|2,0,1]=4 3458 B7R0.8 O=S(=O)([O-])CCCS Amb2689070 [0,1,0,0,0,0|2,0,1]=4 3459 B7R1.2 C=C1CCC(Br)C1 Amb25135798 [0,0,0,1,0,0|3,0,0]=4 3460 B7R1.2 C=C1COC(C)C1 Amb35695393 [0,0,0,1,0,0|3,0,0]=4 3461 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [0,0,0,1,0,0|1,0,1]=3 3462 B7R1.2 CC1=CC(=O)CN1 Amb27390872 [0,0,0,1,0,0|2,0,1]=4 3463 B7R1.2 CC1=CC(=O)CO1 Amb22372192 [0,0,0,1,0,0|2,0,1]=4 3464 B7R1.2 CC1=CC(=O)NC1 Amb24479892 [0,0,0,1,0,0|2,0,1]=4 3465 B7R1.2 CC1=CC(=O)OC1 Amb22002703 [0,0,0,1,0,0|2,0,1]=4 3466 B7R1.2 CC1=CC(C)CC1 Amb24479860 [0,0,0,1,0,0|2,0,0]=3 3467 B7R1.2 CC1=CC(C)NC1 Amb17593062 [0,0,0,1,0,0|3,0,0]=4 3468 B7R1.2 CC1=CC(N)CC1 Amb28186103 [0,0,0,1,0,0|3,0,0]=4 3469 B7R1.2 CC1=CCC(O)O1 Amb27241898 [0,0,0,1,0,0|2,0,1]=4 3470 B7R1.2 CC1=NC(=O)CS1 Amb27838191 [0,0,0,1,0,0|2,0,1]=4 3471 B7R1.2 CC1=NC(C)CN1 Amb22733191 [0,0,0,1,0,0|3,0,0]=4 3472 B7R1.2 CC1=NC(C)CO1 Amb9805507 [0,0,0,1,0,0|3,0,0]=4 3473 B7R1.2 CC1=NCC(=O)N1 Amb27827848 [0,0,0,1,0,0|2,0,1]=4 3474 B7R1.2 CC1=NCC(=O)O1 Amb27783804 [0,0,0,1,0,0|1,0,1]=3 3475 B7R1.2 CC1=NCC(C)S1 Amb26396899 [0,0,0,1,0,0|2,1,0]=4 3476 B7R1.2 CC1=NNC(=O)O1 Amb19957998 [0,0,0,1,0,0|2,0,1]=4 3477 B7R1.2 CC1=NSC(=O)O1 Amb22395221 [0,0,0,1,0,0|2,0,1]=4 3478 B7R1.2 CC1C=CC(=O)C1 Amb27260718 [0,0,0,1,0,0|1,0,2]=4 3479 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [0,0,0,1,0,0|0,0,2]=3 3480 B7R1.2 CC1C=CC(=O)S1 Amb25746305 [0,0,0,1,0,0|0,1,2]=4 3481 B7R1.2 CC1CC(=O)CN1 Amb28349308 [0,0,0,1,0,0|2,0,0]=3 3482 B7R1.2 CC1CC(=O)CO1 Amb25888380 [0,0,0,1,0,0|2,0,0]=3 3483 B7R1.2 CC1CC(=O)CS1 Amb23598370 [0,0,0,1,0,0|2,0,0]=3 3484 B7R1.2 CC1CC(=O)NN1 Amb493880 [0,0,0,1,0,0|3,0,0]=4 3485 B7R1.2 CC1CC(O)CN1 Amb33329377 [0,0,0,1,0,0|2,0,1]=4 3486 B7R1.2 CC1CC(O)CN1 Amb33545349 [0,0,0,1,0,0|2,0,1]=4 3487 B7R1.2 CC1CC(O)CO1 Amb28430079 [0,0,0,1,0,0|2,0,1]=4 3488 B7R1.2 CC1CCC(=O)C1 Amb8513672 [0,0,0,1,0,0|1,0,0]=2 3489 B7R1.2 CC1CCC(=O)N1 Amb19267101 [0,0,0,1,0,0|1,0,0]=2 3490 B7R1.2 CC1CCC(=O)O1 Amb6298321 [0,0,0,1,0,0|0,0,0]=1 3491 B7R1.2 CC1CCC(=O)S1 Amb27252897 [0,0,0,1,0,0|0,1,0]=2 3492 B7R1.2 CC1CCC(=S)N1 Amb27849283 [0,0,0,1,0,0|1,1,0]=3 3493 B7R1.2 CC1CCC(Br)C1 Amb26339047 [0,0,0,1,0,0|2,0,1]=4 3494 B7R1.2 CC1CCC(C)N1 Amb20626165 [0,0,0,1,0,0|2,0,1]=4 3495 B7R1.2 CC1CCC(C)N1 Amb5716833 [0,0,0,1,0,0|2,0,1]=4 3496 B7R1.2 CC1CCC(Cl)C1 Amb25129430 [0,0,0,1,0,0|2,0,1]=4 3497 B7R1.2 CC1CCC(I)C1 Amb27402602 [0,0,0,1,0,0|2,0,1]=4 3498 B7R1.2 CC1CCC(N)C1 Amb20669202 [0,0,0,1,0,0|2,0,1]=4 3499 B7R1.2 CC1CCC(N)C1 Amb24062164 [0,0,0,1,0,0|2,0,1]=4 3500 B7R1.2 CC1CCC(O)C1 Amb4605822 [0,0,0,1,0,0|1,0,1]=3 3501 B7R1.2 CC1CCC(O)N1 Amb28067624 [0,0,0,1,0,0|1,0,1]=3 3502 B7R1.2 CC1CCC(S)C1 Amb25829470 [0,0,0,1,0,0|1,1,1]=4 3503 B7R1.2 CC1CCN(N)C1 Amb24385963 [0,0,0,1,0,0|3,0,0]=4 3504 B7R1.2 CC1CN=C(Br)S1 Amb27476169 [0,0,0,1,0,0|2,1,0]=4 3505 B7R1.2 CC1CN=C(Cl)O1 Amb27959043 [0,0,0,1,0,0|2,0,0]=3 3506 B7R1.2 CC1CN=C(N)N1 Amb30584684 [0,0,0,1,0,0|3,0,0]=4 3507 B7R1.2 CC1CN=C(N)O1 Amb26657342 [0,0,0,1,0,0|2,0,0]=3 3508 B7R1.2 CC1CN=C(N)O1 Amb33611634 [0,0,0,1,0,0|2,0,0]=3 3509 B7R1.2 CC1CN=C(N)S1 Amb6029194 [0,0,0,1,0,0|2,1,0]=4 3510 B7R1.2 CC1CNC(=N)S1 Amb24684074 [0,0,0,1,0,0|2,1,0]=4 3511 B7R1.2 CC1CNC(=O)C1 Amb10608004 [0,0,0,1,0,0|2,0,0]=3 3512 B7R1.2 CC1CNC(=O)N1 Amb17506853 [0,0,0,1,0,0|2,0,0]=3 3513 B7R1.2 CC1CNC(=O)O1 Amb19651732 [0,0,0,1,0,0|1,0,0]=2 3514 B7R1.2 CC1CNC(=S)N1 Amb2724258 [0,0,0,1,0,0|2,1,0]=4 3515 B7R1.2 CC1CNC(=S)S1 Amb17845151 [0,0,0,1,0,0|1,2,0]=4 3516 B7R1.2 CC1COC(=O)C1 Amb22231914 [0,0,0,1,0,0|2,0,0]=3 3517 B7R1.2 CC1COC(=O)N1 Amb19517037 [0,0,0,1,0,0|2,0,0]=3 3518 B7R1.2 CC1COC(=O)O1 Amb8513300 [0,0,0,1,0,0|1,0,0]=2 3519 B7R1.2 CC1COC(C)O1 Amb24074042 [0,0,0,1,0,0|2,0,1]=4 3520 B7R1.2 CC1COC(N)=N1 Amb23449369 [0,0,0,1,0,0|3,0,0]=4 3521 B7R1.2 CC1COC(O)C1 Amb28050442 [0,0,0,1,0,0|2,0,1]=4 3522 B7R1.2 CC1COS(=O)O1 Amb22346070 [0,0,0,1,0,0|2,0,0]=3 3523 B7R1.2 CC1CSC(=O)N1 Amb28320497 [0,0,0,1,0,0|2,0,0]=3 3524 B7R1.2 CC1CSC(=S)N1 Amb25849326 [0,0,0,1,0,0|2,1,0]=4 3525 B7R1.2 CC1CSC(Br)=N1 Amb26888125 [0,0,0,1,0,0|3,0,0]=4 3526 B7R1.2 CC1NC(=O)CS1 Amb27806202 [0,0,0,1,0,0|2,0,0]=3 3527 B7R1.2 CC1NCC(=O)N1 Amb28456791 [0,0,0,1,0,0|2,0,0]=3 3528 B7R1.2 CC1OC(=O)CS1 Amb25314322 [0,0,0,1,0,0|1,0,0]=2 3529 B7R1.2 CN1CCC(=O)C1 Amb22236123 [0,0,0,1,0,0|2,0,0]=3 3530 B7R1.2 CN1CCC(=O)C1 Amb8947873 [0,0,0,1,0,0|2,0,0]=3 3531 B7R1.2 CN1CCC(=O)N1 Amb24064860 [0,0,0,1,0,0|2,0,0]=3 3532 B7R1.2 CN1CCC(N)=N1 Amb28827647 [0,0,0,1,0,0|3,0,0]=4 3533 B7R1.2 CN1CCC(O)C1 Amb32652719 [0,0,0,1,0,0|2,0,1]=4 3534 B7R1.2 CN1CCC(O)C1 Amb8384297 [0,0,0,1,0,0|2,0,1]=4 3535 B7R1.2 CN1CC[C@@H](O)C1 Amb8386825 [0,0,0,1,0,0|2,0,1]=4 3536 B7R1.2 CN1CC[C@H](O)C1 Amb10070789 [0,0,0,1,0,0|2,0,1]=4 3537 B7R1.2 CP1CC[C@H](O)C1 Amb27452496 [0,0,0,1,0,0|2,0,1]=4 3538 B7R1.2 C[C@@H]1C=CC(=O)C1 Amb28199837 [0,0,0,1,0,0|1,0,2]=4 3539 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [0,0,0,1,0,0|1,0,0]=2 3540 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [0,0,0,1,0,0|1,0,0]=2 3541 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [0,0,0,1,0,0|0,0,0]=1 3542 B7R1.2 C[C@@H]1CC[C@@H](Br)C1 Amb27791803 [0,0,0,1,0,0|2,0,1]=4 3543 B7R1.2 C[C@@H]1CC[C@@H](C)C1 Amb25176920 [0,0,0,1,0,0|2,0,1]=4 3544 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb17613372 [0,0,0,1,0,0|2,0,1]=4 3545 B7R1.2 C[C@@H]1CC[C@@H](C)N1 Amb22366804 [0,0,0,1,0,0|2,0,1]=4 3546 B7R1.2 C[C@@H]1CC[C@H](O)C1 Amb27853110 [0,0,0,1,0,0|1,0,1]=3 3547 B7R1.2 C[C@@H]1CN=C(N)O1 Amb33742469 [0,0,0,1,0,0|2,0,0]=3 3548 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [0,0,0,1,0,0|2,0,0]=3 3549 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [0,0,0,1,0,0|1,0,0]=2 3550 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [0,0,0,1,0,0|2,0,0]=3 3551 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [0,0,0,1,0,0|2,0,0]=3 3552 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [0,0,0,1,0,0|1,0,0]=2 3553 B7R1.2 C[C@@H]1COC(O)C1 Amb27399504 [0,0,0,1,0,0|2,0,1]=4 3554 B7R1.2 C[C@@H]1COS(=O)O1 Amb27979548 [0,0,0,1,0,0|2,0,0]=3 3555 B7R1.2 C[C@@H]1CO[C@@H](O)C1 Amb27422487 [0,0,0,1,0,0|2,0,1]=4 3556 B7R1.2 C[C@@H]1C[C@@H](O)CN1 Amb22746400 [0,0,0,1,0,0|2,0,1]=4 3557 B7R1.2 C[C@@H]1C[C@H](O)CN1 Amb22886268 [0,0,0,1,0,0|2,0,1]=4 3558 B7R1.2 C[C@H]1C=CC(=O)C1 Amb27262978 [0,0,0,1,0,0|1,0,2]=4 3559 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [0,0,0,1,0,0|0,0,0]=1 3560 B7R1.2 C[C@H]1CC[C@@H](C)N1 Amb10567751 [0,0,0,1,0,0|2,0,1]=4 3561 B7R1.2 C[C@H]1CC[C@H](C)C1 Amb22747863 [0,0,0,1,0,0|2,0,1]=4 3562 B7R1.2 C[C@H]1CC[C@H](C)N1 Amb26580691 [0,0,0,1,0,0|2,0,1]=4 3563 B7R1.2 C[C@H]1CN=C(N)O1 Amb33744016 [0,0,0,1,0,0|2,0,0]=3 3564 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [0,0,0,1,0,0|2,0,0]=3 3565 B7R1.2 C[C@H]1CNC(=O)N1 Amb27413051 [0,0,0,1,0,0|2,0,0]=3 3566 B7R1.2 C[C@H]1CNC(=S)O1 Amb27843992 [0,0,0,1,0,0|1,1,0]=3 3567 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [0,0,0,1,0,0|2,0,0]=3 3568 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [0,0,0,1,0,0|2,0,0]=3 3569 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [0,0,0,1,0,0|1,0,0]=2 3570 B7R1.2 C[C@H]1C[C@@H](O)CN1 Amb33872130 [0,0,0,1,0,0|2,0,1]=4 3571 B7R1.2 C[C@H]1C[C@@H](O)CO1 Amb28245786 [0,0,0,1,0,0|2,0,1]=4 3572 B7R1.2 C[C@H]1C[C@@H](O)CS1 Amb27662171 [0,0,0,1,0,0|2,0,1]=4 3573 B7R1.2 C[C@H]1C[C@H](O)CN1 Amb33801108 [0,0,0,1,0,0|2,0,1]=4 3574 B7R1.2 ClC1=CC(Br)CC1 Amb27232977 [0,0,0,1,0,0|3,0,0]=4 3575 B7R1.2 NC1=CC(=O)CC1 Amb9753541 [0,0,0,1,0,0|2,0,1]=4 3576 B7R1.2 NC1CCC(=O)C1 Amb22494268 [0,0,0,1,0,0|2,0,0]=3 3577 B7R1.2 NC1CCC(=O)N1 Amb24480433 [0,0,0,1,0,0|2,0,0]=3 3578 B7R1.2 NC1CCC(=O)O1 Amb17593085 [0,0,0,1,0,0|1,0,0]=2 3579 B7R1.2 NC1CCC(O)C1 Amb18561405 [0,0,0,1,0,0|2,0,1]=4 3580 B7R1.2 NC1CCC(O)C1 Amb19958405 [0,0,0,1,0,0|2,0,1]=4 3581 B7R1.2 NC1CCS(=O)C1 Amb19149072 [0,0,0,1,0,0|3,0,0]=4 3582 B7R1.2 NC1CCS(=O)C1 Amb25133789 [0,0,0,1,0,0|3,0,0]=4 3583 B7R1.2 NC1CNC(=O)C1 Amb17760661 [0,0,0,1,0,0|3,0,0]=4 3584 B7R1.2 NC1CNC(=O)C1 Amb33544169 [0,0,0,1,0,0|3,0,0]=4 3585 B7R1.2 NC1COC(=O)C1 Amb30594428 [0,0,0,1,0,0|3,0,0]=4 3586 B7R1.2 NC1COC(=O)C1 Amb9782136 [0,0,0,1,0,0|3,0,0]=4 3587 B7R1.2 NC1CSC(=O)N1 Amb27596093 [0,0,0,1,0,0|3,0,0]=4 3588 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Amb10066961 [0,0,0,1,0,0|2,0,1]=4 3589 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Amb16233749 [0,0,0,1,0,0|2,0,1]=4 3590 B7R1.2 N[C@@H]1CC[C@H](O)C1 Amb10066973 [0,0,0,1,0,0|2,0,1]=4 3591 B7R1.2 N[C@@H]1CC[C@H](O)C1 Amb22406236 [0,0,0,1,0,0|2,0,1]=4 3592 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [0,0,0,1,0,0|3,0,0]=4 3593 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [0,0,0,1,0,0|3,0,0]=4 3594 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [0,0,0,1,0,0|3,0,0]=4 3595 B7R1.2 N[C@@H]1COC(=O)C1 Amb16233747 [0,0,0,1,0,0|3,0,0]=4 3596 B7R1.2 N[C@@H]1COC(=O)C1 Amb26477774 [0,0,0,1,0,0|3,0,0]=4 3597 B7R1.2 N[C@H]1CCC(=O)N1 Amb27482175 [0,0,0,1,0,0|2,0,0]=3 3598 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb10066971 [0,0,0,1,0,0|2,0,1]=4 3599 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb22274622 [0,0,0,1,0,0|2,0,1]=4 3600 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb34916039 [0,0,0,1,0,0|2,0,1]=4 3601 B7R1.2 N[C@H]1CC[C@H](O)C1 Amb10066972 [0,0,0,1,0,0|2,0,1]=4 3602 B7R1.2 N[C@H]1CC[C@H](O)C1 Amb22386861 [0,0,0,1,0,0|2,0,1]=4 3603 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [0,0,0,1,0,0|3,0,0]=4 3604 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [0,0,0,1,0,0|3,0,0]=4 3605 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [0,0,0,1,0,0|3,0,0]=4 3606 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [0,0,0,1,0,0|3,0,0]=4 3607 B7R1.2 O=C1C=C(Br)CC1 Amb23399816 [0,0,0,1,0,0|2,0,1]=4 3608 B7R1.2 O=C1C=C(Cl)CC1 Amb9753542 [0,0,0,1,0,0|2,0,1]=4 3609 B7R1.2 O=C1C=C(O)CC1 Amb9901808 [0,0,0,1,0,0|2,0,1]=4 3610 B7R1.2 O=C1C=CC(Br)O1 Amb22001603 [0,0,0,1,0,0|1,0,2]=4 3611 B7R1.2 O=C1C=CC(Cl)O1 Amb27760027 [0,0,0,1,0,0|1,0,2]=4 3612 B7R1.2 O=C1C=CC(F)O1 Amb27778280 [0,0,0,1,0,0|1,0,2]=4 3613 B7R1.2 O=C1C=CC(O)O1 Amb24544763 [0,0,0,1,0,0|1,0,2]=4 3614 B7R1.2 O=C1CC(F)CO1 Amb24431109 [0,0,0,1,0,0|3,0,0]=4 3615 B7R1.2 O=C1CC(I)CO1 Amb27401189 [0,0,0,1,0,0|3,0,0]=4 3616 B7R1.2 O=C1CC(O)CN1 Amb19958404 [0,0,0,1,0,0|3,0,0]=4 3617 B7R1.2 O=C1CC(O)CO1 Amb4006296 [0,0,0,1,0,0|3,0,0]=4 3618 B7R1.2 O=C1CC(S)CN1 Amb25685875 [0,0,0,1,0,0|3,0,0]=4 3619 B7R1.2 O=C1CCC(=O)C1 Amb2696524 [0,0,0,1,0,0|2,0,1]=4 3620 B7R1.2 O=C1CCC(=O)N1 Amb2793049 [0,0,0,1,0,0|2,0,1]=4 3621 B7R1.2 O=C1CCC(=O)O1 Amb2793017 [0,0,0,1,0,0|1,0,1]=3 3622 B7R1.2 O=C1CCC(=O)S1 Amb2691584 [0,0,0,1,0,0|1,1,1]=4 3623 B7R1.2 O=C1CCC(=S)N1 Amb28122939 [0,0,0,1,0,0|2,0,1]=4 3624 B7R1.2 O=C1CCC(Br)C1 Amb24334292 [0,0,0,1,0,0|2,0,0]=3 3625 B7R1.2 O=C1CCC(Br)N1 Amb27592181 [0,0,0,1,0,0|2,0,0]=3 3626 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [0,0,0,1,0,0|1,0,0]=2 3627 B7R1.2 O=C1CCC(Cl)C1 Amb26585347 [0,0,0,1,0,0|2,0,0]=3 3628 B7R1.2 O=C1CCC(Cl)O1 Amb27477474 [0,0,0,1,0,0|1,0,0]=2 3629 B7R1.2 O=C1CCC(F)C1 Amb21963553 [0,0,0,1,0,0|2,0,0]=3 3630 B7R1.2 O=C1CCC(O)C1 Amb22057378 [0,0,0,1,0,0|2,0,0]=3 3631 B7R1.2 O=C1CCC(O)O1 Amb22740957 [0,0,0,1,0,0|1,0,0]=2 3632 B7R1.2 O=C1CCS(=O)C1 Amb27199097 [0,0,0,1,0,0|3,0,0]=4 3633 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [0,0,0,1,0,0|2,0,0]=3 3634 B7R1.2 O=C1CC[C@@H](O)N1 Amb27458284 [0,0,0,1,0,0|2,0,0]=3 3635 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [0,0,0,1,0,0|2,0,0]=3 3636 B7R1.2 O=C1CC[C@H](O)N1 Amb27881572 [0,0,0,1,0,0|2,0,0]=3 3637 B7R1.2 O=C1CNC(=O)O1 Amb2695392 [0,0,0,1,0,0|2,0,1]=4 3638 B7R1.2 O=C1CNC(=S)O1 Amb27393154 [0,0,0,1,0,0|2,0,1]=4 3639 B7R1.2 O=C1CNC(S)S1 Amb24460897 [0,0,0,1,0,0|2,1,0]=4 3640 B7R1.2 O=C1COC(=O)O1 Amb27837383 [0,0,0,1,0,0|2,0,1]=4 3641 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [0,0,0,1,0,0|3,0,0]=4 3642 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [0,0,0,1,0,0|3,0,0]=4 3643 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [0,0,0,1,0,0|3,0,0]=4 3644 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [0,0,0,1,0,0|3,0,0]=4 3645 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [0,0,0,1,0,0|3,0,0]=4 3646 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [0,0,0,1,0,0|3,0,0]=4 3647 B7R1.2 O=C1OC(O)CS1 Amb28066979 [0,0,0,1,0,0|2,0,0]=3 3648 B7R1.2 O=C1OCC(Cl)O1 Amb10842117 [0,0,0,1,0,0|2,0,0]=3 3649 B7R1.2 O=C1OCC(F)O1 Amb10841016 [0,0,0,1,0,0|2,0,0]=3 3650 B7R1.2 O=S1CCC(Br)C1 Amb27872345 [0,0,0,1,0,0|3,0,0]=4 3651 B7R1.2 O=S1CCC(O)C1 Amb26600157 [0,0,0,1,0,0|3,0,0]=4 3652 B7R1.2 O=S1CC[C@@H](O)C1 Amb28191911 [0,0,0,1,0,0|3,0,0]=4 3653 B7R1.2 OC1C=C(Br)CC1 Amb8391790 [0,0,0,1,0,0|3,0,0]=4 3654 B7R1.2 OC1C=C(I)CC1 Amb26903566 [0,0,0,1,0,0|3,0,0]=4 3655 B7R1.2 OC1CCC(O)C1 Amb8513837 [0,0,0,1,0,0|2,0,1]=4 3656 B7R1.2 OC1CCC(O)O1 Amb4018883 [0,0,0,1,0,0|1,0,2]=4 3657 B7R1.2 OC1CCN(O)C1 Amb27430271 [0,0,0,1,0,0|3,0,0]=4 3658 B7R1.2 O[C@@H]1C=C(Br)CC1 Amb24479014 [0,0,0,1,0,0|3,0,0]=4 3659 B7R1.2 O[C@@H]1CC[C@@H](O)C1 Amb24519755 [0,0,0,1,0,0|2,0,1]=4 3660 B7R1.2 O[C@H]1C=C(Br)CC1 Amb27213930 [0,0,0,1,0,0|3,0,0]=4 3661 B7R1.2 O[C@H]1CC[C@@H](O)C1 Amb26035335 [0,0,0,1,0,0|2,0,1]=4 3662 B7R1.2 O[C@H]1CC[C@H](O)C1 Amb26400686 [0,0,0,1,0,0|2,0,1]=4 3663 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [0,0,0,1,0,0|3,0,0]=4 3664 B7R1.3 BrC1=CCCCC1 Amb21856761 [0,0,0,1,0,0|2,0,0]=3 3665 B7R1.3 BrC1=CCCCO1 Amb24322651 [0,0,0,1,0,0|1,0,1]=3 3666 B7R1.3 BrC1=CCCNC1 Amb27173423 [0,0,0,1,0,0|3,0,0]=4 3667 B7R1.3 BrC1=CCCNC1 Amb32651839 [0,0,0,1,0,0|3,0,0]=4 3668 B7R1.3 BrC1=CCNCC1 Amb24317585 [0,0,0,1,0,0|3,0,0]=4 3669 B7R1.3 BrC1=CCNCC1 Amb33189234 [0,0,0,1,0,0|3,0,0]=4 3670 B7R1.3 BrC1=CCOCC1 Amb21964919 [0,0,0,1,0,0|3,0,0]=4 3671 B7R1.3 BrC1=CCSCC1 Amb22229691 [0,0,0,1,0,0|3,0,0]=4 3672 B7R1.3 BrC1=COCCC1 Amb24322600 [0,0,0,1,0,0|3,0,0]=4 3673 B7R1.3 BrC1=COCCO1 Amb24322806 [0,0,0,1,0,0|2,0,1]=4 3674 B7R1.3 BrC1CCCCC1 Amb3940351 [0,0,0,1,0,0|2,0,1]=4 3675 B7R1.3 BrC1CCCCN1 Amb8629038 [0,0,0,1,0,0|2,0,1]=4 3676 B7R1.3 BrC1CCCCO1 Amb24322575 [0,0,0,1,0,0|1,0,1]=3 3677 B7R1.3 BrC1COCCO1 Amb24322807 [0,0,0,1,0,0|2,0,1]=4 3678 B7R1.3 C=C1CCCCC1 Amb8515603 [0,0,0,1,0,0|2,0,0]=3 3679 B7R1.3 C=C1CCCCN1 Amb27801038 [0,0,0,1,0,0|2,0,0]=3 3680 B7R1.3 C=C1CCCCO1 Amb28345156 [0,0,0,1,0,0|1,0,0]=2 3681 B7R1.3 C=C1CCCNC1 Amb19514641 [0,0,0,1,0,0|3,0,0]=4 3682 B7R1.3 C=C1CCCNC1 Amb22059305 [0,0,0,1,0,0|3,0,0]=4 3683 B7R1.3 C=C1CCCOC1 Amb27594580 [0,0,0,1,0,0|3,0,0]=4 3684 B7R1.3 C=C1CCCSC1 Amb22494848 [0,0,0,1,0,0|3,0,0]=4 3685 B7R1.3 C=C1CCNCC1 Amb19514763 [0,0,0,1,0,0|3,0,0]=4 3686 B7R1.3 C=C1CCNCC1 Amb24079604 [0,0,0,1,0,0|3,0,0]=4 3687 B7R1.3 C=C1CCNCC1 Amb33715165 [0,0,0,1,0,0|3,0,0]=4 3688 B7R1.3 C=C1CCOCC1 Amb22000865 [0,0,0,1,0,0|3,0,0]=4 3689 B7R1.3 C=C1OCCCO1 Amb25734089 [0,0,0,1,0,0|2,0,0]=3 3690 B7R1.3 CC1=CCCCC1 Amb8513524 [0,0,0,1,0,0|2,0,0]=3 3691 B7R1.3 CC1=CCCCO1 Amb24480530 [0,0,0,1,0,0|1,0,1]=3 3692 B7R1.3 CC1=CCCNC1 Amb23439963 [0,0,0,1,0,0|3,0,0]=4 3693 B7R1.3 CC1=CCCNC1 Amb25063349 [0,0,0,1,0,0|3,0,0]=4 3694 B7R1.3 CC1=CCNCC1 Amb18639053 [0,0,0,1,0,0|3,0,0]=4 3695 B7R1.3 CC1=CCNCC1 Amb21961140 [0,0,0,1,0,0|3,0,0]=4 3696 B7R1.3 CC1=CCOCC1 Amb24070517 [0,0,0,1,0,0|3,0,0]=4 3697 B7R1.3 CC1=NCCCC1 Amb27459940 [0,0,0,1,0,0|2,0,0]=3 3698 B7R1.3 CC1=NCCCN1 Amb3650246 [0,0,0,1,0,0|3,0,0]=4 3699 B7R1.3 CC1=NCCCS1 Amb25808748 [0,0,0,1,0,0|2,1,0]=4 3700 B7R1.3 CC1=NCCNC1 Amb22755966 [0,0,0,1,0,0|3,0,0]=4 3701 B7R1.3 CC1CCCCN1 Amb2792828 [0,0,0,1,0,0|2,0,1]=4 3702 B7R1.3 CC1CCCCO1 Amb4035049 [0,0,0,1,0,0|1,0,1]=3 3703 B7R1.3 CC1CCCCS1 Amb17666899 [0,0,0,1,0,0|1,1,1]=4 3704 B7R1.3 CC1CCOCO1 Amb17776591 [0,0,0,1,0,0|2,0,1]=4 3705 B7R1.3 CC1CNCCO1 Amb20621613 [0,0,0,1,0,0|2,0,1]=4 3706 B7R1.3 CC1CNCCO1 Amb32666325 [0,0,0,1,0,0|2,0,1]=4 3707 B7R1.3 CC1CNCCO1 Amb9703073 [0,0,0,1,0,0|2,0,1]=4 3708 B7R1.3 CC1NCCCO1 Amb17506191 [0,0,0,1,0,0|2,0,1]=4 3709 B7R1.3 CC1OCCCO1 Amb26557606 [0,0,0,1,0,0|2,0,1]=4 3710 B7R1.3 CN1CCCCC1 Amb8387007 [0,0,0,1,0,0|3,0,0]=4 3711 B7R1.3 C[C@@H]1CCCCN1 Amb22746548 [0,0,0,1,0,0|2,0,1]=4 3712 B7R1.3 C[C@@H]1CCCCN1 Amb3939006 [0,0,0,1,0,0|2,0,1]=4 3713 B7R1.3 C[C@@H]1CNCCO1 Amb10603219 [0,0,0,1,0,0|2,0,1]=4 3714 B7R1.3 C[C@@H]1CNCCO1 Amb15690754 [0,0,0,1,0,0|2,0,1]=4 3715 B7R1.3 C[C@H]1CCCCN1 Amb8387006 [0,0,0,1,0,0|2,0,1]=4 3716 B7R1.3 C[C@H]1CNCCO1 Amb10603261 [0,0,0,1,0,0|2,0,1]=4 3717 B7R1.3 C[C@H]1CNCCO1 Amb20241673 [0,0,0,1,0,0|2,0,1]=4 3718 B7R1.3 C[C@H]1CNCCO1 Amb32661569 [0,0,0,1,0,0|2,0,1]=4 3719 B7R1.3 C[C@H]1CNCCO1 Amb34916143 [0,0,0,1,0,0|2,0,1]=4 3720 B7R1.3 C[SiH]1CCCCO1 Amb26582586 [0,0,0,1,0,0|1,1,0]=3 3721 B7R1.3 ClC1=CCCCC1 Amb9785147 [0,0,0,1,0,0|2,0,0]=3 3722 B7R1.3 ClC1=CCCCO1 Amb27449514 [0,0,0,1,0,0|1,0,1]=3 3723 B7R1.3 ClC1=CCCNC1 Amb32664385 [0,0,0,1,0,0|3,0,0]=4 3724 B7R1.3 ClC1=CCCNC1 Amb32664386 [0,0,0,1,0,0|3,0,0]=4 3725 B7R1.3 ClC1=COCCO1 Amb27826498 [0,0,0,1,0,0|2,0,1]=4 3726 B7R1.3 ClC1=NCCCN1 Amb27948666 [0,0,0,1,0,0|3,0,0]=4 3727 B7R1.3 ClC1CCCCC1 Amb3940352 [0,0,0,1,0,0|2,0,1]=4 3728 B7R1.3 ClC1CCCCN1 Amb20242688 [0,0,0,1,0,0|2,0,1]=4 3729 B7R1.3 ClC1CCCCO1 Amb17673285 [0,0,0,1,0,0|1,0,1]=3 3730 B7R1.3 ClC1CCCCS1 Amb28123985 [0,0,0,1,0,0|1,1,1]=4 3731 B7R1.3 ClN1CCCCC1 Amb25950915 [0,0,0,1,0,0|3,0,0]=4 3732 B7R1.3 FC1=CCCNC1 Amb27181097 [0,0,0,1,0,0|3,0,0]=4 3733 B7R1.3 FC1=CCCNC1 Amb28314663 [0,0,0,1,0,0|3,0,0]=4 3734 B7R1.3 FC1=CCNCC1 Amb27600797 [0,0,0,1,0,0|3,0,0]=4 3735 B7R1.3 FC1=CCNCC1 Amb33484309 [0,0,0,1,0,0|3,0,0]=4 3736 B7R1.3 FC1=COCCC1 Amb24322810 [0,0,0,1,0,0|3,0,0]=4 3737 B7R1.3 FC1CCCCC1 Amb2688084 [0,0,0,1,0,0|2,0,1]=4 3738 B7R1.3 FC1CCCCO1 Amb24322826 [0,0,0,1,0,0|1,0,1]=3 3739 B7R1.3 FC1CNCCO1 Amb27641873 [0,0,0,1,0,0|2,0,1]=4 3740 B7R1.3 FC1COCCO1 Amb24322827 [0,0,0,1,0,0|2,0,1]=4 3741 B7R1.3 IC1=CCCCC1 Amb27750996 [0,0,0,1,0,0|2,0,0]=3 3742 B7R1.3 IC1=CCOCC1 Amb25364046 [0,0,0,1,0,0|3,0,0]=4 3743 B7R1.3 IC1=COCCC1 Amb24322812 [0,0,0,1,0,0|3,0,0]=4 3744 B7R1.3 IC1=COCCO1 Amb24322818 [0,0,0,1,0,0|2,0,1]=4 3745 B7R1.3 IC1CCCCC1 Amb6608670 [0,0,0,1,0,0|2,0,1]=4 3746 B7R1.3 N=C1CCCCC1 Amb26924126 [0,0,0,1,0,0|2,0,0]=3 3747 B7R1.3 N=C1CCCCN1 Amb17616049 [0,0,0,1,0,0|2,0,0]=3 3748 B7R1.3 N=C1CCCCN1 Amb2780013 [0,0,0,1,0,0|2,0,0]=3 3749 B7R1.3 N=C1COCCN1 Amb24654396 [0,0,0,1,0,0|3,0,0]=4 3750 B7R1.3 N=C1COCCN1 Amb28468104 [0,0,0,1,0,0|3,0,0]=4 3751 B7R1.3 N=C1CSCCN1 Amb32679434 [0,0,0,1,0,0|3,0,0]=4 3752 B7R1.3 N=C1NCCCN1 Amb22642014 [0,0,0,1,0,0|3,0,0]=4 3753 B7R1.3 N=C1NCCCO1 Amb23597225 [0,0,0,1,0,0|2,0,0]=3 3754 B7R1.3 N=C1NCCCO1 Amb28990985 [0,0,0,1,0,0|2,0,0]=3 3755 B7R1.3 N=C1NCCCS1 Amb22524353 [0,0,0,1,0,0|2,1,0]=4 3756 B7R1.3 NC1=CCCCC1 Amb28456773 [0,0,0,1,0,0|2,0,0]=3 3757 B7R1.3 NC1=NCCCC1 Amb3997189 [0,0,0,1,0,0|2,0,0]=3 3758 B7R1.3 NC1=NCCCN1 Amb17608307 [0,0,0,1,0,0|3,0,0]=4 3759 B7R1.3 NC1=NCCCS1 Amb6817862 [0,0,0,1,0,0|2,1,0]=4 3760 B7R1.3 NC1=NCCCS1 Amb8468160 [0,0,0,1,0,0|2,1,0]=4 3761 B7R1.3 NC1=NCCOC1 Amb33743898 [0,0,0,1,0,0|3,0,0]=4 3762 B7R1.3 NC1=NCCSC1 Amb844759 [0,0,0,1,0,0|3,0,0]=4 3763 B7R1.3 NC1CCCCC1 Amb2792843 [0,0,0,1,0,0|2,0,1]=4 3764 B7R1.3 NC1CCCCC1 Amb4035820 [0,0,0,1,0,0|2,0,1]=4 3765 B7R1.3 NC1CCCCC1 Amb6366094 [0,0,0,1,0,0|2,0,1]=4 3766 B7R1.3 NC1CCCCN1 Amb16233706 [0,0,0,1,0,0|2,0,1]=4 3767 B7R1.3 NC1CCCCS1 Amb28052869 [0,0,0,1,0,0|1,1,1]=4 3768 B7R1.3 NN1CCCCC1 Amb535734 [0,0,0,1,0,0|3,0,0]=4 3769 B7R1.3 NN1CCCCC1 Amb6892706 [0,0,0,1,0,0|3,0,0]=4 3770 B7R1.3 N[C@H]1CCCCO1 Amb27655590 [0,0,0,1,0,0|1,0,1]=3 3771 B7R1.3 O=C1C=CCCC1 Amb17843126 [0,0,0,1,0,0|1,0,1]=3 3772 B7R1.3 O=C1C=CCCN1 Amb22001783 [0,0,0,1,0,0|1,0,2]=4 3773 B7R1.3 O=C1C=CCCO1 Amb15693457 [0,0,0,1,0,0|0,0,2]=3 3774 B7R1.3 O=C1C=CCOC1 Amb22234519 [0,0,0,1,0,0|2,0,1]=4 3775 B7R1.3 O=C1C=CCSC1 Amb26544956 [0,0,0,1,0,0|2,0,1]=4 3776 B7R1.3 O=C1C=CNCC1 Amb2700614 [0,0,0,1,0,0|2,0,1]=4 3777 B7R1.3 O=C1C=COCC1 Amb22000873 [0,0,0,1,0,0|2,0,1]=4 3778 B7R1.3 O=C1C=CSCC1 Amb25375022 [0,0,0,1,0,0|2,0,1]=4 3779 B7R1.3 O=C1C=NCCN1 Amb28341190 [0,0,0,1,0,0|2,0,1]=4 3780 B7R1.3 O=C1CCC=CN1 Amb26365285 [0,0,0,1,0,0|1,0,2]=4 3781 B7R1.3 O=C1CCCCC1 Amb2793026 [0,0,0,1,0,0|1,0,0]=2 3782 B7R1.3 O=C1CCCCN1 Amb6892006 [0,0,0,1,0,0|1,0,0]=2 3783 B7R1.3 O=C1CCCCO1 Amb8513592 [0,0,0,1,0,0|0,0,0]=1 3784 B7R1.3 O=C1CCCCS1 Amb25186924 [0,0,0,1,0,0|0,1,0]=2 3785 B7R1.3 O=C1CCCNC1 Amb10070944 [0,0,0,1,0,0|2,0,0]=3 3786 B7R1.3 O=C1CCCNC1 Amb10602349 [0,0,0,1,0,0|2,0,0]=3 3787 B7R1.3 O=C1CCCNC1 Amb19958010 [0,0,0,1,0,0|2,0,0]=3 3788 B7R1.3 O=C1CCCNN1 Amb18061622 [0,0,0,1,0,0|2,0,0]=3 3789 B7R1.3 O=C1CCCOC1 Amb19373430 [0,0,0,1,0,0|2,0,0]=3 3790 B7R1.3 O=C1CCCON1 Amb26560803 [0,0,0,1,0,0|2,0,0]=3 3791 B7R1.3 O=C1CCCSC1 Amb13952257 [0,0,0,1,0,0|2,0,0]=3 3792 B7R1.3 O=C1CCN=CN1 Amb27447786 [0,0,0,1,0,0|2,0,1]=4 3793 B7R1.3 O=C1CCNCC1 Amb2690392 [0,0,0,1,0,0|2,0,0]=3 3794 B7R1.3 O=C1CCNCC1 Amb2793002 [0,0,0,1,0,0|2,0,0]=3 3795 B7R1.3 O=C1CCNCC1 Amb8394939 [0,0,0,1,0,0|2,0,0]=3 3796 B7R1.3 O=C1CCNCN1 Amb27458283 [0,0,0,1,0,0|2,0,0]=3 3797 B7R1.3 O=C1CCOCC1 Amb2725565 [0,0,0,1,0,0|2,0,0]=3 3798 B7R1.3 O=C1CCSCC1 Amb1154265 [0,0,0,1,0,0|2,0,0]=3 3799 B7R1.3 O=C1CNCCN1 Amb4138465 [0,0,0,1,0,0|2,0,0]=3 3800 B7R1.3 O=C1CNCCN1 Amb6334808 [0,0,0,1,0,0|2,0,0]=3 3801 B7R1.3 O=C1CNCCO1 Amb19958702 [0,0,0,1,0,0|1,0,0]=2 3802 B7R1.3 O=C1CNCCO1 Amb32410210 [0,0,0,1,0,0|1,0,0]=2 3803 B7R1.3 O=C1COCCN1 Amb15691115 [0,0,0,1,0,0|2,0,0]=3 3804 B7R1.3 O=C1COCCO1 Amb17933352 [0,0,0,1,0,0|1,0,0]=2 3805 B7R1.3 O=C1CSCCN1 Amb674722 [0,0,0,1,0,0|2,0,0]=3 3806 B7R1.3 O=C1CSCCO1 Amb28069740 [0,0,0,1,0,0|1,0,0]=2 3807 B7R1.3 O=C1CSCCS1 Amb24539369 [0,0,0,1,0,0|1,1,0]=3 3808 B7R1.3 O=C1CSCSC1 Amb19148039 [0,0,0,1,0,0|3,0,0]=4 3809 B7R1.3 O=C1N=CCCN1 Amb24480889 [0,0,0,1,0,0|2,0,1]=4 3810 B7R1.3 O=C1NCCCN1 Amb4034594 [0,0,0,1,0,0|2,0,0]=3 3811 B7R1.3 O=C1NCCCO1 Amb10608499 [0,0,0,1,0,0|1,0,0]=2 3812 B7R1.3 O=C1NCCCS1 Amb24117134 [0,0,0,1,0,0|1,1,0]=3 3813 B7R1.3 O=C1NCCNN1 Amb28341733 [0,0,0,1,0,0|3,0,0]=4 3814 B7R1.3 O=C1NCNCN1 Amb25146452 [0,0,0,1,0,0|3,0,0]=4 3815 B7R1.3 O=C1NNCCO1 Amb32683554 [0,0,0,1,0,0|2,0,0]=3 3816 B7R1.3 O=C1OCCCO1 Amb4034896 [0,0,0,1,0,0|1,0,0]=2 3817 B7R1.3 O=S1CCCNC1 Amb27195521 [0,0,0,1,0,0|3,0,0]=4 3818 B7R1.3 O=S1CCNCC1 Amb18943760 [0,0,0,1,0,0|3,0,0]=4 3819 B7R1.3 O=S1CCNCC1 Amb6307179 [0,0,0,1,0,0|3,0,0]=4 3820 B7R1.3 O=S1CCOCC1 Amb26535052 [0,0,0,1,0,0|3,0,0]=4 3821 B7R1.3 O=S1CCSCC1 Amb25679286 [0,0,0,1,0,0|3,0,0]=4 3822 B7R1.3 O=S1OCCCO1 Amb20240777 [0,0,0,1,0,0|2,0,0]=3 3823 B7R1.3 OC1=CN=NCC1 Amb22756935 [0,0,0,1,0,0|3,0,0]=4 3824 B7R1.3 OC1=NCCNC1 Amb22330543 [0,0,0,1,0,0|2,0,0]=3 3825 B7R1.3 OC1C=CCCC1 Amb4605824 [0,0,0,1,0,0|1,0,2]=4 3826 B7R1.3 OC1CCCCC1 Amb4605832 [0,0,0,1,0,0|1,0,1]=3 3827 B7R1.3 OC1CCCCN1 Amb8393085 [0,0,0,1,0,0|1,0,1]=3 3828 B7R1.3 OC1CCCCO1 Amb8517292 [0,0,0,1,0,0|0,0,2]=3 3829 B7R1.3 OC1CCCNC1 Amb3939221 [0,0,0,1,0,0|2,0,1]=4 3830 B7R1.3 OC1CCCNC1 Amb4036802 [0,0,0,1,0,0|2,0,1]=4 3831 B7R1.3 OC1CCCOC1 Amb16192108 [0,0,0,1,0,0|2,0,1]=4 3832 B7R1.3 OC1CCCSC1 Amb4034626 [0,0,0,1,0,0|2,0,1]=4 3833 B7R1.3 OC1CCNCC1 Amb1152974 [0,0,0,1,0,0|2,0,1]=4 3834 B7R1.3 OC1CCNCC1 Amb2720309 [0,0,0,1,0,0|2,0,1]=4 3835 B7R1.3 OC1CCNCC1 Amb32679563 [0,0,0,1,0,0|2,0,1]=4 3836 B7R1.3 OC1CCOCC1 Amb2723454 [0,0,0,1,0,0|2,0,1]=4 3837 B7R1.3 OC1CCSCC1 Amb2610612 [0,0,0,1,0,0|2,0,1]=4 3838 B7R1.3 OC1CNCCO1 Amb13883759 [0,0,0,1,0,0|1,0,2]=4 3839 B7R1.3 OC1CNCCO1 Amb22011707 [0,0,0,1,0,0|1,0,2]=4 3840 B7R1.3 ON1CCCCC1 Amb6468702 [0,0,0,1,0,0|2,0,0]=3 3841 B7R1.3 ON1CCOCC1 Amb25243510 [0,0,0,1,0,0|3,0,0]=4 3842 B7R1.3 O[C@@H]1CCCNC1 Amb20241315 [0,0,0,1,0,0|2,0,1]=4 3843 B7R1.3 O[C@@H]1CCCNC1 Amb8628462 [0,0,0,1,0,0|2,0,1]=4 3844 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [0,0,0,1,0,0|2,0,1]=4 3845 B7R1.3 O[C@H]1C=CCCC1 Amb10601567 [0,0,0,1,0,0|1,0,2]=4 3846 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [0,0,0,1,0,0|2,0,1]=4 3847 B7R1.3 O[C@H]1CCCNC1 Amb2688784 [0,0,0,1,0,0|2,0,1]=4 3848 B7R1.3 O[C@H]1CCCOC1 Amb20241306 [0,0,0,1,0,0|2,0,1]=4 3849 B7R1.3 S=C1CCCCN1 Amb5720520 [0,0,0,1,0,0|1,1,0]=3 3850 B7R1.3 S=C1CCNCC1 Amb27232690 [0,0,0,1,0,0|2,1,0]=4 3851 B7R1.3 S=C1CCNCN1 Amb27205983 [0,0,0,1,0,0|2,1,0]=4 3852 B7R1.3 S=C1NCCCN1 Amb2690553 [0,0,0,1,0,0|2,1,0]=4 3853 B7R1.3 S=C1NCCCO1 Amb22524560 [0,0,0,1,0,0|1,1,0]=3 3854 B7R1.3 S=C1NCCCS1 Amb4012551 [0,0,0,1,0,0|1,2,0]=4 3855 B7R1.3 S=C1SCCCS1 Amb5717576 [0,0,0,1,0,0|1,2,0]=4 3856 B7R1.3 SC1=COCCC1 Amb33319911 [0,0,0,1,0,0|2,1,0]=4 3857 B7R1.3 SC1=NCCCN1 Amb2537133 [0,0,0,1,0,0|2,1,0]=4 3858 B7R1.3 SC1=NCCCS1 Amb4017252 [0,0,0,1,0,0|1,2,0]=4 3859 B7R1.3 SC1CCCCC1 Amb6608750 [0,0,0,1,0,0|1,1,1]=4 3860 B7R1.3 SC1CCCCN1 Amb27639704 [0,0,0,1,0,0|1,1,1]=4 3861 B7R1.3 [Mg+]C1CCCCC1 Amb22043956 [0,0,0,1,0,0|2,0,1]=4 3862 B7R1.5 C=C1CC1CCI Amb27838218 [0,0,0,1,0,0|3,0,0]=4 3863 B7R1.5 C=C1CC1CCN Amb27850014 [0,0,0,1,0,0|3,0,0]=4 3864 B7R1.5 CCCC1CC1Cl Amb28193341 [0,0,0,1,0,0|2,0,1]=4 3865 B7R1.5 CCCC1CC1N Amb18523756 [0,0,0,1,0,0|2,0,1]=4 3866 B7R1.5 CCCC1CC1N Amb20623324 [0,0,0,1,0,0|2,0,1]=4 3867 B7R1.5 CCCC1ON1C Amb22232363 [0,0,0,1,0,0|2,0,0]=3 3868 B7R1.5 CCC[C@@H]1C[C@@H]1N Amb34915319 [0,0,0,1,0,0|2,0,1]=4 3869 B7R1.5 CCC[C@@H]1C[C@H]1N Amb27488941 [0,0,0,1,0,0|2,0,1]=4 3870 B7R1.5 CCC[C@@H]1C[C@H]1N Amb33032253 [0,0,0,1,0,0|2,0,1]=4 3871 B7R1.5 C[C@@H]1O[C@H]1CCO Amb27184243 [0,0,0,1,0,0|2,0,1]=4 3872 B7R1.5 C[C@H]1O[C@H]1CCBr Amb27454808 [0,0,0,1,0,0|2,0,1]=4 3873 B7R1.5 O=C1C=C1CCO Amb33330739 [0,0,0,1,0,0|2,0,1]=4 3874 B7R1.7 BrCCCC1CO1 Amb27407723 [0,0,0,1,0,0|2,0,1]=4 3875 B7R1.7 CCCCC1CO1 Amb17771532 [0,0,0,1,0,0|1,0,1]=3 3876 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [0,0,0,1,0,0|1,0,1]=3 3877 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [0,0,0,1,0,0|1,0,1]=3 3878 B7R1.7 CCOCC1CO1 Amb9709641 [0,0,0,1,0,0|2,0,1]=4 3879 B7R1.7 CCOC[C@@H]1CO1 Amb25954691 [0,0,0,1,0,0|2,0,1]=4 3880 B7R1.7 CCOC[C@H]1CO1 Amb25888471 [0,0,0,1,0,0|2,0,1]=4 3881 B7R1.7 CCSCC1CO1 Amb6680858 [0,0,0,1,0,0|2,0,1]=4 3882 B7R1.7 CCSC[C@@H]1CO1 Amb25721898 [0,0,0,1,0,0|2,0,1]=4 3883 B7R1.7 CCSC[C@H]1CO1 Amb24747272 [0,0,0,1,0,0|2,0,1]=4 3884 B7R1.7 COCCC1CO1 Amb27984185 [0,0,0,1,0,0|2,0,1]=4 3885 B7R1.7 COCC[C@@H]1CO1 Amb33377003 [0,0,0,1,0,0|2,0,1]=4 3886 B7R1.7 COCC[C@H]1CO1 Amb33377005 [0,0,0,1,0,0|2,0,1]=4 3887 B7R1.7 CSCCC1CO1 Amb25241000 [0,0,0,1,0,0|2,0,1]=4 3888 B7R1.7 CSCC[C@@H]1CO1 Amb33203333 [0,0,0,1,0,0|2,0,1]=4 3889 B7R1.7 CSCC[C@H]1CO1 Amb33203334 [0,0,0,1,0,0|2,0,1]=4 3890 B7R1.7 FCCCC1CO1 Amb33196122 [0,0,0,1,0,0|2,0,1]=4 3891 B7R1.7 ICCCC1CO1 Amb27838220 [0,0,0,1,0,0|2,0,1]=4 3892 B7R1.7 NCCCC1CO1 Amb27816302 [0,0,0,1,0,0|2,0,1]=4 3893 B7R1.7 OCCCC1CO1 Amb28294234 [0,0,0,1,0,0|2,0,1]=4 3894 B7R1.7 OCCC[C@@H]1CO1 Amb27394788 [0,0,0,1,0,0|2,0,1]=4 3895 B7R1.10 C#CC1CC(=O)C1 Amb27874486 [0,0,0,1,0,0|1,0,2]=4 3896 B7R1.10 C=C1CC(CBr)C1 Amb24365342 [0,0,0,1,0,0|3,0,0]=4 3897 B7R1.10 C=C1CC(CCl)C1 Amb33804034 [0,0,0,1,0,0|3,0,0]=4 3898 B7R1.10 C=C1CC(CN)C1 Amb10071401 [0,0,0,1,0,0|3,0,0]=4 3899 B7R1.10 C=C1CC(CN)C1 Amb10976021 [0,0,0,1,0,0|3,0,0]=4 3900 B7R1.10 C=C1CC(CO)C1 Amb25854323 [0,0,0,1,0,0|3,0,0]=4 3901 B7R1.10 C=C1CC(NC)C1 Amb16230428 [0,0,0,1,0,0|3,0,0]=4 3902 B7R1.10 C=C1CC(NC)C1 Amb33734454 [0,0,0,1,0,0|3,0,0]=4 3903 B7R1.10 C=CC1CC(=O)C1 Amb26409138 [0,0,0,1,0,0|1,0,2]=4 3904 B7R1.10 C=CC1CC(=O)N1 Amb26507633 [0,0,0,1,0,0|1,0,2]=4 3905 B7R1.10 C=C[C@@H]1CC(=O)N1 Amb27589344 [0,0,0,1,0,0|1,0,2]=4 3906 B7R1.10 CCC1CC(=O)C1 Amb24406738 [0,0,0,1,0,0|1,0,0]=2 3907 B7R1.10 CCC1CC(N)C1 Amb26430936 [0,0,0,1,0,0|2,0,1]=4 3908 B7R1.10 CCC1CN(N)C1 Amb27493542 [0,0,0,1,0,0|3,0,0]=4 3909 B7R1.10 CCN1CC(O)C1 Amb19516884 [0,0,0,1,0,0|2,0,1]=4 3910 B7R1.10 CCN1CC(O)C1 Amb21960744 [0,0,0,1,0,0|2,0,1]=4 3911 B7R1.10 CNC1CC(O)C1 Amb19149003 [0,0,0,1,0,0|2,0,1]=4 3912 B7R1.10 CNC1CC(O)C1 Amb20623567 [0,0,0,1,0,0|2,0,1]=4 3913 B7R1.10 CNC1CS(=O)C1 Amb32794923 [0,0,0,1,0,0|3,0,0]=4 3914 B7R1.10 CN[C@H]1C[C@@H](O)C1 Amb23440266 [0,0,0,1,0,0|2,0,1]=4 3915 B7R1.10 CN[C@H]1C[C@H](O)C1 Amb23440035 [0,0,0,1,0,0|2,0,1]=4 3916 B7R1.10 CN[C@H]1C[C@H](O)C1 Amb25173769 [0,0,0,1,0,0|2,0,1]=4 3917 B7R1.10 COC1=CC(=O)C1 Amb25092069 [0,0,0,1,0,0|2,0,1]=4 3918 B7R1.10 COC1CC(=O)C1 Amb22754340 [0,0,0,1,0,0|2,0,0]=3 3919 B7R1.10 COC1CC(=O)N1 Amb27802279 [0,0,0,1,0,0|2,0,0]=3 3920 B7R1.10 COC1CC(O)C1 Amb26975414 [0,0,0,1,0,0|2,0,1]=4 3921 B7R1.10 CO[C@H]1C[C@@H](O)C1 Amb26045464 [0,0,0,1,0,0|2,0,1]=4 3922 B7R1.10 CO[C@H]1C[C@H](O)C1 Amb26642540 [0,0,0,1,0,0|2,0,1]=4 3923 B7R1.10 CSC1CC(=O)C1 Amb32655823 [0,0,0,1,0,0|2,0,0]=3 3924 B7R1.10 CSC1CC(=O)N1 Amb25265230 [0,0,0,1,0,0|2,0,0]=3 3925 B7R1.10 CSC1CC(O)C1 Amb24581791 [0,0,0,1,0,0|2,0,1]=4 3926 B7R1.10 CS[C@@H]1CC(=O)N1 Amb27981333 [0,0,0,1,0,0|2,0,0]=3 3927 B7R1.10 CS[C@H]1C[C@@H](O)C1 Amb32660479 [0,0,0,1,0,0|2,0,1]=4 3928 B7R1.10 N#CC1CC(=O)C1 Amb10603718 [0,0,0,1,0,0|2,0,1]=4 3929 B7R1.10 NCC1CC(=O)C1 Amb18251063 [0,0,0,1,0,0|2,0,0]=3 3930 B7R1.10 NCC1CC(=O)C1 Amb22406094 [0,0,0,1,0,0|2,0,0]=3 3931 B7R1.10 NCC1CC(=O)N1 Amb25230632 [0,0,0,1,0,0|2,0,0]=3 3932 B7R1.10 NCC1CC(O)C1 Amb21962033 [0,0,0,1,0,0|2,0,1]=4 3933 B7R1.10 NCC1CC(O)C1 Amb22405901 [0,0,0,1,0,0|2,0,1]=4 3934 B7R1.10 NC[C@H]1C[C@@H](O)C1 Amb22831753 [0,0,0,1,0,0|2,0,1]=4 3935 B7R1.10 NC[C@H]1C[C@@H](O)C1 Amb22899743 [0,0,0,1,0,0|2,0,1]=4 3936 B7R1.10 NC[C@H]1C[C@H](O)C1 Amb22899712 [0,0,0,1,0,0|2,0,1]=4 3937 B7R1.10 NC[C@H]1C[C@H](O)C1 Amb22899737 [0,0,0,1,0,0|2,0,1]=4 3938 B7R1.10 O=C1CC(CBr)C1 Amb20671344 [0,0,0,1,0,0|2,0,0]=3 3939 B7R1.10 O=C1CC(CBr)O1 Amb26981027 [0,0,0,1,0,0|1,0,0]=2 3940 B7R1.10 O=C1CC(CCl)C1 Amb10610581 [0,0,0,1,0,0|2,0,0]=3 3941 B7R1.10 O=C1CC(CCl)O1 Amb28322279 [0,0,0,1,0,0|1,0,0]=2 3942 B7R1.10 O=C1CC(CF)C1 Amb26416198 [0,0,0,1,0,0|2,0,0]=3 3943 B7R1.10 O=C1CC(CI)N1 Amb27838210 [0,0,0,1,0,0|2,0,0]=3 3944 B7R1.10 O=C1CC(CO)C1 Amb16231082 [0,0,0,1,0,0|2,0,0]=3 3945 B7R1.10 O=C1CC(CO)N1 Amb22388379 [0,0,0,1,0,0|2,0,0]=3 3946 B7R1.10 O=C1C[C@H](CO)N1 Amb26887642 [0,0,0,1,0,0|2,0,0]=3 3947 B7R1.10 OC1CC(CBr)C1 Amb25986866 [0,0,0,1,0,0|2,0,1]=4 3948 B7R1.10 OC1CC(CF)C1 Amb34138419 [0,0,0,1,0,0|2,0,1]=4 3949 B7R1.10 OCC1CC(O)C1 Amb22284484 [0,0,0,1,0,0|2,0,1]=4 3950 B7R1.10 OC[C@H]1C[C@H](O)C1 Amb27490798 [0,0,0,1,0,0|2,0,1]=4 3951 B7R1.10 O[C@H]1C[C@@H](CBr)C1 Amb27850666 [0,0,0,1,0,0|2,0,1]=4 3952 B7R1.10 O[C@H]1C[C@@H](CF)C1 Amb34136579 [0,0,0,1,0,0|2,0,1]=4 3953 B7R1.10 O[C@H]1C[C@H](CBr)C1 Amb34164797 [0,0,0,1,0,0|2,0,1]=4 3954 B7R1.12 C=C(C)C1CC1N Amb33199895 [0,0,0,1,0,0|3,0,0]=4 3955 B7R1.12 C=C(C)[C@@H]1C[C@H]1N Amb33199897 [0,0,0,1,0,0|3,0,0]=4 3956 B7R1.12 C=C1CC1C(=O)O Amb9774969 [0,0,0,1,0,0|0,0,2]=3 3957 B7R1.12 C=C1CC1C(N)=O Amb28191145 [0,0,0,1,0,0|1,0,2]=4 3958 B7R1.12 CC(=O)C1CC1C Amb25720437 [0,0,0,1,0,0|1,0,0]=2 3959 B7R1.12 CC(=O)C1N=C1C Amb28050540 [0,0,0,1,0,0|2,0,1]=4 3960 B7R1.12 CC(=O)C1OC1C Amb25920285 [0,0,0,1,0,0|2,0,0]=3 3961 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [0,0,0,1,0,0|1,0,0]=2 3962 B7R1.12 CC(=O)[C@@H]1OC1C Amb27165592 [0,0,0,1,0,0|2,0,0]=3 3963 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [0,0,0,1,0,0|1,0,0]=2 3964 B7R1.12 CC(=O)[C@H]1O[C@H]1C Amb28052513 [0,0,0,1,0,0|2,0,0]=3 3965 B7R1.12 CC(=O)[C@H]1S[C@@H]1C Amb27231676 [0,0,0,1,0,0|2,0,0]=3 3966 B7R1.12 CC(N)C1CC1C Amb24592597 [0,0,0,1,0,0|2,0,1]=4 3967 B7R1.12 CC(N)C1CC1C Amb32663793 [0,0,0,1,0,0|2,0,1]=4 3968 B7R1.12 CC(N)[C@@H]1C[C@H]1C Amb24120602 [0,0,0,1,0,0|2,0,1]=4 3969 B7R1.12 CC(O)C1CC1I Amb27867333 [0,0,0,1,0,0|2,0,1]=4 3970 B7R1.12 CC(O)[C@@H]1O[C@H]1C Amb27660940 [0,0,0,1,0,0|2,0,1]=4 3971 B7R1.12 CC(O)[C@H]1C[C@@H]1C Amb27443623 [0,0,0,1,0,0|1,0,1]=3 3972 B7R1.12 CC(S)C1CC1C Amb25102055 [0,0,0,1,0,0|1,1,1]=4 3973 B7R1.12 CC1=CC1C(=O)O Amb27157805 [0,0,0,1,0,0|0,0,2]=3 3974 B7R1.12 CC1CC1C(=N)N Amb25139920 [0,0,0,1,0,0|2,0,0]=3 3975 B7R1.12 CC1CC1C(=N)N Amb32667599 [0,0,0,1,0,0|2,0,0]=3 3976 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [0,0,0,1,0,0|1,0,0]=2 3977 B7R1.12 CC1CC1C(=O)O Amb9703126 [0,0,0,1,0,0|0,0,0]=1 3978 B7R1.12 CC1CC1C(N)=O Amb8858378 [0,0,0,1,0,0|1,0,0]=2 3979 B7R1.12 CC1CC1C(N)=S Amb25302556 [0,0,0,1,0,0|1,1,0]=3 3980 B7R1.12 CC1CC1[C@@H](C)N Amb26911780 [0,0,0,1,0,0|2,0,1]=4 3981 B7R1.12 CC1CC1[C@@H](C)O Amb24683424 [0,0,0,1,0,0|1,0,1]=3 3982 B7R1.12 CC1CC1[C@H](C)N Amb25687220 [0,0,0,1,0,0|2,0,1]=4 3983 B7R1.12 CC1CC1[C@H](C)O Amb25271040 [0,0,0,1,0,0|1,0,1]=3 3984 B7R1.12 CC1CN1C(=N)N Amb32454207 [0,0,0,1,0,0|3,0,0]=4 3985 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,1,0,0|1,0,0]=2 3986 B7R1.12 CC1SC1C(=O)O Amb27195238 [0,0,0,1,0,0|1,0,0]=2 3987 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [0,0,0,1,0,0|1,0,0]=2 3988 B7R1.12 C[C@@H](O)[C@@H]1C[C@@H]1I Amb27439061 [0,0,0,1,0,0|2,0,1]=4 3989 B7R1.12 C[C@@H]1C[C@@H]1B(O)O Amb24329037 [0,0,0,1,0,0|1,0,1]=3 3990 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [0,0,0,1,0,0|0,0,0]=1 3991 B7R1.12 C[C@@H]1C[C@H]1C(=N)N Amb27252052 [0,0,0,1,0,0|2,0,0]=3 3992 B7R1.12 C[C@@H]1C[C@H]1C(=N)N Amb33483860 [0,0,0,1,0,0|2,0,0]=3 3993 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,1,0,0|1,0,0]=2 3994 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [0,0,0,1,0,0|0,0,0]=1 3995 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [0,0,0,1,0,0|1,0,0]=2 3996 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [0,0,0,1,0,0|1,0,0]=2 3997 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [0,0,0,1,0,0|1,0,0]=2 3998 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [0,0,0,1,0,0|1,0,0]=2 3999 B7R1.12 C[C@H](N)[C@H]1C[C@@H]1C Amb27874335 [0,0,0,1,0,0|2,0,1]=4 4000 B7R1.12 C[C@H](O)[C@@H]1C[C@H]1C Amb28065317 [0,0,0,1,0,0|1,0,1]=3 4001 B7R1.12 C[C@H](O)[C@@H]1O[C@H]1C Amb28345454 [0,0,0,1,0,0|2,0,1]=4 4002 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [0,0,0,1,0,0|0,0,0]=1 4003 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [0,0,0,1,0,0|1,0,0]=2 4004 B7R1.12 C[C@H]1C[C@H]1B(O)O Amb24515113 [0,0,0,1,0,0|1,0,1]=3 4005 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,1,0,0|0,0,0]=1 4006 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [0,0,0,1,0,0|1,0,0]=2 4007 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [0,0,0,1,0,0|1,0,0]=2 4008 B7R1.12 NC(=O)C1CC1Br Amb27838278 [0,0,0,1,0,0|2,0,0]=3 4009 B7R1.12 NC(=O)C1CC1F Amb26026786 [0,0,0,1,0,0|2,0,0]=3 4010 B7R1.12 NC(=O)C1CC1N Amb18279694 [0,0,0,1,0,0|2,0,0]=3 4011 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F Amb27758752 [0,0,0,1,0,0|2,0,0]=3 4012 B7R1.12 NC(=O)[C@@H]1C[C@H]1F Amb27403700 [0,0,0,1,0,0|2,0,0]=3 4013 B7R1.12 NC1CC1C(=O)O Amb7762823 [0,0,0,1,0,0|1,0,0]=2 4014 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [0,0,0,1,0,0|1,0,0]=2 4015 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [0,0,0,1,0,0|1,0,0]=2 4016 B7R1.12 O=C(Cl)C1CC1=O Amb27838228 [0,0,0,1,0,0|2,0,1]=4 4017 B7R1.12 O=C(Cl)C1CC1Cl Amb27865442 [0,0,0,1,0,0|2,0,0]=3 4018 B7R1.12 O=C(Cl)C1CC1F Amb8389490 [0,0,0,1,0,0|2,0,0]=3 4019 B7R1.12 O=C(Cl)[C@@H]1C[C@@H]1Cl Amb28291528 [0,0,0,1,0,0|2,0,0]=3 4020 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,0,0,1,0,0|2,0,0]=3 4021 B7R1.12 O=C(O)C1CC1Br Amb27760446 [0,0,0,1,0,0|1,0,0]=2 4022 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [0,0,0,1,0,0|1,0,0]=2 4023 B7R1.12 O=C(O)C1CC1F Amb22490547 [0,0,0,1,0,0|1,0,0]=2 4024 B7R1.12 O=C(O)C1CC1I Amb26047069 [0,0,0,1,0,0|1,0,0]=2 4025 B7R1.12 O=C(O)C1CC1S Amb20246988 [0,0,0,1,0,0|1,0,0]=2 4026 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [0,0,0,1,0,0|1,0,0]=2 4027 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [0,0,0,1,0,0|1,0,0]=2 4028 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,1,0,0|1,0,0]=2 4029 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [0,0,0,1,0,0|1,0,0]=2 4030 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,1,0,0|1,0,0]=2 4031 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,1,0,0|1,0,0]=2 4032 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [0,0,0,1,0,0|1,0,0]=2 4033 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,1,0,0|1,0,0]=2 4034 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [0,0,0,1,0,0|1,0,0]=2 4035 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [0,0,0,1,0,0|1,0,0]=2 4036 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,1,0,0|1,0,0]=2 4037 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [0,0,0,1,0,0|1,0,0]=2 4038 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,1,0,0|1,0,0]=2 4039 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,1,0,0|1,0,0]=2 4040 B7R1.12 OB(O)C1CC1Br Amb24314265 [0,0,0,1,0,0|2,0,1]=4 4041 B7R1.14 CC1(Br)CCCC1 Amb24612443 [0,0,0,1,0,0|2,0,1]=4 4042 B7R1.14 CC1(C)CCCC1 Amb4019558 [0,0,0,1,0,0|2,0,1]=4 4043 B7R1.14 CC1(N)CCCC1 Amb10609055 [0,0,0,1,0,0|2,0,1]=4 4044 B7R1.14 CC1(N)CCCC1 Amb9477037 [0,0,0,1,0,0|2,0,1]=4 4045 B7R1.14 CC1(O)CCCC1 Amb4037281 [0,0,0,1,0,0|1,0,1]=3 4046 B7R1.14 CC1(O)CCNC1 Amb20623853 [0,0,0,1,0,0|2,0,1]=4 4047 B7R1.14 CC1(O)CCNC1 Amb20671400 [0,0,0,1,0,0|2,0,1]=4 4048 B7R1.14 CC1(O)CCOC1 Amb20667835 [0,0,0,1,0,0|2,0,1]=4 4049 B7R1.14 CC1(O)CCSC1 Amb28050063 [0,0,0,1,0,0|2,0,1]=4 4050 B7R1.14 C[C@@]1(O)CCNC1 Amb24676068 [0,0,0,1,0,0|2,0,1]=4 4051 B7R1.14 C[C@]1(O)CCNC1 Amb22748513 [0,0,0,1,0,0|2,0,1]=4 4052 B7R1.14 C[C@]1(O)CCNC1 Amb22754367 [0,0,0,1,0,0|2,0,1]=4 4053 B7R1.14 C[Si]1(C)CCCC1 Amb19893503 [0,0,0,1,0,0|2,1,0]=4 4054 B7R1.14 C[Si]1(Cl)CCCC1 Amb19893715 [0,0,0,1,0,0|2,1,0]=4 4055 B7R1.14 ClC1(Cl)CCCC1 Amb22733951 [0,0,0,1,0,0|2,0,1]=4 4056 B7R1.14 Cl[Si]1(Cl)CCCC1 Amb19893524 [0,0,0,1,0,0|2,1,0]=4 4057 B7R1.14 FC1(F)CCCC1 Amb10838599 [0,0,0,1,0,0|2,0,1]=4 4058 B7R1.14 N=S1(=N)CCCC1 Amb27453018 [0,0,0,1,0,0|3,0,0]=4 4059 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [0,0,0,1,0,0|2,0,0]=3 4060 B7R1.14 NC1(F)CCCC1 Amb28283925 [0,0,0,1,0,0|2,0,1]=4 4061 B7R1.14 O=S1(=O)CCCC1 Amb2973382 [0,0,0,1,0,0|1,0,1]=3 4062 B7R1.14 O=S1(=O)CCCN1 Amb6893202 [0,0,0,1,0,0|2,0,1]=4 4063 B7R1.14 O=S1(=O)CCCO1 Amb6608684 [0,0,0,1,0,0|2,0,1]=4 4064 B7R1.14 O=S1(=O)CCNC1 Amb27877957 [0,0,0,1,0,0|2,0,1]=4 4065 B7R1.17 CC1(O)CCC1N Amb24117490 [0,0,0,1,0,0|2,0,1]=4 4066 B7R1.17 CC1(O)CCC1N Amb25968766 [0,0,0,1,0,0|2,0,1]=4 4067 B7R1.17 CC1CCS1(=O)=O Amb22364950 [0,0,0,1,0,0|1,0,1]=3 4068 B7R1.17 CC1CNS1(=O)=O Amb35788456 [0,0,0,1,0,0|2,0,1]=4 4069 B7R1.17 CC1NCC1(C)O Amb27875519 [0,0,0,1,0,0|2,0,1]=4 4070 B7R1.17 C[C@@]1(O)CC[C@H]1N Amb32664480 [0,0,0,1,0,0|2,0,1]=4 4071 B7R1.17 C[C@@]1(O)CC[C@H]1N Amb32664481 [0,0,0,1,0,0|2,0,1]=4 4072 B7R1.17 C[C@H]1CCS1(=O)=O Amb27661382 [0,0,0,1,0,0|1,0,1]=3 4073 B7R1.17 OC1(F)CCC1F Amb27211172 [0,0,0,1,0,0|2,0,1]=4 4074 B7R1.18 C=C(C)C1CCC1 Amb25662691 [0,0,0,1,0,0|2,0,0]=3 4075 B7R1.18 C=C(C)C1CCN1 Amb33199611 [0,0,0,1,0,0|3,0,0]=4 4076 B7R1.18 C=C(C)C1CNC1 Amb33226197 [0,0,0,1,0,0|3,0,0]=4 4077 B7R1.18 C=C(F)C1CCC1 Amb27403200 [0,0,0,1,0,0|2,0,0]=3 4078 B7R1.18 CC(=O)C1=CCC1 Amb23453500 [0,0,0,1,0,0|1,0,2]=4 4079 B7R1.18 CC(=O)C1CCC1 Amb4037098 [0,0,0,1,0,0|1,0,0]=2 4080 B7R1.18 CC(=O)C1CCN1 Amb28142364 [0,0,0,1,0,0|2,0,0]=3 4081 B7R1.18 CC(=O)C1CNC1 Amb23400009 [0,0,0,1,0,0|2,0,0]=3 4082 B7R1.18 CC(=O)C1CNC1 Amb23401240 [0,0,0,1,0,0|2,0,0]=3 4083 B7R1.18 CC(=O)C1CNC1 Amb33473586 [0,0,0,1,0,0|2,0,0]=3 4084 B7R1.18 CC(=O)C1COC1 Amb27397483 [0,0,0,1,0,0|2,0,0]=3 4085 B7R1.18 CC(=O)C1CSC1 Amb29849423 [0,0,0,1,0,0|2,0,0]=3 4086 B7R1.18 CC(=O)N1CCC1 Amb22008358 [0,0,0,1,0,0|2,0,0]=3 4087 B7R1.18 CC(Br)C1CCC1 Amb26336046 [0,0,0,1,0,0|2,0,1]=4 4088 B7R1.18 CC(C)C1CCC1 Amb24479859 [0,0,0,1,0,0|2,0,1]=4 4089 B7R1.18 CC(N)C1CCC1 Amb24183538 [0,0,0,1,0,0|2,0,1]=4 4090 B7R1.18 CC(N)C1CCC1 Amb8011026 [0,0,0,1,0,0|2,0,1]=4 4091 B7R1.18 CC(O)C1CCC1 Amb10603414 [0,0,0,1,0,0|1,0,1]=3 4092 B7R1.18 CC(O)C1CCO1 Amb26873978 [0,0,0,1,0,0|2,0,1]=4 4093 B7R1.18 CC(O)C1CNC1 Amb25832454 [0,0,0,1,0,0|2,0,1]=4 4094 B7R1.18 CC(O)C1CNC1 Amb30869334 [0,0,0,1,0,0|2,0,1]=4 4095 B7R1.18 CC(O)C1CNC1 Amb32667051 [0,0,0,1,0,0|2,0,1]=4 4096 B7R1.18 CC(O)C1COC1 Amb33715759 [0,0,0,1,0,0|2,0,1]=4 4097 B7R1.18 CC(O)C1CSC1 Amb32674717 [0,0,0,1,0,0|2,0,1]=4 4098 B7R1.18 CC(S)C1CCC1 Amb24509376 [0,0,0,1,0,0|1,1,1]=4 4099 B7R1.18 CS(=O)C1CNC1 Amb34155891 [0,0,0,1,0,0|3,0,0]=4 4100 B7R1.18 C[C@@H](N)C1CCC1 Amb22747302 [0,0,0,1,0,0|2,0,1]=4 4101 B7R1.18 C[C@@H](N)C1CCC1 Amb31308336 [0,0,0,1,0,0|2,0,1]=4 4102 B7R1.18 C[C@@H](O)C1CCC1 Amb24478546 [0,0,0,1,0,0|1,0,1]=3 4103 B7R1.18 C[C@@H](O)C1CNC1 Amb32674886 [0,0,0,1,0,0|2,0,1]=4 4104 B7R1.18 C[C@@H](O)C1CNC1 Amb32674887 [0,0,0,1,0,0|2,0,1]=4 4105 B7R1.18 C[C@H](N)C1CCC1 Amb33805305 [0,0,0,1,0,0|2,0,1]=4 4106 B7R1.18 C[C@H](O)C1CCC1 Amb25145632 [0,0,0,1,0,0|1,0,1]=3 4107 B7R1.18 C[C@H](O)C1CNC1 Amb32660554 [0,0,0,1,0,0|2,0,1]=4 4108 B7R1.18 C[C@H](O)C1CNC1 Amb32674859 [0,0,0,1,0,0|2,0,1]=4 4109 B7R1.18 N=C(N)C1CCC1 Amb2695056 [0,0,0,1,0,0|2,0,0]=3 4110 B7R1.18 N=C(N)C1CCC1 Amb33528962 [0,0,0,1,0,0|2,0,0]=3 4111 B7R1.18 N=C(N)C1CCN1 Amb28410949 [0,0,0,1,0,0|3,0,0]=4 4112 B7R1.18 N=C(N)C1CSC1 Amb27230259 [0,0,0,1,0,0|3,0,0]=4 4113 B7R1.18 N=C(N)C1CSC1 Amb28465476 [0,0,0,1,0,0|3,0,0]=4 4114 B7R1.18 N=C(N)C1CSC1 Amb32680403 [0,0,0,1,0,0|3,0,0]=4 4115 B7R1.18 N=C(N)N1CCC1 Amb24655942 [0,0,0,1,0,0|3,0,0]=4 4116 B7R1.18 N=C(N)N1CCC1 Amb33536002 [0,0,0,1,0,0|3,0,0]=4 4117 B7R1.18 N=C(N)[C@@H]1CCN1 Amb27790002 [0,0,0,1,0,0|3,0,0]=4 4118 B7R1.18 NC(=O)C1CCC1 Amb33552668 [0,0,0,1,0,0|1,0,0]=2 4119 B7R1.18 NC(=O)C1CCN1 Amb22230240 [0,0,0,1,0,0|2,0,0]=3 4120 B7R1.18 NC(=O)C1CCN1 Amb22491865 [0,0,0,1,0,0|2,0,0]=3 4121 B7R1.18 NC(=O)C1CNC1 Amb10976072 [0,0,0,1,0,0|2,0,0]=3 4122 B7R1.18 NC(=O)C1CNC1 Amb20061301 [0,0,0,1,0,0|2,0,0]=3 4123 B7R1.18 NC(=O)C1CNC1 Amb21960249 [0,0,0,1,0,0|2,0,0]=3 4124 B7R1.18 NC(=O)C1CSC1 Amb27209831 [0,0,0,1,0,0|2,0,0]=3 4125 B7R1.18 NC(=O)N1CCC1 Amb25326782 [0,0,0,1,0,0|2,0,0]=3 4126 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [0,0,0,1,0,0|2,0,0]=3 4127 B7R1.18 NC(=S)C1CCC1 Amb18108358 [0,0,0,1,0,0|1,1,0]=3 4128 B7R1.18 NC(=S)C1CSC1 Amb29867873 [0,0,0,1,0,0|2,1,0]=4 4129 B7R1.18 NC(=S)N1CCC1 Amb23443673 [0,0,0,1,0,0|2,1,0]=4 4130 B7R1.18 NS(=O)C1CCC1 Amb32720395 [0,0,0,1,0,0|2,0,0]=3 4131 B7R1.18 NS(=O)C1COC1 Amb32720384 [0,0,0,1,0,0|3,0,0]=4 4132 B7R1.18 O=C(Br)C1CCC1 Amb28291328 [0,0,0,1,0,0|1,0,0]=2 4133 B7R1.18 O=C(Cl)C1CCC1 Amb33528386 [0,0,0,1,0,0|1,0,0]=2 4134 B7R1.18 O=C(Cl)N1CCC1 Amb28144777 [0,0,0,1,0,0|2,0,0]=3 4135 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [0,0,0,1,0,0|0,0,2]=3 4136 B7R1.18 O=C(O)C1CCC1 Amb2686619 [0,0,0,1,0,0|0,0,0]=1 4137 B7R1.18 O=C(O)C1CCN1 Amb2371568 [0,0,0,1,0,0|1,0,0]=2 4138 B7R1.18 O=C(O)C1CCN1 Amb8391098 [0,0,0,1,0,0|1,0,0]=2 4139 B7R1.18 O=C(O)C1CCO1 Amb2383526 [0,0,0,1,0,0|1,0,0]=2 4140 B7R1.18 O=C(O)C1CCS1 Amb27209836 [0,0,0,1,0,0|1,0,0]=2 4141 B7R1.18 O=C(O)C1CNC1 Amb2444164 [0,0,0,1,0,0|1,0,0]=2 4142 B7R1.18 O=C(O)C1CNC1 Amb8384273 [0,0,0,1,0,0|1,0,0]=2 4143 B7R1.18 O=C(O)C1COC1 Amb33542663 [0,0,0,1,0,0|1,0,0]=2 4144 B7R1.18 O=C(O)C1CSC1 Amb20171470 [0,0,0,1,0,0|1,0,0]=2 4145 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [0,0,0,1,0,0|1,0,0]=2 4146 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [0,0,0,1,0,0|1,0,0]=2 4147 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [0,0,0,1,0,0|1,0,0]=2 4148 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [0,0,0,1,0,0|1,0,0]=2 4149 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [0,0,0,1,0,0|1,0,0]=2 4150 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [0,0,0,1,0,0|1,0,0]=2 4151 B7R1.18 O=C([O-])C1=CCC1 Amb34165365 [0,0,0,1,0,0|0,0,3]=4 4152 B7R1.18 O=S(Cl)C1CCC1 Amb32720394 [0,0,0,1,0,0|2,0,0]=3 4153 B7R1.18 O=S(Cl)C1COC1 Amb32720383 [0,0,0,1,0,0|3,0,0]=4 4154 B7R1.18 O=S([O-])C1CCC1 Amb32755305 [0,0,0,1,0,0|1,0,1]=3 4155 B7R1.18 O=S([O-])C1CNC1 Amb32755449 [0,0,0,1,0,0|2,0,1]=4 4156 B7R1.18 O=[N+]([O-])C1CCC1 Amb13883563 [0,0,0,1,0,0|1,0,1]=3 4157 B7R1.18 O=[N+]([O-])C1CNC1 Amb34150823 [0,0,0,1,0,0|2,0,1]=4 4158 B7R1.18 O=[N+]([O-])C1CNC1 Amb34199881 [0,0,0,1,0,0|2,0,1]=4 4159 B7R1.18 O=[N+]([O-])C1COC1 Amb22289560 [0,0,0,1,0,0|2,0,1]=4 4160 B7R1.18 O=[N+]([O-])N1CCC1 Amb27838189 [0,0,0,1,0,0|2,0,1]=4 4161 B7R1.18 OB(O)C1CCC1 Amb10071491 [0,0,0,1,0,0|1,0,1]=3 4162 B7R1.20 BrC(Br)=CC1CC1 Amb17612546 [0,0,0,1,0,0|2,0,1]=4 4163 B7R1.20 C=C(C)CC1CC1 Amb27207160 [0,0,0,1,0,0|2,0,0]=3 4164 B7R1.20 C=C(C)CC1CO1 Amb33199536 [0,0,0,1,0,0|3,0,0]=4 4165 B7R1.20 CC(=O)C=C1CC1 Amb28201596 [0,0,0,1,0,0|1,0,2]=4 4166 B7R1.20 CC(=O)CC1CC1 Amb10603417 [0,0,0,1,0,0|1,0,0]=2 4167 B7R1.20 CC(=O)NC1CC1 Amb3366973 [0,0,0,1,0,0|2,0,0]=3 4168 B7R1.20 CC(=O)OC1CO1 Amb25261586 [0,0,0,1,0,0|3,0,0]=4 4169 B7R1.20 CC(=S)NC1CC1 Amb28131466 [0,0,0,1,0,0|2,1,0]=4 4170 B7R1.20 CC(Br)CC1CC1 Amb26322577 [0,0,0,1,0,0|2,0,1]=4 4171 B7R1.20 CC(Cl)CC1CC1 Amb24635709 [0,0,0,1,0,0|2,0,1]=4 4172 B7R1.20 CC(N)CC1CC1 Amb18958998 [0,0,0,1,0,0|2,0,1]=4 4173 B7R1.20 CC(N)CC1CC1 Amb33038528 [0,0,0,1,0,0|2,0,1]=4 4174 B7R1.20 CC(O)CC1CC1 Amb26536953 [0,0,0,1,0,0|1,0,1]=3 4175 B7R1.20 CC(O)CN1CC1 Amb17334047 [0,0,0,1,0,0|2,0,1]=4 4176 B7R1.20 CC(S)CC1CC1 Amb26515240 [0,0,0,1,0,0|1,1,1]=4 4177 B7R1.20 CN(C)CC1CC1 Amb1795989 [0,0,0,1,0,0|3,0,0]=4 4178 B7R1.20 CN(N)CC1CC1 Amb28131647 [0,0,0,1,0,0|3,0,0]=4 4179 B7R1.20 CN(O)CC1CC1 Amb33429117 [0,0,0,1,0,0|2,0,0]=3 4180 B7R1.20 C[C@@H](N)CC1CC1 Amb26067529 [0,0,0,1,0,0|2,0,1]=4 4181 B7R1.20 C[C@@H](N)CC1CC1 Amb33483221 [0,0,0,1,0,0|2,0,1]=4 4182 B7R1.20 C[C@@H](O)CC1CC1 Amb22896775 [0,0,0,1,0,0|1,0,1]=3 4183 B7R1.20 C[C@H](N)CC1CC1 Amb25883521 [0,0,0,1,0,0|2,0,1]=4 4184 B7R1.20 C[C@H](N)CC1CC1 Amb33447139 [0,0,0,1,0,0|2,0,1]=4 4185 B7R1.20 C[C@H](O)CC1CC1 Amb28050168 [0,0,0,1,0,0|1,0,1]=3 4186 B7R1.20 N=C(N)CC1CC1 Amb21964664 [0,0,0,1,0,0|2,0,0]=3 4187 B7R1.20 N=C(N)CC1CC1 Amb9423215 [0,0,0,1,0,0|2,0,0]=3 4188 B7R1.20 N=C(N)NC1CC1 Amb21955694 [0,0,0,1,0,0|3,0,0]=4 4189 B7R1.20 N=C(N)NC1CC1 Amb22492366 [0,0,0,1,0,0|3,0,0]=4 4190 B7R1.20 N=C(N)NC1CC1 Amb22587163 [0,0,0,1,0,0|3,0,0]=4 4191 B7R1.20 N=C(N)NC1CC1 Amb6316110 [0,0,0,1,0,0|3,0,0]=4 4192 B7R1.20 NC(=O)CC1CC1 Amb33552967 [0,0,0,1,0,0|1,0,0]=2 4193 B7R1.20 NC(=O)NC1CC1 Amb1152776 [0,0,0,1,0,0|2,0,0]=3 4194 B7R1.20 NC(=O)OC1CC1 Amb27265645 [0,0,0,1,0,0|2,0,0]=3 4195 B7R1.20 NC(=O)OC1CO1 Amb27184555 [0,0,0,1,0,0|3,0,0]=4 4196 B7R1.20 NC(=S)CC1CC1 Amb9423151 [0,0,0,1,0,0|1,1,0]=3 4197 B7R1.20 NC(=S)NC1CC1 Amb429201 [0,0,0,1,0,0|2,1,0]=4 4198 B7R1.20 NC(N)=NC1CC1 Amb19374402 [0,0,0,1,0,0|3,0,0]=4 4199 B7R1.20 NS(=O)CC1CC1 Amb32720358 [0,0,0,1,0,0|2,0,0]=3 4200 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [0,0,0,1,0,0|1,0,0]=2 4201 B7R1.20 O=C(Cl)NC1CC1 Amb27848787 [0,0,0,1,0,0|2,0,0]=3 4202 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [0,0,0,1,0,0|2,0,0]=3 4203 B7R1.20 O=C(O)C=C1CC1 Amb8392543 [0,0,0,1,0,0|0,0,2]=3 4204 B7R1.20 O=C(O)CC1CC1 Amb2686657 [0,0,0,1,0,0|0,0,0]=1 4205 B7R1.20 O=C(O)CC1CO1 Amb25244347 [0,0,0,1,0,0|1,0,0]=2 4206 B7R1.20 O=C(O)C[C@@H]1CO1 Amb27253415 [0,0,0,1,0,0|1,0,0]=2 4207 B7R1.20 O=C(O)C[C@H]1CO1 Amb26068484 [0,0,0,1,0,0|1,0,0]=2 4208 B7R1.20 O=S(Cl)CC1CC1 Amb25914604 [0,0,0,1,0,0|2,0,0]=3 4209 B7R1.20 O=S([O-])CC1CC1 Amb27483189 [0,0,0,1,0,0|1,0,1]=3 4210 B7R1.20 O=[N+]([O-])CC1CO1 Amb23589333 [0,0,0,1,0,0|2,0,1]=4 4211 B7R1.23 CCC1CC1(Br)Br Amb4006862 [0,0,0,1,0,0|2,0,1]=4 4212 B7R1.23 CCC1CC1(C)N Amb27627409 [0,0,0,1,0,0|2,0,1]=4 4213 B7R1.23 CC[C@@H]1C[C@@]1(C)N Amb27975744 [0,0,0,1,0,0|2,0,1]=4 4214 B4R0.1 C#CC(=O)O Amb6600128 [2,0,0,0,0,0|0,0,2]=4 4215 B4R0.1 C=C(Cl)CC Amb22228725 [2,0,0,0,0,0|2,0,0]=4 4216 B4R0.1 C=CC(=O)O Amb2792871 [2,0,0,0,0,0|0,0,2]=4 4217 B4R0.1 CC(=O)CBr Amb6673867 [2,0,0,0,0,0|2,0,0]=4 4218 B4R0.1 CC(=O)CCl Amb2792923 [2,0,0,0,0,0|2,0,0]=4 4219 B4R0.1 CC(=O)CI Amb22831972 [2,0,0,0,0,0|2,0,0]=4 4220 B4R0.1 CC(=O)CN Amb10603379 [2,0,0,0,0,0|2,0,0]=4 4221 B4R0.1 CC(=O)CN Amb22489444 [2,0,0,0,0,0|2,0,0]=4 4222 B4R0.1 CC(=O)CN Amb8393368 [2,0,0,0,0,0|2,0,0]=4 4223 B4R0.1 CC(=O)CO Amb2404925 [2,0,0,0,0,0|2,0,0]=4 4224 B4R0.1 CC(=O)CS Amb19148935 [2,0,0,0,0,0|2,0,0]=4 4225 B4R0.1 CCB(O)O Amb8387605 [2,0,0,0,0,0|1,0,1]=4 4226 B4R0.1 CCC(=N)N Amb2695032 [2,0,0,0,0,0|2,0,0]=4 4227 B4R0.1 CCC(=N)N Amb6316131 [2,0,0,0,0,0|2,0,0]=4 4228 B4R0.1 CCC(=O)Br Amb8517649 [2,0,0,0,0,0|1,0,0]=3 4229 B4R0.1 CCC(=O)Cl Amb2792924 [2,0,0,0,0,0|1,0,0]=3 4230 B4R0.1 CCC(=O)F Amb10839798 [2,0,0,0,0,0|1,0,0]=3 4231 B4R0.1 CCC(=O)O Amb3938995 [2,0,0,0,0,0|0,0,0]=2 4232 B4R0.1 CCC(=O)S Amb26953905 [2,0,0,0,0,0|0,1,0]=3 4233 B4R0.1 CCC(=O)[O-] Amb22731204 [2,0,0,0,0,0|0,0,1]=3 4234 B4R0.1 CCC(=O)[O-] Amb8513417 [2,0,0,0,0,0|0,0,1]=3 4235 B4R0.1 CCC(C)=O Amb4606002 [2,0,0,0,0,0|1,0,0]=3 4236 B4R0.1 CCC(C)O Amb9748253 [2,0,0,0,0,0|1,0,1]=4 4237 B4R0.1 CCC(N)=O Amb3886522 [2,0,0,0,0,0|1,0,0]=3 4238 B4R0.1 CCC(N)=S Amb1114671 [2,0,0,0,0,0|1,1,0]=4 4239 B4R0.1 CCC(O)F Amb27763763 [2,0,0,0,0,0|1,0,1]=4 4240 B4R0.1 CCC(O)O Amb28280915 [2,0,0,0,0,0|0,0,2]=4 4241 B4R0.1 CCN(C)O Amb25746619 [2,0,0,0,0,0|2,0,0]=4 4242 B4R0.1 CCS(=O)Cl Amb24647938 [2,0,0,0,0,0|2,0,0]=4 4243 B4R0.1 CCS(=O)O Amb24332177 [2,0,0,0,0,0|1,0,0]=3 4244 B4R0.1 CCS(=O)[O-] Amb17943109 [2,0,0,0,0,0|1,0,1]=4 4245 B4R0.1 CCS(=O)[O-] Amb22411287 [2,0,0,0,0,0|1,0,1]=4 4246 B4R0.1 CCS(C)=O Amb25301908 [2,0,0,0,0,0|2,0,0]=4 4247 B4R0.1 CCS(N)=O Amb24734600 [2,0,0,0,0,0|2,0,0]=4 4248 B4R0.1 CC[C@@H](C)O Amb8514550 [2,0,0,0,0,0|1,0,1]=4 4249 B4R0.1 CC[C@H](C)O Amb4606006 [2,0,0,0,0,0|1,0,1]=4 4250 B4R0.1 CC[N+](=O)[O-] Amb6608854 [2,0,0,0,0,0|1,0,1]=4 4251 B4R0.1 CC[PH](=O)O Amb8391284 [2,0,0,0,0,0|1,0,0]=3 4252 B4R0.1 CNC(=O)Cl Amb17942998 [2,0,0,0,0,0|2,0,0]=4 4253 B4R0.1 CNC(=O)F Amb27778388 [2,0,0,0,0,0|2,0,0]=4 4254 B4R0.1 CNC(C)=O Amb3886523 [2,0,0,0,0,0|2,0,0]=4 4255 B4R0.1 CNC(N)=O Amb1152075 [2,0,0,0,0,0|2,0,0]=4 4256 B4R0.1 COC(=O)Cl Amb3940230 [2,0,0,0,0,0|2,0,0]=4 4257 B4R0.1 COC(=O)[O-] Amb25688001 [2,0,0,0,0,0|1,0,1]=4 4258 B4R0.1 COC(C)=O Amb6608821 [2,0,0,0,0,0|2,0,0]=4 4259 B4R0.1 COC(N)=O Amb6608701 [2,0,0,0,0,0|2,0,0]=4 4260 B4R0.1 CO[PH](=O)O Amb27489021 [2,0,0,0,0,0|2,0,0]=4 4261 B4R0.1 CSC(=O)Cl Amb22336225 [2,0,0,0,0,0|2,0,0]=4 4262 B4R0.1 CSC(N)=O Amb25082577 [2,0,0,0,0,0|2,0,0]=4 4263 B4R0.1 NC(=O)CBr Amb4477263 [2,0,0,0,0,0|2,0,0]=4 4264 B4R0.1 NC(=O)CCl Amb1933827 [2,0,0,0,0,0|2,0,0]=4 4265 B4R0.1 NC(=O)CF Amb6891955 [2,0,0,0,0,0|2,0,0]=4 4266 B4R0.1 NC(=O)CI Amb2688829 [2,0,0,0,0,0|2,0,0]=4 4267 B4R0.1 NC(=O)CO Amb1804460 [2,0,0,0,0,0|2,0,0]=4 4268 B4R0.1 NC(=O)CS Amb2724286 [2,0,0,0,0,0|2,0,0]=4 4269 B4R0.1 NC(=O)C[SiH3] Amb27807227 [2,0,0,0,0,0|1,1,0]=4 4270 B4R0.1 NCC(=O)Br Amb27810916 [2,0,0,0,0,0|2,0,0]=4 4271 B4R0.1 NCC(=O)Cl Amb6740270 [2,0,0,0,0,0|2,0,0]=4 4272 B4R0.1 NCC(=O)O Amb2609025 [2,0,0,0,0,0|1,0,0]=3 4273 B4R0.1 NCC(=O)O Amb33869972 [2,0,0,0,0,0|1,0,0]=3 4274 B4R0.1 NCC(=O)O Amb8516646 [2,0,0,0,0,0|1,0,0]=3 4275 B4R0.1 NCC(=O)S Amb17593043 [2,0,0,0,0,0|1,1,0]=4 4276 B4R0.1 NCC(=O)[O-] Amb21962917 [2,0,0,0,0,0|1,0,1]=4 4277 B4R0.1 NCC(=O)[O-] Amb22493796 [2,0,0,0,0,0|1,0,1]=4 4278 B4R0.1 NCC(=O)[O-] Amb440282 [2,0,0,0,0,0|1,0,1]=4 4279 B4R0.1 NCC(=O)[O-] Amb5722007 [2,0,0,0,0,0|1,0,1]=4 4280 B4R0.1 NCC(N)=O Amb10604177 [2,0,0,0,0,0|2,0,0]=4 4281 B4R0.1 NCC(N)=O Amb22234569 [2,0,0,0,0,0|2,0,0]=4 4282 B4R0.1 NCC(N)=O Amb6609053 [2,0,0,0,0,0|2,0,0]=4 4283 B4R0.1 NC[PH](=O)O Amb776032 [2,0,0,0,0,0|2,0,0]=4 4284 B4R0.1 NNC(=O)O Amb33512897 [2,0,0,0,0,0|2,0,0]=4 4285 B4R0.1 O=C(Br)CBr Amb2793022 [2,0,0,0,0,0|2,0,0]=4 4286 B4R0.1 O=C(Br)CCl Amb27168386 [2,0,0,0,0,0|2,0,0]=4 4287 B4R0.1 O=C(Cl)CBr Amb6608953 [2,0,0,0,0,0|2,0,0]=4 4288 B4R0.1 O=C(Cl)CCl Amb2793043 [2,0,0,0,0,0|2,0,0]=4 4289 B4R0.1 O=C(Cl)CF Amb16185604 [2,0,0,0,0,0|2,0,0]=4 4290 B4R0.1 O=C(Cl)CI Amb22045163 [2,0,0,0,0,0|2,0,0]=4 4291 B4R0.1 O=C(F)CCl Amb10839258 [2,0,0,0,0,0|2,0,0]=4 4292 B4R0.1 O=C(I)CCl Amb27639296 [2,0,0,0,0,0|2,0,0]=4 4293 B4R0.1 O=C(O)C=S Amb28042222 [2,0,0,0,0,0|1,0,1]=4 4294 B4R0.1 O=C(O)CBr Amb6608658 [2,0,0,0,0,0|1,0,0]=3 4295 B4R0.1 O=C(O)CCl Amb2792919 [2,0,0,0,0,0|1,0,0]=3 4296 B4R0.1 O=C(O)CF Amb6740304 [2,0,0,0,0,0|1,0,0]=3 4297 B4R0.1 O=C(O)CI Amb1916034 [2,0,0,0,0,0|1,0,0]=3 4298 B4R0.1 O=C(O)CO Amb2793019 [2,0,0,0,0,0|1,0,0]=3 4299 B4R0.1 O=C(O)CS Amb6608659 [2,0,0,0,0,0|1,0,0]=3 4300 B4R0.1 O=C(O)C[Na] Amb28255644 [2,0,0,0,0,0|1,0,0]=3 4301 B4R0.1 O=C(O)O[Na] Amb22411585 [2,0,0,0,0,0|2,0,0]=4 4302 B4R0.1 O=C([O-])CO Amb22730982 [2,0,0,0,0,0|1,0,1]=4 4303 B4R0.1 O=C([O-])CO Amb8516148 [2,0,0,0,0,0|1,0,1]=4 4304 B4R0.1 O=C([O-])CS Amb8395172 [2,0,0,0,0,0|1,0,1]=4 4305 B4R0.1 O=CC(=O)O Amb3940872 [2,0,0,0,0,0|1,0,1]=4 4306 B4R0.1 O=CC(=O)O Amb6609044 [2,0,0,0,0,0|1,0,1]=4 4307 B4R0.1 O=S(O)CCl Amb27468736 [2,0,0,0,0,0|2,0,0]=4 4308 B4R0.1 O=S(O)CO Amb27621151 [2,0,0,0,0,0|2,0,0]=4 4309 B4R0.2 BrCCCBr Amb2686759 [2,0,0,0,0,0|2,0,0]=4 4310 B4R0.2 BrCCCI Amb18090828 [2,0,0,0,0,0|2,0,0]=4 4311 B4R0.2 C#CCCC Amb3940495 [2,0,0,0,0,0|0,0,2]=4 4312 B4R0.2 C#CCCO Amb2685716 [2,0,0,0,0,0|0,0,2]=4 4313 B4R0.2 C#CCCO Amb34916688 [2,0,0,0,0,0|0,0,2]=4 4314 B4R0.2 C#NCCC Amb31132336 [2,0,0,0,0,0|1,0,1]=4 4315 B4R0.2 C=C=CCC Amb10565985 [2,0,0,0,0,0|0,0,2]=4 4316 B4R0.2 C=CCC=O Amb25058716 [2,0,0,0,0,0|0,0,2]=4 4317 B4R0.2 C=CCCBr Amb2684977 [2,0,0,0,0,0|1,0,1]=4 4318 B4R0.2 C=CCCC Amb8514606 [2,0,0,0,0,0|0,0,1]=3 4319 B4R0.2 C=CCCCl Amb22229725 [2,0,0,0,0,0|1,0,1]=4 4320 B4R0.2 C=CCCF Amb27869562 [2,0,0,0,0,0|1,0,1]=4 4321 B4R0.2 C=CCCI Amb33546459 [2,0,0,0,0,0|1,0,1]=4 4322 B4R0.2 C=CCCN Amb10601640 [2,0,0,0,0,0|1,0,1]=4 4323 B4R0.2 C=CCCN Amb33484127 [2,0,0,0,0,0|1,0,1]=4 4324 B4R0.2 C=CCCN Amb5717434 [2,0,0,0,0,0|1,0,1]=4 4325 B4R0.2 C=CCCO Amb6609024 [2,0,0,0,0,0|0,0,2]=4 4326 B4R0.2 C=CCC[NH3+] Amb5718705 [2,0,0,0,0,0|1,0,1]=4 4327 B4R0.2 C=CCNC Amb3940004 [2,0,0,0,0,0|1,0,1]=4 4328 B4R0.2 C=CCSC Amb3940478 [2,0,0,0,0,0|1,0,1]=4 4329 B4R0.2 C=CNCC Amb24120592 [2,0,0,0,0,0|1,0,1]=4 4330 B4R0.2 C=COCC Amb2447619 [2,0,0,0,0,0|1,0,1]=4 4331 B4R0.2 C=CSCC Amb10604172 [2,0,0,0,0,0|1,0,1]=4 4332 B4R0.2 C=NCCO Amb27827243 [2,0,0,0,0,0|1,0,1]=4 4333 B4R0.2 CC#CC=O Amb24477088 [2,0,0,0,0,0|0,0,2]=4 4334 B4R0.2 CC#CCO Amb2685715 [2,0,0,0,0,0|0,0,2]=4 4335 B4R0.2 CCCC#N Amb6662840 [2,0,0,0,0,0|1,0,1]=4 4336 B4R0.2 CCCC=O Amb3940026 [2,0,0,0,0,0|0,0,0]=2 4337 B4R0.2 CCCCBr Amb2795761 [2,0,0,0,0,0|1,0,0]=3 4338 B4R0.2 CCCCCl Amb3940273 [2,0,0,0,0,0|1,0,0]=3 4339 B4R0.2 CCCCF Amb2688075 [2,0,0,0,0,0|1,0,0]=3 4340 B4R0.2 CCCCI Amb4606011 [2,0,0,0,0,0|1,0,0]=3 4341 B4R0.2 CCCCN Amb22002333 [2,0,0,0,0,0|1,0,0]=3 4342 B4R0.2 CCCCN Amb3939832 [2,0,0,0,0,0|1,0,0]=3 4343 B4R0.2 CCCCO Amb2793053 [2,0,0,0,0,0|0,0,0]=2 4344 B4R0.2 CCCCS Amb8513452 [2,0,0,0,0,0|0,1,0]=3 4345 B4R0.2 CCCC[SiH3] Amb19883792 [2,0,0,0,0,0|0,1,0]=3 4346 B4R0.2 CCCNC Amb1125050 [2,0,0,0,0,0|1,0,1]=4 4347 B4R0.2 CCCNC Amb13951517 [2,0,0,0,0,0|1,0,1]=4 4348 B4R0.2 CCCNN Amb22490873 [2,0,0,0,0,0|2,0,0]=4 4349 B4R0.2 CCCNN Amb6246347 [2,0,0,0,0,0|2,0,0]=4 4350 B4R0.2 CCCNN Amb9147579 [2,0,0,0,0,0|2,0,0]=4 4351 B4R0.2 CCCOC Amb22227974 [2,0,0,0,0,0|1,0,1]=4 4352 B4R0.2 CCCON Amb21929105 [2,0,0,0,0,0|2,0,0]=4 4353 B4R0.2 CCCON Amb4061686 [2,0,0,0,0,0|2,0,0]=4 4354 B4R0.2 CCCSC Amb22045208 [2,0,0,0,0,0|1,0,1]=4 4355 B4R0.2 CCN=C=O Amb3939325 [2,0,0,0,0,0|1,0,1]=4 4356 B4R0.2 CCNC=O Amb22229692 [2,0,0,0,0,0|1,0,0]=3 4357 B4R0.2 CCNC=S Amb24476965 [2,0,0,0,0,0|1,1,0]=4 4358 B4R0.2 CCNCC Amb21520464 [2,0,0,0,0,0|1,0,1]=4 4359 B4R0.2 CCNCC Amb22047271 [2,0,0,0,0,0|1,0,1]=4 4360 B4R0.2 CCNCC Amb2793074 [2,0,0,0,0,0|1,0,1]=4 4361 B4R0.2 CCNCC Amb8513512 [2,0,0,0,0,0|1,0,1]=4 4362 B4R0.2 CCNCO Amb28048578 [2,0,0,0,0,0|1,0,0]=3 4363 B4R0.2 CCOC=O Amb3429671 [2,0,0,0,0,0|1,0,0]=3 4364 B4R0.2 CCOCBr Amb26033270 [2,0,0,0,0,0|2,0,0]=4 4365 B4R0.2 CCOCC Amb10807375 [2,0,0,0,0,0|1,0,1]=4 4366 B4R0.2 CCOCC Amb8513220 [2,0,0,0,0,0|1,0,1]=4 4367 B4R0.2 CCOCCl Amb8516247 [2,0,0,0,0,0|2,0,0]=4 4368 B4R0.2 CCOCO Amb25042105 [2,0,0,0,0,0|1,0,0]=3 4369 B4R0.2 CCPCC Amb19889866 [2,0,0,0,0,0|1,0,1]=4 4370 B4R0.2 CCSCC Amb8386438 [2,0,0,0,0,0|1,0,1]=4 4371 B4R0.2 CCSCCl Amb27599798 [2,0,0,0,0,0|2,0,0]=4 4372 B4R0.2 CC[AlH3+]CC Amb22053728 [2,0,0,0,0,0|1,0,1]=4 4373 B4R0.2 CC[Ga]CC Amb33513021 [2,0,0,0,0,0|1,0,1]=4 4374 B4R0.2 CC[OH+]CC Amb27461536 [2,0,0,0,0,0|1,0,1]=4 4375 B4R0.2 CC[SiH2]CC Amb19893778 [2,0,0,0,0,0|0,1,1]=4 4376 B4R0.2 CC[Zn]CC Amb8514301 [2,0,0,0,0,0|1,0,1]=4 4377 B4R0.2 CC\C=C/I Amb27985379 [2,0,0,0,0,0|1,0,1]=4 4378 B4R0.2 CC\C=C\Cl Amb25024567 [2,0,0,0,0,0|1,0,1]=4 4379 B4R0.2 CC\C=C\I Amb28346900 [2,0,0,0,0,0|1,0,1]=4 4380 B4R0.2 CC\C=N\O Amb24369620 [2,0,0,0,0,0|1,0,1]=4 4381 B4R0.2 CNCC=O Amb28133605 [2,0,0,0,0,0|1,0,0]=3 4382 B4R0.2 CNCCBr Amb20224134 [2,0,0,0,0,0|2,0,0]=4 4383 B4R0.2 CNCCBr Amb22753915 [2,0,0,0,0,0|2,0,0]=4 4384 B4R0.2 CNCCCl Amb19338156 [2,0,0,0,0,0|2,0,0]=4 4385 B4R0.2 CNCCCl Amb2196487 [2,0,0,0,0,0|2,0,0]=4 4386 B4R0.2 CNCCF Amb25292993 [2,0,0,0,0,0|2,0,0]=4 4387 B4R0.2 CNCCF Amb32661249 [2,0,0,0,0,0|2,0,0]=4 4388 B4R0.2 CNCCI Amb2099455 [2,0,0,0,0,0|2,0,0]=4 4389 B4R0.2 CNCCI Amb6374325 [2,0,0,0,0,0|2,0,0]=4 4390 B4R0.2 CNCCN Amb19958520 [2,0,0,0,0,0|2,0,0]=4 4391 B4R0.2 CNCCN Amb8513507 [2,0,0,0,0,0|2,0,0]=4 4392 B4R0.2 CNCCO Amb2793086 [2,0,0,0,0,0|1,0,0]=3 4393 B4R0.2 CNCCP Amb27786982 [2,0,0,0,0,0|2,0,0]=4 4394 B4R0.2 CNCCS Amb18641549 [2,0,0,0,0,0|1,1,0]=4 4395 B4R0.2 CNCCS Amb32651884 [2,0,0,0,0,0|1,1,0]=4 4396 B4R0.2 COCC=O Amb3941034 [2,0,0,0,0,0|1,0,0]=3 4397 B4R0.2 COCCBr Amb2685166 [2,0,0,0,0,0|2,0,0]=4 4398 B4R0.2 COCCCl Amb3940260 [2,0,0,0,0,0|2,0,0]=4 4399 B4R0.2 COCCI Amb22228848 [2,0,0,0,0,0|2,0,0]=4 4400 B4R0.2 COCCN Amb3939058 [2,0,0,0,0,0|2,0,0]=4 4401 B4R0.2 COCCO Amb4605828 [2,0,0,0,0,0|1,0,0]=3 4402 B4R0.2 COCCS Amb6255784 [2,0,0,0,0,0|1,1,0]=4 4403 B4R0.2 CPCCO Amb27594723 [2,0,0,0,0,0|1,0,0]=3 4404 B4R0.2 CSCC=O Amb27250514 [2,0,0,0,0,0|1,0,0]=3 4405 B4R0.2 CSCCBr Amb18176565 [2,0,0,0,0,0|2,0,0]=4 4406 B4R0.2 CSCCCl Amb2685909 [2,0,0,0,0,0|2,0,0]=4 4407 B4R0.2 CSCCI Amb24477438 [2,0,0,0,0,0|2,0,0]=4 4408 B4R0.2 CSCCN Amb2724163 [2,0,0,0,0,0|2,0,0]=4 4409 B4R0.2 CSCCN Amb6754152 [2,0,0,0,0,0|2,0,0]=4 4410 B4R0.2 CSCCO Amb3568993 [2,0,0,0,0,0|1,0,0]=3 4411 B4R0.2 C\C=C/CC Amb8517400 [2,0,0,0,0,0|1,0,1]=4 4412 B4R0.2 C\C=C\C=O Amb6891937 [2,0,0,0,0,0|0,0,2]=4 4413 B4R0.2 C\C=C\CC Amb9134767 [2,0,0,0,0,0|1,0,1]=4 4414 B4R0.2 C\C=C\CO Amb9277796 [2,0,0,0,0,0|0,0,2]=4 4415 B4R0.2 C\N=C\C=O Amb27849988 [2,0,0,0,0,0|1,0,1]=4 4416 B4R0.2 ClCCCBr Amb6608966 [2,0,0,0,0,0|2,0,0]=4 4417 B4R0.2 ClCCCCl Amb2793083 [2,0,0,0,0,0|2,0,0]=4 4418 B4R0.2 ClCCCI Amb2686137 [2,0,0,0,0,0|2,0,0]=4 4419 B4R0.2 FCCCBr Amb10845700 [2,0,0,0,0,0|2,0,0]=4 4420 B4R0.2 FCCCF Amb10839359 [2,0,0,0,0,0|2,0,0]=4 4421 B4R0.2 FCCCI Amb10838561 [2,0,0,0,0,0|2,0,0]=4 4422 B4R0.2 FCCCS Amb28344639 [2,0,0,0,0,0|1,1,0]=4 4423 B4R0.2 ICCCI Amb8514578 [2,0,0,0,0,0|2,0,0]=4 4424 B4R0.2 N#CCC=O Amb9669129 [2,0,0,0,0,0|1,0,1]=4 4425 B4R0.2 N#CCCO Amb534940 [2,0,0,0,0,0|1,0,1]=4 4426 B4R0.2 NCCC=S Amb28366830 [2,0,0,0,0,0|1,1,0]=4 4427 B4R0.2 NCCCBr Amb22489540 [2,0,0,0,0,0|2,0,0]=4 4428 B4R0.2 NCCCBr Amb6609025 [2,0,0,0,0,0|2,0,0]=4 4429 B4R0.2 NCCCBr Amb932825 [2,0,0,0,0,0|2,0,0]=4 4430 B4R0.2 NCCCCl Amb2720482 [2,0,0,0,0,0|2,0,0]=4 4431 B4R0.2 NCCCCl Amb6306670 [2,0,0,0,0,0|2,0,0]=4 4432 B4R0.2 NCCCF Amb16186035 [2,0,0,0,0,0|2,0,0]=4 4433 B4R0.2 NCCCF Amb19374917 [2,0,0,0,0,0|2,0,0]=4 4434 B4R0.2 NCCCI Amb33249705 [2,0,0,0,0,0|2,0,0]=4 4435 B4R0.2 NCCCN Amb21953130 [2,0,0,0,0,0|2,0,0]=4 4436 B4R0.2 NCCCN Amb21953284 [2,0,0,0,0,0|2,0,0]=4 4437 B4R0.2 NCCCN Amb2793020 [2,0,0,0,0,0|2,0,0]=4 4438 B4R0.2 NCCCO Amb22229163 [2,0,0,0,0,0|1,0,0]=3 4439 B4R0.2 NCCCO Amb2793042 [2,0,0,0,0,0|1,0,0]=3 4440 B4R0.2 NCCCS Amb17500723 [2,0,0,0,0,0|1,1,0]=4 4441 B4R0.2 NCCCS Amb18368606 [2,0,0,0,0,0|1,1,0]=4 4442 B4R0.2 NCCCS Amb20623313 [2,0,0,0,0,0|1,1,0]=4 4443 B4R0.2 NCCNO Amb24476856 [2,0,0,0,0,0|2,0,0]=4 4444 B4R0.2 NNCCO Amb2695098 [2,0,0,0,0,0|2,0,0]=4 4445 B4R0.2 NOCCO Amb17190317 [2,0,0,0,0,0|2,0,0]=4 4446 B4R0.2 N[NH2+]CCO Amb27867172 [2,0,0,0,0,0|2,0,0]=4 4447 B4R0.2 O=CCC=O Amb33512721 [2,0,0,0,0,0|1,0,1]=4 4448 B4R0.2 O=CCCCl Amb16233605 [2,0,0,0,0,0|1,0,0]=3 4449 B4R0.2 O=CCCF Amb21858609 [2,0,0,0,0,0|1,0,0]=3 4450 B4R0.2 O=CCCI Amb26847605 [2,0,0,0,0,0|1,0,0]=3 4451 B4R0.2 O=CCCO Amb24412391 [2,0,0,0,0,0|1,0,0]=3 4452 B4R0.2 O=CCCS Amb27755008 [2,0,0,0,0,0|1,0,0]=3 4453 B4R0.2 O=CNCO Amb27754843 [2,0,0,0,0,0|2,0,0]=4 4454 B4R0.2 O=CNCS Amb27846487 [2,0,0,0,0,0|2,0,0]=4 4455 B4R0.2 OCCCBr Amb932815 [2,0,0,0,0,0|1,0,0]=3 4456 B4R0.2 OCCCCl Amb6608905 [2,0,0,0,0,0|1,0,0]=3 4457 B4R0.2 OCCCF Amb2688406 [2,0,0,0,0,0|1,0,0]=3 4458 B4R0.2 OCCCI Amb2688881 [2,0,0,0,0,0|1,0,0]=3 4459 B4R0.2 OCCCO Amb2793089 [2,0,0,0,0,0|1,0,0]=3 4460 B4R0.2 OCCCS Amb8517566 [2,0,0,0,0,0|1,0,0]=3 4461 B4R0.2 OCCNBr Amb27265947 [2,0,0,0,0,0|2,0,0]=4 4462 B4R0.2 OCCNCl Amb27206146 [2,0,0,0,0,0|2,0,0]=4 4463 B4R0.2 OCCNF Amb27775764 [2,0,0,0,0,0|2,0,0]=4 4464 B4R0.2 OCNCCl Amb16224807 [2,0,0,0,0,0|2,0,0]=4 4465 B4R0.2 OCNCO Amb2793034 [2,0,0,0,0,0|2,0,0]=4 4466 B4R0.2 OCOCCl Amb28280946 [2,0,0,0,0,0|2,0,0]=4 4467 B4R0.2 OCSCO Amb27812260 [2,0,0,0,0,0|2,0,0]=4 4468 B4R0.2 ONCCF Amb25931834 [2,0,0,0,0,0|2,0,0]=4 4469 B4R0.2 O\C=C\CCl Amb27449221 [2,0,0,0,0,0|1,0,1]=4 4470 B4R0.2 PCCCP Amb22227719 [2,0,0,0,0,0|2,0,0]=4 4471 B4R0.2 SCCCBr Amb22270209 [2,0,0,0,0,0|1,1,0]=4 4472 B4R0.2 SCCCS Amb7809241 [2,0,0,0,0,0|1,1,0]=4 4473 B4R0.2 [C-]#[N+]CCC Amb24117082 [2,0,0,0,0,0|1,0,1]=4 4474 B4R0.2 [SiH3]CCCCl Amb28346288 [2,0,0,0,0,0|1,1,0]=4 4475 B6R0.1 C#CC(=O)CCC Amb25696103 [1,1,0,0,0,0|1,0,0]=3 4476 B6R0.1 C#CC(=O)COC Amb27794422 [1,1,0,0,0,0|2,0,0]=4 4477 B6R0.1 C#CC(=O)CSC Amb27667610 [1,1,0,0,0,0|2,0,0]=4 4478 B6R0.1 C#CC(=O)NCC Amb24057137 [1,1,0,0,0,0|2,0,0]=4 4479 B6R0.1 C#CC(=O)OCC Amb2182884 [1,1,0,0,0,0|2,0,0]=4 4480 B6R0.1 C#CC(O)CCC Amb4034577 [1,1,0,0,0,0|1,0,1]=4 4481 B6R0.1 C#CCC(=O)OC Amb5722531 [1,1,0,0,0,0|0,0,2]=4 4482 B6R0.1 C#C[C@@H](O)CCC Amb26381982 [1,1,0,0,0,0|1,0,1]=4 4483 B6R0.1 C#C[C@H](O)CCC Amb26865453 [1,1,0,0,0,0|1,0,1]=4 4484 B6R0.1 C=C(C=O)CCF Amb28253937 [1,1,0,0,0,0|2,0,0]=4 4485 B6R0.1 C=C(C=O)COC Amb28066424 [1,1,0,0,0,0|2,0,0]=4 4486 B6R0.1 C=C(C=O)SCC Amb28050273 [1,1,0,0,0,0|2,0,0]=4 4487 B6R0.1 C=C(CBr)CCC Amb26493276 [1,1,0,0,0,0|2,0,0]=4 4488 B6R0.1 C=C(CC)CCC Amb22228810 [1,1,0,0,0,0|2,0,0]=4 4489 B6R0.1 C=C(CCC)OC Amb27433625 [1,1,0,0,0,0|1,0,0]=3 4490 B6R0.1 C=C(CCl)CCC Amb25871331 [1,1,0,0,0,0|2,0,0]=4 4491 B6R0.1 C=C(CN)CCC Amb33204217 [1,1,0,0,0,0|2,0,0]=4 4492 B6R0.1 C=C(CO)CCN Amb24426567 [1,1,0,0,0,0|2,0,0]=4 4493 B6R0.1 C=C(CO)CCO Amb25825219 [1,1,0,0,0,0|2,0,0]=4 4494 B6R0.1 C=CC(=O)CCC Amb8630773 [1,1,0,0,0,0|1,0,0]=3 4495 B6R0.1 C=CC(=O)CCCl Amb24446646 [1,1,0,0,0,0|2,0,0]=4 4496 B6R0.1 C=CC(=O)CCF Amb33480698 [1,1,0,0,0,0|2,0,0]=4 4497 B6R0.1 C=CC(=O)COC Amb22168158 [1,1,0,0,0,0|2,0,0]=4 4498 B6R0.1 C=CC(=O)CSC Amb26974013 [1,1,0,0,0,0|2,0,0]=4 4499 B6R0.1 C=CC(=O)NCC Amb9480404 [1,1,0,0,0,0|2,0,0]=4 4500 B6R0.1 C=CC(=O)OCC Amb3941513 [1,1,0,0,0,0|2,0,0]=4 4501 B6R0.1 C=CC(O)CCC Amb22002474 [1,1,0,0,0,0|1,0,1]=4 4502 B6R0.1 CC#CC(=O)OC Amb2689389 [1,1,0,0,0,0|0,0,2]=4 4503 B6R0.1 CCC(=O)CCBr Amb27401869 [1,1,0,0,0,0|2,0,0]=4 4504 B6R0.1 CCC(=O)CCI Amb27232362 [1,1,0,0,0,0|2,0,0]=4 4505 B6R0.1 CCC(=O)CCN Amb18202790 [1,1,0,0,0,0|2,0,0]=4 4506 B6R0.1 CCC(=O)CCO Amb26872941 [1,1,0,0,0,0|2,0,0]=4 4507 B6R0.1 CCC(=O)CCS Amb24733984 [1,1,0,0,0,0|2,0,0]=4 4508 B6R0.1 CCC(=O)CNC Amb26408381 [1,1,0,0,0,0|2,0,0]=4 4509 B6R0.1 CCC(=O)CNC Amb32410106 [1,1,0,0,0,0|2,0,0]=4 4510 B6R0.1 CCC(=O)COC Amb19515551 [1,1,0,0,0,0|2,0,0]=4 4511 B6R0.1 CCC(=O)CSC Amb8393183 [1,1,0,0,0,0|2,0,0]=4 4512 B6R0.1 CCCC(=N)NC Amb27254401 [1,1,0,0,0,0|2,0,0]=4 4513 B6R0.1 CCCC(=O)CBr Amb24433274 [1,1,0,0,0,0|1,0,0]=3 4514 B6R0.1 CCCC(=O)CC Amb8513390 [1,1,0,0,0,0|1,0,0]=3 4515 B6R0.1 CCCC(=O)CCl Amb19372924 [1,1,0,0,0,0|1,0,0]=3 4516 B6R0.1 CCCC(=O)CI Amb27876205 [1,1,0,0,0,0|1,0,0]=3 4517 B6R0.1 CCCC(=O)CN Amb17593086 [1,1,0,0,0,0|1,0,0]=3 4518 B6R0.1 CCCC(=O)CN Amb28827644 [1,1,0,0,0,0|1,0,0]=3 4519 B6R0.1 CCCC(=O)CO Amb25125092 [1,1,0,0,0,0|0,0,0]=2 4520 B6R0.1 CCCC(=O)NC Amb3886531 [1,1,0,0,0,0|1,0,0]=3 4521 B6R0.1 CCCC(=O)NN Amb6366352 [1,1,0,0,0,0|1,0,0]=3 4522 B6R0.1 CCCC(=O)NO Amb6260495 [1,1,0,0,0,0|0,0,0]=2 4523 B6R0.1 CCCC(=O)OC Amb8516697 [1,1,0,0,0,0|0,0,0]=2 4524 B6R0.1 CCCC(=O)SC Amb8393184 [1,1,0,0,0,0|0,1,0]=3 4525 B6R0.1 CCCC(=S)NC Amb27259343 [1,1,0,0,0,0|1,1,0]=4 4526 B6R0.1 CCCC(=S)OC Amb22043317 [1,1,0,0,0,0|0,1,0]=3 4527 B6R0.1 CCCC(C)C=O Amb3939898 [1,1,0,0,0,0|1,0,1]=4 4528 B6R0.1 CCCC(C)CO Amb8999036 [1,1,0,0,0,0|1,0,1]=4 4529 B6R0.1 CCCC(C)OC Amb26319305 [1,1,0,0,0,0|1,0,1]=4 4530 B6R0.1 CCCC(C)ON Amb24424249 [1,1,0,0,0,0|1,0,1]=4 4531 B6R0.1 CCCC(Cl)C=O Amb18124277 [1,1,0,0,0,0|1,0,1]=4 4532 B6R0.1 CCCC(Cl)CO Amb25950697 [1,1,0,0,0,0|1,0,1]=4 4533 B6R0.1 CCCC(I)CO Amb27268581 [1,1,0,0,0,0|1,0,1]=4 4534 B6R0.1 CCCC(N)CO Amb3940003 [1,1,0,0,0,0|1,0,1]=4 4535 B6R0.1 CCCC(O)C#N Amb9294949 [1,1,0,0,0,0|1,0,1]=4 4536 B6R0.1 CCCC(O)CBr Amb24365915 [1,1,0,0,0,0|1,0,1]=4 4537 B6R0.1 CCCC(O)CC Amb4037277 [1,1,0,0,0,0|1,0,1]=4 4538 B6R0.1 CCCC(O)CCl Amb24470722 [1,1,0,0,0,0|1,0,1]=4 4539 B6R0.1 CCCC(O)CF Amb26604826 [1,1,0,0,0,0|1,0,1]=4 4540 B6R0.1 CCCC(O)CN Amb8630337 [1,1,0,0,0,0|1,0,1]=4 4541 B6R0.1 CCCC(O)CO Amb8385613 [1,1,0,0,0,0|0,0,2]=4 4542 B6R0.1 CCCC(O)OC Amb27447501 [1,1,0,0,0,0|0,0,2]=4 4543 B6R0.1 CCCN(C)N=O Amb25231763 [1,1,0,0,0,0|2,0,0]=4 4544 B6R0.1 CCCN(N)C=O Amb18121867 [1,1,0,0,0,0|2,0,0]=4 4545 B6R0.1 CCCN(O)C#N Amb28196833 [1,1,0,0,0,0|2,0,0]=4 4546 B6R0.1 CCC[C@@H](C)CO Amb22823174 [1,1,0,0,0,0|1,0,1]=4 4547 B6R0.1 CCC[C@@H](N)CO Amb22756532 [1,1,0,0,0,0|1,0,1]=4 4548 B6R0.1 CCC[C@@H](N)CO Amb3941479 [1,1,0,0,0,0|1,0,1]=4 4549 B6R0.1 CCC[C@@H](O)CC Amb25781736 [1,1,0,0,0,0|1,0,1]=4 4550 B6R0.1 CCC[C@@H](O)CCl Amb22736025 [1,1,0,0,0,0|1,0,1]=4 4551 B6R0.1 CCC[C@@H](O)CN Amb24428580 [1,1,0,0,0,0|1,0,1]=4 4552 B6R0.1 CCC[C@H](C)C=O Amb28248332 [1,1,0,0,0,0|1,0,1]=4 4553 B6R0.1 CCC[C@H](C)CO Amb27423081 [1,1,0,0,0,0|1,0,1]=4 4554 B6R0.1 CCC[C@H](F)C=O Amb27644096 [1,1,0,0,0,0|1,0,1]=4 4555 B6R0.1 CCC[C@H](N)C=O Amb27488589 [1,1,0,0,0,0|1,0,1]=4 4556 B6R0.1 CCC[C@H](N)CO Amb33869036 [1,1,0,0,0,0|1,0,1]=4 4557 B6R0.1 CCC[C@H](N)CO Amb3941480 [1,1,0,0,0,0|1,0,1]=4 4558 B6R0.1 CCC[C@H](O)CC Amb26022373 [1,1,0,0,0,0|1,0,1]=4 4559 B6R0.1 CCC[C@H](O)CCl Amb22735942 [1,1,0,0,0,0|1,0,1]=4 4560 B6R0.1 CCC[C@H](O)CF Amb28348521 [1,1,0,0,0,0|1,0,1]=4 4561 B6R0.1 CCC[C@H](O)CN Amb33204239 [1,1,0,0,0,0|1,0,1]=4 4562 B6R0.1 CCC\C(C)=N\O Amb24693854 [1,1,0,0,0,0|1,0,0]=3 4563 B6R0.1 CCC\C(Cl)=N\O Amb27829565 [1,1,0,0,0,0|1,0,0]=3 4564 B6R0.1 CCC\C(N)=N\N Amb2696446 [1,1,0,0,0,0|2,0,0]=4 4565 B6R0.1 CCC\C(N)=N\O Amb19890174 [1,1,0,0,0,0|1,0,0]=3 4566 B6R0.1 CCC\C(N)=N\O Amb2724965 [1,1,0,0,0,0|1,0,0]=3 4567 B6R0.1 CCNC(=O)CBr Amb2090261 [1,1,0,0,0,0|2,0,0]=4 4568 B6R0.1 CCNC(=O)CC Amb3886529 [1,1,0,0,0,0|2,0,0]=4 4569 B6R0.1 CCNC(=O)CCl Amb1643925 [1,1,0,0,0,0|2,0,0]=4 4570 B6R0.1 CCNC(=O)CF Amb28316230 [1,1,0,0,0,0|2,0,0]=4 4571 B6R0.1 CCNC(=O)CI Amb23512617 [1,1,0,0,0,0|2,0,0]=4 4572 B6R0.1 CCNC(=O)CN Amb21956656 [1,1,0,0,0,0|2,0,0]=4 4573 B6R0.1 CCNC(=O)CN Amb426696 [1,1,0,0,0,0|2,0,0]=4 4574 B6R0.1 CCNC(=O)CO Amb9421415 [1,1,0,0,0,0|1,0,0]=3 4575 B6R0.1 CCNC(=O)NC Amb24120627 [1,1,0,0,0,0|2,0,0]=4 4576 B6R0.1 CCNC(=O)NN Amb8854035 [1,1,0,0,0,0|2,0,0]=4 4577 B6R0.1 CCNC(=O)NO Amb28345704 [1,1,0,0,0,0|1,0,0]=3 4578 B6R0.1 CCNC(=O)OC Amb22734099 [1,1,0,0,0,0|1,0,0]=3 4579 B6R0.1 CCN\C(C)=N\O Amb28429781 [1,1,0,0,0,0|2,0,0]=4 4580 B6R0.1 CCOC(=N)CO Amb17593094 [1,1,0,0,0,0|2,0,0]=4 4581 B6R0.1 CCOC(=O)C#N Amb8513165 [1,1,0,0,0,0|2,0,0]=4 4582 B6R0.1 CCOC(=O)C=O Amb8394919 [1,1,0,0,0,0|1,0,1]=4 4583 B6R0.1 CCOC(=O)CBr Amb2687783 [1,1,0,0,0,0|2,0,0]=4 4584 B6R0.1 CCOC(=O)CC Amb8513446 [1,1,0,0,0,0|2,0,0]=4 4585 B6R0.1 CCOC(=O)CCl Amb3941486 [1,1,0,0,0,0|2,0,0]=4 4586 B6R0.1 CCOC(=O)CF Amb2687849 [1,1,0,0,0,0|2,0,0]=4 4587 B6R0.1 CCOC(=O)CI Amb8514613 [1,1,0,0,0,0|2,0,0]=4 4588 B6R0.1 CCOC(=O)CN Amb2697340 [1,1,0,0,0,0|2,0,0]=4 4589 B6R0.1 CCOC(=O)CN Amb8513174 [1,1,0,0,0,0|2,0,0]=4 4590 B6R0.1 CCOC(=O)CO Amb3939196 [1,1,0,0,0,0|1,0,0]=3 4591 B6R0.1 CCOC(=O)CS Amb6608734 [1,1,0,0,0,0|1,1,0]=4 4592 B6R0.1 CCOC(=O)C[NH3+] Amb24113741 [1,1,0,0,0,0|2,0,0]=4 4593 B6R0.1 CCOC(=O)NC Amb8516631 [1,1,0,0,0,0|2,0,0]=4 4594 B6R0.1 CCOC(=O)NCl Amb24381604 [1,1,0,0,0,0|2,0,0]=4 4595 B6R0.1 CCOC(=O)NN Amb2780496 [1,1,0,0,0,0|2,0,0]=4 4596 B6R0.1 CCOC(=O)NO Amb8384324 [1,1,0,0,0,0|1,0,0]=3 4597 B6R0.1 CCOC(=O)OC Amb22732530 [1,1,0,0,0,0|1,0,0]=3 4598 B6R0.1 CCO[PH](=O)OC Amb27961218 [1,1,0,0,0,0|2,0,0]=4 4599 B6R0.1 CCO\C(C)=N/O Amb5719848 [1,1,0,0,0,0|2,0,0]=4 4600 B6R0.1 CCO\C(C)=N\O Amb28050479 [1,1,0,0,0,0|2,0,0]=4 4601 B6R0.1 CCSC(=O)C=O Amb27403471 [1,1,0,0,0,0|1,0,1]=4 4602 B6R0.1 CCSC(=O)CC Amb22043397 [1,1,0,0,0,0|2,0,0]=4 4603 B6R0.1 CCSC(=O)NC Amb28368964 [1,1,0,0,0,0|2,0,0]=4 4604 B6R0.1 CCSC(=S)OC Amb28280041 [1,1,0,0,0,0|1,1,0]=4 4605 B6R0.1 CC\C=C(/C)C=O Amb3940425 [1,1,0,0,0,0|1,0,1]=4 4606 B6R0.1 CC\C=C(/C)CO Amb22347713 [1,1,0,0,0,0|1,0,1]=4 4607 B6R0.1 CC\C=C(/Cl)C=O Amb28050393 [1,1,0,0,0,0|1,0,1]=4 4608 B6R0.1 CC\C=C(/O)C=O Amb27849683 [1,1,0,0,0,0|0,0,1]=3 4609 B6R0.1 CC\C=C(\C)CO Amb24677771 [1,1,0,0,0,0|1,0,1]=4 4610 B6R0.1 CC\C=C(\O)C=O Amb27195226 [1,1,0,0,0,0|0,0,1]=3 4611 B6R0.1 CNC(=O)CCBr Amb17332890 [1,1,0,0,0,0|2,0,0]=4 4612 B6R0.1 CNC(=O)CCCl Amb1130566 [1,1,0,0,0,0|2,0,0]=4 4613 B6R0.1 CNC(=O)CCN Amb1139824 [1,1,0,0,0,0|2,0,0]=4 4614 B6R0.1 CNC(=O)CCN Amb6893005 [1,1,0,0,0,0|2,0,0]=4 4615 B6R0.1 CNC(=O)CCO Amb10608414 [1,1,0,0,0,0|2,0,0]=4 4616 B6R0.1 CNC(=O)CCS Amb25727705 [1,1,0,0,0,0|2,0,0]=4 4617 B6R0.1 CNC(=O)COC Amb22275885 [1,1,0,0,0,0|2,0,0]=4 4618 B6R0.1 CNCC(=O)CF Amb33377251 [1,1,0,0,0,0|2,0,0]=4 4619 B6R0.1 CNCC(=O)NC Amb2371052 [1,1,0,0,0,0|2,0,0]=4 4620 B6R0.1 CNCC(=O)NC Amb423473 [1,1,0,0,0,0|2,0,0]=4 4621 B6R0.1 CNCC(=O)NN Amb16186920 [1,1,0,0,0,0|2,0,0]=4 4622 B6R0.1 CNCC(=O)NN Amb32667538 [1,1,0,0,0,0|2,0,0]=4 4623 B6R0.1 CNCC(=O)OC Amb1153975 [1,1,0,0,0,0|1,0,0]=3 4624 B6R0.1 CNCC(=O)OC Amb2371116 [1,1,0,0,0,0|1,0,0]=3 4625 B6R0.1 CNC\C(N)=N\O Amb24648670 [1,1,0,0,0,0|2,0,0]=4 4626 B6R0.1 CNNC(=O)OC Amb22411352 [1,1,0,0,0,0|2,0,0]=4 4627 B6R0.1 COC(=N)CCBr Amb27478260 [1,1,0,0,0,0|2,0,0]=4 4628 B6R0.1 COC(=N)CCCl Amb19958799 [1,1,0,0,0,0|2,0,0]=4 4629 B6R0.1 COC(=N)CCCl Amb22234673 [1,1,0,0,0,0|2,0,0]=4 4630 B6R0.1 COC(=N)CCO Amb17593095 [1,1,0,0,0,0|2,0,0]=4 4631 B6R0.1 COC(=O)CC#N Amb3940296 [1,1,0,0,0,0|1,0,1]=4 4632 B6R0.1 COC(=O)CC=O Amb18199826 [1,1,0,0,0,0|1,0,1]=4 4633 B6R0.1 COC(=O)CCBr Amb3940216 [1,1,0,0,0,0|1,0,0]=3 4634 B6R0.1 COC(=O)CCCl Amb8387395 [1,1,0,0,0,0|1,0,0]=3 4635 B6R0.1 COC(=O)CCI Amb24442243 [1,1,0,0,0,0|1,0,0]=3 4636 B6R0.1 COC(=O)CCN Amb1105940 [1,1,0,0,0,0|1,0,0]=3 4637 B6R0.1 COC(=O)CCN Amb2605985 [1,1,0,0,0,0|1,0,0]=3 4638 B6R0.1 COC(=O)CCO Amb8855137 [1,1,0,0,0,0|1,0,0]=3 4639 B6R0.1 COC(=O)CCS Amb2725528 [1,1,0,0,0,0|1,0,0]=3 4640 B6R0.1 COC(=O)CON Amb18640433 [1,1,0,0,0,0|2,0,0]=4 4641 B6R0.1 COC(=O)CON Amb29848090 [1,1,0,0,0,0|2,0,0]=4 4642 B6R0.1 COC(=O)CSC Amb2689527 [1,1,0,0,0,0|1,0,0]=3 4643 B6R0.1 COC(=O)OCCl Amb20623618 [1,1,0,0,0,0|2,0,0]=4 4644 B6R0.1 COC(=O)OCI Amb35753057 [1,1,0,0,0,0|2,0,0]=4 4645 B6R0.1 COCC(=N)NO Amb21858420 [1,1,0,0,0,0|2,0,0]=4 4646 B6R0.1 COCC(=N)OC Amb28989427 [1,1,0,0,0,0|2,0,0]=4 4647 B6R0.1 COCC(=O)CCl Amb24523799 [1,1,0,0,0,0|2,0,0]=4 4648 B6R0.1 COCC(=O)CI Amb27414026 [1,1,0,0,0,0|2,0,0]=4 4649 B6R0.1 COCC(=O)CN Amb18833134 [1,1,0,0,0,0|2,0,0]=4 4650 B6R0.1 COCC(=O)NN Amb6548366 [1,1,0,0,0,0|2,0,0]=4 4651 B6R0.1 COCC(=O)OC Amb8513624 [1,1,0,0,0,0|1,0,0]=3 4652 B6R0.1 COC[C@@H](O)C=O Amb28132745 [1,1,0,0,0,0|1,0,1]=4 4653 B6R0.1 COC[C@H](O)C=O Amb27838256 [1,1,0,0,0,0|1,0,1]=4 4654 B6R0.1 COC\C(N)=N\O Amb8384549 [1,1,0,0,0,0|2,0,0]=4 4655 B6R0.1 CONC(=O)CO Amb28344874 [1,1,0,0,0,0|2,0,0]=4 4656 B6R0.1 COS(=O)CCBr Amb27403603 [1,1,0,0,0,0|2,0,0]=4 4657 B6R0.1 CO[PH](=O)CCBr Amb27657609 [1,1,0,0,0,0|2,0,0]=4 4658 B6R0.1 CO\C=C(/O)C=O Amb27797385 [1,1,0,0,0,0|1,0,1]=4 4659 B6R0.1 CSC(=O)CCO Amb27662309 [1,1,0,0,0,0|1,1,0]=4 4660 B6R0.1 CSCC(=O)CCl Amb25965373 [1,1,0,0,0,0|2,0,0]=4 4661 B6R0.1 CSCC(=O)CN Amb33225415 [1,1,0,0,0,0|2,0,0]=4 4662 B6R0.1 CSCC(=O)NN Amb22058723 [1,1,0,0,0,0|2,0,0]=4 4663 B6R0.1 CSCC(=O)NO Amb28057751 [1,1,0,0,0,0|1,0,0]=3 4664 B6R0.1 CSCC(O)C=O Amb27438538 [1,1,0,0,0,0|1,0,1]=4 4665 B6R0.1 CSC\C(N)=N\O Amb8385720 [1,1,0,0,0,0|2,0,0]=4 4666 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [1,1,0,0,0,0|1,0,0]=3 4667 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [1,1,0,0,0,0|1,0,0]=3 4668 B6R0.1 C\C(CCCl)=N/O Amb27832450 [1,1,0,0,0,0|2,0,0]=4 4669 B6R0.1 C\C=C(/C)CCC Amb25744974 [1,1,0,0,0,0|2,0,0]=4 4670 B6R0.1 C\C=C\C(=O)OC Amb8513568 [1,1,0,0,0,0|0,0,2]=4 4671 B6R0.1 N=C(CCO)NO Amb22491265 [1,1,0,0,0,0|2,0,0]=4 4672 B6R0.1 NCC(=O)CCF Amb26604148 [1,1,0,0,0,0|2,0,0]=4 4673 B6R0.1 NCCC(=O)CF Amb33377162 [1,1,0,0,0,0|2,0,0]=4 4674 B6R0.1 NCCC(=O)CN Amb18121893 [1,1,0,0,0,0|2,0,0]=4 4675 B6R0.1 NCCC(=O)NN Amb18559344 [1,1,0,0,0,0|2,0,0]=4 4676 B6R0.1 NCCC(=O)NO Amb33543073 [1,1,0,0,0,0|1,0,0]=3 4677 B6R0.1 NCCC(O)C=O Amb25682881 [1,1,0,0,0,0|1,0,1]=4 4678 B6R0.1 NCC\C(N)=N\O Amb24761482 [1,1,0,0,0,0|2,0,0]=4 4679 B6R0.1 NNC(=O)CCO Amb20622339 [1,1,0,0,0,0|2,0,0]=4 4680 B6R0.1 NNC(=O)CCS Amb20622690 [1,1,0,0,0,0|2,0,0]=4 4681 B6R0.1 N\C(CCCl)=N/O Amb2695182 [1,1,0,0,0,0|2,0,0]=4 4682 B6R0.1 N\C(CCO)=N/O Amb1113605 [1,1,0,0,0,0|2,0,0]=4 4683 B6R0.1 O=C(CBr)CCBr Amb26567374 [1,1,0,0,0,0|2,0,0]=4 4684 B6R0.1 O=C(CBr)CCCl Amb27984732 [1,1,0,0,0,0|2,0,0]=4 4685 B6R0.1 O=C(CCBr)NO Amb28195718 [1,1,0,0,0,0|1,0,0]=3 4686 B6R0.1 O=C(CCCl)NO Amb25865278 [1,1,0,0,0,0|1,0,0]=3 4687 B6R0.1 O=C(CCl)CCCl Amb22395038 [1,1,0,0,0,0|2,0,0]=4 4688 B6R0.1 O=C(CCl)CCF Amb33413998 [1,1,0,0,0,0|2,0,0]=4 4689 B6R0.1 O=C(CF)CCF Amb28424077 [1,1,0,0,0,0|2,0,0]=4 4690 B6R0.1 O=C(CO)CCO Amb10603377 [1,1,0,0,0,0|1,0,0]=3 4691 B6R0.1 O=C(CO)NCO Amb27593459 [1,1,0,0,0,0|2,0,0]=4 4692 B6R0.1 O=C(NO)OCCl Amb29886186 [1,1,0,0,0,0|2,0,0]=4 4693 B6R0.1 O=CC(=O)CCO Amb28050238 [1,1,0,0,0,0|1,0,1]=4 4694 B6R0.1 O=CC(O)CCBr Amb27838276 [1,1,0,0,0,0|1,0,1]=4 4695 B6R0.1 O=CC(O)CCO Amb27955546 [1,1,0,0,0,0|1,0,1]=4 4696 B6R0.1 O=C[C@H](O)CCBr Amb28399793 [1,1,0,0,0,0|1,0,1]=4 4697 B6R0.1 [C-]#[N+]CC(=O)OC Amb2697203 [1,1,0,0,0,0|1,0,1]=4 4698 B6R0.2 C=C(Br)CC(C)C Amb22583739 [1,1,0,0,0,0|2,0,0]=4 4699 B6R0.2 C=C(C)CC(=O)O Amb6278832 [1,1,0,0,0,0|0,0,1]=3 4700 B6R0.2 C=C(C)CC(C)=O Amb17593075 [1,1,0,0,0,0|1,0,1]=4 4701 B6R0.2 C=C(C)CC(C)Br Amb24365286 [1,1,0,0,0,0|2,0,0]=4 4702 B6R0.2 C=C(C)CC(C)C Amb4019530 [1,1,0,0,0,0|2,0,0]=4 4703 B6R0.2 C=C(C)CC(C)Cl Amb24558200 [1,1,0,0,0,0|2,0,0]=4 4704 B6R0.2 C=C(C)CC(C)O Amb17593083 [1,1,0,0,0,0|2,0,0]=4 4705 B6R0.2 C=C(C)C[C@@H](C)N Amb33199541 [1,1,0,0,0,0|2,0,0]=4 4706 B6R0.2 C=C(C)C[C@@H](C)O Amb25888510 [1,1,0,0,0,0|2,0,0]=4 4707 B6R0.2 C=C(C)C[C@H](C)N Amb33199534 [1,1,0,0,0,0|2,0,0]=4 4708 B6R0.2 C=C(C)C[C@H](C)O Amb27466720 [1,1,0,0,0,0|2,0,0]=4 4709 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [1,1,0,0,0,0|0,0,2]=4 4710 B6R0.2 C=C(Cl)CC(C)Cl Amb28396615 [1,1,0,0,0,0|2,0,0]=4 4711 B6R0.2 C=C(I)CC(=O)O Amb27598435 [1,1,0,0,0,0|0,0,2]=4 4712 B6R0.2 CC(=O)CC(=O)F Amb28122452 [1,1,0,0,0,0|1,0,1]=4 4713 B6R0.2 CC(=O)CC(=O)O Amb377432 [1,1,0,0,0,0|0,0,1]=3 4714 B6R0.2 CC(=O)CC(=O)[O-] Amb31031013 [1,1,0,0,0,0|0,0,2]=4 4715 B6R0.2 CC(=O)CC(C)=O Amb2716228 [1,1,0,0,0,0|1,0,1]=4 4716 B6R0.2 CC(=O)CC(C)=S Amb28381251 [1,1,0,0,0,0|1,0,1]=4 4717 B6R0.2 CC(=O)CC(C)C Amb4605990 [1,1,0,0,0,0|1,0,0]=3 4718 B6R0.2 CC(=O)CC(C)Cl Amb17593234 [1,1,0,0,0,0|1,0,0]=3 4719 B6R0.2 CC(=O)CC(C)N Amb22587050 [1,1,0,0,0,0|1,0,0]=3 4720 B6R0.2 CC(=O)CC(C)N Amb2583230 [1,1,0,0,0,0|1,0,0]=3 4721 B6R0.2 CC(=O)CC(C)O Amb17593091 [1,1,0,0,0,0|1,0,0]=3 4722 B6R0.2 CC(=O)CC(C)S Amb24600676 [1,1,0,0,0,0|1,0,0]=3 4723 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [1,1,0,0,0,0|1,0,0]=3 4724 B6R0.2 CC(=O)CC(F)F Amb24669174 [1,1,0,0,0,0|2,0,0]=4 4725 B6R0.2 CC(=O)CC(N)=O Amb6608777 [1,1,0,0,0,0|1,0,1]=4 4726 B6R0.2 CC(=O)CN(C)C Amb9217324 [1,1,0,0,0,0|2,0,0]=4 4727 B6R0.2 CC(=O)C[C@@H](C)N Amb27493422 [1,1,0,0,0,0|1,0,0]=3 4728 B6R0.2 CC(=O)C[C@H](C)N Amb27222720 [1,1,0,0,0,0|1,0,0]=3 4729 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [1,1,0,0,0,0|1,0,1]=4 4730 B6R0.2 CC(=O)C[S+](C)Cl Amb27835653 [1,1,0,0,0,0|2,0,0]=4 4731 B6R0.2 CC(=O)NC(C)Br Amb27444682 [1,1,0,0,0,0|2,0,0]=4 4732 B6R0.2 CC(=O)NC(C)C Amb3366263 [1,1,0,0,0,0|2,0,0]=4 4733 B6R0.2 CC(=O)NC(C)N Amb27468729 [1,1,0,0,0,0|2,0,0]=4 4734 B6R0.2 CC(=O)OC(C)Br Amb19958925 [1,1,0,0,0,0|2,0,0]=4 4735 B6R0.2 CC(=O)OC(C)C Amb3940484 [1,1,0,0,0,0|2,0,0]=4 4736 B6R0.2 CC(=O)OC(C)Cl Amb24058273 [1,1,0,0,0,0|2,0,0]=4 4737 B6R0.2 CC(=O)OC(C)N Amb27184949 [1,1,0,0,0,0|2,0,0]=4 4738 B6R0.2 CC(=O)OC(C)O Amb27457187 [1,1,0,0,0,0|2,0,0]=4 4739 B6R0.2 CC(=S)CC(=O)O Amb28067768 [1,1,0,0,0,0|0,0,1]=3 4740 B6R0.2 CC(Br)CC(=O)O Amb8517108 [1,1,0,0,0,0|0,0,0]=2 4741 B6R0.2 CC(C)=CC(=O)O Amb1485519 [1,1,0,0,0,0|0,0,2]=4 4742 B6R0.2 CC(C)CB(O)O Amb2447316 [1,1,0,0,0,0|1,0,1]=4 4743 B6R0.2 CC(C)CC(=N)N Amb10066934 [1,1,0,0,0,0|2,0,0]=4 4744 B6R0.2 CC(C)CC(=N)N Amb2696279 [1,1,0,0,0,0|2,0,0]=4 4745 B6R0.2 CC(C)CC(=O)Br Amb26486664 [1,1,0,0,0,0|1,0,0]=3 4746 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [1,1,0,0,0,0|1,0,0]=3 4747 B6R0.2 CC(C)CC(=O)F Amb32667643 [1,1,0,0,0,0|1,0,0]=3 4748 B6R0.2 CC(C)CC(=O)O Amb3939848 [1,1,0,0,0,0|0,0,0]=2 4749 B6R0.2 CC(C)CC(C)O Amb6608920 [1,1,0,0,0,0|1,0,1]=4 4750 B6R0.2 CC(C)CC(N)=O Amb2722931 [1,1,0,0,0,0|1,0,0]=3 4751 B6R0.2 CC(C)CC(N)=S Amb6246355 [1,1,0,0,0,0|1,1,0]=4 4752 B6R0.2 CC(C)CC(N)O Amb28383510 [1,1,0,0,0,0|1,0,1]=4 4753 B6R0.2 CC(C)CC(O)O Amb27207854 [1,1,0,0,0,0|0,0,2]=4 4754 B6R0.2 CC(C)CN(C)O Amb33360311 [1,1,0,0,0,0|2,0,0]=4 4755 B6R0.2 CC(C)CS(=O)Cl Amb26409520 [1,1,0,0,0,0|2,0,0]=4 4756 B6R0.2 CC(C)CS(=O)[O-] Amb19930010 [1,1,0,0,0,0|1,0,1]=4 4757 B6R0.2 CC(C)CS(C)=O Amb27972160 [1,1,0,0,0,0|2,0,0]=4 4758 B6R0.2 CC(C)CS(N)=O Amb24527860 [1,1,0,0,0,0|2,0,0]=4 4759 B6R0.2 CC(C)C[C@@H](C)O Amb8517525 [1,1,0,0,0,0|1,0,1]=4 4760 B6R0.2 CC(C)C[C@H](C)O Amb8517526 [1,1,0,0,0,0|1,0,1]=4 4761 B6R0.2 CC(C)C[N+](=O)[O-] Amb17672613 [1,1,0,0,0,0|1,0,1]=4 4762 B6R0.2 CC(C)NC(=O)Cl Amb27780560 [1,1,0,0,0,0|2,0,0]=4 4763 B6R0.2 CC(C)NC(=O)S Amb27817487 [1,1,0,0,0,0|1,1,0]=4 4764 B6R0.2 CC(C)NC(N)=O Amb1104587 [1,1,0,0,0,0|2,0,0]=4 4765 B6R0.2 CC(C)OC(=O)Cl Amb3941687 [1,1,0,0,0,0|2,0,0]=4 4766 B6R0.2 CC(C)OC(N)=O Amb4017684 [1,1,0,0,0,0|2,0,0]=4 4767 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [1,1,0,0,0,0|2,0,0]=4 4768 B6R0.2 CC(Cl)CC(=O)Cl Amb28343061 [1,1,0,0,0,0|1,0,0]=3 4769 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [1,1,0,0,0,0|0,0,0]=2 4770 B6R0.2 CC(Cl)NC(N)=O Amb28130611 [1,1,0,0,0,0|2,0,0]=4 4771 B6R0.2 CC(Cl)OC(=O)Cl Amb6608999 [1,1,0,0,0,0|2,0,0]=4 4772 B6R0.2 CC(I)CC(=O)O Amb28398380 [1,1,0,0,0,0|0,0,0]=2 4773 B6R0.2 CC(N)CC(=O)O Amb8379759 [1,1,0,0,0,0|0,0,0]=2 4774 B6R0.2 CC(N)CC(=O)S Amb27413857 [1,1,0,0,0,0|0,1,0]=3 4775 B6R0.2 CC(N)CC(C)O Amb18640217 [1,1,0,0,0,0|1,0,1]=4 4776 B6R0.2 CC(N)CC(N)=O Amb18281237 [1,1,0,0,0,0|1,0,0]=3 4777 B6R0.2 CC(N)CC(N)=O Amb33532770 [1,1,0,0,0,0|1,0,0]=3 4778 B6R0.2 CC(N)CS(C)=O Amb33546327 [1,1,0,0,0,0|2,0,0]=4 4779 B6R0.2 CC(O)CC(=O)O Amb8513187 [1,1,0,0,0,0|0,0,0]=2 4780 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [1,1,0,0,0,0|0,0,1]=3 4781 B6R0.2 CC(O)CC(C)F Amb28065744 [1,1,0,0,0,0|1,0,1]=4 4782 B6R0.2 CC(O)CC(C)O Amb10068523 [1,1,0,0,0,0|1,0,1]=4 4783 B6R0.2 CC(O)CC(C)S Amb24122653 [1,1,0,0,0,0|1,0,1]=4 4784 B6R0.2 CC(O)CC(N)=O Amb26394320 [1,1,0,0,0,0|1,0,0]=3 4785 B6R0.2 CC(O)CC(N)=S Amb24479794 [1,1,0,0,0,0|1,1,0]=4 4786 B6R0.2 CC(O)CS(C)=O Amb28137235 [1,1,0,0,0,0|2,0,0]=4 4787 B6R0.2 CC(O)C[N+](=O)[O-] Amb9678341 [1,1,0,0,0,0|1,0,1]=4 4788 B6R0.2 CC(S)CC(=O)O Amb33538201 [1,1,0,0,0,0|0,0,0]=2 4789 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [1,1,0,0,0,0|2,0,0]=4 4790 B6R0.2 CN(C)CC(=O)Cl Amb3939582 [1,1,0,0,0,0|2,0,0]=4 4791 B6R0.2 CN(C)CC(=O)O Amb3319051 [1,1,0,0,0,0|1,0,0]=3 4792 B6R0.2 CN(C)CC(=O)O Amb3940366 [1,1,0,0,0,0|1,0,0]=3 4793 B6R0.2 CN(C)CC(N)=O Amb17231806 [1,1,0,0,0,0|2,0,0]=4 4794 B6R0.2 CN(C)CC(N)=O Amb33321491 [1,1,0,0,0,0|2,0,0]=4 4795 B6R0.2 CN(N)CC(=O)O Amb23592296 [1,1,0,0,0,0|1,0,0]=3 4796 B6R0.2 CN(O)CC(=O)O Amb29838290 [1,1,0,0,0,0|1,0,0]=3 4797 B6R0.2 CS(=O)CC(N)=O Amb24394100 [1,1,0,0,0,0|2,0,0]=4 4798 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [1,1,0,0,0,0|0,0,0]=2 4799 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [1,1,0,0,0,0|0,0,0]=2 4800 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [1,1,0,0,0,0|0,0,0]=2 4801 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [1,1,0,0,0,0|0,0,0]=2 4802 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [1,1,0,0,0,0|0,0,0]=2 4803 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [1,1,0,0,0,0|0,0,1]=3 4804 B6R0.2 C[C@@H](O)CS(C)=O Amb27457390 [1,1,0,0,0,0|2,0,0]=4 4805 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [1,1,0,0,0,0|0,0,0]=2 4806 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [1,1,0,0,0,0|0,0,0]=2 4807 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [1,1,0,0,0,0|0,0,0]=2 4808 B6R0.2 C[C@H](N)CC(N)=O Amb27873963 [1,1,0,0,0,0|1,0,0]=3 4809 B6R0.2 C[C@H](N)C[C@H](C)O Amb27593805 [1,1,0,0,0,0|1,0,1]=4 4810 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [1,1,0,0,0,0|0,0,0]=2 4811 B6R0.2 C[C@H](O)C[C@@H](C)F Amb27486566 [1,1,0,0,0,0|1,0,1]=4 4812 B6R0.2 C[C@H](O)C[C@@H](C)O Amb27273041 [1,1,0,0,0,0|1,0,1]=4 4813 B6R0.2 C[C@H](O)C[C@H](C)I Amb28042894 [1,1,0,0,0,0|1,0,1]=4 4814 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [1,1,0,0,0,0|1,0,1]=4 4815 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [1,1,0,0,0,0|2,0,0]=4 4816 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [1,1,0,0,0,0|1,0,0]=3 4817 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [1,1,0,0,0,0|1,0,0]=3 4818 B6R0.2 C[S+](C)CC(=O)[O-] Amb26065720 [1,1,0,0,0,0|1,0,1]=4 4819 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [1,1,0,0,0,0|0,0,2]=4 4820 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [1,1,0,0,0,0|0,0,2]=4 4821 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [1,1,0,0,0,0|0,0,2]=4 4822 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [1,1,0,0,0,0|0,0,2]=4 4823 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [1,1,0,0,0,0|0,0,2]=4 4824 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [1,1,0,0,0,0|0,0,2]=4 4825 B6R0.2 NC(=O)CC(=O)O Amb4034884 [1,1,0,0,0,0|1,0,1]=4 4826 B6R0.2 NC(=O)CC(F)F Amb28401488 [1,1,0,0,0,0|2,0,0]=4 4827 B6R0.2 NC(=S)CC(=O)O Amb17465742 [1,1,0,0,0,0|1,0,1]=4 4828 B6R0.2 NC(S)CC(=O)O Amb27391244 [1,1,0,0,0,0|1,0,0]=3 4829 B6R0.2 O=C(O)CB(O)O Amb24053058 [1,1,0,0,0,0|2,0,0]=4 4830 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [1,1,0,0,0,0|1,0,1]=4 4831 B6R0.2 O=C(O)CC(=O)O Amb2689065 [1,1,0,0,0,0|1,0,1]=4 4832 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [1,1,0,0,0,0|1,0,0]=3 4833 B6R0.2 O=C(O)CC(F)F Amb22001551 [1,1,0,0,0,0|1,0,0]=3 4834 B6R0.2 O=C(O)CS(=O)O Amb27788997 [1,1,0,0,0,0|2,0,0]=4 4835 B6R0.2 O=C([O-])CC(F)F Amb24117960 [1,1,0,0,0,0|1,0,1]=4 4836 B6R0.2 O=S(O)CC(F)F Amb30035176 [1,1,0,0,0,0|2,0,0]=4 4837 B6R0.2 OC(=S)CC(F)F Amb34179023 [1,1,0,0,0,0|1,1,0]=4 4838 B6R0.3 C#CC(N)C(=O)O Amb28282694 [1,1,0,0,0,0|0,0,2]=4 4839 B6R0.3 C#CC(O)C(=O)O Amb22731622 [1,1,0,0,0,0|0,0,2]=4 4840 B6R0.3 C=C(Br)C(C)CC Amb22583745 [1,1,0,0,0,0|2,0,0]=4 4841 B6R0.3 C=C(C)C(Cl)CC Amb27229374 [1,1,0,0,0,0|2,0,0]=4 4842 B6R0.3 C=C(C)C(O)CC Amb26365874 [1,1,0,0,0,0|2,0,0]=4 4843 B6R0.3 C=C(CBr)C(=O)O Amb6296612 [1,1,0,0,0,0|1,0,1]=4 4844 B6R0.3 C=C(CC)C(=O)Cl Amb22353554 [1,1,0,0,0,0|1,0,1]=4 4845 B6R0.3 C=C(CC)C(=O)O Amb18639591 [1,1,0,0,0,0|0,0,1]=3 4846 B6R0.3 C=C(CCl)C(=O)O Amb27851591 [1,1,0,0,0,0|1,0,1]=4 4847 B6R0.3 C=C(CO)C(=O)O Amb18121817 [1,1,0,0,0,0|1,0,1]=4 4848 B6R0.3 C=C(CS)C(=O)O Amb27263242 [1,1,0,0,0,0|1,0,1]=4 4849 B6R0.3 C=C(OC)C(=O)O Amb18639906 [1,1,0,0,0,0|1,0,1]=4 4850 B6R0.3 C=C(SC)C(=O)O Amb27882690 [1,1,0,0,0,0|1,0,1]=4 4851 B6R0.3 C=CC(C)C(=O)O Amb21618706 [1,1,0,0,0,0|0,0,2]=4 4852 B6R0.3 C=CC(Cl)C(=O)O Amb27216715 [1,1,0,0,0,0|0,0,2]=4 4853 B6R0.3 C=CC(N)C(=O)O Amb20240543 [1,1,0,0,0,0|0,0,2]=4 4854 B6R0.3 C=CC(O)C(=O)O Amb24061247 [1,1,0,0,0,0|0,0,2]=4 4855 B6R0.3 C=CC(S)C(=O)O Amb28069741 [1,1,0,0,0,0|0,0,2]=4 4856 B6R0.3 C=C[C@@H](C)C(=O)O Amb26350417 [1,1,0,0,0,0|0,0,2]=4 4857 B6R0.3 C=C[C@@H](N)C(=O)O Amb22756048 [1,1,0,0,0,0|0,0,2]=4 4858 B6R0.3 C=C[C@H](C)C(=O)O Amb25929549 [1,1,0,0,0,0|0,0,2]=4 4859 B6R0.3 C=C[C@H](N)C(=O)O Amb2699113 [1,1,0,0,0,0|0,0,2]=4 4860 B6R0.3 CC(=O)C(Br)CBr Amb27597612 [1,1,0,0,0,0|2,0,0]=4 4861 B6R0.3 CC(=O)C(C)CCl Amb26477594 [1,1,0,0,0,0|2,0,0]=4 4862 B6R0.3 CC(=O)C(C)CO Amb10844844 [1,1,0,0,0,0|2,0,0]=4 4863 B6R0.3 CC(=O)C(Cl)CCl Amb27257955 [1,1,0,0,0,0|2,0,0]=4 4864 B6R0.3 CC(=O)C(O)CO Amb26463044 [1,1,0,0,0,0|2,0,0]=4 4865 B6R0.3 CC(=O)C([Na])CN Amb28423432 [1,1,0,0,0,0|2,0,0]=4 4866 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [1,1,0,0,0,0|2,0,0]=4 4867 B6R0.3 CC(=O)[C@H](N)CO Amb27451047 [1,1,0,0,0,0|2,0,0]=4 4868 B6R0.3 CC(C#N)C(=O)O Amb17210512 [1,1,0,0,0,0|1,0,1]=4 4869 B6R0.3 CC(C=O)C(=O)O Amb27784775 [1,1,0,0,0,0|1,0,1]=4 4870 B6R0.3 CC(CBr)C(=O)O Amb22002601 [1,1,0,0,0,0|1,0,0]=3 4871 B6R0.3 CC(CCl)C(=O)O Amb18522181 [1,1,0,0,0,0|1,0,0]=3 4872 B6R0.3 CC(CF)C(=O)O Amb24432331 [1,1,0,0,0,0|1,0,0]=3 4873 B6R0.3 CC(CN)C(=O)O Amb2699128 [1,1,0,0,0,0|1,0,0]=3 4874 B6R0.3 CC(CN)C(=O)O Amb6773978 [1,1,0,0,0,0|1,0,0]=3 4875 B6R0.3 CC(CN)C(=O)O Amb8631418 [1,1,0,0,0,0|1,0,0]=3 4876 B6R0.3 CC(CO)C(=O)O Amb8011522 [1,1,0,0,0,0|1,0,0]=3 4877 B6R0.3 CC(NN)C(=O)O Amb18640367 [1,1,0,0,0,0|2,0,0]=4 4878 B6R0.3 CC(ON)C(=O)O Amb33038242 [1,1,0,0,0,0|2,0,0]=4 4879 B6R0.3 CCC(=O)C(=O)Cl Amb27838251 [1,1,0,0,0,0|1,0,1]=4 4880 B6R0.3 CCC(=O)C(=O)O Amb3940359 [1,1,0,0,0,0|0,0,1]=3 4881 B6R0.3 CCC(=O)C(=O)[O-] Amb9825450 [1,1,0,0,0,0|0,0,2]=4 4882 B6R0.3 CCC(=O)C(C)=O Amb8514604 [1,1,0,0,0,0|1,0,1]=4 4883 B6R0.3 CCC(=O)C(N)=O Amb22011827 [1,1,0,0,0,0|1,0,1]=4 4884 B6R0.3 CCC(=S)C(=O)O Amb27872099 [1,1,0,0,0,0|0,0,1]=3 4885 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [1,1,0,0,0,0|1,0,0]=3 4886 B6R0.3 CCC(Br)C(=O)Cl Amb17666758 [1,1,0,0,0,0|1,0,0]=3 4887 B6R0.3 CCC(Br)C(=O)O Amb5716858 [1,1,0,0,0,0|0,0,0]=2 4888 B6R0.3 CCC(Br)C(C)=O Amb24615269 [1,1,0,0,0,0|1,0,0]=3 4889 B6R0.3 CCC(Br)C(N)=O Amb13952819 [1,1,0,0,0,0|1,0,0]=3 4890 B6R0.3 CCC(Br)[N+](=O)[O-] Amb17673702 [1,1,0,0,0,0|1,0,1]=4 4891 B6R0.3 CCC(C)B(O)O Amb10071974 [1,1,0,0,0,0|1,0,1]=4 4892 B6R0.3 CCC(C)C(=N)N Amb6740564 [1,1,0,0,0,0|2,0,0]=4 4893 B6R0.3 CCC(C)C(=N)N Amb8630181 [1,1,0,0,0,0|2,0,0]=4 4894 B6R0.3 CCC(C)C(=O)Cl Amb3939259 [1,1,0,0,0,0|1,0,0]=3 4895 B6R0.3 CCC(C)C(=O)O Amb9703224 [1,1,0,0,0,0|0,0,0]=2 4896 B6R0.3 CCC(C)C(C)=O Amb4605996 [1,1,0,0,0,0|1,0,0]=3 4897 B6R0.3 CCC(C)C(C)O Amb8513435 [1,1,0,0,0,0|1,0,1]=4 4898 B6R0.3 CCC(C)C(N)=O Amb33548100 [1,1,0,0,0,0|1,0,0]=3 4899 B6R0.3 CCC(C)C(N)=S Amb6740516 [1,1,0,0,0,0|1,1,0]=4 4900 B6R0.3 CCC(C)C(O)O Amb27826789 [1,1,0,0,0,0|0,0,2]=4 4901 B6R0.3 CCC(C)S(=O)Cl Amb27841595 [1,1,0,0,0,0|2,0,0]=4 4902 B6R0.3 CCC(C)S(=O)[O-] Amb19893328 [1,1,0,0,0,0|1,0,1]=4 4903 B6R0.3 CCC(C)S(N)=O Amb32756501 [1,1,0,0,0,0|2,0,0]=4 4904 B6R0.3 CCC(C)[C@@H](C)O Amb27946951 [1,1,0,0,0,0|1,0,1]=4 4905 B6R0.3 CCC(C)[C@H](C)O Amb28281014 [1,1,0,0,0,0|1,0,1]=4 4906 B6R0.3 CCC(C)[N+](=O)[O-] Amb4036169 [1,1,0,0,0,0|1,0,1]=4 4907 B6R0.3 CCC(Cl)C(=O)Br Amb28384077 [1,1,0,0,0,0|1,0,0]=3 4908 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [1,1,0,0,0,0|1,0,0]=3 4909 B6R0.3 CCC(Cl)C(=O)O Amb4017887 [1,1,0,0,0,0|0,0,0]=2 4910 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [1,1,0,0,0,0|1,0,0]=3 4911 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [1,1,0,0,0,0|1,0,0]=3 4912 B6R0.3 CCC(Cl)C(O)O Amb27400305 [1,1,0,0,0,0|0,0,2]=4 4913 B6R0.3 CCC(Cl)[N+](=O)[O-] Amb4016590 [1,1,0,0,0,0|1,0,1]=4 4914 B6R0.3 CCC(F)C(=N)N Amb32456109 [1,1,0,0,0,0|2,0,0]=4 4915 B6R0.3 CCC(F)C(=O)O Amb25716167 [1,1,0,0,0,0|0,0,0]=2 4916 B6R0.3 CCC(N)B(O)O Amb28367684 [1,1,0,0,0,0|1,0,1]=4 4917 B6R0.3 CCC(N)C(=O)Cl Amb17593240 [1,1,0,0,0,0|1,0,0]=3 4918 B6R0.3 CCC(N)C(=O)O Amb9729506 [1,1,0,0,0,0|0,0,0]=2 4919 B6R0.3 CCC(N)C(C)O Amb32662794 [1,1,0,0,0,0|1,0,1]=4 4920 B6R0.3 CCC(N)C(C)O Amb8855230 [1,1,0,0,0,0|1,0,1]=4 4921 B6R0.3 CCC(N)C(N)=O Amb1914080 [1,1,0,0,0,0|1,0,0]=3 4922 B6R0.3 CCC(N)C(N)=O Amb33528521 [1,1,0,0,0,0|1,0,0]=3 4923 B6R0.3 CCC(N)C(N)O Amb28348585 [1,1,0,0,0,0|1,0,1]=4 4924 B6R0.3 CCC(N)P(=O)=O Amb27786328 [1,1,0,0,0,0|1,0,1]=4 4925 B6R0.3 CCC(O)C(=N)N Amb33321504 [1,1,0,0,0,0|2,0,0]=4 4926 B6R0.3 CCC(O)C(=O)O Amb6609018 [1,1,0,0,0,0|0,0,0]=2 4927 B6R0.3 CCC(O)C(=O)[O-] Amb17943026 [1,1,0,0,0,0|0,0,1]=3 4928 B6R0.3 CCC(O)C(C)=O Amb25336501 [1,1,0,0,0,0|1,0,0]=3 4929 B6R0.3 CCC(O)C(C)O Amb2227553 [1,1,0,0,0,0|1,0,1]=4 4930 B6R0.3 CCC(O)C(N)=O Amb24116514 [1,1,0,0,0,0|1,0,0]=3 4931 B6R0.3 CCC(O)C(N)=S Amb23449332 [1,1,0,0,0,0|1,1,0]=4 4932 B6R0.3 CCC(O)S(=O)[O-] Amb27166943 [1,1,0,0,0,0|1,0,1]=4 4933 B6R0.3 CCC(S)C(=O)O Amb17501370 [1,1,0,0,0,0|0,0,0]=2 4934 B6R0.3 CCC(S)C(C)=O Amb8393170 [1,1,0,0,0,0|1,0,0]=3 4935 B6R0.3 CCN(C)C(=O)Cl Amb8390927 [1,1,0,0,0,0|2,0,0]=4 4936 B6R0.3 CCN(C)C(C)=O Amb22753516 [1,1,0,0,0,0|2,0,0]=4 4937 B6R0.3 CCN(N)C(C)=O Amb18639976 [1,1,0,0,0,0|2,0,0]=4 4938 B6R0.3 CCN(N)C(N)=O Amb28184355 [1,1,0,0,0,0|2,0,0]=4 4939 B6R0.3 CCN(O)C(C)=O Amb27652499 [1,1,0,0,0,0|2,0,0]=4 4940 B6R0.3 CC[C@@H](Br)C(=O)O Amb9785161 [1,1,0,0,0,0|0,0,0]=2 4941 B6R0.3 CC[C@@H](C)B(O)O Amb27784066 [1,1,0,0,0,0|1,0,1]=4 4942 B6R0.3 CC[C@@H](C)C(=O)O Amb8384578 [1,1,0,0,0,0|0,0,0]=2 4943 B6R0.3 CC[C@@H](C)C(C)=O Amb28283799 [1,1,0,0,0,0|1,0,0]=3 4944 B6R0.3 CC[C@@H](C)[C@@H](C)O Amb27448466 [1,1,0,0,0,0|1,0,1]=4 4945 B6R0.3 CC[C@@H](Cl)C(=O)Cl Amb27985877 [1,1,0,0,0,0|1,0,0]=3 4946 B6R0.3 CC[C@@H](Cl)C(=O)O Amb22800493 [1,1,0,0,0,0|0,0,0]=2 4947 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [1,1,0,0,0,0|1,0,0]=3 4948 B6R0.3 CC[C@@H](N)C(=O)O Amb16233349 [1,1,0,0,0,0|0,0,0]=2 4949 B6R0.3 CC[C@@H](N)C(=O)O Amb3940761 [1,1,0,0,0,0|0,0,0]=2 4950 B6R0.3 CC[C@@H](N)C(C)=O Amb35594875 [1,1,0,0,0,0|1,0,0]=3 4951 B6R0.3 CC[C@@H](N)C(C)O Amb28280672 [1,1,0,0,0,0|1,0,1]=4 4952 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [1,1,0,0,0,0|1,0,0]=3 4953 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [1,1,0,0,0,0|1,0,0]=3 4954 B6R0.3 CC[C@@H](N)[C@@H](C)O Amb24117050 [1,1,0,0,0,0|1,0,1]=4 4955 B6R0.3 CC[C@@H](O)C(=O)O Amb22369401 [1,1,0,0,0,0|0,0,0]=2 4956 B6R0.3 CC[C@@H](O)C(N)=O Amb27792606 [1,1,0,0,0,0|1,0,0]=3 4957 B6R0.3 CC[C@H](Br)C(=O)O Amb20242441 [1,1,0,0,0,0|0,0,0]=2 4958 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [1,1,0,0,0,0|1,0,1]=4 4959 B6R0.3 CC[C@H](C)C(=O)Cl Amb26463969 [1,1,0,0,0,0|1,0,0]=3 4960 B6R0.3 CC[C@H](C)C(=O)O Amb8514667 [1,1,0,0,0,0|0,0,0]=2 4961 B6R0.3 CC[C@H](C)C(N)=O Amb27440802 [1,1,0,0,0,0|1,0,0]=3 4962 B6R0.3 CC[C@H](Cl)C(=O)O Amb25190040 [1,1,0,0,0,0|0,0,0]=2 4963 B6R0.3 CC[C@H](N)C(=O)O Amb2694208 [1,1,0,0,0,0|0,0,0]=2 4964 B6R0.3 CC[C@H](N)C(=O)O Amb8631089 [1,1,0,0,0,0|0,0,0]=2 4965 B6R0.3 CC[C@H](N)C(C)=O Amb29849605 [1,1,0,0,0,0|1,0,0]=3 4966 B6R0.3 CC[C@H](N)C(N)=O Amb8387112 [1,1,0,0,0,0|1,0,0]=3 4967 B6R0.3 CC[C@H](N)C(N)=O Amb8395789 [1,1,0,0,0,0|1,0,0]=3 4968 B6R0.3 CC[C@H](N)[C@@H](C)O Amb24117049 [1,1,0,0,0,0|1,0,1]=4 4969 B6R0.3 CC[C@H](O)C(=O)O Amb4166324 [1,1,0,0,0,0|0,0,0]=2 4970 B6R0.3 CC[C@H](O)[C@@H](C)O Amb27972258 [1,1,0,0,0,0|1,0,1]=4 4971 B6R0.3 CC[C@H](O)[C@H](C)O Amb27664238 [1,1,0,0,0,0|1,0,1]=4 4972 B6R0.3 CC[C@H](S)C(=O)O Amb9785162 [1,1,0,0,0,0|0,0,0]=2 4973 B6R0.3 CNC(=O)C(=O)O Amb2691295 [1,1,0,0,0,0|1,0,1]=4 4974 B6R0.3 CNC(C)C(=O)O Amb19373699 [1,1,0,0,0,0|1,0,0]=3 4975 B6R0.3 CNC(C)C(=O)O Amb9271766 [1,1,0,0,0,0|1,0,0]=3 4976 B6R0.3 CNC(C)C(C)=O Amb24369529 [1,1,0,0,0,0|2,0,0]=4 4977 B6R0.3 CNC(C)C(N)=O Amb33527202 [1,1,0,0,0,0|2,0,0]=4 4978 B6R0.3 CNC(C)C(N)=O Amb7758120 [1,1,0,0,0,0|2,0,0]=4 4979 B6R0.3 CNC(O)C(=O)O Amb27229907 [1,1,0,0,0,0|1,0,0]=3 4980 B6R0.3 CN[C@@H](C)C(=O)O Amb16233347 [1,1,0,0,0,0|1,0,0]=3 4981 B6R0.3 CN[C@@H](C)C(=O)O Amb16233348 [1,1,0,0,0,0|1,0,0]=3 4982 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [1,1,0,0,0,0|2,0,0]=4 4983 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [1,1,0,0,0,0|2,0,0]=4 4984 B6R0.3 CN[C@H](C)C(=O)O Amb10844859 [1,1,0,0,0,0|1,0,0]=3 4985 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [1,1,0,0,0,0|2,0,0]=4 4986 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [1,1,0,0,0,0|2,0,0]=4 4987 B6R0.3 COC(=O)C(=O)O Amb33545007 [1,1,0,0,0,0|1,0,1]=4 4988 B6R0.3 COC(Br)C(=O)O Amb27439128 [1,1,0,0,0,0|1,0,0]=3 4989 B6R0.3 COC(Br)C(C)=O Amb25360111 [1,1,0,0,0,0|2,0,0]=4 4990 B6R0.3 COC(C)C(=O)Cl Amb26005661 [1,1,0,0,0,0|2,0,0]=4 4991 B6R0.3 COC(C)C(=O)O Amb9729215 [1,1,0,0,0,0|1,0,0]=3 4992 B6R0.3 COC(C)C(C)=O Amb9666021 [1,1,0,0,0,0|2,0,0]=4 4993 B6R0.3 COC(C)C(N)=O Amb6541307 [1,1,0,0,0,0|2,0,0]=4 4994 B6R0.3 COC(Cl)C(=O)O Amb28280799 [1,1,0,0,0,0|1,0,0]=3 4995 B6R0.3 COC(Cl)C(C)=O Amb28118971 [1,1,0,0,0,0|2,0,0]=4 4996 B6R0.3 COC(F)C(=O)O Amb27764863 [1,1,0,0,0,0|1,0,0]=3 4997 B6R0.3 COC(F)C(=O)[O-] Amb33447021 [1,1,0,0,0,0|1,0,1]=4 4998 B6R0.3 COC(O)C(C)=O Amb27954086 [1,1,0,0,0,0|2,0,0]=4 4999 B6R0.3 CO[C@@H](C)C(=O)Cl Amb26562182 [1,1,0,0,0,0|2,0,0]=4 5000 B6R0.3 CO[C@@H](C)C(=O)O Amb8515766 [1,1,0,0,0,0|1,0,0]=3 5001 B6R0.3 CO[C@@H](C)C(N)=O Amb8515768 [1,1,0,0,0,0|2,0,0]=4 5002 B6R0.3 CO[C@H](C)C(=O)Cl Amb27588755 [1,1,0,0,0,0|2,0,0]=4 5003 B6R0.3 CO[C@H](C)C(=O)O Amb8515771 [1,1,0,0,0,0|1,0,0]=3 5004 B6R0.3 CO[C@H](C)C(N)=O Amb17617080 [1,1,0,0,0,0|2,0,0]=4 5005 B6R0.3 CSC(C)C(=O)O Amb6274567 [1,1,0,0,0,0|1,0,0]=3 5006 B6R0.3 CSC(C)C(N)=O Amb28047863 [1,1,0,0,0,0|2,0,0]=4 5007 B6R0.3 CSC(Cl)C(=O)Cl Amb27392297 [1,1,0,0,0,0|2,0,0]=4 5008 B6R0.3 CSC(N)C(=O)O Amb28383509 [1,1,0,0,0,0|1,0,0]=3 5009 B6R0.3 CS[C@H](C)C(=O)O Amb26611205 [1,1,0,0,0,0|1,0,0]=3 5010 B6R0.3 C[C@@H](CF)C(=O)O Amb33743265 [1,1,0,0,0,0|1,0,0]=3 5011 B6R0.3 C[C@@H](CI)C(=O)O Amb28322539 [1,1,0,0,0,0|1,0,0]=3 5012 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [1,1,0,0,0,0|1,0,0]=3 5013 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [1,1,0,0,0,0|1,0,0]=3 5014 B6R0.3 C[C@@H](CO)C(=O)O Amb10844567 [1,1,0,0,0,0|1,0,0]=3 5015 B6R0.3 C[C@@H](CO)C(N)=O Amb27254152 [1,1,0,0,0,0|2,0,0]=4 5016 B6R0.3 C[C@@H](ON)C(=O)O Amb27169414 [1,1,0,0,0,0|2,0,0]=4 5017 B6R0.3 C[C@@H](ON)C(=O)O Amb33620846 [1,1,0,0,0,0|2,0,0]=4 5018 B6R0.3 C[C@H](CBr)C(=O)O Amb27975404 [1,1,0,0,0,0|1,0,0]=3 5019 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [1,1,0,0,0,0|2,0,0]=4 5020 B6R0.3 C[C@H](CF)C(=O)O Amb33727262 [1,1,0,0,0,0|1,0,0]=3 5021 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [1,1,0,0,0,0|1,0,0]=3 5022 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [1,1,0,0,0,0|1,0,0]=3 5023 B6R0.3 C[C@H](CO)C(=O)O Amb10844554 [1,1,0,0,0,0|1,0,0]=3 5024 B6R0.3 C[C@H](NBr)C(=O)O Amb28050211 [1,1,0,0,0,0|2,0,0]=4 5025 B6R0.3 C[C@H](NN)C(=O)O Amb28247936 [1,1,0,0,0,0|2,0,0]=4 5026 B6R0.3 C[C@H](ON)C(=O)O Amb25853808 [1,1,0,0,0,0|2,0,0]=4 5027 B6R0.3 C[C@H](ON)C(=O)O Amb33620847 [1,1,0,0,0,0|2,0,0]=4 5028 B6R0.3 C\C=C(/Br)C(=O)O Amb18646193 [1,1,0,0,0,0|0,0,2]=4 5029 B6R0.3 C\C=C(/C)C(=O)O Amb33723768 [1,1,0,0,0,0|0,0,2]=4 5030 B6R0.3 C\C=C(/F)C(=O)O Amb32663762 [1,1,0,0,0,0|0,0,2]=4 5031 B6R0.3 C\C=C(/O)C(=O)O Amb22727962 [1,1,0,0,0,0|0,0,2]=4 5032 B6R0.3 C\C=C(\Br)C(=O)O Amb4014486 [1,1,0,0,0,0|0,0,2]=4 5033 B6R0.3 C\C=C(\C)C(=O)O Amb3445181 [1,1,0,0,0,0|0,0,2]=4 5034 B6R0.3 C\C=C(\Cl)C(=O)O Amb28073985 [1,1,0,0,0,0|0,0,2]=4 5035 B6R0.3 C\C=C(\I)C(=O)O Amb27841305 [1,1,0,0,0,0|0,0,2]=4 5036 B6R0.3 N#CC(N)C(=O)O Amb25328320 [1,1,0,0,0,0|1,0,1]=4 5037 B6R0.3 N#CC(O)C(=O)O Amb27467286 [1,1,0,0,0,0|1,0,1]=4 5038 B6R0.3 NC(=O)C(Br)CBr Amb8390579 [1,1,0,0,0,0|2,0,0]=4 5039 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [1,1,0,0,0,0|2,0,0]=4 5040 B6R0.3 NC(=O)C(N)CO Amb17593097 [1,1,0,0,0,0|2,0,0]=4 5041 B6R0.3 NC(=O)C(N)CO Amb2720301 [1,1,0,0,0,0|2,0,0]=4 5042 B6R0.3 NC(=O)C(N)CS Amb18641990 [1,1,0,0,0,0|2,0,0]=4 5043 B6R0.3 NC(=O)C(N)CS Amb33330875 [1,1,0,0,0,0|2,0,0]=4 5044 B6R0.3 NC(=O)C(O)CO Amb27169520 [1,1,0,0,0,0|2,0,0]=4 5045 B6R0.3 NC(=O)[C@@H](N)CO Amb6336612 [1,1,0,0,0,0|2,0,0]=4 5046 B6R0.3 NC(=O)[C@@H](N)CO Amb8387630 [1,1,0,0,0,0|2,0,0]=4 5047 B6R0.3 NC(=O)[C@@H](N)CS Amb23437751 [1,1,0,0,0,0|2,0,0]=4 5048 B6R0.3 NC(=O)[C@@H](O)CO Amb27816733 [1,1,0,0,0,0|2,0,0]=4 5049 B6R0.3 NC(=O)[C@H](N)CO Amb22886957 [1,1,0,0,0,0|2,0,0]=4 5050 B6R0.3 NC(=O)[C@H](N)CO Amb26505098 [1,1,0,0,0,0|2,0,0]=4 5051 B6R0.3 NC(CCl)C(=O)O Amb19651457 [1,1,0,0,0,0|1,0,0]=3 5052 B6R0.3 NC(CCl)C(=O)O Amb21961077 [1,1,0,0,0,0|1,0,0]=3 5053 B6R0.3 NC(CF)C(=O)O Amb10839589 [1,1,0,0,0,0|1,0,0]=3 5054 B6R0.3 NC(CO)C(=O)O Amb9702805 [1,1,0,0,0,0|1,0,0]=3 5055 B6R0.3 NC(CP)C(=O)O Amb27234251 [1,1,0,0,0,0|1,0,0]=3 5056 B6R0.3 NC(CS)C(=O)Cl Amb28050358 [1,1,0,0,0,0|2,0,0]=4 5057 B6R0.3 NC(CS)C(=O)O Amb13961966 [1,1,0,0,0,0|1,0,0]=3 5058 B6R0.3 NC(CS)C(=O)O Amb22489523 [1,1,0,0,0,0|1,0,0]=3 5059 B6R0.3 NC(CS)C(=O)O Amb6537913 [1,1,0,0,0,0|1,0,0]=3 5060 B6R0.3 NC(CS)C(=O)O Amb6537914 [1,1,0,0,0,0|1,0,0]=3 5061 B6R0.3 NC(CS)C(=O)S Amb27838279 [1,1,0,0,0,0|1,1,0]=4 5062 B6R0.3 NC(CS)S(=O)O Amb27238568 [1,1,0,0,0,0|2,0,0]=4 5063 B6R0.3 NC(C[NH3+])C(=O)O Amb4004471 [1,1,0,0,0,0|1,0,0]=3 5064 B6R0.3 NCC(Br)C(=O)O Amb28385732 [1,1,0,0,0,0|1,0,0]=3 5065 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [1,1,0,0,0,0|1,0,0]=3 5066 B6R0.3 NCC(F)C(=O)O Amb22733051 [1,1,0,0,0,0|1,0,0]=3 5067 B6R0.3 NCC(F)C(=O)O Amb2688010 [1,1,0,0,0,0|1,0,0]=3 5068 B6R0.3 NCC(F)C(N)=O Amb26984913 [1,1,0,0,0,0|2,0,0]=4 5069 B6R0.3 NCC(F)C(N)=O Amb32667436 [1,1,0,0,0,0|2,0,0]=4 5070 B6R0.3 NCC(N)C(=O)O Amb22899095 [1,1,0,0,0,0|1,0,0]=3 5071 B6R0.3 NCC(N)C(=O)O Amb2697095 [1,1,0,0,0,0|1,0,0]=3 5072 B6R0.3 NCC(N)C(=O)O Amb8514284 [1,1,0,0,0,0|1,0,0]=3 5073 B6R0.3 NCC(O)C(=O)O Amb8517492 [1,1,0,0,0,0|1,0,0]=3 5074 B6R0.3 NCC(O)C(N)=O Amb27164291 [1,1,0,0,0,0|2,0,0]=4 5075 B6R0.3 NCC(O)C(N)=O Amb28827639 [1,1,0,0,0,0|2,0,0]=4 5076 B6R0.3 NCC(S)C(=O)O Amb17593238 [1,1,0,0,0,0|1,0,0]=3 5077 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [1,1,0,0,0,0|1,0,0]=3 5078 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [1,1,0,0,0,0|1,0,0]=3 5079 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [1,1,0,0,0,0|1,0,0]=3 5080 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [1,1,0,0,0,0|1,0,0]=3 5081 B6R0.3 NC[C@@H](N)C(N)=O Amb27981260 [1,1,0,0,0,0|2,0,0]=4 5082 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [1,1,0,0,0,0|1,0,0]=3 5083 B6R0.3 NC[C@@H](O)C(N)=O Amb28282144 [1,1,0,0,0,0|2,0,0]=4 5084 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [1,1,0,0,0,0|1,0,0]=3 5085 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [1,1,0,0,0,0|1,0,0]=3 5086 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [1,1,0,0,0,0|1,0,0]=3 5087 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [1,1,0,0,0,0|1,0,0]=3 5088 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [1,1,0,0,0,0|1,0,0]=3 5089 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [1,1,0,0,0,0|1,0,0]=3 5090 B6R0.3 NC[C@H](O)C(N)=O Amb32645211 [1,1,0,0,0,0|2,0,0]=4 5091 B6R0.3 N[C@@H](C=S)C(=O)O Amb27838199 [1,1,0,0,0,0|1,0,1]=4 5092 B6R0.3 N[C@@H](CBr)C(=O)O Amb27188433 [1,1,0,0,0,0|1,0,0]=3 5093 B6R0.3 N[C@@H](CCl)C(=O)O Amb22232860 [1,1,0,0,0,0|1,0,0]=3 5094 B6R0.3 N[C@@H](CCl)C(=O)O Amb8515277 [1,1,0,0,0,0|1,0,0]=3 5095 B6R0.3 N[C@@H](CO)C(=O)O Amb22351170 [1,1,0,0,0,0|1,0,0]=3 5096 B6R0.3 N[C@@H](CO)C(=O)O Amb8387621 [1,1,0,0,0,0|1,0,0]=3 5097 B6R0.3 N[C@@H](CS)C(=O)O Amb3940755 [1,1,0,0,0,0|1,0,0]=3 5098 B6R0.3 N[C@@H](CS)C(=O)O Amb8385453 [1,1,0,0,0,0|1,0,0]=3 5099 B6R0.3 N[C@@H](CS)C(=O)O Amb9826090 [1,1,0,0,0,0|1,0,0]=3 5100 B6R0.3 N[C@@H](CS)S(=O)O Amb27391675 [1,1,0,0,0,0|2,0,0]=4 5101 B6R0.3 N[C@@H](C[SeH])C(=O)O Amb31031035 [1,1,0,0,0,0|1,0,0]=3 5102 B6R0.3 N[C@H](CCl)C(=O)Cl Amb28143184 [1,1,0,0,0,0|2,0,0]=4 5103 B6R0.3 N[C@H](CCl)C(=O)O Amb2699111 [1,1,0,0,0,0|1,0,0]=3 5104 B6R0.3 N[C@H](CCl)C(=O)O Amb9813688 [1,1,0,0,0,0|1,0,0]=3 5105 B6R0.3 N[C@H](CO)C(=O)Cl Amb28058341 [1,1,0,0,0,0|2,0,0]=4 5106 B6R0.3 N[C@H](CO)C(=O)O Amb2690463 [1,1,0,0,0,0|1,0,0]=3 5107 B6R0.3 N[C@H](CS)C(=O)Cl Amb27166396 [1,1,0,0,0,0|2,0,0]=4 5108 B6R0.3 N[C@H](CS)C(=O)O Amb17942912 [1,1,0,0,0,0|1,0,0]=3 5109 B6R0.3 N[C@H](CS)C(=O)O Amb8394603 [1,1,0,0,0,0|1,0,0]=3 5110 B6R0.3 N[C@H](CS)C(=O)O Amb8628479 [1,1,0,0,0,0|1,0,0]=3 5111 B6R0.3 O=C(Cl)C(Br)CBr Amb3940235 [1,1,0,0,0,0|2,0,0]=4 5112 B6R0.3 O=C(Cl)C(Br)CCl Amb28198806 [1,1,0,0,0,0|2,0,0]=4 5113 B6R0.3 O=C(Cl)C(Br)CF Amb28129447 [1,1,0,0,0,0|2,0,0]=4 5114 B6R0.3 O=C(Cl)C(Cl)CCl Amb3940236 [1,1,0,0,0,0|2,0,0]=4 5115 B6R0.3 O=C(O)C(=O)CBr Amb10068671 [1,1,0,0,0,0|1,0,1]=4 5116 B6R0.3 O=C(O)C(=O)CBr Amb8389349 [1,1,0,0,0,0|1,0,1]=4 5117 B6R0.3 O=C(O)C(=O)CCl Amb16233358 [1,1,0,0,0,0|1,0,1]=4 5118 B6R0.3 O=C(O)C(=O)CI Amb27659477 [1,1,0,0,0,0|1,0,1]=4 5119 B6R0.3 O=C(O)C(=O)CO Amb6600025 [1,1,0,0,0,0|1,0,1]=4 5120 B6R0.3 O=C(O)C(=O)CS Amb6600041 [1,1,0,0,0,0|1,0,1]=4 5121 B6R0.3 O=C(O)C(Br)CBr Amb8513574 [1,1,0,0,0,0|1,0,0]=3 5122 B6R0.3 O=C(O)C(Br)CF Amb10605519 [1,1,0,0,0,0|1,0,0]=3 5123 B6R0.3 O=C(O)C(Br)CO Amb18126327 [1,1,0,0,0,0|1,0,0]=3 5124 B6R0.3 O=C(O)C(Cl)CCl Amb22228245 [1,1,0,0,0,0|1,0,0]=3 5125 B6R0.3 O=C(O)C(Cl)CO Amb18124304 [1,1,0,0,0,0|1,0,0]=3 5126 B6R0.3 O=C(O)C(Cl)CS Amb18643661 [1,1,0,0,0,0|1,0,0]=3 5127 B6R0.3 O=C(O)C(F)CO Amb17593117 [1,1,0,0,0,0|1,0,0]=3 5128 B6R0.3 O=C(O)C(O)CBr Amb24061932 [1,1,0,0,0,0|1,0,0]=3 5129 B6R0.3 O=C(O)C(O)CCl Amb6371692 [1,1,0,0,0,0|1,0,0]=3 5130 B6R0.3 O=C(O)C(O)CF Amb27476477 [1,1,0,0,0,0|1,0,0]=3 5131 B6R0.3 O=C(O)C(O)CO Amb17593103 [1,1,0,0,0,0|1,0,0]=3 5132 B6R0.3 O=C(O)C(O)CS Amb18642053 [1,1,0,0,0,0|1,0,0]=3 5133 B6R0.3 O=C(O)C(S)CS Amb18643295 [1,1,0,0,0,0|1,0,0]=3 5134 B6R0.3 O=C(O)[C@@H](Br)CO Amb10601700 [1,1,0,0,0,0|1,0,0]=3 5135 B6R0.3 O=C(O)[C@@H](Cl)CO Amb27968485 [1,1,0,0,0,0|1,0,0]=3 5136 B6R0.3 O=C(O)[C@@H](O)CBr Amb27858794 [1,1,0,0,0,0|1,0,0]=3 5137 B6R0.3 O=C(O)[C@@H](O)CCl Amb22225325 [1,1,0,0,0,0|1,0,0]=3 5138 B6R0.3 O=C(O)[C@@H](O)CF Amb24117272 [1,1,0,0,0,0|1,0,0]=3 5139 B6R0.3 O=C(O)[C@@H](O)CO Amb22226732 [1,1,0,0,0,0|1,0,0]=3 5140 B6R0.3 O=C(O)[C@H](Cl)CO Amb27759746 [1,1,0,0,0,0|1,0,0]=3 5141 B6R0.3 O=C(O)[C@H](O)CBr Amb28137021 [1,1,0,0,0,0|1,0,0]=3 5142 B6R0.3 O=C(O)[C@H](O)CF Amb27467272 [1,1,0,0,0,0|1,0,0]=3 5143 B6R0.3 O=C(O)[C@H](O)CO Amb4166319 [1,1,0,0,0,0|1,0,0]=3 5144 B6R0.3 O=CC(Br)C(=O)O Amb27793774 [1,1,0,0,0,0|1,0,1]=4 5145 B6R0.3 O=CC(F)C(=O)O Amb22055301 [1,1,0,0,0,0|1,0,1]=4 5146 B6R0.3 O=C[C@@H](O)C(=O)O Amb27629391 [1,1,0,0,0,0|1,0,1]=4 5147 B6R0.3 [C-]#[N+]C(C)C(=O)O Amb27974746 [1,1,0,0,0,0|1,0,1]=4 5148 B6R0.5 CCCC(C)(C)O Amb8516075 [1,1,0,0,0,0|1,0,1]=4 5149 B6R0.5 CCCP(=O)(O)O Amb22230045 [1,1,0,0,0,0|1,0,0]=3 5150 B6R0.5 CCCS(=N)(N)=O Amb35711007 [1,1,0,0,0,0|2,0,0]=4 5151 B6R0.5 CCCS(=O)(=O)Cl Amb3939748 [1,1,0,0,0,0|1,0,1]=4 5152 B6R0.5 CCCS(=O)(=O)F Amb10610150 [1,1,0,0,0,0|1,0,1]=4 5153 B6R0.5 CCCS(=O)(=O)[O-] Amb8515942 [1,1,0,0,0,0|1,0,1]=4 5154 B6R0.5 CCCS(=O)(=O)[O-] Amb8517045 [1,1,0,0,0,0|1,0,1]=4 5155 B6R0.5 CCCS(=O)(=O)[S-] Amb22369121 [1,1,0,0,0,0|1,0,1]=4 5156 B6R0.5 CCCS(C)(=N)=O Amb32671061 [1,1,0,0,0,0|2,0,0]=4 5157 B6R0.5 CCCS(N)(=O)=O Amb1139748 [1,1,0,0,0,0|1,0,1]=4 5158 B6R0.5 CCC[Si](C)(C)O Amb27624611 [1,1,0,0,0,0|1,1,0]=4 5159 B6R0.5 CCNS(=O)(=O)O Amb19650770 [1,1,0,0,0,0|2,0,0]=4 5160 B6R0.5 CNCP(=O)(O)O Amb589043 [1,1,0,0,0,0|2,0,0]=4 5161 B6R0.5 CNCP(C)(=O)O Amb4300777 [1,1,0,0,0,0|2,0,0]=4 5162 B6R0.5 NCCP(=O)(O)O Amb4297144 [1,1,0,0,0,0|2,0,0]=4 5163 B6R0.5 NCCS(=O)(=O)O Amb2695361 [1,1,0,0,0,0|2,0,0]=4 5164 B6R0.5 NCC[PH](=O)(=O)O Amb28365875 [1,1,0,0,0,0|2,0,0]=4 5165 B6R0.5 O=P(O)(O)CCBr Amb8479835 [1,1,0,0,0,0|2,0,0]=4 5166 B6R0.5 O=P(O)(O)CCCl Amb6297766 [1,1,0,0,0,0|2,0,0]=4 5167 B6R0.5 O=P(O)(O)CCO Amb22388824 [1,1,0,0,0,0|2,0,0]=4 5168 B6R0.5 O=S(=O)(O)CCBr Amb17938633 [1,1,0,0,0,0|2,0,0]=4 5169 B6R0.5 O=S(=O)(O)CCCl Amb33513054 [1,1,0,0,0,0|2,0,0]=4 5170 B6R0.5 O=S(=O)(O)CCO Amb8383477 [1,1,0,0,0,0|2,0,0]=4 5171 B6R0.5 O=S(=O)(O)CCS Amb22337676 [1,1,0,0,0,0|2,0,0]=4 5172 B6R0.6 BrCCCCCBr Amb6608668 [1,1,0,0,0,0|1,0,1]=4 5173 B6R0.6 C#CCCCC=C Amb22227961 [1,1,0,0,0,0|1,0,1]=4 5174 B6R0.6 C#CCCCC=O Amb17593060 [1,1,0,0,0,0|0,0,1]=3 5175 B6R0.6 C#CCCCCC Amb6297206 [1,1,0,0,0,0|1,0,1]=4 5176 B6R0.6 C#CCCCCCl Amb6336487 [1,1,0,0,0,0|1,0,1]=4 5177 B6R0.6 C#CCCCCF Amb33196082 [1,1,0,0,0,0|1,0,1]=4 5178 B6R0.6 C#CCCCCI Amb22752649 [1,1,0,0,0,0|1,0,1]=4 5179 B6R0.6 C#CCCCCN Amb22059283 [1,1,0,0,0,0|1,0,1]=4 5180 B6R0.6 C#CCCCCN Amb33549738 [1,1,0,0,0,0|1,0,1]=4 5181 B6R0.6 C#CCCCCO Amb6336500 [1,1,0,0,0,0|0,0,2]=4 5182 B6R0.6 C#CCCCNC Amb29083253 [1,1,0,0,0,0|1,0,1]=4 5183 B6R0.6 C#CCCCOC Amb25694831 [1,1,0,0,0,0|1,0,1]=4 5184 B6R0.6 C#CCCCSC Amb26996684 [1,1,0,0,0,0|1,0,1]=4 5185 B6R0.6 C#CCCNC=O Amb27447032 [1,1,0,0,0,0|0,0,2]=4 5186 B6R0.6 C#CCCOCC Amb33169090 [1,1,0,0,0,0|1,0,1]=4 5187 B6R0.6 C#CCCSCC Amb24670860 [1,1,0,0,0,0|1,0,1]=4 5188 B6R0.6 C#CCNCCC Amb10610181 [1,1,0,0,0,0|1,0,1]=4 5189 B6R0.6 C#CCNCCC Amb5262802 [1,1,0,0,0,0|1,0,1]=4 5190 B6R0.6 C#C\C=C\CCC Amb33424839 [1,1,0,0,0,0|1,0,1]=4 5191 B6R0.6 C=C=CCCC=O Amb28208489 [1,1,0,0,0,0|0,0,2]=4 5192 B6R0.6 C=C=CCCCCl Amb17939722 [1,1,0,0,0,0|2,0,0]=4 5193 B6R0.6 C=C=CCCCN Amb27222280 [1,1,0,0,0,0|2,0,0]=4 5194 B6R0.6 C=C=CCCCO Amb10605300 [1,1,0,0,0,0|2,0,0]=4 5195 B6R0.6 C=CC#CCCC Amb17673843 [1,1,0,0,0,0|1,0,1]=4 5196 B6R0.6 C=CCC#CCC Amb22227956 [1,1,0,0,0,0|1,0,1]=4 5197 B6R0.6 C=CCCC#CC Amb35680296 [1,1,0,0,0,0|1,0,1]=4 5198 B6R0.6 C=CCCCC#N Amb6298890 [1,1,0,0,0,0|1,0,1]=4 5199 B6R0.6 C=CCCCC=C Amb22227760 [1,1,0,0,0,0|1,0,1]=4 5200 B6R0.6 C=CCCCC=O Amb13883672 [1,1,0,0,0,0|0,0,1]=3 5201 B6R0.6 C=CCCCCBr Amb3940222 [1,1,0,0,0,0|1,0,0]=3 5202 B6R0.6 C=CCCCCC Amb3940498 [1,1,0,0,0,0|1,0,0]=3 5203 B6R0.6 C=CCCCCCl Amb2692039 [1,1,0,0,0,0|1,0,0]=3 5204 B6R0.6 C=CCCCCF Amb24409527 [1,1,0,0,0,0|1,0,0]=3 5205 B6R0.6 C=CCCCCI Amb26858458 [1,1,0,0,0,0|1,0,0]=3 5206 B6R0.6 C=CCCCCN Amb18639514 [1,1,0,0,0,0|1,0,0]=3 5207 B6R0.6 C=CCCCCO Amb3940341 [1,1,0,0,0,0|1,0,0]=3 5208 B6R0.6 C=CCCCNC Amb18523846 [1,1,0,0,0,0|1,0,0]=3 5209 B6R0.6 C=CCCCNC Amb32651835 [1,1,0,0,0,0|1,0,0]=3 5210 B6R0.6 C=CCCCNO Amb27437399 [1,1,0,0,0,0|1,0,1]=4 5211 B6R0.6 C=CCCCOC Amb24432882 [1,1,0,0,0,0|1,0,0]=3 5212 B6R0.6 C=CCCOCCl Amb2696084 [1,1,0,0,0,0|2,0,0]=4 5213 B6R0.6 C=CCCSCC Amb27213772 [1,1,0,0,0,0|1,0,0]=3 5214 B6R0.6 C=CCC\C=C\C Amb22734684 [1,1,0,0,0,0|1,0,1]=4 5215 B6R0.6 C=CCNCCC Amb22587187 [1,1,0,0,0,0|1,0,0]=3 5216 B6R0.6 C=CCNCCC Amb6683949 [1,1,0,0,0,0|1,0,0]=3 5217 B6R0.6 C=CCNCCCl Amb17334072 [1,1,0,0,0,0|2,0,0]=4 5218 B6R0.6 C=CCNCCN Amb17091015 [1,1,0,0,0,0|2,0,0]=4 5219 B6R0.6 C=CCNCCO Amb6706545 [1,1,0,0,0,0|2,0,0]=4 5220 B6R0.6 C=CCNCOC Amb27973157 [1,1,0,0,0,0|2,0,0]=4 5221 B6R0.6 C=CCOCC=O Amb27402231 [1,1,0,0,0,0|0,0,2]=4 5222 B6R0.6 C=CCOCCBr Amb33531510 [1,1,0,0,0,0|2,0,0]=4 5223 B6R0.6 C=CCOCCC Amb3940491 [1,1,0,0,0,0|1,0,0]=3 5224 B6R0.6 C=CCOCCCl Amb2696085 [1,1,0,0,0,0|2,0,0]=4 5225 B6R0.6 C=CCOCCI Amb24739964 [1,1,0,0,0,0|2,0,0]=4 5226 B6R0.6 C=CCOCCN Amb32667523 [1,1,0,0,0,0|2,0,0]=4 5227 B6R0.6 C=CCOCCN Amb33530047 [1,1,0,0,0,0|2,0,0]=4 5228 B6R0.6 C=CCOCCO Amb3940609 [1,1,0,0,0,0|2,0,0]=4 5229 B6R0.6 C=CCOCOC Amb24385255 [1,1,0,0,0,0|2,0,0]=4 5230 B6R0.6 C=CCSCC=O Amb18641509 [1,1,0,0,0,0|0,0,2]=4 5231 B6R0.6 C=CCSCCCl Amb28042684 [1,1,0,0,0,0|2,0,0]=4 5232 B6R0.6 C=CCSCCN Amb13951462 [1,1,0,0,0,0|2,0,0]=4 5233 B6R0.6 C=CCSCCN Amb6273787 [1,1,0,0,0,0|2,0,0]=4 5234 B6R0.6 C=COCCCC Amb8513427 [1,1,0,0,0,0|1,0,0]=3 5235 B6R0.6 C=COCCCCl Amb27613489 [1,1,0,0,0,0|2,0,0]=4 5236 B6R0.6 C=COCCCF Amb22008255 [1,1,0,0,0,0|2,0,0]=4 5237 B6R0.6 C=COCCCN Amb3997182 [1,1,0,0,0,0|2,0,0]=4 5238 B6R0.6 C=COCCOC Amb21520356 [1,1,0,0,0,0|2,0,0]=4 5239 B6R0.6 C=CSCCCN Amb27800121 [1,1,0,0,0,0|2,0,0]=4 5240 B6R0.6 C=C\C=C\CCC Amb33171502 [1,1,0,0,0,0|1,0,1]=4 5241 B6R0.6 CC#CCCCO Amb20242139 [1,1,0,0,0,0|0,0,2]=4 5242 B6R0.6 CCC#CCC=O Amb28396959 [1,1,0,0,0,0|0,0,1]=3 5243 B6R0.6 CCC#CCCO Amb8514641 [1,1,0,0,0,0|0,0,2]=4 5244 B6R0.6 CCC=C=CC=O Amb27237589 [1,1,0,0,0,0|0,0,2]=4 5245 B6R0.6 CCCC#CC=O Amb27244852 [1,1,0,0,0,0|0,0,1]=3 5246 B6R0.6 CCCC=C=CBr Amb27477883 [1,1,0,0,0,0|1,0,1]=4 5247 B6R0.6 CCCCBOC Amb22728871 [1,1,0,0,0,0|1,0,0]=3 5248 B6R0.6 CCCCC#CI Amb27632377 [1,1,0,0,0,0|1,0,1]=4 5249 B6R0.6 CCCCC=[N+]=[N-] Amb28184340 [1,1,0,0,0,0|1,0,0]=3 5250 B6R0.6 CCCCCC#N Amb6250301 [1,1,0,0,0,0|1,0,1]=4 5251 B6R0.6 CCCCCC=O Amb3939522 [1,1,0,0,0,0|0,0,0]=2 5252 B6R0.6 CCCCCCBr Amb3940085 [1,1,0,0,0,0|1,0,1]=4 5253 B6R0.6 CCCCCCC Amb8513177 [1,1,0,0,0,0|1,0,1]=4 5254 B6R0.6 CCCCCCCl Amb7764628 [1,1,0,0,0,0|1,0,1]=4 5255 B6R0.6 CCCCCCF Amb8516643 [1,1,0,0,0,0|1,0,1]=4 5256 B6R0.6 CCCCCCI Amb6608700 [1,1,0,0,0,0|1,0,1]=4 5257 B6R0.6 CCCCCCN Amb2721179 [1,1,0,0,0,0|1,0,1]=4 5258 B6R0.6 CCCCCCN Amb3940465 [1,1,0,0,0,0|1,0,1]=4 5259 B6R0.6 CCCCCCO Amb3941500 [1,1,0,0,0,0|0,0,1]=3 5260 B6R0.6 CCCCCCS Amb8514502 [1,1,0,0,0,0|0,1,1]=4 5261 B6R0.6 CCCCCC[SiH3] Amb19893900 [1,1,0,0,0,0|1,0,1]=4 5262 B6R0.6 CCCCCNC Amb3939381 [1,1,0,0,0,0|1,0,1]=4 5263 B6R0.6 CCCCCNN Amb32693399 [1,1,0,0,0,0|1,0,1]=4 5264 B6R0.6 CCCCCNN Amb6249376 [1,1,0,0,0,0|1,0,1]=4 5265 B6R0.6 CCCCCNO Amb25067859 [1,1,0,0,0,0|0,0,1]=3 5266 B6R0.6 CCCCCOC Amb9787609 [1,1,0,0,0,0|0,0,1]=3 5267 B6R0.6 CCCCCON Amb18122095 [1,1,0,0,0,0|0,0,1]=3 5268 B6R0.6 CCCCCSC Amb21618865 [1,1,0,0,0,0|0,1,1]=4 5269 B6R0.6 CCCCN=C=O Amb3939310 [1,1,0,0,0,0|0,0,1]=3 5270 B6R0.6 CCCCN=C=S Amb6572520 [1,1,0,0,0,0|0,1,1]=4 5271 B6R0.6 CCCCN=[N+]=N Amb34916661 [1,1,0,0,0,0|2,0,0]=4 5272 B6R0.6 CCCCN=[N+]=[N-] Amb17939434 [1,1,0,0,0,0|2,0,0]=4 5273 B6R0.6 CCCCN=[N+]=[N-] Amb33526892 [1,1,0,0,0,0|2,0,0]=4 5274 B6R0.6 CCCCNC=O Amb4017838 [1,1,0,0,0,0|0,0,0]=2 5275 B6R0.6 CCCCNCC Amb3939842 [1,1,0,0,0,0|1,0,1]=4 5276 B6R0.6 CCCCNOC Amb24479420 [1,1,0,0,0,0|1,0,0]=3 5277 B6R0.6 CCCCOB=O Amb26900238 [1,1,0,0,0,0|1,0,0]=3 5278 B6R0.6 CCCCOC=O Amb6608882 [1,1,0,0,0,0|0,0,0]=2 5279 B6R0.6 CCCCOCC Amb2685642 [1,1,0,0,0,0|1,0,1]=4 5280 B6R0.6 CCCCOCO Amb24480826 [1,1,0,0,0,0|0,0,1]=3 5281 B6R0.6 CCCCON=O Amb8515227 [1,1,0,0,0,0|1,0,0]=3 5282 B6R0.6 CCCCSC#N Amb4035931 [1,1,0,0,0,0|1,0,1]=4 5283 B6R0.6 CCCCSCC Amb9787545 [1,1,0,0,0,0|1,0,1]=4 5284 B6R0.6 CCCCSCCl Amb25146885 [1,1,0,0,0,0|1,0,1]=4 5285 B6R0.6 CCCCSCO Amb27623932 [1,1,0,0,0,0|0,0,1]=3 5286 B6R0.6 CCCC\C=C\I Amb25173925 [1,1,0,0,0,0|1,0,0]=3 5287 B6R0.6 CCCNCC#N Amb6714443 [1,1,0,0,0,0|1,0,1]=4 5288 B6R0.6 CCCNCCC Amb3939352 [1,1,0,0,0,0|1,0,1]=4 5289 B6R0.6 CCCNCCCl Amb17334074 [1,1,0,0,0,0|1,0,1]=4 5290 B6R0.6 CCCNCCN Amb8515461 [1,1,0,0,0,0|1,0,1]=4 5291 B6R0.6 CCCNCCO Amb3939869 [1,1,0,0,0,0|0,0,1]=3 5292 B6R0.6 CCCNCOC Amb27830080 [1,1,0,0,0,0|1,0,1]=4 5293 B6R0.6 CCCN\C=N\N Amb28049932 [1,1,0,0,0,0|2,0,0]=4 5294 B6R0.6 CCCOCC#N Amb8874819 [1,1,0,0,0,0|1,0,1]=4 5295 B6R0.6 CCCOCCC Amb8513440 [1,1,0,0,0,0|1,0,1]=4 5296 B6R0.6 CCCOCCCl Amb8514866 [1,1,0,0,0,0|1,0,1]=4 5297 B6R0.6 CCCOCCI Amb27596856 [1,1,0,0,0,0|1,0,1]=4 5298 B6R0.6 CCCOCCN Amb3939563 [1,1,0,0,0,0|1,0,1]=4 5299 B6R0.6 CCCOCCO Amb3939227 [1,1,0,0,0,0|0,0,1]=3 5300 B6R0.6 CCCSCC#N Amb6680723 [1,1,0,0,0,0|1,0,1]=4 5301 B6R0.6 CCCSCCBr Amb9304990 [1,1,0,0,0,0|1,0,1]=4 5302 B6R0.6 CCCSCCC Amb9787473 [1,1,0,0,0,0|1,0,1]=4 5303 B6R0.6 CCCSCCCl Amb9304987 [1,1,0,0,0,0|1,0,1]=4 5304 B6R0.6 CCCSCCN Amb19888435 [1,1,0,0,0,0|1,0,1]=4 5305 B6R0.6 CCCSCCN Amb6268693 [1,1,0,0,0,0|1,0,1]=4 5306 B6R0.6 CCCSCCS Amb28050075 [1,1,0,0,0,0|0,1,1]=4 5307 B6R0.6 CCCSCNC Amb27879006 [1,1,0,0,0,0|2,0,0]=4 5308 B6R0.6 CCC\C=C/C=O Amb25885814 [1,1,0,0,0,0|0,0,1]=3 5309 B6R0.6 CCC\C=C\C=O Amb3940431 [1,1,0,0,0,0|0,0,1]=3 5310 B6R0.6 CCC\C=C\CCl Amb27482813 [1,1,0,0,0,0|1,0,1]=4 5311 B6R0.6 CCC\C=C\CN Amb33475254 [1,1,0,0,0,0|1,0,1]=4 5312 B6R0.6 CCC\C=C\CO Amb32660968 [1,1,0,0,0,0|0,0,1]=3 5313 B6R0.6 CCC\C=C\CS Amb33373719 [1,1,0,0,0,0|0,1,1]=4 5314 B6R0.6 CCNCCC#N Amb2720499 [1,1,0,0,0,0|1,0,1]=4 5315 B6R0.6 CCNCCCBr Amb27265760 [1,1,0,0,0,0|1,0,1]=4 5316 B6R0.6 CCNCCCF Amb28050218 [1,1,0,0,0,0|1,0,1]=4 5317 B6R0.6 CCNCCCN Amb17315269 [1,1,0,0,0,0|1,0,1]=4 5318 B6R0.6 CCNCCCO Amb6733726 [1,1,0,0,0,0|0,0,1]=3 5319 B6R0.6 CCNCCOC Amb32653021 [1,1,0,0,0,0|1,0,1]=4 5320 B6R0.6 CCNCCOC Amb3939818 [1,1,0,0,0,0|1,0,1]=4 5321 B6R0.6 CCNCCSC Amb19024605 [1,1,0,0,0,0|2,0,0]=4 5322 B6R0.6 CCNCCSC Amb28941534 [1,1,0,0,0,0|2,0,0]=4 5323 B6R0.6 CCNCNC=O Amb27252409 [1,1,0,0,0,0|1,0,0]=3 5324 B6R0.6 CCNC\C=C/I Amb23539308 [1,1,0,0,0,0|1,0,1]=4 5325 B6R0.6 CCNOCCO Amb28281707 [1,1,0,0,0,0|1,0,1]=4 5326 B6R0.6 CCN\C=C/C=O Amb27793118 [1,1,0,0,0,0|0,0,2]=4 5327 B6R0.6 CCOCCC#N Amb4019489 [1,1,0,0,0,0|1,0,1]=4 5328 B6R0.6 CCOCCC=O Amb25688261 [1,1,0,0,0,0|0,0,0]=2 5329 B6R0.6 CCOCCCBr Amb8828206 [1,1,0,0,0,0|1,0,1]=4 5330 B6R0.6 CCOCCCCl Amb6255304 [1,1,0,0,0,0|1,0,1]=4 5331 B6R0.6 CCOCCCN Amb3939347 [1,1,0,0,0,0|1,0,1]=4 5332 B6R0.6 CCOCCCO Amb3939322 [1,1,0,0,0,0|0,0,1]=3 5333 B6R0.6 CCOCCNC Amb19959934 [1,1,0,0,0,0|2,0,0]=4 5334 B6R0.6 CCOCCNC Amb33529221 [1,1,0,0,0,0|2,0,0]=4 5335 B6R0.6 CCOCCNN Amb22587352 [1,1,0,0,0,0|2,0,0]=4 5336 B6R0.6 CCOCCNN Amb6744628 [1,1,0,0,0,0|2,0,0]=4 5337 B6R0.6 CCOCCOC Amb22052684 [1,1,0,0,0,0|1,0,1]=4 5338 B6R0.6 CCOCCON Amb18061689 [1,1,0,0,0,0|1,0,1]=4 5339 B6R0.6 CCOCNC=O Amb28252363 [1,1,0,0,0,0|1,0,0]=3 5340 B6R0.6 CCOC\C=C\Br Amb28244732 [1,1,0,0,0,0|1,0,1]=4 5341 B6R0.6 CCO\C=C/C=O Amb27423444 [1,1,0,0,0,0|0,0,2]=4 5342 B6R0.6 CCO\C=C\C=O Amb18639560 [1,1,0,0,0,0|0,0,2]=4 5343 B6R0.6 CCSCCC#N Amb6680683 [1,1,0,0,0,0|1,0,1]=4 5344 B6R0.6 CCSCCC=O Amb27254551 [1,1,0,0,0,0|0,0,0]=2 5345 B6R0.6 CCSCCCBr Amb9305000 [1,1,0,0,0,0|1,0,1]=4 5346 B6R0.6 CCSCCCI Amb28461625 [1,1,0,0,0,0|1,0,1]=4 5347 B6R0.6 CCSCCCN Amb6680223 [1,1,0,0,0,0|1,0,1]=4 5348 B6R0.6 CCSCCCO Amb3939588 [1,1,0,0,0,0|0,0,1]=3 5349 B6R0.6 CCSCCCS Amb26476929 [1,1,0,0,0,0|0,1,1]=4 5350 B6R0.6 CCSCCNC Amb16186669 [1,1,0,0,0,0|2,0,0]=4 5351 B6R0.6 CCSCCNN Amb27218047 [1,1,0,0,0,0|2,0,0]=4 5352 B6R0.6 CCSCCNO Amb33324087 [1,1,0,0,0,0|1,0,0]=3 5353 B6R0.6 CCSCCON Amb24414250 [1,1,0,0,0,0|1,0,1]=4 5354 B6R0.6 CCSCNC=O Amb28315587 [1,1,0,0,0,0|1,0,0]=3 5355 B6R0.6 CC\C=C/CC=O Amb18639157 [1,1,0,0,0,0|0,0,1]=3 5356 B6R0.6 CC\C=C/CCC Amb26600858 [1,1,0,0,0,0|1,0,1]=4 5357 B6R0.6 CC\C=C/CCO Amb2720771 [1,1,0,0,0,0|0,0,2]=4 5358 B6R0.6 CC\C=C\CCC Amb19930065 [1,1,0,0,0,0|1,0,1]=4 5359 B6R0.6 CC\C=C\CCO Amb3940339 [1,1,0,0,0,0|0,0,2]=4 5360 B6R0.6 CC\C=C\CNO Amb33225042 [1,1,0,0,0,0|1,0,1]=4 5361 B6R0.6 CNCCCCCl Amb34916601 [1,1,0,0,0,0|1,0,1]=4 5362 B6R0.6 CNCCCCF Amb27231439 [1,1,0,0,0,0|1,0,1]=4 5363 B6R0.6 CNCCCCN Amb17334048 [1,1,0,0,0,0|1,0,1]=4 5364 B6R0.6 CNCCCCN Amb2698063 [1,1,0,0,0,0|1,0,1]=4 5365 B6R0.6 CNCCCCO Amb33539277 [1,1,0,0,0,0|0,0,1]=3 5366 B6R0.6 CNCCCNC Amb3940467 [1,1,0,0,0,0|2,0,0]=4 5367 B6R0.6 CNCCCOC Amb33801534 [1,1,0,0,0,0|1,0,1]=4 5368 B6R0.6 CNCCCOC Amb9204018 [1,1,0,0,0,0|1,0,1]=4 5369 B6R0.6 CNCCCON Amb27430260 [1,1,0,0,0,0|1,0,1]=4 5370 B6R0.6 CNCCCSC Amb6718995 [1,1,0,0,0,0|2,0,0]=4 5371 B6R0.6 CNCC\C=C\Cl Amb27605601 [1,1,0,0,0,0|1,0,1]=4 5372 B6R0.6 COCCCC#N Amb6258835 [1,1,0,0,0,0|1,0,1]=4 5373 B6R0.6 COCCCC=O Amb33530955 [1,1,0,0,0,0|0,0,0]=2 5374 B6R0.6 COCCCCBr Amb8855443 [1,1,0,0,0,0|1,0,1]=4 5375 B6R0.6 COCCCCCl Amb17942999 [1,1,0,0,0,0|1,0,1]=4 5376 B6R0.6 COCCCCI Amb25933499 [1,1,0,0,0,0|1,0,1]=4 5377 B6R0.6 COCCCCN Amb10610278 [1,1,0,0,0,0|1,0,1]=4 5378 B6R0.6 COCCCCN Amb6251056 [1,1,0,0,0,0|1,0,1]=4 5379 B6R0.6 COCCCCO Amb17666901 [1,1,0,0,0,0|0,0,1]=3 5380 B6R0.6 COCCCCS Amb24654696 [1,1,0,0,0,0|0,1,1]=4 5381 B6R0.6 COCCCNN Amb25887940 [1,1,0,0,0,0|2,0,0]=4 5382 B6R0.6 COCCCNN Amb33204509 [1,1,0,0,0,0|2,0,0]=4 5383 B6R0.6 COCCCNN Amb33553392 [1,1,0,0,0,0|2,0,0]=4 5384 B6R0.6 COCCCNO Amb33378127 [1,1,0,0,0,0|1,0,0]=3 5385 B6R0.6 COCCCOC Amb22168275 [1,1,0,0,0,0|1,0,1]=4 5386 B6R0.6 COCCCON Amb18559290 [1,1,0,0,0,0|1,0,1]=4 5387 B6R0.6 COCCCSC Amb28139052 [1,1,0,0,0,0|1,0,1]=4 5388 B6R0.6 COCCN=C=O Amb901883 [1,1,0,0,0,0|1,0,1]=4 5389 B6R0.6 COCCNC=O Amb24334241 [1,1,0,0,0,0|1,0,0]=3 5390 B6R0.6 COCCOCO Amb28281708 [1,1,0,0,0,0|1,0,1]=4 5391 B6R0.6 COCNCCO Amb18522071 [1,1,0,0,0,0|1,0,1]=4 5392 B6R0.6 COCOCC=O Amb27409311 [1,1,0,0,0,0|1,0,0]=3 5393 B6R0.6 COCOCCO Amb23590973 [1,1,0,0,0,0|1,0,1]=4 5394 B6R0.6 COC\C=C\C=O Amb33473884 [1,1,0,0,0,0|0,0,2]=4 5395 B6R0.6 COC\C=C\CO Amb33428788 [1,1,0,0,0,0|1,0,1]=4 5396 B6R0.6 CONCCCN Amb26953498 [1,1,0,0,0,0|2,0,0]=4 5397 B6R0.6 CONCCCN Amb30584683 [1,1,0,0,0,0|2,0,0]=4 5398 B6R0.6 CONCCCN Amb32666616 [1,1,0,0,0,0|2,0,0]=4 5399 B6R0.6 CONCCCO Amb24479622 [1,1,0,0,0,0|1,0,1]=4 5400 B6R0.6 CONCCCO Amb33456216 [1,1,0,0,0,0|1,0,1]=4 5401 B6R0.6 CSCCCC#N Amb17504231 [1,1,0,0,0,0|1,0,1]=4 5402 B6R0.6 CSCCCC=O Amb25992553 [1,1,0,0,0,0|0,0,0]=2 5403 B6R0.6 CSCCCCBr Amb19054837 [1,1,0,0,0,0|1,0,1]=4 5404 B6R0.6 CSCCCCCl Amb25240444 [1,1,0,0,0,0|1,0,1]=4 5405 B6R0.6 CSCCCCF Amb27620229 [1,1,0,0,0,0|1,0,1]=4 5406 B6R0.6 CSCCCCN Amb17500948 [1,1,0,0,0,0|1,0,1]=4 5407 B6R0.6 CSCCCCO Amb9825911 [1,1,0,0,0,0|0,0,1]=3 5408 B6R0.6 CSCCCCS Amb27461555 [1,1,0,0,0,0|0,1,1]=4 5409 B6R0.6 CSCCCNN Amb24093854 [1,1,0,0,0,0|2,0,0]=4 5410 B6R0.6 CSCCCNO Amb27948053 [1,1,0,0,0,0|1,0,0]=3 5411 B6R0.6 CSCCCON Amb27947150 [1,1,0,0,0,0|1,0,1]=4 5412 B6R0.6 CSCCCSC Amb22043311 [1,1,0,0,0,0|2,0,0]=4 5413 B6R0.6 CSCCN=C=O Amb19889355 [1,1,0,0,0,0|1,0,1]=4 5414 B6R0.6 CSCCNC=O Amb28437305 [1,1,0,0,0,0|1,0,0]=3 5415 B6R0.6 CSC\C=C\C=O Amb33271737 [1,1,0,0,0,0|0,0,2]=4 5416 B6R0.6 CSC\C=C\CO Amb33079758 [1,1,0,0,0,0|1,0,1]=4 5417 B6R0.6 C\C=C/CCC=O Amb28202620 [1,1,0,0,0,0|0,0,1]=3 5418 B6R0.6 C\C=C/CCCC Amb24467666 [1,1,0,0,0,0|1,0,0]=3 5419 B6R0.6 C\C=C/CCCN Amb27658374 [1,1,0,0,0,0|1,0,1]=4 5420 B6R0.6 C\C=C/CCCO Amb17614951 [1,1,0,0,0,0|0,0,2]=4 5421 B6R0.6 C\C=C\CCC=O Amb17593074 [1,1,0,0,0,0|0,0,1]=3 5422 B6R0.6 C\C=C\CCCC Amb8515158 [1,1,0,0,0,0|1,0,0]=3 5423 B6R0.6 C\C=C\CCCI Amb25837122 [1,1,0,0,0,0|1,0,1]=4 5424 B6R0.6 C\C=C\CCCO Amb22347882 [1,1,0,0,0,0|0,0,2]=4 5425 B6R0.6 C\C=C\SCCC Amb22168314 [1,1,0,0,0,0|1,0,1]=4 5426 B6R0.6 ClCCCCCBr Amb2724373 [1,1,0,0,0,0|1,0,1]=4 5427 B6R0.6 ClCCCCCCl Amb6608828 [1,1,0,0,0,0|1,0,1]=4 5428 B6R0.6 ClCCCCCI Amb10069913 [1,1,0,0,0,0|1,0,1]=4 5429 B6R0.6 FCCCCCBr Amb15701635 [1,1,0,0,0,0|1,0,1]=4 5430 B6R0.6 FCCCCCF Amb27397467 [1,1,0,0,0,0|1,0,1]=4 5431 B6R0.6 FCCCCCS Amb24409033 [1,1,0,0,0,0|0,1,1]=4 5432 B6R0.6 ICCCCCI Amb8514835 [1,1,0,0,0,0|1,0,1]=4 5433 B6R0.6 N#CCCCC=O Amb18120556 [1,1,0,0,0,0|0,0,1]=3 5434 B6R0.6 N#CCCCCBr Amb2685556 [1,1,0,0,0,0|1,0,1]=4 5435 B6R0.6 N#CCCCCCl Amb3940299 [1,1,0,0,0,0|1,0,1]=4 5436 B6R0.6 N#CCCCCF Amb26935678 [1,1,0,0,0,0|1,0,1]=4 5437 B6R0.6 N#CCCCCI Amb27650166 [1,1,0,0,0,0|1,0,1]=4 5438 B6R0.6 N#CCCCCN Amb30628578 [1,1,0,0,0,0|1,0,1]=4 5439 B6R0.6 N#CCCCCN Amb33532899 [1,1,0,0,0,0|1,0,1]=4 5440 B6R0.6 N#CCCCCO Amb33531864 [1,1,0,0,0,0|0,0,2]=4 5441 B6R0.6 NCCCCC=O Amb26627836 [1,1,0,0,0,0|0,0,0]=2 5442 B6R0.6 NCCCCCBr Amb26581378 [1,1,0,0,0,0|1,0,1]=4 5443 B6R0.6 NCCCCCCl Amb17593241 [1,1,0,0,0,0|1,0,1]=4 5444 B6R0.6 NCCCCCF Amb28383861 [1,1,0,0,0,0|1,0,1]=4 5445 B6R0.6 NCCCCCF Amb35747648 [1,1,0,0,0,0|1,0,1]=4 5446 B6R0.6 NCCCCCI Amb27596855 [1,1,0,0,0,0|1,0,1]=4 5447 B6R0.6 NCCCCCN Amb22002397 [1,1,0,0,0,0|1,0,1]=4 5448 B6R0.6 NCCCCCN Amb8513099 [1,1,0,0,0,0|1,0,1]=4 5449 B6R0.6 NCCCCCO Amb3939337 [1,1,0,0,0,0|0,0,1]=3 5450 B6R0.6 NCCCCCS Amb33362345 [1,1,0,0,0,0|0,1,1]=4 5451 B6R0.6 NCCCCCS Amb33527075 [1,1,0,0,0,0|0,1,1]=4 5452 B6R0.6 NCCCCNO Amb24117989 [1,1,0,0,0,0|1,0,0]=3 5453 B6R0.6 NCCCCNO Amb27668394 [1,1,0,0,0,0|1,0,0]=3 5454 B6R0.6 NCCCCON Amb28188672 [1,1,0,0,0,0|1,0,1]=4 5455 B6R0.6 NCCCNC=O Amb5723517 [1,1,0,0,0,0|1,0,0]=3 5456 B6R0.6 NCCC\C=C/I Amb28050291 [1,1,0,0,0,0|1,0,1]=4 5457 B6R0.6 NCCNCCO Amb6600573 [1,1,0,0,0,0|1,0,1]=4 5458 B6R0.6 NCCOCCO Amb3939011 [1,1,0,0,0,0|1,0,1]=4 5459 B6R0.6 NCCSCCO Amb2725559 [1,1,0,0,0,0|1,0,1]=4 5460 B6R0.6 NNCCCCO Amb24692523 [1,1,0,0,0,0|1,0,1]=4 5461 B6R0.6 NOCCCCF Amb27160797 [1,1,0,0,0,0|1,0,1]=4 5462 B6R0.6 O=C=NCCCBr Amb27859638 [1,1,0,0,0,0|1,0,1]=4 5463 B6R0.6 O=C=NCCCCl Amb3939153 [1,1,0,0,0,0|1,0,1]=4 5464 B6R0.6 O=C=NCCCF Amb27838244 [1,1,0,0,0,0|1,0,1]=4 5465 B6R0.6 O=CCCCC=O Amb6600455 [1,1,0,0,0,0|0,0,1]=3 5466 B6R0.6 O=CCCCCBr Amb18126353 [1,1,0,0,0,0|0,0,0]=2 5467 B6R0.6 O=CCCCCCl Amb18123550 [1,1,0,0,0,0|0,0,0]=2 5468 B6R0.6 O=CCCCCO Amb10603837 [1,1,0,0,0,0|0,0,0]=2 5469 B6R0.6 O=CCCCN=O Amb27838215 [1,1,0,0,0,0|1,0,0]=3 5470 B6R0.6 O=CCC\C=C/Br Amb27838206 [1,1,0,0,0,0|0,0,2]=4 5471 B6R0.6 O=CCC\C=C\Cl Amb27955198 [1,1,0,0,0,0|0,0,2]=4 5472 B6R0.6 O=CNCCCO Amb27248821 [1,1,0,0,0,0|1,0,0]=3 5473 B6R0.6 O=C\C=C/CCO Amb27235316 [1,1,0,0,0,0|0,0,2]=4 5474 B6R0.6 O=C\C=C\CCF Amb33429802 [1,1,0,0,0,0|0,0,2]=4 5475 B6R0.6 O=[PH2]OCCCO Amb27218913 [1,1,0,0,0,0|2,0,0]=4 5476 B6R0.6 OCCCCCBr Amb10603824 [1,1,0,0,0,0|0,0,1]=3 5477 B6R0.6 OCCCCCCl Amb8386939 [1,1,0,0,0,0|0,0,1]=3 5478 B6R0.6 OCCCCCF Amb24479828 [1,1,0,0,0,0|0,0,1]=3 5479 B6R0.6 OCCCCCO Amb6296608 [1,1,0,0,0,0|0,0,1]=3 5480 B6R0.6 OCCCCNO Amb27396013 [1,1,0,0,0,0|1,0,0]=3 5481 B6R0.6 OCCC\C=C\Br Amb27483322 [1,1,0,0,0,0|1,0,1]=4 5482 B6R0.6 OCCC\C=C\I Amb27879078 [1,1,0,0,0,0|1,0,1]=4 5483 B6R0.6 OCCNCCF Amb27468539 [1,1,0,0,0,0|1,0,1]=4 5484 B6R0.6 OCCNCCO Amb22035219 [1,1,0,0,0,0|1,0,1]=4 5485 B6R0.6 OCCNCCO Amb3997179 [1,1,0,0,0,0|1,0,1]=4 5486 B6R0.6 OCCNCCS Amb18522180 [1,1,0,0,0,0|1,0,1]=4 5487 B6R0.6 OCCOCCBr Amb24057456 [1,1,0,0,0,0|1,0,1]=4 5488 B6R0.6 OCCOCCCl Amb3940337 [1,1,0,0,0,0|1,0,1]=4 5489 B6R0.6 OCCOCCF Amb17593119 [1,1,0,0,0,0|1,0,1]=4 5490 B6R0.6 OCCOCCI Amb27602214 [1,1,0,0,0,0|1,0,1]=4 5491 B6R0.6 OCCOCCO Amb32671216 [1,1,0,0,0,0|1,0,1]=4 5492 B6R0.6 OCCOCCO Amb6608789 [1,1,0,0,0,0|1,0,1]=4 5493 B6R0.6 OCCOCCS Amb22008751 [1,1,0,0,0,0|1,0,1]=4 5494 B6R0.6 OCCPCCO Amb27185495 [1,1,0,0,0,0|1,0,1]=4 5495 B6R0.6 OCCSCCCl Amb27413860 [1,1,0,0,0,0|1,0,1]=4 5496 B6R0.6 OCCSCCO Amb6891967 [1,1,0,0,0,0|1,0,1]=4 5497 B6R0.6 OCCSCCS Amb27829564 [1,1,0,0,0,0|1,0,1]=4 5498 B6R0.6 OC\C=C\CCF Amb33196119 [1,1,0,0,0,0|1,0,1]=4 5499 B6R0.6 OC\C=C\CCO Amb26017278 [1,1,0,0,0,0|1,0,1]=4 5500 B6R0.6 SCCCCCS Amb8514611 [1,1,0,0,0,0|0,1,1]=4 5501 B6R0.6 [C-]#[N+]CCCCC Amb2684559 [1,1,0,0,0,0|1,0,1]=4 5502 B6R0.6 [C-]#[N+]CCCCF Amb26005128 [1,1,0,0,0,0|2,0,0]=4 5503 B6R0.6 [C-]#[N+]CCCOC Amb2235648 [1,1,0,0,0,0|2,0,0]=4 5504 B6R0.6 [C-]#[N+]CCCSC Amb33198739 [1,1,0,0,0,0|2,0,0]=4 5505 B6R0.6 [C-]#[N+]CCOCC Amb1981103 [1,1,0,0,0,0|2,0,0]=4 5506 B6R0.6 [C-]#[N+]CCSCC Amb33324019 [1,1,0,0,0,0|2,0,0]=4 5507 B6R0.6 [N-]=[N+]=NCCC=O Amb28050185 [1,1,0,0,0,0|2,0,0]=4 5508 B8R0.2 C#C[C@@H](C)[C@H](C)C(=O)O Amb27257738 [0,2,0,0,0,0|0,0,2]=4 5509 B8R0.2 C#C[C@H](C)[C@@H](O)C(=O)O Amb27777980 [0,2,0,0,0,0|0,0,2]=4 5510 B8R0.2 C=C(C(=O)O)C(C)CC Amb18642655 [0,2,0,0,0,0|0,0,1]=3 5511 B8R0.2 C=C(C(=O)O)[C@@H](O)CC Amb28253249 [0,2,0,0,0,0|0,0,1]=3 5512 B8R0.2 C=C(C(C)=O)[C@@H](O)CC Amb27165607 [0,2,0,0,0,0|1,0,1]=4 5513 B8R0.2 C=C(C(C)=O)[C@H](O)CC Amb27634796 [0,2,0,0,0,0|1,0,1]=4 5514 B8R0.2 C=C(C)C(C)C(O)CC Amb28401073 [0,2,0,0,0,0|2,0,0]=4 5515 B8R0.2 C=C(C)C(N)C(C)CC Amb27760262 [0,2,0,0,0,0|2,0,0]=4 5516 B8R0.2 C=C(C)C(O)C(Cl)CC Amb28124578 [0,2,0,0,0,0|2,0,0]=4 5517 B8R0.2 C=C(C)C(O)C(N)CC Amb35624531 [0,2,0,0,0,0|2,0,0]=4 5518 B8R0.2 C=C(C)C(O)[C@@H](C)CC Amb28049235 [0,2,0,0,0,0|2,0,0]=4 5519 B8R0.2 C=C(C)C(O)[C@@H](N)CC Amb35601511 [0,2,0,0,0,0|2,0,0]=4 5520 B8R0.2 C=C(C)C(O)[C@H](N)CC Amb35659411 [0,2,0,0,0,0|2,0,0]=4 5521 B8R0.2 C=C(C)[C@@H](C)[C@@H](O)CC Amb28319535 [0,2,0,0,0,0|2,0,0]=4 5522 B8R0.2 C=C(O)C(O)C(=O)CC Amb28051028 [0,2,0,0,0,0|1,0,1]=4 5523 B8R0.2 C=CC(C)C(C)C(=O)O Amb18642611 [0,2,0,0,0,0|0,0,2]=4 5524 B8R0.2 C=CC(C)C(N)C(=O)O Amb18989861 [0,2,0,0,0,0|0,0,2]=4 5525 B8R0.2 C=CC(C)C(O)C(=O)O Amb18642750 [0,2,0,0,0,0|0,0,2]=4 5526 B8R0.2 C=CC(C)[C@@H](N)C(=O)O Amb25889532 [0,2,0,0,0,0|0,0,2]=4 5527 B8R0.2 C=CC(C)[C@H](N)C(=O)O Amb27761345 [0,2,0,0,0,0|0,0,2]=4 5528 B8R0.2 C=CC(N)C(C)C(=O)O Amb33036213 [0,2,0,0,0,0|0,0,2]=4 5529 B8R0.2 C=CC(O)C(C)C(=O)O Amb18642774 [0,2,0,0,0,0|0,0,2]=4 5530 B8R0.2 C=CC(O)C(N)C(=O)O Amb18642830 [0,2,0,0,0,0|0,0,2]=4 5531 B8R0.2 C=CC(O)[C@H](N)C(=O)O Amb28429839 [0,2,0,0,0,0|0,0,2]=4 5532 B8R0.2 C=C[C@@H](C)[C@H](N)C(=O)O Amb28129785 [0,2,0,0,0,0|0,0,2]=4 5533 B8R0.2 C=C[C@@H](C)[C@H](O)C(=O)O Amb27788648 [0,2,0,0,0,0|0,0,2]=4 5534 B8R0.2 C=C[C@H](C)[C@@H](N)C(=O)O Amb28067623 [0,2,0,0,0,0|0,0,2]=4 5535 B8R0.2 C=C[C@H](C)[C@H](Cl)C(=O)O Amb27601824 [0,2,0,0,0,0|0,0,2]=4 5536 B8R0.2 C=C[C@H](C)[C@H](F)C(=O)O Amb28285951 [0,2,0,0,0,0|0,0,2]=4 5537 B8R0.2 C=C[C@H](O)[C@@H](C)C(=O)O Amb28422977 [0,2,0,0,0,0|0,0,2]=4 5538 B8R0.2 C=C[C@H](O)[C@@H](N)C(=O)O Amb27236340 [0,2,0,0,0,0|0,0,2]=4 5539 B8R0.2 C=C[C@H](O)[C@H](C)C(=O)O Amb28285106 [0,2,0,0,0,0|0,0,2]=4 5540 B8R0.2 CC(=O)C(C)C(N)CO Amb27186035 [0,2,0,0,0,0|2,0,0]=4 5541 B8R0.2 CC(=O)C(O)C(O)CO Amb26636819 [0,2,0,0,0,0|2,0,0]=4 5542 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO Amb26654815 [0,2,0,0,0,0|2,0,0]=4 5543 B8R0.2 CC(=O)[C@H](O)[C@@H](O)CO Amb28201025 [0,2,0,0,0,0|2,0,0]=4 5544 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [0,2,0,0,0,0|2,0,0]=4 5545 B8R0.2 CC(C#N)C(N)C(=O)O Amb33065998 [0,2,0,0,0,0|1,0,1]=4 5546 B8R0.2 CC(C#N)[C@@H](N)C(=O)O Amb33308709 [0,2,0,0,0,0|1,0,1]=4 5547 B8R0.2 CC(C#N)[C@H](N)C(=O)O Amb33308645 [0,2,0,0,0,0|1,0,1]=4 5548 B8R0.2 CC(C(=O)O)C(N)CN Amb24532823 [0,2,0,0,0,0|1,0,0]=3 5549 B8R0.2 CC(CCl)C(N)C(=O)O Amb27470876 [0,2,0,0,0,0|1,0,0]=3 5550 B8R0.2 CC(CN)C(C)C(=O)O Amb27217450 [0,2,0,0,0,0|1,0,0]=3 5551 B8R0.2 CC(CN)C(F)C(=O)O Amb35750952 [0,2,0,0,0,0|1,0,0]=3 5552 B8R0.2 CC(CN)C(F)C(=O)O Amb35751592 [0,2,0,0,0,0|1,0,0]=3 5553 B8R0.2 CC(CN)C(O)C(=O)O Amb18642919 [0,2,0,0,0,0|1,0,0]=3 5554 B8R0.2 CC(CO)C(C)C(=O)O Amb27255789 [0,2,0,0,0,0|1,0,0]=3 5555 B8R0.2 CC(CO)C(N)C(=O)O Amb27629815 [0,2,0,0,0,0|1,0,0]=3 5556 B8R0.2 CC(CO)C(N)C(N)=O Amb33308985 [0,2,0,0,0,0|2,0,0]=4 5557 B8R0.2 CC(CO)[C@@H](N)C(=O)O Amb33308939 [0,2,0,0,0,0|1,0,0]=3 5558 B8R0.2 CC(CO)[C@H](N)C(=O)O Amb25918803 [0,2,0,0,0,0|1,0,0]=3 5559 B8R0.2 CC(CS)C(C)C(=O)O Amb17593702 [0,2,0,0,0,0|1,0,0]=3 5560 B8R0.2 CC(NO)C(C)C(=O)O Amb27185439 [0,2,0,0,0,0|2,0,0]=4 5561 B8R0.2 CCC(=O)C(=O)C(=O)O Amb31097725 [0,2,0,0,0,0|0,0,2]=4 5562 B8R0.2 CCC(=O)C(C)C(C)=O Amb17666954 [0,2,0,0,0,0|1,0,1]=4 5563 B8R0.2 CCC(=S)[C@H](N)C(=O)O Amb25111086 [0,2,0,0,0,0|0,0,1]=3 5564 B8R0.2 CCC(Br)C(=O)C(=O)O Amb27232743 [0,2,0,0,0,0|0,0,1]=3 5565 B8R0.2 CCC(C)C(=O)C(=O)Cl Amb28285750 [0,2,0,0,0,0|1,0,1]=4 5566 B8R0.2 CCC(C)C(=O)C(=O)O Amb2695339 [0,2,0,0,0,0|0,0,1]=3 5567 B8R0.2 CCC(C)C(Br)C(=O)O Amb4015586 [0,2,0,0,0,0|0,0,0]=2 5568 B8R0.2 CCC(C)C(Br)C(N)=O Amb27472685 [0,2,0,0,0,0|1,0,0]=3 5569 B8R0.2 CCC(C)C(C)B(O)O Amb25889778 [0,2,0,0,0,0|1,0,1]=4 5570 B8R0.2 CCC(C)C(C)C(=N)N Amb28142986 [0,2,0,0,0,0|2,0,0]=4 5571 B8R0.2 CCC(C)C(C)C(=O)O Amb18290719 [0,2,0,0,0,0|0,0,0]=2 5572 B8R0.2 CCC(C)C(C)C(C)=O Amb4035878 [0,2,0,0,0,0|1,0,0]=3 5573 B8R0.2 CCC(C)C(C)C(C)O Amb4020071 [0,2,0,0,0,0|1,0,1]=4 5574 B8R0.2 CCC(C)C(Cl)C(=O)O Amb17593752 [0,2,0,0,0,0|0,0,0]=2 5575 B8R0.2 CCC(C)C(Cl)C(N)=O Amb27771780 [0,2,0,0,0,0|1,0,0]=3 5576 B8R0.2 CCC(C)C(N)C(=O)O Amb9702778 [0,2,0,0,0,0|0,0,0]=2 5577 B8R0.2 CCC(C)C(N)C(C)O Amb18832525 [0,2,0,0,0,0|1,0,1]=4 5578 B8R0.2 CCC(C)C(N)C(N)=O Amb1105283 [0,2,0,0,0,0|1,0,0]=3 5579 B8R0.2 CCC(C)C(N)C(N)=O Amb1152621 [0,2,0,0,0,0|1,0,0]=3 5580 B8R0.2 CCC(C)C(N)C(N)=O Amb33551930 [0,2,0,0,0,0|1,0,0]=3 5581 B8R0.2 CCC(C)C(N)C(N)=S Amb19374909 [0,2,0,0,0,0|1,1,0]=4 5582 B8R0.2 CCC(C)C(O)C(=O)O Amb18288809 [0,2,0,0,0,0|0,0,0]=2 5583 B8R0.2 CCC(C)C(O)C(N)=O Amb24112761 [0,2,0,0,0,0|1,0,0]=3 5584 B8R0.2 CCC(C)C(S)C(=O)O Amb27667077 [0,2,0,0,0,0|0,0,0]=2 5585 B8R0.2 CCC(C)[C@@H](C)C(=O)O Amb10844494 [0,2,0,0,0,0|0,0,0]=2 5586 B8R0.2 CCC(C)[C@@H](N)C(=O)O Amb10844500 [0,2,0,0,0,0|0,0,0]=2 5587 B8R0.2 CCC(C)[C@H](Br)C(=O)Cl Amb27166137 [0,2,0,0,0,0|1,0,0]=3 5588 B8R0.2 CCC(C)[C@H](Br)C(=O)O Amb28183049 [0,2,0,0,0,0|0,0,0]=2 5589 B8R0.2 CCC(C)[C@H](C)C(=O)O Amb10844495 [0,2,0,0,0,0|0,0,0]=2 5590 B8R0.2 CCC(C)[C@H](Cl)C(=O)O Amb28314442 [0,2,0,0,0,0|0,0,0]=2 5591 B8R0.2 CCC(C)[C@H](N)C(=O)O Amb10844501 [0,2,0,0,0,0|0,0,0]=2 5592 B8R0.2 CCC(C)[C@H](N)C(C)=O Amb35617474 [0,2,0,0,0,0|1,0,0]=3 5593 B8R0.2 CCC(C)[C@H](N)C(C)O Amb35588414 [0,2,0,0,0,0|1,0,1]=4 5594 B8R0.2 CCC(Cl)C(C)C(C)=O Amb27983787 [0,2,0,0,0,0|1,0,0]=3 5595 B8R0.2 CCC(F)C(=O)C(=O)O Amb27489910 [0,2,0,0,0,0|0,0,1]=3 5596 B8R0.2 CCC(F)C(Br)C(=O)O Amb27858717 [0,2,0,0,0,0|0,0,0]=2 5597 B8R0.2 CCC(N)C(F)C(=O)O Amb33036406 [0,2,0,0,0,0|0,0,0]=2 5598 B8R0.2 CCC(N)C(O)C(N)=O Amb28055940 [0,2,0,0,0,0|1,0,0]=3 5599 B8R0.2 CCC(O)C(C)C(=O)O Amb10844267 [0,2,0,0,0,0|0,0,0]=2 5600 B8R0.2 CCC(O)C(C)C(C)=O Amb26336386 [0,2,0,0,0,0|1,0,0]=3 5601 B8R0.2 CCC(O)C(C)[N+](=O)[O-] Amb17618435 [0,2,0,0,0,0|1,0,1]=4 5602 B8R0.2 CCC(O)C(F)C(=O)O Amb33136388 [0,2,0,0,0,0|0,0,0]=2 5603 B8R0.2 CCC(O)C(N)C(=O)O Amb18203168 [0,2,0,0,0,0|0,0,0]=2 5604 B8R0.2 CCC(O)C(O)C(C)O Amb27456333 [0,2,0,0,0,0|1,0,1]=4 5605 B8R0.2 CCC(O)[C@H](N)C(=O)O Amb24364655 [0,2,0,0,0,0|0,0,0]=2 5606 B8R0.2 CCN(C)C(=O)C(=O)O Amb9304051 [0,2,0,0,0,0|1,0,1]=4 5607 B8R0.2 CCN(C)C(C)C(=O)O Amb8890967 [0,2,0,0,0,0|1,0,0]=3 5608 B8R0.2 CCN(C)[C@@H](C)C(=O)O Amb27228167 [0,2,0,0,0,0|1,0,0]=3 5609 B8R0.2 CCN(C)[C@H](C)C(N)=O Amb28062132 [0,2,0,0,0,0|2,0,0]=4 5610 B8R0.2 CCN(N)C(C)C(=O)O Amb27655613 [0,2,0,0,0,0|1,0,0]=3 5611 B8R0.2 CC[C@@H](C)C(Cl)C(=O)O Amb27472040 [0,2,0,0,0,0|0,0,0]=2 5612 B8R0.2 CC[C@@H](C)[C@@H](Br)C(=O)Cl Amb27194351 [0,2,0,0,0,0|1,0,0]=3 5613 B8R0.2 CC[C@@H](C)[C@@H](C)C(C)=O Amb27949165 [0,2,0,0,0,0|1,0,0]=3 5614 B8R0.2 CC[C@@H](C)[C@@H](C)C(N)=O Amb28049888 [0,2,0,0,0,0|1,0,0]=3 5615 B8R0.2 CC[C@@H](C)[C@@H](Cl)C(=O)O Amb28130604 [0,2,0,0,0,0|0,0,0]=2 5616 B8R0.2 CC[C@@H](C)[C@@H](F)C(=O)O Amb28347222 [0,2,0,0,0,0|0,0,0]=2 5617 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O Amb8513329 [0,2,0,0,0,0|0,0,0]=2 5618 B8R0.2 CC[C@@H](C)[C@@H](O)C(=O)O Amb26063750 [0,2,0,0,0,0|0,0,0]=2 5619 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O Amb26866576 [0,2,0,0,0,0|0,0,0]=2 5620 B8R0.2 CC[C@@H](C)[C@H](C)C(C)=O Amb25024740 [0,2,0,0,0,0|1,0,0]=3 5621 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O Amb10068321 [0,2,0,0,0,0|0,0,0]=2 5622 B8R0.2 CC[C@@H](C)[C@H](O)[C@@H](C)O Amb24389196 [0,2,0,0,0,0|1,0,1]=4 5623 B8R0.2 CC[C@@H](O)[C@@H](C)C(=O)O Amb27879857 [0,2,0,0,0,0|0,0,0]=2 5624 B8R0.2 CC[C@@H](O)[C@@H](C)C(C)=O Amb26600956 [0,2,0,0,0,0|1,0,0]=3 5625 B8R0.2 CC[C@@H](O)[C@H](C)[C@H](C)O Amb27946609 [0,2,0,0,0,0|1,0,1]=4 5626 B8R0.2 CC[C@@H](O)[C@H](O)C(C)=O Amb27861441 [0,2,0,0,0,0|1,0,0]=3 5627 B8R0.2 CC[C@@H](O)[C@H](O)C(C)O Amb28049151 [0,2,0,0,0,0|1,0,1]=4 5628 B8R0.2 CC[C@H](Br)[C@H](Br)C(=O)O Amb16233350 [0,2,0,0,0,0|0,0,0]=2 5629 B8R0.2 CC[C@H](C)C(=O)C(=O)O Amb28075584 [0,2,0,0,0,0|0,0,1]=3 5630 B8R0.2 CC[C@H](C)C(C)C(=O)O Amb27950556 [0,2,0,0,0,0|0,0,0]=2 5631 B8R0.2 CC[C@H](C)C(C)C(N)=O Amb28049537 [0,2,0,0,0,0|1,0,0]=3 5632 B8R0.2 CC[C@H](C)C(N)C(=O)O Amb27209489 [0,2,0,0,0,0|0,0,0]=2 5633 B8R0.2 CC[C@H](C)[C@@H](Br)C(=O)O Amb23401386 [0,2,0,0,0,0|0,0,0]=2 5634 B8R0.2 CC[C@H](C)[C@@H](C)C(C)=O Amb27250604 [0,2,0,0,0,0|1,0,0]=3 5635 B8R0.2 CC[C@H](C)[C@@H](F)C(=O)O Amb27954743 [0,2,0,0,0,0|0,0,0]=2 5636 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O Amb8516280 [0,2,0,0,0,0|0,0,0]=2 5637 B8R0.2 CC[C@H](C)[C@H](Br)C(N)=O Amb27235575 [0,2,0,0,0,0|1,0,0]=3 5638 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)Cl Amb27768651 [0,2,0,0,0,0|1,0,0]=3 5639 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O Amb22388560 [0,2,0,0,0,0|0,0,0]=2 5640 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O Amb3940753 [0,2,0,0,0,0|0,0,0]=2 5641 B8R0.2 CC[C@H](C)[C@H](N)C(C)O Amb35737490 [0,2,0,0,0,0|1,0,1]=4 5642 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O Amb10878815 [0,2,0,0,0,0|1,0,0]=3 5643 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O Amb9813724 [0,2,0,0,0,0|1,0,0]=3 5644 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O Amb2694797 [0,2,0,0,0,0|0,0,0]=2 5645 B8R0.2 CC[C@H](C)[C@H](O)[C@@H](C)O Amb27588936 [0,2,0,0,0,0|1,0,1]=4 5646 B8R0.2 CC[C@H](N)[C@H](C)C(=O)O Amb27779460 [0,2,0,0,0,0|0,0,0]=2 5647 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O Amb26981388 [0,2,0,0,0,0|0,0,0]=2 5648 B8R0.2 CC[C@H](O)[C@@H](O)[C@@H](C)O Amb28454611 [0,2,0,0,0,0|1,0,1]=4 5649 B8R0.2 CC[C@H](O)[C@H](Br)C(=O)O Amb28285137 [0,2,0,0,0,0|0,0,0]=2 5650 B8R0.2 CC[C@H](O)[C@H](C)C(C)=O Amb27590145 [0,2,0,0,0,0|1,0,0]=3 5651 B8R0.2 CC[C@H](O)[C@H](N)C(=O)O Amb26024594 [0,2,0,0,0,0|0,0,0]=2 5652 B8R0.2 CC[C@H](O)[C@H](O)[C@@H](C)O Amb28321543 [0,2,0,0,0,0|1,0,1]=4 5653 B8R0.2 CC\C(C)=C(/C)C(=O)O Amb27424733 [0,2,0,0,0,0|0,0,2]=4 5654 B8R0.2 CC\C(O)=C(\C)C(=O)O Amb27253362 [0,2,0,0,0,0|0,0,2]=4 5655 B8R0.2 CNC(=O)C(C)C(=O)O Amb26367215 [0,2,0,0,0,0|1,0,1]=4 5656 B8R0.2 CNC(C)C(C)C(C)=O Amb27202218 [0,2,0,0,0,0|2,0,0]=4 5657 B8R0.2 CNC(C)C(N)C(=O)O Amb18642890 [0,2,0,0,0,0|1,0,0]=3 5658 B8R0.2 CNC(C)C(O)C(N)=O Amb28366769 [0,2,0,0,0,0|2,0,0]=4 5659 B8R0.2 COC(=O)C(C)C(=O)O Amb33545071 [0,2,0,0,0,0|1,0,1]=4 5660 B8R0.2 COC(=O)C(N)C(=O)O Amb27487566 [0,2,0,0,0,0|1,0,1]=4 5661 B8R0.2 COC(C)C(Br)C(=O)Cl Amb27215381 [0,2,0,0,0,0|2,0,0]=4 5662 B8R0.2 COC(C)C(Br)C(=O)O Amb16233352 [0,2,0,0,0,0|1,0,0]=3 5663 B8R0.2 COC(C)C(Br)C(C)=O Amb27477738 [0,2,0,0,0,0|2,0,0]=4 5664 B8R0.2 COC(C)C(C)C(=O)O Amb10844268 [0,2,0,0,0,0|1,0,0]=3 5665 B8R0.2 COC(C)C(Cl)C(N)=O Amb27614474 [0,2,0,0,0,0|2,0,0]=4 5666 B8R0.2 COC(C)C(N)C(=O)O Amb17938689 [0,2,0,0,0,0|1,0,0]=3 5667 B8R0.2 COC(C)C(N)C(N)=O Amb27195568 [0,2,0,0,0,0|2,0,0]=4 5668 B8R0.2 COC(C)C(O)C(=O)O Amb27816478 [0,2,0,0,0,0|1,0,0]=3 5669 B8R0.2 COC(C)[C@@H](C)C(=O)O Amb33729616 [0,2,0,0,0,0|1,0,0]=3 5670 B8R0.2 COC(C)[C@@H](N)C(=O)O Amb25733335 [0,2,0,0,0,0|1,0,0]=3 5671 B8R0.2 COC(C)[C@H](C)C(=O)O Amb25722336 [0,2,0,0,0,0|1,0,0]=3 5672 B8R0.2 COC(C)[C@H](N)C(=O)O Amb25881538 [0,2,0,0,0,0|1,0,0]=3 5673 B8R0.2 COC(Cl)C(Cl)C(C)=O Amb27231978 [0,2,0,0,0,0|2,0,0]=4 5674 B8R0.2 CON(C)C(C)C(=O)O Amb27665034 [0,2,0,0,0,0|2,0,0]=4 5675 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O Amb26036938 [0,2,0,0,0,0|1,0,0]=3 5676 B8R0.2 CO[C@@H](C)[C@H](Br)C(N)=O Amb27863450 [0,2,0,0,0,0|2,0,0]=4 5677 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O Amb8390422 [0,2,0,0,0,0|1,0,0]=3 5678 B8R0.2 CO[C@H](C)[C@@H](Br)C(=O)O Amb27392325 [0,2,0,0,0,0|1,0,0]=3 5679 B8R0.2 CO[C@H](C)[C@@H](Cl)C(=O)O Amb27424722 [0,2,0,0,0,0|1,0,0]=3 5680 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O Amb16183892 [0,2,0,0,0,0|1,0,0]=3 5681 B8R0.2 CO[C@H](C)[C@H](N)C(N)=O Amb32723110 [0,2,0,0,0,0|2,0,0]=4 5682 B8R0.2 CO[C@H](C)[C@H](O)C(=O)O Amb25316180 [0,2,0,0,0,0|1,0,0]=3 5683 B8R0.2 CO[C@H](Cl)[C@H](Cl)C(C)=O Amb27407718 [0,2,0,0,0,0|2,0,0]=4 5684 B8R0.2 CSC(C)C(Cl)C(=O)Cl Amb28352236 [0,2,0,0,0,0|2,0,0]=4 5685 B8R0.2 CSC(C)C(N)C(N)=O Amb30035540 [0,2,0,0,0,0|2,0,0]=4 5686 B8R0.2 CS[C@H](C)[C@H](N)C(=O)O Amb27771288 [0,2,0,0,0,0|1,0,0]=3 5687 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb24117487 [0,2,0,0,0,0|1,0,0]=3 5688 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb27828649 [0,2,0,0,0,0|1,0,0]=3 5689 B8R0.2 C[C@@H](CO)[C@H](N)C(=O)O Amb24117488 [0,2,0,0,0,0|1,0,0]=3 5690 B8R0.2 C[C@H](C(=O)O)[C@@H](O)CN Amb28056248 [0,2,0,0,0,0|1,0,0]=3 5691 B8R0.2 C[C@H](CN)[C@@H](O)C(=O)O Amb27455474 [0,2,0,0,0,0|1,0,0]=3 5692 B8R0.2 C\C=C(/C)C(C)C(=O)O Amb27810548 [0,2,0,0,0,0|0,0,2]=4 5693 B8R0.2 C\C=C(/C)C(N)C(=O)O Amb18642706 [0,2,0,0,0,0|0,0,2]=4 5694 B8R0.2 C\C=C(\Br)C(O)C(=O)O Amb27657537 [0,2,0,0,0,0|0,0,2]=4 5695 B8R0.2 C\C=C(\C)C(C)C(=O)O Amb27626047 [0,2,0,0,0,0|0,0,2]=4 5696 B8R0.2 C\C=C(\C)C(N)C(=O)O Amb27634383 [0,2,0,0,0,0|0,0,2]=4 5697 B8R0.2 C\C=C(\C)[C@H](N)C(=O)O Amb28424373 [0,2,0,0,0,0|0,0,2]=4 5698 B8R0.2 NC(=O)[C@@H](F)[C@@H](O)CO Amb27668286 [0,2,0,0,0,0|2,0,0]=4 5699 B8R0.2 NC(=O)[C@H](O)[C@@H](O)CO Amb27814631 [0,2,0,0,0,0|2,0,0]=4 5700 B8R0.2 NC(C(=O)O)C(F)CO Amb27950986 [0,2,0,0,0,0|1,0,0]=3 5701 B8R0.2 NC(C(=O)O)C(O)CCl Amb27846402 [0,2,0,0,0,0|1,0,0]=3 5702 B8R0.2 NC(C(=O)O)C(O)CF Amb27592597 [0,2,0,0,0,0|1,0,0]=3 5703 B8R0.2 NC(C(=O)O)C(S)CO Amb27199680 [0,2,0,0,0,0|1,0,0]=3 5704 B8R0.2 NC(CO)C(N)C(=O)O Amb28208230 [0,2,0,0,0,0|1,0,0]=3 5705 B8R0.2 NCC(O)C(N)C(=O)O Amb27876292 [0,2,0,0,0,0|1,0,0]=3 5706 B8R0.2 NCC(O)C(O)C(=O)O Amb27830532 [0,2,0,0,0,0|1,0,0]=3 5707 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb27945588 [0,2,0,0,0,0|1,0,0]=3 5708 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb33209939 [0,2,0,0,0,0|1,0,0]=3 5709 B8R0.2 NC[C@@H](O)[C@H](N)C(=O)O Amb30884414 [0,2,0,0,0,0|1,0,0]=3 5710 B8R0.2 NC[C@H](F)[C@H](F)C(=O)O Amb27224824 [0,2,0,0,0,0|1,0,0]=3 5711 B8R0.2 N[C@@H](C(=O)O)C(O)CBr Amb28245344 [0,2,0,0,0,0|1,0,0]=3 5712 B8R0.2 N[C@@H](C(=O)O)C(S)CO Amb27233478 [0,2,0,0,0,0|1,0,0]=3 5713 B8R0.2 N[C@@H](C(=O)O)[C@H](O)CO Amb24671346 [0,2,0,0,0,0|1,0,0]=3 5714 B8R0.2 N[C@H](C(=O)O)C(O)CCl Amb27212707 [0,2,0,0,0,0|1,0,0]=3 5715 B8R0.2 N[C@H](C(=O)O)C(O)CO Amb28255690 [0,2,0,0,0,0|1,0,0]=3 5716 B8R0.2 N[C@H](C(=O)O)[C@@H](O)CO Amb25678241 [0,2,0,0,0,0|1,0,0]=3 5717 B8R0.2 O=C(O)C(=O)C(O)CO Amb27408895 [0,2,0,0,0,0|1,0,1]=4 5718 B8R0.2 O=C(O)C(Br)C(Br)CBr Amb22347644 [0,2,0,0,0,0|1,0,0]=3 5719 B8R0.2 O=C(O)C(O)C(O)CO Amb22495524 [0,2,0,0,0,0|1,0,0]=3 5720 B8R0.2 O=C(O)[C@@H](F)[C@H](O)CO Amb27195151 [0,2,0,0,0,0|1,0,0]=3 5721 B8R0.2 O=C(O)[C@H](O)C(O)CO Amb27229496 [0,2,0,0,0,0|1,0,0]=3 5722 B8R0.2 O=C(O)[C@H](O)[C@@H](O)CO Amb27849401 [0,2,0,0,0,0|1,0,0]=3 5723 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO Amb32644462 [0,2,0,0,0,0|1,0,0]=3 5724 B8R0.2 O=C([O-])C(O)C(O)CO Amb22733096 [0,2,0,0,0,0|1,0,1]=4 5725 B8R0.2 O=C([O-])[C@@H](O)[C@H](O)CO Amb22744783 [0,2,0,0,0,0|1,0,1]=4 5726 B8R0.2 O=C([O-])[C@@H](O)[C@H](O)CO Amb32414707 [0,2,0,0,0,0|1,0,1]=4 5727 B8R0.2 O=CC(O)C(O)C(=O)O Amb18124399 [0,2,0,0,0,0|1,0,1]=4 5728 B8R0.2 O=C[C@H](O)[C@H](O)C(=O)O Amb27266059 [0,2,0,0,0,0|1,0,1]=4 5729 B8R0.5 C#CCC(C)CC(C)=O Amb24707587 [0,2,0,0,0,0|1,0,1]=4 5730 B8R0.5 C#CCC(N)CC(=O)O Amb26909337 [0,2,0,0,0,0|0,0,1]=3 5731 B8R0.5 C#CC[C@@H](N)CC(=O)O Amb22746284 [0,2,0,0,0,0|0,0,1]=3 5732 B8R0.5 C#CC[C@@H](N)CC(=O)O Amb24539924 [0,2,0,0,0,0|0,0,1]=3 5733 B8R0.5 C=C(Br)CC(O)CCC Amb27194656 [0,2,0,0,0,0|2,0,0]=4 5734 B8R0.5 C=C(Br)CN(C)CCC Amb27877357 [0,2,0,0,0,0|2,0,0]=4 5735 B8R0.5 C=C(C)CC(C)CCC Amb22730409 [0,2,0,0,0,0|2,0,0]=4 5736 B8R0.5 C=C(C)CC(C)CCN Amb27210688 [0,2,0,0,0,0|2,0,0]=4 5737 B8R0.5 C=C(C)CC(C)NCC Amb27648467 [0,2,0,0,0,0|2,0,0]=4 5738 B8R0.5 C=C(C)CC(Cl)CCC Amb27842029 [0,2,0,0,0,0|2,0,0]=4 5739 B8R0.5 C=C(C)CC(N)COC Amb27171032 [0,2,0,0,0,0|2,0,0]=4 5740 B8R0.5 C=C(C)CC(N)CSC Amb27794207 [0,2,0,0,0,0|2,0,0]=4 5741 B8R0.5 C=C(C)CC(O)CCC Amb28058869 [0,2,0,0,0,0|2,0,0]=4 5742 B8R0.5 C=C(C)CC(O)CCO Amb28049190 [0,2,0,0,0,0|2,0,0]=4 5743 B8R0.5 C=C(C)CC(O)CSC Amb28313018 [0,2,0,0,0,0|2,0,0]=4 5744 B8R0.5 C=C(C)C[C@@H](O)CCC Amb27217651 [0,2,0,0,0,0|2,0,0]=4 5745 B8R0.5 C=C=CC(C)CC(=O)O Amb27631675 [0,2,0,0,0,0|0,0,2]=4 5746 B8R0.5 C=CCC(C)CC(=O)O Amb18642628 [0,2,0,0,0,0|0,0,1]=3 5747 B8R0.5 C=CCC(C)CC(C)=O Amb17593320 [0,2,0,0,0,0|1,0,1]=4 5748 B8R0.5 C=CCC(N)CC(=O)O Amb22641964 [0,2,0,0,0,0|0,0,1]=3 5749 B8R0.5 C=CCC(N)CC(=O)O Amb31307622 [0,2,0,0,0,0|0,0,1]=3 5750 B8R0.5 C=CCC(O)CC(=O)O Amb18642785 [0,2,0,0,0,0|0,0,1]=3 5751 B8R0.5 C=CCN(C)CC(=O)O Amb9301047 [0,2,0,0,0,0|0,0,2]=4 5752 B8R0.5 C=CC[C@@H](C)CC(C)=O Amb27974516 [0,2,0,0,0,0|1,0,1]=4 5753 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb22746166 [0,2,0,0,0,0|0,0,1]=3 5754 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb2699117 [0,2,0,0,0,0|0,0,1]=3 5755 B8R0.5 C=CC[C@@H](O)CC(=O)O Amb28073530 [0,2,0,0,0,0|0,0,1]=3 5756 B8R0.5 C=CC[C@H](N)CC(=O)O Amb2699116 [0,2,0,0,0,0|0,0,1]=3 5757 B8R0.5 C=CC[C@H](N)CC(=O)O Amb33726074 [0,2,0,0,0,0|0,0,1]=3 5758 B8R0.5 