0 B6R0.4 C#CCCC(=C)C Amb18634222 [0,0,0,0,0,0|3,0,1]=4 1 B6R0.4 C#CCCC(=O)Cl Amb26949181 [0,0,0,0,0,0|2,0,1]=3 2 B6R0.4 C#CCCC(=O)O Amb33532622 [0,0,0,0,0,0|1,0,1]=2 3 B6R0.4 C#CCCC(=O)[O-] Amb22232009 [0,0,0,0,0,0|1,0,2]=3 4 B6R0.4 C#CCCC(C)=O Amb8869638 [0,0,0,0,0,0|2,0,1]=3 5 B6R0.4 C#CCCC(C)O Amb27175253 [0,0,0,0,0,0|2,0,2]=4 6 B6R0.4 C#CCNC(=O)Br Amb27792816 [0,0,0,0,0,0|3,0,1]=4 7 B6R0.4 C#CCNC(=O)I Amb27838254 [0,0,0,0,0,0|3,0,1]=4 8 B6R0.4 C#CCNC(C)=O Amb20623038 [0,0,0,0,0,0|3,0,1]=4 9 B6R0.4 C#CCNC(N)=O Amb2724225 [0,0,0,0,0,0|3,0,1]=4 10 B6R0.4 C#CCOC(=O)Cl Amb13777322 [0,0,0,0,0,0|3,0,1]=4 11 B6R0.4 C#CCOC(C)=O Amb8517415 [0,0,0,0,0,0|3,0,1]=4 12 B6R0.4 C#CCOC(N)=O Amb26654642 [0,0,0,0,0,0|3,0,1]=4 13 B6R0.4 C#CCSC(C)=O Amb32683409 [0,0,0,0,0,0|3,0,1]=4 14 B6R0.4 C#C\C=C\C(=O)O Amb17593056 [0,0,0,0,0,0|1,0,3]=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|2,0,0]=2 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|4,0,0]=4 19 B6R0.4 C=C(C)CCC#N Amb2778548 [0,0,0,0,0,0|2,0,2]=4 20 B6R0.4 C=C(C)CCCBr Amb22886717 [0,0,0,0,0,0|3,0,0]=3 21 B6R0.4 C=C(C)CCCC Amb2721685 [0,0,0,0,0,0|3,0,0]=3 22 B6R0.4 C=C(C)CCCCl Amb24089299 [0,0,0,0,0,0|3,0,0]=3 23 B6R0.4 C=C(C)CCCN Amb24761452 [0,0,0,0,0,0|2,0,0]=2 24 B6R0.4 C=C(C)CCCN Amb33534233 [0,0,0,0,0,0|2,0,0]=2 25 B6R0.4 C=C(C)CCCO Amb22886814 [0,0,0,0,0,0|3,0,0]=3 26 B6R0.4 C=C(C)CCCS Amb33198962 [0,0,0,0,0,0|3,0,0]=3 27 B6R0.4 C=C(C)CCNC Amb18993045 [0,0,0,0,0,0|4,0,0]=4 28 B6R0.4 C=C(C)CCOC Amb33546340 [0,0,0,0,0,0|4,0,0]=4 29 B6R0.4 C=C(C)CCON Amb25862621 [0,0,0,0,0,0|3,0,0]=3 30 B6R0.4 C=C(C)CCSC Amb28400079 [0,0,0,0,0,0|4,0,0]=4 31 B6R0.4 C=C(C)CNCC Amb3940049 [0,0,0,0,0,0|4,0,0]=4 32 B6R0.4 C=C(C)COCCl Amb27424965 [0,0,0,0,0,0|4,0,0]=4 33 B6R0.4 C=C(C)\C=C\CN Amb33199533 [0,0,0,0,0,0|2,0,2]=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|2,0,0]=2 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|4,0,0]=4 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|1,0,2]=3 42 B6R0.4 C=CCCB(O)O Amb10067042 [0,0,0,0,0,0|2,0,2]=4 43 B6R0.4 C=CCCC(=C)C Amb22228883 [0,0,0,0,0,0|3,0,1]=4 44 B6R0.4 C=CCCC(=N)N Amb25326954 [0,0,0,0,0,0|3,0,1]=4 45 B6R0.4 C=CCCC(=O)Cl Amb3939003 [0,0,0,0,0,0|2,0,1]=3 46 B6R0.4 C=CCCC(=O)O Amb3940112 [0,0,0,0,0,0|1,0,1]=2 47 B6R0.4 C=CCCC(C)=O Amb2721704 [0,0,0,0,0,0|2,0,1]=3 48 B6R0.4 C=CCCC(C)O Amb22059013 [0,0,0,0,0,0|2,0,2]=4 49 B6R0.4 C=CCCC(C)O Amb34915890 [0,0,0,0,0,0|2,0,2]=4 50 B6R0.4 C=CCCC(N)=O Amb28136349 [0,0,0,0,0,0|2,0,1]=3 51 B6R0.4 C=CCCS(=O)[O-] Amb25680826 [0,0,0,0,0,0|2,0,2]=4 52 B6R0.4 C=CCC[C@@H](C)O Amb19929324 [0,0,0,0,0,0|2,0,2]=4 53 B6R0.4 C=CCC[C@H](C)O Amb22226511 [0,0,0,0,0,0|2,0,2]=4 54 B6R0.4 C=CCNC(C)=O Amb5797445 [0,0,0,0,0,0|3,0,1]=4 55 B6R0.4 C=CCNC(N)=O Amb6599864 [0,0,0,0,0,0|3,0,1]=4 56 B6R0.4 C=CCOC(=O)Cl Amb6600570 [0,0,0,0,0,0|3,0,1]=4 57 B6R0.4 C=CCOC(N)=O Amb4017585 [0,0,0,0,0,0|3,0,1]=4 58 B6R0.4 C=CNCC(=O)O Amb28346027 [0,0,0,0,0,0|2,0,1]=3 59 B6R0.4 C=COCC(=O)O Amb27247261 [0,0,0,0,0,0|2,0,1]=3 60 B6R0.4 C=COCC(C)=O Amb27838258 [0,0,0,0,0,0|3,0,1]=4 61 B6R0.4 CB(C)NCCN Amb27217332 [0,0,0,0,0,0|4,0,0]=4 62 B6R0.4 CC#CCC(=O)O Amb17939740 [0,0,0,0,0,0|1,0,2]=3 63 B6R0.4 CC#CCC(C)=O Amb27648528 [0,0,0,0,0,0|2,0,2]=4 64 B6R0.4 CC(=N)NCCF Amb28123831 [0,0,0,0,0,0|4,0,0]=4 65 B6R0.4 CC(=O)CC#CO Amb27463647 [0,0,0,0,0,0|2,0,2]=4 66 B6R0.4 CC(=O)CCC#N Amb17334046 [0,0,0,0,0,0|1,0,2]=3 67 B6R0.4 CC(=O)CCC=O Amb18639597 [0,0,0,0,0,0|2,0,1]=3 68 B6R0.4 CC(=O)CCCBr Amb8394105 [0,0,0,0,0,0|2,0,0]=2 69 B6R0.4 CC(=O)CCCCl Amb3940272 [0,0,0,0,0,0|2,0,0]=2 70 B6R0.4 CC(=O)CCCF Amb25068187 [0,0,0,0,0,0|2,0,0]=2 71 B6R0.4 CC(=O)CCCN Amb18121547 [0,0,0,0,0,0|1,0,0]=1 72 B6R0.4 CC(=O)CCCN Amb32661221 [0,0,0,0,0,0|1,0,0]=1 73 B6R0.4 CC(=O)CCCN Amb32661286 [0,0,0,0,0,0|1,0,0]=1 74 B6R0.4 CC(=O)CCCO Amb3940340 [0,0,0,0,0,0|2,0,0]=2 75 B6R0.4 CC(=O)CN=C=S Amb27490781 [0,0,0,0,0,0|3,0,1]=4 76 B6R0.4 CC(=O)CN=[N+]=[N-] Amb18114476 [0,0,0,0,0,0|3,0,1]=4 77 B6R0.4 CC(=O)CSC#N Amb9788383 [0,0,0,0,0,0|2,0,2]=4 78 B6R0.4 CC(=O)C\C=N\O Amb27750272 [0,0,0,0,0,0|3,0,1]=4 79 B6R0.4 CC(=O)NCC#N Amb3886527 [0,0,0,0,0,0|2,0,2]=4 80 B6R0.4 CC(=O)NCC=O Amb25757509 [0,0,0,0,0,0|3,0,1]=4 81 B6R0.4 CC(=O)NCCBr Amb4311522 [0,0,0,0,0,0|3,0,0]=3 82 B6R0.4 CC(=O)NCCCl Amb423758 [0,0,0,0,0,0|3,0,0]=3 83 B6R0.4 CC(=O)NCCN Amb1218225 [0,0,0,0,0,0|2,0,0]=2 84 B6R0.4 CC(=O)NCCO Amb2720909 [0,0,0,0,0,0|3,0,0]=3 85 B6R0.4 CC(=O)NCCS Amb22230992 [0,0,0,0,0,0|3,0,0]=3 86 B6R0.4 CC(=O)OCC#N Amb9677308 [0,0,0,0,0,0|2,0,2]=4 87 B6R0.4 CC(=O)OCCBr Amb3940209 [0,0,0,0,0,0|3,0,0]=3 88 B6R0.4 CC(=O)OCCN Amb18121947 [0,0,0,0,0,0|2,0,0]=2 89 B6R0.4 CC(=O)OCCN Amb28827650 [0,0,0,0,0,0|2,0,0]=2 90 B6R0.4 CC(=O)OCCO Amb3941004 [0,0,0,0,0,0|3,0,0]=3 91 B6R0.4 CC(=O)SCC=O Amb27873378 [0,0,0,0,0,0|3,0,1]=4 92 B6R0.4 CC(=O)SCCBr Amb24608039 [0,0,0,0,0,0|3,0,0]=3 93 B6R0.4 CC(=O)SCCN Amb21953963 [0,0,0,0,0,0|2,0,0]=2 94 B6R0.4 CC(=O)SCCN Amb22011516 [0,0,0,0,0,0|2,0,0]=2 95 B6R0.4 CC(=O)SCCN Amb31291049 [0,0,0,0,0,0|2,0,0]=2 96 B6R0.4 CC(=O)SCCO Amb27481182 [0,0,0,0,0,0|3,0,0]=3 97 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [0,0,0,0,0,0|2,0,2]=4 98 B6R0.4 CC(=O)\C=C\CF Amb33379250 [0,0,0,0,0,0|2,0,2]=4 99 B6R0.4 CC(=S)SCCCl Amb27952185 [0,0,0,0,0,0|3,1,0]=4 100 B6R0.4 CC(=S)SCCO Amb28350218 [0,0,0,0,0,0|3,1,0]=4 101 B6R0.4 CC(Br)CCCBr Amb2686750 [0,0,0,0,0,0|3,0,1]=4 102 B6R0.4 CC(Br)CCCF Amb33334194 [0,0,0,0,0,0|3,0,1]=4 103 B6R0.4 CC(C)=CCCBr Amb3941652 [0,0,0,0,0,0|3,0,1]=4 104 B6R0.4 CC(C)=CCCCl Amb27865707 [0,0,0,0,0,0|3,0,1]=4 105 B6R0.4 CC(C)=CCCI Amb22395000 [0,0,0,0,0,0|3,0,1]=4 106 B6R0.4 CC(C)=CCCN Amb18962494 [0,0,0,0,0,0|2,0,1]=3 107 B6R0.4 CC(C)=CCCO Amb22002283 [0,0,0,0,0,0|3,0,1]=4 108 B6R0.4 CC(C)=CCCS Amb35588788 [0,0,0,0,0,0|3,0,1]=4 109 B6R0.4 CC(C)=CCON Amb18560217 [0,0,0,0,0,0|3,0,1]=4 110 B6R0.4 CC(C)=CCON Amb29848095 [0,0,0,0,0,0|3,0,1]=4 111 B6R0.4 CC(C)=NCCO Amb27612560 [0,0,0,0,0,0|4,0,0]=4 112 B6R0.4 CC(C)CCCBr Amb3940143 [0,0,0,0,0,0|3,0,1]=4 113 B6R0.4 CC(C)CCCCl Amb33546075 [0,0,0,0,0,0|3,0,1]=4 114 B6R0.4 CC(C)CCCI Amb27814431 [0,0,0,0,0,0|3,0,1]=4 115 B6R0.4 CC(C)CCCN Amb1136518 [0,0,0,0,0,0|2,0,1]=3 116 B6R0.4 CC(C)CCCN Amb13952127 [0,0,0,0,0,0|2,0,1]=3 117 B6R0.4 CC(C)CCCO Amb3939329 [0,0,0,0,0,0|3,0,1]=4 118 B6R0.4 CC(C)CCCS Amb26425936 [0,0,0,0,0,0|3,0,1]=4 119 B6R0.4 CC(C)CCNN Amb20622972 [0,0,0,0,0,0|3,0,1]=4 120 B6R0.4 CC(C)CCNN Amb28990929 [0,0,0,0,0,0|3,0,1]=4 121 B6R0.4 CC(C)CCNN Amb6244044 [0,0,0,0,0,0|3,0,1]=4 122 B6R0.4 CC(C)CCON Amb17101067 [0,0,0,0,0,0|3,0,1]=4 123 B6R0.4 CC(C)CCON Amb28994300 [0,0,0,0,0,0|3,0,1]=4 124 B6R0.4 CC(C)NCCN Amb29844469 [0,0,0,0,0,0|3,0,1]=4 125 B6R0.4 CC(C)NCCN Amb33299284 [0,0,0,0,0,0|3,0,1]=4 126 B6R0.4 CC(C)NCCN Amb8513197 [0,0,0,0,0,0|3,0,1]=4 127 B6R0.4 CC(C)OCCN Amb22491045 [0,0,0,0,0,0|3,0,1]=4 128 B6R0.4 CC(C)OCCN Amb2784936 [0,0,0,0,0,0|3,0,1]=4 129 B6R0.4 CC(C)SCCN Amb21959653 [0,0,0,0,0,0|3,0,1]=4 130 B6R0.4 CC(C)SCCN Amb22586910 [0,0,0,0,0,0|3,0,1]=4 131 B6R0.4 CC(C)SCCN Amb6256717 [0,0,0,0,0,0|3,0,1]=4 132 B6R0.4 CC(Cl)CCCCl Amb19516004 [0,0,0,0,0,0|3,0,1]=4 133 B6R0.4 CC(Cl)CCCO Amb28138028 [0,0,0,0,0,0|3,0,1]=4 134 B6R0.4 CC(F)CCCBr Amb27760484 [0,0,0,0,0,0|3,0,1]=4 135 B6R0.4 CC(F)CCCO Amb27186289 [0,0,0,0,0,0|3,0,1]=4 136 B6R0.4 CC(N)CCCF Amb27612972 [0,0,0,0,0,0|3,0,1]=4 137 B6R0.4 CC(N)CCCN Amb22168271 [0,0,0,0,0,0|2,0,1]=3 138 B6R0.4 CC(N)CCCN Amb28827626 [0,0,0,0,0,0|2,0,1]=3 139 B6R0.4 CC(N)CCCO Amb17569888 [0,0,0,0,0,0|3,0,1]=4 140 B6R0.4 CC(O)CCC#N Amb27974459 [0,0,0,0,0,0|1,0,3]=4 141 B6R0.4 CC(O)CCC=O Amb17593090 [0,0,0,0,0,0|2,0,2]=4 142 B6R0.4 CC(O)CCCBr Amb25889007 [0,0,0,0,0,0|2,0,1]=3 143 B6R0.4 CC(O)CCCCl Amb22270232 [0,0,0,0,0,0|2,0,1]=3 144 B6R0.4 CC(O)CCCF Amb24385806 [0,0,0,0,0,0|2,0,1]=3 145 B6R0.4 CC(O)CCCN Amb8630414 [0,0,0,0,0,0|1,0,1]=2 146 B6R0.4 CC(O)CCCO Amb22227752 [0,0,0,0,0,0|2,0,1]=3 147 B6R0.4 CC(O)COCO Amb27764974 [0,0,0,0,0,0|3,0,1]=4 148 B6R0.4 CC(O)NCCN Amb28128791 [0,0,0,0,0,0|2,0,1]=3 149 B6R0.4 CC(O)OCCO Amb28065279 [0,0,0,0,0,0|3,0,1]=4 150 B6R0.4 CC(O)OCCS Amb25313392 [0,0,0,0,0,0|3,0,1]=4 151 B6R0.4 CC(S)CCCN Amb18251084 [0,0,0,0,0,0|1,1,1]=3 152 B6R0.4 CC(S)CCCO Amb24412207 [0,0,0,0,0,0|2,1,1]=4 153 B6R0.4 CC=C=CC(=O)O Amb17593065 [0,0,0,0,0,0|1,0,3]=4 154 B6R0.4 CCC#CC(=O)O Amb6336503 [0,0,0,0,0,0|1,0,2]=3 155 B6R0.4 CCC#CC(C)=O Amb2721702 [0,0,0,0,0,0|2,0,2]=4 156 B6R0.4 CCCC=C(C)C Amb4035860 [0,0,0,0,0,0|3,0,1]=4 157 B6R0.4 CCCCB(Cl)Cl Amb22230362 [0,0,0,0,0,0|4,0,0]=4 158 B6R0.4 CCCCB(F)F Amb27268214 [0,0,0,0,0,0|4,0,0]=4 159 B6R0.4 CCCCB(O)O Amb2447142 [0,0,0,0,0,0|2,0,1]=3 160 B6R0.4 CCCCC(=N)N Amb10066937 [0,0,0,0,0,0|3,0,0]=3 161 B6R0.4 CCCCC(=N)N Amb2696360 [0,0,0,0,0,0|3,0,0]=3 162 B6R0.4 CCCCC(=O)Cl Amb3939066 [0,0,0,0,0,0|2,0,0]=2 163 B6R0.4 CCCCC(=O)O Amb3939877 [0,0,0,0,0,0|1,0,0]=1 164 B6R0.4 CCCCC(=O)[O-] Amb22056343 [0,0,0,0,0,0|1,0,1]=2 165 B6R0.4 CCCCC(=S)S Amb27195855 [0,0,0,0,0,0|1,2,0]=3 166 B6R0.4 CCCCC(C)=O Amb6608652 [0,0,0,0,0,0|2,0,0]=2 167 B6R0.4 CCCCC(C)Br Amb4015489 [0,0,0,0,0,0|3,0,1]=4 168 B6R0.4 CCCCC(C)C Amb8513255 [0,0,0,0,0,0|3,0,1]=4 169 B6R0.4 CCCCC(C)I Amb17673919 [0,0,0,0,0,0|3,0,1]=4 170 B6R0.4 CCCCC(C)N Amb33527132 [0,0,0,0,0,0|3,0,1]=4 171 B6R0.4 CCCCC(C)N Amb33532410 [0,0,0,0,0,0|3,0,1]=4 172 B6R0.4 CCCCC(C)O Amb4605977 [0,0,0,0,0,0|2,0,1]=3 173 B6R0.4 CCCCC(C)S Amb26326801 [0,0,0,0,0,0|2,1,1]=4 174 B6R0.4 CCCCC(Cl)Br Amb28050002 [0,0,0,0,0,0|3,0,1]=4 175 B6R0.4 CCCCC(Cl)Cl Amb26420376 [0,0,0,0,0,0|3,0,1]=4 176 B6R0.4 CCCCC(F)Br Amb27211132 [0,0,0,0,0,0|3,0,1]=4 177 B6R0.4 CCCCC(N)=O Amb6891958 [0,0,0,0,0,0|2,0,0]=2 178 B6R0.4 CCCCC(N)=S Amb6249558 [0,0,0,0,0,0|2,1,0]=3 179 B6R0.4 CCCCN(C)N Amb22730468 [0,0,0,0,0,0|4,0,0]=4 180 B6R0.4 CCCCN(C)O Amb33204268 [0,0,0,0,0,0|3,0,0]=3 181 B6R0.4 CCCCP(Cl)Cl Amb25051489 [0,0,0,0,0,0|4,0,0]=4 182 B6R0.4 CCCCS(=O)Cl Amb24551332 [0,0,0,0,0,0|3,0,0]=3 183 B6R0.4 CCCCS(=O)[O-] Amb19889352 [0,0,0,0,0,0|2,0,1]=3 184 B6R0.4 CCCCS(N)=O Amb32720302 [0,0,0,0,0,0|3,0,0]=3 185 B6R0.4 CCCC[C@@H](C)N Amb20242479 [0,0,0,0,0,0|3,0,1]=4 186 B6R0.4 CCCC[C@@H](C)O Amb19929139 [0,0,0,0,0,0|2,0,1]=3 187 B6R0.4 CCCC[C@H](C)N Amb20242478 [0,0,0,0,0,0|3,0,1]=4 188 B6R0.4 CCCC[C@H](C)O Amb8515092 [0,0,0,0,0,0|2,0,1]=3 189 B6R0.4 CCCC[N+](=O)[O-] Amb6298783 [0,0,0,0,0,0|2,0,1]=3 190 B6R0.4 CCCC[PH](=O)O Amb8391286 [0,0,0,0,0,0|2,0,0]=2 191 B6R0.4 CCCC[SiH](C)C Amb9807507 [0,0,0,0,0,0|3,1,0]=4 192 B6R0.4 CCCNC(=N)N Amb10844865 [0,0,0,0,0,0|4,0,0]=4 193 B6R0.4 CCCNC(=N)N Amb20667746 [0,0,0,0,0,0|4,0,0]=4 194 B6R0.4 CCCNC(=O)Cl Amb25688616 [0,0,0,0,0,0|3,0,0]=3 195 B6R0.4 CCCNC(=S)S Amb28128280 [0,0,0,0,0,0|2,2,0]=4 196 B6R0.4 CCCNC(C)=O Amb5835710 [0,0,0,0,0,0|3,0,0]=3 197 B6R0.4 CCCNC(N)=O Amb1152241 [0,0,0,0,0,0|3,0,0]=3 198 B6R0.4 CCCNC(N)=S Amb1152085 [0,0,0,0,0,0|3,1,0]=4 199 B6R0.4 CCCN[N+](=O)[O-] Amb21953652 [0,0,0,0,0,0|3,0,1]=4 200 B6R0.4 CCCOC(=O)Cl Amb10604123 [0,0,0,0,0,0|3,0,0]=3 201 B6R0.4 CCCOC(=O)F Amb32667886 [0,0,0,0,0,0|3,0,0]=3 202 B6R0.4 CCCOC(=S)[S-] Amb594778 [0,0,0,0,0,0|2,2,0]=4 203 B6R0.4 CCCOC(N)=O Amb6334809 [0,0,0,0,0,0|3,0,0]=3 204 B6R0.4 CCCO[N+](=O)[O-] Amb22732564 [0,0,0,0,0,0|3,0,1]=4 205 B6R0.4 CCCSC(=N)N Amb20676008 [0,0,0,0,0,0|4,0,0]=4 206 B6R0.4 CCCSC(=N)N Amb23482968 [0,0,0,0,0,0|4,0,0]=4 207 B6R0.4 CCCSC(C)=O Amb22043301 [0,0,0,0,0,0|3,0,0]=3 208 B6R0.4 CCCSC(N)=O Amb27167907 [0,0,0,0,0,0|3,0,0]=3 209 B6R0.4 CCNCC(=N)N Amb28050789 [0,0,0,0,0,0|4,0,0]=4 210 B6R0.4 CCNCC(=O)Cl Amb27948279 [0,0,0,0,0,0|3,0,0]=3 211 B6R0.4 CCNCC(=O)O Amb10609667 [0,0,0,0,0,0|2,0,0]=2 212 B6R0.4 CCNCC(=O)O Amb7764661 [0,0,0,0,0,0|2,0,0]=2 213 B6R0.4 CCNCC(C)=O Amb24545893 [0,0,0,0,0,0|3,0,0]=3 214 B6R0.4 CCNCC(C)=O Amb32661185 [0,0,0,0,0,0|3,0,0]=3 215 B6R0.4 CCNCC(C)O Amb32666214 [0,0,0,0,0,0|3,0,1]=4 216 B6R0.4 CCNCC(C)O Amb9247475 [0,0,0,0,0,0|3,0,1]=4 217 B6R0.4 CCNCC(N)=O Amb1128676 [0,0,0,0,0,0|3,0,0]=3 218 B6R0.4 CCNCC(N)=O Amb4035424 [0,0,0,0,0,0|3,0,0]=3 219 B6R0.4 CCNC[C@@H](C)O Amb27827890 [0,0,0,0,0,0|3,0,1]=4 220 B6R0.4 CCNC[C@@H](C)O Amb32652513 [0,0,0,0,0,0|3,0,1]=4 221 B6R0.4 CCNC[C@H](C)O Amb25785620 [0,0,0,0,0,0|3,0,1]=4 222 B6R0.4 CCNC[C@H](C)O Amb32652535 [0,0,0,0,0,0|3,0,1]=4 223 B6R0.4 CCOCC(=N)N Amb19890012 [0,0,0,0,0,0|4,0,0]=4 224 B6R0.4 CCOCC(=N)N Amb6268669 [0,0,0,0,0,0|4,0,0]=4 225 B6R0.4 CCOCC(=O)Cl Amb33528415 [0,0,0,0,0,0|3,0,0]=3 226 B6R0.4 CCOCC(=O)O Amb3939880 [0,0,0,0,0,0|2,0,0]=2 227 B6R0.4 CCOCC(=O)S Amb27813482 [0,0,0,0,0,0|2,1,0]=3 228 B6R0.4 CCOCC(C)=O Amb9666086 [0,0,0,0,0,0|3,0,0]=3 229 B6R0.4 CCOCC(C)O Amb33535096 [0,0,0,0,0,0|3,0,1]=4 230 B6R0.4 CCOCC(N)=S Amb6276655 [0,0,0,0,0,0|3,1,0]=4 231 B6R0.4 CCOC[C@@H](C)O Amb27203934 [0,0,0,0,0,0|3,0,1]=4 232 B6R0.4 CCONC(C)=O Amb22230675 [0,0,0,0,0,0|4,0,0]=4 233 B6R0.4 CCPCC(=O)O Amb28321137 [0,0,0,0,0,0|2,0,0]=2 234 B6R0.4 CCSCC(=N)N Amb6680834 [0,0,0,0,0,0|4,0,0]=4 235 B6R0.4 CCSCC(=O)O Amb1125185 [0,0,0,0,0,0|2,0,0]=2 236 B6R0.4 CCSCC(C)=O Amb4018179 [0,0,0,0,0,0|3,0,0]=3 237 B6R0.4 CCSCC(N)=S Amb27188472 [0,0,0,0,0,0|3,1,0]=4 238 B6R0.4 CCSC[C@@H](C)O Amb26059442 [0,0,0,0,0,0|3,0,1]=4 239 B6R0.4 CCSC[C@H](C)O Amb25220206 [0,0,0,0,0,0|3,0,1]=4 240 B6R0.4 CC\C=C/C(=O)O Amb28429841 [0,0,0,0,0,0|1,0,2]=3 241 B6R0.4 CC\C=C/C(C)=O Amb27835645 [0,0,0,0,0,0|2,0,2]=4 242 B6R0.4 CC\C=C\C(=O)Cl Amb2690073 [0,0,0,0,0,0|2,0,2]=4 243 B6R0.4 CC\C=C\C(=O)O Amb6608967 [0,0,0,0,0,0|1,0,2]=3 244 B6R0.4 CC\C=C\C(C)=O Amb26022886 [0,0,0,0,0,0|2,0,2]=4 245 B6R0.4 CC\C=C\C(N)=O Amb25770876 [0,0,0,0,0,0|2,0,2]=4 246 B6R0.4 CC\N=C\C(=O)O Amb28041425 [0,0,0,0,0,0|2,0,1]=3 247 B6R0.4 CC\N=C\C(C)=O Amb27854982 [0,0,0,0,0,0|3,0,1]=4 248 B6R0.4 CN(C)CCCBr Amb10603677 [0,0,0,0,0,0|4,0,0]=4 249 B6R0.4 CN(C)CCCCl Amb33537241 [0,0,0,0,0,0|4,0,0]=4 250 B6R0.4 CN(C)CCCCl Amb8513141 [0,0,0,0,0,0|4,0,0]=4 251 B6R0.4 CN(C)CCCI Amb35781980 [0,0,0,0,0,0|4,0,0]=4 252 B6R0.4 CN(C)CCCN Amb3939839 [0,0,0,0,0,0|3,0,0]=3 253 B6R0.4 CN(C)CCCO Amb3939321 [0,0,0,0,0,0|4,0,0]=4 254 B6R0.4 CN(C)CCCS Amb24078629 [0,0,0,0,0,0|4,0,0]=4 255 B6R0.4 CN(C)CCCS Amb27974610 [0,0,0,0,0,0|4,0,0]=4 256 B6R0.4 CN(C)CCNN Amb1116628 [0,0,0,0,0,0|4,0,0]=4 257 B6R0.4 CN(C)CCNN Amb32414597 [0,0,0,0,0,0|4,0,0]=4 258 B6R0.4 CN(C)CCNN Amb33545778 [0,0,0,0,0,0|4,0,0]=4 259 B6R0.4 CN(C)CCNN Amb6892602 [0,0,0,0,0,0|4,0,0]=4 260 B6R0.4 CN(C)CCON Amb17104842 [0,0,0,0,0,0|4,0,0]=4 261 B6R0.4 CN(C)CCON Amb5721904 [0,0,0,0,0,0|4,0,0]=4 262 B6R0.4 CN(C)NCCN Amb18061645 [0,0,0,0,0,0|4,0,0]=4 263 B6R0.4 CN(C)OCCN Amb28313748 [0,0,0,0,0,0|4,0,0]=4 264 B6R0.4 CN(O)CCCF Amb33480871 [0,0,0,0,0,0|3,0,0]=3 265 B6R0.4 CNCCC(=O)Cl Amb27422890 [0,0,0,0,0,0|3,0,0]=3 266 B6R0.4 CNCCC(=O)O Amb10609760 [0,0,0,0,0,0|2,0,0]=2 267 B6R0.4 CNCCC(=O)O Amb7766400 [0,0,0,0,0,0|2,0,0]=2 268 B6R0.4 CNCCC(C)=O Amb24560306 [0,0,0,0,0,0|3,0,0]=3 269 B6R0.4 CNCCC(C)=O Amb28827637 [0,0,0,0,0,0|3,0,0]=3 270 B6R0.4 CNCCC(C)O Amb17569889 [0,0,0,0,0,0|3,0,1]=4 271 B6R0.4 CNCCC(C)O Amb34141241 [0,0,0,0,0,0|3,0,1]=4 272 B6R0.4 CNCCC(N)=O Amb19959913 [0,0,0,0,0,0|3,0,0]=3 273 B6R0.4 CNCCC(N)=O Amb33538309 [0,0,0,0,0,0|3,0,0]=3 274 B6R0.4 CNCCN(C)O Amb27628863 [0,0,0,0,0,0|4,0,0]=4 275 B6R0.4 CNCCS(C)=O Amb21984676 [0,0,0,0,0,0|4,0,0]=4 276 B6R0.4 CNCC[C@H](C)O Amb27801301 [0,0,0,0,0,0|3,0,1]=4 277 B6R0.4 CNCC[N+](=O)[O-] Amb35704404 [0,0,0,0,0,0|3,0,1]=4 278 B6R0.4 COCCB(O)O Amb27173037 [0,0,0,0,0,0|3,0,1]=4 279 B6R0.4 COCCC(=N)N Amb2696283 [0,0,0,0,0,0|4,0,0]=4 280 B6R0.4 COCCC(=N)N Amb8630184 [0,0,0,0,0,0|4,0,0]=4 281 B6R0.4 COCCC(=O)Cl Amb2689274 [0,0,0,0,0,0|3,0,0]=3 282 B6R0.4 COCCC(=O)O Amb3938990 [0,0,0,0,0,0|2,0,0]=2 283 B6R0.4 COCCC(C)=O Amb7764907 [0,0,0,0,0,0|3,0,0]=3 284 B6R0.4 COCCC(C)O Amb20621489 [0,0,0,0,0,0|3,0,1]=4 285 B6R0.4 COCCC(N)=O Amb33538943 [0,0,0,0,0,0|3,0,0]=3 286 B6R0.4 COCCC(N)=S Amb6250669 [0,0,0,0,0,0|3,1,0]=4 287 B6R0.4 COCCC(O)Br Amb20242943 [0,0,0,0,0,0|3,0,1]=4 288 B6R0.4 COCCC(O)O Amb28410462 [0,0,0,0,0,0|2,0,2]=4 289 B6R0.4 COCCN(C)O Amb33428857 [0,0,0,0,0,0|4,0,0]=4 290 B6R0.4 COCCS(=O)Cl Amb25914790 [0,0,0,0,0,0|4,0,0]=4 291 B6R0.4 COCCS(=O)[O-] Amb26874008 [0,0,0,0,0,0|3,0,1]=4 292 B6R0.4 COCCS(N)=O Amb32720336 [0,0,0,0,0,0|4,0,0]=4 293 B6R0.4 COCC[C@@H](C)O Amb27237141 [0,0,0,0,0,0|3,0,1]=4 294 B6R0.4 COCC[C@H](C)O Amb26559043 [0,0,0,0,0,0|3,0,1]=4 295 B6R0.4 COCNC(N)=O Amb25744350 [0,0,0,0,0,0|4,0,0]=4 296 B6R0.4 CONCC(N)=O Amb28455463 [0,0,0,0,0,0|4,0,0]=4 297 B6R0.4 CO\C=C\C(=O)O Amb18121767 [0,0,0,0,0,0|2,0,2]=4 298 B6R0.4 CO\N=C\C(=O)O Amb10976081 [0,0,0,0,0,0|3,0,1]=4 299 B6R0.4 CP(O)OCCCl Amb28384727 [0,0,0,0,0,0|4,0,0]=4 300 B6R0.4 CS(=O)CCCN Amb18974527 [0,0,0,0,0,0|2,0,0]=2 301 B6R0.4 CS(=O)CCCN Amb32684177 [0,0,0,0,0,0|2,0,0]=2 302 B6R0.4 CS(=O)NCCN Amb25888549 [0,0,0,0,0,0|3,0,0]=3 303 B6R0.4 CS(=O)OCCCl Amb27471823 [0,0,0,0,0,0|4,0,0]=4 304 B6R0.4 CSC#CC(=O)O Amb33309663 [0,0,0,0,0,0|2,0,2]=4 305 B6R0.4 CSCCC(=N)N Amb19373501 [0,0,0,0,0,0|4,0,0]=4 306 B6R0.4 CSCCC(=N)N Amb19516878 [0,0,0,0,0,0|4,0,0]=4 307 B6R0.4 CSCCC(=O)O Amb3939879 [0,0,0,0,0,0|2,0,0]=2 308 B6R0.4 CSCCC(C)=O Amb8392858 [0,0,0,0,0,0|3,0,0]=3 309 B6R0.4 CSCCC(C)O Amb27860401 [0,0,0,0,0,0|3,0,1]=4 310 B6R0.4 CSCCC(N)=S Amb17307559 [0,0,0,0,0,0|3,1,0]=4 311 B6R0.4 CSCCN(=O)=O Amb24179458 [0,0,0,0,0,0|3,0,1]=4 312 B6R0.4 CSCCN(C)O Amb33272058 [0,0,0,0,0,0|4,0,0]=4 313 B6R0.4 CSCC[C@@H](C)O Amb33198759 [0,0,0,0,0,0|3,0,1]=4 314 B6R0.4 CSCC[C@H](C)O Amb33198747 [0,0,0,0,0,0|3,0,1]=4 315 B6R0.4 CSCSC(C)=O Amb27876851 [0,0,0,0,0,0|4,0,0]=4 316 B6R0.4 CSSCC(=O)O Amb25378801 [0,0,0,0,0,0|3,0,0]=3 317 B6R0.4 CS\C=C\C(=O)O Amb30584688 [0,0,0,0,0,0|2,0,2]=4 318 B6R0.4 C[C@@H](Cl)CCCO Amb27233570 [0,0,0,0,0,0|3,0,1]=4 319 B6R0.4 C[C@@H](N)CCCF Amb33377445 [0,0,0,0,0,0|3,0,1]=4 320 B6R0.4 C[C@@H](N)CCCO Amb27602210 [0,0,0,0,0,0|3,0,1]=4 321 B6R0.4 C[C@@H](O)CCCCl Amb22801499 [0,0,0,0,0,0|2,0,1]=3 322 B6R0.4 C[C@@H](O)CCCF Amb33376908 [0,0,0,0,0,0|2,0,1]=3 323 B6R0.4 C[C@@H](O)CCCO Amb28047449 [0,0,0,0,0,0|2,0,1]=3 324 B6R0.4 C[C@H](N)CCCF Amb33377444 [0,0,0,0,0,0|3,0,1]=4 325 B6R0.4 C[C@H](O)CCC=O Amb27188424 [0,0,0,0,0,0|2,0,2]=4 326 B6R0.4 C[C@H](O)CCCF Amb33376887 [0,0,0,0,0,0|2,0,1]=3 327 B6R0.4 C[PH](=O)OCCCl Amb28340992 [0,0,0,0,0,0|4,0,0]=4 328 B6R0.4 C[SiH](C)CCCCl Amb27655852 [0,0,0,0,0,0|3,1,0]=4 329 B6R0.4 C[SiH](Cl)CCCCl Amb28364265 [0,0,0,0,0,0|3,1,0]=4 330 B6R0.4 C\C(Br)=C\CCCl Amb28054738 [0,0,0,0,0,0|3,0,1]=4 331 B6R0.4 C\C(Br)=C\CCN Amb28060834 [0,0,0,0,0,0|2,0,1]=3 332 B6R0.4 C\C(Cl)=C\CCCl Amb27786934 [0,0,0,0,0,0|3,0,1]=4 333 B6R0.4 C\C(Cl)=C\CCO Amb27956430 [0,0,0,0,0,0|3,0,1]=4 334 B6R0.4 C\C(Cl)=C\CNN Amb27232272 [0,0,0,0,0,0|3,0,1]=4 335 B6R0.4 C\C(N)=N\CCO Amb26857579 [0,0,0,0,0,0|4,0,0]=4 336 B6R0.4 C\C=C\CC(=O)O Amb3941538 [0,0,0,0,0,0|1,0,2]=3 337 B6R0.4 C\C=C\CC(N)=O Amb26589975 [0,0,0,0,0,0|2,0,2]=4 338 B6R0.4 C\N=C\CC(C)=O Amb28202181 [0,0,0,0,0,0|3,0,1]=4 339 B6R0.4 ClCCC=C(Cl)Cl Amb27882644 [0,0,0,0,0,0|3,0,1]=4 340 B6R0.4 ClCCCC(Cl)Cl Amb25343250 [0,0,0,0,0,0|3,0,1]=4 341 B6R0.4 ClCCC[SiH](Cl)Cl Amb27831288 [0,0,0,0,0,0|3,1,0]=4 342 B6R0.4 FC(F)=CCCBr Amb10839379 [0,0,0,0,0,0|3,0,1]=4 343 B6R0.4 FC(F)=CCCCl Amb19895470 [0,0,0,0,0,0|3,0,1]=4 344 B6R0.4 