C=CC[C@H](O)CC(=O)O Amb28345940 [0,2,0,0,0,0|0,0,1]=3 5759 B8R0.5 CC(=O)CC(C)CC=O Amb28076874 [0,2,0,0,0,0|1,0,1]=4 5760 B8R0.5 CC(=O)CC(O)CCBr Amb28290412 [0,2,0,0,0,0|1,0,0]=3 5761 B8R0.5 CC(=O)CN(C)CCO Amb10608107 [0,2,0,0,0,0|2,0,0]=4 5762 B8R0.5 CC(=O)C[C@@H](O)CCBr Amb27400290 [0,2,0,0,0,0|1,0,0]=3 5763 B8R0.5 CC(=O)C[C@H](C)CC=O Amb27265839 [0,2,0,0,0,0|1,0,1]=4 5764 B8R0.5 CC(=O)NC(C)CCO Amb27656183 [0,2,0,0,0,0|2,0,0]=4 5765 B8R0.5 CC(=O)N[C@H](C)CCO Amb28454929 [0,2,0,0,0,0|2,0,0]=4 5766 B8R0.5 CC(=O)OC(C)CCCl Amb27801962 [0,2,0,0,0,0|2,0,0]=4 5767 B8R0.5 CC(CC#N)CC(=O)O Amb18642506 [0,2,0,0,0,0|0,0,1]=3 5768 B8R0.5 CC(CC(=O)O)N=C=O Amb33471303 [0,2,0,0,0,0|1,0,1]=4 5769 B8R0.5 CC(CC(=O)O)N=C=S Amb33471532 [0,2,0,0,0,0|1,0,1]=4 5770 B8R0.5 CC(CC(=O)O)NC#N Amb35634497 [0,2,0,0,0,0|1,0,1]=4 5771 B8R0.5 CC(CC(=O)O)NC=O Amb18967805 [0,2,0,0,0,0|1,0,1]=4 5772 B8R0.5 CC(CCF)CC(=O)O Amb24477914 [0,2,0,0,0,0|0,0,0]=2 5773 B8R0.5 CC(CCN)CC(=O)O Amb20667689 [0,2,0,0,0,0|0,0,0]=2 5774 B8R0.5 CC(CCN)CC(=O)O Amb24376646 [0,2,0,0,0,0|0,0,0]=2 5775 B8R0.5 CC(CCN)C[PH](=O)O Amb28250150 [0,2,0,0,0,0|1,0,0]=3 5776 B8R0.5 CC(CCO)CC(=O)O Amb18642882 [0,2,0,0,0,0|0,0,0]=2 5777 B8R0.5 CC(O)CC(C)CCO Amb27970261 [0,2,0,0,0,0|1,0,1]=4 5778 B8R0.5 CC(O)CC(O)CCBr Amb27841515 [0,2,0,0,0,0|1,0,1]=4 5779 B8R0.5 CCCC(=O)CC(C)=O Amb9775079 [0,2,0,0,0,0|1,0,0]=3 5780 B8R0.5 CCCC(=O)CC(N)=O Amb28290969 [0,2,0,0,0,0|1,0,0]=3 5781 B8R0.5 CCCC(Br)CC(C)=O Amb27974270 [0,2,0,0,0,0|1,0,0]=3 5782 B8R0.5 CCCC(C)CC(=N)N Amb25771598 [0,2,0,0,0,0|2,0,0]=4 5783 B8R0.5 CCCC(C)CC(=O)O Amb6749227 [0,2,0,0,0,0|0,0,0]=2 5784 B8R0.5 CCCC(C)CC(C)=O Amb22229841 [0,2,0,0,0,0|1,0,0]=3 5785 B8R0.5 CCCC(C)CC(C)O Amb22229840 [0,2,0,0,0,0|1,0,1]=4 5786 B8R0.5 CCCC(C)CC(N)=O Amb25146057 [0,2,0,0,0,0|1,0,0]=3 5787 B8R0.5 CCCC(C)CC(N)=S Amb26066806 [0,2,0,0,0,0|1,1,0]=4 5788 B8R0.5 CCCC(C)CN(C)O Amb33322352 [0,2,0,0,0,0|2,0,0]=4 5789 B8R0.5 CCCC(C)CS(=O)[O-] Amb32755301 [0,2,0,0,0,0|1,0,1]=4 5790 B8R0.5 CCCC(C)C[C@@H](C)O Amb33321139 [0,2,0,0,0,0|1,0,1]=4 5791 B8R0.5 CCCC(C)C[C@H](C)O Amb33321088 [0,2,0,0,0,0|1,0,1]=4 5792 B8R0.5 CCCC(C)C[N+](=O)[O-] Amb33321122 [0,2,0,0,0,0|1,0,1]=4 5793 B8R0.5 CCCC(C)NC(=O)Cl Amb35637095 [0,2,0,0,0,0|1,0,0]=3 5794 B8R0.5 CCCC(C)NC(N)=S Amb9212106 [0,2,0,0,0,0|1,1,0]=4 5795 B8R0.5 CCCC(C)OC(=O)Cl Amb27205395 [0,2,0,0,0,0|1,0,0]=3 5796 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [0,2,0,0,0,0|1,0,0]=3 5797 B8R0.5 CCCC(C)OC(N)=O Amb27150798 [0,2,0,0,0,0|1,0,0]=3 5798 B8R0.5 CCCC(Cl)OC(C)=O Amb27490997 [0,2,0,0,0,0|1,0,0]=3 5799 B8R0.5 CCCC(N)C=C(C)C Amb28240518 [0,2,0,0,0,0|2,0,0]=4 5800 B8R0.5 CCCC(N)CC(=O)O Amb1993864 [0,2,0,0,0,0|0,0,0]=2 5801 B8R0.5 CCCC(N)CC(C)=O Amb28069229 [0,2,0,0,0,0|1,0,0]=3 5802 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [0,2,0,0,0,0|1,0,0]=3 5803 B8R0.5 CCCC(N)CS(C)=O Amb27475787 [0,2,0,0,0,0|2,0,0]=4 5804 B8R0.5 CCCC(O)CC(=O)O Amb2699832 [0,2,0,0,0,0|0,0,0]=2 5805 B8R0.5 CCCC(O)CC(C)=O Amb17593376 [0,2,0,0,0,0|1,0,0]=3 5806 B8R0.5 CCCC(O)CC(C)O Amb27484551 [0,2,0,0,0,0|1,0,1]=4 5807 B8R0.5 CCCC(O)OS(=O)[O-] Amb28139797 [0,2,0,0,0,0|1,0,1]=4 5808 B8R0.5 CCCC(O)SC(C)=O Amb27807055 [0,2,0,0,0,0|1,0,0]=3 5809 B8R0.5 CCCN(C)CC(=O)O Amb19373314 [0,2,0,0,0,0|0,0,0]=2 5810 B8R0.5 CCCN(C)CC(=O)O Amb8899167 [0,2,0,0,0,0|0,0,0]=2 5811 B8R0.5 CCCN(C)CC(C)O Amb17334132 [0,2,0,0,0,0|1,0,1]=4 5812 B8R0.5 CCCN(O)CC(=O)O Amb27850231 [0,2,0,0,0,0|0,0,0]=2 5813 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [0,2,0,0,0,0|0,0,0]=2 5814 B8R0.5 CCCS(=O)CC(C)=O Amb27180126 [0,2,0,0,0,0|1,0,0]=3 5815 B8R0.5 CCC[C@@H](N)CC(=O)O Amb22225223 [0,2,0,0,0,0|0,0,0]=2 5816 B8R0.5 CCC[C@@H](N)CC(=O)O Amb24739278 [0,2,0,0,0,0|0,0,0]=2 5817 B8R0.5 CCC[C@@H](O)CC(=O)O Amb25188904 [0,2,0,0,0,0|0,0,0]=2 5818 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [0,2,0,0,0,0|1,0,0]=3 5819 B8R0.5 CCC[C@H](C)CC(=O)O Amb10844381 [0,2,0,0,0,0|0,0,0]=2 5820 B8R0.5 CCC[C@H](C)NC(C)=O Amb27655527 [0,2,0,0,0,0|1,0,0]=3 5821 B8R0.5 CCC[C@H](N)CC(=O)O Amb22226359 [0,2,0,0,0,0|0,0,0]=2 5822 B8R0.5 CCC[C@H](N)CC(=O)O Amb27464904 [0,2,0,0,0,0|0,0,0]=2 5823 B8R0.5 CCC[C@H](O)CC(=O)O Amb25367955 [0,2,0,0,0,0|0,0,0]=2 5824 B8R0.5 CCC[C@H](O)C[C@H](C)O Amb27653094 [0,2,0,0,0,0|1,0,1]=4 5825 B8R0.5 CCC[C@H](S)C[C@H](C)O Amb28049110 [0,2,0,0,0,0|1,0,1]=4 5826 B8R0.5 CCC\C(C)=C\C(=O)O Amb33528454 [0,2,0,0,0,0|0,0,1]=3 5827 B8R0.5 CCC\C(C)=C\C(C)=O Amb28289440 [0,2,0,0,0,0|1,0,1]=4 5828 B8R0.5 CCC\C(C)=C\C(N)=O Amb27799064 [0,2,0,0,0,0|1,0,1]=4 5829 B8R0.5 CCC\C(N)=C\C(N)=O Amb27620335 [0,2,0,0,0,0|1,0,1]=4 5830 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,2,0,0,0,0|0,0,1]=3 5831 B8R0.5 CCNC(=O)CC(C)=O Amb6254356 [0,2,0,0,0,0|1,0,1]=4 5832 B8R0.5 CCNC(=O)CC(N)=O Amb28058296 [0,2,0,0,0,0|1,0,1]=4 5833 B8R0.5 CCNC(C)CC(=O)O Amb13952759 [0,2,0,0,0,0|0,0,0]=2 5834 B8R0.5 CCNC(C)CC(=O)O Amb9398369 [0,2,0,0,0,0|0,0,0]=2 5835 B8R0.5 CCNC(C)CC(N)=O Amb17231866 [0,2,0,0,0,0|1,0,0]=3 5836 B8R0.5 CCOC(=N)CC(=O)O Amb26612803 [0,2,0,0,0,0|0,0,1]=3 5837 B8R0.5 CCOC(=N)CC(N)=O Amb26328004 [0,2,0,0,0,0|1,0,1]=4 5838 B8R0.5 CCOC(=O)CC(=O)Cl Amb3939375 [0,2,0,0,0,0|1,0,1]=4 5839 B8R0.5 CCOC(=O)CC(=O)O Amb22492654 [0,2,0,0,0,0|0,0,1]=3 5840 B8R0.5 CCOC(=O)CC(=O)O Amb3939916 [0,2,0,0,0,0|0,0,1]=3 5841 B8R0.5 CCOC(=O)CC(=O)[O-] Amb2221978 [0,2,0,0,0,0|0,0,2]=4 5842 B8R0.5 CCOC(=O)CC(C)=O Amb2793050 [0,2,0,0,0,0|1,0,1]=4 5843 B8R0.5 CCOC(=O)CC(N)=O Amb8390795 [0,2,0,0,0,0|1,0,1]=4 5844 B8R0.5 CCOC(=O)CS(=O)O Amb27452527 [0,2,0,0,0,0|1,0,1]=4 5845 B8R0.5 CCOC(C)CC(=N)N Amb33424963 [0,2,0,0,0,0|2,0,0]=4 5846 B8R0.5 CCOC(C)CC(=O)O Amb9397849 [0,2,0,0,0,0|0,0,0]=2 5847 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [0,2,0,0,0,0|1,0,0]=3 5848 B8R0.5 CCOC(C)CC(C)O Amb26629604 [0,2,0,0,0,0|1,0,1]=4 5849 B8R0.5 CCOC(C)CC(N)=S Amb33424942 [0,2,0,0,0,0|1,1,0]=4 5850 B8R0.5 CCOC(C)CN(C)O Amb33425716 [0,2,0,0,0,0|2,0,0]=4 5851 B8R0.5 CCOC(C)C[C@@H](C)O Amb33425062 [0,2,0,0,0,0|1,0,1]=4 5852 B8R0.5 CCOC(C)C[C@H](C)O Amb33225080 [0,2,0,0,0,0|1,0,1]=4 5853 B8R0.5 CCOC(C)C[N+](=O)[O-] Amb33425047 [0,2,0,0,0,0|1,0,1]=4 5854 B8R0.5 CCOC(C)OC(C)=O Amb17689197 [0,2,0,0,0,0|2,0,0]=4 5855 B8R0.5 CCOC(Cl)CS(=O)Cl Amb27591703 [0,2,0,0,0,0|2,0,0]=4 5856 B8R0.5 CCOC(Cl)OC(C)=O Amb28145161 [0,2,0,0,0,0|2,0,0]=4 5857 B8R0.5 CCO[C@@H](C)CC(C)=O Amb27424691 [0,2,0,0,0,0|1,0,0]=3 5858 B8R0.5 CCO[C@@H](C)C[C@@H](C)O Amb27481375 [0,2,0,0,0,0|1,0,1]=4 5859 B8R0.5 CCO[C@@H](C)C[C@H](C)O Amb27424949 [0,2,0,0,0,0|1,0,1]=4 5860 B8R0.5 CCO[C@H](O)CC(C)=O Amb27838621 [0,2,0,0,0,0|1,0,0]=3 5861 B8R0.5 CCO\C(N)=C\C(=O)O Amb28285256 [0,2,0,0,0,0|0,0,2]=4 5862 B8R0.5 CCSC(=O)CC(=O)O Amb27406351 [0,2,0,0,0,0|0,0,1]=3 5863 B8R0.5 CCSC(=O)CC(C)=O Amb27234619 [0,2,0,0,0,0|1,0,1]=4 5864 B8R0.5 CCSC(=S)CC(C)=O Amb27838746 [0,2,0,0,0,0|1,0,1]=4 5865 B8R0.5 CCSC(C)CC(=O)O Amb9398136 [0,2,0,0,0,0|0,0,0]=2 5866 B8R0.5 CC\C=C(/Br)CC(=O)O Amb28208655 [0,2,0,0,0,0|0,0,1]=3 5867 B8R0.5 CC\C=C(\C)CC(N)=O Amb27771837 [0,2,0,0,0,0|1,0,1]=4 5868 B8R0.5 CC\N=C(/C)CC(C)=O Amb28052216 [0,2,0,0,0,0|1,0,1]=4 5869 B8R0.5 CN(CC#N)CC(=O)O Amb9301061 [0,2,0,0,0,0|1,0,1]=4 5870 B8R0.5 CN(CCF)CC(N)=O Amb27254943 [0,2,0,0,0,0|2,0,0]=4 5871 B8R0.5 CN(CCN)CC(=O)O Amb18313585 [0,2,0,0,0,0|1,0,0]=3 5872 B8R0.5 CN(CCN)CC(=O)O Amb32701580 [0,2,0,0,0,0|1,0,0]=3 5873 B8R0.5 CN(CCO)CC(=O)O Amb5767486 [0,2,0,0,0,0|1,0,0]=3 5874 B8R0.5 CNCC(C)CC(C)O Amb27786755 [0,2,0,0,0,0|1,0,1]=4 5875 B8R0.5 CNCC(C)OC(N)=O Amb28078033 [0,2,0,0,0,0|2,0,0]=4 5876 B8R0.5 CNCC(O)CC(=O)O Amb28423259 [0,2,0,0,0,0|0,0,0]=2 5877 B8R0.5 CNCC(O)CC(=O)O Amb32661843 [0,2,0,0,0,0|0,0,0]=2 5878 B8R0.5 CNCC(O)CS(C)=O Amb27477065 [0,2,0,0,0,0|2,0,0]=4 5879 B8R0.5 CNC[C@H](N)CC(=O)O Amb27798881 [0,2,0,0,0,0|0,0,0]=2 5880 B8R0.5 COCC(=O)CC(=O)O Amb24093174 [0,2,0,0,0,0|0,0,1]=3 5881 B8R0.5 COCC(=O)CC(C)=O Amb15701314 [0,2,0,0,0,0|1,0,1]=4 5882 B8R0.5 COCC(C)CC(=O)O Amb19024342 [0,2,0,0,0,0|0,0,0]=2 5883 B8R0.5 COCC(C)CC(C)=O Amb27464321 [0,2,0,0,0,0|1,0,0]=3 5884 B8R0.5 COCC(C)CC(C)O Amb27796096 [0,2,0,0,0,0|1,0,1]=4 5885 B8R0.5 COCC(C)CC(N)=O Amb27860801 [0,2,0,0,0,0|1,0,0]=3 5886 B8R0.5 COCC(C)CS(=O)Cl Amb32720532 [0,2,0,0,0,0|2,0,0]=4 5887 B8R0.5 COCC(C)CS(=O)[O-] Amb32754752 [0,2,0,0,0,0|1,0,1]=4 5888 B8R0.5 COCC(C)CS(N)=O Amb32720533 [0,2,0,0,0,0|2,0,0]=4 5889 B8R0.5 COCC(C)NC(=O)Cl Amb35637106 [0,2,0,0,0,0|2,0,0]=4 5890 B8R0.5 COCC(C)NC(N)=O Amb405922 [0,2,0,0,0,0|2,0,0]=4 5891 B8R0.5 COCC(C)OC(=O)Cl Amb27395128 [0,2,0,0,0,0|2,0,0]=4 5892 B8R0.5 COCC(C)OC(C)=O Amb8516695 [0,2,0,0,0,0|2,0,0]=4 5893 B8R0.5 COCC(C)OC(N)=O Amb24645730 [0,2,0,0,0,0|2,0,0]=4 5894 B8R0.5 COCC(N)CC(=O)O Amb26641146 [0,2,0,0,0,0|0,0,0]=2 5895 B8R0.5 COCC(N)CC(C)O Amb27433240 [0,2,0,0,0,0|1,0,1]=4 5896 B8R0.5 COCC(N)CC(N)=O Amb33308419 [0,2,0,0,0,0|1,0,0]=3 5897 B8R0.5 COCC(O)CC(=N)N Amb24665644 [0,2,0,0,0,0|2,0,0]=4 5898 B8R0.5 COCC(O)CC(=O)O Amb18832518 [0,2,0,0,0,0|0,0,0]=2 5899 B8R0.5 COCC(O)CC(N)=S Amb27657699 [0,2,0,0,0,0|1,1,0]=4 5900 B8R0.5 COC[C@@H](C)OC(C)=O Amb27460270 [0,2,0,0,0,0|2,0,0]=4 5901 B8R0.5 COC[C@@H](O)CC(=O)O Amb33428853 [0,2,0,0,0,0|0,0,0]=2 5902 B8R0.5 COC[C@H](N)CC(=O)O Amb33038388 [0,2,0,0,0,0|0,0,0]=2 5903 B8R0.5 COC[C@H](N)CC(=O)O Amb33330661 [0,2,0,0,0,0|0,0,0]=2 5904 B8R0.5 COC[C@H](O)CC(=O)O Amb33428852 [0,2,0,0,0,0|0,0,0]=2 5905 B8R0.5 COC\C(C)=C\C(=O)O Amb25311787 [0,2,0,0,0,0|0,0,2]=4 5906 B8R0.5 CONC(C)CC(=O)O Amb26844930 [0,2,0,0,0,0|1,0,0]=3 5907 B8R0.5 CO\C=C(\C)CC(=O)O Amb27410916 [0,2,0,0,0,0|0,0,2]=4 5908 B8R0.5 CPCC(N)CC(=O)O Amb27184896 [0,2,0,0,0,0|0,0,0]=2 5909 B8R0.5 CSCC(C)CC(=O)O Amb33273729 [0,2,0,0,0,0|0,0,0]=2 5910 B8R0.5 CSCC(C)NC(=O)Cl Amb35633391 [0,2,0,0,0,0|2,0,0]=4 5911 B8R0.5 CSCC(C)OC(C)=O Amb24450062 [0,2,0,0,0,0|2,0,0]=4 5912 B8R0.5 CSCC(N)CC(=O)O Amb25960719 [0,2,0,0,0,0|0,0,0]=2 5913 B8R0.5 CSCC(O)CC(=O)O Amb24621046 [0,2,0,0,0,0|0,0,0]=2 5914 B8R0.5 CSC[C@@H](N)CC(=O)O Amb27961000 [0,2,0,0,0,0|0,0,0]=2 5915 B8R0.5 CSC[C@@H](O)CC(=O)O Amb33271747 [0,2,0,0,0,0|0,0,0]=2 5916 B8R0.5 CSC[C@H](O)CC(=O)O Amb33271746 [0,2,0,0,0,0|0,0,0]=2 5917 B8R0.5 C[C@@H](CC(=O)O)N=[N+]=[N-] Amb27657105 [0,2,0,0,0,0|2,0,0]=4 5918 B8R0.5 C[C@@H](O)C[C@H](C)CCO Amb27766934 [0,2,0,0,0,0|1,0,1]=4 5919 B8R0.5 C[C@H](CC(=O)O)N=C=O Amb33471360 [0,2,0,0,0,0|1,0,1]=4 5920 B8R0.5 C[C@H](CC(=O)O)N=C=S Amb33471590 [0,2,0,0,0,0|1,0,1]=4 5921 B8R0.5 C[C@H](CCO)CC(=O)O Amb27461411 [0,2,0,0,0,0|0,0,0]=2 5922 B8R0.5 C[C@H](O)C[C@@H](C)CCO Amb27598607 [0,2,0,0,0,0|1,0,1]=4 5923 B8R0.5 C[C@H](O)C[C@H](O)CCBr Amb27983593 [0,2,0,0,0,0|1,0,1]=4 5924 B8R0.5 C\C(=C\C(=O)O)CCS Amb28345950 [0,2,0,0,0,0|0,0,2]=4 5925 B8R0.5 C\C=C\C(Cl)CC(=O)Cl Amb27407059 [0,2,0,0,0,0|1,0,1]=4 5926 B8R0.5 C\C=C\C(N)CC(=O)O Amb25975538 [0,2,0,0,0,0|0,0,1]=3 5927 B8R0.5 C\C=C\C(N)CC(N)=O Amb24599388 [0,2,0,0,0,0|1,0,1]=4 5928 B8R0.5 C\C=C\C(O)CC(=O)O Amb8398291 [0,2,0,0,0,0|0,0,1]=3 5929 B8R0.5 C\C=C\[C@@H](C)CC(C)=O Amb27598952 [0,2,0,0,0,0|1,0,1]=4 5930 B8R0.5 C\C=C\[C@H](C)CC(=O)O Amb28047718 [0,2,0,0,0,0|0,0,1]=3 5931 B8R0.5 C\C=C\[C@H](C)CC(C)=O Amb28246522 [0,2,0,0,0,0|1,0,1]=4 5932 B8R0.5 N#CCC(O)CC(=O)O Amb27249794 [0,2,0,0,0,0|0,0,1]=3 5933 B8R0.5 N#CCC(O)CC(N)=O Amb27259184 [0,2,0,0,0,0|1,0,1]=4 5934 B8R0.5 N#CCS(=O)CC(=O)O Amb18984975 [0,2,0,0,0,0|1,0,1]=4 5935 B8R0.5 N#CC[C@@H](O)CC(N)=O Amb22225367 [0,2,0,0,0,0|1,0,1]=4 5936 B8R0.5 N#CC[C@H](O)CC(N)=O Amb22226710 [0,2,0,0,0,0|1,0,1]=4 5937 B8R0.5 NC(CCF)CC(=O)O Amb33038391 [0,2,0,0,0,0|0,0,0]=2 5938 B8R0.5 NCCC(N)CC(=O)O Amb26043872 [0,2,0,0,0,0|0,0,0]=2 5939 B8R0.5 NCCC(O)CC(=O)O Amb27882021 [0,2,0,0,0,0|0,0,0]=2 5940 B8R0.5 NCCC(O)CC(=O)O Amb31031000 [0,2,0,0,0,0|0,0,0]=2 5941 B8R0.5 NCCS(=O)CC(N)=O Amb28456172 [0,2,0,0,0,0|2,0,0]=4 5942 B8R0.5 NCC[C@H](N)CC(=O)O Amb10067021 [0,2,0,0,0,0|0,0,0]=2 5943 B8R0.5 NCC[C@H](N)CC(=O)O Amb35750363 [0,2,0,0,0,0|0,0,0]=2 5944 B8R0.5 N[C@H](CCO)CC(=O)O Amb27169169 [0,2,0,0,0,0|0,0,0]=2 5945 B8R0.5 O=C(O)CC(O)CCF Amb33196428 [0,2,0,0,0,0|0,0,0]=2 5946 B8R0.5 O=C(O)CC(O)CCO Amb31031042 [0,2,0,0,0,0|0,0,0]=2 5947 B8R0.5 O=C(O)CC(O)CNO Amb28044304 [0,2,0,0,0,0|1,0,0]=3 5948 B8R0.5 O=C(O)C[C@@H](O)CCF Amb33196426 [0,2,0,0,0,0|0,0,0]=2 5949 B8R0.5 O=C(O)C[C@H](O)CCF Amb33196427 [0,2,0,0,0,0|0,0,0]=2 5950 B8R0.5 O=C(O)\C=C(/Cl)CCO Amb27845284 [0,2,0,0,0,0|0,0,2]=4 5951 B8R0.16 C#CC(C#N)CC(=O)O Amb28144249 [0,2,0,0,0,0|0,0,2]=4 5952 B8R0.16 C#CC(CC)NC(N)=O Amb28074397 [0,2,0,0,0,0|2,0,0]=4 5953 B8R0.16 C#CC(CC)OC(C)=O Amb27837591 [0,2,0,0,0,0|2,0,0]=4 5954 B8R0.16 C=C(C)CC(CC)CBr Amb32688070 [0,2,0,0,0,0|2,0,0]=4 5955 B8R0.16 C=C(C)CC(CC)CCl Amb32688067 [0,2,0,0,0,0|2,0,0]=4 5956 B8R0.16 C=C(C)CC(CC)NC Amb27468504 [0,2,0,0,0,0|2,0,0]=4 5957 B8R0.16 C=C(Cl)CC(CC)CBr Amb32688078 [0,2,0,0,0,0|2,0,0]=4 5958 B8R0.16 C=C(Cl)CC(CC)CCl Amb32688075 [0,2,0,0,0,0|2,0,0]=4 5959 B8R0.16 C=CC(C=C)CC(=O)O Amb18642422 [0,2,0,0,0,0|0,0,2]=4 5960 B8R0.16 C=CC(CC(C)=O)OC Amb26556400 [0,2,0,0,0,0|2,0,0]=4 5961 B8R0.16 C=CC(CC)CC(=O)O Amb18642661 [0,2,0,0,0,0|0,0,0]=2 5962 B8R0.16 C=CC(CC)OC(C)=O Amb24325174 [0,2,0,0,0,0|2,0,0]=4 5963 B8R0.16 C=C[C@@H](CC)CC(=O)O Amb27784737 [0,2,0,0,0,0|0,0,0]=2 5964 B8R0.16 C=C\C(=C/C(=O)O)CC Amb28058156 [0,2,0,0,0,0|0,0,2]=4 5965 B8R0.16 CCC(=CC(=O)O)CC Amb6749110 [0,2,0,0,0,0|0,0,2]=4 5966 B8R0.16 CCC(C#N)CC(=O)O Amb26871850 [0,2,0,0,0,0|0,0,0]=2 5967 B8R0.16 CCC(C#N)NC(C)=O Amb27837460 [0,2,0,0,0,0|2,0,0]=4 5968 B8R0.16 CCC(C#N)OC(C)=O Amb24593580 [0,2,0,0,0,0|2,0,0]=4 5969 B8R0.16 CCC(C=O)CC(C)=O Amb18642641 [0,2,0,0,0,0|1,0,0]=3 5970 B8R0.16 CCC(CBr)OC(C)=O Amb27945591 [0,2,0,0,0,0|2,0,0]=4 5971 B8R0.16 CCC(CC(=N)N)OC Amb9029652 [0,2,0,0,0,0|2,0,0]=4 5972 B8R0.16 CCC(CC(=O)O)OC Amb19037306 [0,2,0,0,0,0|0,0,0]=2 5973 B8R0.16 CCC(CC(=O)O)SC Amb18316304 [0,2,0,0,0,0|0,0,0]=2 5974 B8R0.16 CCC(CC(C)=O)OC Amb25053006 [0,2,0,0,0,0|1,0,0]=3 5975 B8R0.16 CCC(CC(C)O)OC Amb33326096 [0,2,0,0,0,0|1,0,1]=4 5976 B8R0.16 CCC(CC(N)=O)NC Amb27666636 [0,2,0,0,0,0|1,0,0]=3 5977 B8R0.16 CCC(CC(N)=O)OC Amb2611703 [0,2,0,0,0,0|1,0,0]=3 5978 B8R0.16 CCC(CC(N)=O)SC Amb27809399 [0,2,0,0,0,0|1,0,0]=3 5979 B8R0.16 CCC(CC(N)=S)OC Amb9029616 [0,2,0,0,0,0|1,1,0]=4 5980 B8R0.16 CCC(CC)CB(O)O Amb24360547 [0,2,0,0,0,0|1,0,1]=4 5981 B8R0.16 CCC(CC)CC(=N)N Amb25213951 [0,2,0,0,0,0|2,0,0]=4 5982 B8R0.16 CCC(CC)CC(=O)O Amb6749211 [0,2,0,0,0,0|0,0,0]=2 5983 B8R0.16 CCC(CC)CC(C)=O Amb25791160 [0,2,0,0,0,0|1,0,0]=3 5984 B8R0.16 CCC(CC)CC(C)O Amb27868247 [0,2,0,0,0,0|1,0,1]=4 5985 B8R0.16 CCC(CC)CC(N)=O Amb28072905 [0,2,0,0,0,0|1,0,0]=3 5986 B8R0.16 CCC(CC)CC(N)=S Amb24642789 [0,2,0,0,0,0|1,1,0]=4 5987 B8R0.16 CCC(CC)CN(C)O Amb33313813 [0,2,0,0,0,0|2,0,0]=4 5988 B8R0.16 CCC(CC)CS(=O)[O-] Amb32754097 [0,2,0,0,0,0|1,0,1]=4 5989 B8R0.16 CCC(CC)C[C@@H](C)O Amb26502185 [0,2,0,0,0,0|1,0,1]=4 5990 B8R0.16 CCC(CC)C[C@H](C)O Amb33313773 [0,2,0,0,0,0|1,0,1]=4 5991 B8R0.16 CCC(CC)C[N+](=O)[O-] Amb25174023 [0,2,0,0,0,0|1,0,1]=4 5992 B8R0.16 CCC(CC)NC(=O)Cl Amb35637078 [0,2,0,0,0,0|2,0,0]=4 5993 B8R0.16 CCC(CC)NC(C)=O Amb3886548 [0,2,0,0,0,0|2,0,0]=4 5994 B8R0.16 CCC(CC)NC(N)=O Amb1138537 [0,2,0,0,0,0|2,0,0]=4 5995 B8R0.16 CCC(CC)OC(=O)Cl Amb26860668 [0,2,0,0,0,0|2,0,0]=4 5996 B8R0.16 CCC(CC)OC(C)=O Amb24617396 [0,2,0,0,0,0|2,0,0]=4 5997 B8R0.16 CCC(CN(C)O)OC Amb33320153 [0,2,0,0,0,0|2,0,0]=4 5998 B8R0.16 CCC(CN)CC(=O)O Amb20669457 [0,2,0,0,0,0|0,0,0]=2 5999 B8R0.16 CCC(CN)CC(=O)O Amb22059482 [0,2,0,0,0,0|0,0,0]=2 6000 B8R0.16 CCC(CN)NC(C)=O Amb18112590 [0,2,0,0,0,0|2,0,0]=4 6001 B8R0.16 CCC(CN)NC(N)=O Amb18908302 [0,2,0,0,0,0|2,0,0]=4 6002 B8R0.16 CCC(CO)CC(C)O Amb27260248 [0,2,0,0,0,0|1,0,1]=4 6003 B8R0.16 CCC(CS(=O)Cl)OC Amb32720785 [0,2,0,0,0,0|2,0,0]=4 6004 B8R0.16 CCC(CS(=O)[O-])OC Amb32755240 [0,2,0,0,0,0|1,0,1]=4 6005 B8R0.16 CCC(CS(C)=O)NC Amb27461011 [0,2,0,0,0,0|2,0,0]=4 6006 B8R0.16 CCC(CS(N)=O)OC Amb32720787 [0,2,0,0,0,0|2,0,0]=4 6007 B8R0.16 CCC(C[C@@H](C)O)OC Amb33325777 [0,2,0,0,0,0|1,0,1]=4 6008 B8R0.16 CCC(C[C@H](C)O)OC Amb33325778 [0,2,0,0,0,0|1,0,1]=4 6009 B8R0.16 CCC(C[N+](=O)[O-])OC Amb33325772 [0,2,0,0,0,0|1,0,1]=4 6010 B8R0.16 CCC(OC)OC(C)=O Amb28133007 [0,2,0,0,0,0|2,0,0]=4 6011 B8R0.16 CCN(C#N)CC(=O)O Amb35634503 [0,2,0,0,0,0|1,0,0]=3 6012 B8R0.16 CCN(C=O)CC(=O)O Amb18972736 [0,2,0,0,0,0|1,0,0]=3 6013 B8R0.16 CCN(C=O)CC(N)=O Amb27593321 [0,2,0,0,0,0|2,0,0]=4 6014 B8R0.16 CCN(CC(N)=O)N=O Amb27173174 [0,2,0,0,0,0|2,0,0]=4 6015 B8R0.16 CCN(CC)CC(=O)O Amb19258254 [0,2,0,0,0,0|1,0,0]=3 6016 B8R0.16 CCN(CC)CC(=O)O Amb2721806 [0,2,0,0,0,0|1,0,0]=3 6017 B8R0.16 CCN(CC)CC(=O)[O-] Amb22732183 [0,2,0,0,0,0|1,0,1]=4 6018 B8R0.16 CCN(CC)CC(N)=O Amb7101625 [0,2,0,0,0,0|2,0,0]=4 6019 B8R0.16 CCP(CC)CC(C)=O Amb27631555 [0,2,0,0,0,0|2,0,0]=4 6020 B8R0.16 CC[C@@H](C#N)NC(C)=O Amb27450708 [0,2,0,0,0,0|2,0,0]=4 6021 B8R0.16 CC[C@@H](CO)NC(C)=O Amb27251985 [0,2,0,0,0,0|2,0,0]=4 6022 B8R0.16 CC[C@@H](CO)OC(C)=O Amb27879395 [0,2,0,0,0,0|2,0,0]=4 6023 B8R0.16 CC[C@H](C=O)CC(=O)[O-] Amb28198369 [0,2,0,0,0,0|0,0,1]=3 6024 B8R0.16 CC[C@H](CBr)OC(C)=O Amb27771714 [0,2,0,0,0,0|2,0,0]=4 6025 B8R0.16 CC\[N+](CC(=O)O)=N\[O-] Amb25365958 [0,2,0,0,0,0|1,0,0]=3 6026 B8R0.16 CNC(C#N)CC(N)=O Amb28046414 [0,2,0,0,0,0|2,0,0]=4 6027 B8R0.16 CNC(CN)CC(N)=O Amb28247281 [0,2,0,0,0,0|2,0,0]=4 6028 B8R0.16 COC(CC(=O)O)OC Amb22231899 [0,2,0,0,0,0|1,0,0]=3 6029 B8R0.16 COC(CC(C)=O)OC Amb6608687 [0,2,0,0,0,0|2,0,0]=4 6030 B8R0.16 COC(CC(N)=O)OC Amb2417314 [0,2,0,0,0,0|2,0,0]=4 6031 B8R0.16 COC(CCl)CC(C)=O Amb28364308 [0,2,0,0,0,0|2,0,0]=4 6032 B8R0.16 COC(CN)CC(=O)O Amb27806172 [0,2,0,0,0,0|1,0,0]=3 6033 B8R0.16 COC(CN)CC(=O)O Amb28555397 [0,2,0,0,0,0|1,0,0]=3 6034 B8R0.16 COC(CN)CC(N)=O Amb28189645 [0,2,0,0,0,0|2,0,0]=4 6035 B8R0.16 COC(CN)CC(N)=O Amb32952894 [0,2,0,0,0,0|2,0,0]=4 6036 B8R0.16 CSC(CC(=O)O)SC Amb27165674 [0,2,0,0,0,0|1,0,0]=3 6037 B8R0.16 CSC(CCl)CC(=O)O Amb28042698 [0,2,0,0,0,0|1,0,0]=3 6038 B8R0.16 C\C=C(/CC)CC(=O)O Amb27473412 [0,2,0,0,0,0|0,0,1]=3 6039 B8R0.16 C\C=C(/CC)CC(N)=O Amb27830307 [0,2,0,0,0,0|1,0,1]=4 6040 B8R0.16 NCC(CF)CC(=O)O Amb27244579 [0,2,0,0,0,0|1,0,0]=3 6041 B8R0.16 NCC(CO)CC(=O)O Amb22546422 [0,2,0,0,0,0|1,0,0]=3 6042 B8R0.16 NC\C(=C/F)CC(=O)O Amb27960296 [0,2,0,0,0,0|1,0,1]=4 6043 B8R0.16 O=C(Cl)CC(CF)CCl Amb27955884 [0,2,0,0,0,0|2,0,0]=4 6044 B8R0.16 O=C(Cl)C[C@@H](CF)CCl Amb27478061 [0,2,0,0,0,0|2,0,0]=4 6045 B8R0.16 O=C(O)CC(CF)CF Amb27448541 [0,2,0,0,0,0|1,0,0]=3 6046 B8R0.16 O=C(O)CC(CO)CCl Amb27468690 [0,2,0,0,0,0|1,0,0]=3 6047 B8R0.16 O=C(O)CN(CO)CO Amb27412887 [0,2,0,0,0,0|2,0,0]=4 6048 B8R0.19 C#CC(=O)NC(C)CC Amb27423996 [0,2,0,0,0,0|2,0,0]=4 6049 B8R0.19 C#CC(O)CC(=O)OC Amb28078873 [0,2,0,0,0,0|0,0,2]=4 6050 B8R0.19 C#CC(O)CC(C)CC Amb27870666 [0,2,0,0,0,0|1,0,1]=4 6051 B8R0.19 C#CC(O)CC(N)CC Amb35740452 [0,2,0,0,0,0|1,0,1]=4 6052 B8R0.19 C#C[C@@H](N)CC(=O)OC Amb27393788 [0,2,0,0,0,0|0,0,2]=4 6053 B8R0.19 C=C(C#N)CC(O)CC Amb27602533 [0,2,0,0,0,0|2,0,0]=4 6054 B8R0.19 C=C(CBr)CC(=O)OC Amb28076120 [0,2,0,0,0,0|1,0,1]=4 6055 B8R0.19 C=C(CCl)CC(=O)OC Amb24053257 [0,2,0,0,0,0|1,0,1]=4 6056 B8R0.19 C=C(CO)CC(=O)OC Amb28455395 [0,2,0,0,0,0|1,0,1]=4 6057 B8R0.19 C=C(CO)SC(C)CC Amb28315517 [0,2,0,0,0,0|2,0,0]=4 6058 B8R0.19 C=CC(=O)C[C@@H](C)CC Amb27838707 [0,2,0,0,0,0|1,0,0]=3 6059 B8R0.19 C=CC(=O)OC(C)CC Amb22733882 [0,2,0,0,0,0|2,0,0]=4 6060 B8R0.19 CC(CN)CC(=O)NO Amb27395401 [0,2,0,0,0,0|1,0,0]=3 6061 B8R0.19 CC(CO)NC(=O)CO Amb27652814 [0,2,0,0,0,0|2,0,0]=4 6062 B8R0.19 CCC(=O)CC(=O)CC Amb2688649 [0,2,0,0,0,0|1,0,1]=4 6063 B8R0.19 CCC(=O)CC(=O)OC Amb2691582 [0,2,0,0,0,0|0,0,1]=3 6064 B8R0.19 CCC(=O)CC(C)CC Amb9702836 [0,2,0,0,0,0|1,0,0]=3 6065 B8R0.19 CCC(=O)CC(O)CC Amb28144079 [0,2,0,0,0,0|1,0,0]=3 6066 B8R0.19 CCC(=O)CN(C)CC Amb27837485 [0,2,0,0,0,0|2,0,0]=4 6067 B8R0.19 CCC(=O)C[C@H](O)OC Amb27838622 [0,2,0,0,0,0|2,0,0]=4 6068 B8R0.19 CCC(=O)NC(=O)OC Amb27845509 [0,2,0,0,0,0|1,0,1]=4 6069 B8R0.19 CCC(=O)OC(Cl)CC Amb27392331 [0,2,0,0,0,0|2,0,0]=4 6070 B8R0.19 CCC(=O)OC(O)CC Amb28206135 [0,2,0,0,0,0|2,0,0]=4 6071 B8R0.19 CCC(Br)CC(=O)OC Amb27477901 [0,2,0,0,0,0|0,0,0]=2 6072 B8R0.19 CCC(C)CC(=N)NC Amb35670868 [0,2,0,0,0,0|2,0,0]=4 6073 B8R0.19 CCC(C)CC(=O)CCl Amb22395327 [0,2,0,0,0,0|1,0,0]=3 6074 B8R0.19 CCC(C)CC(=O)CO Amb26515791 [0,2,0,0,0,0|0,0,0]=2 6075 B8R0.19 CCC(C)CC(=O)NO Amb28321295 [0,2,0,0,0,0|0,0,0]=2 6076 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [0,2,0,0,0,0|0,0,0]=2 6077 B8R0.19 CCC(C)CC(C)CO Amb24574609 [0,2,0,0,0,0|1,0,1]=4 6078 B8R0.19 CCC(C)CC(N)CO Amb24721873 [0,2,0,0,0,0|1,0,1]=4 6079 B8R0.19 CCC(C)CC(N)CO Amb28960291 [0,2,0,0,0,0|1,0,1]=4 6080 B8R0.19 CCC(C)CC(O)CN Amb25044040 [0,2,0,0,0,0|1,0,1]=4 6081 B8R0.19 CCC(C)C[C@@H](C)CO Amb33736426 [0,2,0,0,0,0|1,0,1]=4 6082 B8R0.19 CCC(C)C[C@H](C)CO Amb26516131 [0,2,0,0,0,0|1,0,1]=4 6083 B8R0.19 CCC(C)C\C(N)=N\N Amb27652257 [0,2,0,0,0,0|2,0,0]=4 6084 B8R0.19 CCC(C)C\C(N)=N\O Amb24415677 [0,2,0,0,0,0|1,0,0]=3 6085 B8R0.19 CCC(C)NC(=O)CBr Amb17331628 [0,2,0,0,0,0|2,0,0]=4 6086 B8R0.19 CCC(C)NC(=O)CCl Amb1149867 [0,2,0,0,0,0|2,0,0]=4 6087 B8R0.19 CCC(C)NC(=O)CF Amb28049930 [0,2,0,0,0,0|2,0,0]=4 6088 B8R0.19 CCC(C)NC(=O)CO Amb5798172 [0,2,0,0,0,0|1,0,0]=3 6089 B8R0.19 CCC(C)NC(=O)NC Amb3538405 [0,2,0,0,0,0|2,0,0]=4 6090 B8R0.19 CCC(C)OC(=O)CBr Amb28126234 [0,2,0,0,0,0|2,0,0]=4 6091 B8R0.19 CCC(C)OC(=O)CCl Amb26360779 [0,2,0,0,0,0|2,0,0]=4 6092 B8R0.19 CCC(C)OC(=O)CS Amb26841875 [0,2,0,0,0,0|1,1,0]=4 6093 B8R0.19 CCC(C)OC(=O)NN Amb27769116 [0,2,0,0,0,0|2,0,0]=4 6094 B8R0.19 CCC(C)SC(=S)OC Amb28049421 [0,2,0,0,0,0|1,1,0]=4 6095 B8R0.19 CCC(C)\C=C(\C)C=O Amb27205774 [0,2,0,0,0,0|1,0,1]=4 6096 B8R0.19 CCC(Cl)CC(=O)OC Amb27971680 [0,2,0,0,0,0|0,0,0]=2 6097 B8R0.19 CCC(F)CN(C)OC Amb27837655 [0,2,0,0,0,0|2,0,0]=4 6098 B8R0.19 CCC(N)CC(=O)OC Amb18203185 [0,2,0,0,0,0|0,0,0]=2 6099 B8R0.19 CCC(N)CC(=O)OC Amb22264719 [0,2,0,0,0,0|0,0,0]=2 6100 B8R0.19 CCC(N)CC(C)CO Amb19149274 [0,2,0,0,0,0|1,0,1]=4 6101 B8R0.19 CCC(N)CC(O)CC Amb25858181 [0,2,0,0,0,0|1,0,1]=4 6102 B8R0.19 CCC(N)CC(O)CF Amb33220388 [0,2,0,0,0,0|1,0,1]=4 6103 B8R0.19 CCC(N)CC(O)CO Amb27792071 [0,2,0,0,0,0|0,0,2]=4 6104 B8R0.19 CCC(N)CN(C)OC Amb27981780 [0,2,0,0,0,0|2,0,0]=4 6105 B8R0.19 CCC(N)CS(=O)CC Amb27408740 [0,2,0,0,0,0|2,0,0]=4 6106 B8R0.19 CCC(N)C\C(C)=C\Cl Amb29879760 [0,2,0,0,0,0|2,0,0]=4 6107 B8R0.19 CCC(N)C\C(N)=N\O Amb24379538 [0,2,0,0,0,0|1,0,0]=3 6108 B8R0.19 CCC(O)CC(=O)OC Amb24425172 [0,2,0,0,0,0|0,0,0]=2 6109 B8R0.19 CCC(O)CC(O)CC Amb25702353 [0,2,0,0,0,0|1,0,1]=4 6110 B8R0.19 CCC(O)OC(=O)CS Amb27768823 [0,2,0,0,0,0|1,1,0]=4 6111 B8R0.19 CCN(C)CC(=O)NC Amb28208183 [0,2,0,0,0,0|2,0,0]=4 6112 B8R0.19 CCN(C)CC(=O)NN Amb10608256 [0,2,0,0,0,0|2,0,0]=4 6113 B8R0.19 CCN(C)CC(=O)NN Amb19890161 [0,2,0,0,0,0|2,0,0]=4 6114 B8R0.19 CCN(C)CC(=O)OC Amb8873255 [0,2,0,0,0,0|1,0,0]=3 6115 B8R0.19 CC[C@@H](C)CC(=O)OC Amb28059460 [0,2,0,0,0,0|0,0,0]=2 6116 B8R0.19 CC[C@@H](C)C[C@@H](C)C=O Amb27798245 [0,2,0,0,0,0|1,0,1]=4 6117 B8R0.19 CC[C@@H](C)C[C@@H](C)CO Amb27650160 [0,2,0,0,0,0|1,0,1]=4 6118 B8R0.19 CC[C@@H](N)CC(=O)OC Amb20241226 [0,2,0,0,0,0|0,0,0]=2 6119 B8R0.19 CC[C@@H](N)CC(=O)OC Amb26016603 [0,2,0,0,0,0|0,0,0]=2 6120 B8R0.19 CC[C@@H](N)CC(C)OC Amb27858077 [0,2,0,0,0,0|1,0,1]=4 6121 B8R0.19 CC[C@@H](N)C[C@H](O)CC Amb19929572 [0,2,0,0,0,0|1,0,1]=4 6122 B8R0.19 CC[C@@H](O)CC(=O)OC Amb22224793 [0,2,0,0,0,0|0,0,0]=2 6123 B8R0.19 CC[C@@H](O)C[C@H](O)CC Amb22388488 [0,2,0,0,0,0|1,0,1]=4 6124 B8R0.19 CC[C@@H](O)\C=C(/C)C=O Amb27257893 [0,2,0,0,0,0|1,0,1]=4 6125 B8R0.19 CC[C@H](C)CC(=O)NC Amb27596095 [0,2,0,0,0,0|1,0,0]=3 6126 B8R0.19 CC[C@H](C)CC(C)C=O Amb27257883 [0,2,0,0,0,0|1,0,1]=4 6127 B8R0.19 CC[C@H](C)NC(=O)OC Amb28049899 [0,2,0,0,0,0|1,0,0]=3 6128 B8R0.19 CC[C@H](C)\C=C(\C)CO Amb27406971 [0,2,0,0,0,0|1,0,1]=4 6129 B8R0.19 CC[C@H](N)CC(=O)OC Amb27411455 [0,2,0,0,0,0|0,0,0]=2 6130 B8R0.19 CC[C@H](N)CC(=O)OC Amb33457880 [0,2,0,0,0,0|0,0,0]=2 6131 B8R0.19 CC[C@H](N)C[C@H](O)CC Amb19929573 [0,2,0,0,0,0|1,0,1]=4 6132 B8R0.19 CC[C@H](O)CC(=O)OC Amb20240681 [0,2,0,0,0,0|0,0,0]=2 6133 B8R0.19 CC[C@H](O)C[C@@H](O)CC Amb24467480 [0,2,0,0,0,0|1,0,1]=4 6134 B8R0.19 CC[C@H](O)C[C@H](O)CC Amb27604338 [0,2,0,0,0,0|1,0,1]=4 6135 B8R0.19 CC\C(C)=C\C(=O)OC Amb25334129 [0,2,0,0,0,0|0,0,2]=4 6136 B8R0.19 CC\C(N)=C\C(=O)OC Amb26515846 [0,2,0,0,0,0|0,0,2]=4 6137 B8R0.19 CNC(=O)CC(=O)OC Amb17399823 [0,2,0,0,0,0|1,0,1]=4 6138 B8R0.19 CNC(=O)CC(C)CN Amb27961028 [0,2,0,0,0,0|2,0,0]=4 6139 B8R0.19 CNC(=O)CC(C)NC Amb10608347 [0,2,0,0,0,0|2,0,0]=4 6140 B8R0.19 CNC(=O)CC(C)NC Amb22587223 [0,2,0,0,0,0|2,0,0]=4 6141 B8R0.19 CNC(=O)CC(O)CO Amb25960171 [0,2,0,0,0,0|2,0,0]=4 6142 B8R0.19 CNC(C)CC(=O)OC Amb9398364 [0,2,0,0,0,0|1,0,0]=3 6143 B8R0.19 CNC(C)C\C(N)=N\O Amb25147148 [0,2,0,0,0,0|2,0,0]=4 6144 B8R0.19 CN[C@H](C)CC(=O)OC Amb33495831 [0,2,0,0,0,0|1,0,0]=3 6145 B8R0.19 COC(=N)CC(=O)OC Amb24476600 [0,2,0,0,0,0|1,0,1]=4 6146 B8R0.19 COC(=N)CC(C)OC Amb27864965 [0,2,0,0,0,0|2,0,0]=4 6147 B8R0.19 COC(=O)CC(=O)CCl Amb3940254 [0,2,0,0,0,0|1,0,1]=4 6148 B8R0.19 COC(=O)CC(=O)CF Amb27409309 [0,2,0,0,0,0|1,0,1]=4 6149 B8R0.19 COC(=O)CC(=O)OC Amb6196416 [0,2,0,0,0,0|1,0,1]=4 6150 B8R0.19 COC(=O)CC(=S)OC Amb27399792 [0,2,0,0,0,0|1,0,1]=4 6151 B8R0.19 COC(=O)CC(C)C#N Amb17334095 [0,2,0,0,0,0|1,0,1]=4 6152 B8R0.19 COC(=O)CC(C)C=O Amb18642765 [0,2,0,0,0,0|1,0,1]=4 6153 B8R0.19 COC(=O)CC(C)CBr Amb24692917 [0,2,0,0,0,0|1,0,0]=3 6154 B8R0.19 COC(=O)CC(C)CN Amb18642843 [0,2,0,0,0,0|1,0,0]=3 6155 B8R0.19 COC(=O)CC(C)CN Amb33457749 [0,2,0,0,0,0|1,0,0]=3 6156 B8R0.19 COC(=O)CC(C)OC Amb9397848 [0,2,0,0,0,0|1,0,0]=3 6157 B8R0.19 COC(=O)CC(C)SC Amb19374125 [0,2,0,0,0,0|1,0,0]=3 6158 B8R0.19 COC(=O)CC(F)C=O Amb27173133 [0,2,0,0,0,0|1,0,1]=4 6159 B8R0.19 COC(=O)CC(F)CBr Amb28400231 [0,2,0,0,0,0|1,0,0]=3 6160 B8R0.19 COC(=O)CC(F)CN Amb28400247 [0,2,0,0,0,0|1,0,0]=3 6161 B8R0.19 COC(=O)CC(N)CN Amb22264781 [0,2,0,0,0,0|1,0,0]=3 6162 B8R0.19 COC(=O)CC(O)CCl Amb20241285 [0,2,0,0,0,0|1,0,0]=3 6163 B8R0.19 COC(=O)CC(O)CF Amb26920791 [0,2,0,0,0,0|1,0,0]=3 6164 B8R0.19 COC(=O)CC(O)CN Amb25146166 [0,2,0,0,0,0|1,0,0]=3 6165 B8R0.19 COC(=O)CC(O)CN Amb32668884 [0,2,0,0,0,0|1,0,0]=3 6166 B8R0.19 COC(=O)CC(O)CO Amb6600485 [0,2,0,0,0,0|1,0,0]=3 6167 B8R0.19 COC(=O)CC([NH3+])C[NH3+] Amb24112943 [0,2,0,0,0,0|1,0,0]=3 6168 B8R0.19 COC(=O)C[C@@H](C)C=O Amb27863686 [0,2,0,0,0,0|1,0,1]=4 6169 B8R0.19 COC(=O)C[C@@H](C)CN Amb27216066 [0,2,0,0,0,0|1,0,0]=3 6170 B8R0.19 COC(=O)C[C@@H](C)CO Amb22747755 [0,2,0,0,0,0|1,0,0]=3 6171 B8R0.19 COC(=O)C[C@@H](O)CBr Amb23437907 [0,2,0,0,0,0|1,0,0]=3 6172 B8R0.19 COC(=O)C[C@@H](O)CCl Amb8394990 [0,2,0,0,0,0|1,0,0]=3 6173 B8R0.19 COC(=O)C[C@@H](O)CF Amb33358243 [0,2,0,0,0,0|1,0,0]=3 6174 B8R0.19 COC(=O)C[C@@H](O)CN Amb24113025 [0,2,0,0,0,0|1,0,0]=3 6175 B8R0.19 COC(=O)C[C@@H](O)CN Amb33330793 [0,2,0,0,0,0|1,0,0]=3 6176 B8R0.19 COC(=O)C[C@H](C)C=O Amb28366984 [0,2,0,0,0,0|1,0,1]=4 6177 B8R0.19 COC(=O)C[C@H](C)CN Amb27202560 [0,2,0,0,0,0|1,0,0]=3 6178 B8R0.19 COC(=O)C[C@H](C)CO Amb27831499 [0,2,0,0,0,0|1,0,0]=3 6179 B8R0.19 COC(=O)C[C@H](O)CBr Amb8384043 [0,2,0,0,0,0|1,0,0]=3 6180 B8R0.19 COC(=O)C[C@H](O)CCl Amb2695337 [0,2,0,0,0,0|1,0,0]=3 6181 B8R0.19 COC(=O)C[C@H](O)CF Amb33358247 [0,2,0,0,0,0|1,0,0]=3 6182 B8R0.19 COC(=O)C[C@H](O)CN Amb26604358 [0,2,0,0,0,0|1,0,0]=3 6183 B8R0.19 COC(=O)C[C@H](O)CN Amb33331047 [0,2,0,0,0,0|1,0,0]=3 6184 B8R0.19 COC(=O)C[C@H](O)CO Amb13883661 [0,2,0,0,0,0|1,0,0]=3 6185 B8R0.19 COC(=O)NC(C)CN Amb18251139 [0,2,0,0,0,0|2,0,0]=4 6186 B8R0.19 COC(=O)NC(C)OC Amb27640252 [0,2,0,0,0,0|2,0,0]=4 6187 B8R0.19 COC(=O)N[C@@H](C)CN Amb28071139 [0,2,0,0,0,0|2,0,0]=4 6188 B8R0.19 COC(=O)N[C@@H](C)CO Amb27238443 [0,2,0,0,0,0|2,0,0]=4 6189 B8R0.19 COC(=O)N[C@H](C)CN Amb27794832 [0,2,0,0,0,0|2,0,0]=4 6190 B8R0.19 COC(=O)OC(C)CBr Amb28348252 [0,2,0,0,0,0|2,0,0]=4 6191 B8R0.19 COC(=O)OC(C)CO Amb28315454 [0,2,0,0,0,0|2,0,0]=4 6192 B8R0.19 COC(=O)O[C@H](C)CO Amb27981874 [0,2,0,0,0,0|2,0,0]=4 6193 B8R0.19 COC(C)C\C(N)=N\O Amb25116224 [0,2,0,0,0,0|2,0,0]=4 6194 B8R0.19 CSC(C)CC(=O)NN Amb27837504 [0,2,0,0,0,0|2,0,0]=4 6195 B8R0.19 CSC(C)C\C(N)=N\O Amb27236765 [0,2,0,0,0,0|2,0,0]=4 6196 B8R0.19 C\C=C(/C)CC(O)CC Amb27252008 [0,2,0,0,0,0|2,0,0]=4 6197 B8R0.19 C\N=C(/C)CC(=O)OC Amb25888830 [0,2,0,0,0,0|1,0,1]=4 6198 B8R0.19 NNC(=O)CC(O)CCl Amb19942496 [0,2,0,0,0,0|2,0,0]=4 6199 B8R0.19 O=C(CO)CC(O)CO Amb26067178 [0,2,0,0,0,0|1,0,0]=3 6200 B8R0.19 O=CC(=O)CC(O)CO Amb28202610 [0,2,0,0,0,0|1,0,1]=4 6201 B8R0.19 O=CC(=O)C[C@@H](O)CO Amb27873015 [0,2,0,0,0,0|1,0,1]=4 6202 B8R0.19 O=CC(O)CC(=O)CO Amb28144194 [0,2,0,0,0,0|1,0,1]=4 6203 B8R0.19 O=CC(O)CC(O)CO Amb22731319 [0,2,0,0,0,0|1,0,1]=4 6204 B8R0.19 O=C[C@@H](O)C[C@@H](O)CO Amb27394636 [0,2,0,0,0,0|1,0,1]=4 6205 B8R0.19 O=C[C@@H](O)C[C@H](O)CO Amb28388612 [0,2,0,0,0,0|1,0,1]=4 6206 B8R0.19 O=C[C@H](O)CC(=O)CO Amb28121885 [0,2,0,0,0,0|1,0,1]=4 6207 B8R0.19 [C-]#[N+]C(C)CC(=O)OC Amb2688934 [0,2,0,0,0,0|1,0,1]=4 6208 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [0,2,0,0,0,0|1,0,1]=4 6209 B8R0.23 C=C(Br)CC(N)C(=O)O Amb24557771 [0,2,0,0,0,0|0,0,2]=4 6210 B8R0.23 C=C(Br)CC(O)C(C)C Amb27197177 [0,2,0,0,0,0|2,0,0]=4 6211 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O Amb22746251 [0,2,0,0,0,0|0,0,2]=4 6212 B8R0.23 C=C(Br)C[C@H](N)C(=O)O Amb25918807 [0,2,0,0,0,0|0,0,2]=4 6213 B8R0.23 C=C(Br)[C@@H](O)CC(=O)O Amb27392180 [0,2,0,0,0,0|0,0,2]=4 6214 B8R0.23 C=C(C)C(C)CC(=O)O Amb18642614 [0,2,0,0,0,0|0,0,1]=3 6215 B8R0.23 C=C(C)C(C)CC(C)=O Amb27607290 [0,2,0,0,0,0|1,0,1]=4 6216 B8R0.23 C=C(C)C(N)CC(=O)O Amb2697570 [0,2,0,0,0,0|0,0,1]=3 6217 B8R0.23 C=C(C)C(N)CC(N)=O Amb24401112 [0,2,0,0,0,0|1,0,1]=4 6218 B8R0.23 C=C(C)C(O)CC(=O)O Amb18642756 [0,2,0,0,0,0|0,0,1]=3 6219 B8R0.23 C=C(C)C(O)CC(C)=O Amb27605750 [0,2,0,0,0,0|1,0,1]=4 6220 B8R0.23 C=C(C)C(O)CC(C)N Amb35583525 [0,2,0,0,0,0|2,0,0]=4 6221 B8R0.23 C=C(C)CC(=O)C(=O)O Amb28073130 [0,2,0,0,0,0|0,0,2]=4 6222 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [0,2,0,0,0,0|0,0,1]=3 6223 B8R0.23 C=C(C)CC(C)C(C)=O Amb28203090 [0,2,0,0,0,0|1,0,1]=4 6224 B8R0.23 C=C(C)CC(C)C(C)Cl Amb27816011 [0,2,0,0,0,0|2,0,0]=4 6225 B8R0.23 C=C(C)CC(C)C(C)O Amb28063256 [0,2,0,0,0,0|2,0,0]=4 6226 B8R0.23 C=C(C)CC(Cl)C(C)=O Amb27458140 [0,2,0,0,0,0|1,0,1]=4 6227 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [0,2,0,0,0,0|0,0,1]=3 6228 B8R0.23 C=C(C)CC(N)C(C)C Amb27595590 [0,2,0,0,0,0|2,0,0]=4 6229 B8R0.23 C=C(C)CC(N)C(N)=O Amb26326676 [0,2,0,0,0,0|1,0,1]=4 6230 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [0,2,0,0,0,0|0,0,1]=3 6231 B8R0.23 C=C(C)CC(O)C(C)Br Amb27212973 [0,2,0,0,0,0|2,0,0]=4 6232 B8R0.23 C=C(C)CC(O)C(C)C Amb22228361 [0,2,0,0,0,0|2,0,0]=4 6233 B8R0.23 C=C(C)CC(O)C(C)N Amb35588698 [0,2,0,0,0,0|2,0,0]=4 6234 B8R0.23 C=C(C)CC(O)[C@@H](C)N Amb35624113 [0,2,0,0,0,0|2,0,0]=4 6235 B8R0.23 C=C(C)CC(O)[C@H](C)N Amb35737769 [0,2,0,0,0,0|2,0,0]=4 6236 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [0,2,0,0,0,0|0,0,1]=3 6237 B8R0.23 C=C(C)C[C@@H](C)[C@H](C)N Amb28074299 [0,2,0,0,0,0|2,0,0]=4 6238 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [0,2,0,0,0,0|0,0,1]=3 6239 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [0,2,0,0,0,0|0,0,1]=3 6240 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [0,2,0,0,0,0|0,0,1]=3 6241 B8R0.23 C=C(C)[C@@H](O)CC(=O)O Amb25789715 [0,2,0,0,0,0|0,0,1]=3 6242 B8R0.23 C=C(C)[C@@H](O)CC(C)=O Amb26477424 [0,2,0,0,0,0|1,0,1]=4 6243 B8R0.23 C=C(C)[C@H](C)CC(=O)O Amb27447241 [0,2,0,0,0,0|0,0,1]=3 6244 B8R0.23 C=C(C)[C@H](O)CC(=O)O Amb28286173 [0,2,0,0,0,0|0,0,1]=3 6245 B8R0.23 C=C(C)[C@H](O)CC(C)=O Amb27409964 [0,2,0,0,0,0|1,0,1]=4 6246 B8R0.23 C=C(CC(=O)O)C(C)=O Amb27831643 [0,2,0,0,0,0|0,0,2]=4 6247 B8R0.23 C=C(CC(C)C)C(=O)Cl Amb28256819 [0,2,0,0,0,0|1,0,1]=4 6248 B8R0.23 C=C(CC(C)C)C(=O)O Amb33542856 [0,2,0,0,0,0|0,0,1]=3 6249 B8R0.23 C=C(CC(C)C)C(C)=O Amb22277685 [0,2,0,0,0,0|1,0,1]=4 6250 B8R0.23 C=C(CN(C)C)C(=O)O Amb33544507 [0,2,0,0,0,0|1,0,1]=4 6251 B8R0.23 C=C(CN(C)O)C(=O)O Amb27640409 [0,2,0,0,0,0|1,0,1]=4 6252 B8R0.23 C=C(Cl)CC(C)C(C)O Amb33212811 [0,2,0,0,0,0|2,0,0]=4 6253 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb24411473 [0,2,0,0,0,0|0,0,2]=4 6254 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb28935021 [0,2,0,0,0,0|0,0,2]=4 6255 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660529 [0,2,0,0,0,0|0,0,2]=4 6256 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660530 [0,2,0,0,0,0|0,0,2]=4 6257 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb28059492 [0,2,0,0,0,0|0,0,2]=4 6258 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb32656263 [0,2,0,0,0,0|0,0,2]=4 6259 B8R0.23 C=C(F)CC(C)C(=O)O Amb27975781 [0,2,0,0,0,0|0,0,2]=4 6260 B8R0.23 C=C(F)CC(Cl)C(=O)O Amb27876022 [0,2,0,0,0,0|0,0,2]=4 6261 B8R0.23 C=C(F)C[C@@H](N)C(=O)O Amb27771842 [0,2,0,0,0,0|0,0,2]=4 6262 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,2,0,0,0,0|2,0,0]=4 6263 B8R0.23 CC(=O)C(=O)CC(=O)O Amb17593364 [0,2,0,0,0,0|0,0,2]=4 6264 B8R0.23 CC(=O)C(=O)CC(C)C Amb22489717 [0,2,0,0,0,0|1,0,1]=4 6265 B8R0.23 CC(=O)C(Br)CC(=O)O Amb27834306 [0,2,0,0,0,0|0,0,1]=3 6266 B8R0.23 CC(=O)C(C)CC(=O)O Amb18292788 [0,2,0,0,0,0|0,0,1]=3 6267 B8R0.23 CC(=O)C(C)CC(C)C Amb24640121 [0,2,0,0,0,0|1,0,0]=3 6268 B8R0.23 CC(=O)C(C)CN(C)C Amb4019104 [0,2,0,0,0,0|2,0,0]=4 6269 B8R0.23 CC(=O)C(Cl)CC(C)O Amb27454439 [0,2,0,0,0,0|1,0,0]=3 6270 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [0,2,0,0,0,0|0,0,1]=3 6271 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,2,0,0,0,0|1,0,1]=4 6272 B8R0.23 CC(=O)C(O)CC(=O)O Amb25341886 [0,2,0,0,0,0|0,0,1]=3 6273 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [0,2,0,0,0,0|1,0,0]=3 6274 B8R0.23 CC(=O)CC(=O)C(=O)O Amb18642736 [0,2,0,0,0,0|0,0,2]=4 6275 B8R0.23 CC(=O)CC(=O)C(C)C Amb17778966 [0,2,0,0,0,0|1,0,1]=4 6276 B8R0.23 CC(=O)CC(Br)C(C)C Amb28436887 [0,2,0,0,0,0|1,0,0]=3 6277 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [0,2,0,0,0,0|0,0,1]=3 6278 B8R0.23 CC(=O)CC(C)C(C)=O Amb26490545 [0,2,0,0,0,0|1,0,1]=4 6279 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [0,2,0,0,0,0|0,0,1]=3 6280 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [0,2,0,0,0,0|0,0,1]=3 6281 B8R0.23 CC(=O)CC(N)C(C)C Amb27409984 [0,2,0,0,0,0|1,0,0]=3 6282 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [0,2,0,0,0,0|1,0,1]=4 6283 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [0,2,0,0,0,0|0,0,1]=3 6284 B8R0.23 CC(=O)CN(C)C(C)C Amb22587141 [0,2,0,0,0,0|2,0,0]=4 6285 B8R0.23 CC(=O)CS(=O)C(C)C Amb27804515 [0,2,0,0,0,0|2,0,0]=4 6286 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [0,2,0,0,0,0|0,0,1]=3 6287 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [0,2,0,0,0,0|0,0,1]=3 6288 B8R0.23 CC(=O)C[C@@H](O)C(C)C Amb25135567 [0,2,0,0,0,0|1,0,0]=3 6289 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [0,2,0,0,0,0|0,0,1]=3 6290 B8R0.23 CC(=O)C[C@H](C)C(C)=O Amb28051038 [0,2,0,0,0,0|1,0,1]=4 6291 B8R0.23 CC(=O)C[C@H](C)C(C)C Amb28285288 [0,2,0,0,0,0|1,0,0]=3 6292 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [0,2,0,0,0,0|0,0,1]=3 6293 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [0,2,0,0,0,0|0,0,1]=3 6294 B8R0.23 CC(=O)N(C)CC(=O)O Amb33526797 [0,2,0,0,0,0|1,0,1]=4 6295 B8R0.23 CC(=O)N(Cl)CC(=O)O Amb28366945 [0,2,0,0,0,0|1,0,1]=4 6296 B8R0.23 CC(=O)NC(C)C(=O)O Amb9745652 [0,2,0,0,0,0|1,0,1]=4 6297 B8R0.23 CC(=O)N[C@@H](C)C(=O)O Amb8390375 [0,2,0,0,0,0|1,0,1]=4 6298 B8R0.23 CC(=O)N[C@H](C)C(=O)O Amb19944277 [0,2,0,0,0,0|1,0,1]=4 6299 B8R0.23 CC(=O)OC(C)C(=O)O Amb22360672 [0,2,0,0,0,0|1,0,1]=4 6300 B8R0.23 CC(=O)OC(C)C(C)O Amb28366888 [0,2,0,0,0,0|2,0,0]=4 6301 B8R0.23 CC(=O)O[C@@H](C)C(=O)O Amb3938984 [0,2,0,0,0,0|1,0,1]=4 6302 B8R0.23 CC(=O)O[C@@H](C)[C@@H](C)Br Amb24558149 [0,2,0,0,0,0|2,0,0]=4 6303 B8R0.23 CC(=O)O[C@@H](C)[C@H](C)O Amb28321279 [0,2,0,0,0,0|2,0,0]=4 6304 B8R0.23 CC(=O)O[C@H](C)C(=O)O Amb26458759 [0,2,0,0,0,0|1,0,1]=4 6305 B8R0.23 CC(=O)O[C@H](C)C(C)O Amb27192959 [0,2,0,0,0,0|2,0,0]=4 6306 B8R0.23 CC(=O)S[C@@H](C)C(=O)O Amb26639910 [0,2,0,0,0,0|1,0,1]=4 6307 B8R0.23 CC(=O)S[C@H](C)C(=O)O Amb28118658 [0,2,0,0,0,0|1,0,1]=4 6308 B8R0.23 CC(=O)[C@@H](C)CN(C)C Amb27162005 [0,2,0,0,0,0|2,0,0]=4 6309 B8R0.23 CC(=O)[C@@H](N)CC(C)C Amb28344512 [0,2,0,0,0,0|1,0,0]=3 6310 B8R0.23 CC(=O)[C@@H](N)CC(N)=O Amb28044564 [0,2,0,0,0,0|1,0,1]=4 6311 B8R0.23 CC(=O)[C@@H](O)CC(=O)O Amb28398474 [0,2,0,0,0,0|0,0,1]=3 6312 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [0,2,0,0,0,0|1,0,0]=3 6313 B8R0.23 CC(=O)[C@H](C)CC(=O)O Amb25360184 [0,2,0,0,0,0|0,0,1]=3 6314 B8R0.23 CC(=O)[C@H](N)CC(C)C Amb27490707 [0,2,0,0,0,0|1,0,0]=3 6315 B8R0.23 CC(=S)NC(C)C(=O)O Amb27876447 [0,2,0,0,0,0|1,0,1]=4 6316 B8R0.23 CC(Br)C(C)NC(N)=O Amb27233701 [0,2,0,0,0,0|2,0,0]=4 6317 B8R0.23 CC(Br)CC(=O)C(=O)O Amb28146183 [0,2,0,0,0,0|0,0,1]=3 6318 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [0,2,0,0,0,0|0,0,0]=2 6319 B8R0.23 CC(C)=C(C)CC(=O)O Amb18642613 [0,2,0,0,0,0|0,0,2]=4 6320 B8R0.23 CC(C)=CC(O)C(=O)O Amb28346343 [0,2,0,0,0,0|0,0,2]=4 6321 B8R0.23 CC(C)=C[C@@H](O)C(=O)O Amb27228179 [0,2,0,0,0,0|0,0,2]=4 6322 B8R0.23 CC(C)=C[C@H](O)C(=O)O Amb27473652 [0,2,0,0,0,0|0,0,2]=4 6323 B8R0.23 CC(C)C(C)CB(O)O Amb28138502 [0,2,0,0,0,0|1,0,1]=4 6324 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,2,0,0,0,0|0,0,0]=2 6325 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,2,0,0,0,0|1,0,0]=3 6326 B8R0.23 CC(C)C(C)NC(=O)Cl Amb35637133 [0,2,0,0,0,0|2,0,0]=4 6327 B8R0.23 CC(C)C(C)NC(N)=O Amb7761978 [0,2,0,0,0,0|2,0,0]=4 6328 B8R0.23 CC(C)C(C)OC(=O)Cl Amb27835399 [0,2,0,0,0,0|2,0,0]=4 6329 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [0,2,0,0,0,0|0,0,0]=2 6330 B8R0.23 CC(C)C(Cl)OC(=O)Cl Amb8515447 [0,2,0,0,0,0|2,0,0]=4 6331 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [0,2,0,0,0,0|0,0,0]=2 6332 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [0,2,0,0,0,0|0,0,0]=2 6333 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,2,0,0,0,0|1,0,0]=3 6334 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [0,2,0,0,0,0|0,0,0]=2 6335 B8R0.23 CC(C)CC(=N)C(=O)O Amb27268516 [0,2,0,0,0,0|0,0,1]=3 6336 B8R0.23 CC(C)CC(=O)C(=O)Cl Amb28350424 [0,2,0,0,0,0|1,0,1]=4 6337 B8R0.23 CC(C)CC(=O)C(=O)O Amb8387123 [0,2,0,0,0,0|0,0,1]=3 6338 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb21962530 [0,2,0,0,0,0|0,0,2]=4 6339 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb22360647 [0,2,0,0,0,0|0,0,2]=4 6340 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb8393074 [0,2,0,0,0,0|0,0,2]=4 6341 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb8513874 [0,2,0,0,0,0|0,0,2]=4 6342 B8R0.23 CC(C)CC(Br)C(=O)Cl Amb26515942 [0,2,0,0,0,0|1,0,0]=3 6343 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [0,2,0,0,0,0|0,0,0]=2 6344 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [0,2,0,0,0,0|0,0,0]=2 6345 B8R0.23 CC(C)CC(C)C(C)O Amb27620814 [0,2,0,0,0,0|1,0,1]=4 6346 B8R0.23 CC(C)CC(C)S(=O)Cl Amb32720376 [0,2,0,0,0,0|2,0,0]=4 6347 B8R0.23 CC(C)CC(C)S(=O)[O-] Amb24371233 [0,2,0,0,0,0|1,0,1]=4 6348 B8R0.23 CC(C)CC(C)S(N)=O Amb32720382 [0,2,0,0,0,0|2,0,0]=4 6349 B8R0.23 CC(C)CC(Cl)C(=O)Cl Amb27400431 [0,2,0,0,0,0|1,0,0]=3 6350 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [0,2,0,0,0,0|0,0,0]=2 6351 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [0,2,0,0,0,0|0,0,0]=2 6352 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [0,2,0,0,0,0|0,0,0]=2 6353 B8R0.23 CC(C)CC(N)C(C)O Amb18642850 [0,2,0,0,0,0|1,0,1]=4 6354 B8R0.23 CC(C)CC(N)C(N)=O Amb6334827 [0,2,0,0,0,0|1,0,0]=3 6355 B8R0.23 CC(C)CC(N)C(N)=O Amb9729639 [0,2,0,0,0,0|1,0,0]=3 6356 B8R0.23 CC(C)CC(N)C(N)=S Amb28292675 [0,2,0,0,0,0|1,1,0]=4 6357 B8R0.23 CC(C)CC(N)C(O)O Amb27970496 [0,2,0,0,0,0|0,0,2]=4 6358 B8R0.23 CC(C)CC(N)P(O)O Amb27231724 [0,2,0,0,0,0|1,0,1]=4 6359 B8R0.23 CC(C)CC(N)[PH](=O)O Amb27831348 [0,2,0,0,0,0|1,0,0]=3 6360 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [0,2,0,0,0,0|0,0,0]=2 6361 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [0,2,0,0,0,0|0,0,1]=3 6362 B8R0.23 CC(C)CC(O)[N+](=O)[O-] Amb27162218 [0,2,0,0,0,0|1,0,1]=4 6363 B8R0.23 CC(C)CC(O)[PH](=O)O Amb27255267 [0,2,0,0,0,0|1,0,0]=3 6364 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [0,2,0,0,0,0|0,0,0]=2 6365 B8R0.23 CC(C)CN(C)C(=O)Cl Amb26589878 [0,2,0,0,0,0|2,0,0]=4 6366 B8R0.23 CC(C)CN(N)C(N)=O Amb27624191 [0,2,0,0,0,0|2,0,0]=4 6367 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [0,2,0,0,0,0|0,0,0]=2 6368 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [0,2,0,0,0,0|0,0,0]=2 6369 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [0,2,0,0,0,0|0,0,0]=2 6370 B8R0.23 CC(C)C[C@@H](N)B(O)O Amb27978098 [0,2,0,0,0,0|1,0,1]=4 6371 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [0,2,0,0,0,0|0,0,0]=2 6372 B8R0.23 CC(C)C[C@@H](N)C(C)O Amb28201191 [0,2,0,0,0,0|1,0,1]=4 6373 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb16183944 [0,2,0,0,0,0|1,0,0]=3 6374 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,2,0,0,0,0|1,0,0]=3 6375 B8R0.23 CC(C)C[C@@H](N)C(N)=S Amb27450783 [0,2,0,0,0,0|1,1,0]=4 6376 B8R0.23 CC(C)C[C@@H](N)[C@@H](C)O Amb27593782 [0,2,0,0,0,0|1,0,1]=4 6377 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [0,2,0,0,0,0|0,0,0]=2 6378 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [0,2,0,0,0,0|0,0,0]=2 6379 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [0,2,0,0,0,0|0,0,0]=2 6380 B8R0.23 CC(C)C[C@H](Br)C(N)=O Amb28197754 [0,2,0,0,0,0|1,0,0]=3 6381 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [0,2,0,0,0,0|0,0,0]=2 6382 B8R0.23 CC(C)C[C@H](Cl)C(=O)Cl Amb27657532 [0,2,0,0,0,0|1,0,0]=3 6383 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [0,2,0,0,0,0|0,0,0]=2 6384 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [0,2,0,0,0,0|0,0,0]=2 6385 B8R0.23 CC(C)C[C@H](N)B(O)O Amb24578467 [0,2,0,0,0,0|1,0,1]=4 6386 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [0,2,0,0,0,0|0,0,0]=2 6387 B8R0.23 CC(C)C[C@H](N)C(=O)S Amb27810129 [0,2,0,0,0,0|0,1,0]=3 6388 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb10670112 [0,2,0,0,0,0|1,0,0]=3 6389 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb8515324 [0,2,0,0,0,0|1,0,0]=3 6390 B8R0.23 CC(C)C[C@H](N)C(N)=S Amb28285298 [0,2,0,0,0,0|1,1,0]=4 6391 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [0,2,0,0,0,0|0,0,0]=2 6392 B8R0.23 CC(C)N(C)CC(=O)O Amb10609863 [0,2,0,0,0,0|1,0,0]=3 6393 B8R0.23 CC(C)N(C)CC(=O)O Amb6639901 [0,2,0,0,0,0|1,0,0]=3 6394 B8R0.23 CC(C)NC(=O)C(=O)O Amb2693957 [0,2,0,0,0,0|1,0,1]=4 6395 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [0,2,0,0,0,0|1,0,0]=3 6396 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [0,2,0,0,0,0|1,0,0]=3 6397 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [0,2,0,0,0,0|1,0,0]=3 6398 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [0,2,0,0,0,0|1,0,0]=3 6399 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb6541556 [0,2,0,0,0,0|1,0,1]=4 6400 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb9172207 [0,2,0,0,0,0|1,0,1]=4 6401 B8R0.23 CC(C)OC(F)C(=O)O Amb28045324 [0,2,0,0,0,0|1,0,0]=3 6402 B8R0.23 CC(C)SC(=S)C(=O)O Amb27196601 [0,2,0,0,0,0|1,0,1]=4 6403 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [0,2,0,0,0,0|1,0,0]=3 6404 B8R0.23 CC(C)SC(C)C(N)=O Amb28071700 [0,2,0,0,0,0|2,0,0]=4 6405 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [0,2,0,0,0,0|1,0,0]=3 6406 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,2,0,0,0,0|0,0,0]=2 6407 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [0,2,0,0,0,0|0,0,0]=2 6408 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [0,2,0,0,0,0|0,0,0]=2 6409 B8R0.23 CC(C)[C@@H](N)CC(N)=O Amb28340737 [0,2,0,0,0,0|1,0,0]=3 6410 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [0,2,0,0,0,0|0,0,0]=2 6411 B8R0.23 CC(C)[C@@H](O)CC(N)=O Amb27443470 [0,2,0,0,0,0|1,0,0]=3 6412 B8R0.23 CC(C)[C@H](C)CB(O)O Amb27169740 [0,2,0,0,0,0|1,0,1]=4 6413 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [0,2,0,0,0,0|0,0,0]=2 6414 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [0,2,0,0,0,0|0,0,0]=2 6415 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,2,0,0,0,0|1,0,0]=3 6416 B8R0.23 CC(C)[C@H](N)C[C@H](C)O Amb27457995 [0,2,0,0,0,0|1,0,1]=4 6417 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [0,2,0,0,0,0|0,0,0]=2 6418 B8R0.23 CC(C)\C=C(/F)C(=O)O Amb34913203 [0,2,0,0,0,0|0,0,2]=4 6419 B8R0.23 CC(C)\C=C(\Br)C(=O)O Amb27789870 [0,2,0,0,0,0|0,0,2]=4 6420 B8R0.23 CC(C)\C=C(\F)C(=O)O Amb27838509 [0,2,0,0,0,0|0,0,2]=4 6421 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,2,0,0,0,0|1,0,1]=4 6422 B8R0.23 CC(CC(=O)O)C(F)F Amb27441233 [0,2,0,0,0,0|1,0,0]=3 6423 B8R0.23 CC(CC(=O)O)C(N)=O Amb25737942 [0,2,0,0,0,0|1,0,1]=4 6424 B8R0.23 CC(CC(=O)O)C(N)N Amb27481204 [0,2,0,0,0,0|1,0,0]=3 6425 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [0,2,0,0,0,0|1,0,0]=3 6426 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [0,2,0,0,0,0|1,0,0]=3 6427 B8R0.23 CC(CC(=O)O)N(C)O Amb27639550 [0,2,0,0,0,0|1,0,0]=3 6428 B8R0.23 CC(CC(F)F)C(=O)O Amb22896466 [0,2,0,0,0,0|1,0,0]=3 6429 B8R0.23 CC(CC(N)=O)C(=O)O Amb27596628 [0,2,0,0,0,0|1,0,1]=4 6430 B8R0.23 CC(CC(N)=O)N(C)C Amb17231867 [0,2,0,0,0,0|2,0,0]=4 6431 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [0,2,0,0,0,0|1,0,0]=3 6432 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [0,2,0,0,0,0|1,0,0]=3 6433 B8R0.23 CC(CN(C)C)C(N)=O Amb17231865 [0,2,0,0,0,0|2,0,0]=4 6434 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [0,2,0,0,0,0|1,0,0]=3 6435 B8R0.23 CC(CS(=O)O)C(=O)O Amb28118949 [0,2,0,0,0,0|2,0,0]=4 6436 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [0,2,0,0,0,0|1,0,0]=3 6437 B8R0.23 CC(CS(C)=O)C(N)=O Amb27981416 [0,2,0,0,0,0|2,0,0]=4 6438 B8R0.23 CC(C[PH](=O)O)C(=O)O Amb27477749 [0,2,0,0,0,0|2,0,0]=4 6439 B8R0.23 CC(Cl)C(C)OC(=O)Cl Amb27831442 [0,2,0,0,0,0|2,0,0]=4 6440 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [0,2,0,0,0,0|0,0,0]=2 6441 B8R0.23 CC(Cl)\C=C(\O)C(=O)O Amb27658885 [0,2,0,0,0,0|0,0,2]=4 6442 B8R0.23 CC(N)C(C)NC(N)=O Amb27427383 [0,2,0,0,0,0|2,0,0]=4 6443 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [0,2,0,0,0,0|0,0,0]=2 6444 B8R0.23 CC(N)C(O)CC(N)=O Amb28184577 [0,2,0,0,0,0|1,0,0]=3 6445 B8R0.23 CC(N)C(O)C[PH](=O)O Amb28130506 [0,2,0,0,0,0|1,0,0]=3 6446 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [0,2,0,0,0,0|0,0,0]=2 6447 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [0,2,0,0,0,0|0,0,0]=2 6448 B8R0.23 CC(N)CN(C)C(N)=O Amb18203178 [0,2,0,0,0,0|2,0,0]=4 6449 B8R0.23 CC(N)[C@@H](O)C[PH](=O)O Amb27841881 [0,2,0,0,0,0|1,0,0]=3 6450 B8R0.23 CC(O)C(C)NC(N)=O Amb27254184 [0,2,0,0,0,0|2,0,0]=4 6451 B8R0.23 CC(O)C(C)OC(N)=O Amb27644455 [0,2,0,0,0,0|2,0,0]=4 6452 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [0,2,0,0,0,0|0,0,0]=2 6453 B8R0.23 CC(O)C(N)CC(N)=O Amb27246007 [0,2,0,0,0,0|1,0,0]=3 6454 B8R0.23 CC(O)CC(=O)C(=O)O Amb25789747 [0,2,0,0,0,0|0,0,1]=3 6455 B8R0.23 CC(O)CC(C)C(C)C Amb28059818 [0,2,0,0,0,0|1,0,1]=4 6456 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [0,2,0,0,0,0|0,0,0]=2 6457 B8R0.23 CC(O)CC(N)C(C)C Amb27956567 [0,2,0,0,0,0|1,0,1]=4 6458 B8R0.23 CC(O)CC(N)C(N)=O Amb33065888 [0,2,0,0,0,0|1,0,0]=3 6459 B8R0.23 CC(O)CC(O)C(C)C Amb535791 [0,2,0,0,0,0|1,0,1]=4 6460 B8R0.23 CC(O)CC(S)C(C)C Amb28049086 [0,2,0,0,0,0|1,0,1]=4 6461 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [0,2,0,0,0,0|0,0,0]=2 6462 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [0,2,0,0,0,0|0,0,0]=2 6463 B8R0.23 CC(OC(F)F)C(=O)O Amb24358717 [0,2,0,0,0,0|2,0,0]=4 6464 B8R0.23 CN(C)C(=O)CC(=O)O Amb17399822 [0,2,0,0,0,0|1,0,1]=4 6465 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [0,2,0,0,0,0|1,0,0]=3 6466 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [0,2,0,0,0,0|1,0,0]=3 6467 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [0,2,0,0,0,0|1,0,0]=3 6468 B8R0.23 CN(C)CC(N)C(N)=O Amb18984335 [0,2,0,0,0,0|2,0,0]=4 6469 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [0,2,0,0,0,0|1,0,0]=3 6470 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [0,2,0,0,0,0|1,0,0]=3 6471 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [0,2,0,0,0,0|1,0,0]=3 6472 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [0,2,0,0,0,0|1,0,0]=3 6473 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [0,2,0,0,0,0|1,0,0]=3 6474 B8R0.23 CN(CC(=O)O)S(C)=O Amb27862060 [0,2,0,0,0,0|2,0,0]=4 6475 B8R0.23 CN(N)C(=O)CC(=O)O Amb25326354 [0,2,0,0,0,0|1,0,1]=4 6476 B8R0.23 CS(=N)C[C@H](N)C(=O)O Amb27838573 [0,2,0,0,0,0|1,0,0]=3 6477 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [0,2,0,0,0,0|1,0,0]=3 6478 B8R0.23 CS(=O)CC(N)C(N)=O Amb27608115 [0,2,0,0,0,0|2,0,0]=4 6479 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [0,2,0,0,0,0|1,0,0]=3 6480 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [0,2,0,0,0,0|1,0,0]=3 6481 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [0,2,0,0,0,0|1,0,1]=4 6482 B8R0.23 C[C@@H](CC(F)F)C(=O)O Amb33749533 [0,2,0,0,0,0|1,0,0]=3 6483 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [0,2,0,0,0,0|0,0,0]=2 6484 B8R0.23 C[C@@H](N)C(=O)CC(N)=O Amb28188661 [0,2,0,0,0,0|1,0,1]=4 6485 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [0,2,0,0,0,0|0,0,0]=2 6486 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [0,2,0,0,0,0|0,0,0]=2 6487 B8R0.23 C[C@@H](OC(F)F)C(=O)O Amb24389309 [0,2,0,0,0,0|2,0,0]=4 6488 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [0,2,0,0,0,0|1,0,1]=4 6489 B8R0.23 C[C@H](CC(=O)O)C(Cl)Cl Amb28292581 [0,2,0,0,0,0|1,0,0]=3 6490 B8R0.23 C[C@H](CC(=O)O)C(N)=O Amb28133461 [0,2,0,0,0,0|1,0,1]=4 6491 B8R0.23 C[C@H](CC(=O)O)S(C)=O Amb27410588 [0,2,0,0,0,0|1,0,0]=3 6492 B8R0.23 C[C@H](CC(F)F)C(=O)O Amb33727762 [0,2,0,0,0,0|1,0,0]=3 6493 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [0,2,0,0,0,0|0,0,0]=2 6494 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [0,2,0,0,0,0|0,0,0]=2 6495 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [0,2,0,0,0,0|0,0,0]=2 6496 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [0,2,0,0,0,0|0,0,0]=2 6497 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [0,2,0,0,0,0|0,0,0]=2 6498 B8R0.23 C[C@H](NS(C)=O)C(=O)O Amb27212723 [0,2,0,0,0,0|2,0,0]=4 6499 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [0,2,0,0,0,0|0,0,0]=2 6500 B8R0.23 C[C@H](OC(F)F)C(=O)O Amb26499188 [0,2,0,0,0,0|2,0,0]=4 6501 B8R0.23 C[C@H](OC(N)=O)[C@@H](C)Cl Amb27875080 [0,2,0,0,0,0|2,0,0]=4 6502 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [0,2,0,0,0,0|1,0,0]=3 6503 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [0,2,0,0,0,0|1,0,0]=3 6504 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [0,2,0,0,0,0|1,0,0]=3 6505 B8R0.23 C\C(=C/C(=O)O)C(C)C Amb17506861 [0,2,0,0,0,0|0,0,2]=4 6506 B8R0.23 C\C(=C/C(C)C)C(=O)O Amb18642616 [0,2,0,0,0,0|0,0,2]=4 6507 B8R0.23 C\C(=C\C(C)N)C(=O)O Amb25731207 [0,2,0,0,0,0|0,0,2]=4 6508 B8R0.23 C\C(Cl)=C/C(C)C(=O)O Amb28285105 [0,2,0,0,0,0|0,0,2]=4 6509 B8R0.23 C\C(Cl)=C/C(Cl)C(=O)O Amb28128482 [0,2,0,0,0,0|0,0,2]=4 6510 B8R0.23 NC(=O)C(N)CC(=O)O Amb18124347 [0,2,0,0,0,0|1,0,1]=4 6511 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666212 [0,2,0,0,0,0|1,0,1]=4 6512 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666239 [0,2,0,0,0,0|1,0,1]=4 6513 B8R0.23 NC(=O)C(N)CC(F)F Amb27409676 [0,2,0,0,0,0|2,0,0]=4 6514 B8R0.23 NC(=O)CC(Br)C(=O)O Amb26012685 [0,2,0,0,0,0|1,0,1]=4 6515 B8R0.23 NC(=O)CC(Cl)C(=O)O Amb27478086 [0,2,0,0,0,0|1,0,1]=4 6516 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [0,2,0,0,0,0|1,0,1]=4 6517 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [0,2,0,0,0,0|1,0,1]=4 6518 B8R0.23 NC(=O)CC(N)C(F)F Amb32418214 [0,2,0,0,0,0|2,0,0]=4 6519 B8R0.23 NC(=O)CC(O)C(=O)O Amb27807542 [0,2,0,0,0,0|1,0,1]=4 6520 B8R0.23 NC(=O)CC(S)C(=O)O Amb27494183 [0,2,0,0,0,0|1,0,1]=4 6521 B8R0.23 NC(=O)C[C@@H](Br)C(=O)O Amb27858620 [0,2,0,0,0,0|1,0,1]=4 6522 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [0,2,0,0,0,0|1,0,1]=4 6523 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [0,2,0,0,0,0|1,0,1]=4 6524 B8R0.23 NC(=O)C[C@@H](O)C(=O)O Amb24681022 [0,2,0,0,0,0|1,0,1]=4 6525 B8R0.23 NC(=O)C[C@@H](S)C(=O)O Amb27234637 [0,2,0,0,0,0|1,0,1]=4 6526 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [0,2,0,0,0,0|1,0,1]=4 6527 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [0,2,0,0,0,0|1,0,1]=4 6528 B8R0.23 NC(=O)C[C@H](S)C(=O)O Amb27253643 [0,2,0,0,0,0|1,0,1]=4 6529 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb19334954 [0,2,0,0,0,0|1,0,1]=4 6530 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb31291739 [0,2,0,0,0,0|1,0,1]=4 6531 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb32652393 [0,2,0,0,0,0|1,0,1]=4 6532 B8R0.23 NC(=O)[C@H](N)CC(=O)O Amb27768775 [0,2,0,0,0,0|1,0,1]=4 6533 B8R0.23 NC(=O)[C@H](N)CC(F)F Amb27163215 [0,2,0,0,0,0|2,0,0]=4 6534 B8R0.23 NC(=S)C[C@H](N)C(=O)O Amb28410343 [0,2,0,0,0,0|1,0,1]=4 6535 B8R0.23 NC(CB(O)O)C(=O)O Amb28285179 [0,2,0,0,0,0|2,0,0]=4 6536 B8R0.23 NC(CB(O)O)C(=O)O Amb33803309 [0,2,0,0,0,0|2,0,0]=4 6537 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [0,2,0,0,0,0|1,0,1]=4 6538 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22167994 [0,2,0,0,0,0|1,0,1]=4 6539 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22337568 [0,2,0,0,0,0|1,0,1]=4 6540 B8R0.23 NC(CC(=O)O)C(Cl)Cl Amb27964120 [0,2,0,0,0,0|1,0,0]=3 6541 B8R0.23 NC(CC(=O)O)C(F)F Amb23570587 [0,2,0,0,0,0|1,0,0]=3 6542 B8R0.23 NC(CC(Cl)Cl)C(=O)O Amb27791749 [0,2,0,0,0,0|1,0,0]=3 6543 B8R0.23 NC(CC(F)F)C(=O)O Amb13952714 [0,2,0,0,0,0|1,0,0]=3 6544 B8R0.23 NC(CC(F)F)C(=O)O Amb33546007 [0,2,0,0,0,0|1,0,0]=3 6545 B8R0.23 NC(CS(=O)O)C(=O)O Amb541272 [0,2,0,0,0,0|2,0,0]=4 6546 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [0,2,0,0,0,0|1,0,1]=4 6547 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [0,2,0,0,0,0|1,0,1]=4 6548 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Amb22801032 [0,2,0,0,0,0|1,0,1]=4 6549 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [0,2,0,0,0,0|1,0,1]=4 6550 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [0,2,0,0,0,0|1,0,1]=4 6551 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb26944439 [0,2,0,0,0,0|1,0,0]=3 6552 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb33482837 [0,2,0,0,0,0|1,0,0]=3 6553 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb6600148 [0,2,0,0,0,0|2,0,0]=4 6554 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb9809803 [0,2,0,0,0,0|2,0,0]=4 6555 B8R0.23 N[C@@H](C[SH](=O)=O)C(=O)O Amb27858626 [0,2,0,0,0,0|2,0,0]=4 6556 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [0,2,0,0,0,0|1,0,1]=4 6557 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb25117310 [0,2,0,0,0,0|1,0,0]=3 6558 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb33743521 [0,2,0,0,0,0|1,0,0]=3 6559 B8R0.23 O=C(O)C(=O)CC(F)F Amb33337766 [0,2,0,0,0,0|1,0,1]=4 6560 B8R0.23 O=C(O)C(O)CC(F)F Amb25274709 [0,2,0,0,0,0|1,0,0]=3 6561 B8R0.23 O=C(O)C(O)CC(O)O Amb28397948 [0,2,0,0,0,0|1,0,0]=3 6562 B8R0.23 O=C(O)C(O)C[N+](=O)[O-] Amb6883775 [0,2,0,0,0,0|2,0,0]=4 6563 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [0,2,0,0,0,0|1,0,1]=4 6564 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [0,2,0,0,0,0|1,0,1]=4 6565 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [0,2,0,0,0,0|1,0,1]=4 6566 B8R0.23 O=C(O)CC(O)C(Cl)Cl Amb27985520 [0,2,0,0,0,0|1,0,0]=3 6567 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [0,2,0,0,0,0|1,0,1]=4 6568 B8R0.23 O=C(O)CS(=O)C(F)F Amb18979309 [0,2,0,0,0,0|2,0,0]=4 6569 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [0,2,0,0,0,0|1,0,1]=4 6570 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [0,2,0,0,0,0|1,0,1]=4 6571 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [0,2,0,0,0,0|1,0,1]=4 6572 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [0,2,0,0,0,0|1,0,1]=4 6573 B8R0.23 O=C(O)C[C@@H](O)C(F)F Amb33337779 [0,2,0,0,0,0|1,0,0]=3 6574 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [0,2,0,0,0,0|1,0,1]=4 6575 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [0,2,0,0,0,0|1,0,1]=4 6576 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [0,2,0,0,0,0|1,0,1]=4 6577 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [0,2,0,0,0,0|1,0,1]=4 6578 B8R0.23 O=C(O)C[C@H](O)C(F)F Amb33485299 [0,2,0,0,0,0|1,0,0]=3 6579 B8R0.23 O=C(O)[C@H](Cl)CC(Cl)Cl Amb27831354 [0,2,0,0,0,0|1,0,0]=3 6580 B8R0.24 CCC(=O)CS(=O)(=O)O Amb27762508 [0,2,0,0,0,0|1,0,1]=4 6581 B8R0.24 CCC(C)CC(C)(C)O Amb25045207 [0,2,0,0,0,0|1,0,1]=4 6582 B8R0.24 CCC(C)CS(=O)(=O)Cl Amb33539922 [0,2,0,0,0,0|1,0,1]=4 6583 B8R0.24 CCC(C)CS(=O)(=O)F Amb19373796 [0,2,0,0,0,0|1,0,1]=4 6584 B8R0.24 CCC(C)CS(C)(=N)=O Amb32671075 [0,2,0,0,0,0|2,0,0]=4 6585 B8R0.24 CCC(C)CS(N)(=O)=O Amb18180195 [0,2,0,0,0,0|1,0,1]=4 6586 B8R0.24 CCC(C)OP(=O)(O)O Amb27202561 [0,2,0,0,0,0|2,0,0]=4 6587 B8R0.24 CCC(Cl)OS(=O)(=O)O Amb27984818 [0,2,0,0,0,0|2,0,0]=4 6588 B8R0.24 CCC(F)CS(=O)(=O)Cl Amb27842253 [0,2,0,0,0,0|1,0,1]=4 6589 B8R0.24 CCC(N)CC(C)(C)O Amb35592881 [0,2,0,0,0,0|1,0,1]=4 6590 B8R0.24 CCC(N)CP(=O)(O)O Amb27407104 [0,2,0,0,0,0|1,0,0]=3 6591 B8R0.24 CCC(N)CS(=O)(=O)F Amb33463755 [0,2,0,0,0,0|1,0,1]=4 6592 B8R0.24 CCC(N)CS(=O)(=O)O Amb27454945 [0,2,0,0,0,0|1,0,0]=3 6593 B8R0.24 CCC(N)CS(C)(=O)=O Amb17485988 [0,2,0,0,0,0|1,0,1]=4 6594 B8R0.24 CCC(N)CS(C)(=O)=O Amb31156558 [0,2,0,0,0,0|1,0,1]=4 6595 B8R0.24 CP(=O)(O)C[C@H](O)CN Amb27247309 [0,2,0,0,0,0|2,0,0]=4 6596 B8R0.24 N[C@@H](CO)CS(=O)(=O)O Amb28118562 [0,2,0,0,0,0|2,0,0]=4 6597 B8R0.24 O=P(O)(O)CC(O)CCl Amb3354883 [0,2,0,0,0,0|2,0,0]=4 6598 B8R0.24 O=S(=O)(O)CC(O)CO Amb25802047 [0,2,0,0,0,0|2,0,0]=4 6599 B8R0.24 O=S(=O)(O)CC(O)CS Amb17594311 [0,2,0,0,0,0|2,0,0]=4 6600 B8R0.34 C=C(C)CC(C)(C)CC Amb22228307 [0,2,0,0,0,0|2,0,0]=4 6601 B8R0.34 C=C(C)CC(C)(N)CC Amb35634476 [0,2,0,0,0,0|2,0,0]=4 6602 B8R0.34 C=C(C)CC(C)(O)CC Amb4035727 [0,2,0,0,0,0|2,0,0]=4 6603 B8R0.34 C=CC(C)(C)CC(=O)O Amb5718701 [0,2,0,0,0,0|0,0,2]=4 6604 B8R0.34 C=CC(C)(N)CC(=O)O Amb22641965 [0,2,0,0,0,0|0,0,2]=4 6605 B8R0.34 C=CC(C)(N)CC(=O)O Amb31307623 [0,2,0,0,0,0|0,0,2]=4 6606 B8R0.34 C=CC(C)(O)CC(=O)O Amb18642755 [0,2,0,0,0,0|0,0,2]=4 6607 B8R0.34 CC(=O)CC(C)(C)CBr Amb27185624 [0,2,0,0,0,0|2,0,0]=4 6608 B8R0.34 CC(=O)CC(C)(C)CO Amb24689736 [0,2,0,0,0,0|2,0,0]=4 6609 B8R0.34 CC(=O)CC(C)(Cl)CCl Amb27227718 [0,2,0,0,0,0|2,0,0]=4 6610 B8R0.34 CC(C)(C#N)CC(=O)O Amb25887307 [0,2,0,0,0,0|1,0,1]=4 6611 B8R0.34 CC(C)(C=O)CC(=O)O Amb28401504 [0,2,0,0,0,0|1,0,1]=4 6612 B8R0.34 CC(C)(CBr)CC(=O)Cl Amb27424627 [0,2,0,0,0,0|2,0,0]=4 6613 B8R0.34 CC(C)(CBr)CC(=O)O Amb24480039 [0,2,0,0,0,0|1,0,0]=3 6614 B8R0.34 CC(C)(CC(=O)O)NO Amb27859691 [0,2,0,0,0,0|2,0,0]=4 6615 B8R0.34 CC(C)(CF)CC(=O)O Amb26575195 [0,2,0,0,0,0|1,0,0]=3 6616 B8R0.34 CC(C)(CI)CC(=O)Cl Amb33295130 [0,2,0,0,0,0|2,0,0]=4 6617 B8R0.34 CC(C)(CI)CC(=O)O Amb33295131 [0,2,0,0,0,0|1,0,0]=3 6618 B8R0.34 CC(C)(CN)CC(=O)O Amb4245619 [0,2,0,0,0,0|1,0,0]=3 6619 B8R0.34 CC(C)(CN)CC(=O)O Amb578353 [0,2,0,0,0,0|1,0,0]=3 6620 B8R0.34 CC(C)(CO)CC(=O)O Amb24116870 [0,2,0,0,0,0|1,0,0]=3 6621 B8R0.34 CC(C)(CO)CC(=O)[O-] Amb24178915 [0,2,0,0,0,0|1,0,1]=4 6622 B8R0.34 CC(N)(CCl)CC(=O)O Amb22641961 [0,2,0,0,0,0|1,0,0]=3 6623 B8R0.34 CC(N)(CN)CC(=O)O Amb32787831 [0,2,0,0,0,0|1,0,0]=3 6624 B8R0.34 CC(N)(CN)CC(N)=O Amb32787386 [0,2,0,0,0,0|2,0,0]=4 6625 B8R0.34 CC(N)(CO)CC(=O)O Amb27162086 [0,2,0,0,0,0|1,0,0]=3 6626 B8R0.34 CC(O)(CCl)CC(=O)O Amb27409236 [0,2,0,0,0,0|1,0,0]=3 6627 B8R0.34 CC(O)(CN)CC(=O)O Amb25188898 [0,2,0,0,0,0|1,0,0]=3 6628 B8R0.34 CC(O)(CN)CC(=O)O Amb28935004 [0,2,0,0,0,0|1,0,0]=3 6629 B8R0.34 CCC(C)(C)CC(=N)N Amb33266965 [0,2,0,0,0,0|2,0,0]=4 6630 B8R0.34 CCC(C)(C)CC(=O)Cl Amb25032181 [0,2,0,0,0,0|1,0,0]=3 6631 B8R0.34 CCC(C)(C)CC(=O)O Amb10573669 [0,2,0,0,0,0|0,0,0]=2 6632 B8R0.34 CCC(C)(C)CC(C)=O Amb22388941 [0,2,0,0,0,0|1,0,0]=3 6633 B8R0.34 CCC(C)(C)CC(C)O Amb25918693 [0,2,0,0,0,0|1,0,1]=4 6634 B8R0.34 CCC(C)(C)CC(N)=O Amb27217075 [0,2,0,0,0,0|1,0,0]=3 6635 B8R0.34 CCC(C)(C)CC(N)=S Amb33266962 [0,2,0,0,0,0|1,1,0]=4 6636 B8R0.34 CCC(C)(C)CN(C)O Amb33267069 [0,2,0,0,0,0|2,0,0]=4 6637 B8R0.34 CCC(C)(C)CS(=O)Cl Amb32720560 [0,2,0,0,0,0|2,0,0]=4 6638 B8R0.34 CCC(C)(C)CS(=O)[O-] Amb32754311 [0,2,0,0,0,0|1,0,1]=4 6639 B8R0.34 CCC(C)(C)CS(N)=O Amb32720561 [0,2,0,0,0,0|2,0,0]=4 6640 B8R0.34 CCC(C)(C)C[C@@H](C)O Amb33266332 [0,2,0,0,0,0|1,0,1]=4 6641 B8R0.34 CCC(C)(C)C[C@H](C)O Amb33266334 [0,2,0,0,0,0|1,0,1]=4 6642 B8R0.34 CCC(C)(C)C[N+](=O)[O-] Amb24469650 [0,2,0,0,0,0|1,0,1]=4 6643 B8R0.34 CCC(C)(C)NC(=O)Cl Amb35637104 [0,2,0,0,0,0|2,0,0]=4 6644 B8R0.34 CCC(C)(C)NC(C)=O Amb3886546 [0,2,0,0,0,0|2,0,0]=4 6645 B8R0.34 CCC(C)(C)NC(N)=O Amb1139044 [0,2,0,0,0,0|2,0,0]=4 6646 B8R0.34 CCC(C)(C)OC(=O)Cl Amb27590991 [0,2,0,0,0,0|2,0,0]=4 6647 B8R0.34 CCC(C)(C)OC(C)=O Amb9787139 [0,2,0,0,0,0|2,0,0]=4 6648 B8R0.34 CCC(C)(C)OC(N)=O Amb27878422 [0,2,0,0,0,0|2,0,0]=4 6649 B8R0.34 CCC(C)(F)CC(=O)O Amb27645740 [0,2,0,0,0,0|0,0,0]=2 6650 B8R0.34 CCC(C)(N)CC(=O)O Amb25853863 [0,2,0,0,0,0|0,0,0]=2 6651 B8R0.34 CCC(C)(N)CC(C)O Amb29883689 [0,2,0,0,0,0|1,0,1]=4 6652 B8R0.34 CCC(C)(N)CC(N)=O Amb33254471 [0,2,0,0,0,0|1,0,0]=3 6653 B8R0.34 CCC(C)(O)CC(=O)O Amb18298122 [0,2,0,0,0,0|0,0,0]=2 6654 B8R0.34 CCC(C)(O)CC(C)O Amb27399622 [0,2,0,0,0,0|1,0,1]=4 6655 B8R0.34 CCC(C)(S)CC(C)=O Amb26053261 [0,2,0,0,0,0|1,0,0]=3 6656 B8R0.34 CCC(F)(F)CC(=O)Cl Amb29880872 [0,2,0,0,0,0|1,0,0]=3 6657 B8R0.34 CCC(F)(F)CC(=O)O Amb32666992 [0,2,0,0,0,0|0,0,0]=2 6658 B8R0.34 CCC(F)(F)CC(C)=O Amb30010781 [0,2,0,0,0,0|1,0,0]=3 6659 B8R0.34 CCC(F)(F)CC(N)=O Amb29882358 [0,2,0,0,0,0|1,0,0]=3 6660 B8R0.34 CCC(F)(F)CS(=O)Cl Amb32720931 [0,2,0,0,0,0|2,0,0]=4 6661 B8R0.34 CCC(F)(F)CS(=O)[O-] Amb32755571 [0,2,0,0,0,0|1,0,1]=4 6662 B8R0.34 CCC(F)(F)CS(N)=O Amb32720932 [0,2,0,0,0,0|2,0,0]=4 6663 B8R0.34 CCS(=O)(=O)CC(=O)O Amb6277554 [0,2,0,0,0,0|1,0,0]=3 6664 B8R0.34 CCS(=O)(=O)CC(C)=O Amb19515195 [0,2,0,0,0,0|2,0,0]=4 6665 B8R0.34 CCS(=O)(=O)CC(N)=O Amb28325613 [0,2,0,0,0,0|2,0,0]=4 6666 B8R0.34 CC[C@@](C)(N)CC(=O)O Amb25738026 [0,2,0,0,0,0|0,0,0]=2 6667 B8R0.34 CC[Si](C)(C)CC(=O)O Amb28145155 [0,2,0,0,0,0|0,1,0]=3 6668 B8R0.34 CNC(C)(C)CC(C)=O Amb27759912 [0,2,0,0,0,0|2,0,0]=4 6669 B8R0.34 CNC(C)(C)CC(N)=O Amb28077438 [0,2,0,0,0,0|2,0,0]=4 6670 B8R0.34 CNS(=O)(=O)CC(=O)O Amb6741780 [0,2,0,0,0,0|2,0,0]=4 6671 B8R0.34 COC(C)(C)CC(=O)O Amb25887304 [0,2,0,0,0,0|1,0,0]=3 6672 B8R0.34 COC(C)(C)CC(C)=O Amb6893067 [0,2,0,0,0,0|2,0,0]=4 6673 B8R0.34 COC(C)(O)CC(C)=O Amb25873980 [0,2,0,0,0,0|2,0,0]=4 6674 B8R0.34 C[Si](C)(CCl)CC(=O)O Amb25107199 [0,2,0,0,0,0|1,1,0]=4 6675 B8R0.34 NCC(F)(F)CC(=O)O Amb19148532 [0,2,0,0,0,0|1,0,0]=3 6676 B8R0.34 NCC(F)(F)CC(=O)O Amb32693401 [0,2,0,0,0,0|1,0,0]=3 6677 B8R0.34 O=C(O)CC(F)(F)CBr Amb27592325 [0,2,0,0,0,0|1,0,0]=3 6678 B8R0.34 O=C(O)CC(F)(F)CCl Amb33741692 [0,2,0,0,0,0|1,0,0]=3 6679 B8R0.34 O=C(O)CC(F)(F)CF Amb33402041 [0,2,0,0,0,0|1,0,0]=3 6680 B8R0.1 C#CCC(=O)CCCC Amb8390126 [0,2,0,0,0,0|1,0,0]=3 6681 B8R0.1 C#CCC(=O)CCNC Amb28126893 [0,2,0,0,0,0|2,0,0]=4 6682 B8R0.1 C#CCC(O)CCCC Amb8390125 [0,2,0,0,0,0|1,0,1]=4 6683 B8R0.1 C#CCCC(=O)CCO Amb24384003 [0,2,0,0,0,0|0,0,2]=4 6684 B8R0.1 C#CCCC(=O)COC Amb28041985 [0,2,0,0,0,0|0,0,2]=4 6685 B8R0.1 C#CCCC(=O)OCC Amb18636093 [0,2,0,0,0,0|0,0,2]=4 6686 B8R0.1 C=C(CCN)CCCC Amb25883662 [0,2,0,0,0,0|2,0,0]=4 6687 B8R0.1 C=C=CC(=O)CCCCl Amb27470781 [0,2,0,0,0,0|2,0,0]=4 6688 B8R0.1 C=C=CC(O)CCCC Amb28065816 [0,2,0,0,0,0|1,0,1]=4 6689 B8R0.1 C=C=C[C@@H](O)CCCC Amb28315458 [0,2,0,0,0,0|1,0,1]=4 6690 B8R0.1 C=CCC(=O)CCCBr Amb27401886 [0,2,0,0,0,0|2,0,0]=4 6691 B8R0.1 C=CCC(=O)CCCC Amb10567269 [0,2,0,0,0,0|1,0,0]=3 6692 B8R0.1 C=CCC(=O)CCCN Amb27252862 [0,2,0,0,0,0|2,0,0]=4 6693 B8R0.1 C=CCC(=O)COCC Amb27402397 [0,2,0,0,0,0|2,0,0]=4 6694 B8R0.1 C=CCC(=O)CSCC Amb27265833 [0,2,0,0,0,0|2,0,0]=4 6695 B8R0.1 C=CCC(=O)NCCC Amb27437889 [0,2,0,0,0,0|2,0,0]=4 6696 B8R0.1 C=CCCC(=O)NOC Amb27837663 [0,2,0,0,0,0|0,0,2]=4 6697 B8R0.1 C=CCCC(=O)OCC Amb10601809 [0,2,0,0,0,0|0,0,2]=4 6698 B8R0.1 C=CC[C@@H](O)CCCC Amb28139816 [0,2,0,0,0,0|1,0,1]=4 6699 B8R0.1 C=CNC(=O)OCCC Amb27472919 [0,2,0,0,0,0|2,0,0]=4 6700 B8R0.1 CC#CCC(=O)OCC Amb26574646 [0,2,0,0,0,0|0,0,2]=4 6701 B8R0.1 CCC#CC(=O)OCC Amb2721504 [0,2,0,0,0,0|0,0,2]=4 6702 B8R0.1 CCCC(=O)CCCF Amb28182770 [0,2,0,0,0,0|2,0,0]=4 6703 B8R0.1 CCCC(=O)CCCN Amb27866597 [0,2,0,0,0,0|2,0,0]=4 6704 B8R0.1 CCCCC(=N)OCC Amb20673140 [0,2,0,0,0,0|1,0,0]=3 6705 B8R0.1 CCCCC(=N)OCC Amb26549922 [0,2,0,0,0,0|1,0,0]=3 6706 B8R0.1 CCCCC(=O)CC#N Amb7768265 [0,2,0,0,0,0|1,0,0]=3 6707 B8R0.1 CCCCC(=O)CCC Amb3940685 [0,2,0,0,0,0|1,0,0]=3 6708 B8R0.1 CCCCC(=O)CCN Amb28186730 [0,2,0,0,0,0|1,0,0]=3 6709 B8R0.1 CCCCC(=O)CNC Amb25824276 [0,2,0,0,0,0|1,0,0]=3 6710 B8R0.1 CCCCC(=O)COC Amb19374627 [0,2,0,0,0,0|0,0,0]=2 6711 B8R0.1 CCCCC(=O)CSC Amb27837495 [0,2,0,0,0,0|0,1,0]=3 6712 B8R0.1 CCCCC(=O)N=C=O Amb17231844 [0,2,0,0,0,0|0,0,1]=3 6713 B8R0.1 CCCCC(=O)N=[N+]=[N-] Amb25888669 [0,2,0,0,0,0|1,0,0]=3 6714 B8R0.1 CCCCC(=O)OCC Amb6296060 [0,2,0,0,0,0|0,0,0]=2 6715 B8R0.1 CCCCC(=O)OCCl Amb28314260 [0,2,0,0,0,0|0,0,0]=2 6716 B8R0.1 CCCCC(=O)\C=C\Cl Amb24650002 [0,2,0,0,0,0|1,0,0]=3 6717 B8R0.1 CCCCC(=O)\C=C\O Amb26515841 [0,2,0,0,0,0|0,0,0]=2 6718 B8R0.1 CCCCC(=O)\C=N\O Amb27963887 [0,2,0,0,0,0|0,0,0]=2 6719 B8R0.1 CCCCC(C)CC=O Amb18642676 [0,2,0,0,0,0|1,0,1]=4 6720 B8R0.1 CCCCC(C)CCO Amb22229364 [0,2,0,0,0,0|1,0,1]=4 6721 B8R0.1 CCCCC(C)CON Amb33428412 [0,2,0,0,0,0|1,0,1]=4 6722 B8R0.1 CCCCC(C)N=C=O Amb24524293 [0,2,0,0,0,0|1,0,1]=4 6723 B8R0.1 CCCCC(Cl)CCO Amb27791848 [0,2,0,0,0,0|1,0,1]=4 6724 B8R0.1 CCCCC(F)CCO Amb27664743 [0,2,0,0,0,0|1,0,1]=4 6725 B8R0.1 CCCCC(N)CCO Amb18642854 [0,2,0,0,0,0|1,0,1]=4 6726 B8R0.1 CCCCC(N)CCO Amb24117271 [0,2,0,0,0,0|1,0,1]=4 6727 B8R0.1 CCCCC(N)COC Amb19374470 [0,2,0,0,0,0|1,0,1]=4 6728 B8R0.1 CCCCC(O)CC#N Amb18642535 [0,2,0,0,0,0|1,0,1]=4 6729 B8R0.1 CCCCC(O)CCN Amb25784846 [0,2,0,0,0,0|1,0,1]=4 6730 B8R0.1 CCCCC(O)CNC Amb24351205 [0,2,0,0,0,0|1,0,1]=4 6731 B8R0.1 CCCCN(C)CC=O Amb27651977 [0,2,0,0,0,0|2,0,0]=4 6732 B8R0.1 CCCCN(C)CCO Amb3204758 [0,2,0,0,0,0|2,0,0]=4 6733 B8R0.1 CCCCN(N)CCO Amb28398931 [0,2,0,0,0,0|2,0,0]=4 6734 B8R0.1 CCCCS(=O)CCO Amb6752517 [0,2,0,0,0,0|1,0,0]=3 6735 B8R0.1 CCCC[C@@H](C)CCO Amb24477883 [0,2,0,0,0,0|1,0,1]=4 6736 B8R0.1 CCCC[C@@H](C)N=C=O Amb22042694 [0,2,0,0,0,0|1,0,1]=4 6737 B8R0.1 CCCC[C@@H](N)CCO Amb22748774 [0,2,0,0,0,0|1,0,1]=4 6738 B8R0.1 CCCC[C@@H](O)CCBr Amb28320766 [0,2,0,0,0,0|1,0,1]=4 6739 B8R0.1 CCCC[C@@H](O)CCN Amb24716695 [0,2,0,0,0,0|1,0,1]=4 6740 B8R0.1 CCCC[C@H](C)N=C=O Amb22042695 [0,2,0,0,0,0|1,0,1]=4 6741 B8R0.1 CCCC[C@H](F)CCO Amb28049226 [0,2,0,0,0,0|1,0,1]=4 6742 B8R0.1 CCCC[C@H](N)CCO Amb27947953 [0,2,0,0,0,0|1,0,1]=4 6743 B8R0.1 CCCC[C@H](O)CC#N Amb27208114 [0,2,0,0,0,0|1,0,1]=4 6744 B8R0.1 CCCC[C@H](O)CCBr Amb27483780 [0,2,0,0,0,0|1,0,1]=4 6745 B8R0.1 CCCC[C@H](O)CCN Amb26996017 [0,2,0,0,0,0|1,0,1]=4 6746 B8R0.1 CCCC\C(C)=C\C#N Amb27613270 [0,2,0,0,0,0|2,0,0]=4 6747 B8R0.1 CCCC\C(C)=C\CO Amb28041191 [0,2,0,0,0,0|1,0,0]=3 6748 B8R0.1 CCCC\C(C)=N\OC Amb27169368 [0,2,0,0,0,0|1,0,0]=3 6749 B8R0.1 CCCC\C(F)=C\CO Amb28315526 [0,2,0,0,0,0|1,0,0]=3 6750 B8R0.1 CCCC\C(I)=C\CO Amb28057014 [0,2,0,0,0,0|1,0,0]=3 6751 B8R0.1 CCCC\C(N)=C\C#N Amb28312838 [0,2,0,0,0,0|2,0,0]=4 6752 B8R0.1 CCCC\C(N)=N\OC Amb27837654 [0,2,0,0,0,0|1,0,0]=3 6753 B8R0.1 CCCC\C(O)=C\C=O Amb27257932 [0,2,0,0,0,0|0,0,0]=2 6754 B8R0.1 CCCC\C([O-])=C\C#N Amb32671470 [0,2,0,0,0,0|1,0,1]=4 6755 B8R0.1 CCCNC(=N)COC Amb27454619 [0,2,0,0,0,0|2,0,0]=4 6756 B8R0.1 CCCNC(=N)NOC Amb28349383 [0,2,0,0,0,0|2,0,0]=4 6757 B8R0.1 CCCNC(=O)C#CCl Amb27778365 [0,2,0,0,0,0|2,0,0]=4 6758 B8R0.1 CCCNC(=O)CC#N Amb6496946 [0,2,0,0,0,0|2,0,0]=4 6759 B8R0.1 CCCNC(=O)CCBr Amb17333407 [0,2,0,0,0,0|2,0,0]=4 6760 B8R0.1 CCCNC(=O)CCCl Amb1128924 [0,2,0,0,0,0|2,0,0]=4 6761 B8R0.1 CCCNC(=O)CCN Amb1133966 [0,2,0,0,0,0|2,0,0]=4 6762 B8R0.1 CCCNC(=O)CCN Amb21957303 [0,2,0,0,0,0|2,0,0]=4 6763 B8R0.1 CCCNC(=O)CCO Amb17334123 [0,2,0,0,0,0|1,0,0]=3 6764 B8R0.1 CCCNC(=O)CNC Amb2370799 [0,2,0,0,0,0|2,0,0]=4 6765 B8R0.1 CCCNC(=O)CNC Amb403043 [0,2,0,0,0,0|2,0,0]=4 6766 B8R0.1 CCCNC(=O)NCC Amb3101998 [0,2,0,0,0,0|2,0,0]=4 6767 B8R0.1 CCCNC(=O)OCC Amb17787091 [0,2,0,0,0,0|1,0,0]=3 6768 B8R0.1 CCCNC(=S)NOC Amb27455778 [0,2,0,0,0,0|1,1,0]=4 6769 B8R0.1 CCCOC(=N)CCO Amb27757381 [0,2,0,0,0,0|2,0,0]=4 6770 B8R0.1 CCCOC(=O)CC#N Amb16232992 [0,2,0,0,0,0|2,0,0]=4 6771 B8R0.1 CCCOC(=O)CCC Amb8517637 [0,2,0,0,0,0|2,0,0]=4 6772 B8R0.1 CCCOC(=O)CCN Amb19409653 [0,2,0,0,0,0|2,0,0]=4 6773 B8R0.1 CCCOC(=O)CCN Amb8874764 [0,2,0,0,0,0|2,0,0]=4 6774 B8R0.1 CCCOC(=O)CCO Amb22504631 [0,2,0,0,0,0|1,0,0]=3 6775 B8R0.1 CCCOC(=O)CCS Amb22053845 [0,2,0,0,0,0|1,1,0]=4 6776 B8R0.1 CCCOC(=O)N=[N+]=[N-] Amb27646413 [0,2,0,0,0,0|2,0,0]=4 6777 B8R0.1 CCCOC(=O)NCC Amb26642760 [0,2,0,0,0,0|2,0,0]=4 6778 B8R0.1 CCCOC(=O)NCO Amb25082749 [0,2,0,0,0,0|1,0,0]=3 6779 B8R0.1 CCCOC(=O)OCCl Amb22054704 [0,2,0,0,0,0|1,0,0]=3 6780 B8R0.1 CCCSC(=O)NCC Amb27244385 [0,2,0,0,0,0|2,0,0]=4 6781 B8R0.1 CCNC(=O)CCCCl Amb1136094 [0,2,0,0,0,0|2,0,0]=4 6782 B8R0.1 CCNC(=O)CCCN Amb6270972 [0,2,0,0,0,0|2,0,0]=4 6783 B8R0.1 CCNC(=O)CCCO Amb17231872 [0,2,0,0,0,0|2,0,0]=4 6784 B8R0.1 CCNC(=O)CCOC Amb25027996 [0,2,0,0,0,0|2,0,0]=4 6785 B8R0.1 CCNC(=O)COCC Amb3445547 [0,2,0,0,0,0|2,0,0]=4 6786 B8R0.1 CCNCC(=O)NCC Amb33334645 [0,2,0,0,0,0|2,0,0]=4 6787 B8R0.1 CCNCC(=O)NCC Amb423615 [0,2,0,0,0,0|2,0,0]=4 6788 B8R0.1 CCNCC(=O)OCC Amb33527965 [0,2,0,0,0,0|1,0,0]=3 6789 B8R0.1 CCOC(=N)CCCBr Amb20673080 [0,2,0,0,0,0|2,0,0]=4 6790 B8R0.1 CCOC(=N)CCCBr Amb26019479 [0,2,0,0,0,0|2,0,0]=4 6791 B8R0.1 CCOC(=N)CCCCl Amb8427994 [0,2,0,0,0,0|2,0,0]=4 6792 B8R0.1 CCOC(=N)CCCCl Amb9173329 [0,2,0,0,0,0|2,0,0]=4 6793 B8R0.1 CCOC(=N)CCCO Amb27390716 [0,2,0,0,0,0|2,0,0]=4 6794 B8R0.1 CCOC(=N)CCNC Amb25367262 [0,2,0,0,0,0|2,0,0]=4 6795 B8R0.1 CCOC(=N)CCOC Amb25300008 [0,2,0,0,0,0|2,0,0]=4 6796 B8R0.1 CCOC(=N)CCOC Amb31377414 [0,2,0,0,0,0|2,0,0]=4 6797 B8R0.1 CCOC(=O)CCC#N Amb3941721 [0,2,0,0,0,0|1,0,1]=4 6798 B8R0.1 CCOC(=O)CCC=O Amb17593369 [0,2,0,0,0,0|1,0,1]=4 6799 B8R0.1 CCOC(=O)CCCBr Amb3940218 [0,2,0,0,0,0|1,0,0]=3 6800 B8R0.1 CCOC(=O)CCCCl Amb1153203 [0,2,0,0,0,0|1,0,0]=3 6801 B8R0.1 CCOC(=O)CCCN Amb2720231 [0,2,0,0,0,0|1,0,0]=3 6802 B8R0.1 CCOC(=O)CCCN Amb3938993 [0,2,0,0,0,0|1,0,0]=3 6803 B8R0.1 CCOC(=O)CCCO Amb22733346 [0,2,0,0,0,0|1,0,0]=3 6804 B8R0.1 CCOC(=O)CCCS Amb27424650 [0,2,0,0,0,0|1,0,0]=3 6805 B8R0.1 CCOC(=O)CCNC Amb28934933 [0,2,0,0,0,0|1,0,0]=3 6806 B8R0.1 CCOC(=O)CCNC