FC(F)CCCBr Amb27816901 [0,0,0,0,0,0|3,0,1]=4 345 B6R0.4 FC(F)CCCCl Amb32688139 [0,0,0,0,0,0|3,0,1]=4 346 B6R0.4 FC(F)CCCI Amb35636651 [0,0,0,0,0,0|3,0,1]=4 347 B6R0.4 FC(F)CCCS Amb32812927 [0,0,0,0,0,0|3,0,1]=4 348 B6R0.4 N#CCCC(=O)Cl Amb25106570 [0,0,0,0,0,0|1,0,2]=3 349 B6R0.4 N#CCCC(=O)O Amb2694975 [0,0,0,0,0,0|0,0,2]=2 350 B6R0.4 N#CCCC(N)=O Amb8841150 [0,0,0,0,0,0|1,0,2]=3 351 B6R0.4 N#CCCS(=O)Cl Amb32720334 [0,0,0,0,0,0|2,0,2]=4 352 B6R0.4 N#CCCS(=O)[O-] Amb32754806 [0,0,0,0,0,0|1,0,3]=4 353 B6R0.4 N#CCCS(N)=O Amb32720335 [0,0,0,0,0,0|2,0,2]=4 354 B6R0.4 N#CCNC(N)=O Amb20622301 [0,0,0,0,0,0|2,0,2]=4 355 B6R0.4 N#C\C=C\C(=O)O Amb25853809 [0,0,0,0,0,0|0,0,4]=4 356 B6R0.4 N=C(N)CCCBr Amb4297022 [0,0,0,0,0,0|3,0,0]=3 357 B6R0.4 N=C(N)CCCCl Amb4297061 [0,0,0,0,0,0|3,0,0]=3 358 B6R0.4 N=C(N)CCCF Amb27231400 [0,0,0,0,0,0|3,0,0]=3 359 B6R0.4 N=C(N)CCCN Amb25888970 [0,0,0,0,0,0|2,0,0]=2 360 B6R0.4 N=C(N)CCCN Amb33299271 [0,0,0,0,0,0|2,0,0]=2 361 B6R0.4 N=C(N)CCCO Amb33038287 [0,0,0,0,0,0|3,0,0]=3 362 B6R0.4 N=C(N)NCCN Amb27815372 [0,0,0,0,0,0|3,0,0]=3 363 B6R0.4 N=C(N)NCCN Amb28827645 [0,0,0,0,0,0|3,0,0]=3 364 B6R0.4 N=C(N)NCCO Amb16231403 [0,0,0,0,0,0|4,0,0]=4 365 B6R0.4 N=C(N)NCCO Amb6429694 [0,0,0,0,0,0|4,0,0]=4 366 B6R0.4 N=C(N)SCCCl Amb28282677 [0,0,0,0,0,0|4,0,0]=4 367 B6R0.4 N=C(N)SCCN Amb1146037 [0,0,0,0,0,0|3,0,0]=3 368 B6R0.4 N=C(N)SCCN Amb3940706 [0,0,0,0,0,0|3,0,0]=3 369 B6R0.4 N=C(N)SCCO Amb1160204 [0,0,0,0,0,0|4,0,0]=4 370 B6R0.4 N=C(N)SCCO Amb34916582 [0,0,0,0,0,0|4,0,0]=4 371 B6R0.4 N=CNCC(=O)Cl Amb27216499 [0,0,0,0,0,0|2,0,2]=4 372 B6R0.4 N=CNCC(=O)O Amb24670244 [0,0,0,0,0,0|1,0,2]=3 373 B6R0.4 NC(=O)CCCCl Amb1138237 [0,0,0,0,0,0|2,0,0]=2 374 B6R0.4 NC(=O)CCCF Amb28073400 [0,0,0,0,0,0|2,0,0]=2 375 B6R0.4 NC(=O)CCCO Amb20623438 [0,0,0,0,0,0|2,0,0]=2 376 B6R0.4 NC(=O)CCCS Amb27174778 [0,0,0,0,0,0|2,0,0]=2 377 B6R0.4 NC(=O)CN=C=S Amb6673216 [0,0,0,0,0,0|3,0,1]=4 378 B6R0.4 NC(=O)C\C=C/Cl Amb27593169 [0,0,0,0,0,0|2,0,2]=4 379 B6R0.4 NC(=O)NCCBr Amb28385599 [0,0,0,0,0,0|3,0,0]=3 380 B6R0.4 NC(=O)NCCF Amb27446994 [0,0,0,0,0,0|3,0,0]=3 381 B6R0.4 NC(=O)NCCI Amb27454955 [0,0,0,0,0,0|3,0,0]=3 382 B6R0.4 NC(=O)NCCO Amb1146041 [0,0,0,0,0,0|3,0,0]=3 383 B6R0.4 NC(=O)OCCCl Amb3940645 [0,0,0,0,0,0|3,0,0]=3 384 B6R0.4 NC(=O)OCCO Amb20623788 [0,0,0,0,0,0|3,0,0]=3 385 B6R0.4 NC(=O)SCCCl Amb27619850 [0,0,0,0,0,0|3,0,0]=3 386 B6R0.4 NC(=S)CCCBr Amb33328371 [0,0,0,0,0,0|2,1,0]=3 387 B6R0.4 NC(=S)CCCCl Amb33328364 [0,0,0,0,0,0|2,1,0]=3 388 B6R0.4 NC(=S)CCCO Amb9215001 [0,0,0,0,0,0|2,1,0]=3 389 B6R0.4 NC(=S)NCCBr Amb27760395 [0,0,0,0,0,0|3,1,0]=4 390 B6R0.4 NC(=S)NCCF Amb26580655 [0,0,0,0,0,0|3,1,0]=4 391 B6R0.4 NC(=S)NCCO Amb19515723 [0,0,0,0,0,0|3,1,0]=4 392 B6R0.4 NC(=S)NCCS Amb19374848 [0,0,0,0,0,0|3,1,0]=4 393 B6R0.4 NC(N)=NCCO Amb19374418 [0,0,0,0,0,0|4,0,0]=4 394 B6R0.4 NC(N)=NCCS Amb25127300 [0,0,0,0,0,0|4,0,0]=4 395 B6R0.4 NCC#CC(=O)O Amb25703096 [0,0,0,0,0,0|0,0,2]=2 396 B6R0.4 NCC#CC(=O)O Amb32666878 [0,0,0,0,0,0|0,0,2]=2 397 B6R0.4 NCCCB(O)O Amb25878196 [0,0,0,0,0,0|1,0,1]=2 398 B6R0.4 NCCCB(O)O Amb33339111 [0,0,0,0,0,0|1,0,1]=2 399 B6R0.4 NCCCC(=O)Cl Amb1935063 [0,0,0,0,0,0|1,0,0]=1 400 B6R0.4 NCCCC(=O)O Amb1935210 [0,0,0,0,0,0|0,0,0]=0 401 B6R0.4 NCCCC(F)F Amb20670479 [0,0,0,0,0,0|2,0,1]=3 402 B6R0.4 NCCCC(F)F Amb27763708 [0,0,0,0,0,0|2,0,1]=3 403 B6R0.4 NCCCC(N)=O Amb2099583 [0,0,0,0,0,0|1,0,0]=1 404 B6R0.4 NCCCC(N)=O Amb6543438 [0,0,0,0,0,0|1,0,0]=1 405 B6R0.4 NCCCS(=O)O Amb25185942 [0,0,0,0,0,0|1,0,0]=1 406 B6R0.4 NCCC[N+](=O)[O-] Amb18833132 [0,0,0,0,0,0|1,0,1]=2 407 B6R0.4 NCCC[PH](=O)O Amb22370049 [0,0,0,0,0,0|1,0,0]=1 408 B6R0.4 NCCNB(O)O Amb28074068 [0,0,0,0,0,0|2,0,1]=3 409 B6R0.4 NCCNC(N)=O Amb19374121 [0,0,0,0,0,0|2,0,0]=2 410 B6R0.4 NCCNC(N)=O Amb32665340 [0,0,0,0,0,0|2,0,0]=2 411 B6R0.4 NCCNC(N)=O Amb6254968 [0,0,0,0,0,0|2,0,0]=2 412 B6R0.4 NCCNC(N)=S Amb20619929 [0,0,0,0,0,0|2,1,0]=3 413 B6R0.4 NCCOB(O)O Amb27257443 [0,0,0,0,0,0|2,0,1]=3 414 B6R0.4 NCCOC(F)F Amb25132824 [0,0,0,0,0,0|3,0,1]=4 415 B6R0.4 NCCOC(N)=O Amb22059480 [0,0,0,0,0,0|2,0,0]=2 416 B6R0.4 NCCOC(N)=O Amb24271076 [0,0,0,0,0,0|2,0,0]=2 417 B6R0.4 NCCOP(O)O Amb28184361 [0,0,0,0,0,0|2,0,1]=3 418 B6R0.4 NCCOS(=O)O Amb25843211 [0,0,0,0,0,0|2,0,0]=2 419 B6R0.4 NCCO[PH](=O)O Amb28046334 [0,0,0,0,0,0|2,0,0]=2 420 B6R0.4 NCCSC(=S)S Amb27407724 [0,0,0,0,0,0|1,2,0]=3 421 B6R0.4 NC\C=C/C(=O)O Amb24117018 [0,0,0,0,0,0|0,0,2]=2 422 B6R0.4 NC\C=C\B(O)O Amb25824731 [0,0,0,0,0,0|1,0,3]=4 423 B6R0.4 NC\C=C\C(=O)O Amb33422010 [0,0,0,0,0,0|0,0,2]=2 424 B6R0.4 NC\C=C\C(=O)O Amb33422035 [0,0,0,0,0,0|0,0,2]=2 425 B6R0.4 NNCCC(=O)O Amb33756816 [0,0,0,0,0,0|1,0,0]=1 426 B6R0.4 NNCO[PH](=O)O Amb28239913 [0,0,0,0,0,0|3,0,0]=3 427 B6R0.4 NOCC=C(Cl)Cl Amb35703893 [0,0,0,0,0,0|3,0,1]=4 428 B6R0.4 NOCCC(=O)O Amb17569891 [0,0,0,0,0,0|1,0,0]=1 429 B6R0.4 NOCCC(=O)O Amb32693437 [0,0,0,0,0,0|1,0,0]=1 430 B6R0.4 NOCCC(F)F Amb24663364 [0,0,0,0,0,0|3,0,1]=4 431 B6R0.4 NOCCC(N)=O Amb27838275 [0,0,0,0,0,0|2,0,0]=2 432 B6R0.4 NS(=O)CCCBr Amb32720400 [0,0,0,0,0,0|3,0,0]=3 433 B6R0.4 NS(=O)CCCCl Amb32720303 [0,0,0,0,0,0|3,0,0]=3 434 B6R0.4 NS(=O)CCCF Amb32720390 [0,0,0,0,0,0|3,0,0]=3 435 B6R0.4 O=C(Br)CCCBr Amb25724818 [0,0,0,0,0,0|2,0,0]=2 436 B6R0.4 O=C(Cl)CCCBr Amb3940241 [0,0,0,0,0,0|2,0,0]=2 437 B6R0.4 O=C(Cl)CCCCl Amb6608638 [0,0,0,0,0,0|2,0,0]=2 438 B6R0.4 O=C(Cl)NCCBr Amb28123956 [0,0,0,0,0,0|3,0,0]=3 439 B6R0.4 O=C(Cl)NCCCl Amb24479815 [0,0,0,0,0,0|3,0,0]=3 440 B6R0.4 O=C(Cl)NCCF Amb35633248 [0,0,0,0,0,0|3,0,0]=3 441 B6R0.4 O=C(Cl)OCCBr Amb8514406 [0,0,0,0,0,0|3,0,0]=3 442 B6R0.4 O=C(Cl)OCCCl Amb6608837 [0,0,0,0,0,0|3,0,0]=3 443 B6R0.4 O=C(Cl)OCCF Amb21618836 [0,0,0,0,0,0|3,0,0]=3 444 B6R0.4 O=C(Cl)\C=C\CCl Amb33294776 [0,0,0,0,0,0|2,0,2]=4 445 B6R0.4 O=C(O)C#CCCl Amb33544591 [0,0,0,0,0,0|1,0,2]=3 446 B6R0.4 O=C(O)C#CCI Amb27860307 [0,0,0,0,0,0|1,0,2]=3 447 B6R0.4 O=C(O)C#CCO Amb22002375 [0,0,0,0,0,0|1,0,2]=3 448 B6R0.4 O=C(O)CCCBr Amb8393276 [0,0,0,0,0,0|1,0,0]=1 449 B6R0.4 O=C(O)CCCCl Amb3940333 [0,0,0,0,0,0|1,0,0]=1 450 B6R0.4 O=C(O)CCCF Amb17593104 [0,0,0,0,0,0|1,0,0]=1 451 B6R0.4 O=C(O)CCCI Amb22295911 [0,0,0,0,0,0|1,0,0]=1 452 B6R0.4 O=C(O)CCCO Amb18640332 [0,0,0,0,0,0|1,0,0]=1 453 B6R0.4 O=C(O)CCCS Amb16185429 [0,0,0,0,0,0|1,0,0]=1 454 B6R0.4 O=C(O)CCNO Amb28067767 [0,0,0,0,0,0|2,0,0]=2 455 B6R0.4 O=C(O)CCSCl Amb28387511 [0,0,0,0,0,0|2,0,0]=2 456 B6R0.4 O=C(O)COCF Amb33378705 [0,0,0,0,0,0|2,0,0]=2 457 B6R0.4 O=C(O)CPCO Amb28340565 [0,0,0,0,0,0|2,0,0]=2 458 B6R0.4 O=C(O)CSSCl Amb27477882 [0,0,0,0,0,0|3,0,0]=3 459 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [0,0,0,0,0,0|1,0,2]=3 460 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [0,0,0,0,0,0|1,0,2]=3 461 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [0,0,0,0,0,0|1,0,2]=3 462 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [0,0,0,0,0,0|1,0,2]=3 463 B6R0.4 O=C(O)\C=C\CF Amb33470171 [0,0,0,0,0,0|1,0,2]=3 464 B6R0.4 O=C(O)\C=C\CO Amb32662006 [0,0,0,0,0,0|1,0,2]=3 465 B6R0.4 O=C(S)NCCO Amb27430045 [0,0,0,0,0,0|2,1,0]=3 466 B6R0.4 O=C([O-])CCCO Amb3429667 [0,0,0,0,0,0|1,0,1]=2 467 B6R0.4 O=C([O-])CNCO Amb8383630 [0,0,0,0,0,0|2,0,1]=3 468 B6R0.4 O=C([O-])\C=C\CO Amb33542275 [0,0,0,0,0,0|1,0,3]=4 469 B6R0.4 O=CCCC(=O)O Amb17673897 [0,0,0,0,0,0|1,0,1]=2 470 B6R0.4 O=CCCC(O)O Amb27838257 [0,0,0,0,0,0|1,0,3]=4 471 B6R0.4 O=CCC[N+](=O)[O-] Amb24052990 [0,0,0,0,0,0|2,0,2]=4 472 B6R0.4 O=CNCC(=O)O Amb1911508 [0,0,0,0,0,0|2,0,1]=3 473 B6R0.4 O=COCC(=O)O Amb26624011 [0,0,0,0,0,0|2,0,1]=3 474 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [0,0,0,0,0,0|1,0,3]=4 475 B6R0.4 O=S(Br)OCCCl Amb28422386 [0,0,0,0,0,0|4,0,0]=4 476 B6R0.4 O=S(Cl)CCCBr Amb32720399 [0,0,0,0,0,0|3,0,0]=3 477 B6R0.4 O=S(Cl)CCCCl Amb25791632 [0,0,0,0,0,0|3,0,0]=3 478 B6R0.4 O=S(Cl)CCCF Amb32720389 [0,0,0,0,0,0|3,0,0]=3 479 B6R0.4 O=S(Cl)OCCCl Amb27975786 [0,0,0,0,0,0|4,0,0]=4 480 B6R0.4 O=S(O)COCO Amb27410575 [0,0,0,0,0,0|3,0,0]=3 481 B6R0.4 O=S(O)OCCCl Amb27786730 [0,0,0,0,0,0|3,0,0]=3 482 B6R0.4 O=S([O-])CCCBr Amb32754123 [0,0,0,0,0,0|2,0,1]=3 483 B6R0.4 O=S([O-])CCCCl Amb26370094 [0,0,0,0,0,0|2,0,1]=3 484 B6R0.4 O=S([O-])CCCF Amb32754093 [0,0,0,0,0,0|2,0,1]=3 485 B6R0.4 O=S([O-])CCCO Amb27221257 [0,0,0,0,0,0|2,0,1]=3 486 B6R0.4 O=[N+]([O-])CCCCl Amb25267487 [0,0,0,0,0,0|2,0,1]=3 487 B6R0.4 O=[N+]([O-])CCCF Amb25234942 [0,0,0,0,0,0|2,0,1]=3 488 B6R0.4 O=[N+]([O-])CCCO Amb20247690 [0,0,0,0,0,0|2,0,1]=3 489 B6R0.4 O=[N+]([O-])NCCO Amb17618377 [0,0,0,0,0,0|3,0,1]=4 490 B6R0.4 O=[N+]([O-])OCCCl Amb27963893 [0,0,0,0,0,0|3,0,1]=4 491 B6R0.4 O=[PH](O)CCCO Amb28345330 [0,0,0,0,0,0|2,0,0]=2 492 B6R0.4 O=[PH](S)OCCO Amb27981751 [0,0,0,0,0,0|3,1,0]=4 493 B6R0.4 OB(O)CCCBr Amb24480413 [0,0,0,0,0,0|2,0,1]=3 494 B6R0.4 OB(O)CCCCl Amb28347311 [0,0,0,0,0,0|2,0,1]=3 495 B6R0.4 OB(O)CCNCl Amb27978905 [0,0,0,0,0,0|3,0,1]=4 496 B6R0.4 OCCC=C(Cl)Cl Amb17593563 [0,0,0,0,0,0|3,0,1]=4 497 B6R0.4 OCCCB(O)O Amb27391604 [0,0,0,0,0,0|2,0,1]=3 498 B6R0.4 OCCCC(F)F Amb26940819 [0,0,0,0,0,0|3,0,1]=4 499 B6R0.4 OCCOP(O)O Amb28283645 [0,0,0,0,0,0|3,0,1]=4 500 B6R0.4 OP(O)OCCCl Amb27469023 [0,0,0,0,0,0|3,0,1]=4 501 B6R0.4 [C-]#[N+]CCC(=C)C Amb33199608 [0,0,0,0,0,0|4,0,0]=4 502 B6R0.4 [N-]=[N+]=NCC(=O)Cl Amb27267972 [0,0,0,0,0,0|3,0,1]=4 503 B6R0.4 [N-]=[N+]=NCC(=O)F Amb27187200 [0,0,0,0,0,0|3,0,1]=4 504 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [0,0,0,0,0,0|2,0,1]=3 505 B6R0.4 [N-]=[N+]=NCC(=O)[O-] Amb32662603 [0,0,0,0,0,0|2,0,2]=4 506 B6R0.4 [N-]=[N+]=NCC(N)=O Amb26393051 [0,0,0,0,0,0|3,0,1]=4 507 B5R0.1 BC(=O)NCC Amb27430059 [1,0,0,0,0,0|2,0,0]=3 508 B5R0.1 C#CCC(=O)O Amb33532662 [1,0,0,0,0,0|0,0,2]=3 509 B5R0.1 C=C(Br)CCBr Amb25827098 [1,0,0,0,0,0|3,0,0]=4 510 B5R0.1 C=C(Br)CCCl Amb8391241 [1,0,0,0,0,0|3,0,0]=4 511 B5R0.1 C=C(Br)CCO Amb4014497 [1,0,0,0,0,0|3,0,0]=4 512 B5R0.1 C=C(Br)CNC Amb18950247 [1,0,0,0,0,0|3,0,0]=4 513 B5R0.1 C=C(Br)CNN Amb27205172 [1,0,0,0,0,0|3,0,0]=4 514 B5R0.1 C=C(Br)COC Amb25361496 [1,0,0,0,0,0|3,0,0]=4 515 B5R0.1 C=C(Br)CSC Amb28313326 [1,0,0,0,0,0|3,0,0]=4 516 B5R0.1 C=C(C)CCBr Amb21857866 [1,0,0,0,0,0|3,0,0]=4 517 B5R0.1 C=C(C)CCC Amb8513259 [1,0,0,0,0,0|2,0,0]=3 518 B5R0.1 C=C(C)CCCl Amb27810807 [1,0,0,0,0,0|3,0,0]=4 519 B5R0.1 C=C(C)CCI Amb26649317 [1,0,0,0,0,0|3,0,0]=4 520 B5R0.1 C=C(C)CCN Amb17673481 [1,0,0,0,0,0|2,0,0]=3 521 B5R0.1 C=C(C)CCN Amb33543001 [1,0,0,0,0,0|2,0,0]=3 522 B5R0.1 C=C(C)CCO Amb34916534 [1,0,0,0,0,0|3,0,0]=4 523 B5R0.1 C=C(C)CCO Amb8513522 [1,0,0,0,0,0|3,0,0]=4 524 B5R0.1 C=C(C)CCS Amb25887673 [1,0,0,0,0,0|3,0,0]=4 525 B5R0.1 C=C(C)CNC Amb30625043 [1,0,0,0,0,0|3,0,0]=4 526 B5R0.1 C=C(C)CNC Amb3941317 [1,0,0,0,0,0|3,0,0]=4 527 B5R0.1 C=C(C)CNN Amb2792852 [1,0,0,0,0,0|3,0,0]=4 528 B5R0.1 C=C(C)COC Amb26589016 [1,0,0,0,0,0|3,0,0]=4 529 B5R0.1 C=C(C)CON Amb18560218 [1,0,0,0,0,0|3,0,0]=4 530 B5R0.1 C=C(C)CON Amb30634348 [1,0,0,0,0,0|3,0,0]=4 531 B5R0.1 C=C(C)CSC Amb20671946 [1,0,0,0,0,0|3,0,0]=4 532 B5R0.1 C=C(C)OCC Amb8393241 [1,0,0,0,0,0|3,0,0]=4 533 B5R0.1 C=C(Cl)CCI Amb28187982 [1,0,0,0,0,0|3,0,0]=4 534 B5R0.1 C=C(Cl)CCN Amb27493165 [1,0,0,0,0,0|2,0,0]=3 535 B5R0.1 C=C(F)CNC Amb28194424 [1,0,0,0,0,0|3,0,0]=4 536 B5R0.1 C=CCC(=O)Cl Amb33543701 [1,0,0,0,0,0|1,0,2]=4 537 B5R0.1 C=CCC(=O)O Amb3940098 [1,0,0,0,0,0|0,0,2]=3 538 B5R0.1 C=CCC(C)=O Amb8396482 [1,0,0,0,0,0|1,0,2]=4 539 B5R0.1 C=CCC(N)=O Amb17610156 [1,0,0,0,0,0|1,0,2]=4 540 B5R0.1 C=CCS(=O)O Amb33534190 [1,0,0,0,0,0|1,0,2]=4 541 B5R0.1 C=CC[PH](=O)O Amb8391287 [1,0,0,0,0,0|1,0,2]=4 542 B5R0.1 C=NCC(N)=O Amb26548445 [1,0,0,0,0,0|2,0,1]=4 543 B5R0.1 CC#CC(=O)Cl Amb27778056 [1,0,0,0,0,0|1,0,2]=4 544 B5R0.1 CC#CC(=O)O Amb2685714 [1,0,0,0,0,0|0,0,2]=3 545 B5R0.1 CC#CC(C)=O Amb17593016 [1,0,0,0,0,0|1,0,2]=4 546 B5R0.1 CC#CC(N)=O Amb10552409 [1,0,0,0,0,0|1,0,2]=4 547 B5R0.1 CC(=O)CC#N Amb1102132 [1,0,0,0,0,0|1,0,2]=4 548 B5R0.1 CC(=O)CC=N Amb28285098 [1,0,0,0,0,0|1,0,2]=4 549 B5R0.1 CC(=O)CCBr Amb24078246 [1,0,0,0,0,0|2,0,0]=3 550 B5R0.1 CC(=O)CCCl Amb2720823 [1,0,0,0,0,0|2,0,0]=3 551 B5R0.1 CC(=O)CCF Amb26427773 [1,0,0,0,0,0|2,0,0]=3 552 B5R0.1 CC(=O)CCN Amb18632933 [1,0,0,0,0,0|1,0,0]=2 553 B5R0.1 CC(=O)CCN Amb33544540 [1,0,0,0,0,0|1,0,0]=2 554 B5R0.1 CC(=O)CCO Amb836357 [1,0,0,0,0,0|2,0,0]=3 555 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [1,0,0,0,0,0|1,0,1]=3 556 B5R0.1 CC(=O)CNO Amb28049954 [1,0,0,0,0,0|3,0,0]=4 557 B5R0.1 CC(=O)CSN Amb28430346 [1,0,0,0,0,0|2,0,0]=3 558 B5R0.1 CC(=O)NCO Amb8516057 [1,0,0,0,0,0|3,0,0]=4 559 B5R0.1 CC(=O)OCBr Amb3941481 [1,0,0,0,0,0|3,0,0]=4 560 B5R0.1 CC(=O)OCCl Amb33542858 [1,0,0,0,0,0|3,0,0]=4 561 B5R0.1 CC(=O)OCI Amb25226851 [1,0,0,0,0,0|3,0,0]=4 562 B5R0.1 CC(=O)SCBr Amb25349900 [1,0,0,0,0,0|3,0,0]=4 563 B5R0.1 CC(=O)SCI Amb33339258 [1,0,0,0,0,0|3,0,0]=4 564 B5R0.1 CC(=O)SCO Amb27255261 [1,0,0,0,0,0|3,0,0]=4 565 B5R0.1 CC(=O)\C=C/N Amb25147403 [1,0,0,0,0,0|1,0,2]=4 566 B5R0.1 CC(=O)\C=C\N Amb8395283 [1,0,0,0,0,0|1,0,2]=4 567 B5R0.1 CC(C)=CCN Amb10601678 [1,0,0,0,0,0|2,0,1]=4 568 B5R0.1 CC(C)=CCN Amb10601679 [1,0,0,0,0,0|2,0,1]=4 569 B5R0.1 CC(C)CCN Amb22337707 [1,0,0,0,0,0|2,0,1]=4 570 B5R0.1 CC(C)CCN Amb3939010 [1,0,0,0,0,0|2,0,1]=4 571 B5R0.1 CC(Cl)CCN Amb28383162 [1,0,0,0,0,0|2,0,1]=4 572 B5R0.1 CC(F)CCN Amb26081186 [1,0,0,0,0,0|2,0,1]=4 573 B5R0.1 CC(F)CCN Amb32653508 [1,0,0,0,0,0|2,0,1]=4 574 B5R0.1 CC(N)CCN Amb18951361 [1,0,0,0,0,0|2,0,1]=4 575 B5R0.1 CC(N)CCN Amb19338152 [1,0,0,0,0,0|2,0,1]=4 576 B5R0.1 CC(O)CCBr Amb33548043 [1,0,0,0,0,0|2,0,1]=4 577 B5R0.1 CC(O)CCCl Amb24551052 [1,0,0,0,0,0|2,0,1]=4 578 B5R0.1 CC(O)CCF Amb26449397 [1,0,0,0,0,0|2,0,1]=4 579 B5R0.1 CC(O)CCN Amb32666140 [1,0,0,0,0,0|1,0,1]=3 580 B5R0.1 CC(O)CCN Amb33537908 [1,0,0,0,0,0|1,0,1]=3 581 B5R0.1 CC(O)CCO Amb6608662 [1,0,0,0,0,0|2,0,1]=4 582 B5R0.1 CC(O)CNN Amb33622274 [1,0,0,0,0,0|2,0,1]=4 583 B5R0.1 CC(O)CNN Amb844968 [1,0,0,0,0,0|2,0,1]=4 584 B5R0.1 CC(O)CON Amb21962618 [1,0,0,0,0,0|2,0,1]=4 585 B5R0.1 CC(S)CCN Amb18908261 [1,0,0,0,0,0|1,1,1]=4 586 B5R0.1 CC(S)CCN Amb32675067 [1,0,0,0,0,0|1,1,1]=4 587 B5R0.1 CCC=C(Br)Br Amb25887651 [1,0,0,0,0,0|2,0,1]=4 588 B5R0.1 CCC=C(C)C Amb22336412 [1,0,0,0,0,0|2,0,1]=4 589 B5R0.1 CCC=C(F)F Amb10839842 [1,0,0,0,0,0|2,0,1]=4 590 B5R0.1 CCCB(O)O Amb2447105 [1,0,0,0,0,0|1,0,1]=3 591 B5R0.1 CCCC(=N)N Amb10610381 [1,0,0,0,0,0|2,0,0]=3 592 B5R0.1 CCCC(=N)N Amb2695914 [1,0,0,0,0,0|2,0,0]=3 593 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,0,0,0,0|1,0,0]=2 594 B5R0.1 CCCC(=O)Cl Amb2792903 [1,0,0,0,0,0|1,0,0]=2 595 B5R0.1 CCCC(=O)O Amb3939012 [1,0,0,0,0,0|0,0,0]=1 596 B5R0.1 CCCC(=O)[O-] Amb8514901 [1,0,0,0,0,0|0,0,1]=2 597 B5R0.1 CCCC(=S)Cl Amb24626931 [1,0,0,0,0,0|1,1,0]=3 598 B5R0.1 CCCC(Br)Br Amb27801326 [1,0,0,0,0,0|2,0,1]=4 599 B5R0.1 CCCC(C)=O Amb6608910 [1,0,0,0,0,0|1,0,0]=2 600 B5R0.1 CCCC(C)Br Amb3940201 [1,0,0,0,0,0|2,0,1]=4 601 B5R0.1 CCCC(C)Cl Amb4018346 [1,0,0,0,0,0|2,0,1]=4 602 B5R0.1 CCCC(C)I Amb17939400 [1,0,0,0,0,0|2,0,1]=4 603 B5R0.1 CCCC(C)N Amb10609075 [1,0,0,0,0,0|2,0,1]=4 604 B5R0.1 CCCC(C)N Amb3941259 [1,0,0,0,0,0|2,0,1]=4 605 B5R0.1 CCCC(C)O Amb4605839 [1,0,0,0,0,0|1,0,1]=3 606 B5R0.1 CCCC(C)S Amb7784731 [1,0,0,0,0,0|1,1,1]=4 607 B5R0.1 CCCC(Cl)Br Amb27657591 [1,0,0,0,0,0|2,0,1]=4 608 B5R0.1 CCCC(Cl)Cl Amb25062516 [1,0,0,0,0,0|2,0,1]=4 609 B5R0.1 CCCC(F)Br Amb27856781 [1,0,0,0,0,0|2,0,1]=4 610 B5R0.1 CCCC(N)=O Amb3886524 [1,0,0,0,0,0|1,0,0]=2 611 B5R0.1 CCCC(N)=S Amb6245403 [1,0,0,0,0,0|1,1,0]=3 612 B5R0.1 CCCC(N)=[NH2+] Amb8384484 [1,0,0,0,0,0|2,0,0]=3 613 B5R0.1 CCCC(O)=S Amb22229383 [1,0,0,0,0,0|0,1,0]=2 614 B5R0.1 CCCC(O)Cl Amb22552567 [1,0,0,0,0,0|1,0,1]=3 615 B5R0.1 CCCC(O)O Amb26364594 [1,0,0,0,0,0|0,0,2]=3 616 B5R0.1 CCCN(C)C Amb22733186 [1,0,0,0,0,0|3,0,0]=4 617 B5R0.1 CCCN(C)O Amb25024622 [1,0,0,0,0,0|2,0,0]=3 618 B5R0.1 CCCP(Cl)Cl Amb22053969 [1,0,0,0,0,0|3,0,0]=4 619 B5R0.1 CCCS(=O)Cl Amb25025566 [1,0,0,0,0,0|2,0,0]=3 620 B5R0.1 CCCS(=O)[O-] Amb19929119 [1,0,0,0,0,0|1,0,1]=3 621 B5R0.1 CCCS(N)=O Amb24733579 [1,0,0,0,0,0|2,0,0]=3 622 B5R0.1 CCC[C@@H](C)N Amb22898992 [1,0,0,0,0,0|2,0,1]=4 623 B5R0.1 CCC[C@@H](C)N Amb23439500 [1,0,0,0,0,0|2,0,1]=4 624 B5R0.1 CCC[C@@H](C)O Amb8628178 [1,0,0,0,0,0|1,0,1]=3 625 B5R0.1 CCC[C@@H](N)O Amb28074861 [1,0,0,0,0,0|1,0,1]=3 626 B5R0.1 CCC[C@H](C)Br Amb27650565 [1,0,0,0,0,0|2,0,1]=4 627 B5R0.1 CCC[C@H](C)N Amb21618754 [1,0,0,0,0,0|2,0,1]=4 628 B5R0.1 CCC[C@H](C)N Amb31204590 [1,0,0,0,0,0|2,0,1]=4 629 B5R0.1 CCC[C@H](C)O Amb8389338 [1,0,0,0,0,0|1,0,1]=3 630 B5R0.1 CCC[N+](=O)[O-] Amb8513268 [1,0,0,0,0,0|1,0,1]=3 631 B5R0.1 CCNC(=N)N Amb21964689 [1,0,0,0,0,0|3,0,0]=4 632 B5R0.1 CCNC(=N)N Amb22053912 [1,0,0,0,0,0|3,0,0]=4 633 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,0,0,0,0|2,0,0]=3 634 B5R0.1 CCNC(=S)S Amb26505127 [1,0,0,0,0,0|1,2,0]=4 635 B5R0.1 CCNC(C)=O Amb2780415 [1,0,0,0,0,0|2,0,0]=3 636 B5R0.1 CCNC(N)=O Amb6608844 [1,0,0,0,0,0|2,0,0]=3 637 B5R0.1 CCNC(N)=S Amb6608838 [1,0,0,0,0,0|2,1,0]=4 638 B5R0.1 CCNC(N)=[NH2+] Amb22734753 [1,0,0,0,0,0|3,0,0]=4 639 B5R0.1 CCOB(O)O Amb27221375 [1,0,0,0,0,0|2,0,1]=4 640 B5R0.1 CCOC(=N)N Amb16231402 [1,0,0,0,0,0|3,0,0]=4 641 B5R0.1 CCOC(=N)N Amb27173000 [1,0,0,0,0,0|3,0,0]=4 642 B5R0.1 CCOC(=O)Cl Amb2793045 [1,0,0,0,0,0|2,0,0]=3 643 B5R0.1 CCOC(=O)O Amb8393208 [1,0,0,0,0,0|1,0,0]=2 644 B5R0.1 CCOC(=S)Cl Amb26030825 [1,0,0,0,0,0|2,1,0]=4 645 B5R0.1 CCOC(=S)[S-] Amb22729921 [1,0,0,0,0,0|1,2,0]=4 646 B5R0.1 CCOC(=S)[S-] Amb8480129 [1,0,0,0,0,0|1,2,0]=4 647 B5R0.1 CCOC(C)=N Amb8394853 [1,0,0,0,0,0|3,0,0]=4 648 B5R0.1 CCOC(C)=N Amb8514666 [1,0,0,0,0,0|3,0,0]=4 649 B5R0.1 CCOC(C)=O Amb3940488 [1,0,0,0,0,0|2,0,0]=3 650 B5R0.1 CCOC(C)=S Amb22047276 [1,0,0,0,0,0|2,1,0]=4 651 B5R0.1 CCOC(N)=O Amb6608672 [1,0,0,0,0,0|2,0,0]=3 652 B5R0.1 CCOC(N)=S Amb10241338 [1,0,0,0,0,0|2,1,0]=4 653 B5R0.1 CCOS(=O)Cl Amb25239825 [1,0,0,0,0,0|3,0,0]=4 654 B5R0.1 CCO[N+](=O)[O-] Amb22732543 [1,0,0,0,0,0|2,0,1]=4 655 B5R0.1 CCO[PH](=O)O Amb22360741 [1,0,0,0,0,0|2,0,0]=3 656 B5R0.1 CCO[PH](=O)[O-] Amb22731647 [1,0,0,0,0,0|2,0,1]=4 657 B5R0.1 CCO[Si](=O)O Amb26569259 [1,0,0,0,0,0|1,1,0]=3 658 B5R0.1 CCSC(=N)N Amb16205363 [1,0,0,0,0,0|3,0,0]=4 659 B5R0.1 CCSC(=N)N Amb8393903 [1,0,0,0,0,0|3,0,0]=4 660 B5R0.1 CCSC(=N)[NH3+] Amb24113877 [1,0,0,0,0,0|3,0,0]=4 661 B5R0.1 CCSC(=O)Cl Amb8516064 [1,0,0,0,0,0|2,0,0]=3 662 B5R0.1 CCSC(=S)[S-] Amb27247124 [1,0,0,0,0,0|1,2,0]=4 663 B5R0.1 CCSC(C)=S Amb8394854 [1,0,0,0,0,0|2,1,0]=4 664 B5R0.1 CCSC(N)=S Amb25969673 [1,0,0,0,0,0|2,1,0]=4 665 B5R0.1 CC[O+]=C(N)N Amb22492446 [1,0,0,0,0,0|3,0,0]=4 666 B5R0.1 CN(C)CCN Amb2720698 [1,0,0,0,0,0|3,0,0]=4 667 B5R0.1 CN(O)CCCl Amb27473361 [1,0,0,0,0,0|3,0,0]=4 668 B5R0.1 CN(O)CCF Amb33377280 [1,0,0,0,0,0|3,0,0]=4 669 B5R0.1 CNCC(=O)O Amb6298808 [1,0,0,0,0,0|1,0,0]=2 670 B5R0.1 CNCC(=O)O Amb6599996 [1,0,0,0,0,0|1,0,0]=2 671 B5R0.1 CNCC(=O)[O-] Amb20246714 [1,0,0,0,0,0|1,0,1]=3 672 B5R0.1 CNCC(C)=O Amb17621974 [1,0,0,0,0,0|2,0,0]=3 673 B5R0.1 CNCC(C)=O Amb21959975 [1,0,0,0,0,0|2,0,0]=3 674 B5R0.1 CNCC(C)O Amb32666238 [1,0,0,0,0,0|2,0,1]=4 675 B5R0.1 CNCC(C)O Amb9247471 [1,0,0,0,0,0|2,0,1]=4 676 B5R0.1 CNCC(N)=O Amb19134307 [1,0,0,0,0,0|2,0,0]=3 677 B5R0.1 CNCC(N)=O Amb3940074 [1,0,0,0,0,0|2,0,0]=3 678 B5R0.1 CNCC(N)=O Amb9151172 [1,0,0,0,0,0|2,0,0]=3 