Amb9026169 [0,2,0,0,0,0|1,0,0]=3 6807 B8R0.1 CCOC(=O)CCNN Amb23504114 [0,2,0,0,0,0|2,0,0]=4 6808 B8R0.1 CCOC(=O)CCNO Amb27406192 [0,2,0,0,0,0|2,0,0]=4 6809 B8R0.1 CCOC(=O)CCON Amb24481776 [0,2,0,0,0,0|2,0,0]=4 6810 B8R0.1 CCOC(=O)CNOC Amb25072690 [0,2,0,0,0,0|2,0,0]=4 6811 B8R0.1 CCOC(=O)COCCl Amb28066573 [0,2,0,0,0,0|2,0,0]=4 6812 B8R0.1 CCOC(=O)CONC Amb27780565 [0,2,0,0,0,0|2,0,0]=4 6813 B8R0.1 CCOC(=O)CSCC Amb7755283 [0,2,0,0,0,0|1,0,0]=3 6814 B8R0.1 CCOC(=O)CSCCl Amb27267833 [0,2,0,0,0,0|2,0,0]=4 6815 B8R0.1 CCOC(=O)NCCCl Amb10601693 [0,2,0,0,0,0|2,0,0]=4 6816 B8R0.1 CCOC(=O)NCCN Amb18304505 [0,2,0,0,0,0|2,0,0]=4 6817 B8R0.1 CCOC(=O)NCCN Amb33552162 [0,2,0,0,0,0|2,0,0]=4 6818 B8R0.1 CCOC(=O)NCCO Amb3939457 [0,2,0,0,0,0|2,0,0]=4 6819 B8R0.1 CCOC(=O)NCOC Amb27391112 [0,2,0,0,0,0|2,0,0]=4 6820 B8R0.1 CCOC(=O)NCSC Amb27856739 [0,2,0,0,0,0|2,0,0]=4 6821 B8R0.1 CCOC(=O)OCCBr Amb24480075 [0,2,0,0,0,0|2,0,0]=4 6822 B8R0.1 CCOC(=O)OCCO Amb28072969 [0,2,0,0,0,0|2,0,0]=4 6823 B8R0.1 CCOC(=O)OCCS Amb26511404 [0,2,0,0,0,0|2,0,0]=4 6824 B8R0.1 CCOC(=O)SCCCl Amb27453639 [0,2,0,0,0,0|2,0,0]=4 6825 B8R0.1 CCOCC(=N)OCC Amb25095949 [0,2,0,0,0,0|2,0,0]=4 6826 B8R0.1 CCOCC(=O)CSC Amb27838440 [0,2,0,0,0,0|1,1,0]=4 6827 B8R0.1 CCOCC(=O)N=C=O Amb27816899 [0,2,0,0,0,0|1,0,1]=4 6828 B8R0.1 CCOCC(=O)N=[N+]=[N-] Amb25951661 [0,2,0,0,0,0|2,0,0]=4 6829 B8R0.1 CCOCC(=O)OCC Amb2720920 [0,2,0,0,0,0|1,0,0]=3 6830 B8R0.1 CCOCC(=O)OCCl Amb32677195 [0,2,0,0,0,0|1,0,0]=3 6831 B8R0.1 CCOCC(=O)\C=N\O Amb27232490 [0,2,0,0,0,0|1,0,0]=3 6832 B8R0.1 CCONC(=O)CCO Amb27826995 [0,2,0,0,0,0|2,0,0]=4 6833 B8R0.1 CCONC(=O)NOC Amb27837582 [0,2,0,0,0,0|2,0,0]=4 6834 B8R0.1 CCSC(=O)CCCBr Amb27440205 [0,2,0,0,0,0|1,1,0]=4 6835 B8R0.1 CCSC(=O)CCCCl Amb27412565 [0,2,0,0,0,0|1,1,0]=4 6836 B8R0.1 CCSCC(=O)CCN Amb33324045 [0,2,0,0,0,0|2,0,0]=4 6837 B8R0.1 CCSCC(=O)CNC Amb33324042 [0,2,0,0,0,0|2,0,0]=4 6838 B8R0.1 CC\C=C\C(=O)COC Amb27793962 [0,2,0,0,0,0|0,0,2]=4 6839 B8R0.1 CC\C=C\C(=O)NOC Amb27396752 [0,2,0,0,0,0|0,0,2]=4 6840 B8R0.1 CC\C=C\C(=O)OCC Amb22008263 [0,2,0,0,0,0|0,0,2]=4 6841 B8R0.1 CNCC(=O)CCOC Amb33377830 [0,2,0,0,0,0|2,0,0]=4 6842 B8R0.1 CNCC(=O)CCSC Amb33198762 [0,2,0,0,0,0|2,0,0]=4 6843 B8R0.1 CNCCC(=O)NC#N Amb27950076 [0,2,0,0,0,0|2,0,0]=4 6844 B8R0.1 CNCCS(=O)COC Amb28193873 [0,2,0,0,0,0|2,0,0]=4 6845 B8R0.1 COCC(=O)CCC=O Amb28343164 [0,2,0,0,0,0|1,0,1]=4 6846 B8R0.1 COCC(=O)CCCCl Amb27838444 [0,2,0,0,0,0|1,0,0]=3 6847 B8R0.1 COCC(=O)CCCO Amb27869244 [0,2,0,0,0,0|1,0,0]=3 6848 B8R0.1 COCC(=O)NCCCl Amb25889490 [0,2,0,0,0,0|2,0,0]=4 6849 B8R0.1 COCC(=O)NCCF Amb27222484 [0,2,0,0,0,0|2,0,0]=4 6850 B8R0.1 COCC(=O)NCCN Amb1142190 [0,2,0,0,0,0|2,0,0]=4 6851 B8R0.1 COCC(=O)NCCN Amb33620906 [0,2,0,0,0,0|2,0,0]=4 6852 B8R0.1 COCC(=O)NCCO Amb25828239 [0,2,0,0,0,0|2,0,0]=4 6853 B8R0.1 COCC(=O)OCCBr Amb33276573 [0,2,0,0,0,0|2,0,0]=4 6854 B8R0.1 COCC(=O)OCCCl Amb28137490 [0,2,0,0,0,0|2,0,0]=4 6855 B8R0.1 COCC(=O)OCCO Amb28366893 [0,2,0,0,0,0|2,0,0]=4 6856 B8R0.1 COCCC(=O)CC#N Amb9210310 [0,2,0,0,0,0|2,0,0]=4 6857 B8R0.1 COCCC(=O)CCN Amb33377832 [0,2,0,0,0,0|2,0,0]=4 6858 B8R0.1 COCCC(=O)COC Amb27441027 [0,2,0,0,0,0|1,0,0]=3 6859 B8R0.1 COCCC(=O)NOC Amb27776650 [0,2,0,0,0,0|1,0,0]=3 6860 B8R0.1 COCC\C(N)=N\OC Amb27768584 [0,2,0,0,0,0|2,0,0]=4 6861 B8R0.1 COCNC(=O)NCO Amb25979392 [0,2,0,0,0,0|2,0,0]=4 6862 B8R0.1 CONC(=O)CCC=O Amb27837664 [0,2,0,0,0,0|1,0,1]=4 6863 B8R0.1 CONC(=O)CCCO Amb27810629 [0,2,0,0,0,0|1,0,0]=3 6864 B8R0.1 CONC(=O)CSSC Amb27837673 [0,2,0,0,0,0|2,0,0]=4 6865 B8R0.1 CONC(=O)NCCF Amb27837628 [0,2,0,0,0,0|2,0,0]=4 6866 B8R0.1 CONC(=O)NCCO Amb27649685 [0,2,0,0,0,0|2,0,0]=4 6867 B8R0.1 CONCC(=O)NOC Amb27660592 [0,2,0,0,0,0|2,0,0]=4 6868 B8R0.1 CSCCC(=O)CC#N Amb28182720 [0,2,0,0,0,0|2,0,0]=4 6869 B8R0.1 CSCCC(=O)CCN Amb33198765 [0,2,0,0,0,0|2,0,0]=4 6870 B8R0.1 CSCCC(=O)N=C=S Amb27856541 [0,2,0,0,0,0|1,1,0]=4 6871 B8R0.1 C\C(=C/CO)CCCN Amb27469758 [0,2,0,0,0,0|2,0,0]=4 6872 B8R0.1 C\C=C\C(=O)CCCC Amb22043314 [0,2,0,0,0,0|1,0,0]=3 6873 B8R0.1 C\C=C\C(=O)NCCC Amb26018237 [0,2,0,0,0,0|2,0,0]=4 6874 B8R0.1 C\C=C\C(O)CCCC Amb4605888 [0,2,0,0,0,0|1,0,1]=4 6875 B8R0.1 N#CNC(=O)CCCCl Amb27404834 [0,2,0,0,0,0|2,0,0]=4 6876 B8R0.1 NCCNC(=O)CCO Amb27624387 [0,2,0,0,0,0|2,0,0]=4 6877 B8R0.1 NOCC(=O)NCCO Amb27494090 [0,2,0,0,0,0|2,0,0]=4 6878 B8R0.1 O=C(CCBr)CCCCl Amb24434557 [0,2,0,0,0,0|2,0,0]=4 6879 B8R0.1 O=C(CCO)NCCO Amb28197638 [0,2,0,0,0,0|2,0,0]=4 6880 B8R0.1 O=C=NC(=O)CCCCl Amb17593678 [0,2,0,0,0,0|1,0,1]=4 6881 B8R0.1 [C-]#[N+]CCC(=O)OCC Amb2592648 [0,2,0,0,0,0|1,0,1]=4 6882 B8R0.3 C#CC(=O)C(C)CCO Amb28125122 [0,2,0,0,0,0|2,0,0]=4 6883 B8R0.3 C#CC(=O)C(C)CNC Amb27250908 [0,2,0,0,0,0|2,0,0]=4 6884 B8R0.3 C#CC(=O)C(C)CSC Amb28064285 [0,2,0,0,0,0|2,0,0]=4 6885 B8R0.3 C#CC(=O)N(O)CCC Amb29849692 [0,2,0,0,0,0|2,0,0]=4 6886 B8R0.3 C#CC(=O)[C@@H](N)CCC Amb35662325 [0,2,0,0,0,0|1,0,0]=3 6887 B8R0.3 C#CC(=O)[C@H](N)CCC Amb35659947 [0,2,0,0,0,0|1,0,0]=3 6888 B8R0.3 C#CC(O)C(C)CCC Amb2721691 [0,2,0,0,0,0|1,0,1]=4 6889 B8R0.3 C#CC(O)C(N)CCC Amb30024095 [0,2,0,0,0,0|1,0,1]=4 6890 B8R0.3 C#CC(O)[C@@H](N)CCC Amb29889767 [0,2,0,0,0,0|1,0,1]=4 6891 B8R0.3 C#CC(O)[C@H](N)CCC Amb35662326 [0,2,0,0,0,0|1,0,1]=4 6892 B8R0.3 C#CCC(C)C(=O)OC Amb18115942 [0,2,0,0,0,0|0,0,2]=4 6893 B8R0.3 C#CCC(N)C(=O)OC Amb24426865 [0,2,0,0,0,0|0,0,2]=4 6894 B8R0.3 C#CCC(N)C(=O)OC Amb32663324 [0,2,0,0,0,0|0,0,2]=4 6895 B8R0.3 C#CC[C@@H](N)C(=O)OC Amb26919399 [0,2,0,0,0,0|0,0,2]=4 6896 B8R0.3 C#CC[C@H](N)C(=O)OC Amb22746034 [0,2,0,0,0,0|0,0,2]=4 6897 B8R0.3 C#CC[C@H](N)C(=O)OC Amb27870421 [0,2,0,0,0,0|0,0,2]=4 6898 B8R0.3 C#C[C@@H](O)[C@H](C)CCC Amb28315429 [0,2,0,0,0,0|1,0,1]=4 6899 B8R0.3 C=C(C#N)C(O)CCC Amb18642324 [0,2,0,0,0,0|2,0,0]=4 6900 B8R0.3 C=C(CBr)C(C)CCC Amb33434199 [0,2,0,0,0,0|2,0,0]=4 6901 B8R0.3 C=C(CCC)C(=O)OC Amb25689366 [0,2,0,0,0,0|0,0,1]=3 6902 B8R0.3 C=C(CCO)C(=O)OC Amb27258056 [0,2,0,0,0,0|1,0,1]=4 6903 B8R0.3 C=C(CN)C(C)CCC Amb33321097 [0,2,0,0,0,0|2,0,0]=4 6904 B8R0.3 C=C(CNC)C(=O)OC Amb27968604 [0,2,0,0,0,0|1,0,1]=4 6905 B8R0.3 C=C(COC)C(=O)OC Amb27172332 [0,2,0,0,0,0|1,0,1]=4 6906 B8R0.3 C=C(OCC)C(=O)OC Amb26329484 [0,2,0,0,0,0|1,0,1]=4 6907 B8R0.3 C=CC(=C)C(O)CCC Amb27187900 [0,2,0,0,0,0|2,0,0]=4 6908 B8R0.3 C=CC(=O)C(C)CCC Amb25967399 [0,2,0,0,0,0|1,0,0]=3 6909 B8R0.3 C=CC(=O)C(C)OCC Amb25720653 [0,2,0,0,0,0|2,0,0]=4 6910 B8R0.3 C=CC(=O)C(N)CCC Amb27251910 [0,2,0,0,0,0|1,0,0]=3 6911 B8R0.3 C=CC(=O)C(O)CCC Amb27461859 [0,2,0,0,0,0|1,0,0]=3 6912 B8R0.3 C=CC(O)C(C)CCC Amb24461689 [0,2,0,0,0,0|1,0,1]=4 6913 B8R0.3 C=CC(O)C(O)CCC Amb27779738 [0,2,0,0,0,0|1,0,1]=4 6914 B8R0.3 C=CCC(C)C(=O)OC Amb27787724 [0,2,0,0,0,0|0,0,2]=4 6915 B8R0.3 C=CCC(Cl)C(=O)OC Amb25365264 [0,2,0,0,0,0|0,0,2]=4 6916 B8R0.3 C=CCC(N)C(=O)NO Amb28322025 [0,2,0,0,0,0|0,0,2]=4 6917 B8R0.3 C=CCC(N)C(=O)OC Amb18642703 [0,2,0,0,0,0|0,0,2]=4 6918 B8R0.3 C=CCC(N)C(=O)OC Amb22757544 [0,2,0,0,0,0|0,0,2]=4 6919 B8R0.3 C=CCC(O)C(=O)OC Amb28435077 [0,2,0,0,0,0|0,0,2]=4 6920 B8R0.3 C=CC[C@@H](N)C(=O)OC Amb24635550 [0,2,0,0,0,0|0,0,2]=4 6921 B8R0.3 C=CC[C@@H](N)C(=O)OC Amb33868785 [0,2,0,0,0,0|0,0,2]=4 6922 B8R0.3 C=CC[C@H](N)C(=O)OC Amb22750599 [0,2,0,0,0,0|0,0,2]=4 6923 B8R0.3 C=CC[C@H](N)C(=O)OC Amb24120340 [0,2,0,0,0,0|0,0,2]=4 6924 B8R0.3 C=C[C@@H](O)[C@H](C)CCC Amb28315525 [0,2,0,0,0,0|1,0,1]=4 6925 B8R0.3 CC#CC(N)C(=O)OC Amb27625818 [0,2,0,0,0,0|0,0,2]=4 6926 B8R0.3 CC#CC(O)C(=O)OC Amb27233768 [0,2,0,0,0,0|0,0,2]=4 6927 B8R0.3 CC(CCN)C(=O)CO Amb24478589 [0,2,0,0,0,0|1,0,0]=3 6928 B8R0.3 CC(CCN)C(=O)NN Amb27838428 [0,2,0,0,0,0|2,0,0]=4 6929 B8R0.3 CC(CCO)C(O)C=O Amb27614168 [0,2,0,0,0,0|1,0,1]=4 6930 B8R0.3 CCC(=O)C(Br)COC Amb28121135 [0,2,0,0,0,0|2,0,0]=4 6931 B8R0.3 CCC(=O)C(C)CCN Amb18832550 [0,2,0,0,0,0|2,0,0]=4 6932 B8R0.3 CCC(=O)C(C)CNC Amb27961495 [0,2,0,0,0,0|2,0,0]=4 6933 B8R0.3 CCC(=O)C(C)COC Amb27960816 [0,2,0,0,0,0|2,0,0]=4 6934 B8R0.3 CCC(=O)C(Cl)CCO Amb26477870 [0,2,0,0,0,0|2,0,0]=4 6935 B8R0.3 CCCC(=O)\C(C)=C\O Amb27838701 [0,2,0,0,0,0|1,0,1]=4 6936 B8R0.3 CCCC(=O)\C(C)=N\O Amb27627435 [0,2,0,0,0,0|1,0,1]=4 6937 B8R0.3 CCCC(=O)\C(O)=C\O Amb27206861 [0,2,0,0,0,0|0,0,2]=4 6938 B8R0.3 CCCC(Br)C(=O)CBr Amb27229993 [0,2,0,0,0,0|1,0,0]=3 6939 B8R0.3 CCCC(Br)C(=O)OC Amb20621576 [0,2,0,0,0,0|0,0,0]=2 6940 B8R0.3 CCCC(C)C(=O)CC Amb17593350 [0,2,0,0,0,0|1,0,0]=3 6941 B8R0.3 CCCC(C)C(=O)CCl Amb24568325 [0,2,0,0,0,0|1,0,0]=3 6942 B8R0.3 CCCC(C)C(=O)CN Amb25686985 [0,2,0,0,0,0|1,0,0]=3 6943 B8R0.3 CCCC(C)C(C)C=O Amb26004179 [0,2,0,0,0,0|1,0,1]=4 6944 B8R0.3 CCCC(C)C(C)CO Amb25889633 [0,2,0,0,0,0|1,0,1]=4 6945 B8R0.3 CCCC(C)C(C)ON Amb33223663 [0,2,0,0,0,0|1,0,1]=4 6946 B8R0.3 CCCC(C)C(Cl)C=O Amb18643960 [0,2,0,0,0,0|1,0,1]=4 6947 B8R0.3 CCCC(C)C(N)CO Amb27944873 [0,2,0,0,0,0|1,0,1]=4 6948 B8R0.3 CCCC(C)C(N)CO Amb28934959 [0,2,0,0,0,0|1,0,1]=4 6949 B8R0.3 CCCC(C)C(O)C#N Amb27837471 [0,2,0,0,0,0|1,0,1]=4 6950 B8R0.3 CCCC(C)C(O)CBr Amb33433844 [0,2,0,0,0,0|1,0,1]=4 6951 B8R0.3 CCCC(C)C(O)CC Amb8513254 [0,2,0,0,0,0|1,0,1]=4 6952 B8R0.3 CCCC(C)C(O)CF Amb33223686 [0,2,0,0,0,0|1,0,1]=4 6953 B8R0.3 CCCC(C)C(O)CN Amb24367529 [0,2,0,0,0,0|1,0,1]=4 6954 B8R0.3 CCCC(C)C(O)CO Amb26590486 [0,2,0,0,0,0|0,0,2]=4 6955 B8R0.3 CCCC(C)C(O)OC Amb27833644 [0,2,0,0,0,0|0,0,2]=4 6956 B8R0.3 CCCC(C)N(C)OC Amb27837631 [0,2,0,0,0,0|2,0,0]=4 6957 B8R0.3 CCCC(C)[C@@H](C)CO Amb33735566 [0,2,0,0,0,0|1,0,1]=4 6958 B8R0.3 CCCC(C)[C@@H](N)CO Amb33223654 [0,2,0,0,0,0|1,0,1]=4 6959 B8R0.3 CCCC(C)[C@@H](O)CN Amb33322327 [0,2,0,0,0,0|1,0,1]=4 6960 B8R0.3 CCCC(C)[C@H](C)CO Amb33738171 [0,2,0,0,0,0|1,0,1]=4 6961 B8R0.3 CCCC(C)[C@H](N)CO Amb33322325 [0,2,0,0,0,0|1,0,1]=4 6962 B8R0.3 CCCC(C)[C@H](O)CN Amb33322326 [0,2,0,0,0,0|1,0,1]=4 6963 B8R0.3 CCCC(C)\C(N)=N\N Amb27450913 [0,2,0,0,0,0|2,0,0]=4 6964 B8R0.3 CCCC(Cl)C(=O)NC Amb27878145 [0,2,0,0,0,0|1,0,0]=3 6965 B8R0.3 CCCC(Cl)C(=O)OF Amb28399722 [0,2,0,0,0,0|0,0,0]=2 6966 B8R0.3 CCCC(Cl)\C(Cl)=N\O Amb27659357 [0,2,0,0,0,0|1,0,0]=3 6967 B8R0.3 CCCC(N)C(=O)NC Amb9514804 [0,2,0,0,0,0|1,0,0]=3 6968 B8R0.3 CCCC(N)C(=O)NO Amb22059373 [0,2,0,0,0,0|0,0,0]=2 6969 B8R0.3 CCCC(N)C(=O)OC Amb2786376 [0,2,0,0,0,0|0,0,0]=2 6970 B8R0.3 CCCC(N)C(=O)OC Amb33549293 [0,2,0,0,0,0|0,0,0]=2 6971 B8R0.3 CCCC(N)C(O)CI Amb27492943 [0,2,0,0,0,0|1,0,1]=4 6972 B8R0.3 CCCC(N)\C(N)=N\O Amb24749079 [0,2,0,0,0,0|1,0,0]=3 6973 B8R0.3 CCCC(N)\C(O)=N\O Amb20669260 [0,2,0,0,0,0|0,0,1]=3 6974 B8R0.3 CCCC(O)C(=O)CO Amb27802691 [0,2,0,0,0,0|0,0,0]=2 6975 B8R0.3 CCCC(O)C(=O)NC Amb25944249 [0,2,0,0,0,0|1,0,0]=3 6976 B8R0.3 CCCC(O)C(=O)OC Amb23454534 [0,2,0,0,0,0|0,0,0]=2 6977 B8R0.3 CCCC(O)C(C)OC Amb28205615 [0,2,0,0,0,0|1,0,1]=4 6978 B8R0.3 CCCC(O)C(Cl)CO Amb28382769 [0,2,0,0,0,0|1,0,1]=4 6979 B8R0.3 CCCC(O)C(N)CO Amb24478778 [0,2,0,0,0,0|1,0,1]=4 6980 B8R0.3 CCCC(O)C(O)CBr Amb27659014 [0,2,0,0,0,0|1,0,1]=4 6981 B8R0.3 CCCC(O)C(O)CO Amb8514776 [0,2,0,0,0,0|0,0,2]=4 6982 B8R0.3 CCCC(O)N(C)OC Amb27956624 [0,2,0,0,0,0|2,0,0]=4 6983 B8R0.3 CCCN(C)C(=O)CBr Amb28047727 [0,2,0,0,0,0|2,0,0]=4 6984 B8R0.3 CCCN(C)C(=O)CC Amb27434979 [0,2,0,0,0,0|2,0,0]=4 6985 B8R0.3 CCCN(C)C(=O)CCl Amb8898875 [0,2,0,0,0,0|2,0,0]=4 6986 B8R0.3 CCCN(C)C(=O)CN Amb8899077 [0,2,0,0,0,0|2,0,0]=4 6987 B8R0.3 CCCN(C)C(=O)NC Amb27815056 [0,2,0,0,0,0|2,0,0]=4 6988 B8R0.3 CCCN(C)\C(N)=N\O Amb27948905 [0,2,0,0,0,0|2,0,0]=4 6989 B8R0.3 CCCN(N)C(=O)CC Amb33191590 [0,2,0,0,0,0|2,0,0]=4 6990 B8R0.3 CCCN(N)C(=O)OC Amb33191592 [0,2,0,0,0,0|1,0,0]=3 6991 B8R0.3 CCCN(O)C(=O)CBr Amb28319001 [0,2,0,0,0,0|2,0,0]=4 6992 B8R0.3 CCC[C@@H](Br)C(=O)OC Amb27166248 [0,2,0,0,0,0|0,0,0]=2 6993 B8R0.3 CCC[C@@H](C)[C@H](O)CO Amb27972550 [0,2,0,0,0,0|0,0,2]=4 6994 B8R0.3 CCC[C@@H](Cl)C(=O)OC Amb27179954 [0,2,0,0,0,0|0,0,0]=2 6995 B8R0.3 CCC[C@@H](Cl)[C@@H](O)CO Amb27984692 [0,2,0,0,0,0|0,0,2]=4 6996 B8R0.3 CCC[C@@H](N)C(=O)NN Amb27844787 [0,2,0,0,0,0|1,0,0]=3 6997 B8R0.3 CCC[C@@H](N)C(=O)NO Amb28314574 [0,2,0,0,0,0|0,0,0]=2 6998 B8R0.3 CCC[C@@H](N)C(=O)OC Amb25146086 [0,2,0,0,0,0|0,0,0]=2 6999 B8R0.3 CCC[C@@H](N)C(=O)OC Amb30526950 [0,2,0,0,0,0|0,0,0]=2 7000 B8R0.3 CCC[C@@H](O)C(=O)CO Amb27802757 [0,2,0,0,0,0|0,0,0]=2 7001 B8R0.3 CCC[C@@H](O)C(=O)OC Amb28344665 [0,2,0,0,0,0|0,0,0]=2 7002 B8R0.3 CCC[C@@H](O)[C@@H](Cl)CO Amb27858711 [0,2,0,0,0,0|1,0,1]=4 7003 B8R0.3 CCC[C@@H](O)[C@@H](F)CO Amb27980595 [0,2,0,0,0,0|1,0,1]=4 7004 B8R0.3 CCC[C@@H](O)[C@H](O)CCl Amb27257549 [0,2,0,0,0,0|1,0,1]=4 7005 B8R0.3 CCC[C@H](Br)C(=O)OC Amb28346240 [0,2,0,0,0,0|0,0,0]=2 7006 B8R0.3 CCC[C@H](C)C(=O)OC Amb28344077 [0,2,0,0,0,0|0,0,0]=2 7007 B8R0.3 CCC[C@H](C)[C@@H](O)CO Amb28069434 [0,2,0,0,0,0|0,0,2]=4 7008 B8R0.3 CCC[C@H](C)[C@H](O)CO Amb27457975 [0,2,0,0,0,0|0,0,2]=4 7009 B8R0.3 CCC[C@H](F)C(=O)CC Amb28351547 [0,2,0,0,0,0|1,0,0]=3 7010 B8R0.3 CCC[C@H](N)C(=O)NC Amb25991661 [0,2,0,0,0,0|1,0,0]=3 7011 B8R0.3 CCC[C@H](N)C(=O)OC Amb10844887 [0,2,0,0,0,0|0,0,0]=2 7012 B8R0.3 CCC[C@H](N)C(=O)OC Amb17942871 [0,2,0,0,0,0|0,0,0]=2 7013 B8R0.3 CCC[C@H](O)C(=O)CO Amb27838685 [0,2,0,0,0,0|0,0,0]=2 7014 B8R0.3 CCC[C@H](O)C(C)OC Amb27838750 [0,2,0,0,0,0|1,0,1]=4 7015 B8R0.3 CCC[C@H](O)[C@@H](N)CO Amb28455449 [0,2,0,0,0,0|1,0,1]=4 7016 B8R0.3 CCC[C@H](O)[C@@H](O)CC Amb28315486 [0,2,0,0,0,0|1,0,1]=4 7017 B8R0.3 CCC[C@H](O)[C@@H](O)CO Amb27831452 [0,2,0,0,0,0|0,0,2]=4 7018 B8R0.3 CCC\C(C)=C(/F)CO Amb28315467 [0,2,0,0,0,0|1,0,1]=4 7019 B8R0.3 CCNC(=O)C(=O)OC Amb27810841 [0,2,0,0,0,0|1,0,1]=4 7020 B8R0.3 CCNC(C)C(=O)NC Amb32674962 [0,2,0,0,0,0|2,0,0]=4 7021 B8R0.3 CCNC(C)C(=O)NC Amb7758141 [0,2,0,0,0,0|2,0,0]=4 7022 B8R0.3 CCNC(C)C(=O)OC Amb19003120 [0,2,0,0,0,0|1,0,0]=3 7023 B8R0.3 CCNC(C)C(=O)OC Amb32751752 [0,2,0,0,0,0|1,0,0]=3 7024 B8R0.3 CCN[C@@H](C)C(=O)OC Amb9228630 [0,2,0,0,0,0|1,0,0]=3 7025 B8R0.3 CCOC(=N)C(=O)OC Amb24657206 [0,2,0,0,0,0|1,0,1]=4 7026 B8R0.3 CCOC(=O)C(=O)O[K] Amb22043915 [0,2,0,0,0,0|1,0,1]=4 7027 B8R0.3 CCOC(Br)C(=O)OC Amb28342296 [0,2,0,0,0,0|1,0,0]=3 7028 B8R0.3 CCOC(C)C(=N)OC Amb28141396 [0,2,0,0,0,0|2,0,0]=4 7029 B8R0.3 CCOC(C)C(=O)C=O Amb26045242 [0,2,0,0,0,0|1,0,1]=4 7030 B8R0.3 CCOC(C)C(=O)CN Amb33425731 [0,2,0,0,0,0|2,0,0]=4 7031 B8R0.3 CCOC(C)C(=O)NN Amb2081553 [0,2,0,0,0,0|2,0,0]=4 7032 B8R0.3 CCOC(C)C(=O)NN Amb9172212 [0,2,0,0,0,0|2,0,0]=4 7033 B8R0.3 CCOC(C)\C(N)=N\O Amb19515269 [0,2,0,0,0,0|2,0,0]=4 7034 B8R0.3 CCON(C)C(=O)OC Amb27806974 [0,2,0,0,0,0|2,0,0]=4 7035 B8R0.3 CCO[C@@H](C)C(=O)OC Amb28060813 [0,2,0,0,0,0|1,0,0]=3 7036 B8R0.3 CCSC(C)C(=O)NN Amb28124227 [0,2,0,0,0,0|2,0,0]=4 7037 B8R0.3 CCSC(C)\C(N)=N\O Amb28130333 [0,2,0,0,0,0|2,0,0]=4 7038 B8R0.3 CCSC(Cl)C(=O)OC Amb27845442 [0,2,0,0,0,0|1,0,0]=3 7039 B8R0.3 CC\C=C(/C)C(=O)OC Amb22360680 [0,2,0,0,0,0|0,0,2]=4 7040 B8R0.3 CC\C=C(\C)C(=O)NO Amb28454269 [0,2,0,0,0,0|0,0,2]=4 7041 B8R0.3 CC\C=C(\C)C(=O)OC Amb27798467 [0,2,0,0,0,0|0,0,2]=4 7042 B8R0.3 CC\C=C(\N)C(=O)OC Amb27255558 [0,2,0,0,0,0|0,0,2]=4 7043 B8R0.3 CN(CCO)C(=O)CO Amb5798177 [0,2,0,0,0,0|2,0,0]=4 7044 B8R0.3 CNC(=O)C(Br)CCBr Amb27750735 [0,2,0,0,0,0|2,0,0]=4 7045 B8R0.3 CNC(=O)C(C)CCN Amb26863529 [0,2,0,0,0,0|2,0,0]=4 7046 B8R0.3 CNC(=O)[C@@H](N)CCN Amb28197475 [0,2,0,0,0,0|2,0,0]=4 7047 B8R0.3 CNCC(C)C(=O)NC Amb20623735 [0,2,0,0,0,0|2,0,0]=4 7048 B8R0.3 CNCC(C)C(=O)NO Amb28120671 [0,2,0,0,0,0|1,0,0]=3 7049 B8R0.3 CNCC(C)C(=O)OC Amb9288459 [0,2,0,0,0,0|1,0,0]=3 7050 B8R0.3 CNCC(C)\C(N)=N\O Amb24707863 [0,2,0,0,0,0|2,0,0]=4 7051 B8R0.3 CNCC(N)C(=O)OC Amb27758128 [0,2,0,0,0,0|1,0,0]=3 7052 B8R0.3 COC(=O)C(Br)CCBr Amb4441764 [0,2,0,0,0,0|1,0,0]=3 7053 B8R0.3 COC(=O)C(Br)CCCl Amb27424625 [0,2,0,0,0,0|1,0,0]=3 7054 B8R0.3 COC(=O)C(Br)CSC Amb28321151 [0,2,0,0,0,0|1,0,0]=3 7055 B8R0.3 COC(=O)C(C)CC#N Amb17334094 [0,2,0,0,0,0|1,0,1]=4 7056 B8R0.3 COC(=O)C(C)CC=O Amb18642746 [0,2,0,0,0,0|1,0,1]=4 7057 B8R0.3 COC(=O)C(C)CCBr Amb26493267 [0,2,0,0,0,0|1,0,0]=3 7058 B8R0.3 COC(=O)C(C)CCCl Amb16230918 [0,2,0,0,0,0|1,0,0]=3 7059 B8R0.3 COC(=O)C(C)CCN Amb26438013 [0,2,0,0,0,0|1,0,0]=3 7060 B8R0.3 COC(=O)C(C)CCN Amb31156338 [0,2,0,0,0,0|1,0,0]=3 7061 B8R0.3 COC(=O)C(C)CON Amb27944891 [0,2,0,0,0,0|2,0,0]=4 7062 B8R0.3 COC(=O)C(C)CSC Amb28203970 [0,2,0,0,0,0|1,0,0]=3 7063 B8R0.3 COC(=O)C(F)CCN Amb22388532 [0,2,0,0,0,0|1,0,0]=3 7064 B8R0.3 COC(=O)C(N)CC#N Amb26573884 [0,2,0,0,0,0|1,0,1]=4 7065 B8R0.3 COC(=O)C(N)CCBr Amb2695255 [0,2,0,0,0,0|1,0,0]=3 7066 B8R0.3 COC(=O)C(N)CCBr Amb4296941 [0,2,0,0,0,0|1,0,0]=3 7067 B8R0.3 COC(=O)C(N)CCCl Amb27855259 [0,2,0,0,0,0|1,0,0]=3 7068 B8R0.3 COC(=O)C(N)CCF Amb25066743 [0,2,0,0,0,0|1,0,0]=3 7069 B8R0.3 COC(=O)C(N)CCN Amb24113143 [0,2,0,0,0,0|1,0,0]=3 7070 B8R0.3 COC(=O)C(N)CCN Amb25733368 [0,2,0,0,0,0|1,0,0]=3 7071 B8R0.3 COC(=O)C(N)CCO Amb18305497 [0,2,0,0,0,0|1,0,0]=3 7072 B8R0.3 COC(=O)C(N)CON Amb27451370 [0,2,0,0,0,0|2,0,0]=4 7073 B8R0.3 COC(=O)C(N)CON Amb33329476 [0,2,0,0,0,0|2,0,0]=4 7074 B8R0.3 COC(=O)C(N)CSC Amb19878256 [0,2,0,0,0,0|1,0,0]=3 7075 B8R0.3 COC(=O)C(N)CSC Amb22052594 [0,2,0,0,0,0|1,0,0]=3 7076 B8R0.3 COC(=O)C(O)CC#N Amb25716720 [0,2,0,0,0,0|1,0,1]=4 7077 B8R0.3 COC(=O)C(O)CCBr Amb28385691 [0,2,0,0,0,0|1,0,0]=3 7078 B8R0.3 COC(=O)C(O)CCF Amb25114455 [0,2,0,0,0,0|1,0,0]=3 7079 B8R0.3 COC(=O)C(O)CCN Amb26960420 [0,2,0,0,0,0|1,0,0]=3 7080 B8R0.3 COC(=O)C(O)CSC Amb26009506 [0,2,0,0,0,0|1,0,0]=3 7081 B8R0.3 COC(=O)N(C)CCBr Amb27984717 [0,2,0,0,0,0|2,0,0]=4 7082 B8R0.3 COC(=O)N(C)CCCl Amb25916438 [0,2,0,0,0,0|2,0,0]=4 7083 B8R0.3 COC(=O)N(C)CCN Amb18975991 [0,2,0,0,0,0|2,0,0]=4 7084 B8R0.3 COC(=O)N(C)CCN Amb32667515 [0,2,0,0,0,0|2,0,0]=4 7085 B8R0.3 COC(=O)N(C)CCO Amb28049300 [0,2,0,0,0,0|2,0,0]=4 7086 B8R0.3 COC(=O)[C@@H](N)CCBr Amb2695271 [0,2,0,0,0,0|1,0,0]=3 7087 B8R0.3 COC(=O)[C@@H](N)CCBr Amb4296950 [0,2,0,0,0,0|1,0,0]=3 7088 B8R0.3 COC(=O)[C@@H](N)CCI Amb27806573 [0,2,0,0,0,0|1,0,0]=3 7089 B8R0.3 COC(=O)[C@@H](N)CCN Amb25727598 [0,2,0,0,0,0|1,0,0]=3 7090 B8R0.3 COC(=O)[C@@H](N)CCN Amb32658006 [0,2,0,0,0,0|1,0,0]=3 7091 B8R0.3 COC(=O)[C@@H](N)CCO Amb24746756 [0,2,0,0,0,0|1,0,0]=3 7092 B8R0.3 COC(=O)[C@@H](N)CSC Amb15701265 [0,2,0,0,0,0|1,0,0]=3 7093 B8R0.3 COC(=O)[C@@H](N)CSC Amb17322841 [0,2,0,0,0,0|1,0,0]=3 7094 B8R0.3 COC(=O)[C@@H](O)CCN Amb25146066 [0,2,0,0,0,0|1,0,0]=3 7095 B8R0.3 COC(=O)[C@@H](O)CCN Amb33457506 [0,2,0,0,0,0|1,0,0]=3 7096 B8R0.3 COC(=O)[C@@H](O)CCO Amb27406740 [0,2,0,0,0,0|1,0,0]=3 7097 B8R0.3 COC(=O)[C@H](C)CC=O Amb28388611 [0,2,0,0,0,0|1,0,1]=4 7098 B8R0.3 COC(=O)[C@H](C)CCO Amb28134520 [0,2,0,0,0,0|1,0,0]=3 7099 B8R0.3 COC(=O)[C@H](N)CCBr Amb2695267 [0,2,0,0,0,0|1,0,0]=3 7100 B8R0.3 COC(=O)[C@H](N)CCO Amb26475851 [0,2,0,0,0,0|1,0,0]=3 7101 B8R0.3 COC(=O)[C@H](N)CON Amb27949646 [0,2,0,0,0,0|2,0,0]=4 7102 B8R0.3 COC(=O)[C@H](N)CSC Amb27788444 [0,2,0,0,0,0|1,0,0]=3 7103 B8R0.3 COC(=O)[C@H](O)CCBr Amb27863444 [0,2,0,0,0,0|1,0,0]=3 7104 B8R0.3 COC(=O)[C@H](O)CCO Amb28315513 [0,2,0,0,0,0|1,0,0]=3 7105 B8R0.3 COCC(Br)C(=O)OC Amb10070673 [0,2,0,0,0,0|1,0,0]=3 7106 B8R0.3 COCC(Cl)C(=N)OC Amb27657220 [0,2,0,0,0,0|2,0,0]=4 7107 B8R0.3 COCC(Cl)C(=O)OC Amb27477958 [0,2,0,0,0,0|1,0,0]=3 7108 B8R0.3 COCC(N)C(=O)NO Amb27838499 [0,2,0,0,0,0|1,0,0]=3 7109 B8R0.3 COCC(N)C(=O)OC Amb23454660 [0,2,0,0,0,0|1,0,0]=3 7110 B8R0.3 COCC(N)C(=O)OC Amb32941874 [0,2,0,0,0,0|1,0,0]=3 7111 B8R0.3 COCC(O)C(=O)OC Amb23596463 [0,2,0,0,0,0|1,0,0]=3 7112 B8R0.3 COCN(C)C(=O)CO Amb27472523 [0,2,0,0,0,0|2,0,0]=4 7113 B8R0.3 COCN(C)C(=O)OC Amb27201767 [0,2,0,0,0,0|2,0,0]=4 7114 B8R0.3 COC[C@@H](N)C(=O)OC Amb33871640 [0,2,0,0,0,0|1,0,0]=3 7115 B8R0.3 COC[C@@H](O)C(=O)CO Amb27180388 [0,2,0,0,0,0|1,0,0]=3 7116 B8R0.3 COC[C@@H](O)[C@H](O)C=O Amb28121213 [0,2,0,0,0,0|1,0,1]=4 7117 B8R0.3 COC[C@H](N)C(=O)OC Amb27882809 [0,2,0,0,0,0|1,0,0]=3 7118 B8R0.3 CONC(C)C(=O)OC Amb32729489 [0,2,0,0,0,0|2,0,0]=4 7119 B8R0.3 CSCC(C)C(=O)NN Amb27207902 [0,2,0,0,0,0|2,0,0]=4 7120 B8R0.3 CSCC(C)\C(N)=N\O Amb27217313 [0,2,0,0,0,0|2,0,0]=4 7121 B8R0.3 CSCC(N)C(=O)NN Amb27951018 [0,2,0,0,0,0|2,0,0]=4 7122 B8R0.3 CSCC(O)C(=O)CO Amb28141435 [0,2,0,0,0,0|1,0,0]=3 7123 B8R0.3 C\C=C(/Cl)C(O)CCC Amb28346365 [0,2,0,0,0,0|2,0,0]=4 7124 B8R0.3 C\C=C\C(Br)C(=O)OC Amb27476466 [0,2,0,0,0,0|0,0,2]=4 7125 B8R0.3 NC(CCO)C(O)C=O Amb28123154 [0,2,0,0,0,0|1,0,1]=4 7126 B8R0.6 C#CC(=O)CCCCC Amb27844075 [0,2,0,0,0,0|1,0,0]=3 7127 B8R0.6 C#CC(=O)CCNCC Amb27252840 [0,2,0,0,0,0|1,0,0]=3 7128 B8R0.6 C#CC(=O)COCCN Amb28194342 [0,2,0,0,0,0|2,0,0]=4 7129 B8R0.6 C#CC(=O)CSCCC Amb27436447 [0,2,0,0,0,0|1,0,0]=3 7130 B8R0.6 C#CC(=O)NCCCF Amb27977478 [0,2,0,0,0,0|2,0,0]=4 7131 B8R0.6 C#CC(=O)NCCCN Amb18296191 [0,2,0,0,0,0|2,0,0]=4 7132 B8R0.6 C#CC(=O)NCCOC Amb26516143 [0,2,0,0,0,0|2,0,0]=4 7133 B8R0.6 C#CC(=O)NOCCC Amb35735987 [0,2,0,0,0,0|2,0,0]=4 7134 B8R0.6 C#CC(=O)OCCCC Amb25839203 [0,2,0,0,0,0|1,0,0]=3 7135 B8R0.6 C#CC(O)CCCCC Amb2721717 [0,2,0,0,0,0|1,0,1]=4 7136 B8R0.6 C#CC(O)CCCCN Amb28341771 [0,2,0,0,0,0|1,0,1]=4 7137 B8R0.6 C#CC(O)CNCCC Amb28189676 [0,2,0,0,0,0|1,0,1]=4 7138 B8R0.6 C#CC(O)OCCCC Amb27432239 [0,2,0,0,0,0|1,0,1]=4 7139 B8R0.6 C#CCCCC(=O)CBr Amb27164981 [0,2,0,0,0,0|1,0,1]=4 7140 B8R0.6 C#CCCCC(=O)CC Amb27837514 [0,2,0,0,0,0|1,0,1]=4 7141 B8R0.6 C#CCCCC(=O)CN Amb27788268 [0,2,0,0,0,0|1,0,1]=4 7142 B8R0.6 C#CCCCC(=O)NC Amb27482425 [0,2,0,0,0,0|1,0,1]=4 7143 B8R0.6 C#CCCCC(=O)NN Amb28342617 [0,2,0,0,0,0|1,0,1]=4 7144 B8R0.6 C#CCCCC(=O)OC Amb2721693 [0,2,0,0,0,0|0,0,1]=3 7145 B8R0.6 C#CCCCC(=O)SC Amb27457790 [0,2,0,0,0,0|0,1,1]=4 7146 B8R0.6 C#CCCNC(=O)OC Amb24477847 [0,2,0,0,0,0|0,0,2]=4 7147 B8R0.6 C#CCCOC(=O)CO Amb27632704 [0,2,0,0,0,0|0,0,2]=4 7148 B8R0.6 C#CCNCC(=O)NO Amb28410283 [0,2,0,0,0,0|0,0,2]=4 7149 B8R0.6 C#CCNCC(=O)OC Amb6706474 [0,2,0,0,0,0|0,0,2]=4 7150 B8R0.6 C#CCOCC(=O)OC Amb9208653 [0,2,0,0,0,0|0,0,2]=4 7151 B8R0.6 C#C[C@@H](O)CCCCC Amb8516365 [0,2,0,0,0,0|1,0,1]=4 7152 B8R0.6 C#C[C@H](O)CCCCC Amb8516404 [0,2,0,0,0,0|1,0,1]=4 7153 B8R0.6 C=C(C=O)CCCCC Amb18642442 [0,2,0,0,0,0|1,0,0]=3 7154 B8R0.6 C=C(C=O)CCCCCl Amb27621755 [0,2,0,0,0,0|1,0,0]=3 7155 B8R0.6 C=C(CBr)CCCCC Amb27875113 [0,2,0,0,0,0|2,0,0]=4 7156 B8R0.6 C=C(CC)CCCCCl Amb27430621 [0,2,0,0,0,0|2,0,0]=4 7157 B8R0.6 C=C(CC)CCCCO Amb25057130 [0,2,0,0,0,0|2,0,0]=4 7158 B8R0.6 C=C(CC)CNCCC Amb27456809 [0,2,0,0,0,0|2,0,0]=4 7159 B8R0.6 C=C(CC)NCCCC Amb27230099 [0,2,0,0,0,0|2,0,0]=4 7160 B8R0.6 C=C(CCCCCl)OC Amb27470874 [0,2,0,0,0,0|1,0,0]=3 7161 B8R0.6 C=C(CCl)COCCC Amb27629932 [0,2,0,0,0,0|2,0,0]=4 7162 B8R0.6 C=C(CN)CSCCC Amb27771737 [0,2,0,0,0,0|2,0,0]=4 7163 B8R0.6 C=C(CO)CCCC#N Amb27801561 [0,2,0,0,0,0|1,0,1]=4 7164 B8R0.6 C=C(CO)CCCCO Amb27405284 [0,2,0,0,0,0|1,0,0]=3 7165 B8R0.6 C=C(CO)CSCCO Amb27959258 [0,2,0,0,0,0|2,0,0]=4 7166 B8R0.6 C=C=CCCC(=O)OC Amb10605302 [0,2,0,0,0,0|0,0,2]=4 7167 B8R0.6 C=CC(=O)CCCCC Amb20671146 [0,2,0,0,0,0|1,0,0]=3 7168 B8R0.6 C=CC(=O)CC\C=C/C Amb27838702 [0,2,0,0,0,0|1,0,1]=4 7169 B8R0.6 C=CC(=O)COCCN Amb27410002 [0,2,0,0,0,0|2,0,0]=4 7170 B8R0.6 C=CC(=O)CSCCC Amb28041993 [0,2,0,0,0,0|1,0,0]=3 7171 B8R0.6 C=CC(=O)C\C=C/CC Amb27838780 [0,2,0,0,0,0|1,0,1]=4 7172 B8R0.6 C=CC(=O)C\C=C\CC Amb24574125 [0,2,0,0,0,0|1,0,1]=4 7173 B8R0.6 C=CC(=O)NCCCC Amb9480528 [0,2,0,0,0,0|1,0,0]=3 7174 B8R0.6 C=CC(=O)NCCCO Amb33531592 [0,2,0,0,0,0|2,0,0]=4 7175 B8R0.6 C=CC(=O)NCCOC Amb9480397 [0,2,0,0,0,0|2,0,0]=4 7176 B8R0.6 C=CC(=O)OCCCC Amb3940493 [0,2,0,0,0,0|1,0,0]=3 7177 B8R0.6 C=CC(=O)OCCCC Amb3940920 [0,2,0,0,0,0|1,0,0]=3 7178 B8R0.6 C=CC(=O)OCCCN Amb24120374 [0,2,0,0,0,0|2,0,0]=4 7179 B8R0.6 C=CC(=O)OCCCN Amb30585183 [0,2,0,0,0,0|2,0,0]=4 7180 B8R0.6 C=CC(=O)OCCCO Amb22167329 [0,2,0,0,0,0|2,0,0]=4 7181 B8R0.6 C=CC(=O)OCCOC Amb8515845 [0,2,0,0,0,0|2,0,0]=4 7182 B8R0.6 C=CC(=O)OCCSC Amb17940077 [0,2,0,0,0,0|2,0,0]=4 7183 B8R0.6 C=CC(=O)\C=C\CCC Amb33448444 [0,2,0,0,0,0|1,0,1]=4 7184 B8R0.6 C=CC(O)CCCCBr Amb27666905 [0,2,0,0,0,0|1,0,1]=4 7185 B8R0.6 C=CC(O)CCCCC Amb3940384 [0,2,0,0,0,0|1,0,1]=4 7186 B8R0.6 C=CC(O)CCCCO Amb28193458 [0,2,0,0,0,0|1,0,1]=4 7187 B8R0.6 C=CC(O)CSCCC Amb28200246 [0,2,0,0,0,0|1,0,1]=4 7188 B8R0.6 C=CCCCC(=C)C=O Amb27802486 [0,2,0,0,0,0|1,0,1]=4 7189 B8R0.6 C=CCCCC(=O)CBr Amb27966828 [0,2,0,0,0,0|1,0,1]=4 7190 B8R0.6 C=CCCCC(=O)CC Amb27249620 [0,2,0,0,0,0|1,0,1]=4 7191 B8R0.6 C=CCCCC(=O)OC Amb22730759 [0,2,0,0,0,0|0,0,1]=3 7192 B8R0.6 C=CCCOC(=O)CO Amb27487083 [0,2,0,0,0,0|0,0,2]=4 7193 B8R0.6 C=CCNCC(=O)NO Amb27755815 [0,2,0,0,0,0|0,0,2]=4 7194 B8R0.6 C=CCNCC(=O)OC Amb6706546 [0,2,0,0,0,0|0,0,2]=4 7195 B8R0.6 C=CCOCC(=O)CO Amb27256454 [0,2,0,0,0,0|0,0,2]=4 7196 B8R0.6 C=CCOCC(=O)NO Amb28204931 [0,2,0,0,0,0|0,0,2]=4 7197 B8R0.6 C=CCOCC(=O)OC Amb7793827 [0,2,0,0,0,0|0,0,2]=4 7198 B8R0.6 C=CCSCC(=O)NO Amb27837659 [0,2,0,0,0,0|0,0,2]=4 7199 B8R0.6 C=COCCC(=O)OC Amb27394977 [0,2,0,0,0,0|0,0,2]=4 7200 B8R0.6 C=C[C@@H](O)CCCCC Amb8513277 [0,2,0,0,0,0|1,0,1]=4 7201 B8R0.6 C=C[C@H](O)CCCCC Amb8515093 [0,2,0,0,0,0|1,0,1]=4 7202 B8R0.6 CC#CCCC(O)C=O Amb27219115 [0,2,0,0,0,0|0,0,2]=4 7203 B8R0.6 CC#CCNC(=O)OC Amb27266040 [0,2,0,0,0,0|0,0,2]=4 7204 B8R0.6 CC(CCCCN)NO Amb27956523 [0,2,0,0,0,0|1,0,1]=4 7205 B8R0.6 CC(CO)CCCCO Amb27751851 [0,2,0,0,0,0|1,0,1]=4 7206 B8R0.6 CCC(=O)CCCCO Amb27867195 [0,2,0,0,0,0|1,0,0]=3 7207 B8R0.6 CCC(=O)CSCCCl Amb28399270 [0,2,0,0,0,0|2,0,0]=4 7208 B8R0.6 CCC(=O)CSCCO Amb4165967 [0,2,0,0,0,0|2,0,0]=4 7209 B8R0.6 CCC(=O)NCCCBr Amb9209422 [0,2,0,0,0,0|2,0,0]=4 7210 B8R0.6 CCC(=O)NCCCCl Amb3886595 [0,2,0,0,0,0|2,0,0]=4 7211 B8R0.6 CCC(=O)NCCCI Amb27222536 [0,2,0,0,0,0|2,0,0]=4 7212 B8R0.6 CCC(=O)NCCCN Amb6280448 [0,2,0,0,0,0|2,0,0]=4 7213 B8R0.6 CCC(=O)NCCCO Amb5797471 [0,2,0,0,0,0|2,0,0]=4 7214 B8R0.6 CCC(=O)OCCCBr Amb27262082 [0,2,0,0,0,0|2,0,0]=4 7215 B8R0.6 CCC(=O)OCCCO Amb28138647 [0,2,0,0,0,0|2,0,0]=4 7216 B8R0.6 CCC(=O)OCCOC Amb27977811 [0,2,0,0,0,0|2,0,0]=4 7217 B8R0.6 CCC(O)CCCCCl Amb27786918 [0,2,0,0,0,0|1,0,1]=4 7218 B8R0.6 CCC(O)CCCCO Amb27762946 [0,2,0,0,0,0|1,0,1]=4 7219 B8R0.6 CCC(O)CCCNC Amb27655789 [0,2,0,0,0,0|1,0,1]=4 7220 B8R0.6 CCC(O)CCCOC Amb28249167 [0,2,0,0,0,0|1,0,1]=4 7221 B8R0.6 CCCC#CC(=O)OC Amb8517413 [0,2,0,0,0,0|0,0,1]=3 7222 B8R0.6 CCCCCC(=O)CC Amb8513554 [0,2,0,0,0,0|1,0,0]=3 7223 B8R0.6 CCCCCC(=O)CO Amb27956467 [0,2,0,0,0,0|0,0,0]=2 7224 B8R0.6 CCCCCC(=O)CS Amb27750258 [0,2,0,0,0,0|0,1,0]=3 7225 B8R0.6 CCCCCC(=O)NN Amb6540616 [0,2,0,0,0,0|1,0,0]=3 7226 B8R0.6 CCCCCC(=O)NO Amb2720996 [0,2,0,0,0,0|0,0,0]=2 7227 B8R0.6 CCCCCC(=O)OC Amb6608968 [0,2,0,0,0,0|0,0,0]=2 7228 B8R0.6 CCCCCC(C)CO Amb21618749 [0,2,0,0,0,0|1,0,1]=4 7229 B8R0.6 CCCCCC(Cl)C=O Amb18643792 [0,2,0,0,0,0|1,0,1]=4 7230 B8R0.6 CCCCCC(N)CO Amb24524295 [0,2,0,0,0,0|1,0,1]=4 7231 B8R0.6 CCCCCC(O)C#N Amb9295066 [0,2,0,0,0,0|1,0,1]=4 7232 B8R0.6 CCCCCC(O)C=O Amb18642802 [0,2,0,0,0,0|0,0,1]=3 7233 B8R0.6 CCCCCC(O)CF Amb22546481 [0,2,0,0,0,0|1,0,1]=4 7234 B8R0.6 CCCCCC(O)CN Amb8630208 [0,2,0,0,0,0|1,0,1]=4 7235 B8R0.6 CCCCCC(O)CO Amb22227711 [0,2,0,0,0,0|0,0,2]=4 7236 B8R0.6 CCCCCC(O)CS Amb27404970 [0,2,0,0,0,0|0,1,1]=4 7237 B8R0.6 CCCCCN(C)N=O Amb10070585 [0,2,0,0,0,0|2,0,0]=4 7238 B8R0.6 CCCCC[C@@H](C)C=O Amb28351479 [0,2,0,0,0,0|1,0,1]=4 7239 B8R0.6 CCCCC[C@@H](C)CO Amb28318700 [0,2,0,0,0,0|1,0,1]=4 7240 B8R0.6 CCCCC[C@@H](O)C#N Amb27593479 [0,2,0,0,0,0|1,0,1]=4 7241 B8R0.6 CCCCC[C@@H](O)CC Amb25708717 [0,2,0,0,0,0|1,0,1]=4 7242 B8R0.6 CCCCC[C@@H](O)CO Amb28281704 [0,2,0,0,0,0|0,0,2]=4 7243 B8R0.6 CCCCC[C@H](Cl)C=O Amb28400198 [0,2,0,0,0,0|1,0,1]=4 7244 B8R0.6 CCCCC[C@H](O)C=O Amb28198840 [0,2,0,0,0,0|0,0,1]=3 7245 B8R0.6 CCCCC[C@H](O)CC Amb25326807 [0,2,0,0,0,0|1,0,1]=4 7246 B8R0.6 CCCCC[C@H](O)CO Amb27762354 [0,2,0,0,0,0|0,0,2]=4 7247 B8R0.6 CCCCC\C(C)=C\Br Amb27831352 [0,2,0,0,0,0|2,0,0]=4 7248 B8R0.6 CCCCC\C(C)=N\N Amb28400606 [0,2,0,0,0,0|2,0,0]=4 7249 B8R0.6 CCCCC\C(C)=N\O Amb22338237 [0,2,0,0,0,0|1,0,0]=3 7250 B8R0.6 CCCCC\C(F)=C/Br Amb27983714 [0,2,0,0,0,0|2,0,0]=4 7251 B8R0.6 CCCCC\C(N)=N/N Amb2696449 [0,2,0,0,0,0|2,0,0]=4 7252 B8R0.6 CCCCNC(=N)C#N Amb27478758 [0,2,0,0,0,0|2,0,0]=4 7253 B8R0.6 CCCCNC(=O)CBr Amb17327510 [0,2,0,0,0,0|1,0,0]=3 7254 B8R0.6 CCCCNC(=O)CC Amb3373336 [0,2,0,0,0,0|1,0,0]=3 7255 B8R0.6 CCCCNC(=O)CCl Amb1204239 [0,2,0,0,0,0|1,0,0]=3 7256 B8R0.6 CCCCNC(=O)CN Amb21958688 [0,2,0,0,0,0|1,0,0]=3 7257 B8R0.6 CCCCNC(=O)CN Amb5783028 [0,2,0,0,0,0|1,0,0]=3 7258 B8R0.6 CCCCNC(=O)CO Amb5798171 [0,2,0,0,0,0|0,0,0]=2 7259 B8R0.6 CCCCNC(=O)NC Amb1060752 [0,2,0,0,0,0|1,0,0]=3 7260 B8R0.6 CCCCNC(=O)NN Amb8853914 [0,2,0,0,0,0|1,0,0]=3 7261 B8R0.6 CCCCNC(=O)OC Amb3364701 [0,2,0,0,0,0|0,0,0]=2 7262 B8R0.6 CCCCNC(=S)C#N Amb27424696 [0,2,0,0,0,0|1,1,0]=4 7263 B8R0.6 CCCCNC(=S)CC Amb27975765 [0,2,0,0,0,0|1,1,0]=4 7264 B8R0.6 CCCCNC(=S)NN Amb1104554 [0,2,0,0,0,0|1,1,0]=4 7265 B8R0.6 CCCCNC(=S)NO Amb10574487 [0,2,0,0,0,0|0,1,0]=3 7266 B8R0.6 CCCCN\C(C)=N/O Amb27173635 [0,2,0,0,0,0|1,0,0]=3 7267 B8R0.6 CCCCN\C(N)=N\O Amb24735707 [0,2,0,0,0,0|1,0,0]=3 7268 B8R0.6 CCCCOC(=N)CBr Amb27758698 [0,2,0,0,0,0|2,0,0]=4 7269 B8R0.6 CCCCOC(=N)CCl Amb29847969 [0,2,0,0,0,0|2,0,0]=4 7270 B8R0.6 CCCCOC(=O)C=O Amb3941041 [0,2,0,0,0,0|0,0,1]=3 7271 B8R0.6 CCCCOC(=O)CCl Amb2724515 [0,2,0,0,0,0|1,0,0]=3 7272 B8R0.6 CCCCOC(=O)CN Amb19373374 [0,2,0,0,0,0|1,0,0]=3 7273 B8R0.6 CCCCOC(=O)CN Amb3939626 [0,2,0,0,0,0|1,0,0]=3 7274 B8R0.6 CCCCOC(=O)CO Amb9277787 [0,2,0,0,0,0|0,0,0]=2 7275 B8R0.6 CCCCOC(=O)CS Amb4034596 [0,2,0,0,0,0|0,1,0]=3 7276 B8R0.6 CCCCOC(=O)C[NH3+] Amb22733556 [0,2,0,0,0,0|1,0,0]=3 7277 B8R0.6 CCCCOC(=O)NC Amb24680085 [0,2,0,0,0,0|1,0,0]=3 7278 B8R0.6 CCCCOC(=O)OC Amb25921901 [0,2,0,0,0,0|0,0,0]=2 7279 B8R0.6 CCCCOC(=S)NC Amb28120184 [0,2,0,0,0,0|1,1,0]=4 7280 B8R0.6 CCCCOC(C)CO Amb24712962 [0,2,0,0,0,0|1,0,1]=4 7281 B8R0.6 CCCCOC(O)CC Amb28429916 [0,2,0,0,0,0|1,0,1]=4 7282 B8R0.6 CCCCOS(=O)CCl Amb27863540 [0,2,0,0,0,0|2,0,0]=4 7283 B8R0.6 CCCCO[C@@H](C)CO Amb27631909 [0,2,0,0,0,0|1,0,1]=4 7284 B8R0.6 CCCCO\C(Cl)=C/Cl Amb27792254 [0,2,0,0,0,0|2,0,0]=4 7285 B8R0.6 CCCCSC(=O)CBr Amb27627822 [0,2,0,0,0,0|1,0,0]=3 7286 B8R0.6 CCCCSC(=O)CCl Amb27660104 [0,2,0,0,0,0|1,0,0]=3 7287 B8R0.6 CCCCSC(=S)NC Amb28119899 [0,2,0,0,0,0|1,1,0]=4 7288 B8R0.6 CCCCS\C(N)=N\N Amb27461477 [0,2,0,0,0,0|2,0,0]=4 7289 B8R0.6 CCCC\C=C(/Br)C=O Amb28130465 [0,2,0,0,0,0|1,0,0]=3 7290 B8R0.6 CCCC\C=C(/C)CBr Amb27865492 [0,2,0,0,0,0|2,0,0]=4 7291 B8R0.6 CCCC\C=C(/Cl)C=O Amb27949654 [0,2,0,0,0,0|1,0,0]=3 7292 B8R0.6 CCCC\C=C(\Br)C=O Amb28196734 [0,2,0,0,0,0|1,0,0]=3 7293 B8R0.6 CCCC\C=C(\C)CBr Amb27444640 [0,2,0,0,0,0|2,0,0]=4 7294 B8R0.6 CCCC\C=C(\C)CCl Amb25317209 [0,2,0,0,0,0|2,0,0]=4 7295 B8R0.6 CCCC\C=C(\C)CI Amb27879768 [0,2,0,0,0,0|2,0,0]=4 7296 B8R0.6 CCCC\C=C(\C)CN Amb28288856 [0,2,0,0,0,0|2,0,0]=4 7297 B8R0.6 CCCC\C=C(\Cl)CO Amb28315452 [0,2,0,0,0,0|1,0,0]=3 7298 B8R0.6 CCCC\C=C(\F)CO Amb27835021 [0,2,0,0,0,0|1,0,0]=3 7299 B8R0.6 CCCNCC(=O)NC Amb6714452 [0,2,0,0,0,0|1,0,0]=3 7300 B8R0.6 CCCNCC(=O)NN Amb27495361 [0,2,0,0,0,0|1,0,0]=3 7301 B8R0.6 CCCNCC(=O)NO Amb27171730 [0,2,0,0,0,0|0,0,0]=2 7302 B8R0.6 CCCNCC(=O)OC Amb28934926 [0,2,0,0,0,0|0,0,0]=2 7303 B8R0.6 CCCNCC(=O)OC Amb6687123 [0,2,0,0,0,0|0,0,0]=2 7304 B8R0.6 CCCNCC(O)CCl Amb27267938 [0,2,0,0,0,0|1,0,1]=4 7305 B8R0.6 CCCNCC(O)CF Amb28254417 [0,2,0,0,0,0|1,0,1]=4 7306 B8R0.6 CCCNCC(O)CO Amb8854777 [0,2,0,0,0,0|0,0,2]=4 7307 B8R0.6 CCCNC[C@@H](O)CC Amb27662024 [0,2,0,0,0,0|1,0,1]=4 7308 B8R0.6 CCCNC[C@@H](O)CO Amb33041826 [0,2,0,0,0,0|0,0,2]=4 7309 B8R0.6 CCCNC\C(C)=C\Cl Amb27842024 [0,2,0,0,0,0|2,0,0]=4 7310 B8R0.6 CCCNC\C(Cl)=C\Cl Amb27795480 [0,2,0,0,0,0|2,0,0]=4 7311 B8R0.6 CCCNC\C(N)=N\O Amb25147147 [0,2,0,0,0,0|1,0,0]=3 7312 B8R0.6 CCCOCC(=O)CBr Amb28319117 [0,2,0,0,0,0|1,0,0]=3 7313 B8R0.6 CCCOCC(=O)CC Amb27837457 [0,2,0,0,0,0|1,0,0]=3 7314 B8R0.6 CCCOCC(=O)CCl Amb27882673 [0,2,0,0,0,0|1,0,0]=3 7315 B8R0.6 CCCOCC(C)C=O Amb28241425 [0,2,0,0,0,0|1,0,1]=4 7316 B8R0.6 CCCOCC(O)CCl Amb28144574 [0,2,0,0,0,0|1,0,1]=4 7317 B8R0.6 CCCOCC(O)CO Amb10071476 [0,2,0,0,0,0|0,0,2]=4 7318 B8R0.6 CCCOC[C@H](O)CO Amb28049195 [0,2,0,0,0,0|0,0,2]=4 7319 B8R0.6 CCCOC\C(N)=N\O Amb8874862 [0,2,0,0,0,0|1,0,0]=3 7320 B8R0.6 CCCONC(=O)CCl Amb28399458 [0,2,0,0,0,0|2,0,0]=4 7321 B8R0.6 CCCO\C=C(/Br)C=O Amb27224779 [0,2,0,0,0,0|1,0,1]=4 7322 B8R0.6 CCCO\C=C(\C)C=O Amb27789567 [0,2,0,0,0,0|1,0,1]=4 7323 B8R0.6 CCCSCC(=O)CC Amb27837484 [0,2,0,0,0,0|1,0,0]=3 7324 B8R0.6 CCCSCC(=O)NC Amb27162536 [0,2,0,0,0,0|1,0,0]=3 7325 B8R0.6 CCCSCC(=O)OC Amb7753194 [0,2,0,0,0,0|0,0,0]=2 7326 B8R0.6 CCCSCC(N)CO Amb28364274 [0,2,0,0,0,0|1,0,1]=4 7327 B8R0.6 CCCSCC(O)CC Amb28049075 [0,2,0,0,0,0|1,0,1]=4 7328 B8R0.6 CCCSCC(O)CO Amb27858570 [0,2,0,0,0,0|0,0,2]=4 7329 B8R0.6 CCCSC[C@@H](O)CC Amb27956460 [0,2,0,0,0,0|1,0,1]=4 7330 B8R0.6 CCCSC\C(N)=N\N Amb27765151 [0,2,0,0,0,0|2,0,0]=4 7331 B8R0.6 CCCSC\C(N)=N\O Amb6680793 [0,2,0,0,0,0|1,0,0]=3 7332 B8R0.6 CCCS\C=C(\C)C=O Amb27467800 [0,2,0,0,0,0|1,0,1]=4 7333 B8R0.6 CCC\C=C/C(=O)OC Amb27423496 [0,2,0,0,0,0|0,0,1]=3 7334 B8R0.6 CCC\C=C\C(=O)CBr Amb27477837 [0,2,0,0,0,0|1,0,1]=4 7335 B8R0.6 CCC\C=C\C(=O)CC Amb26400662 [0,2,0,0,0,0|1,0,1]=4 7336 B8R0.6 CCC\C=C\C(=O)CCl Amb33220754 [0,2,0,0,0,0|1,0,1]=4 7337 B8R0.6 CCC\C=C\C(=O)CN Amb33327186 [0,2,0,0,0,0|1,0,1]=4 7338 B8R0.6 CCC\C=C\C(=O)NN Amb25852581 [0,2,0,0,0,0|1,0,1]=4 7339 B8R0.6 CCC\C=C\C(=O)OC Amb6366801 [0,2,0,0,0,0|0,0,1]=3 7340 B8R0.6 CCNCCC(=O)NC Amb28423128 [0,2,0,0,0,0|1,0,0]=3 7341 B8R0.6 CCNCCC(=O)NC Amb33528495 [0,2,0,0,0,0|1,0,0]=3 7342 B8R0.6 CCNCCC(=O)NN Amb8428177 [0,2,0,0,0,0|1,0,0]=3 7343 B8R0.6 CCNCCC(=O)OC Amb6739987 [0,2,0,0,0,0|0,0,0]=2 7344 B8R0.6 CCNCCC(O)CC Amb27483130 [0,2,0,0,0,0|1,0,1]=4 7345 B8R0.6 CCNCCN(C)OC Amb28207205 [0,2,0,0,0,0|2,0,0]=4 7346 B8R0.6 CCNCC\C(C)=C\Cl Amb27853590 [0,2,0,0,0,0|2,0,0]=4 7347 B8R0.6 CCNCC\C(N)=N/O Amb19981295 [0,2,0,0,0,0|1,0,0]=3 7348 B8R0.6 CCN\C=C\C(=O)OC Amb2386650 [0,2,0,0,0,0|0,0,2]=4 7349 B8R0.6 CCOCCC(=N)OC Amb27606548 [0,2,0,0,0,0|1,0,0]=3 7350 B8R0.6 CCOCCC(=N)OC Amb32653542 [0,2,0,0,0,0|1,0,0]=3 7351 B8R0.6 CCOCCC(=O)CC Amb27837472 [0,2,0,0,0,0|1,0,0]=3 7352 B8R0.6 CCOCCC(=O)CCl Amb27591059 [0,2,0,0,0,0|1,0,0]=3 7353 B8R0.6 CCOCCC(=O)CN Amb27253736 [0,2,0,0,0,0|1,0,0]=3 7354 B8R0.6 CCOCCC(=O)NN Amb6541358 [0,2,0,0,0,0|1,0,0]=3 7355 B8R0.6 CCOCCC(=O)OC Amb7773814 [0,2,0,0,0,0|0,0,0]=2 7356 B8R0.6 CCOCCC(Cl)CO Amb28118931 [0,2,0,0,0,0|1,0,1]=4 7357 B8R0.6 CCOCCN(C)OC Amb27837601 [0,2,0,0,0,0|2,0,0]=4 7358 B8R0.6 CCOCC[C@H](N)CO Amb27488751 [0,2,0,0,0,0|1,0,1]=4 7359 B8R0.6 CCOCC\C(N)=N\O Amb6266452 [0,2,0,0,0,0|1,0,0]=3 7360 B8R0.6 CCOCNC(=O)CCl Amb28132401 [0,2,0,0,0,0|2,0,0]=4 7361 B8R0.6 CCO\C=C\C(=O)OC Amb33356217 [0,2,0,0,0,0|0,0,2]=4 7362 B8R0.6 CCSCCC(=O)NN Amb27837509 [0,2,0,0,0,0|1,0,0]=3 7363 B8R0.6 CCSCCC(=O)OC Amb4016403 [0,2,0,0,0,0|0,0,0]=2 7364 B8R0.6 CCSCCC(N)CO Amb25820753 [0,2,0,0,0,0|1,0,1]=4 7365 B8R0.6 CCSCCC(O)C#N Amb27985378 [0,2,0,0,0,0|1,0,1]=4 7366 B8R0.6 CCSCCC(O)CN Amb24581930 [0,2,0,0,0,0|1,0,1]=4 7367 B8R0.6 CCSCCN(C)OC Amb27256037 [0,2,0,0,0,0|2,0,0]=4 7368 B8R0.6 CCSCC\C(N)=N\O Amb6680782 [0,2,0,0,0,0|1,0,0]=3 7369 B8R0.6 CCS\C=C\C(=O)OC Amb24387094 [0,2,0,0,0,0|0,0,2]=4 7370 B8R0.6 CC\C=C\CC(=O)OC Amb8517644 [0,2,0,0,0,0|0,0,1]=3 7371 B8R0.6 CN(C=O)CCCCO Amb27434543 [0,2,0,0,0,0|2,0,0]=4 7372 B8R0.6 CN(CCCCO)N=O Amb25709435 [0,2,0,0,0,0|2,0,0]=4 7373 B8R0.6 CNC(=O)CCCCBr Amb17235862 [0,2,0,0,0,0|1,0,0]=3 7374 B8R0.6 CNC(=O)CCCCN Amb27220816 [0,2,0,0,0,0|1,0,0]=3 7375 B8R0.6 CNC(=O)CCCCO Amb17231874 [0,2,0,0,0,0|1,0,0]=3 7376 B8R0.6 CNC(=O)CCCON Amb27230783 [0,2,0,0,0,0|2,0,0]=4 7377 B8R0.6 CNC(=O)CCCSC Amb18411875 [0,2,0,0,0,0|1,0,0]=3 7378 B8R0.6 CNC(=O)CCSCCl Amb27430707 [0,2,0,0,0,0|2,0,0]=4 7379 B8R0.6 CNC(=O)COCCN Amb19016737 [0,2,0,0,0,0|2,0,0]=4 7380 B8R0.6 CNC(=O)COCCN Amb24271094 [0,2,0,0,0,0|2,0,0]=4 7381 B8R0.6 CNC(=O)COCCO Amb28285253 [0,2,0,0,0,0|2,0,0]=4 7382 B8R0.6 CNC(=O)CSCCN Amb6264722 [0,2,0,0,0,0|2,0,0]=4 7383 B8R0.6 CNC(=O)CSCOC Amb27757180 [0,2,0,0,0,0|2,0,0]=4 7384 B8R0.6 CNC(=O)NCCCCl Amb13951257 [0,2,0,0,0,0|2,0,0]=4 7385 B8R0.6 CNC(=O)NCCCF Amb27843538 [0,2,0,0,0,0|2,0,0]=4 7386 B8R0.6 CNC(=O)NCCCN Amb18908303 [0,2,0,0,0,0|2,0,0]=4 7387 B8R0.6 CNC(=O)NCCCN Amb33743450 [0,2,0,0,0,0|2,0,0]=4 7388 B8R0.6 CNC(=O)NCCCO Amb27161587 [0,2,0,0,0,0|2,0,0]=4 7389 B8R0.6 CNC(=O)NCCSC Amb27452991 [0,2,0,0,0,0|2,0,0]=4 7390 B8R0.6 CNC(=O)OCCCN Amb27243133 [0,2,0,0,0,0|2,0,0]=4 7391 B8R0.6 CNC(=O)OCCCN Amb33803867 [0,2,0,0,0,0|2,0,0]=4 7392 B8R0.6 CNC(=O)OCCOC Amb24598834 [0,2,0,0,0,0|2,0,0]=4 7393 B8R0.6 CNC(=O)SCCCCl Amb27750203 [0,2,0,0,0,0|2,0,0]=4 7394 B8R0.6 CNCC#CC(=O)OC Amb33168795 [0,2,0,0,0,0|0,0,2]=4 7395 B8R0.6 CNCCCC(=O)NC Amb18303609 [0,2,0,0,0,0|1,0,0]=3 7396 B8R0.6 CNCCCC(=O)NC Amb22098814 [0,2,0,0,0,0|1,0,0]=3 7397 B8R0.6 CNCCCC(=O)NO Amb28041873 [0,2,0,0,0,0|0,0,0]=2 7398 B8R0.6 CNCCCC(=O)OC Amb7969745 [0,2,0,0,0,0|0,0,0]=2 7399 B8R0.6 CNCCCC(=O)OC Amb8841493 [0,2,0,0,0,0|0,0,0]=2 7400 B8R0.6 CNCCCC(C)OC Amb17569936 [0,2,0,0,0,0|1,0,1]=4 7401 B8R0.6 CNCCC\C(N)=N\O Amb27464123 [0,2,0,0,0,0|1,0,0]=3 7402 B8R0.6 CNC\C=C\C(=O)OC Amb26535556 [0,2,0,0,0,0|0,0,2]=4 7403 B8R0.6 COC(=N)CCCCCl Amb32941935 [0,2,0,0,0,0|1,0,0]=3 7404 B8R0.6 COC(=N)COCCO Amb27857878 [0,2,0,0,0,0|2,0,0]=4 7405 B8R0.6 COC(=O)C#CCCN Amb32656224 [0,2,0,0,0,0|0,0,2]=4 7406 B8R0.6 COC(=O)C#CCCO Amb22230912 [0,2,0,0,0,0|0,0,2]=4 7407 B8R0.6 COC(=O)CC#CCO Amb28321358 [0,2,0,0,0,0|0,0,2]=4 7408 B8R0.6 COC(=O)CCCC#N Amb8961157 [0,2,0,0,0,0|0,0,1]=3 7409 B8R0.6 COC(=O)CCCCBr Amb3940220 [0,2,0,0,0,0|0,0,0]=2 7410 B8R0.6 COC(=O)CCCCCl Amb3940767 [0,2,0,0,0,0|0,0,0]=2 7411 B8R0.6 COC(=O)CCCCI Amb4018545 [0,2,0,0,0,0|0,0,0]=2 7412 B8R0.6 COC(=O)CCCCN Amb13951283 [0,2,0,0,0,0|0,0,0]=2 7413 B8R0.6 COC(=O)CCCCN Amb18642844 [0,2,0,0,0,0|0,0,0]=2 7414 B8R0.6 COC(=O)CCCCO Amb22641583 [0,2,0,0,0,0|0,0,0]=2 7415 B8R0.6 COC(=O)CCCCS Amb27218229 [0,2,0,0,0,0|0,0,0]=2 7416 B8R0.6 COC(=O)CCCON Amb25266351 [0,2,0,0,0,0|1,0,0]=3 7417 B8R0.6 COC(=O)CCCON Amb32753844 [0,2,0,0,0,0|1,0,0]=3 7418 B8R0.6 COC(=O)CCN=C=O Amb3905408 [0,2,0,0,0,0|1,0,1]=4 7419 B8R0.6 COC(=O)CCN=C=S Amb520874 [0,2,0,0,0,0|1,0,1]=4 7420 B8R0.6 COC(=O)CCN=[N+]=[N-] Amb22900901 [0,2,0,0,0,0|2,0,0]=4 7421 B8R0.6 COC(=O)CCSC#N Amb27624712 [0,2,0,0,0,0|1,0,1]=4 7422 B8R0.6 COC(=O)CC\C=C\Br Amb26433263 [0,2,0,0,0,0|0,0,2]=4 7423 B8R0.6 COC(=O)CNCC#N Amb6707511 [0,2,0,0,0,0|1,0,1]=4 7424 B8R0.6 COC(=O)CNCCF Amb27175508 [0,2,0,0,0,0|1,0,0]=3 7425 B8R0.6 COC(=O)CNCCN Amb27755951 [0,2,0,0,0,0|1,0,0]=3 7426 B8R0.6 COC(=O)CNCCS Amb28285258 [0,2,0,0,0,0|1,0,0]=3 7427 B8R0.6 COC(=O)COCCBr Amb27657286 [0,2,0,0,0,0|1,0,0]=3 7428 B8R0.6 COC(=O)COCCCl Amb8389878 [0,2,0,0,0,0|1,0,0]=3 7429 B8R0.6 COC(=O)COCCN Amb24401799 [0,2,0,0,0,0|1,0,0]=3 7430 B8R0.6 COC(=O)COCCN Amb33495145 [0,2,0,0,0,0|1,0,0]=3 7431 B8R0.6 COC(=O)COCCO Amb24113538 [0,2,0,0,0,0|1,0,0]=3 7432 B8R0.6 COC(=O)CSCCN Amb19268671 [0,2,0,0,0,0|1,0,0]=3 7433 B8R0.6 COC(=O)CSCCN Amb6272538 [0,2,0,0,0,0|1,0,0]=3 7434 B8R0.6 COC(=O)CSCCO Amb9245011 [0,2,0,0,0,0|1,0,0]=3 7435 B8R0.6 COC(=O)C\C=C\CBr Amb27444630 [0,2,0,0,0,0|0,0,2]=4 7436 B8R0.6 COC(=O)C\C=C\CCl Amb25084500 [0,2,0,0,0,0|0,0,2]=4 7437 B8R0.6 COC(=O)NCCC#N Amb28049746 [0,2,0,0,0,0|1,0,1]=4 7438 B8R0.6 COC(=O)NCCCF Amb27968335 [0,2,0,0,0,0|1,0,0]=3 7439 B8R0.6 COC(=O)OCCCF Amb24088642 [0,2,0,0,0,0|1,0,0]=3 7440 B8R0.6 COC(=O)\C=C\CCBr Amb22756459 [0,2,0,0,0,0|0,0,2]=4 7441 B8R0.6 COC(=O)\C=C\CCN Amb27617644 [0,2,0,0,0,0|0,0,2]=4 7442 B8R0.6 COC(=O)\C=C\CCO Amb26347391 [0,2,0,0,0,0|0,0,2]=4 7443 B8R0.6 COC(=S)SCCCF Amb27837959 [0,2,0,0,0,0|1,1,0]=4 7444 B8R0.6 COC(C)CCCCCl Amb27881913 [0,2,0,0,0,0|1,0,1]=4 7445 B8R0.6 COCC#CC(=O)OC Amb27804438 [0,2,0,0,0,0|0,0,2]=4 7446 B8R0.6 COCCCC(=O)CCl Amb28255500 [0,2,0,0,0,0|1,0,0]=3 7447 B8R0.6 COCCCC(=O)CN Amb27632511 [0,2,0,0,0,0|1,0,0]=3 7448 B8R0.6 COCCCC(=O)NN Amb8455564 [0,2,0,0,0,0|1,0,0]=3 7449 B8R0.6 COCCCC(=O)OC Amb8952328 [0,2,0,0,0,0|0,0,0]=2 7450 B8R0.6 COCCCC(C)C=O Amb28118341 [0,2,0,0,0,0|1,0,1]=4 7451 B8R0.6 COCCCC(Cl)C=O Amb28146758 [0,2,0,0,0,0|1,0,1]=4 7452 B8R0.6 COCCCC(N)CO Amb26550641 [0,2,0,0,0,0|1,0,1]=4 7453 B8R0.6 COCCCC(O)CN Amb26323215 [0,2,0,0,0,0|1,0,1]=4 7454 B8R0.6 COCCCC(O)CO Amb27588922 [0,2,0,0,0,0|0,0,2]=4 7455 B8R0.6 COCCCN(C)OC Amb27837704 [0,2,0,0,0,0|2,0,0]=4 7456 B8R0.6 COCCC\C(N)=N\O Amb9728042 [0,2,0,0,0,0|1,0,0]=3 7457 B8R0.6 COCCNC(=O)CBr Amb2090677 [0,2,0,0,0,0|2,0,0]=4 7458 B8R0.6 COCCNC(=O)CCl Amb1151070 [0,2,0,0,0,0|2,0,0]=4 7459 B8R0.6 COCCNC(=O)CI Amb28388548 [0,2,0,0,0,0|2,0,0]=4 7460 B8R0.6 COCCNC(=O)CN Amb1155607 [0,2,0,0,0,0|2,0,0]=4 7461 B8R0.6 COCCNC(=O)CN Amb19515050 [0,2,0,0,0,0|2,0,0]=4 7462 B8R0.6 COCCNC(=O)CO Amb9421655 [0,2,0,0,0,0|1,0,0]=3 7463 B8R0.6 COCCNC(=O)CS Amb27844158 [0,2,0,0,0,0|1,1,0]=4 7464 B8R0.6 COCCNC(=O)NN Amb9214804 [0,2,0,0,0,0|2,0,0]=4 7465 B8R0.6 COCCNC(=O)OC Amb3361553 [0,2,0,0,0,0|1,0,0]=3 7466 B8R0.6 COCCOC(=O)CBr Amb18602737 [0,2,0,0,0,0|2,0,0]=4 7467 B8R0.6 COCCOC(=O)CN Amb28252338 [0,2,0,0,0,0|2,0,0]=4 7468 B8R0.6 COCCOC(=O)CS Amb26859402 [0,2,0,0,0,0|1,1,0]=4 7469 B8R0.6 COCCOC(=O)OC Amb26026830 [0,2,0,0,0,0|1,0,0]=3 7470 B8R0.6 COCSCC(=O)NN Amb27483053 [0,2,0,0,0,0|2,0,0]=4 7471 B8R0.6 COCSCC(=O)OC Amb27972043 [0,2,0,0,0,0|1,0,0]=3 7472 B8R0.6 COC\C=C\C(=O)OC Amb25887192 [0,2,0,0,0,0|0,0,2]=4 7473 B8R0.6 CON(C)CCCCF Amb27837672 [0,2,0,0,0,0|2,0,0]=4 7474 B8R0.6 CON(C)CCCCN Amb28206802 [0,2,0,0,0,0|2,0,0]=4 7475 B8R0.6 CON(C)CCCSC Amb27660591 [0,2,0,0,0,0|2,0,0]=4 7476 B8R0.6 CONCCC(=O)OC Amb26511384 [0,2,0,0,0,0|1,0,0]=3 7477 B8R0.6 CO[PH](=O)OCCCCl Amb27407755 [0,2,0,0,0,0|2,0,0]=4 7478 B8R0.6 CSCCCC(C)C=O Amb27973193 [0,2,0,0,0,0|1,0,1]=4 7479 B8R0.6 CSCCCC(N)CO Amb25888586 [0,2,0,0,0,0|1,0,1]=4 7480 B8R0.6 CSCCCC(O)CN Amb25809175 [0,2,0,0,0,0|1,0,1]=4 7481 B8R0.6 CSCCC\C(N)=N\O Amb25324485 [0,2,0,0,0,0|1,0,0]=3 7482 B8R0.6 CSCCNC(=O)CBr Amb17324267 [0,2,0,0,0,0|2,0,0]=4 7483 B8R0.6 CSCCNC(=O)CCl Amb9387316 [0,2,0,0,0,0|2,0,0]=4 7484 B8R0.6 CSCCNC(=O)CS Amb27851001 [0,2,0,0,0,0|1,1,0]=4 7485 B8R0.6 CSCCNC(=O)NN Amb27869243 [0,2,0,0,0,0|2,0,0]=4 7486 B8R0.6 CSCCOC(=O)C=O Amb27645544 [0,2,0,0,0,0|1,0,1]=4 7487 B8R0.6 CSCCOC(=O)CO Amb28193244 [0,2,0,0,0,0|1,0,0]=3 7488 B8R0.6 C[C@H](CO)CCCCO Amb27804560 [0,2,0,0,0,0|1,0,1]=4 7489 B8R0.6 C\C(=C/CCCBr)CO Amb28348616 [0,2,0,0,0,0|1,0,1]=4 7490 B8R0.6 C\C(=C/CCCN)CO Amb28077171 [0,2,0,0,0,0|1,0,1]=4 7491 B8R0.6 C\C=C(/C)CCCCO Amb28385373 [0,2,0,0,0,0|2,0,0]=4 7492 B8R0.6 C\C=C(\C)CCCCBr Amb26877158 [0,2,0,0,0,0|2,0,0]=4 7493 B8R0.6 C\C=C\CCC(=O)NC Amb25339401 [0,2,0,0,0,0|1,0,1]=4 7494 B8R0.6 N#CC(O)CCCCO Amb17593356 [0,2,0,0,0,0|1,0,1]=4 7495 B8R0.6 N#CCCCC(=O)C#N Amb27835198 [0,2,0,0,0,0|1,0,1]=4 7496 B8R0.6 N#CCCCC(=O)CBr Amb27791840 [0,2,0,0,0,0|1,0,1]=4 7497 B8R0.6 N#CCCC\C(N)=N\O Amb28251882 [0,2,0,0,0,0|1,0,1]=4 7498 B8R0.6 NCC(=O)NCCCCl Amb33483904 [0,2,0,0,0,0|2,0,0]=4 7499 B8R0.6 NCC(=O)NCCCCl Amb33483921 [0,2,0,0,0,0|2,0,0]=4 7500 B8R0.6 NCC(=O)OCCCO Amb27430485 [0,2,0,0,0,0|2,0,0]=4 7501 B8R0.6 NCC(O)CCCCBr Amb27956026 [0,2,0,0,0,0|1,0,1]=4 7502 B8R0.6 NCCCCC(=O)NN Amb18061874 [0,2,0,0,0,0|1,0,0]=3 7503 B8R0.6 NCCCCC(N)CO Amb27403112 [0,2,0,0,0,0|1,0,1]=4 7504 B8R0.6 NCCCC[C@H](N)C=O Amb27230236 [0,2,0,0,0,0|1,0,1]=4 7505 B8R0.6 NCCCC[C@H](N)CO Amb25883920 [0,2,0,0,0,0|1,0,1]=4 7506 B8R0.6 NCCCC[C@H](N)CO Amb33801813 [0,2,0,0,0,0|1,0,1]=4 7507 B8R0.6 NCCCC\C(N)=N\O Amb26494974 [0,2,0,0,0,0|1,0,0]=3 7508 B8R0.6 NCCCNC(=O)CBr Amb27837527 [0,2,0,0,0,0|2,0,0]=4 7509 B8R0.6 NCCCNC(=O)CN Amb19011430 [0,2,0,0,0,0|2,0,0]=4 7510 B8R0.6 NCCCNC(=O)CO Amb28346767 [0,2,0,0,0,0|1,0,0]=3 7511 B8R0.6 NCCCNC(=O)CS Amb27391980 [0,2,0,0,0,0|1,1,0]=4 7512 B8R0.6 NCCCN\C(N)=N\O Amb27468839 [0,2,0,0,0,0|2,0,0]=4 7513 B8R0.6 NCCSCC(=O)NO Amb28455962 [0,2,0,0,0,0|1,0,0]=3 7514 B8R0.6 NC[C@H](O)CCCCBr Amb27165807 [0,2,0,0,0,0|1,0,1]=4 7515 B8R0.6 NNC(=O)CCCCS Amb27766833 [0,2,0,0,0,0|1,0,0]=3 7516 B8R0.6 NNC(=O)CSCCO Amb27432331 [0,2,0,0,0,0|2,0,0]=4 7517 B8R0.6 NNC(=O)NCCCF Amb27812049 [0,2,0,0,0,0|2,0,0]=4 7518 B8R0.6 NNC(=O)SCCCS Amb27768062 [0,2,0,0,0,0|2,0,0]=4 7519 B8R0.6 N\C(CCCCBr)=N\O Amb2695919 [0,2,0,0,0,0|1,0,0]=3 7520 B8R0.6 N\C(CCCCCl)=N\O Amb2696032 [0,2,0,0,0,0|1,0,0]=3 7521 B8R0.6 N\C(CCCCF)=N/O Amb27793943 [0,2,0,0,0,0|1,0,0]=3 7522 B8R0.6 N\N=C(/N)CCCCCl Amb2696496 [0,2,0,0,0,0|2,0,0]=4 7523 B8R0.6 O=C(CBr)NCCCF Amb28289230 [0,2,0,0,0,0|2,0,0]=4 7524 B8R0.6 O=C(CBr)NCCCO Amb17329705 [0,2,0,0,0,0|2,0,0]=4 7525 B8R0.6 O=C(CCCCBr)NO Amb27494446 [0,2,0,0,0,0|0,0,0]=2 7526 B8R0.6 O=C(CCCCCl)NO Amb28326259 [0,2,0,0,0,0|0,0,0]=2 7527 B8R0.6 O=C(CCl)NCCCCl Amb2125567 [0,2,0,0,0,0|2,0,0]=4 7528 B8R0.6 O=C(CCl)NCCCF Amb27198384 [0,2,0,0,0,0|2,0,0]=4 7529 B8R0.6 O=C(CCl)NCCCO Amb4477240 [0,2,0,0,0,0|2,0,0]=4 7530 B8R0.6 O=C(CCl)OCCCO Amb27198162 [0,2,0,0,0,0|2,0,0]=4 7531 B8R0.6 O=C(CO)NCCCO Amb5798092 [0,2,0,0,0,0|1,0,0]=3 7532 B8R0.6 O=C(CO)OCCCCl Amb27457140 [0,2,0,0,0,0|1,0,0]=3 7533 B8R0.6 O=C(CO)OCCCF Amb27765133 [0,2,0,0,0,0|1,0,0]=3 7534 B8R0.6 O=C(CS)NCCCF Amb27628663 [0,2,0,0,0,0|1,1,0]=4 7535 B8R0.6 O=C\C(F)=C\CCCCl Amb28429849 [0,2,0,0,0,0|1,0,1]=4 7536 B8R0.6 OC(CCl)CCCCCl Amb27490964 [0,2,0,0,0,0|1,0,1]=4 7537 B8R0.6 OC(CS)CCCCS Amb27487018 [0,2,0,0,0,0|0,1,1]=4 7538 B8R0.6 OCC(O)CCCCBr Amb27444663 [0,2,0,0,0,0|0,0,2]=4 7539 B8R0.6 OCCCCC(O)CBr Amb27219046 [0,2,0,0,0,0|1,0,1]=4 7540 B8R0.6 OCCCCC(O)CO Amb8513368 [0,2,0,0,0,0|0,0,2]=4 7541 B8R0.6 OC\C(F)=C\CCCCl Amb27623942 [0,2,0,0,0,0|1,0,1]=4 7542 B8R0.6 [C-]#[N+]CCCC(=O)OC Amb2688933 [0,2,0,0,0,0|0,0,1]=3 7543 B8R0.8 C#CCCC(=O)C(O)O Amb27405278 [0,2,0,0,0,0|0,0,2]=4 7544 B8R0.8 C#CCCC(=O)N(C)O Amb35735506 [0,2,0,0,0,0|0,0,2]=4 7545 B8R0.8 C#CCCC(C)C(=O)O Amb27464960 [0,2,0,0,0,0|0,0,1]=3 7546 B8R0.8 C#CCCC(C)C(N)=O Amb28341068 [0,2,0,0,0,0|1,0,1]=4 7547 B8R0.8 C#CCCC(N)C(=O)O Amb6277526 [0,2,0,0,0,0|0,0,1]=3 7548 B8R0.8 C#CCCC(N)C(N)=O Amb25703121 [0,2,0,0,0,0|1,0,1]=4 7549 B8R0.8 C#CCCC(O)C(N)=O Amb28057741 [0,2,0,0,0,0|1,0,1]=4 7550 B8R0.8 C#CCC[C@@H](N)C(=O)O Amb24088809 [0,2,0,0,0,0|0,0,1]=3 7551 B8R0.8 C#CCC[C@H](N)C(=O)O Amb24088866 [0,2,0,0,0,0|0,0,1]=3 7552 B8R0.8 C#CCC[C@H](N)C(=O)O Amb33744060 [0,2,0,0,0,0|0,0,1]=3 7553 B8R0.8 C#CCNC(C)C(=O)O Amb9327029 [0,2,0,0,0,0|0,0,2]=4 7554 B8R0.8 C#CCN[C@H](C)C(=O)O Amb27815665 [0,2,0,0,0,0|0,0,2]=4 7555 B8R0.8 C#CCOC(C)C(=O)O Amb9208661 [0,2,0,0,0,0|0,0,2]=4 7556 B8R0.8 C#CCO[C@H](C)C(=O)O Amb28042909 [0,2,0,0,0,0|0,0,2]=4 7557 B8R0.8 C#CCSC(C)C(=O)O Amb6274343 [0,2,0,0,0,0|0,0,2]=4 7558 B8R0.8 C=C(Br)C(O)CCCC Amb27978217 [0,2,0,0,0,0|1,0,1]=4 7559 B8R0.8 C=C(C)C(=O)CCCC Amb27968800 [0,2,0,0,0,0|1,0,0]=3 7560 B8R0.8 C=C(C)C(=O)CSCC Amb27950016 [0,2,0,0,0,0|2,0,0]=4 7561 B8R0.8 C=C(C)C(=O)NCCC Amb27204510 [0,2,0,0,0,0|2,0,0]=4 7562 B8R0.8 C=C(C)C(=O)OCCC Amb17933169 [0,2,0,0,0,0|2,0,0]=4 7563 B8R0.8 C=C(C)C(C)CCCO Amb28069648 [0,2,0,0,0,0|2,0,0]=4 7564 B8R0.8 C=C(C)C(Cl)CCCBr Amb27619001 [0,2,0,0,0,0|2,0,0]=4 7565 B8R0.8 C=C(C)C(Cl)CCCC Amb27433963 [0,2,0,0,0,0|2,0,0]=4 7566 B8R0.8 C=C(C)C(N)CSCC Amb27252910 [0,2,0,0,0,0|2,0,0]=4 7567 B8R0.8 C=C(C)C(O)CCCC Amb4037317 [0,2,0,0,0,0|1,0,1]=4 7568 B8R0.8 C=C(C)C(O)CCOC Amb27844656 [0,2,0,0,0,0|2,0,0]=4 7569 B8R0.8 C=C(C)C(O)CNCC Amb27814109 [0,2,0,0,0,0|2,0,0]=4 7570 B8R0.8 C=C(C)[C@H](O)CCCC Amb28205959 [0,2,0,0,0,0|1,0,1]=4 7571 B8R0.8 C=C(CCCC)C(=O)O Amb18642649 [0,2,0,0,0,0|0,0,0]=2 7572 B8R0.8 C=C(CCCC)C(C)=O Amb27260457 [0,2,0,0,0,0|1,0,0]=3 7573 B8R0.8 C=C(CCCC)C(C)O Amb27946944 [0,2,0,0,0,0|1,0,0]=3 7574 B8R0.8 C=C(CCCO)C(=O)O Amb28313844 [0,2,0,0,0,0|0,0,1]=3 7575 B8R0.8 C=C(CCCO)C(N)=O Amb27423225 [0,2,0,0,0,0|1,0,1]=4 7576 B8R0.8 C=C(CCOC)C(=O)O Amb26588153 [0,2,0,0,0,0|0,0,1]=3 7577 B8R0.8 C=C(CCSC)C(=O)O Amb27188177 [0,2,0,0,0,0|0,0,1]=3 7578 B8R0.8 C=C(COCC)C(=O)O Amb27444042 [0,2,0,0,0,0|0,0,1]=3 7579 B8R0.8 C=C(CSCC)C(=O)O Amb26023918 [0,2,0,0,0,0|0,0,1]=3 7580 B8R0.8 C=C(Cl)C(O)CNCC Amb28342104 [0,2,0,0,0,0|2,0,0]=4 7581 B8R0.8 C=C(OCOC)C(=O)O Amb27467648 [0,2,0,0,0,0|1,0,1]=4 7582 B8R0.8 C=C(\C=C\CC)C(=O)O Amb33267978 [0,2,0,0,0,0|0,0,2]=4 7583 B8R0.8 C=C=CCC(N)C(=O)O Amb25843448 [0,2,0,0,0,0|0,0,2]=4 7584 B8R0.8 C=C=CC[C@@H](N)C(=O)O Amb28070890 [0,2,0,0,0,0|0,0,2]=4 7585 B8R0.8 C=CCCC(=O)C(=O)O Amb25738669 [0,2,0,0,0,0|0,0,2]=4 7586 B8R0.8 C=CCCC(Br)C(=O)O Amb28047448 [0,2,0,0,0,0|0,0,1]=3 7587 B8R0.8 C=CCCC(C)C(=O)O Amb18642656 [0,2,0,0,0,0|0,0,1]=3 7588 B8R0.8 C=CCCC(C)C(C)=O Amb27470888 [0,2,0,0,0,0|1,0,1]=4 7589 B8R0.8 C=CCCC(N)C(=O)O Amb24383848 [0,2,0,0,0,0|0,0,1]=3 7590 B8R0.8 C=CCCC(N)C(=O)O Amb28934988 [0,2,0,0,0,0|0,0,1]=3 7591 B8R0.8 C=CCCC(N)C(N)=O Amb24333721 [0,2,0,0,0,0|1,0,1]=4 7592 B8R0.8 C=CCC[C@@H](N)C(=O)O Amb23439045 [0,2,0,0,0,0|0,0,1]=3 7593 B8R0.8 C=CCC[C@@H](N)C(N)=O Amb27168705 [0,2,0,0,0,0|1,0,1]=4 7594 B8R0.8 C=CCC[C@H](N)C(=O)O Amb28285244 [0,2,0,0,0,0|0,0,1]=3 7595 B8R0.8 C=CCC[C@H](O)C(=O)O Amb28122952 [0,2,0,0,0,0|0,0,1]=3 7596 B8R0.8 C=CCNC(C)C(=O)O Amb9326762 [0,2,0,0,0,0|0,0,2]=4 7597 B8R0.8 C=CCOC(C)C(=O)O Amb9208699 [0,2,0,0,0,0|0,0,2]=4 7598 B8R0.8 C=CCSC(C)C(=O)O Amb6273705 [0,2,0,0,0,0|0,0,2]=4 7599 B8R0.8 C=CSCC(N)C(=O)O Amb28321669 [0,2,0,0,0,0|0,0,2]=4 7600 B8R0.8 CC#CCC(=O)C(C)O Amb27667484 [0,2,0,0,0,0|0,0,2]=4 7601 B8R0.8 CC#CCC(C)C(=O)O Amb28281174 [0,2,0,0,0,0|0,0,1]=3 7602 B8R0.8 CC#CCC(C)C(C)=O Amb28049063 [0,2,0,0,0,0|1,0,1]=4 7603 B8R0.8 CC#CCC(N)C(=O)O Amb18988250 [0,2,0,0,0,0|0,0,1]=3 7604 B8R0.8 CC#CCC(N)C(=O)O Amb33551077 [0,2,0,0,0,0|0,0,1]=3 7605 B8R0.8 CC#CCC(N)C(N)=O Amb25793338 [0,2,0,0,0,0|1,0,1]=4 7606 B8R0.8 CC#CC[C@@H](N)C(=O)O Amb22746783 [0,2,0,0,0,0|0,0,1]=3 7607 B8R0.8 CC#CC[C@H](N)C(=O)O Amb27815040 [0,2,0,0,0,0|0,0,1]=3 7608 B8R0.8 CC(=O)C(=O)CCCBr Amb27955170 [0,2,0,0,0,0|1,0,1]=4 7609 B8R0.8 CC(=O)C(=O)CCCN Amb27666363 [0,2,0,0,0,0|1,0,1]=4 7610 B8R0.8 CC(=O)C(C)CCC#N Amb8394545 [0,2,0,0,0,0|1,0,1]=4 7611 B8R0.8 CC(=O)C(C)CCCF Amb27593343 [0,2,0,0,0,0|1,0,0]=3 7612 B8R0.8 CC(=O)C(C)CCCO Amb27628329 [0,2,0,0,0,0|1,0,0]=3 7613 B8R0.8 CC(=O)C(C)OCCN Amb18111235 [0,2,0,0,0,0|2,0,0]=4 7614 B8R0.8 CC(=O)C(Cl)CCCO Amb27860344 [0,2,0,0,0,0|1,0,0]=3 7615 B8R0.8 CC(=O)C(O)CCC=O Amb25965289 [0,2,0,0,0,0|1,0,1]=4 7616 B8R0.8 CC(=O)N(C)CCCBr Amb28189301 [0,2,0,0,0,0|2,0,0]=4 7617 B8R0.8 CC(=O)N(C)CCCN Amb32666496 [0,2,0,0,0,0|2,0,0]=4 7618 B8R0.8 CC(=O)N(C)CCCN Amb33533003 [0,2,0,0,0,0|2,0,0]=4 7619 B8R0.8 CC(=O)N(N)CCCN Amb27404575 [0,2,0,0,0,0|2,0,0]=4 7620 B8R0.8 CC(=O)[C@@H](N)CCCO Amb27835141 [0,2,0,0,0,0|1,0,0]=3 7621 B8R0.8 CC(C)C(=O)CCCCl Amb24340262 [0,2,0,0,0,0|2,0,0]=4 7622 B8R0.8 CC(CCC#N)C(=O)O Amb24462559 [0,2,0,0,0,0|0,0,1]=3 7623 B8R0.8 CC(CCCCl)C(=O)O Amb2720283 [0,2,0,0,0,0|0,0,0]=2 7624 B8R0.8 CC(CCCF)C(=O)O Amb25244585 [0,2,0,0,0,0|0,0,0]=2 7625 B8R0.8 CC(CCCN)C(=O)O Amb25146072 [0,2,0,0,0,0|0,0,0]=2 7626 B8R0.8 CC(CCCN)C(=O)O Amb32686960 [0,2,0,0,0,0|0,0,0]=2 7627 B8R0.8 CC(CCCN)C(N)=O Amb27667997 [0,2,0,0,0,0|1,0,0]=3 7628 B8R0.8 CC(CN=C=O)C(=O)O Amb33471309 [0,2,0,0,0,0|1,0,1]=4 7629 B8R0.8 CC(CN=C=S)C(=O)O Amb33471538 [0,2,0,0,0,0|1,0,1]=4 7630 B8R0.8 CC(CNC#N)C(=O)O Amb35634505 [0,2,0,0,0,0|1,0,1]=4 7631 B8R0.8 CC(C\C=N\O)C(=O)O Amb27217284 [0,2,0,0,0,0|1,0,1]=4 7632 B8R0.8 CC(NCCF)C(N)=O Amb27453201 [0,2,0,0,0,0|2,0,0]=4 7633 B8R0.8 CC(NCCS)C(=O)O Amb28057720 [0,2,0,0,0,0|1,0,0]=3 7634 B8R0.8 CC(NCCS)C(N)=O Amb27168964 [0,2,0,0,0,0|2,0,0]=4 7635 B8R0.8 CC(O)C(=O)CCC=O Amb28430094 [0,2,0,0,0,0|1,0,1]=4 7636 B8R0.8 CC(O)C(=O)NCCO Amb2721070 [0,2,0,0,0,0|2,0,0]=4 7637 B8R0.8 CC(O)C(=O)OCCBr Amb33276524 [0,2,0,0,0,0|2,0,0]=4 7638 B8R0.8 CC(O)C(=O)OCCCl Amb26074602 [0,2,0,0,0,0|2,0,0]=4 7639 B8R0.8 CC(O)C(=O)OCCO Amb24061251 [0,2,0,0,0,0|2,0,0]=4 7640 B8R0.8 CC(O)C(C)CCCF Amb28348330 [0,2,0,0,0,0|1,0,1]=4 7641 B8R0.8 CC(O)C(C)CCCO Amb28457820 [0,2,0,0,0,0|1,0,1]=4 7642 B8R0.8 CC(OCC#N)C(=O)O Amb27465969 [0,2,0,0,0,0|1,0,1]=4 7643 B8R0.8 CC(OCCF)C(=O)O Amb27240801 [0,2,0,0,0,0|1,0,0]=3 7644 B8R0.8 CC(OCCN)C(=O)O Amb22546285 [0,2,0,0,0,0|1,0,0]=3 7645 B8R0.8 CC(OCCO)C(=O)O Amb6680915 [0,2,0,0,0,0|1,0,0]=3 7646 B8R0.8 CC(OCCS)C(=O)O Amb27857332 [0,2,0,0,0,0|1,0,0]=3 7647 B8R0.8 CC(SCC#N)C(=O)O Amb6260833 [0,2,0,0,0,0|1,0,1]=4 7648 B8R0.8 CC(SCCCl)C(=O)O Amb27404902 [0,2,0,0,0,0|1,0,0]=3 7649 B8R0.8 CC(SCCN)C(=O)O Amb17500447 [0,2,0,0,0,0|1,0,0]=3 7650 B8R0.8 CCCCC(=O)C(=O)O Amb18642761 [0,2,0,0,0,0|0,0,0]=2 7651 B8R0.8 CCCCC(=O)C(=O)[O-] Amb32664416 [0,2,0,0,0,0|0,0,1]=3 7652 B8R0.8 CCCCC(=O)C(Br)Br Amb28120327 [0,2,0,0,0,0|1,0,0]=3 7653 B8R0.8 CCCCC(=O)C(C)=O Amb2721315 [0,2,0,0,0,0|0,0,1]=3 7654 B8R0.8 CCCCC(=O)C(C)C Amb9024769 [0,2,0,0,0,0|1,0,0]=3 7655 B8R0.8 CCCCC(=O)C(C)Cl Amb17593705 [0,2,0,0,0,0|1,0,0]=3 7656 B8R0.8 CCCCC(=O)C(C)N Amb26583107 [0,2,0,0,0,0|1,0,0]=3 7657 B8R0.8 CCCCC(=O)C(Cl)Cl Amb17594228 [0,2,0,0,0,0|1,0,0]=3 7658 B8R0.8 CCCCC(=O)C(F)Cl Amb28385384 [0,2,0,0,0,0|1,0,0]=3 7659 B8R0.8 CCCCC(=O)C(F)F Amb26859892 [0,2,0,0,0,0|1,0,0]=3 7660 B8R0.8 CCCCC(=O)[C@@H](C)O Amb25829551 [0,2,0,0,0,0|0,0,0]=2 7661 B8R0.8 CCCCC(=O)[C@H](C)O Amb25097116 [0,2,0,0,0,0|0,0,0]=2 7662 B8R0.8 CCCCC(=O)[C@H](C)[NH3+] Amb22503703 [0,2,0,0,0,0|1,0,0]=3 7663 B8R0.8 CCCCC(Br)C(=O)Br Amb22347914 [0,2,0,0,0,0|1,0,0]=3 7664 B8R0.8 CCCCC(Br)C(=O)Cl Amb17569836 [0,2,0,0,0,0|1,0,0]=3 7665 B8R0.8 CCCCC(Br)C(=O)O Amb9703129 [0,2,0,0,0,0|0,0,0]=2 7666 B8R0.8 CCCCC(Br)C(C)O Amb27400344 [0,2,0,0,0,0|1,0,1]=4 7667 B8R0.8 CCCCC(Br)C(N)=O Amb19514624 [0,2,0,0,0,0|1,0,0]=3 7668 B8R0.8 CCCCC(Br)C(N)=S Amb27239240 [0,2,0,0,0,0|1,1,0]=4 7669 B8R0.8 CCCCC(C)=C(C)C Amb22228294 [0,2,0,0,0,0|2,0,0]=4 7670 B8R0.8 CCCCC(C)C(=O)O Amb3939937 [0,2,0,0,0,0|0,0,0]=2 7671 B8R0.8 CCCCC(C)C(C)=O Amb4034582 [0,2,0,0,0,0|1,0,0]=3 7672 B8R0.8 CCCCC(C)C(C)O Amb4017613 [0,2,0,0,0,0|1,0,1]=4 7673 B8R0.8 CCCCC(C)C(N)=O Amb8504697 [0,2,0,0,0,0|1,0,0]=3 7674 B8R0.8 CCCCC(C)S(=O)Cl Amb32720495 [0,2,0,0,0,0|1,0,1]=4 7675 B8R0.8 CCCCC(C)S(=O)[O-] Amb32754844 [0,2,0,0,0,0|1,0,1]=4 7676 B8R0.8 CCCCC(C)S(N)=O Amb32720496 [0,2,0,0,0,0|1,0,1]=4 7677 B8R0.8 CCCCC(C)[N+](=O)[O-] Amb27229455 [0,2,0,0,0,0|1,0,1]=4 7678 B8R0.8 CCCCC(Cl)C(=O)O Amb17593750 [0,2,0,0,0,0|0,0,0]=2 7679 B8R0.8 CCCCC(Cl)C(N)=O Amb27803407 [0,2,0,0,0,0|1,0,0]=3 7680 B8R0.8 CCCCC(F)C(=O)O Amb25238781 [0,2,0,0,0,0|0,0,0]=2 7681 B8R0.8 CCCCC(F)C(C)=O Amb27228475 [0,2,0,0,0,0|1,0,0]=3 7682 B8R0.8 CCCCC(F)C(N)=O Amb28060527 [0,2,0,0,0,0|1,0,0]=3 7683 B8R0.8 CCCCC(N)B(O)O Amb26622066 [0,2,0,0,0,0|1,0,1]=4 7684 B8R0.8 CCCCC(N)C(=O)O Amb4134813 [0,2,0,0,0,0|0,0,0]=2 7685 B8R0.8 CCCCC(N)C(C)=O Amb1099238 [0,2,0,0,0,0|1,0,0]=3 7686 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [0,2,0,0,0,0|1,0,0]=3 7687 B8R0.8 CCCCC(N)C(C)O Amb24351619 [0,2,0,0,0,0|1,0,1]=4 7688 B8R0.8 CCCCC(N)C(C)O Amb28935013 [0,2,0,0,0,0|1,0,1]=4 7689 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [0,2,0,0,0,0|1,0,0]=3 7690 B8R0.8 CCCCC(N)[PH](=O)O Amb27863480 [0,2,0,0,0,0|1,0,0]=3 7691 B8R0.8 CCCCC(O)C(=O)O Amb3941634 [0,2,0,0,0,0|0,0,0]=2 7692 B8R0.8 CCCCC(O)C(C)=O Amb27877068 [0,2,0,0,0,0|0,0,1]=3 7693 B8R0.8 CCCCC(O)C(C)C Amb4017685 [0,2,0,0,0,0|1,0,1]=4 7694 B8R0.8 CCCCC(O)C(F)F Amb27780124 [0,2,0,0,0,0|1,0,1]=4 7695 B8R0.8 CCCCC(O)C(N)=O Amb24116640 [0,2,0,0,0,0|0,0,1]=3 7696 B8R0.8 CCCCC(O)[PH](=O)O Amb27488929 [0,2,0,0,0,0|0,0,1]=3 7697 B8R0.8 CCCCC(S)C(=O)O Amb25323873 [0,2,0,0,0,0|0,0,0]=2 7698 B8R0.8 CCCCN(C)C(=O)Cl Amb17563097 [0,2,0,0,0,0|1,0,0]=3 7699 B8R0.8 CCCCN(C)C(N)=O Amb6245238 [0,2,0,0,0,0|1,0,0]=3 7700 B8R0.8 CCCCN(C)C(N)=S Amb6247550 [0,2,0,0,0,0|1,1,0]=4 7701 B8R0.8 CCCCN(N)C(C)=O Amb33191476 [0,2,0,0,0,0|1,0,0]=3 7702 B8R0.8 CCCC[C@@H](C)C(=O)O Amb24590691 [0,2,0,0,0,0|0,0,0]=2 7703 B8R0.8 CCCC[C@@H](C)[C@H](C)O Amb27763643 [0,2,0,0,0,0|1,0,1]=4 7704 B8R0.8 CCCC[C@@H](Cl)B(O)O Amb27657838 [0,2,0,0,0,0|1,0,1]=4 7705 B8R0.8 CCCC[C@@H](Cl)C(=O)O Amb27471038 [0,2,0,0,0,0|0,0,0]=2 7706 B8R0.8 CCCC[C@@H](N)C(=O)O Amb1995006 [0,2,0,0,0,0|0,0,0]=2 7707 B8R0.8 CCCC[C@@H](O)C(C)C Amb27474121 [0,2,0,0,0,0|1,0,1]=4 7708 B8R0.8 CCCC[C@H](Br)C(=O)O Amb28385588 [0,2,0,0,0,0|0,0,0]=2 7709 B8R0.8 CCCC[C@H](C)C(=O)O Amb25850678 [0,2,0,0,0,0|0,0,0]=2 7710 B8R0.8 CCCC[C@H](Cl)C(=O)Cl Amb28291526 [0,2,0,0,0,0|1,0,0]=3 7711 B8R0.8 CCCC[C@H](Cl)C(=O)O Amb27955265 [0,2,0,0,0,0|0,0,0]=2 7712 B8R0.8 CCCC[C@H](N)C(=O)O Amb1995007 [0,2,0,0,0,0|0,0,0]=2 7713 B8R0.8 CCCC[C@H](N)C(N)=O Amb9813732 [0,2,0,0,0,0|1,0,0]=3 7714 B8R0.8 CCCC[C@H](O)C(=O)O Amb27626002 [0,2,0,0,0,0|0,0,0]=2 7715 B8R0.8 CCCC[C@H](O)[C@@H](C)O Amb28139279 [0,2,0,0,0,0|0,0,2]=4 7716 B8R0.8 CCCNC(=N)S(=O)O Amb27650670 [0,2,0,0,0,0|1,0,1]=4 7717 B8R0.8 CCCNC(=O)C(=O)O Amb9303791 [0,2,0,0,0,0|0,0,1]=3 7718 B8R0.8 CCCNC(=O)C(C)=O Amb17399819 [0,2,0,0,0,0|1,0,1]=4 7719 B8R0.8 CCCNC(=O)C(C)Br Amb17324530 [0,2,0,0,0,0|2,0,0]=4 7720 B8R0.8 CCCNC(=O)C(C)Cl Amb9745738 [0,2,0,0,0,0|2,0,0]=4 7721 B8R0.8 CCCNC(=O)C(C)N Amb21958679 [0,2,0,0,0,0|2,0,0]=4 7722 B8R0.8 CCCNC(=O)C(C)N Amb431323 [0,2,0,0,0,0|2,0,0]=4 7723 B8R0.8 CCCNC(=O)C(C)O Amb9421398 [0,2,0,0,0,0|1,0,0]=3 7724 B8R0.8 CCCNC(=O)C(Cl)Cl Amb6393806 [0,2,0,0,0,0|2,0,0]=4 7725 B8R0.8 CCCNC(=O)C(F)F Amb27608055 [0,2,0,0,0,0|2,0,0]=4 7726 B8R0.8 CCCNC(=O)N(C)C Amb3101994 [0,2,0,0,0,0|2,0,0]=4 7727 B8R0.8 CCCNC(=O)N(C)O Amb27867919 [0,2,0,0,0,0|1,0,0]=3 7728 B8R0.8 CCCNC(=O)[C@@H](C)N Amb17987726 [0,2,0,0,0,0|2,0,0]=4 7729 B8R0.8 CCCNC(=O)[C@@H](C)N Amb33328683 [0,2,0,0,0,0|2,0,0]=4 7730 B8R0.8 CCCNC(=O)[C@@H](C)O Amb25317170 [0,2,0,0,0,0|1,0,0]=3 7731 B8R0.8 CCCNC(=O)[C@H](C)N Amb35750165 [0,2,0,0,0,0|2,0,0]=4 7732 B8R0.8 CCCNC(=O)[C@H](C)N Amb5783184 [0,2,0,0,0,0|2,0,0]=4 7733 B8R0.8 CCCNC(=O)[C@H](C)S Amb27950174 [0,2,0,0,0,0|1,1,0]=4 7734 B8R0.8 CCCNC(C)C(=O)O Amb9326994 [0,2,0,0,0,0|0,0,0]=2 7735 B8R0.8 CCCN[C@H](C)C(=O)O Amb28073462 [0,2,0,0,0,0|0,0,0]=2 7736 B8R0.8 CCCOC(=N)C(C)O Amb27444735 [0,2,0,0,0,0|2,0,0]=4 7737 B8R0.8 CCCOC(=O)C(=O)Cl Amb27164480 [0,2,0,0,0,0|1,0,1]=4 7738 B8R0.8 CCCOC(=O)C(=O)O Amb28399593 [0,2,0,0,0,0|0,0,1]=3 7739 B8R0.8 CCCOC(=O)C(C)=O Amb25838665 [0,2,0,0,0,0|1,0,1]=4 7740 B8R0.8 CCCOC(=O)C(C)Br Amb24351605 [0,2,0,0,0,0|2,0,0]=4 7741 B8R0.8 CCCOC(=O)C(C)Cl Amb9787445 [0,2,0,0,0,0|2,0,0]=4 7742 B8R0.8 CCCOC(=O)C(C)N Amb8874760 [0,2,0,0,0,0|2,0,0]=4 7743 B8R0.8 CCCOC(=O)C(C)O Amb3939699 [0,2,0,0,0,0|1,0,0]=3 7744 B8R0.8 CCCOC(=O)C(Cl)Cl Amb24480074 [0,2,0,0,0,0|2,0,0]=4 7745 B8R0.8 CCCOC(=O)N(C)C Amb27393446 [0,2,0,0,0,0|2,0,0]=4 7746 B8R0.8 CCCOC(=O)N(C)N Amb33191433 [0,2,0,0,0,0|2,0,0]=4 7747 B8R0.8 CCCOC(=O)[C@@H](C)Cl Amb27233619 [0,2,0,0,0,0|2,0,0]=4 7748 B8R0.8 CCCOC(=O)[C@H](C)N Amb28255132 [0,2,0,0,0,0|2,0,0]=4 7749 B8R0.8 CCCOC(=O)[C@H](C)N Amb33249867 [0,2,0,0,0,0|2,0,0]=4 7750 B8R0.8 CCCOC(=O)[C@H](C)O Amb8517137 [0,2,0,0,0,0|1,0,0]=3 7751 B8R0.8 CCCOC(C)C(=N)N Amb28049083 [0,2,0,0,0,0|2,0,0]=4 7752 B8R0.8 CCCOC(C)C(=O)O Amb8874518 [0,2,0,0,0,0|0,0,0]=2 7753 B8R0.8 CCCOC(C)C(N)=O Amb27424673 [0,2,0,0,0,0|1,0,0]=3 7754 B8R0.8 CCCOC(C)[C@@H](C)O Amb27869773 [0,2,0,0,0,0|1,0,1]=4 7755 B8R0.8 CCCSC(=S)C(=O)O Amb27808849 [0,2,0,0,0,0|0,0,1]=3 7756 B8R0.8 CCCSC(C)C(=O)O Amb6274283 [0,2,0,0,0,0|0,0,0]=2 7757 B8R0.8 CCCSC(C)C(C)O Amb27482489 [0,2,0,0,0,0|1,0,1]=4 7758 B8R0.8 CCCSC(C)C(N)=O Amb28070722 [0,2,0,0,0,0|1,0,0]=3 7759 B8R0.8 CCCSC(F)C(=O)O Amb27655346 [0,2,0,0,0,0|0,0,0]=2 7760 B8R0.8 CCCSC(N)C(=O)O Amb27865736 [0,2,0,0,0,0|0,0,0]=2 7761 B8R0.8 CCCSC(O)C(=O)O Amb27592135 [0,2,0,0,0,0|0,0,0]=2 7762 B8R0.8 CCC\C=C(/Br)C(=O)O Amb27816159 [0,2,0,0,0,0|0,0,1]=3 7763 B8R0.8 CCC\C=C(/C)C(=O)O Amb10844998 [0,2,0,0,0,0|0,0,1]=3 7764 B8R0.8 CCC\C=C(/C)C(C)=O Amb17593317 [0,2,0,0,0,0|1,0,1]=4 7765 B8R0.8 CCC\C=C(/F)C(C)=O Amb27227052 [0,2,0,0,0,0|1,0,1]=4 7766 B8R0.8 CCC\C=C(\C)[C@@H](C)O Amb27484961 [0,2,0,0,0,0|1,0,1]=4 7767 B8R0.8 CCC\C=C(\C)[N+](=O)[O-] Amb27185824 [0,2,0,0,0,0|1,0,1]=4 7768 B8R0.8 CCC\C=C(\F)C(=O)O Amb27448669 [0,2,0,0,0,0|0,0,1]=3 7769 B8R0.8 CCC\N=C(\C)C(C)=O Amb28255004 [0,2,0,0,0,0|1,0,1]=4 7770 B8R0.8 CCNCC(=O)C(C)C Amb27810782 [0,2,0,0,0,0|2,0,0]=4 7771 B8R0.8 CCNCC(=O)N(C)C Amb6250723 [0,2,0,0,0,0|2,0,0]=4 7772 B8R0.8 CCNCC(C)C(=O)O Amb13952782 [0,2,0,0,0,0|0,0,0]=2 7773 B8R0.8 CCNCC(C)C(=O)O Amb9400285 [0,2,0,0,0,0|0,0,0]=2 7774 B8R0.8 CCNCC(C)C(N)=O Amb8944545 [0,2,0,0,0,0|1,0,0]=3 7775 B8R0.8 CCNCC(O)C(N)=O Amb28049207 [0,2,0,0,0,0|1,0,0]=3 7776 B8R0.8 CCOCC(=O)C(C)C Amb27803834 [0,2,0,0,0,0|2,0,0]=4 7777 B8R0.8 CCOCC(=O)N(C)N Amb33191441 [0,2,0,0,0,0|2,0,0]=4 7778 B8R0.8 CCOCC(Br)C(=O)O Amb28458425 [0,2,0,0,0,0|0,0,0]=2 7779 B8R0.8 CCOCC(C)C(=O)O Amb9172215 [0,2,0,0,0,0|0,0,0]=2 7780 B8R0.8 CCOCC(C)C(C)O Amb24529048 [0,2,0,0,0,0|1,0,1]=4 7781 B8R0.8 CCOCC(C)C(N)=O Amb28067564 [0,2,0,0,0,0|1,0,0]=3 7782 B8R0.8 CCOCC(N)C(=O)O Amb28048685 [0,2,0,0,0,0|0,0,0]=2 7783 B8R0.8 CCOCC(N)C(=O)O Amb33542705 [0,2,0,0,0,0|0,0,0]=2 7784 B8R0.8 CCOCC(N)C(N)=O Amb26973746 [0,2,0,0,0,0|1,0,0]=3 7785 B8R0.8 CCOC[C@@H](C)C(=O)O Amb25790635 [0,2,0,0,0,0|0,0,0]=2 7786 B8R0.8 CCOC[C@@H](N)C(=O)O Amb25889733 [0,2,0,0,0,0|0,0,0]=2 7787 B8R0.8 CCOC[C@@H](N)C(=O)O Amb30585227 [0,2,0,0,0,0|0,0,0]=2 7788 B8R0.8 CCOC[C@@H](O)C(=O)O Amb33347463 [0,2,0,0,0,0|0,0,0]=2 7789 B8R0.8 CCOC[C@H](C)C(=O)O Amb10844265 [0,2,0,0,0,0|0,0,0]=2 7790 B8R0.8 CCOC[C@H](N)C(=O)O Amb22737184 [0,2,0,0,0,0|0,0,0]=2 7791 B8R0.8 CCOC[C@H](N)C(=O)O Amb24478577 [0,2,0,0,0,0|0,0,0]=2 7792 B8R0.8 CCONC(=O)[C@H](C)O Amb27806937 [0,2,0,0,0,0|2,0,0]=4 7793 B8R0.8 CCONC(C)C(N)=O Amb27228322 [0,2,0,0,0,0|2,0,0]=4 7794 B8R0.8 CCO\C=C(/Br)C(=O)O Amb27198193 [0,2,0,0,0,0|0,0,2]=4 7795 B8R0.8 CCO\C=C(/C)C(=O)O Amb27249542 [0,2,0,0,0,0|0,0,2]=4 7796 B8R0.8 CCO\C=C(\Br)C(=O)O Amb27645304 [0,2,0,0,0,0|0,0,2]=4 7797 B8R0.8 CCO\C=C(\O)C(C)=O Amb27486167 [0,2,0,0,0,0|1,0,1]=4 7798 B8R0.8 CCO\N=C(/C)C(=O)O Amb27595574 [0,2,0,0,0,0|1,0,1]=4 7799 B8R0.8 CCSCC(=O)C(C)C Amb28255428 [0,2,0,0,0,0|2,0,0]=4 7800 B8R0.8 CCSCC(=O)C(C)N Amb33324067 [0,2,0,0,0,0|2,0,0]=4 7801 B8R0.8 CCSCC(=O)C(F)F Amb33404865 [0,2,0,0,0,0|2,0,0]=4 7802 B8R0.8 CCSCC(C)C(=O)O Amb9400067 [0,2,0,0,0,0|0,0,0]=2 7803 B8R0.8 CCSCC(C)C(C)=O Amb27409600 [0,2,0,0,0,0|1,0,0]=3 7804 B8R0.8 CCSCC(N)C(=O)O Amb6257004 [0,2,0,0,0,0|0,0,0]=2 7805 B8R0.8 CCSCC(O)C(=O)O Amb27231753 [0,2,0,0,0,0|0,0,0]=2 7806 B8R0.8 CCSC[C@H](O)C(=O)O Amb27983830 [0,2,0,0,0,0|0,0,0]=2 7807 B8R0.8 CC\C=C/C(O)C(C)=O Amb28122622 [0,2,0,0,0,0|1,0,1]=4 7808 B8R0.8 CC\C=C\C(=O)C(=O)O Amb27486094 [0,2,0,0,0,0|0,0,2]=4 7809 B8R0.8 CC\C=C\C(C)C(=O)O Amb33172515 [0,2,0,0,0,0|0,0,1]=3 7810 B8R0.8 CC\C=C\C(C)C(C)=O Amb25295311 [0,2,0,0,0,0|1,0,1]=4 7811 B8R0.8 CC\C=C\C(N)C(=O)O Amb33449874 [0,2,0,0,0,0|0,0,1]=3 7812 B8R0.8 CC\C=C\C(O)C(=O)O Amb27781864 [0,2,0,0,0,0|0,0,1]=3 7813 B8R0.8 CC\C=C\[C@@H](N)C(=O)O Amb27239476 [0,2,0,0,0,0|0,0,1]=3 7814 B8R0.8 CN(C)C(=O)CCCCl Amb1128819 [0,2,0,0,0,0|2,0,0]=4 7815 B8R0.8 CN(C)C(=O)CCCN Amb10610208 [0,2,0,0,0,0|2,0,0]=4 7816 B8R0.8 CN(C)C(=O)CCCN Amb10610229 [0,2,0,0,0,0|2,0,0]=4 7817 B8R0.8 CN(C)C(=O)CCCN Amb6276022 [0,2,0,0,0,0|2,0,0]=4 7818 B8R0.8 CN(C)C(=O)CCCO Amb17231873 [0,2,0,0,0,0|2,0,0]=4 7819 B8R0.8 CN(CCCBr)C(=O)Cl Amb33296940 [0,2,0,0,0,0|2,0,0]=4 7820 B8R0.8 CN(CCCCl)C(=O)Cl Amb32668823 [0,2,0,0,0,0|2,0,0]=4 7821 B8R0.8 CNCCC(=O)N(C)C Amb22757530 [0,2,0,0,0,0|2,0,0]=4 7822 B8R0.8 CNCCC(=O)N(C)C Amb6600531 [0,2,0,0,0,0|2,0,0]=4 7823 B8R0.8 CNCCC(C)C(N)=O Amb28368198 [0,2,0,0,0,0|1,0,0]=3 7824 B8R0.8 CNCCN(C)C(=O)S Amb27473520 [0,2,0,0,0,0|1,1,0]=4 7825 B8R0.8 CNCCN(C)C(C)=O Amb20669225 [0,2,0,0,0,0|2,0,0]=4 7826 B8R0.8 CNCCN(C)C(N)=O Amb27765294 [0,2,0,0,0,0|2,0,0]=4 7827 B8R0.8 CNCCN(C)C(N)=O Amb32674843 [0,2,0,0,0,0|2,0,0]=4 7828 B8R0.8 COCCC(=O)C(=O)O Amb27959741 [0,2,0,0,0,0|0,0,1]=3 7829 B8R0.8 COCCC(=O)C(C)C Amb19514652 [0,2,0,0,0,0|2,0,0]=4 7830 B8R0.8 COCCC(=O)C(C)N Amb33377835 [0,2,0,0,0,0|2,0,0]=4 7831 B8R0.8 COCCC(=O)C(F)F Amb33400147 [0,2,0,0,0,0|2,0,0]=4 7832 B8R0.8 COCCC(=O)N(C)C Amb25147229 [0,2,0,0,0,0|2,0,0]=4 7833 B8R0.8 COCCC(=O)N(C)N Amb33191439 [0,2,0,0,0,0|2,0,0]=4 7834 B8R0.8 COCCC(Br)C(=O)Cl Amb27209614 [0,2,0,0,0,0|1,0,0]=3 7835 B8R0.8 COCCC(C)C(=O)O Amb18523823 [0,2,0,0,0,0|0,0,0]=2 7836 B8R0.8 COCCC(C)S(=O)Cl Amb32720499 [0,2,0,0,0,0|2,0,0]=4 7837 B8R0.8 COCCC(C)S(=O)[O-] Amb32754663 [0,2,0,0,0,0|1,0,1]=4 7838 B8R0.8 COCCC(C)S(N)=O Amb32720500 [0,2,0,0,0,0|2,0,0]=4 7839 B8R0.8 COCCC(Cl)C(=O)Cl Amb28118917 [0,2,0,0,0,0|1,0,0]=3 7840 B8R0.8 COCCC(Cl)C(=O)O Amb27424361 [0,2,0,0,0,0|0,0,0]=2 7841 B8R0.8 COCCC(N)C(=O)O Amb32675454 [0,2,0,0,0,0|0,0,0]=2 7842 B8R0.8 COCCC(N)C(=O)O Amb6281324 [0,2,0,0,0,0|0,0,0]=2 7843 B8R0.8 COCCC(N)C(N)=O Amb18311365 [0,2,0,0,0,0|1,0,0]=3 7844 B8R0.8 COCCC(N)C(N)=O Amb32712112 [0,2,0,0,0,0|1,0,0]=3 7845 B8R0.8 COCCC(O)C(=O)O Amb27647966 [0,2,0,0,0,0|0,0,0]=2 7846 B8R0.8 COCCN(C)C(=O)Cl Amb27595784 [0,2,0,0,0,0|2,0,0]=4 7847 B8R0.8 COCCN(C)C(=O)O Amb32677018 [0,2,0,0,0,0|1,0,0]=3 7848 B8R0.8 COCCN(C)C(N)=O Amb27475656 [0,2,0,0,0,0|2,0,0]=4 7849 B8R0.8 COCC[C@@H](N)C(=O)O Amb16183870 [0,2,0,0,0,0|0,0,0]=2 7850 B8R0.8 COCC[C@H](N)C(=O)O Amb16183872 [0,2,0,0,0,0|0,0,0]=2 7851 B8R0.8 COCC[C@H](N)C(=O)O Amb24054991 [0,2,0,0,0,0|0,0,0]=2 7852 B8R0.8 COCOC(=O)C(C)O Amb26601975 [0,2,0,0,0,0|2,0,0]=4 7853 B8R0.8 COCOC(C)C(=O)O Amb28120688 [0,2,0,0,0,0|1,0,0]=3 7854 B8R0.8 COCOC(C)C(C)=O Amb24563208 [0,2,0,0,0,0|2,0,0]=4 7855 B8R0.8 COCSC(C)C(=O)O Amb28410278 [0,2,0,0,0,0|1,0,0]=3 7856 B8R0.8 COCSC(C)C(C)=O Amb28189229 [0,2,0,0,0,0|2,0,0]=4 7857 B8R0.8 COC\C=C(\Br)C(=O)O Amb24580462 [0,2,0,0,0,0|0,0,2]=4 7858 B8R0.8 COC\C=C(\C)C(=O)O Amb27169036 [0,2,0,0,0,0|0,0,2]=4 7859 B8R0.8 COC\C=C(\F)C(=O)O Amb27872029 [0,2,0,0,0,0|0,0,2]=4 7860 B8R0.8 CONCC(N)C(N)=O Amb27216151 [0,2,0,0,0,0|2,0,0]=4 7861 B8R0.8 CO\C=C\[C@@H](N)C(=O)O Amb27427471 [0,2,0,0,0,0|0,0,2]=4 7862 B8R0.8 CPOC[C@H](N)C(=O)O Amb27424475 [0,2,0,0,0,0|1,0,0]=3 7863 B8R0.8 CSCCC(=N)C(=O)O Amb27196552 [0,2,0,0,0,0|0,0,1]=3 7864 B8R0.8 CSCCC(=O)C(=O)O Amb18643588 [0,2,0,0,0,0|0,0,1]=3 7865 B8R0.8 CSCCC(=O)C(C)N Amb33199124 [0,2,0,0,0,0|2,0,0]=4 7866 B8R0.8 CSCCC(=O)C(F)F Amb25343014 [0,2,0,0,0,0|2,0,0]=4 7867 B8R0.8 CSCCC(=O)C(N)=O Amb28042492 [0,2,0,0,0,0|1,0,1]=4 7868 B8R0.8 CSCCC(=O)N(C)C Amb27953186 [0,2,0,0,0,0|2,0,0]=4 7869 B8R0.8 CSCCC(C)C(=O)O Amb24739356 [0,2,0,0,0,0|0,0,0]=2 7870 B8R0.8 CSCCC(Cl)C(=O)O Amb27468599 [0,2,0,0,0,0|0,0,0]=2 7871 B8R0.8 CSCCC(Cl)C(N)=O Amb18185555 [0,2,0,0,0,0|1,0,0]=3 7872 B8R0.8 CSCCC(N)C(=O)O Amb9703095 [0,2,0,0,0,0|0,0,0]=2 7873 B8R0.8 CSCCC(N)C(C)=O Amb28388741 [0,2,0,0,0,0|1,0,0]=3 7874 B8R0.8 CSCCC(N)C(C)O Amb27655583 [0,2,0,0,0,0|1,0,1]=4 7875 B8R0.8 CSCCC(N)C(N)=O Amb17142872 [0,2,0,0,0,0|1,0,0]=3 7876 B8R0.8 CSCCC(N)C(N)=O Amb32752921 [0,2,0,0,0,0|1,0,0]=3 7877 B8R0.8 CSCCC(O)C(=O)O Amb18304609 [0,2,0,0,0,0|0,0,0]=2 7878 B8R0.8 CSCCC(O)C(=O)[O-] Amb8393072 [0,2,0,0,0,0|0,0,1]=3 7879 B8R0.8 CSCCC(O)C(N)=O Amb20669403 [0,2,0,0,0,0|1,0,0]=3 7880 B8R0.8 CSCC[C@@H](N)C(=O)O Amb2720567 [0,2,0,0,0,0|0,0,0]=2 7881 B8R0.8 CSCC[C@@H](N)C(=O)[O-] Amb32414686 [0,2,0,0,0,0|0,0,1]=3 7882 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [0,2,0,0,0,0|1,0,0]=3 7883 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [0,2,0,0,0,0|1,0,0]=3 7884 B8R0.8 CSCC[C@@H](O)C(=O)O Amb25124092 [0,2,0,0,0,0|0,0,0]=2 7885 B8R0.8 CSCC[C@H](Cl)C(=O)O Amb28286496 [0,2,0,0,0,0|0,0,0]=2 7886 B8R0.8 CSCC[C@H](N)C(=O)O Amb5720611 [0,2,0,0,0,0|0,0,0]=2 7887 B8R0.8 CSCC[C@H](N)C(C)=O Amb27763449 [0,2,0,0,0,0|1,0,0]=3 7888 B8R0.8 CSCC[C@H](N)C(N)=O Amb8390412 [0,2,0,0,0,0|1,0,0]=3 7889 B8R0.8 CSCC[C@H](N)C(N)=O Amb9813735 [0,2,0,0,0,0|1,0,0]=3 7890 B8R0.8 CSCC[C@H](O)C(=O)O Amb28285270 [0,2,0,0,0,0|0,0,0]=2 7891 B8R0.8 CSCOC(N)C(=O)O Amb27634144 [0,2,0,0,0,0|1,0,0]=3 7892 B8R0.8 CSCO[C@H](N)C(=O)O Amb28183053 [0,2,0,0,0,0|1,0,0]=3 7893 B8R0.8 CSOCC(N)C(=O)O Amb28285144 [0,2,0,0,0,0|1,0,0]=3 7894 B8R0.8 CSSCC(C)C(=O)O Amb27240302 [0,2,0,0,0,0|1,0,0]=3 7895 B8R0.8 CSSC[C@@H](N)C(=O)O Amb28381312 [0,2,0,0,0,0|1,0,0]=3 7896 B8R0.8 CSSC[C@H](N)C(=O)O Amb28118786 [0,2,0,0,0,0|1,0,0]=3 7897 B8R0.8 CS\C=C/[C@H](N)C(=O)O Amb26006745 [0,2,0,0,0,0|0,0,2]=4 7898 B8R0.8 CS\C=C\C(N)C(=O)O Amb27759361 [0,2,0,0,0,0|0,0,2]=4 7899 B8R0.8 C[C@@H](CCC#N)C(=O)O Amb27870712 [0,2,0,0,0,0|0,0,1]=3 7900 B8R0.8 C[C@@H](CCCN)C(=O)O Amb28314637 [0,2,0,0,0,0|0,0,0]=2 7901 B8R0.8 C[C@@H](CN=[N+]=[N-])C(=O)O Amb27955982 [0,2,0,0,0,0|2,0,0]=4 7902 B8R0.8 C[C@@H](NCCF)C(=O)O Amb28073998 [0,2,0,0,0,0|1,0,0]=3 7903 B8R0.8 C[C@@H](NCCO)C(=O)O Amb26885478 [0,2,0,0,0,0|1,0,0]=3 7904 B8R0.8 C[C@@H](O)C(=O)NCCF Amb27485671 [0,2,0,0,0,0|2,0,0]=4 7905 B8R0.8 C[C@@H](O)C(=O)OCCBr Amb33051943 [0,2,0,0,0,0|2,0,0]=4 7906 B8R0.8 C[C@@H](O)[C@H](O)CCCO Amb27982574 [0,2,0,0,0,0|1,0,1]=4 7907 B8R0.8 C[C@@H](OCCF)C(=O)O Amb27763930 [0,2,0,0,0,0|1,0,0]=3 7908 B8R0.8 C[C@@H](OCCO)C(=O)O Amb28318043 [0,2,0,0,0,0|1,0,0]=3 7909 B8R0.8 C[C@@H](SCCN)C(=O)O Amb27170977 [0,2,0,0,0,0|1,0,0]=3 7910 B8R0.8 C[C@H](NCC#N)C(=O)O Amb28079480 [0,2,0,0,0,0|1,0,1]=4 7911 B8R0.8 C[C@H](NCCO)C(=O)O Amb28058421 [0,2,0,0,0,0|1,0,0]=3 7912 B8R0.8 C[C@H](O)C(=O)NCCN Amb27838528 [0,2,0,0,0,0|2,0,0]=4 7913 B8R0.8 C[C@H](O)C(=O)OCCBr Amb33051905 [0,2,0,0,0,0|2,0,0]=4 7914 B8R0.8 C[C@H](O)C(=O)OCCO Amb28325065 [0,2,0,0,0,0|2,0,0]=4 7915 B8R0.8 C[C@H](OCCN)C(=O)O Amb27479935 [0,2,0,0,0,0|1,0,0]=3 7916 B8R0.8 C[C@H](OCCO)C(=O)O Amb27398048 [0,2,0,0,0,0|1,0,0]=3 7917 B8R0.8 C[Se]CCC(N)C(=O)O Amb8514803 [0,2,0,0,0,0|0,0,0]=2 7918 B8R0.8 C[Se]CC[C@@H](N)C(=O)O Amb31031165 [0,2,0,0,0,0|0,0,0]=2 7919 B8R0.8 C[Se]CC[C@H](N)C(=O)O Amb8514895 [0,2,0,0,0,0|0,0,0]=2 7920 B8R0.8 C\C(=C/CCN)C(=O)O Amb28397850 [0,2,0,0,0,0|0,0,2]=4 7921 B8R0.8 C\C=C/CC(=O)C(=O)O Amb27450808 [0,2,0,0,0,0|0,0,2]=4 7922 B8R0.8 C\C=C\CC(=O)C(=O)O Amb18642583 [0,2,0,0,0,0|0,0,2]=4 7923 B8R0.8 C\C=C\CC(C)C(=O)O Amb18642630 [0,2,0,0,0,0|0,0,1]=3 7924 B8R0.8 C\C=C\CC(C)C(C)=O Amb27799374 [0,2,0,0,0,0|1,0,1]=4 7925 B8R0.8 C\C=C\CC(F)C(=O)O Amb27959670 [0,2,0,0,0,0|0,0,1]=3 7926 B8R0.8 C\C=C\CC(N)C(=O)O Amb6256663 [0,2,0,0,0,0|0,0,1]=3 7927 B8R0.8 C\C=C\CC(N)C(N)=O Amb26904386 [0,2,0,0,0,0|1,0,1]=4 7928 B8R0.8 C\C=C\CC(O)C(C)=O Amb25707027 [0,2,0,0,0,0|1,0,1]=4 7929 B8R0.8 C\C=C\C[C@@H](N)C(=O)O Amb33065673 [0,2,0,0,0,0|0,0,1]=3 7930 B8R0.8 C\C=C\C[C@H](C)C(=O)O Amb28368854 [0,2,0,0,0,0|0,0,1]=3 7931 B8R0.8 C\C=C\C[C@H](C)C(C)=O Amb26891739 [0,2,0,0,0,0|1,0,1]=4 7932 B8R0.8 C\C=C\C[C@H](N)C(=O)O Amb27768785 [0,2,0,0,0,0|0,0,1]=3 7933 B8R0.8 N#CCCC(Br)C(=O)O Amb27863558 [0,2,0,0,0,0|0,0,1]=3 7934 B8R0.8 N#CCCC(N)C(=O)O Amb18642589 [0,2,0,0,0,0|0,0,1]=3 7935 B8R0.8 N#CCCC(N)C(N)=O Amb26567424 [0,2,0,0,0,0|1,0,1]=4 7936 B8R0.8 N#CCCC(O)C(=O)O Amb28239951 [0,2,0,0,0,0|0,0,1]=3 7937 B8R0.8 N#CCCC([AlH5])C(=O)O Amb31132465 [0,2,0,0,0,0|0,0,1]=3 7938 B8R0.8 N#CCC[C@@H](N)C(=O)O Amb25063958 [0,2,0,0,0,0|0,0,1]=3 7939 B8R0.8 N#CCC[C@H](N)C(=O)O Amb16183912 [0,2,0,0,0,0|0,0,1]=3 