679 B5R0.1 CNC[C@@H](C)O Amb26972484 [1,0,0,0,0,0|2,0,1]=4 680 B5R0.1 CNC[C@@H](C)O Amb32652763 [1,0,0,0,0,0|2,0,1]=4 681 B5R0.1 CNC[C@H](C)O Amb27596614 [1,0,0,0,0,0|2,0,1]=4 682 B5R0.1 CNC[C@H](C)O Amb32652861 [1,0,0,0,0,0|2,0,1]=4 683 B5R0.1 CNOC(N)=O Amb28341734 [1,0,0,0,0,0|3,0,0]=4 684 B5R0.1 COCB(O)O Amb28401589 [1,0,0,0,0,0|2,0,1]=4 685 B5R0.1 COCC(=N)N Amb2696281 [1,0,0,0,0,0|3,0,0]=4 686 B5R0.1 COCC(=N)N Amb33551686 [1,0,0,0,0,0|3,0,0]=4 687 B5R0.1 COCC(=O)Cl Amb3939326 [1,0,0,0,0,0|2,0,0]=3 688 B5R0.1 COCC(=O)O Amb3939876 [1,0,0,0,0,0|1,0,0]=2 689 B5R0.1 COCC(C)=O Amb8513767 [1,0,0,0,0,0|2,0,0]=3 690 B5R0.1 COCC(C)O Amb33544397 [1,0,0,0,0,0|2,0,1]=4 691 B5R0.1 COCC(N)=O Amb1153776 [1,0,0,0,0,0|2,0,0]=3 692 B5R0.1 COCC(N)=S Amb6268129 [1,0,0,0,0,0|2,1,0]=4 693 B5R0.1 COC[C@@H](C)O Amb8383545 [1,0,0,0,0,0|2,0,1]=4 694 B5R0.1 COC[C@H](C)O Amb8515770 [1,0,0,0,0,0|2,0,1]=4 695 B5R0.1 CONC(C)=O Amb25046114 [1,0,0,0,0,0|3,0,0]=4 696 B5R0.1 CONC(N)=O Amb2417193 [1,0,0,0,0,0|3,0,0]=4 697 B5R0.1 CS(=O)CCBr Amb28049280 [1,0,0,0,0,0|3,0,0]=4 698 B5R0.1 CS(=O)CCCl Amb24116979 [1,0,0,0,0,0|3,0,0]=4 699 B5R0.1 CS(=O)CCI Amb27752977 [1,0,0,0,0,0|3,0,0]=4 700 B5R0.1 CS(=O)CCN Amb2786559 [1,0,0,0,0,0|2,0,0]=3 701 B5R0.1 CS(=O)CCN Amb33543191 [1,0,0,0,0,0|2,0,0]=3 702 B5R0.1 CS(=O)CCO Amb28075364 [1,0,0,0,0,0|3,0,0]=4 703 B5R0.1 CSCC(=N)N Amb2696282 [1,0,0,0,0,0|3,0,0]=4 704 B5R0.1 CSCC(=N)N Amb8630183 [1,0,0,0,0,0|3,0,0]=4 705 B5R0.1 CSCC(=O)Cl Amb24528357 [1,0,0,0,0,0|2,0,0]=3 706 B5R0.1 CSCC(=O)O Amb1152425 [1,0,0,0,0,0|1,0,0]=2 707 B5R0.1 CSCC(C)=O Amb20621731 [1,0,0,0,0,0|2,0,0]=3 708 B5R0.1 CSCC(C)O Amb20622311 [1,0,0,0,0,0|2,0,1]=4 709 B5R0.1 CSCC(N)=O Amb19515874 [1,0,0,0,0,0|2,0,0]=3 710 B5R0.1 CSCC(N)=S Amb17503394 [1,0,0,0,0,0|2,1,0]=4 711 B5R0.1 CSCS(C)=O Amb22045140 [1,0,0,0,0,0|3,0,0]=4 712 B5R0.1 CSC[C@@H](C)O Amb24408899 [1,0,0,0,0,0|2,0,1]=4 713 B5R0.1 CSC[C@H](C)O Amb24699036 [1,0,0,0,0,0|2,0,1]=4 714 B5R0.1 CSNC(C)=O Amb22500292 [1,0,0,0,0,0|3,0,0]=4 715 B5R0.1 C[C@@H](O)CCBr Amb27392288 [1,0,0,0,0,0|2,0,1]=4 716 B5R0.1 C[C@@H](O)CCF Amb33376906 [1,0,0,0,0,0|2,0,1]=4 717 B5R0.1 C[C@@H](O)CCI Amb27594639 [1,0,0,0,0,0|2,0,1]=4 718 B5R0.1 C[C@@H](O)CCN Amb22736702 [1,0,0,0,0,0|1,0,1]=3 719 B5R0.1 C[C@@H](O)CCN Amb28555327 [1,0,0,0,0,0|1,0,1]=3 720 B5R0.1 C[C@@H](O)CCO Amb4166294 [1,0,0,0,0,0|2,0,1]=4 721 B5R0.1 C[C@@H](O)CON Amb26019757 [1,0,0,0,0,0|2,0,1]=4 722 B5R0.1 C[C@H](O)CCBr Amb28367228 [1,0,0,0,0,0|2,0,1]=4 723 B5R0.1 C[C@H](O)CCF Amb33376900 [1,0,0,0,0,0|2,0,1]=4 724 B5R0.1 C[C@H](O)CCN Amb22736705 [1,0,0,0,0,0|1,0,1]=3 725 B5R0.1 C[C@H](O)CCN Amb34159890 [1,0,0,0,0,0|1,0,1]=3 726 B5R0.1 C[C@H](O)CCO Amb4166300 [1,0,0,0,0,0|2,0,1]=4 727 B5R0.1 C[C@H](O)CNN Amb27589718 [1,0,0,0,0,0|2,0,1]=4 728 B5R0.1 C[C@H](O)CON Amb24557560 [1,0,0,0,0,0|2,0,1]=4 729 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [1,0,0,0,0,0|2,0,0]=3 730 B5R0.1 C\C(Cl)=C\CN Amb2693573 [1,0,0,0,0,0|2,0,1]=4 731 B5R0.1 C\C(I)=C\CN Amb27216485 [1,0,0,0,0,0|2,0,1]=4 732 B5R0.1 C\C(O)=C\CN Amb33294274 [1,0,0,0,0,0|1,0,1]=3 733 B5R0.1 C\C=C/C(=O)O Amb27779315 [1,0,0,0,0,0|0,0,2]=3 734 B5R0.1 C\C=C/C(C)=O Amb28351405 [1,0,0,0,0,0|1,0,2]=4 735 B5R0.1 C\C=C\C(=O)Br Amb25026006 [1,0,0,0,0,0|1,0,2]=4 736 B5R0.1 C\C=C\C(=O)Cl Amb8517577 [1,0,0,0,0,0|1,0,2]=4 737 B5R0.1 C\C=C\C(=O)O Amb8385856 [1,0,0,0,0,0|0,0,2]=3 738 B5R0.1 C\C=C\C(C)=O Amb33941980 [1,0,0,0,0,0|1,0,2]=4 739 B5R0.1 C\C=C\C(N)=O Amb4025906 [1,0,0,0,0,0|1,0,2]=4 740 B5R0.1 N#CCC(=O)Cl Amb17593096 [1,0,0,0,0,0|1,0,2]=4 741 B5R0.1 N#CCC(=O)O Amb2609022 [1,0,0,0,0,0|0,0,2]=3 742 B5R0.1 N#CCC(N)=O Amb6336473 [1,0,0,0,0,0|1,0,2]=4 743 B5R0.1 N=C(Br)CCBr Amb27653883 [1,0,0,0,0,0|3,0,0]=4 744 B5R0.1 N=C(N)CCBr Amb4297021 [1,0,0,0,0,0|3,0,0]=4 745 B5R0.1 N=C(N)CCCl Amb25839424 [1,0,0,0,0,0|3,0,0]=4 746 B5R0.1 N=C(N)CCF Amb26024692 [1,0,0,0,0,0|3,0,0]=4 747 B5R0.1 N=C(N)CCN Amb27265608 [1,0,0,0,0,0|2,0,0]=3 748 B5R0.1 N=C(N)CCN Amb32687503 [1,0,0,0,0,0|2,0,0]=3 749 B5R0.1 N=C(N)CCN Amb33164129 [1,0,0,0,0,0|2,0,0]=3 750 B5R0.1 N=C(N)CCO Amb2696134 [1,0,0,0,0,0|3,0,0]=4 751 B5R0.1 N=C(N)CCO Amb8630168 [1,0,0,0,0,0|3,0,0]=4 752 B5R0.1 NC(=O)CC=O Amb25777522 [1,0,0,0,0,0|2,0,1]=4 753 B5R0.1 NC(=O)CCBr Amb21618712 [1,0,0,0,0,0|2,0,0]=3 754 B5R0.1 NC(=O)CCCl Amb1127569 [1,0,0,0,0,0|2,0,0]=3 755 B5R0.1 NC(=O)CCF Amb28289353 [1,0,0,0,0,0|2,0,0]=3 756 B5R0.1 NC(=O)CCI Amb27966778 [1,0,0,0,0,0|2,0,0]=3 757 B5R0.1 NC(=O)CCO Amb9421407 [1,0,0,0,0,0|2,0,0]=3 758 B5R0.1 NC(=O)CCS Amb27154802 [1,0,0,0,0,0|2,0,0]=3 759 B5R0.1 NC(=O)CNCl Amb28315673 [1,0,0,0,0,0|3,0,0]=4 760 B5R0.1 NC(=O)NCO Amb17674341 [1,0,0,0,0,0|3,0,0]=4 761 B5R0.1 NC(=O)SCCl Amb26419693 [1,0,0,0,0,0|3,0,0]=4 762 B5R0.1 NC(=S)CCCl Amb33328368 [1,0,0,0,0,0|2,1,0]=4 763 B5R0.1 NC(=S)CCF Amb27950563 [1,0,0,0,0,0|2,1,0]=4 764 B5R0.1 NC(=S)CCO Amb8855295 [1,0,0,0,0,0|2,1,0]=4 765 B5R0.1 NC(=S)CCS Amb17503271 [1,0,0,0,0,0|2,1,0]=4 766 B5R0.1 NC(O)CCO Amb28252327 [1,0,0,0,0,0|2,0,1]=4 767 B5R0.1 NCC=C(Cl)Cl Amb26612466 [1,0,0,0,0,0|2,0,1]=4 768 B5R0.1 NCC=C(Cl)Cl Amb28555334 [1,0,0,0,0,0|2,0,1]=4 769 B5R0.1 NCCB(O)O Amb27859105 [1,0,0,0,0,0|1,0,1]=3 770 B5R0.1 NCCC(=O)Cl Amb24117140 [1,0,0,0,0,0|1,0,0]=2 771 B5R0.1 NCCC(=O)O Amb1935127 [1,0,0,0,0,0|0,0,0]=1 772 B5R0.1 NCCC(=O)[O-] Amb28991330 [1,0,0,0,0,0|0,0,1]=2 773 B5R0.1 NCCC(Cl)Cl Amb25982493 [1,0,0,0,0,0|2,0,1]=4 774 B5R0.1 NCCC(F)F Amb19372958 [1,0,0,0,0,0|2,0,1]=4 775 B5R0.1 NCCC(F)F Amb19514789 [1,0,0,0,0,0|2,0,1]=4 776 B5R0.1 NCCC(N)=O Amb1137251 [1,0,0,0,0,0|1,0,0]=2 777 B5R0.1 NCCC(N)=O Amb9147573 [1,0,0,0,0,0|1,0,0]=2 778 B5R0.1 NCCC(N)=S Amb18523221 [1,0,0,0,0,0|1,1,0]=3 779 B5R0.1 NCCC(N)=S Amb33456385 [1,0,0,0,0,0|1,1,0]=3 780 B5R0.1 NCCC(O)O Amb27449145 [1,0,0,0,0,0|0,0,2]=3 781 B5R0.1 NCCS(=O)O Amb6600043 [1,0,0,0,0,0|1,0,0]=2 782 B5R0.1 NCCS(N)=O Amb33512527 [1,0,0,0,0,0|2,0,0]=3 783 B5R0.1 NCC[N+](=O)[O-] Amb18203119 [1,0,0,0,0,0|1,0,1]=3 784 B5R0.1 NCC[PH](=O)O Amb22168066 [1,0,0,0,0,0|1,0,0]=2 785 B5R0.1 NCC[PH](=O)O Amb35788864 [1,0,0,0,0,0|1,0,0]=2 786 B5R0.1 NCO[N+](=O)[O-] Amb28049282 [1,0,0,0,0,0|2,0,1]=4 787 B5R0.1 NNCC(=O)O Amb32751165 [1,0,0,0,0,0|1,0,0]=2 788 B5R0.1 NNCC(=O)O Amb6740299 [1,0,0,0,0,0|1,0,0]=2 789 B5R0.1 NNCC(N)=O Amb32990162 [1,0,0,0,0,0|2,0,0]=3 790 B5R0.1 NOCC(=O)O Amb1154237 [1,0,0,0,0,0|1,0,0]=2 791 B5R0.1 NOCC(=O)O Amb4324355 [1,0,0,0,0,0|1,0,0]=2 792 B5R0.1 NOCC(=O)O Amb8513076 [1,0,0,0,0,0|1,0,0]=2 793 B5R0.1 NOCC(N)=O Amb33528973 [1,0,0,0,0,0|2,0,0]=3 794 B5R0.1 NS(=O)CCCl Amb24407159 [1,0,0,0,0,0|3,0,0]=4 795 B5R0.1 NS(=O)CCF Amb32720391 [1,0,0,0,0,0|3,0,0]=4 796 B5R0.1 NS(=O)CCO Amb32720357 [1,0,0,0,0,0|3,0,0]=4 797 B5R0.1 N\C=C\C(=O)O Amb27217920 [1,0,0,0,0,0|0,0,2]=3 798 B5R0.1 N\C=C\C(N)=O Amb27237320 [1,0,0,0,0,0|1,0,2]=4 799 B5R0.1 O=C(Br)CCBr Amb24624022 [1,0,0,0,0,0|2,0,0]=3 800 B5R0.1 O=C(Cl)CCBr Amb3941484 [1,0,0,0,0,0|2,0,0]=3 801 B5R0.1 O=C(Cl)CCCl Amb3939313 [1,0,0,0,0,0|2,0,0]=3 802 B5R0.1 O=C(Cl)CCF Amb27148631 [1,0,0,0,0,0|2,0,0]=3 803 B5R0.1 O=C(Cl)CCI Amb28454579 [1,0,0,0,0,0|2,0,0]=3 804 B5R0.1 O=C(Cl)CCO Amb27270014 [1,0,0,0,0,0|2,0,0]=3 805 B5R0.1 O=C(Cl)NCCl Amb28315820 [1,0,0,0,0,0|3,0,0]=4 806 B5R0.1 O=C(Cl)OCCl Amb8389474 [1,0,0,0,0,0|3,0,0]=4 807 B5R0.1 O=C(F)CCCl Amb27257545 [1,0,0,0,0,0|2,0,0]=3 808 B5R0.1 O=C(F)OCCl Amb27860169 [1,0,0,0,0,0|3,0,0]=4 809 B5R0.1 O=C(O)C#CBr Amb17593707 [1,0,0,0,0,0|1,0,2]=4 810 B5R0.1 O=C(O)C#CCl Amb17593098 [1,0,0,0,0,0|1,0,2]=4 811 B5R0.1 O=C(O)CCBr Amb2685479 [1,0,0,0,0,0|1,0,0]=2 812 B5R0.1 O=C(O)CCCl Amb5395408 [1,0,0,0,0,0|1,0,0]=2 813 B5R0.1 O=C(O)CCF Amb10603694 [1,0,0,0,0,0|1,0,0]=2 814 B5R0.1 O=C(O)CCI Amb2688882 [1,0,0,0,0,0|1,0,0]=2 815 B5R0.1 O=C(O)CCO Amb2688785 [1,0,0,0,0,0|1,0,0]=2 816 B5R0.1 O=C(O)CCS Amb6608916 [1,0,0,0,0,0|1,0,0]=2 817 B5R0.1 O=C(O)CNO Amb24120360 [1,0,0,0,0,0|2,0,0]=3 818 B5R0.1 O=C(O)\C=C/Br Amb18644453 [1,0,0,0,0,0|1,0,2]=4 819 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [1,0,0,0,0,0|1,0,2]=4 820 B5R0.1 O=C(O)\C=C/I Amb28315824 [1,0,0,0,0,0|1,0,2]=4 821 B5R0.1 O=C(O)\C=C\Br Amb27423608 [1,0,0,0,0,0|1,0,2]=4 822 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [1,0,0,0,0,0|1,0,2]=4 823 B5R0.1 O=C(O)\C=C\I Amb30584673 [1,0,0,0,0,0|1,0,2]=4 824 B5R0.1 O=C(O)\C=C\O Amb26055842 [1,0,0,0,0,0|1,0,2]=4 825 B5R0.1 O=C(O)\C=C\S Amb28401590 [1,0,0,0,0,0|1,0,2]=4 826 B5R0.1 O=C(O)\C=N\O Amb20671938 [1,0,0,0,0,0|2,0,1]=4 827 B5R0.1 O=C(S)CCCl Amb27461454 [1,0,0,0,0,0|1,1,0]=3 828 B5R0.1 O=C([O-])CCO Amb22055495 [1,0,0,0,0,0|1,0,1]=3 829 B5R0.1 O=C([O-])NCCl Amb27777248 [1,0,0,0,0,0|2,0,1]=4 830 B5R0.1 O=CCC(=O)O Amb22169407 [1,0,0,0,0,0|1,0,1]=3 831 B5R0.1 O=CCC(=O)[Na] Amb27949540 [1,0,0,0,0,0|2,0,1]=4 832 B5R0.1 O=S(Cl)CCCl Amb26494051 [1,0,0,0,0,0|3,0,0]=4 833 B5R0.1 O=S(Cl)CCF Amb32720386 [1,0,0,0,0,0|3,0,0]=4 834 B5R0.1 O=S(Cl)CCO Amb32720404 [1,0,0,0,0,0|3,0,0]=4 835 B5R0.1 O=S(O)CCO Amb25937057 [1,0,0,0,0,0|2,0,0]=3 836 B5R0.1 O=S([O-])CCCl Amb27639192 [1,0,0,0,0,0|2,0,1]=4 837 B5R0.1 O=S([O-])CCF Amb27213259 [1,0,0,0,0,0|2,0,1]=4 838 B5R0.1 O=S([O-])CCO Amb32754124 [1,0,0,0,0,0|2,0,1]=4 839 B5R0.1 O=[N+]([O-])CCBr Amb25965752 [1,0,0,0,0,0|2,0,1]=4 840 B5R0.1 O=[N+]([O-])CCCl Amb28381478 [1,0,0,0,0,0|2,0,1]=4 841 B5R0.1 O=[N+]([O-])CCF Amb17674352 [1,0,0,0,0,0|2,0,1]=4 842 B5R0.1 O=[N+]([O-])CCO Amb3940447 [1,0,0,0,0,0|2,0,1]=4 843 B5R0.1 O=[N+]([O-])CCS Amb26620894 [1,0,0,0,0,0|2,0,1]=4 844 B5R0.1 OB(O)CCF Amb27479949 [1,0,0,0,0,0|2,0,1]=4 845 B5R0.1 OC(Br)CCBr Amb27457468 [1,0,0,0,0,0|2,0,1]=4 846 B5R0.1 OC(Cl)CCCl Amb28255432 [1,0,0,0,0,0|2,0,1]=4 847 B5R0.1 OC(O)CCS Amb25746150 [1,0,0,0,0,0|1,0,2]=4 848 B5R0.1 OCCC(O)Cl Amb26052481 [1,0,0,0,0,0|2,0,1]=4 849 B5R0.1 OP(O)CCCl Amb27169424 [1,0,0,0,0,0|2,0,1]=4 850 B5R0.2 BrCCCCBr Amb2686718 [1,0,0,0,0,0|2,0,1]=4 851 B5R0.2 BrCCCCI Amb25861429 [1,0,0,0,0,0|2,0,1]=4 852 B5R0.2 BrCCCNBr Amb27424198 [1,0,0,0,0,0|3,0,0]=4 853 B5R0.2 Br\C=C\CCBr Amb25663040 [1,0,0,0,0,0|2,0,1]=4 854 B5R0.2 C#CCCC=C Amb18117518 [1,0,0,0,0,0|2,0,1]=4 855 B5R0.2 C#CCCC=O Amb28049678 [1,0,0,0,0,0|1,0,1]=3 856 B5R0.2 C#CCCCBr Amb17610060 [1,0,0,0,0,0|2,0,1]=4 857 B5R0.2 C#CCCCC Amb4135448 [1,0,0,0,0,0|2,0,1]=4 858 B5R0.2 C#CCCCCl Amb3940276 [1,0,0,0,0,0|2,0,1]=4 859 B5R0.2 C#CCCCF Amb26904785 [1,0,0,0,0,0|2,0,1]=4 860 B5R0.2 C#CCCCI Amb25843530 [1,0,0,0,0,0|2,0,1]=4 861 B5R0.2 C#CCCCN Amb18962495 [1,0,0,0,0,0|1,0,1]=3 862 B5R0.2 C#CCCCN Amb33532759 [1,0,0,0,0,0|1,0,1]=3 863 B5R0.2 C#CCCCO Amb1219893 [1,0,0,0,0,0|1,0,2]=4 864 B5R0.2 C#CCCCS Amb24333394 [1,0,0,0,0,0|2,0,1]=4 865 B5R0.2 C#CCCON Amb28200358 [1,0,0,0,0,0|2,0,1]=4 866 B5R0.2 C#NCCCC Amb31132446 [1,0,0,0,0,0|3,0,0]=4 867 B5R0.2 C=C=CCC=O Amb27234481 [1,0,0,0,0,0|1,0,2]=4 868 B5R0.2 C=C=CCCN Amb27252647 [1,0,0,0,0,0|1,0,2]=4 869 B5R0.2 C=CCCC#N Amb10605750 [1,0,0,0,0,0|1,0,2]=4 870 B5R0.2 C=CCCC=C Amb8513514 [1,0,0,0,0,0|2,0,1]=4 871 B5R0.2 C=CCCC=O Amb4358616 [1,0,0,0,0,0|1,0,1]=3 872 B5R0.2 C=CCCCBr Amb3940219 [1,0,0,0,0,0|2,0,0]=3 873 B5R0.2 C=CCCCC Amb3940497 [1,0,0,0,0,0|2,0,0]=3 874 B5R0.2 C=CCCCCl Amb22229585 [1,0,0,0,0,0|2,0,0]=3 875 B5R0.2 C=CCCCF Amb25689705 [1,0,0,0,0,0|2,0,0]=3 876 B5R0.2 C=CCCCI Amb25278794 [1,0,0,0,0,0|2,0,0]=3 877 B5R0.2 C=CCCCN Amb18299670 [1,0,0,0,0,0|1,0,0]=2 878 B5R0.2 C=CCCCN Amb22001451 [1,0,0,0,0,0|1,0,0]=2 879 B5R0.2 C=CCCCO Amb8513439 [1,0,0,0,0,0|2,0,0]=3 880 B5R0.2 C=CCCC[CH2-] Amb32644015 [1,0,0,0,0,0|2,0,0]=3 881 B5R0.2 C=CCCNC Amb18993048 [1,0,0,0,0,0|3,0,0]=4 882 B5R0.2 C=CCCNC Amb33553635 [1,0,0,0,0,0|3,0,0]=4 883 B5R0.2 C=CCCOC Amb28065418 [1,0,0,0,0,0|3,0,0]=4 884 B5R0.2 C=CCCON Amb22233632 [1,0,0,0,0,0|2,0,0]=3 885 B5R0.2 C=CCCON Amb22896384 [1,0,0,0,0,0|2,0,0]=3 886 B5R0.2 C=CCCSC Amb24431590 [1,0,0,0,0,0|3,0,0]=4 887 B5R0.2 C=CCNC=O Amb2781857 [1,0,0,0,0,0|2,0,1]=4 888 B5R0.2 C=CCNCC Amb13951161 [1,0,0,0,0,0|3,0,0]=4 889 B5R0.2 C=CCNCC Amb6683951 [1,0,0,0,0,0|3,0,0]=4 890 B5R0.2 C=CCOCBr Amb28384107 [1,0,0,0,0,0|3,0,0]=4 891 B5R0.2 C=CCOCC Amb2684299 [1,0,0,0,0,0|3,0,0]=4 892 B5R0.2 C=CCOCCl Amb28429831 [1,0,0,0,0,0|3,0,0]=4 893 B5R0.2 C=CCSCC Amb6366495 [1,0,0,0,0,0|3,0,0]=4 894 B5R0.2 C=CCSCCl Amb25859631 [1,0,0,0,0,0|3,0,0]=4 895 B5R0.2 C=CNCCC Amb27461242 [1,0,0,0,0,0|3,0,0]=4 896 B5R0.2 C=COCCC Amb17940706 [1,0,0,0,0,0|3,0,0]=4 897 B5R0.2 C=COCCI Amb28245341 [1,0,0,0,0,0|3,0,0]=4 898 B5R0.2 C=COCCN Amb17593030 [1,0,0,0,0,0|2,0,0]=3 899 B5R0.2 C=COCCN Amb32409664 [1,0,0,0,0,0|2,0,0]=3 900 B5R0.2 C=COCCO Amb17674184 [1,0,0,0,0,0|3,0,0]=4 901 B5R0.2 C=CSCCCl Amb27390785 [1,0,0,0,0,0|3,0,0]=4 902 B5R0.2 C=CSCCO Amb27607172 [1,0,0,0,0,0|3,0,0]=4 903 B5R0.2 C=C\C=C\CN Amb26011188 [1,0,0,0,0,0|1,0,2]=4 904 B5R0.2 C=C\C=C\CN Amb32824809 [1,0,0,0,0,0|1,0,2]=4 905 B5R0.2 C=NCCCCl Amb28346586 [1,0,0,0,0,0|3,0,0]=4 906 B5R0.2 CC#CCC=O Amb27850282 [1,0,0,0,0,0|1,0,2]=4 907 B5R0.2 CC#CCCN Amb18285893 [1,0,0,0,0,0|1,0,2]=4 908 B5R0.2 CC#CCCN Amb33543085 [1,0,0,0,0,0|1,0,2]=4 909 B5R0.2 CCC#CC=O Amb25663194 [1,0,0,0,0,0|1,0,2]=4 910 B5R0.2 CCCCC#N Amb6662839 [1,0,0,0,0,0|2,0,1]=4 911 B5R0.2 CCCCC=O Amb3939655 [1,0,0,0,0,0|1,0,0]=2 912 B5R0.2 CCCCCBr Amb3940084 [1,0,0,0,0,0|2,0,1]=4 913 B5R0.2 CCCCCC Amb2447471 [1,0,0,0,0,0|2,0,1]=4 914 B5R0.2 CCCCCCl Amb8514576 [1,0,0,0,0,0|2,0,1]=4 915 B5R0.2 CCCCCF Amb10838686 [1,0,0,0,0,0|2,0,1]=4 916 B5R0.2 CCCCCI Amb6891946 [1,0,0,0,0,0|2,0,1]=4 917 B5R0.2 CCCCCN Amb3939830 [1,0,0,0,0,0|1,0,1]=3 918 B5R0.2 CCCCCO Amb3939051 [1,0,0,0,0,0|1,0,1]=3 919 B5R0.2 CCCCCS Amb8513287 [1,0,0,0,0,0|1,1,1]=4 920 B5R0.2 CCCCC[SiH3] Amb19893989 [1,0,0,0,0,0|2,0,1]=4 921 B5R0.2 CCCCNC Amb3939351 [1,0,0,0,0,0|3,0,0]=4 922 B5R0.2 CCCCNN Amb1105203 [1,0,0,0,0,0|2,0,1]=4 923 B5R0.2 CCCCNN Amb22230363 [1,0,0,0,0,0|2,0,1]=4 924 B5R0.2 CCCCNN Amb33055062 [1,0,0,0,0,0|2,0,1]=4 925 B5R0.2 CCCCNO Amb24686451 [1,0,0,0,0,0|2,0,0]=3 926 B5R0.2 CCCCNO Amb32687485 [1,0,0,0,0,0|2,0,0]=3 927 B5R0.2 CCCCON Amb17101066 [1,0,0,0,0,0|2,0,1]=4 928 B5R0.2 CCCCON Amb6308542 [1,0,0,0,0,0|2,0,1]=4 929 B5R0.2 CCCCSC Amb4036342 [1,0,0,0,0,0|3,0,0]=4 930 B5R0.2 CCCN=C=O Amb3939331 [1,0,0,0,0,0|2,0,1]=4 931 B5R0.2 CCCNC=S Amb27754027 [1,0,0,0,0,0|2,1,0]=4 932 B5R0.2 CCC\C=C\Br Amb17673688 [1,0,0,0,0,0|2,0,1]=4 933 B5R0.2 CCC\C=C\Cl Amb25026521 [1,0,0,0,0,0|2,0,1]=4 934 B5R0.2 CCC\C=C\N Amb27217273 [1,0,0,0,0,0|2,0,1]=4 935 B5R0.2 CCC\C=N\O Amb27213413 [1,0,0,0,0,0|2,0,1]=4 936 B5R0.2 CCNCCN Amb6297789 [1,0,0,0,0,0|2,0,1]=4 937 B5R0.2 CCNCCO Amb19372818 [1,0,0,0,0,0|2,0,1]=4 938 B5R0.2 CCNCCO Amb3940070 [1,0,0,0,0,0|2,0,1]=4 939 B5R0.2 CCOCCN Amb1130918 [1,0,0,0,0,0|2,0,1]=4 940 B5R0.2 CCOCCN Amb29844456 [1,0,0,0,0,0|2,0,1]=4 941 B5R0.2 CCOCCO Amb3939142 [1,0,0,0,0,0|2,0,1]=4 942 B5R0.2 CCSCC=O Amb17940620 [1,0,0,0,0,0|2,0,0]=3 943 B5R0.2 CCSCCN Amb2687948 [1,0,0,0,0,0|2,0,1]=4 944 B5R0.2 CCSCCN Amb9825826 [1,0,0,0,0,0|2,0,1]=4 945 B5R0.2 CCSCCO Amb1085958 [1,0,0,0,0,0|2,0,1]=4 946 B5R0.2 CC\C=C\C=O Amb33986391 [1,0,0,0,0,0|1,0,2]=4 947 B5R0.2 CNCCCBr Amb28291325 [1,0,0,0,0,0|3,0,0]=4 948 B5R0.2 CNCCCBr Amb33473632 [1,0,0,0,0,0|3,0,0]=4 949 B5R0.2 CNCCCCl Amb22002154 [1,0,0,0,0,0|3,0,0]=4 950 B5R0.2 CNCCCCl Amb3941419 [1,0,0,0,0,0|3,0,0]=4 951 B5R0.2 CNCCCF Amb27405698 [1,0,0,0,0,0|3,0,0]=4 952 B5R0.2 CNCCCN Amb2698065 [1,0,0,0,0,0|2,0,0]=3 953 B5R0.2 CNCCCO Amb9246656 [1,0,0,0,0,0|2,0,1]=4 954 B5R0.2 CNCCNN Amb24117180 [1,0,0,0,0,0|3,0,0]=4 955 B5R0.2 CNCCNO Amb27976196 [1,0,0,0,0,0|3,0,0]=4 956 B5R0.2 CNOCCN Amb22411501 [1,0,0,0,0,0|3,0,0]=4 957 B5R0.2 CNOCCN Amb22490915 [1,0,0,0,0,0|3,0,0]=4 958 B5R0.2 COCCC=O Amb10602324 [1,0,0,0,0,0|2,0,0]=3 959 B5R0.2 COCCCBr Amb8828205 [1,0,0,0,0,0|3,0,0]=4 960 B5R0.2 COCCCCl Amb6255994 [1,0,0,0,0,0|3,0,0]=4 961 B5R0.2 COCCCF Amb22007998 [1,0,0,0,0,0|3,0,0]=4 962 B5R0.2 COCCCI Amb33546474 [1,0,0,0,0,0|3,0,0]=4 963 B5R0.2 COCCCN Amb3939346 [1,0,0,0,0,0|2,0,0]=3 964 B5R0.2 COCCCO Amb8385593 [1,0,0,0,0,0|2,0,1]=4 965 B5R0.2 COCCCS Amb13952794 [1,0,0,0,0,0|3,0,0]=4 966 B5R0.2 COCCNN Amb10609107 [1,0,0,0,0,0|3,0,0]=4 967 B5R0.2 COCCNN Amb19374182 [1,0,0,0,0,0|3,0,0]=4 968 B5R0.2 COCCNN Amb22233534 [1,0,0,0,0,0|3,0,0]=4 969 B5R0.2 COCCNN Amb22587527 [1,0,0,0,0,0|3,0,0]=4 970 B5R0.2 COCCNN Amb6248350 [1,0,0,0,0,0|3,0,0]=4 971 B5R0.2 COCCNO Amb25284480 [1,0,0,0,0,0|3,0,0]=4 972 B5R0.2 COCCON Amb17194148 [1,0,0,0,0,0|3,0,0]=4 973 B5R0.2 COCCON Amb20623946 [1,0,0,0,0,0|3,0,0]=4 974 B5R0.2 COCNC=O Amb28049834 [1,0,0,0,0,0|3,0,0]=4 975 B5R0.2 CONCCN Amb25733738 [1,0,0,0,0,0|3,0,0]=4 976 B5R0.2 CONCCN Amb32645968 [1,0,0,0,0,0|3,0,0]=4 977 B5R0.2 CSCCC=O Amb3939952 [1,0,0,0,0,0|2,0,0]=3 978 B5R0.2 CSCCCBr Amb18180189 [1,0,0,0,0,0|3,0,0]=4 979 B5R0.2 CSCCCCl Amb10602296 [1,0,0,0,0,0|3,0,0]=4 980 B5R0.2 CSCCCN Amb33801570 [1,0,0,0,0,0|2,0,0]=3 981 B5R0.2 CSCCCN Amb6718923 [1,0,0,0,0,0|2,0,0]=3 982 B5R0.2 CSCCCO Amb3939523 [1,0,0,0,0,0|2,0,1]=4 983 B5R0.2 CSCCCS Amb25744031 [1,0,0,0,0,0|3,0,0]=4 984 B5R0.2 CSCCNN Amb18640583 [1,0,0,0,0,0|3,0,0]=4 985 B5R0.2 CSCCNO Amb33272071 [1,0,0,0,0,0|3,0,0]=4 986 B5R0.2 CSCCON Amb25806571 [1,0,0,0,0,0|3,0,0]=4 987 B5R0.2 CSSCCN Amb26850738 [1,0,0,0,0,0|3,0,0]=4 988 B5R0.2 CSSCCN Amb32652424 [1,0,0,0,0,0|3,0,0]=4 989 B5R0.2 C[SiH2]CCCN Amb28049027 [1,0,0,0,0,0|1,1,0]=3 990 B5R0.2 C\C=C/CCC Amb6366719 [1,0,0,0,0,0|2,0,1]=4 991 B5R0.2 C\C=C/CCO Amb19930204 [1,0,0,0,0,0|2,0,1]=4 992 B5R0.2 C\C=C\CC=O Amb26655030 [1,0,0,0,0,0|1,0,2]=4 993 B5R0.2 C\C=C\CCBr Amb32667161 [1,0,0,0,0,0|2,0,1]=4 994 B5R0.2 C\C=C\CCCl Amb26978891 [1,0,0,0,0,0|2,0,1]=4 995 B5R0.2 C\C=C\CCN Amb19374038 [1,0,0,0,0,0|1,0,1]=3 996 B5R0.2 C\C=C\CCN Amb33038294 [1,0,0,0,0,0|1,0,1]=3 997 B5R0.2 C\C=C\CCO Amb24655557 [1,0,0,0,0,0|2,0,1]=4 998 B5R0.2 C\C=C\CON Amb18560216 [1,0,0,0,0,0|2,0,1]=4 999 B5R0.2 C\C=N\CCC Amb27954749 [1,0,0,0,0,0|3,0,0]=4 1000 B5R0.2 C\C=N\CCN Amb27837883 [1,0,0,0,0,0|2,0,0]=3 1001 B5R0.2 ClCCCCBr Amb8391065 [1,0,0,0,0,0|2,0,1]=4 1002 B5R0.2 ClCCCCCl Amb6608890 [1,0,0,0,0,0|2,0,1]=4 1003 B5R0.2 ClCCCCI Amb8517518 [1,0,0,0,0,0|2,0,1]=4 1004 B5R0.2 ClCCCNCl Amb27165116 [1,0,0,0,0,0|3,0,0]=4 1005 B5R0.2 ClCCC[SiH2]Cl Amb27629993 [1,0,0,0,0,0|2,1,0]=4 1006 B5R0.2 Cl\C=C\CCCl Amb25929864 [1,0,0,0,0,0|2,0,1]=4 1007 B5R0.2 Cl\C=C\CCI Amb27647471 [1,0,0,0,0,0|2,0,1]=4 1008 B5R0.2 FCCCCBr Amb2685210 [1,0,0,0,0,0|2,0,1]=4 1009 B5R0.2 FCCCCCl Amb27655616 [1,0,0,0,0,0|2,0,1]=4 1010 B5R0.2 FCCCCF Amb10839858 [1,0,0,0,0,0|2,0,1]=4 1011 B5R0.2 FCCCCI Amb28283837 [1,0,0,0,0,0|2,0,1]=4 1012 B5R0.2 FCCCCS Amb25065453 [1,0,0,0,0,0|1,1,1]=4 1013 B5R0.2 ICCCCI Amb17672573 [1,0,0,0,0,0|2,0,1]=4 1014 B5R0.2 N#CCCC=O Amb3941009 [1,0,0,0,0,0|0,0,2]=3 1015 B5R0.2 N#CCCCBr Amb3940093 [1,0,0,0,0,0|2,0,1]=4 1016 B5R0.2 N#CCCCCl Amb3940298 [1,0,0,0,0,0|2,0,1]=4 1017 B5R0.2 N#CCCCF Amb25146362 [1,0,0,0,0,0|2,0,1]=4 1018 B5R0.2 N#CCCCI Amb8517592 [1,0,0,0,0,0|2,0,1]=4 1019 B5R0.2 N#CCCCN Amb28555321 [1,0,0,0,0,0|1,0,1]=3 1020 B5R0.2 N#CCCCN Amb6271100 [1,0,0,0,0,0|1,0,1]=3 1021 B5R0.2 N#CCCCO Amb4021727 [1,0,0,0,0,0|0,0,3]=4 1022 B5R0.2 N#CCCCS Amb17504257 [1,0,0,0,0,0|2,0,1]=4 1023 B5R0.2 N#CCCNN Amb2694748 [1,0,0,0,0,0|2,0,1]=4 1024 B5R0.2 N#CCCNO Amb22748730 [1,0,0,0,0,0|1,0,2]=4 1025 B5R0.2 N#CCOC=O Amb22347946 [1,0,0,0,0,0|1,0,2]=4 