7940 B8R0.8 N#CCC[C@H](O)C(=O)O Amb28144260 [0,2,0,0,0,0|0,0,1]=3 7941 B8R0.8 N#CNCC(O)C(=O)O Amb35634509 [0,2,0,0,0,0|1,0,1]=4 7942 B8R0.8 N#CNC[C@H](O)C(=O)O Amb35634507 [0,2,0,0,0,0|1,0,1]=4 7943 B8R0.8 N#CSCC(N)C(=O)O Amb17593655 [0,2,0,0,0,0|1,0,1]=4 7944 B8R0.8 N=C(NCCO)C(=O)O Amb18124348 [0,2,0,0,0,0|1,0,1]=4 7945 B8R0.8 NC(=O)C(=O)CCCCl Amb27450674 [0,2,0,0,0,0|1,0,1]=4 7946 B8R0.8 NC(=O)C(N)CCCF Amb27424739 [0,2,0,0,0,0|1,0,0]=3 7947 B8R0.8 NC(=O)C(N)CCCO Amb33066182 [0,2,0,0,0,0|1,0,0]=3 7948 B8R0.8 NC(CCCBr)C(=O)O Amb24480263 [0,2,0,0,0,0|0,0,0]=2 7949 B8R0.8 NC(CCCCl)B(O)O Amb27491021 [0,2,0,0,0,0|1,0,1]=4 7950 B8R0.8 NC(CCCF)C(=O)O Amb25366994 [0,2,0,0,0,0|0,0,0]=2 7951 B8R0.8 NC(CCCO)C(=O)O Amb18642915 [0,2,0,0,0,0|0,0,0]=2 7952 B8R0.8 NC(CCCO)C(=O)O Amb22900028 [0,2,0,0,0,0|0,0,0]=2 7953 B8R0.8 NC(CCCS)C(=O)O Amb27947968 [0,2,0,0,0,0|0,0,0]=2 7954 B8R0.8 NC(CCNO)C(=O)O Amb28285114 [0,2,0,0,0,0|1,0,0]=3 7955 B8R0.8 NC(CN=C=S)C(=O)O Amb28281778 [0,2,0,0,0,0|1,0,1]=4 7956 B8R0.8 NC(C\C=C\Br)C(=O)O Amb27607572 [0,2,0,0,0,0|0,0,2]=4 7957 B8R0.8 NC(C\C=C\Cl)C(=O)O Amb33037023 [0,2,0,0,0,0|0,0,2]=4 7958 B8R0.8 NCCCC(Br)C(=O)O Amb17595166 [0,2,0,0,0,0|0,0,0]=2 7959 B8R0.8 NCCCC(F)C(=O)O Amb27235092 [0,2,0,0,0,0|0,0,0]=2 7960 B8R0.8 NCCCC(N)C(=O)O Amb22489477 [0,2,0,0,0,0|0,0,0]=2 7961 B8R0.8 NCCCC(N)C(=O)O Amb4006442 [0,2,0,0,0,0|0,0,0]=2 7962 B8R0.8 NCCCC(N)C(=O)O Amb9173756 [0,2,0,0,0,0|0,0,0]=2 7963 B8R0.8 NCCCC(N)C(=S)S Amb27657930 [0,2,0,0,0,0|0,2,0]=4 7964 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [0,2,0,0,0,0|1,0,0]=3 7965 B8R0.8 NCCCC(N)[PH](=O)O Amb27645413 [0,2,0,0,0,0|1,0,0]=3 7966 B8R0.8 NCCC[C@@H](N)C(=O)O Amb32411789 [0,2,0,0,0,0|0,0,0]=2 7967 B8R0.8 NCCC[C@@H](N)C(=O)O Amb6600152 [0,2,0,0,0,0|0,0,0]=2 7968 B8R0.8 NCCC[C@@H](N)C(=O)O Amb8390415 [0,2,0,0,0,0|0,0,0]=2 7969 B8R0.8 NCCC[C@H](N)C(=O)O Amb20240598 [0,2,0,0,0,0|0,0,0]=2 7970 B8R0.8 NCCC[C@H](N)C(=O)O Amb22746434 [0,2,0,0,0,0|0,0,0]=2 7971 B8R0.8 NCCC[C@H](N)C(=O)O Amb8513279 [0,2,0,0,0,0|0,0,0]=2 7972 B8R0.8 NCCC[C@H](N)C(=O)O Amb8627869 [0,2,0,0,0,0|0,0,0]=2 7973 B8R0.8 NCCC[C@H](O)C(=O)O Amb27804309 [0,2,0,0,0,0|0,0,0]=2 7974 B8R0.8 NCC\C=C(\F)C(=O)O Amb27398392 [0,2,0,0,0,0|0,0,2]=4 7975 B8R0.8 NCOCC(N)C(=O)O Amb27429950 [0,2,0,0,0,0|1,0,0]=3 7976 B8R0.8 NCOC[C@@H](N)C(=O)O Amb27233969 [0,2,0,0,0,0|1,0,0]=3 7977 B8R0.8 NC\C=C\[C@H](N)C(=O)O Amb24580033 [0,2,0,0,0,0|0,0,2]=4 7978 B8R0.8 NOCCC(N)C(=O)O Amb17593409 [0,2,0,0,0,0|1,0,0]=3 7979 B8R0.8 NOCCC(N)C(=O)O Amb21858490 [0,2,0,0,0,0|1,0,0]=3 7980 B8R0.8 NOCC[C@H](N)C(=O)O Amb26346874 [0,2,0,0,0,0|1,0,0]=3 7981 B8R0.8 NOCC[C@H](N)C(=O)O Amb33038084 [0,2,0,0,0,0|1,0,0]=3 7982 B8R0.8 N[C@@H](CCCCl)C(=O)O Amb27227989 [0,2,0,0,0,0|0,0,0]=2 7983 B8R0.8 N[C@@H](CCCF)C(=O)O Amb27223043 [0,2,0,0,0,0|0,0,0]=2 7984 B8R0.8 N[C@@H](CCCO)C(=O)O Amb16183887 [0,2,0,0,0,0|0,0,0]=2 7985 B8R0.8 N[C@@H](CCNO)C(=O)O Amb24117852 [0,2,0,0,0,0|1,0,0]=3 7986 B8R0.8 N[C@@H](CSCO)C(=O)O Amb27470985 [0,2,0,0,0,0|1,0,0]=3 7987 B8R0.8 N[C@@H](CSN=O)C(=O)O Amb28182982 [0,2,0,0,0,0|2,0,0]=4 7988 B8R0.8 N[C@@H](C\C=C\Cl)C(=O)O Amb33065741 [0,2,0,0,0,0|0,0,2]=4 7989 B8R0.8 N[C@H](CCCBr)C(=O)O Amb26080278 [0,2,0,0,0,0|0,0,0]=2 7990 B8R0.8 N[C@H](CCCF)C(=O)O Amb26908418 [0,2,0,0,0,0|0,0,0]=2 7991 B8R0.8 N[C@H](CCCO)C(=O)O Amb28120579 [0,2,0,0,0,0|0,0,0]=2 7992 B8R0.8 N[C@H](CCCO)C(=O)O Amb34913429 [0,2,0,0,0,0|0,0,0]=2 7993 B8R0.8 N[C@H](CSN=O)C(=O)O Amb27845439 [0,2,0,0,0,0|2,0,0]=4 7994 B8R0.8 N[C@H](C\C=C\Cl)C(=O)O Amb33309034 [0,2,0,0,0,0|0,0,2]=4 7995 B8R0.8 O=C(Cl)C(=O)CCCBr Amb28313649 [0,2,0,0,0,0|1,0,1]=4 7996 B8R0.8 O=C(O)C(=O)CCCF Amb33196459 [0,2,0,0,0,0|0,0,1]=3 7997 B8R0.8 O=C(O)C(=O)CCCO Amb27470301 [0,2,0,0,0,0|0,0,1]=3 7998 B8R0.8 O=C(O)C(=O)CCCO Amb30666618 [0,2,0,0,0,0|0,0,1]=3 7999 B8R0.8 O=C(O)C(=O)CSCCl Amb33069677 [0,2,0,0,0,0|1,0,1]=4 8000 B8R0.8 O=C(O)C(Br)CCCCl Amb17595866 [0,2,0,0,0,0|0,0,0]=2 8001 B8R0.8 O=C(O)C(Br)CCCO Amb28313364 [0,2,0,0,0,0|0,0,0]=2 8002 B8R0.8 O=C(O)C(O)CC#CBr Amb27634839 [0,2,0,0,0,0|0,0,2]=4 8003 B8R0.8 O=C(O)C(O)CCCF Amb33196454 [0,2,0,0,0,0|0,0,0]=2 8004 B8R0.8 O=C(O)C(O)CCCO Amb18642939 [0,2,0,0,0,0|0,0,0]=2 8005 B8R0.8 O=C(O)[C@H](F)CN=C=S Amb33471626 [0,2,0,0,0,0|1,0,1]=4 8006 B8R0.8 O=C(OCCBr)C(O)O Amb33276619 [0,2,0,0,0,0|2,0,0]=4 8007 B8R0.8 O=C([O-])C(O)CCCO Amb28935028 [0,2,0,0,0,0|0,0,1]=3 8008 B8R0.8 O=C=NC[C@@H](F)C(=O)O Amb33037069 [0,2,0,0,0,0|1,0,1]=4 8009 B8R0.8 O=CCCC(=O)C(=O)O Amb27882544 [0,2,0,0,0,0|0,0,2]=4 8010 B8R0.8 O=CCCC(=O)C(=O)O Amb32670694 [0,2,0,0,0,0|0,0,2]=4 8011 B8R0.8 O=CNC[C@@H](O)C(=O)O Amb27637039 [0,2,0,0,0,0|1,0,1]=4 8012 B8R0.8 O=COCC(Cl)C(=O)O Amb27477082 [0,2,0,0,0,0|1,0,1]=4 8013 B8R0.8 [N-]=[N+]=NCC(N)C(=O)O Amb28342834 [0,2,0,0,0,0|2,0,0]=4 8014 B8R0.8 [N-]=[N+]=NCC(N)C(=O)O Amb35752605 [0,2,0,0,0,0|2,0,0]=4 8015 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O Amb26007532 [0,2,0,0,0,0|2,0,0]=4 8016 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O Amb33734276 [0,2,0,0,0,0|2,0,0]=4 8017 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O Amb25072668 [0,2,0,0,0,0|2,0,0]=4 8018 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O Amb30586485 [0,2,0,0,0,0|2,0,0]=4 8019 B8R0.9 C#CC(=C)CCC(=O)O Amb27655639 [0,2,0,0,0,0|0,0,2]=4 8020 B8R0.9 C#CC(=O)CCN(C)C Amb28198080 [0,2,0,0,0,0|2,0,0]=4 8021 B8R0.9 C#CC(=O)COC(C)C Amb28253401 [0,2,0,0,0,0|2,0,0]=4 8022 B8R0.9 C#CC(=O)NCC(C)N Amb27406534 [0,2,0,0,0,0|2,0,0]=4 8023 B8R0.9 C#CC(=O)OCC(C)Br Amb33050567 [0,2,0,0,0,0|2,0,0]=4 8024 B8R0.9 C#CC(=O)OC[C@@H](C)O Amb27761509 [0,2,0,0,0,0|2,0,0]=4 8025 B8R0.9 C#CC(=O)OC[C@H](C)O Amb27613818 [0,2,0,0,0,0|2,0,0]=4 8026 B8R0.9 C#CC(C)CCC(N)=O Amb27602261 [0,2,0,0,0,0|1,0,0]=3 8027 B8R0.9 C#CC(C)NCC(=O)O Amb27207997 [0,2,0,0,0,0|1,0,0]=3 8028 B8R0.9 C#CC(C)NCC(N)=O Amb28352348 [0,2,0,0,0,0|2,0,0]=4 8029 B8R0.9 C#CC(C)SCC(=O)O Amb27168265 [0,2,0,0,0,0|1,0,0]=3 8030 B8R0.9 C#CC(F)CCC(=O)O Amb28041990 [0,2,0,0,0,0|0,0,1]=3 8031 B8R0.9 C#CC(N)CCC(=O)O Amb22352566 [0,2,0,0,0,0|0,0,1]=3 8032 B8R0.9 C#CC(O)CCC(C)N Amb35740609 [0,2,0,0,0,0|1,0,1]=4 8033 B8R0.9 C=C(C)CCC(=O)CN Amb27809573 [0,2,0,0,0,0|1,0,1]=4 8034 B8R0.9 C=C(C)CCC(C)CBr Amb27794197 [0,2,0,0,0,0|2,0,0]=4 8035 B8R0.9 C=C(C)CCC(C)CN Amb27180681 [0,2,0,0,0,0|2,0,0]=4 8036 B8R0.9 C=C(C)CCC(C)NC Amb27452757 [0,2,0,0,0,0|2,0,0]=4 8037 B8R0.9 C=C(C)CCC(N)CC Amb27395082 [0,2,0,0,0,0|2,0,0]=4 8038 B8R0.9 C=C(C)CCC(N)CN Amb27422880 [0,2,0,0,0,0|2,0,0]=4 8039 B8R0.9 C=C(C)CCC(O)CO Amb28315440 [0,2,0,0,0,0|2,0,0]=4 8040 B8R0.9 C=C(C)CNC(=O)CO Amb27866006 [0,2,0,0,0,0|1,0,1]=4 8041 B8R0.9 C=C(C)CNC(=O)OC Amb27473324 [0,2,0,0,0,0|1,0,1]=4 8042 B8R0.9 C=C(C)CNC(C)CC Amb17308623 [0,2,0,0,0,0|2,0,0]=4 8043 B8R0.9 C=C(C)COC(=O)CO Amb28280952 [0,2,0,0,0,0|1,0,1]=4 8044 B8R0.9 C=C(C)CSC(C)CC Amb27615012 [0,2,0,0,0,0|2,0,0]=4 8045 B8R0.9 C=C(C=O)CCC(=O)O Amb27655564 [0,2,0,0,0,0|0,0,2]=4 8046 B8R0.9 C=C(CC)CNC(C)=O Amb27985317 [0,2,0,0,0,0|1,0,1]=4 8047 B8R0.9 C=C(CC)CNC(N)=O Amb28342560 [0,2,0,0,0,0|1,0,1]=4 8048 B8R0.9 C=C(CC)OCC(C)=O Amb27227543 [0,2,0,0,0,0|1,0,1]=4 8049 B8R0.9 C=C(CO)CCN(C)C Amb28049092 [0,2,0,0,0,0|2,0,0]=4 8050 B8R0.9 C=C(CO)SCC(C)C Amb27805315 [0,2,0,0,0,0|2,0,0]=4 8051 B8R0.9 C=C(Cl)CSC(C)CC Amb28062133 [0,2,0,0,0,0|2,0,0]=4 8052 B8R0.9 C=C(\C=C\C(=O)O)CC Amb27229488 [0,2,0,0,0,0|0,0,2]=4 8053 B8R0.9 C=CC(=C)CCC(=O)O Amb18642412 [0,2,0,0,0,0|0,0,2]=4 8054 B8R0.9 C=CC(=C)CCC(C)O Amb27956504 [0,2,0,0,0,0|2,0,0]=4 8055 B8R0.9 C=CC(=C)CC[C@H](C)O Amb28207351 [0,2,0,0,0,0|2,0,0]=4 8056 B8R0.9 C=CC(=O)CCC(C)C Amb25341966 [0,2,0,0,0,0|1,0,0]=3 8057 B8R0.9 C=CC(=O)CCN(C)C Amb27838465 [0,2,0,0,0,0|2,0,0]=4 8058 B8R0.9 C=CC(=O)COC(C)C Amb24614526 [0,2,0,0,0,0|2,0,0]=4 8059 B8R0.9 C=CC(=O)CSC(C)C Amb28313053 [0,2,0,0,0,0|2,0,0]=4 8060 B8R0.9 C=CC(=O)NCC(C)N Amb27837537 [0,2,0,0,0,0|2,0,0]=4 8061 B8R0.9 C=CC(=O)NCC(C)O Amb9361385 [0,2,0,0,0,0|2,0,0]=4 8062 B8R0.9 C=CC(=O)OCC(C)C Amb3940723 [0,2,0,0,0,0|2,0,0]=4 8063 B8R0.9 C=CC(=O)OCC(C)O Amb4016502 [0,2,0,0,0,0|2,0,0]=4 8064 B8R0.9 C=CC(C)CCC(C)=O Amb26390728 [0,2,0,0,0,0|1,0,0]=3 8065 B8R0.9 C=CC(C)OCC(=O)O Amb18642764 [0,2,0,0,0,0|1,0,0]=3 8066 B8R0.9 C=CC(C)SCC(C)=O Amb27837610 [0,2,0,0,0,0|2,0,0]=4 8067 B8R0.9 C=CC(N)CCC(=O)O Amb10843623 [0,2,0,0,0,0|0,0,1]=3 8068 B8R0.9 C=CC(N)CCC(=O)O Amb22056347 [0,2,0,0,0,0|0,0,1]=3 8069 B8R0.9 C=CC(O)CCC(=O)O Amb25785193 [0,2,0,0,0,0|0,0,1]=3 8070 B8R0.9 C=CC(O)CCC(C)C Amb28397043 [0,2,0,0,0,0|1,0,1]=4 8071 B8R0.9 C=CC([NH3+])CCC(=O)O Amb10845648 [0,2,0,0,0,0|0,0,1]=3 8072 B8R0.9 C=C[C@H](N)CCC(=O)O Amb25694354 [0,2,0,0,0,0|0,0,1]=3 8073 B8R0.9 C=C[C@H](O)CCC(=O)O Amb27168215 [0,2,0,0,0,0|0,0,1]=3 8074 B8R0.9 C=C\C(C)=C\CC(=O)O Amb33276241 [0,2,0,0,0,0|0,0,2]=4 8075 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,2,0,0,0,0|1,0,1]=4 8076 B8R0.9 CC(=O)CCC(=O)NO Amb26971070 [0,2,0,0,0,0|0,0,1]=3 8077 B8R0.9 CC(=O)CCC(C)C=O Amb18642612 [0,2,0,0,0,0|1,0,0]=3 8078 B8R0.9 CC(=O)CCC(C)CO Amb27838673 [0,2,0,0,0,0|1,0,0]=3 8079 B8R0.9 CC(=O)CCC(Cl)CCl Amb27259129 [0,2,0,0,0,0|1,0,0]=3 8080 B8R0.9 CC(=O)CCC(F)CCl Amb28060125 [0,2,0,0,0,0|1,0,0]=3 8081 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,2,0,0,0,0|1,0,0]=3 8082 B8R0.9 CC(=O)CCC(O)CF Amb28322193 [0,2,0,0,0,0|1,0,0]=3 8083 B8R0.9 CC(=O)CCN(C)C=O Amb27802453 [0,2,0,0,0,0|2,0,0]=4 8084 B8R0.9 CC(=O)CCN(C)N=O Amb28364300 [0,2,0,0,0,0|2,0,0]=4 8085 B8R0.9 CC(=O)CNC(C)CO Amb27614242 [0,2,0,0,0,0|2,0,0]=4 8086 B8R0.9 CC(=O)COC(C)CN Amb18110559 [0,2,0,0,0,0|2,0,0]=4 8087 B8R0.9 CC(=O)NCC(=O)CO Amb27494067 [0,2,0,0,0,0|1,0,1]=4 8088 B8R0.9 CC(=O)NCC(=O)NO Amb25340085 [0,2,0,0,0,0|1,0,1]=4 8089 B8R0.9 CC(=O)NCC(C)C=O Amb27485699 [0,2,0,0,0,0|2,0,0]=4 8090 B8R0.9 CC(=O)NCC(C)CN Amb18300590 [0,2,0,0,0,0|2,0,0]=4 8091 B8R0.9 CC(=O)NCC(C)ON Amb17138377 [0,2,0,0,0,0|2,0,0]=4 8092 B8R0.9 CC(=O)NC[C@@H](O)CO Amb27156658 [0,2,0,0,0,0|2,0,0]=4 8093 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,2,0,0,0,0|2,0,0]=4 8094 B8R0.9 CC(=O)OCC(=O)CO Amb28253910 [0,2,0,0,0,0|1,0,1]=4 8095 B8R0.9 CC(=O)OCC(C)CBr Amb22386917 [0,2,0,0,0,0|2,0,0]=4 8096 B8R0.9 CC(=O)OCC(F)CO Amb27443281 [0,2,0,0,0,0|2,0,0]=4 8097 B8R0.9 CC(=O)OCC(N)CO Amb33140919 [0,2,0,0,0,0|2,0,0]=4 8098 B8R0.9 CC(=O)OCC(O)CCl Amb17593815 [0,2,0,0,0,0|2,0,0]=4 8099 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,2,0,0,0,0|2,0,0]=4 8100 B8R0.9 CC(=O)OCC(S)CCl Amb28056223 [0,2,0,0,0,0|2,0,0]=4 8101 B8R0.9 CC(=O)OC[C@@H](O)CCl Amb27469927 [0,2,0,0,0,0|2,0,0]=4 8102 B8R0.9 CC(=O)OC[C@H](C)C=O Amb27230590 [0,2,0,0,0,0|2,0,0]=4 8103 B8R0.9 CC(=O)OC[C@H](C)CBr Amb28385279 [0,2,0,0,0,0|2,0,0]=4 8104 B8R0.9 CC(=O)SCC(C)C=O Amb27827463 [0,2,0,0,0,0|2,0,0]=4 8105 B8R0.9 CC(=O)SCC(C)CCl Amb4605870 [0,2,0,0,0,0|2,0,0]=4 8106 B8R0.9 CC(=O)SC[C@H](O)CO Amb27261704 [0,2,0,0,0,0|2,0,0]=4 8107 B8R0.9 CC(C#CC(=O)O)CN Amb33168959 [0,2,0,0,0,0|0,0,2]=4 8108 B8R0.9 CC(C#N)NCC(=O)O Amb18293465 [0,2,0,0,0,0|1,0,0]=3 8109 B8R0.9 CC(C)CCC(=O)CCl Amb20668816 [0,2,0,0,0,0|1,0,0]=3 8110 B8R0.9 CC(C)CCC(=O)CN Amb27599814 [0,2,0,0,0,0|1,0,0]=3 8111 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,2,0,0,0,0|0,0,0]=2 8112 B8R0.9 CC(C)CCC(=O)NN Amb6744504 [0,2,0,0,0,0|1,0,0]=3 8113 B8R0.9 CC(C)CCC(=O)NO Amb6744847 [0,2,0,0,0,0|0,0,0]=2 8114 B8R0.9 CC(C)CCC(C)CO Amb24478637 [0,2,0,0,0,0|1,0,1]=4 8115 B8R0.9 CC(C)CCC(F)CO Amb28315415 [0,2,0,0,0,0|1,0,1]=4 8116 B8R0.9 CC(C)CCC(N)CO Amb18832528 [0,2,0,0,0,0|1,0,1]=4 8117 B8R0.9 CC(C)CCC(N)CO Amb28960290 [0,2,0,0,0,0|1,0,1]=4 8118 B8R0.9 CC(C)CCC(O)CCl Amb27473402 [0,2,0,0,0,0|1,0,1]=4 8119 B8R0.9 CC(C)CCC(O)CN Amb28282095 [0,2,0,0,0,0|1,0,1]=4 8120 B8R0.9 CC(C)CC[C@@H](C)CO Amb27156839 [0,2,0,0,0,0|1,0,1]=4 8121 B8R0.9 CC(C)CC[C@H](C)CO Amb25781634 [0,2,0,0,0,0|1,0,1]=4 8122 B8R0.9 CC(C)CC[C@H](O)CO Amb28315482 [0,2,0,0,0,0|0,0,2]=4 8123 B8R0.9 CC(C)CC\C(Cl)=N\O Amb28366200 [0,2,0,0,0,0|1,0,0]=3 8124 B8R0.9 CC(C)CC\C(N)=N\N Amb28290196 [0,2,0,0,0,0|2,0,0]=4 8125 B8R0.9 CC(C)CC\C(N)=N\O Amb10205331 [0,2,0,0,0,0|1,0,0]=3 8126 B8R0.9 CC(C)CNC(=O)CBr Amb10608023 [0,2,0,0,0,0|2,0,0]=4 8127 B8R0.9 CC(C)CNC(=O)CCl Amb1160207 [0,2,0,0,0,0|2,0,0]=4 8128 B8R0.9 CC(C)CNC(=O)CN Amb13951745 [0,2,0,0,0,0|2,0,0]=4 8129 B8R0.9 CC(C)CNC(=O)CN Amb5783029 [0,2,0,0,0,0|2,0,0]=4 8130 B8R0.9 CC(C)CNC(=O)CO Amb9421416 [0,2,0,0,0,0|1,0,0]=3 8131 B8R0.9 CC(C)CNC(=O)NN Amb8854030 [0,2,0,0,0,0|2,0,0]=4 8132 B8R0.9 CC(C)COC(=O)CBr Amb22036611 [0,2,0,0,0,0|2,0,0]=4 8133 B8R0.9 CC(C)COC(=O)CN Amb19011993 [0,2,0,0,0,0|2,0,0]=4 8134 B8R0.9 CC(C)COC(=O)CO Amb27218940 [0,2,0,0,0,0|1,0,0]=3 8135 B8R0.9 CC(C)CO\C(N)=N\O Amb27653313 [0,2,0,0,0,0|2,0,0]=4 8136 B8R0.9 CC(C)NCC(=O)NN Amb27630359 [0,2,0,0,0,0|2,0,0]=4 8137 B8R0.9 CC(C)NC\C(N)=N\O Amb27264292 [0,2,0,0,0,0|2,0,0]=4 8138 B8R0.9 CC(C)OCC(=O)CCl Amb24481789 [0,2,0,0,0,0|2,0,0]=4 8139 B8R0.9 CC(C)OCC(=O)CN Amb24481788 [0,2,0,0,0,0|2,0,0]=4 8140 B8R0.9 CC(C)OCC(=O)NN Amb2089067 [0,2,0,0,0,0|2,0,0]=4 8141 B8R0.9 CC(C)OCC(=O)NN Amb2189164 [0,2,0,0,0,0|2,0,0]=4 8142 B8R0.9 CC(C)OCC(O)C=O Amb27239297 [0,2,0,0,0,0|1,0,1]=4 8143 B8R0.9 CC(C)OC\C(N)=N\O Amb9177999 [0,2,0,0,0,0|2,0,0]=4 8144 B8R0.9 CC(C)SC\C(N)=N\O Amb25771404 [0,2,0,0,0,0|2,0,0]=4 8145 B8R0.9 CC(C=O)CC[N+](=O)[O-] Amb27985090 [0,2,0,0,0,0|1,0,1]=4 8146 B8R0.9 CC(CBr)CCS(C)=O Amb26630308 [0,2,0,0,0,0|2,0,0]=4 8147 B8R0.9 CC(CBr)COC(N)=O Amb27879004 [0,2,0,0,0,0|2,0,0]=4 8148 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [0,2,0,0,0,0|0,0,0]=2 8149 B8R0.9 CC(CCl)CCC(=O)Cl Amb25921088 [0,2,0,0,0,0|1,0,0]=3 8150 B8R0.9 CC(CCl)CCC(=O)O Amb27838484 [0,2,0,0,0,0|0,0,0]=2 8151 B8R0.9 CC(CCl)CCS(C)=O Amb26541793 [0,2,0,0,0,0|2,0,0]=4 8152 B8R0.9 CC(CN)CCC(=O)O Amb22059189 [0,2,0,0,0,0|0,0,0]=2 8153 B8R0.9 CC(CN)CCC(=O)O Amb28935016 [0,2,0,0,0,0|0,0,0]=2 8154 B8R0.9 CC(CN)CCS(C)=O Amb28430263 [0,2,0,0,0,0|2,0,0]=4 8155 B8R0.9 CC(CN)CC[N+](=O)[O-] Amb33746654 [0,2,0,0,0,0|1,0,1]=4 8156 B8R0.9 CC(CN)CNC(N)=O Amb18994081 [0,2,0,0,0,0|2,0,0]=4 8157 B8R0.9 CC(CN)OCC(=O)O Amb18629591 [0,2,0,0,0,0|1,0,0]=3 8158 B8R0.9 CC(CN)SCC(=O)O Amb28142553 [0,2,0,0,0,0|1,0,0]=3 8159 B8R0.9 CC(CO)CCS(C)=O Amb27815628 [0,2,0,0,0,0|2,0,0]=4 8160 B8R0.9 CC(CO)CC[C@H](C)O Amb28207320 [0,2,0,0,0,0|1,0,1]=4 8161 B8R0.9 CC(CO)CC[N+](=O)[O-] Amb27481503 [0,2,0,0,0,0|1,0,1]=4 8162 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,2,0,0,0,0|2,0,0]=4 8163 B8R0.9 CC(CO)SCC(N)=O Amb27969999 [0,2,0,0,0,0|2,0,0]=4 8164 B8R0.9 CC(Cl)CNC(=O)CCl Amb24480042 [0,2,0,0,0,0|2,0,0]=4 8165 B8R0.9 CC(Cl)CSC(=O)CCl Amb27863331 [0,2,0,0,0,0|2,0,0]=4 8166 B8R0.9 CC(N)CCC(=O)NN Amb27945385 [0,2,0,0,0,0|1,0,0]=3 8167 B8R0.9 CC(N)CCC(=O)NO Amb27606094 [0,2,0,0,0,0|0,0,0]=2 8168 B8R0.9 CC(N)CC\C(N)=N\O Amb30008328 [0,2,0,0,0,0|1,0,0]=3 8169 B8R0.9 CC(O)CCC(=O)NN Amb19748590 [0,2,0,0,0,0|1,0,0]=3 8170 B8R0.9 CC(O)CCC(C)C#N Amb28315408 [0,2,0,0,0,0|1,0,1]=4 8171 B8R0.9 CC(O)CCC(C)CO Amb27218004 [0,2,0,0,0,0|1,0,1]=4 8172 B8R0.9 CC(O)CCN(C)C=O Amb27485177 [0,2,0,0,0,0|2,0,0]=4 8173 B8R0.9 CC(O)CC\C(N)=N\O Amb29852670 [0,2,0,0,0,0|1,0,0]=3 8174 B8R0.9 CC(O)CNC(=O)CCl Amb17324265 [0,2,0,0,0,0|2,0,0]=4 8175 B8R0.9 CC(O)COC(=O)CBr Amb25253067 [0,2,0,0,0,0|2,0,0]=4 8176 B8R0.9 CC(\C=C\C(=O)O)CN Amb27234754 [0,2,0,0,0,0|0,0,2]=4 8177 B8R0.9 CCC(=N)NCC(N)=O Amb28049684 [0,2,0,0,0,0|1,0,1]=4 8178 B8R0.9 CCC(=N)SCC(=O)O Amb27412807 [0,2,0,0,0,0|0,0,1]=3 8179 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,2,0,0,0,0|0,0,0]=2 8180 B8R0.9 CCC(=O)CCC(C)=O Amb17593347 [0,2,0,0,0,0|1,0,0]=3 8181 B8R0.9 CCC(=O)CCC(C)C Amb9031667 [0,2,0,0,0,0|1,0,0]=3 8182 B8R0.9 CCC(=O)CCC(C)N Amb27866596 [0,2,0,0,0,0|1,0,0]=3 8183 B8R0.9 CCC(=O)CNC(C)C Amb28341444 [0,2,0,0,0,0|2,0,0]=4 8184 B8R0.9 CCC(=O)COC(C)=O Amb3940673 [0,2,0,0,0,0|1,0,1]=4 8185 B8R0.9 CCC(=O)COC(C)C Amb27960841 [0,2,0,0,0,0|2,0,0]=4 8186 B8R0.9 CCC(=O)CSC(C)=O Amb27180933 [0,2,0,0,0,0|1,0,1]=4 8187 B8R0.9 CCC(=O)CSC(C)C Amb27450301 [0,2,0,0,0,0|2,0,0]=4 8188 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,2,0,0,0,0|0,0,1]=3 8189 B8R0.9 CCC(=O)NCC(C)Br Amb28207756 [0,2,0,0,0,0|2,0,0]=4 8190 B8R0.9 CCC(=O)NCC(C)C Amb17798304 [0,2,0,0,0,0|2,0,0]=4 8191 B8R0.9 CCC(=O)NCC(C)Cl Amb27836210 [0,2,0,0,0,0|2,0,0]=4 8192 B8R0.9 CCC(=O)NCC(C)O Amb9275499 [0,2,0,0,0,0|2,0,0]=4 8193 B8R0.9 CCC(=O)NCC(N)=O Amb17231864 [0,2,0,0,0,0|1,0,1]=4 8194 B8R0.9 CCC(=O)OCC(C)=O Amb27662511 [0,2,0,0,0,0|1,0,1]=4 8195 B8R0.9 CCC(=O)OCC(C)Br Amb28436820 [0,2,0,0,0,0|2,0,0]=4 8196 B8R0.9 CCC(=O)OCC(C)C Amb8393164 [0,2,0,0,0,0|2,0,0]=4 8197 B8R0.9 CCC(=O)OCC(C)O Amb28184966 [0,2,0,0,0,0|2,0,0]=4 8198 B8R0.9 CCC(=O)OCC(N)=O Amb26505774 [0,2,0,0,0,0|1,0,1]=4 8199 B8R0.9 CCC(=O)OC[C@@H](C)O Amb28049124 [0,2,0,0,0,0|2,0,0]=4 8200 B8R0.9 CCC(=O)\C=C/C(=O)O Amb27838748 [0,2,0,0,0,0|0,0,2]=4 8201 B8R0.9 CCC(=O)\C=C\C(=O)O Amb18642585 [0,2,0,0,0,0|0,0,2]=4 8202 B8R0.9 CCC(Br)CCC(=O)O Amb28367201 [0,2,0,0,0,0|0,0,0]=2 8203 B8R0.9 CCC(Br)COC(C)=O Amb26916647 [0,2,0,0,0,0|1,0,0]=3 8204 B8R0.9 CCC(C)C#CC(=O)O Amb28145990 [0,2,0,0,0,0|0,0,1]=3 8205 B8R0.9 CCC(C)CCB(O)O Amb25063737 [0,2,0,0,0,0|1,0,1]=4 8206 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,2,0,0,0,0|0,0,0]=2 8207 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,2,0,0,0,0|1,0,0]=3 8208 B8R0.9 CCC(C)CCC(C)O Amb22732215 [0,2,0,0,0,0|1,0,1]=4 8209 B8R0.9 CCC(C)CC[C@@H](C)O Amb26485746 [0,2,0,0,0,0|1,0,1]=4 8210 B8R0.9 CCC(C)CC[C@H](C)O Amb33318485 [0,2,0,0,0,0|1,0,1]=4 8211 B8R0.9 CCC(C)CC[N+](=O)[O-] Amb33226911 [0,2,0,0,0,0|1,0,1]=4 8212 B8R0.9 CCC(C)CNC(=O)Cl Amb29881345 [0,2,0,0,0,0|1,0,0]=3 8213 B8R0.9 CCC(C)CNC(C)=O Amb27643953 [0,2,0,0,0,0|1,0,0]=3 8214 B8R0.9 CCC(C)CNC(N)=O Amb27258807 [0,2,0,0,0,0|1,0,0]=3 8215 B8R0.9 CCC(C)COC(=O)Cl Amb20246588 [0,2,0,0,0,0|1,0,0]=3 8216 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,2,0,0,0,0|0,0,0]=2 8217 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,2,0,0,0,0|0,0,0]=2 8218 B8R0.9 CCC(C)NCC(N)=O Amb6661064 [0,2,0,0,0,0|1,0,0]=3 8219 B8R0.9 CCC(C)NC[C@@H](C)O Amb27184367 [0,2,0,0,0,0|1,0,1]=4 8220 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,2,0,0,0,0|0,0,0]=2 8221 B8R0.9 CCC(C)OCC(C)=O Amb27803509 [0,2,0,0,0,0|1,0,0]=3 8222 B8R0.9 CCC(C)OCC(C)O Amb28207569 [0,2,0,0,0,0|1,0,1]=4 8223 B8R0.9 CCC(C)OCC(N)=O Amb27167179 [0,2,0,0,0,0|1,0,0]=3 8224 B8R0.9 CCC(C)OC[C@H](C)O Amb27869786 [0,2,0,0,0,0|1,0,1]=4 8225 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,2,0,0,0,0|0,0,0]=2 8226 B8R0.9 CCC(C)SCC(N)=O Amb27603087 [0,2,0,0,0,0|1,0,0]=3 8227 B8R0.9 CCC(C)SC[C@H](C)O Amb28248745 [0,2,0,0,0,0|1,0,1]=4 8228 B8R0.9 CCC(C)\C=C\C(=O)O Amb33171963 [0,2,0,0,0,0|0,0,1]=3 8229 B8R0.9 CCC(C)\C=C\C(C)=O Amb24062970 [0,2,0,0,0,0|1,0,1]=4 8230 B8R0.9 CCC(C)\C=C\C(N)=O Amb27439352 [0,2,0,0,0,0|1,0,1]=4 8231 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,2,0,0,0,0|1,0,0]=3 8232 B8R0.9 CCC(Cl)CCC(=O)O Amb27955847 [0,2,0,0,0,0|0,0,0]=2 8233 B8R0.9 CCC(Cl)COC(=O)Cl Amb25967600 [0,2,0,0,0,0|1,0,0]=3 8234 B8R0.9 CCC(N)C#CC(=O)O Amb33168922 [0,2,0,0,0,0|0,0,1]=3 8235 B8R0.9 CCC(N)CC=C(C)C Amb27251594 [0,2,0,0,0,0|2,0,0]=4 8236 B8R0.9 CCC(N)CC=C(Cl)Cl Amb29869998 [0,2,0,0,0,0|2,0,0]=4 8237 B8R0.9 CCC(N)CCC(=O)O Amb21961489 [0,2,0,0,0,0|0,0,0]=2 8238 B8R0.9 CCC(N)CCC(=O)O Amb5717972 [0,2,0,0,0,0|0,0,0]=2 8239 B8R0.9 CCC(N)CCC(N)=O Amb27194979 [0,2,0,0,0,0|1,0,0]=3 8240 B8R0.9 CCC(N)CNC(N)=O Amb27437062 [0,2,0,0,0,0|1,0,0]=3 8241 B8R0.9 CCC(N)CSC(=N)N Amb27179911 [0,2,0,0,0,0|2,0,0]=4 8242 B8R0.9 CCC(N)\C=C\C(=O)O Amb27867410 [0,2,0,0,0,0|0,0,1]=3 8243 B8R0.9 CCC(O)C#CC(=O)O Amb27169546 [0,2,0,0,0,0|0,0,1]=3 8244 B8R0.9 CCC(O)CCB(O)O Amb24353745 [0,2,0,0,0,0|1,0,1]=4 8245 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [0,2,0,0,0,0|0,0,0]=2 8246 B8R0.9 CCC(O)CCC(C)C Amb19944686 [0,2,0,0,0,0|1,0,1]=4 8247 B8R0.9 CCC(O)CCC(N)=O Amb27234638 [0,2,0,0,0,0|1,0,0]=3 8248 B8R0.9 CCC(O)CC[C@@H](C)O Amb28049249 [0,2,0,0,0,0|1,0,1]=4 8249 B8R0.9 CCC(O)CNC(N)=O Amb27235306 [0,2,0,0,0,0|1,0,0]=3 8250 B8R0.9 CCC(O)COC(N)=O Amb27175099 [0,2,0,0,0,0|1,0,0]=3 8251 B8R0.9 CCC(O)CSC(=N)N Amb27179945 [0,2,0,0,0,0|2,0,0]=4 8252 B8R0.9 CCC(O)C\C=C(\C)Br Amb27405191 [0,2,0,0,0,0|2,0,0]=4 8253 B8R0.9 CCC(S)CCC(=O)O Amb27954753 [0,2,0,0,0,0|0,0,0]=2 8254 B8R0.9 CCN(C)CCC(=O)O Amb8428205 [0,2,0,0,0,0|0,0,0]=2 8255 B8R0.9 CCN(C)CCC(=O)O Amb8890954 [0,2,0,0,0,0|0,0,0]=2 8256 B8R0.9 CCS(=O)CCC(=O)O Amb9173461 [0,2,0,0,0,0|0,0,0]=2 8257 B8R0.9 CCS(=O)NCC(=O)O Amb28322707 [0,2,0,0,0,0|1,0,0]=3 8258 B8R0.9 CCS(=O)NCC(N)=O Amb27433455 [0,2,0,0,0,0|2,0,0]=4 8259 B8R0.9 CCS(=O)\C=C\C(=O)O Amb28347741 [0,2,0,0,0,0|0,0,2]=4 8260 B8R0.9 CC[C@@H](Br)COC(C)=O Amb28254442 [0,2,0,0,0,0|1,0,0]=3 8261 B8R0.9 CC[C@@H](C)C#CC(=O)O Amb27975780 [0,2,0,0,0,0|0,0,1]=3 8262 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,2,0,0,0,0|0,0,0]=2 8263 B8R0.9 CC[C@@H](C)\C=C\C(=O)O Amb24117189 [0,2,0,0,0,0|0,0,1]=3 8264 B8R0.9 CC[C@@H](N)CSC(=N)N Amb27392045 [0,2,0,0,0,0|2,0,0]=4 8265 B8R0.9 CC[C@@H](O)CCC(N)=O Amb27254154 [0,2,0,0,0,0|1,0,0]=3 8266 B8R0.9 CC[C@H](C)C#CC(=O)O Amb28132200 [0,2,0,0,0,0|0,0,1]=3 8267 B8R0.9 CC[C@H](C)CCC(C)=O Amb27447760 [0,2,0,0,0,0|1,0,0]=3 8268 B8R0.9 CC[C@H](C)CCC(N)=O Amb28346481 [0,2,0,0,0,0|1,0,0]=3 8269 B8R0.9 CC[C@H](C)CC[C@H](C)O Amb27807458 [0,2,0,0,0,0|1,0,1]=4 8270 B8R0.9 CC[C@H](C)CNC(N)=S Amb28285101 [0,2,0,0,0,0|1,1,0]=4 8271 B8R0.9 CC[C@H](C)COC(C)=O Amb27408010 [0,2,0,0,0,0|1,0,0]=3 8272 B8R0.9 CC[C@H](N)\C=C\C(=O)O Amb27878954 [0,2,0,0,0,0|0,0,1]=3 8273 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [0,2,0,0,0,0|0,0,0]=2 8274 B8R0.9 CC[C@H](O)CNC(C)=O Amb27762160 [0,2,0,0,0,0|1,0,0]=3 8275 B8R0.9 CC\C(C)=C\CC(=O)O Amb22011800 [0,2,0,0,0,0|0,0,1]=3 8276 B8R0.9 CN(C#N)CCC(=O)O Amb35634504 [0,2,0,0,0,0|1,0,0]=3 8277 B8R0.9 CN(C#N)CCC(N)=O Amb27190230 [0,2,0,0,0,0|2,0,0]=4 8278 B8R0.9 CN(C)CCC(=O)CCl Amb33057681 [0,2,0,0,0,0|2,0,0]=4 8279 B8R0.9 CN(C)CCC(=O)CN Amb18203194 [0,2,0,0,0,0|2,0,0]=4 8280 B8R0.9 CN(C)CCC(=O)NN Amb396230 [0,2,0,0,0,0|2,0,0]=4 8281 B8R0.9 CN(C)CCC(=O)NO Amb27762089 [0,2,0,0,0,0|1,0,0]=3 8282 B8R0.9 CN(C)CC\C(N)=N/O Amb2695942 [0,2,0,0,0,0|2,0,0]=4 8283 B8R0.9 CN(C)CC\C(N)=N\O Amb1118599 [0,2,0,0,0,0|2,0,0]=4 8284 B8R0.9 CN(CCC(=O)O)N=O Amb17618592 [0,2,0,0,0,0|1,0,0]=3 8285 B8R0.9 CN(CCC(N)=O)N=O Amb27487572 [0,2,0,0,0,0|2,0,0]=4 8286 B8R0.9 CNC(=O)CCC(=O)O Amb2720937 [0,2,0,0,0,0|0,0,1]=3 8287 B8R0.9 CNC(=O)CCC(C)=O Amb17334107 [0,2,0,0,0,0|1,0,1]=4 8288 B8R0.9 CNC(=O)CCC(C)C Amb27165938 [0,2,0,0,0,0|1,0,0]=3 8289 B8R0.9 CNC(=O)CCC(C)N Amb33109814 [0,2,0,0,0,0|1,0,0]=3 8290 B8R0.9 CNC(=O)CCC(C)O Amb17334125 [0,2,0,0,0,0|1,0,0]=3 8291 B8R0.9 CNC(=O)CCC(Cl)Cl Amb32671998 [0,2,0,0,0,0|2,0,0]=4 8292 B8R0.9 CNC(=O)CCC(F)F Amb27837707 [0,2,0,0,0,0|2,0,0]=4 8293 B8R0.9 CNC(=O)CCC(N)=O Amb17334114 [0,2,0,0,0,0|1,0,1]=4 8294 B8R0.9 CNC(=O)CCN(C)C Amb24735586 [0,2,0,0,0,0|2,0,0]=4 8295 B8R0.9 CNC(=O)CC[C@H](C)O Amb27799232 [0,2,0,0,0,0|1,0,0]=3 8296 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,2,0,0,0,0|1,0,1]=4 8297 B8R0.9 CNC(=O)NCC(C)O Amb28326263 [0,2,0,0,0,0|2,0,0]=4 8298 B8R0.9 CNC(=O)OCC(=O)O Amb30018932 [0,2,0,0,0,0|1,0,1]=4 8299 B8R0.9 CNC(=O)OCC(C)N Amb35735119 [0,2,0,0,0,0|2,0,0]=4 8300 B8R0.9 CNC(=S)NCC(=O)O Amb4044376 [0,2,0,0,0,0|1,0,1]=4 8301 B8R0.9 CNC(C)CCS(C)=O Amb27791401 [0,2,0,0,0,0|2,0,0]=4 8302 B8R0.9 COC(=O)C#CC(C)C Amb28250141 [0,2,0,0,0,0|0,0,2]=4 8303 B8R0.9 COC(=O)C#CC(C)Cl Amb27243956 [0,2,0,0,0,0|0,0,2]=4 8304 B8R0.9 COC(=O)C#C[C@H](C)O Amb27981745 [0,2,0,0,0,0|0,0,2]=4 8305 B8R0.9 COC(=O)CCB(O)O Amb25705142 [0,2,0,0,0,0|2,0,0]=4 8306 B8R0.9 COC(=O)CCC(=O)Cl Amb3939311 [0,2,0,0,0,0|1,0,1]=4 8307 B8R0.9 COC(=O)CCC(=O)O Amb6538024 [0,2,0,0,0,0|0,0,1]=3 8308 B8R0.9 COC(=O)CCC(C)=O Amb13777321 [0,2,0,0,0,0|0,0,1]=3 8309 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,2,0,0,0,0|0,0,0]=2 8310 B8R0.9 COC(=O)CCC(C)C Amb9241809 [0,2,0,0,0,0|0,0,0]=2 8311 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,2,0,0,0,0|0,0,0]=2 8312 B8R0.9 COC(=O)CCC(C)I Amb27445524 [0,2,0,0,0,0|0,0,0]=2 8313 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,2,0,0,0,0|0,0,0]=2 8314 B8R0.9 COC(=O)CCC(C)N Amb35750839 [0,2,0,0,0,0|0,0,0]=2 8315 B8R0.9 COC(=O)CCC(C)O Amb26459430 [0,2,0,0,0,0|0,0,0]=2 8316 B8R0.9 COC(=O)CCC(C)S Amb28066829 [0,2,0,0,0,0|0,0,0]=2 8317 B8R0.9 COC(=O)CCC(C)[O-] Amb30988005 [0,2,0,0,0,0|0,0,0]=2 8318 B8R0.9 COC(=O)CCC(F)F Amb27770565 [0,2,0,0,0,0|1,0,0]=3 8319 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,2,0,0,0,0|1,0,1]=4 8320 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [0,2,0,0,0,0|1,0,1]=4 8321 B8R0.9 COC(=O)CCN(C)C Amb7757843 [0,2,0,0,0,0|1,0,0]=3 8322 B8R0.9 COC(=O)CCS(=O)Cl Amb25944850 [0,2,0,0,0,0|2,0,0]=4 8323 B8R0.9 COC(=O)CCS(=O)O Amb25967240 [0,2,0,0,0,0|1,0,1]=4 8324 B8R0.9 COC(=O)CCS(=O)[O-] Amb21520328 [0,2,0,0,0,0|2,0,0]=4 8325 B8R0.9 COC(=O)CCS(N)=O Amb32720304 [0,2,0,0,0,0|2,0,0]=4 8326 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,2,0,0,0,0|0,0,0]=2 8327 B8R0.9 COC(=O)CC[C@H](C)N Amb27950697 [0,2,0,0,0,0|0,0,0]=2 8328 B8R0.9 COC(=O)CC[N+](=O)[O-] Amb26494342 [0,2,0,0,0,0|2,0,0]=4 8329 B8R0.9 COC(=O)CNC(C)=O Amb3886556 [0,2,0,0,0,0|1,0,1]=4 8330 B8R0.9 COC(=O)CNC(C)C Amb6687063 [0,2,0,0,0,0|1,0,0]=3 8331 B8R0.9 COC(=O)COC(C)=O Amb28049254 [0,2,0,0,0,0|1,0,1]=4 8332 B8R0.9 COC(=O)COC(C)C Amb9206385 [0,2,0,0,0,0|1,0,0]=3 8333 B8R0.9 COC(=O)COC(Cl)Cl Amb22230457 [0,2,0,0,0,0|2,0,0]=4 8334 B8R0.9 COC(=O)CSC(C)C Amb28049081 [0,2,0,0,0,0|1,0,0]=3 8335 B8R0.9 COC(=O)NCC(=O)O Amb3941451 [0,2,0,0,0,0|1,0,1]=4 8336 B8R0.9 COC(=O)NCC(C)=O Amb28461105 [0,2,0,0,0,0|1,0,1]=4 8337 B8R0.9 COC(=O)NCC(C)Cl Amb27401852 [0,2,0,0,0,0|1,0,0]=3 8338 B8R0.9 COC(=O)NCC(C)O Amb9285615 [0,2,0,0,0,0|1,0,0]=3 8339 B8R0.9 COC(=O)NC[C@@H](C)O Amb28204216 [0,2,0,0,0,0|1,0,0]=3 8340 B8R0.9 COC(=O)NNC(C)C Amb22496456 [0,2,0,0,0,0|2,0,0]=4 8341 B8R0.9 COC(=O)OCC(=O)O Amb8393899 [0,2,0,0,0,0|1,0,1]=4 8342 B8R0.9 COC(=O)OCC(F)F Amb24088551 [0,2,0,0,0,0|2,0,0]=4 8343 B8R0.9 COC(=O)SCC(C)Cl Amb28386344 [0,2,0,0,0,0|1,0,0]=3 8344 B8R0.9 COC(=O)\C=C\C(C)C Amb2689521 [0,2,0,0,0,0|0,0,2]=4 8345 B8R0.9 COC(=O)\C=C\C(C)N Amb33069659 [0,2,0,0,0,0|0,0,2]=4 8346 B8R0.9 COC(=O)\C=C\C(C)N Amb33069671 [0,2,0,0,0,0|0,0,2]=4 8347 B8R0.9 COC(=O)\C=C\C(C)O Amb27484758 [0,2,0,0,0,0|0,0,2]=4 8348 B8R0.9 COC(=O)\C=C\[C@@H](C)N Amb27252211 [0,2,0,0,0,0|0,0,2]=4 8349 B8R0.9 COC(=S)SCC(=O)O Amb26653180 [0,2,0,0,0,0|1,0,1]=4 8350 B8R0.9 COC(C)CCC(=O)O Amb24271104 [0,2,0,0,0,0|0,0,0]=2 8351 B8R0.9 COC(C)CCC(C)=O Amb25880180 [0,2,0,0,0,0|1,0,0]=3 8352 B8R0.9 COC(C)CCC(C)Br Amb28385552 [0,2,0,0,0,0|1,0,1]=4 8353 B8R0.9 COC(C)CNC(=O)Cl Amb35633401 [0,2,0,0,0,0|2,0,0]=4 8354 B8R0.9 COC(C)COC(=O)Cl Amb32656121 [0,2,0,0,0,0|2,0,0]=4 8355 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,2,0,0,0,0|2,0,0]=4 8356 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,2,0,0,0,0|2,0,0]=4 8357 B8R0.9 COC(C)\C=C\C(=O)O Amb27203687 [0,2,0,0,0,0|0,0,2]=4 8358 B8R0.9 COC(F)C#CC(=O)O Amb33169067 [0,2,0,0,0,0|0,0,2]=4 8359 B8R0.9 CON(C)CCC(=O)O Amb27881744 [0,2,0,0,0,0|1,0,0]=3 8360 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [0,2,0,0,0,0|0,0,0]=2 8361 B8R0.9 CO[C@@H](C)CC[C@@H](C)O Amb28065305 [0,2,0,0,0,0|1,0,1]=4 8362 B8R0.9 CO[C@@H](C)CNC(C)=O Amb35605355 [0,2,0,0,0,0|2,0,0]=4 8363 B8R0.9 CO[C@@H](C)CNC(N)=O Amb35641866 [0,2,0,0,0,0|2,0,0]=4 8364 B8R0.9 CO[C@H](C)CNC(C)=O Amb30024558 [0,2,0,0,0,0|2,0,0]=4 8365 B8R0.9 CO[C@H](C)CNC(N)=O Amb29883111 [0,2,0,0,0,0|2,0,0]=4 8366 B8R0.9 CO\C(C)=C\CC(=O)O Amb27963206 [0,2,0,0,0,0|0,0,2]=4 8367 B8R0.9 CO\P(=O)=C\CC(=O)O Amb27199324 [0,2,0,0,0,0|1,0,1]=4 8368 B8R0.9 CS(=O)CCC(N)CO Amb27867840 [0,2,0,0,0,0|2,0,0]=4 8369 B8R0.9 CS(=O)CCC(O)CN Amb27403927 [0,2,0,0,0,0|2,0,0]=4 8370 B8R0.9 CS(=O)CC\C(N)=N\O Amb27852254 [0,2,0,0,0,0|2,0,0]=4 8371 B8R0.9 CSC(=O)CCC(C)C Amb25743840 [0,2,0,0,0,0|0,1,0]=3 8372 B8R0.9 CSC(=O)CCC(C)O Amb28065144 [0,2,0,0,0,0|0,1,0]=3 8373 B8R0.9 CSC(C)CCC(=O)O Amb22059071 [0,2,0,0,0,0|0,0,0]=2 8374 B8R0.9 CSC(C)CCC(N)=O Amb27247670 [0,2,0,0,0,0|1,0,0]=3 8375 B8R0.9 CSC(C)CNC(=O)Cl Amb35633460 [0,2,0,0,0,0|2,0,0]=4 8376 B8R0.9 C[C@@H](CN)CC[N+](=O)[O-] Amb33744961 [0,2,0,0,0,0|1,0,1]=4 8377 B8R0.9 C[C@@H](CO)CC[N+](=O)[O-] Amb13883660 [0,2,0,0,0,0|1,0,1]=4 8378 B8R0.9 C[C@@H](O)CNC(=O)CBr Amb28049185 [0,2,0,0,0,0|2,0,0]=4 8379 B8R0.9 C[C@@H](O)CNC(=O)CN Amb27495538 [0,2,0,0,0,0|2,0,0]=4 8380 B8R0.9 C[C@H](CN)CC[N+](=O)[O-] Amb33748017 [0,2,0,0,0,0|1,0,1]=4 8381 B8R0.9 C[C@H](CO)CC[N+](=O)[O-] Amb33743126 [0,2,0,0,0,0|1,0,1]=4 8382 B8R0.9 C[C@H](O)CC[C@H](C)CO Amb28049197 [0,2,0,0,0,0|1,0,1]=4 8383 B8R0.9 C[C@H](O)CNC(=O)CCl Amb28049186 [0,2,0,0,0,0|2,0,0]=4 8384 B8R0.9 C[C@H](O)CNC(=O)CN Amb27399091 [0,2,0,0,0,0|2,0,0]=4 8385 B8R0.9 C[C@H](O)CNC(=O)CO Amb27829811 [0,2,0,0,0,0|1,0,0]=3 8386 B8R0.9 C\C(C#N)=C\CC(=O)O Amb27196398 [0,2,0,0,0,0|0,0,2]=4 8387 B8R0.9 C\C(C=O)=C\CC(C)C Amb24573481 [0,2,0,0,0,0|1,0,1]=4 8388 B8R0.9 C\C(CCC(=O)O)=N/O Amb25138471 [0,2,0,0,0,0|0,0,1]=3 8389 B8R0.9 C\C(CCC(C)C)=N/O Amb25235824 [0,2,0,0,0,0|1,0,0]=3 8390 B8R0.9 C\C(CCC(C)C)=N\O Amb24547350 [0,2,0,0,0,0|1,0,0]=3 8391 B8R0.9 C\C(CCN(C)C)=N/O Amb27813221 [0,2,0,0,0,0|2,0,0]=4 8392 B8R0.9 C\C(CSC(C)C)=N/O Amb27406156 [0,2,0,0,0,0|2,0,0]=4 8393 B8R0.9 C\C=C(\C)CCC(C)=O Amb24610198 [0,2,0,0,0,0|1,0,1]=4 8394 B8R0.9 N#CC(N)CCC(=O)O Amb27596135 [0,2,0,0,0,0|0,0,1]=3 8395 B8R0.9 N#CC(N)CCC(=O)O Amb30666632 [0,2,0,0,0,0|0,0,1]=3 8396 B8R0.9 N=C(CCl)NCC(=O)O Amb28282661 [0,2,0,0,0,0|1,0,1]=4 8397 B8R0.9 NC(=O)CCC(O)CO Amb28073389 [0,2,0,0,0,0|1,0,0]=3 8398 B8R0.9 NC(=O)CC[C@H](N)CF Amb27431484 [0,2,0,0,0,0|1,0,0]=3 8399 B8R0.9 NC(=O)CC[C@H](N)CO Amb24368577 [0,2,0,0,0,0|1,0,0]=3 8400 B8R0.9 NC(=O)OCC(Br)CBr Amb22732242 [0,2,0,0,0,0|2,0,0]=4 8401 B8R0.9 NC(=O)OCC(Cl)CCl Amb27771643 [0,2,0,0,0,0|2,0,0]=4 8402 B8R0.9 NC(=O)OCC(N)CO Amb27956487 [0,2,0,0,0,0|2,0,0]=4 8403 B8R0.9 NC(CCl)CCC(=O)O Amb27440510 [0,2,0,0,0,0|0,0,0]=2 8404 B8R0.9 NC(CF)CCC(=O)Cl Amb27876552 [0,2,0,0,0,0|1,0,0]=3 8405 B8R0.9 NC(CF)CCC(=O)O Amb19148378 [0,2,0,0,0,0|0,0,0]=2 8406 B8R0.9 NC(CF)CCC(=O)O Amb33473114 [0,2,0,0,0,0|0,0,0]=2 8407 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [0,2,0,0,0,0|0,0,0]=2 8408 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [0,2,0,0,0,0|0,0,0]=2 8409 B8R0.9 NC(CS)CCC(=O)O Amb27458291 [0,2,0,0,0,0|0,0,0]=2 8410 B8R0.9 NCC(=O)CCC(=O)O Amb2720232 [0,2,0,0,0,0|0,0,1]=3 8411 B8R0.9 NCC(=O)CCC(=O)O Amb5395775 [0,2,0,0,0,0|0,0,1]=3 8412 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,2,0,0,0,0|1,0,1]=4 8413 B8R0.9 NCC(=O)NCC(=O)O Amb8382637 [0,2,0,0,0,0|1,0,1]=4 8414 B8R0.9 NCC(N)CCC(=O)O Amb19328773 [0,2,0,0,0,0|0,0,0]=2 8415 B8R0.9 NCC(N)CCC(=O)O Amb27837536 [0,2,0,0,0,0|0,0,0]=2 8416 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [0,2,0,0,0,0|0,0,0]=2 8417 B8R0.9 NCC(O)CCC(=O)[O-] Amb33330648 [0,2,0,0,0,0|0,0,1]=3 8418 B8R0.9 NCC(O)CNC(N)=O Amb27838588 [0,2,0,0,0,0|2,0,0]=4 8419 B8R0.9 NCC(O)CNC(N)=O Amb33457634 [0,2,0,0,0,0|2,0,0]=4 8420 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [0,2,0,0,0,0|0,0,0]=2 8421 B8R0.9 NC[C@H](N)CCC(=O)O Amb28068164 [0,2,0,0,0,0|0,0,0]=2 8422 B8R0.9 N[C@@H](CS)CCC(=O)O Amb28341808 [0,2,0,0,0,0|0,0,0]=2 8423 B8R0.9 N[C@H](CF)CCC(=O)O Amb32729481 [0,2,0,0,0,0|0,0,0]=2 8424 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [0,2,0,0,0,0|0,0,0]=2 8425 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [0,2,0,0,0,0|0,0,0]=2 8426 B8R0.9 O=C(Cl)OCC(Cl)CCl Amb27758582 [0,2,0,0,0,0|2,0,0]=4 8427 B8R0.9 O=C(O)CCC(=O)CCl Amb25736440 [0,2,0,0,0,0|0,0,1]=3 8428 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [0,2,0,0,0,0|0,0,0]=2 8429 B8R0.9 O=C(O)CCC(S)CS Amb27407074 [0,2,0,0,0,0|0,0,0]=2 8430 B8R0.9 O=C(O)CC\C(O)=N\O Amb24745795 [0,2,0,0,0,0|1,0,1]=4 8431 B8R0.9 O=C(O)CNC(=O)CCl Amb1144436 [0,2,0,0,0,0|1,0,1]=4 8432 B8R0.9 O=C(O)CNC(=O)CO Amb18124375 [0,2,0,0,0,0|1,0,1]=4 8433 B8R0.9 O=C(O)COC(=O)CCl Amb18644547 [0,2,0,0,0,0|1,0,1]=4 8434 B8R0.9 O=C(O)CSC(=O)CS Amb27213308 [0,2,0,0,0,0|1,0,1]=4 8435 B8R0.9 O=C(O)\C=C\C(O)CO Amb18642875 [0,2,0,0,0,0|0,0,2]=4 8436 B8R0.9 O=C(O)\C=C\[C@H](O)CO Amb27437218 [0,2,0,0,0,0|0,0,2]=4 8437 B8R0.9 O=CC(=O)CCC(=O)O Amb18642737 [0,2,0,0,0,0|0,0,2]=4 8438 B8R0.9 O=NN(O)CCC(=O)O Amb27495384 [0,2,0,0,0,0|2,0,0]=4 8439 B8R0.11 C#CC(CO)CCCC Amb28460669 [0,2,0,0,0,0|1,0,1]=4 8440 B8R0.11 C=C=C(CCCBr)OC Amb27424624 [0,2,0,0,0,0|2,0,0]=4 8441 B8R0.11 C=C=C(CO)CCCC Amb28315430 [0,2,0,0,0,0|1,0,0]=3 8442 B8R0.11 C=CN(C=O)CCCC Amb28386437 [0,2,0,0,0,0|2,0,0]=4 8443 B8R0.11 C=C[C@@H](CO)CCCC Amb27652686 [0,2,0,0,0,0|1,0,1]=4 8444 B8R0.11 C=C\C(=C/Br)CCCC Amb27637668 [0,2,0,0,0,0|2,0,0]=4 8445 B8R0.11 CCCCC(C#N)C=O Amb27775574 [0,2,0,0,0,0|1,0,1]=4 8446 B8R0.11 CCCCC(C=O)C=O Amb24365233 [0,2,0,0,0,0|0,0,2]=4 8447 B8R0.11 CCCCC(C=O)CC Amb534281 [0,2,0,0,0,0|1,0,1]=4 8448 B8R0.11 CCCCC(C=O)CO Amb28144205 [0,2,0,0,0,0|0,0,1]=3 8449 B8R0.11 CCCCC(C=O)CS Amb27256571 [0,2,0,0,0,0|0,1,1]=4 8450 B8R0.11 CCCCC(C=O)SC Amb18124546 [0,2,0,0,0,0|0,1,1]=4 8451 B8R0.11 CCCCC(CBr)OC Amb28118948 [0,2,0,0,0,0|1,0,1]=4 8452 B8R0.11 CCCCC(CC)CO Amb3939324 [0,2,0,0,0,0|1,0,1]=4 8453 B8R0.11 CCCCC(CC)ON Amb27978532 [0,2,0,0,0,0|1,0,1]=4 8454 B8R0.11 CCCCC(CN)CO Amb27255723 [0,2,0,0,0,0|1,0,1]=4 8455 B8R0.11 CCCCC(CN)OC Amb26656345 [0,2,0,0,0,0|1,0,1]=4 8456 B8R0.11 CCCCC(CO)NC Amb24120141 [0,2,0,0,0,0|1,0,1]=4 8457 B8R0.11 CCCCC(CO)SC Amb27766567 [0,2,0,0,0,0|0,1,1]=4 8458 B8R0.11 CCCCN(C=O)CO Amb28366870 [0,2,0,0,0,0|1,0,0]=3 8459 B8R0.11 CCCCN(CC)N=O Amb22055949 [0,2,0,0,0,0|2,0,0]=4 8460 B8R0.11 CCCCP(CO)CO Amb25887216 [0,2,0,0,0,0|1,0,1]=4 8461 B8R0.11 CCCC[C@@H](CC)CO Amb27659806 [0,2,0,0,0,0|1,0,1]=4 8462 B8R0.11 CCCC[C@@H](CO)NC Amb27596040 [0,2,0,0,0,0|1,0,1]=4 8463 B8R0.11 CCCC[C@H](C=O)CC Amb27412091 [0,2,0,0,0,0|1,0,1]=4 8464 B8R0.11 CCCC[C@H](CO)OC Amb27956602 [0,2,0,0,0,0|0,0,2]=4 8465 B8R0.11 CCCC\C(=C\F)CN Amb28411484 [0,2,0,0,0,0|2,0,0]=4 8466 B8R0.11 CCCC\C(C=O)=C/N Amb27778578 [0,2,0,0,0,0|1,0,0]=3 8467 B8R0.11 CCCC\C(C=O)=C/O Amb27789093 [0,2,0,0,0,0|0,0,0]=2 8468 B8R0.11 CCCC\C(C=O)=C\N Amb27389633 [0,2,0,0,0,0|1,0,0]=3 8469 B8R0.11 CCCN\C(CC)=N\O Amb27472777 [0,2,0,0,0,0|2,0,0]=4 8470 B8R0.11 CCC\C=C(/C=O)CC Amb24553023 [0,2,0,0,0,0|1,0,1]=4 8471 B8R0.11 CCC\C=C(/CC)CO Amb4035898 [0,2,0,0,0,0|1,0,1]=4 8472 B8R0.11 CCC\C=C(\C=O)CC Amb2721034 [0,2,0,0,0,0|1,0,1]=4 8473 B8R0.11 CCC\C=C(\CC)CO Amb28059781 [0,2,0,0,0,0|1,0,1]=4 8474 B8R0.11 CCC\C=C(\CO)OC Amb27443175 [0,2,0,0,0,0|0,0,2]=4 8475 B8R0.11 CC\C(CCCCl)=N/O Amb27165091 [0,2,0,0,0,0|2,0,0]=4 8476 B8R0.11 COC(C=O)CCCCl Amb27810864 [0,2,0,0,0,0|1,0,1]=4 8477 B8R0.11 C\C=C(/C=O)CCCO Amb27788394 [0,2,0,0,0,0|2,0,0]=4 8478 B8R0.11 N\C=C(/C=O)CCCO Amb25307863 [0,2,0,0,0,0|2,0,0]=4 8479 B8R0.25 C#CC(C)(O)CCCC Amb1063489 [0,2,0,0,0,0|1,0,1]=4 8480 B8R0.25 C=CS(=O)(=O)CCCC Amb1085957 [0,2,0,0,0,0|1,0,1]=4 8481 B8R0.25 CCCCC(C)(C)C=O Amb18642677 [0,2,0,0,0,0|1,0,1]=4 8482 B8R0.25 CCCCC(C)(C)CO Amb22228162 [0,2,0,0,0,0|1,0,1]=4 8483 B8R0.25 CCCCC(C)(C)ON Amb33428086 [0,2,0,0,0,0|1,0,1]=4 8484 B8R0.25 CCCCC(C)(F)CO Amb27208184 [0,2,0,0,0,0|1,0,1]=4 8485 B8R0.25 CCCCC(C)(N)CO Amb27152411 [0,2,0,0,0,0|1,0,1]=4 8486 B8R0.25 CCCCC(C)(N)CO Amb28555376 [0,2,0,0,0,0|1,0,1]=4 8487 B8R0.25 CCCCC(C)(O)CCl Amb25760612 [0,2,0,0,0,0|1,0,1]=4 8488 B8R0.25 CCCCC(C)(O)CN Amb22713404 [0,2,0,0,0,0|1,0,1]=4 8489 B8R0.25 CCCCC(Cl)(Cl)C=O Amb2720226 [0,2,0,0,0,0|1,0,1]=4 8490 B8R0.25 CCCCC(F)(F)CO Amb32744758 [0,2,0,0,0,0|1,0,1]=4 8491 B8R0.25 CCCCS(=O)(=O)CCl Amb8502986 [0,2,0,0,0,0|1,0,1]=4 8492 B8R0.25 CCCCS(=O)(=O)NC Amb1134930 [0,2,0,0,0,0|1,0,1]=4 8493 B8R0.25 CCCCS(=O)(=O)NN Amb6247301 [0,2,0,0,0,0|1,0,1]=4 8494 B8R0.25 CCCCS(=O)(=O)NO Amb17232119 [0,2,0,0,0,0|1,0,0]=3 8495 B8R0.25 CCCC[C@@](C)(F)CO Amb27617053 [0,2,0,0,0,0|1,0,1]=4 8496 B8R0.25 CCCC[C@@](C)(O)C=O Amb27614157 [0,2,0,0,0,0|0,0,1]=3 8497 B8R0.25 CCCC[C@](C)(F)CO Amb28049244 [0,2,0,0,0,0|1,0,1]=4 8498 B8R0.25 CCCC[Si](C)(C)OC Amb2685635 [0,2,0,0,0,0|1,1,0]=4 8499 B8R0.25 CCCOP(=O)(O)OC Amb27430040 [0,2,0,0,0,0|2,0,0]=4 8500 B8R0.25 CCCOP(C)(=O)CO Amb28315420 [0,2,0,0,0,0|2,0,0]=4 8501 B8R0.25 CCCSP(=O)(S)OC Amb27880707 [0,2,0,0,0,0|2,0,0]=4 8502 B8R0.25 CCNCP(=O)(O)CC Amb27790812 [0,2,0,0,0,0|2,0,0]=4 8503 B8R0.25 CCNCP(=O)(O)CO Amb27873445 [0,2,0,0,0,0|2,0,0]=4 8504 B8R0.25 CCOCC(C)(O)C=O Amb27461744 [0,2,0,0,0,0|1,0,1]=4 8505 B8R0.25 CCP(=O)(O)CCCN Amb26898508 [0,2,0,0,0,0|2,0,0]=4 8506 B8R0.25 CNCCP(=O)(O)CN Amb27236322 [0,2,0,0,0,0|2,0,0]=4 8507 B8R0.25 COS(=O)(=O)CCCO Amb28049148 [0,2,0,0,0,0|2,0,0]=4 8508 B8R0.25 O=S(=O)(CCCCl)NO Amb28059369 [0,2,0,0,0,0|2,0,0]=4 8509 B8R0.7 C#CCCCCC(=O)Cl Amb28312904 [0,2,0,0,0,0|1,0,0]=3 8510 B8R0.7 C#CCCCCC(=O)O Amb2721485 [0,2,0,0,0,0|0,0,0]=2 8511 B8R0.7 C#CCCCC[C@@H](C)O Amb27207329 [0,2,0,0,0,0|1,0,1]=4 8512 B8R0.7 C#CCCCC[C@H](C)O Amb28315512 [0,2,0,0,0,0|1,0,1]=4 8513 B8R0.7 C#CCCOCC(=O)O Amb28118359 [0,2,0,0,0,0|0,0,1]=3 8514 B8R0.7 C#CCCSCC(C)=O Amb27218867 [0,2,0,0,0,0|1,0,1]=4 8515 B8R0.7 C#CCOCCC(=O)O Amb9208654 [0,2,0,0,0,0|0,0,1]=3 8516 B8R0.7 C#CCOCCC(N)=O Amb27837665 [0,2,0,0,0,0|1,0,1]=4 8517 B8R0.7 C#CCSCCC(C)=O Amb27946691 [0,2,0,0,0,0|1,0,1]=4 8518 B8R0.7 C#CCSCCC(N)=O Amb27856148 [0,2,0,0,0,0|1,0,1]=4 8519 B8R0.7 C#C\C=C\CCC(=O)O Amb10605297 [0,2,0,0,0,0|0,0,2]=4 8520 B8R0.7 C=C(Br)CCCCC=O Amb28200066 [0,2,0,0,0,0|2,0,0]=4 8521 B8R0.7 C=C(Br)CCNCCO Amb27616621 [0,2,0,0,0,0|2,0,0]=4 8522 B8R0.7 C=C(Br)CNCCCF Amb27169577 [0,2,0,0,0,0|2,0,0]=4 8523 B8R0.7 C=C(Br)CNCCCN Amb18330318 [0,2,0,0,0,0|2,0,0]=4 8524 B8R0.7 C=C(Br)CNOCCC Amb27824492 [0,2,0,0,0,0|2,0,0]=4 8525 B8R0.7 C=C(Br)COCCCC Amb27956559 [0,2,0,0,0,0|2,0,0]=4 8526 B8R0.7 C=C(Br)COCCNC Amb18324681 [0,2,0,0,0,0|2,0,0]=4 8527 B8R0.7 C=C(Br)CSCCCF Amb27827023 [0,2,0,0,0,0|2,0,0]=4 8528 B8R0.7 C=C(C)C#CCCCC Amb27602312 [0,2,0,0,0,0|2,0,0]=4 8529 B8R0.7 C=C(C)CCCCC#N Amb6298906 [0,2,0,0,0,0|2,0,0]=4 8530 B8R0.7 C=C(C)CCCCC=O Amb27750320 [0,2,0,0,0,0|2,0,0]=4 8531 B8R0.7 C=C(C)CCCCCBr Amb28436917 [0,2,0,0,0,0|2,0,0]=4 8532 B8R0.7 C=C(C)CCCCCC Amb6298939 [0,2,0,0,0,0|2,0,0]=4 8533 B8R0.7 C=C(C)CCCCCO Amb27641867 [0,2,0,0,0,0|2,0,0]=4 8534 B8R0.7 C=C(C)CCNCCC Amb27813957 [0,2,0,0,0,0|2,0,0]=4 8535 B8R0.7 C=C(C)CCOCCBr Amb27242287 [0,2,0,0,0,0|2,0,0]=4 8536 B8R0.7 C=C(C)CCSCCN Amb28123809 [0,2,0,0,0,0|2,0,0]=4 8537 B8R0.7 C=C(C)CNCCCC Amb17308646 [0,2,0,0,0,0|2,0,0]=4 8538 B8R0.7 C=C(C)CNCCCF Amb27494348 [0,2,0,0,0,0|2,0,0]=4 8539 B8R0.7 C=C(C)CNCCCN Amb28044366 [0,2,0,0,0,0|2,0,0]=4 8540 B8R0.7 C=C(C)CNCCCO Amb28285230 [0,2,0,0,0,0|2,0,0]=4 8541 B8R0.7 C=C(C)CNCCNC Amb28457188 [0,2,0,0,0,0|2,0,0]=4 8542 B8R0.7 C=C(C)COCCCC Amb22641495 [0,2,0,0,0,0|2,0,0]=4 8543 B8R0.7 C=C(C)COCCCN Amb28123400 [0,2,0,0,0,0|2,0,0]=4 8544 B8R0.7 C=C(C)COCCNC Amb27217708 [0,2,0,0,0,0|2,0,0]=4 8545 B8R0.7 C=C(C)CONCCC Amb28074460 [0,2,0,0,0,0|2,0,0]=4 8546 B8R0.7 C=C(C)CSCCCC Amb9787751 [0,2,0,0,0,0|2,0,0]=4 8547 B8R0.7 C=C(C)CSCCNC Amb28250295 [0,2,0,0,0,0|2,0,0]=4 8548 B8R0.7 C=C(Cl)CCCCC#N Amb6298896 [0,2,0,0,0,0|2,0,0]=4 8549 B8R0.7 C=C(Cl)CCCCCCl Amb6298881 [0,2,0,0,0,0|2,0,0]=4 8550 B8R0.7 C=C(Cl)CNCCCF Amb27835297 [0,2,0,0,0,0|2,0,0]=4 8551 B8R0.7 C=C(Cl)CNCCSC Amb27783779 [0,2,0,0,0,0|2,0,0]=4 8552 B8R0.7 C=C(Cl)COCCCN Amb28197915 [0,2,0,0,0,0|2,0,0]=4 8553 B8R0.7 C=C(Cl)CSCCCF Amb27783661 [0,2,0,0,0,0|2,0,0]=4 8554 B8R0.7 C=C(Cl)CSCCCS Amb27401749 [0,2,0,0,0,0|2,0,0]=4 8555 B8R0.7 C=C(Cl)CSCCNC Amb27421610 [0,2,0,0,0,0|2,0,0]=4 8556 B8R0.7 C=C(Cl)CSCCOC Amb28281528 [0,2,0,0,0,0|2,0,0]=4 8557 B8R0.7 C=C(F)CNCCOC Amb27632960 [0,2,0,0,0,0|2,0,0]=4 8558 B8R0.7 C=CC#CCCC(=O)O Amb28422492 [0,2,0,0,0,0|0,0,2]=4 8559 B8R0.7 C=CCCC#CC(=O)O Amb28201250 [0,2,0,0,0,0|0,0,2]=4 8560 B8R0.7 C=CCCCCB(O)O Amb20171333 [0,2,0,0,0,0|1,0,1]=4 8561 B8R0.7 C=CCCCCC(=O)O Amb6299578 [0,2,0,0,0,0|0,0,0]=2 8562 B8R0.7 C=CCCCCC(C)=O Amb24546961 [0,2,0,0,0,0|1,0,0]=3 8563 B8R0.7 C=CCCCCC(N)=O Amb27236725 [0,2,0,0,0,0|1,0,0]=3 8564 B8R0.7 C=CCCCCC(N)=S Amb27950014 [0,2,0,0,0,0|1,1,0]=4 8565 B8R0.7 C=CCCCCN(C)O Amb27626977 [0,2,0,0,0,0|2,0,0]=4 8566 B8R0.7 C=CCCCC[N+](=O)[O-] Amb9825999 [0,2,0,0,0,0|1,0,1]=4 8567 B8R0.7 C=CCCCOC(C)=O Amb6366589 [0,2,0,0,0,0|1,0,1]=4 8568 B8R0.7 C=CCCNCC(N)=O Amb33545653 [0,2,0,0,0,0|1,0,1]=4 8569 B8R0.7 C=CCCOCC(=O)O Amb7793843 [0,2,0,0,0,0|0,0,1]=3 8570 B8R0.7 C=CCCOCC(C)=O Amb27465238 [0,2,0,0,0,0|1,0,1]=4 8571 B8R0.7 C=CCCSCC(=O)O Amb27810806 [0,2,0,0,0,0|0,0,1]=3 8572 B8R0.7 C=CCC\C=C\C(=O)O Amb25756053 [0,2,0,0,0,0|0,0,2]=4 8573 B8R0.7 C=CCNCCC(=O)O Amb33527032 [0,2,0,0,0,0|0,0,1]=3 8574 B8R0.7 C=CCNCCC(=O)O Amb7755724 [0,2,0,0,0,0|0,0,1]=3 8575 B8R0.7 C=CCNCCC(N)=O Amb8841114 [0,2,0,0,0,0|1,0,1]=4 8576 B8R0.7 C=CCOCCC(N)=O Amb27844989 [0,2,0,0,0,0|1,0,1]=4 8577 B8R0.7 C=CC\C=C\CC(=O)O Amb18642408 [0,2,0,0,0,0|0,0,2]=4 8578 B8R0.7 C=C\C=C\CCC(=O)O Amb10605294 [0,2,0,0,0,0|0,0,2]=4 8579 B8R0.7 C=NCCCNC(C)=O Amb27950176 [0,2,0,0,0,0|1,0,1]=4 8580 B8R0.7 CC#CC#CCC(=O)O Amb28320530 [0,2,0,0,0,0|0,0,2]=4 8581 B8R0.7 CC#CCC#CC(=O)O Amb27180050 [0,2,0,0,0,0|0,0,2]=4 8582 B8R0.7 CC#CCCCC(=O)O Amb28046337 [0,2,0,0,0,0|0,0,0]=2 8583 B8R0.7 CC#CCCCC(N)=O Amb27853693 [0,2,0,0,0,0|1,0,0]=3 8584 B8R0.7 CC#CCNCC(=O)O Amb28410306 [0,2,0,0,0,0|0,0,1]=3 8585 B8R0.7 CC#CCOCC(C)=O Amb25112537 [0,2,0,0,0,0|1,0,1]=4 8586 B8R0.7 CC#CCSCC(C)=O Amb27411694 [0,2,0,0,0,0|1,0,1]=4 8587 B8R0.7 CC(=O)CCC#CCCl Amb28203937 [0,2,0,0,0,0|1,0,1]=4 8588 B8R0.7 CC(=O)CCC#CCO Amb27867270 [0,2,0,0,0,0|1,0,1]=4 8589 B8R0.7 CC(=O)CCCCC#N Amb18642300 [0,2,0,0,0,0|1,0,0]=3 8590 B8R0.7 CC(=O)CCCCCBr Amb27401578 [0,2,0,0,0,0|1,0,0]=3 8591 B8R0.7 CC(=O)CCCCCCl Amb26591097 [0,2,0,0,0,0|1,0,0]=3 8592 B8R0.7 CC(=O)CCCCCN Amb22641918 [0,2,0,0,0,0|1,0,0]=3 8593 B8R0.7 CC(=O)CCCCCN Amb24113384 [0,2,0,0,0,0|1,0,0]=3 8594 B8R0.7 CC(=O)CCCCCO Amb27237283 [0,2,0,0,0,0|1,0,0]=3 8595 B8R0.7 CC(=O)CCCN=[N+]=[N-] Amb28457742 [0,2,0,0,0,0|2,0,0]=4 8596 B8R0.7 CC(=O)CCCOC=O Amb1033032 [0,2,0,0,0,0|1,0,1]=4 8597 B8R0.7 CC(=O)CCCSC#N Amb26984900 [0,2,0,0,0,0|1,0,1]=4 8598 B8R0.7 CC(=O)CCC\C=C\Cl Amb26336040 [0,2,0,0,0,0|1,0,1]=4 8599 B8R0.7 CC(=O)CCNCCO Amb24481900 [0,2,0,0,0,0|1,0,0]=3 8600 B8R0.7 CC(=O)CCOCCBr Amb32651831 [0,2,0,0,0,0|1,0,0]=3 8601 B8R0.7 CC(=O)CCOCCCl Amb27982282 [0,2,0,0,0,0|1,0,0]=3 8602 B8R0.7 CC(=O)CCOCCN Amb18628609 [0,2,0,0,0,0|1,0,0]=3 8603 B8R0.7 CC(=O)CCSCC#N Amb18927970 [0,2,0,0,0,0|1,0,1]=4 8604 B8R0.7 CC(=O)CC\C=C/CO Amb27828969 [0,2,0,0,0,0|1,0,1]=4 8605 B8R0.7 CC(=O)COCCCN Amb18630475 [0,2,0,0,0,0|1,0,0]=3 8606 B8R0.7 CC(=O)CSCCCF Amb28065634 [0,2,0,0,0,0|1,0,0]=3 8607 B8R0.7 CC(=O)C\C=C\CCCl Amb25729220 [0,2,0,0,0,0|1,0,1]=4 8608 B8R0.7 CC(=O)NCCCC#N Amb28049789 [0,2,0,0,0,0|1,0,1]=4 8609 B8R0.7 CC(=O)NCCCCCl Amb25883586 [0,2,0,0,0,0|1,0,0]=3 8610 B8R0.7 CC(=O)NCCCCF Amb27180576 [0,2,0,0,0,0|1,0,0]=3 8611 B8R0.7 CC(=O)NCCCCI Amb27768800 [0,2,0,0,0,0|1,0,0]=3 8612 B8R0.7 CC(=O)NCCCCN Amb17053700 [0,2,0,0,0,0|1,0,0]=3 8613 B8R0.7 CC(=O)NCCCCO Amb17102977 [0,2,0,0,0,0|1,0,0]=3 8614 B8R0.7 CC(=O)NCCCON Amb17138378 [0,2,0,0,0,0|2,0,0]=4 8615 B8R0.7 CC(=O)NCCCON Amb6308549 [0,2,0,0,0,0|2,0,0]=4 8616 B8R0.7 CC(=O)NOCCCF Amb28436015 [0,2,0,0,0,0|2,0,0]=4 8617 B8R0.7 CC(=O)NOCCCO Amb28205723 [0,2,0,0,0,0|2,0,0]=4 8618 B8R0.7 CC(=O)OCCCCBr Amb2725321 [0,2,0,0,0,0|1,0,0]=3 8619 B8R0.7 CC(=O)OCCCCCl Amb3940275 [0,2,0,0,0,0|1,0,0]=3 8620 B8R0.7 CC(=O)OCCCCI Amb2725257 [0,2,0,0,0,0|1,0,0]=3 8621 B8R0.7 CC(=O)OCCCCN Amb24657282 [0,2,0,0,0,0|1,0,0]=3 8622 B8R0.7 CC(=O)OCCCCO Amb25714960 [0,2,0,0,0,0|1,0,0]=3 8623 B8R0.7 CC(=O)OCCOCBr Amb8395197 [0,2,0,0,0,0|2,0,0]=4 8624 B8R0.7 CC(=O)OCCSCCl Amb28122692 [0,2,0,0,0,0|2,0,0]=4 8625 B8R0.7 CC(=O)OCOCCBr Amb28458426 [0,2,0,0,0,0|2,0,0]=4 8626 B8R0.7 CC(=O)SCCCC#N Amb17607671 [0,2,0,0,0,0|1,0,1]=4 8627 B8R0.7 CC(=O)SCCCC=O Amb22524698 [0,2,0,0,0,0|1,0,1]=4 8628 B8R0.7 CC(=O)SCCCCBr Amb22641871 [0,2,0,0,0,0|1,0,0]=3 8629 B8R0.7 CC(=O)SCCCCN Amb24117263 [0,2,0,0,0,0|1,0,0]=3 8630 B8R0.7 CC(=O)SCCCCN Amb27429858 [0,2,0,0,0,0|1,0,0]=3 8631 B8R0.7 CC(C)=CCCCCBr Amb25933172 [0,2,0,0,0,0|2,0,0]=4 8632 B8R0.7 CC(C)=CCCCCCl Amb32688153 [0,2,0,0,0,0|2,0,0]=4 8633 B8R0.7 CC(C)=CCCCCN Amb28345726 [0,2,0,0,0,0|2,0,0]=4 8634 B8R0.7 CC(C)=CCCCCO Amb28315431 [0,2,0,0,0,0|2,0,0]=4 8635 B8R0.7 CC(O)CCCCCF Amb27660009 [0,2,0,0,0,0|1,0,1]=4 8636 B8R0.7 CC(O)CCCCCO Amb27464322 [0,2,0,0,0,0|1,0,1]=4 8637 B8R0.7 CC(O)CCNCCN Amb27768810 [0,2,0,0,0,0|1,0,1]=4 8638 B8R0.7 CC(O)CNCCCF Amb27273615 [0,2,0,0,0,0|1,0,1]=4 8639 B8R0.7 CC(O)CNCCCO Amb17308669 [0,2,0,0,0,0|1,0,1]=4 8640 B8R0.7 CC(O)COCCCN Amb28318924 [0,2,0,0,0,0|1,0,1]=4 8641 B8R0.7 CC(O)CSCCCS Amb27956596 [0,2,0,0,0,0|1,0,1]=4 8642 B8R0.7 CC=C=CCCC(C)=O Amb27180942 [0,2,0,0,0,0|1,0,1]=4 8643 B8R0.7 CCC#CCCC(=O)O Amb28046178 [0,2,0,0,0,0|0,0,0]=2 8644 B8R0.7 CCC#CCCC(O)O Amb28064154 [0,2,0,0,0,0|0,0,2]=4 8645 B8R0.7 CCCC#CCC(=O)O Amb17593307 [0,2,0,0,0,0|0,0,0]=2 8646 B8R0.7 CCCC#CC[C@@H](C)O Amb27652867 [0,2,0,0,0,0|1,0,1]=4 8647 B8R0.7 CCCCC#CC(=O)O Amb2721486 [0,2,0,0,0,0|0,0,0]=2 8648 B8R0.7 CCCCC#CC(C)=O Amb17593278 [0,2,0,0,0,0|1,0,0]=3 8649 B8R0.7 CCCCC#CC(C)O Amb27231182 [0,2,0,0,0,0|1,0,1]=4 8650 B8R0.7 CCCCC#CC(N)=O Amb27782976 [0,2,0,0,0,0|1,0,0]=3 8651 B8R0.7 CCCCC#C[C@@H](C)O Amb27835165 [0,2,0,0,0,0|1,0,1]=4 8652 B8R0.7 CCCCCC=C(F)F Amb10840486 [0,2,0,0,0,0|2,0,0]=4 8653 B8R0.7 CCCCCCB(O)O Amb2722519 [0,2,0,0,0,0|1,0,1]=4 8654 B8R0.7 CCCCCCC(=O)Cl Amb3940244 [0,2,0,0,0,0|1,0,0]=3 8655 B8R0.7 CCCCCCC(=O)O Amb34915914 [0,2,0,0,0,0|0,0,0]=2 8656 B8R0.7 CCCCCCC(=O)O Amb3499439 [0,2,0,0,0,0|0,0,0]=2 8657 B8R0.7 CCCCCCC(=O)[O-] Amb22729026 [0,2,0,0,0,0|0,0,1]=3 8658 B8R0.7 CCCCCCC(C)=O Amb6891961 [0,2,0,0,0,0|1,0,0]=3 8659 B8R0.7 CCCCCCC(C)O Amb3940385 [0,2,0,0,0,0|1,0,1]=4 8660 B8R0.7 CCCCCCC(N)=O Amb8858816 [0,2,0,0,0,0|1,0,0]=3 8661 B8R0.7 CCCCCCC(O)O Amb27451028 [0,2,0,0,0,0|0,0,2]=4 8662 B8R0.7 CCCCCC[C@@H](C)O Amb8513616 [0,2,0,0,0,0|1,0,1]=4 8663 B8R0.7 CCCCCC[N+](=O)[O-] Amb17618424 [0,2,0,0,0,0|1,0,1]=4 8664 B8R0.7 CCCCCNC(=N)N Amb28049568 [0,2,0,0,0,0|2,0,0]=4 8665 B8R0.7 CCCCCNC(C)=N Amb28127671 [0,2,0,0,0,0|2,0,0]=4 8666 B8R0.7 CCCCCNC(N)=O Amb6246936 [0,2,0,0,0,0|1,0,0]=3 8667 B8R0.7 CCCCCNC(N)=S Amb9212112 [0,2,0,0,0,0|1,1,0]=4 8668 B8R0.7 CCCCCOB(O)O Amb24716868 [0,2,0,0,0,0|1,0,1]=4 8669 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [0,2,0,0,0,0|1,0,0]=3 8670 B8R0.7 CCCCCOC(N)=O Amb27655610 [0,2,0,0,0,0|1,0,0]=3 8671 B8R0.7 CCCCCSC(=N)N Amb20675976 [0,2,0,0,0,0|2,0,0]=4 8672 B8R0.7 CCCCCSC(=N)N Amb23590643 [0,2,0,0,0,0|2,0,0]=4 8673 B8R0.7 CCCCNCC(=O)Cl Amb27189998 [0,2,0,0,0,0|1,0,0]=3 8674 B8R0.7 CCCCNCC(=O)O Amb7766471 [0,2,0,0,0,0|0,0,0]=2 8675 B8R0.7 CCCCNCC(C)O Amb9246458 [0,2,0,0,0,0|1,0,1]=4 8676 B8R0.7 CCCCNCC(N)=O Amb1126543 [0,2,0,0,0,0|1,0,0]=3 8677 B8R0.7 CCCCNCC(N)=O Amb7969721 [0,2,0,0,0,0|1,0,0]=3 8678 B8R0.7 CCCCNN=C(C)C Amb28049741 [0,2,0,0,0,0|2,0,0]=4 8679 B8R0.7 CCCCNNC(N)=S Amb23590674 [0,2,0,0,0,0|1,1,0]=4 8680 B8R0.7 CCCCOCC(=O)O Amb8514871 [0,2,0,0,0,0|0,0,0]=2 8681 B8R0.7 CCCCOCC(C)O Amb4019960 [0,2,0,0,0,0|1,0,1]=4 8682 B8R0.7 CCCCOCC(N)=O Amb27855875 [0,2,0,0,0,0|1,0,0]=3 8683 B8R0.7 CCCCONC(N)=O Amb2899789 [0,2,0,0,0,0|1,0,0]=3 8684 B8R0.7 CCCCSCC(=N)N Amb9479963 [0,2,0,0,0,0|2,0,0]=4 8685 B8R0.7 CCCCSCC(=O)O Amb1138789 [0,2,0,0,0,0|0,0,0]=2 8686 B8R0.7 CCCCSCC(C)O Amb27768766 [0,2,0,0,0,0|1,0,1]=4 8687 B8R0.7 CCCC\C=C/C(C)=O Amb28074727 [0,2,0,0,0,0|1,0,0]=3 8688 B8R0.7 CCCC\C=C\B(O)O Amb10068585 [0,2,0,0,0,0|1,0,1]=4 8689 B8R0.7 CCCC\C=C\C(=O)Cl Amb2688651 [0,2,0,0,0,0|1,0,0]=3 8690 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [0,2,0,0,0,0|0,0,0]=2 8691 B8R0.7 CCCC\C=C\C(=O)[O-] Amb17778116 [0,2,0,0,0,0|0,0,1]=3 8692 B8R0.7 CCCC\C=C\[C@H](C)O Amb27950980 [0,2,0,0,0,0|1,0,1]=4 8693 B8R0.7 CCCNCCC(=O)O Amb18633174 [0,2,0,0,0,0|0,0,0]=2 8694 B8R0.7 CCCNCCC(=O)O Amb2372065 [0,2,0,0,0,0|0,0,0]=2 8695 B8R0.7 CCCNCCC(C)=O Amb24700442 [0,2,0,0,0,0|1,0,0]=3 8696 B8R0.7 CCCNCCC(N)=S Amb17232015 [0,2,0,0,0,0|1,1,0]=4 8697 B8R0.7 CCCNCC[C@@H](C)O Amb27251174 [0,2,0,0,0,0|1,0,1]=4 8698 B8R0.7 CCCNCC[PH](=O)O Amb28056179 [0,2,0,0,0,0|1,0,0]=3 8699 B8R0.7 CCCOCCC(=O)O Amb8874502 [0,2,0,0,0,0|0,0,0]=2 8700 B8R0.7 CCCOCCC(C)=O Amb8874915 [0,2,0,0,0,0|1,0,0]=3 8701 B8R0.7 CCCOCCC(C)O Amb27438490 [0,2,0,0,0,0|1,0,1]=4 8702 B8R0.7 CCCONCC(=O)O Amb27401902 [0,2,0,0,0,0|0,0,0]=2 8703 B8R0.7 CCCO\C=C\C(N)=O Amb28198536 [0,2,0,0,0,0|1,0,1]=4 8704 B8R0.7 CCCSCCC(N)=S Amb17503250 [0,2,0,0,0,0|1,1,0]=4 8705 B8R0.7 CCCS\C=C/C(=O)O Amb18644291 [0,2,0,0,0,0|0,0,1]=3 8706 B8R0.7 CCCS\C=C/C(=O)[O-] Amb19816096 [0,2,0,0,0,0|0,0,2]=4 8707 B8R0.7 CCCS\C=C/C(=O)[O-] Amb6600550 [0,2,0,0,0,0|0,0,2]=4 8708 B8R0.7 CCC\C=C/CC(C)=O Amb27974039 [0,2,0,0,0,0|1,0,0]=3 8709 B8R0.7 CCC\C=C\CC(=N)N Amb33373714 [0,2,0,0,0,0|2,0,0]=4 8710 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [0,2,0,0,0,0|0,0,0]=2 8711 B8R0.7 CCC\C=C\CC(C)=O Amb33429740 [0,2,0,0,0,0|1,0,0]=3 8712 B8R0.7 CCC\C=C\CC(C)O Amb27766099 [0,2,0,0,0,0|1,0,1]=4 8713 B8R0.7 CCC\C=C\CC(N)=S Amb33373713 [0,2,0,0,0,0|1,1,0]=4 8714 B8R0.7 CCC\C=C\CN(C)O Amb33224461 [0,2,0,0,0,0|2,0,0]=4 8715 B8R0.7 CCC\C=C\C[C@@H](C)O Amb33424840 [0,2,0,0,0,0|1,0,1]=4 8716 B8R0.7 CCC\C=C\C[C@H](C)O Amb33358968 [0,2,0,0,0,0|1,0,1]=4 8717 B8R0.7 CCC\C=N\NC(C)=O Amb27613902 [0,2,0,0,0,0|1,0,1]=4 8718 B8R0.7 CCC\C=N\NC(N)=O Amb25690939 [0,2,0,0,0,0|1,0,1]=4 8719 B8R0.7 CCNCC#CC(=O)O Amb33168956 [0,2,0,0,0,0|0,0,1]=3 8720 B8R0.7 CCNCCCC(=O)O Amb30585148 [0,2,0,0,0,0|0,0,0]=2 8721 B8R0.7 CCNCCCC(=O)O Amb6253896 [0,2,0,0,0,0|0,0,0]=2 8722 B8R0.7 CCNCCCC(N)=O Amb24709859 [0,2,0,0,0,0|1,0,0]=3 8723 B8R0.7 CCNCCCS(C)=O Amb27223315 [0,2,0,0,0,0|2,0,0]=4 8724 B8R0.7 CCNCCNC(C)=O Amb6732650 [0,2,0,0,0,0|1,0,0]=3 8725 B8R0.7 CCNCCSC(C)=O Amb27187142 [0,2,0,0,0,0|1,0,0]=3 8726 B8R0.7 CCOCC#CC(N)=O Amb33495806 [0,2,0,0,0,0|1,0,1]=4 8727 B8R0.7 CCOCCCC(=O)O Amb6257602 [0,2,0,0,0,0|0,0,0]=2 8728 B8R0.7 CCOCCNC(=N)N Amb28049323 [0,2,0,0,0,0|2,0,0]=4 8729 B8R0.7 CCOCCNC(C)=N Amb27789482 [0,2,0,0,0,0|2,0,0]=4 8730 B8R0.7 CCOCCNC(N)=O Amb9454688 [0,2,0,0,0,0|1,0,0]=3 8731 B8R0.7 CCOCCOC(=O)Cl Amb22228804 [0,2,0,0,0,0|1,0,0]=3 8732 B8R0.7 CCOCCOC(C)=O Amb8383625 [0,2,0,0,0,0|1,0,0]=3 8733 B8R0.7 CCOCCOC(N)=O Amb27760038 [0,2,0,0,0,0|1,0,0]=3 8734 B8R0.7 CCOCCSC(=N)N Amb20675990 [0,2,0,0,0,0|2,0,0]=4 8735 B8R0.7 CCOC\C=C/C(=O)O Amb27807906 [0,2,0,0,0,0|0,0,1]=3 8736 B8R0.7 CCOC\C=C\C(=O)O Amb19020649 [0,2,0,0,0,0|0,0,1]=3 8737 B8R0.7 CCONCCS(C)=O Amb27247491 [0,2,0,0,0,0|2,0,0]=4 8738 B8R0.7 CCO\C=N\CC(=O)O Amb27440832 [0,2,0,0,0,0|0,0,1]=3 8739 B8R0.7 CCSCCCB(O)O Amb24351131 [0,2,0,0,0,0|1,0,1]=4 8740 B8R0.7 CCSCCCC(=N)N Amb28934927 [0,2,0,0,0,0|2,0,0]=4 8741 B8R0.7 CCSCCCC(=O)O Amb6680204 [0,2,0,0,0,0|0,0,0]=2 8742 B8R0.7 CCSCCCC(C)=O Amb9660283 [0,2,0,0,0,0|1,0,0]=3 8743 B8R0.7 CCSCCCC(C)O Amb26319707 [0,2,0,0,0,0|1,0,1]=4 8744 B8R0.7 CCSCCCC(N)=S Amb28285187 [0,2,0,0,0,0|1,1,0]=4 8745 B8R0.7 CCSCCC[C@@H](C)O Amb33323738 [0,2,0,0,0,0|1,0,1]=4 8746 B8R0.7 CCSCCC[C@H](C)O Amb33323739 [0,2,0,0,0,0|1,0,1]=4 8747 B8R0.7 CCSCCC[N+](=O)[O-] Amb33323726 [0,2,0,0,0,0|1,0,1]=4 8748 B8R0.7 CCSCCNC(=N)N Amb28183780 [0,2,0,0,0,0|2,0,0]=4 8749 B8R0.7 CCSCCNC(C)=O Amb27848944 [0,2,0,0,0,0|1,0,0]=3 8750 B8R0.7 CCSCCNC(N)=O Amb27639100 [0,2,0,0,0,0|1,0,0]=3 8751 B8R0.7 CCSCCSC(=N)N Amb583113 [0,2,0,0,0,0|2,0,0]=4 8752 B8R0.7 CCSC\C=C\C(=O)O Amb33449652 [0,2,0,0,0,0|0,0,1]=3 8753 B8R0.7 CCSC\C=C\C(C)=O Amb33323646 [0,2,0,0,0,0|1,0,1]=4 8754 B8R0.7 CCSSCCC(=O)O Amb27837279 [0,2,0,0,0,0|0,0,0]=2 8755 B8R0.7 CC\C=C/CCC(=O)O Amb25831265 [0,2,0,0,0,0|0,0,0]=2 8756 B8R0.7 CC\C=C/SCC(C)=O Amb24615236 [0,2,0,0,0,0|1,0,1]=4 8757 B8R0.7 CC\C=C\C=C\C(=O)O Amb33359031 [0,2,0,0,0,0|0,0,2]=4 8758 B8R0.7 CC\C=C\CCC(=O)O Amb18642608 [0,2,0,0,0,0|0,0,0]=2 8759 B8R0.7 CC\C=C\CCC(C)=O Amb24523649 [0,2,0,0,0,0|1,0,0]=3 8760 B8R0.7 CC\C=C\CCC(C)O Amb33079835 [0,2,0,0,0,0|1,0,1]=4 8761 B8R0.7 CC\C=C\CCC(N)=O Amb27221048 [0,2,0,0,0,0|1,0,0]=3 8762 B8R0.7 CC\C=C\CC[C@@H](C)O Amb33267991 [0,2,0,0,0,0|1,0,1]=4 8763 B8R0.7 CC\C=C\CC[C@H](C)O Amb33267992 [0,2,0,0,0,0|1,0,1]=4 8764 B8R0.7 CC\C=C\CC[N+](=O)[O-] Amb33267977 [0,2,0,0,0,0|1,0,1]=4 8765 B8R0.7 CC\C=C\CNC(C)=O Amb27828159 [0,2,0,0,0,0|1,0,1]=4 8766 B8R0.7 CC\C=C\COC(C)=O Amb27487199 [0,2,0,0,0,0|1,0,1]=4 8767 B8R0.7 CC\C=C\OCC(C)=O Amb25235223 [0,2,0,0,0,0|1,0,1]=4 8768 B8R0.7 CC\C=C\SCC(C)=O Amb28245395 [0,2,0,0,0,0|1,0,1]=4 8769 B8R0.7 CNCCCCC(=O)O Amb10605773 [0,2,0,0,0,0|0,0,0]=2 8770 B8R0.7 CNCCCCC(=O)O Amb24340485 [0,2,0,0,0,0|0,0,0]=2 8771 B8R0.7 CNCCCCC(C)O Amb17569923 [0,2,0,0,0,0|1,0,1]=4 8772 B8R0.7 CNCCCCC(N)=O Amb27780478 [0,2,0,0,0,0|1,0,0]=3 8773 B8R0.7 CNCCCNC(=S)S Amb26390720 [0,2,0,0,0,0|0,2,0]=4 8774 B8R0.7 CNCCCNC(C)=O Amb33547919 [0,2,0,0,0,0|1,0,0]=3 8775 B8R0.7 CNCCCNC(C)=O Amb34913785 [0,2,0,0,0,0|1,0,0]=3 8776 B8R0.7 CNCCCNC(C)=O Amb9464418 [0,2,0,0,0,0|1,0,0]=3 8777 B8R0.7 CNCCCNS(C)=O Amb27186838 [0,2,0,0,0,0|2,0,0]=4 8778 B8R0.7 CNCCOCC(=O)O Amb18630741 [0,2,0,0,0,0|0,0,0]=2 8779 B8R0.7 CNCCOCC(C)=O Amb18111838 [0,2,0,0,0,0|1,0,0]=3 8780 B8R0.7 CNCCOCC(N)=O Amb27447982 [0,2,0,0,0,0|1,0,0]=3 8781 B8R0.7 COCC#CCC(=O)O Amb27663198 [0,2,0,0,0,0|0,0,1]=3 8782 B8R0.7 COCCC#CC(=O)O Amb27392974 [0,2,0,0,0,0|0,0,1]=3 8783 B8R0.7 COCCCCB(O)O Amb27230891 [0,2,0,0,0,0|1,0,1]=4 8784 B8R0.7 COCCCCC(=O)O Amb9207785 [0,2,0,0,0,0|0,0,0]=2 8785 B8R0.7 COCCCCC(C)=O Amb9659801 [0,2,0,0,0,0|1,0,0]=3 8786 B8R0.7 COCCCCC(C)O Amb25235448 [0,2,0,0,0,0|1,0,1]=4 8787 B8R0.7 COCCCCS(=O)Cl Amb32720517 [0,2,0,0,0,0|2,0,0]=4 8788 B8R0.7 COCCCCS(=O)[O-] Amb32754745 [0,2,0,0,0,0|1,0,1]=4 8789 B8R0.7 COCCCCS(N)=O Amb32720518 [0,2,0,0,0,0|2,0,0]=4 8790 B8R0.7 COCCCC[C@@H](C)O Amb33377490 [0,2,0,0,0,0|1,0,1]=4 8791 B8R0.7 COCCCC[C@H](C)O Amb33377491 [0,2,0,0,0,0|1,0,1]=4 8792 B8R0.7 COCCCC[N+](=O)[O-] Amb33377457 [0,2,0,0,0,0|1,0,1]=4 8793 B8R0.7 COCCCNC(=N)N Amb22058724 [0,2,0,0,0,0|2,0,0]=4 8794 B8R0.7 COCCCNC(=N)N Amb33547912 [0,2,0,0,0,0|2,0,0]=4 8795 B8R0.7 COCCCNC(=O)Cl Amb27791959 [0,2,0,0,0,0|1,0,0]=3 8796 B8R0.7 COCCCNC(C)=N Amb28049783 [0,2,0,0,0,0|2,0,0]=4 8797 B8R0.7 COCCCNC(C)=O Amb3358083 [0,2,0,0,0,0|1,0,0]=3 8798 B8R0.7 COCCCNC(N)=O Amb1105274 [0,2,0,0,0,0|1,0,0]=3 8799 B8R0.7 COCCCNC(N)=S Amb2777917 [0,2,0,0,0,0|1,1,0]=4 8800 B8R0.7 COCCCOC(C)=O Amb22732978 [0,2,0,0,0,0|1,0,0]=3 8801 B8R0.7 COCCNCC(=O)O Amb19514667 [0,2,0,0,0,0|0,0,0]=2 8802 B8R0.7 COCCNCC(=O)O Amb7766415 [0,2,0,0,0,0|0,0,0]=2 8803 B8R0.7 COCCNCC(N)=O Amb13951972 [0,2,0,0,0,0|1,0,0]=3 8804 B8R0.7 COCCNCC(N)=O Amb6707121 [0,2,0,0,0,0|1,0,0]=3 8805 B8R0.7 COCCOCC(=O)O Amb2721259 [0,2,0,0,0,0|0,0,0]=2 8806 B8R0.7 COCCOCC(C)=O Amb9665444 [0,2,0,0,0,0|1,0,0]=3 8807 B8R0.7 COCCOCC(C)O Amb25939469 [0,2,0,0,0,0|1,0,1]=4 8808 B8R0.7 COCCOCC(O)O Amb27397097 [0,2,0,0,0,0|0,0,2]=4 8809 B8R0.7 COCCSCC(=O)O Amb6245777 [0,2,0,0,0,0|0,0,0]=2 8810 B8R0.7 COCCSCC(C)O Amb18179365 [0,2,0,0,0,0|1,0,1]=4 8811 B8R0.7 COCCSC[C@H](C)O Amb27977734 [0,2,0,0,0,0|1,0,1]=4 8812 B8R0.7 COCC\C=C\C(=O)O Amb33080389 [0,2,0,0,0,0|0,0,1]=3 8813 B8R0.7 COCC\C=C\C(C)=O Amb33377354 [0,2,0,0,0,0|1,0,1]=4 8814 B8R0.7 COCOCCC(=O)O Amb27784860 [0,2,0,0,0,0|0,0,0]=2 8815 B8R0.7 COCSCCC(=O)O Amb27263382 [0,2,0,0,0,0|0,0,0]=2 8816 B8R0.7 CS(=O)CCCCC#N Amb25711714 [0,2,0,0,0,0|2,0,0]=4 8817 B8R0.7 CS(=O)CCCCC=O Amb27856287 [0,2,0,0,0,0|2,0,0]=4 8818 B8R0.7 CS(=O)CCCCCCl Amb27173793 [0,2,0,0,0,0|2,0,0]=4 8819 B8R0.7 CS(=O)CCNCCCl Amb27222833 [0,2,0,0,0,0|2,0,0]=4 8820 B8R0.7 CS(=O)CCNCCF Amb28138817 [0,2,0,0,0,0|2,0,0]=4 8821 B8R0.7 CSCCCCC(=O)O Amb17503764 [0,2,0,0,0,0|0,0,0]=2 8822 B8R0.7 CSCCCCC(C)=O Amb27815140 [0,2,0,0,0,0|1,0,0]=3 8823 B8R0.7 CSCCCCC(C)O Amb27863049 [0,2,0,0,0,0|1,0,1]=4 8824 B8R0.7 CSCCCCC(N)=O Amb27662727 [0,2,0,0,0,0|1,0,0]=3 8825 B8R0.7 CSCCCC[C@@H](C)O Amb33198291 [0,2,0,0,0,0|1,0,1]=4 8826 B8R0.7 CSCCCC[C@H](C)O Amb33198292 [0,2,0,0,0,0|1,0,1]=4 8827 B8R0.7 CSCCCC[N+](=O)[O-] Amb33198277 [0,2,0,0,0,0|1,0,1]=4 8828 B8R0.7 CSCCCOC(C)=O Amb8392861 [0,2,0,0,0,0|1,0,0]=3 8829 B8R0.7 CSCCNCC(=O)O Amb24401934 [0,2,0,0,0,0|0,0,0]=2 8830 B8R0.7 CSCCNCC(=O)O Amb28934977 [0,2,0,0,0,0|0,0,0]=2 8831 B8R0.7 CSCCNCC(N)=O Amb27850987 [0,2,0,0,0,0|1,0,0]=3 8832 B8R0.7 CSCCNC[C@@H](C)O Amb27785175 [0,2,0,0,0,0|1,0,1]=4 8833 B8R0.7 CSCCOCC(=O)O Amb27392229 [0,2,0,0,0,0|0,0,0]=2 8834 B8R0.7 CSCCONC(C)=O Amb27247630 [0,2,0,0,0,0|2,0,0]=4 8835 B8R0.7 CSCCSCC(=O)O Amb27964765 [0,2,0,0,0,0|0,0,0]=2 8836 B8R0.7 CSCC\C=C\C(=O)O Amb33475293 [0,2,0,0,0,0|0,0,1]=3 8837 B8R0.7 CSCC\C=C\C(C)=O Amb33197615 [0,2,0,0,0,0|1,0,1]=4 8838 B8R0.7 CSC\C=C\CC(=O)O Amb28072070 [0,2,0,0,0,0|0,0,1]=3 8839 B8R0.7 CSSCCCC(=O)O Amb25269470 [0,2,0,0,0,0|0,0,0]=2 8840 B8R0.7 CSSCCNC(C)=O Amb27805193 [0,2,0,0,0,0|2,0,0]=4 8841 B8R0.7 C[C@@H](O)CCCCCO Amb28461367 [0,2,0,0,0,0|1,0,1]=4 8842 B8R0.7 C[C@H](O)CCCCC=O Amb27793108 [0,2,0,0,0,0|1,0,1]=4 8843 B8R0.7 C[C@H](O)CNCCCN Amb27755469 [0,2,0,0,0,0|1,0,1]=4 8844 B8R0.7 C[SiH2]CCCCC(C)O Amb28049251 [0,2,0,0,0,0|1,0,1]=4 8845 B8R0.7 C\C(N)=N\CCCCO Amb28457978 [0,2,0,0,0,0|2,0,0]=4 8846 B8R0.7 C\C=C\C=C\CC(=O)O Amb27755824 [0,2,0,0,0,0|0,0,2]=4 8847 B8R0.7 C\C=C\CC#CC(=O)O Amb24599409 [0,2,0,0,0,0|0,0,2]=4 8848 B8R0.7 C\C=C\CCCC(=O)O Amb18642615 [0,2,0,0,0,0|0,0,0]=2 8849 B8R0.7 C\C=C\CCCC(C)=O Amb24466633 [0,2,0,0,0,0|1,0,0]=3 8850 B8R0.7 C\C=C\CCNC(N)=O Amb27845871 [0,2,0,0,0,0|1,0,1]=4 8851 B8R0.7 C\C=C\CSCC(=O)O Amb9727556 [0,2,0,0,0,0|0,0,1]=3 8852 B8R0.7 C\C=C\C\C=C\C(=O)O Amb27440048 [0,2,0,0,0,0|0,0,2]=4 8853 B8R0.7 C\C=C\OCCC(C)=O Amb24631670 [0,2,0,0,0,0|1,0,1]=4 8854 B8R0.7 FC(F)=CCCCCBr Amb27863490 [0,2,0,0,0,0|2,0,0]=4 8855 B8R0.7 N#CCCCCC(=O)O Amb17593332 [0,2,0,0,0,0|0,0,0]=2 8856 B8R0.7 N#CCCCCC(N)=O Amb24108037 [0,2,0,0,0,0|1,0,0]=3 8857 B8R0.7 N#CCCCCS(=O)Cl Amb32720347 [0,2,0,0,0,0|2,0,0]=4 8858 B8R0.7 N#CCCCCS(=O)[O-] Amb32754250 [0,2,0,0,0,0|1,0,1]=4 8859 B8R0.7 N#CCCCCS(N)=O Amb32720348 [0,2,0,0,0,0|2,0,0]=4 8860 B8R0.7 N#CCCCNC(N)=O Amb27644105 [0,2,0,0,0,0|1,0,1]=4 8861 B8R0.7 N#CCCNCC(=O)O Amb2720474 [0,2,0,0,0,0|0,0,1]=3 8862 B8R0.7 N#CCCSCC(=O)O Amb17502363 [0,2,0,0,0,0|0,0,1]=3 8863 B8R0.7 N#CCSCCC(=O)O Amb6277440 [0,2,0,0,0,0|0,0,1]=3 8864 B8R0.7 N#CCSCCC(N)=O Amb27430604 [0,2,0,0,0,0|1,0,1]=4 8865 B8R0.7 N#CC\C=C\CC(=O)O Amb27762977 [0,2,0,0,0,0|0,0,2]=4 8866 B8R0.7 N#C\C=C\CCC(=O)O Amb27785050 [0,2,0,0,0,0|0,0,2]=4 8867 B8R0.7 N=C(N)CCCCCO Amb27447678 [0,2,0,0,0,0|2,0,0]=4 8868 B8R0.7 N=C(N)CCOCCO Amb6681748 [0,2,0,0,0,0|2,0,0]=4 8869 B8R0.7 N=C(N)NCCCCN Amb19929571 [0,2,0,0,0,0|2,0,0]=4 8870 B8R0.7 N=C(N)NCCCCN Amb2781574 [0,2,0,0,0,0|2,0,0]=4 8871 B8R0.7 N=C(N)NCCCCN Amb3941521 [0,2,0,0,0,0|2,0,0]=4 8872 B8R0.7 N=C(N)SCCCCF Amb28457766 [0,2,0,0,0,0|2,0,0]=4 8873 B8R0.7 NC(=O)C#CCCCCl Amb28133803 [0,2,0,0,0,0|1,0,1]=4 8874 B8R0.7 NC(=O)CCCCCBr Amb2685265 [0,2,0,0,0,0|1,0,0]=3 8875 B8R0.7 NC(=O)CCCCCCl Amb27392074 [0,2,0,0,0,0|1,0,0]=3 8876 B8R0.7 NC(=O)CCCCCF Amb27837777 [0,2,0,0,0,0|1,0,0]=3 8877 B8R0.7 NC(=O)CCCCCO Amb22524369 [0,2,0,0,0,0|1,0,0]=3 8878 B8R0.7 NC(=O)CCCN=C=S Amb19514658 [0,2,0,0,0,0|1,0,1]=4 8879 B8R0.7 NC(=O)CCNCCO Amb4303499 [0,2,0,0,0,0|1,0,0]=3 8880 B8R0.7 NC(=O)CCOCCO Amb28289325 [0,2,0,0,0,0|1,0,0]=3 8881 B8R0.7 NC(=O)CCSCCBr Amb28367265 [0,2,0,0,0,0|1,0,0]=3 8882 B8R0.7 NC(=O)CCSCCCl Amb27620677 [0,2,0,0,0,0|1,0,0]=3 8883 B8R0.7 NC(=O)CNCCCO Amb9246617 [0,2,0,0,0,0|1,0,0]=3 8884 B8R0.7 NC(=O)CSCCCCl Amb28397637 [0,2,0,0,0,0|1,0,0]=3 8885 B8R0.7 NC(=O)CSCCCO Amb27408312 [0,2,0,0,0,0|1,0,0]=3 8886 B8R0.7 NC(=O)CSCCCS Amb27965314 [0,2,0,0,0,0|1,0,0]=3 8887 B8R0.7 NC(=O)NCCCCBr Amb27614497 [0,2,0,0,0,0|1,0,0]=3 8888 B8R0.7 NC(=O)NCCCCF Amb27663218 [0,2,0,0,0,0|1,0,0]=3 8889 B8R0.7 NC(=O)NOCCCO Amb28189929 [0,2,0,0,0,0|2,0,0]=4 8890 B8R0.7 NC(=S)CCCCCF Amb27956470 [0,2,0,0,0,0|1,1,0]=4 8891 B8R0.7 NC(=S)CCOCCO Amb6681260 [0,2,0,0,0,0|1,1,0]=4 8892 B8R0.7 NC(=S)NCCCCF Amb27783801 [0,2,0,0,0,0|1,1,0]=4 8893 B8R0.7 NCCCC#CC(=O)O Amb33168806 [0,2,0,0,0,0|0,0,1]=3 8894 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [0,2,0,0,0,0|1,0,0]=3 8895 B8R0.7 NCCCCCC(=O)O Amb17607928 [0,2,0,0,0,0|0,0,0]=2 8896 B8R0.7 NCCCCCC(=O)O Amb1905625 [0,2,0,0,0,0|0,0,0]=2 8897 B8R0.7 NCCCCCC(=O)[O-] Amb28990947 [0,2,0,0,0,0|0,0,1]=3 8898 B8R0.7 NCCCCNC(=S)S Amb26625184 [0,2,0,0,0,0|0,2,0]=4 8899 B8R0.7 NCCCCNC(N)=O Amb19026975 [0,2,0,0,0,0|1,0,0]=3 8900 B8R0.7 NCCCCNC(N)=O Amb19374296 [0,2,0,0,0,0|1,0,0]=3 8901 B8R0.7 NCCCCNC(N)=S Amb28041776 [0,2,0,0,0,0|1,1,0]=4 8902 B8R0.7 NCCCOCC(=O)O Amb18111435 [0,2,0,0,0,0|0,0,0]=2 8903 B8R0.7 NCCCOCC(=O)O Amb31217489 [0,2,0,0,0,0|0,0,0]=2 8904 B8R0.7 NCCCSCC(=O)O Amb17500676 [0,2,0,0,0,0|0,0,0]=2 8905 B8R0.7 NCCC\C=C\C(=O)O Amb25221789 [0,2,0,0,0,0|0,0,1]=3 8906 B8R0.7 NCCNCCC(=O)O Amb20668304 [0,2,0,0,0,0|0,0,0]=2 8907 B8R0.7 NCCNCCC(=O)O Amb22058790 [0,2,0,0,0,0|0,0,0]=2 8908 B8R0.7 NCCNCCC(N)=O Amb27436823 [0,2,0,0,0,0|1,0,0]=3 8909 B8R0.7 NCCNCC[SH](=O)=O Amb27816609 [0,2,0,0,0,0|1,0,1]=4 8910 B8R0.7 NCCOCCC(=O)O Amb18630461 [0,2,0,0,0,0|0,0,0]=2 8911 B8R0.7 NCCOCCC(=O)O Amb33330744 [0,2,0,0,0,0|0,0,0]=2 8912 B8R0.7 NCCOCCC(N)=O Amb27751130 [0,2,0,0,0,0|1,0,0]=3 8913 B8R0.7 NCCSCCC(=O)O Amb21988844 [0,2,0,0,0,0|0,0,0]=2 8914 B8R0.7 NCCSSCC(=O)O Amb27658690 [0,2,0,0,0,0|1,0,0]=3 8915 B8R0.7 NOCCCCC(=O)O Amb27596055 [0,2,0,0,0,0|0,0,0]=2 8916 B8R0.7 NS(=O)CCCCCBr Amb32720462 [0,2,0,0,0,0|2,0,0]=4 8917 B8R0.7 O=C(Cl)CCCCCBr Amb2685267 [0,2,0,0,0,0|1,0,0]=3 8918 B8R0.7 O=C(Cl)CCCCCCl Amb10844967 [0,2,0,0,0,0|1,0,0]=3 8919 B8R0.7 O=C(Cl)CCCCCO Amb28056558 [0,2,0,0,0,0|1,0,0]=3 8920 B8R0.7 O=C(Cl)CCNCCCl Amb28121157 [0,2,0,0,0,0|1,0,0]=3 8921 B8R0.7 O=C(Cl)CCOCCCl Amb27966437 [0,2,0,0,0,0|1,0,0]=3 8922 B8R0.7 O=C(Cl)OCCCCCl Amb8515449 [0,2,0,0,0,0|1,0,0]=3 8923 B8R0.7 O=C(Cl)\C=C\CCCCl Amb27439280 [0,2,0,0,0,0|1,0,1]=4 8924 B8R0.7 O=C(F)CCCCCCl Amb27173031 [0,2,0,0,0,0|1,0,0]=3 8925 B8R0.7 O=C(O)CCC#CCO Amb27949900 [0,2,0,0,0,0|0,0,1]=3 8926 B8R0.7 O=C(O)CCCCCBr Amb2081955 [0,2,0,0,0,0|0,0,0]=2 8927 B8R0.7 O=C(O)CCCCCCl Amb18796646 [0,2,0,0,0,0|0,0,0]=2 8928 B8R0.7 O=C(O)CCCCCF Amb26063796 [0,2,0,0,0,0|0,0,0]=2 8929 B8R0.7 O=C(O)CCCCCI Amb22736492 [0,2,0,0,0,0|0,0,0]=2 8930 B8R0.7 O=C(O)CCCCCO Amb8515991 [0,2,0,0,0,0|0,0,0]=2 8931 B8R0.7 O=C(O)CCCCNO Amb28410171 [0,2,0,0,0,0|0,0,0]=2 8932 B8R0.7 O=C(O)CCCN=C=S Amb26330552 [0,2,0,0,0,0|0,0,1]=3 8933 B8R0.7 O=C(O)CCNCCF Amb27954272 [0,2,0,0,0,0|0,0,0]=2 8934 B8R0.7 O=C(O)CCNCCO Amb1110010 [0,2,0,0,0,0|0,0,0]=2 8935 B8R0.7 O=C(O)CCNCCS Amb28285239 [0,2,0,0,0,0|0,0,0]=2 8936 B8R0.7 O=C(O)CCOCCBr Amb24057757 [0,2,0,0,0,0|0,0,0]=2 8937 B8R0.7 O=C(O)CCOCCF Amb27807548 [0,2,0,0,0,0|0,0,0]=2 8938 B8R0.7 O=C(O)CCOCCO Amb6680916 [0,2,0,0,0,0|0,0,0]=2 8939 B8R0.7 O=C(O)CCOCCS Amb27226892 [0,2,0,0,0,0|0,0,0]=2 8940 B8R0.7 O=C(O)CCSCCBr Amb27468126 [0,2,0,0,0,0|0,0,0]=2 8941 B8R0.7 O=C(O)CCSCCF Amb27172860 [0,2,0,0,0,0|0,0,0]=2 8942 B8R0.7 O=C(O)CCSCCS Amb18126456 [0,2,0,0,0,0|0,0,0]=2 8943 B8R0.7 O=C(O)CNCCCCl Amb28055692 [0,2,0,0,0,0|0,0,0]=2 8944 B8R0.7 O=C(O)CNCCCF Amb27649256 [0,2,0,0,0,0|0,0,0]=2 8945 B8R0.7 O=C(O)CNCCCO Amb9325805 [0,2,0,0,0,0|0,0,0]=2 8946 B8R0.7 O=C(O)COCCCO Amb28288633 [0,2,0,0,0,0|0,0,0]=2 8947 B8R0.7 O=C(O)COC\C=C\Cl Amb27450817 [0,2,0,0,0,0|0,0,2]=4 8948 B8R0.7 O=C(O)C\C=C/CCO Amb28410474 [0,2,0,0,0,0|0,0,1]=3 8949 B8R0.7 O=C(O)C\C=C\CCO Amb27221056 [0,2,0,0,0,0|0,0,1]=3 8950 B8R0.7 O=C(O)C\C=C\CCS Amb27421360 [0,2,0,0,0,0|0,0,1]=3 8951 B8R0.7 O=C(O)\C=C/SCCO Amb27430273 [0,2,0,0,0,0|0,0,2]=4 8952 B8R0.7 O=C(O)\C=C\CCCCl Amb18644386 [0,2,0,0,0,0|0,0,1]=3 8953 B8R0.7 O=C(O)\C=C\NCCO Amb28056766 [0,2,0,0,0,0|0,0,2]=4 8954 B8R0.7 O=C(O)\C=C\SCCO Amb28281149 [0,2,0,0,0,0|0,0,2]=4 8955 B8R0.7 O=C([O-])CCCCCO Amb22491268 [0,2,0,0,0,0|0,0,1]=3 8956 B8R0.7 O=C=NCCCC(=O)O Amb26014000 [0,2,0,0,0,0|0,0,1]=3 8957 B8R0.7 O=CCCCCC(=O)O Amb18642763 [0,2,0,0,0,0|0,0,0]=2 8958 B8R0.7 O=CCCCCC(O)O Amb28285175 [0,2,0,0,0,0|0,0,2]=4 8959 B8R0.7 O=CC\C=C\CC(=O)O Amb25911988 [0,2,0,0,0,0|0,0,2]=4 8960 B8R0.7 O=CNCCCC(=O)O Amb18305404 [0,2,0,0,0,0|0,0,1]=3 8961 B8R0.7 O=COCCCC(=O)O Amb27217713 [0,2,0,0,0,0|0,0,1]=3 8962 B8R0.7 O=C\C=C\CCC(=O)O Amb26920160 [0,2,0,0,0,0|0,0,2]=4 8963 B8R0.7 O=S(Cl)CCCCCBr Amb32720461 [0,2,0,0,0,0|2,0,0]=4 8964 B8R0.7 O=S([O-])CCCCCBr Amb32755703 [0,2,0,0,0,0|1,0,1]=4 8965 B8R0.7 O=S([O-])CCCCCO Amb27394866 [0,2,0,0,0,0|1,0,1]=4 8966 B8R0.7 O=[N+]([O-])CCCCCO Amb25911225 [0,2,0,0,0,0|1,0,1]=4 8967 B8R0.7 O=[N+]([O-])CCSCCO Amb28045665 [0,2,0,0,0,0|1,0,1]=4 8968 B8R0.7 O=[N+]([O-])OCCCCBr Amb25951247 [0,2,0,0,0,0|1,0,1]=4 8969 B8R0.7 O=[N+]([O-])OCCCCO Amb21929397 [0,2,0,0,0,0|1,0,1]=4 8970 B8R0.7 OB(O)CCCCCBr Amb21856239 [0,2,0,0,0,0|1,0,1]=4 8971 B8R0.7 OB(O)CCCCCCl Amb25047934 [0,2,0,0,0,0|1,0,1]=4 8972 B8R0.7 OCCCCC=C(F)F Amb27225930 [0,2,0,0,0,0|2,0,0]=4 8973 B8R0.7 OCCCCCB(O)O Amb27614305 [0,2,0,0,0,0|1,0,1]=4 8974 B8R0.7 OCCCCSC(=S)S Amb28315412 [0,2,0,0,0,0|0,2,0]=4 8975 B8R0.7 OCCSCCB(O)O Amb27593951 [0,2,0,0,0,0|1,0,1]=4 8976 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [0,2,0,0,0,0|1,0,0]=3 8977 B8R0.21 CC(C)(O)CCCCN Amb17569932 [0,2,0,0,0,0|1,0,1]=4 8978 B8R0.21 CC(C)(O)CCCCO Amb26047691 [0,2,0,0,0,0|1,0,1]=4 8979 B8R0.21 CCCCCS(=O)(=O)Cl Amb2690082 [0,2,0,0,0,0|1,0,1]=4 8980 B8R0.21 CCCCCS(=O)(=O)F Amb32718322 [0,2,0,0,0,0|1,0,1]=4 8981 B8R0.21 CCCCCS(=O)(=O)O Amb10844728 [0,2,0,0,0,0|1,0,0]=3 8982 B8R0.21 CCCCCS(=O)(=O)[O-] Amb2690072 [0,2,0,0,0,0|1,0,1]=4 8983 B8R0.21 CCCCCS(=O)(=O)[O-] Amb4025819 [0,2,0,0,0,0|1,0,1]=4 8984 B8R0.21 CCCCCS(C)(=O)=O Amb27455782 [0,2,0,0,0,0|1,0,1]=4 8985 B8R0.21 CCCCCS(N)(=O)=O Amb16191925 [0,2,0,0,0,0|1,0,1]=4 8986 B8R0.21 CCCCNP(N)(N)=O Amb17610387 [0,2,0,0,0,0|2,0,0]=4 8987 B8R0.21 CCCCNS(=O)(=O)Cl Amb17193917 [0,2,0,0,0,0|1,0,1]=4 8988 B8R0.21 CCCCNS(=O)(=O)O Amb4018979 [0,2,0,0,0,0|1,0,0]=3 8989 B8R0.21 CCCCNS(C)(=O)=O Amb3360690 [0,2,0,0,0,0|1,0,1]=4 8990 B8R0.21 CCCCNS(N)(=O)=O Amb22436420 [0,2,0,0,0,0|1,0,1]=4 8991 B8R0.21 CCCCOP(=O)(O)O Amb24419212 [0,2,0,0,0,0|1,0,0]=3 8992 B8R0.21 CCCCOP(=O)([O-])[O-] Amb24090708 [0,2,0,0,0,0|1,0,1]=4 8993 B8R0.21 CCCCOP(C)(=O)Cl Amb27445528 [0,2,0,0,0,0|2,0,0]=4 8994 B8R0.21 CCCCOS(=O)(=O)O Amb22169780 [0,2,0,0,0,0|1,0,0]=3 8995 B8R0.21 CCCCOS(C)(=O)=O Amb8395242 [0,2,0,0,0,0|1,0,1]=4 8996 B8R0.21 CCCCOS(N)(=O)=O Amb27150044 [0,2,0,0,0,0|1,0,1]=4 8997 B8R0.21 CCCCO[Si](O)(O)O Amb27658765 [0,2,0,0,0,0|0,1,1]=4 8998 B8R0.21 CCCNCC(C)(C)O Amb33534010 [0,2,0,0,0,0|1,0,1]=4 8999 B8R0.21 CCC\C=C\S(=O)(=O)O Amb28140687 [0,2,0,0,0,0|1,0,1]=4 9000 B8R0.21 CCNCCC(C)(C)O Amb27881628 [0,2,0,0,0,0|1,0,1]=4 9001 B8R0.21 CCNCCP(=O)(O)O Amb27400507 [0,2,0,0,0,0|1,0,0]=3 9002 B8R0.21 CCNCCS(=O)(=O)F Amb33463757 [0,2,0,0,0,0|1,0,1]=4 9003 B8R0.21 CCNCCS(C)(=O)=O Amb18523815 [0,2,0,0,0,0|1,0,1]=4 9004 B8R0.21 CCOCCS(=O)(=O)Cl Amb9316468 [0,2,0,0,0,0|1,0,1]=4 9005 B8R0.21 CCOCCS(=O)(=O)F Amb25722585 [0,2,0,0,0,0|1,0,1]=4 9006 B8R0.21 CCOCCS(=O)(=O)[O-] Amb27616352 [0,2,0,0,0,0|1,0,1]=4 9007 B8R0.21 CCOCCS(N)(=O)=O Amb9316791 [0,2,0,0,0,0|1,0,1]=4 9008 B8R0.21 CCSCCC(C)(C)O Amb25888893 [0,2,0,0,0,0|1,0,1]=4 9009 B8R0.21 CCSCCS(=O)(=O)Cl Amb27656410 [0,2,0,0,0,0|1,0,1]=4 9010 B8R0.21 CCSCCS(=O)(=O)F Amb33053206 [0,2,0,0,0,0|1,0,1]=4 9011 B8R0.21 CCSCCS(C)(=O)=O Amb27833287 [0,2,0,0,0,0|1,0,1]=4 9012 B8R0.21 CCSCCS(N)(=O)=O Amb26596003 [0,2,0,0,0,0|1,0,1]=4 9013 B8R0.21 CNCCCC(C)(C)O Amb17569928 [0,2,0,0,0,0|1,0,1]=4 9014 B8R0.21 CNCCCS(=O)(=O)F Amb33463799 [0,2,0,0,0,0|1,0,1]=4 9015 B8R0.21 CNCCCS(C)(=O)=O Amb18304934 [0,2,0,0,0,0|1,0,1]=4 9016 B8R0.21 CNCCCS(C)(=O)=O Amb33527631 [0,2,0,0,0,0|1,0,1]=4 9017 B8R0.21 CNCCOP(=O)(O)O Amb25785079 [0,2,0,0,0,0|2,0,0]=4 9018 B8R0.21 CNCCOS(=O)(=O)O Amb27412361 [0,2,0,0,0,0|2,0,0]=4 9019 B8R0.21 CNCCSP(=O)(O)O Amb27749900 [0,2,0,0,0,0|2,0,0]=4 9020 B8R0.21 CNCCSS(=O)(=O)O Amb25772807 [0,2,0,0,0,0|2,0,0]=4 9021 B8R0.21 COCCCC(C)(C)O Amb27409674 [0,2,0,0,0,0|1,0,1]=4 9022 B8R0.21 COCCCS(=O)(=O)Cl Amb18538494 [0,2,0,0,0,0|1,0,1]=4 9023 B8R0.21 COCCCS(=O)(=O)F Amb20623730 [0,2,0,0,0,0|1,0,1]=4 9024 B8R0.21 COCCCS(=O)(=O)O Amb22523485 [0,2,0,0,0,0|1,0,0]=3 9025 B8R0.21 COCCCS(C)(=O)=O Amb27968921 [0,2,0,0,0,0|1,0,1]=4 9026 B8R0.21 COCCCS(N)(=O)=O Amb18791542 [0,2,0,0,0,0|1,0,1]=4 9027 B8R0.21 COCCOP(=O)(O)O Amb25366442 [0,2,0,0,0,0|2,0,0]=4 9028 B8R0.21 CP(=O)(O)SCCCN Amb27760346 [0,2,0,0,0,0|2,0,0]=4 9029 B8R0.21 CS(=O)(=O)CCCCBr Amb24401565 [0,2,0,0,0,0|1,0,1]=4 9030 B8R0.21 CS(=O)(=O)CCCCCl Amb17138674 [0,2,0,0,0,0|1,0,1]=4 9031 B8R0.21 CS(=O)(=O)CCCCN Amb17138437 [0,2,0,0,0,0|1,0,1]=4 9032 B8R0.21 CS(=O)(=O)CCCCN Amb33552110 [0,2,0,0,0,0|1,0,1]=4 9033 B8R0.21 CS(=O)(=O)CCCCO Amb18180175 [0,2,0,0,0,0|1,0,1]=4 9034 B8R0.21 CS(=O)(=O)CCCCS Amb33058066 [0,2,0,0,0,0|1,0,1]=4 9035 B8R0.21 CSCCCC(C)(C)O Amb33198744 [0,2,0,0,0,0|1,0,1]=4 9036 B8R0.21 CSCCCS(=O)(=O)Cl Amb25922338 [0,2,0,0,0,0|1,0,1]=4 9037 B8R0.21 CSCCCS(=O)(=O)F Amb33076644 [0,2,0,0,0,0|1,0,1]=4 9038 B8R0.21 CSCCCS(C)(=O)=O Amb27838088 [0,2,0,0,0,0|1,0,1]=4 9039 B8R0.21 CSCCCS(N)(=O)=O Amb25032148 [0,2,0,0,0,0|1,0,1]=4 9040 B8R0.21 N#CCCCS(=O)(=O)O Amb24428958 [0,2,0,0,0,0|1,0,1]=4 9041 B8R0.21 NCCCCP(=O)(O)O Amb4036798 [0,2,0,0,0,0|1,0,0]=3 9042 B8R0.21 NCCCCS(=O)(=O)F Amb33463776 [0,2,0,0,0,0|1,0,1]=4 9043 B8R0.21 NCCCCS(=O)(=O)O Amb28285138 [0,2,0,0,0,0|1,0,0]=3 9044 B8R0.21 NCCCCS(N)(=O)=O Amb19016662 [0,2,0,0,0,0|1,0,1]=4 9045 B8R0.21 NCCCCS(N)(=O)=O Amb33552095 [0,2,0,0,0,0|1,0,1]=4 9046 B8R0.21 NCCCSS(=O)(=O)O Amb25147112 [0,2,0,0,0,0|2,0,0]=4 9047 B8R0.21 NNCCCS(=O)(=O)O Amb28043284 [0,2,0,0,0,0|2,0,0]=4 9048 B8R0.21 NP(=O)(O)CCCCCl Amb27659294 [0,2,0,0,0,0|1,0,0]=3 9049 B8R0.21 NS(=O)(=O)CCCCCl Amb25953993 [0,2,0,0,0,0|1,0,1]=4 9050 B8R0.21 NS(=O)(=O)CCCCF Amb28133885 [0,2,0,0,0,0|1,0,1]=4 9051 B8R0.21 O=CCCCP(=O)(O)O Amb28143994 [0,2,0,0,0,0|1,0,1]=4 9052 B8R0.21 O=P(O)(O)CCCCBr Amb22832006 [0,2,0,0,0,0|1,0,0]=3 9053 B8R0.21 O=P(O)(O)CCCCCl Amb22388731 [0,2,0,0,0,0|1,0,0]=3 9054 B8R0.21 O=P(O)(O)CCCNO Amb17615049 [0,2,0,0,0,0|2,0,0]=4 9055 B8R0.21 O=P(O)(O)COCCBr Amb27830604 [0,2,0,0,0,0|2,0,0]=4 9056 B8R0.21 O=P(O)(O)OCCCO Amb28077881 [0,2,0,0,0,0|2,0,0]=4 9057 B8R0.21 O=S(=O)(Cl)CCCCCl Amb7101618 [0,2,0,0,0,0|1,0,1]=4 9058 B8R0.21 O=S(=O)(Cl)CCCCF Amb25325507 [0,2,0,0,0,0|1,0,1]=4 9059 B8R0.21 O=S(=O)(F)CCCCCl Amb26564787 [0,2,0,0,0,0|1,0,1]=4 9060 B8R0.21 