1026 B5R0.2 N#CNCCN Amb28049617 [1,0,0,0,0,0|2,0,1]=4 1027 B5R0.2 NCC#CCO Amb20623045 [1,0,0,0,0,0|0,0,3]=4 1028 B5R0.2 NCC#CCO Amb28146743 [1,0,0,0,0,0|0,0,3]=4 1029 B5R0.2 NCCC#CBr Amb27195619 [1,0,0,0,0,0|1,0,2]=4 1030 B5R0.2 NCCCC=O Amb26851044 [1,0,0,0,0,0|0,0,0]=1 1031 B5R0.2 NCCCCBr Amb21858985 [1,0,0,0,0,0|1,0,1]=3 1032 B5R0.2 NCCCCCl Amb18640687 [1,0,0,0,0,0|1,0,1]=3 1033 B5R0.2 NCCCCCl Amb22233734 [1,0,0,0,0,0|1,0,1]=3 1034 B5R0.2 NCCCCF Amb26017241 [1,0,0,0,0,0|1,0,1]=3 1035 B5R0.2 NCCCCF Amb28555328 [1,0,0,0,0,0|1,0,1]=3 1036 B5R0.2 NCCCCI Amb27837961 [1,0,0,0,0,0|1,0,1]=3 1037 B5R0.2 NCCCCN Amb22489528 [1,0,0,0,0,0|1,0,1]=3 1038 B5R0.2 NCCCCN Amb6608640 [1,0,0,0,0,0|1,0,1]=3 1039 B5R0.2 NCCCCN Amb8514498 [1,0,0,0,0,0|1,0,1]=3 1040 B5R0.2 NCCCCO Amb3939336 [1,0,0,0,0,0|0,0,1]=2 1041 B5R0.2 NCCCCS Amb17500976 [1,0,0,0,0,0|0,1,1]=3 1042 B5R0.2 NCCCCS Amb22546260 [1,0,0,0,0,0|0,1,1]=3 1043 B5R0.2 NCCCN=O Amb28049442 [1,0,0,0,0,0|1,0,0]=2 1044 B5R0.2 NCCCNN Amb27392601 [1,0,0,0,0,0|2,0,0]=3 1045 B5R0.2 NCCCNO Amb27882495 [1,0,0,0,0,0|1,0,0]=2 1046 B5R0.2 NCCCNO Amb32729324 [1,0,0,0,0,0|1,0,0]=2 1047 B5R0.2 NCCOC=O Amb24612320 [1,0,0,0,0,0|1,0,0]=2 1048 B5R0.2 NCCOCF Amb33378706 [1,0,0,0,0,0|2,0,1]=4 1049 B5R0.2 NCCSN=O Amb27950442 [1,0,0,0,0,0|2,0,0]=3 1050 B5R0.2 NCC\C=C\Cl Amb27391191 [1,0,0,0,0,0|1,0,1]=3 1051 B5R0.2 NC\C=C\CO Amb33212383 [1,0,0,0,0,0|0,0,3]=4 1052 B5R0.2 NC\C=C\CO Amb33495152 [1,0,0,0,0,0|0,0,3]=4 1053 B5R0.2 NNCCCF Amb25696672 [1,0,0,0,0,0|2,0,1]=4 1054 B5R0.2 NNCCCO Amb19514839 [1,0,0,0,0,0|1,0,1]=3 1055 B5R0.2 NNCCCO Amb22058994 [1,0,0,0,0,0|1,0,1]=3 1056 B5R0.2 NNCCNN Amb25314393 [1,0,0,0,0,0|3,0,0]=4 1057 B5R0.2 NOCCCF Amb24632017 [1,0,0,0,0,0|2,0,1]=4 1058 B5R0.2 NOCCCO Amb18061671 [1,0,0,0,0,0|1,0,1]=3 1059 B5R0.2 NOCCCS Amb17608230 [1,0,0,0,0,0|1,1,1]=4 1060 B5R0.2 NOCCCS Amb27489799 [1,0,0,0,0,0|1,1,1]=4 1061 B5R0.2 NOCCON Amb31308386 [1,0,0,0,0,0|3,0,0]=4 1062 B5R0.2 NOC\C=C\Cl Amb32653337 [1,0,0,0,0,0|2,0,1]=4 1063 B5R0.2 NOC\C=C\Cl Amb32701613 [1,0,0,0,0,0|2,0,1]=4 1064 B5R0.2 N\C=N\OC=O Amb28118665 [1,0,0,0,0,0|2,0,1]=4 1065 B5R0.2 O=BOCCBr Amb27954923 [1,0,0,0,0,0|3,0,0]=4 1066 B5R0.2 O=C=NCCBr Amb17194090 [1,0,0,0,0,0|2,0,1]=4 1067 B5R0.2 O=C=NCCCl Amb535458 [1,0,0,0,0,0|2,0,1]=4 1068 B5R0.2 O=C=NCCF Amb24710430 [1,0,0,0,0,0|2,0,1]=4 1069 B5R0.2 O=C=NCCO Amb27659445 [1,0,0,0,0,0|2,0,1]=4 1070 B5R0.2 O=CCCC=O Amb8395090 [1,0,0,0,0,0|1,0,1]=3 1071 B5R0.2 O=CCCCBr Amb18644189 [1,0,0,0,0,0|1,0,0]=2 1072 B5R0.2 O=CCCCCl Amb8395190 [1,0,0,0,0,0|1,0,0]=2 1073 B5R0.2 O=CCCCF Amb24056028 [1,0,0,0,0,0|1,0,0]=2 1074 B5R0.2 O=CCCCI Amb27249641 [1,0,0,0,0,0|1,0,0]=2 1075 B5R0.2 O=CCCCO Amb24589235 [1,0,0,0,0,0|1,0,0]=2 1076 B5R0.2 O=CCCSS Amb22524519 [1,0,0,0,0,0|2,0,0]=3 1077 B5R0.2 O=CCNC=O Amb26370295 [1,0,0,0,0,0|2,0,1]=4 1078 B5R0.2 O=CC\C=C\Cl Amb24571938 [1,0,0,0,0,0|1,0,2]=4 1079 B5R0.2 O=CNCCF Amb28205988 [1,0,0,0,0,0|2,0,0]=3 1080 B5R0.2 O=COCCBr Amb27816149 [1,0,0,0,0,0|2,0,0]=3 1081 B5R0.2 O=COCCO Amb26625741 [1,0,0,0,0,0|2,0,0]=3 1082 B5R0.2 O=C\C=C\CCl Amb18122401 [1,0,0,0,0,0|1,0,2]=4 1083 B5R0.2 O=C\C=C\CF Amb33475269 [1,0,0,0,0,0|1,0,2]=4 1084 B5R0.2 O=C\C=C\CO Amb24356008 [1,0,0,0,0,0|1,0,2]=4 1085 B5R0.2 O=NOCCCl Amb27205298 [1,0,0,0,0,0|3,0,0]=4 1086 B5R0.2 O=NOCCI Amb28188003 [1,0,0,0,0,0|3,0,0]=4 1087 B5R0.2 O=NOCCO Amb22363071 [1,0,0,0,0,0|3,0,0]=4 1088 B5R0.2 O=S=NCCCl Amb27634384 [1,0,0,0,0,0|3,0,0]=4 1089 B5R0.2 OCCCCBr Amb8395353 [1,0,0,0,0,0|1,0,1]=3 1090 B5R0.2 OCCCCCl Amb1101976 [1,0,0,0,0,0|1,0,1]=3 1091 B5R0.2 OCCCCF Amb17593046 [1,0,0,0,0,0|1,0,1]=3 1092 B5R0.2 OCCCCO Amb2793029 [1,0,0,0,0,0|1,0,1]=3 1093 B5R0.2 OCCNCO Amb22228429 [1,0,0,0,0,0|2,0,1]=4 1094 B5R0.2 OCCOCCl Amb24673634 [1,0,0,0,0,0|2,0,1]=4 1095 B5R0.2 OCC\C=C\Br Amb27425005 [1,0,0,0,0,0|2,0,1]=4 1096 B5R0.2 OCC\C=C\Cl Amb27859286 [1,0,0,0,0,0|2,0,1]=4 1097 B5R0.2 OCC\N=N\O Amb25747385 [1,0,0,0,0,0|3,0,0]=4 1098 B5R0.2 ONCCCF Amb25931859 [1,0,0,0,0,0|2,0,0]=3 1099 B5R0.2 O\C=N\CCCl Amb24684796 [1,0,0,0,0,0|2,0,0]=3 1100 B5R0.2 SCCCCS Amb8513069 [1,0,0,0,0,0|1,1,1]=4 1101 B5R0.2 [C-]#[N+]CCCC Amb2235001 [1,0,0,0,0,0|3,0,0]=4 1102 B5R0.2 [C-]#[N+]CCCF Amb26423847 [1,0,0,0,0,0|3,0,0]=4 1103 B5R0.2 [N-]=[N+]=NCC=O Amb26953499 [1,0,0,0,0,0|2,0,1]=4 1104 B5R0.2 [N-]=[N+]=NCCN Amb20622748 [1,0,0,0,0,0|3,0,0]=4 1105 B5R0.2 [N-]=[N+]=NCCN Amb22058756 [1,0,0,0,0,0|3,0,0]=4 1106 B5R0.2 [NH-]\[NH+]=N\CCN Amb27424999 [1,0,0,0,0,0|3,0,0]=4 1107 B7R0.2 C#CC(C)CC(=O)O Amb27246384 [0,1,0,0,0,0|1,0,1]=3 1108 B7R0.2 C#C[C@H](O)CC(=O)O Amb28285208 [0,1,0,0,0,0|1,0,1]=3 1109 B7R0.2 C=C(Br)CC(O)CO Amb27206509 [0,1,0,0,0,0|3,0,0]=4 1110 B7R0.2 C=C(Br)C[C@@H](C)CO Amb28069642 [0,1,0,0,0,0|3,0,0]=4 1111 B7R0.2 C=C(Br)C[C@H](C)CO Amb27196706 [0,1,0,0,0,0|3,0,0]=4 1112 B7R0.2 C=C(C)CC(C)CBr Amb32688065 [0,1,0,0,0,0|3,0,0]=4 1113 B7R0.2 C=C(C)CC(C)CC Amb22228340 [0,1,0,0,0,0|3,0,0]=4 1114 B7R0.2 C=C(C)CC(C)CCl Amb32688064 [0,1,0,0,0,0|3,0,0]=4 1115 B7R0.2 C=C(C)CC(F)CO Amb28079110 [0,1,0,0,0,0|3,0,0]=4 1116 B7R0.2 C=C(C)CC(N)CO Amb24665584 [0,1,0,0,0,0|3,0,0]=4 1117 B7R0.2 C=C(C)CC(O)CN Amb33199504 [0,1,0,0,0,0|2,0,0]=3 1118 B7R0.2 C=C(C)C[C@H](N)CO Amb27633094 [0,1,0,0,0,0|3,0,0]=4 1119 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [0,1,0,0,0,0|1,0,1]=3 1120 B7R0.2 C=C(CC)CC(N)=O Amb27394598 [0,1,0,0,0,0|2,0,1]=4 1121 B7R0.2 C=C(Cl)CC(C)CBr Amb32688072 [0,1,0,0,0,0|3,0,0]=4 1122 B7R0.2 C=C(Cl)CC(C)CCl Amb32688071 [0,1,0,0,0,0|3,0,0]=4 1123 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [0,1,0,0,0,0|3,0,0]=4 1124 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [0,1,0,0,0,0|1,0,1]=3 1125 B7R0.2 C=CC(C)CC(C)=O Amb27759897 [0,1,0,0,0,0|2,0,1]=4 1126 B7R0.2 C=CC(C)CC(N)=O Amb27168118 [0,1,0,0,0,0|2,0,1]=4 1127 B7R0.2 C=CC(N)CC(=O)O Amb22641963 [0,1,0,0,0,0|1,0,1]=3 1128 B7R0.2 C=CC(N)CC(=O)O Amb31307621 [0,1,0,0,0,0|1,0,1]=3 1129 B7R0.2 C=CC(O)CC(=O)O Amb18641866 [0,1,0,0,0,0|1,0,1]=3 1130 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [0,1,0,0,0,0|1,0,1]=3 1131 B7R0.2 C=C[C@@H](N)CC(=O)O Amb28315938 [0,1,0,0,0,0|1,0,1]=3 1132 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [0,1,0,0,0,0|1,0,1]=3 1133 B7R0.2 CC(=O)CC(=O)CO Amb28316150 [0,1,0,0,0,0|2,0,1]=4 1134 B7R0.2 CC(=O)CC(C)C#N Amb18124227 [0,1,0,0,0,0|1,0,2]=4 1135 B7R0.2 CC(=O)CC(C)CCl Amb28313530 [0,1,0,0,0,0|2,0,0]=3 1136 B7R0.2 CC(=O)CC(C)CN Amb18251072 [0,1,0,0,0,0|1,0,0]=2 1137 B7R0.2 CC(=O)CC(N)CO Amb27240210 [0,1,0,0,0,0|2,0,0]=3 1138 B7R0.2 CC(=O)CC(O)CCl Amb27827457 [0,1,0,0,0,0|2,0,0]=3 1139 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [0,1,0,0,0,0|2,0,1]=4 1140 B7R0.2 CC(=O)C[C@@H](O)CCl Amb27817734 [0,1,0,0,0,0|2,0,0]=3 1141 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [0,1,0,0,0,0|2,0,1]=4 1142 B7R0.2 CC(=O)C[C@H](O)CO Amb28316148 [0,1,0,0,0,0|2,0,0]=3 1143 B7R0.2 CC(=O)C\C(C)=N\N Amb28048941 [0,1,0,0,0,0|2,0,1]=4 1144 B7R0.2 CC(=O)NC(=O)CN Amb24117061 [0,1,0,0,0,0|2,0,1]=4 1145 B7R0.2 CC(=O)NC(C)CCl Amb33542146 [0,1,0,0,0,0|3,0,0]=4 1146 B7R0.2 CC(=O)NC(C)CO Amb9276356 [0,1,0,0,0,0|3,0,0]=4 1147 B7R0.2 CC(=O)N[C@@H](C)CN Amb27768700 [0,1,0,0,0,0|2,0,0]=3 1148 B7R0.2 CC(=O)N[C@@H](C)CO Amb26515722 [0,1,0,0,0,0|3,0,0]=4 1149 B7R0.2 CC(=O)N[C@H](C)CO Amb24426644 [0,1,0,0,0,0|3,0,0]=4 1150 B7R0.2 CC(=O)OC(=O)CN Amb28240797 [0,1,0,0,0,0|2,0,1]=4 1151 B7R0.2 CC(=O)OC(Br)CBr Amb21520423 [0,1,0,0,0,0|3,0,0]=4 1152 B7R0.2 CC(=O)OC(C)CBr Amb26477506 [0,1,0,0,0,0|3,0,0]=4 1153 B7R0.2 CC(=O)OC(C)CN Amb27838841 [0,1,0,0,0,0|2,0,0]=3 1154 B7R0.2 CC(=O)OC(F)CBr Amb28239801 [0,1,0,0,0,0|3,0,0]=4 1155 B7R0.2 CC(=O)OC(F)CCl Amb27473993 [0,1,0,0,0,0|3,0,0]=4 1156 B7R0.2 CC(=O)OC(O)CN Amb27839430 [0,1,0,0,0,0|2,0,0]=3 1157 B7R0.2 CC(=O)SC(C)CBr Amb27983834 [0,1,0,0,0,0|3,0,0]=4 1158 B7R0.2 CC(=O)SC(C)CCl Amb27253145 [0,1,0,0,0,0|3,0,0]=4 1159 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,1,0,0,0,0|0,0,2]=3 1160 B7R0.2 CC(C#N)CC(=O)[O-] Amb32952895 [0,1,0,0,0,0|0,0,3]=4 1161 B7R0.2 CC(C)CC(Br)CN Amb27598426 [0,1,0,0,0,0|2,0,1]=4 1162 B7R0.2 CC(C)CC(C)CN Amb8950132 [0,1,0,0,0,0|2,0,1]=4 1163 B7R0.2 CC(C)CC(F)CN Amb24387968 [0,1,0,0,0,0|2,0,1]=4 1164 B7R0.2 CC(C)CC(N)CN Amb33527180 [0,1,0,0,0,0|2,0,1]=4 1165 B7R0.2 CC(C)CC(N)CN Amb9380668 [0,1,0,0,0,0|2,0,1]=4 1166 B7R0.2 CC(C)CC(O)CN Amb33548420 [0,1,0,0,0,0|2,0,1]=4 1167 B7R0.2 CC(C)CC(O)CN Amb9295087 [0,1,0,0,0,0|2,0,1]=4 1168 B7R0.2 CC(C)CC(S)CN Amb18251146 [0,1,0,0,0,0|2,0,1]=4 1169 B7R0.2 CC(C)C[C@@H](C)CN Amb33738463 [0,1,0,0,0,0|2,0,1]=4 1170 B7R0.2 CC(C)C[C@@H](N)CN Amb25345853 [0,1,0,0,0,0|2,0,1]=4 1171 B7R0.2 CC(C)C[C@@H](O)CN Amb33203519 [0,1,0,0,0,0|2,0,1]=4 1172 B7R0.2 CC(C)C[C@@H](S)CN Amb27602168 [0,1,0,0,0,0|2,0,1]=4 1173 B7R0.2 CC(C)C[C@H](C)CN Amb33747134 [0,1,0,0,0,0|2,0,1]=4 1174 B7R0.2 CC(C)C[C@H](O)CN Amb33203517 [0,1,0,0,0,0|2,0,1]=4 1175 B7R0.2 CC(C)C[C@H](S)CN Amb27815055 [0,1,0,0,0,0|2,0,1]=4 1176 B7R0.2 CC(CC(=O)O)NN Amb28346224 [0,1,0,0,0,0|1,0,0]=2 1177 B7R0.2 CC(CC(=O)O)NN Amb33141007 [0,1,0,0,0,0|1,0,0]=2 1178 B7R0.2 CC(CCl)CC(=O)Cl Amb27949867 [0,1,0,0,0,0|2,0,0]=3 1179 B7R0.2 CC(CCl)CS(=O)Cl Amb32720419 [0,1,0,0,0,0|3,0,0]=4 1180 B7R0.2 CC(CCl)CS(=O)[O-] Amb32754348 [0,1,0,0,0,0|2,0,1]=4 1181 B7R0.2 CC(CCl)CS(N)=O Amb32720421 [0,1,0,0,0,0|3,0,0]=4 1182 B7R0.2 CC(CCl)OC(=O)Cl Amb27482960 [0,1,0,0,0,0|3,0,0]=4 1183 B7R0.2 CC(CCl)OC(=O)F Amb27424209 [0,1,0,0,0,0|3,0,0]=4 1184 B7R0.2 CC(CF)CC(=O)O Amb25990964 [0,1,0,0,0,0|1,0,0]=2 1185 B7R0.2 CC(CN)CB(O)O Amb27166460 [0,1,0,0,0,0|1,0,1]=3 1186 B7R0.2 CC(CN)CC(=O)O Amb18124263 [0,1,0,0,0,0|0,0,0]=1 1187 B7R0.2 CC(CN)CC(=O)O Amb20669501 [0,1,0,0,0,0|0,0,0]=1 1188 B7R0.2 CC(CN)CC(=O)O Amb32752805 [0,1,0,0,0,0|0,0,0]=1 1189 B7R0.2 CC(CN)CC(F)F Amb25904828 [0,1,0,0,0,0|2,0,1]=4 1190 B7R0.2 CC(CN)CC(F)F Amb28920984 [0,1,0,0,0,0|2,0,1]=4 1191 B7R0.2 CC(CN)CC(N)=O Amb18641899 [0,1,0,0,0,0|1,0,0]=2 1192 B7R0.2 CC(CN)CN(C)C Amb5751521 [0,1,0,0,0,0|3,0,0]=4 1193 B7R0.2 CC(CN)CP(O)O Amb27838320 [0,1,0,0,0,0|1,0,1]=3 1194 B7R0.2 CC(CN)NC(=N)N Amb28250823 [0,1,0,0,0,0|3,0,0]=4 1195 B7R0.2 CC(CN)NC(N)=O Amb18202682 [0,1,0,0,0,0|2,0,0]=3 1196 B7R0.2 CC(CN)O[PH](=O)O Amb28388782 [0,1,0,0,0,0|2,0,0]=3 1197 B7R0.2 CC(CO)CC(=O)O Amb18198168 [0,1,0,0,0,0|1,0,0]=2 1198 B7R0.2 CC(CO)CC(=O)[O-] Amb33329956 [0,1,0,0,0,0|1,0,1]=3 1199 B7R0.2 CC(CO)OC(N)=O Amb26402233 [0,1,0,0,0,0|3,0,0]=4 1200 B7R0.2 CC(Cl)CC(C)CN Amb27856217 [0,1,0,0,0,0|2,0,1]=4 1201 B7R0.2 CC(N)CC(N)CN Amb26515700 [0,1,0,0,0,0|2,0,1]=4 1202 B7R0.2 CC(O)CC(C)CN Amb19337142 [0,1,0,0,0,0|1,0,1]=3 1203 B7R0.2 CC(O)CC(O)CF Amb27978648 [0,1,0,0,0,0|2,0,1]=4 1204 B7R0.2 CC(O)C[C@H](C)CO Amb27394893 [0,1,0,0,0,0|2,0,1]=4 1205 B7R0.2 CC(O)C[C@H](O)CO Amb27397070 [0,1,0,0,0,0|2,0,1]=4 1206 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [0,1,0,0,0,0|1,0,1]=3 1207 B7R0.2 CCC(=O)CC(C)=O Amb9775078 [0,1,0,0,0,0|2,0,1]=4 1208 B7R0.2 CCC(=O)CC(N)=O Amb8384375 [0,1,0,0,0,0|2,0,1]=4 1209 B7R0.2 CCC(C)CB(O)O Amb27591902 [0,1,0,0,0,0|2,0,1]=4 1210 B7R0.2 CCC(C)CC(=N)N Amb10607625 [0,1,0,0,0,0|3,0,0]=4 1211 B7R0.2 CCC(C)CC(=N)N Amb19890168 [0,1,0,0,0,0|3,0,0]=4 1212 B7R0.2 CCC(C)CC(=O)Cl Amb10844649 [0,1,0,0,0,0|2,0,0]=3 1213 B7R0.2 CCC(C)CC(=O)O Amb2689581 [0,1,0,0,0,0|1,0,0]=2 1214 B7R0.2 CCC(C)CC(C)=O Amb10608208 [0,1,0,0,0,0|2,0,0]=3 1215 B7R0.2 CCC(C)CC(C)O Amb4035421 [0,1,0,0,0,0|2,0,1]=4 1216 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,1,0,0,0,0|2,0,0]=3 1217 B7R0.2 CCC(C)CC(N)=S Amb26989527 [0,1,0,0,0,0|2,1,0]=4 1218 B7R0.2 CCC(C)CN(C)O Amb33373890 [0,1,0,0,0,0|3,0,0]=4 1219 B7R0.2 CCC(C)CS(=O)Cl Amb32720505 [0,1,0,0,0,0|3,0,0]=4 1220 B7R0.2 CCC(C)CS(=O)[O-] Amb27408549 [0,1,0,0,0,0|2,0,1]=4 1221 B7R0.2 CCC(C)CS(C)=O Amb27837877 [0,1,0,0,0,0|3,0,0]=4 1222 B7R0.2 CCC(C)CS(N)=O Amb32720506 [0,1,0,0,0,0|3,0,0]=4 1223 B7R0.2 CCC(C)C[C@@H](C)O Amb33318318 [0,1,0,0,0,0|2,0,1]=4 1224 B7R0.2 CCC(C)C[C@H](C)O Amb33318389 [0,1,0,0,0,0|2,0,1]=4 1225 B7R0.2 CCC(C)C[N+](=O)[O-] Amb25075983 [0,1,0,0,0,0|2,0,1]=4 1226 B7R0.2 CCC(C)NC(=O)Cl Amb27838339 [0,1,0,0,0,0|3,0,0]=4 1227 B7R0.2 CCC(C)NC(C)=O Amb3358085 [0,1,0,0,0,0|3,0,0]=4 1228 B7R0.2 CCC(C)NC(N)=O Amb9702507 [0,1,0,0,0,0|3,0,0]=4 1229 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [0,1,0,0,0,0|3,0,0]=4 1230 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [0,1,0,0,0,0|3,0,0]=4 1231 B7R0.2 CCC(Cl)CC(C)=O Amb28121450 [0,1,0,0,0,0|2,0,0]=3 1232 B7R0.2 CCC(Cl)OC(C)=O Amb27392214 [0,1,0,0,0,0|3,0,0]=4 1233 B7R0.2 CCC(Cl)SC(=O)Cl Amb27945612 [0,1,0,0,0,0|3,0,0]=4 1234 B7R0.2 CCC(Cl)SC(C)=O Amb27407733 [0,1,0,0,0,0|3,0,0]=4 1235 B7R0.2 CCC(N)CC(=O)O Amb1993862 [0,1,0,0,0,0|1,0,0]=2 1236 B7R0.2 CCC(N)CC(=O)O Amb8631361 [0,1,0,0,0,0|1,0,0]=2 1237 B7R0.2 CCC(N)CC(C)=O Amb18631696 [0,1,0,0,0,0|2,0,0]=3 1238 B7R0.2 CCC(N)CC(C)=O Amb26895708 [0,1,0,0,0,0|2,0,0]=3 1239 B7R0.2 CCC(N)CC(C)O Amb27604743 [0,1,0,0,0,0|2,0,1]=4 1240 B7R0.2 CCC(N)CC(N)=O Amb25727686 [0,1,0,0,0,0|2,0,0]=3 1241 B7R0.2 CCC(N)CC(N)=S Amb28078345 [0,1,0,0,0,0|2,1,0]=4 1242 B7R0.2 CCC(O)CC(=O)O Amb10844270 [0,1,0,0,0,0|1,0,0]=2 1243 B7R0.2 CCC(O)CC(C)=O Amb25065181 [0,1,0,0,0,0|2,0,0]=3 1244 B7R0.2 CCC(O)CC(C)O Amb26515705 [0,1,0,0,0,0|2,0,1]=4 1245 B7R0.2 CCC(O)CS(C)=O Amb28457838 [0,1,0,0,0,0|3,0,0]=4 1246 B7R0.2 CCC(O)C[N+](=O)[O-] Amb25136685 [0,1,0,0,0,0|2,0,1]=4 1247 B7R0.2 CCC(O)OC(C)=O Amb28256771 [0,1,0,0,0,0|3,0,0]=4 1248 B7R0.2 CCN(C)CC(=O)O Amb33620688 [0,1,0,0,0,0|2,0,0]=3 1249 B7R0.2 CCN(C)CC(=O)O Amb8428140 [0,1,0,0,0,0|2,0,0]=3 1250 B7R0.2 CCN(C)CC(C)=O Amb8427987 [0,1,0,0,0,0|3,0,0]=4 1251 B7R0.2 CCN(C)CC(C)=O Amb9173327 [0,1,0,0,0,0|3,0,0]=4 1252 B7R0.2 CCN(C)CC(N)=O Amb27639873 [0,1,0,0,0,0|3,0,0]=4 1253 B7R0.2 CCN(O)CC(=O)O Amb28195485 [0,1,0,0,0,0|2,0,0]=3 1254 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,1,0,0,0,0|2,0,0]=3 1255 B7R0.2 CCS(=O)CC(C)=O Amb26873160 [0,1,0,0,0,0|3,0,0]=4 1256 B7R0.2 CCS(=O)CC(N)=O Amb27762121 [0,1,0,0,0,0|3,0,0]=4 1257 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [0,1,0,0,0,0|1,0,0]=2 1258 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [0,1,0,0,0,0|1,0,0]=2 1259 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [0,1,0,0,0,0|1,0,0]=2 1260 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [0,1,0,0,0,0|1,0,0]=2 1261 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [0,1,0,0,0,0|2,0,0]=3 1262 B7R0.2 CC[C@@H](O)C[C@@H](C)O Amb4166323 [0,1,0,0,0,0|2,0,1]=4 1263 B7R0.2 CC[C@@H](O)C[C@H](C)O Amb27946301 [0,1,0,0,0,0|2,0,1]=4 1264 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [0,1,0,0,0,0|1,0,0]=2 1265 B7R0.2 CC[C@H](C)CC(C)O Amb27437194 [0,1,0,0,0,0|2,0,1]=4 1266 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [0,1,0,0,0,0|1,0,0]=2 1267 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [0,1,0,0,0,0|1,0,0]=2 1268 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [0,1,0,0,0,0|1,0,0]=2 1269 B7R0.2 CC[C@H](O)CC(C)=O Amb26980782 [0,1,0,0,0,0|2,0,0]=3 1270 B7R0.2 CC[C@H](O)C[C@@H](C)O Amb27790287 [0,1,0,0,0,0|2,0,1]=4 1271 B7R0.2 CC\C(Br)=C\C(=O)O Amb27409320 [0,1,0,0,0,0|1,0,2]=4 1272 B7R0.2 CC\C(C)=C/C(=O)O Amb18281014 [0,1,0,0,0,0|1,0,2]=4 1273 B7R0.2 CC\C(C)=C\C(=O)O Amb33528462 [0,1,0,0,0,0|1,0,2]=4 1274 B7R0.2 CC\C(F)=C/C(=O)O Amb27780201 [0,1,0,0,0,0|1,0,2]=4 1275 B7R0.2 CC\C(N)=C\C(=O)O Amb28145108 [0,1,0,0,0,0|1,0,2]=4 1276 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [0,1,0,0,0,0|1,0,2]=4 1277 B7R0.2 CN(C)CC(N)CN Amb18641938 [0,1,0,0,0,0|3,0,0]=4 1278 B7R0.2 CN(C)CC(O)CN Amb22587169 [0,1,0,0,0,0|3,0,0]=4 1279 B7R0.2 CN(C)CC(O)CN Amb9710934 [0,1,0,0,0,0|3,0,0]=4 1280 B7R0.2 CN(CC(=O)O)N=O Amb17618622 [0,1,0,0,0,0|3,0,0]=4 1281 B7R0.2 CN(CO)CC(=O)O Amb27663224 [0,1,0,0,0,0|2,0,0]=3 1282 B7R0.2 CNC(=O)CC(=O)O Amb33529761 [0,1,0,0,0,0|2,0,1]=4 1283 B7R0.2 CNC(C)CC(=O)O Amb21959674 [0,1,0,0,0,0|2,0,0]=3 1284 B7R0.2 CNC(C)CC(=O)O Amb9398363 [0,1,0,0,0,0|2,0,0]=3 1285 B7R0.2 CNC(C)CC(N)=O Amb17231826 [0,1,0,0,0,0|3,0,0]=4 1286 B7R0.2 CNC(C)CC(N)=O Amb19960012 [0,1,0,0,0,0|3,0,0]=4 1287 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [0,1,0,0,0,0|2,0,0]=3 1288 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,1,0,0,0,0|2,0,1]=4 1289 B7R0.2 COC(C)CC(=O)O Amb4001695 [0,1,0,0,0,0|2,0,0]=3 1290 B7R0.2 COC(C)CC(C)=O Amb26512071 [0,1,0,0,0,0|3,0,0]=4 1291 B7R0.2 COC(C)CC(N)=O Amb27838372 [0,1,0,0,0,0|3,0,0]=4 1292 B7R0.2 CON(C)CC(=O)O Amb8010467 [0,1,0,0,0,0|3,0,0]=4 1293 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [0,1,0,0,0,0|2,0,0]=3 1294 B7R0.2 CO[C@H](C)CC(C)=O Amb26494510 [0,1,0,0,0,0|3,0,0]=4 1295 B7R0.2 CS(=O)CC(O)CN Amb24482487 [0,1,0,0,0,0|2,0,0]=3 1296 B7R0.2 CS(=O)CC(O)CN Amb32683521 [0,1,0,0,0,0|2,0,0]=3 1297 B7R0.2 CSC(C)CC(=O)O Amb18967824 [0,1,0,0,0,0|2,0,0]=3 1298 B7R0.2 CSC(C)CC(C)=O Amb25714199 [0,1,0,0,0,0|3,0,0]=4 1299 B7R0.2 CSC(C)CC(N)=O Amb27838848 [0,1,0,0,0,0|3,0,0]=4 1300 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [0,1,0,0,0,0|2,0,0]=3 1301 B7R0.2 C[C@@H](CCl)CC(=O)Cl Amb27855839 [0,1,0,0,0,0|2,0,0]=3 1302 B7R0.2 C[C@@H](CF)NC(N)=O Amb27660553 [0,1,0,0,0,0|3,0,0]=4 1303 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [0,1,0,0,0,0|0,0,0]=1 1304 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [0,1,0,0,0,0|0,0,0]=1 1305 B7R0.2 C[C@@H](CN)CC(F)F Amb33728852 [0,1,0,0,0,0|2,0,1]=4 1306 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [0,1,0,0,0,0|0,0,0]=1 1307 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [0,1,0,0,0,0|0,0,0]=1 1308 B7R0.2 C[C@H](CN)CC(F)F Amb33727001 [0,1,0,0,0,0|2,0,1]=4 1309 B7R0.2 C[C@H](CN)NC(N)=O Amb28049036 [0,1,0,0,0,0|2,0,0]=3 1310 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [0,1,0,0,0,0|1,0,0]=2 1311 B7R0.2 C[C@H](O)C[C@H](O)CCl Amb27668776 [0,1,0,0,0,0|2,0,1]=4 1312 B7R0.2 C[C@H](O)C[C@H](O)CO Amb27472671 [0,1,0,0,0,0|2,0,1]=4 1313 B7R0.2 C\C(=C/C(=O)O)CO Amb18641871 [0,1,0,0,0,0|1,0,2]=4 1314 B7R0.2 C\C(=C/C(N)=O)CN Amb28288035 [0,1,0,0,0,0|1,0,2]=4 1315 B7R0.2 C\C(CC(=O)O)=N/O Amb28388976 [0,1,0,0,0,0|2,0,1]=4 1316 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [0,1,0,0,0,0|1,0,2]=4 1317 B7R0.2 N#CC(N)CC(=O)O Amb27985578 [0,1,0,0,0,0|0,0,2]=3 1318 B7R0.2 N#CC(N)CC(N)=O Amb24122907 [0,1,0,0,0,0|1,0,2]=4 1319 B7R0.2 N#CC(O)CC(N)=O Amb28063048 [0,1,0,0,0,0|1,0,2]=4 1320 B7R0.2 NC(=O)CC(=O)CCl Amb27797889 [0,1,0,0,0,0|2,0,1]=4 1321 B7R0.2 NC(=O)CC(Br)CO Amb28384721 [0,1,0,0,0,0|2,0,0]=3 1322 B7R0.2 NC(=O)CC(N)CCl Amb26458731 [0,1,0,0,0,0|2,0,0]=3 1323 B7R0.2 NC(=O)CC(O)CO Amb25662216 [0,1,0,0,0,0|2,0,0]=3 1324 B7R0.2 NC(=O)CN(O)CBr Amb27863565 [0,1,0,0,0,0|3,0,0]=4 1325 B7R0.2 NC(=O)C[C@@H](O)CCl Amb27173051 [0,1,0,0,0,0|2,0,0]=3 1326 B7R0.2 NC(=O)C[C@H](O)CO Amb8388588 [0,1,0,0,0,0|2,0,0]=3 1327 B7R0.2 NC(=S)CC(O)CF Amb26626569 [0,1,0,0,0,0|2,1,0]=4 1328 B7R0.2 NC(=S)CC(O)CO Amb27793984 [0,1,0,0,0,0|2,1,0]=4 1329 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [0,1,0,0,0,0|1,0,1]=3 1330 B7R0.2 NC(CF)CC(=O)O Amb24428065 [0,1,0,0,0,0|1,0,0]=2 1331 B7R0.2 NC(CS)CC(=O)O Amb25090412 [0,1,0,0,0,0|1,0,0]=2 1332 B7R0.2 NCC(=O)C[PH](=O)O Amb27257536 [0,1,0,0,0,0|1,0,1]=3 1333 B7R0.2 NCC(F)C[PH](=O)O Amb28398603 [0,1,0,0,0,0|1,0,0]=2 1334 B7R0.2 NCC(N)CC(=O)O Amb19515145 [0,1,0,0,0,0|0,0,0]=1 1335 B7R0.2 NCC(N)CC(=O)O Amb21858324 [0,1,0,0,0,0|0,0,0]=1 1336 B7R0.2 NCC(N)CC(F)F Amb27589345 [0,1,0,0,0,0|2,0,1]=4 1337 B7R0.2 NCC(N)CC(N)=O Amb27603845 [0,1,0,0,0,0|1,0,0]=2 1338 B7R0.2 NCC(O)CC(=O)O Amb32663899 [0,1,0,0,0,0|0,0,0]=1 1339 B7R0.2 NCC(O)CC(=O)O Amb33544754 [0,1,0,0,0,0|0,0,0]=1 1340 B7R0.2 NCC(O)CC(F)F Amb32811185 [0,1,0,0,0,0|2,0,1]=4 1341 B7R0.2 NCC(O)CS(=O)O Amb27831981 [0,1,0,0,0,0|1,0,0]=2 1342 B7R0.2 NC[C@@H](F)CC(=O)O Amb27481078 [0,1,0,0,0,0|0,0,0]=1 1343 B7R0.2 NC[C@@H](F)CS(=O)O Amb27460870 [0,1,0,0,0,0|1,0,0]=2 1344 B7R0.2 NC[C@@H](F)C[PH](=O)O Amb24481490 [0,1,0,0,0,0|1,0,0]=2 1345 B7R0.2 NC[C@@H](N)CC(=O)O Amb10603267 [0,1,0,0,0,0|0,0,0]=1 1346 B7R0.2 NC[C@@H](O)CC(=O)O Amb32665211 [0,1,0,0,0,0|0,0,0]=1 1347 B7R0.2 NC[C@@H](O)CC(=O)O Amb8386098 [0,1,0,0,0,0|0,0,0]=1 1348 B7R0.2 NC[C@@H](O)CC(N)=O Amb27838875 [0,1,0,0,0,0|1,0,0]=2 1349 B7R0.2 NC[C@@H](O)C[PH](=O)O Amb27596096 [0,1,0,0,0,0|1,0,0]=2 1350 B7R0.2 NC[C@H](F)C[PH](=O)O Amb27216774 [0,1,0,0,0,0|1,0,0]=2 1351 B7R0.2 NC[C@H](O)CC(=O)O Amb8628962 [0,1,0,0,0,0|0,0,0]=1 1352 B7R0.2 NC[C@H](O)CP(=O)=O Amb28249133 [0,1,0,0,0,0|1,0,1]=3 1353 B7R0.2 NC\C(I)=C\C(=O)O Amb28386476 [0,1,0,0,0,0|0,0,2]=3 1354 B7R0.2 NNC(=O)CC(=O)O Amb25073925 [0,1,0,0,0,0|1,0,1]=3 1355 B7R0.2 NNC(=O)CC(N)=O Amb1980864 [0,1,0,0,0,0|2,0,1]=4 1356 B7R0.2 NNC(=O)CC(N)=O Amb27660515 [0,1,0,0,0,0|2,0,1]=4 1357 B7R0.2 N[C@@H](CO)CC(=O)O Amb16184020 [0,1,0,0,0,0|1,0,0]=2 1358 B7R0.2 N[C@@H](CO)CC(=O)O Amb22388520 [0,1,0,0,0,0|1,0,0]=2 1359 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [0,1,0,0,0,0|1,0,1]=3 1360 B7R0.2 N[C@H](CO)CC(=O)O Amb2694944 [0,1,0,0,0,0|1,0,0]=2 1361 B7R0.2 N[C@H](CS)CC(=O)O Amb28326106 [0,1,0,0,0,0|1,0,0]=2 1362 B7R0.2 N\C(CC(=O)O)=N/O Amb8384544 [0,1,0,0,0,0|2,0,1]=4 1363 B7R0.2 O=C(Cl)CC(=O)CCl Amb17593874 [0,1,0,0,0,0|2,0,1]=4 1364 B7R0.2 O=C(Cl)OC(Cl)CCl Amb27483797 [0,1,0,0,0,0|3,0,0]=4 1365 B7R0.2 O=C(O)CC(=O)CCl Amb18124484 [0,1,0,0,0,0|1,0,1]=3 1366 B7R0.2 O=C(O)CC(O)CBr Amb27592126 [0,1,0,0,0,0|1,0,0]=2 1367 B7R0.2 O=C(O)CC(O)CF Amb26557587 [0,1,0,0,0,0|1,0,0]=2 1368 B7R0.2 O=C(O)CC(O)CO Amb28120003 [0,1,0,0,0,0|1,0,0]=2 1369 B7R0.2 O=C(O)CC(O)CS Amb27244674 [0,1,0,0,0,0|1,0,0]=2 1370 B7R0.2 O=C(O)C[C@@H](O)CF Amb33377449 [0,1,0,0,0,0|1,0,0]=2 1371 B7R0.2 O=C(O)C[C@H](O)CBr Amb28325607 [0,1,0,0,0,0|1,0,0]=2 1372 B7R0.2 O=C(O)C[C@H](O)CCl Amb27830780 [0,1,0,0,0,0|1,0,0]=2 1373 B7R0.2 O=C(O)C[C@H](O)CF Amb33377451 [0,1,0,0,0,0|1,0,0]=2 1374 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [0,1,0,0,0,0|1,0,0]=2 1375 B7R0.2 O=C(O)C\C(Cl)=C\Cl Amb27812877 [0,1,0,0,0,0|1,0,2]=4 1376 B7R0.2 O=C(O)\C=C(/Br)CO Amb27424808 [0,1,0,0,0,0|1,0,2]=4 1377 B7R0.2 O=C(O)\C=C(\O)CBr Amb28458506 [0,1,0,0,0,0|1,0,2]=4 1378 B7R0.2 O=C([O-])CC(O)CO Amb24117078 [0,1,0,0,0,0|1,0,1]=3 1379 B7R0.2 O=CN(O)CC(=O)O Amb25367291 [0,1,0,0,0,0|2,0,1]=4 1380 B7R0.2 O=[N+]([O-])CC(O)CCl Amb28133599 [0,1,0,0,0,0|2,0,1]=4 1381 B7R0.3 C#CC(=C)CCCO Amb17593132 [0,1,0,0,0,0|3,0,0]=4 1382 B7R0.3 C#CC(=O)CCCC Amb28128200 [0,1,0,0,0,0|2,0,0]=3 1383 B7R0.3 C#CC(=O)CCCCl Amb27669507 [0,1,0,0,0,0|2,0,0]=3 1384 B7R0.3 C#CC(=O)CCCN Amb27631285 [0,1,0,0,0,0|1,0,0]=2 1385 B7R0.3 C#CC(=O)CCCO Amb27593195 [0,1,0,0,0,0|2,0,0]=3 1386 B7R0.3 C#CC(=O)NCCN Amb18950627 [0,1,0,0,0,0|2,0,0]=3 1387 B7R0.3 C#CC(=O)NCCN Amb31188137 [0,1,0,0,0,0|2,0,0]=3 1388 B7R0.3 C#CC(=O)NCCO Amb9361227 [0,1,0,0,0,0|3,0,0]=4 1389 B7R0.3 C#CC(=O)OCCBr Amb27437049 [0,1,0,0,0,0|3,0,0]=4 1390 B7R0.3 C#CC(=O)OCCC Amb27761363 [0,1,0,0,0,0|3,0,0]=4 1391 B7R0.3 C#CC(=O)OCCO Amb27589194 [0,1,0,0,0,0|3,0,0]=4 1392 B7R0.3 C#CC(O)CCCN Amb30024282 [0,1,0,0,0,0|1,0,1]=3 1393 B7R0.3 C#CCCC(=O)NN Amb18636071 [0,1,0,0,0,0|2,0,1]=4 1394 B7R0.3 C#CCCC(=O)OC Amb18115985 [0,1,0,0,0,0|1,0,1]=3 1395 B7R0.3 C#CCCC(O)C=O Amb28246623 [0,1,0,0,0,0|1,0,2]=4 1396 B7R0.3 C#CCNC(=O)OC Amb26516332 [0,1,0,0,0,0|2,0,1]=4 1397 B7R0.3 C#CCOC(=O)OC Amb27148094 [0,1,0,0,0,0|2,0,1]=4 1398 B7R0.3 C#C[C@@H](N)CCCN Amb27169320 [0,1,0,0,0,0|2,0,1]=4 1399 B7R0.3 C=C(C=O)CCC#N Amb17593125 [0,1,0,0,0,0|1,0,2]=4 1400 B7R0.3 C=C(C=O)CCCC Amb4025817 [0,1,0,0,0,0|2,0,0]=3 1401 B7R0.3 C=C(C=O)CCCO Amb28128165 [0,1,0,0,0,0|2,0,0]=3 1402 B7R0.3 C=C(C=O)CCOC Amb27948778 [0,1,0,0,0,0|3,0,0]=4 1403 B7R0.3 C=C(CBr)CCCC Amb25249105 [0,1,0,0,0,0|3,0,0]=4 1404 B7R0.3 C=C(CBr)CCCCl Amb27865558 [0,1,0,0,0,0|3,0,0]=4 1405 B7R0.3 C=C(CC)CCCBr Amb27491082 [0,1,0,0,0,0|3,0,0]=4 1406 B7R0.3 C=C(CC)CCCC Amb9787281 [0,1,0,0,0,0|3,0,0]=4 1407 B7R0.3 C=C(CC)CCCCl Amb28397002 [0,1,0,0,0,0|3,0,0]=4 1408 B7R0.3 C=C(CC)CCCN Amb27631266 [0,1,0,0,0,0|2,0,0]=3 1409 B7R0.3 C=C(CC)CCCO Amb26032857 [0,1,0,0,0,0|3,0,0]=4 1410 B7R0.3 C=C(CCl)CCCC Amb25889368 [0,1,0,0,0,0|3,0,0]=4 1411 B7R0.3 C=C(CN)CCCC Amb27630595 [0,1,0,0,0,0|3,0,0]=4 1412 B7R0.3 C=C=C(C)CCCBr Amb27876055 [0,1,0,0,0,0|3,0,0]=4 1413 B7R0.3 C=C=C(C)CCCN Amb27839400 [0,1,0,0,0,0|2,0,0]=3 1414 B7R0.3 C=C=C(C)CCCO Amb28321385 [0,1,0,0,0,0|3,0,0]=4 1415 B7R0.3 C=CC(=O)CCCC Amb25062494 [0,1,0,0,0,0|2,0,0]=3 1416 B7R0.3 C=CC(=O)CCCCl Amb24568327 [0,1,0,0,0,0|2,0,0]=3 1417 B7R0.3 C=CC(=O)CCOC Amb24744935 [0,1,0,0,0,0|3,0,0]=4 1418 B7R0.3 C=CC(=O)CCSC Amb25334636 [0,1,0,0,0,0|3,0,0]=4 1419 B7R0.3 C=CC(=O)COCC Amb27248148 [0,1,0,0,0,0|3,0,0]=4 1420 B7R0.3 C=CC(=O)CSCC Amb25865187 [0,1,0,0,0,0|3,0,0]=4 1421 B7R0.3 C=CC(=O)NCCBr Amb28325545 [0,1,0,0,0,0|3,0,0]=4 1422 B7R0.3 C=CC(=O)NCCC Amb9480391 [0,1,0,0,0,0|3,0,0]=4 1423 B7R0.3 C=CC(=O)NCCCl Amb20668986 [0,1,0,0,0,0|3,0,0]=4 1424 B7R0.3 C=CC(=O)NCCF Amb27805492 [0,1,0,0,0,0|3,0,0]=4 1425 B7R0.3 C=CC(=O)NCCN Amb18291565 [0,1,0,0,0,0|2,0,0]=3 1426 B7R0.3 C=CC(=O)NCCN Amb19514971 [0,1,0,0,0,0|2,0,0]=3 1427 B7R0.3 C=CC(=O)NCCO Amb9361225 [0,1,0,0,0,0|3,0,0]=4 1428 B7R0.3 C=CC(=O)OCCC Amb22045218 [0,1,0,0,0,0|3,0,0]=4 1429 B7R0.3 C=CC(=O)OCCF Amb2688098 [0,1,0,0,0,0|3,0,0]=4 1430 B7R0.3 C=CCCC(=N)NO Amb26959869 [0,1,0,0,0,0|2,0,1]=4 1431 B7R0.3 C=CCCC(=O)C#N Amb27749803 [0,1,0,0,0,0|2,0,1]=4 1432 B7R0.3 C=CCCC(=O)CBr Amb22059627 [0,1,0,0,0,0|2,0,1]=4 1433 B7R0.3 C=CCCC(=O)CC Amb9031676 [0,1,0,0,0,0|2,0,1]=4 1434 B7R0.3 C=CCCC(=O)CCl Amb22059504 [0,1,0,0,0,0|2,0,1]=4 1435 B7R0.3 C=CCCC(=O)CF Amb28074643 [0,1,0,0,0,0|2,0,1]=4 1436 B7R0.3 C=CCCC(=O)NC Amb25041195 [0,1,0,0,0,0|2,0,1]=4 1437 B7R0.3 C=CCCC(=O)NN Amb27775332 [0,1,0,0,0,0|2,0,1]=4 1438 B7R0.3 C=CCCC(=O)NN Amb27831946 [0,1,0,0,0,0|2,0,1]=4 1439 B7R0.3 C=CCCC(=O)NO Amb28205003 [0,1,0,0,0,0|1,0,1]=3 1440 B7R0.3 C=CCCC(=O)OC Amb2369959 [0,1,0,0,0,0|1,0,1]=3 1441 B7R0.3 C=CCCC(O)C=O Amb27863605 [0,1,0,0,0,0|1,0,2]=4 1442 B7R0.3 C=CCNC(=O)CO Amb33531863 [0,1,0,0,0,0|2,0,1]=4 1443 B7R0.3 C=CCNC(=O)NO Amb28134073 [0,1,0,0,0,0|2,0,1]=4 1444 B7R0.3 C=CCNC(=O)OC Amb17794125 [0,1,0,0,0,0|2,0,1]=4 1445 B7R0.3 C=CCOC(=O)OC Amb8515646 [0,1,0,0,0,0|2,0,1]=4 1446 B7R0.3 C=C[C@H](O)CCCO Amb27423134 [0,1,0,0,0,0|2,0,1]=4 1447 B7R0.3 C=C\C(C)=C/CCN Amb27494431 [0,1,0,0,0,0|2,0,1]=4 1448 B7R0.3 CC#CCC(=O)OC Amb6336504 [0,1,0,0,0,0|1,0,2]=4 1449 B7R0.3 CC(C#N)CCCN Amb24657102 [0,1,0,0,0,0|2,0,1]=4 1450 B7R0.3 CC(C=N)CCCN Amb27640100 [0,1,0,0,0,0|2,0,1]=4 1451 B7R0.3 CC(C=O)CCCBr Amb26526795 [0,1,0,0,0,0|2,0,1]=4 1452 B7R0.3 CC(CCl)CCCN Amb27472589 [0,1,0,0,0,0|2,0,1]=4 1453 B7R0.3 CC(CO)CCCN Amb17569904 [0,1,0,0,0,0|1,0,1]=3 1454 B7R0.3 CC(CO)CCCN Amb32686956 [0,1,0,0,0,0|1,0,1]=3 1455 B7R0.3 CC(CO)CCCO Amb25098490 [0,1,0,0,0,0|2,0,1]=4 1456 B7R0.3 CC(CO)NCCN Amb27805491 [0,1,0,0,0,0|2,0,1]=4 1457 B7R0.3 CCC#CC(=O)OC Amb27838321 [0,1,0,0,0,0|1,0,2]=4 1458 B7R0.3 CCC(=O)CCC#N Amb25321503 [0,1,0,0,0,0|1,0,2]=4 1459 B7R0.3 CCC(=O)CCCBr Amb25765636 [0,1,0,0,0,0|2,0,0]=3 1460 B7R0.3 CCC(=O)CCCCl Amb17593423 [0,1,0,0,0,0|2,0,0]=3 1461 B7R0.3 CCC(=O)CCCN Amb18833012 [0,1,0,0,0,0|1,0,0]=2 1462 B7R0.3 CCC(=O)CCNC Amb27963044 [0,1,0,0,0,0|3,0,0]=4 1463 B7R0.3 CCC(=O)CCSC Amb25680024 [0,1,0,0,0,0|3,0,0]=4 1464 B7R0.3 CCC(=O)NCCCl Amb17103188 [0,1,0,0,0,0|3,0,0]=4 1465 B7R0.3 CCC(=O)NCCF Amb27972779 [0,1,0,0,0,0|3,0,0]=4 1466 B7R0.3 CCC(=O)NCCN Amb1137732 [0,1,0,0,0,0|2,0,0]=3 1467 B7R0.3 CCC(=O)NCCN Amb32434788 [0,1,0,0,0,0|2,0,0]=3 1468 B7R0.3 CCC(=O)NCCN Amb33741516 [0,1,0,0,0,0|2,0,0]=3 1469 B7R0.3 CCC(=O)NCCO Amb5797470 [0,1,0,0,0,0|3,0,0]=4 1470 B7R0.3 CCC(=O)NCCS Amb24505089 [0,1,0,0,0,0|3,0,0]=4 1471 B7R0.3 CCC(=O)OCCBr Amb27424669 [0,1,0,0,0,0|3,0,0]=4 1472 B7R0.3 CCC(=O)OCCF Amb27981291 [0,1,0,0,0,0|3,0,0]=4 1473 B7R0.3 CCC(=O)OCCO Amb27217859 [0,1,0,0,0,0|3,0,0]=4 1474 B7R0.3 CCC(=O)SCCBr Amb27865550 [0,1,0,0,0,0|3,0,0]=4 1475 B7R0.3 CCC(C)CCCN Amb17569898 [0,1,0,0,0,0|2,0,1]=4 1476 B7R0.3 CCC(N)CCCN Amb27392660 [0,1,0,0,0,0|2,0,1]=4 1477 B7R0.3 CCC(O)CCCN Amb18202667 [0,1,0,0,0,0|1,0,1]=3 1478 B7R0.3 CCC(O)CCCN Amb19374975 [0,1,0,0,0,0|1,0,1]=3 1479 B7R0.3 CCC(O)CCCO Amb17593216 [0,1,0,0,0,0|2,0,1]=4 1480 B7R0.3 CCCCC(=N)OC Amb17617956 [0,1,0,0,0,0|2,0,0]=3 1481 B7R0.3 CCCCC(=N)OC Amb25353357 [0,1,0,0,0,0|2,0,0]=3 1482 B7R0.3 CCCCC(=O)C#N Amb22729179 [0,1,0,0,0,0|2,0,0]=3 1483 B7R0.3 CCCCC(=O)CBr Amb24563421 [0,1,0,0,0,0|2,0,0]=3 1484 B7R0.3 CCCCC(=O)CC Amb4605999 [0,1,0,0,0,0|2,0,0]=3 1485 B7R0.3 CCCCC(=O)CCl Amb17593420 [0,1,0,0,0,0|2,0,0]=3 1486 B7R0.3 CCCCC(=O)CN Amb24473062 [0,1,0,0,0,0|2,0,0]=3 1487 B7R0.3 CCCCC(=O)CO Amb26073501 [0,1,0,0,0,0|1,0,0]=2 1488 B7R0.3 CCCCC(=O)NC Amb5797766 [0,1,0,0,0,0|2,0,0]=3 1489 B7R0.3 CCCCC(=O)NN Amb534136 [0,1,0,0,0,0|2,0,0]=3 1490 B7R0.3 CCCCC(=O)NO Amb6269796 [0,1,0,0,0,0|1,0,0]=2 1491 B7R0.3 CCCCC(=S)NC Amb27838397 [0,1,0,0,0,0|2,1,0]=4 1492 B7R0.3 CCCCC(Br)C=O Amb17594581 [0,1,0,0,0,0|2,0,1]=4 1493 B7R0.3 CCCCC(C)C=O Amb17593191 [0,1,0,0,0,0|2,0,1]=4 1494 B7R0.3 CCCCC(C)CO Amb17593205 [0,1,0,0,0,0|2,0,1]=4 1495 B7R0.3 CCCCC(C)ON Amb33428411 [0,1,0,0,0,0|2,0,1]=4 1496 B7R0.3 CCCCC(F)C=O Amb27838938 [0,1,0,0,0,0|2,0,1]=4 1497 B7R0.3 CCCCC(N)C=O Amb28422291 [0,1,0,0,0,0|2,0,1]=4 1498 B7R0.3 CCCCC(N)CO Amb3939373 [0,1,0,0,0,0|2,0,1]=4 1499 B7R0.3 CCCCC(O)CBr Amb25233429 [0,1,0,0,0,0|2,0,1]=4 1500 B7R0.3 CCCCC(O)CC Amb10844720 [0,1,0,0,0,0|2,0,1]=4 1501 B7R0.3 CCCCC(O)CCl Amb24481415 [0,1,0,0,0,0|2,0,1]=4 1502 B7R0.3 CCCCC(O)CF Amb27807497 [0,1,0,0,0,0|2,0,1]=4 1503 B7R0.3 CCCCC(O)CN Amb8630130 [0,1,0,0,0,0|2,0,1]=4 1504 B7R0.3 CCCCC(O)CO Amb8390318 [0,1,0,0,0,0|1,0,2]=4 1505 B7R0.3 CCCCN(C)C=O Amb26967032 [0,1,0,0,0,0|3,0,0]=4 1506 B7R0.3 CCCCN(C)N=O Amb22231185 [0,1,0,0,0,0|3,0,0]=4 1507 B7R0.3 CCCCN(O)CC Amb27230146 [0,1,0,0,0,0|3,0,0]=4 1508 B7R0.3 CCCC[C@@H](Br)CO Amb27658529 [0,1,0,0,0,0|2,0,1]=4 1509 B7R0.3 CCCC[C@@H](C)CO Amb27481144 [0,1,0,0,0,0|2,0,1]=4 1510 B7R0.3 CCCC[C@@H](F)CO Amb27593926 [0,1,0,0,0,0|2,0,1]=4 1511 B7R0.3 CCCC[C@@H](N)CO Amb8517438 [0,1,0,0,0,0|2,0,1]=4 1512 B7R0.3 CCCC[C@@H](O)C#N Amb27798698 [0,1,0,0,0,0|2,0,1]=4 1513 B7R0.3 CCCC[C@@H](O)CN Amb33428417 [0,1,0,0,0,0|2,0,1]=4 1514 B7R0.3 CCCC[C@H](C)C=O Amb26587628 [0,1,0,0,0,0|2,0,1]=4 1515 B7R0.3 CCCC[C@H](C)CO Amb26370424 [0,1,0,0,0,0|2,0,1]=4 1516 B7R0.3 CCCC[C@H](F)CO Amb28315208 [0,1,0,0,0,0|2,0,1]=4 1517 B7R0.3 CCCC[C@H](N)CO Amb3941478 [0,1,0,0,0,0|2,0,1]=4 1518 B7R0.3 CCCC[C@H](O)CF Amb27656199 [0,1,0,0,0,0|2,0,1]=4 1519 B7R0.3 CCCC[C@H](O)CN Amb33428416 [0,1,0,0,0,0|2,0,1]=4 1520 B7R0.3 CCCC[C@H](S)CO Amb27804425 [0,1,0,0,0,0|1,1,1]=4 1521 B7R0.3 CCCC\C(Br)=C\Cl Amb27484205 [0,1,0,0,0,0|3,0,0]=4 1522 B7R0.3 CCCC\C(C)=N\N Amb27883272 [0,1,0,0,0,0|3,0,0]=4 1523 B7R0.3 CCCC\C(Cl)=N\O Amb28397410 [0,1,0,0,0,0|2,0,0]=3 1524 B7R0.3 CCCC\C(N)=N/O Amb2696577 [0,1,0,0,0,0|2,0,0]=3 1525 B7R0.3 CCCC\C(N)=N\O Amb8391665 [0,1,0,0,0,0|2,0,0]=3 1526 B7R0.3 CCCNC(=O)CBr Amb17330843 [0,1,0,0,0,0|3,0,0]=4 1527 B7R0.3 CCCNC(=O)CC Amb5797516 [0,1,0,0,0,0|3,0,0]=4 1528 B7R0.3 CCCNC(=O)CCl Amb1207068 [0,1,0,0,0,0|3,0,0]=4 1529 B7R0.3 CCCNC(=O)CI Amb23512283 [0,1,0,0,0,0|3,0,0]=4 1530 B7R0.3 CCCNC(=O)CN Amb10781813 [0,1,0,0,0,0|3,0,0]=4 1531 B7R0.3 CCCNC(=O)CN Amb426858 [0,1,0,0,0,0|3,0,0]=4 1532 B7R0.3 CCCNC(=O)CO Amb5798169 [0,1,0,0,0,0|2,0,0]=3 1533 B7R0.3 CCCNC(=O)NCl Amb28057729 [0,1,0,0,0,0|3,0,0]=4 1534 B7R0.3 CCCNC(=O)NN Amb8854021 [0,1,0,0,0,0|3,0,0]=4 1535 B7R0.3 CCCN\C(C)=N\O Amb27234636 [0,1,0,0,0,0|3,0,0]=4 1536 B7R0.3 CCCN\C(N)=N\O Amb28430250 [0,1,0,0,0,0|3,0,0]=4 1537 B7R0.3 CCCOC(=O)C=O Amb18641875 [0,1,0,0,0,0|2,0,1]=4 1538 B7R0.3 CCCOC(=O)CCl Amb9787444 [0,1,0,0,0,0|3,0,0]=4 1539 B7R0.3 CCCOC(=O)CN Amb9826861 [0,1,0,0,0,0|3,0,0]=4 1540 B7R0.3 CCCOC(=O)CO Amb25964379 [0,1,0,0,0,0|2,0,0]=3 1541 B7R0.3 CCCOC(=O)OC Amb27153532 [0,1,0,0,0,0|2,0,0]=3 1542 B7R0.3 CCCSC(=O)CBr Amb28385643 [0,1,0,0,0,0|3,0,0]=4 1543 B7R0.3 CCCSC(=O)CC Amb25882938 [0,1,0,0,0,0|3,0,0]=4 1544 B7R0.3 CCCSC(=O)NC Amb27788550 [0,1,0,0,0,0|3,0,0]=4 1545 B7R0.3 CCCSC(=O)NN Amb27769595 [0,1,0,0,0,0|3,0,0]=4 1546 B7R0.3 CCC\C=C(/Cl)C=O Amb27201672 [0,1,0,0,0,0|2,0,1]=4 1547 B7R0.3 CCN(C)CCCN Amb6670583 [0,1,0,0,0,0|3,0,0]=4 1548 B7R0.3 CCN(O)CCCN Amb27839388 [0,1,0,0,0,0|2,0,0]=3 1549 B7R0.3 CCNCC(=O)NC Amb32680747 [0,1,0,0,0,0|3,0,0]=4 1550 B7R0.3 CCNCC(=O)NC Amb6251820 [0,1,0,0,0,0|3,0,0]=4 1551 B7R0.3 CCNCC(=O)NO Amb27755137 [0,1,0,0,0,0|2,0,0]=3 1552 B7R0.3 CCNCC(=O)OC Amb19514718 [0,1,0,0,0,0|2,0,0]=3 1553 B7R0.3 CCNCC(=O)OC Amb6687125 [0,1,0,0,0,0|2,0,0]=3 1554 B7R0.3 CCNC\C(N)=N\O Amb24612871 [0,1,0,0,0,0|3,0,0]=4 1555 B7R0.3 CCOCC(=O)CC Amb27406475 [0,1,0,0,0,0|3,0,0]=4 1556 B7R0.3 CCOCC(=O)CCl Amb25087764 [0,1,0,0,0,0|3,0,0]=4 1557 B7R0.3 CCOCC(=O)CF Amb28316133 [0,1,0,0,0,0|3,0,0]=4 1558 B7R0.3 CCOCC(=O)CN Amb27453616 [0,1,0,0,0,0|3,0,0]=4 1559 B7R0.3 CCOCC(=O)CO Amb28066809 [0,1,0,0,0,0|2,0,0]=3 1560 B7R0.3 CCOCC(=O)NN Amb2111918 [0,1,0,0,0,0|3,0,0]=4 1561 B7R0.3 CCOCC(=O)NN Amb6744505 [0,1,0,0,0,0|3,0,0]=4 1562 B7R0.3 CCOCC(=O)OC Amb7753022 [0,1,0,0,0,0|2,0,0]=3 1563 B7R0.3 CCOCC(O)C=O Amb27883256 [0,1,0,0,0,0|2,0,1]=4 1564 B7R0.3 CCOC\C(C)=N\O Amb28049034 [0,1,0,0,0,0|3,0,0]=4 1565 B7R0.3 CCOC\C(N)=N\O Amb6280903 [0,1,0,0,0,0|3,0,0]=4 1566 B7R0.3 CCONC(=O)CO Amb27762105 [0,1,0,0,0,0|3,0,0]=4 1567 B7R0.3 CCS(=O)CCCCl Amb27188737 [0,1,0,0,0,0|3,0,0]=4 1568 B7R0.3 CCS(=O)CCCN Amb18306016 [0,1,0,0,0,0|2,0,0]=3 1569 B7R0.3 CCSCC(=O)CCl Amb24545960 [0,1,0,0,0,0|3,0,0]=4 1570 B7R0.3 CCSCC(=O)CN Amb33324079 [0,1,0,0,0,0|3,0,0]=4 1571 B7R0.3 CCSCC(=O)NN Amb2610654 [0,1,0,0,0,0|3,0,0]=4 1572 B7R0.3 CCSCC(=O)OC Amb7753193 [0,1,0,0,0,0|2,0,0]=3 1573 B7R0.3 CCSC\C(N)=N\O Amb6680779 [0,1,0,0,0,0|3,0,0]=4 1574 B7R0.3 CCS\C=C(\O)C=O Amb27412581 [0,1,0,0,0,0|2,0,1]=4 1575 B7R0.3 CC\C(C)=C\CCN Amb27243209 [0,1,0,0,0,0|2,0,1]=4 1576 B7R0.3 CC\C(C)=N\CCN Amb28126958 [0,1,0,0,0,0|3,0,0]=4 1577 B7R0.3 CC\C=C\C(=O)OC Amb2689583 [0,1,0,0,0,0|1,0,2]=4 1578 B7R0.3 CN(C=O)CCCCl Amb24589375 [0,1,0,0,0,0|3,0,0]=4 1579 B7R0.3 CN(C=O)CCCO Amb17593211 [0,1,0,0,0,0|3,0,0]=4 1580 B7R0.3 CN(CCCO)N=O Amb25934136 [0,1,0,0,0,0|3,0,0]=4 1581 B7R0.3 CNC(=O)CCC#N Amb17334052 [0,1,0,0,0,0|1,0,2]=4 1582 B7R0.3 CNC(=O)CCCCl Amb1137464 [0,1,0,0,0,0|2,0,0]=3 1583 B7R0.3 CNC(=O)CCCI Amb27625606 [0,1,0,0,0,0|2,0,0]=3 1584 B7R0.3 CNC(=O)CCCN Amb6263864 [0,1,0,0,0,0|1,0,0]=2 1585 B7R0.3 CNC(=O)CCCN Amb9176288 [0,1,0,0,0,0|1,0,0]=2 1586 B7R0.3 CNC(=O)CCCO Amb17231829 [0,1,0,0,0,0|2,0,0]=3 1587 B7R0.3 CNC(=O)CCCS Amb27259921 [0,1,0,0,0,0|2,0,0]=3 1588 B7R0.3 CNC(=O)CCNN Amb26936043 [0,1,0,0,0,0|2,0,0]=3 1589 B7R0.3 CNC(=O)CCOC Amb27655430 [0,1,0,0,0,0|3,0,0]=4 1590 B7R0.3 CNC(=O)NCCCl Amb27148870 [0,1,0,0,0,0|3,0,0]=4 1591 B7R0.3 CNC(=O)NCCN Amb17231831 [0,1,0,0,0,0|2,0,0]=3 1592 B7R0.3 CNC(=O)NCCN Amb28934877 [0,1,0,0,0,0|2,0,0]=3 1593 B7R0.3 CNC(=O)NCCN Amb32663759 [0,1,0,0,0,0|2,0,0]=3 1594 B7R0.3 CNC(=O)NCCO Amb24376074 [0,1,0,0,0,0|3,0,0]=4 1595 B7R0.3 CNC(=O)NCCS Amb28350549 [0,1,0,0,0,0|3,0,0]=4 1596 B7R0.3 CNC(=O)OCCCl Amb22363563 [0,1,0,0,0,0|3,0,0]=4 1597 B7R0.3 CNC(=O)OCCF Amb28071923 [0,1,0,0,0,0|3,0,0]=4 1598 B7R0.3 CNC(=O)OCCO Amb3939460 [0,1,0,0,0,0|3,0,0]=4 1599 B7R0.3 CNC(=O)\C=C\CN Amb27196933 [0,1,0,0,0,0|1,0,2]=4 1600 B7R0.3 CNC(=O)\C=C\CN Amb29083397 [0,1,0,0,0,0|1,0,2]=4 1601 B7R0.3 CNC(=S)NCCN Amb27838997 [0,1,0,0,0,0|2,1,0]=4 1602 B7R0.3 CNCCC(=N)OC Amb28411188 [0,1,0,0,0,0|3,0,0]=4 1603 B7R0.3 CNCCC(=O)NC Amb19959924 [0,1,0,0,0,0|3,0,0]=4 1604 B7R0.3 CNCCC(=O)NC Amb8428200 [0,1,0,0,0,0|3,0,0]=4 1605 B7R0.3 CNCCC(=O)NN Amb28143068 [0,1,0,0,0,0|3,0,0]=4 1606 B7R0.3 CNCCC(=O)NO Amb27763537 [0,1,0,0,0,0|2,0,0]=3 1607 B7R0.3 CNCCC(=O)OC Amb22168213 [0,1,0,0,0,0|2,0,0]=3 1608 B7R0.3 CNCCC(=O)OC Amb7969878 [0,1,0,0,0,0|2,0,0]=3 1609 B7R0.3 CNCC\C(N)=N/O Amb19981296 [0,1,0,0,0,0|3,0,0]=4 1610 B7R0.3 CNCC\C(N)=N\O Amb22410480 [0,1,0,0,0,0|3,0,0]=4 1611 B7R0.3 CNOCC(=O)OC Amb32662920 [0,1,0,0,0,0|3,0,0]=4 1612 B7R0.3 CNOCC(=O)OC Amb33067971 [0,1,0,0,0,0|3,0,0]=4 1613 B7R0.3 COC(=N)CCC#N Amb17593155 [0,1,0,0,0,0|1,0,2]=4 1614 B7R0.3 COC(=N)CCCCl Amb16231406 [0,1,0,0,0,0|2,0,0]=3 1615 B7R0.3 COC(=N)CCCCl Amb27631457 [0,1,0,0,0,0|2,0,0]=3 1616 B7R0.3 COC(=N)CCCS Amb27628992 [0,1,0,0,0,0|2,0,0]=3 1617 B7R0.3 COC(=O)C#CCCl Amb17673855 [0,1,0,0,0,0|1,0,2]=4 1618 B7R0.3 COC(=O)C#CCN Amb24581713 [0,1,0,0,0,0|0,0,2]=3 1619 B7R0.3 COC(=O)C#CCN Amb33038300 [0,1,0,0,0,0|0,0,2]=3 1620 B7R0.3 COC(=O)C#CCO Amb16233601 [0,1,0,0,0,0|1,0,2]=4 1621 B7R0.3 COC(=O)CCC#N Amb2689406 [0,1,0,0,0,0|0,0,2]=3 1622 B7R0.3 COC(=O)CCC=O Amb18124259 [0,1,0,0,0,0|1,0,1]=3 1623 B7R0.3 COC(=O)CCCBr Amb8516943 [0,1,0,0,0,0|1,0,0]=2 1624 B7R0.3 COC(=O)CCCCl Amb3940271 [0,1,0,0,0,0|1,0,0]=2 1625 B7R0.3 COC(=O)CCCI Amb3941711 [0,1,0,0,0,0|1,0,0]=2 1626 B7R0.3 COC(=O)CCCN Amb402626 [0,1,0,0,0,0|0,0,0]=1 1627 B7R0.3 COC(=O)CCCS Amb19373761 [0,1,0,0,0,0|1,0,0]=2 1628 B7R0.3 COC(=O)CCC[NH3+] Amb2778689 [0,1,0,0,0,0|0,0,1]=2 1629 B7R0.3 COC(=O)CCON Amb29848091 [0,1,0,0,0,0|1,0,0]=2 1630 B7R0.3 COC(=O)CCSC Amb8393179 [0,1,0,0,0,0|2,0,0]=3 1631 B7R0.3 COC(=O)CN=C=O Amb3905407 [0,1,0,0,0,0|2,0,1]=4 1632 B7R0.3 COC(=O)CN=C=S Amb2371376 [0,1,0,0,0,0|2,0,1]=4 1633 B7R0.3 COC(=O)CN=[N+]=[N-] Amb1101953 [0,1,0,0,0,0|2,0,1]=4 1634 B7R0.3 COC(=O)CNC=O Amb22000868 [0,1,0,0,0,0|2,0,1]=4 1635 B7R0.3 COC(=O)CNC=S Amb27839121 [0,1,0,0,0,0|2,0,1]=4 1636 B7R0.3 COC(=O)CSCBr Amb28458464 [0,1,0,0,0,0|2,0,0]=3 1637 B7R0.3 COC(=O)C\C=C\Cl Amb28458363 [0,1,0,0,0,0|1,0,2]=4 1638 B7R0.3 COC(=O)NCC=O Amb27839038 [0,1,0,0,0,0|2,0,1]=4 1639 B7R0.3 COC(=O)NCCN Amb18970459 [0,1,0,0,0,0|1,0,0]=2 1640 B7R0.3 COC(=O)NCCN Amb28934803 [0,1,0,0,0,0|1,0,0]=2 1641 B7R0.3 COC(=O)NCCO Amb9285601 [0,1,0,0,0,0|2,0,0]=3 1642 B7R0.3 COC(=O)NCSC Amb28398191 [0,1,0,0,0,0|3,0,0]=4 1643 B7R0.3 COC(=O)OCC=O Amb28208420 [0,1,0,0,0,0|2,0,1]=4 1644 B7R0.3 COC(=O)OCCBr Amb27228663 [0,1,0,0,0,0|2,0,0]=3 1645 B7R0.3 COC(=O)SCCCl Amb27640237 [0,1,0,0,0,0|2,0,0]=3 1646 B7R0.3 COC(=O)\C=C\CBr Amb8513243 [0,1,0,0,0,0|1,0,2]=4 1647 B7R0.3 COC(=O)\C=C\CF Amb35747826 [0,1,0,0,0,0|1,0,2]=4 1648 B7R0.3 COC(=O)\C=C\CN Amb24117125 [0,1,0,0,0,0|0,0,2]=3 1649 B7R0.3 COC(=O)\C=C\CN Amb30634316 [0,1,0,0,0,0|0,0,2]=3 1650 B7R0.3 COC(=S)SCCF Amb27458294 [0,1,0,0,0,0|2,1,0]=4 1651 B7R0.3 COC(C)CCCBr Amb27198618 [0,1,0,0,0,0|2,0,1]=4 1652 B7R0.3 COC(C)CCCCl Amb28397922 [0,1,0,0,0,0|2,0,1]=4 1653 B7R0.3 COC(C)CCCN Amb17569913 [0,1,0,0,0,0|1,0,1]=3 1654 B7R0.3 COCCC(=O)CCl Amb20622320 [0,1,0,0,0,0|3,0,0]=4 