O=S(=O)(F)CCCCF Amb32717467 [0,2,0,0,0,0|1,0,1]=4 9061 B8R0.21 O=S(=O)(O)CCCCO Amb25945104 [0,2,0,0,0,0|1,0,0]=3 9062 B8R0.21 O=S(=O)(O)CCCCS Amb26556587 [0,2,0,0,0,0|1,0,0]=3 9063 B8R0.21 O=S(=O)(O)CNCCO Amb28119895 [0,2,0,0,0,0|2,0,0]=4 9064 B8R0.21 O=S(=O)(O)NCCCO Amb19651459 [0,2,0,0,0,0|2,0,0]=4 9065 B8R0.21 O=S(=O)(O)OCCCCl Amb27771619 [0,2,0,0,0,0|2,0,0]=4 9066 B8R0.21 O=S(=O)([O-])CCCCI Amb10880692 [0,2,0,0,0,0|1,0,1]=4 9067 B8R0.21 O=S(=O)([O-])CCCCI Amb25352406 [0,2,0,0,0,0|1,0,1]=4 9068 B8R0.21 O=S(=O)([O-])CCCCO Amb32650208 [0,2,0,0,0,0|1,0,1]=4 9069 B8R0.28 C=C(Br)CNC[C@@H](C)O Amb28285300 [0,2,0,0,0,0|2,0,0]=4 9070 B8R0.28 C=C(Br)CNC[C@H](C)O Amb27184417 [0,2,0,0,0,0|2,0,0]=4 9071 B8R0.28 C=C(Br)COCC(C)C Amb28246325 [0,2,0,0,0,0|2,0,0]=4 9072 B8R0.28 C=C(Br)CSCC(C)N Amb27464775 [0,2,0,0,0,0|2,0,0]=4 9073 B8R0.28 C=C(C)CCCC(=C)C Amb22228385 [0,2,0,0,0,0|2,0,0]=4 9074 B8R0.28 C=C(C)CCCC(=O)O Amb2699907 [0,2,0,0,0,0|0,0,0]=2 9075 B8R0.28 C=C(C)CCCC(C)=O Amb17739959 [0,2,0,0,0,0|1,0,0]=3 9076 B8R0.28 C=C(C)CCCC(C)Br Amb27955163 [0,2,0,0,0,0|2,0,0]=4 9077 B8R0.28 C=C(C)CCCC(C)C Amb22228386 [0,2,0,0,0,0|2,0,0]=4 9078 B8R0.28 C=C(C)CCCC(C)Cl Amb27965952 [0,2,0,0,0,0|2,0,0]=4 9079 B8R0.28 C=C(C)CCCC(N)=O Amb27837767 [0,2,0,0,0,0|1,0,0]=3 9080 B8R0.28 C=C(C)CCC[C@@H](C)N Amb28049331 [0,2,0,0,0,0|2,0,0]=4 9081 B8R0.28 C=C(C)CCNC(C)=O Amb27780923 [0,2,0,0,0,0|1,0,1]=4 9082 B8R0.28 C=C(C)CCOC(C)=O Amb4035107 [0,2,0,0,0,0|1,0,1]=4 9083 B8R0.28 C=C(C)CCSC(C)C Amb27443471 [0,2,0,0,0,0|2,0,0]=4 9084 B8R0.28 C=C(C)CNCC(C)C Amb17308640 [0,2,0,0,0,0|2,0,0]=4 9085 B8R0.28 C=C(C)CNC[C@H](C)O Amb27852384 [0,2,0,0,0,0|2,0,0]=4 9086 B8R0.28 C=C(C)CSCC(=O)O Amb6280447 [0,2,0,0,0,0|0,0,1]=3 9087 B8R0.28 C=C(C)CSCC(C)=O Amb27877304 [0,2,0,0,0,0|1,0,1]=4 9088 B8R0.28 C=C(C)C\C=C\C(=O)O Amb27602149 [0,2,0,0,0,0|0,0,2]=4 9089 B8R0.28 C=C(C)\C=C\CC(=O)O Amb18642409 [0,2,0,0,0,0|0,0,2]=4 9090 B8R0.28 C=C(Cl)CCCC(N)=O Amb27253854 [0,2,0,0,0,0|1,0,1]=4 9091 B8R0.28 C=C(Cl)CNC[C@H](C)O Amb27642026 [0,2,0,0,0,0|2,0,0]=4 9092 B8R0.28 C=C(F)CCCC(=O)O Amb22641515 [0,2,0,0,0,0|0,0,1]=3 9093 B8R0.28 CC(=N)NCCC(N)=O Amb28049611 [0,2,0,0,0,0|1,0,1]=4 9094 B8R0.28 CC(=O)C#CCC(C)C Amb27442442 [0,2,0,0,0,0|1,0,1]=4 9095 B8R0.28 CC(=O)CCC=C(C)C Amb533052 [0,2,0,0,0,0|1,0,1]=4 9096 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,2,0,0,0,0|0,0,0]=2 9097 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [0,2,0,0,0,0|1,0,0]=3 9098 B8R0.28 CC(=O)CCCC(C)C Amb33532191 [0,2,0,0,0,0|1,0,0]=3 9099 B8R0.28 CC(=O)CCCC(C)N Amb27483216 [0,2,0,0,0,0|1,0,0]=3 9100 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,2,0,0,0,0|1,0,0]=3 9101 B8R0.28 CC(=O)CCCN(C)C Amb2778944 [0,2,0,0,0,0|1,0,0]=3 9102 B8R0.28 CC(=O)CCC[N+](=O)[O-] Amb18203187 [0,2,0,0,0,0|1,0,1]=4 9103 B8R0.28 CC(=O)CCNC(C)=O Amb17102868 [0,2,0,0,0,0|1,0,1]=4 9104 B8R0.28 CC(=O)CCNC(C)C Amb26463473 [0,2,0,0,0,0|1,0,0]=3 9105 B8R0.28 CC(=O)CCNN(C)C Amb27838684 [0,2,0,0,0,0|2,0,0]=4 9106 B8R0.28 CC(=O)CCOC(C)=O Amb4605918 [0,2,0,0,0,0|1,0,1]=4 9107 B8R0.28 CC(=O)CCOC(C)C Amb22229804 [0,2,0,0,0,0|1,0,0]=3 9108 B8R0.28 CC(=O)CC\C=C(\C)Cl Amb17593664 [0,2,0,0,0,0|1,0,1]=4 9109 B8R0.28 CC(=O)CNCC(C)C Amb25067661 [0,2,0,0,0,0|1,0,0]=3 9110 B8R0.28 CC(=O)CNCC(C)C Amb32663767 [0,2,0,0,0,0|1,0,0]=3 9111 B8R0.28 CC(=O)CNCC(C)O Amb24589662 [0,2,0,0,0,0|1,0,0]=3 9112 B8R0.28 CC(=O)CSCC(=O)O Amb26415891 [0,2,0,0,0,0|0,0,1]=3 9113 B8R0.28 CC(=O)CSCC(=O)[O-] Amb20622616 [0,2,0,0,0,0|0,0,2]=4 9114 B8R0.28 CC(=O)CSCC(C)C Amb9269384 [0,2,0,0,0,0|1,0,0]=3 9115 B8R0.28 CC(=O)CSCC(C)F Amb28135753 [0,2,0,0,0,0|1,0,0]=3 9116 B8R0.28 CC(=O)CSCC(C)O Amb27215204 [0,2,0,0,0,0|1,0,0]=3 9117 B8R0.28 CC(=O)CSCC(F)F Amb27956449 [0,2,0,0,0,0|2,0,0]=4 9118 B8R0.28 CC(=O)CSCC(N)=O Amb27411260 [0,2,0,0,0,0|1,0,1]=4 9119 B8R0.28 CC(=O)C\C=C\C(C)C Amb26846089 [0,2,0,0,0,0|1,0,1]=4 9120 B8R0.28 CC(=O)C\C=C\C(C)O Amb26528351 [0,2,0,0,0,0|1,0,1]=4 9121 B8R0.28 CC(=O)NCCC(=O)O Amb1104704 [0,2,0,0,0,0|0,0,1]=3 9122 B8R0.28 CC(=O)NCCC(C)Cl Amb27952422 [0,2,0,0,0,0|1,0,0]=3 9123 B8R0.28 CC(=O)NCCC(N)=O Amb8997734 [0,2,0,0,0,0|1,0,1]=4 9124 B8R0.28 CC(=O)NCCS(=O)O Amb27638053 [0,2,0,0,0,0|1,0,1]=4 9125 B8R0.28 CC(=O)NOCC(=O)O Amb25921073 [0,2,0,0,0,0|1,0,1]=4 9126 B8R0.28 CC(=O)OCCC(=O)O Amb18642866 [0,2,0,0,0,0|0,0,1]=3 9127 B8R0.28 CC(=O)OCCC(C)C Amb2793054 [0,2,0,0,0,0|1,0,0]=3 9128 B8R0.28 CC(=O)OCCC(C)O Amb26357497 [0,2,0,0,0,0|1,0,0]=3 9129 B8R0.28 CC(=O)OCCC(C)S Amb25077156 [0,2,0,0,0,0|1,0,0]=3 9130 B8R0.28 CC(=O)OCCC(N)=O Amb25921090 [0,2,0,0,0,0|1,0,1]=4 9131 B8R0.28 CC(=O)OCCN(C)C Amb8516593 [0,2,0,0,0,0|2,0,0]=4 9132 B8R0.28 CC(=O)OCC[C@H](C)O Amb28192682 [0,2,0,0,0,0|1,0,0]=3 9133 B8R0.28 CC(=O)SCCC(=O)Cl Amb26637117 [0,2,0,0,0,0|1,0,1]=4 9134 B8R0.28 CC(=O)SCCC(=O)O Amb17607685 [0,2,0,0,0,0|0,0,1]=3 9135 B8R0.28 CC(=O)SCCN(C)C Amb27607143 [0,2,0,0,0,0|2,0,0]=4 9136 B8R0.28 CC(=O)\C=C/CC(C)C Amb27190424 [0,2,0,0,0,0|1,0,1]=4 9137 B8R0.28 CC(=O)\C=C\CC(=O)O Amb26900226 [0,2,0,0,0,0|0,0,2]=4 9138 B8R0.28 CC(=O)\C=C\CC(C)C Amb3354778 [0,2,0,0,0,0|1,0,1]=4 9139 B8R0.28 CC(C)=CCCC(=O)O Amb10601609 [0,2,0,0,0,0|0,0,1]=3 9140 B8R0.28 CC(C)=CCCC(C)C Amb30023884 [0,2,0,0,0,0|2,0,0]=4 9141 B8R0.28 CC(C)=CCCC(C)Cl Amb25032126 [0,2,0,0,0,0|2,0,0]=4 9142 B8R0.28 CC(C)=CCCC(C)N Amb3371996 [0,2,0,0,0,0|2,0,0]=4 9143 B8R0.28 CC(C)=CCC[C@@H](C)Br Amb27400323 [0,2,0,0,0,0|2,0,0]=4 9144 B8R0.28 CC(C)=CCC[C@@H](C)N Amb27404604 [0,2,0,0,0,0|2,0,0]=4 9145 B8R0.28 CC(C)=CCC[C@@H](C)O Amb22049561 [0,2,0,0,0,0|2,0,0]=4 9146 B8R0.28 CC(C)=CCC[C@H](C)N Amb27162485 [0,2,0,0,0,0|2,0,0]=4 9147 B8R0.28 CC(C)=CCC[C@H](C)O Amb22049564 [0,2,0,0,0,0|2,0,0]=4 9148 B8R0.28 CC(C)=NNCC(=O)O Amb27958222 [0,2,0,0,0,0|1,0,1]=4 9149 B8R0.28 CC(C)C#CCC(=O)O Amb26516061 [0,2,0,0,0,0|0,0,1]=3 9150 B8R0.28 CC(C)CC#CC(=O)O Amb28398479 [0,2,0,0,0,0|0,0,1]=3 9151 B8R0.28 CC(C)CCCC(=N)N Amb23569433 [0,2,0,0,0,0|2,0,0]=4 9152 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [0,2,0,0,0,0|0,0,0]=2 9153 B8R0.28 CC(C)CCCC(C)O Amb2721284 [0,2,0,0,0,0|1,0,1]=4 9154 B8R0.28 CC(C)CCCC(N)=S Amb28285193 [0,2,0,0,0,0|1,1,0]=4 9155 B8R0.28 CC(C)CCCP(O)O Amb27835938 [0,2,0,0,0,0|1,0,1]=4 9156 B8R0.28 CC(C)CCCS(=O)Cl Amb32720416 [0,2,0,0,0,0|2,0,0]=4 9157 B8R0.28 CC(C)CCCS(=O)[O-] Amb32754454 [0,2,0,0,0,0|1,0,1]=4 9158 B8R0.28 CC(C)CCCS(N)=O Amb32720417 [0,2,0,0,0,0|2,0,0]=4 9159 B8R0.28 CC(C)CCC[C@@H](C)O Amb22746847 [0,2,0,0,0,0|1,0,1]=4 9160 B8R0.28 CC(C)CCC[C@H](C)O Amb28291294 [0,2,0,0,0,0|1,0,1]=4 9161 B8R0.28 CC(C)CCC[N+](=O)[O-] Amb33226988 [0,2,0,0,0,0|1,0,1]=4 9162 B8R0.28 CC(C)CCNC(=N)N Amb24524670 [0,2,0,0,0,0|2,0,0]=4 9163 B8R0.28 CC(C)CCNC(N)=O Amb1104833 [0,2,0,0,0,0|1,0,0]=3 9164 B8R0.28 CC(C)CCNC(N)=S Amb386166 [0,2,0,0,0,0|1,1,0]=4 9165 B8R0.28 CC(C)CCOC(=N)N Amb27169586 [0,2,0,0,0,0|2,0,0]=4 9166 B8R0.28 CC(C)CCOC(=O)Cl Amb27463593 [0,2,0,0,0,0|1,0,0]=3 9167 B8R0.28 CC(C)CCOC(=S)[S-] Amb13777309 [0,2,0,0,0,0|0,2,0]=4 9168 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [0,2,0,0,0,0|1,0,0]=3 9169 B8R0.28 CC(C)CCOS(=O)[O-] Amb24524507 [0,2,0,0,0,0|1,0,1]=4 9170 B8R0.28 CC(C)CCO[N+](=O)[O-] Amb2720793 [0,2,0,0,0,0|1,0,1]=4 9171 B8R0.28 CC(C)CCSC(=N)N Amb20676007 [0,2,0,0,0,0|2,0,0]=4 9172 B8R0.28 CC(C)CNCC(=O)O Amb19373106 [0,2,0,0,0,0|0,0,0]=2 9173 B8R0.28 CC(C)CNCC(=O)O Amb7766417 [0,2,0,0,0,0|0,0,0]=2 9174 B8R0.28 CC(C)CNCC(C)O Amb534459 [0,2,0,0,0,0|1,0,1]=4 9175 B8R0.28 CC(C)CNCC(N)=O Amb1118171 [0,2,0,0,0,0|1,0,0]=3 9176 B8R0.28 CC(C)CNCC(N)=O Amb6892556 [0,2,0,0,0,0|1,0,0]=3 9177 B8R0.28 CC(C)COCC(=O)O Amb2608476 [0,2,0,0,0,0|0,0,0]=2 9178 B8R0.28 CC(C)COCC(C)O Amb9787471 [0,2,0,0,0,0|1,0,1]=4 9179 B8R0.28 CC(C)COCC(N)=S Amb6279156 [0,2,0,0,0,0|1,1,0]=4 9180 B8R0.28 CC(C)CSCC(=O)O Amb1134811 [0,2,0,0,0,0|0,0,0]=2 9181 B8R0.28 CC(C)CSCC(C)O Amb27260857 [0,2,0,0,0,0|1,0,1]=4 9182 B8R0.28 CC(C)C\C=C\C(=O)O Amb8392407 [0,2,0,0,0,0|0,0,1]=3 9183 B8R0.28 CC(C)NCCC(=O)O Amb1106349 [0,2,0,0,0,0|0,0,0]=2 9184 B8R0.28 CC(C)NCCC(=O)O Amb528114 [0,2,0,0,0,0|0,0,0]=2 9185 B8R0.28 CC(C)NCCC(N)=O Amb8841611 [0,2,0,0,0,0|1,0,0]=3 9186 B8R0.28 CC(C)NCCS(C)=O Amb27489425 [0,2,0,0,0,0|2,0,0]=4 9187 B8R0.28 CC(C)NCC[C@H](C)O Amb27829826 [0,2,0,0,0,0|1,0,1]=4 9188 B8R0.28 CC(C)NCC[PH](=O)O Amb28056178 [0,2,0,0,0,0|1,0,0]=3 9189 B8R0.28 CC(C)OCCC(=N)N Amb32674823 [0,2,0,0,0,0|2,0,0]=4 9190 B8R0.28 CC(C)OCCC(=N)N Amb6276326 [0,2,0,0,0,0|2,0,0]=4 9191 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [0,2,0,0,0,0|1,0,0]=3 9192 B8R0.28 CC(C)OCCC(=O)O Amb6260272 [0,2,0,0,0,0|0,0,0]=2 9193 B8R0.28 CC(C)OCCC(N)=S Amb6256598 [0,2,0,0,0,0|1,1,0]=4 9194 B8R0.28 CC(C)OCCN(C)O Amb33274847 [0,2,0,0,0,0|2,0,0]=4 9195 B8R0.28 CC(C)OCCS(=O)Cl Amb28286105 [0,2,0,0,0,0|2,0,0]=4 9196 B8R0.28 CC(C)OCCS(=O)[O-] Amb27476549 [0,2,0,0,0,0|1,0,1]=4 9197 B8R0.28 CC(C)OCCS(N)=O Amb32720491 [0,2,0,0,0,0|2,0,0]=4 9198 B8R0.28 CC(C)OCC[C@@H](C)O Amb28065212 [0,2,0,0,0,0|1,0,1]=4 9199 B8R0.28 CC(C)OCC[C@H](C)O Amb25090046 [0,2,0,0,0,0|1,0,1]=4 9200 B8R0.28 CC(C)OCC[N+](=O)[O-] Amb33274121 [0,2,0,0,0,0|1,0,1]=4 9201 B8R0.28 CC(C)SCCC(=N)N Amb27623018 [0,2,0,0,0,0|2,0,0]=4 9202 B8R0.28 CC(C)SCCC(=O)O Amb6267279 [0,2,0,0,0,0|0,0,0]=2 9203 B8R0.28 CC(C)SCCC(N)=S Amb17307561 [0,2,0,0,0,0|1,1,0]=4 9204 B8R0.28 CC(C)S\C=C\C(=O)O Amb27838559 [0,2,0,0,0,0|0,0,2]=4 9205 B8R0.28 CC(C)\C=C\CC(=O)O Amb17844074 [0,2,0,0,0,0|0,0,1]=3 9206 B8R0.28 CC(Cl)CCCC(=O)Cl Amb26491427 [0,2,0,0,0,0|1,0,0]=3 9207 B8R0.28 CC(Cl)CCCC(N)=O Amb27869185 [0,2,0,0,0,0|1,0,0]=3 9208 B8R0.28 CC(Cl)CCCS(C)=O Amb27627114 [0,2,0,0,0,0|2,0,0]=4 9209 B8R0.28 CC(F)CCCC(=O)O Amb28144031 [0,2,0,0,0,0|0,0,0]=2 9210 B8R0.28 CC(N)CCCC(=O)O Amb22059416 [0,2,0,0,0,0|0,0,0]=2 9211 B8R0.28 CC(N)CCCC(=O)O Amb28934990 [0,2,0,0,0,0|0,0,0]=2 9212 B8R0.28 CC(N)CSCC(=O)O Amb27221487 [0,2,0,0,0,0|0,0,0]=2 9213 B8R0.28 CC(N)C\C=C\C(=O)O Amb27863954 [0,2,0,0,0,0|0,0,1]=3 9214 B8R0.28 CC(O)CCC=C(Cl)Cl Amb35710409 [0,2,0,0,0,0|2,0,0]=4 9215 B8R0.28 CC(O)CCCB(O)O Amb24389636 [0,2,0,0,0,0|1,0,1]=4 9216 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [0,2,0,0,0,0|0,0,0]=2 9217 B8R0.28 CC(O)CCCC(=O)[O-] Amb17615415 [0,2,0,0,0,0|0,0,1]=3 9218 B8R0.28 CC(O)CCCC(N)=S Amb27265713 [0,2,0,0,0,0|1,1,0]=4 9219 B8R0.28 CC(O)CCCN(C)C Amb24271102 [0,2,0,0,0,0|1,0,1]=4 9220 B8R0.28 CC(O)CCNC(C)C Amb24117028 [0,2,0,0,0,0|1,0,1]=4 9221 B8R0.28 CC(O)CCNC(N)=S Amb27950544 [0,2,0,0,0,0|1,1,0]=4 9222 B8R0.28 CC(O)CCOC(C)C Amb28049548 [0,2,0,0,0,0|1,0,1]=4 9223 B8R0.28 CC(O)CNCC(=O)O Amb9359979 [0,2,0,0,0,0|0,0,0]=2 9224 B8R0.28 CC(O)CNCC(=O)[O-] Amb35789181 [0,2,0,0,0,0|0,0,1]=3 9225 B8R0.28 CC(O)CNCC(C)O Amb4036799 [0,2,0,0,0,0|1,0,1]=4 9226 B8R0.28 CC(O)CNC[C@H](C)O Amb27236687 [0,2,0,0,0,0|1,0,1]=4 9227 B8R0.28 CC(O)COCC(=O)O Amb27968624 [0,2,0,0,0,0|0,0,0]=2 9228 B8R0.28 CC(O)COCC(C)O Amb8516611 [0,2,0,0,0,0|1,0,1]=4 9229 B8R0.28 CC(O)COCC(N)=O Amb27216633 [0,2,0,0,0,0|1,0,0]=3 9230 B8R0.28 CC(O)COC[C@H](C)O Amb27470308 [0,2,0,0,0,0|1,0,1]=4 9231 B8R0.28 CC(O)CSCC(=O)O Amb19005278 [0,2,0,0,0,0|0,0,0]=2 9232 B8R0.28 CN(C)CCCB(O)O Amb24069054 [0,2,0,0,0,0|1,0,1]=4 9233 B8R0.28 CN(C)CCCC(=N)N Amb32751305 [0,2,0,0,0,0|2,0,0]=4 9234 B8R0.28 CN(C)CCCC(=N)N Amb6278287 [0,2,0,0,0,0|2,0,0]=4 9235 B8R0.28 CN(C)CCCC(=O)Cl Amb27450969 [0,2,0,0,0,0|1,0,0]=3 9236 B8R0.28 CN(C)CCCC(=O)Cl Amb32409435 [0,2,0,0,0,0|1,0,0]=3 9237 B8R0.28 CN(C)CCCC(=O)O Amb2716225 [0,2,0,0,0,0|0,0,0]=2 9238 B8R0.28 CN(C)CCCC(=O)O Amb9176338 [0,2,0,0,0,0|0,0,0]=2 9239 B8R0.28 CN(C)CCCC(N)=O Amb25887462 [0,2,0,0,0,0|1,0,0]=3 9240 B8R0.28 CN(C)CCCC(N)=S Amb6256460 [0,2,0,0,0,0|1,1,0]=4 9241 B8R0.28 CN(C)CCCN(C)O Amb33272648 [0,2,0,0,0,0|2,0,0]=4 9242 B8R0.28 CN(C)CCCS(=O)[O-] Amb32755542 [0,2,0,0,0,0|1,0,1]=4 9243 B8R0.28 CN(C)CCC[N+](=O)[O-] Amb26394292 [0,2,0,0,0,0|1,0,1]=4 9244 B8R0.28 CN(C)CCNC(N)=O Amb1129425 [0,2,0,0,0,0|2,0,0]=4 9245 B8R0.28 CN(C)CCNC(N)=O Amb33552131 [0,2,0,0,0,0|2,0,0]=4 9246 B8R0.28 CN(C)CCNC(O)=S Amb25106929 [0,2,0,0,0,0|1,1,0]=4 9247 B8R0.28 CN(C)CCOC(N)=O Amb28423955 [0,2,0,0,0,0|2,0,0]=4 9248 B8R0.28 CN(C)C\C=C/C(=O)O Amb26347338 [0,2,0,0,0,0|0,0,2]=4 9249 B8R0.28 CN(C)C\C=C\C(=O)O Amb15695416 [0,2,0,0,0,0|0,0,2]=4 9250 B8R0.28 CN(C)C\C=C\C(=O)O Amb33716600 [0,2,0,0,0,0|0,0,2]=4 9251 B8R0.28 CN(C)C\C=C\C(=O)O Amb8395946 [0,2,0,0,0,0|0,0,2]=4 9252 B8R0.28 CN(C)NCCC(N)=O Amb28072486 [0,2,0,0,0,0|2,0,0]=4 9253 B8R0.28 CS(=O)CCNC(=O)Cl Amb35633190 [0,2,0,0,0,0|2,0,0]=4 9254 B8R0.28 C[C@@H](O)CCCN(C)C Amb33272247 [0,2,0,0,0,0|1,0,1]=4 9255 B8R0.28 C[C@@H](O)CCC[C@@H](C)O Amb4166306 [0,2,0,0,0,0|1,0,1]=4 9256 B8R0.28 C[C@@H](O)CCNC(=N)N Amb28063422 [0,2,0,0,0,0|2,0,0]=4 9257 B8R0.28 C[C@H](N)C\C=C\C(=O)O Amb27784845 [0,2,0,0,0,0|0,0,1]=3 9258 B8R0.28 C[C@H](N)\C=C\CC(=O)O Amb28044026 [0,2,0,0,0,0|0,0,1]=3 9259 B8R0.28 C[C@H](O)CCCN(C)C Amb33272243 [0,2,0,0,0,0|1,0,1]=4 9260 B8R0.28 C[C@H](O)CCNC(=N)N Amb27211779 [0,2,0,0,0,0|2,0,0]=4 9261 B8R0.28 C[C@H](O)CNCC(N)=O Amb27879357 [0,2,0,0,0,0|1,0,0]=3 9262 B8R0.28 C[C@H](O)COC[C@H](C)O Amb27662102 [0,2,0,0,0,0|1,0,1]=4 9263 B8R0.28 C[C@H](O)CSC[C@H](C)O Amb27603289 [0,2,0,0,0,0|1,0,1]=4 9264 B8R0.28 C[C@H](O)C\C=C\C(=O)O Amb27812394 [0,2,0,0,0,0|0,0,1]=3 9265 B8R0.28 C[NH+](C)CCCC(=O)O Amb9786711 [0,2,0,0,0,0|0,0,0]=2 9266 B8R0.28 C\C(Br)=C/CCC(C)C Amb8389870 [0,2,0,0,0,0|2,0,0]=4 9267 B8R0.28 C\C(Cl)=C\CCC(C)O Amb27653025 [0,2,0,0,0,0|2,0,0]=4 9268 B8R0.28 N=C(N)CSCC(=O)O Amb28040821 [0,2,0,0,0,0|1,0,1]=4 9269 B8R0.28 N=C(N)NCCC(=O)O Amb3940732 [0,2,0,0,0,0|1,0,1]=4 9270 B8R0.28 N=C(N)SCCC(=O)O Amb1043190 [0,2,0,0,0,0|1,0,1]=4 9271 B8R0.28 NC(=O)CCCC(=O)O Amb5718388 [0,2,0,0,0,0|0,0,1]=3 9272 B8R0.28 NC(=O)CCC[N+](=O)[O-] Amb22432425 [0,2,0,0,0,0|2,0,0]=4 9273 B8R0.28 NC(=O)CCSC(F)F Amb27809296 [0,2,0,0,0,0|2,0,0]=4 9274 B8R0.28 NC(=O)COCC(=O)O Amb3429648 [0,2,0,0,0,0|1,0,1]=4 9275 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [0,2,0,0,0,0|1,0,1]=4 9276 B8R0.28 NC(=O)NCCC(=O)O Amb6567400 [0,2,0,0,0,0|1,0,1]=4 9277 B8R0.28 NC(=O)SCCC(=O)O Amb28340935 [0,2,0,0,0,0|1,0,1]=4 9278 B8R0.28 NC(=S)CCCC(=O)O Amb27956588 [0,2,0,0,0,0|0,0,1]=3 9279 B8R0.28 NC(=S)NCCC(=O)O Amb27815302 [0,2,0,0,0,0|1,0,1]=4 9280 B8R0.28 NC(=S)SCCC(=O)O Amb4007391 [0,2,0,0,0,0|1,0,1]=4 9281 B8R0.28 O=C(Cl)CCCC(=O)Cl Amb3940242 [0,2,0,0,0,0|1,0,1]=4 9282 B8R0.28 O=C(Cl)NCCC(F)F Amb35625886 [0,2,0,0,0,0|2,0,0]=4 9283 B8R0.28 O=C(O)CCCC(=O)O Amb4037276 [0,2,0,0,0,0|0,0,1]=3 9284 B8R0.28 O=C(O)CCCC(F)F Amb24117996 [0,2,0,0,0,0|0,0,0]=2 9285 B8R0.28 O=C(O)CCCN(Cl)Cl Amb28313437 [0,2,0,0,0,0|1,0,0]=3 9286 B8R0.28 O=C(O)CCC[N+](=O)[O-] Amb24711043 [0,2,0,0,0,0|1,0,0]=3 9287 B8R0.28 O=C(O)CCO[N+](=O)[O-] Amb21953424 [0,2,0,0,0,0|2,0,0]=4 9288 B8R0.28 O=C(O)CCSC(F)F Amb8840854 [0,2,0,0,0,0|1,0,0]=3 9289 B8R0.28 O=C(O)CNCC(=O)O Amb3940364 [0,2,0,0,0,0|1,0,1]=4 9290 B8R0.28 O=C(O)COCC(=O)O Amb4433967 [0,2,0,0,0,0|1,0,1]=4 9291 B8R0.28 O=C(O)COCC(F)F Amb27218102 [0,2,0,0,0,0|1,0,0]=3 9292 B8R0.28 O=C(O)CSCC(=O)O Amb6608738 [0,2,0,0,0,0|1,0,1]=4 9293 B8R0.28 O=C(O)CSCC(F)F Amb18791606 [0,2,0,0,0,0|1,0,0]=3 9294 B8R0.28 O=C([O-])COCC(=O)O Amb9787328 [0,2,0,0,0,0|1,0,1]=4 9295 B8R0.28 OC(O)CCCC(O)O Amb28315515 [0,2,0,0,0,0|0,0,2]=4 9296 B8R0.12 C#CCC(C)(C)C(=O)O Amb18636154 [0,2,0,0,0,0|0,0,2]=4 9297 B8R0.12 C#CC[C@](C)(N)C(=O)O Amb16183909 [0,2,0,0,0,0|0,0,2]=4 9298 B8R0.12 C=C(C)C(C)(C)CCC Amb27757688 [0,2,0,0,0,0|2,0,0]=4 9299 B8R0.12 C=CCC(C)(C)C(=O)O Amb10603495 [0,2,0,0,0,0|0,0,2]=4 9300 B8R0.12 C=CCC(F)(F)C(=O)O Amb10982503 [0,2,0,0,0,0|0,0,2]=4 9301 B8R0.12 C=CC[C@@](C)(N)C(=O)O Amb8389450 [0,2,0,0,0,0|0,0,2]=4 9302 B8R0.12 C=CC[C@@](C)(O)C(=O)O Amb27412350 [0,2,0,0,0,0|0,0,2]=4 9303 B8R0.12 C=CC[C@](C)(N)C(=O)O Amb8514992 [0,2,0,0,0,0|0,0,2]=4 9304 B8R0.12 C=CC[C@](C)(O)C(=O)O Amb27958223 [0,2,0,0,0,0|0,0,2]=4 9305 B8R0.12 CC(=O)C(C)(C)CCO Amb27838668 [0,2,0,0,0,0|2,0,0]=4 9306 B8R0.12 CC(=O)C(F)(F)CCO Amb27476544 [0,2,0,0,0,0|2,0,0]=4 9307 B8R0.12 CC(C)(CC#N)C(=O)O Amb33545085 [0,2,0,0,0,0|1,0,1]=4 9308 B8R0.12 CC(C)(CCCl)C(=O)Cl Amb25824469 [0,2,0,0,0,0|2,0,0]=4 9309 B8R0.12 CC(C)(CCCl)C(=O)O Amb27953901 [0,2,0,0,0,0|1,0,0]=3 9310 B8R0.12 CC(C)(CCF)C(=O)O Amb27838513 [0,2,0,0,0,0|1,0,0]=3 9311 B8R0.12 CC(C)(CCN)C(=O)O Amb2694929 [0,2,0,0,0,0|1,0,0]=3 9312 B8R0.12 CC(C)(CCN)C(=O)O Amb8630069 [0,2,0,0,0,0|1,0,0]=3 9313 B8R0.12 CC(C)(CCO)C(=O)O Amb24763728 [0,2,0,0,0,0|1,0,0]=3 9314 B8R0.12 CC(C)(CCO)C(=O)[O-] Amb29083409 [0,2,0,0,0,0|1,0,1]=4 9315 B8R0.12 CC(N)(CCCl)C(N)=O Amb25887461 [0,2,0,0,0,0|2,0,0]=4 9316 B8R0.12 CC(N)(CCF)C(=O)O Amb27961476 [0,2,0,0,0,0|1,0,0]=3 9317 B8R0.12 CC(N)(CCF)C(=O)O Amb28934998 [0,2,0,0,0,0|1,0,0]=3 9318 B8R0.12 CC(N)(CCO)C(N)=O Amb30013972 [0,2,0,0,0,0|2,0,0]=4 9319 B8R0.12 CC(O)(CC#N)C(=O)O Amb27260344 [0,2,0,0,0,0|1,0,1]=4 9320 B8R0.12 CC(O)(CCF)C(=O)O Amb33379277 [0,2,0,0,0,0|1,0,0]=3 9321 B8R0.12 CCCC(C)(Br)C(N)=O Amb28292478 [0,2,0,0,0,0|1,0,0]=3 9322 B8R0.12 CCCC(C)(C)C(=O)Cl Amb22168276 [0,2,0,0,0,0|1,0,0]=3 9323 B8R0.12 CCCC(C)(C)C(=O)O Amb2720786 [0,2,0,0,0,0|0,0,0]=2 9324 B8R0.12 CCCC(C)(C)C(C)=O Amb26026773 [0,2,0,0,0,0|1,0,0]=3 9325 B8R0.12 CCCC(C)(C)C(C)O Amb28346260 [0,2,0,0,0,0|1,0,1]=4 9326 B8R0.12 CCCC(C)(C)C(N)=O Amb25887199 [0,2,0,0,0,0|1,0,0]=3 9327 B8R0.12 CCCC(C)(C)S(=O)Cl Amb32993430 [0,2,0,0,0,0|2,0,0]=4 9328 B8R0.12 CCCC(C)(C)S(N)=O Amb32993629 [0,2,0,0,0,0|2,0,0]=4 9329 B8R0.12 CCCC(C)(Cl)C(=O)O Amb17593751 [0,2,0,0,0,0|0,0,0]=2 9330 B8R0.12 CCCC(C)(F)C(=O)O Amb27797327 [0,2,0,0,0,0|0,0,0]=2 9331 B8R0.12 CCCC(C)(N)C(=O)O Amb9720287 [0,2,0,0,0,0|0,0,0]=2 9332 B8R0.12 CCCC(C)(N)C(C)O Amb35583755 [0,2,0,0,0,0|1,0,1]=4 9333 B8R0.12 CCCC(C)(N)C(N)=S Amb19148046 [0,2,0,0,0,0|1,1,0]=4 9334 B8R0.12 CCCC(C)(O)C(=O)O Amb18288835 [0,2,0,0,0,0|0,0,0]=2 9335 B8R0.12 CCCC(C)(O)C(C)=O Amb26490520 [0,2,0,0,0,0|1,0,0]=3 9336 B8R0.12 CCCC(C)(O)C(N)=O Amb24116806 [0,2,0,0,0,0|1,0,0]=3 9337 B8R0.12 CCCC(Cl)(Cl)C(=O)O Amb2720219 [0,2,0,0,0,0|0,0,0]=2 9338 B8R0.12 CCCC(Cl)(Cl)C(C)=O Amb26875052 [0,2,0,0,0,0|1,0,0]=3 9339 B8R0.12 CCCC(F)(F)C(=O)Cl Amb27420905 [0,2,0,0,0,0|1,0,0]=3 9340 B8R0.12 CCCC(F)(F)C(=O)O Amb19929277 [0,2,0,0,0,0|0,0,0]=2 9341 B8R0.12 CCC[C@@](C)(N)C(=O)O Amb2699127 [0,2,0,0,0,0|0,0,0]=2 9342 B8R0.12 CCC[C@](C)(N)C(=O)O Amb16232632 [0,2,0,0,0,0|0,0,0]=2 9343 B8R0.12 CCNC(C)(C)C(=O)O Amb13952777 [0,2,0,0,0,0|1,0,0]=3 9344 B8R0.12 CCNC(C)(C)C(=O)O Amb9619876 [0,2,0,0,0,0|1,0,0]=3 9345 B8R0.12 CCNC(C)(C)C(N)=O Amb18301842 [0,2,0,0,0,0|2,0,0]=4 9346 B8R0.12 CCOC(C)(C)C(=O)O Amb18976723 [0,2,0,0,0,0|1,0,0]=3 9347 B8R0.12 CCOC(Cl)(Cl)C(=O)O Amb27422864 [0,2,0,0,0,0|1,0,0]=3 9348 B8R0.12 CCSC(C)(C)C(=O)O Amb17501487 [0,2,0,0,0,0|1,0,0]=3 9349 B8R0.12 CCSC(F)(F)C(=O)O Amb28182780 [0,2,0,0,0,0|1,0,0]=3 9350 B8R0.12 CCSC(F)(F)C(=O)[O-] Amb32729453 [0,2,0,0,0,0|1,0,1]=4 9351 B8R0.12 CNCC(C)(C)C(=O)O Amb26557784 [0,2,0,0,0,0|1,0,0]=3 9352 B8R0.12 CNCC(C)(C)C(=O)O Amb33249638 [0,2,0,0,0,0|1,0,0]=3 9353 B8R0.12 CNCC(C)(O)C(=O)O Amb27478763 [0,2,0,0,0,0|1,0,0]=3 9354 B8R0.12 CNCC(F)(F)C(=O)O Amb22497225 [0,2,0,0,0,0|1,0,0]=3 9355 B8R0.12 CNCC(F)(F)C(=O)O Amb22523480 [0,2,0,0,0,0|1,0,0]=3 9356 B8R0.12 CNC[C@@](C)(N)C(=O)O Amb27975719 [0,2,0,0,0,0|1,0,0]=3 9357 B8R0.12 CNC[C@](C)(N)C(=O)O Amb25882845 [0,2,0,0,0,0|1,0,0]=3 9358 B8R0.12 COCC(C)(C)C(=O)O Amb10608195 [0,2,0,0,0,0|1,0,0]=3 9359 B8R0.12 COCC(C)(N)C(=O)O Amb18990135 [0,2,0,0,0,0|1,0,0]=3 9360 B8R0.12 COCC(C)(N)C(=O)O Amb20622455 [0,2,0,0,0,0|1,0,0]=3 9361 B8R0.12 COCC(C)(N)C(N)=O Amb18298766 [0,2,0,0,0,0|2,0,0]=4 9362 B8R0.12 COCC(C)(N)C(N)=O Amb19515079 [0,2,0,0,0,0|2,0,0]=4 9363 B8R0.12 COCC(C)(O)C(=O)O Amb18992608 [0,2,0,0,0,0|1,0,0]=3 9364 B8R0.12 COCC(C)(O)C(C)=O Amb27598932 [0,2,0,0,0,0|2,0,0]=4 9365 B8R0.12 COCC(C)(O)C(N)=O Amb27460227 [0,2,0,0,0,0|2,0,0]=4 9366 B8R0.12 COCC(F)(F)C(=O)O Amb24518571 [0,2,0,0,0,0|1,0,0]=3 9367 B8R0.12 COC[C@](C)(N)C(=O)O Amb24568285 [0,2,0,0,0,0|1,0,0]=3 9368 B8R0.12 CSCC(C)(C)C(=O)O Amb18124874 [0,2,0,0,0,0|1,0,0]=3 9369 B8R0.12 CSCC(C)(N)C(=O)O Amb18294541 [0,2,0,0,0,0|1,0,0]=3 9370 B8R0.12 CSCC(F)(F)C(=O)O Amb23590987 [0,2,0,0,0,0|1,0,0]=3 9371 B8R0.12 CSCC(F)(F)C(N)=O Amb23590988 [0,2,0,0,0,0|2,0,0]=4 9372 B8R0.12 C[C@@](N)(CCO)C(=O)O Amb28048736 [0,2,0,0,0,0|1,0,0]=3 9373 B8R0.12 C[C@](N)(CCN)C(=O)O Amb25348479 [0,2,0,0,0,0|1,0,0]=3 9374 B8R0.12 C\C=C\C(C)(N)C(=O)O Amb24671255 [0,2,0,0,0,0|0,0,2]=4 9375 B8R0.12 N#CCC(F)(F)C(=O)O Amb27186473 [0,2,0,0,0,0|1,0,1]=4 9376 B8R0.12 NC(=O)C(Cl)(Cl)CCCl Amb27471978 [0,2,0,0,0,0|2,0,0]=4 9377 B8R0.12 NCCC(F)(F)C(=O)O Amb2697352 [0,2,0,0,0,0|1,0,0]=3 9378 B8R0.12 NCCC(F)(F)C(=O)O Amb31378944 [0,2,0,0,0,0|1,0,0]=3 9379 B8R0.12 NOCC(F)(F)C(=O)O Amb33171236 [0,2,0,0,0,0|2,0,0]=4 9380 B8R0.12 O=C(O)C(F)(F)CCF Amb32811300 [0,2,0,0,0,0|1,0,0]=3 9381 B8R0.12 O=C(O)C(F)(F)CNO Amb33170566 [0,2,0,0,0,0|2,0,0]=4 9382 B8R0.14 CC(CCN)S(=O)(=O)O Amb27231740 [0,2,0,0,0,0|2,0,0]=4 9383 B8R0.14 CC(CCO)P(=O)(O)O Amb28125457 [0,2,0,0,0,0|2,0,0]=4 9384 B8R0.14 CCCC(C)C(C)(C)O Amb4035726 [0,2,0,0,0,0|1,0,1]=4 9385 B8R0.14 CCCC(C)S(=O)(=O)Cl Amb2690081 [0,2,0,0,0,0|1,0,1]=4 9386 B8R0.14 CCCC(C)S(=O)(=O)F Amb32717655 [0,2,0,0,0,0|1,0,1]=4 9387 B8R0.14 CCCC(C)S(N)(=O)=O Amb18793305 [0,2,0,0,0,0|1,0,1]=4 9388 B8R0.14 CCCC(Cl)C(C)(C)O Amb27785543 [0,2,0,0,0,0|1,0,1]=4 9389 B8R0.14 CCCC(N)C(C)(C)O Amb33214879 [0,2,0,0,0,0|1,0,1]=4 9390 B8R0.14 CCCC(N)P(=O)(O)O Amb8516011 [0,2,0,0,0,0|1,0,0]=3 9391 B8R0.14 CCCC(N)S(=O)(=O)O Amb28075743 [0,2,0,0,0,0|1,0,0]=3 9392 B8R0.14 CCCC(O)C(C)(C)O Amb27858272 [0,2,0,0,0,0|1,0,1]=4 9393 B8R0.14 CCCC(O)P(=O)(O)O Amb26480670 [0,2,0,0,0,0|1,0,0]=3 9394 B8R0.14 CCCC(O)P(C)(=O)O Amb28315561 [0,2,0,0,0,0|1,0,0]=3 9395 B8R0.14 CCC[C@@H](O)P(=O)(O)O Amb27172583 [0,2,0,0,0,0|1,0,0]=3 9396 B8R0.14 CNCC(C)S(=O)(=O)O Amb27484161 [0,2,0,0,0,0|2,0,0]=4 9397 B8R0.14 C[C@H](CCO)P(=O)(O)O Amb27765916 [0,2,0,0,0,0|2,0,0]=4 9398 B8R0.14 N[C@@H](CCO)P(=O)(O)O Amb27424703 [0,2,0,0,0,0|2,0,0]=4 9399 B8R0.14 O=P(O)(O)[C@@H](O)CCF Amb27766537 [0,2,0,0,0,0|2,0,0]=4 9400 B8R0.15 C#CC(CCC)C(C)O Amb27780508 [0,2,0,0,0,0|1,0,1]=4 9401 B8R0.15 C#CCC(C#N)C(=O)O Amb35741463 [0,2,0,0,0,0|0,0,2]=4 9402 B8R0.15 C#CC[C@H](CC)C(=O)O Amb28120786 [0,2,0,0,0,0|0,0,2]=4 9403 B8R0.15 C=C(C)C(CCC)NC Amb27667465 [0,2,0,0,0,0|2,0,0]=4 9404 B8R0.15 C=C(C)C(CCC)NN Amb27603084 [0,2,0,0,0,0|2,0,0]=4 9405 B8R0.15 C=C=C(CCC)C(=O)O Amb28045352 [0,2,0,0,0,0|0,0,1]=3 9406 B8R0.15 C=CC(OCC)C(C)=O Amb25691894 [0,2,0,0,0,0|2,0,0]=4 9407 B8R0.15 C=CC(SCC)C(=O)O Amb27757608 [0,2,0,0,0,0|1,0,0]=3 9408 B8R0.15 C=CC(\C=C\C)C(=O)O Amb27214636 [0,2,0,0,0,0|0,0,2]=4 9409 B8R0.15 C=CCC(C#N)C(=O)O Amb27657209 [0,2,0,0,0,0|0,0,2]=4 9410 B8R0.15 C=CCC(C=O)C(=O)O Amb28313315 [0,2,0,0,0,0|0,0,2]=4 9411 B8R0.15 C=CCC(CC)C(=O)O Amb18642632 [0,2,0,0,0,0|0,0,2]=4 9412 B8R0.15 C=CCC(NO)C(=O)O Amb27768789 [0,2,0,0,0,0|0,0,2]=4 9413 B8R0.15 C=CC[C@@H](C=C)C(=O)O Amb28285259 [0,2,0,0,0,0|0,0,2]=4 9414 B8R0.15 C=C[C@@H](CCC)C(=O)O Amb27658640 [0,2,0,0,0,0|0,0,0]=2 9415 B8R0.15 CCC(CCF)C(=O)O Amb26321627 [0,2,0,0,0,0|1,0,0]=3 9416 B8R0.15 CCC(CCN)C(=O)O Amb24699884 [0,2,0,0,0,0|1,0,0]=3 9417 B8R0.15 CCC(CCN)C(=O)O Amb32662662 [0,2,0,0,0,0|1,0,0]=3 9418 B8R0.15 CCC(CCO)C(=O)O Amb18642884 [0,2,0,0,0,0|1,0,0]=3 9419 B8R0.15 CCC(COC)C(=O)O Amb18124352 [0,2,0,0,0,0|1,0,0]=3 9420 B8R0.15 CCC(COC)C(C)=O Amb27593031 [0,2,0,0,0,0|2,0,0]=4 9421 B8R0.15 CCC(CSC)C(=O)O Amb33272061 [0,2,0,0,0,0|1,0,0]=3 9422 B8R0.15 CCC(SSC)C(=O)O Amb27236075 [0,2,0,0,0,0|2,0,0]=4 9423 B8R0.15 CCCC(C#N)C(C)=O Amb24053569 [0,2,0,0,0,0|1,0,0]=3 9424 B8R0.15 CCCC(C=O)C(=O)O Amb27464964 [0,2,0,0,0,0|0,0,0]=2 9425 B8R0.15 CCCC(CBr)C(=O)Cl Amb27639323 [0,2,0,0,0,0|1,0,0]=3 9426 B8R0.15 CCCC(CC)B(O)O Amb24464750 [0,2,0,0,0,0|1,0,1]=4 9427 B8R0.15 CCCC(CC)C(=O)O Amb19009626 [0,2,0,0,0,0|0,0,0]=2 9428 B8R0.15 CCCC(CC)S(=O)Cl Amb32720451 [0,2,0,0,0,0|2,0,0]=4 9429 B8R0.15 CCCC(CC)S(=O)[O-] Amb32754970 [0,2,0,0,0,0|1,0,1]=4 9430 B8R0.15 CCCC(CC)S(N)=O Amb32720452 [0,2,0,0,0,0|2,0,0]=4 9431 B8R0.15 CCCC(CF)C(=O)O Amb27186472 [0,2,0,0,0,0|0,0,0]=2 9432 B8R0.15 CCCC(CN)C(=O)O Amb19373497 [0,2,0,0,0,0|0,0,0]=2 9433 B8R0.15 CCCC(CN)C(C)O Amb27253919 [0,2,0,0,0,0|1,0,1]=4 9434 B8R0.15 CCCC(CO)C(=O)O Amb25881510 [0,2,0,0,0,0|0,0,0]=2 9435 B8R0.15 CCCC(NC)C(=O)O Amb21961534 [0,2,0,0,0,0|0,0,0]=2 9436 B8R0.15 CCCC(NC)C(=O)O Amb22587444 [0,2,0,0,0,0|0,0,0]=2 9437 B8R0.15 CCCC(NC)C(=O)O Amb9496293 [0,2,0,0,0,0|0,0,0]=2 9438 B8R0.15 CCCC(NC)C(N)=O Amb19006602 [0,2,0,0,0,0|1,0,0]=3 9439 B8R0.15 CCCC(NO)C(=O)O Amb22372057 [0,2,0,0,0,0|0,0,0]=2 9440 B8R0.15 CCCC(OC)C(=N)N Amb27860491 [0,2,0,0,0,0|2,0,0]=4 9441 B8R0.15 CCCC(OC)C(=O)O Amb8455302 [0,2,0,0,0,0|0,0,0]=2 9442 B8R0.15 CCCC(OC)C(C)=O Amb27207958 [0,2,0,0,0,0|1,0,0]=3 9443 B8R0.15 CCCC(SC)C(=O)O Amb28289849 [0,2,0,0,0,0|0,0,0]=2 9444 B8R0.15 CCCN(C#N)C(N)=O Amb28054148 [0,2,0,0,0,0|2,0,0]=4 9445 B8R0.15 CCCN(CC)C(=O)Cl Amb26023426 [0,2,0,0,0,0|2,0,0]=4 9446 B8R0.15 CCCN(CO)C(C)=O Amb27956592 [0,2,0,0,0,0|2,0,0]=4 9447 B8R0.15 CCCN(N=O)C(C)=O Amb27259134 [0,2,0,0,0,0|2,0,0]=4 9448 B8R0.15 CCCN(N=O)C(N)=O Amb17618621 [0,2,0,0,0,0|2,0,0]=4 9449 B8R0.15 CCCN(OC)C(C)=O Amb27409304 [0,2,0,0,0,0|2,0,0]=4 9450 B8R0.15 CCC[C@@H](CC)B(O)O Amb27947027 [0,2,0,0,0,0|1,0,1]=4 9451 B8R0.15 CCC[C@@H](CO)C(=O)O Amb24571859 [0,2,0,0,0,0|0,0,0]=2 9452 B8R0.15 CCC[C@@H](CO)[C@H](C)O Amb28315465 [0,2,0,0,0,0|1,0,1]=4 9453 B8R0.15 CCC[C@@H](NC)C(=O)O Amb25771939 [0,2,0,0,0,0|0,0,0]=2 9454 B8R0.15 CCC[C@@H](NC)C(=O)O Amb33801471 [0,2,0,0,0,0|0,0,0]=2 9455 B8R0.15 CCC[C@H](CN)C(=O)O Amb27460612 [0,2,0,0,0,0|0,0,0]=2 9456 B8R0.15 CCC[C@H](CO)C(=O)O Amb25063310 [0,2,0,0,0,0|0,0,0]=2 9457 B8R0.15 CCC[C@H](NC)C(=O)O Amb25062610 [0,2,0,0,0,0|0,0,0]=2 9458 B8R0.15 CCC[C@H](NC)C(=O)O Amb33456398 [0,2,0,0,0,0|0,0,0]=2 9459 B8R0.15 CCC[C@H](NC)C(N)=O Amb27475077 [0,2,0,0,0,0|1,0,0]=3 9460 B8R0.15 CCC\C(=C/Br)C(C)=O Amb28366544 [0,2,0,0,0,0|1,0,1]=4 9461 B8R0.15 CCC\C(=N/O)C(C)=O Amb24687410 [0,2,0,0,0,0|1,0,1]=4 9462 B8R0.15 CCC\C(=N/O)C(N)=O Amb25174964 [0,2,0,0,0,0|1,0,1]=4 9463 B8R0.15 CCC\C(=N\O)C(C)=O Amb27599448 [0,2,0,0,0,0|1,0,1]=4 9464 B8R0.15 CCNC(CC)C(=O)O Amb33339265 [0,2,0,0,0,0|1,0,0]=3 9465 B8R0.15 CCNC(CC)C(=O)O Amb9620054 [0,2,0,0,0,0|1,0,0]=3 9466 B8R0.15 CCNC(CC)C(N)=O Amb19006590 [0,2,0,0,0,0|2,0,0]=4 9467 B8R0.15 CCN[C@@H](CC)C(=O)O Amb26019582 [0,2,0,0,0,0|1,0,0]=3 9468 B8R0.15 CCN[C@H](CC)C(=O)O Amb33347493 [0,2,0,0,0,0|1,0,0]=3 9469 B8R0.15 CCOC(CC)C(=O)O Amb9675410 [0,2,0,0,0,0|1,0,0]=3 9470 B8R0.15 CCOC(CC)C(N)=O Amb8073028 [0,2,0,0,0,0|2,0,0]=4 9471 B8R0.15 CCOC(CCl)C(C)=O Amb27254122 [0,2,0,0,0,0|2,0,0]=4 9472 B8R0.15 CCOC(CS)C(=O)O Amb19037339 [0,2,0,0,0,0|1,0,0]=3 9473 B8R0.15 CCSC(CC)C(=O)O Amb9675503 [0,2,0,0,0,0|1,0,0]=3 9474 B8R0.15 CC[C@H](CCN)C(=O)O Amb27754665 [0,2,0,0,0,0|1,0,0]=3 9475 B8R0.15 CC\C=C(\CC)C(=O)O Amb27195307 [0,2,0,0,0,0|0,0,2]=4 9476 B8R0.15 CNC(CCO)C(=O)O Amb27390592 [0,2,0,0,0,0|1,0,0]=3 9477 B8R0.15 CNC(COC)C(=O)O Amb19304133 [0,2,0,0,0,0|1,0,0]=3 9478 B8R0.15 CNC(COC)C(=O)O Amb22059040 [0,2,0,0,0,0|1,0,0]=3 9479 B8R0.15 CNC(COC)C(N)=O Amb24120142 [0,2,0,0,0,0|2,0,0]=4 9480 B8R0.15 CNC(COC)C(N)=O Amb32666305 [0,2,0,0,0,0|2,0,0]=4 9481 B8R0.15 CNCC(C#N)C(=O)O Amb25756304 [0,2,0,0,0,0|1,0,0]=3 9482 B8R0.15 CNCC(CO)C(=O)O Amb26352745 [0,2,0,0,0,0|1,0,0]=3 9483 B8R0.15 CNCC(CO)C(=O)O Amb32661056 [0,2,0,0,0,0|1,0,0]=3 9484 B8R0.15 CN[C@@H](COC)C(N)=O Amb26458948 [0,2,0,0,0,0|2,0,0]=4 9485 B8R0.15 CN[C@@H](COC)C(N)=O Amb28935003 [0,2,0,0,0,0|2,0,0]=4 9486 B8R0.15 CN[C@H](COC)C(=O)O Amb33347473 [0,2,0,0,0,0|1,0,0]=3 9487 B8R0.15 CN[C@H](COC)C(N)=O Amb26507221 [0,2,0,0,0,0|2,0,0]=4 9488 B8R0.15 CN[C@H](COC)C(N)=O Amb32661128 [0,2,0,0,0,0|2,0,0]=4 9489 B8R0.15 COC(CC#N)C(=O)O Amb27157791 [0,2,0,0,0,0|1,0,1]=4 9490 B8R0.15 COC(CCF)C(=O)O Amb33379286 [0,2,0,0,0,0|1,0,0]=3 9491 B8R0.15 COC(CCN)C(=O)O Amb26631814 [0,2,0,0,0,0|1,0,0]=3 9492 B8R0.15 COC(CCN)C(=O)O Amb32661022 [0,2,0,0,0,0|1,0,0]=3 9493 B8R0.15 COCC(CN)C(=O)O Amb27219429 [0,2,0,0,0,0|1,0,0]=3 9494 B8R0.15 COCC(NO)C(=O)O Amb27247213 [0,2,0,0,0,0|1,0,0]=3 9495 B8R0.15 COCC(OC)C(=O)O Amb26627988 [0,2,0,0,0,0|1,0,0]=3 9496 B8R0.15 COCC(ON)C(=O)O Amb27251693 [0,2,0,0,0,0|1,0,0]=3 9497 B8R0.15 COCC(ON)C(=O)O Amb32670944 [0,2,0,0,0,0|1,0,0]=3 9498 B8R0.15 COCC(SC)C(=O)O Amb28046503 [0,2,0,0,0,0|1,0,0]=3 9499 B8R0.15 CSCC(CN)C(=O)O Amb33272062 [0,2,0,0,0,0|1,0,0]=3 9500 B8R0.15 C\C=C(/CCC)C(C)=O Amb27206702 [0,2,0,0,0,0|1,0,1]=4 9501 B8R0.15 C\C=C(/CCN)C(=O)O Amb27493438 [0,2,0,0,0,0|1,0,1]=4 9502 B8R0.15 C\C=C(/CNC)C(=O)O Amb27881689 [0,2,0,0,0,0|1,0,1]=4 9503 B8R0.15 C\C=C(/OCC)C(=O)O Amb18642768 [0,2,0,0,0,0|1,0,1]=4 9504 B8R0.15 C\C=C(\CNC)C(=O)O Amb27954442 [0,2,0,0,0,0|1,0,1]=4 9505 B8R0.15 C\C=C\[C@@H](CC)C(=O)O Amb28388676 [0,2,0,0,0,0|0,0,2]=4 9506 B8R0.15 C\C=N\[C@H](CO)C(=O)O Amb28423512 [0,2,0,0,0,0|1,0,1]=4 9507 B8R0.15 N#CC(CCF)C(=O)O Amb35741465 [0,2,0,0,0,0|1,0,0]=3 9508 B8R0.15 N#CC(CCO)C(=O)O Amb35741464 [0,2,0,0,0,0|1,0,0]=3 9509 B8R0.15 N#CCC(C#N)C(=O)O Amb35621636 [0,2,0,0,0,0|1,0,1]=4 9510 B8R0.15 NCC(CCF)C(=O)O Amb33196465 [0,2,0,0,0,0|1,0,0]=3 9511 B8R0.15 O=C(O)C(CO)CCF Amb27876842 [0,2,0,0,0,0|1,0,0]=3 9512 B8R0.15 O=C(O)C(CS)CCS Amb27477377 [0,2,0,0,0,0|1,0,0]=3 9513 B8R0.15 O=C(O)[C@H](CS)NCO Amb27980938 [0,2,0,0,0,0|2,0,0]=4 9514 B8R0.29 C=C(C)CCC(C)(C)N Amb33200278 [0,2,0,0,0,0|2,0,0]=4 9515 B8R0.29 C=C(C)CCP(=O)(O)O Amb27163975 [0,2,0,0,0,0|1,0,1]=4 9516 B8R0.29 CC(=O)CCC(C)(C)C Amb27481983 [0,2,0,0,0,0|1,0,0]=3 9517 B8R0.29 CC(=O)CCC(C)(C)Cl Amb27260509 [0,2,0,0,0,0|1,0,0]=3 9518 B8R0.29 CC(=O)CCC(C)(C)F Amb26512496 [0,2,0,0,0,0|1,0,0]=3 9519 B8R0.29 CC(=O)CCC(C)(C)O Amb26961451 [0,2,0,0,0,0|1,0,0]=3 9520 B8R0.29 CC(=O)CCC(C)(F)F Amb26479040 [0,2,0,0,0,0|1,0,0]=3 9521 B8R0.29 CC(=O)CCC(F)(F)F Amb24055935 [0,2,0,0,0,0|2,0,0]=4 9522 B8R0.29 CC(=O)CCS(C)(=O)=O Amb18181020 [0,2,0,0,0,0|2,0,0]=4 9523 B8R0.29 CC(=O)CC[N+](C)(C)C Amb4015632 [0,2,0,0,0,0|2,0,0]=4 9524 B8R0.29 CC(=O)CC[Si](C)(C)C Amb28324359 [0,2,0,0,0,0|1,1,0]=4 9525 B8R0.29 CC(=O)CC[Si](C)(C)Cl Amb27828965 [0,2,0,0,0,0|1,1,0]=4 9526 B8R0.29 CC(=O)CNC(C)(C)C Amb1091895 [0,2,0,0,0,0|2,0,0]=4 9527 B8R0.29 CC(=O)COC(C)(C)C Amb9666858 [0,2,0,0,0,0|2,0,0]=4 9528 B8R0.29 CC(=O)CSC(C)(C)C Amb4165959 [0,2,0,0,0,0|2,0,0]=4 9529 B8R0.29 CC(=O)NCC(C)(C)N Amb18642812 [0,2,0,0,0,0|2,0,0]=4 9530 B8R0.29 CC(=O)NCC(C)(C)O Amb25082896 [0,2,0,0,0,0|2,0,0]=4 9531 B8R0.29 CC(=O)NCC(C)(C)S Amb27489471 [0,2,0,0,0,0|2,0,0]=4 9532 B8R0.29 CC(=O)NCC(C)(F)F Amb29855696 [0,2,0,0,0,0|2,0,0]=4 9533 B8R0.29 CC(=O)OCC(C)(C)Br Amb33276495 [0,2,0,0,0,0|2,0,0]=4 9534 B8R0.29 CC(=O)SCC(C)(C)C Amb26932052 [0,2,0,0,0,0|2,0,0]=4 9535 B8R0.29 CC(=O)SCC(C)(C)O Amb27397144 [0,2,0,0,0,0|2,0,0]=4 9536 B8R0.29 CC(Br)(Br)COC(N)=O Amb27435159 [0,2,0,0,0,0|2,0,0]=4 9537 B8R0.29 CC(Br)CCS(C)(=O)=O Amb33481791 [0,2,0,0,0,0|1,0,1]=4 9538 B8R0.29 CC(C)(Br)CCC(=O)O Amb27402242 [0,2,0,0,0,0|0,0,0]=2 9539 B8R0.29 CC(C)(C)C#CC(=O)O Amb33545064 [0,2,0,0,0,0|0,0,2]=4 9540 B8R0.29 CC(C)(C)CCB(O)O Amb24502180 [0,2,0,0,0,0|1,0,1]=4 9541 B8R0.29 CC(C)(C)CCC(=N)N Amb24412583 [0,2,0,0,0,0|2,0,0]=4 9542 B8R0.29 CC(C)(C)CCC(=N)N Amb33743592 [0,2,0,0,0,0|2,0,0]=4 9543 B8R0.29 CC(C)(C)CCC(=O)Cl Amb25105178 [0,2,0,0,0,0|1,0,0]=3 9544 B8R0.29 CC(C)(C)CCC(=O)O Amb8467936 [0,2,0,0,0,0|0,0,0]=2 9545 B8R0.29 CC(C)(C)CCC(N)=O Amb28349074 [0,2,0,0,0,0|1,0,0]=3 9546 B8R0.29 CC(C)(C)CCC(N)=S Amb28049043 [0,2,0,0,0,0|1,1,0]=4 9547 B8R0.29 CC(C)(C)CCS(=O)Cl Amb27226931 [0,2,0,0,0,0|2,0,0]=4 9548 B8R0.29 CC(C)(C)CCS(=O)[O-] Amb26987947 [0,2,0,0,0,0|1,0,1]=4 9549 B8R0.29 CC(C)(C)CCS(N)=O Amb32720539 [0,2,0,0,0,0|2,0,0]=4 9550 B8R0.29 CC(C)(C)CC[N+](=O)[O-] Amb32954794 [0,2,0,0,0,0|1,0,1]=4 9551 B8R0.29 CC(C)(C)CNC(=O)Cl Amb35625636 [0,2,0,0,0,0|2,0,0]=4 9552 B8R0.29 CC(C)(C)CNC(N)=O Amb20623709 [0,2,0,0,0,0|2,0,0]=4 9553 B8R0.29 CC(C)(C)COC(=O)Cl Amb10844667 [0,2,0,0,0,0|2,0,0]=4 9554 B8R0.29 CC(C)(C)COC(=O)F Amb27238052 [0,2,0,0,0,0|2,0,0]=4 9555 B8R0.29 CC(C)(C)NCC(=O)Cl Amb22739730 [0,2,0,0,0,0|2,0,0]=4 9556 B8R0.29 CC(C)(C)NCC(=O)Cl Amb26459118 [0,2,0,0,0,0|2,0,0]=4 9557 B8R0.29 CC(C)(C)NCC(=O)O Amb10610332 [0,2,0,0,0,0|1,0,0]=3 9558 B8R0.29 CC(C)(C)NCC(=O)O Amb7766549 [0,2,0,0,0,0|1,0,0]=3 9559 B8R0.29 CC(C)(C)NCC(N)=O Amb6714542 [0,2,0,0,0,0|2,0,0]=4 9560 B8R0.29 CC(C)(C)OCC(=O)Cl Amb33552858 [0,2,0,0,0,0|2,0,0]=4 9561 B8R0.29 CC(C)(C)OCC(=O)O Amb2691328 [0,2,0,0,0,0|1,0,0]=3 9562 B8R0.29 CC(C)(C)OCC(N)=O Amb22228918 [0,2,0,0,0,0|2,0,0]=4 9563 B8R0.29 CC(C)(C)SCC(=O)O Amb433078 [0,2,0,0,0,0|1,0,0]=3 9564 B8R0.29 CC(C)(C)[NH2+]CC(=O)O Amb2695316 [0,2,0,0,0,0|1,0,0]=3 9565 B8R0.29 CC(C)(C)\C=C\C(=O)O Amb30585155 [0,2,0,0,0,0|0,0,2]=4 9566 B8R0.29 CC(C)(Cl)CCB(O)O Amb28136544 [0,2,0,0,0,0|1,0,1]=4 9567 B8R0.29 CC(C)(Cl)CCC(=O)O Amb18644451 [0,2,0,0,0,0|0,0,0]=2 9568 B8R0.29 CC(C)(F)CCC(=O)O Amb26316862 [0,2,0,0,0,0|0,0,0]=2 9569 B8R0.29 CC(C)(F)CC[N+](=O)[O-] Amb33271853 [0,2,0,0,0,0|1,0,1]=4 9570 B8R0.29 CC(C)(F)OCC(=O)O Amb33225288 [0,2,0,0,0,0|1,0,0]=3 9571 B8R0.29 CC(C)(F)\C=C\C(=O)O Amb33272218 [0,2,0,0,0,0|0,0,2]=4 9572 B8R0.29 CC(C)(N)CCC(=O)O Amb13951332 [0,2,0,0,0,0|0,0,0]=2 9573 B8R0.29 CC(C)(N)CCC(=O)O Amb6740013 [0,2,0,0,0,0|0,0,0]=2 9574 B8R0.29 CC(C)(N)CNC(N)=O Amb8631174 [0,2,0,0,0,0|2,0,0]=4 9575 B8R0.29 CC(C)(N)CNC(N)=O Amb8631175 [0,2,0,0,0,0|2,0,0]=4 9576 B8R0.29 CC(C)(N)\C=C\C(=O)O Amb26640960 [0,2,0,0,0,0|0,0,2]=4 9577 B8R0.29 CC(C)(O)C#CC(=O)O Amb6364820 [0,2,0,0,0,0|0,0,2]=4 9578 B8R0.29 CC(C)(O)CCC(=O)[O-] Amb33552947 [0,2,0,0,0,0|0,0,1]=3 9579 B8R0.29 CC(C)(O)CCC(N)=O Amb27667598 [0,2,0,0,0,0|1,0,0]=3 9580 B8R0.29 CC(C)(O)CNC(N)=O Amb27175271 [0,2,0,0,0,0|2,0,0]=4 9581 B8R0.29 CC(C)(S)CCC(=O)O Amb22489759 [0,2,0,0,0,0|0,0,0]=2 9582 B8R0.29 CC(C)CCC(C)(C)O Amb4035887 [0,2,0,0,0,0|1,0,1]=4 9583 B8R0.29 CC(C)CCS(=O)(=O)Br Amb23555504 [0,2,0,0,0,0|1,0,1]=4 9584 B8R0.29 CC(C)CCS(=O)(=O)Cl Amb18289340 [0,2,0,0,0,0|1,0,1]=4 9585 B8R0.29 CC(C)CCS(=O)(=O)F Amb32716844 [0,2,0,0,0,0|1,0,1]=4 9586 B8R0.29 CC(C)CCS(=O)(=O)O Amb26996755 [0,2,0,0,0,0|1,0,0]=3 9587 B8R0.29 CC(C)CCS(C)(=N)=O Amb32671062 [0,2,0,0,0,0|2,0,0]=4 9588 B8R0.29 CC(C)CCS(N)(=O)=O Amb18791482 [0,2,0,0,0,0|1,0,1]=4 9589 B8R0.29 CC(C)COP(=O)(O)O Amb25264732 [0,2,0,0,0,0|2,0,0]=4 9590 B8R0.29 CC(C)NCS(=O)(=O)O Amb27409883 [0,2,0,0,0,0|2,0,0]=4 9591 B8R0.29 CC(Cl)CCC(C)(C)O Amb27659351 [0,2,0,0,0,0|1,0,1]=4 9592 B8R0.29 CC(Cl)CCS(=O)(=O)Cl Amb26007552 [0,2,0,0,0,0|1,0,1]=4 9593 B8R0.29 CC(Cl)CCS(=O)(=O)F Amb32719144 [0,2,0,0,0,0|1,0,1]=4 9594 B8R0.29 CC(Cl)CCS(N)(=O)=O Amb25774525 [0,2,0,0,0,0|1,0,1]=4 9595 B8R0.29 CC(F)(F)CCC(=O)O Amb6252611 [0,2,0,0,0,0|0,0,0]=2 9596 B8R0.29 CC(F)(F)CCS(=O)Cl Amb32720776 [0,2,0,0,0,0|2,0,0]=4 9597 B8R0.29 CC(F)(F)CCS(=O)[O-] Amb32755253 [0,2,0,0,0,0|1,0,1]=4 9598 B8R0.29 CC(F)(F)CCS(N)=O Amb32720772 [0,2,0,0,0,0|2,0,0]=4 9599 B8R0.29 CC(F)(F)CC[N+](=O)[O-] Amb32810125 [0,2,0,0,0,0|1,0,1]=4 9600 B8R0.29 CC(F)(F)CNC(=O)Cl Amb35633315 [0,2,0,0,0,0|2,0,0]=4 9601 B8R0.29 CC(F)(F)CNC(N)=O Amb30007305 [0,2,0,0,0,0|2,0,0]=4 9602 B8R0.29 CC(F)(F)OCC(=O)O Amb32809085 [0,2,0,0,0,0|1,0,0]=3 9603 B8R0.29 CC(F)(F)\C=C\C(=O)O Amb22295928 [0,2,0,0,0,0|0,0,2]=4 9604 B8R0.29 CC(F)CCS(=O)(=O)Cl Amb28072755 [0,2,0,0,0,0|1,0,1]=4 9605 B8R0.29 CC(F)CCS(=O)(=O)F Amb32717836 [0,2,0,0,0,0|1,0,1]=4 9606 B8R0.29 CC(N)CCP(=O)(O)O Amb27392223 [0,2,0,0,0,0|1,0,0]=3 9607 B8R0.29 CC(N)CCS(=O)(=O)F Amb33463870 [0,2,0,0,0,0|1,0,1]=4 9608 B8R0.29 CC(N)CCS(C)(=O)=O Amb18300587 [0,2,0,0,0,0|1,0,1]=4 9609 B8R0.29 CC(O)CCC(C)(C)C Amb28410318 [0,2,0,0,0,0|1,0,1]=4 9610 B8R0.29 CC(O)CCC(C)(C)F Amb24757018 [0,2,0,0,0,0|1,0,1]=4 9611 B8R0.29 CC(O)CCC(C)(C)N Amb18642848 [0,2,0,0,0,0|1,0,1]=4 9612 B8R0.29 CC(O)CCC(C)(F)F Amb26442575 [0,2,0,0,0,0|1,0,1]=4 9613 B8R0.29 CC(O)CCS(=O)(=O)Cl Amb27882564 [0,2,0,0,0,0|1,0,1]=4 9614 B8R0.29 CC(O)CCS(C)(=O)=O Amb18180142 [0,2,0,0,0,0|1,0,1]=4 9615 B8R0.29 CC(O)COP(C)(=O)O Amb28069786 [0,2,0,0,0,0|2,0,0]=4 9616 B8R0.29 CC(O)NCP(=O)(O)O Amb27201283 [0,2,0,0,0,0|2,0,0]=4 9617 B8R0.29 CN(C)CCP(=O)(O)O Amb26639131 [0,2,0,0,0,0|2,0,0]=4 9618 B8R0.29 CN(C)CCS(=O)(=O)O Amb25875615 [0,2,0,0,0,0|2,0,0]=4 9619 B8R0.29 CN(O)CCC(C)(C)C Amb33203937 [0,2,0,0,0,0|2,0,0]=4 9620 B8R0.29 CP(=O)(O)CCC(=O)O Amb1792559 [0,2,0,0,0,0|1,0,0]=3 9621 B8R0.29 CP(=O)(O)OCC(=O)O Amb26578720 [0,2,0,0,0,0|2,0,0]=4 9622 B8R0.29 CS(=N)(=O)NCC(=O)O Amb35687837 [0,2,0,0,0,0|2,0,0]=4 9623 B8R0.29 CS(=O)(=O)CCC(=O)O Amb6275720 [0,2,0,0,0,0|1,0,0]=3 9624 B8R0.29 CS(=O)(=O)NCC(=O)O Amb1120433 [0,2,0,0,0,0|2,0,0]=4 9625 B8R0.29 CS(=O)(=O)OCC(=O)O Amb25783884 [0,2,0,0,0,0|2,0,0]=4 9626 B8R0.29 CS(=O)(=O)SCC(=O)O Amb17610576 [0,2,0,0,0,0|2,0,0]=4 9627 B8R0.29 CS(C)(=O)=NCC(=O)O Amb27159666 [0,2,0,0,0,0|2,0,0]=4 9628 B8R0.29 C[C@@H](N)CCP(C)(=O)Cl Amb28119076 [0,2,0,0,0,0|2,0,0]=4 9629 B8R0.29 C[C@@H](N)CCS(C)(=O)=O Amb33411441 [0,2,0,0,0,0|1,0,1]=4 9630 B8R0.29 C[C@@H](N)COS(=O)(=O)O Amb27598040 [0,2,0,0,0,0|2,0,0]=4 9631 B8R0.29 C[C@@H](O)CCC(C)(C)C Amb33380491 [0,2,0,0,0,0|1,0,1]=4 9632 B8R0.29 C[C@@H](O)CCC(C)(C)F Amb33272518 [0,2,0,0,0,0|1,0,1]=4 9633 B8R0.29 C[C@@H](O)CCC(C)(F)F Amb32809872 [0,2,0,0,0,0|1,0,1]=4 9634 B8R0.29 C[C@@H](O)CCS(C)(=O)=O Amb33055796 [0,2,0,0,0,0|1,0,1]=4 9635 B8R0.29 C[C@H](N)CCS(C)(=O)=O Amb33481789 [0,2,0,0,0,0|1,0,1]=4 9636 B8R0.29 C[C@H](O)CCC(C)(C)C Amb33380503 [0,2,0,0,0,0|1,0,1]=4 9637 B8R0.29 C[C@H](O)CCC(C)(C)F Amb33272519 [0,2,0,0,0,0|1,0,1]=4 9638 B8R0.29 C[C@H](O)CCC(C)(F)F Amb32810129 [0,2,0,0,0,0|1,0,1]=4 9639 B8R0.29 C[C@H](O)CCS(C)(=O)=O Amb33055794 [0,2,0,0,0,0|1,0,1]=4 9640 B8R0.29 C[N+](C)(C)CCC(=O)O Amb24117222 [0,2,0,0,0,0|1,0,0]=3 9641 B8R0.29 C[N+](C)(C)CCC(=O)O Amb33803200 [0,2,0,0,0,0|1,0,0]=3 9642 B8R0.29 C[N+](C)(C)CCC(=O)[O-] Amb26420871 [0,2,0,0,0,0|1,0,1]=4 9643 B8R0.29 C[N+](C)(N)CCC(=O)O Amb27878681 [0,2,0,0,0,0|1,0,0]=3 9644 B8R0.29 C[Si](C)(C)CCC(=O)Cl Amb27187901 [0,2,0,0,0,0|1,1,0]=4 9645 B8R0.29 NC(=O)CCC(Cl)(Cl)Cl Amb27424705 [0,2,0,0,0,0|2,0,0]=4 9646 B8R0.29 NC(=O)CCC(F)(F)F Amb2702583 [0,2,0,0,0,0|2,0,0]=4 9647 B8R0.29 NS(=O)(=O)CCC(=O)O Amb6741826 [0,2,0,0,0,0|2,0,0]=4 9648 B8R0.29 O=C(Br)CCC(F)(F)F Amb22360324 [0,2,0,0,0,0|2,0,0]=4 9649 B8R0.29 O=C(Cl)CCC(F)(F)F Amb19737369 [0,2,0,0,0,0|2,0,0]=4 9650 B8R0.29 O=C(O)CCC(Cl)(Cl)Cl Amb2725076 [0,2,0,0,0,0|1,0,0]=3 9651 B8R0.29 O=C(O)CCC(F)(F)Br Amb10838819 [0,2,0,0,0,0|1,0,0]=3 9652 B8R0.29 O=C(O)CCC(F)(F)Cl Amb27848419 [0,2,0,0,0,0|1,0,0]=3 9653 B8R0.29 O=C(O)CCC(F)(F)F Amb2778697 [0,2,0,0,0,0|1,0,0]=3 9654 B8R0.29 O=C(O)CCP(=O)(O)O Amb2228990 [0,2,0,0,0,0|2,0,0]=4 9655 B8R0.29 O=C(O)CCS(=O)(=O)O Amb17399954 [0,2,0,0,0,0|2,0,0]=4 9656 B8R0.29 O=C(O)CCS(=O)(=O)[O-] Amb28960294 [0,2,0,0,0,0|2,0,0]=4 9657 B8R0.29 O=C(O)COC(F)(F)F Amb9677564 [0,2,0,0,0,0|2,0,0]=4 9658 B8R0.29 O=C(O)CSC(F)(F)F Amb4443073 [0,2,0,0,0,0|2,0,0]=4 9659 B6R1.2 BrC1=CCCC1 Amb10067271 [1,0,0,1,0,0|2,0,0]=4 9660 B6R1.2 BrC1=CCCO1 Amb24322605 [1,0,0,1,0,0|1,0,1]=4 9661 B6R1.2 BrC1CCCO1 Amb24322808 [1,0,0,1,0,0|1,0,1]=4 9662 B6R1.2 C=C1CCCC1 Amb22337671 [1,0,0,1,0,0|2,0,0]=4 9663 B6R1.2 C=C1CCCS1 Amb28137153 [1,0,0,1,0,0|1,1,0]=4 9664 B6R1.2 C=C1OCCO1 Amb24477046 [1,0,0,1,0,0|2,0,0]=4 9665 B6R1.2 CC1=CCCC1 Amb8513250 [1,0,0,1,0,0|2,0,0]=4 9666 B6R1.2 CC1=CCCO1 Amb20621083 [1,0,0,1,0,0|1,0,1]=4 9667 B6R1.2 CC1=NCCC1 Amb8513341 [1,0,0,1,0,0|2,0,0]=4 9668 B6R1.2 CC1=NCCO1 Amb8395082 [1,0,0,1,0,0|2,0,0]=4 9669 B6R1.2 CC1CCCO1 Amb8385612 [1,0,0,1,0,0|1,0,1]=4 9670 B6R1.2 ClC1=NCCO1 Amb8396614 [1,0,0,1,0,0|2,0,0]=4 9671 B6R1.2 IC1=CCCC1 Amb24332192 [1,0,0,1,0,0|2,0,0]=4 9672 B6R1.2 IC1=CCCO1 Amb24322816 [1,0,0,1,0,0|1,0,1]=4 9673 B6R1.2 N=C1CCCN1 Amb2371632 [1,0,0,1,0,0|2,0,0]=4 9674 B6R1.2 N=C1CCCN1 Amb501585 [1,0,0,1,0,0|2,0,0]=4 9675 B6R1.2 N=C1CCCS1 Amb10072429 [1,0,0,1,0,0|1,1,0]=4 9676 B6R1.2 N=C1CCCS1 Amb9825646 [1,0,0,1,0,0|1,1,0]=4 9677 B6R1.2 N=C1NCCO1 Amb20623979 [1,0,0,1,0,0|2,0,0]=4 9678 B6R1.2 NC1=NCCC1 Amb10976565 [1,0,0,1,0,0|2,0,0]=4 9679 B6R1.2 NC1=NCCC1 Amb8342250 [1,0,0,1,0,0|2,0,0]=4 9680 B6R1.2 NC1=NCCO1 Amb24325166 [1,0,0,1,0,0|2,0,0]=4 9681 B6R1.2 NC1CCCO1 Amb16233703 [1,0,0,1,0,0|1,0,1]=4 9682 B6R1.2 O=C1C=CCC1 Amb4019519 [1,0,0,1,0,0|1,0,1]=4 9683 B6R1.2 O=C1C=CCO1 Amb2792769 [1,0,0,1,0,0|0,0,2]=4 9684 B6R1.2 O=C1C=NCO1 Amb25786221 [1,0,0,1,0,0|1,0,1]=4 9685 B6R1.2 O=C1CC=NO1 Amb27654112 [1,0,0,1,0,0|1,0,1]=4 9686 B6R1.2 O=C1CCCC1 Amb2793024 [1,0,0,1,0,0|1,0,0]=3 9687 B6R1.2 O=C1CCCN1 Amb22169686 [1,0,0,1,0,0|1,0,0]=3 9688 B6R1.2 O=C1CCCN1 Amb6608645 [1,0,0,1,0,0|1,0,0]=3 9689 B6R1.2 O=C1CCCO1 Amb3940401 [1,0,0,1,0,0|0,0,0]=2 9690 B6R1.2 O=C1CCCS1 Amb22338102 [1,0,0,1,0,0|0,1,0]=3 9691 B6R1.2 O=C1CCNC1 Amb2700623 [1,0,0,1,0,0|2,0,0]=4 9692 B6R1.2 O=C1CCNC1 Amb8386645 [1,0,0,1,0,0|2,0,0]=4 9693 B6R1.2 O=C1CCNN1 Amb33551041 [1,0,0,1,0,0|2,0,0]=4 9694 B6R1.2 O=C1CCNN1 Amb3428540 [1,0,0,1,0,0|2,0,0]=4 9695 B6R1.2 O=C1CCOC1 Amb7990143 [1,0,0,1,0,0|2,0,0]=4 9696 B6R1.2 O=C1CCON1 Amb22235009 [1,0,0,1,0,0|2,0,0]=4 9697 B6R1.2 O=C1CCSC1 Amb2720904 [1,0,0,1,0,0|2,0,0]=4 9698 B6R1.2 O=C1CNCN1 Amb19957368 [1,0,0,1,0,0|2,0,0]=4 9699 B6R1.2 O=C1CNCS1 Amb27443758 [1,0,0,1,0,0|1,1,0]=4 9700 B6R1.2 O=C1COCN1 Amb28132686 [1,0,0,1,0,0|2,0,0]=4 9701 B6R1.2 O=C1CSCN1 Amb28187121 [1,0,0,1,0,0|2,0,0]=4 9702 B6R1.2 O=C1NCCN1 Amb6357221 [1,0,0,1,0,0|2,0,0]=4 9703 B6R1.2 O=C1NCCN1 Amb6608941 [1,0,0,1,0,0|2,0,0]=4 9704 B6R1.2 O=C1NCCO1 Amb6608807 [1,0,0,1,0,0|1,0,0]=3 9705 B6R1.2 O=C1NCCS1 Amb431322 [1,0,0,1,0,0|1,1,0]=4 9706 B6R1.2 O=C1OCCO1 Amb4057710 [1,0,0,1,0,0|1,0,0]=3 9707 B6R1.2 O=C1OCCS1 Amb27398683 [1,0,0,1,0,0|1,0,0]=3 9708 B6R1.2 O=S1CCCC1 Amb2690579 [1,0,0,1,0,0|2,0,0]=4 9709 B6R1.2 O=S1OCCO1 Amb8383890 [1,0,0,1,0,0|2,0,0]=4 9710 B6R1.2 O=[PH]1CCCC1 Amb33804724 [1,0,0,1,0,0|2,0,0]=4 9711 B6R1.2 O=[PH]1OCCO1 Amb22346149 [1,0,0,1,0,0|2,0,0]=4 9712 B6R1.2 OC1=NNCC1 Amb2111955 [1,0,0,1,0,0|2,0,0]=4 9713 B6R1.2 OC1=NNCC1 Amb844737 [1,0,0,1,0,0|2,0,0]=4 9714 B6R1.2 OC1CCCC1 Amb3939016 [1,0,0,1,0,0|1,0,1]=4 9715 B6R1.2 OC1CCCN1 Amb28120620 [1,0,0,1,0,0|1,0,1]=4 9716 B6R1.2 OC1CCCO1 Amb17615892 [1,0,0,1,0,0|0,0,2]=4 9717 B6R1.2 OC1CCCS1 Amb27864587 [1,0,0,1,0,0|0,1,1]=4 9718 B6R1.2 ON1CCCC1 Amb30988006 [1,0,0,1,0,0|2,0,0]=4 9719 B6R1.2 ON1CCCC1 Amb4035438 [1,0,0,1,0,0|2,0,0]=4 9720 B6R1.2 S=C1CCCC1 Amb28049287 [1,0,0,1,0,0|1,1,0]=4 9721 B6R1.2 S=C1CCCN1 Amb2778514 [1,0,0,1,0,0|1,1,0]=4 9722 B6R1.2 S=C1CCCO1 Amb27808589 [1,0,0,1,0,0|0,1,0]=3 9723 B6R1.2 S=C1NCCO1 Amb2371644 [1,0,0,1,0,0|1,1,0]=4 9724 B6R1.3 CCCC1CO1 Amb17771535 [1,0,0,1,0,0|1,0,1]=4 9725 B6R1.3 CCC[C@@H]1CO1 Amb25348803 [1,0,0,1,0,0|1,0,1]=4 9726 B6R1.3 CCC[C@H]1CO1 Amb10982593 [1,0,0,1,0,0|1,0,1]=4 9727 B6R1.5 C=C1CC(C)C1 Amb27242578 [1,0,0,1,0,0|2,0,0]=4 9728 B6R1.5 CC1=CC(=O)C1 Amb27451158 [1,0,0,1,0,0|1,0,1]=4 9729 B6R1.5 CC1CC(=O)C1 Amb22284831 [1,0,0,1,0,0|1,0,0]=3 9730 B6R1.5 CC1CC(=O)N1 Amb28383498 [1,0,0,1,0,0|1,0,0]=3 9731 B6R1.5 CC1CC(=O)O1 Amb13777279 [1,0,0,1,0,0|0,0,0]=2 9732 B6R1.5 CC1CC(=O)S1 Amb27424521 [1,0,0,1,0,0|0,1,0]=3 9733 B6R1.5 CC1CC(C)O1 Amb22737240 [1,0,0,1,0,0|1,0,1]=4 9734 B6R1.5 CC1CC(O)C1 Amb22235436 [1,0,0,1,0,0|1,0,1]=4 9735 B6R1.5 CN1CC(=O)C1 Amb22292462 [1,0,0,1,0,0|2,0,0]=4 9736 B6R1.5 CN1CC(=O)C1 Amb30869395 [1,0,0,1,0,0|2,0,0]=4 9737 B6R1.5 C[C@@H]1CC(=O)N1 Amb26611068 [1,0,0,1,0,0|1,0,0]=3 9738 B6R1.5 C[C@@H]1C[C@@H](C)O1 Amb24332806 [1,0,0,1,0,0|1,0,1]=4 9739 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [1,0,0,1,0,0|0,0,0]=2 9740 B6R1.5 C[C@H]1C[C@@H](C)O1 Amb24333814 [1,0,0,1,0,0|1,0,1]=4 9741 B6R1.5 C[C@H]1C[C@@H](O)C1 Amb27472789 [1,0,0,1,0,0|1,0,1]=4 9742 B6R1.5 C[C@H]1C[C@H](O)C1 Amb26010738 [1,0,0,1,0,0|1,0,1]=4 9743 B6R1.5 NC1CC(=O)C1 Amb20241928 [1,0,0,1,0,0|2,0,0]=4 9744 B6R1.5 NC1CC(=O)C1 Amb23439093 [1,0,0,1,0,0|2,0,0]=4 9745 B6R1.5 O=C1CC(Br)C1 Amb33548005 [1,0,0,1,0,0|2,0,0]=4 9746 B6R1.5 O=C1CC(F)C1 Amb27260513 [1,0,0,1,0,0|2,0,0]=4 9747 B6R1.5 O=C1CC(F)N1 Amb24588463 [1,0,0,1,0,0|2,0,0]=4 9748 B6R1.5 O=C1CC(O)C1 Amb22235480 [1,0,0,1,0,0|2,0,0]=4 9749 B6R1.5 O=C1C[C@@H](Br)N1 Amb26634817 [1,0,0,1,0,0|2,0,0]=4 9750 B6R1.8 CCC1=CC1=O Amb28284229 [1,0,0,1,0,0|1,0,1]=4 9751 B6R1.8 CCC1OC1C Amb1141391 [1,0,0,1,0,0|1,0,1]=4 9752 B6R1.9 CC1CC1(C)O Amb22157187 [1,0,0,1,0,0|1,0,1]=4 9753 B6R1.10 CC1(O)CCC1 Amb17940165 [1,0,0,1,0,0|1,0,1]=4 9754 B6R1.10 N=S1(=O)CCC1 Amb31308363 [1,0,0,1,0,0|2,0,0]=4 9755 B6R1.10 O=S1(=O)CCC1 Amb13883572 [1,0,0,1,0,0|1,0,1]=4 9756 B6R1.11 C=C(Br)C1CC1 Amb22583737 [1,0,0,1,0,0|2,0,0]=4 9757 B6R1.11 C=C(C)C1CC1 Amb33542793 [1,0,0,1,0,0|2,0,0]=4 9758 B6R1.11 C=C(Cl)C1CC1 Amb28322133 [1,0,0,1,0,0|2,0,0]=4 9759 B6R1.11 CC(=O)C1CC1 Amb2686663 [1,0,0,1,0,0|1,0,0]=3 9760 B6R1.11 CC(=O)C1CO1 Amb4477044 [1,0,0,1,0,0|2,0,0]=4 9761 B6R1.11 CC(=S)C1CC1 Amb27424574 [1,0,0,1,0,0|1,1,0]=4 9762 B6R1.11 CC(O)C1CC1 Amb9748276 [1,0,0,1,0,0|1,0,1]=4 9763 B6R1.11 C[C@@H](O)C1CC1 Amb13952943 [1,0,0,1,0,0|1,0,1]=4 9764 B6R1.11 C[C@H](O)C1CC1 Amb13952945 [1,0,0,1,0,0|1,0,1]=4 9765 B6R1.11 N=C(N)C1CC1 Amb2686661 [1,0,0,1,0,0|2,0,0]=4 9766 B6R1.11 N=C(N)C1CC1 Amb2695053 [1,0,0,1,0,0|2,0,0]=4 9767 B6R1.11 NC(=O)C1CC1 Amb33546284 [1,0,0,1,0,0|1,0,0]=3 9768 B6R1.11 NC(=O)C1CO1 Amb6261241 [1,0,0,1,0,0|2,0,0]=4 9769 B6R1.11 NC(=O)C1CS1 Amb27217272 [1,0,0,1,0,0|2,0,0]=4 9770 B6R1.11 NC(=S)C1CC1 Amb6244950 [1,0,0,1,0,0|1,1,0]=4 9771 B6R1.11 NC(O)C1CC1 Amb22492754 [1,0,0,1,0,0|1,0,1]=4 9772 B6R1.11 NS(=O)C1CC1 Amb33071950 [1,0,0,1,0,0|2,0,0]=4 9773 B6R1.11 O=C(Br)C1CC1 Amb27457101 [1,0,0,1,0,0|1,0,0]=3 9774 B6R1.11 O=C(Cl)C1CC1 Amb3939317 [1,0,0,1,0,0|1,0,0]=3 9775 B6R1.11 O=C(I)C1CC1 Amb28315968 [1,0,0,1,0,0|1,0,0]=3 9776 B6R1.11 O=C(O)C1C=C1 Amb27185565 [1,0,0,1,0,0|0,0,2]=4 9777 B6R1.11 O=C(O)C1CC1 Amb2686655 [1,0,0,1,0,0|0,0,0]=2 9778 B6R1.11 O=C(O)C1CN1 Amb21864773 [1,0,0,1,0,0|1,0,0]=3 9779 B6R1.11 O=C(O)C1CO1 Amb8395277 [1,0,0,1,0,0|1,0,0]=3 9780 B6R1.11 O=C(O)C1NN1 Amb27949037 [1,0,0,1,0,0|2,0,0]=4 9781 B6R1.11 O=C(O)[C@@H]1CN1 Amb22745452 [1,0,0,1,0,0|1,0,0]=3 9782 B6R1.11 O=C(O)[C@@H]1CO1 Amb26994292 [1,0,0,1,0,0|1,0,0]=3 9783 B6R1.11 O=C(O)[C@@H]1CS1 Amb28396934 [1,0,0,1,0,0|1,0,0]=3 9784 B6R1.11 O=C(O)[C@H]1CS1 Amb27845518 [1,0,0,1,0,0|1,0,0]=3 9785 B6R1.11 O=C([O-])C1CO1 Amb22492453 [1,0,0,1,0,0|1,0,1]=4 9786 B6R1.11 O=S(Cl)C1CC1 Amb25662827 [1,0,0,1,0,0|2,0,0]=4 9787 B6R1.11 O=S(O)C1CC1 Amb24334290 [1,0,0,1,0,0|1,0,0]=3 9788 B6R1.11 O=S([O-])C1CC1 Amb2694437 [1,0,0,1,0,0|1,0,1]=4 9789 B6R1.11 O=[N+]([O-])C1CC1 Amb25768805 [1,0,0,1,0,0|1,0,1]=4 9790 B6R1.11 O=[PH](O)C1CC1 Amb8391285 [1,0,0,1,0,0|1,0,0]=3 9791 B6R1.11 OB(O)C1CC1 Amb2455832 [1,0,0,1,0,0|1,0,1]=4 9792 B6R1.11 OC(O)C1CC1 Amb28062492 [1,0,0,1,0,0|0,0,2]=4 9793 B6R1.1 C1=CCCCC1 Amb6608805 [1,0,0,1,0,0|1,0,0]=3 9794 B6R1.1 C1=CCNCC1 Amb2720330 [1,0,0,1,0,0|2,0,0]=4 9795 B6R1.1 C1=CCNCC1 Amb3941710 [1,0,0,1,0,0|2,0,0]=4 9796 B6R1.1 C1=CCOCC1 Amb16234261 [1,0,0,1,0,0|2,0,0]=4 9797 B6R1.1 C1=CCSCC1 Amb29848083 [1,0,0,1,0,0|2,0,0]=4 9798 B6R1.1 C1=CNCCC1 Amb24389577 [1,0,0,1,0,0|1,0,1]=4 9799 B6R1.1 C1=COCCC1 Amb6609004 [1,0,0,1,0,0|0,0,1]=3 9800 B6R1.1 C1=COCCN1 Amb27413503 [1,0,0,1,0,0|1,0,1]=4 9801 B6R1.1 C1=COCCO1 Amb22043779 [1,0,0,1,0,0|1,0,1]=4 9802 B6R1.1 C1=NCCCC1 Amb27752613 [1,0,0,1,0,0|1,0,0]=3 9803 B6R1.1 C1=NCCCN1 Amb17620508 [1,0,0,1,0,0|2,0,0]=4 9804 B6R1.1 C1=NCNCC1 Amb27175339 [1,0,0,1,0,0|2,0,0]=4 9805 B6R1.1 C1=NSCCC1 Amb27266087 [1,0,0,1,0,0|2,0,0]=4 9806 B6R1.1 C1CCNCC1 Amb2792840 [1,0,0,1,0,0|1,0,1]=4 9807 B6R1.1 C1CCNCC1 Amb2816589 [1,0,0,1,0,0|1,0,1]=4 9808 B6R1.1 C1CCNNC1 Amb10975991 [1,0,0,1,0,0|2,0,0]=4 9809 B6R1.1 C1CCNNC1 Amb18559485 [1,0,0,1,0,0|2,0,0]=4 9810 B6R1.1 C1CCNNC1 Amb22263856 [1,0,0,1,0,0|2,0,0]=4 9811 B6R1.1 C1CCONC1 Amb22586922 [1,0,0,1,0,0|1,0,0]=3 9812 B6R1.1 C1CCONC1 Amb6365589 [1,0,0,1,0,0|1,0,0]=3 9813 B6R1.1 C1CCSCC1 Amb17666898 [1,0,0,1,0,0|0,1,1]=4 9814 B6R1.1 C1CCSSC1 Amb27845946 [1,0,0,1,0,0|1,1,0]=4 9815 B6R1.1 C1CC[NH2+]CC1 Amb19957935 [1,0,0,1,0,0|1,0,1]=4 9816 B6R1.1 C1CC[NH2+]CC1 Amb21856129 [1,0,0,1,0,0|1,0,1]=4 9817 B6R1.1 C1CNCOC1 Amb17506190 [1,0,0,1,0,0|1,0,1]=4 9818 B6R1.1 C1CNCOC1 Amb32652717 [1,0,0,1,0,0|1,0,1]=4 9819 B6R1.1 C1COCCN1 Amb2792841 [1,0,0,1,0,0|1,0,1]=4 9820 B6R1.1 C1COCCN1 Amb4020200 [1,0,0,1,0,0|1,0,1]=4 9821 B6R1.1 C1COCCO1 Amb6608797 [1,0,0,1,0,0|1,0,1]=4 9822 B6R1.1 C1COCOC1 Amb8515936 [1,0,0,1,0,0|1,0,1]=4 9823 B6R1.1 C1CSCCO1 Amb2690613 [1,0,0,1,0,0|1,0,1]=4 9824 B6R1.1 C1CSOCS1 Amb28315787 [1,0,0,1,0,0|2,0,0]=4 9825 B6R1.4 C=C1CCC1C Amb27424508 [1,0,0,1,0,0|1,0,0]=3 9826 B6R1.4 C=C1CCC1Cl Amb27637701 [1,0,0,1,0,0|2,0,0]=4 9827 B6R1.4 CC1CCC1=O Amb17593022 [1,0,0,1,0,0|0,0,0]=2 9828 B6R1.4 CC1CCC1Br Amb27657001 [1,0,0,1,0,0|1,0,1]=4 9829 B6R1.4 CC1CCC1N Amb26081246 [1,0,0,1,0,0|1,0,1]=4 9830 B6R1.4 CC1CCC1N Amb33550388 [1,0,0,1,0,0|1,0,1]=4 9831 B6R1.4 CC1CCC1O Amb33546533 [1,0,0,1,0,0|0,0,1]=3 9832 B6R1.4 CC1CCC1S Amb26562257 [1,0,0,1,0,0|0,1,1]=4 9833 B6R1.4 CC1CNC1=O Amb24444140 [1,0,0,1,0,0|1,0,0]=3 9834 B6R1.4 CC1COC1=O Amb25794274 [1,0,0,1,0,0|1,0,0]=3 9835 B6R1.4 CC1NCC1O Amb22754478 [1,0,0,1,0,0|1,0,1]=4 9836 B6R1.4 CC1NCC1O Amb26381929 [1,0,0,1,0,0|1,0,1]=4 9837 B6R1.4 CC1NNC1=O Amb35751853 [1,0,0,1,0,0|2,0,0]=4 9838 B6R1.4 CC1OCC1=O Amb23456088 [1,0,0,1,0,0|1,0,0]=3 9839 B6R1.4 CC1OCC1O Amb25917442 [1,0,0,1,0,0|1,0,1]=4 9840 B6R1.4 C[C@@H]1CC[C@H]1N Amb27461478 [1,0,0,1,0,0|1,0,1]=4 9841 B6R1.4 C[C@@H]1CC[C@H]1N Amb31030976 [1,0,0,1,0,0|1,0,1]=4 9842 B6R1.4 C[C@@H]1CC[C@H]1O Amb28053300 [1,0,0,1,0,0|0,0,1]=3 9843 B6R1.4 C[C@@H]1NCC1O Amb24120609 [1,0,0,1,0,0|1,0,1]=4 9844 B6R1.4 C[C@@H]1NC[C@@H]1O Amb25252257 [1,0,0,1,0,0|1,0,1]=4 9845 B6R1.4 C[C@@H]1NC[C@@H]1O Amb33719043 [1,0,0,1,0,0|1,0,1]=4 9846 B6R1.4 C[C@@H]1NC[C@H]1O Amb26448868 [1,0,0,1,0,0|1,0,1]=4 9847 B6R1.4 C[C@@H]1NC[C@H]1O Amb33719042 [1,0,0,1,0,0|1,0,1]=4 9848 B6R1.4 C[C@@H]1OC[C@@H]1O Amb25988882 [1,0,0,1,0,0|1,0,1]=4 9849 B6R1.4 C[C@@H]1OC[C@H]1O Amb25913383 [1,0,0,1,0,0|1,0,1]=4 9850 B6R1.4 C[C@@H]1SC[C@H]1O Amb27775813 [1,0,0,1,0,0|1,0,1]=4 9851 B6R1.4 C[C@H]1CC[C@H]1Br Amb28141451 [1,0,0,1,0,0|1,0,1]=4 9852 B6R1.4 C[C@H]1CNC1=O Amb27620602 [1,0,0,1,0,0|1,0,0]=3 9853 B6R1.4 C[C@H]1NCC1O Amb34145767 [1,0,0,1,0,0|1,0,1]=4 9854 B6R1.4 C[C@H]1NC[C@@H]1O Amb34137561 [1,0,0,1,0,0|1,0,1]=4 9855 B6R1.4 C[C@H]1NC[C@H]1O Amb34139677 [1,0,0,1,0,0|1,0,1]=4 9856 B6R1.4 C[C@H]1NC[C@H]1O Amb34145135 [1,0,0,1,0,0|1,0,1]=4 9857 B6R1.4 NC1CCC1=O Amb22896568 [1,0,0,1,0,0|1,0,0]=3 9858 B6R1.4 NC1CCC1=O Amb25887804 [1,0,0,1,0,0|1,0,0]=3 9859 B6R1.4 NC1CCC1O Amb19148610 [1,0,0,1,0,0|1,0,1]=4 9860 B6R1.4 NC1CCC1O Amb31291441 [1,0,0,1,0,0|1,0,1]=4 9861 B6R1.4 NC1CNC1=O Amb18832512 [1,0,0,1,0,0|2,0,0]=4 9862 B6R1.4 NC1CNC1=O Amb32671465 [1,0,0,1,0,0|2,0,0]=4 9863 B6R1.4 NN1CCC1=O Amb27860475 [1,0,0,1,0,0|2,0,0]=4 9864 B6R1.4 NN1CCC1=O Amb30625658 [1,0,0,1,0,0|2,0,0]=4 9865 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22757952 [1,0,0,1,0,0|1,0,1]=4 9866 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22823228 [1,0,0,1,0,0|1,0,1]=4 9867 B6R1.4 N[C@@H]1CC[C@H]1O Amb22757953 [1,0,0,1,0,0|1,0,1]=4 9868 B6R1.4 N[C@@H]1CC[C@H]1O Amb22823232 [1,0,0,1,0,0|1,0,1]=4 9869 B6R1.4 N[C@@H]1CC[C@H]1O Amb33719048 [1,0,0,1,0,0|1,0,1]=4 9870 B6R1.4 N[C@@H]1CNC1=O Amb22751418 [1,0,0,1,0,0|2,0,0]=4 9871 B6R1.4 N[C@@H]1CNC1=O Amb30982058 [1,0,0,1,0,0|2,0,0]=4 9872 B6R1.4 N[C@@H]1COC1=O Amb22748014 [1,0,0,1,0,0|2,0,0]=4 9873 B6R1.4 N[C@H]1CC[C@@H]1O Amb24579886 [1,0,0,1,0,0|1,0,1]=4 9874 B6R1.4 N[C@H]1CC[C@H]1O Amb24580190 [1,0,0,1,0,0|1,0,1]=4 9875 B6R1.4 N[C@H]1CNC1=O Amb25811302 [1,0,0,1,0,0|2,0,0]=4 9876 B6R1.4 N[C@H]1CNC1=O Amb31291144 [1,0,0,1,0,0|2,0,0]=4 9877 B6R1.4 N[C@H]1COC1=O Amb28315731 [1,0,0,1,0,0|2,0,0]=4 9878 B6R1.4 N[C@H]1CSC1=O Amb27391192 [1,0,0,1,0,0|2,0,0]=4 9879 B6R1.4 O=C1CCC1=O Amb4036402 [1,0,0,1,0,0|1,0,1]=4 9880 B6R1.4 O=C1CCC1Br Amb21964157 [1,0,0,1,0,0|1,0,0]=3 9881 B6R1.4 O=C1CCC1Cl Amb33544158 [1,0,0,1,0,0|1,0,0]=3 9882 B6R1.4 O=C1CCC1O Amb17593027 [1,0,0,1,0,0|1,0,0]=3 9883 B6R1.4 O=C1NCC1O Amb24689689 [1,0,0,1,0,0|2,0,0]=4 9884 B6R1.4 OC1CCC1F Amb34138084 [1,0,0,1,0,0|1,0,1]=4 9885 B6R1.4 OC1CCC1O Amb27647204 [1,0,0,1,0,0|1,0,1]=4 9886 B6R1.4 O[C@@H]1CC[C@H]1O Amb28053810 [1,0,0,1,0,0|1,0,1]=4 9887 B6R1.4 O[C@@H]1CC[C@H]1S Amb27420494 [1,0,0,1,0,0|1,0,1]=4 9888 B6R1.4 O[C@H]1CC[C@H]1O Amb24505810 [1,0,0,1,0,0|1,0,1]=4 9889 B6R1.6 BrCC1C=CC1 Amb27188357 [1,0,0,1,0,0|2,0,0]=4 9890 B6R1.6 BrCC1CCC1 Amb3940157 [1,0,0,1,0,0|1,0,1]=4 9891 B6R1.6 BrCC1CCO1 Amb2383525 [1,0,0,1,0,0|1,0,1]=4 9892 B6R1.6 C#CC1CCC1 Amb25184959 [1,0,0,1,0,0|1,0,1]=4 9893 B6R1.6 C=CC1CCC1 Amb27254044 [1,0,0,1,0,0|1,0,0]=3 9894 B6R1.6 C=C[C@H]1CCN1 Amb27164530 [1,0,0,1,0,0|2,0,0]=4 9895 B6R1.6 CC=C1CCC1 Amb27960500 [1,0,0,1,0,0|1,0,1]=4 9896 B6R1.6 CCC1CCC1 Amb24394555 [1,0,0,1,0,0|1,0,1]=4 9897 B6R1.6 CCC1CCN1 Amb24117042 [1,0,0,1,0,0|1,0,1]=4 9898 B6R1.6 CCC1CCN1 Amb32661102 [1,0,0,1,0,0|1,0,1]=4 9899 B6R1.6 CCC1CNC1 Amb25836819 [1,0,0,1,0,0|2,0,0]=4 9900 B6R1.6 CCC1CNC1 Amb34151372 [1,0,0,1,0,0|2,0,0]=4 9901 B6R1.6 CNC1CCC1 Amb18946245 [1,0,0,1,0,0|2,0,0]=4 9902 B6R1.6 CNC1CCC1 Amb19303706 [1,0,0,1,0,0|2,0,0]=4 9903 B6R1.6 CSC1CCC1 Amb27875235 [1,0,0,1,0,0|2,0,0]=4 9904 B6R1.6 ClCC1CCC1 Amb8860570 [1,0,0,1,0,0|1,0,1]=4 9905 B6R1.6 ClCC1CCO1 Amb22495451 [1,0,0,1,0,0|1,0,1]=4 9906 B6R1.6 ICC1CCC1 Amb27831605 [1,0,0,1,0,0|1,0,1]=4 9907 B6R1.6 ICC1CCO1 Amb13883581 [1,0,0,1,0,0|1,0,1]=4 9908 B6R1.6 N#CC1CCC1 Amb16232994 [1,0,0,1,0,0|1,0,1]=4 9909 B6R1.6 NCC1C=CC1 Amb32658178 [1,0,0,1,0,0|2,0,0]=4 9910 B6R1.6 NCC1CCC1 Amb6255393 [1,0,0,1,0,0|1,0,1]=4 9911 B6R1.6 NCC1CCC1 Amb7969499 [1,0,0,1,0,0|1,0,1]=4 9912 B6R1.6 NCC1CCO1 Amb19895255 [1,0,0,1,0,0|1,0,1]=4 9913 B6R1.6 NC[C@@H]1CCO1 Amb34141504 [1,0,0,1,0,0|1,0,1]=4 9914 B6R1.6 NC[C@H]1CCO1 Amb33805341 [1,0,0,1,0,0|1,0,1]=4 9915 B6R1.6 NNC1CCC1 Amb21936692 [1,0,0,1,0,0|2,0,0]=4 9916 B6R1.6 NNC1CCC1 Amb33533268 [1,0,0,1,0,0|2,0,0]=4 9917 B6R1.6 NNC1CCC1 Amb6892241 [1,0,0,1,0,0|2,0,0]=4 9918 B6R1.6 NOC1CCC1 Amb10975959 [1,0,0,1,0,0|2,0,0]=4 9919 B6R1.6 NOC1CCC1 Amb25118834 [1,0,0,1,0,0|2,0,0]=4 9920 B6R1.6 O=CC1CCC1 Amb8009552 [1,0,0,1,0,0|0,0,0]=2 9921 B6R1.6 O=CC1CCN1 Amb25757222 [1,0,0,1,0,0|1,0,0]=3 9922 B6R1.6 O=CC1CCS1 Amb27644631 [1,0,0,1,0,0|1,0,0]=3 9923 B6R1.6 O=CC1CNC1 Amb25919428 [1,0,0,1,0,0|1,0,0]=3 9924 B6R1.6 O=CC1COC1 Amb21857829 [1,0,0,1,0,0|1,0,0]=3 9925 B6R1.6 O=NN1CCC1 Amb24407378 [1,0,0,1,0,0|2,0,0]=4 9926 B6R1.6 OCC1C=CC1 Amb26987497 [1,0,0,1,0,0|2,0,0]=4 9927 B6R1.6 OCC1CCC1 Amb2686620 [1,0,0,1,0,0|0,0,1]=3 9928 B6R1.6 OCC1CCN1 Amb21963462 [1,0,0,1,0,0|1,0,1]=4 9929 B6R1.6 OCC1CCN1 Amb32682448 [1,0,0,1,0,0|1,0,1]=4 9930 B6R1.6 OCC1CCO1 Amb21960943 [1,0,0,1,0,0|1,0,1]=4 9931 B6R1.6 OCC1CNC1 Amb17943116 [1,0,0,1,0,0|1,0,1]=4 9932 B6R1.6 OCC1CNC1 Amb33530567 [1,0,0,1,0,0|1,0,1]=4 9933 B6R1.6 OCC1COC1 Amb33546888 [1,0,0,1,0,0|1,0,1]=4 9934 B6R1.6 OCC1CSC1 Amb23438800 [1,0,0,1,0,0|1,0,1]=4 9935 B6R1.6 OC[C@@H]1CCN1 Amb22406086 [1,0,0,1,0,0|1,0,1]=4 9936 B6R1.6 OC[C@@H]1CCN1 Amb34913959 [1,0,0,1,0,0|1,0,1]=4 9937 B6R1.6 OC[C@H]1CCN1 Amb22233159 [1,0,0,1,0,0|1,0,1]=4 9938 B6R1.6 OC[C@H]1CCN1 Amb33859052 [1,0,0,1,0,0|1,0,1]=4 9939 B6R1.6 OC[C@H]1CCO1 Amb24559274 [1,0,0,1,0,0|1,0,1]=4 9940 B6R1.6 ON=C1CCC1 Amb2782887 [1,0,0,1,0,0|1,0,1]=4 9941 B6R1.6 ONC1COC1 Amb28201079 [1,0,0,1,0,0|2,0,0]=4 9942 B6R1.6 SCC1CCC1 Amb26511279 [1,0,0,1,0,0|0,1,1]=4 9943 B6R1.6 [C-]#[N+]C1CCC1 Amb19892422 [1,0,0,1,0,0|2,0,0]=4 9944 B8R1.1 C#CC1CCC(C)O1 Amb28048959 [0,1,0,1,0,0|1,0,1]=4 9945 B8R1.1 C#CC1CC[C@@H](C)O1 Amb33226112 [0,1,0,1,0,0|1,0,1]=4 9946 B8R1.1 C=C1CCC(CO)C1 Amb27869714 [0,1,0,1,0,0|2,0,0]=4 9947 B8R1.1 C=C1CC[C@H](CO)C1 Amb28430210 [0,1,0,1,0,0|2,0,0]=4 9948 B8R1.1 C=C1COC(CC)C1 Amb35614622 [0,1,0,1,0,0|1,0,0]=3 9949 B8R1.1 C=CC1CCC(=O)C1 Amb26592031 [0,1,0,1,0,0|1,0,1]=4 9950 B8R1.1 C=CC1CCC(=O)N1 Amb20622087 [0,1,0,1,0,0|1,0,1]=4 9951 B8R1.1 C=CC1CCC(=O)O1 Amb33249669 [0,1,0,1,0,0|0,0,1]=3 9952 B8R1.1 C=CC1CCC(C)O1 Amb27181113 [0,1,0,1,0,0|1,0,1]=4 9953 B8R1.1 C=CC1CC[C@@H](C)O1 Amb33448079 [0,1,0,1,0,0|1,0,1]=4 9954 B8R1.1 C=CC1CNC(=O)O1 Amb25064259 [0,1,0,1,0,0|0,0,2]=4 9955 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,1,0,1,0,0|0,0,2]=4 9956 B8R1.1 C=CC1COC(=O)O1 Amb17942789 [0,1,0,1,0,0|0,0,2]=4 9957 B8R1.1 C=C[C@@H]1CCC(=O)N1 Amb27838334 [0,1,0,1,0,0|1,0,1]=4 9958 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,1,0,1,0,0|0,0,2]=4 9959 B8R1.1 C=C[C@@H]1COC(=O)O1 Amb25946828 [0,1,0,1,0,0|0,0,2]=4 9960 B8R1.1 C=C[C@H]1CCC(=O)N1 Amb27459295 [0,1,0,1,0,0|1,0,1]=4 9961 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,1,0,1,0,0|0,0,2]=4 9962 B8R1.1 C=C[C@H]1COC(=O)O1 Amb26588639 [0,1,0,1,0,0|0,0,2]=4 9963 B8R1.1 CC1=C\C(=N\O)CC1 Amb28324785 [0,1,0,1,0,0|1,0,1]=4 9964 B8R1.1 CC1=NOC(CBr)C1 Amb23571392 [0,1,0,1,0,0|2,0,0]=4 9965 B8R1.1 CC1=NOC(CCl)C1 Amb23571110 [0,1,0,1,0,0|2,0,0]=4 9966 B8R1.1 CC1=NOC(CN)C1 Amb21955831 [0,1,0,1,0,0|2,0,0]=4 9967 B8R1.1 CC1=NOC(CN)C1 Amb8010054 [0,1,0,1,0,0|2,0,0]=4 9968 B8R1.1 CC1=NOC(CO)C1 Amb9902086 [0,1,0,1,0,0|2,0,0]=4 9969 B8R1.1 CC1=NO[C@H](CO)C1 Amb28455073 [0,1,0,1,0,0|2,0,0]=4 9970 B8R1.1 CC1CC=C(CO)O1 Amb28400924 [0,1,0,1,0,0|0,0,2]=4 9971 B8R1.1 CC1CCC(C#N)O1 Amb27809602 [0,1,0,1,0,0|1,0,1]=4 9972 B8R1.1 CC1CCC(C=O)C1 Amb33549452 [0,1,0,1,0,0|1,0,1]=4 9973 B8R1.1 CC1CCC(CI)O1 Amb28386366 [0,1,0,1,0,0|1,0,1]=4 9974 B8R1.1 CC1CCC(CN)O1 Amb33551292 [0,1,0,1,0,0|1,0,1]=4 9975 B8R1.1 CC1CCC(CO)N1 Amb26316183 [0,1,0,1,0,0|1,0,1]=4 9976 B8R1.1 CC1CCC(CO)N1 Amb32666058 [0,1,0,1,0,0|1,0,1]=4 9977 B8R1.1 CC1CCC(CS)O1 Amb24524291 [0,1,0,1,0,0|0,1,1]=4 9978 B8R1.1 CC1CC\C(=N/N)C1 Amb28137031 [0,1,0,1,0,0|2,0,0]=4 9979 B8R1.1 CC1CN=C(CCl)O1 Amb29845386 [0,1,0,1,0,0|2,0,0]=4 9980 B8R1.1 CC1CN=C(CN)O1 Amb29845388 [0,1,0,1,0,0|2,0,0]=4 9981 B8R1.1 CC1C\C(=N\O)CO1 Amb35709648 [0,1,0,1,0,0|2,0,0]=4 9982 B8R1.1 CCC1=CC(=O)CC1 Amb25889297 [0,1,0,1,0,0|1,0,0]=3 9983 B8R1.1 CCC1=CC(C)CC1 Amb25810526 [0,1,0,1,0,0|2,0,0]=4 9984 B8R1.1 CCC1=CC(O)CC1 Amb28399443 [0,1,0,1,0,0|1,0,1]=4 9985 B8R1.1 CCC1=CCC(=O)O1 Amb27974572 [0,1,0,1,0,0|0,0,1]=3 9986 B8R1.1 CCC1=CCC(=O)S1 Amb27631498 [0,1,0,1,0,0|0,1,1]=4 9987 B8R1.1 CCC1=NNC(=O)C1 Amb4335453 [0,1,0,1,0,0|1,0,1]=4 9988 B8R1.1 CCC1=NOC(=O)C1 Amb26614539 [0,1,0,1,0,0|0,0,1]=3 9989 B8R1.1 CCC1C=CC(=O)O1 Amb23571855 [0,1,0,1,0,0|0,0,1]=3 9990 B8R1.1 CCC1CC(=O)CO1 Amb27856666 [0,1,0,1,0,0|0,0,0]=2 9991 B8R1.1 CCC1CC(=O)NN1 Amb29862365 [0,1,0,1,0,0|1,0,0]=3 9992 B8R1.1 CCC1CC(Br)CO1 Amb27657725 [0,1,0,1,0,0|1,0,1]=4 9993 B8R1.1 CCC1CC(Cl)CO1 Amb29870833 [0,1,0,1,0,0|1,0,1]=4 9994 B8R1.1 CCC1CC(N)CO1 Amb29866234 [0,1,0,1,0,0|1,0,1]=4 9995 B8R1.1 CCC1CC(O)CN1 Amb27398576 [0,1,0,1,0,0|1,0,1]=4 9996 B8R1.1 CCC1CC(O)CN1 Amb32753264 [0,1,0,1,0,0|1,0,1]=4 9997 B8R1.1 CCC1CC(S)CO1 Amb32788423 [0,1,0,1,0,0|0,1,1]=4 9998 B8R1.1 CCC1CCC(=O)N1 Amb19516715 [0,1,0,1,0,0|1,0,0]=3 9999 B8R1.1 CCC1CCC(=O)O1 Amb3941505 [0,1,0,1,0,0|0,0,0]=2 10000 B8R1.1 CCC1CCC(O)C1 Amb24471617 [0,1,0,1,0,0|1,0,1]=4 10001 B8R1.1 CCC1CCC(O)O1 Amb27804358 [0,1,0,1,0,0|0,0,2]=4 10002 B8R1.1 CCC1CN=C(Br)S1 Amb27783911 [0,1,0,1,0,0|1,1,0]=4 10003 B8R1.1 CCC1CN=C(C)N1 Amb25732193 [0,1,0,1,0,0|2,0,0]=4 10004 B8R1.1 CCC1CN=C(C)S1 Amb25197984 [0,1,0,1,0,0|1,1,0]=4 10005 B8R1.1 CCC1CN=C(Cl)S1 Amb28315725 [0,1,0,1,0,0|1,1,0]=4 10006 B8R1.1 CCC1CNC(=O)C1 Amb10608005 [0,1,0,1,0,0|1,0,0]=3 10007 B8R1.1 CCC1CNC(=O)N1 Amb17506855 [0,1,0,1,0,0|1,0,0]=3 10008 B8R1.1 CCC1CNC(=O)O1 Amb27237218 [0,1,0,1,0,0|0,0,0]=2 10009 B8R1.1 CCC1CNC(=S)S1 Amb28428460 [0,1,0,1,0,0|0,2,0]=4 10010 B8R1.1 CCC1CNC(S)=N1 Amb25072509 [0,1,0,1,0,0|1,1,0]=4 10011 B8R1.1 CCC1COC(=O)C1 Amb27854064 [0,1,0,1,0,0|0,0,0]=2 10012 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,1,0,1,0,0|1,0,0]=3 10013 B8R1.1 CCC1COC(=O)O1 Amb2721339 [0,1,0,1,0,0|0,0,0]=2 10014 B8R1.1 CCC1COC(=S)N1 Amb27264047 [0,1,0,1,0,0|1,1,0]=4 10015 B8R1.1 CCC1CSC(=S)N1 Amb25078191 [0,1,0,1,0,0|1,1,0]=4 10016 B8R1.1 CCC1CSC(Br)=N1 Amb25749236 [0,1,0,1,0,0|2,0,0]=4 10017 B8R1.1 CCC1CSC(C)=N1 Amb24325349 [0,1,0,1,0,0|2,0,0]=4 10018 B8R1.1 CCC1CSC(Cl)=N1 Amb28049028 [0,1,0,1,0,0|2,0,0]=4 10019 B8R1.1 CCC1N=C(C)CS1 Amb24664975 [0,1,0,1,0,0|2,0,0]=4 10020 B8R1.1 CCC1OCC(C)O1 Amb19892405 [0,1,0,1,0,0|1,0,1]=4 10021 B8R1.1 CCN1CCC(N)=N1 Amb27875572 [0,1,0,1,0,0|2,0,0]=4 10022 B8R1.1 CCN1CCC(O)C1 Amb3939019 [0,1,0,1,0,0|1,0,1]=4 10023 B8R1.1 CC[C@@H]1C=CC(=O)O1 Amb27954643 [0,1,0,1,0,0|0,0,1]=3 10024 B8R1.1 CC[C@@H]1CCC(=O)O1 Amb26626757 [0,1,0,1,0,0|0,0,0]=2 10025 B8R1.1 CC[C@@H]1CC[C@H](O)C1 Amb27626637 [0,1,0,1,0,0|1,0,1]=4 10026 B8R1.1 CC[C@@H]1COC(=S)N1 Amb27838333 [0,1,0,1,0,0|1,1,0]=4 10027 B8R1.1 CC[C@@H]1C[C@H](O)CN1 Amb27787989 [0,1,0,1,0,0|1,0,1]=4 10028 B8R1.1 CC[C@H]1C=CC(=O)O1 Amb28195329 [0,1,0,1,0,0|0,0,1]=3 10029 B8R1.1 CC[C@H]1C=C[C@H](O)C1 Amb28064182 [0,1,0,1,0,0|1,0,1]=4 10030 B8R1.1 CC[C@H]1CCC(=O)O1 Amb25795415 [0,1,0,1,0,0|0,0,0]=2 10031 B8R1.1 CC[C@H]1CNC(=O)O1 Amb27954656 [0,1,0,1,0,0|0,0,0]=2 10032 B8R1.1 CC[C@H]1COC(=O)N1 Amb27411564 [0,1,0,1,0,0|1,0,0]=3 10033 B8R1.1 CC[C@H]1COC(=S)N1 Amb27596053 [0,1,0,1,0,0|1,1,0]=4 10034 B8R1.1 CC[C@H]1CSC(=S)N1 Amb27810512 [0,1,0,1,0,0|1,1,0]=4 10035 B8R1.1 CC[C@H]1C[C@@H](O)CN1 Amb32676625 [0,1,0,1,0,0|1,0,1]=4 10036 B8R1.1 CC[C@H]1C[C@@H](O)CN1 Amb32676626 [0,1,0,1,0,0|1,0,1]=4 10037 B8R1.1 CNC1=NCC(C)O1 Amb27202732 [0,1,0,1,0,0|2,0,0]=4 10038 B8R1.1 CNC1CCC(=O)C1 Amb28316112 [0,1,0,1,0,0|1,0,0]=3 10039 B8R1.1 CNC1CCC(O)C1 Amb27595077 [0,1,0,1,0,0|1,0,1]=4 10040 B8R1.1 CNC1CNC(=O)C1 Amb25851765 [0,1,0,1,0,0|2,0,0]=4 10041 B8R1.1 CNC1COC(=O)C1 Amb26505382 [0,1,0,1,0,0|1,0,0]=3 10042 B8R1.1 COC1=CC(=O)CC1 Amb21864758 [0,1,0,1,0,0|1,0,1]=4 10043 B8R1.1 COC1C=CC(=O)O1 Amb22490509 [0,1,0,1,0,0|0,0,2]=4 10044 B8R1.1 COC1CC(=O)CO1 Amb27409395 [0,1,0,1,0,0|1,0,0]=3 10045 B8R1.1 COC1CCC(=O)C1 Amb24483163 [0,1,0,1,0,0|1,0,0]=3 10046 B8R1.1 COC1CCC(=O)N1 Amb17617087 [0,1,0,1,0,0|1,0,0]=3 10047 B8R1.1 COC1CCC(C)N1 Amb27838380 [0,1,0,1,0,0|1,0,1]=4 10048 B8R1.1 COC1CCC(O)C1 Amb26330676 [0,1,0,1,0,0|1,0,1]=4 10049 B8R1.1 COC1CNC(=O)C1 Amb24683870 [0,1,0,1,0,0|2,0,0]=4 10050 B8R1.1 COC1COC(=O)N1 Amb24372259 [0,1,0,1,0,0|2,0,0]=4 10051 B8R1.1 CO[C@@H]1CC[C@H](O)C1 Amb25913334 [0,1,0,1,0,0|1,0,1]=4 10052 B8R1.1 CSC1CCC(=O)C1 Amb28184431 [0,1,0,1,0,0|1,0,0]=3 10053 B8R1.1 CSC1CCC(O)C1 Amb33620320 [0,1,0,1,0,0|1,0,1]=4 10054 B8R1.1 CSC1COC(=O)O1 Amb27395888 [0,1,0,1,0,0|1,0,0]=3 10055 B8R1.1 C[C@@H]1C=C(C=O)CC1 Amb25760068 [0,1,0,1,0,0|1,0,0]=3 10056 B8R1.1 C[C@@H]1CCC(CBr)O1 Amb33331125 [0,1,0,1,0,0|1,0,1]=4 10057 B8R1.1 C[C@@H]1CCC(CN)O1 Amb33423847 [0,1,0,1,0,0|1,0,1]=4 10058 B8R1.1 C[C@@H]1CCC(CO)O1 Amb24524279 [0,1,0,1,0,0|0,0,2]=4 10059 B8R1.1 C[C@@H]1CCC(CS)O1 Amb32730401 [0,1,0,1,0,0|0,1,1]=4 10060 B8R1.1 C[C@@H]1CC[C@H](CO)N1 Amb24679369 [0,1,0,1,0,0|1,0,1]=4 10061 B8R1.1 C[C@@H]1CC[C@H](CO)N1 Amb30594251 [0,1,0,1,0,0|1,0,1]=4 10062 B8R1.1 C[C@@H]1CC[C@H](CO)O1 Amb22886849 [0,1,0,1,0,0|0,0,2]=4 10063 B8R1.1 C[C@H]1C=C(C=O)CC1 Amb25839230 [0,1,0,1,0,0|1,0,0]=3 10064 B8R1.1 C[C@H]1C=C(CO)CC1 Amb27452870 [0,1,0,1,0,0|1,0,0]=3 10065 B8R1.1 C[C@H]1CCC(CCl)O1 Amb27874116 [0,1,0,1,0,0|1,0,1]=4 10066 B8R1.1 C[C@H]1CC[C@@H](CO)N1 Amb22886262 [0,1,0,1,0,0|1,0,1]=4 10067 B8R1.1 C[C@H]1CC[C@@H](CO)O1 Amb27640536 [0,1,0,1,0,0|0,0,2]=4 10068 B8R1.1 C[C@H]1CC[C@H](CO)O1 Amb27484806 [0,1,0,1,0,0|0,0,2]=4 10069 B8R1.1 C\C=C1\CCC(=O)O1 Amb27421031 [0,1,0,1,0,0|0,0,1]=3 10070 B8R1.1 C\N=C1/CCC(=O)N1 Amb26457426 [0,1,0,1,0,0|1,0,1]=4 10071 B8R1.1 ClCC1CC(Br)=NO1 Amb23449511 [0,1,0,1,0,0|2,0,0]=4 10072 B8R1.1 N#CC1CCC(=O)C1 Amb22886979 [0,1,0,1,0,0|1,0,1]=4 10073 B8R1.1 N#CC1CCC(=O)N1 Amb26361514 [0,1,0,1,0,0|1,0,1]=4 10074 B8R1.1 N#CC1CNC(=O)O1 Amb26984953 [0,1,0,1,0,0|1,0,1]=4 10075 B8R1.1 N#CC1COC(=O)O1 Amb35788458 [0,1,0,1,0,0|1,0,1]=4 10076 B8R1.1 N#C[C@H]1CCC(=O)C1 Amb26562820 [0,1,0,1,0,0|1,0,1]=4 10077 B8R1.1 N#C[C@H]1CCC(=O)N1 Amb27404492 [0,1,0,1,0,0|1,0,1]=4 10078 B8R1.1 N=C1CC[C@H](CO)N1 Amb27431528 [0,1,0,1,0,0|2,0,0]=4 10079 B8R1.1 NC1=NCC(CBr)O1 Amb2721921 [0,1,0,1,0,0|2,0,0]=4 10080 B8R1.1 NC1=NCC(CBr)O1 Amb33328591 [0,1,0,1,0,0|2,0,0]=4 10081 B8R1.1 NC1=NCC(CCl)O1 Amb26392039 [0,1,0,1,0,0|2,0,0]=4 10082 B8R1.1 NC1=NCC(CO)O1 Amb27596592 [0,1,0,1,0,0|2,0,0]=4 10083 B8R1.1 NC1=NC[C@@H](CCl)O1 Amb27839394 [0,1,0,1,0,0|2,0,0]=4 10084 B8R1.1 NCC1=NOC(=O)C1 Amb18833041 [0,1,0,1,0,0|1,0,1]=4 10085 B8R1.1 NCC1C=CC(=O)O1 Amb27842373 [0,1,0,1,0,0|0,0,2]=4 10086 B8R1.1 NCC1CC(Br)=NO1 Amb22169739 [0,1,0,1,0,0|2,0,0]=4 10087 B8R1.1 NCC1CC(Cl)=NO1 Amb28341795 [0,1,0,1,0,0|2,0,0]=4 10088 B8R1.1 NCC1CCC(=O)C1 Amb24644946 [0,1,0,1,0,0|1,0,0]=3 10089 B8R1.1 NCC1CCC(=O)N1 Amb19330383 [0,1,0,1,0,0|1,0,0]=3 10090 B8R1.1 NCC1CCC(=O)N1 Amb2154785 [0,1,0,1,0,0|1,0,0]=3 10091 B8R1.1 NCC1CCC(=O)N1 Amb2699145 [0,1,0,1,0,0|1,0,0]=3 10092 B8R1.1 NCC1CCC(=O)O1 Amb24482045 [0,1,0,1,0,0|0,0,0]=2 10093 B8R1.1 NCC1CCC(=O)O1 Amb28934914 [0,1,0,1,0,0|0,0,0]=2 10094 B8R1.1 NCC1CCC(O)C1 Amb22886211 [0,1,0,1,0,0|1,0,1]=4 10095 B8R1.1 NCC1CCC(O)C1 Amb33547590 [0,1,0,1,0,0|1,0,1]=4 10096 B8R1.1 NCC1CNC(=O)C1 Amb22899752 [0,1,0,1,0,0|2,0,0]=4 10097 B8R1.1 NCC1CNC(=O)C1 Amb32434789 [0,1,0,1,0,0|2,0,0]=4 10098 B8R1.1 NCC1CNC(=O)C1 Amb8009790 [0,1,0,1,0,0|2,0,0]=4 10099 B8R1.1 NCC1CNC(=O)N1 Amb32666643 [0,1,0,1,0,0|2,0,0]=4 10100 B8R1.1 NCC1CNC(=O)N1 Amb33339243 [0,1,0,1,0,0|2,0,0]=4 10101 B8R1.1 NCC1CNC(=O)O1 Amb17506099 [0,1,0,1,0,0|1,0,0]=3 10102 B8R1.1 NCC1CNC(=O)O1 Amb33527727 [0,1,0,1,0,0|1,0,0]=3 10103 B8R1.1 NCC1COC(=O)N1 Amb27852206 [0,1,0,1,0,0|2,0,0]=4 10104 B8R1.1 NCC1COC(=O)N1 Amb28934922 [0,1,0,1,0,0|2,0,0]=4 10105 B8R1.1 NC[C@@H]1CC(Br)=NO1 Amb27409100 [0,1,0,1,0,0|2,0,0]=4 10106 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb22746678 [0,1,0,1,0,0|1,0,0]=3 10107 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb2699146 [0,1,0,1,0,0|1,0,0]=3 10108 B8R1.1 NC[C@@H]1CC[C@@H](O)C1 Amb10066974 [0,1,0,1,0,0|1,0,1]=4 10109 B8R1.1 NC[C@@H]1CC[C@H](O)C1 Amb10066982 [0,1,0,1,0,0|1,0,1]=4 10110 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439750 [0,1,0,1,0,0|2,0,0]=4 10111 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439751 [0,1,0,1,0,0|2,0,0]=4 10112 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb24183560 [0,1,0,1,0,0|1,0,0]=3 10113 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb25127772 [0,1,0,1,0,0|1,0,0]=3 10114 B8R1.1 NC[C@H]1CCC(=O)N1 Amb2699147 [0,1,0,1,0,0|1,0,0]=3 10115 B8R1.1 NC[C@H]1CCC(=O)N1 Amb32721612 [0,1,0,1,0,0|1,0,0]=3 10116 B8R1.1 NC[C@H]1CC[C@@H](O)C1 Amb10066975 [0,1,0,1,0,0|1,0,1]=4 10117 B8R1.1 NC[C@H]1CNC(=O)C1 Amb27797276 [0,1,0,1,0,0|2,0,0]=4 10118 B8R1.1 NC[C@H]1CNC(=O)C1 Amb31204575 [0,1,0,1,0,0|2,0,0]=4 10119 B8R1.1 NC[C@H]1CNC(=O)O1 Amb27403470 [0,1,0,1,0,0|1,0,0]=3 10120 B8R1.1 NC[C@H]1CNC(=O)O1 Amb30869777 [0,1,0,1,0,0|1,0,0]=3 10121 B8R1.1 O=C1C=CC(CBr)O1 Amb24423424 [0,1,0,1,0,0|0,0,2]=4 10122 B8R1.1 O=C1C=C[C@@H](CBr)O1 Amb28128549 [0,1,0,1,0,0|0,0,2]=4 10123 B8R1.1 O=C1C=C[C@@H](CO)O1 Amb3939187 [0,1,0,1,0,0|0,0,2]=4 10124 B8R1.1 O=C1C=C[C@H](CO)O1 Amb2699833 [0,1,0,1,0,0|0,0,2]=4 10125 B8R1.1 O=C1CC(CBr)CN1 Amb33548071 [0,1,0,1,0,0|2,0,0]=4 10126 B8R1.1 O=C1CC(CCl)CN1 Amb27259904 [0,1,0,1,0,0|2,0,0]=4 10127 B8R1.1 O=C1CC(CF)CN1 Amb33379247 [0,1,0,1,0,0|2,0,0]=4 10128 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,1,0,1,0,0|1,0,0]=3 10129 B8R1.1 O=C1CC(CI)CN1 Amb25031171 [0,1,0,1,0,0|2,0,0]=4 10130 B8R1.1 O=C1CC(CO)CN1 Amb9902173 [0,1,0,1,0,0|2,0,0]=4 10131 B8R1.1 O=C1CC(CO)CO1 Amb22886806 [0,1,0,1,0,0|1,0,0]=3 10132 B8R1.1 O=C1CC(CO)NN1 Amb35686080 [0,1,0,1,0,0|2,0,0]=4 10133 B8R1.1 O=C1CC(CS)CN1 Amb27850787 [0,1,0,1,0,0|2,0,0]=4 10134 B8R1.1 O=C1CC=C(CO)O1 Amb26977633 [0,1,0,1,0,0|0,0,2]=4 10135 B8R1.1 O=C1CCC(CBr)N1 Amb22492782 [0,1,0,1,0,0|1,0,0]=3 10136 B8R1.1 O=C1CCC(CBr)N1 Amb32752580 [0,1,0,1,0,0|1,0,0]=3 10137 B8R1.1 O=C1CCC(CBr)O1 Amb22587611 [0,1,0,1,0,0|0,0,0]=2 10138 B8R1.1 O=C1CCC(CCl)N1 Amb25125270 [0,1,0,1,0,0|1,0,0]=3 10139 B8R1.1 O=C1CCC(CCl)O1 Amb10608418 [0,1,0,1,0,0|0,0,0]=2 10140 B8R1.1 O=C1CCC(CF)N1 Amb27838313 [0,1,0,1,0,0|1,0,0]=3 10141 B8R1.1 O=C1CCC(CI)C1 Amb27481152 [0,1,0,1,0,0|1,0,0]=3 10142 B8R1.1 O=C1CCC(CI)N1 Amb25955610 [0,1,0,1,0,0|1,0,0]=3 10143 B8R1.1 O=C1CCC(CI)O1 Amb25718848 [0,1,0,1,0,0|0,0,0]=2 10144 B8R1.1 O=C1CCC(CO)C1 Amb22168734 [0,1,0,1,0,0|1,0,0]=3 10145 B8R1.1 O=C1CCC(CO)N1 Amb33544815 [0,1,0,1,0,0|1,0,0]=3 10146 B8R1.1 O=C1CCC(CO)O1 Amb20240701 [0,1,0,1,0,0|0,0,0]=2 10147 B8R1.1 O=C1CCC(CO)S1 Amb28202904 [0,1,0,1,0,0|0,1,0]=3 10148 B8R1.1 O=C1CCC(CS)C1 Amb27828867 [0,1,0,1,0,0|1,0,0]=3 10149 B8R1.1 O=C1CCC(CS)N1 Amb32788463 [0,1,0,1,0,0|1,0,0]=3 10150 B8R1.1 O=C1CC[C@@H](CBr)N1 Amb2694702 [0,1,0,1,0,0|1,0,0]=3 10151 B8R1.1 O=C1CC[C@@H](CBr)N1 Amb32664923 [0,1,0,1,0,0|1,0,0]=3 10152 B8R1.1 O=C1CC[C@@H](CBr)O1 Amb24483198 [0,1,0,1,0,0|0,0,0]=2 10153 B8R1.1 O=C1CC[C@@H](CI)O1 Amb27175447 [0,1,0,1,0,0|0,0,0]=2 10154 B8R1.1 O=C1CC[C@@H](CO)N1 Amb2371840 [0,1,0,1,0,0|1,0,0]=3 10155 B8R1.1 O=C1CC[C@@H](CO)O1 Amb8515911 [0,1,0,1,0,0|0,0,0]=2 10156 B8R1.1 O=C1CC[C@H](CBr)C1 Amb26032409 [0,1,0,1,0,0|1,0,0]=3 10157 B8R1.1 O=C1CC[C@H](CBr)N1 Amb2695539 [0,1,0,1,0,0|1,0,0]=3 10158 B8R1.1 O=C1CC[C@H](CCl)N1 Amb26508557 [0,1,0,1,0,0|1,0,0]=3 10159 B8R1.1 O=C1CC[C@H](CO)N1 Amb2694795 [0,1,0,1,0,0|1,0,0]=3 10160 B8R1.1 O=C1CC[C@H](CO)O1 Amb4037005 [0,1,0,1,0,0|0,0,0]=2 10161 B8R1.1 O=C1CNC(CCl)C1 Amb27864068 [0,1,0,1,0,0|2,0,0]=4 10162 B8R1.1 O=C1COC(CO)C1 Amb24117838 [0,1,0,1,0,0|1,0,0]=3 10163 B8R1.1 O=C1COC(CO)N1 Amb27789986 [0,1,0,1,0,0|2,0,0]=4 10164 B8R1.1 O=C1C[C@@H](CBr)CO1 Amb27590526 [0,1,0,1,0,0|1,0,0]=3 10165 B8R1.1 O=C1C[C@@H](CO)CN1 Amb24515579 [0,1,0,1,0,0|2,0,0]=4 10166 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,1,0,1,0,0|1,0,0]=3 10167 B8R1.1 O=C1C[C@H](CO)CN1 Amb25745471 [0,1,0,1,0,0|2,0,0]=4 10168 B8R1.1 O=C1NC(CCl)CO1 Amb28282690 [0,1,0,1,0,0|2,0,0]=4 10169 B8R1.1 O=C1NC(CF)CO1 Amb33358226 [0,1,0,1,0,0|2,0,0]=4 10170 B8R1.1 O=C1NC(CO)CO1 Amb22410779 [0,1,0,1,0,0|2,0,0]=4 10171 B8R1.1 O=C1NC(CO)CS1 Amb27170689 [0,1,0,1,0,0|2,0,0]=4 10172 B8R1.1 O=C1NCC(CBr)O1 Amb24530204 [0,1,0,1,0,0|1,0,0]=3 10173 B8R1.1 O=C1NCC(CBr)S1 Amb7968758 [0,1,0,1,0,0|1,1,0]=4 10174 B8R1.1 O=C1NCC(CCl)O1 Amb1152954 [0,1,0,1,0,0|1,0,0]=3 10175 B8R1.1 O=C1NCC(CF)O1 Amb33379234 [0,1,0,1,0,0|1,0,0]=3 10176 B8R1.1 O=C1NCC(CI)O1 Amb28282085 [0,1,0,1,0,0|1,0,0]=3 10177 B8R1.1 O=C1NCC(CO)O1 