1655 B7R0.3 COCCC(=O)CN Amb26515688 [0,1,0,0,0,0|3,0,0]=4 1656 B7R0.3 COCCC(=O)NN Amb2689273 [0,1,0,0,0,0|3,0,0]=4 1657 B7R0.3 COCCC(=O)OC Amb6296150 [0,1,0,0,0,0|2,0,0]=3 1658 B7R0.3 COCC\C(N)=C\O Amb28364926 [0,1,0,0,0,0|3,0,0]=4 1659 B7R0.3 COCC\C(N)=N/O Amb19890177 [0,1,0,0,0,0|3,0,0]=4 1660 B7R0.3 COCC\C(N)=N/O Amb2696139 [0,1,0,0,0,0|3,0,0]=4 1661 B7R0.3 COCC\C(N)=N\O Amb22490466 [0,1,0,0,0,0|3,0,0]=4 1662 B7R0.3 COCC\C(N)=N\O Amb8384548 [0,1,0,0,0,0|3,0,0]=4 1663 B7R0.3 COCNC(=O)OC Amb27253203 [0,1,0,0,0,0|3,0,0]=4 1664 B7R0.3 CON(C)CCCF Amb28285235 [0,1,0,0,0,0|3,0,0]=4 1665 B7R0.3 CON(C)CCCN Amb24697678 [0,1,0,0,0,0|2,0,0]=3 1666 B7R0.3 CON(C)CCCN Amb32665371 [0,1,0,0,0,0|2,0,0]=3 1667 B7R0.3 CON(C)CCCO Amb26370515 [0,1,0,0,0,0|3,0,0]=4 1668 B7R0.3 COS(=O)OCCO Amb27835054 [0,1,0,0,0,0|3,0,0]=4 1669 B7R0.3 CSC(=O)CCCCl Amb27249585 [0,1,0,0,0,0|1,1,0]=3 1670 B7R0.3 CSCCC(=O)CCl Amb25910902 [0,1,0,0,0,0|3,0,0]=4 1671 B7R0.3 CSCCC(=O)CF Amb28316167 [0,1,0,0,0,0|3,0,0]=4 1672 B7R0.3 CSCCC(=O)CN Amb33199125 [0,1,0,0,0,0|3,0,0]=4 1673 B7R0.3 CSCC\C(N)=N\O Amb25127504 [0,1,0,0,0,0|3,0,0]=4 1674 B7R0.3 C[C@@H](CO)CCCBr Amb28128316 [0,1,0,0,0,0|2,0,1]=4 1675 B7R0.3 C[C@@H](CO)CCCO Amb27664197 [0,1,0,0,0,0|2,0,1]=4 1676 B7R0.3 C\C(=C/CCBr)CO Amb27454855 [0,1,0,0,0,0|2,0,1]=4 1677 B7R0.3 C\C(=C/CCCl)CO Amb27600969 [0,1,0,0,0,0|2,0,1]=4 1678 B7R0.3 C\C(C=O)=C/CCO Amb28255738 [0,1,0,0,0,0|2,0,1]=4 1679 B7R0.3 C\C(CCCO)=N/O Amb28207168 [0,1,0,0,0,0|2,0,0]=3 1680 B7R0.3 C\C=C(/C)CCCC Amb22229367 [0,1,0,0,0,0|3,0,0]=4 1681 B7R0.3 C\C=C(/Cl)CCCCl Amb27832144 [0,1,0,0,0,0|3,0,0]=4 1682 B7R0.3 C\C=C(\C)CCCBr Amb28325651 [0,1,0,0,0,0|3,0,0]=4 1683 B7R0.3 C\C=C(\C)CCCN Amb27412873 [0,1,0,0,0,0|2,0,0]=3 1684 B7R0.3 C\C=C(\C)NCCN Amb27838834 [0,1,0,0,0,0|3,0,0]=4 1685 B7R0.3 C\C=C(\Cl)CCCCl Amb27421928 [0,1,0,0,0,0|3,0,0]=4 1686 B7R0.3 C\C=C\CC(=O)OC Amb8394879 [0,1,0,0,0,0|1,0,2]=4 1687 B7R0.3 N#CC(=O)CCCCl Amb28410737 [0,1,0,0,0,0|2,0,0]=3 1688 B7R0.3 N#CCCC(=O)C#N Amb28049016 [0,1,0,0,0,0|1,0,2]=4 1689 B7R0.3 N#CCCC(=O)C=O Amb27792293 [0,1,0,0,0,0|0,0,3]=4 1690 B7R0.3 N#CCCC(=O)CN Amb27240440 [0,1,0,0,0,0|1,0,2]=4 1691 B7R0.3 N#C[C@H](O)CCCBr Amb27981129 [0,1,0,0,0,0|2,0,1]=4 1692 B7R0.3 NC(CO)CCCF Amb28069002 [0,1,0,0,0,0|2,0,1]=4 1693 B7R0.3 NC(CO)CCCO Amb18641979 [0,1,0,0,0,0|2,0,1]=4 1694 B7R0.3 NCC(=O)NCCF Amb27659897 [0,1,0,0,0,0|3,0,0]=4 1695 B7R0.3 NCC(=O)NCCF Amb33473629 [0,1,0,0,0,0|3,0,0]=4 1696 B7R0.3 NCC(=O)NCCO Amb9023087 [0,1,0,0,0,0|3,0,0]=4 1697 B7R0.3 NCC(=O)OCCCl Amb4244115 [0,1,0,0,0,0|3,0,0]=4 1698 B7R0.3 NCC(=O)OCCF Amb27964557 [0,1,0,0,0,0|3,0,0]=4 1699 B7R0.3 NCC(O)CCCF Amb33196094 [0,1,0,0,0,0|2,0,1]=4 1700 B7R0.3 NCCCC(=O)NN Amb18061734 [0,1,0,0,0,0|1,0,0]=2 1701 B7R0.3 NCCCC(N)CF Amb28410605 [0,1,0,0,0,0|2,0,1]=4 1702 B7R0.3 NCCCC(N)CN Amb26640553 [0,1,0,0,0,0|2,0,1]=4 1703 B7R0.3 NCCCC(N)CO Amb27665423 [0,1,0,0,0,0|1,0,1]=3 1704 B7R0.3 NCCCC(O)CO Amb27759884 [0,1,0,0,0,0|0,0,2]=3 1705 B7R0.3 NCCC[C@H](N)C=O Amb27838296 [0,1,0,0,0,0|1,0,1]=3 1706 B7R0.3 NCCC\C(N)=N\O Amb25889843 [0,1,0,0,0,0|1,0,0]=2 1707 B7R0.3 NCCNC(=O)CS Amb27413124 [0,1,0,0,0,0|1,1,0]=3 1708 B7R0.3 NCCNC(=O)NN Amb19514735 [0,1,0,0,0,0|2,0,0]=3 1709 B7R0.3 NCCNC(=O)NN Amb26370529 [0,1,0,0,0,0|2,0,0]=3 1710 B7R0.3 NCCSC(=O)CCl Amb28284347 [0,1,0,0,0,0|2,0,0]=3 1711 B7R0.3 NCC\C=C(/Cl)CN Amb27838982 [0,1,0,0,0,0|2,0,1]=4 1712 B7R0.3 NCC\C=C(\Cl)CN Amb28193495 [0,1,0,0,0,0|2,0,1]=4 1713 B7R0.3 NC[C@H](O)CCCO Amb27632965 [0,1,0,0,0,0|2,0,1]=4 1714 B7R0.3 NNC(=O)CCCCl Amb9818914 [0,1,0,0,0,0|2,0,0]=3 1715 B7R0.3 NNC(=O)CCCO Amb535400 [0,1,0,0,0,0|2,0,0]=3 1716 B7R0.3 NNC(=O)CCNO Amb25128022 [0,1,0,0,0,0|3,0,0]=4 1717 B7R0.3 NNC(=O)OCCO Amb4020372 [0,1,0,0,0,0|3,0,0]=4 1718 B7R0.3 NOCC[C@H](N)CO Amb27430113 [0,1,0,0,0,0|2,0,1]=4 1719 B7R0.3 N[C@@H](CO)CCCO Amb28254525 [0,1,0,0,0,0|2,0,1]=4 1720 B7R0.3 N[C@H](CO)CCCO Amb24117047 [0,1,0,0,0,0|2,0,1]=4 1721 B7R0.3 N\C(CCCBr)=N/O Amb4297023 [0,1,0,0,0,0|2,0,0]=3 1722 B7R0.3 N\N=C(/N)CCCCl Amb2696495 [0,1,0,0,0,0|3,0,0]=4 1723 B7R0.3 O=C(CBr)CCCBr Amb27153779 [0,1,0,0,0,0|2,0,0]=3 1724 B7R0.3 O=C(CBr)CCCCl Amb27875989 [0,1,0,0,0,0|2,0,0]=3 1725 B7R0.3 O=C(CBr)NCCBr Amb24104073 [0,1,0,0,0,0|3,0,0]=4 1726 B7R0.3 O=C(CBr)NCCCl Amb29848056 [0,1,0,0,0,0|3,0,0]=4 1727 B7R0.3 O=C(CCCCl)NO Amb28061167 [0,1,0,0,0,0|1,0,0]=2 1728 B7R0.3 O=C(CCCF)NO Amb28185008 [0,1,0,0,0,0|1,0,0]=2 1729 B7R0.3 O=C(CCl)CCCBr Amb22395325 [0,1,0,0,0,0|2,0,0]=3 1730 B7R0.3 O=C(CCl)CCCCl Amb22395285 [0,1,0,0,0,0|2,0,0]=3 1731 B7R0.3 O=C(CCl)NCCBr Amb26055016 [0,1,0,0,0,0|3,0,0]=4 1732 B7R0.3 O=C(CCl)NCCCl Amb22261518 [0,1,0,0,0,0|3,0,0]=4 1733 B7R0.3 O=C(CCl)NCCF Amb28048272 [0,1,0,0,0,0|3,0,0]=4 1734 B7R0.3 O=C(CCl)NCCO Amb5716292 [0,1,0,0,0,0|3,0,0]=4 1735 B7R0.3 O=C(CCl)NCCS Amb25350349 [0,1,0,0,0,0|3,0,0]=4 1736 B7R0.3 O=C(CCl)SCCCl Amb28396574 [0,1,0,0,0,0|3,0,0]=4 1737 B7R0.3 O=C(CF)OCCCl Amb25112007 [0,1,0,0,0,0|3,0,0]=4 1738 B7R0.3 O=C(CO)CCCO Amb27227084 [0,1,0,0,0,0|1,0,0]=2 1739 B7R0.3 O=C(CO)NCCO Amb5798091 [0,1,0,0,0,0|2,0,0]=3 1740 B7R0.3 O=C(CO)OCCF Amb28049311 [0,1,0,0,0,0|2,0,0]=3 1741 B7R0.3 O=C(CS)NCCF Amb28204076 [0,1,0,0,0,0|2,1,0]=4 1742 B7R0.3 O=C(CS)OCCO Amb26476359 [0,1,0,0,0,0|2,1,0]=4 1743 B7R0.3 O=C(NCl)OCCCl Amb27220875 [0,1,0,0,0,0|3,0,0]=4 1744 B7R0.3 O=CC(=O)CCCO Amb27751348 [0,1,0,0,0,0|1,0,1]=3 1745 B7R0.3 O=CC(Cl)CCCO Amb27831369 [0,1,0,0,0,0|2,0,1]=4 1746 B7R0.3 O=CCCC(=O)CO Amb27799816 [0,1,0,0,0,0|1,0,1]=3 1747 B7R0.3 O=CCC\C(Cl)=N\O Amb27751320 [0,1,0,0,0,0|2,0,1]=4 1748 B7R0.3 O=C[C@H](O)CCCO Amb27164637 [0,1,0,0,0,0|1,0,1]=3 1749 B7R0.3 O=C\C(Br)=C/CCO Amb27841266 [0,1,0,0,0,0|2,0,1]=4 1750 B7R0.3 O=C\C(F)=C\CCO Amb27798298 [0,1,0,0,0,0|2,0,1]=4 1751 B7R0.3 OC(CBr)CCCBr Amb27268592 [0,1,0,0,0,0|2,0,1]=4 1752 B7R0.3 OC(CCl)CCCCl Amb26019455 [0,1,0,0,0,0|2,0,1]=4 1753 B7R0.3 OCC(O)CCCCl Amb17593523 [0,1,0,0,0,0|1,0,2]=4 1754 B7R0.3 OCCCC(O)CO Amb17593225 [0,1,0,0,0,0|1,0,2]=4 1755 B7R0.3 OCCC[C@@H](O)CO Amb27213939 [0,1,0,0,0,0|1,0,2]=4 1756 B7R0.3 OCCC[C@H](Cl)CO Amb27165705 [0,1,0,0,0,0|2,0,1]=4 1757 B7R0.3 OC[C@@H](O)CCCCl Amb27235461 [0,1,0,0,0,0|1,0,2]=4 1758 B7R0.3 [C-]#[N+]CCC(=O)OC Amb2689499 [0,1,0,0,0,0|2,0,0]=3 1759 B7R0.4 C#CCCCC(=N)N Amb27429454 [0,1,0,0,0,0|3,0,0]=4 1760 B7R0.4 C#CCCCC(=O)Cl Amb2688725 [0,1,0,0,0,0|2,0,0]=3 1761 B7R0.4 C#CCCCC(=O)O Amb2721705 [0,1,0,0,0,0|1,0,0]=2 1762 B7R0.4 C#CCCCC(C)=O Amb18115312 [0,1,0,0,0,0|2,0,0]=3 1763 B7R0.4 C#CCCCC(C)O Amb24360348 [0,1,0,0,0,0|2,0,1]=4 1764 B7R0.4 C#CCCCC(N)=O Amb27590599 [0,1,0,0,0,0|2,0,0]=3 1765 B7R0.4 C#CCCC[C@@H](C)O Amb26936874 [0,1,0,0,0,0|2,0,1]=4 1766 B7R0.4 C#CCCC[C@H](C)O Amb27809722 [0,1,0,0,0,0|2,0,1]=4 1767 B7R0.4 C#CCCNC(C)=O Amb21942373 [0,1,0,0,0,0|2,0,1]=4 1768 B7R0.4 C#CCCNC(N)=O Amb26993283 [0,1,0,0,0,0|2,0,1]=4 1769 B7R0.4 C#CCCOC(=O)Cl Amb22360631 [0,1,0,0,0,0|2,0,1]=4 1770 B7R0.4 C#CCCOC(N)=O Amb28364943 [0,1,0,0,0,0|2,0,1]=4 1771 B7R0.4 C#CCNCC(=O)O Amb33551387 [0,1,0,0,0,0|1,0,1]=3 1772 B7R0.4 C#CCNCC(=O)O Amb6740302 [0,1,0,0,0,0|1,0,1]=3 1773 B7R0.4 C#CCOCC(=O)O Amb9208655 [0,1,0,0,0,0|1,0,1]=3 1774 B7R0.4 C#CCOCC(C)=O Amb3987398 [0,1,0,0,0,0|2,0,1]=4 1775 B7R0.4 C#CCSCC(=O)O Amb2372297 [0,1,0,0,0,0|1,0,1]=3 1776 B7R0.4 C=C(Br)CCCC#N Amb6298900 [0,1,0,0,0,0|2,0,1]=4 1777 B7R0.4 C=C(Br)CCCCBr Amb4035450 [0,1,0,0,0,0|3,0,0]=4 1778 B7R0.4 C=C(Br)CNCCN Amb18180845 [0,1,0,0,0,0|2,0,0]=3 1779 B7R0.4 C=C(Br)COCCN Amb19020783 [0,1,0,0,0,0|2,0,0]=3 1780 B7R0.4 C=C(Br)COCCO Amb28453509 [0,1,0,0,0,0|3,0,0]=4 1781 B7R0.4 C=C(C)CCCC#N Amb6298905 [0,1,0,0,0,0|2,0,1]=4 1782 B7R0.4 C=C(C)CCCCC Amb6298938 [0,1,0,0,0,0|3,0,0]=4 1783 B7R0.4 C=C(C)CCCCO Amb26872404 [0,1,0,0,0,0|3,0,0]=4 1784 B7R0.4 C=C(C)CCCNN Amb28345747 [0,1,0,0,0,0|2,0,0]=3 1785 B7R0.4 C=C(C)CCOCCl Amb28366369 [0,1,0,0,0,0|3,0,0]=4 1786 B7R0.4 C=C(C)CNCCC Amb17308631 [0,1,0,0,0,0|3,0,0]=4 1787 B7R0.4 C=C(C)CNCCF Amb28316183 [0,1,0,0,0,0|3,0,0]=4 1788 B7R0.4 C=C(C)COCCN Amb19020764 [0,1,0,0,0,0|2,0,0]=3 1789 B7R0.4 C=C(C)COCCN Amb20631068 [0,1,0,0,0,0|2,0,0]=3 1790 B7R0.4 C=C(C)COCCO Amb27452088 [0,1,0,0,0,0|3,0,0]=4 1791 B7R0.4 C=C(C)CSCCC Amb27449649 [0,1,0,0,0,0|3,0,0]=4 1792 B7R0.4 C=C(C)CSCCN Amb6259178 [0,1,0,0,0,0|2,0,0]=3 1793 B7R0.4 C=C(Cl)CCCC=O Amb27751311 [0,1,0,0,0,0|3,0,0]=4 1794 B7R0.4 C=C(Cl)CNCCC Amb19004838 [0,1,0,0,0,0|3,0,0]=4 1795 B7R0.4 C=C(Cl)CNCCN Amb27394577 [0,1,0,0,0,0|2,0,0]=3 1796 B7R0.4 C=C(Cl)COCCN Amb19020765 [0,1,0,0,0,0|2,0,0]=3 1797 B7R0.4 C=C(Cl)CSCCO Amb9273887 [0,1,0,0,0,0|3,0,0]=4 1798 B7R0.4 C=C(F)CCCCO Amb22641473 [0,1,0,0,0,0|3,0,0]=4 1799 B7R0.4 C=C=CCCC(C)=O Amb28315801 [0,1,0,0,0,0|2,0,1]=4 1800 B7R0.4 C=C=CSCC(=O)O Amb27812092 [0,1,0,0,0,0|1,0,2]=4 1801 B7R0.4 C=CC#CCC(=O)O Amb27162652 [0,1,0,0,0,0|1,0,2]=4 1802 B7R0.4 C=CCC#CC(=O)O Amb28252724 [0,1,0,0,0,0|1,0,2]=4 1803 B7R0.4 C=CCCCB(O)O Amb22169115 [0,1,0,0,0,0|2,0,1]=4 1804 B7R0.4 C=CCCCC(=O)Cl Amb8392411 [0,1,0,0,0,0|2,0,0]=3 1805 B7R0.4 C=CCCCC(=O)O Amb3941675 [0,1,0,0,0,0|1,0,0]=2 1806 B7R0.4 C=CCCCC(C)=O Amb17593171 [0,1,0,0,0,0|2,0,0]=3 1807 B7R0.4 C=CCCCC(C)O Amb22059432 [0,1,0,0,0,0|2,0,1]=4 1808 B7R0.4 C=CCCNC(N)=O Amb25789999 [0,1,0,0,0,0|2,0,1]=4 1809 B7R0.4 C=CCCOC(=O)Cl Amb10844792 [0,1,0,0,0,0|2,0,1]=4 1810 B7R0.4 C=CCCOC(C)=O Amb3940828 [0,1,0,0,0,0|2,0,1]=4 1811 B7R0.4 C=CCCSC(C)=O Amb24117956 [0,1,0,0,0,0|2,0,1]=4 1812 B7R0.4 C=CCNCC(=O)O Amb7766404 [0,1,0,0,0,0|1,0,1]=3 1813 B7R0.4 C=CCNCC(=O)O Amb8631497 [0,1,0,0,0,0|1,0,1]=3 1814 B7R0.4 C=CCNCC(N)=O Amb6706481 [0,1,0,0,0,0|2,0,1]=4 1815 B7R0.4 C=CCOCC(=O)O Amb9208694 [0,1,0,0,0,0|1,0,1]=3 1816 B7R0.4 C=CCOCC(C)=O Amb27829146 [0,1,0,0,0,0|2,0,1]=4 1817 B7R0.4 C=CCOCC(N)=O Amb26859258 [0,1,0,0,0,0|2,0,1]=4 1818 B7R0.4 C=CCSCC(=O)O Amb33526723 [0,1,0,0,0,0|1,0,1]=3 1819 B7R0.4 C=CNCCC(=O)O Amb27429817 [0,1,0,0,0,0|1,0,1]=3 1820 B7R0.4 C=COCCC(=O)O Amb28350126 [0,1,0,0,0,0|1,0,1]=3 1821 B7R0.4 C=C\C=C\CC(=O)O Amb34916435 [0,1,0,0,0,0|1,0,2]=4 1822 B7R0.4 CC#CCCC(=O)O Amb3987196 [0,1,0,0,0,0|1,0,1]=3 1823 B7R0.4 CC(=N)NCCCO Amb27967298 [0,1,0,0,0,0|3,0,0]=4 1824 B7R0.4 CC(=O)C#CCCO Amb28316149 [0,1,0,0,0,0|2,0,1]=4 1825 B7R0.4 CC(=O)CCCC#N Amb17106756 [0,1,0,0,0,0|1,0,1]=3 1826 B7R0.4 CC(=O)CCCCBr Amb16234126 [0,1,0,0,0,0|2,0,0]=3 1827 B7R0.4 CC(=O)CCCCCl Amb3941549 [0,1,0,0,0,0|2,0,0]=3 1828 B7R0.4 CC(=O)CCCCF Amb27490855 [0,1,0,0,0,0|2,0,0]=3 1829 B7R0.4 CC(=O)CCCCN Amb27401218 [0,1,0,0,0,0|1,0,0]=2 1830 B7R0.4 CC(=O)CCCCO Amb10603864 [0,1,0,0,0,0|2,0,0]=3 1831 B7R0.4 CC(=O)CCN=[N+]=[N-] Amb18522048 [0,1,0,0,0,0|2,0,1]=4 1832 B7R0.4 CC(=O)CCSC#N Amb28062990 [0,1,0,0,0,0|1,0,2]=4 1833 B7R0.4 CC(=O)CC\C=N\O Amb27656180 [0,1,0,0,0,0|1,0,2]=4 1834 B7R0.4 CC(=O)CNOCO Amb27244723 [0,1,0,0,0,0|3,0,0]=4 1835 B7R0.4 CC(=O)COCCCl Amb25346574 [0,1,0,0,0,0|2,0,0]=3 1836 B7R0.4 CC(=O)COCCF Amb27463527 [0,1,0,0,0,0|2,0,0]=3 1837 B7R0.4 CC(=O)COCCO Amb28122841 [0,1,0,0,0,0|2,0,0]=3 1838 B7R0.4 CC(=O)CSCCF Amb24621173 [0,1,0,0,0,0|2,0,0]=3 1839 B7R0.4 CC(=O)CSCCN Amb17500454 [0,1,0,0,0,0|1,0,0]=2 1840 B7R0.4 CC(=O)CSCCO Amb4165952 [0,1,0,0,0,0|2,0,0]=3 1841 B7R0.4 CC(=O)NCCC#N Amb5787037 [0,1,0,0,0,0|1,0,2]=4 1842 B7R0.4 CC(=O)NCCC=O Amb17102165 [0,1,0,0,0,0|2,0,1]=4 1843 B7R0.4 CC(=O)NCCCBr Amb8826231 [0,1,0,0,0,0|2,0,0]=3 1844 B7R0.4 CC(=O)NCCCCl Amb3886559 [0,1,0,0,0,0|2,0,0]=3 1845 B7R0.4 CC(=O)NCCCN Amb10610286 [0,1,0,0,0,0|1,0,0]=2 1846 B7R0.4 CC(=O)NCCCN Amb6664982 [0,1,0,0,0,0|1,0,0]=2 1847 B7R0.4 CC(=O)NCCCO Amb3429354 [0,1,0,0,0,0|2,0,0]=3 1848 B7R0.4 CC(=O)NCCNN Amb24117179 [0,1,0,0,0,0|2,0,0]=3 1849 B7R0.4 CC(=O)NCCON Amb17138368 [0,1,0,0,0,0|2,0,0]=3 1850 B7R0.4 CC(=O)NOCCO Amb27484242 [0,1,0,0,0,0|3,0,0]=4 1851 B7R0.4 CC(=O)OCCCBr Amb26515737 [0,1,0,0,0,0|2,0,0]=3 1852 B7R0.4 CC(=O)OCCCCl Amb3940269 [0,1,0,0,0,0|2,0,0]=3 1853 B7R0.4 CC(=O)OCCCO Amb25854267 [0,1,0,0,0,0|2,0,0]=3 1854 B7R0.4 CC(=O)OCCCS Amb4018773 [0,1,0,0,0,0|2,0,0]=3 1855 B7R0.4 CC(=O)OCCNN Amb27769313 [0,1,0,0,0,0|2,0,0]=3 1856 B7R0.4 CC(=O)OCOCCl Amb27656207 [0,1,0,0,0,0|3,0,0]=4 1857 B7R0.4 CC(=O)SCCC#N Amb22351951 [0,1,0,0,0,0|1,0,2]=4 1858 B7R0.4 CC(=O)SCCC=O Amb25101351 [0,1,0,0,0,0|2,0,1]=4 1859 B7R0.4 CC(=O)SCCCBr Amb17610077 [0,1,0,0,0,0|2,0,0]=3 1860 B7R0.4 CC(=O)SCCCCl Amb3940270 [0,1,0,0,0,0|2,0,0]=3 1861 B7R0.4 CC(=O)\C=C\CCF Amb33196081 [0,1,0,0,0,0|2,0,1]=4 1862 B7R0.4 CC(=O)\C=C\CCO Amb26479998 [0,1,0,0,0,0|2,0,1]=4 1863 B7R0.4 CC(=S)OCCCO Amb28381661 [0,1,0,0,0,0|2,1,0]=4 1864 B7R0.4 CC(C)=CCCCN Amb18641749 [0,1,0,0,0,0|2,0,0]=3 1865 B7R0.4 CC(C)=CCCCO Amb26478086 [0,1,0,0,0,0|3,0,0]=4 1866 B7R0.4 CC(C)=CCCON Amb35588109 [0,1,0,0,0,0|2,0,1]=4 1867 B7R0.4 CC(C)=NCCCN Amb28126946 [0,1,0,0,0,0|2,0,0]=3 1868 B7R0.4 CC(C)CCCCN Amb33548422 [0,1,0,0,0,0|2,0,1]=4 1869 B7R0.4 CC(C)CCCCN Amb9304907 [0,1,0,0,0,0|2,0,1]=4 1870 B7R0.4 CC(C)CCCON Amb28315398 [0,1,0,0,0,0|2,0,1]=4 1871 B7R0.4 CC(C)CCNCN Amb27194901 [0,1,0,0,0,0|2,0,1]=4 1872 B7R0.4 CC(C)CNCCN Amb17091016 [0,1,0,0,0,0|2,0,1]=4 1873 B7R0.4 CC(C)COCCN Amb33548979 [0,1,0,0,0,0|2,0,1]=4 1874 B7R0.4 CC(C)COCCN Amb6247554 [0,1,0,0,0,0|2,0,1]=4 1875 B7R0.4 CC(C)CSCCN Amb28934790 [0,1,0,0,0,0|2,0,1]=4 1876 B7R0.4 CC(C)CSCCN Amb6274135 [0,1,0,0,0,0|2,0,1]=4 1877 B7R0.4 CC(C)NCCCN Amb8515462 [0,1,0,0,0,0|2,0,1]=4 1878 B7R0.4 CC(C)OCCCN Amb6608864 [0,1,0,0,0,0|2,0,1]=4 1879 B7R0.4 CC(C)OCCCN Amb6892638 [0,1,0,0,0,0|2,0,1]=4 1880 B7R0.4 CC(C)SCCCN Amb10075505 [0,1,0,0,0,0|2,0,1]=4 1881 B7R0.4 CC(F)CSCCN Amb27782477 [0,1,0,0,0,0|2,0,1]=4 1882 B7R0.4 CC(N)CCCCN Amb25214697 [0,1,0,0,0,0|2,0,1]=4 1883 B7R0.4 CC(N)CCCCN Amb33551364 [0,1,0,0,0,0|2,0,1]=4 1884 B7R0.4 CC(N)CNCCN Amb28198270 [0,1,0,0,0,0|2,0,1]=4 1885 B7R0.4 CC(O)CCCC=O Amb18641887 [0,1,0,0,0,0|2,0,1]=4 1886 B7R0.4 CC(O)CCCCF Amb27486303 [0,1,0,0,0,0|2,0,1]=4 1887 B7R0.4 CC(O)CCCCN Amb17569903 [0,1,0,0,0,0|1,0,1]=3 1888 B7R0.4 CC(O)CCCCO Amb22227757 [0,1,0,0,0,0|2,0,1]=4 1889 B7R0.4 CC(O)CCCC[SiH3] Amb28322353 [0,1,0,0,0,0|2,0,1]=4 1890 B7R0.4 CC(O)CNCCN Amb4034606 [0,1,0,0,0,0|1,0,1]=3 1891 B7R0.4 CC(O)CNCCO Amb4020001 [0,1,0,0,0,0|2,0,1]=4 1892 B7R0.4 CC(O)CNCCS Amb27838396 [0,1,0,0,0,0|2,0,1]=4 1893 B7R0.4 CC(O)COCCCl Amb27410199 [0,1,0,0,0,0|2,0,1]=4 1894 B7R0.4 CC(O)COCCN Amb27404532 [0,1,0,0,0,0|1,0,1]=3 1895 B7R0.4 CC(O)CSCCO Amb22055428 [0,1,0,0,0,0|2,0,1]=4 1896 B7R0.4 CC(O)CSCCS Amb28074830 [0,1,0,0,0,0|2,0,1]=4 1897 B7R0.4 CC(S)CCCCN Amb32788406 [0,1,0,0,0,0|1,1,1]=4 1898 B7R0.4 CC(S)COCCN Amb32788415 [0,1,0,0,0,0|1,1,1]=4 1899 B7R0.4 CCC#CCC(=O)O Amb26515701 [0,1,0,0,0,0|1,0,1]=3 1900 B7R0.4 CCC#CCC(C)=O Amb28040888 [0,1,0,0,0,0|2,0,1]=4 1901 B7R0.4 CCCC#CC(=O)O Amb2721706 [0,1,0,0,0,0|1,0,1]=3 1902 B7R0.4 CCCC#CC(C)=O Amb26844271 [0,1,0,0,0,0|2,0,1]=4 1903 B7R0.4 CCCC#CC(N)=O Amb27175227 [0,1,0,0,0,0|2,0,1]=4 1904 B7R0.4 CCCCC=C(C)C Amb22228888 [0,1,0,0,0,0|3,0,0]=4 1905 B7R0.4 CCCCCB(O)O Amb2447470 [0,1,0,0,0,0|2,0,1]=4 1906 B7R0.4 CCCCCC(=N)N Amb19890171 [0,1,0,0,0,0|3,0,0]=4 1907 B7R0.4 CCCCCC(=N)N Amb2696574 [0,1,0,0,0,0|3,0,0]=4 1908 B7R0.4 CCCCCC(=N)N Amb35747068 [0,1,0,0,0,0|3,0,0]=4 1909 B7R0.4 CCCCCC(=O)F Amb26061517 [0,1,0,0,0,0|2,0,0]=3 1910 B7R0.4 CCCCCC(=O)O Amb3939846 [0,1,0,0,0,0|1,0,0]=2 1911 B7R0.4 CCCCCC(=O)[O-] Amb22337624 [0,1,0,0,0,0|1,0,1]=3 1912 B7R0.4 CCCCCC(C)=O Amb6608885 [0,1,0,0,0,0|2,0,0]=3 1913 B7R0.4 CCCCCC(C)O Amb8383668 [0,1,0,0,0,0|2,0,1]=4 1914 B7R0.4 CCCCCC(N)=S Amb6246072 [0,1,0,0,0,0|2,1,0]=4 1915 B7R0.4 CCCCCC(O)Cl Amb27232933 [0,1,0,0,0,0|2,0,1]=4 1916 B7R0.4 CCCCCC(O)O Amb25921998 [0,1,0,0,0,0|1,0,2]=4 1917 B7R0.4 CCCCCN(C)O Amb33428427 [0,1,0,0,0,0|3,0,0]=4 1918 B7R0.4 CCCCCS(=O)Cl Amb32720370 [0,1,0,0,0,0|3,0,0]=4 1919 B7R0.4 CCCCCS(=O)[O-] Amb32754032 [0,1,0,0,0,0|2,0,1]=4 1920 B7R0.4 CCCCCS(C)=O Amb27457494 [0,1,0,0,0,0|3,0,0]=4 1921 B7R0.4 CCCCCS(N)=O Amb32720371 [0,1,0,0,0,0|3,0,0]=4 1922 B7R0.4 CCCCC[C@@H](C)O Amb20242420 [0,1,0,0,0,0|2,0,1]=4 1923 B7R0.4 CCCCC[C@H](C)O Amb8395591 [0,1,0,0,0,0|2,0,1]=4 1924 B7R0.4 CCCCC[N+](=O)[O-] Amb22227991 [0,1,0,0,0,0|2,0,1]=4 1925 B7R0.4 CCCCNC(=N)N Amb19748357 [0,1,0,0,0,0|3,0,0]=4 1926 B7R0.4 CCCCNC(=N)N Amb32653258 [0,1,0,0,0,0|3,0,0]=4 1927 B7R0.4 CCCCNC(=O)Cl Amb24574309 [0,1,0,0,0,0|2,0,0]=3 1928 B7R0.4 CCCCNC(C)=N Amb27663050 [0,1,0,0,0,0|3,0,0]=4 1929 B7R0.4 CCCCNC(C)=O Amb5835711 [0,1,0,0,0,0|2,0,0]=3 1930 B7R0.4 CCCCNC(N)=O Amb6663202 [0,1,0,0,0,0|2,0,0]=3 1931 B7R0.4 CCCCNC(N)=S Amb1152044 [0,1,0,0,0,0|2,1,0]=4 1932 B7R0.4 CCCCOB(O)O Amb25687500 [0,1,0,0,0,0|2,0,1]=4 1933 B7R0.4 CCCCOC(=O)Cl Amb6608833 [0,1,0,0,0,0|2,0,0]=3 1934 B7R0.4 CCCCOC(=S)[S-] Amb16186572 [0,1,0,0,0,0|1,2,0]=4 1935 B7R0.4 CCCCOC(C)=O Amb6608782 [0,1,0,0,0,0|2,0,0]=3 1936 B7R0.4 CCCCOC(C)O Amb26537694 [0,1,0,0,0,0|2,0,1]=4 1937 B7R0.4 CCCCOC(N)=O Amb4136361 [0,1,0,0,0,0|2,0,0]=3 1938 B7R0.4 CCCCO[PH](=O)O Amb26035392 [0,1,0,0,0,0|2,0,0]=3 1939 B7R0.4 CCCCSC(=N)N Amb10552525 [0,1,0,0,0,0|3,0,0]=4 1940 B7R0.4 CCCCSC(=N)N Amb4007584 [0,1,0,0,0,0|3,0,0]=4 1941 B7R0.4 CCCCSC(=O)Cl Amb22352826 [0,1,0,0,0,0|2,0,0]=3 1942 B7R0.4 CCCCSC(C)O Amb27191967 [0,1,0,0,0,0|2,0,1]=4 1943 B7R0.4 CCCNCC(=O)O Amb10609640 [0,1,0,0,0,0|1,0,0]=2 1944 B7R0.4 CCCNCC(=O)O Amb1110628 [0,1,0,0,0,0|1,0,0]=2 1945 B7R0.4 CCCNCC(C)=O Amb26954588 [0,1,0,0,0,0|2,0,0]=3 1946 B7R0.4 CCCNCC(C)O Amb9359420 [0,1,0,0,0,0|2,0,1]=4 1947 B7R0.4 CCCNCC(N)=O Amb1124632 [0,1,0,0,0,0|2,0,0]=3 1948 B7R0.4 CCCNCC(N)=O Amb28934788 [0,1,0,0,0,0|2,0,0]=3 1949 B7R0.4 CCCNNC(N)=O Amb27405031 [0,1,0,0,0,0|3,0,0]=4 1950 B7R0.4 CCCOCB(O)O Amb27461328 [0,1,0,0,0,0|2,0,1]=4 1951 B7R0.4 CCCOCC(=O)Cl Amb27260778 [0,1,0,0,0,0|2,0,0]=3 1952 B7R0.4 CCCOCC(=O)O Amb8874504 [0,1,0,0,0,0|1,0,0]=2 1953 B7R0.4 CCCOCC(N)=O Amb27844884 [0,1,0,0,0,0|2,0,0]=3 1954 B7R0.4 CCCOCC(N)=S Amb8874828 [0,1,0,0,0,0|2,1,0]=4 1955 B7R0.4 CCCOC[C@@H](C)O Amb28048955 [0,1,0,0,0,0|2,0,1]=4 1956 B7R0.4 CCCONC(C)=O Amb27764366 [0,1,0,0,0,0|3,0,0]=4 1957 B7R0.4 CCCONC(N)=O Amb2899788 [0,1,0,0,0,0|3,0,0]=4 1958 B7R0.4 CCCSCC(=O)O Amb1137113 [0,1,0,0,0,0|1,0,0]=2 1959 B7R0.4 CCCSCC(C)=O Amb9668676 [0,1,0,0,0,0|2,0,0]=3 1960 B7R0.4 CCCSCC(C)O Amb27463818 [0,1,0,0,0,0|2,0,1]=4 1961 B7R0.4 CCCSCC(N)=O Amb27424658 [0,1,0,0,0,0|2,0,0]=3 1962 B7R0.4 CCCSC[C@@H](C)O Amb27641885 [0,1,0,0,0,0|2,0,1]=4 1963 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [0,1,0,0,0,0|2,0,1]=4 1964 B7R0.4 CCC\C=C\C(=O)Cl Amb2688716 [0,1,0,0,0,0|2,0,1]=4 1965 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [0,1,0,0,0,0|1,0,1]=3 1966 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [0,1,0,0,0,0|2,0,1]=4 1967 B7R0.4 CCC\C=C\C(N)=O Amb26397290 [0,1,0,0,0,0|2,0,1]=4 1968 B7R0.4 CCNCCC(=O)O Amb28934794 [0,1,0,0,0,0|1,0,0]=2 1969 B7R0.4 CCNCCC(=O)O Amb7766402 [0,1,0,0,0,0|1,0,0]=2 1970 B7R0.4 CCNCCC(C)=O Amb18641851 [0,1,0,0,0,0|2,0,0]=3 1971 B7R0.4 CCNCCC(C)O Amb27239293 [0,1,0,0,0,0|2,0,1]=4 1972 B7R0.4 CCNCCC(N)=O Amb33533384 [0,1,0,0,0,0|2,0,0]=3 1973 B7R0.4 CCNCCC(N)=O Amb35749820 [0,1,0,0,0,0|2,0,0]=3 1974 B7R0.4 CCNCCC(N)=S Amb17231882 [0,1,0,0,0,0|2,1,0]=4 1975 B7R0.4 CCNNCC(=O)O Amb28326075 [0,1,0,0,0,0|2,0,0]=3 1976 B7R0.4 CCOCCC(=N)N Amb2696677 [0,1,0,0,0,0|3,0,0]=4 1977 B7R0.4 CCOCCC(=N)N Amb33551393 [0,1,0,0,0,0|3,0,0]=4 1978 B7R0.4 CCOCCC(=O)Cl Amb20672027 [0,1,0,0,0,0|2,0,0]=3 1979 B7R0.4 CCOCCC(=O)O Amb3939859 [0,1,0,0,0,0|1,0,0]=2 1980 B7R0.4 CCOCCC(C)=O Amb7764636 [0,1,0,0,0,0|2,0,0]=3 1981 B7R0.4 CCOCCC(C)O Amb27852957 [0,1,0,0,0,0|2,0,1]=4 1982 B7R0.4 CCOCCC(N)=S Amb6263797 [0,1,0,0,0,0|2,1,0]=4 1983 B7R0.4 CCOCCS(=O)Cl Amb24625733 [0,1,0,0,0,0|3,0,0]=4 1984 B7R0.4 CCOCCS(=O)[O-] Amb26001359 [0,1,0,0,0,0|2,0,1]=4 1985 B7R0.4 CCOCCS(N)=O Amb32720346 [0,1,0,0,0,0|3,0,0]=4 1986 B7R0.4 CCOCC[C@H](C)O Amb27946039 [0,1,0,0,0,0|2,0,1]=4 1987 B7R0.4 CCOCNC(N)=O Amb25765493 [0,1,0,0,0,0|3,0,0]=4 1988 B7R0.4 CCOCOC(=O)Cl Amb27623794 [0,1,0,0,0,0|3,0,0]=4 1989 B7R0.4 CCO\C=C\C(=O)O Amb2725260 [0,1,0,0,0,0|1,0,2]=4 1990 B7R0.4 CCO\N=C\C(=O)O Amb27468748 [0,1,0,0,0,0|2,0,1]=4 1991 B7R0.4 CCSCCC(=N)N Amb6680836 [0,1,0,0,0,0|3,0,0]=4 1992 B7R0.4 CCSCCC(=O)O Amb6273140 [0,1,0,0,0,0|1,0,0]=2 1993 B7R0.4 CCSCCC(C)=O Amb9655821 [0,1,0,0,0,0|2,0,0]=3 1994 B7R0.4 CCSCCC(C)O Amb28048927 [0,1,0,0,0,0|2,0,1]=4 1995 B7R0.4 CCSCCC(N)=O Amb27258252 [0,1,0,0,0,0|2,0,0]=3 1996 B7R0.4 CCSCCC(N)=S Amb17307560 [0,1,0,0,0,0|2,1,0]=4 1997 B7R0.4 CCSCCN(C)O Amb33324043 [0,1,0,0,0,0|3,0,0]=4 1998 B7R0.4 CCSCC[C@@H](C)O Amb33223925 [0,1,0,0,0,0|2,0,1]=4 1999 B7R0.4 CCSCC[C@H](C)O Amb33323733 [0,1,0,0,0,0|2,0,1]=4 2000 B7R0.4 CCSCC[N+](=O)[O-] Amb27838043 [0,1,0,0,0,0|2,0,1]=4 2001 B7R0.4 CCSSCC(C)=O Amb28316151 [0,1,0,0,0,0|3,0,0]=4 2002 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [0,1,0,0,0,0|1,0,1]=3 2003 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [0,1,0,0,0,0|2,0,1]=4 2004 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [0,1,0,0,0,0|2,0,1]=4 2005 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [0,1,0,0,0,0|1,0,1]=3 2006 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [0,1,0,0,0,0|2,0,1]=4 2007 B7R0.4 CC\C=C\C[PH](=O)O Amb8391288 [0,1,0,0,0,0|2,0,1]=4 2008 B7R0.4 CN(C)CCCCN Amb2687444 [0,1,0,0,0,0|3,0,0]=4 2009 B7R0.4 CN(C)CCCNN Amb32652854 [0,1,0,0,0,0|3,0,0]=4 2010 B7R0.4 CN(C)CCCNN Amb5722660 [0,1,0,0,0,0|3,0,0]=4 2011 B7R0.4 CN(C)CCCNO Amb33272652 [0,1,0,0,0,0|3,0,0]=4 2012 B7R0.4 CN(C)CCCON Amb17104868 [0,1,0,0,0,0|3,0,0]=4 2013 B7R0.4 CN(C)CCCON Amb35747638 [0,1,0,0,0,0|3,0,0]=4 2014 B7R0.4 CN(C)NCCCN Amb28129327 [0,1,0,0,0,0|3,0,0]=4 2015 B7R0.4 CNCC#CC(=O)O Amb27218273 [0,1,0,0,0,0|0,0,2]=3 2016 B7R0.4 CNCCC=C(Cl)Cl Amb35710754 [0,1,0,0,0,0|2,0,1]=4 2017 B7R0.4 CNCCCC(=O)O Amb1153115 [0,1,0,0,0,0|0,0,0]=1 2018 B7R0.4 CNCCCC(=O)O Amb4521435 [0,1,0,0,0,0|0,0,0]=1 2019 B7R0.4 CNCCCC(C)=O Amb27838406 [0,1,0,0,0,0|1,0,0]=2 2020 B7R0.4 CNCCCC(C)C Amb32757651 [0,1,0,0,0,0|2,0,1]=4 2021 B7R0.4 CNCCCC(C)C Amb8853654 [0,1,0,0,0,0|2,0,1]=4 2022 B7R0.4 CNCCCC(C)O Amb17569899 [0,1,0,0,0,0|1,0,1]=3 2023 B7R0.4 CNCCCC(N)=O Amb18303611 [0,1,0,0,0,0|1,0,0]=2 2024 B7R0.4 CNCCCC(N)=O Amb31307731 [0,1,0,0,0,0|1,0,0]=2 2025 B7R0.4 CNCCCN(C)C Amb3939356 [0,1,0,0,0,0|3,0,0]=4 2026 B7R0.4 CNCCCS(C)=O Amb27827686 [0,1,0,0,0,0|2,0,0]=3 2027 B7R0.4 CNCCC[C@@H](C)O Amb27784601 [0,1,0,0,0,0|1,0,1]=3 2028 B7R0.4 CNCCNC(=S)S Amb28397261 [0,1,0,0,0,0|1,2,0]=4 2029 B7R0.4 CNCCNC(C)=O Amb28934797 [0,1,0,0,0,0|2,0,0]=3 2030 B7R0.4 CNCCNC(C)=O Amb9256137 [0,1,0,0,0,0|2,0,0]=3 2031 B7R0.4 CNCCNC(N)=O Amb18299975 [0,1,0,0,0,0|2,0,0]=3 2032 B7R0.4 CNCCNS(C)=O Amb28286115 [0,1,0,0,0,0|3,0,0]=4 2033 B7R0.4 CNCCOC(C)=O Amb18124262 [0,1,0,0,0,0|2,0,0]=3 2034 B7R0.4 CNCCOC(C)=O Amb33621071 [0,1,0,0,0,0|2,0,0]=3 2035 B7R0.4 CNCCOC(N)=O Amb25136928 [0,1,0,0,0,0|2,0,0]=3 2036 B7R0.4 CNCCOC(N)=O Amb32693459 [0,1,0,0,0,0|2,0,0]=3 2037 B7R0.4 CNCCSC(=N)N Amb23590673 [0,1,0,0,0,0|3,0,0]=4 2038 B7R0.4 CNC\C=C\C(=O)O Amb25368293 [0,1,0,0,0,0|0,0,2]=3 2039 B7R0.4 COCC#CC(=O)O Amb33544473 [0,1,0,0,0,0|1,0,2]=4 2040 B7R0.4 COCCCB(O)O Amb27754195 [0,1,0,0,0,0|2,0,1]=4 2041 B7R0.4 COCCCC(=N)N Amb19269156 [0,1,0,0,0,0|3,0,0]=4 2042 B7R0.4 COCCCC(=N)N Amb6266770 [0,1,0,0,0,0|3,0,0]=4 2043 B7R0.4 COCCCC(=O)O Amb6275629 [0,1,0,0,0,0|1,0,0]=2 2044 B7R0.4 COCCCC(C)=O Amb9031556 [0,1,0,0,0,0|2,0,0]=3 2045 B7R0.4 COCCCC(C)O Amb4020863 [0,1,0,0,0,0|2,0,1]=4 2046 B7R0.4 COCCCC(N)=S Amb6270649 [0,1,0,0,0,0|2,1,0]=4 2047 B7R0.4 COCCCN(C)O Amb33377831 [0,1,0,0,0,0|3,0,0]=4 2048 B7R0.4 COCCCS(=O)Cl Amb26013061 [0,1,0,0,0,0|3,0,0]=4 2049 B7R0.4 COCCCS(=O)[O-] Amb27974844 [0,1,0,0,0,0|2,0,1]=4 2050 B7R0.4 COCCCS(N)=O Amb32720360 [0,1,0,0,0,0|3,0,0]=4 2051 B7R0.4 COCCC[C@@H](C)O Amb33428680 [0,1,0,0,0,0|2,0,1]=4 2052 B7R0.4 COCCC[C@H](C)O Amb27396064 [0,1,0,0,0,0|2,0,1]=4 2053 B7R0.4 COCCC[N+](=O)[O-] Amb33428678 [0,1,0,0,0,0|2,0,1]=4 2054 B7R0.4 COCCNC(C)=O Amb3358082 [0,1,0,0,0,0|3,0,0]=4 2055 B7R0.4 COCCNC(N)=O Amb1104938 [0,1,0,0,0,0|3,0,0]=4 2056 B7R0.4 COCCOC(=O)Cl Amb2689125 [0,1,0,0,0,0|3,0,0]=4 2057 B7R0.4 COCCOC(C)=O Amb4037074 [0,1,0,0,0,0|3,0,0]=4 2058 B7R0.4 COCCOC(N)=O Amb25054225 [0,1,0,0,0,0|3,0,0]=4 2059 B7R0.4 COCOCC(=O)O Amb28059312 [0,1,0,0,0,0|2,0,0]=3 2060 B7R0.4 COCSCC(=O)O Amb27466837 [0,1,0,0,0,0|2,0,0]=3 2061 B7R0.4 COC\C=C\C(=O)O Amb33986212 [0,1,0,0,0,0|1,0,2]=4 2062 B7R0.4 CP(O)OCCCCl Amb28254545 [0,1,0,0,0,0|3,0,0]=4 2063 B7R0.4 CS(=O)CCCC#N Amb26007802 [0,1,0,0,0,0|2,0,1]=4 2064 B7R0.4 CS(=O)CCCCBr Amb27874454 [0,1,0,0,0,0|3,0,0]=4 2065 B7R0.4 CS(=O)CCCCCl Amb27253421 [0,1,0,0,0,0|3,0,0]=4 2066 B7R0.4 CS(=O)CCCCN Amb17617794 [0,1,0,0,0,0|2,0,0]=3 2067 B7R0.4 CS(=O)CCCON Amb28324081 [0,1,0,0,0,0|2,0,0]=3 2068 B7R0.4 CS(=O)NCCCCl Amb27265745 [0,1,0,0,0,0|3,0,0]=4 2069 B7R0.4 CSCCCC(=N)N Amb27829199 [0,1,0,0,0,0|3,0,0]=4 2070 B7R0.4 CSCCCC(=O)O Amb17503622 [0,1,0,0,0,0|1,0,0]=2 2071 B7R0.4 CSCCCC(C)=O Amb25122381 [0,1,0,0,0,0|2,0,0]=3 2072 B7R0.4 CSCCCC(C)O Amb25958947 [0,1,0,0,0,0|2,0,1]=4 2073 B7R0.4 CSCCCC(N)=S Amb28048945 [0,1,0,0,0,0|2,1,0]=4 2074 B7R0.4 CSCCCN(C)O Amb33198763 [0,1,0,0,0,0|3,0,0]=4 2075 B7R0.4 CSCCC[C@@H](C)O Amb33198286 [0,1,0,0,0,0|2,0,1]=4 2076 B7R0.4 CSCCC[C@H](C)O Amb33198288 [0,1,0,0,0,0|2,0,1]=4 2077 B7R0.4 CSCCC[N+](=O)[O-] Amb33200220 [0,1,0,0,0,0|2,0,1]=4 2078 B7R0.4 CSCCNC(=O)Cl Amb29882959 [0,1,0,0,0,0|3,0,0]=4 2079 B7R0.4 CSCCNC(C)=O Amb8504699 [0,1,0,0,0,0|3,0,0]=4 2080 B7R0.4 CSCCNC(N)=O Amb27424586 [0,1,0,0,0,0|3,0,0]=4 2081 B7R0.4 CSCCSC(C)=O Amb27635033 [0,1,0,0,0,0|3,0,0]=4 2082 B7R0.4 CSCSCC(=O)O Amb27858824 [0,1,0,0,0,0|2,0,0]=3 2083 B7R0.4 CSSCCC(=O)O Amb26848465 [0,1,0,0,0,0|2,0,0]=3 2084 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [0,1,0,0,0,0|1,0,2]=4 2085 B7R0.4 C[C@@H](O)CCCCBr Amb28343132 [0,1,0,0,0,0|2,0,1]=4 2086 B7R0.4 C[C@@H](O)CCCCCl Amb8517538 [0,1,0,0,0,0|2,0,1]=4 2087 B7R0.4 C[C@@H](O)CCCCF Amb33196128 [0,1,0,0,0,0|2,0,1]=4 2088 B7R0.4 C[C@@H](O)CCCCN Amb27789987 [0,1,0,0,0,0|1,0,1]=3 2089 B7R0.4 C[C@@H](O)CNCCF Amb27486911 [0,1,0,0,0,0|2,0,1]=4 2090 B7R0.4 C[C@H](O)CCCC#N Amb27979195 [0,1,0,0,0,0|1,0,2]=4 2091 B7R0.4 C[C@H](O)CCCCF Amb33196129 [0,1,0,0,0,0|2,0,1]=4 2092 B7R0.4 C[C@H](O)CCCCO Amb28381637 [0,1,0,0,0,0|2,0,1]=4 2093 B7R0.4 C\C(Br)=C\CCCBr Amb22347606 [0,1,0,0,0,0|3,0,0]=4 2094 B7R0.4 C\C(Cl)=C\CCCO Amb27211291 [0,1,0,0,0,0|3,0,0]=4 2095 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [0,1,0,0,0,0|1,0,1]=3 2096 B7R0.4 C\C=C\CCC(C)=O Amb9031579 [0,1,0,0,0,0|2,0,1]=4 2097 B7R0.4 ClCCCC=C(Cl)Cl Amb28284505 [0,1,0,0,0,0|3,0,0]=4 2098 B7R0.4 N#CCCCC(=O)O Amb33542831 [0,1,0,0,0,0|0,0,1]=2 2099 B7R0.4 N#CCCCS(=O)Cl Amb32720313 [0,1,0,0,0,0|2,0,1]=4 2100 B7R0.4 N#CCCCS(=O)[O-] Amb32753961 [0,1,0,0,0,0|1,0,2]=4 2101 B7R0.4 N#CCCCS(N)=O Amb32720314 [0,1,0,0,0,0|2,0,1]=4 2102 B7R0.4 N#CCCC[N+](=O)[O-] Amb27437950 [0,1,0,0,0,0|1,0,2]=4 2103 B7R0.4 N#CCSCC(=O)O Amb6243720 [0,1,0,0,0,0|0,0,2]=3 2104 B7R0.4 N#CNCCC(=O)O Amb30031691 [0,1,0,0,0,0|0,0,2]=3 2105 B7R0.4 N#CNOCC(=O)O Amb35634483 [0,1,0,0,0,0|1,0,2]=4 2106 B7R0.4 N=C(N)CCCCBr Amb4297024 [0,1,0,0,0,0|3,0,0]=4 2107 B7R0.4 N=C(N)CCCCCl Amb4297063 [0,1,0,0,0,0|3,0,0]=4 2108 B7R0.4 N=C(N)CCCCF Amb27486600 [0,1,0,0,0,0|3,0,0]=4 2109 B7R0.4 N=C(N)CCCCN Amb25714813 [0,1,0,0,0,0|2,0,0]=3 2110 B7R0.4 N=C(N)CCCCN Amb33299438 [0,1,0,0,0,0|2,0,0]=3 2111 B7R0.4 N=C(N)SCCCBr Amb27970087 [0,1,0,0,0,0|3,0,0]=4 2112 B7R0.4 NC(=O)CCCCBr Amb27875083 [0,1,0,0,0,0|2,0,0]=3 2113 B7R0.4 NC(=O)CCCCCl Amb7782532 [0,1,0,0,0,0|2,0,0]=3 2114 B7R0.4 NC(=O)CCCCO Amb3939470 [0,1,0,0,0,0|2,0,0]=3 2115 B7R0.4 NC(=O)CCCCS Amb27839239 [0,1,0,0,0,0|2,0,0]=3 2116 B7R0.4 NC(=O)CCSCCl Amb27430706 [0,1,0,0,0,0|2,0,0]=3 2117 B7R0.4 NC(=O)CC\C=C\Cl Amb25173831 [0,1,0,0,0,0|2,0,1]=4 2118 B7R0.4 NC(=O)CNCCO Amb6714605 [0,1,0,0,0,0|2,0,0]=3 2119 B7R0.4 NC(=O)COCCBr Amb25133475 [0,1,0,0,0,0|2,0,0]=3 2120 B7R0.4 NC(=O)COCCCl Amb5722397 [0,1,0,0,0,0|2,0,0]=3 2121 B7R0.4 NC(=O)CSCCBr Amb28193514 [0,1,0,0,0,0|2,0,0]=3 2122 B7R0.4 NC(=O)CSCCO Amb6754148 [0,1,0,0,0,0|2,0,0]=3 2123 B7R0.4 NC(=O)CSCCS Amb27651871 [0,1,0,0,0,0|2,0,0]=3 2124 B7R0.4 NC(=O)NCCCF Amb27396406 [0,1,0,0,0,0|2,0,0]=3 2125 B7R0.4 NC(=O)NCCCO Amb9248133 [0,1,0,0,0,0|2,0,0]=3 2126 B7R0.4 NC(=O)NCCN=O Amb27796959 [0,1,0,0,0,0|2,0,1]=4 2127 B7R0.4 NC(=O)OCCCBr Amb28316236 [0,1,0,0,0,0|2,0,0]=3 2128 B7R0.4 NC(=S)CCCCBr Amb27622634 [0,1,0,0,0,0|2,1,0]=4 2129 B7R0.4 NC(=S)CCCCCl Amb25177620 [0,1,0,0,0,0|2,1,0]=4 2130 B7R0.4 NCC#CCC(=O)O Amb27976019 [0,1,0,0,0,0|0,0,1]=2 2131 B7R0.4 NCCC#CC(=O)O Amb32656225 [0,1,0,0,0,0|0,0,1]=2 2132 B7R0.4 NCCCC=C(Cl)Cl Amb27400339 [0,1,0,0,0,0|2,0,0]=3 2133 B7R0.4 NCCCCB(O)O Amb27436221 [0,1,0,0,0,0|1,0,1]=3 2134 B7R0.4 NCCCCC(=O)Cl Amb26599615 [0,1,0,0,0,0|1,0,0]=2 2135 B7R0.4 NCCCCC(=O)O Amb2780021 [0,1,0,0,0,0|0,0,0]=1 2136 B7R0.4 NCCCCC(=O)O Amb3941646 [0,1,0,0,0,0|0,0,0]=1 2137 B7R0.4 NCCCCC(=O)O Amb9825855 [0,1,0,0,0,0|0,0,0]=1 2138 B7R0.4 NCCCCC(F)F Amb32812804 [0,1,0,0,0,0|2,0,1]=4 2139 B7R0.4 NCCCCC(N)=O Amb18641897 [0,1,0,0,0,0|1,0,0]=2 2140 B7R0.4 NCCCCC(N)=O Amb33552086 [0,1,0,0,0,0|1,0,0]=2 2141 B7R0.4 NCCCCS(=O)O Amb27882127 [0,1,0,0,0,0|1,0,0]=2 2142 B7R0.4 NCCCNC(=O)O Amb24093884 [0,1,0,0,0,0|0,0,0]=1 2143 B7R0.4 NCCCNC(=O)S Amb27839485 [0,1,0,0,0,0|0,1,0]=2 2144 B7R0.4 NCCCNC(=S)S Amb27772303 [0,1,0,0,0,0|0,2,0]=3 2145 B7R0.4 NCCCNC(N)=O Amb18296186 [0,1,0,0,0,0|1,0,0]=2 2146 B7R0.4 NCCCNC(N)=O Amb20622408 [0,1,0,0,0,0|1,0,0]=2 2147 B7R0.4 NCCCOC(F)F Amb26485921 [0,1,0,0,0,0|2,0,1]=4 2148 B7R0.4 NCCCOC(N)=O Amb26334419 [0,1,0,0,0,0|1,0,0]=2 2149 B7R0.4 NCCCOC(N)=O Amb33299259 [0,1,0,0,0,0|1,0,0]=2 2150 B7R0.4 NCCCOS(=O)O Amb26007874 [0,1,0,0,0,0|1,0,0]=2 2151 B7R0.4 NCCNCC(=O)O Amb17608063 [0,1,0,0,0,0|0,0,0]=1 2152 B7R0.4 NCCNCC(=O)O Amb33339058 [0,1,0,0,0,0|0,0,0]=1 2153 B7R0.4 NCCNCC(F)F Amb26016081 [0,1,0,0,0,0|2,0,1]=4 2154 B7R0.4 NCCNCC(F)F Amb33038217 [0,1,0,0,0,0|2,0,1]=4 2155 B7R0.4 NCCNCC(N)=O Amb28388338 [0,1,0,0,0,0|1,0,0]=2 2156 B7R0.4 NCCOCC(=O)O Amb18630146 [0,1,0,0,0,0|0,0,0]=1 2157 B7R0.4 NCCOCC(=O)O Amb33550947 [0,1,0,0,0,0|0,0,0]=1 2158 B7R0.4 NCCOCC(F)F Amb33329374 [0,1,0,0,0,0|2,0,1]=4 2159 B7R0.4 NCCOCC(N)=O Amb18523830 [0,1,0,0,0,0|1,0,0]=2 2160 B7R0.4 NCCOCC(N)=O Amb33549549 [0,1,0,0,0,0|1,0,0]=2 2161 B7R0.4 NCCSCC(=O)O Amb17500446 [0,1,0,0,0,0|0,0,0]=1 2162 B7R0.4 NCCSCC(=O)O Amb20622325 [0,1,0,0,0,0|0,0,0]=1 2163 B7R0.4 NCCSCC(F)F Amb19373690 [0,1,0,0,0,0|2,0,1]=4 2164 B7R0.4 NCCSCC(N)=O Amb6266329 [0,1,0,0,0,0|1,0,0]=2 2165 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [0,1,0,0,0,0|0,0,1]=2 2166 B7R0.4 NOCCCC(=O)O Amb10975956 [0,1,0,0,0,0|0,0,0]=1 2167 B7R0.4 NOCCCC(=O)O Amb22011795 [0,1,0,0,0,0|0,0,0]=1 2168 B7R0.4 NOCCCC(=O)O Amb31283653 [0,1,0,0,0,0|0,0,0]=1 2169 B7R0.4 NS(=O)CCCCCl Amb32720307 [0,1,0,0,0,0|3,0,0]=4 2170 B7R0.4 NS(=O)CCCCF Amb32720393 [0,1,0,0,0,0|3,0,0]=4 2171 B7R0.4 O=C(Cl)CCCCBr Amb2685557 [0,1,0,0,0,0|2,0,0]=3 2172 B7R0.4 O=C(Cl)CCCCCl Amb6296596 [0,1,0,0,0,0|2,0,0]=3 2173 B7R0.4 O=C(Cl)COCCCl Amb17610887 [0,1,0,0,0,0|2,0,0]=3 2174 B7R0.4 O=C(Cl)NCCCCl Amb27856097 [0,1,0,0,0,0|2,0,0]=3 2175 B7R0.4 O=C(Cl)NCCCF Amb35633310 [0,1,0,0,0,0|2,0,0]=3 2176 B7R0.4 O=C(Cl)OCCCCl Amb10844795 [0,1,0,0,0,0|2,0,0]=3 2177 B7R0.4 O=C(Cl)OCCCF Amb26994902 [0,1,0,0,0,0|2,0,0]=3 2178 B7R0.4 O=C(Cl)\C=C\CCCl Amb27413542 [0,1,0,0,0,0|2,0,1]=4 2179 B7R0.4 O=C(O)C#CCCO Amb25844914 [0,1,0,0,0,0|1,0,1]=3 2180 B7R0.4 O=C(O)CCCCBr Amb6608763 [0,1,0,0,0,0|1,0,0]=2 2181 B7R0.4 O=C(O)CCCCCl Amb3940369 [0,1,0,0,0,0|1,0,0]=2 2182 B7R0.4 O=C(O)CCCCF Amb26639920 [0,1,0,0,0,0|1,0,0]=2 2183 B7R0.4 O=C(O)CCCCO Amb9214971 [0,1,0,0,0,0|1,0,0]=2 2184 B7R0.4 O=C(O)CCCCS Amb17503767 [0,1,0,0,0,0|1,0,0]=2 2185 B7R0.4 O=C(O)CCCNCl Amb27173950 [0,1,0,0,0,0|0,0,0]=1 2186 B7R0.4 O=C(O)CCN=C=S Amb24562253 [0,1,0,0,0,0|1,0,1]=3 2187 B7R0.4 O=C(O)CC\C=C\Br Amb25238247 [0,1,0,0,0,0|1,0,1]=3 2188 B7R0.4 O=C(O)CC\C=N\O Amb27211579 [0,1,0,0,0,0|0,0,2]=3 2189 B7R0.4 O=C(O)CNCCF Amb28076282 [0,1,0,0,0,0|1,0,0]=2 2190 B7R0.4 O=C(O)CNCCO Amb9325653 [0,1,0,0,0,0|1,0,0]=2 2191 B7R0.4 O=C(O)COCCCl Amb21857870 [0,1,0,0,0,0|1,0,0]=2 2192 B7R0.4 O=C(O)COCCF Amb27866609 [0,1,0,0,0,0|1,0,0]=2 2193 B7R0.4 O=C(O)COCCO Amb6680914 [0,1,0,0,0,0|1,0,0]=2 2194 B7R0.4 O=C(O)CSCCCl Amb18644703 [0,1,0,0,0,0|1,0,0]=2 2195 B7R0.4 O=C(O)CSSCCl Amb27983630 [0,1,0,0,0,0|2,0,0]=3 2196 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [0,1,0,0,0,0|1,0,1]=3 2197 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [0,1,0,0,0,0|1,0,1]=3 2198 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [0,1,0,0,0,0|1,0,1]=3 2199 B7R0.4 O=C(O)\C=C\CCBr Amb25702661 [0,1,0,0,0,0|1,0,1]=3 2200 B7R0.4 O=C(O)\C=C\CCF Amb33196445 [0,1,0,0,0,0|1,0,1]=3 2201 B7R0.4 O=C([O-])CCCCF Amb33527827 [0,1,0,0,0,0|1,0,1]=3 2202 B7R0.4 O=C([O-])CCCCO Amb13952763 [0,1,0,0,0,0|1,0,1]=3 2203 B7R0.4 O=C([O-])CCCCO Amb22749314 [0,1,0,0,0,0|1,0,1]=3 2204 B7R0.4 O=C([O-])COCCO Amb33553026 [0,1,0,0,0,0|1,0,1]=3 2205 B7R0.4 O=C=NCCC(=O)Cl Amb17593404 [0,1,0,0,0,0|2,0,1]=4 2206 B7R0.4 O=C=NCCC(=O)O Amb26053417 [0,1,0,0,0,0|1,0,1]=3 2207 B7R0.4 O=CCCCC(=O)O Amb17593198 [0,1,0,0,0,0|1,0,0]=2 2208 B7R0.4 O=CCCCC(O)O Amb25889261 [0,1,0,0,0,0|1,0,2]=4 2209 B7R0.4 O=CNCCC(=O)O Amb18290434 [0,1,0,0,0,0|1,0,1]=3 2210 B7R0.4 O=CNOCC(=O)O Amb27477273 [0,1,0,0,0,0|2,0,1]=4 2211 B7R0.4 O=NSCCC(=O)O Amb28429846 [0,1,0,0,0,0|1,0,1]=3 2212 B7R0.4 O=S(Cl)CCCCCl Amb32720306 [0,1,0,0,0,0|3,0,0]=4 2213 B7R0.4 O=S(Cl)CCCCF Amb32720392 [0,1,0,0,0,0|3,0,0]=4 2214 B7R0.4 O=S(Cl)OCCCF Amb34916628 [0,1,0,0,0,0|3,0,0]=4 2215 B7R0.4 O=S([O-])CCCCCl Amb28400114 [0,1,0,0,0,0|2,0,1]=4 2216 B7R0.4 O=S([O-])CCCCF Amb32754733 [0,1,0,0,0,0|2,0,1]=4 2217 B7R0.4 O=S([O-])CCCCO Amb27181023 [0,1,0,0,0,0|2,0,1]=4 2218 B7R0.4 O=[N+]([O-])CCCCF Amb33171716 [0,1,0,0,0,0|2,0,1]=4 2219 B7R0.4 O=[N+]([O-])CCCCO Amb25739830 [0,1,0,0,0,0|2,0,1]=4 2220 B7R0.4 O=[N+]([O-])OCCCBr Amb21953589 [0,1,0,0,0,0|2,0,1]=4 2221 B7R0.4 OB(O)CCCCBr Amb20171450 [0,1,0,0,0,0|2,0,1]=4 2222 B7R0.4 OC(Cl)CCCCCl Amb27410884 [0,1,0,0,0,0|2,0,1]=4 2223 B7R0.4 OC(O)CCCSS Amb27978339 [0,1,0,0,0,0|1,0,2]=4 2224 B7R0.4 OCCCC=C(F)F Amb28287397 [0,1,0,0,0,0|3,0,0]=4 2225 B7R0.4 OCCCCB(O)O Amb25351122 [0,1,0,0,0,0|2,0,1]=4 2226 B7R0.4 OCCCOB(O)O Amb27491736 [0,1,0,0,0,0|2,0,1]=4 2227 B7R0.4 [N-]=[N+]=NCCC(=O)Cl Amb27831534 [0,1,0,0,0,0|2,0,1]=4 2228 B7R0.4 [N-]=[N+]=NCCC(=O)O Amb20622326 [0,1,0,0,0,0|1,0,1]=3 2229 B7R0.5 C#CCC(=O)C(=O)O Amb27601316 [0,1,0,0,0,0|1,0,2]=4 2230 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [0,1,0,0,0,0|1,0,1]=3 2231 B7R0.5 C#CCC(C)C(C)=O Amb27465169 [0,1,0,0,0,0|2,0,1]=4 2232 B7R0.5 C#CCC(F)C(C)=O Amb28249962 [0,1,0,0,0,0|2,0,1]=4 2233 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [0,1,0,0,0,0|1,0,1]=3 2234 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [0,1,0,0,0,0|1,0,1]=3 2235 B7R0.5 C#CCC(N)C(C)=O Amb27228190 [0,1,0,0,0,0|2,0,1]=4 2236 B7R0.5 C#CCC(N)C(N)=O Amb22059485 [0,1,0,0,0,0|2,0,1]=4 2237 B7R0.5 C#CCC(N)C(N)=O Amb33543329 [0,1,0,0,0,0|2,0,1]=4 2238 B7R0.5 C#CCC(N)[PH](=O)O Amb27838345 [0,1,0,0,0,0|2,0,1]=4 2239 B7R0.5 C#CCC(O)C(=O)O Amb27154881 [0,1,0,0,0,0|1,0,1]=3 2240 B7R0.5 C#CCC(O)C(C)=O Amb27442415 [0,1,0,0,0,0|2,0,1]=4 2241 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [0,1,0,0,0,0|1,0,1]=3 2242 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [0,1,0,0,0,0|1,0,1]=3 2243 B7R0.5 C#CC[C@@H](N)C(N)=O Amb27473309 [0,1,0,0,0,0|2,0,1]=4 2244 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [0,1,0,0,0,0|1,0,1]=3 2245 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [0,1,0,0,0,0|1,0,1]=3 2246 B7R0.5 C#CC[C@H](N)C(N)=O Amb28345609 [0,1,0,0,0,0|2,0,1]=4 2247 B7R0.5 C=C(C)C(=C)CCN Amb33199210 [0,1,0,0,0,0|2,0,1]=4 2248 B7R0.5 C=C(C)C(=O)CCN Amb25694471 [0,1,0,0,0,0|2,0,1]=4 2249 B7R0.5 C=C(C)C(C)CCN Amb33199933 [0,1,0,0,0,0|2,0,0]=3 2250 B7R0.5 C=C(C)C(C)CCO Amb27766618 [0,1,0,0,0,0|3,0,0]=4 2251 B7R0.5 C=C(C)C(C)CON Amb33199600 [0,1,0,0,0,0|3,0,0]=4 2252 B7R0.5 C=C(C)C(Cl)CCC Amb28121399 [0,1,0,0,0,0|3,0,0]=4 2253 B7R0.5 C=C(C)C(F)CCN Amb28401279 [0,1,0,0,0,0|2,0,0]=3 2254 B7R0.5 C=C(C)C(N)CCO Amb27391185 [0,1,0,0,0,0|3,0,0]=4 2255 B7R0.5 C=C(C)C(O)CCN Amb25929797 [0,1,0,0,0,0|2,0,0]=3 2256 B7R0.5 C=C(C)[C@@H](O)CCN Amb33199602 [0,1,0,0,0,0|2,0,0]=3 2257 B7R0.5 C=C(C)[C@H](O)CCN Amb33199603 [0,1,0,0,0,0|2,0,0]=3 2258 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [0,1,0,0,0,0|1,0,1]=3 2259 B7R0.5 C=C(CCF)C(=O)O Amb33480692 [0,1,0,0,0,0|1,0,1]=3 2260 B7R0.5 C=C(CCN)C(=O)O Amb27267272 [0,1,0,0,0,0|0,0,1]=2 2261 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [0,1,0,0,0,0|1,0,1]=3 2262 B7R0.5 C=C(COC)C(=O)O Amb26978134 [0,1,0,0,0,0|2,0,1]=4 2263 B7R0.5 C=C(CSC)C(=O)O Amb26953041 [0,1,0,0,0,0|2,0,1]=4 2264 B7R0.5 C=C(F)C(O)CCC Amb27833609 [0,1,0,0,0,0|3,0,0]=4 2265 B7R0.5 C=CCC(=C)C(=O)O Amb18641687 [0,1,0,0,0,0|1,0,2]=4 2266 B7R0.5 C=CCC(=O)C(=O)O Amb25890017 [0,1,0,0,0,0|1,0,2]=4 2267 B7R0.5 C=CCC(Br)C(C)=O Amb27760403 [0,1,0,0,0,0|2,0,1]=4 2268 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [0,1,0,0,0,0|1,0,1]=3 2269 B7R0.5 C=CCC(C)C(C)=O Amb19373098 [0,1,0,0,0,0|2,0,1]=4 2270 B7R0.5 C=CCC(C)C(N)=O Amb27788519 [0,1,0,0,0,0|2,0,1]=4 2271 B7R0.5 C=CCC(Cl)C(=O)Cl Amb27463323 [0,1,0,0,0,0|2,0,1]=4 2272 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [0,1,0,0,0,0|1,0,1]=3 2273 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [0,1,0,0,0,0|1,0,1]=3 2274 B7R0.5 C=CCC(F)C(C)=O Amb19889753 [0,1,0,0,0,0|2,0,1]=4 2275 B7R0.5 C=CCC(N)C(=O)Cl Amb27413912 [0,1,0,0,0,0|2,0,1]=4 2276 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [0,1,0,0,0,0|1,0,1]=3 2277 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [0,1,0,0,0,0|1,0,1]=3 2278 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [0,1,0,0,0,0|2,0,1]=4 2279 B7R0.5 C=CCC(N)C(N)=O Amb26585896 [0,1,0,0,0,0|2,0,1]=4 2280 B7R0.5 C=CCC(O)C(C)=O Amb26451431 [0,1,0,0,0,0|2,0,1]=4 2281 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [0,1,0,0,0,0|1,0,1]=3 2282 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [0,1,0,0,0,0|1,0,1]=3 2283 B7R0.5 C=CC[C@@H](N)C(N)=O Amb27838370 [0,1,0,0,0,0|2,0,1]=4 2284 B7R0.5 C=CC[C@H](C)C(C)=O Amb26641913 [0,1,0,0,0,0|2,0,1]=4 2285 B7R0.5 C=CC[C@H](N)C(=O)Cl Amb28120452 [0,1,0,0,0,0|2,0,1]=4 2286 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [0,1,0,0,0,0|1,0,1]=3 2287 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [0,1,0,0,0,0|1,0,1]=3 2288 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [0,1,0,0,0,0|1,0,2]=4 