Amb9421413 [0,1,0,1,0,0|1,0,0]=3 10178 B8R1.1 O=C1NCC(CS)O1 Amb25725846 [0,1,0,1,0,0|1,0,0]=3 10179 B8R1.1 O=C1NC[C@@H](CBr)O1 Amb27401944 [0,1,0,1,0,0|1,0,0]=3 10180 B8R1.1 O=C1NC[C@@H](CCl)O1 Amb22232513 [0,1,0,1,0,0|1,0,0]=3 10181 B8R1.1 O=C1NC[C@@H](CO)N1 Amb33482781 [0,1,0,1,0,0|2,0,0]=4 10182 B8R1.1 O=C1NC[C@@H](CO)O1 Amb24183552 [0,1,0,1,0,0|1,0,0]=3 10183 B8R1.1 O=C1NC[C@H](CCl)O1 Amb25077275 [0,1,0,1,0,0|1,0,0]=3 10184 B8R1.1 O=C1NC[C@H](CO)N1 Amb33620311 [0,1,0,1,0,0|2,0,0]=4 10185 B8R1.1 O=C1NC[C@H](CO)O1 Amb22737250 [0,1,0,1,0,0|1,0,0]=3 10186 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,1,0,1,0,0|2,0,0]=4 10187 B8R1.1 O=C1N[C@@H](CO)CO1 Amb26396455 [0,1,0,1,0,0|2,0,0]=4 10188 B8R1.1 O=C1N[C@H](CI)CO1 Amb28048135 [0,1,0,1,0,0|2,0,0]=4 10189 B8R1.1 O=C1N[C@H](CO)CO1 Amb26653948 [0,1,0,1,0,0|2,0,0]=4 10190 B8R1.1 O=C1N[C@H](CO)CS1 Amb27655608 [0,1,0,1,0,0|2,0,0]=4 10191 B8R1.1 O=C1OCC(CCl)O1 Amb3940630 [0,1,0,1,0,0|1,0,0]=3 10192 B8R1.1 O=C1OCC(CF)O1 Amb28348445 [0,1,0,1,0,0|1,0,0]=3 10193 B8R1.1 O=C1OCC(CO)O1 Amb3939438 [0,1,0,1,0,0|1,0,0]=3 10194 B8R1.1 O=C1OCC(CS)O1 Amb32650873 [0,1,0,1,0,0|1,0,0]=3 10195 B8R1.1 O=C1SCC(CCl)S1 Amb27975820 [0,1,0,1,0,0|1,1,0]=4 10196 B8R1.1 O=C1SCC(CO)S1 Amb27394779 [0,1,0,1,0,0|1,1,0]=4 10197 B8R1.1 O=CC1CCC(=O)C1 Amb18124240 [0,1,0,1,0,0|1,0,1]=4 10198 B8R1.1 O=CC1CCC(=O)N1 Amb24113125 [0,1,0,1,0,0|1,0,1]=4 10199 B8R1.1 O=CC1COC(=O)C1 Amb26428572 [0,1,0,1,0,0|1,0,1]=4 10200 B8R1.1 O=CC1COC(=O)O1 Amb27446683 [0,1,0,1,0,0|1,0,1]=4 10201 B8R1.1 O=C[C@@H]1CCC(=O)N1 Amb27390986 [0,1,0,1,0,0|1,0,1]=4 10202 B8R1.1 O=C[C@H]1CCC(=O)O1 Amb27964499 [0,1,0,1,0,0|0,0,1]=3 10203 B8R1.1 O=C[C@H]1CCC(=O)S1 Amb27792268 [0,1,0,1,0,0|0,1,1]=4 10204 B8R1.1 O=S1CCC(CO)C1 Amb27763052 [0,1,0,1,0,0|2,0,0]=4 10205 B8R1.1 O=S1COC(CCl)C1 Amb27257436 [0,1,0,1,0,0|2,0,0]=4 10206 B8R1.1 O=S1OCC(CBr)O1 Amb27873947 [0,1,0,1,0,0|2,0,0]=4 10207 B8R1.1 O=S1OCC(CCl)O1 Amb24624110 [0,1,0,1,0,0|2,0,0]=4 10208 B8R1.1 O=S1OCC(CF)O1 Amb21951909 [0,1,0,1,0,0|2,0,0]=4 10209 B8R1.1 O=S1OCC(CO)O1 Amb25802802 [0,1,0,1,0,0|2,0,0]=4 10210 B8R1.1 O=[PH]1OCC(CCl)O1 Amb27984375 [0,1,0,1,0,0|2,0,0]=4 10211 B8R1.1 OCC1CC(Br)=NO1 Amb23449512 [0,1,0,1,0,0|2,0,0]=4 10212 B8R1.1 OCC1CC(Cl)=NO1 Amb28381642 [0,1,0,1,0,0|2,0,0]=4 10213 B8R1.1 OCC1CCC(=S)N1 Amb28076783 [0,1,0,1,0,0|1,1,0]=4 10214 B8R1.1 OCC1CCC(O)C1 Amb22168730 [0,1,0,1,0,0|1,0,1]=4 10215 B8R1.1 OCC1CCC(O)O1 Amb22492783 [0,1,0,1,0,0|0,0,2]=4 10216 B8R1.1 OCC1CN=C(S)O1 Amb25092005 [0,1,0,1,0,0|1,1,0]=4 10217 B8R1.1 OCC1CNC(O)=N1 Amb24602100 [0,1,0,1,0,0|2,0,0]=4 10218 B8R1.1 OCC1CSC(=S)O1 Amb28190348 [0,1,0,1,0,0|1,1,0]=4 10219 B8R1.1 OC[C@@H]1CCC(=S)N1 Amb27205006 [0,1,0,1,0,0|1,1,0]=4 10220 B8R1.1 OC[C@@H]1CCC(O)O1 Amb27642087 [0,1,0,1,0,0|0,0,2]=4 10221 B8R1.1 OC[C@@H]1CC[C@@H](O)O1 Amb27220239 [0,1,0,1,0,0|0,0,2]=4 10222 B8R1.1 OC[C@@H]1CC[C@H](O)O1 Amb27664169 [0,1,0,1,0,0|0,0,2]=4 10223 B8R1.1 OC[C@H]1CC[C@H](O)C1 Amb24544575 [0,1,0,1,0,0|1,0,1]=4 10224 B8R1.1 O[C@@H]1CC[C@@H](CS)C1 Amb27448845 [0,1,0,1,0,0|1,0,1]=4 10225 B8R1.1 O[C@@H]1CC[C@H](CCl)O1 Amb27778464 [0,1,0,1,0,0|0,0,2]=4 10226 B8R1.1 O[C@H]1CC[C@H](CCl)O1 Amb27879445 [0,1,0,1,0,0|0,0,2]=4 10227 B8R1.1 S=C1CCC(CCl)N1 Amb27605868 [0,1,0,1,0,0|1,1,0]=4 10228 B8R1.1 S=C1OC(CCl)CS1 Amb27461326 [0,1,0,1,0,0|1,1,0]=4 10229 B8R1.1 [NH3+]C[C@@H]1CCC(=O)O1 Amb28464028 [0,1,0,1,0,0|0,0,0]=2 10230 B8R1.4 C=C1CCCC(=O)C1 Amb28132034 [0,1,0,1,0,0|1,0,1]=4 10231 B8R1.4 C=C1CCNC(C)C1 Amb29849450 [0,1,0,1,0,0|2,0,0]=4 10232 B8R1.4 C=C1CCOC(C)C1 Amb25235098 [0,1,0,1,0,0|2,0,0]=4 10233 B8R1.4 C=C1CNCC(C)C1 Amb35719512 [0,1,0,1,0,0|2,0,0]=4 10234 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,1,0,1,0,0|1,0,0]=3 10235 B8R1.4 CC1=CC(=O)CSC1 Amb28316129 [0,1,0,1,0,0|1,0,1]=4 10236 B8R1.4 CC1=CC(=O)NCC1 Amb27170325 [0,1,0,1,0,0|1,0,1]=4 10237 B8R1.4 CC1=CC(C)CCC1 Amb26410159 [0,1,0,1,0,0|2,0,0]=4 10238 B8R1.4 CC1=CC(C)CNC1 Amb25757457 [0,1,0,1,0,0|2,0,0]=4 10239 B8R1.4 CC1=CC(C)CNC1 Amb28934871 [0,1,0,1,0,0|2,0,0]=4 10240 B8R1.4 CC1=CC(C)OCC1 Amb17689157 [0,1,0,1,0,0|2,0,0]=4 10241 B8R1.4 CC1=CC(Cl)CCC1 Amb27860262 [0,1,0,1,0,0|2,0,0]=4 10242 B8R1.4 CC1=CC(O)CCC1 Amb10844732 [0,1,0,1,0,0|1,0,1]=4 10243 B8R1.4 CC1=CCCC(=O)C1 Amb27661853 [0,1,0,1,0,0|1,0,1]=4 10244 B8R1.4 CC1=CCCC(=O)N1 Amb27949580 [0,1,0,1,0,0|1,0,1]=4 10245 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,1,0,1,0,0|0,0,1]=3 10246 B8R1.4 CC1=CCNC(=O)O1 Amb23596886 [0,1,0,1,0,0|0,0,2]=4 10247 B8R1.4 CC1=C[C@@H](O)CCC1 Amb27466476 [0,1,0,1,0,0|1,0,1]=4 10248 B8R1.4 CC1=NC(=O)CCC1 Amb28239945 [0,1,0,1,0,0|1,0,0]=3 10249 B8R1.4 CC1=NC(C)CCC1 Amb27589065 [0,1,0,1,0,0|2,0,0]=4 10250 B8R1.4 CC1CC(=O)CCN1 Amb1087926 [0,1,0,1,0,0|1,0,0]=3 10251 B8R1.4 CC1CC(=O)CCN1 Amb19515809 [0,1,0,1,0,0|1,0,0]=3 10252 B8R1.4 CC1CC(=O)CCN1 Amb30585094 [0,1,0,1,0,0|1,0,0]=3 10253 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,1,0,1,0,0|1,0,0]=3 10254 B8R1.4 CC1CC(=O)CCS1 Amb27256424 [0,1,0,1,0,0|1,0,0]=3 10255 B8R1.4 CC1CC(Br)CCO1 Amb25367234 [0,1,0,1,0,0|1,0,1]=4 10256 B8R1.4 CC1CC(Cl)CCO1 Amb26046391 [0,1,0,1,0,0|1,0,1]=4 10257 B8R1.4 CC1CC(N)CCO1 Amb22059408 [0,1,0,1,0,0|1,0,1]=4 10258 B8R1.4 CC1CC(N)CCO1 Amb33715162 [0,1,0,1,0,0|1,0,1]=4 10259 B8R1.4 CC1CC(O)CCN1 Amb1051141 [0,1,0,1,0,0|1,0,1]=4 10260 B8R1.4 CC1CC(O)CCN1 Amb32661025 [0,1,0,1,0,0|1,0,1]=4 10261 B8R1.4 CC1CC(O)CCO1 Amb22757197 [0,1,0,1,0,0|1,0,1]=4 10262 B8R1.4 CC1CC(S)CCO1 Amb26515745 [0,1,0,1,0,0|1,0,1]=4 10263 B8R1.4 CC1CC=CC(=O)C1 Amb4034490 [0,1,0,1,0,0|1,0,1]=4 10264 B8R1.4 CC1CC=CC(=O)N1 Amb27788159 [0,1,0,1,0,0|1,0,1]=4 10265 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,1,0,1,0,0|0,0,1]=3 10266 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,1,0,1,0,0|1,0,0]=3 10267 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,1,0,1,0,0|1,0,0]=3 10268 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,1,0,1,0,0|0,0,0]=2 10269 B8R1.4 CC1CCCC(O)C1 Amb9702772 [0,1,0,1,0,0|1,0,1]=4 10270 B8R1.4 CC1CCCN(O)C1 Amb27631256 [0,1,0,1,0,0|2,0,0]=4 10271 B8R1.4 CC1CCN=C(N)S1 Amb22228568 [0,1,0,1,0,0|1,1,0]=4 10272 B8R1.4 CC1CCNC(=O)C1 Amb20668125 [0,1,0,1,0,0|1,0,0]=3 10273 B8R1.4 CC1CCNC(=O)N1 Amb27193730 [0,1,0,1,0,0|1,0,0]=3 10274 B8R1.4 CC1CCNC(=S)N1 Amb27838373 [0,1,0,1,0,0|1,1,0]=4 10275 B8R1.4 CC1CCNC(C)O1 Amb33193276 [0,1,0,1,0,0|1,0,1]=4 10276 B8R1.4 CC1CCNC(N)=N1 Amb25879219 [0,1,0,1,0,0|2,0,0]=4 10277 B8R1.4 CC1CCNC(N)=N1 Amb35747071 [0,1,0,1,0,0|2,0,0]=4 10278 B8R1.4 CC1CCOC(=O)N1 Amb27655650 [0,1,0,1,0,0|1,0,0]=3 10279 B8R1.4 CC1CCOC(=O)O1 Amb33714707 [0,1,0,1,0,0|0,0,0]=2 10280 B8R1.4 CC1CCOC(C)O1 Amb4017488 [0,1,0,1,0,0|1,0,1]=4 10281 B8R1.4 CC1CCOC(I)C1 Amb32419164 [0,1,0,1,0,0|1,0,1]=4 10282 B8R1.4 CC1CCOS(=O)O1 Amb4010773 [0,1,0,1,0,0|1,0,0]=3 10283 B8R1.4 CC1CNCC(=O)C1 Amb26048394 [0,1,0,1,0,0|1,0,0]=3 10284 B8R1.4 CC1CNCC(=O)C1 Amb33494302 [0,1,0,1,0,0|1,0,0]=3 10285 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,1,0,1,0,0|1,0,0]=3 10286 B8R1.4 CC1CNCC(=O)N1 Amb32410668 [0,1,0,1,0,0|1,0,0]=3 10287 B8R1.4 CC1CNCC(C)O1 Amb5716863 [0,1,0,1,0,0|1,0,1]=4 10288 B8R1.4 CC1CNCC(O)C1 Amb24507417 [0,1,0,1,0,0|1,0,1]=4 10289 B8R1.4 CC1CNCC(O)C1 Amb28934840 [0,1,0,1,0,0|1,0,1]=4 10290 B8R1.4 CC1CNNC(=O)C1 Amb27800916 [0,1,0,1,0,0|2,0,0]=4 10291 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,1,0,1,0,0|1,0,0]=3 10292 B8R1.4 CC1COCC(C)O1 Amb26515760 [0,1,0,1,0,0|1,0,1]=4 10293 B8R1.4 CC1CS(=O)CCN1 Amb18124392 [0,1,0,1,0,0|2,0,0]=4 10294 B8R1.4 CC1CSCC(C)O1 Amb4016354 [0,1,0,1,0,0|1,0,1]=4 10295 B8R1.4 CC1NCCC(=O)N1 Amb32418334 [0,1,0,1,0,0|1,0,0]=3 10296 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,1,0,1,0,0|1,0,0]=3 10297 B8R1.4 CN1CCCC(=O)C1 Amb22304741 [0,1,0,1,0,0|1,0,0]=3 10298 B8R1.4 CN1CCCC(=O)C1 Amb31204623 [0,1,0,1,0,0|1,0,0]=3 10299 B8R1.4 CN1CCCC(O)C1 Amb33623580 [0,1,0,1,0,0|1,0,1]=4 10300 B8R1.4 CN1CCCC(O)C1 Amb534752 [0,1,0,1,0,0|1,0,1]=4 10301 B8R1.4 CN1CCC[C@@H](O)C1 Amb22225150 [0,1,0,1,0,0|1,0,1]=4 10302 B8R1.4 CN1CCC[C@H](O)C1 Amb22225471 [0,1,0,1,0,0|1,0,1]=4 10303 B8R1.4 CN1CCNC(=O)C1 Amb19958159 [0,1,0,1,0,0|2,0,0]=4 10304 B8R1.4 CN1CCOC(=O)C1 Amb21963307 [0,1,0,1,0,0|1,0,0]=3 10305 B8R1.4 CN1CCOC(=O)C1 Amb22491652 [0,1,0,1,0,0|1,0,0]=3 10306 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb22748911 [0,1,0,1,0,0|1,0,0]=3 10307 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb23439312 [0,1,0,1,0,0|1,0,0]=3 10308 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb27593729 [0,1,0,1,0,0|1,0,0]=3 10309 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,1,0,1,0,0|1,0,0]=3 10310 B8R1.4 C[C@@H]1CC=CC(=O)C1 Amb27762503 [0,1,0,1,0,0|1,0,1]=4 10311 B8R1.4 C[C@@H]1CCCC(=O)C1 Amb21618704 [0,1,0,1,0,0|1,0,0]=3 10312 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,1,0,1,0,0|1,0,0]=3 10313 B8R1.4 C[C@@H]1CCCC(=O)O1 Amb4166295 [0,1,0,1,0,0|0,0,0]=2 10314 B8R1.4 C[C@@H]1CCC[C@@H](O)C1 Amb24383351 [0,1,0,1,0,0|1,0,1]=4 10315 B8R1.4 C[C@@H]1CCC[C@H](O)C1 Amb24713971 [0,1,0,1,0,0|1,0,1]=4 10316 B8R1.4 C[C@@H]1CCO[C@@H](O)C1 Amb27854200 [0,1,0,1,0,0|0,0,2]=4 10317 B8R1.4 C[C@@H]1CCO[C@H](O)C1 Amb27484825 [0,1,0,1,0,0|0,0,2]=4 10318 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,1,0,1,0,0|1,0,0]=3 10319 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,1,0,1,0,0|1,0,0]=3 10320 B8R1.4 C[C@@H]1CNC[C@@H](C)O1 Amb22745550 [0,1,0,1,0,0|1,0,1]=4 10321 B8R1.4 C[C@@H]1CNC[C@H](O)C1 Amb27212277 [0,1,0,1,0,0|1,0,1]=4 10322 B8R1.4 C[C@@H]1CNC[C@H](O)C1 Amb28644756 [0,1,0,1,0,0|1,0,1]=4 10323 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,1,0,1,0,0|1,0,0]=3 10324 B8R1.4 C[C@@H]1C[C@@H](Br)CCO1 Amb25281129 [0,1,0,1,0,0|1,0,1]=4 10325 B8R1.4 C[C@@H]1C[C@H](N)CCO1 Amb24575458 [0,1,0,1,0,0|1,0,1]=4 10326 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb22406182 [0,1,0,1,0,0|1,0,1]=4 10327 B8R1.4 C[C@@H]1C[C@H](O)CCN1 Amb23440188 [0,1,0,1,0,0|1,0,1]=4 10328 B8R1.4 C[C@H]1CC(=O)CCN1 Amb22406027 [0,1,0,1,0,0|1,0,0]=3 10329 B8R1.4 C[C@H]1CC(=O)CCN1 Amb28072876 [0,1,0,1,0,0|1,0,0]=3 10330 B8R1.4 C[C@H]1CC(=O)CCN1 Amb33801725 [0,1,0,1,0,0|1,0,0]=3 10331 B8R1.4 C[C@H]1CC(=O)CCO1 Amb27969730 [0,1,0,1,0,0|1,0,0]=3 10332 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,1,0,1,0,0|0,0,1]=3 10333 B8R1.4 C[C@H]1CCCC(=O)C1 Amb22799724 [0,1,0,1,0,0|1,0,0]=3 10334 B8R1.4 C[C@H]1CCCC(=O)O1 Amb26865751 [0,1,0,1,0,0|0,0,0]=2 10335 B8R1.4 C[C@H]1CCCC(O)C1 Amb27410880 [0,1,0,1,0,0|1,0,1]=4 10336 B8R1.4 C[C@H]1CCCC(O)O1 Amb28206458 [0,1,0,1,0,0|0,0,2]=4 10337 B8R1.4 C[C@H]1CCC[C@@H](O)C1 Amb22800307 [0,1,0,1,0,0|1,0,1]=4 10338 B8R1.4 C[C@H]1CCC[C@H](O)C1 Amb26633070 [0,1,0,1,0,0|1,0,1]=4 10339 B8R1.4 C[C@H]1CCNC(=O)C1 Amb25739591 [0,1,0,1,0,0|1,0,0]=3 10340 B8R1.4 C[C@H]1CCO[C@@H](O)C1 Amb28197437 [0,1,0,1,0,0|0,0,2]=4 10341 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,1,0,1,0,0|1,0,0]=3 10342 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,1,0,1,0,0|1,0,0]=3 10343 B8R1.4 C[C@H]1CNC[C@@H](C)O1 Amb33719087 [0,1,0,1,0,0|1,0,1]=4 10344 B8R1.4 C[C@H]1CNC[C@@H](C)O1 Amb3939625 [0,1,0,1,0,0|1,0,1]=4 10345 B8R1.4 C[C@H]1CNC[C@@H](O)C1 Amb28057034 [0,1,0,1,0,0|1,0,1]=4 10346 B8R1.4 C[C@H]1CNC[C@H](C)O1 Amb22406103 [0,1,0,1,0,0|1,0,1]=4 10347 B8R1.4 C[C@H]1CNC[C@H](O)C1 Amb27630532 [0,1,0,1,0,0|1,0,1]=4 10348 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,1,0,1,0,0|1,0,0]=3 10349 B8R1.4 C[C@H]1CS(=O)CCN1 Amb27866032 [0,1,0,1,0,0|2,0,0]=4 10350 B8R1.4 C[C@H]1C[C@@H](O)CCN1 Amb22406181 [0,1,0,1,0,0|1,0,1]=4 10351 B8R1.4 C[C@H]1C[C@@H](O)CCN1 Amb26916893 [0,1,0,1,0,0|1,0,1]=4 10352 B8R1.4 C[C@H]1C[C@@H](O)CCO1 Amb26549571 [0,1,0,1,0,0|1,0,1]=4 10353 B8R1.4 C[C@H]1C[C@H](O)CCO1 Amb26891979 [0,1,0,1,0,0|1,0,1]=4 10354 B8R1.4 NC1=CC(=O)CCC1 Amb1151335 [0,1,0,1,0,0|1,0,1]=4 10355 B8R1.4 NC1=CC(O)CCC1 Amb28127332 [0,1,0,1,0,0|2,0,0]=4 10356 B8R1.4 NC1CCCC(=O)C1 Amb23440459 [0,1,0,1,0,0|1,0,0]=3 10357 B8R1.4 NC1CCCC(=O)C1 Amb8387391 [0,1,0,1,0,0|1,0,0]=3 10358 B8R1.4 NC1CCCC(O)C1 Amb22491291 [0,1,0,1,0,0|1,0,1]=4 10359 B8R1.4 NC1CCCC(O)C1 Amb9717357 [0,1,0,1,0,0|1,0,1]=4 10360 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,1,0,1,0,0|1,0,0]=3 10361 B8R1.4 NC1CCNC(=O)C1 Amb19957631 [0,1,0,1,0,0|1,0,0]=3 10362 B8R1.4 NC1CCNC(=O)C1 Amb21960626 [0,1,0,1,0,0|1,0,0]=3 10363 B8R1.4 NC1COCC(=O)C1 Amb33623050 [0,1,0,1,0,0|2,0,0]=4 10364 B8R1.4 NC1COCC(=O)C1 Amb33716160 [0,1,0,1,0,0|2,0,0]=4 10365 B8R1.4 N[C@@H]1CCCS(=O)C1 Amb25168909 [0,1,0,1,0,0|2,0,0]=4 10366 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 Amb24074365 [0,1,0,1,0,0|1,0,1]=4 10367 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 Amb24671187 [0,1,0,1,0,0|1,0,1]=4 10368 B8R1.4 N[C@@H]1CCC[C@H](O)C1 Amb33870222 [0,1,0,1,0,0|1,0,1]=4 10369 B8R1.4 N[C@@H]1CCNC(=O)C1 Amb27489147 [0,1,0,1,0,0|1,0,0]=3 10370 B8R1.4 N[C@H]1CCCS(=O)C1 Amb27838286 [0,1,0,1,0,0|2,0,0]=4 10371 B8R1.4 N[C@H]1CCC[C@@H](O)C1 Amb22746547 [0,1,0,1,0,0|1,0,1]=4 10372 B8R1.4 N[C@H]1CCC[C@@H](O)C1 Amb22752827 [0,1,0,1,0,0|1,0,1]=4 10373 B8R1.4 N[C@H]1CCC[C@H](O)C1 Amb22828171 [0,1,0,1,0,0|1,0,1]=4 10374 B8R1.4 N[C@H]1CCC[C@H](O)C1 Amb22886176 [0,1,0,1,0,0|1,0,1]=4 10375 B8R1.4 N[C@H]1CCNC(=O)C1 Amb25168718 [0,1,0,1,0,0|1,0,0]=3 10376 B8R1.4 O=C1C=C(Br)CCC1 Amb33542768 [0,1,0,1,0,0|1,0,1]=4 10377 B8R1.4 O=C1C=C(Cl)CCC1 Amb2697044 [0,1,0,1,0,0|1,0,1]=4 10378 B8R1.4 O=C1C=C(I)CCC1 Amb25706767 [0,1,0,1,0,0|1,0,1]=4 10379 B8R1.4 O=C1C=C(O)CCC1 Amb17844413 [0,1,0,1,0,0|1,0,1]=4 10380 B8R1.4 O=C1C=CCC(O)C1 Amb27227199 [0,1,0,1,0,0|1,0,1]=4 10381 B8R1.4 O=C1C=[N+]([O-])CCC1 Amb27751417 [0,1,0,1,0,0|2,0,0]=4 10382 B8R1.4 O=C1CC(F)CCN1 Amb27459538 [0,1,0,1,0,0|1,0,0]=3 10383 B8R1.4 O=C1CC(O)CCN1 Amb10602744 [0,1,0,1,0,0|1,0,0]=3 10384 B8R1.4 O=C1CC(S)NCN1 Amb28245543 [0,1,0,1,0,0|2,0,0]=4 10385 B8R1.4 O=C1CCCC(=O)C1 Amb932798 [0,1,0,1,0,0|1,0,1]=4 10386 B8R1.4 O=C1CCCC(=O)N1 Amb8386485 [0,1,0,1,0,0|1,0,1]=4 10387 B8R1.4 O=C1CCCC(=O)O1 Amb6608952 [0,1,0,1,0,0|0,0,1]=3 10388 B8R1.4 O=C1CCCC(=O)S1 Amb27849467 [0,1,0,1,0,0|0,1,1]=4 10389 B8R1.4 O=C1CCCC(Br)C1 Amb27850962 [0,1,0,1,0,0|1,0,0]=3 10390 B8R1.4 O=C1CCCC(Cl)C1 Amb26946112 [0,1,0,1,0,0|1,0,0]=3 10391 B8R1.4 O=C1CCCC(Cl)N1 Amb28423467 [0,1,0,1,0,0|1,0,0]=3 10392 B8R1.4 O=C1CCCC(F)C1 Amb24578309 [0,1,0,1,0,0|1,0,0]=3 10393 B8R1.4 O=C1CCCC(I)C1 Amb24436778 [0,1,0,1,0,0|1,0,0]=3 10394 B8R1.4 O=C1CCCC(O)C1 Amb22754759 [0,1,0,1,0,0|1,0,0]=3 10395 B8R1.4 O=C1CCCC(O)N1 Amb26394230 [0,1,0,1,0,0|1,0,0]=3 10396 B8R1.4 O=C1CCC[C@@H](O)C1 Amb25320136 [0,1,0,1,0,0|1,0,0]=3 10397 B8R1.4 O=C1CCC[C@H](O)C1 Amb27432456 [0,1,0,1,0,0|1,0,0]=3 10398 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,1,0,1,0,0|1,0,1]=4 10399 B8R1.4 O=C1CCNC(=O)O1 Amb22011553 [0,1,0,1,0,0|1,0,1]=4 10400 B8R1.4 O=C1CCOC(=O)C1 Amb26459895 [0,1,0,1,0,0|0,0,1]=3 10401 B8R1.4 O=C1COCC(=O)O1 Amb1214326 [0,1,0,1,0,0|1,0,1]=4 10402 B8R1.4 O=C1CS(=O)CCN1 Amb27184590 [0,1,0,1,0,0|2,0,0]=4 10403 B8R1.4 O=C1CSCC(=O)O1 Amb2725405 [0,1,0,1,0,0|1,0,1]=4 10404 B8R1.4 O=C1C[C@@H](O)CCN1 Amb22744924 [0,1,0,1,0,0|1,0,0]=3 10405 B8R1.4 O=C1C[C@H](O)CCN1 Amb17845212 [0,1,0,1,0,0|1,0,0]=3 10406 B8R1.4 O=S1CCCC(Br)C1 Amb26370333 [0,1,0,1,0,0|2,0,0]=4 10407 B8R1.4 O=S1CCCC(Cl)C1 Amb27876412 [0,1,0,1,0,0|2,0,0]=4 10408 B8R1.4 O=S1CCCC(O)C1 Amb26354128 [0,1,0,1,0,0|2,0,0]=4 10409 B8R1.4 O=S1CCC[C@H](O)C1 Amb28206445 [0,1,0,1,0,0|2,0,0]=4 10410 B8R1.4 OC1C=C(Cl)CCC1 Amb28138656 [0,1,0,1,0,0|2,0,0]=4 10411 B8R1.4 OC1CCCC(O)C1 Amb4035048 [0,1,0,1,0,0|1,0,1]=4 10412 B8R1.4 OC1CCNC(O)C1 Amb27265958 [0,1,0,1,0,0|1,0,1]=4 10413 B8R1.4 OC1C[C@H](O)CCO1 Amb27261550 [0,1,0,1,0,0|0,0,2]=4 10414 B8R1.4 O[C@@H]1CCC[C@@H](O)C1 Amb27950165 [0,1,0,1,0,0|1,0,1]=4 10415 B8R1.4 O[C@@H]1CCC[C@H](O)O1 Amb27166854 [0,1,0,1,0,0|0,0,2]=4 10416 B8R1.4 O[C@H]1C=C(Br)CCC1 Amb27980419 [0,1,0,1,0,0|2,0,0]=4 10417 B8R1.4 O[C@H]1CCC[C@@H](O)C1 Amb22801622 [0,1,0,1,0,0|1,0,1]=4 10418 B8R1.4 O[C@H]1CCC[C@H](O)C1 Amb22801014 [0,1,0,1,0,0|1,0,1]=4 10419 B8R1.18 C=C1CC(C)NC1=O Amb27201887 [0,1,0,1,0,0|1,0,1]=4 10420 B8R1.18 C=C1CC(C)OC1=O Amb8389608 [0,1,0,1,0,0|0,0,1]=3 10421 B8R1.18 CC1=CC(=O)C(Br)C1 Amb28284387 [0,1,0,1,0,0|1,0,1]=4 10422 B8R1.18 CC1=CC(=O)C(C)C1 Amb24647798 [0,1,0,1,0,0|1,0,1]=4 10423 B8R1.18 CC1=CC(=O)C(Cl)C1 Amb27750318 [0,1,0,1,0,0|1,0,1]=4 10424 B8R1.18 CC1=CC(=O)CC1C Amb16191977 [0,1,0,1,0,0|1,0,1]=4 10425 B8R1.18 CC1=CC(=O)C[C@@H]1C Amb28316193 [0,1,0,1,0,0|1,0,1]=4 10426 B8R1.18 CC1=CC(=O)C[C@H]1C Amb28316192 [0,1,0,1,0,0|1,0,1]=4 10427 B8R1.18 CC1=CC(Cl)C(=O)O1 Amb24349720 [0,1,0,1,0,0|0,0,2]=4 10428 B8R1.18 CC1=NC(C)OC1=O Amb27429121 [0,1,0,1,0,0|1,0,1]=4 10429 B8R1.18 CC1C=C(O)C(=O)O1 Amb24332982 [0,1,0,1,0,0|0,0,2]=4 10430 B8R1.18 CC1CC(=N)NC1C Amb27655587 [0,1,0,1,0,0|2,0,0]=4 10431 B8R1.18 CC1CC(=O)C(=O)C1 Amb27256511 [0,1,0,1,0,0|1,0,1]=4 10432 B8R1.18 CC1CC(=O)C(C)C1 Amb26510571 [0,1,0,1,0,0|1,0,0]=3 10433 B8R1.18 CC1CC(=O)C(C)O1 Amb26869093 [0,1,0,1,0,0|2,0,0]=4 10434 B8R1.18 CC1CC(=O)CC1C Amb25933629 [0,1,0,1,0,0|1,0,0]=3 10435 B8R1.18 CC1CC(=O)CN1C Amb20669273 [0,1,0,1,0,0|2,0,0]=4 10436 B8R1.18 CC1CC(=O)N(C)C1 Amb10068268 [0,1,0,1,0,0|2,0,0]=4 10437 B8R1.18 CC1CC(=O)NC1C Amb20623595 [0,1,0,1,0,0|1,0,0]=3 10438 B8R1.18 CC1CC(=O)NC1O Amb27975748 [0,1,0,1,0,0|2,0,0]=4 10439 B8R1.18 CC1CC(=O)OC1=O Amb3940407 [0,1,0,1,0,0|1,0,1]=4 10440 B8R1.18 CC1CC(=O)OC1C Amb27873473 [0,1,0,1,0,0|0,0,0]=2 10441 B8R1.18 CC1CC(=O)OC1O Amb26536810 [0,1,0,1,0,0|1,0,0]=3 10442 B8R1.18 CC1CC(Br)C(=O)O1 Amb6608903 [0,1,0,1,0,0|0,0,0]=2 10443 B8R1.18 CC1CC(Br)C(C)O1 Amb27476404 [0,1,0,1,0,0|1,0,1]=4 10444 B8R1.18 CC1CC(C)C(=O)N1 Amb24698782 [0,1,0,1,0,0|1,0,0]=3 10445 B8R1.18 CC1CC(C)C(=O)O1 Amb4017434 [0,1,0,1,0,0|0,0,0]=2 10446 B8R1.18 CC1CC(N)C(=O)O1 Amb32653104 [0,1,0,1,0,0|0,0,0]=2 10447 B8R1.18 CC1CC(N)C(=O)O1 Amb448594 [0,1,0,1,0,0|0,0,0]=2 10448 B8R1.18 CC1CC(N)C(C)O1 Amb24619349 [0,1,0,1,0,0|1,0,1]=4 10449 B8R1.18 CC1CC(N)C(C)O1 Amb30585143 [0,1,0,1,0,0|1,0,1]=4 10450 B8R1.18 CC1CC(O)C(=O)N1 Amb27784846 [0,1,0,1,0,0|1,0,0]=3 10451 B8R1.18 CC1CC(O)C(=O)O1 Amb27451083 [0,1,0,1,0,0|0,0,0]=2 10452 B8R1.18 CC1CC(O)CC1C Amb28350247 [0,1,0,1,0,0|1,0,1]=4 10453 B8R1.18 CC1CC(O)CC1N Amb25169593 [0,1,0,1,0,0|1,0,1]=4 10454 B8R1.18 CC1CC(O)C[C@H]1C Amb27485056 [0,1,0,1,0,0|1,0,1]=4 10455 B8R1.18 CC1CC(S)C(C)O1 Amb22234723 [0,1,0,1,0,0|1,0,1]=4 10456 B8R1.18 CC1CN(C)C(O)=N1 Amb26370503 [0,1,0,1,0,0|2,0,0]=4 10457 B8R1.18 CC1CN(C)CC1=O Amb20622328 [0,1,0,1,0,0|2,0,0]=4 10458 B8R1.18 CC1C[C@@H](C)CC1=O Amb27424916 [0,1,0,1,0,0|1,0,0]=3 10459 B8R1.18 CC1C[C@H](N)C(=O)O1 Amb27844768 [0,1,0,1,0,0|0,0,0]=2 10460 B8R1.18 CC1C[C@H](O)[C@H](C)O1 Amb27855467 [0,1,0,1,0,0|1,0,1]=4 10461 B8R1.18 CC1N=C(O)NC1C Amb27594689 [0,1,0,1,0,0|2,0,0]=4 10462 B8R1.18 CC1NC(=O)C(C)N1 Amb24481399 [0,1,0,1,0,0|2,0,0]=4 10463 B8R1.18 CC1NC(=O)C(C)S1 Amb27784375 [0,1,0,1,0,0|2,0,0]=4 10464 B8R1.18 CC1NC(=O)CC1=O Amb23598276 [0,1,0,1,0,0|1,0,1]=4 10465 B8R1.18 CC1NC(=O)CC1O Amb27792924 [0,1,0,1,0,0|1,0,0]=3 10466 B8R1.18 CC1NC(=O)OC1C Amb25747248 [0,1,0,1,0,0|1,0,0]=3 10467 B8R1.18 CC1NC(=O)[C@H](C)N1 Amb28284134 [0,1,0,1,0,0|2,0,0]=4 10468 B8R1.18 CC1NC(=S)OC1C Amb28123435 [0,1,0,1,0,0|1,1,0]=4 10469 B8R1.18 CC1OC(=O)C=C1N Amb27838294 [0,1,0,1,0,0|0,0,2]=4 10470 B8R1.18 CC1OC(=O)CC1=O Amb28290899 [0,1,0,1,0,0|0,0,1]=3 10471 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,1,0,1,0,0|1,0,1]=4 10472 B8R1.18 CC1OC(=O)OC1=O Amb28315579 [0,1,0,1,0,0|1,0,1]=4 10473 B8R1.18 CC1OC(=O)OC1C Amb27485944 [0,1,0,1,0,0|1,0,0]=3 10474 B8R1.18 CC1OS(=O)OC1C Amb25997586 [0,1,0,1,0,0|2,0,0]=4 10475 B8R1.18 CN1CC(N)C(=O)N1 Amb25872890 [0,1,0,1,0,0|2,0,0]=4 10476 B8R1.18 C[C@@H]1CC(=O)C[C@H]1C Amb24470272 [0,1,0,1,0,0|1,0,0]=3 10477 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,1,0,1,0,0|1,0,1]=4 10478 B8R1.18 C[C@@H]1C[C@@H](C)C(O)O1 Amb27430981 [0,1,0,1,0,0|0,0,2]=4 10479 B8R1.18 C[C@@H]1C[C@@H](Cl)C(=O)O1 Amb25288126 [0,1,0,1,0,0|0,0,0]=2 10480 B8R1.18 C[C@@H]1C[C@@H](O)C(=S)N1 Amb28133564 [0,1,0,1,0,0|1,1,0]=4 10481 B8R1.18 C[C@@H]1NC(=O)CC1=O Amb18833079 [0,1,0,1,0,0|1,0,1]=4 10482 B8R1.18 C[C@@H]1NC(=O)O[C@@H]1C Amb28132650 [0,1,0,1,0,0|1,0,0]=3 10483 B8R1.18 C[C@@H]1NC(=O)S[C@H]1C Amb27420158 [0,1,0,1,0,0|1,1,0]=4 10484 B8R1.18 C[C@@H]1OC(=O)C[C@H]1Cl Amb27252234 [0,1,0,1,0,0|0,0,0]=2 10485 B8R1.18 C[C@@H]1OC(O)C[C@H]1C Amb27432218 [0,1,0,1,0,0|0,0,2]=4 10486 B8R1.18 C[C@@H]1O[C@H](O)C[C@H]1C Amb27215270 [0,1,0,1,0,0|0,0,2]=4 10487 B8R1.18 C[C@@H]1S[C@H](C)NC1=O Amb27857156 [0,1,0,1,0,0|2,0,0]=4 10488 B8R1.18 C[C@H]1C=C(Br)C(=O)O1 Amb27244767 [0,1,0,1,0,0|0,0,2]=4 10489 B8R1.18 C[C@H]1CC(=O)C[C@H]1C Amb22230244 [0,1,0,1,0,0|1,0,0]=3 10490 B8R1.18 C[C@H]1CC(=O)OC1=O Amb2609932 [0,1,0,1,0,0|1,0,1]=4 10491 B8R1.18 C[C@H]1CC(=O)O[C@H]1C Amb27471867 [0,1,0,1,0,0|0,0,0]=2 10492 B8R1.18 C[C@H]1CC(=O)[C@H](C)C1 Amb28429622 [0,1,0,1,0,0|1,0,0]=3 10493 B8R1.18 C[C@H]1CC(=O)[C@H](C)O1 Amb28246509 [0,1,0,1,0,0|2,0,0]=4 10494 B8R1.18 C[C@H]1CC(O)O[C@H]1C Amb28321291 [0,1,0,1,0,0|0,0,2]=4 10495 B8R1.18 C[C@H]1C[C@@H](C)C(=O)O1 Amb28060142 [0,1,0,1,0,0|0,0,0]=2 10496 B8R1.18 C[C@H]1C[C@@H](C)NC1=O Amb27619178 [0,1,0,1,0,0|1,0,0]=3 10497 B8R1.18 C[C@H]1C[C@@H](O)C[C@H]1C Amb27659843 [0,1,0,1,0,0|1,0,1]=4 10498 B8R1.18 C[C@H]1C[C@H](O)C(=O)O1 Amb27852763 [0,1,0,1,0,0|0,0,0]=2 10499 B8R1.18 C[C@H]1C[C@H](O)C[C@H]1C Amb27946955 [0,1,0,1,0,0|1,0,1]=4 10500 B8R1.18 C[C@H]1NC(=N)O[C@@H]1C Amb27420136 [0,1,0,1,0,0|2,0,0]=4 10501 B8R1.18 C[C@H]1NC(=O)C[C@@H]1O Amb28128239 [0,1,0,1,0,0|1,0,0]=3 10502 B8R1.18 C[C@H]1NC(=O)C[C@@H]1S Amb28388503 [0,1,0,1,0,0|1,0,0]=3 10503 B8R1.18 C[C@H]1NC(=O)C[C@H]1O Amb28131156 [0,1,0,1,0,0|1,0,0]=3 10504 B8R1.18 C[C@H]1NC(=O)C[C@H]1S Amb27621424 [0,1,0,1,0,0|1,0,0]=3 10505 B8R1.18 C[C@H]1OC(=O)C[C@@H]1N Amb27973900 [0,1,0,1,0,0|0,0,0]=2 10506 B8R1.18 C[C@H]1OC(=O)C[C@H]1O Amb27775518 [0,1,0,1,0,0|0,0,0]=2 10507 B8R1.18 NC1CC(=O)CC1N Amb27486601 [0,1,0,1,0,0|2,0,0]=4 10508 B8R1.18 NC1CC(=O)OC1=O Amb27216215 [0,1,0,1,0,0|1,0,1]=4 10509 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb25992097 [0,1,0,1,0,0|1,0,1]=4 10510 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb8631355 [0,1,0,1,0,0|1,0,1]=4 10511 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,1,0,1,0,0|1,0,1]=4 10512 B8R1.18 N[C@H]1CC(=O)O[C@H]1O Amb28196677 [0,1,0,1,0,0|1,0,0]=3 10513 B8R1.18 O=C1CC(Cl)C(=O)O1 Amb24677749 [0,1,0,1,0,0|1,0,1]=4 10514 B8R1.18 O=C1CC(O)C(=O)O1 Amb27399619 [0,1,0,1,0,0|1,0,1]=4 10515 B8R1.18 O=C1C[C@@H](F)C(=O)O1 Amb28286140 [0,1,0,1,0,0|1,0,1]=4 10516 B8R1.18 O=C1C[C@@H](O)[C@H](O)C1 Amb27841798 [0,1,0,1,0,0|2,0,0]=4 10517 B8R1.18 O=C1C[C@H](F)C(=O)O1 Amb27406936 [0,1,0,1,0,0|1,0,1]=4 10518 B8R1.18 O=C1OC(Cl)C(Cl)O1 Amb20670724 [0,1,0,1,0,0|2,0,0]=4 10519 B8R1.18 O=C1OC(O)CC1O Amb27761542 [0,1,0,1,0,0|1,0,0]=3 10520 B8R1.18 O=C1O[C@@H](Cl)[C@H](Cl)O1 Amb25061412 [0,1,0,1,0,0|2,0,0]=4 10521 B8R1.20 C=C1CC1CC(=O)O Amb25870954 [0,1,0,1,0,0|0,0,1]=3 10522 B8R1.20 C=C1CC1CC(C)=O Amb28326031 [0,1,0,1,0,0|1,0,1]=4 10523 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,1,0,1,0,0|1,0,1]=4 10524 B8R1.20 CC(=O)CC1CC1C Amb26916692 [0,1,0,1,0,0|1,0,0]=3 10525 B8R1.20 CC(=O)CC1OC1C Amb27767850 [0,1,0,1,0,0|1,0,0]=3 10526 B8R1.20 CC(=O)C[C@H]1C[C@H]1C Amb28121459 [0,1,0,1,0,0|1,0,0]=3 10527 B8R1.20 CC(=O)NC1CC1N Amb32663550 [0,1,0,1,0,0|2,0,0]=4 10528 B8R1.20 CC(=O)NC1CC1N Amb9457357 [0,1,0,1,0,0|2,0,0]=4 10529 B8R1.20 CC(=O)N[C@@H]1C[C@H]1N Amb32664511 [0,1,0,1,0,0|2,0,0]=4 10530 B8R1.20 CC(=O)N[C@@H]1C[C@H]1N Amb32664512 [0,1,0,1,0,0|2,0,0]=4 10531 B8R1.20 CC(C)CC1CC1O Amb27625280 [0,1,0,1,0,0|1,0,1]=4 10532 B8R1.20 CC(O)CC1CC1C Amb28284530 [0,1,0,1,0,0|1,0,1]=4 10533 B8R1.20 CC(O)CC1OC1C Amb27763687 [0,1,0,1,0,0|1,0,1]=4 10534 B8R1.20 CC(O)C[C@@H]1C[C@H]1C Amb27456742 [0,1,0,1,0,0|1,0,1]=4 10535 B8R1.20 CC(O)C[C@@H]1O[C@@H]1C Amb27852494 [0,1,0,1,0,0|1,0,1]=4 10536 B8R1.20 CC(O)C[C@@H]1O[C@H]1C Amb28197530 [0,1,0,1,0,0|1,0,1]=4 10537 B8R1.20 CC(O)C[C@H]1O[C@H]1C Amb27220288 [0,1,0,1,0,0|1,0,1]=4 10538 B8R1.20 CC1CC1CC(=N)N Amb33144831 [0,1,0,1,0,0|2,0,0]=4 10539 B8R1.20 CC1CC1CC(=O)O Amb25316515 [0,1,0,1,0,0|0,0,0]=2 10540 B8R1.20 CC1CC1CC(N)=S Amb33144881 [0,1,0,1,0,0|1,1,0]=4 10541 B8R1.20 CC1CC1CN(C)O Amb33145039 [0,1,0,1,0,0|2,0,0]=4 10542 B8R1.20 CC1CC1C[C@@H](C)O Amb33144240 [0,1,0,1,0,0|1,0,1]=4 10543 B8R1.20 CC1CC1C[C@H](C)O Amb33144242 [0,1,0,1,0,0|1,0,1]=4 10544 B8R1.20 CC1CC1C[N+](=O)[O-] Amb33144229 [0,1,0,1,0,0|1,0,1]=4 10545 B8R1.20 CC1CC1NC(=O)Cl Amb35625773 [0,1,0,1,0,0|1,0,0]=3 10546 B8R1.20 CC1CC1NC(N)=S Amb25361754 [0,1,0,1,0,0|1,1,0]=4 10547 B8R1.20 CC1C\C1=C/C(=O)O Amb25256441 [0,1,0,1,0,0|0,0,1]=3 10548 B8R1.20 C[C@@H]1C[C@H]1CB(O)O Amb27448502 [0,1,0,1,0,0|1,0,1]=4 10549 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [0,1,0,1,0,0|0,0,0]=2 10550 B8R1.20 C[C@@H]1C[C@H]1NC(N)=O Amb28059830 [0,1,0,1,0,0|1,0,0]=3 10551 B8R1.20 NC1CC1CC(=O)O Amb27201670 [0,1,0,1,0,0|0,0,0]=2 10552 B8R1.20 N[C@@H]1C[C@H]1CC(=O)O Amb27252154 [0,1,0,1,0,0|0,0,0]=2 10553 B8R1.20 O=C(O)CC1CC1O Amb27981662 [0,1,0,1,0,0|0,0,0]=2 10554 B8R1.31 C=C(C)C1CCC1O Amb25993078 [0,1,0,1,0,0|2,0,0]=4 10555 B8R1.31 C=C1CCC1C(=O)O Amb28281144 [0,1,0,1,0,0|0,0,1]=3 10556 B8R1.31 CC(=O)C1=C(C)CC1 Amb28316170 [0,1,0,1,0,0|1,0,1]=4 10557 B8R1.31 CC(=O)C1CCC1=O Amb26910118 [0,1,0,1,0,0|1,0,1]=4 10558 B8R1.31 CC(=O)C1CCC1O Amb33213172 [0,1,0,1,0,0|1,0,0]=3 10559 B8R1.31 CC(=O)N1CCC1C Amb27603227 [0,1,0,1,0,0|1,0,0]=3 10560 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C Amb26866992 [0,1,0,1,0,0|1,0,0]=3 10561 B8R1.31 CC(=O)[C@H]1CC[C@H]1C Amb26361346 [0,1,0,1,0,0|1,0,0]=3 10562 B8R1.31 CC(O)C1CCC1F Amb34153521 [0,1,0,1,0,0|1,0,1]=4 10563 B8R1.31 CC1CCC1C(=N)N Amb35745182 [0,1,0,1,0,0|2,0,0]=4 10564 B8R1.31 CC1CCC1C(=O)O Amb21857447 [0,1,0,1,0,0|0,0,0]=2 10565 B8R1.31 CC1NCC1C(=O)O Amb26984410 [0,1,0,1,0,0|0,0,0]=2 10566 B8R1.31 CN1CCC1C(=O)O Amb22011586 [0,1,0,1,0,0|0,0,0]=2 10567 B8R1.31 CN1CC[C@@H]1C(=O)O Amb24183372 [0,1,0,1,0,0|0,0,0]=2 10568 B8R1.31 CN1CC[C@H]1C(=O)O Amb24699921 [0,1,0,1,0,0|0,0,0]=2 10569 B8R1.31 C[C@@H]1CC[C@@H]1C(=O)O Amb28203929 [0,1,0,1,0,0|0,0,0]=2 10570 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb24597629 [0,1,0,1,0,0|0,0,0]=2 10571 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb33620541 [0,1,0,1,0,0|0,0,0]=2 10572 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O Amb34913092 [0,1,0,1,0,0|0,0,0]=2 10573 B8R1.31 C[C@H]1CC[C@H]1C(N)=O Amb27237000 [0,1,0,1,0,0|1,0,0]=3 10574 B8R1.31 NC(=O)C1CCC1F Amb32943793 [0,1,0,1,0,0|1,0,0]=3 10575 B8R1.31 NC(=O)C1CCC1N Amb20248288 [0,1,0,1,0,0|1,0,0]=3 10576 B8R1.31 NC(=O)[C@@H]1CC[C@H]1N Amb27225132 [0,1,0,1,0,0|1,0,0]=3 10577 B8R1.31 NC1CCC1C(=O)O Amb26979562 [0,1,0,1,0,0|0,0,0]=2 10578 B8R1.31 NC1COC1C(=O)O Amb28428430 [0,1,0,1,0,0|1,0,0]=3 10579 B8R1.31 NN1CC[C@H]1C(=O)O Amb27261518 [0,1,0,1,0,0|1,0,0]=3 10580 B8R1.31 NS(=O)[C@@H]1CC[C@@H]1F Amb32720839 [0,1,0,1,0,0|2,0,0]=4 10581 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24117048 [0,1,0,1,0,0|0,0,0]=2 10582 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24183584 [0,1,0,1,0,0|0,0,0]=2 10583 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb25976891 [0,1,0,1,0,0|0,0,0]=2 10584 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb31291972 [0,1,0,1,0,0|0,0,0]=2 10585 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Amb24681491 [0,1,0,1,0,0|1,0,0]=3 10586 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb27187220 [0,1,0,1,0,0|0,0,0]=2 10587 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb33805288 [0,1,0,1,0,0|0,0,0]=2 10588 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb25911896 [0,1,0,1,0,0|0,0,0]=2 10589 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb33801366 [0,1,0,1,0,0|0,0,0]=2 10590 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Amb25324265 [0,1,0,1,0,0|1,0,0]=3 10591 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Amb25929776 [0,1,0,1,0,0|1,0,0]=3 10592 B8R1.31 O=C(O)C1=C(Br)CC1 Amb28454412 [0,1,0,1,0,0|0,0,2]=4 10593 B8R1.31 O=C(O)C1=C(Cl)CC1 Amb33609521 [0,1,0,1,0,0|0,0,2]=4 10594 B8R1.31 O=C(O)C1C=CC1Br Amb27220099 [0,1,0,1,0,0|0,0,2]=4 10595 B8R1.31 O=C(O)C1C=CC1O Amb27475863 [0,1,0,1,0,0|0,0,2]=4 10596 B8R1.31 O=C(O)C1CCC1Cl Amb27490061 [0,1,0,1,0,0|0,0,0]=2 10597 B8R1.31 O=C(O)C1CCC1F Amb27835547 [0,1,0,1,0,0|0,0,0]=2 10598 B8R1.31 O=C(O)C1CCC1O Amb24481384 [0,1,0,1,0,0|0,0,0]=2 10599 B8R1.31 O=C(O)C1CNC1=O Amb24524290 [0,1,0,1,0,0|1,0,1]=4 10600 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O Amb27619188 [0,1,0,1,0,0|0,0,0]=2 10601 B8R1.31 O=C(O)[C@@H]1CNC1=O Amb26452604 [0,1,0,1,0,0|1,0,1]=4 10602 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O Amb34913090 [0,1,0,1,0,0|0,0,0]=2 10603 B8R1.31 O=C(O)[C@H]1CNC1=O Amb34146450 [0,1,0,1,0,0|1,0,1]=4 10604 B8R1.31 O=S(Cl)[C@@H]1CC[C@@H]1F Amb32720881 [0,1,0,1,0,0|2,0,0]=4 10605 B8R1.31 O=S([O-])[C@@H]1CC[C@@H]1F Amb32755401 [0,1,0,1,0,0|1,0,1]=4 10606 B8R1.34 BrC(Br)=CC1CCC1 Amb28070853 [0,1,0,1,0,0|2,0,0]=4 10607 B8R1.34 C=C(C)CC1CNC1 Amb24576858 [0,1,0,1,0,0|2,0,0]=4 10608 B8R1.34 CC(=N)NC1CCC1 Amb28068644 [0,1,0,1,0,0|2,0,0]=4 10609 B8R1.34 CC(=O)CC1CCC1 Amb20668826 [0,1,0,1,0,0|1,0,0]=3 10610 B8R1.34 CC(=O)CC1CNC1 Amb26366652 [0,1,0,1,0,0|1,0,0]=3 10611 B8R1.34 CC(=O)CC1COC1 Amb22728373 [0,1,0,1,0,0|1,0,0]=3 10612 B8R1.34 CC(=O)NC1CNC1 Amb21960869 [0,1,0,1,0,0|2,0,0]=4 10613 B8R1.34 CC(=O)NC1CNC1 Amb8011307 [0,1,0,1,0,0|2,0,0]=4 10614 B8R1.34 CC(=O)NN1CCC1 Amb32674457 [0,1,0,1,0,0|2,0,0]=4 10615 B8R1.34 CC(=O)OC1CNC1 Amb21956164 [0,1,0,1,0,0|2,0,0]=4 10616 B8R1.34 CC(=O)OC1CNC1 Amb21959342 [0,1,0,1,0,0|2,0,0]=4 10617 B8R1.34 CC(=O)OC1CNC1 Amb30594705 [0,1,0,1,0,0|2,0,0]=4 10618 B8R1.34 CC(=O)OC1COC1 Amb25257353 [0,1,0,1,0,0|2,0,0]=4 10619 B8R1.34 CC(=O)SC1CNC1 Amb26017419 [0,1,0,1,0,0|2,0,0]=4 10620 B8R1.34 CC(=O)SC1CNC1 Amb34154195 [0,1,0,1,0,0|2,0,0]=4 10621 B8R1.34 CC(=O)SC1COC1 Amb28074762 [0,1,0,1,0,0|2,0,0]=4 10622 B8R1.34 CC(O)CC1CCC1 Amb24590967 [0,1,0,1,0,0|1,0,1]=4 10623 B8R1.34 CC(O)CC1CNC1 Amb35622518 [0,1,0,1,0,0|1,0,1]=4 10624 B8R1.34 CC(O)CN1CCC1 Amb28048933 [0,1,0,1,0,0|1,0,1]=4 10625 B8R1.34 CN(O)CC1CCC1 Amb33195459 [0,1,0,1,0,0|2,0,0]=4 10626 B8R1.34 CS(=O)CC1CNC1 Amb26615132 [0,1,0,1,0,0|2,0,0]=4 10627 B8R1.34 CS(=O)CC1CNC1 Amb35752883 [0,1,0,1,0,0|2,0,0]=4 10628 B8R1.34 C[C@@H](O)CC1CCC1 Amb24673338 [0,1,0,1,0,0|1,0,1]=4 10629 B8R1.34 C[C@H](O)CC1CCC1 Amb24719399 [0,1,0,1,0,0|1,0,1]=4 10630 B8R1.34 N=C(N)CC1CCC1 Amb25693457 [0,1,0,1,0,0|2,0,0]=4 10631 B8R1.34 N=C(N)CC1CCC1 Amb28934881 [0,1,0,1,0,0|2,0,0]=4 10632 B8R1.34 N=C(N)CN1CCC1 Amb27650462 [0,1,0,1,0,0|2,0,0]=4 10633 B8R1.34 N=C(N)NC1CCC1 Amb24433597 [0,1,0,1,0,0|2,0,0]=4 10634 B8R1.34 N=C(N)NC1CCC1 Amb33338855 [0,1,0,1,0,0|2,0,0]=4 10635 B8R1.34 NC(=O)CC1CNC1 Amb25890059 [0,1,0,1,0,0|1,0,0]=3 10636 B8R1.34 NC(=O)CC1CNC1 Amb28819957 [0,1,0,1,0,0|1,0,0]=3 10637 B8R1.34 NC(=O)NC1CCC1 Amb24692278 [0,1,0,1,0,0|1,0,0]=3 10638 B8R1.34 NC(=O)NC1CNC1 Amb27624358 [0,1,0,1,0,0|2,0,0]=4 10639 B8R1.34 NC(=O)NC1CNC1 Amb35745883 [0,1,0,1,0,0|2,0,0]=4 10640 B8R1.34 NC(=O)OC1CCC1 Amb27976028 [0,1,0,1,0,0|1,0,0]=3 10641 B8R1.34 NC(=O)OC1CNC1 Amb23598269 [0,1,0,1,0,0|2,0,0]=4 10642 B8R1.34 NC(=O)OC1CNC1 Amb33329462 [0,1,0,1,0,0|2,0,0]=4 10643 B8R1.34 NC(=O)OC1CSC1 Amb22364584 [0,1,0,1,0,0|2,0,0]=4 10644 B8R1.34 NC(=S)CC1CCC1 Amb28456182 [0,1,0,1,0,0|1,1,0]=4 10645 B8R1.34 NC(=S)NC1CCC1 Amb33530393 [0,1,0,1,0,0|1,1,0]=4 10646 B8R1.34 NC(N)=NC1CCC1 Amb33551765 [0,1,0,1,0,0|2,0,0]=4 10647 B8R1.34 NS(=O)CC1CCC1 Amb32720398 [0,1,0,1,0,0|2,0,0]=4 10648 B8R1.34 O=C(Cl)CC1CCC1 Amb22491179 [0,1,0,1,0,0|1,0,0]=3 10649 B8R1.34 O=C(Cl)NC1CCC1 Amb35625531 [0,1,0,1,0,0|1,0,0]=3 10650 B8R1.34 O=C(Cl)OC1CCC1 Amb33532032 [0,1,0,1,0,0|1,0,0]=3 10651 B8R1.34 O=C(Cl)OC1COC1 Amb28048913 [0,1,0,1,0,0|2,0,0]=4 10652 B8R1.34 O=C(O)C=C1CCC1 Amb20667794 [0,1,0,1,0,0|0,0,1]=3 10653 B8R1.34 O=C(O)C=C1CNC1 Amb27255049 [0,1,0,1,0,0|0,0,2]=4 10654 B8R1.34 O=C(O)C=C1CNC1 Amb34150330 [0,1,0,1,0,0|0,0,2]=4 10655 B8R1.34 O=C(O)C=C1COC1 Amb26866250 [0,1,0,1,0,0|0,0,2]=4 10656 B8R1.34 O=C(O)C=C1CSC1 Amb24379733 [0,1,0,1,0,0|0,0,2]=4 10657 B8R1.34 O=C(O)CC1CCC1 Amb2696078 [0,1,0,1,0,0|0,0,0]=2 10658 B8R1.34 O=C(O)CC1CCN1 Amb25068427 [0,1,0,1,0,0|0,0,0]=2 10659 B8R1.34 O=C(O)CC1CCO1 Amb28136625 [0,1,0,1,0,0|0,0,0]=2 10660 B8R1.34 O=C(O)CC1CNC1 Amb21856240 [0,1,0,1,0,0|0,0,0]=2 10661 B8R1.34 O=C(O)CC1CNC1 Amb22057370 [0,1,0,1,0,0|0,0,0]=2 10662 B8R1.34 O=C(O)CC1CNC1 Amb22739043 [0,1,0,1,0,0|0,0,0]=2 10663 B8R1.34 O=C(O)CC1COC1 Amb18199145 [0,1,0,1,0,0|0,0,0]=2 10664 B8R1.34 O=C(O)CC1CSC1 Amb26049907 [0,1,0,1,0,0|0,0,0]=2 10665 B8R1.34 O=C(O)CN1CCC1 Amb28934892 [0,1,0,1,0,0|0,0,0]=2 10666 B8R1.34 O=C(O)C[C@@H]1CCO1 Amb33715997 [0,1,0,1,0,0|0,0,0]=2 10667 B8R1.34 O=C(O)C[C@H]1CCO1 Amb26570015 [0,1,0,1,0,0|0,0,0]=2 10668 B8R1.34 O=C([O-])CC1COC1 Amb32664987 [0,1,0,1,0,0|0,0,1]=3 10669 B8R1.34 O=S(Cl)CC1CCC1 Amb27266105 [0,1,0,1,0,0|2,0,0]=4 10670 B8R1.34 O=S(O)CC1CCC1 Amb27426399 [0,1,0,1,0,0|1,0,0]=3 10671 B8R1.34 O=S([O-])CC1CCC1 Amb28194022 [0,1,0,1,0,0|1,0,1]=4 10672 B8R1.34 O=S([O-])CC1CNC1 Amb32755470 [0,1,0,1,0,0|1,0,1]=4 10673 B8R1.34 O=[N+]([O-])CC1CCC1 Amb33195476 [0,1,0,1,0,0|1,0,1]=4 10674 B8R1.34 O=[N+]([O-])CC1COC1 Amb21961002 [0,1,0,1,0,0|1,0,1]=4 10675 B8R1.34 O=[N+]([O-])CC1CSC1 Amb27836157 [0,1,0,1,0,0|1,0,1]=4 10676 B8R1.40 C#CC(=O)NC1CC1 Amb23556886 [0,1,0,1,0,0|2,0,0]=4 10677 B8R1.40 C=C(CBr)CC1CC1 Amb33451579 [0,1,0,1,0,0|2,0,0]=4 10678 B8R1.40 C=C(CCl)CC1CC1 Amb33052797 [0,1,0,1,0,0|2,0,0]=4 10679 B8R1.40 C=C(CN)CC1CC1 Amb33224924 [0,1,0,1,0,0|2,0,0]=4 10680 B8R1.40 C=CC(=O)CC1CC1 Amb27203132 [0,1,0,1,0,0|1,0,0]=3 10681 B8R1.40 C=CC(=O)NC1CC1 Amb9280294 [0,1,0,1,0,0|2,0,0]=4 10682 B8R1.40 C=CC(O)CC1CC1 Amb24469416 [0,1,0,1,0,0|1,0,1]=4 10683 B8R1.40 CC(C=O)CC1CC1 Amb25100922 [0,1,0,1,0,0|1,0,1]=4 10684 B8R1.40 CC(CC1CC1)ON Amb33361225 [0,1,0,1,0,0|1,0,1]=4 10685 B8R1.40 CC(CO)CC1CC1 Amb24433846 [0,1,0,1,0,0|1,0,1]=4 10686 B8R1.40 CCC(=O)CC1CC1 Amb26322177 [0,1,0,1,0,0|1,0,0]=3 10687 B8R1.40 CCC(=O)CC1CO1 Amb28316245 [0,1,0,1,0,0|2,0,0]=4 10688 B8R1.40 CCC(C)CC1CO1 Amb26349228 [0,1,0,1,0,0|1,0,1]=4 10689 B8R1.40 CCS(=O)CC1CC1 Amb27810286 [0,1,0,1,0,0|2,0,0]=4 10690 B8R1.40 CC[C@@H](O)CC1CC1 Amb27954053 [0,1,0,1,0,0|1,0,1]=4 10691 B8R1.40 CN(C=O)CC1CC1 Amb24117127 [0,1,0,1,0,0|2,0,0]=4 10692 B8R1.40 CNC(=O)NC1CC1 Amb2132760 [0,1,0,1,0,0|2,0,0]=4 10693 B8R1.40 CNC(=O)OC1CC1 Amb32697664 [0,1,0,1,0,0|2,0,0]=4 10694 B8R1.40 COC(=O)C=C1CC1 Amb26419681 [0,1,0,1,0,0|0,0,2]=4 10695 B8R1.40 COC(=O)CC1CC1 Amb20622313 [0,1,0,1,0,0|0,0,0]=2 10696 B8R1.40 COC(=O)NC1CC1 Amb17869115 [0,1,0,1,0,0|1,0,0]=3 10697 B8R1.40 CO\C(C)=N\C1CC1 Amb22356785 [0,1,0,1,0,0|2,0,0]=4 10698 B8R1.40 CSC(=O)NC1CC1 Amb27814849 [0,1,0,1,0,0|1,1,0]=4 10699 B8R1.40 C[C@@H](CO)CC1CC1 Amb33746887 [0,1,0,1,0,0|1,0,1]=4 10700 B8R1.40 C[C@H](CO)CC1CC1 Amb33738178 [0,1,0,1,0,0|1,0,1]=4 10701 B8R1.40 C\C(C=O)=C/C1CC1 Amb27234400 [0,1,0,1,0,0|1,0,1]=4 10702 B8R1.40 NC(CO)CC1CC1 Amb18203350 [0,1,0,1,0,0|1,0,1]=4 10703 B8R1.40 NC(CO)CC1CC1 Amb33544543 [0,1,0,1,0,0|1,0,1]=4 10704 B8R1.40 NCC(=O)CC1CC1 Amb18203369 [0,1,0,1,0,0|1,0,0]=3 10705 B8R1.40 NCC(=O)CC1CC1 Amb32410146 [0,1,0,1,0,0|1,0,0]=3 10706 B8R1.40 NCC(=O)NC1CC1 Amb2371201 [0,1,0,1,0,0|2,0,0]=4 10707 B8R1.40 NCC(=O)NC1CC1 Amb439730 [0,1,0,1,0,0|2,0,0]=4 10708 B8R1.40 NCC(=O)OC1CC1 Amb17942928 [0,1,0,1,0,0|2,0,0]=4 10709 B8R1.40 NCC(O)CC1CC1 Amb18833011 [0,1,0,1,0,0|1,0,1]=4 10710 B8R1.40 NC[C@@H](O)CC1CC1 Amb33361466 [0,1,0,1,0,0|1,0,1]=4 10711 B8R1.40 NC[C@H](O)CC1CC1 Amb33361467 [0,1,0,1,0,0|1,0,1]=4 10712 B8R1.40 NNC(=O)CC1CC1 Amb8858841 [0,1,0,1,0,0|1,0,0]=3 10713 B8R1.40 NNC(=O)NC1CC1 Amb8854029 [0,1,0,1,0,0|2,0,0]=4 10714 B8R1.40 N[C@@H](CO)CC1CC1 Amb28457801 [0,1,0,1,0,0|1,0,1]=4 10715 B8R1.40 N[C@@H](CO)CC1CC1 Amb34154929 [0,1,0,1,0,0|1,0,1]=4 10716 B8R1.40 N[C@H](CO)CC1CC1 Amb26843116 [0,1,0,1,0,0|1,0,1]=4 10717 B8R1.40 N[C@H](CO)CC1CC1 Amb34160420 [0,1,0,1,0,0|1,0,1]=4 10718 B8R1.40 N\C(CC1CC1)=N/O Amb33531894 [0,1,0,1,0,0|1,0,0]=3 10719 B8R1.40 O=C(CBr)CC1CC1 Amb33545541 [0,1,0,1,0,0|1,0,0]=3 10720 B8R1.40 O=C(CBr)NC1CC1 Amb17331226 [0,1,0,1,0,0|2,0,0]=4 10721 B8R1.40 O=C(CCl)CC1CC1 Amb22395343 [0,1,0,1,0,0|1,0,0]=3 10722 B8R1.40 O=C(CCl)NC1CC1 Amb6336555 [0,1,0,1,0,0|2,0,0]=4 10723 B8R1.40 O=C(CO)NC1CC1 Amb5798093 [0,1,0,1,0,0|1,0,0]=3 10724 B8R1.40 O=C(CS)NC1CC1 Amb24183332 [0,1,0,1,0,0|1,1,0]=4 10725 B8R1.40 O=CC(=O)NC1CC1 Amb27838315 [0,1,0,1,0,0|1,0,1]=4 10726 B8R1.40 O=CC(O)CC1CC1 Amb27490937 [0,1,0,1,0,0|0,0,1]=3 10727 B8R1.40 OC(CBr)CC1CC1 Amb33451558 [0,1,0,1,0,0|1,0,1]=4 10728 B8R1.40 OC(CCl)CC1CC1 Amb26454818 [0,1,0,1,0,0|1,0,1]=4 10729 B8R1.40 OC(CF)CC1CC1 Amb33361222 [0,1,0,1,0,0|1,0,1]=4 10730 B8R1.40 OCC(O)CC1CC1 Amb33361892 [0,1,0,1,0,0|0,0,2]=4 10731 B8R1.42 C=C(C)CC1(N)CC1 Amb30030892 [0,1,0,1,0,0|2,0,0]=4 10732 B8R1.42 C=C(C)CC1(O)CC1 Amb33199209 [0,1,0,1,0,0|2,0,0]=4 10733 B8R1.42 CC(=O)CC1(C)CC1 Amb10607353 [0,1,0,1,0,0|1,0,0]=3 10734 B8R1.42 CC(=O)CC1(N)CC1 Amb28073167 [0,1,0,1,0,0|1,0,0]=3 10735 B8R1.42 CC(=O)NC1(O)CC1 Amb27793388 [0,1,0,1,0,0|2,0,0]=4 10736 B8R1.42 CC(=O)OC1(C)CC1 Amb10069988 [0,1,0,1,0,0|2,0,0]=4 10737 B8R1.42 CC(O)CC1(C)CC1 Amb26370449 [0,1,0,1,0,0|1,0,1]=4 10738 B8R1.42 CC(O)CC1(N)CC1 Amb18833015 [0,1,0,1,0,0|1,0,1]=4 10739 B8R1.42 CC1(CC(=N)N)CC1 Amb33312229 [0,1,0,1,0,0|2,0,0]=4 10740 B8R1.42 CC1(CC(=O)O)CC1 Amb33544283 [0,1,0,1,0,0|0,0,0]=2 10741 B8R1.42 CC1(CC(=O)O)N=N1 Amb27424155 [0,1,0,1,0,0|2,0,0]=4 10742 B8R1.42 CC1(CC(N)=S)CC1 Amb33312228 [0,1,0,1,0,0|1,1,0]=4 10743 B8R1.42 CC1(CS(=O)Cl)CC1 Amb32720396 [0,1,0,1,0,0|2,0,0]=4 10744 B8R1.42 CC1(CS(=O)[O-])CC1 Amb32755200 [0,1,0,1,0,0|1,0,1]=4 10745 B8R1.42 CC1(CS(N)=O)CC1 Amb32720397 [0,1,0,1,0,0|2,0,0]=4 10746 B8R1.42 CC1(C[N+](=O)[O-])CC1 Amb33312921 [0,1,0,1,0,0|1,0,1]=4 10747 B8R1.42 CC1(NC(=O)Cl)CC1 Amb35625910 [0,1,0,1,0,0|2,0,0]=4 10748 B8R1.42 CC1(OC(=O)Cl)CC1 Amb28430543 [0,1,0,1,0,0|2,0,0]=4 10749 B8R1.42 CN(O)CC1(C)CC1 Amb33313346 [0,1,0,1,0,0|2,0,0]=4 10750 B8R1.42 C[C@@H](O)CC1(C)CC1 Amb33312934 [0,1,0,1,0,0|1,0,1]=4 10751 B8R1.42 C[C@H](O)CC1(C)CC1 Amb33312928 [0,1,0,1,0,0|1,0,1]=4 10752 B8R1.42 NC(=O)CC1(N)CC1 Amb26530454 [0,1,0,1,0,0|1,0,0]=3 10753 B8R1.42 NC1(CC(=O)O)CC1 Amb18833024 [0,1,0,1,0,0|0,0,0]=2 10754 B8R1.42 NC1(CC(=O)O)CC1 Amb33550832 [0,1,0,1,0,0|0,0,0]=2 10755 B8R1.42 NC1(C[SH](=O)=O)CC1 Amb28245479 [0,1,0,1,0,0|1,0,1]=4 10756 B8R1.42 NS(=O)CC1(F)CC1 Amb32720908 [0,1,0,1,0,0|2,0,0]=4 10757 B8R1.42 O=C(O)CC1(Br)CC1 Amb27261767 [0,1,0,1,0,0|0,0,0]=2 10758 B8R1.42 O=C(O)CC1(Cl)CC1 Amb35743975 [0,1,0,1,0,0|0,0,0]=2 10759 B8R1.42 O=C(O)CC1(F)CC1 Amb28434812 [0,1,0,1,0,0|0,0,0]=2 10760 B8R1.42 O=C(O)CC1(O)CC1 Amb24117238 [0,1,0,1,0,0|0,0,0]=2 10761 B8R1.42 O=S(Cl)CC1(F)CC1 Amb32720926 [0,1,0,1,0,0|2,0,0]=4 10762 B8R1.42 O=S([O-])CC1(F)CC1 Amb32755414 [0,1,0,1,0,0|1,0,1]=4 10763 B8R1.43 C#CC1CC1C(=O)O Amb27398329 [0,1,0,1,0,0|0,0,1]=3 10764 B8R1.43 C#C[C@H]1C[C@@H]1C(=O)O Amb24076488 [0,1,0,1,0,0|0,0,1]=3 10765 B8R1.43 C#C[C@H]1C[C@H]1C(=O)O Amb28073511 [0,1,0,1,0,0|0,0,1]=3 10766 B8R1.43 C=C(C)C1CC1CN Amb33199508 [0,1,0,1,0,0|2,0,0]=4 10767 B8R1.43 C=C(C)C1CC1CO Amb27197103 [0,1,0,1,0,0|2,0,0]=4 10768 B8R1.43 C=C(C)[C@@H]1C[C@H]1CN Amb33199509 [0,1,0,1,0,0|2,0,0]=4 10769 B8R1.43 C=C(C)[C@H]1C[C@@H]1CO Amb28065860 [0,1,0,1,0,0|2,0,0]=4 10770 B8R1.43 C=CC1CC1C(C)=O Amb28075229 [0,1,0,1,0,0|1,0,1]=4 10771 B8R1.43 C=C[C@@H]1C[C@H]1C(=O)O Amb28347448 [0,1,0,1,0,0|0,0,1]=3 10772 B8R1.43 C=C[C@@H]1C[C@H]1C(C)=O Amb27420181 [0,1,0,1,0,0|1,0,1]=4 10773 B8R1.43 CC(=O)C1CC1C=O Amb27809942 [0,1,0,1,0,0|1,0,1]=4 10774 B8R1.43 CC(=O)C1CC1CN Amb33132446 [0,1,0,1,0,0|1,0,0]=3 10775 B8R1.43 CC(=O)[C@@H]1C[C@@H]1CN Amb33132469 [0,1,0,1,0,0|1,0,0]=3 10776 B8R1.43 CC(=O)[C@@H]1C[C@@H]1CO Amb28074697 [0,1,0,1,0,0|1,0,0]=3 10777 B8R1.43 CC(=O)[C@@H]1C[C@H]1C#N Amb28062975 [0,1,0,1,0,0|1,0,1]=4 10778 B8R1.43 CC(=O)[C@@H]1C[C@H]1CCl Amb27447264 [0,1,0,1,0,0|1,0,0]=3 10779 B8R1.43 CC(=O)[C@@H]1C[C@H]1CO Amb26561383 [0,1,0,1,0,0|1,0,0]=3 10780 B8R1.43 CC(=O)[C@H]1C[C@H]1C=O Amb27186674 [0,1,0,1,0,0|1,0,1]=4 10781 B8R1.43 CC(O)C1CC1CO Amb27763793 [0,1,0,1,0,0|1,0,1]=4 10782 B8R1.43 CC(O)[C@@H]1C[C@@H]1CO Amb27215056 [0,1,0,1,0,0|1,0,1]=4 10783 B8R1.43 CCC1CC1C(=O)Cl Amb27778180 [0,1,0,1,0,0|1,0,0]=3 10784 B8R1.43 CCC1CC1C(=O)O Amb18961272 [0,1,0,1,0,0|0,0,0]=2 10785 B8R1.43 CCC1CC1[C@@H](C)O Amb28065226 [0,1,0,1,0,0|1,0,1]=4 10786 B8R1.43 CCC1OC1C(C)=O Amb27206899 [0,1,0,1,0,0|1,0,0]=3 10787 B8R1.43 CCC1OC1C(N)=O Amb27461385 [0,1,0,1,0,0|1,0,0]=3 10788 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O Amb24112910 [0,1,0,1,0,0|0,0,0]=2 10789 B8R1.43 CC[C@@H]1O[C@@H]1C(=O)O Amb27855470 [0,1,0,1,0,0|0,0,0]=2 10790 B8R1.43 CC[C@@H]1O[C@@H]1C(C)=O Amb27854614 [0,1,0,1,0,0|1,0,0]=3 10791 B8R1.43 CC[C@H]1C[C@H]1C(=O)O Amb33098417 [0,1,0,1,0,0|0,0,0]=2 10792 B8R1.43 CC[C@H]1O[C@@H]1C(=O)O Amb27811556 [0,1,0,1,0,0|0,0,0]=2 10793 B8R1.43 CC[C@H]1O[C@H]1C(=O)O Amb27222314 [0,1,0,1,0,0|0,0,0]=2 10794 B8R1.43 COC1CC1C(=O)Cl Amb35717346 [0,1,0,1,0,0|1,0,0]=3 10795 B8R1.43 COC1CC1C(N)=O Amb35671242 [0,1,0,1,0,0|1,0,0]=3 10796 B8R1.43 CO[C@@H]1C[C@H]1C(=O)O Amb24514838 [0,1,0,1,0,0|0,0,0]=2 10797 B8R1.43 CO[C@@H]1C[C@H]1C(C)=O Amb27407296 [0,1,0,1,0,0|1,0,0]=3 10798 B8R1.43 CO[C@@H]1C[C@H]1C(C)O Amb27184522 [0,1,0,1,0,0|1,0,1]=4 10799 B8R1.43 C[C@@H](O)[C@H]1C[C@H]1CO Amb27213970 [0,1,0,1,0,0|1,0,1]=4 10800 B8R1.43 N#CC1CC1C(=O)O Amb24183452 [0,1,0,1,0,0|0,0,1]=3 10801 B8R1.43 N#C[C@@H]1C[C@@H]1C(=O)O Amb24183522 [0,1,0,1,0,0|0,0,1]=3 10802 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O Amb24183456 [0,1,0,1,0,0|0,0,1]=3 10803 B8R1.43 N#C[C@H]1C[C@@H]1C(=O)O Amb33805321 [0,1,0,1,0,0|0,0,1]=3 10804 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O Amb25168974 [0,1,0,1,0,0|0,0,1]=3 10805 B8R1.43 NC(=O)C1CC1CO Amb23538670 [0,1,0,1,0,0|1,0,0]=3 10806 B8R1.43 NCC1CC1C(=O)O Amb2694938 [0,1,0,1,0,0|0,0,0]=2 10807 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb24680970 [0,1,0,1,0,0|0,0,0]=2 10808 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb32992808 [0,1,0,1,0,0|0,0,0]=2 10809 B8R1.43 NC[C@@H]1C[C@@H]1C(N)=O Amb33042252 [0,1,0,1,0,0|1,0,0]=3 10810 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O Amb27205078 [0,1,0,1,0,0|0,0,0]=2 10811 B8R1.43 NC[C@H]1C[C@@H]1C(=O)O Amb27252099 [0,1,0,1,0,0|0,0,0]=2 10812 B8R1.43 NC[C@H]1C[C@H]1C(=O)O Amb28069146 [0,1,0,1,0,0|0,0,0]=2 10813 B8R1.43 NNC1CC1C(=O)O Amb10576221 [0,1,0,1,0,0|1,0,0]=3 10814 B8R1.43 O=C(O)C1CC1CBr Amb27407770 [0,1,0,1,0,0|0,0,0]=2 10815 B8R1.43 O=C(O)C1CC1CCl Amb26895220 [0,1,0,1,0,0|0,0,0]=2 10816 B8R1.43 O=C(O)C1CC1CO Amb25173469 [0,1,0,1,0,0|0,0,0]=2 10817 B8R1.43 O=C(O)[C@@H]1C[C@@H]1CO Amb28198703 [0,1,0,1,0,0|0,0,0]=2 10818 B8R1.43 O=C(O)[C@@H]1C[C@H]1CBr Amb26552185 [0,1,0,1,0,0|0,0,0]=2 10819 B8R1.43 O=C(O)[C@@H]1C[C@H]1CF Amb33098414 [0,1,0,1,0,0|0,0,0]=2 10820 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO Amb25231147 [0,1,0,1,0,0|0,0,0]=2 10821 B8R1.43 O=C(O)[C@H]1C[C@H]1CO Amb26916980 [0,1,0,1,0,0|0,0,0]=2 10822 B8R1.43 O=C([O-])C1CC1CO Amb33534503 [0,1,0,1,0,0|0,0,1]=3 10823 B8R1.43 O=C([O-])[C@@H]1C[C@H]1CO Amb35789135 [0,1,0,1,0,0|0,0,1]=3 10824 B8R1.43 O=C[C@H]1C[C@H]1C(=O)O Amb25911990 [0,1,0,1,0,0|0,0,1]=3 10825 B8R1.43 O=[N+]([O-])C1CC1CBr Amb32416244 [0,1,0,1,0,0|1,0,1]=4 10826 B8R1.43 OB(O)C1CC1CCl Amb27955519 [0,1,0,1,0,0|1,0,1]=4 10827 B8R1.51 C=C1CCC(C)(C)C1 Amb27471090 [0,1,0,1,0,0|2,0,0]=4 10828 B8R1.51 CC1(C)CC(=O)CN1 Amb24460323 [0,1,0,1,0,0|2,0,0]=4 10829 B8R1.51 CC1(C)CC(=O)CN1 Amb32693438 [0,1,0,1,0,0|2,0,0]=4 10830 B8R1.51 CC1(C)CC(=O)CO1 Amb24083194 [0,1,0,1,0,0|2,0,0]=4 10831 B8R1.51 CC1(C)CCC(=N)N1 Amb25733497 [0,1,0,1,0,0|2,0,0]=4 10832 B8R1.51 CC1(C)CCC(=N)N1 Amb32662918 [0,1,0,1,0,0|2,0,0]=4 10833 B8R1.51 CC1(C)CCC(=O)C1 Amb19516867 [0,1,0,1,0,0|1,0,0]=3 10834 B8R1.51 CC1(C)CCC(=O)N1 Amb9173662 [0,1,0,1,0,0|1,0,0]=3 10835 B8R1.51 CC1(C)CCC(=O)O1 Amb8631207 [0,1,0,1,0,0|0,0,0]=2 10836 B8R1.51 CC1(C)CCC(O)C1 Amb22549345 [0,1,0,1,0,0|1,0,1]=4 10837 B8R1.51 CC1(C)CCC(O)O1 Amb26962652 [0,1,0,1,0,0|0,0,2]=4 10838 B8R1.51 CC1(C)CN=C(N)O1 Amb25720624 [0,1,0,1,0,0|2,0,0]=4 10839 B8R1.51 CC1(C)CNC(=O)C1 Amb6752004 [0,1,0,1,0,0|2,0,0]=4 10840 B8R1.51 CC1(C)CNC(=O)N1 Amb4022598 [0,1,0,1,0,0|2,0,0]=4 10841 B8R1.51 CC1(C)CNC(=O)O1 Amb16202554 [0,1,0,1,0,0|1,0,0]=3 10842 B8R1.51 CC1(C)CNC(=O)S1 Amb27655652 [0,1,0,1,0,0|1,1,0]=4 10843 B8R1.51 CC1(C)CNC(=S)O1 Amb27838912 [0,1,0,1,0,0|1,1,0]=4 10844 B8R1.51 CC1(C)COC(=O)C1 Amb22284870 [0,1,0,1,0,0|2,0,0]=4 10845 B8R1.51 CC1(C)COC(=O)N1 Amb19516997 [0,1,0,1,0,0|2,0,0]=4 10846 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,1,0,1,0,0|1,0,0]=3 10847 B8R1.51 CC1(C)CSC(=O)N1 Amb27173093 [0,1,0,1,0,0|2,0,0]=4 10848 B8R1.51 CC1(C)NCC(=N)O1 Amb27838287 [0,1,0,1,0,0|2,0,0]=4 10849 B8R1.51 CC1(C)NCC(=O)N1 Amb27770341 [0,1,0,1,0,0|2,0,0]=4 10850 B8R1.51 CC1(C)NCC(=O)O1 Amb27969182 [0,1,0,1,0,0|1,0,0]=3 10851 B8R1.51 CC1(C)OCC(=O)O1 Amb10601611 [0,1,0,1,0,0|1,0,0]=3 10852 B8R1.51 CC1(F)CCC(=O)O1 Amb27597762 [0,1,0,1,0,0|0,0,0]=2 10853 B8R1.51 CC1(F)COC(=O)O1 Amb27420932 [0,1,0,1,0,0|1,0,0]=3 10854 B8R1.51 CC1(O)C=CC(=O)O1 Amb26551626 [0,1,0,1,0,0|0,0,2]=4 10855 B8R1.51 CC1(O)CCC(N)C1 Amb24483255 [0,1,0,1,0,0|1,0,1]=4 10856 B8R1.51 CC1(O)CCC(N)C1 Amb33951111 [0,1,0,1,0,0|1,0,1]=4 10857 B8R1.51 CC1(O)CCC(O)C1 Amb27763253 [0,1,0,1,0,0|1,0,1]=4 10858 B8R1.51 CC1(O)CNC(=O)C1 Amb2722777 [0,1,0,1,0,0|2,0,0]=4 10859 B8R1.51 CC1CCC(C)(O)C1 Amb26863470 [0,1,0,1,0,0|1,0,1]=4 10860 B8R1.51 CC1CCS(=O)(=O)C1 Amb2548451 [0,1,0,1,0,0|1,0,1]=4 10861 B8R1.51 CC1CCS(=O)(=O)N1 Amb24556783 [0,1,0,1,0,0|1,0,1]=4 10862 B8R1.51 CC1CCS(=O)(=O)O1 Amb26382065 [0,1,0,1,0,0|1,0,0]=3 10863 B8R1.51 CC1COS(=O)(=O)O1 Amb17772236 [0,1,0,1,0,0|2,0,0]=4 10864 B8R1.51 CS1(=O)=NC(=O)CC1 Amb33483218 [0,1,0,1,0,0|2,0,0]=4 10865 B8R1.51 C[C@@H]1COS(=O)(=O)O1 Amb22736783 [0,1,0,1,0,0|2,0,0]=4 10866 B8R1.51 C[C@H]1COS(=O)(=O)O1 Amb28120271 [0,1,0,1,0,0|2,0,0]=4 10867 B8R1.51 C[C@]1(O)CNC(=O)C1 Amb28253160 [0,1,0,1,0,0|2,0,0]=4 10868 B8R1.51 C[Si]1(C)CCC(=O)C1 Amb29837969 [0,1,0,1,0,0|1,1,0]=4 10869 B8R1.51 NC1CCS(=O)(=O)C1 Amb1080886 [0,1,0,1,0,0|1,0,1]=4 10870 B8R1.51 NC1CCS(=O)(=O)C1 Amb1152771 [0,1,0,1,0,0|1,0,1]=4 10871 B8R1.51 NC1CCS(=O)(=O)C1 Amb8508170 [0,1,0,1,0,0|1,0,1]=4 10872 B8R1.51 NC1CC[S+](=O)([O-])C1 Amb17726901 [0,1,0,1,0,0|1,0,1]=4 10873 B8R1.51 N[C@@H]1CCS(=O)(=O)C1 Amb33872364 [0,1,0,1,0,0|1,0,1]=4 10874 B8R1.51 N[C@H]1CCS(=O)(=O)C1 Amb30634357 [0,1,0,1,0,0|1,0,1]=4 10875 B8R1.51 O=C1CCC(Cl)(Cl)C1 Amb28141254 [0,1,0,1,0,0|2,0,0]=4 10876 B8R1.51 O=C1CCC(F)(F)C1 Amb21963547 [0,1,0,1,0,0|2,0,0]=4 10877 B8R1.51 O=C1CCS(=O)(=O)O1 Amb17399828 [0,1,0,1,0,0|2,0,0]=4 10878 B8R1.51 O=S1(=O)CCC(Br)C1 Amb2813269 [0,1,0,1,0,0|1,0,1]=4 10879 B8R1.51 O=S1(=O)CCC(Cl)C1 Amb2598932 [0,1,0,1,0,0|1,0,1]=4 10880 B8R1.51 O=S1(=O)CCC(I)C1 Amb19517046 [0,1,0,1,0,0|1,0,1]=4 10881 B8R1.51 O=S1(=O)CCC(O)C1 Amb5716885 [0,1,0,1,0,0|1,0,1]=4 10882 B8R1.51 O=S1(=O)CCC(S)C1 Amb2796511 [0,1,0,1,0,0|1,0,1]=4 10883 B8R1.51 O=S1(=O)CCC([S-])C1 Amb18526895 [0,1,0,1,0,0|1,0,1]=4 10884 B8R1.51 O=S1(=O)CC[C@@H](O)C1 Amb27981301 [0,1,0,1,0,0|1,0,1]=4 10885 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 Amb2793187 [0,1,0,1,0,0|1,0,1]=4 10886 B8R1.51 [NH3+]C1CCS(=O)(=O)C1 Amb3911968 [0,1,0,1,0,0|1,0,1]=4 10887 B8R1.62 CC1(CCl)CC(=O)N1 Amb27974580 [0,1,0,1,0,0|2,0,0]=4 10888 B8R1.62 CC1(CO)CC(=O)C1 Amb22406263 [0,1,0,1,0,0|2,0,0]=4 10889 B8R1.62 CCC1(F)CC(=O)C1 Amb28146639 [0,1,0,1,0,0|1,0,0]=3 10890 B8R1.62 CCC1(N)CC(O)C1 Amb33204301 [0,1,0,1,0,0|1,0,1]=4 10891 B8R1.62 O=C1CC(Cl)(CCl)O1 Amb27493123 [0,1,0,1,0,0|1,0,0]=3 10892 B8R1.67 C=C1C(C)C1C(=O)O Amb27985954 [0,1,0,1,0,0|0,0,1]=3 10893 B8R1.67 C=C1C(C)C1C(C)=O Amb26887809 [0,1,0,1,0,0|1,0,1]=4 10894 B8R1.67 CC(=O)C1[C@H](C)[C@H]1C Amb25985971 [0,1,0,1,0,0|1,0,0]=3 10895 B8R1.67 CC(=O)[C@H]1[C@@H](Cl)[C@@H]1C Amb27865414 [0,1,0,1,0,0|1,0,0]=3 10896 B8R1.67 CC(=O)[C@H]1[C@H](C)[C@@H]1Br Amb27204152 [0,1,0,1,0,0|1,0,0]=3 10897 B8R1.67 CC(=O)[C@H]1[C@H](C)[C@H]1Cl Amb27880620 [0,1,0,1,0,0|1,0,0]=3 10898 B8R1.67 CC(O)[C@@H]1[C@@H](C)[C@H]1C Amb28321600 [0,1,0,1,0,0|1,0,1]=4 10899 B8R1.67 CC1C(Cl)C1C(=O)O Amb32656377 [0,1,0,1,0,0|0,0,0]=2 10900 B8R1.67 C[C@@H]1C(C(=O)O)[C@@H]1C Amb25937319 [0,1,0,1,0,0|0,0,0]=2 10901 B8R1.67 C[C@@H]1[C@@H](N)[C@@H]1C(=O)O Amb28365983 [0,1,0,1,0,0|0,0,0]=2 10902 B8R1.67 O=C(O)C1C(Cl)C1Cl Amb25918156 [0,1,0,1,0,0|1,0,0]=3 10903 B8R1.83 C#CC(=O)C1CC1C Amb27626468 [0,1,0,1,0,0|1,0,0]=3 10904 B8R1.83 C#CC(=O)[C@@H]1O[C@H]1C Amb28054303 [0,1,0,1,0,0|2,0,0]=4 10905 B8R1.83 C#C[C@@H](O)C1CC1C Amb27973209 [0,1,0,1,0,0|1,0,1]=4 10906 B8R1.83 C=C(CBr)C1CC1C Amb33431700 [0,1,0,1,0,0|2,0,0]=4 10907 B8R1.83 C=C(CN)C1CC1C Amb33144230 [0,1,0,1,0,0|2,0,0]=4 10908 B8R1.83 C=C1CC1C(=O)OC Amb28284472 [0,1,0,1,0,0|0,0,2]=4 10909 B8R1.83 C=CC(=O)C1CC1C Amb25173576 [0,1,0,1,0,0|1,0,0]=3 10910 B8R1.83 C=CC(O)C1CC1C Amb25871300 [0,1,0,1,0,0|1,0,1]=4 10911 B8R1.83 CC(C=O)C1CC1C Amb33144234 [0,1,0,1,0,0|1,0,1]=4 10912 B8R1.83 CC1CC1C(=O)C=O Amb27882956 [0,1,0,1,0,0|0,0,1]=3 10913 B8R1.83 CC1CC1C(=O)CCl Amb24104125 [0,1,0,1,0,0|1,0,0]=3 10914 B8R1.83 CC1CC1C(=O)CN Amb24524253 [0,1,0,1,0,0|1,0,0]=3 10915 B8R1.83 CC1CC1C(=O)NN Amb9708926 [0,1,0,1,0,0|1,0,0]=3 10916 B8R1.83 CC1CC1C(C)ON Amb33144251 [0,1,0,1,0,0|1,0,1]=4 10917 B8R1.83 CC1CC1C(N)CO Amb33359775 [0,1,0,1,0,0|1,0,1]=4 10918 B8R1.83 CC1CC1C(O)CBr Amb33431699 [0,1,0,1,0,0|1,0,1]=4 10919 B8R1.83 CC1CC1C(O)CF Amb33144233 [0,1,0,1,0,0|1,0,1]=4 10920 B8R1.83 CC1CC1C(O)CN Amb33449247 [0,1,0,1,0,0|1,0,1]=4 10921 B8R1.83 CC1CC1C(O)CO Amb33449423 [0,1,0,1,0,0|0,0,2]=4 10922 B8R1.83 CC1CC1[C@@H](N)CO Amb33144259 [0,1,0,1,0,0|1,0,1]=4 10923 B8R1.83 CC1CC1[C@@H](O)CN Amb33144262 [0,1,0,1,0,0|1,0,1]=4 10924 B8R1.83 CC1CC1[C@H](N)CO Amb33144260 [0,1,0,1,0,0|1,0,1]=4 10925 B8R1.83 CC1CC1[C@H](O)CN Amb33144261 [0,1,0,1,0,0|1,0,1]=4 10926 B8R1.83 CC1CC1\C(N)=N\O Amb25186813 [0,1,0,1,0,0|1,0,0]=3 10927 B8R1.83 CCC(=O)C1CC1C Amb26336728 [0,1,0,1,0,0|1,0,0]=3 10928 B8R1.83 CCC(=O)C1OC1C Amb25944989 [0,1,0,1,0,0|2,0,0]=4 10929 B8R1.83 CCC(=O)[C@@H]1C[C@@H]1Br Amb27197919 [0,1,0,1,0,0|2,0,0]=4 10930 B8R1.83 CCC(O)C1CC1C Amb28078250 [0,1,0,1,0,0|1,0,1]=4 10931 B8R1.83 CC[C@@H](O)C1CC1C Amb27861173 [0,1,0,1,0,0|1,0,1]=4 10932 B8R1.83 CC[C@H](O)C1CC1C Amb27226963 [0,1,0,1,0,0|1,0,1]=4 10933 B8R1.83 CNC(=O)C1CC1C Amb27469589 [0,1,0,1,0,0|1,0,0]=3 10934 B8R1.83 CNC(=O)[C@@H]1C[C@H]1C Amb27165349 [0,1,0,1,0,0|1,0,0]=3 10935 B8R1.83 CNC(=O)[C@H]1C[C@@H]1C Amb27651146 [0,1,0,1,0,0|1,0,0]=3 10936 B8R1.83 COC(=O)C1CC1Br Amb27864121 [0,1,0,1,0,0|1,0,0]=3 10937 B8R1.83 COC(=O)C1CC1C Amb9241819 [0,1,0,1,0,0|0,0,0]=2 10938 B8R1.83 COC(=O)C1OC1C Amb22055865 [0,1,0,1,0,0|1,0,0]=3 10939 B8R1.83 COC(=O)[C@@H]1C[C@H]1C Amb27205901 [0,1,0,1,0,0|0,0,0]=2 10940 B8R1.83 COC(=O)[C@@H]1C[C@H]1F Amb28072373 [0,1,0,1,0,0|1,0,0]=3 10941 B8R1.83 COC(=O)[C@@H]1N[C@H]1C Amb24120620 [0,1,0,1,0,0|1,0,0]=3 10942 B8R1.83 COC(=O)[C@@H]1O[C@H]1C Amb27880914 [0,1,0,1,0,0|1,0,0]=3 10943 B8R1.2 BrC=C1CCCCC1 Amb22337534 [0,1,0,1,0,0|2,0,0]=4 10944 B8R1.2 BrCC1=CCCCC1 Amb23439167 [0,1,0,1,0,0|2,0,0]=4 10945 B8R1.2 BrCC1CCCCO1 Amb1680201 [0,1,0,1,0,0|1,0,1]=4 10946 B8R1.2 BrC[C@@H]1CCCCO1 Amb27793586 [0,1,0,1,0,0|1,0,1]=4 10947 B8R1.2 C#CC1=CCCCC1 Amb1102053 [0,1,0,1,0,0|2,0,0]=4 10948 B8R1.2 C#CC1CCCCO1 Amb17673286 [0,1,0,1,0,0|1,0,1]=4 10949 B8R1.2 C=CC1=CCCCC1 Amb24387238 [0,1,0,1,0,0|2,0,0]=4 10950 B8R1.2 C=CC1CCCCO1 Amb35672708 [0,1,0,1,0,0|1,0,1]=4 10951 B8R1.2 CC=C1CCCCC1 Amb8513433 [0,1,0,1,0,0|2,0,0]=4 10952 B8R1.2 CCC1=CCCCC1 Amb25337001 [0,1,0,1,0,0|2,0,0]=4 10953 B8R1.2 CCC1CCCCO1 Amb2703732 [0,1,0,1,0,0|1,0,1]=4 10954 B8R1.2 CN=C1CCCCC1 Amb27838980 [0,1,0,1,0,0|2,0,0]=4 10955 B8R1.2 CNC1=NCCCC1 Amb23570622 [0,1,0,1,0,0|2,0,0]=4 10956 B8R1.2 CNC1=NCCCC1 Amb28934861 [0,1,0,1,0,0|2,0,0]=4 10957 B8R1.2 CNC1CCCCO1 Amb26068497 [0,1,0,1,0,0|1,0,1]=4 10958 B8R1.2 COC1=CCCCC1 Amb10601667 [0,1,0,1,0,0|1,0,0]=3 10959 B8R1.2 COC1=CCNCC1 Amb27174213 [0,1,0,1,0,0|2,0,0]=4 10960 B8R1.2 COC1=CCOCC1 Amb21927983 [0,1,0,1,0,0|2,0,0]=4 10961 B8R1.2 COC1=NCCCC1 Amb2689803 [0,1,0,1,0,0|1,0,0]=3 10962 B8R1.2 COC1=NCCCN1 Amb27838826 [0,1,0,1,0,0|2,0,0]=4 10963 B8R1.2 COC1=NCCNC1 Amb33218461 [0,1,0,1,0,0|2,0,0]=4 10964 B8R1.2 COC1=NCCOC1 Amb25304653 [0,1,0,1,0,0|2,0,0]=4 10965 B8R1.2 COC1CCCCC1 Amb4035423 [0,1,0,1,0,0|1,0,1]=4 10966 B8R1.2 COC1CCCCN1 Amb24384593 [0,1,0,1,0,0|1,0,1]=4 10967 B8R1.2 COC1CCCCO1 Amb21955138 [0,1,0,1,0,0|0,0,2]=4 10968 B8R1.2 CSC1=CCCCC1 Amb28316123 [0,1,0,1,0,0|1,1,0]=4 10969 B8R1.2 C\N=C1/NCCCO1 Amb28282697 [0,1,0,1,0,0|2,0,0]=4 10970 B8R1.2 ClCC1=CCCCO1 Amb23585659 [0,1,0,1,0,0|1,0,1]=4 10971 B8R1.2 ClCC1CCCCO1 Amb2723692 [0,1,0,1,0,0|1,0,1]=4 10972 B8R1.2 ClC[C@H]1CCCCO1 Amb27879106 [0,1,0,1,0,0|1,0,1]=4 10973 B8R1.2 ClN=C1CCCCC1 Amb25069376 [0,1,0,1,0,0|2,0,0]=4 10974 B8R1.2 Cl\C=C1\CCOCO1 Amb26566005 [0,1,0,1,0,0|2,0,0]=4 10975 B8R1.2 ICC1CCCCO1 Amb24060887 [0,1,0,1,0,0|1,0,1]=4 10976 B8R1.2 N#CC1=CCCCC1 Amb2720853 [0,1,0,1,0,0|2,0,0]=4 10977 B8R1.2 N#CC1=CCCCO1 Amb2700340 [0,1,0,1,0,0|1,0,1]=4 10978 B8R1.2 N#CC1CCCCO1 Amb26630839 [0,1,0,1,0,0|1,0,1]=4 10979 B8R1.2 NCC1=CCCCC1 Amb10607847 [0,1,0,1,0,0|2,0,0]=4 10980 B8R1.2 NCC1=CCCCC1 Amb22587029 [0,1,0,1,0,0|2,0,0]=4 10981 B8R1.2 NCC1=CCCCO1 Amb33457505 [0,1,0,1,0,0|1,0,1]=4 10982 B8R1.2 NCC1=CCCCO1 Amb8009853 [0,1,0,1,0,0|1,0,1]=4 10983 B8R1.2 NCC1CCCCO1 Amb19372867 [0,1,0,1,0,0|1,0,1]=4 10984 B8R1.2 NCC1CCCCO1 Amb2723691 [0,1,0,1,0,0|1,0,1]=4 10985 B8R1.2 NC[C@@H]1CCCCO1 Amb22225424 [0,1,0,1,0,0|1,0,1]=4 10986 B8R1.2 NC[C@@H]1CCCCO1 Amb24062887 [0,1,0,1,0,0|1,0,1]=4 10987 B8R1.2 NC[C@H]1CCCCO1 Amb22225114 [0,1,0,1,0,0|1,0,1]=4 10988 B8R1.2 NC[C@H]1CCCCO1 Amb24061931 [0,1,0,1,0,0|1,0,1]=4 10989 B8R1.2 NN=C1CCCCC1 Amb26080931 [0,1,0,1,0,0|2,0,0]=4 10990 B8R1.2 NNC1=CCCCC1 Amb27880817 [0,1,0,1,0,0|2,0,0]=4 10991 B8R1.2 NNC1=CCCCO1 Amb28125675 [0,1,0,1,0,0|1,0,1]=4 10992 B8R1.2 NOC1CCCCC1 Amb18641839 [0,1,0,1,0,0|1,0,1]=4 10993 B8R1.2 NOC1CCCCO1 Amb10975936 [0,1,0,1,0,0|0,0,2]=4 10994 B8R1.2 O=CC1=CCCCC1 Amb33545149 [0,1,0,1,0,0|1,0,0]=3 10995 B8R1.2 O=CC1=CCCNC1 Amb27833007 [0,1,0,1,0,0|2,0,0]=4 10996 B8R1.2 O=CC1=CCCOC1 Amb1102766 [0,1,0,1,0,0|2,0,0]=4 10997 B8R1.2 O=CC1=CCCSC1 Amb18642670 [0,1,0,1,0,0|2,0,0]=4 10998 B8R1.2 O=CC1=CCOCC1 Amb18641683 [0,1,0,1,0,0|2,0,0]=4 10999 B8R1.2 O=CC1=COCCC1 Amb2433566 [0,1,0,1,0,0|2,0,0]=4 11000 B8R1.2 O=CC1=COCCO1 Amb2786548 [0,1,0,1,0,0|1,0,1]=4 11001 B8R1.2 O=CC1=CSCCC1 Amb28316147 [0,1,0,1,0,0|2,0,0]=4 11002 B8R1.2 O=CC1CCCCC1 Amb3939850 [0,1,0,1,0,0|1,0,1]=4 11003 B8R1.2 O=CC1CCCCN1 Amb20242687 [0,1,0,1,0,0|1,0,1]=4 11004 B8R1.2 O=CC1CCCCN1 Amb8384317 [0,1,0,1,0,0|1,0,1]=4 11005 B8R1.2 O=CC1CCCCO1 Amb8009759 [0,1,0,1,0,0|0,0,1]=3 11006 B8R1.2 O=CC1CCCCS1 Amb18642816 [0,1,0,1,0,0|0,1,1]=4 11007 B8R1.2 O=CC1COCCO1 Amb8011456 [0,1,0,1,0,0|1,0,1]=4 11008 B8R1.2 O=CN1CCCCC1 Amb2720341 [0,1,0,1,0,0|2,0,0]=4 11009 B8R1.2 O=C[C@@H]1CCCCN1 Amb27468660 [0,1,0,1,0,0|1,0,1]=4 11010 B8R1.2 O=C[C@H]1CCCCN1 Amb27203300 [0,1,0,1,0,0|1,0,1]=4 11011 B8R1.2 O=NN1CCCCC1 Amb10604043 [0,1,0,1,0,0|2,0,0]=4 11012 B8R1.2 O=NN1CCCCO1 Amb27472845 [0,1,0,1,0,0|1,0,0]=3 11013 B8R1.2 OCC1=CCCCC1 Amb24122911 [0,1,0,1,0,0|1,0,0]=3 11014 B8R1.2 OCC1=CCCCO1 Amb20248629 [0,1,0,1,0,0|0,0,2]=4 11015 B8R1.2 OCC1=CCCOC1 Amb24329074 [0,1,0,1,0,0|2,0,0]=4 11016 B8R1.2 OCC1=CCOCC1 Amb27394889 [0,1,0,1,0,0|2,0,0]=4 11017 B8R1.2 OCC1=CCSCC1 Amb28189541 [0,1,0,1,0,0|2,0,0]=4 11018 B8R1.2 OCC1=COCCC1 Amb24426430 [0,1,0,1,0,0|2,0,0]=4 11019 B8R1.2 OCC1=NCCCN1 Amb28326118 [0,1,0,1,0,0|2,0,0]=4 11020 B8R1.2 OCC1=NOCCC1 Amb25675358 [0,1,0,1,0,0|2,0,0]=4 11021 B8R1.2 OCC1CCCCC1 Amb3939316 [0,1,0,1,0,0|1,0,1]=4 11022 B8R1.2 OCC1CCCCN1 Amb6768986 [0,1,0,1,0,0|1,0,1]=4 11023 B8R1.2 OCC1CCCCN1 Amb9703110 [0,1,0,1,0,0|1,0,1]=4 11024 B8R1.2 OCC1CCCCO1 Amb9703167 [0,1,0,1,0,0|0,0,2]=4 11025 B8R1.2 OCC1CCCCS1 Amb20669084 [0,1,0,1,0,0|0,1,1]=4 11026 B8R1.2 OCN1CCCCC1 Amb25949562 [0,1,0,1,0,0|2,0,0]=4 11027 B8R1.2 OC[C@@H]1CCCCN1 Amb13886314 [0,1,0,1,0,0|1,0,1]=4 11028 B8R1.2 OC[C@@H]1CCCCO1 Amb24182043 [0,1,0,1,0,0|0,0,2]=4 11029 B8R1.2 OC[C@H]1CCCCN1 Amb13886286 [0,1,0,1,0,0|1,0,1]=4 11030 B8R1.2 OC[C@H]1CCCCO1 Amb25873825 [0,1,0,1,0,0|0,0,2]=4 11031 B8R1.2 ON=C1CCCCC1 Amb6364727 [0,1,0,1,0,0|1,0,0]=3 11032 B8R1.2 ON=C1CCNCC1 Amb16226328 [0,1,0,1,0,0|2,0,0]=4 11033 B8R1.2 ON=C1CCOCC1 Amb9173664 [0,1,0,1,0,0|2,0,0]=4 11034 B8R1.2 ON=C1CCSCC1 Amb2445012 [0,1,0,1,0,0|2,0,0]=4 11035 B8R1.2 ONC1=NCCOC1 Amb27962415 [0,1,0,1,0,0|2,0,0]=4 11036 B8R1.2 ONC1=NCCOC1 Amb33309983 [0,1,0,1,0,0|2,0,0]=4 11037 B8R1.2 ONC1CCCCO1 Amb27428911 [0,1,0,1,0,0|0,0,2]=4 11038 B8R1.2 O[NH2+]C1CCCCC1 Amb9826874 [0,1,0,1,0,0|1,0,1]=4 11039 B8R1.2 O\N=C1/C=CCCC1 Amb28316146 [0,1,0,1,0,0|1,0,1]=4 11040 B8R1.2 O\N=C1/CNCCS1 Amb27838324 [0,1,0,1,0,0|1,1,0]=4 11041 B8R1.2 O\N=C1\CCCCN1 Amb4136429 [0,1,0,1,0,0|1,0,0]=3 11042 B8R1.2 SCC1CCCCO1 Amb23585661 [0,1,0,1,0,0|0,1,1]=4 11043 B8R1.2 [C-]#[N+]C1=CCCCC1 Amb10603087 [0,1,0,1,0,0|2,0,0]=4 11044 B8R1.3 C=C1CCC(=O)CC1 Amb22229828 [0,1,0,1,0,0|1,0,1]=4 11045 B8R1.3 C=C1CCC(C)CC1 Amb24058250 [0,1,0,1,0,0|2,0,0]=4 11046 B8R1.3 C=C1CCC(C)NC1 Amb27626150 [0,1,0,1,0,0|2,0,0]=4 11047 B8R1.3 C=C1CCC(C)OC1 Amb30011003 [0,1,0,1,0,0|1,0,0]=3 11048 B8R1.3 C=C1CCC(C)SC1 Amb35611382 [0,1,0,1,0,0|1,1,0]=4 11049 B8R1.3 C=C1CCC(N)CC1 Amb23599023 [0,1,0,1,0,0|2,0,0]=4 11050 B8R1.3 C=C1CCC(N)CC1 Amb33537570 [0,1,0,1,0,0|2,0,0]=4 11051 B8R1.3 C=C1CCC(O)CC1 Amb27603595 [0,1,0,1,0,0|2,0,0]=4 11052 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,1,0,1,0,0|1,0,1]=4 11053 B8R1.3 CC1=CCC(C)CC1 Amb26354597 [0,1,0,1,0,0|2,0,0]=4 11054 B8R1.3 CC1=CC[C@@H](N)CC1 Amb27493017 [0,1,0,1,0,0|2,0,0]=4 11055 B8R1.3 CC1=CC[C@H](N)CC1 Amb28365931 [0,1,0,1,0,0|2,0,0]=4 11056 B8R1.3 CC1=NNC(=O)CC1 Amb2606146 [0,1,0,1,0,0|1,0,1]=4 11057 B8R1.3 CC1C=CC(=O)CC1 Amb24556470 [0,1,0,1,0,0|1,0,0]=3 11058 B8R1.3 CC1CC=C(Cl)CC1 Amb27783557 [0,1,0,1,0,0|2,0,0]=4 11059 B8R1.3 CC1CCC(=O)CC1 Amb6608654 [0,1,0,1,0,0|1,0,0]=3 11060 B8R1.3 CC1CCC(=O)CN1 Amb26979747 [0,1,0,1,0,0|1,0,0]=3 11061 B8R1.3 CC1CCC(=O)CN1 Amb32686523 [0,1,0,1,0,0|1,0,0]=3 11062 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,1,0,1,0,0|0,0,0]=2 11063 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,1,0,1,0,0|0,1,0]=3 11064 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,1,0,1,0,0|1,0,0]=3 11065 B8R1.3 CC1CCC(=O)NN1 Amb27443930 [0,1,0,1,0,0|1,0,0]=3 11066 B8R1.3 CC1CCC(=O)OC1 Amb27667524 [0,1,0,1,0,0|0,0,0]=2 11067 B8R1.3 CC1CCC(N)CO1 Amb35709402 [0,1,0,1,0,0|1,0,1]=4 11068 B8R1.3 CC1CCC(O)CC1 Amb4605823 [0,1,0,1,0,0|1,0,1]=4 11069 B8R1.3 CC1CCC(O)CC1 Amb9787282 [0,1,0,1,0,0|1,0,1]=4 11070 B8R1.3 CC1CCC(O)CN1 Amb18641838 [0,1,0,1,0,0|1,0,1]=4 11071 B8R1.3 CC1CCC(O)CN1 Amb28934843 [0,1,0,1,0,0|1,0,1]=4 11072 B8R1.3 CC1CCC(O)CO1 Amb26381886 [0,1,0,1,0,0|0,0,2]=4 11073 B8R1.3 CC1CCC(O)OC1 Amb27835928 [0,1,0,1,0,0|0,0,2]=4 11074 B8R1.3 CC1CCC(S)CO1 Amb32788236 [0,1,0,1,0,0|0,1,1]=4 11075 B8R1.3 CC1CN=C(O)NC1 Amb25268854 [0,1,0,1,0,0|2,0,0]=4 11076 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,1,0,1,0,0|2,0,0]=4 11077 B8R1.3 CC1CNC(=O)CN1 Amb34912937 [0,1,0,1,0,0|2,0,0]=4 11078 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,1,0,1,0,0|1,0,0]=3 11079 B8R1.3 CC1COS(=O)OC1 Amb27785765 [0,1,0,1,0,0|2,0,0]=4 11080 B8R1.3 CC1OCC(=O)CO1 Amb28316125 [0,1,0,1,0,0|1,0,0]=3 11081 B8R1.3 CN1C=CC(=O)CC1 Amb17593148 [0,1,0,1,0,0|2,0,0]=4 11082 B8R1.3 CN1CCC(=O)CC1 Amb2725656 [0,1,0,1,0,0|2,0,0]=4 11083 B8R1.3 C[C@@H]1C=CC(=O)CC1 Amb28144188 [0,1,0,1,0,0|1,0,0]=3 11084 B8R1.3 C[C@@H]1CCC(=N)NC1 Amb27429397 [0,1,0,1,0,0|2,0,0]=4 11085 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,1,0,1,0,0|1,0,0]=3 11086 B8R1.3 C[C@@H]1CCC(=O)OC1 Amb26004046 [0,1,0,1,0,0|0,0,0]=2 11087 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb22886214 [0,1,0,1,0,0|1,0,1]=4 11088 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb25175824 [0,1,0,1,0,0|1,0,1]=4 11089 B8R1.3 C[C@@H]1CC[C@H](Br)CO1 Amb27656949 [0,1,0,1,0,0|1,0,1]=4 11090 B8R1.3 C[C@@H]1CC[C@H](Cl)CO1 Amb28076706 [0,1,0,1,0,0|1,0,1]=4 11091 B8R1.3 C[C@@H]1CC[C@H](O)CN1 Amb22886213 [0,1,0,1,0,0|1,0,1]=4 11092 B8R1.3 C[C@@H]1CC[C@H](O)CN1 Amb26440123 [0,1,0,1,0,0|1,0,1]=4 11093 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,1,0,1,0,0|2,0,0]=4 11094 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,1,0,1,0,0|2,0,0]=4 11095 B8R1.3 C[C@@H]1CNC(=O)CO1 Amb27470503 [0,1,0,1,0,0|1,0,0]=3 11096 B8R1.3 C[C@H]1C=C[C@@H](O)CC1 Amb27186928 [0,1,0,1,0,0|1,0,1]=4 11097 B8R1.3 C[C@H]1CCC(=O)NC1 Amb27838374 [0,1,0,1,0,0|1,0,0]=3 11098 B8R1.3 C[C@H]1CC[C@@H](O)CC1 Amb10844735 [0,1,0,1,0,0|1,0,1]=4 11099 B8R1.3 C[C@H]1CC[C@@H](O)CN1 Amb27420157 [0,1,0,1,0,0|1,0,1]=4 11100 B8R1.3 C[C@H]1CC[C@@H](O)CN1 Amb34140397 [0,1,0,1,0,0|1,0,1]=4 11101 B8R1.3 C[C@H]1CC[C@H](O)CC1 Amb8513394 [0,1,0,1,0,0|1,0,1]=4 11102 B8R1.3 C[C@H]1CC[C@H](O)CN1 Amb24575263 [0,1,0,1,0,0|1,0,1]=4 11103 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,1,0,1,0,0|2,0,0]=4 11104 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,1,0,1,0,0|2,0,0]=4 11105 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,1,0,1,0,0|1,0,0]=3 11106 B8R1.3 NC1CCC(=O)CC1 Amb10067105 [0,1,0,1,0,0|1,0,0]=3 11107 B8R1.3 NC1CCC(=O)CC1 Amb21862513 [0,1,0,1,0,0|1,0,0]=3 11108 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [0,1,0,1,0,0|1,0,0]=3 11109 B8R1.3 NC1CCC(=O)NC1 Amb18833034 [0,1,0,1,0,0|1,0,0]=3 11110 B8R1.3 NC1CCC(O)CC1 Amb2684385 [0,1,0,1,0,0|1,0,1]=4 11111 B8R1.3 NC1CCC(O)CC1 Amb8627755 [0,1,0,1,0,0|1,0,1]=4 11112 B8R1.3 NC1CCS(=O)CC1 Amb18943776 [0,1,0,1,0,0|2,0,0]=4 11113 B8R1.3 NC1CCS(=O)CC1 Amb21988665 [0,1,0,1,0,0|2,0,0]=4 11114 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb2699221 [0,1,0,1,0,0|1,0,0]=3 11115 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb27432343 [0,1,0,1,0,0|1,0,0]=3 11116 B8R1.3 N[C@H]1CCC(=O)NC1 Amb22748949 [0,1,0,1,0,0|1,0,0]=3 11117 B8R1.3 N[C@H]1CCC(=O)NC1 Amb2699220 [0,1,0,1,0,0|1,0,0]=3 11118 B8R1.3 N[C@H]1CC[C@@H](O)CC1 Amb10071293 [0,1,0,1,0,0|1,0,1]=4 11119 B8R1.3 N[C@H]1CC[C@@H](O)CC1 Amb2684002 [0,1,0,1,0,0|1,0,1]=4 11120 B8R1.3 N[C@H]1CC[C@H](O)CC1 Amb2720456 [0,1,0,1,0,0|1,0,1]=4 11121 B8R1.3 N[C@H]1CC[C@H](O)CC1 Amb9825572 [0,1,0,1,0,0|1,0,1]=4 11122 B8R1.3 O=C1C=CC(O)CC1 Amb28048996 [0,1,0,1,0,0|1,0,1]=4 11123 B8R1.3 O=C1CCC(=O)CC1 Amb6471902 [0,1,0,1,0,0|1,0,1]=4 11124 B8R1.3 O=C1CCC(=O)NC1 Amb15692796 [0,1,0,1,0,0|1,0,1]=4 11125 B8R1.3 O=C1CCC(=O)OC1 Amb26404271 [0,1,0,1,0,0|0,0,1]=3 11126 B8R1.3 O=C1CCC(Br)CC1 Amb28342260 [0,1,0,1,0,0|1,0,0]=3 11127 B8R1.3 O=C1CCC(Cl)CC1 Amb26585218 [0,1,0,1,0,0|1,0,0]=3 11128 B8R1.3 O=C1CCC(F)CC1 Amb20671078 [0,1,0,1,0,0|1,0,0]=3 11129 B8R1.3 O=C1CCC(I)CC1 Amb27232393 [0,1,0,1,0,0|1,0,0]=3 11130 B8R1.3 O=C1CCC(O)CC1 Amb2699831 [0,1,0,1,0,0|1,0,0]=3 11131 B8R1.3 O=C1CCC(O)CN1 Amb10066907 [0,1,0,1,0,0|1,0,0]=3 11132 B8R1.3 O=C1CCC(O)CO1 Amb26345105 [0,1,0,1,0,0|0,0,0]=2 11133 B8R1.3 O=C1CCN(Cl)CC1 Amb27430526 [0,1,0,1,0,0|2,0,0]=4 11134 B8R1.3 O=C1CCS(=O)CC1 Amb2612398 [0,1,0,1,0,0|2,0,0]=4 11135 B8R1.3 O=C1CC[C@@H](O)CN1 Amb2698033 [0,1,0,1,0,0|1,0,0]=3 11136 B8R1.3 O=C1CC[C@H](O)CN1 Amb2698032 [0,1,0,1,0,0|1,0,0]=3 11137 B8R1.3 O=C1COC(=O)CN1 Amb2612815 [0,1,0,1,0,0|1,0,1]=4 11138 B8R1.3 O=C1COC(=O)CO1 Amb2725557 [0,1,0,1,0,0|1,0,1]=4 11139 B8R1.3 O=C1NCC(O)CN1 Amb19516674 [0,1,0,1,0,0|2,0,0]=4 11140 B8R1.3 O=C1NCC(O)CO1 Amb27210928 [0,1,0,1,0,0|1,0,0]=3 11141 B8R1.3 O=S1CCC(Cl)CC1 Amb21988466 [0,1,0,1,0,0|2,0,0]=4 11142 B8R1.3 O=S1CCC(O)CC1 Amb21988465 [0,1,0,1,0,0|2,0,0]=4 11143 B8R1.3 O=S1CCC(S)CC1 Amb32788878 [0,1,0,1,0,0|2,0,0]=4 11144 B8R1.3 OC1=NCC(O)CN1 Amb20001781 [0,1,0,1,0,0|2,0,0]=4 11145 B8R1.3 OC1CCC(Br)CC1 Amb24117124 [0,1,0,1,0,0|1,0,1]=4 11146 B8R1.3 OC1CCC(Cl)CC1 Amb2720844 [0,1,0,1,0,0|1,0,1]=4 11147 B8R1.3 OC1CCC(Cl)CO1 Amb27232820 [0,1,0,1,0,0|0,0,2]=4 11148 B8R1.3 OC1CCC(F)CC1 Amb25698698 [0,1,0,1,0,0|1,0,1]=4 11149 B8R1.3 OC1CCC(O)CC1 Amb2778648 [0,1,0,1,0,0|1,0,1]=4 11150 B8R1.3 OC1CCC(O)OC1 Amb28349930 [0,1,0,1,0,0|0,0,2]=4 11151 B8R1.3 OC1CCC(O)SC1 Amb27472799 [0,1,0,1,0,0|0,1,1]=4 11152 B8R1.3 OC1CCC(S)CC1 Amb27197599 [0,1,0,1,0,0|1,0,1]=4 11153 B8R1.3 O[C@H]1CC[C@@H](F)CC1 Amb25341995 [0,1,0,1,0,0|1,0,1]=4 11154 B8R1.3 O[C@H]1CC[C@@H](O)CC1 Amb33524036 [0,1,0,1,0,0|1,0,1]=4 11155 B8R1.3 O[C@H]1CC[C@H](Cl)CC1 Amb27232988 [0,1,0,1,0,0|1,0,1]=4 11156 B8R1.3 O[C@H]1CC[C@H](O)CC1 Amb22750651 [0,1,0,1,0,0|1,0,1]=4 11157 B8R1.3 O[C@H]1CC[C@H](S)CC1 Amb33524237 [0,1,0,1,0,0|1,0,1]=4 11158 B8R1.5 BrC1=CCCCC1Br Amb25255682 [0,1,0,1,0,0|2,0,0]=4 11159 B8R1.5 BrC1CCCOC1Br Amb17940346 [0,1,0,1,0,0|1,0,1]=4 11160 B8R1.5 C=C1CCCCC1=C Amb8392110 [0,1,0,1,0,0|2,0,0]=4 11161 B8R1.5 C=C1CCCCC1=O Amb18561347 [0,1,0,1,0,0|1,0,0]=3 11162 B8R1.5 C=C1CCCCC1C Amb25203919 [0,1,0,1,0,0|2,0,0]=4 11163 B8R1.5 C=C1CCCCC1Cl Amb27858823 [0,1,0,1,0,0|2,0,0]=4 11164 B8R1.5 C=C1CCCCC1O Amb28316215 [0,1,0,1,0,0|1,0,0]=3 11165 B8R1.5 C=C1CCCC[C@@H]1N Amb27252272 [0,1,0,1,0,0|2,0,0]=4 11166 B8R1.5 C=C1COCCC1=O Amb18063600 [0,1,0,1,0,0|2,0,0]=4 11167 B8R1.5 C=C1NCCCC1F Amb28384341 [0,1,0,1,0,0|2,0,0]=4 11168 B8R1.5 CC1=C(C)CCCC1 Amb4019565 [0,1,0,1,0,0|2,0,0]=4 11169 B8R1.5 CC1=CCCCC1=O Amb15693479 [0,1,0,1,0,0|1,0,1]=4 11170 B8R1.5 CC1=CCCCC1Br Amb27856502 [0,1,0,1,0,0|2,0,0]=4 11171 B8R1.5 CC1=CCCCC1C Amb22489910 [0,1,0,1,0,0|2,0,0]=4 11172 B8R1.5 CC1=CCCCC1Cl Amb28207840 [0,1,0,1,0,0|2,0,0]=4 11173 B8R1.5 CC1=CCCCC1O Amb22365276 [0,1,0,1,0,0|1,0,1]=4 11174 B8R1.5 CC1=NCCCC1=O Amb27803670 [0,1,0,1,0,0|2,0,0]=4 11175 B8R1.5 CC1=NCCOC1=O Amb27623377 [0,1,0,1,0,0|1,0,1]=4 11176 B8R1.5 CC1CCC=CC1=O Amb17593138 [0,1,0,1,0,0|1,0,1]=4 11177 B8R1.5 CC1CCCCC1=O Amb6608749 [0,1,0,1,0,0|1,0,0]=3 11178 B8R1.5 CC1CCCCC1O Amb3940289 [0,1,0,1,0,0|1,0,1]=4 11179 B8R1.5 CC1CCCCN1O Amb28121416 [0,1,0,1,0,0|1,0,1]=4 11180 B8R1.5 CC1CCCN=C1N Amb26551145 [0,1,0,1,0,0|2,0,0]=4 11181 B8R1.5 CC1CCCNC1=O Amb2778949 [0,1,0,1,0,0|1,0,0]=3 11182 B8R1.5 CC1CCCOC1=O Amb26933974 [0,1,0,1,0,0|0,0,0]=2 11183 B8R1.5 CC1CCCOC1O Amb28207170 [0,1,0,1,0,0|0,0,2]=4 11184 B8R1.5 CC1CCNCC1=O Amb28990014 [0,1,0,1,0,0|2,0,0]=4 11185 B8R1.5 CC1CCNCC1=O Amb8388554 [0,1,0,1,0,0|2,0,0]=4 11186 B8R1.5 CC1CCOCC1=O Amb25718285 [0,1,0,1,0,0|2,0,0]=4 11187 B8R1.5 CC1CNCCC1=O Amb19888361 [0,1,0,1,0,0|2,0,0]=4 11188 B8R1.5 CC1CNCCC1=O Amb8393082 [0,1,0,1,0,0|2,0,0]=4 11189 B8R1.5 CC1COCCC1=O Amb21856147 [0,1,0,1,0,0|2,0,0]=4 11190 B8R1.5 CC1CSCCC1=O Amb26404796 [0,1,0,1,0,0|2,0,0]=4 11191 B8R1.5 CC1NCCCC1=O Amb26633057 [0,1,0,1,0,0|2,0,0]=4 11192 B8R1.5 CC1NCCCC1=O Amb32695440 [0,1,0,1,0,0|2,0,0]=4 11193 B8R1.5 CC1NCCNC1=O Amb5846691 [0,1,0,1,0,0|2,0,0]=4 11194 B8R1.5 CC1NCCNC1=O Amb9778910 [0,1,0,1,0,0|2,0,0]=4 11195 B8R1.5 CC1NCCSC1=O Amb27489291 [0,1,0,1,0,0|1,1,0]=4 11196 B8R1.5 CC1OCCCC1=O Amb28048940 [0,1,0,1,0,0|2,0,0]=4 11197 B8R1.5 CC1OCCCC1Br Amb22500038 [0,1,0,1,0,0|1,0,1]=4 11198 B8R1.5 CC1OCCNC1=O Amb19517095 [0,1,0,1,0,0|2,0,0]=4 11199 B8R1.5 CC1SCCCC1=O Amb25989585 [0,1,0,1,0,0|2,0,0]=4 11200 B8R1.5 CC1SCCNC1=O Amb4009235 [0,1,0,1,0,0|2,0,0]=4 11201 B8R1.5 CN1CCCNC1=O Amb10608416 [0,1,0,1,0,0|2,0,0]=4 11202 B8R1.5 CN1CCCNC1=O Amb32665804 [0,1,0,1,0,0|2,0,0]=4 11203 B8R1.5 CN1CCNCC1=O Amb1834069 [0,1,0,1,0,0|2,0,0]=4 11204 B8R1.5 CN1CCNCC1=O Amb6540859 [0,1,0,1,0,0|2,0,0]=4 11205 B8R1.5 CN1CCOCC1=O Amb22301593 [0,1,0,1,0,0|2,0,0]=4 11206 B8R1.5 CN1CNCCC1=O Amb27409650 [0,1,0,1,0,0|2,0,0]=4 11207 B8R1.5 CN1NCCCC1=O Amb18559232 [0,1,0,1,0,0|2,0,0]=4 11208 B8R1.5 C[C@@H]1CCC=CC1=O Amb28316223 [0,1,0,1,0,0|1,0,1]=4 11209 B8R1.5 C[C@@H]1CCCC[C@@H]1O Amb22801473 [0,1,0,1,0,0|1,0,1]=4 11210 B8R1.5 C[C@@H]1CCCC[C@H]1O Amb2780856 [0,1,0,1,0,0|1,0,1]=4 11211 B8R1.5 C[C@@H]1CCCO[C@@H]1O Amb27452063 [0,1,0,1,0,0|0,0,2]=4 11212 B8R1.5 C[C@@H]1NCCNC1=O Amb18203363 [0,1,0,1,0,0|2,0,0]=4 11213 B8R1.5 C[C@@H]1OCCCC1=O Amb28202118 [0,1,0,1,0,0|2,0,0]=4 11214 B8R1.5 C[C@@H]1OCCC[C@H]1Br Amb27444138 [0,1,0,1,0,0|1,0,1]=4 11215 B8R1.5 C[C@@H]1OCCC[C@H]1Cl Amb27453022 [0,1,0,1,0,0|1,0,1]=4 11216 B8R1.5 C[C@@H]1SCCNC1=O Amb34915743 [0,1,0,1,0,0|2,0,0]=4 11217 B8R1.5 C[C@H]1CCC=CC1=O Amb28316171 [0,1,0,1,0,0|1,0,1]=4 11218 B8R1.5 C[C@H]1CCCC[C@@H]1O Amb10842239 [0,1,0,1,0,0|1,0,1]=4 11219 B8R1.5 C[C@H]1CCCNC1=O Amb27648584 [0,1,0,1,0,0|1,0,0]=3 11220 B8R1.5 C[C@H]1CCCO[C@@H]1O Amb27452053 [0,1,0,1,0,0|0,0,2]=4 11221 B8R1.5 C[C@H]1NCCNC1=O Amb22336965 [0,1,0,1,0,0|2,0,0]=4 11222 B8R1.5 C[C@H]1SCCNC1=O Amb27810802 [0,1,0,1,0,0|2,0,0]=4 11223 B8R1.5 ClC1CCCOC1Cl Amb25101518 [0,1,0,1,0,0|1,0,1]=4 11224 B8R1.5 Cl[C@@H]1OCCC[C@H]1Cl Amb27865663 [0,1,0,1,0,0|1,0,1]=4 11225 B8R1.5 FC1=CCCCC1Br Amb28325638 [0,1,0,1,0,0|2,0,0]=4 11226 B8R1.5 F[C@@H]1OCCC[C@@H]1Cl Amb27253582 [0,1,0,1,0,0|1,0,1]=4 11227 B8R1.5 F[C@@H]1OCCC[C@H]1Br Amb27434707 [0,1,0,1,0,0|1,0,1]=4 11228 B8R1.5 NC1=NCCCC1=O Amb28399329 [0,1,0,1,0,0|2,0,0]=4 11229 B8R1.5 NC1=NCCCC1Cl Amb27391114 [0,1,0,1,0,0|2,0,0]=4 11230 B8R1.5 NC1=NCCCC1O Amb27985373 [0,1,0,1,0,0|2,0,0]=4 11231 B8R1.5 NC1CCCC=C1Br Amb27974263 [0,1,0,1,0,0|2,0,0]=4 11232 B8R1.5 NC1CCCC=C1Br Amb33338965 [0,1,0,1,0,0|2,0,0]=4 11233 B8R1.5 NC1CCCC=C1Cl Amb18124341 [0,1,0,1,0,0|2,0,0]=4 11234 B8R1.5 NC1CCCCC1=O Amb17939051 [0,1,0,1,0,0|1,0,0]=3 11235 B8R1.5 NC1CCCCC1=O Amb22001819 [0,1,0,1,0,0|1,0,0]=3 11236 B8R1.5 NC1CCCCC1O Amb22228578 [0,1,0,1,0,0|1,0,1]=4 11237 B8R1.5 NC1CCCCC1O Amb31302362 [0,1,0,1,0,0|1,0,1]=4 11238 B8R1.5 NC1CCCCC1O Amb3428551 [0,1,0,1,0,0|1,0,1]=4 11239 B8R1.5 NC1CCCNC1=O Amb1088746 [0,1,0,1,0,0|1,0,0]=3 11240 B8R1.5 NC1CCCNC1=O Amb8428208 [0,1,0,1,0,0|1,0,0]=3 11241 B8R1.5 NC1CCCOB1O Amb24681060 [0,1,0,1,0,0|1,0,1]=4 11242 B8R1.5 NC1CCCOB1O Amb32668036 [0,1,0,1,0,0|1,0,1]=4 11243 B8R1.5 NC1CCONC1=O Amb22295935 [0,1,0,1,0,0|2,0,0]=4 11244 B8R1.5 NC1CNCCC1=O Amb27635311 [0,1,0,1,0,0|2,0,0]=4 11245 B8R1.5 NC1COCCC1=O Amb18833021 [0,1,0,1,0,0|2,0,0]=4 11246 B8R1.5 NC1COCCC1=O Amb32670691 [0,1,0,1,0,0|2,0,0]=4 11247 B8R1.5 NC1CSCCC1=O Amb4296938 [0,1,0,1,0,0|2,0,0]=4 11248 B8R1.5 NN1CCCCC1=O Amb13952152 [0,1,0,1,0,0|1,0,0]=3 11249 B8R1.5 NN1CCCCC1=O Amb22275946 [0,1,0,1,0,0|1,0,0]=3 11250 B8R1.5 NN1CCCNC1=O Amb25343173 [0,1,0,1,0,0|2,0,0]=4 11251 B8R1.5 NN1CCCOC1=O Amb17608306 [0,1,0,1,0,0|1,0,0]=3 11252 B8R1.5 NN1CCOCC1=O Amb27238452 [0,1,0,1,0,0|2,0,0]=4 11253 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993806 [0,1,0,1,0,0|1,0,1]=4 11254 B8R1.5 N[C@@H]1CCCC[C@@H]1O Amb1993917 [0,1,0,1,0,0|1,0,1]=4 11255 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993805 [0,1,0,1,0,0|1,0,1]=4 11256 B8R1.5 N[C@@H]1CCCC[C@H]1O Amb1993916 [0,1,0,1,0,0|1,0,1]=4 11257 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,1,0,1,0,0|1,0,0]=3 11258 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,1,0,1,0,0|1,0,0]=3 11259 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb19515805 [0,1,0,1,0,0|1,0,1]=4 11260 B8R1.5 N[C@H]1CCCC[C@@H]1O Amb2612694 [0,1,0,1,0,0|1,0,1]=4 11261 B8R1.5 N[C@H]1CCCC[C@H]1O Amb19516016 [0,1,0,1,0,0|1,0,1]=4 11262 B8R1.5 N[C@H]1CCCC[C@H]1O Amb20622436 [0,1,0,1,0,0|1,0,1]=4 11263 B8R1.5 N[C@H]1CCCNC1=O Amb10603272 [0,1,0,1,0,0|1,0,0]=3 11264 B8R1.5 N[C@H]1CCCNC1=O Amb8631316 [0,1,0,1,0,0|1,0,0]=3 11265 B8R1.5 O=C1C=CCCC1Br Amb27477843 [0,1,0,1,0,0|1,0,1]=4 11266 B8R1.5 O=C1C=CCCC1O Amb27165534 [0,1,0,1,0,0|0,0,2]=4 11267 B8R1.5 O=C1CCCC=C1Br Amb10067493 [0,1,0,1,0,0|1,0,1]=4 11268 B8R1.5 O=C1CCCC=C1F Amb28253992 [0,1,0,1,0,0|1,0,1]=4 11269 B8R1.5 O=C1CCCC=C1I Amb10601698 [0,1,0,1,0,0|1,0,1]=4 11270 B8R1.5 O=C1CCCC=C1O Amb2699837 [0,1,0,1,0,0|0,0,1]=3 11271 B8R1.5 O=C1CCCCC1=O Amb1154131 [0,1,0,1,0,0|0,0,1]=3 11272 B8R1.5 O=C1CCCCC1Br Amb8394127 [0,1,0,1,0,0|1,0,0]=3 11273 B8R1.5 O=C1CCCCC1Cl Amb1154371 [0,1,0,1,0,0|1,0,0]=3 11274 B8R1.5 O=C1CCCCC1F Amb10605769 [0,1,0,1,0,0|1,0,0]=3 11275 B8R1.5 O=C1CCCCC1I Amb28239314 [0,1,0,1,0,0|1,0,0]=3 11276 B8R1.5 O=C1CCCCC1O Amb8390042 [0,1,0,1,0,0|0,0,0]=2 11277 B8R1.5 O=C1CCCCC1S Amb25839265 [0,1,0,1,0,0|0,1,0]=3 11278 B8R1.5 O=C1CCCC[C@@H]1F Amb24379012 [0,1,0,1,0,0|1,0,0]=3 11279 B8R1.5 O=C1CCCC[C@@H]1O Amb28316212 [0,1,0,1,0,0|0,0,0]=2 11280 B8R1.5 O=C1CCCC[C@H]1Cl Amb28119800 [0,1,0,1,0,0|1,0,0]=3 11281 B8R1.5 O=C1CCCNC1=O Amb2445649 [0,1,0,1,0,0|1,0,1]=4 11282 B8R1.5 O=C1CCCOC1=O Amb24662237 [0,1,0,1,0,0|0,0,1]=3 11283 B8R1.5 O=C1CCCSC1Cl Amb26534671 [0,1,0,1,0,0|2,0,0]=4 11284 B8R1.5 O=C1CCNCC1Br Amb21520330 [0,1,0,1,0,0|2,0,0]=4 11285 B8R1.5 O=C1CCNCC1F Amb13885958 [0,1,0,1,0,0|2,0,0]=4 11286 B8R1.5 O=C1CCNCC1F Amb22002662 [0,1,0,1,0,0|2,0,0]=4 11287 B8R1.5 O=C1CCNCC1O Amb24075970 [0,1,0,1,0,0|1,0,0]=3 11288 B8R1.5 O=C1CCNCC1O Amb27230548 [0,1,0,1,0,0|1,0,0]=3 11289 B8R1.5 O=C1CCNCN1O Amb24120639 [0,1,0,1,0,0|1,0,0]=3 11290 B8R1.5 O=C1CCNC[C@H]1F Amb27467922 [0,1,0,1,0,0|2,0,0]=4 11291 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,1,0,1,0,0|2,0,0]=4 11292 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,1,0,1,0,0|2,0,0]=4 11293 B8R1.5 O=C1CCOCC1F Amb19958536 [0,1,0,1,0,0|2,0,0]=4 11294 B8R1.5 O=C1CCOCC1O Amb26966688 [0,1,0,1,0,0|1,0,0]=3 11295 B8R1.5 O=C1CCOC[C@@H]1Br Amb26936362 [0,1,0,1,0,0|2,0,0]=4 11296 B8R1.5 O=C1CCOC[C@@H]1F Amb27813369 [0,1,0,1,0,0|2,0,0]=4 11297 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,1,0,1,0,0|2,0,0]=4 11298 B8R1.5 O=C1CCSCC1Br Amb22493812 [0,1,0,1,0,0|2,0,0]=4 11299 B8R1.5 O=C1CCSCC1O Amb27762936 [0,1,0,1,0,0|1,0,0]=3 11300 B8R1.5 O=C1CCSC[C@@H]1O Amb28316128 [0,1,0,1,0,0|1,0,0]=3 11301 B8R1.5 O=C1COCCC1Br Amb24416092 [0,1,0,1,0,0|2,0,0]=4 11302 B8R1.5 O=C1COCCC1F Amb28048950 [0,1,0,1,0,0|2,0,0]=4 11303 B8R1.5 O=C1COCC[C@H]1F Amb27207103 [0,1,0,1,0,0|2,0,0]=4 11304 B8R1.5 O=C1NCCCC1Br Amb33543864 [0,1,0,1,0,0|1,0,0]=3 11305 B8R1.5 O=C1NCCCC1F Amb13888988 [0,1,0,1,0,0|1,0,0]=3 11306 B8R1.5 O=C1NCCCC1O Amb10602315 [0,1,0,1,0,0|1,0,0]=3 11307 B8R1.5 O=C1NCCC[C@@H]1O Amb22226682 [0,1,0,1,0,0|1,0,0]=3 11308 B8R1.5 O=C1NCCC[C@H]1O Amb22225342 [0,1,0,1,0,0|1,0,0]=3 11309 B8R1.5 O=C1NCCOC1=O Amb24120265 [0,1,0,1,0,0|1,0,1]=4 11310 B8R1.5 O=C1NCNCC1Br Amb28060398 [0,1,0,1,0,0|2,0,0]=4 11311 B8R1.5 O=C1NNCCC1Cl Amb26453975 [0,1,0,1,0,0|2,0,0]=4 11312 B8R1.5 O=C1OCC=CC1O Amb27795928 [0,1,0,1,0,0|0,0,2]=4 11313 B8R1.5 O=C1OCCC=C1Br Amb27838412 [0,1,0,1,0,0|0,0,2]=4 11314 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,1,0,1,0,0|0,0,0]=2 11315 B8R1.5 O=C1OCCCC1Cl Amb28195106 [0,1,0,1,0,0|0,0,0]=2 11316 B8R1.5 O=C1OCCCC1O Amb19959000 [0,1,0,1,0,0|0,0,0]=2 11317 B8R1.5 O=C1OCCOC1=O Amb4010211 [0,1,0,1,0,0|1,0,1]=4 11318 B8R1.5 O=C1OCCSC1Br Amb27776793 [0,1,0,1,0,0|1,0,0]=3 11319 B8R1.5 O=C1SCCSC1Cl Amb25026142 [0,1,0,1,0,0|1,1,0]=4 11320 B8R1.5 O=S1CCCCC1Cl Amb27669604 [0,1,0,1,0,0|1,0,1]=4 11321 B8R1.5 O=S1CCCC[C@H]1Cl Amb28343131 [0,1,0,1,0,0|1,0,1]=4 11322 B8R1.5 OC1CCCC=C1Br Amb17594500 [0,1,0,1,0,0|1,0,1]=4 11323 B8R1.5 OC1CCCC=C1Cl Amb27970979 [0,1,0,1,0,0|1,0,1]=4 11324 B8R1.5 OC1CCCCC1Br Amb17594580 [0,1,0,1,0,0|1,0,1]=4 11325 B8R1.5 OC1CCCCC1F Amb28141588 [0,1,0,1,0,0|1,0,1]=4 11326 B8R1.5 OC1CCCCC1I Amb10601565 [0,1,0,1,0,0|1,0,1]=4 11327 B8R1.5 OC1CCCCC1O Amb534699 [0,1,0,1,0,0|0,0,2]=4 11328 B8R1.5 OC1CCCCC1S Amb28061858 [0,1,0,1,0,0|0,1,1]=4 11329 B8R1.5 OC1CCCOC1O Amb27594250 [0,1,0,1,0,0|0,0,2]=4 11330 B8R1.5 O[C@@H]1CCCC=C1Br Amb25687871 [0,1,0,1,0,0|1,0,1]=4 11331 B8R1.5 O[C@@H]1CCCC=C1Cl Amb28067316 [0,1,0,1,0,0|1,0,1]=4 11332 B8R1.5 O[C@@H]1CCCC[C@@H]1Cl Amb8394050 [0,1,0,1,0,0|1,0,1]=4 11333 B8R1.5 O[C@@H]1CCCC[C@H]1Br Amb17940195 [0,1,0,1,0,0|1,0,1]=4 11334 B8R1.5 O[C@@H]1CCCC[C@H]1Cl Amb17844352 [0,1,0,1,0,0|1,0,1]=4 11335 B8R1.5 O[C@@H]1CCCC[C@H]1F Amb10606383 [0,1,0,1,0,0|1,0,1]=4 11336 B8R1.5 O[C@@H]1CCCC[C@H]1O Amb6754065 [0,1,0,1,0,0|0,0,2]=4 11337 B8R1.5 O[C@@H]1CCCC[C@H]1S Amb27205716 [0,1,0,1,0,0|0,1,1]=4 11338 B8R1.5 O[C@@H]1CCCO[C@H]1O Amb27659639 [0,1,0,1,0,0|0,0,2]=4 11339 B8R1.5 O[C@@H]1OCCC[C@@H]1Cl Amb27788417 [0,1,0,1,0,0|0,0,2]=4 11340 B8R1.5 O[C@H]1CCCC=C1Br Amb24505024 [0,1,0,1,0,0|1,0,1]=4 11341 B8R1.5 O[C@H]1CCCC[C@@H]1Cl Amb27420202 [0,1,0,1,0,0|1,0,1]=4 11342 B8R1.5 O[C@H]1CCCC[C@@H]1F Amb26565801 [0,1,0,1,0,0|1,0,1]=4 11343 B8R1.5 O[C@H]1CCCC[C@@H]1O Amb2778553 [0,1,0,1,0,0|0,0,2]=4 11344 B8R1.5 O[C@H]1CCCC[C@H]1Br Amb8394049 [0,1,0,1,0,0|1,0,1]=4 11345 B8R1.5 O[C@H]1CCCC[C@H]1Cl Amb27629800 [0,1,0,1,0,0|1,0,1]=4 11346 B8R1.5 O[C@H]1CCCC[C@H]1O Amb2720739 [0,1,0,1,0,0|0,0,2]=4 11347 B8R1.5 O[C@H]1CCCC[C@H]1S Amb28205526 [0,1,0,1,0,0|0,1,1]=4 11348 B8R1.5 [NH3+][C@@H]1CCCC[C@@H]1O Amb24112952 [0,1,0,1,0,0|1,0,1]=4 11349 B8R1.9 C=C1CC1CCCO Amb27801929 [0,1,0,1,0,0|2,0,0]=4 11350 B8R1.9 CC1OC1CCCBr Amb28383540 [0,1,0,1,0,0|1,0,1]=4 11351 B8R1.9 CC1OC1CCCO Amb28344681 [0,1,0,1,0,0|1,0,1]=4 11352 B8R1.9 CCCCC1OC1O Amb27493204 [0,1,0,1,0,0|0,0,2]=4 11353 B8R1.9 C[C@H]1O[C@@H]1CCCCl Amb27229206 [0,1,0,1,0,0|1,0,1]=4 11354 B8R1.9 C[C@H]1O[C@H]1CCCBr Amb27863536 [0,1,0,1,0,0|1,0,1]=4 11355 B8R1.9 O[C@@H]1C[C@H]1CCCCl Amb27202822 [0,1,0,1,0,0|1,0,1]=4 11356 B8R1.9 O[C@H]1C[C@@H]1CCCCl Amb27428217 [0,1,0,1,0,0|1,0,1]=4 11357 B8R1.13 CCCC1CCC1O Amb24359183 [0,1,0,1,0,0|1,0,1]=4 11358 B8R1.13 CCCC1CNC1=O Amb27413136 [0,1,0,1,0,0|1,0,0]=3 11359 B8R1.13 CCCC1SCC1O Amb27803103 [0,1,0,1,0,0|0,1,1]=4 11360 B8R1.13 COCC1CCC1=O Amb28069700 [0,1,0,1,0,0|2,0,0]=4 11361 B8R1.13 O=C1CCC1CCCl Amb27252476 [0,1,0,1,0,0|2,0,0]=4 11362 B8R1.17 CCCC1SC1CO Amb27751937 [0,1,0,1,0,0|0,1,1]=4 11363 B8R1.17 CCC[C@@H]1C[C@@H]1C=O Amb27841173 [0,1,0,1,0,0|1,0,1]=4 11364 B8R1.17 CCC[C@@H]1C[C@H]1CO Amb24533879 [0,1,0,1,0,0|1,0,1]=4 11365 B8R1.17 CCC[C@@H]1O[C@@H]1C=O Amb28142382 [0,1,0,1,0,0|0,0,1]=3 11366 B8R1.17 CCC[C@@H]1O[C@@H]1CO Amb26564240 [0,1,0,1,0,0|0,0,2]=4 11367 B8R1.17 CCC[C@@H]1O[C@H]1CBr Amb28319242 [0,1,0,1,0,0|1,0,1]=4 11368 B8R1.17 CCC[C@H]1C[C@H]1CO Amb28345377 [0,1,0,1,0,0|1,0,1]=4 11369 B8R1.17 CCC[C@H]1S[C@@H]1CO Amb27977865 [0,1,0,1,0,0|0,1,1]=4 11370 B8R1.17 O=CC1OC1CCBr Amb27657238 [0,1,0,1,0,0|1,0,1]=4 11371 B8R1.22 BrC1=CCCCCC1 Amb10071167 [0,1,0,1,0,0|2,0,0]=4 11372 B8R1.22 C=C1CCCNCC1 Amb30982578 [0,1,0,1,0,0|2,0,0]=4 11373 B8R1.22 C=C1CCCSCC1 Amb35674113 [0,1,0,1,0,0|2,0,0]=4 11374 B8R1.22 C=C1OCCCCO1 Amb22228877 [0,1,0,1,0,0|1,0,0]=3 11375 B8R1.22 CC1=CCCCCC1 Amb22227978 [0,1,0,1,0,0|2,0,0]=4 11376 B8R1.22 CC1CCCCCO1 Amb22364798 [0,1,0,1,0,0|1,0,1]=4 11377 B8R1.22 CC1CCCOCO1 Amb28046311 [0,1,0,1,0,0|1,0,1]=4 11378 B8R1.22 CC1CCNCCO1 Amb26412871 [0,1,0,1,0,0|1,0,1]=4 11379 B8R1.22 CC1CCNCCO1 Amb30585117 [0,1,0,1,0,0|1,0,1]=4 11380 B8R1.22 CC1CNCCCO1 Amb22886427 [0,1,0,1,0,0|1,0,1]=4 11381 B8R1.22 CC1CNCCCO1 Amb9358449 [0,1,0,1,0,0|1,0,1]=4 11382 B8R1.22 CC1OCCCCO1 Amb22731719 [0,1,0,1,0,0|1,0,1]=4 11383 B8R1.22 CN1CCNCCO1 Amb27226764 [0,1,0,1,0,0|2,0,0]=4 11384 B8R1.22 C[C@@H]1CCNCCO1 Amb27624211 [0,1,0,1,0,0|1,0,1]=4 11385 B8R1.22 C[C@H]1CNCCCO1 Amb35752396 [0,1,0,1,0,0|1,0,1]=4 11386 B8R1.22 ClC1CCCCOC1 Amb27409037 [0,1,0,1,0,0|1,0,1]=4 11387 B8R1.22 NC1=NCCCCC1 Amb19514661 [0,1,0,1,0,0|2,0,0]=4 11388 B8R1.22 NC1=NCCCCC1 Amb4451463 [0,1,0,1,0,0|2,0,0]=4 11389 B8R1.22 NC1=NCCCCN1 Amb28119984 [0,1,0,1,0,0|2,0,0]=4 11390 B8R1.22 NC1=NCCCCS1 Amb27592425 [0,1,0,1,0,0|1,1,0]=4 11391 B8R1.22 NC1=NCCCSC1 Amb25688170 [0,1,0,1,0,0|2,0,0]=4 11392 B8R1.22 O=C1C=CCCCC1 Amb10601704 [0,1,0,1,0,0|1,0,0]=3 11393 B8R1.22 O=C1C=CCCCN1 Amb22500450 [0,1,0,1,0,0|1,0,1]=4 11394 B8R1.22 O=C1CC=CCCC1 Amb24450177 [0,1,0,1,0,0|1,0,1]=4 11395 B8R1.22 O=C1CC=CCCN1 Amb27830230 [0,1,0,1,0,0|1,0,1]=4 11396 B8R1.22 O=C1CCC=CCC1 Amb22230447 [0,1,0,1,0,0|1,0,1]=4 11397 B8R1.22 O=C1CCC=COC1 Amb27812549 [0,1,0,1,0,0|0,0,2]=4 11398 B8R1.22 O=C1CCCCCC1 Amb4135729 [0,1,0,1,0,0|1,0,0]=3 11399 B8R1.22 O=C1CCCCCN1 Amb6364991 [0,1,0,1,0,0|1,0,0]=3 11400 B8R1.22 O=C1CCCCCO1 Amb8513719 [0,1,0,1,0,0|0,0,0]=2 11401 B8R1.22 O=C1CCCCCS1 Amb25810807 [0,1,0,1,0,0|0,1,0]=3 11402 B8R1.22 O=C1CCCCC[N-]1 Amb24117486 [0,1,0,1,0,0|1,0,0]=3 11403 B8R1.22 O=C1CCCCNC1 Amb22000936 [0,1,0,1,0,0|1,0,0]=3 11404 B8R1.22 O=C1CCCCNC1 Amb25922210 [0,1,0,1,0,0|1,0,0]=3 11405 B8R1.22 O=C1CCCNCC1 Amb8393630 [0,1,0,1,0,0|1,0,0]=3 11406 B8R1.22 O=C1CCCNCC1 Amb9174228 [0,1,0,1,0,0|1,0,0]=3 11407 B8R1.22 O=C1CCCOCC1 Amb25873789 [0,1,0,1,0,0|1,0,0]=3 11408 B8R1.22 O=C1CCCSCC1 Amb25318842 [0,1,0,1,0,0|1,0,0]=3 11409 B8R1.22 O=C1CCCSCN1 Amb27879423 [0,1,0,1,0,0|1,0,0]=3 11410 B8R1.22 O=C1CCNCCN1 Amb10069937 [0,1,0,1,0,0|1,0,0]=3 11411 B8R1.22 O=C1CCNCCN1 Amb1107713 [0,1,0,1,0,0|1,0,0]=3 11412 B8R1.22 O=C1CCNCCN1 Amb483265 [0,1,0,1,0,0|1,0,0]=3 11413 B8R1.22 O=C1CCNCCO1 Amb27760600 [0,1,0,1,0,0|0,0,0]=2 11414 B8R1.22 O=C1CCNNCC1 Amb28421828 [0,1,0,1,0,0|2,0,0]=4 11415 B8R1.22 O=C1CCOCCN1 Amb13951193 [0,1,0,1,0,0|1,0,0]=3 11416 B8R1.22 O=C1CCOCOC1 Amb27434094 [0,1,0,1,0,0|1,0,0]=3 11417 B8R1.22 O=C1CCSCCN1 Amb21912439 [0,1,0,1,0,0|1,0,0]=3 11418 B8R1.22 O=C1CNCCCN1 Amb22754482 [0,1,0,1,0,0|1,0,0]=3 11419 B8R1.22 O=C1CNCCCN1 Amb6739889 [0,1,0,1,0,0|1,0,0]=3 11420 B8R1.22 O=C1CNCCNC1 Amb30867934 [0,1,0,1,0,0|2,0,0]=4 11421 B8R1.22 O=C1COCCCN1 Amb22371065 [0,1,0,1,0,0|1,0,0]=3 11422 B8R1.22 O=C1COCCOC1 Amb22284314 [0,1,0,1,0,0|1,0,0]=3 11423 B8R1.22 O=C1CSCCSC1 Amb8503291 [0,1,0,1,0,0|1,1,0]=4 11424 B8R1.22 O=C1NCCCCN1 Amb25960043 [0,1,0,1,0,0|1,0,0]=3 11425 B8R1.22 O=C1NCCCCO1 Amb27405440 [0,1,0,1,0,0|0,0,0]=2 11426 B8R1.22 O=C1OCCCCO1 Amb25350626 [0,1,0,1,0,0|0,0,0]=2 11427 B8R1.22 O=S1CCCNCC1 Amb21856414 [0,1,0,1,0,0|2,0,0]=4 11428 B8R1.22 O=S1OCCCCO1 Amb9787325 [0,1,0,1,0,0|1,0,0]=3 11429 B8R1.22 OC1C=CCCCC1 Amb26034783 [0,1,0,1,0,0|1,0,1]=4 11430 B8R1.22 OC1CCCCCC1 Amb3940358 [0,1,0,1,0,0|1,0,1]=4 11431 B8R1.22 OC1CCCCCO1 Amb4034492 [0,1,0,1,0,0|0,0,2]=4 11432 B8R1.22 OC1CCCCCS1 Amb17615898 [0,1,0,1,0,0|0,1,1]=4 11433 B8R1.22 OC1CCCCNC1 Amb22371121 [0,1,0,1,0,0|1,0,1]=4 11434 B8R1.22 OC1CCCCNC1 Amb22886250 [0,1,0,1,0,0|1,0,1]=4 11435 B8R1.22 OC1CCCCOC1 Amb27424901 [0,1,0,1,0,0|0,0,2]=4 11436 B8R1.22 OC1CCCNCC1 Amb19958701 [0,1,0,1,0,0|1,0,1]=4 11437 B8R1.22 OC1CCCNCC1 Amb2695607 [0,1,0,1,0,0|1,0,1]=4 11438 B8R1.22 OC1CCCOCC1 Amb18202762 [0,1,0,1,0,0|1,0,1]=4 11439 B8R1.22 OC1CCCSCC1 Amb18202861 [0,1,0,1,0,0|1,0,1]=4 11440 B8R1.22 OC1OCCCCO1 Amb27197834 [0,1,0,1,0,0|0,0,2]=4 11441 B8R1.22 O[C@@H]1C=CCCCC1 Amb28205998 [0,1,0,1,0,0|1,0,1]=4 11442 B8R1.22 O[C@@H]1CCCCOC1 Amb28125793 [0,1,0,1,0,0|0,0,2]=4 11443 B8R1.22 O[C@H]1CCCOCC1 Amb28058426 [0,1,0,1,0,0|1,0,1]=4 11444 B8R1.22 S=C1CCCCCN1 Amb1935077 [0,1,0,1,0,0|1,1,0]=4 11445 B8R1.22 S=C1NCCCCN1 Amb2724259 [0,1,0,1,0,0|1,1,0]=4 11446 B8R1.38 C#CC(=O)C1CCC1 Amb27390977 [0,1,0,1,0,0|1,0,0]=3 11447 B8R1.38 C#CC(=O)C1CNC1 Amb25062877 [0,1,0,1,0,0|2,0,0]=4 11448 B8R1.38 C#CC(=O)C1CSC1 Amb29863242 [0,1,0,1,0,0|2,0,0]=4 11449 B8R1.38 C#CC(=O)N1CCC1 Amb28078576 [0,1,0,1,0,0|2,0,0]=4 11450 B8R1.38 C=C(C#N)C1CCC1 Amb27488910 [0,1,0,1,0,0|2,0,0]=4 11451 B8R1.38 C=C(CBr)C1CCC1 Amb33334942 [0,1,0,1,0,0|2,0,0]=4 11452 B8R1.38 C=C(CCl)C1CCC1 Amb33256587 [0,1,0,1,0,0|2,0,0]=4 11453 B8R1.38 C=C(CN)C1CCC1 Amb33314107 [0,1,0,1,0,0|2,0,0]=4 11454 B8R1.38 C=CC(=O)C1CCC1 Amb25968097 [0,1,0,1,0,0|1,0,0]=3 11455 B8R1.38 C=CC(=O)C1CNC1 Amb25173599 [0,1,0,1,0,0|2,0,0]=4 11456 B8R1.38 C=CC(=O)C1CSC1 Amb29863243 [0,1,0,1,0,0|2,0,0]=4 11457 B8R1.38 C=CC(=O)N1CCC1 Amb9480630 [0,1,0,1,0,0|2,0,0]=4 11458 B8R1.38 CC(C=O)C1CCC1 Amb25918317 [0,1,0,1,0,0|1,0,1]=4 11459 B8R1.38 CC(CO)C1CCC1 Amb23590277 [0,1,0,1,0,0|1,0,1]=4 11460 B8R1.38 CC(ON)C1CCC1 Amb33314311 [0,1,0,1,0,0|1,0,1]=4 11461 B8R1.38 CCC(=O)C1CCC1 Amb17593163 [0,1,0,1,0,0|1,0,0]=3 11462 B8R1.38 CCC(=O)C1CCO1 Amb28368772 [0,1,0,1,0,0|2,0,0]=4 11463 B8R1.38 CCC(=O)C1CNC1 Amb24366850 [0,1,0,1,0,0|2,0,0]=4 11464 B8R1.38 CCC(=O)C1COC1 Amb30024290 [0,1,0,1,0,0|2,0,0]=4 11465 B8R1.38 CCC(=O)C1CSC1 Amb29863244 [0,1,0,1,0,0|2,0,0]=4 11466 B8R1.38 CCC(O)C1CCC1 Amb26516697 [0,1,0,1,0,0|1,0,1]=4 11467 B8R1.38 CC[C@@H](O)C1CCC1 Amb28048956 [0,1,0,1,0,0|1,0,1]=4 11468 B8R1.38 CN(C=O)C1CCC1 Amb27255546 [0,1,0,1,0,0|2,0,0]=4 11469 B8R1.38 CNC(=O)C1CCC1 Amb22231329 [0,1,0,1,0,0|1,0,0]=3 11470 B8R1.38 CNC(=O)C1CNC1 Amb20061385 [0,1,0,1,0,0|2,0,0]=4 11471 B8R1.38 CNC(=O)C1CNC1 Amb33550683 [0,1,0,1,0,0|2,0,0]=4 11472 B8R1.38 CNC(=O)[C@H]1CCN1 Amb27837634 [0,1,0,1,0,0|2,0,0]=4 11473 B8R1.38 COC(=O)C1=CCC1 Amb24689222 [0,1,0,1,0,0|0,0,2]=4 11474 B8R1.38 COC(=O)C1C=CC1 Amb33715996 [0,1,0,1,0,0|0,0,2]=4 11475 B8R1.38 COC(=O)C1CCC1 Amb6366581 [0,1,0,1,0,0|0,0,0]=2 11476 B8R1.38 COC(=O)C1CCN1 Amb2699142 [0,1,0,1,0,0|1,0,0]=3 11477 B8R1.38 COC(=O)C1CCN1 Amb33544519 [0,1,0,1,0,0|1,0,0]=3 11478 B8R1.38 COC(=O)C1CNC1 Amb10604008 [0,1,0,1,0,0|1,0,0]=3 11479 B8R1.38 COC(=O)C1CNC1 Amb13883580 [0,1,0,1,0,0|1,0,0]=3 11480 B8R1.38 COC(=O)C1COC1 Amb21961760 [0,1,0,1,0,0|1,0,0]=3 11481 B8R1.38 COC(=O)[C@@H]1CCN1 Amb19888362 [0,1,0,1,0,0|1,0,0]=3 11482 B8R1.38 COC(=O)[C@@H]1CCN1 Amb22405994 [0,1,0,1,0,0|1,0,0]=3 11483 B8R1.38 COC(=O)[C@H]1CCN1 Amb22737543 [0,1,0,1,0,0|1,0,0]=3 11484 B8R1.38 COC(=O)[C@H]1CCN1 Amb24694404 [0,1,0,1,0,0|1,0,0]=3 11485 B8R1.38 C\C(=N/O)C1CCC1 Amb27871299 [0,1,0,1,0,0|1,0,0]=3 11486 B8R1.38 N#CC(O)C1CCC1 Amb24747346 [0,1,0,1,0,0|1,0,1]=4 11487 B8R1.38 N=C(NO)C1CCC1 Amb22265719 [0,1,0,1,0,0|1,0,0]=3 11488 B8R1.38 NC(CO)C1CCC1 Amb24077492 [0,1,0,1,0,0|1,0,1]=4 11489 B8R1.38 NC(CO)C1CCC1 Amb33544272 [0,1,0,1,0,0|1,0,1]=4 11490 B8R1.38 NCC(=O)C1CCC1 Amb24524254 [0,1,0,1,0,0|1,0,0]=3 11491 B8R1.38 NCC(=O)C1CCC1 Amb29083365 [0,1,0,1,0,0|1,0,0]=3 11492 B8R1.38 NCC(=O)N1CCC1 Amb22896591 [0,1,0,1,0,0|2,0,0]=4 11493 B8R1.38 NCC(=O)N1CCC1 Amb25167399 [0,1,0,1,0,0|2,0,0]=4 11494 B8R1.38 NCC(O)C1CCC1 Amb27444822 [0,1,0,1,0,0|1,0,1]=4 11495 B8R1.38 NCC(O)C1CCC1 Amb28934862 [0,1,0,1,0,0|1,0,1]=4 11496 B8R1.38 NCN(O)C1CCC1 Amb28256759 [0,1,0,1,0,0|2,0,0]=4 11497 B8R1.38 NC[C@@H](O)C1CCC1 Amb33314122 [0,1,0,1,0,0|1,0,1]=4 11498 B8R1.38 NC[C@H](O)C1CCC1 Amb33314123 [0,1,0,1,0,0|1,0,1]=4 11499 B8R1.38 NNC(=O)C1CCC1 Amb6393395 [0,1,0,1,0,0|1,0,0]=3 11500 B8R1.38 NNC(=O)C1CCN1 Amb27490207 [0,1,0,1,0,0|2,0,0]=4 11501 B8R1.38 NNC(=O)C1CSC1 Amb28436260 [0,1,0,1,0,0|2,0,0]=4 11502 B8R1.38 NNC(=O)[C@H]1CCN1 Amb27604154 [0,1,0,1,0,0|2,0,0]=4 11503 B8R1.38 N[C@@H](CO)C1CCC1 Amb24077485 [0,1,0,1,0,0|1,0,1]=4 11504 B8R1.38 N[C@@H](CO)C1CCC1 Amb27780087 [0,1,0,1,0,0|1,0,1]=4 11505 B8R1.38 N[C@H](CO)C1CCC1 Amb24077520 [0,1,0,1,0,0|1,0,1]=4 11506 B8R1.38 N[C@H](CO)C1CCC1 Amb26018518 [0,1,0,1,0,0|1,0,1]=4 11507 B8R1.38 N\C(=N/O)C1CCC1 Amb33546908 [0,1,0,1,0,0|1,0,0]=3 11508 B8R1.38 N\C(=N/O)C1CSC1 Amb26890692 [0,1,0,1,0,0|2,0,0]=4 11509 B8R1.38 N\C(=N/O)N1CCC1 Amb28453444 [0,1,0,1,0,0|2,0,0]=4 11510 B8R1.38 N\N=C(/N)C1CCC1 Amb2695055 [0,1,0,1,0,0|2,0,0]=4 11511 B8R1.38 O=C(CBr)C1CCC1 Amb20622821 [0,1,0,1,0,0|1,0,0]=3 11512 B8R1.38 O=C(CBr)N1CCC1 Amb8011564 [0,1,0,1,0,0|2,0,0]=4 11513 B8R1.38 O=C(CCl)C1CCC1 Amb26987586 [0,1,0,1,0,0|1,0,0]=3 11514 B8R1.38 O=C(CCl)N1CCC1 Amb418250 [0,1,0,1,0,0|2,0,0]=4 11515 B8R1.38 O=C(CO)C1CCC1 Amb28188903 [0,1,0,1,0,0|0,0,0]=2 11516 B8R1.38 O=C(CO)N1CCC1 Amb9421597 [0,1,0,1,0,0|1,0,0]=3 11517 B8R1.38 O=C(CS)N1CCC1 Amb27663596 [0,1,0,1,0,0|1,1,0]=4 11518 B8R1.38 O=C(NO)C1CCC1 Amb6265921 [0,1,0,1,0,0|0,0,0]=2 11519 B8R1.38 O=C(NO)C1CCN1 Amb27659056 [0,1,0,1,0,0|1,0,0]=3 11520 B8R1.38 O=CC(=O)C1CCC1 Amb28315726 [0,1,0,1,0,0|0,0,1]=3 11521 B8R1.38 O=CC(F)C1CCC1 Amb22011677 [0,1,0,1,0,0|1,0,1]=4 11522 B8R1.38 OC(CBr)C1CCC1 Amb26849805 [0,1,0,1,0,0|1,0,1]=4 11523 B8R1.38 OC(CCl)C1CCC1 Amb33256188 [0,1,0,1,0,0|1,0,1]=4 11524 B8R1.38 OC(CF)C1CCC1 Amb27193238 [0,1,0,1,0,0|1,0,1]=4 11525 B8R1.38 OCC(F)=C1CCC1 Amb32645996 [0,1,0,1,0,0|1,0,1]=4 11526 B8R1.38 OCC(O)C1CCC1 Amb27157763 [0,1,0,1,0,0|0,0,2]=4 11527 B8R1.41 CCCCC1(C)CO1 Amb28397276 [0,1,0,1,0,0|1,0,1]=4 11528 B8R1.41 CCCCC1(O)CC1 Amb26332576 [0,1,0,1,0,0|1,0,1]=4 11529 B8R1.44 CCC1CC1(C)CO Amb27753496 [0,1,0,1,0,0|1,0,1]=4 11530 B8R1.46 C=C1C(=O)N[C@H]1CC Amb27251965 [0,1,0,1,0,0|1,0,1]=4 11531 B8R1.46 CC1C(=O)NC1CO Amb27785549 [0,1,0,1,0,0|2,0,0]=4 11532 B8R1.46 CC[C@@H]1NC(=O)[C@H]1C Amb27188452 [0,1,0,1,0,0|1,0,0]=3 11533 B8R1.46 NC1C(=O)NC1CCl Amb27429760 [0,1,0,1,0,0|2,0,0]=4 11534 B8R1.46 NC1C(=O)NC1CO Amb27985586 [0,1,0,1,0,0|2,0,0]=4 11535 B8R1.46 N[C@@H]1C(=O)N[C@@H]1CO Amb28058411 [0,1,0,1,0,0|2,0,0]=4 11536 B8R1.46 O=C1CC(CO)C1F Amb27973059 [0,1,0,1,0,0|2,0,0]=4 11537 B8R1.46 O=C1C[C@H](CO)N1O Amb27833657 [0,1,0,1,0,0|1,0,0]=3 11538 B8R1.46 O=C1O[C@H](CO)[C@H]1O Amb27659903 [0,1,0,1,0,0|1,0,0]=3 11539 B8R1.47 CCC1CC(CO)C1 Amb23537746 [0,1,0,1,0,0|1,0,1]=4 11540 B8R1.47 CCC1CN(C=O)C1 Amb35587890 [0,1,0,1,0,0|2,0,0]=4 11541 B8R1.47 COC1CC(=NO)C1 Amb27881086 [0,1,0,1,0,0|2,0,0]=4 11542 B8R1.47 OCC1CC(=NO)C1 Amb23570500 [0,1,0,1,0,0|2,0,0]=4 11543 B8R1.50 C=C1C(=O)CCC1C Amb27199153 [0,1,0,1,0,0|1,0,0]=3 11544 B8R1.50 C=C1CCN(C)C1=O Amb24457267 [0,1,0,1,0,0|2,0,0]=4 11545 B8R1.50 CC1=C(Br)C(=O)CC1 Amb10067495 [0,1,0,1,0,0|1,0,1]=4 11546 B8R1.50 CC1=C(C)C(=O)CC1 Amb22351730 [0,1,0,1,0,0|1,0,1]=4 11547 B8R1.50 CC1=C(C)C(C)CC1 Amb25725570 [0,1,0,1,0,0|2,0,0]=4 11548 B8R1.50 CC1=C(O)C(=O)CC1 Amb4004294 [0,1,0,1,0,0|0,0,1]=3 11549 B8R1.50 CC1=C(O)C(=O)CO1 Amb8386149 [0,1,0,1,0,0|1,0,1]=4 11550 B8R1.50 CC1=C(O)C(=O)CS1 Amb27273133 [0,1,0,1,0,0|1,0,1]=4 11551 B8R1.50 CC1=C(O)C(=O)OC1 Amb23571854 [0,1,0,1,0,0|1,0,1]=4 11552 B8R1.50 CC1=C(O)C(=O)SC1 Amb24638526 [0,1,0,1,0,0|1,0,1]=4 11553 B8R1.50 CC1=CCC(=O)C1O Amb27828885 [0,1,0,1,0,0|0,0,2]=4 11554 B8R1.50 CC1=CCC(C)C1=O Amb17778666 [0,1,0,1,0,0|1,0,1]=4 11555 B8R1.50 CC1C(=O)CCN1C Amb24453852 [0,1,0,1,0,0|2,0,0]=4 11556 B8R1.50 CC1CCC(=O)C1=O Amb4477353 [0,1,0,1,0,0|0,0,1]=3 11557 B8R1.50 CC1CCC(=O)C1C Amb27485174 [0,1,0,1,0,0|1,0,0]=3 11558 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,1,0,1,0,0|1,0,0]=3 11559 B8R1.50 CC1CCC(=O)N1C Amb15693449 [0,1,0,1,0,0|1,0,0]=3 11560 B8R1.50 CC1CCC(C)C1=O Amb27198252 [0,1,0,1,0,0|1,0,1]=4 11561 B8R1.50 CC1CCC(C)C1O Amb24447767 [0,1,0,1,0,0|1,0,1]=4 11562 B8R1.50 CC1CCC(F)C1=O Amb32656355 [0,1,0,1,0,0|1,0,1]=4 11563 B8R1.50 CC1CCC(N)C1O Amb27595668 [0,1,0,1,0,0|1,0,1]=4 11564 B8R1.50 CC1CCC(O)C1N Amb26505400 [0,1,0,1,0,0|1,0,1]=4 11565 B8R1.50 CC1CCC(O)C1O Amb4016376 [0,1,0,1,0,0|0,0,2]=4 11566 B8R1.50 CC1CCN(C)C1=O Amb10068267 [0,1,0,1,0,0|2,0,0]=4 11567 B8R1.50 CC1CC[C@H](O)[C@@H]1O Amb27185469 [0,1,0,1,0,0|0,0,2]=4 11568 B8R1.50 CC1CN=C(O)N1C Amb27853518 [0,1,0,1,0,0|2,0,0]=4 11569 B8R1.50 CC1CNC(=O)C1C Amb24334186 [0,1,0,1,0,0|2,0,0]=4 11570 B8R1.50 CC1CNC(=O)N1Cl Amb27759555 [0,1,0,1,0,0|2,0,0]=4 11571 B8R1.50 CC1COC(=O)C1=O Amb27262699 [0,1,0,1,0,0|1,0,1]=4 11572 B8R1.50 CC1COC(=O)C1Br Amb27401963 [0,1,0,1,0,0|2,0,0]=4 11573 B8R1.50 CC1NCC(=O)N1C Amb24742108 [0,1,0,1,0,0|2,0,0]=4 11574 B8R1.50 CC1NCN(O)C1=O Amb28251778 [0,1,0,1,0,0|2,0,0]=4 11575 B8R1.50 CC1OCC(=O)C1C Amb29866230 [0,1,0,1,0,0|2,0,0]=4 11576 B8R1.50 CC1OCC(=O)C1O Amb28131956 [0,1,0,1,0,0|1,0,0]=3 11577 B8R1.50 CC1OCC(O)C1=O Amb28048942 [0,1,0,1,0,0|1,0,1]=4 11578 B8R1.50 CN1C(=O)CCC1O Amb17615583 [0,1,0,1,0,0|2,0,0]=4 11579 B8R1.50 CN1CCC(=O)C1=O Amb24183817 [0,1,0,1,0,0|1,0,1]=4 11580 B8R1.50 CN1CCC(O)C1=O Amb20622738 [0,1,0,1,0,0|1,0,1]=4 11581 B8R1.50 C[C@@H]1C(=O)CCN1C Amb18833064 [0,1,0,1,0,0|2,0,0]=4 11582 B8R1.50 C[C@@H]1C(=O)CC[C@@H]1O Amb28253966 [0,1,0,1,0,0|2,0,0]=4 11583 B8R1.50 C[C@@H]1CC[C@@H](O)[C@@H]1C Amb27978369 [0,1,0,1,0,0|1,0,1]=4 11584 B8R1.50 C[C@@H]1CNC(=O)[C@@H]1N Amb27488737 [0,1,0,1,0,0|2,0,0]=4 11585 B8R1.50 C[C@@H]1CNC(=O)[C@H]1C Amb27437481 [0,1,0,1,0,0|2,0,0]=4 11586 B8R1.50 C[C@@H]1CNC(=S)[C@H]1O Amb27494768 [0,1,0,1,0,0|1,1,0]=4 11587 B8R1.50 C[C@@H]1COC(=O)[C@@H]1C Amb28411565 [0,1,0,1,0,0|2,0,0]=4 11588 B8R1.50 C[C@H]1CC[C@H](C)C1=O Amb27434148 [0,1,0,1,0,0|1,0,1]=4 11589 B8R1.50 C[C@H]1CC[C@H](O)[C@@H]1C Amb27224813 [0,1,0,1,0,0|1,0,1]=4 11590 B8R1.50 C[C@H]1CC[C@H](O)[C@@H]1N Amb28132647 [0,1,0,1,0,0|1,0,1]=4 11591 B8R1.50 C[C@H]1CC[C@H](O)[C@H]1C Amb27420260 [0,1,0,1,0,0|1,0,1]=4 11592 B8R1.50 C[C@H]1CNC(=O)[C@@H]1C Amb27783966 [0,1,0,1,0,0|2,0,0]=4 11593 B8R1.50 NC1CCN(O)C1=O Amb8631273 [0,1,0,1,0,0|2,0,0]=4 11594 B8R1.50 N[C@@H]1CCN(O)C1=O Amb22362895 [0,1,0,1,0,0|2,0,0]=4 11595 B8R1.50 N[C@H]1CCN(O)C1=O Amb25345964 [0,1,0,1,0,0|2,0,0]=4 11596 B8R1.50 O=C1CCC(=O)C1O Amb24443990 [0,1,0,1,0,0|1,0,1]=4 11597 B8R1.50 O=C1CCC(=O)N1O Amb1152089 [0,1,0,1,0,0|1,0,1]=4 11598 B8R1.50 O=C1CCC(Br)=C1O Amb24677469 [0,1,0,1,0,0|1,0,1]=4 11599 B8R1.50 O=C1CCC(Cl)=C1O Amb28316155 [0,1,0,1,0,0|1,0,1]=4 11600 B8R1.50 O=C1CCC(F)C1Br Amb27875964 [0,1,0,1,0,0|2,0,0]=4 11601 B8R1.50 O=C1CCC(O)=C1O Amb17593179 [0,1,0,1,0,0|1,0,1]=4 11602 B8R1.50 O=C1CCC(O)N1O Amb27214701 [0,1,0,1,0,0|1,0,0]=3 11603 B8R1.50 O=C1CC[C@H](O)[C@@H]1O Amb28253888 [0,1,0,1,0,0|1,0,0]=3 11604 B8R1.50 O=C1NCC(O)C1O Amb27813982 [0,1,0,1,0,0|2,0,0]=4 11605 B8R1.50 O=C1OCC(O)C1O Amb22730078 [0,1,0,1,0,0|2,0,0]=4 11606 B8R1.50 O=C1OC[C@@H](O)[C@@H]1O Amb24609731 [0,1,0,1,0,0|2,0,0]=4 11607 B8R1.50 O=C1OC[C@@H](O)[C@H]1O Amb8515014 [0,1,0,1,0,0|2,0,0]=4 11608 B8R1.50 O=C1OC[C@H](O)[C@@H]1O Amb27440225 [0,1,0,1,0,0|2,0,0]=4 11609 B8R1.50 O=C1OC[C@H](O)[C@H]1O Amb15692412 [0,1,0,1,0,0|2,0,0]=4 11610 B8R1.52 C#CC1(O)CCCC1 Amb1058765 [0,1,0,1,0,0|1,0,1]=4 11611 B8R1.52 C=CC1(O)CCCC1 Amb24483275 [0,1,0,1,0,0|1,0,1]=4 11612 B8R1.52 CC1(C=O)CCCC1 Amb18641706 [0,1,0,1,0,0|1,0,1]=4 11613 B8R1.52 CC1(CO)CCCC1 Amb33547610 [0,1,0,1,0,0|1,0,1]=4 11614 B8R1.52 CCC1(O)CCCC1 Amb4016460 [0,1,0,1,0,0|1,0,1]=4 11615 B8R1.52 N#CC1(O)CCCC1 Amb8471053 [0,1,0,1,0,0|1,0,1]=4 11616 B8R1.52 NC1(CO)CCCC1 Amb2236186 [0,1,0,1,0,0|1,0,1]=4 11617 B8R1.52 NC1(CO)CCCC1 Amb2695458 [0,1,0,1,0,0|1,0,1]=4 11618 B8R1.52 NCC1(O)CCCC1 Amb1108087 [0,1,0,1,0,0|1,0,1]=4 11619 B8R1.52 NCC1(O)CCCC1 Amb6892837 [0,1,0,1,0,0|1,0,1]=4 11620 B8R1.52 NNC1(O)CCCC1 Amb27882712 [0,1,0,1,0,0|1,0,1]=4 11621 B8R1.52 O=CC1(Br)CCCC1 Amb25758600 [0,1,0,1,0,0|1,0,1]=4 11622 B8R1.52 O=CC1(Cl)CCCC1 Amb35788343 [0,1,0,1,0,0|1,0,1]=4 11623 B8R1.52 O=CC1(F)CCCC1 Amb27948601 [0,1,0,1,0,0|1,0,1]=4 11624 B8R1.52 O=CC1(O)CCCC1 Amb18124253 [0,1,0,1,0,0|0,0,1]=3 11625 B8R1.52 OC1(CBr)CCCC1 Amb26649510 [0,1,0,1,0,0|1,0,1]=4 11626 B8R1.52 OC1(CCl)CCCC1 Amb27422898 [0,1,0,1,0,0|1,0,1]=4 11627 B8R1.52 OC1(CI)CCCC1 Amb26493976 [0,1,0,1,0,0|1,0,1]=4 11628 B8R1.52 OCC1(F)CCCC1 Amb26586261 [0,1,0,1,0,0|1,0,1]=4 11629 B8R1.52 OCC1(O)CCCC1 Amb33547838 [0,1,0,1,0,0|0,0,2]=4 11630 B8R1.58 CC1CCC1(O)CO Amb28049315 [0,1,0,1,0,0|0,0,2]=4 11631 B8R1.6 C=C1CC(CCO)C1 Amb33328881 [0,1,0,1,0,0|2,0,0]=4 11632 B8R1.6 C=CCC1CC(=O)N1 Amb24453069 [0,1,0,1,0,0|1,0,1]=4 11633 B8R1.6 CCCC1CC(=O)C1 Amb27398824 [0,1,0,1,0,0|1,0,0]=3 11634 B8R1.6 CCCC1CC(=O)N1 Amb26494598 [0,1,0,1,0,0|1,0,0]=3 11635 B8R1.6 CCCC1CC(O)C1 Amb27252902 [0,1,0,1,0,0|1,0,1]=4 11636 B8R1.6 CCCC1CC(O)S1 Amb28139454 [0,1,0,1,0,0|0,1,1]=4 11637 B8R1.6 CCCN1CC(O)C1 Amb25747214 [0,1,0,1,0,0|1,0,1]=4 11638 B8R1.6 CCCN1CC(O)C1 Amb34164272 [0,1,0,1,0,0|1,0,1]=4 11639 B8R1.6 CCC[C@H]1CC(=O)N1 Amb27184591 [0,1,0,1,0,0|1,0,0]=3 11640 B8R1.6 CCNC1CC(O)C1 Amb32410243 [0,1,0,1,0,0|1,0,1]=4 11641 B8R1.6 CCNC1CS(=O)C1 Amb32794922 [0,1,0,1,0,0|2,0,0]=4 11642 B8R1.6 CCOC1CC(=O)C1 Amb33530910 [0,1,0,1,0,0|1,0,0]=3 11643 B8R1.6 CCOC1CC(O)C1 Amb25079645 [0,1,0,1,0,0|1,0,1]=4 11644 B8R1.6 CCO[C@H]1C[C@@H](O)C1 Amb28131607 [0,1,0,1,0,0|1,0,1]=4 11645 B8R1.6 CCO[C@H]1C[C@H](O)C1 Amb24482985 [0,1,0,1,0,0|1,0,1]=4 11646 B8R1.6 CCSC1CC(O)C1 Amb32753230 [0,1,0,1,0,0|1,0,1]=4 11647 B8R1.6 CCS[C@H]1C[C@@H](O)C1 Amb32674536 [0,1,0,1,0,0|1,0,1]=4 11648 B8R1.6 CNCC1CC(O)C1 Amb25732572 [0,1,0,1,0,0|1,0,1]=4 11649 B8R1.6 CNC[C@H]1C[C@@H](O)C1 Amb22831752 [0,1,0,1,0,0|1,0,1]=4 11650 B8R1.6 COCC1CC(=O)C1 Amb25771052 [0,1,0,1,0,0|1,0,0]=3 11651 B8R1.6 COCC1CC(O)C1 Amb32679362 [0,1,0,1,0,0|1,0,1]=4 11652 B8R1.6 N#CCC1CC(=O)C1 Amb30869389 [0,1,0,1,0,0|1,0,1]=4 11653 B8R1.6 N#CCC1CC(=O)N1 Amb27630655 [0,1,0,1,0,0|1,0,1]=4 11654 B8R1.6 NCCC1CC(O)C1 Amb24715768 [0,1,0,1,0,0|1,0,1]=4 11655 B8R1.6 NCCC1CC(O)C1 Amb28934909 [0,1,0,1,0,0|1,0,1]=4 11656 B8R1.6 NCC[C@H]1C[C@@H](O)C1 Amb30526926 [0,1,0,1,0,0|1,0,1]=4 11657 B8R1.6 NCC[C@H]1C[C@H](O)C1 Amb30526899 [0,1,0,1,0,0|1,0,1]=4 11658 B8R1.6 O=C1CC(CCBr)C1 Amb28385574 [0,1,0,1,0,0|1,0,0]=3 11659 B8R1.6 O=C1CC(CCBr)N1 Amb28255540 [0,1,0,1,0,0|1,0,0]=3 11660 B8R1.6 O=C1CC(CCCl)C1 Amb27832893 [0,1,0,1,0,0|1,0,0]=3 11661 B8R1.6 O=C1CC(CCO)N1 Amb27467326 [0,1,0,1,0,0|1,0,0]=3 11662 B8R1.6 O=C1C[C@@H](CCO)N1 Amb27838874 [0,1,0,1,0,0|1,0,0]=3 11663 B8R1.6 O=CC[C@@H]1CC(=O)N1 Amb27402326 [0,1,0,1,0,0|1,0,1]=4 11664 B8R1.7 C=C(C)C1CCCC1 Amb26515703 [0,1,0,1,0,0|2,0,0]=4 11665 B8R1.7 C=C(C)C1CCCN1 Amb23536664 [0,1,0,1,0,0|2,0,0]=4 11666 B8R1.7 C=C(C)C1CCNC1 Amb27460933 [0,1,0,1,0,0|2,0,0]=4 11667 B8R1.7 C=C(C)[C@@H]1CCCN1 Amb28186967 [0,1,0,1,0,0|2,0,0]=4 11668 B8R1.7 CC(=O)C1=CCCC1 Amb22338190 [0,1,0,1,0,0|1,0,1]=4 11669 B8R1.7 CC(=O)C1CCC=N1 Amb22496787 [0,1,0,1,0,0|1,0,1]=4 11670 B8R1.7 CC(=O)C1CCCC1 Amb2612425 [0,1,0,1,0,0|1,0,0]=3 11671 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [0,1,0,1,0,0|1,0,0]=3 11672 B8R1.7 CC(=O)C1CCCN1 Amb33870768 [0,1,0,1,0,0|1,0,0]=3 11673 B8R1.7 CC(=O)C1CCCO1 Amb23590167 [0,1,0,1,0,0|1,0,0]=3 11674 B8R1.7 CC(=O)C1CCCS1 Amb27838322 [0,1,0,1,0,0|1,0,0]=3 11675 B8R1.7 CC(=O)C1CCNC1 Amb18833067 [0,1,0,1,0,0|1,0,0]=3 11676 B8R1.7 CC(=O)C1CCNC1 Amb22899078 [0,1,0,1,0,0|1,0,0]=3 11677 B8R1.7 CC(=O)C1CCOC1 Amb18833038 [0,1,0,1,0,0|1,0,0]=3 11678 B8R1.7 CC(=O)C1CCSC1 Amb27412975 [0,1,0,1,0,0|1,0,0]=3 11679 B8R1.7 CC(=O)C1NCCS1 Amb22757393 [0,1,0,1,0,0|2,0,0]=4 11680 B8R1.7 CC(=O)C1OCCO1 Amb24053150 [0,1,0,1,0,0|2,0,0]=4 11681 B8R1.7 CC(=O)C1OCCS1 Amb27262730 [0,1,0,1,0,0|2,0,0]=4 11682 B8R1.7 CC(=O)N1CCCC1 Amb3358093 [0,1,0,1,0,0|1,0,0]=3 11683 B8R1.7 CC(=O)N1CCNC1 Amb27795361 [0,1,0,1,0,0|2,0,0]=4 11684 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb27170693 [0,1,0,1,0,0|1,0,0]=3 11685 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb31291120 [0,1,0,1,0,0|1,0,0]=3 11686 B8R1.7 CC(=O)[C@@H]1CCCO1 Amb22746525 [0,1,0,1,0,0|1,0,0]=3 11687 B8R1.7 CC(=O)[C@@H]1CCNC1 Amb30039124 [0,1,0,1,0,0|1,0,0]=3 11688 B8R1.7 CC(=O)[C@H]1CCCN1 Amb27453624 [0,1,0,1,0,0|1,0,0]=3 11689 B8R1.7 CC(=O)[C@H]1CCCO1 Amb25173839 [0,1,0,1,0,0|1,0,0]=3 11690 B8R1.7 CC(=O)[C@H]1CCNC1 Amb33132071 [0,1,0,1,0,0|1,0,0]=3 11691 B8R1.7 CC(O)C1CCCC1 Amb32409773 [0,1,0,1,0,0|1,0,1]=4 11692 B8R1.7 CC(O)C1CCCC1 Amb4035956 [0,1,0,1,0,0|1,0,1]=4 11693 B8R1.7 CC(O)C1CCCN1 Amb17231822 [0,1,0,1,0,0|1,0,1]=4 11694 B8R1.7 CC(O)C1CCCO1 Amb26319231 [0,1,0,1,0,0|1,0,1]=4 11695 B8R1.7 CC(O)C1CCNC1 Amb22886901 [0,1,0,1,0,0|1,0,1]=4 11696 B8R1.7 CC(O)C1CCNC1 Amb9782643 [0,1,0,1,0,0|1,0,1]=4 11697 B8R1.7 CC(O)C1CCOC1 Amb20623722 [0,1,0,1,0,0|1,0,1]=4 11698 B8R1.7 CC(O)N1CCCC1 Amb27650167 [0,1,0,1,0,0|1,0,1]=4 11699 B8R1.7 CC(O)[C@@H]1CCCN1 Amb24685154 [0,1,0,1,0,0|1,0,1]=4 11700 B8R1.7 CC(O)[C@@H]1CCNC1 Amb35603308 [0,1,0,1,0,0|1,0,1]=4 11701 B8R1.7 CC(O)[C@H]1CCCN1 Amb26394098 [0,1,0,1,0,0|1,0,1]=4 11702 B8R1.7 CC(O)[C@H]1CCNC1 Amb35662397 [0,1,0,1,0,0|1,0,1]=4 11703 B8R1.7 CS(=O)C1CCCC1 Amb28049298 [0,1,0,1,0,0|2,0,0]=4 11704 B8R1.7 C[C@@H](O)C1CCCC1 Amb19515558 [0,1,0,1,0,0|1,0,1]=4 11705 B8R1.7 C[C@@H](O)C1CCCO1 Amb26854223 [0,1,0,1,0,0|1,0,1]=4 11706 B8R1.7 C[C@@H](O)C1CCCS1 Amb33416214 [0,1,0,1,0,0|1,0,1]=4 11707 B8R1.7 C[C@@H](O)C1CCOC1 Amb25724373 [0,1,0,1,0,0|1,0,1]=4 11708 B8R1.7 C[C@@H](O)C1CCSC1 Amb33141336 [0,1,0,1,0,0|1,0,1]=4 11709 B8R1.7 C[C@H](O)C1CCCC1 Amb25842291 [0,1,0,1,0,0|1,0,1]=4 11710 B8R1.7 C[C@H](O)C1CCCO1 Amb25985121 [0,1,0,1,0,0|1,0,1]=4 11711 B8R1.7 C[C@H](O)C1CCCS1 Amb33416213 [0,1,0,1,0,0|1,0,1]=4 11712 B8R1.7 C[C@H](O)C1CCNC1 Amb27264787 [0,1,0,1,0,0|1,0,1]=4 11713 B8R1.7 C[C@H](O)C1CCOC1 Amb24365203 [0,1,0,1,0,0|1,0,1]=4 11714 B8R1.7 C[C@H](O)C1CCSC1 Amb33141325 [0,1,0,1,0,0|1,0,1]=4 11715 B8R1.7 C[C@H](O)[C@H]1CCCO1 Amb26563465 [0,1,0,1,0,0|1,0,1]=4 11716 B8R1.7 FC(Br)=C1CCCC1 Amb32993482 [0,1,0,1,0,0|2,0,0]=4 11717 B8R1.7 N=C(N)C1CCCC1 Amb2695059 [0,1,0,1,0,0|2,0,0]=4 11718 B8R1.7 N=C(N)C1CCCC1 Amb8630086 [0,1,0,1,0,0|2,0,0]=4 11719 B8R1.7 N=C(N)C1CCCN1 Amb24549144 [0,1,0,1,0,0|2,0,0]=4 11720 B8R1.7 N=C(N)C1CCCN1 Amb32718817 [0,1,0,1,0,0|2,0,0]=4 11721 B8R1.7 N=C(N)C1CCCO1 Amb22059430 [0,1,0,1,0,0|2,0,0]=4 11722 B8R1.7 N=C(N)C1CCCO1 Amb28934896 [0,1,0,1,0,0|2,0,0]=4 11723 B8R1.7 N=C(N)C1CCCS1 Amb24470321 [0,1,0,1,0,0|2,0,0]=4 11724 B8R1.7 N=C(N)C1CCNC1 Amb17934233 [0,1,0,1,0,0|2,0,0]=4 11725 B8R1.7 N=C(N)C1CCNC1 Amb24502578 [0,1,0,1,0,0|2,0,0]=4 11726 B8R1.7 N=C(N)C1CCNC1 Amb30585137 [0,1,0,1,0,0|2,0,0]=4 11727 B8R1.7 N=C(N)C1CCOC1 Amb28249322 [0,1,0,1,0,0|2,0,0]=4 11728 B8R1.7 N=C(N)C1CCOC1 Amb32434758 [0,1,0,1,0,0|2,0,0]=4 11729 B8R1.7 N=C(N)C1CCOC1 Amb33533170 [0,1,0,1,0,0|2,0,0]=4 11730 B8R1.7 N=C(N)C1CCSC1 Amb29849405 [0,1,0,1,0,0|2,0,0]=4 11731 B8R1.7 N=C(N)N1CCCC1 Amb2079636 [0,1,0,1,0,0|2,0,0]=4 11732 B8R1.7 N=C(N)N1CCCC1 Amb22736590 [0,1,0,1,0,0|2,0,0]=4 11733 B8R1.7 N=C(N)N1CCCC1 Amb2724397 [0,1,0,1,0,0|2,0,0]=4 11734 B8R1.7 N=C(N)N1CCCC1 Amb3429818 [0,1,0,1,0,0|2,0,0]=4 11735 B8R1.7 N=C(N)N1CCCC1 Amb453141 [0,1,0,1,0,0|2,0,0]=4 11736 B8R1.7 NC(=O)C1=CCCC1 Amb20622488 [0,1,0,1,0,0|1,0,1]=4 11737 B8R1.7 NC(=O)C1C=CCC1 Amb25063981 [0,1,0,1,0,0|1,0,1]=4 11738 B8R1.7 NC(=O)C1CC=CC1 Amb10068010 [0,1,0,1,0,0|1,0,1]=4 11739 B8R1.7 NC(=O)C1CCCC1 Amb8858372 [0,1,0,1,0,0|1,0,0]=3 11740 B8R1.7 NC(=O)C1CCCN1 Amb2720282 [0,1,0,1,0,0|1,0,0]=3 11741 B8R1.7 NC(=O)C1CCCN1 Amb9724672 [0,1,0,1,0,0|1,0,0]=3 11742 B8R1.7 NC(=O)C1CCCO1 Amb33545693 [0,1,0,1,0,0|1,0,0]=3 11743 B8R1.7 NC(=O)C1CCNC1 Amb19373271 [0,1,0,1,0,0|1,0,0]=3 11744 B8R1.7 NC(=O)C1CCNC1 Amb9728548 [0,1,0,1,0,0|1,0,0]=3 11745 B8R1.7 NC(=O)C1CCOC1 Amb9677690 [0,1,0,1,0,0|1,0,0]=3 11746 B8R1.7 NC(=O)C1CSCN1 Amb2967256 [0,1,0,1,0,0|2,0,0]=4 11747 B8R1.7 NC(=O)C1NCCS1 Amb27655014 [0,1,0,1,0,0|2,0,0]=4 11748 B8R1.7 NC(=O)N1CCCC1 Amb1107229 [0,1,0,1,0,0|1,0,0]=3 11749 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [0,1,0,1,0,0|1,0,0]=3 11750 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb2690398 [0,1,0,1,0,0|1,0,0]=3 11751 B8R1.7 NC(=O)[C@@H]1CCCO1 Amb4166303 [0,1,0,1,0,0|1,0,0]=3 11752 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb20671394 [0,1,0,1,0,0|1,0,0]=3 11753 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb22405894 [0,1,0,1,0,0|1,0,0]=3 11754 B8R1.7 NC(=O)[C@@H]1CCOC1 Amb27413583 [0,1,0,1,0,0|1,0,0]=3 11755 B8R1.7 NC(=O)[C@@H]1COCN1 Amb27194677 [0,1,0,1,0,0|2,0,0]=4 11756 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [0,1,0,1,0,0|1,0,0]=3 11757 B8R1.7 NC(=O)[C@H]1CCCN1 Amb2690397 [0,1,0,1,0,0|1,0,0]=3 11758 B8R1.7 NC(=O)[C@H]1CCNC1 Amb20671395 [0,1,0,1,0,0|1,0,0]=3 11759 B8R1.7 NC(=O)[C@H]1CCNC1 Amb22405893 [0,1,0,1,0,0|1,0,0]=3 11760 B8R1.7 NC(=O)[C@H]1CCOC1 Amb33228699 [0,1,0,1,0,0|1,0,0]=3 11761 B8R1.7 NC(=O)[C@H]1CNCO1 Amb27838356 [0,1,0,1,0,0|2,0,0]=4 11762 B8R1.7 NC(=O)[C@H]1CNCS1 Amb27488571 [0,1,0,1,0,0|2,0,0]=4 11763 B8R1.7 NC(=S)C1CCCC1 Amb6245625 [0,1,0,1,0,0|1,1,0]=4 11764 B8R1.7 NC(=S)C1CCCN1 Amb19148043 [0,1,0,1,0,0|1,1,0]=4 11765 B8R1.7 NC(=S)C1CCCO1 Amb18108094 [0,1,0,1,0,0|1,1,0]=4 11766 B8R1.7 NC(=S)C1CCCS1 Amb26896532 [0,1,0,1,0,0|1,1,0]=4 11767 B8R1.7 NC(=S)C1CCNC1 Amb35605372 [0,1,0,1,0,0|1,1,0]=4 11768 B8R1.7 NC(=S)C1CCOC1 Amb9704089 [0,1,0,1,0,0|1,1,0]=4 11769 B8R1.7 NC(=S)C1CCSC1 Amb30011189 [0,1,0,1,0,0|1,1,0]=4 11770 B8R1.7 NC(=S)N1CCCC1 Amb405550 [0,1,0,1,0,0|1,1,0]=4 11771 B8R1.7 NC(=S)[C@@H]1CCCN1 Amb24588473 [0,1,0,1,0,0|1,1,0]=4 11772 B8R1.7 NC(=S)[C@H]1CCCN1 Amb24469314 [0,1,0,1,0,0|1,1,0]=4 11773 B8R1.7 NC(=[NH2+])N1CCCC1 Amb22269903 [0,1,0,1,0,0|2,0,0]=4 11774 B8R1.7 NC(=[NH2+])N1CCCC1 Amb9799909 [0,1,0,1,0,0|2,0,0]=4 11775 B8R1.7 NS(=O)C1CCCC1 Amb26405101 [0,1,0,1,0,0|2,0,0]=4 11776 B8R1.7 NS(=O)C1CCOC1 Amb32720361 [0,1,0,1,0,0|2,0,0]=4 11777 B8R1.7 O=C(Br)C1CCCC1 Amb27793826 [0,1,0,1,0,0|1,0,0]=3 11778 B8R1.7 O=C(Cl)C1=CCCC1 Amb25870845 [0,1,0,1,0,0|1,0,1]=4 11779 B8R1.7 O=C(Cl)C1CC=CC1 Amb24371090 [0,1,0,1,0,0|1,0,1]=4 11780 B8R1.7 O=C(Cl)C1CCCC1 Amb3939172 [0,1,0,1,0,0|1,0,0]=3 11781 B8R1.7 O=C(Cl)C1CCCN1 Amb27258805 [0,1,0,1,0,0|1,0,0]=3 11782 B8R1.7 O=C(Cl)C1CCCO1 Amb5747111 [0,1,0,1,0,0|1,0,0]=3 11783 B8R1.7 O=C(Cl)C1CCCS1 Amb25189766 [0,1,0,1,0,0|1,0,0]=3 11784 B8R1.7 O=C(Cl)C1CCNC1 Amb28316213 [0,1,0,1,0,0|1,0,0]=3 11785 B8R1.7 O=C(Cl)C1CCOC1 Amb9677595 [0,1,0,1,0,0|1,0,0]=3 11786 B8R1.7 O=C(Cl)C1CCSC1 Amb27778382 [0,1,0,1,0,0|1,0,0]=3 11787 B8R1.7 O=C(Cl)C1CSCN1 Amb17142875 [0,1,0,1,0,0|2,0,0]=4 11788 B8R1.7 O=C(Cl)N1CCCC1 Amb8516771 [0,1,0,1,0,0|1,0,0]=3 11789 B8R1.7 O=C(Cl)N1CCOC1 Amb32863956 [0,1,0,1,0,0|2,0,0]=4 11790 B8R1.7 O=C(Cl)[C@@H]1CCCN1 Amb28313801 [0,1,0,1,0,0|1,0,0]=3 11791 B8R1.7 O=C(O)C1=CCCC1 Amb3940288 [0,1,0,1,0,0|0,0,1]=3 11792 B8R1.7 O=C(O)C1=CCCN1 Amb17593173 [0,1,0,1,0,0|0,0,2]=4 11793 B8R1.7 O=C(O)C1=CCCO1 Amb19148920 [0,1,0,1,0,0|0,0,2]=4 11794 B8R1.7 O=C(O)C1=CCCS1 Amb18642795 [0,1,0,1,0,0|0,0,2]=4 11795 B8R1.7 O=C(O)C1=CCNC1 Amb26017269 [0,1,0,1,0,0|0,0,2]=4 11796 B8R1.7 O=C(O)C1=CCOC1 Amb24434391 [0,1,0,1,0,0|0,0,2]=4 11797 B8R1.7 O=C(O)C1=CCSC1 Amb18642797 [0,1,0,1,0,0|0,0,2]=4 11798 B8R1.7 O=C(O)C1=COCC1 Amb18124248 [0,1,0,1,0,0|0,0,2]=4 11799 B8R1.7 O=C(O)C1=NCCN1 Amb27787520 [0,1,0,1,0,0|1,0,1]=4 11800 B8R1.7 O=C(O)C1=NOCC1 Amb24353499 [0,1,0,1,0,0|1,0,1]=4 11801 B8R1.7 O=C(O)C1C=CCC1 Amb18641680 [0,1,0,1,0,0|0,0,1]=3 11802 B8R1.7 O=C(O)C1C=CCN1 Amb22899488 [0,1,0,1,0,0|0,0,2]=4 11803 B8R1.7 O=C(O)C1C=CCN1 Amb9804432 [0,1,0,1,0,0|0,0,2]=4 11804 B8R1.7 O=C(O)C1C=CCO1 Amb18641762 [0,1,0,1,0,0|0,0,2]=4 11805 B8R1.7 O=C(O)C1CC=CC1 Amb2694750 [0,1,0,1,0,0|0,0,1]=3 11806 B8R1.7 O=C(O)C1CC=NN1 Amb18641765 [0,1,0,1,0,0|1,0,1]=4 11807 B8R1.7 O=C(O)C1CC=NO1 Amb27216537 [0,1,0,1,0,0|1,0,1]=4 11808 B8R1.7 O=C(O)C1CCC=N1 Amb27849168 [0,1,0,1,0,0|0,0,1]=3 11809 B8R1.7 O=C(O)C1CCCC1 Amb3939849 [0,1,0,1,0,0|0,0,0]=2 11810 B8R1.7 O=C(O)C1CCCN1 Amb1157517 [0,1,0,1,0,0|0,0,0]=2 11811 B8R1.7 O=C(O)C1CCCN1 Amb22040086 [0,1,0,1,0,0|0,0,0]=2 11812 B8R1.7 O=C(O)C1CCCO1 Amb9702828 [0,1,0,1,0,0|0,0,0]=2 11813 B8R1.7 O=C(O)C1CCCS1 Amb18124363 [0,1,0,1,0,0|0,0,0]=2 11814 B8R1.7 O=C(O)C1CCNC1 Amb16230724 [0,1,0,1,0,0|0,0,0]=2 11815 B8R1.7 O=C(O)C1CCNC1 Amb16233446 [0,1,0,1,0,0|0,0,0]=2 11816 B8R1.7 O=C(O)C1CCNC1 Amb2694866 [0,1,0,1,0,0|0,0,0]=2 11817 B8R1.7 O=C(O)C1CCNO1 Amb28205451 [0,1,0,1,0,0|1,0,0]=3 11818 B8R1.7 O=C(O)C1CCNO1 Amb33329025 [0,1,0,1,0,0|1,0,0]=3 11819 B8R1.7 O=C(O)C1CCOC1 Amb33542759 [0,1,0,1,0,0|0,0,0]=2 11820 B8R1.7 O=C(O)C1CCSC1 Amb18124360 [0,1,0,1,0,0|0,0,0]=2 11821 B8R1.7 O=C(O)C1CCSS1 Amb8388097 [0,1,0,1,0,0|1,0,0]=3 11822 B8R1.7 O=C(O)C1CNCN1 Amb27597638 [0,1,0,1,0,0|1,0,0]=3 11823 B8R1.7 O=C(O)C1COC=N1 Amb28291372 [0,1,0,1,0,0|1,0,1]=4 11824 B8R1.7 O=C(O)C1COCN1 Amb2694915 [0,1,0,1,0,0|1,0,0]=3 11825 B8R1.7 O=C(O)C1COCN1 Amb2696354 [0,1,0,1,0,0|1,0,0]=3 11826 B8R1.7 O=C(O)C1COCO1 Amb27810510 [0,1,0,1,0,0|1,0,0]=3 11827 B8R1.7 O=C(O)C1CSCN1 Amb532947 [0,1,0,1,0,0|1,0,0]=3 11828 B8R1.7 O=C(O)C1CSSC1 Amb17593735 [0,1,0,1,0,0|1,0,0]=3 11829 B8R1.7 O=C(O)C1NCCS1 Amb2444644 [0,1,0,1,0,0|1,0,0]=3 11830 B8R1.7 O=C(O)C1OCCO1 Amb24349582 [0,1,0,1,0,0|1,0,0]=3 11831 B8R1.7 O=C(O)C1SCCS1 Amb20669087 [0,1,0,1,0,0|1,0,0]=3 11832 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb16183937 [0,1,0,1,0,0|0,0,2]=4 11833 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb22750611 [0,1,0,1,0,0|0,0,2]=4 11834 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb3940757 [0,1,0,1,0,0|0,0,0]=2 11835 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb6754105 [0,1,0,1,0,0|0,0,0]=2 11836 B8R1.7 O=C(O)[C@@H]1CCCO1 Amb3940908 [0,1,0,1,0,0|0,0,0]=2 11837 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb6893875 [0,1,0,1,0,0|0,0,0]=2 11838 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb8630322 [0,1,0,1,0,0|0,0,0]=2 11839 B8R1.7 O=C(O)[C@@H]1CCOC1 Amb10603235 [0,1,0,1,0,0|0,0,0]=2 11840 B8R1.7 O=C(O)[C@@H]1CCON1 Amb26919409 [0,1,0,1,0,0|1,0,0]=3 11841 B8R1.7 O=C(O)[C@@H]1COCN1 Amb19515958 [0,1,0,1,0,0|1,0,0]=3 11842 B8R1.7 O=C(O)[C@@H]1CSC=N1 Amb35648199 [0,1,0,1,0,0|1,0,1]=4 11843 B8R1.7 O=C(O)[C@@H]1CSCN1 Amb3940400 [0,1,0,1,0,0|1,0,0]=3 11844 B8R1.7 O=C(O)[C@H]1C=CCC1 Amb27872028 [0,1,0,1,0,0|0,0,1]=3 11845 B8R1.7 O=C(O)[C@H]1C=CCN1 Amb34158387 [0,1,0,1,0,0|0,0,2]=4 11846 B8R1.7 O=C(O)[C@H]1CCC=N1 Amb28128325 [0,1,0,1,0,0|0,0,1]=3 11847 B8R1.7 O=C(O)[C@H]1CCCN1 Amb2720569 [0,1,0,1,0,0|0,0,0]=2 11848 B8R1.7 O=C(O)[C@H]1CCCO1 Amb3941554 [0,1,0,1,0,0|0,0,0]=2 11849 B8R1.7 O=C(O)[C@H]1CCNC1 Amb2700058 [0,1,0,1,0,0|0,0,0]=2 11850 B8R1.7 O=C(O)[C@H]1CCNC1 Amb6893874 [0,1,0,1,0,0|0,0,0]=2 11851 B8R1.7 O=C(O)[C@H]1CCOC1 Amb22226787 [0,1,0,1,0,0|0,0,0]=2 11852 B8R1.7 O=C(O)[C@H]1CCSC1 Amb28241390 [0,1,0,1,0,0|0,0,0]=2 11853 B8R1.7 O=C(O)[C@H]1CNCS1 Amb27414077 [0,1,0,1,0,0|1,0,0]=3 11854 B8R1.7 O=C(O)[C@H]1CSC=N1 Amb35641724 [0,1,0,1,0,0|1,0,1]=4 11855 B8R1.7 O=C(O)[C@H]1CSCN1 Amb544887 [0,1,0,1,0,0|1,0,0]=3 11856 B8R1.7 O=C(O)[C@H]1NCCS1 Amb25920370 [0,1,0,1,0,0|1,0,0]=3 11857 B8R1.7 O=C(S)C1CCCO1 Amb27827519 [0,1,0,1,0,0|0,1,0]=3 11858 B8R1.7 O=C(S)[C@@H]1CCCN1 Amb27468669 [0,1,0,1,0,0|0,1,0]=3 11859 B8R1.7 O=C(S)[C@@H]1CCCO1 Amb24117867 [0,1,0,1,0,0|0,1,0]=3 11860 B8R1.7 O=C([O-])C1CCC=N1 Amb33624430 [0,1,0,1,0,0|0,0,2]=4 11861 B8R1.7 O=C([O-])[C@@H]1CCCN1 Amb34160472 [0,1,0,1,0,0|0,0,1]=3 11862 B8R1.7 O=S(Cl)C1CCCC1 Amb25914787 [0,1,0,1,0,0|2,0,0]=4 11863 B8R1.7 O=S(Cl)C1CCOC1 Amb32720381 [0,1,0,1,0,0|2,0,0]=4 11864 B8R1.7 O=S(O)C1NCCN1 Amb27846291 [0,1,0,1,0,0|2,0,0]=4 11865 B8R1.7 O=S([O-])C1CCCC1 Amb26419894 [0,1,0,1,0,0|1,0,1]=4 11866 B8R1.7 O=S([O-])C1CCOC1 Amb32754091 [0,1,0,1,0,0|1,0,1]=4 11867 B8R1.7 O=[N+]([O-])C1CCCC1 Amb8517343 [0,1,0,1,0,0|1,0,1]=4 11868 B8R1.7 O=[N+]([O-])C1CCOC1 Amb32992809 [0,1,0,1,0,0|1,0,1]=4 11869 B8R1.7 O=[N+]([O-])C1CCSC1 Amb33299031 [0,1,0,1,0,0|1,0,1]=4 11870 B8R1.7 O=[PH](O)C1CCCN1 Amb27450678 [0,1,0,1,0,0|1,0,0]=3 11871 B8R1.7 OB(O)C1CCCC1 Amb2447144 [0,1,0,1,0,0|1,0,1]=4 11872 B8R1.7 OB(O)C1CCCO1 Amb24317356 [0,1,0,1,0,0|1,0,1]=4 11873 B8R1.7 OB(O)C1CCNC1 Amb22490638 [0,1,0,1,0,0|1,0,1]=4 11874 B8R1.7 OB(O)[C@H]1CCOC1 Amb28249089 [0,1,0,1,0,0|1,0,1]=4 11875 B8R1.7 OC(O)[C@H]1CCCN1 Amb27836006 [0,1,0,1,0,0|0,0,2]=4 11876 B8R1.7 S=C(S)N1CCCC1 Amb391421 [0,1,0,1,0,0|0,2,0]=4 11877 B8R1.7 S=C([S-])N1CCCC1 Amb15741178 [0,1,0,1,0,0|0,2,0]=4 11878 B8R1.7 S=C([S-])N1CCCC1 Amb6357434 [0,1,0,1,0,0|0,2,0]=4 11879 B8R1.19 CC1(O)CCCC1N Amb22295747 [0,1,0,1,0,0|1,0,1]=4 11880 B8R1.19 CC1(O)CCCC1N Amb32674775 [0,1,0,1,0,0|1,0,1]=4 11881 B8R1.19 CC1CCCC1(C)O Amb28318222 [0,1,0,1,0,0|1,0,1]=4 11882 B8R1.19 CC1CCCS1(=O)=O Amb2797231 [0,1,0,1,0,0|1,0,1]=4 11883 B8R1.19 CC1CCNS1(=O)=O Amb33298956 [0,1,0,1,0,0|1,0,1]=4 11884 B8R1.19 CN1CCCS1(=O)=O Amb19959571 [0,1,0,1,0,0|1,0,1]=4 11885 B8R1.19 C[C@@H]1COC[C@]1(C)O Amb22886885 [0,1,0,1,0,0|1,0,1]=4 11886 B8R1.19 C[C@@]1(O)CCC[C@@H]1O Amb27207789 [0,1,0,1,0,0|1,0,1]=4 11887 B8R1.19 C[C@@]1(O)CCC[C@H]1O Amb27437196 [0,1,0,1,0,0|1,0,1]=4 11888 B8R1.19 C[C@]1(O)CCC[C@@H]1N Amb28059560 [0,1,0,1,0,0|1,0,1]=4 11889 B8R1.19 NC1CCCS1(=O)=O Amb27421871 [0,1,0,1,0,0|1,0,1]=4 11890 B8R1.27 CC1(O)CC1CCO Amb27588888 [0,1,0,1,0,0|1,0,1]=4 11891 B8R1.35 C=C(Br)CNC1CC1 Amb18969560 [0,1,0,1,0,0|2,0,0]=4 11892 B8R1.35 C=C(C)CNC1CC1 Amb17317871 [0,1,0,1,0,0|2,0,0]=4 11893 B8R1.35 C=C(Cl)CNC1CC1 Amb18969181 [0,1,0,1,0,0|2,0,0]=4 11894 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [0,1,0,1,0,0|1,0,0]=3 11895 B8R1.35 CC(=O)CCC1CO1 Amb28388031 [0,1,0,1,0,0|1,0,0]=3 11896 B8R1.35 CC(=O)CNC1CC1 Amb27831542 [0,1,0,1,0,0|1,0,0]=3 11897 B8R1.35 CC(=O)NCC1CC1 Amb2782861 [0,1,0,1,0,0|1,0,0]=3 11898 B8R1.35 CC(=O)NCC1CO1 Amb23557281 [0,1,0,1,0,0|2,0,0]=4 11899 B8R1.35 CC(=O)NC[C@@H]1CO1 Amb27871512 [0,1,0,1,0,0|2,0,0]=4 11900 B8R1.35 CC(=O)NC[C@H]1CO1 Amb25068125 [0,1,0,1,0,0|2,0,0]=4 11901 B8R1.35 CC(=O)OCC1CO1 Amb10789133 [0,1,0,1,0,0|2,0,0]=4 11902 B8R1.35 CC(=O)OC[C@@H]1CO1 Amb27391694 [0,1,0,1,0,0|2,0,0]=4 11903 B8R1.35 CC(=O)\C=C\C1CC1 Amb32955627 [0,1,0,1,0,0|1,0,1]=4 11904 B8R1.35 CC(C)CCC1CO1 Amb26899468 [0,1,0,1,0,0|1,0,1]=4 11905 B8R1.35 CC(O)CCC1CC1 Amb25733792 [0,1,0,1,0,0|1,0,1]=4 11906 B8R1.35 CC(O)CNC1CC1 Amb17138364 [0,1,0,1,0,0|1,0,1]=4 11907 B8R1.35 CN(O)CCC1CC1 Amb33361504 [0,1,0,1,0,0|2,0,0]=4 11908 B8R1.35 CS(=O)CCC1CO1 Amb27837563 [0,1,0,1,0,0|2,0,0]=4 11909 B8R1.35 C[C@@H](O)CCC1CC1 Amb24693085 [0,1,0,1,0,0|1,0,1]=4 11910 B8R1.35 C[C@@H](O)CNC1CC1 Amb25083354 [0,1,0,1,0,0|1,0,1]=4 11911 B8R1.35 C[C@H](O)CCC1CC1 Amb25025020 [0,1,0,1,0,0|1,0,1]=4 11912 B8R1.35 C[C@H](O)CNC1CC1 Amb25694355 [0,1,0,1,0,0|1,0,1]=4 11913 B8R1.35 N=C(N)CCC1CC1 Amb26607260 [0,1,0,1,0,0|2,0,0]=4 11914 B8R1.35 N=C(N)NCC1CC1 Amb19748557 [0,1,0,1,0,0|2,0,0]=4 11915 B8R1.35 N=C(N)OCC1CC1 Amb27430108 [0,1,0,1,0,0|2,0,0]=4 11916 B8R1.35 N=C(N)SCC1CC1 Amb24364813 [0,1,0,1,0,0|2,0,0]=4 11917 B8R1.35 N=C(N)SCC1CC1 Amb3428823 [0,1,0,1,0,0|2,0,0]=4 11918 B8R1.35 NC(=O)CCC1CC1 Amb28066625 [0,1,0,1,0,0|1,0,0]=3 11919 B8R1.35 NC(=O)CCC1CO1 Amb28252693 [0,1,0,1,0,0|1,0,0]=3 11920 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,1,0,1,0,0|1,0,0]=3 11921 B8R1.35 NC(=O)CNC1CC1 Amb6246049 [0,1,0,1,0,0|1,0,0]=3 11922 B8R1.35 NC(=O)NCC1CC1 Amb1138798 [0,1,0,1,0,0|1,0,0]=3 11923 B8R1.35 NC(=O)OCC1CC1 Amb27668381 [0,1,0,1,0,0|1,0,0]=3 11924 B8R1.35 NC(=O)\C=C/C1CC1 Amb27422387 [0,1,0,1,0,0|1,0,1]=4 11925 B8R1.35 NC(=S)CCC1CC1 Amb24483097 [0,1,0,1,0,0|1,1,0]=4 11926 B8R1.35 NC(=S)NCC1CC1 Amb2725385 [0,1,0,1,0,0|1,1,0]=4 11927 B8R1.35 NS(=O)CCC1CC1 Amb32720477 [0,1,0,1,0,0|2,0,0]=4 11928 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [0,1,0,1,0,0|1,0,0]=3 11929 B8R1.35 O=C(Cl)NCC1CC1 Amb27410108 [0,1,0,1,0,0|1,0,0]=3 11930 B8R1.35 O=C(Cl)OCC1CC1 Amb33528888 [0,1,0,1,0,0|1,0,0]=3 11931 B8R1.35 O=C(O)C#CC1CC1 Amb1036650 [0,1,0,1,0,0|0,0,1]=3 11932 B8R1.35 O=C(O)CCC1=CC1 Amb28364765 [0,1,0,1,0,0|0,0,1]=3 11933 B8R1.35 O=C(O)CCC1CC1 Amb2686667 [0,1,0,1,0,0|0,0,0]=2 11934 B8R1.35 O=C(O)CCC1CO1 Amb27667995 [0,1,0,1,0,0|0,0,0]=2 11935 B8R1.35 O=C(O)CNC1CC1 Amb7766401 [0,1,0,1,0,0|0,0,0]=2 11936 B8R1.35 O=C(O)CNC1CC1 Amb9677481 [0,1,0,1,0,0|0,0,0]=2 11937 B8R1.35 O=C(O)COC1CC1 Amb27214838 [0,1,0,1,0,0|0,0,0]=2 11938 B8R1.35 O=C(O)CSC1CC1 Amb6760620 [0,1,0,1,0,0|0,0,0]=2 11939 B8R1.35 O=C(O)\C=C/C1CC1 Amb28247513 [0,1,0,1,0,0|0,0,1]=3 11940 B8R1.35 O=C(O)\C=C\C1CC1 Amb18285135 [0,1,0,1,0,0|0,0,1]=3 11941 B8R1.35 O=C(O)\C=C\C1CC1 Amb33714766 [0,1,0,1,0,0|0,0,1]=3 11942 B8R1.35 O=C(O)\C=C\C1CO1 Amb24548089 [0,1,0,1,0,0|0,0,2]=4 11943 B8R1.35 O=S(Cl)CCC1CC1 Amb26910502 [0,1,0,1,0,0|2,0,0]=4 11944 B8R1.35 O=S([O-])CCC1CC1 Amb25212503 [0,1,0,1,0,0|1,0,1]=4 11945 B8R1.35 O=[N+]([O-])CCC1CC1 Amb33429105 [0,1,0,1,0,0|1,0,1]=4 11946 B8R1.35 OB(O)CCC1CC1 Amb26515786 [0,1,0,1,0,0|1,0,1]=4 11947 B8R1.36 BrCCCCC1CO1 Amb16234127 [0,1,0,1,0,0|1,0,1]=4 11948 B8R1.36 CCCCCC1CO1 Amb19892425 [0,1,0,1,0,0|1,0,1]=4 11949 B8R1.36 CCCCC[C@@H]1CO1 Amb27862379 [0,1,0,1,0,0|1,0,1]=4 11950 B8R1.36 CCOCCC1CO1 Amb25679046 [0,1,0,1,0,0|1,0,1]=4 11951 B8R1.36 CCSCCC1CO1 Amb26575735 [0,1,0,1,0,0|1,0,1]=4 11952 B8R1.36 COCCCC1CO1 Amb24676522 [0,1,0,1,0,0|1,0,1]=4 11953 B8R1.36 CSCCCC1CO1 Amb24687956 [0,1,0,1,0,0|1,0,1]=4 11954 B8R1.36 ClCCCCC1CO1 Amb25727648 [0,1,0,1,0,0|1,0,1]=4 11955 B8R1.36 OCCCCC1CO1 Amb28410478 [0,1,0,1,0,0|1,0,1]=4 11956 B8R1.36 OCCCC[C@H]1CO1 Amb28206206 [0,1,0,1,0,0|1,0,1]=4 11957 B8R1.48 NCC1CCS1(=O)=O Amb28249163 [0,1,0,1,0,0|1,0,1]=4 11958 B8R1.48 NCC1CCS1(=O)=O Amb33329372 [0,1,0,1,0,0|1,0,1]=4 11959 B8R1.48 O=S1(=O)CCC1CO Amb25178802 [0,1,0,1,0,0|1,0,1]=4 11960 B8R1.72 CC1(C)CCCCO1 Amb28048681 [0,1,0,1,0,0|1,0,1]=4 11961 B8R1.72 CC1(O)CCCCC1 Amb8513249 [0,1,0,1,0,0|1,0,1]=4 11962 B8R1.72 CC1(O)CCCNC1 Amb10607739 [0,1,0,1,0,0|1,0,1]=4 11963 B8R1.72 CC1(O)CCCNC1 Amb22491963 [0,1,0,1,0,0|1,0,1]=4 11964 B8R1.72 CC1(O)CCCOC1 Amb20668932 [0,1,0,1,0,0|1,0,1]=4 11965 B8R1.72 CC1(O)CCCSC1 Amb29857705 [0,1,0,1,0,0|1,0,1]=4 11966 B8R1.72 CC1(O)CCNCC1 Amb18943983 [0,1,0,1,0,0|1,0,1]=4 11967 B8R1.72 CC1(O)CCNCC1 Amb19515938 [0,1,0,1,0,0|1,0,1]=4 11968 B8R1.72 CC1(O)CCOCC1 Amb19957780 [0,1,0,1,0,0|1,0,1]=4 11969 B8R1.72 CC1(O)CCSCC1 Amb24672466 [0,1,0,1,0,0|1,0,1]=4 11970 B8R1.72 CP1(=O)CCNCC1 Amb24715796 [0,1,0,1,0,0|2,0,0]=4 11971 B8R1.72 CP1(=O)CCNCC1 Amb32675162 [0,1,0,1,0,0|2,0,0]=4 11972 B8R1.72 C[C@]1(O)CCCNC1 Amb27470163 [0,1,0,1,0,0|1,0,1]=4 11973 B8R1.72 N=S1(=O)CCCCC1 Amb25258608 [0,1,0,1,0,0|2,0,0]=4 11974 B8R1.72 N=S1(=O)CCNCC1 Amb27652837 [0,1,0,1,0,0|2,0,0]=4 11975 B8R1.72 N=S1(=O)CCNCC1 Amb31308374 [0,1,0,1,0,0|2,0,0]=4 11976 B8R1.72 N=S1(=O)CCOCC1 Amb33543895 [0,1,0,1,0,0|2,0,0]=4 11977 B8R1.72 O=P1(O)CCNCC1 Amb28398023 [0,1,0,1,0,0|1,0,0]=3 11978 B8R1.72 O=P1(O)OCCCO1 Amb27881859 [0,1,0,1,0,0|2,0,0]=4 11979 B8R1.72 O=S1(=O)CCCCN1 Amb10068561 [0,1,0,1,0,0|1,0,1]=4 11980 B8R1.72 O=S1(=O)CCCCO1 Amb6608747 [0,1,0,1,0,0|1,0,0]=3 11981 B8R1.72 O=S1(=O)CCCNC1 Amb27838312 [0,1,0,1,0,0|1,0,1]=4 11982 B8R1.72 O=S1(=O)CCCNC1 Amb32670599 [0,1,0,1,0,0|1,0,1]=4 11983 B8R1.72 O=S1(=O)CCNCC1 Amb1102302 [0,1,0,1,0,0|1,0,1]=4 11984 B8R1.72 O=S1(=O)CCNCC1 Amb6307180 [0,1,0,1,0,0|1,0,1]=4 11985 B8R1.72 O=S1(=O)CCOCC1 Amb2779436 [0,1,0,1,0,0|1,0,1]=4 11986 B8R1.72 O=S1(=O)NCCCO1 Amb33098585 [0,1,0,1,0,0|2,0,0]=4 11987 B8R1.72 O=S1(=O)OCCCO1 Amb22233116 [0,1,0,1,0,0|2,0,0]=4 11988 B8R1.72 OC1(O)CCNCC1 Amb10789293 [0,1,0,1,0,0|0,0,2]=4 11989 B8R1.72 OC1(O)CCNCC1 Amb17619443 [0,1,0,1,0,0|0,0,2]=4 11990 B8R1.72 OC1(O)CCNCC1 Amb2720275 [0,1,0,1,0,0|0,0,2]=4 11991 B8R1.23 C=C(C)C1CC(=O)N1 Amb27858929 [0,1,0,1,0,0|1,0,1]=4 11992 B8R1.23 C=C(C)[C@@H]1CC(=O)N1 Amb28251769 [0,1,0,1,0,0|1,0,1]=4 11993 B8R1.23 C=C1CC(C(=O)Cl)C1 Amb10071441 [0,1,0,1,0,0|1,0,1]=4 11994 B8R1.23 C=C1CC(C(=O)O)C1 Amb613197 [0,1,0,1,0,0|0,0,1]=3 11995 B8R1.23 C=C1CC(C(C)=O)C1 Amb26547728 [0,1,0,1,0,0|1,0,1]=4 11996 B8R1.23 C=C1CC(C(N)=O)C1 Amb22896664 [0,1,0,1,0,0|1,0,1]=4 11997 B8R1.23 CC(=O)C1=CC(C)C1 Amb27802162 [0,1,0,1,0,0|1,0,1]=4 11998 B8R1.23 CC(=O)C1C=C(C)C1 Amb24676939 [0,1,0,1,0,0|1,0,1]=4 11999 B8R1.23 CC(=O)C1CC(=N)C1 Amb27636166 [0,1,0,1,0,0|1,0,1]=4 12000 B8R1.23 CC(=O)C1CC(C)C1 Amb23590280 [0,1,0,1,0,0|1,0,0]=3 12001 B8R1.23 CC(=O)C1CC(N)C1 Amb29880102 [0,1,0,1,0,0|1,0,0]=3 12002 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,1,0,1,0,0|1,0,0]=3 12003 B8R1.23 CC(=O)N1CC(N)C1 Amb19329932 [0,1,0,1,0,0|2,0,0]=4 12004 B8R1.23 CC(=O)N1CC(N)C1 Amb22406088 [0,1,0,1,0,0|2,0,0]=4 12005 B8R1.23 CC(=O)N1CC(N)C1 Amb33339040 [0,1,0,1,0,0|2,0,0]=4 12006 B8R1.23 CC(=O)N1CC(O)C1 Amb17935746 [0,1,0,1,0,0|2,0,0]=4 12007 B8R1.23 CC(=O)N1CC(S)C1 Amb27433776 [0,1,0,1,0,0|2,0,0]=4 12008 B8R1.23 CC(=O)[C@H]1C[C@@H](C)C1 Amb28253646 [0,1,0,1,0,0|1,0,0]=3 12009 B8R1.23 CC(C)C1=CC(=O)C1 Amb27948687 [0,1,0,1,0,0|1,0,1]=4 12010 B8R1.23 CC(C)C1CC(=O)C1 Amb25806486 [0,1,0,1,0,0|1,0,0]=3 12011 B8R1.23 CC(C)C1CC(=O)N1 Amb26450589 [0,1,0,1,0,0|1,0,0]=3 12012 B8R1.23 CC(C)[C@@H]1CC(=O)N1 Amb28363876 [0,1,0,1,0,0|1,0,0]=3 12013 B8R1.23 CC(C)[C@H]1C[C@@H](O)C1 Amb27946929 [0,1,0,1,0,0|1,0,1]=4 12014 B8R1.23 CC(Cl)C1CC(=O)O1 Amb27878702 [0,1,0,1,0,0|0,0,0]=2 12015 B8R1.23 CC(F)C1CC(=O)C1 Amb34159489 [0,1,0,1,0,0|1,0,0]=3 12016 B8R1.23 CC(N)C1CC(O)C1 Amb34164942 [0,1,0,1,0,0|1,0,1]=4 12017 B8R1.23 CC(O)C1CC(=O)C1 Amb34159488 [0,1,0,1,0,0|1,0,0]=3 12018 B8R1.23 CC(O)C1CC(N)C1 Amb35625271 [0,1,0,1,0,0|1,0,1]=4 12019 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [0,1,0,1,0,0|0,0,0]=2 12020 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [0,1,0,1,0,0|0,0,0]=2 12021 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [0,1,0,1,0,0|0,0,0]=2 12022 B8R1.23 CC1CC(C(C)O)C1 Amb23590278 [0,1,0,1,0,0|1,0,1]=4 12023 B8R1.23 CC1CC(C(C)O)O1 Amb28125884 [0,1,0,1,0,0|1,0,1]=4 12024 B8R1.23 CC1CC(C(N)=O)C1 Amb27954948 [0,1,0,1,0,0|1,0,0]=3 12025 B8R1.23 CC1CN(C(=O)Cl)C1 Amb35667757 [0,1,0,1,0,0|2,0,0]=4 12026 B8R1.23 CC1CN(C(N)=O)C1 Amb30039472 [0,1,0,1,0,0|2,0,0]=4 12027 B8R1.23 CC1C[C@H]([C@H](C)O)O1 Amb27775507 [0,1,0,1,0,0|1,0,1]=4 12028 B8R1.23 CN(C)C1CC(=O)C1 Amb34159682 [0,1,0,1,0,0|2,0,0]=4 12029 B8R1.23 CN1CC(C(=O)Cl)C1 Amb35781982 [0,1,0,1,0,0|2,0,0]=4 12030 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [0,1,0,1,0,0|1,0,0]=3 12031 B8R1.23 C[C@@H](N)C1CC(O)C1 Amb34912829 [0,1,0,1,0,0|1,0,1]=4 12032 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [0,1,0,1,0,0|0,0,0]=2 12033 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [0,1,0,1,0,0|0,0,0]=2 12034 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [0,1,0,1,0,0|0,0,0]=2 12035 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [0,1,0,1,0,0|0,0,0]=2 12036 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [0,1,0,1,0,0|0,0,0]=2 12037 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [0,1,0,1,0,0|0,0,0]=2 12038 B8R1.23 N=C(N)C1CC(F)C1 Amb26358514 [0,1,0,1,0,0|2,0,0]=4 12039 B8R1.23 NC(=O)C1CC(Cl)C1 Amb27424316 [0,1,0,1,0,0|1,0,0]=3 12040 B8R1.23 NC(=O)C1CC(F)C1 Amb27946575 [0,1,0,1,0,0|1,0,0]=3 12041 B8R1.23 NC(=O)C1CC(N)C1 Amb20622654 [0,1,0,1,0,0|1,0,0]=3 12042 B8R1.23 NC(=O)C1CC(N)C1 Amb32664988 [0,1,0,1,0,0|1,0,0]=3 12043 B8R1.23 NC(=O)N1CC(N)C1 Amb27632971 [0,1,0,1,0,0|2,0,0]=4 12044 B8R1.23 NC(=O)N1CC(N)C1 Amb33483188 [0,1,0,1,0,0|2,0,0]=4 12045 B8R1.23 NC(=O)N1CC(O)C1 Amb28068660 [0,1,0,1,0,0|2,0,0]=4 12046 B8R1.23 NC(=O)[C@H]1C[C@@H](Cl)C1 Amb27882303 [0,1,0,1,0,0|1,0,0]=3 12047 B8R1.23 NC(=O)[C@H]1C[C@@H](N)C1 Amb22896793 [0,1,0,1,0,0|1,0,0]=3 12048 B8R1.23 NC(=O)[C@H]1C[C@@H](N)C1 Amb32664685 [0,1,0,1,0,0|1,0,0]=3 12049 B8R1.23 NC(=O)[C@H]1C[C@H](Cl)C1 Amb27882281 [0,1,0,1,0,0|1,0,0]=3 12050 B8R1.23 NC(=O)[C@H]1C[C@H](N)C1 Amb22896794 [0,1,0,1,0,0|1,0,0]=3 12051 B8R1.23 NC(=O)[C@H]1C[C@H](N)C1 Amb32668185 [0,1,0,1,0,0|1,0,0]=3 12052 B8R1.23 NC(=S)[C@H]1C[C@H](Cl)C1 Amb35789073 [0,1,0,1,0,0|1,1,0]=4 12053 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [0,1,0,1,0,0|0,0,0]=2 12054 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [0,1,0,1,0,0|0,0,0]=2 12055 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [0,1,0,1,0,0|0,0,0]=2 12056 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [0,1,0,1,0,0|0,0,0]=2 12057 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [0,1,0,1,0,0|0,0,0]=2 12058 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [0,1,0,1,0,0|0,0,0]=2 12059 B8R1.23 O=C(Cl)C1CC(Cl)C1 Amb24739809 [0,1,0,1,0,0|1,0,0]=3 12060 B8R1.23 O=C(Cl)C1CC(F)C1 Amb28049013 [0,1,0,1,0,0|1,0,0]=3 12061 B8R1.23 O=C(Cl)N1CC(F)C1 Amb33803382 [0,1,0,1,0,0|2,0,0]=4 12062 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [0,1,0,1,0,0|0,0,0]=2 12063 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [0,1,0,1,0,0|0,0,0]=2 12064 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [0,1,0,1,0,0|0,0,0]=2 12065 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [0,1,0,1,0,0|0,0,0]=2 12066 B8R1.23 O=C(O)C1CS(=O)C1 Amb26056015 [0,1,0,1,0,0|1,0,0]=3 12067 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [0,1,0,1,0,0|0,0,0]=2 12068 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [0,1,0,1,0,0|0,0,0]=2 12069 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [0,1,0,1,0,0|0,0,0]=2 12070 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [0,1,0,1,0,0|0,0,0]=2 12071 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [0,1,0,1,0,0|0,0,0]=2 12072 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [0,1,0,1,0,0|0,0,0]=2 12073 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [0,1,0,1,0,0|0,0,0]=2 12074 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [0,1,0,1,0,0|0,0,0]=2 12075 B8R1.23 O=C1CC(C(=O)Cl)C1 Amb16230813 [0,1,0,1,0,0|1,0,1]=4 12076 B8R1.23 O=C1CC(C(=O)O)C1 Amb33544325 [0,1,0,1,0,0|0,0,1]=3 12077 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [0,1,0,1,0,0|1,0,1]=4 12078 B8R1.23 O=C1CC(C(=O)O)O1 Amb26887454 [0,1,0,1,0,0|1,0,1]=4 12079 B8R1.23 O=C1CC(C(Cl)Cl)O1 Amb27952844 [0,1,0,1,0,0|1,0,0]=3 12080 B8R1.23 O=C1CC(C(F)F)C1 Amb27805522 [0,1,0,1,0,0|2,0,0]=4 12081 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [0,1,0,1,0,0|1,0,1]=4 12082 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [0,1,0,1,0,0|1,0,1]=4 12083 B8R1.30 C=C1CC1(N)C(=O)O Amb22274582 [0,1,0,1,0,0|0,0,2]=4 12084 B8R1.30 CC(=O)[C@@]1(C)C[C@H]1C Amb28131473 [0,1,0,1,0,0|1,0,0]=3 12085 B8R1.30 CC(=O)[C@]1(C)C[C@H]1C Amb28054445 [0,1,0,1,0,0|1,0,0]=3 12086 B8R1.30 CC(=O)[C@]1(C)C[C@H]1Cl Amb27965058 [0,1,0,1,0,0|2,0,0]=4 12087 B8R1.30 CC(O)[C@]1(C)C[C@H]1C Amb27857929 [0,1,0,1,0,0|1,0,1]=4 12088 B8R1.30 CC1(C(=O)Cl)CC1Br Amb27637734 [0,1,0,1,0,0|2,0,0]=4 12089 B8R1.30 CC1(C(=O)O)CC1Br Amb25889224 [0,1,0,1,0,0|1,0,0]=3 12090 B8R1.30 CC1(C(=O)O)CC1Cl Amb28325885 [0,1,0,1,0,0|1,0,0]=3 12091 B8R1.30 CC1(C(=O)O)CC1F Amb24445672 [0,1,0,1,0,0|1,0,0]=3 12092 B8R1.30 CC1CC1(C)C(=O)O Amb28456906 [0,1,0,1,0,0|0,0,0]=2 12093 B8R1.30 CC1CC1(F)C(=O)O Amb32679974 [0,1,0,1,0,0|0,0,0]=2 12094 B8R1.30 CC1CC1(N)C(=O)O Amb26066646 [0,1,0,1,0,0|0,0,0]=2 12095 B8R1.30 CC1CC1(N)C(N)=O Amb28434643 [0,1,0,1,0,0|1,0,0]=3 12096 B8R1.30 C[C@@H]1C[C@@]1(C)C(=O)O Amb24680945 [0,1,0,1,0,0|0,0,0]=2 12097 B8R1.30 C[C@@H]1C[C@@]1(N)C(N)=O Amb27969162 [0,1,0,1,0,0|1,0,0]=3 12098 B8R1.30 C[C@@H]1C[C@@]1(O)C(=O)O Amb28133921 [0,1,0,1,0,0|0,0,0]=2 12099 B8R1.30 C[C@@H]1O[C@]1(C)C(=O)O Amb28057500 [0,1,0,1,0,0|1,0,0]=3 12100 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1Cl Amb28134278 [0,1,0,1,0,0|1,0,0]=3 12101 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1F Amb24053139 [0,1,0,1,0,0|1,0,0]=3 12102 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Br Amb27222642 [0,1,0,1,0,0|1,0,0]=3 12103 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Cl Amb28196682 [0,1,0,1,0,0|1,0,0]=3 12104 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1F Amb26656665 [0,1,0,1,0,0|1,0,0]=3 12105 B8R1.30 C[C@H]1C[C@@]1(C)C(=O)O Amb27789627 [0,1,0,1,0,0|0,0,0]=2 12106 B8R1.30 C[C@H]1C[C@@]1(Cl)C(=O)O Amb28286348 [0,1,0,1,0,0|0,0,0]=2 12107 B8R1.30 C[C@H]1C[C@]1(N)C(=O)O Amb27873946 [0,1,0,1,0,0|0,0,0]=2 12108 B8R1.30 C[C@H]1C[C@]1(N)C(N)=O Amb27419998 [0,1,0,1,0,0|1,0,0]=3 12109 B8R1.30 C[C@H]1C[C@]1(O)C(=O)O Amb27881113 [0,1,0,1,0,0|0,0,0]=2 12110 B8R1.30 C[C@]1(C(=O)O)C[C@@H]1F Amb26987734 [0,1,0,1,0,0|1,0,0]=3 12111 B8R1.30 C[C@]1(C(=O)O)C[C@H]1F Amb26870422 [0,1,0,1,0,0|1,0,0]=3 12112 B8R1.30 NC1(C(=O)O)CC1Br Amb27430541 [0,1,0,1,0,0|1,0,0]=3 12113 B8R1.30 NC1(C(=O)O)CC1Cl Amb27596928 [0,1,0,1,0,0|1,0,0]=3 12114 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Br Amb28411230 [0,1,0,1,0,0|1,0,0]=3 12115 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Cl Amb25245700 [0,1,0,1,0,0|1,0,0]=3 12116 B8R1.30 N[C@@]1(C(=O)O)C[C@H]1Cl Amb28436769 [0,1,0,1,0,0|1,0,0]=3 12117 B8R1.30 N[C@]1(C(=O)O)C[C@@H]1Cl Amb26587370 [0,1,0,1,0,0|1,0,0]=3 12118 B8R1.30 N[C@]1(C(=O)O)C[C@H]1Cl Amb22748908 [0,1,0,1,0,0|1,0,0]=3 12119 B8R1.37 CCCC(C)C1CO1 Amb26958521 [0,1,0,1,0,0|1,0,1]=4 12120 B8R1.37 CCCC(C)[C@@H]1CO1 Amb33320432 [0,1,0,1,0,0|1,0,1]=4 12121 B8R1.37 CCCC(C)[C@H]1CO1 Amb33320433 [0,1,0,1,0,0|1,0,1]=4 12122 B8R1.37 CCC[C@@H](Br)[C@@H]1CO1 Amb27858901 [0,1,0,1,0,0|1,0,1]=4 12123 B8R1.54 C=C(C(=O)O)C1CC1 Amb24481397 [0,1,0,1,0,0|0,0,1]=3 12124 B8R1.54 C=C(C)C(Cl)C1CC1 Amb28076603 [0,1,0,1,0,0|2,0,0]=4 12125 B8R1.54 C=C(C)C(N)C1CC1 Amb27234544 [0,1,0,1,0,0|2,0,0]=4 12126 B8R1.54 C=C(C)C(O)C1CC1 Amb27236079 [0,1,0,1,0,0|2,0,0]=4 12127 B8R1.54 CC(=O)C(=O)C1CC1 Amb20241141 [0,1,0,1,0,0|1,0,1]=4 12128 B8R1.54 CC(=O)C(C)C1CC1 Amb25798488 [0,1,0,1,0,0|1,0,0]=3 12129 B8R1.54 CC(=O)C(N)C1CC1 Amb27668423 [0,1,0,1,0,0|1,0,0]=3 12130 B8R1.54 CC(=O)N(C)C1CC1 Amb27259327 [0,1,0,1,0,0|2,0,0]=4 12131 B8R1.54 CC(=O)N(N)C1CC1 Amb33191631 [0,1,0,1,0,0|2,0,0]=4 12132 B8R1.54 CC(C(=N)N)C1CC1 Amb32751206 [0,1,0,1,0,0|2,0,0]=4 12133 B8R1.54 CC(C(=O)O)=C1CC1 Amb24450586 [0,1,0,1,0,0|0,0,2]=4 12134 B8R1.54 CC(C(=O)O)C1CC1 Amb33537630 [0,1,0,1,0,0|0,0,0]=2 12135 B8R1.54 CC(O)C(C)C1CC1 Amb26396484 [0,1,0,1,0,0|1,0,1]=4 12136 B8R1.54 CN(C(=O)Cl)C1CC1 Amb32671378 [0,1,0,1,0,0|2,0,0]=4 12137 B8R1.54 C[C@@H](C(=O)O)C1CC1 Amb33732043 [0,1,0,1,0,0|0,0,0]=2 12138 B8R1.54 C[C@@H](O)[C@@H](N)C1CC1 Amb28132696 [0,1,0,1,0,0|1,0,1]=4 12139 B8R1.54 C[C@H](C(=O)O)C1CC1 Amb33744363 [0,1,0,1,0,0|0,0,0]=2 12140 B8R1.54 C[C@H](O)[C@@H](N)C1CC1 Amb28429788 [0,1,0,1,0,0|1,0,1]=4 12141 B8R1.54 N=C(N)C(N)C1CC1 Amb28142515 [0,1,0,1,0,0|2,0,0]=4 12142 B8R1.54 N=C(N)C(O)C1CC1 Amb26566610 [0,1,0,1,0,0|2,0,0]=4 12143 B8R1.54 N=C(N)C(O)C1CC1 Amb33339210 [0,1,0,1,0,0|2,0,0]=4 12144 B8R1.54 NC(=O)C(Cl)C1CC1 Amb26875098 [0,1,0,1,0,0|1,0,0]=3 12145 B8R1.54 NC(=O)C(N)C1CC1 Amb18282442 [0,1,0,1,0,0|1,0,0]=3 12146 B8R1.54 NC(=O)C(N)C1CC1 Amb28991331 [0,1,0,1,0,0|1,0,0]=3 12147 B8R1.54 NC(=O)C(O)C1CC1 Amb20630809 [0,1,0,1,0,0|1,0,0]=3 12148 B8R1.54 NC(=O)[C@H](N)C1CC1 Amb27436476 [0,1,0,1,0,0|1,0,0]=3 12149 B8R1.54 NC(=S)C(N)C1CC1 Amb27858041 [0,1,0,1,0,0|1,1,0]=4 12150 B8R1.54 NC(C(=O)O)C1CC1 Amb19515010 [0,1,0,1,0,0|0,0,0]=2 12151 B8R1.54 NC(C(=O)O)C1CC1 Amb2696737 [0,1,0,1,0,0|0,0,0]=2 12152 B8R1.54 N[C@@H](C(=O)O)C1CC1 Amb2699141 [0,1,0,1,0,0|0,0,0]=2 12153 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb19929447 [0,1,0,1,0,0|0,0,0]=2 12154 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb2694840 [0,1,0,1,0,0|0,0,0]=2 12155 B8R1.54 O=C(Cl)C(=O)C1CC1 Amb26514373 [0,1,0,1,0,0|1,0,1]=4 12156 B8R1.54 O=C(O)C(=O)C1CC1 Amb16233327 [0,1,0,1,0,0|0,0,1]=3 12157 B8R1.54 O=C(O)C(F)C1CC1 Amb25936979 [0,1,0,1,0,0|0,0,0]=2 12158 B8R1.54 O=C(O)C(O)C1CC1 Amb18282441 [0,1,0,1,0,0|0,0,0]=2 12159 B8R1.54 O=C([O-])C(=O)C1CC1 Amb22641890 [0,1,0,1,0,0|0,0,2]=4 12160 B8R1.78 C=C(C)C1(N)CCC1 Amb33199176 [0,1,0,1,0,0|2,0,0]=4 12161 B8R1.78 C=C(C)C1(O)CCC1 Amb25991226 [0,1,0,1,0,0|2,0,0]=4 12162 B8R1.78 C=C(O)C1(C)COC1 Amb27790823 [0,1,0,1,0,0|2,0,0]=4 12163 B8R1.78 CC(=O)C1(C)CCC1 Amb27249451 [0,1,0,1,0,0|1,0,0]=3 12164 B8R1.78 CC(=O)C1(C)CCN1 Amb35747959 [0,1,0,1,0,0|2,0,0]=4 12165 B8R1.78 CC(=O)C1(C)CCN1 Amb35748148 [0,1,0,1,0,0|2,0,0]=4 12166 B8R1.78 CC(=O)C1(C)CNC1 Amb24622325 [0,1,0,1,0,0|2,0,0]=4 12167 B8R1.78 CC(=O)C1(C)COC1 Amb22406104 [0,1,0,1,0,0|2,0,0]=4 12168 B8R1.78 CC(=O)C1(F)CNC1 Amb34150766 [0,1,0,1,0,0|2,0,0]=4 12169 B8R1.78 CC(=O)C1(N)CCC1 Amb26578364 [0,1,0,1,0,0|1,0,0]=3 12170 B8R1.78 CC(=O)C1(O)CCC1 Amb33328556 [0,1,0,1,0,0|1,0,0]=3 12171 B8R1.78 CC(O)C1(N)CCC1 Amb29874794 [0,1,0,1,0,0|1,0,1]=4 12172 B8R1.78 CC1(C(=O)Cl)CCC1 Amb24533834 [0,1,0,1,0,0|1,0,0]=3 12173 B8R1.78 CC1(C(=O)O)CCC1 Amb33544631 [0,1,0,1,0,0|0,0,0]=2 12174 B8R1.78 CC1(C(=O)O)CCN1 Amb24483061 [0,1,0,1,0,0|1,0,0]=3 12175 B8R1.78 CC1(C(=O)O)CCN1 Amb33483840 [0,1,0,1,0,0|1,0,0]=3 12176 B8R1.78 CC1(C(=O)O)CCN1 Amb34138205 [0,1,0,1,0,0|1,0,0]=3 12177 B8R1.78 CC1(C(=O)O)CCO1 Amb22001906 [0,1,0,1,0,0|1,0,0]=3 12178 B8R1.78 CC1(C(=O)O)CNC1 Amb24077476 [0,1,0,1,0,0|1,0,0]=3 12179 B8R1.78 CC1(C(=O)O)CNC1 Amb24561978 [0,1,0,1,0,0|1,0,0]=3 12180 B8R1.78 CC1(C(=O)O)COC1 Amb33543882 [0,1,0,1,0,0|1,0,0]=3 12181 B8R1.78 CC1(C(=O)O)CSC1 Amb21960451 [0,1,0,1,0,0|1,0,0]=3 12182 B8R1.78 CC1(C(N)=O)CCC1 Amb28396894 [0,1,0,1,0,0|1,0,0]=3 12183 B8R1.78 CC1(C(N)=O)CNC1 Amb26944170 [0,1,0,1,0,0|2,0,0]=4 12184 B8R1.78 CC1(C(N)=O)CNC1 Amb28921018 [0,1,0,1,0,0|2,0,0]=4 12185 B8R1.78 CC1(C(N)=O)COC1 Amb27837831 [0,1,0,1,0,0|2,0,0]=4 12186 B8R1.78 CC1(S(=O)Cl)CCC1 Amb32720734 [0,1,0,1,0,0|2,0,0]=4 12187 B8R1.78 CC1(S(N)=O)CCC1 Amb32720950 [0,1,0,1,0,0|2,0,0]=4 12188 B8R1.78 N=C(N)C1(O)CCC1 Amb27430631 [0,1,0,1,0,0|2,0,0]=4 12189 B8R1.78 NC(=O)C1(Br)CCC1 Amb24481413 [0,1,0,1,0,0|1,0,0]=3 12190 B8R1.78 NC(=O)C1(F)CNC1 Amb34147675 [0,1,0,1,0,0|2,0,0]=4 12191 B8R1.78 NC(=O)C1(N)CCC1 Amb18523727 [0,1,0,1,0,0|1,0,0]=3 12192 B8R1.78 NC(=O)C1(N)CCC1 Amb33550276 [0,1,0,1,0,0|1,0,0]=3 12193 B8R1.78 NC(=O)C1(N)CNC1 Amb26851458 [0,1,0,1,0,0|2,0,0]=4 12194 B8R1.78 NC(=O)C1(N)CNC1 Amb33482864 [0,1,0,1,0,0|2,0,0]=4 12195 B8R1.78 NC(=O)C1(N)COC1 Amb24483241 [0,1,0,1,0,0|2,0,0]=4 12196 B8R1.78 NC(=O)C1(N)COC1 Amb32679270 [0,1,0,1,0,0|2,0,0]=4 12197 B8R1.78 NC(=O)C1(O)CCC1 Amb24122570 [0,1,0,1,0,0|1,0,0]=3 12198 B8R1.78 NC(=O)C1(O)CNC1 Amb25246646 [0,1,0,1,0,0|2,0,0]=4 12199 B8R1.78 NC(=O)C1(O)CNC1 Amb28934911 [0,1,0,1,0,0|2,0,0]=4 12200 B8R1.78 NC1(C(=O)Cl)CCC1 Amb32409362 [0,1,0,1,0,0|1,0,0]=3 12201 B8R1.78 NC1(C(=O)F)CCC1 Amb34148081 [0,1,0,1,0,0|1,0,0]=3 12202 B8R1.78 NC1(C(=O)O)CCC1 Amb2694933 [0,1,0,1,0,0|0,0,0]=2 12203 B8R1.78 NC1(C(=O)O)CCC1 Amb8630070 [0,1,0,1,0,0|0,0,0]=2 12204 B8R1.78 NC1(C(=O)O)CNC1 Amb19895006 [0,1,0,1,0,0|1,0,0]=3 12205 B8R1.78 NC1(C(=O)O)CNC1 Amb21960937 [0,1,0,1,0,0|1,0,0]=3 12206 B8R1.78 NC1(C(=O)O)COC1 Amb18199133 [0,1,0,1,0,0|1,0,0]=3 12207 B8R1.78 NC1(C(=O)O)COC1 Amb33109883 [0,1,0,1,0,0|1,0,0]=3 12208 B8R1.78 NC1(C(=O)O)CSC1 Amb21927718 [0,1,0,1,0,0|1,0,0]=3 12209 B8R1.78 O=C(Cl)C1(Br)CCC1 Amb26358748 [0,1,0,1,0,0|1,0,0]=3 12210 B8R1.78 O=C(Cl)C1(Cl)CCC1 Amb33127943 [0,1,0,1,0,0|1,0,0]=3 12211 B8R1.78 O=C(O)C1(Br)CCC1 Amb495556 [0,1,0,1,0,0|0,0,0]=2 12212 B8R1.78 O=C(O)C1(Cl)CCC1 Amb24422884 [0,1,0,1,0,0|0,0,0]=2 12213 B8R1.78 O=C(O)C1(F)CCC1 Amb22886536 [0,1,0,1,0,0|0,0,0]=2 12214 B8R1.78 O=C(O)C1(F)CNC1 Amb23440120 [0,1,0,1,0,0|1,0,0]=3 12215 B8R1.78 O=C(O)C1(O)CCC1 Amb495557 [0,1,0,1,0,0|0,0,0]=2 12216 B8R1.78 O=C(O)C1(O)CNC1 Amb24122891 [0,1,0,1,0,0|1,0,0]=3 12217 B8R1.78 O=C(O)C1(O)CNC1 Amb28934838 [0,1,0,1,0,0|1,0,0]=3 12218 B8R1.78 O=C(O)C1(O)COC1 Amb25714262 [0,1,0,1,0,0|1,0,0]=3 12219 B8R1.78 O=C(O)C1(S)CCC1 Amb34159631 [0,1,0,1,0,0|0,0,0]=2 12220 B8R1.78 O=[N+]([O-])C1(Br)CCC1 Amb25841397 [0,1,0,1,0,0|1,0,1]=4 12221 B8R1.69 CC1(N)CCC1(C)O Amb24117489 [0,1,0,1,0,0|1,0,1]=4 12222 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,1,0,1,0,0|1,0,0]=3 12223 B8R1.77 CC(=O)C1CC1(C)O Amb27963572 [0,1,0,1,0,0|1,0,0]=3 12224 B8R1.77 CC(=O)C1CC1(Cl)Cl Amb25890324 [0,1,0,1,0,0|2,0,0]=4 12225 B8R1.77 CC(=O)C1CC1(F)F Amb25219948 [0,1,0,1,0,0|2,0,0]=4 12226 B8R1.77 CC(=O)C1OC1(C)C Amb4605897 [0,1,0,1,0,0|2,0,0]=4 12227 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [0,1,0,1,0,0|0,0,0]=2 12228 B8R1.77 CC1(C)CC1B(O)O Amb28316229 [0,1,0,1,0,0|1,0,1]=4 12229 B8R1.77 CC1(C)CC1C(=N)N Amb28048937 [0,1,0,1,0,0|2,0,0]=4 12230 B8R1.77 CC1(C)CC1C(=N)N Amb28934919 [0,1,0,1,0,0|2,0,0]=4 12231 B8R1.77 CC1(C)CC1C(=O)Cl Amb16230811 [0,1,0,1,0,0|1,0,0]=3 12232 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [0,1,0,1,0,0|0,0,0]=2 12233 B8R1.77 CC1(C)CC1C(N)=O Amb2778846 [0,1,0,1,0,0|1,0,0]=3 12234 B8R1.77 CC1(C)CC1C(N)=S Amb25983596 [0,1,0,1,0,0|1,1,0]=4 12235 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [0,1,0,1,0,0|0,0,0]=2 12236 B8R1.77 CC1(C)C[C@@H]1C(N)=O Amb4166316 [0,1,0,1,0,0|1,0,0]=3 12237 B8R1.77 CC1(C)C[C@H]1C(N)=O Amb10072071 [0,1,0,1,0,0|1,0,0]=3 12238 B8R1.77 CC1(C)OC1C(=O)O Amb24481352 [0,1,0,1,0,0|1,0,0]=3 12239 B8R1.77 CC1(C)SC1C(N)=O Amb27838390 [0,1,0,1,0,0|2,0,0]=4 12240 B8R1.77 C[C@@H](O)[C@@H]1CC1(C)C Amb28207137 [0,1,0,1,0,0|1,0,1]=4 12241 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [0,1,0,1,0,0|0,0,0]=2 12242 B8R1.77 C[C@H](O)C1CC1(C)C Amb27602446 [0,1,0,1,0,0|1,0,1]=4 12243 B8R1.77 C[C@H](O)[C@@H]1CC1(C)C Amb27197232 [0,1,0,1,0,0|1,0,1]=4 12244 B8R1.77 NC(=O)C1CC1(Cl)Cl Amb2722922 [0,1,0,1,0,0|2,0,0]=4 12245 B8R1.77 NC(=O)C1CC1(F)F Amb24715693 [0,1,0,1,0,0|2,0,0]=4 12246 B8R1.77 O=C(Cl)C1CC1(Cl)Cl Amb16230810 [0,1,0,1,0,0|2,0,0]=4 12247 B8R1.77 O=C(Cl)C1CC1(F)F Amb27864246 [0,1,0,1,0,0|2,0,0]=4 12248 B8R1.77 O=C(Cl)[C@@H]1C[C@@]1(F)Cl Amb27768018 [0,1,0,1,0,0|2,0,0]=4 12249 B8R1.77 O=C(Cl)[C@@H]1C[C@]1(F)Cl Amb27249625 [0,1,0,1,0,0|2,0,0]=4 12250 B8R1.77 O=C(O)C1CC1(Cl)Cl Amb1106460 [0,1,0,1,0,0|1,0,0]=3 12251 B8R1.77 O=C(O)C1CC1(F)Br Amb25952257 [0,1,0,1,0,0|1,0,0]=3 12252 B8R1.77 O=C(O)C1CC1(F)Cl Amb10841879 [0,1,0,1,0,0|1,0,0]=3 12253 B8R1.77 O=C(O)C1CC1(F)F Amb2691845 [0,1,0,1,0,0|1,0,0]=3 12254 B8R1.77 O=C(O)[C@@H]1CC1(F)F Amb30869365 [0,1,0,1,0,0|1,0,0]=3 12255 B8R1.77 O=C(O)[C@@H]1C[C@@]1(F)Cl Amb28252683 [0,1,0,1,0,0|1,0,0]=3 12256 B8R1.77 O=C(O)[C@H]1CC1(Cl)Cl Amb27444143 [0,1,0,1,0,0|1,0,0]=3 12257 B8R1.77 O=C(O)[C@H]1CC1(F)F Amb33802940 [0,1,0,1,0,0|1,0,0]=3 12258 B8R1.21 CC1CC1C(C)(C)O Amb26526960 [0,1,0,1,0,0|1,0,1]=4 12259 B8R1.21 CC1CC1S(=O)(=O)Cl Amb33058069 [0,1,0,1,0,0|1,0,1]=4 12260 B8R1.21 CC1CC1S(=O)(=O)F Amb33263178 [0,1,0,1,0,0|1,0,1]=4 12261 B8R1.21 CC1CC1S(N)(=O)=O Amb29850882 [0,1,0,1,0,0|1,0,1]=4 12262 B8R1.21 C[C@@H]1C[C@H]1S(=O)(=O)Cl Amb35719515 [0,1,0,1,0,0|1,0,1]=4 12263 B8R1.21 C[C@@H]1C[C@H]1S(N)(=O)=O Amb29849438 [0,1,0,1,0,0|1,0,1]=4 12264 B8R1.21 C[C@H]1O[C@H]1P(=O)(O)O Amb8385971 [0,1,0,1,0,0|2,0,0]=4 12265 B8R1.55 NS(=O)(=O)C1CCC1 Amb22896754 [0,1,0,1,0,0|1,0,1]=4 12266 B8R1.55 O=S(=O)(Cl)C1CCC1 Amb22001055 [0,1,0,1,0,0|1,0,1]=4 12267 B8R1.55 O=S(=O)(F)C1CCC1 Amb32717989 [0,1,0,1,0,0|1,0,1]=4 12268 B8R1.55 O=S(=O)(O)C1CNC1 Amb24693636 [0,1,0,1,0,0|2,0,0]=4 12269 B8R1.56 CC(C)(O)CC1CC1 Amb24689606 [0,1,0,1,0,0|1,0,1]=4 12270 B8R1.56 CS(=O)(=O)CC1CC1 Amb28194466 [0,1,0,1,0,0|1,0,1]=4 12271 B8R1.56 NS(=O)(=O)CC1CC1 Amb19338125 [0,1,0,1,0,0|1,0,1]=4 12272 B8R1.56 O=S(=O)(Br)CC1CC1 Amb27390925 [0,1,0,1,0,0|1,0,1]=4 12273 B8R1.56 O=S(=O)(Cl)CC1CC1 Amb18176559 [0,1,0,1,0,0|1,0,1]=4 12274 B8R1.56 O=S(=O)(F)CC1CC1 Amb28282250 [0,1,0,1,0,0|1,0,1]=4 12275 B8R2.4 O=C1CC2CC1C2 Amb24426322 [0,0,0,2,0,0|1,0,0]=3 12276 B8R2.4 O=C1NC2CC1C2 Amb27848619 [0,0,0,2,0,0|1,0,0]=3 12277 B8R2.18 O=C1CC2CC2C1 Amb25750119 [0,0,0,2,0,0|1,0,0]=3 12278 B8R2.18 O=C1CC2OC2C1 Amb25050255 [0,0,0,2,0,0|2,0,0]=4 12279 B8R2.18 O=C1C[C@@H]2C[C@@H]2C1 Amb28350467 [0,0,0,2,0,0|1,0,0]=3 12280 B8R2.18 OC1CC2CC2C1 Amb21864713 [0,0,0,2,0,0|1,0,1]=4 12281 B8R2.18 OC1C[C@@H]2C[C@@H]2C1 Amb26015753 [0,0,0,2,0,0|1,0,1]=4 12282 B8R2.18 ON1CC2CC2C1 Amb27778528 [0,0,0,2,0,0|2,0,0]=4 12283 B8R2.18 O[C@@H]1C[C@@H]2C[C@@H]2C1 Amb22746717 [0,0,0,2,0,0|1,0,1]=4 12284 B8R2.18 O[C@H]1C[C@@H]2C[C@@H]2C1 Amb24576455 [0,0,0,2,0,0|1,0,1]=4 12285 B8R2.34 C1=C2CCC(C1)C2 Amb28196687 [0,0,0,2,0,0|2,0,0]=4 12286 B8R2.38 C=C1CCC2CC12 Amb27836170 [0,0,0,2,0,0|2,0,0]=4 12287 B8R2.38 O=C1C=C[C@@H]2C[C@H]12 Amb28052364 [0,0,0,2,0,0|1,0,1]=4 12288 B8R2.38 O=C1CCC2CC12 Amb22736104 [0,0,0,2,0,0|1,0,0]=3 12289 B8R2.38 O=C1CCC2OC12 Amb28141441 [0,0,0,2,0,0|2,0,0]=4 12290 B8R2.38 O=C1CC[C@@H]2C[C@H]12 Amb24623125 [0,0,0,2,0,0|1,0,0]=3 12291 B8R2.38 O=C1CC[C@H]2C[C@@H]12 Amb27845572 [0,0,0,2,0,0|1,0,0]=3 12292 B8R2.38 O=C1CNC2CC12 Amb34142462 [0,0,0,2,0,0|2,0,0]=4 12293 B8R2.38 O=C1CN[C@@H]2C[C@H]12 Amb27630008 [0,0,0,2,0,0|2,0,0]=4 12294 B8R2.38 O=C1NCC2CC12 Amb22546330 [0,0,0,2,0,0|1,0,0]=3 12295 B8R2.38 O=C1NCC2OC12 Amb28143671 [0,0,0,2,0,0|2,0,0]=4 12296 B8R2.38 O=C1NC[C@@H]2C[C@H]12 Amb27961231 [0,0,0,2,0,0|1,0,0]=3 12297 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,2,0,0|0,0,0]=2 12298 B8R2.38 O=C1OC[C@H]2C[C@@H]12 Amb27421949 [0,0,0,2,0,0|0,0,0]=2 12299 B8R2.38 OC1CC[C@H]2C[C@@H]12 Amb25240579 [0,0,0,2,0,0|1,0,1]=4 12300 B8R2.38 O[C@@H]1CC[C@@H]2C[C@H]12 Amb28195207 [0,0,0,2,0,0|1,0,1]=4 12301 B8R2.38 O[C@H]1CC[C@@H]2C[C@H]12 Amb25811014 [0,0,0,2,0,0|1,0,1]=4 12302 B8R2.38 O[C@H]1CC[C@H]2C[C@@H]12 Amb28053346 [0,0,0,2,0,0|1,0,1]=4 12303 B8R2.2 CC12CCCC1O2 Amb22338783 [0,0,0,2,0,0|1,0,1]=4 12304 B8R2.2 OC12CCCC1C2 Amb27197420 [0,0,0,2,0,0|1,0,1]=4 12305 B8R2.5 OC1CC2CCC12 Amb27423363 [0,0,0,2,0,0|1,0,1]=4 12306 B8R2.5 O[C@H]1C[C@@H]2CC[C@H]12 Amb28207349 [0,0,0,2,0,0|1,0,1]=4 12307 B8R2.11 O=C1C2CCCC12 Amb27838225 [0,0,0,2,0,0|1,0,0]=3 12308 B8R2.11 O[C@@H]1[C@H]2CCC[C@H]21 Amb28138662 [0,0,0,2,0,0|1,0,1]=4 12309 B8R2.23 C1CC2NC(C1)O2 Amb27831530 [0,0,0,2,0,0|1,0,1]=4 12310 B8R2.25 C1CCC2OC2C1 Amb9703000 [0,0,0,2,0,0|1,0,1]=4 12311 B8R2.25 C1CNC2OC2C1 Amb27803715 [0,0,0,2,0,0|1,0,1]=4 12312 B8R2.25 C1COC2CC2C1 Amb28050658 [0,0,0,2,0,0|1,0,1]=4 12313 B8R2.26 CC1CC1C2CO2 Amb33358170 [0,0,0,2,0,0|1,0,1]=4 12314 B8R2.26 CC1CC1[C@@H]2CO2 Amb33342918 [0,0,0,2,0,0|1,0,1]=4 12315 B8R2.26 CC1CC1[C@H]2CO2 Amb33342919 [0,0,0,2,0,0|1,0,1]=4 12316 B8R2.1 C1CC(C2CO2)C1 Amb25910592 [0,0,0,2,0,0|1,0,1]=4 12317 B8R2.1 C1CC([C@@H]2CO2)C1 Amb33313817 [0,0,0,2,0,0|1,0,1]=4 12318 B8R2.1 C1CC([C@H]2CO2)C1 Amb33313818 [0,0,0,2,0,0|1,0,1]=4 12319 B8R2.24 C1CC1CC2CO2 Amb25088515 [0,0,0,2,0,0|1,0,1]=4 12320 B8R2.24 C1CC1C[C@@H]2CO2 Amb33360856 [0,0,0,2,0,0|1,0,1]=4 12321 B8R2.24 C1CC1C[C@H]2CO2 Amb33360672 [0,0,0,2,0,0|1,0,1]=4 12322 B8R2.55 C1CCC2(C1)CO2 Amb19375048 [0,0,0,2,0,0|1,0,1]=4 12323 B8R2.53 O=C1CC2(CC2)C1 Amb24106341 [0,0,0,2,0,0|1,0,0]=3 12324 B8R2.53 OC1CC2(CC2)C1 Amb27639309 [0,0,0,2,0,0|1,0,1]=4 12325 B8R2.66 O=C(O)C12CC1C2 Amb24732235 [0,0,0,2,0,0|0,0,0]=2 12326 B8R2.66 O=C([O-])C12CC1C2 Amb32662743 [0,0,0,2,0,0|0,0,1]=3