2289 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [0,1,0,0,0,0|1,0,2]=4 2290 B7R0.5 CC(=O)C(=O)CCCl Amb28077243 [0,1,0,0,0,0|2,0,1]=4 2291 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [0,1,0,0,0,0|2,0,1]=4 2292 B7R0.5 CC(=O)C(Br)CCBr Amb26442822 [0,1,0,0,0,0|2,0,0]=3 2293 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [0,1,0,0,0,0|2,0,0]=3 2294 B7R0.5 CC(=O)C(C)CC#N Amb27403110 [0,1,0,0,0,0|1,0,2]=4 2295 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [0,1,0,0,0,0|2,0,0]=3 2296 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [0,1,0,0,0,0|2,0,0]=3 2297 B7R0.5 CC(=O)C(C)CCO Amb13881368 [0,1,0,0,0,0|2,0,0]=3 2298 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [0,1,0,0,0,0|2,0,1]=4 2299 B7R0.5 CC(=O)C(Cl)CCBr Amb27259779 [0,1,0,0,0,0|2,0,0]=3 2300 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [0,1,0,0,0,0|2,0,0]=3 2301 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [0,1,0,0,0,0|2,0,0]=3 2302 B7R0.5 CC(=O)C(F)CCBr Amb28429129 [0,1,0,0,0,0|2,0,0]=3 2303 B7R0.5 CC(=O)C(F)CCCl Amb27390864 [0,1,0,0,0,0|2,0,0]=3 2304 B7R0.5 CC(=O)C(N)CCO Amb25087112 [0,1,0,0,0,0|2,0,0]=3 2305 B7R0.5 CC(=O)C(S)CCO Amb25831127 [0,1,0,0,0,0|2,0,0]=3 2306 B7R0.5 CC(=O)N(C)CCBr Amb27592204 [0,1,0,0,0,0|3,0,0]=4 2307 B7R0.5 CC(=O)N(C)CCCl Amb27480683 [0,1,0,0,0,0|3,0,0]=4 2308 B7R0.5 CC(=O)N(C)CCN Amb17046786 [0,1,0,0,0,0|2,0,0]=3 2309 B7R0.5 CC(=O)N(C)CCN Amb34137491 [0,1,0,0,0,0|2,0,0]=3 2310 B7R0.5 CC(=O)N(C)CCO Amb5797447 [0,1,0,0,0,0|3,0,0]=4 2311 B7R0.5 CC(=O)[C@@H](C)CC#N Amb26887655 [0,1,0,0,0,0|1,0,2]=4 2312 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [0,1,0,0,0,0|2,0,0]=3 2313 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [0,1,0,0,0,0|2,0,1]=4 2314 B7R0.5 CC(C)=C(C)CCN Amb26481951 [0,1,0,0,0,0|2,0,1]=4 2315 B7R0.5 CC(C)C(C)CCN Amb18293552 [0,1,0,0,0,0|2,0,1]=4 2316 B7R0.5 CC(C)C(F)CCN Amb25356457 [0,1,0,0,0,0|2,0,1]=4 2317 B7R0.5 CC(C)C(O)CCN Amb17231832 [0,1,0,0,0,0|2,0,1]=4 2318 B7R0.5 CC(C)[C@@H](O)CCN Amb24474145 [0,1,0,0,0,0|2,0,1]=4 2319 B7R0.5 CC(C)[C@H](N)CCN Amb29849539 [0,1,0,0,0,0|2,0,1]=4 2320 B7R0.5 CC(C)[C@H](O)CCN Amb26345189 [0,1,0,0,0,0|2,0,1]=4 2321 B7R0.5 CC(C)[C@H](O)CCN Amb30586553 [0,1,0,0,0,0|2,0,1]=4 2322 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [0,1,0,0,0,0|0,0,2]=3 2323 B7R0.5 CC(CC#N)C(N)=O Amb8944748 [0,1,0,0,0,0|1,0,2]=4 2324 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [0,1,0,0,0,0|1,0,1]=3 2325 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [0,1,0,0,0,0|2,0,0]=3 2326 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [0,1,0,0,0,0|1,0,0]=2 2327 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [0,1,0,0,0,0|2,0,0]=3 2328 B7R0.5 CC(CCF)C(=O)O Amb24678386 [0,1,0,0,0,0|1,0,0]=2 2329 B7R0.5 CC(CCN)=C(Br)Br Amb27484892 [0,1,0,0,0,0|2,0,1]=4 2330 B7R0.5 CC(CCN)B(O)O Amb27592499 [0,1,0,0,0,0|1,0,1]=3 2331 B7R0.5 CC(CCN)C(=O)O Amb20667970 [0,1,0,0,0,0|0,0,0]=1 2332 B7R0.5 CC(CCN)C(=O)O Amb538221 [0,1,0,0,0,0|0,0,0]=1 2333 B7R0.5 CC(CCN)C(F)F Amb26449237 [0,1,0,0,0,0|2,0,1]=4 2334 B7R0.5 CC(CCN)C(F)F Amb35752891 [0,1,0,0,0,0|2,0,1]=4 2335 B7R0.5 CC(CCN)N(C)C Amb8428165 [0,1,0,0,0,0|3,0,0]=4 2336 B7R0.5 CC(CCN)S(C)=O Amb20668090 [0,1,0,0,0,0|2,0,0]=3 2337 B7R0.5 CC(CCO)C(=O)O Amb18641949 [0,1,0,0,0,0|1,0,0]=2 2338 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [0,1,0,0,0,0|1,0,1]=3 2339 B7R0.5 CC(CCO)C(N)=O Amb28280962 [0,1,0,0,0,0|2,0,0]=3 2340 B7R0.5 CC(CCO)S(=O)[O-] Amb28315550 [0,1,0,0,0,0|2,0,1]=4 2341 B7R0.5 CC(CNO)C(=O)O Amb28315956 [0,1,0,0,0,0|2,0,0]=3 2342 B7R0.5 CC(CSS)C(=O)O Amb27437183 [0,1,0,0,0,0|2,0,0]=3 2343 B7R0.5 CC(F)C(C)CCN Amb28435428 [0,1,0,0,0,0|2,0,1]=4 2344 B7R0.5 CC(N=C=O)C(=O)O Amb33471295 [0,1,0,0,0,0|2,0,1]=4 2345 B7R0.5 CC(N=C=S)C(=O)O Amb25945785 [0,1,0,0,0,0|2,0,1]=4 2346 B7R0.5 CC(N=[N+]=[N-])C(=O)O Amb27202649 [0,1,0,0,0,0|2,0,1]=4 2347 B7R0.5 CC(NC=O)C(=O)O Amb1144629 [0,1,0,0,0,0|2,0,1]=4 2348 B7R0.5 CC(NCO)C(=O)O Amb27468253 [0,1,0,0,0,0|2,0,0]=3 2349 B7R0.5 CC(O)C(C)CCBr Amb27878805 [0,1,0,0,0,0|2,0,1]=4 2350 B7R0.5 CC(O)C(C)CCF Amb28120971 [0,1,0,0,0,0|2,0,1]=4 2351 B7R0.5 CC(O)C(C)CCN Amb18202662 [0,1,0,0,0,0|1,0,1]=3 2352 B7R0.5 CC(O)C(Cl)CCCl Amb28195866 [0,1,0,0,0,0|2,0,1]=4 2353 B7R0.5 CC(OC=O)C(=O)O Amb27872094 [0,1,0,0,0,0|2,0,1]=4 2354 B7R0.5 CC(\N=N\O)C(=O)O Amb28251041 [0,1,0,0,0,0|3,0,0]=4 2355 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [0,1,0,0,0,0|1,0,1]=3 2356 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [0,1,0,0,0,0|2,0,1]=4 2357 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [0,1,0,0,0,0|2,0,0]=3 2358 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [0,1,0,0,0,0|1,0,0]=2 2359 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [0,1,0,0,0,0|2,0,0]=3 2360 B7R0.5 CCCC(Br)S(C)=O Amb27471989 [0,1,0,0,0,0|3,0,0]=4 2361 B7R0.5 CCCC(C)C(=N)N Amb27810844 [0,1,0,0,0,0|3,0,0]=4 2362 B7R0.5 CCCC(C)C(=N)N Amb33212650 [0,1,0,0,0,0|3,0,0]=4 2363 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [0,1,0,0,0,0|2,0,0]=3 2364 B7R0.5 CCCC(C)C(=O)O Amb3938958 [0,1,0,0,0,0|1,0,0]=2 2365 B7R0.5 CCCC(C)C(C)=O Amb4034597 [0,1,0,0,0,0|2,0,0]=3 2366 B7R0.5 CCCC(C)C(C)O Amb4036337 [0,1,0,0,0,0|2,0,1]=4 2367 B7R0.5 CCCC(C)C(N)=O Amb3886535 [0,1,0,0,0,0|2,0,0]=3 2368 B7R0.5 CCCC(C)C(N)=S Amb25138492 [0,1,0,0,0,0|2,1,0]=4 2369 B7R0.5 CCCC(C)S(=O)Cl Amb32720536 [0,1,0,0,0,0|3,0,0]=4 2370 B7R0.5 CCCC(C)S(=O)[O-] Amb32754802 [0,1,0,0,0,0|2,0,1]=4 2371 B7R0.5 CCCC(C)S(N)=O Amb32720511 [0,1,0,0,0,0|3,0,0]=4 2372 B7R0.5 CCCC(C)[C@@H](C)O Amb33322347 [0,1,0,0,0,0|2,0,1]=4 2373 B7R0.5 CCCC(C)[C@H](C)O Amb33322346 [0,1,0,0,0,0|2,0,1]=4 2374 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [0,1,0,0,0,0|1,0,0]=2 2375 B7R0.5 CCCC(F)C(=O)O Amb25842008 [0,1,0,0,0,0|1,0,0]=2 2376 B7R0.5 CCCC(F)C(C)=O Amb28316211 [0,1,0,0,0,0|2,0,0]=3 2377 B7R0.5 CCCC(F)C(N)=O Amb28127390 [0,1,0,0,0,0|2,0,0]=3 2378 B7R0.5 CCCC(N)C(=N)N Amb27222841 [0,1,0,0,0,0|3,0,0]=4 2379 B7R0.5 CCCC(N)C(=O)O Amb6262055 [0,1,0,0,0,0|1,0,0]=2 2380 B7R0.5 CCCC(N)C(C)=O Amb27838289 [0,1,0,0,0,0|2,0,0]=3 2381 B7R0.5 CCCC(N)C(N)=O Amb22284825 [0,1,0,0,0,0|2,0,0]=3 2382 B7R0.5 CCCC(N)C(N)=O Amb9514970 [0,1,0,0,0,0|2,0,0]=3 2383 B7R0.5 CCCC(N)C(N)=S Amb28121515 [0,1,0,0,0,0|2,1,0]=4 2384 B7R0.5 CCCC(O)C(=N)N Amb27881736 [0,1,0,0,0,0|3,0,0]=4 2385 B7R0.5 CCCC(O)C(=O)O Amb2818222 [0,1,0,0,0,0|1,0,0]=2 2386 B7R0.5 CCCC(O)C(C)=O Amb22495823 [0,1,0,0,0,0|2,0,0]=3 2387 B7R0.5 CCCC(O)C(N)=O Amb24116553 [0,1,0,0,0,0|2,0,0]=3 2388 B7R0.5 CCCC(S)C(=O)O Amb18124440 [0,1,0,0,0,0|1,0,0]=2 2389 B7R0.5 CCCN(C)C(=O)Cl Amb26478280 [0,1,0,0,0,0|3,0,0]=4 2390 B7R0.5 CCCN(C)C(N)=O Amb8898960 [0,1,0,0,0,0|3,0,0]=4 2391 B7R0.5 CCCN(N)C(C)=O Amb18641903 [0,1,0,0,0,0|3,0,0]=4 2392 B7R0.5 CCCN(O)C(N)=O Amb28347092 [0,1,0,0,0,0|3,0,0]=4 2393 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [0,1,0,0,0,0|1,0,0]=2 2394 B7R0.5 CCC[C@@H](C)C(C)O Amb28187641 [0,1,0,0,0,0|2,0,1]=4 2395 B7R0.5 CCC[C@@H](C)[C@@H](C)O Amb27181050 [0,1,0,0,0,0|2,0,1]=4 2396 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [0,1,0,0,0,0|1,0,0]=2 2397 B7R0.5 CCC[C@@H](Cl)[C@H](C)O Amb27668868 [0,1,0,0,0,0|2,0,1]=4 2398 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [0,1,0,0,0,0|1,0,0]=2 2399 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [0,1,0,0,0,0|2,0,0]=3 2400 B7R0.5 CCC[C@@H](N)C(C)O Amb29849610 [0,1,0,0,0,0|2,0,1]=4 2401 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [0,1,0,0,0,0|2,0,0]=3 2402 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [0,1,0,0,0,0|2,0,0]=3 2403 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [0,1,0,0,0,0|1,0,0]=2 2404 B7R0.5 CCC[C@@H](O)[C@@H](C)O Amb27457775 [0,1,0,0,0,0|2,0,1]=4 2405 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [0,1,0,0,0,0|1,0,0]=2 2406 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [0,1,0,0,0,0|1,0,0]=2 2407 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [0,1,0,0,0,0|2,0,0]=3 2408 B7R0.5 CCC[C@H](C)[C@H](C)O Amb28065150 [0,1,0,0,0,0|2,0,1]=4 2409 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [0,1,0,0,0,0|1,0,0]=2 2410 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [0,1,0,0,0,0|1,0,0]=2 2411 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [0,1,0,0,0,0|1,0,0]=2 2412 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [0,1,0,0,0,0|2,0,0]=3 2413 B7R0.5 CCC[C@H](N)C(C)O Amb35664016 [0,1,0,0,0,0|2,0,1]=4 2414 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [0,1,0,0,0,0|2,0,0]=3 2415 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [0,1,0,0,0,0|2,0,0]=3 2416 B7R0.5 CCC[C@H](N)[C@H](C)O Amb27883481 [0,1,0,0,0,0|2,0,1]=4 2417 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [0,1,0,0,0,0|1,0,0]=2 2418 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [0,1,0,0,0,0|2,0,0]=3 2419 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [0,1,0,0,0,0|1,0,0]=2 2420 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [0,1,0,0,0,0|2,0,1]=4 2421 B7R0.5 CCNC(C)C(=O)O Amb33527634 [0,1,0,0,0,0|2,0,0]=3 2422 B7R0.5 CCNC(C)C(=O)O Amb9326962 [0,1,0,0,0,0|2,0,0]=3 2423 B7R0.5 CCNC(C)C(N)=O Amb21959648 [0,1,0,0,0,0|3,0,0]=4 2424 B7R0.5 CCNC(C)C(N)=O Amb7758139 [0,1,0,0,0,0|3,0,0]=4 2425 B7R0.5 CCNC(O)C(=O)O Amb27259098 [0,1,0,0,0,0|2,0,0]=3 2426 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [0,1,0,0,0,0|2,0,0]=3 2427 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [0,1,0,0,0,0|2,0,0]=3 2428 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [0,1,0,0,0,0|2,0,1]=4 2429 B7R0.5 CCOC(C)C(=O)O Amb9725271 [0,1,0,0,0,0|2,0,0]=3 2430 B7R0.5 CCOC(C)C(C)=O Amb9666103 [0,1,0,0,0,0|3,0,0]=4 2431 B7R0.5 CCOC(C)C(N)=O Amb19960053 [0,1,0,0,0,0|3,0,0]=4 2432 B7R0.5 CCOC(Cl)C(=O)Cl Amb27659279 [0,1,0,0,0,0|3,0,0]=4 2433 B7R0.5 CCOC(Cl)C(N)=O Amb27468650 [0,1,0,0,0,0|3,0,0]=4 2434 B7R0.5 CCOC(F)C(=O)O Amb27210743 [0,1,0,0,0,0|2,0,0]=3 2435 B7R0.5 CCSC(=O)C(=O)O Amb28410577 [0,1,0,0,0,0|2,0,1]=4 2436 B7R0.5 CCSC(C)C(=O)O Amb9721554 [0,1,0,0,0,0|2,0,0]=3 2437 B7R0.5 CCSC(C)C(N)=O Amb27830179 [0,1,0,0,0,0|3,0,0]=4 2438 B7R0.5 CCSC(Cl)C(C)=O Amb27862346 [0,1,0,0,0,0|3,0,0]=4 2439 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [0,1,0,0,0,0|1,0,2]=4 2440 B7R0.5 CC\C=C(/F)C(=O)O Amb27968785 [0,1,0,0,0,0|1,0,2]=4 2441 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [0,1,0,0,0,0|1,0,2]=4 2442 B7R0.5 CN(CCBr)C(=O)Cl Amb33296909 [0,1,0,0,0,0|3,0,0]=4 2443 B7R0.5 CN(CCCl)C(=O)Cl Amb25285023 [0,1,0,0,0,0|3,0,0]=4 2444 B7R0.5 CN(CCN)C(N)=O Amb18953297 [0,1,0,0,0,0|2,0,0]=3 2445 B7R0.5 CN(CCN)S(C)=O Amb27778010 [0,1,0,0,0,0|3,0,0]=4 2446 B7R0.5 CNCC(C)C(=O)O Amb13952364 [0,1,0,0,0,0|2,0,0]=3 2447 B7R0.5 CNCC(C)C(=O)O Amb9400281 [0,1,0,0,0,0|2,0,0]=3 2448 B7R0.5 CNCC(C)C(N)=O Amb8943991 [0,1,0,0,0,0|3,0,0]=4 2449 B7R0.5 CNCC(N)C(=O)O Amb10845350 [0,1,0,0,0,0|2,0,0]=3 2450 B7R0.5 CNCC(O)C(=O)O Amb26894610 [0,1,0,0,0,0|2,0,0]=3 2451 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [0,1,0,0,0,0|2,0,0]=3 2452 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [0,1,0,0,0,0|2,0,0]=3 2453 B7R0.5 COCC(Br)C(=O)Cl Amb27797270 [0,1,0,0,0,0|3,0,0]=4 2454 B7R0.5 COCC(Br)C(=O)O Amb17594709 [0,1,0,0,0,0|2,0,0]=3 2455 B7R0.5 COCC(C)C(=O)O Amb33545090 [0,1,0,0,0,0|2,0,0]=3 2456 B7R0.5 COCC(C)C(C)=O Amb24683449 [0,1,0,0,0,0|3,0,0]=4 2457 B7R0.5 COCC(C)C(N)=O Amb27401584 [0,1,0,0,0,0|3,0,0]=4 2458 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [0,1,0,0,0,0|2,0,0]=3 2459 B7R0.5 COCC(N)C(=O)O Amb33551350 [0,1,0,0,0,0|2,0,0]=3 2460 B7R0.5 COCC(N)C(=O)O Amb6752055 [0,1,0,0,0,0|2,0,0]=3 2461 B7R0.5 COCC(N)C(C)=O Amb27468401 [0,1,0,0,0,0|3,0,0]=4 2462 B7R0.5 COCC(N)C(N)=O Amb18984372 [0,1,0,0,0,0|3,0,0]=4 2463 B7R0.5 COCC(N)C(N)=O Amb32693410 [0,1,0,0,0,0|3,0,0]=4 2464 B7R0.5 COCC(O)C(=O)O Amb18124273 [0,1,0,0,0,0|2,0,0]=3 2465 B7R0.5 COCC(O)C(N)=O Amb28069186 [0,1,0,0,0,0|3,0,0]=4 2466 B7R0.5 COCC(S)C(=O)O Amb27763656 [0,1,0,0,0,0|2,0,0]=3 2467 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [0,1,0,0,0,0|2,0,0]=3 2468 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [0,1,0,0,0,0|2,0,0]=3 2469 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [0,1,0,0,0,0|2,0,0]=3 2470 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [0,1,0,0,0,0|2,0,0]=3 2471 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [0,1,0,0,0,0|2,0,0]=3 2472 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [0,1,0,0,0,0|2,0,0]=3 2473 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [0,1,0,0,0,0|2,0,0]=3 2474 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [0,1,0,0,0,0|3,0,0]=4 2475 B7R0.5 CSCC(C)C(=O)O Amb18967825 [0,1,0,0,0,0|2,0,0]=3 2476 B7R0.5 CSCC(Cl)C(=O)Cl Amb27801927 [0,1,0,0,0,0|3,0,0]=4 2477 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [0,1,0,0,0,0|2,0,0]=3 2478 B7R0.5 CSCC(N)C(=O)O Amb33804791 [0,1,0,0,0,0|2,0,0]=3 2479 B7R0.5 CSCC(N)C(=O)O Amb6280829 [0,1,0,0,0,0|2,0,0]=3 2480 B7R0.5 CSCC(O)C(=O)O Amb25131873 [0,1,0,0,0,0|2,0,0]=3 2481 B7R0.5 CSCC(O)C(C)=O Amb25983211 [0,1,0,0,0,0|3,0,0]=4 2482 B7R0.5 CSCC(O)C(N)=O Amb27168145 [0,1,0,0,0,0|3,0,0]=4 2483 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [0,1,0,0,0,0|2,0,0]=3 2484 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [0,1,0,0,0,0|2,0,0]=3 2485 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [0,1,0,0,0,0|2,0,0]=3 2486 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [0,1,0,0,0,0|3,0,0]=4 2487 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [0,1,0,0,0,0|1,0,0]=2 2488 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [0,1,0,0,0,0|0,0,0]=1 2489 B7R0.5 C[C@@H](N=C=O)C(=O)O Amb33189209 [0,1,0,0,0,0|2,0,1]=4 2490 B7R0.5 C[C@@H](N=C=S)C(=O)O Amb33471579 [0,1,0,0,0,0|2,0,1]=4 2491 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O Amb28325865 [0,1,0,0,0,0|2,0,1]=4 2492 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O Amb32620194 [0,1,0,0,0,0|2,0,1]=4 2493 B7R0.5 C[C@@H](NC#N)C(=O)O Amb35634494 [0,1,0,0,0,0|1,0,2]=4 2494 B7R0.5 C[C@@H](O)[C@H](Cl)CCCl Amb27173783 [0,1,0,0,0,0|2,0,1]=4 2495 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [0,1,0,0,0,0|1,0,0]=2 2496 B7R0.5 C[C@H](N=C=O)C(=O)O Amb33471333 [0,1,0,0,0,0|2,0,1]=4 2497 B7R0.5 C[C@H](N=C=S)C(=O)O Amb33471562 [0,1,0,0,0,0|2,0,1]=4 2498 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O Amb32620189 [0,1,0,0,0,0|2,0,1]=4 2499 B7R0.5 C[C@H](NC#N)C(=O)O Amb30031667 [0,1,0,0,0,0|1,0,2]=4 2500 B7R0.5 C[C@H](NC=O)C(=O)O Amb28323701 [0,1,0,0,0,0|2,0,1]=4 2501 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [0,1,0,0,0,0|2,0,0]=3 2502 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [0,1,0,0,0,0|2,0,0]=3 2503 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [0,1,0,0,0,0|2,0,0]=3 2504 B7R0.5 C\C(=C/CCl)C(=O)O Amb25844891 [0,1,0,0,0,0|1,0,2]=4 2505 B7R0.5 C\C(=C/CN)C(=O)O Amb25845292 [0,1,0,0,0,0|0,0,2]=3 2506 B7R0.5 C\C(=C/CN)C(N)=O Amb30030310 [0,1,0,0,0,0|1,0,2]=4 2507 B7R0.5 C\C(=C/CS)C(=O)O Amb28041309 [0,1,0,0,0,0|1,0,2]=4 2508 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [0,1,0,0,0,0|1,0,2]=4 2509 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [0,1,0,0,0,0|1,0,2]=4 2510 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [0,1,0,0,0,0|1,0,2]=4 2511 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [0,1,0,0,0,0|1,0,2]=4 2512 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [0,1,0,0,0,0|1,0,2]=4 2513 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [0,1,0,0,0,0|0,0,2]=3 2514 B7R0.5 N#CCC(N)C(N)=O Amb33308724 [0,1,0,0,0,0|1,0,2]=4 2515 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [0,1,0,0,0,0|0,0,2]=3 2516 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [0,1,0,0,0,0|0,0,2]=3 2517 B7R0.5 NC(=O)C(Br)CCCl Amb27954931 [0,1,0,0,0,0|2,0,0]=3 2518 B7R0.5 NC(=O)C(N)CCF Amb24391278 [0,1,0,0,0,0|2,0,0]=3 2519 B7R0.5 NC(=O)C(N)CCO Amb24481392 [0,1,0,0,0,0|2,0,0]=3 2520 B7R0.5 NC(=O)C(N)CNO Amb27396201 [0,1,0,0,0,0|3,0,0]=4 2521 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [0,1,0,0,0,0|1,0,0]=2 2522 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [0,1,0,0,0,0|1,0,0]=2 2523 B7R0.5 NC(CCF)C(=O)O Amb25889337 [0,1,0,0,0,0|1,0,0]=2 2524 B7R0.5 NC(CCF)C(=O)O Amb28934889 [0,1,0,0,0,0|1,0,0]=2 2525 B7R0.5 NC(CCO)C(=O)O Amb8514287 [0,1,0,0,0,0|1,0,0]=2 2526 B7R0.5 NC(CCS)C(=O)O Amb19267093 [0,1,0,0,0,0|1,0,0]=2 2527 B7R0.5 NC(CCS)C(=O)O Amb3499433 [0,1,0,0,0,0|1,0,0]=2 2528 B7R0.5 NC(CCS)[PH](=O)O Amb27409002 [0,1,0,0,0,0|2,0,0]=3 2529 B7R0.5 NC(CNO)C(=O)O Amb4092732 [0,1,0,0,0,0|2,0,0]=3 2530 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [0,1,0,0,0,0|2,0,0]=3 2531 B7R0.5 NC(\C=C\F)C(=O)O Amb27666430 [0,1,0,0,0,0|1,0,2]=4 2532 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [0,1,0,0,0,0|0,0,0]=1 2533 B7R0.5 NCCC(F)C(=O)O Amb10838221 [0,1,0,0,0,0|0,0,0]=1 2534 B7R0.5 NCCC(F)C(=O)O Amb22229524 [0,1,0,0,0,0|0,0,0]=1 2535 B7R0.5 NCCC(F)C(F)F Amb25043201 [0,1,0,0,0,0|2,0,1]=4 2536 B7R0.5 NCCC(F)[PH](=O)O Amb27639139 [0,1,0,0,0,0|1,0,0]=2 2537 B7R0.5 NCCC(N)C(=O)O Amb2697841 [0,1,0,0,0,0|0,0,0]=1 2538 B7R0.5 NCCC(N)C(=O)O Amb8514694 [0,1,0,0,0,0|0,0,0]=1 2539 B7R0.5 NCCC(N)C(F)F Amb24377545 [0,1,0,0,0,0|2,0,1]=4 2540 B7R0.5 NCCC(O)C(=O)O Amb16232090 [0,1,0,0,0,0|0,0,0]=1 2541 B7R0.5 NCCC(O)C(F)F Amb25135624 [0,1,0,0,0,0|2,0,1]=4 2542 B7R0.5 NCCC(O)C(N)=O Amb28121985 [0,1,0,0,0,0|1,0,0]=2 2543 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [0,1,0,0,0,0|0,0,0]=1 2544 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [0,1,0,0,0,0|0,0,0]=1 2545 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [0,1,0,0,0,0|0,0,0]=1 2546 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [0,1,0,0,0,0|0,0,0]=1 2547 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [0,1,0,0,0,0|1,0,0]=2 2548 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [0,1,0,0,0,0|0,0,0]=1 2549 B7R0.5 NCC[C@@H](O)C(F)F Amb33485341 [0,1,0,0,0,0|2,0,1]=4 2550 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [0,1,0,0,0,0|0,0,0]=1 2551 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [0,1,0,0,0,0|0,0,0]=1 2552 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [0,1,0,0,0,0|0,0,0]=1 2553 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [0,1,0,0,0,0|0,0,0]=1 2554 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [0,1,0,0,0,0|0,0,0]=1 2555 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [0,1,0,0,0,0|0,0,0]=1 2556 B7R0.5 NCC[C@H](O)C(F)F Amb33337782 [0,1,0,0,0,0|2,0,1]=4 2557 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [0,1,0,0,0,0|1,0,0]=2 2558 B7R0.5 NC\C=C(/F)C(=O)O Amb33802627 [0,1,0,0,0,0|0,0,2]=3 2559 B7R0.5 NC\C=C(\F)C(=O)O Amb28340962 [0,1,0,0,0,0|0,0,2]=3 2560 B7R0.5 NNCC(O)C(=O)[O-] Amb27956514 [0,1,0,0,0,0|1,0,1]=3 2561 B7R0.5 NOCC(N)C(=O)O Amb24184086 [0,1,0,0,0,0|1,0,0]=2 2562 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [0,1,0,0,0,0|1,0,0]=2 2563 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [0,1,0,0,0,0|1,0,0]=2 2564 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [0,1,0,0,0,0|1,0,0]=2 2565 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [0,1,0,0,0,0|1,0,0]=2 2566 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [0,1,0,0,0,0|1,0,0]=2 2567 B7R0.5 N[C@@H](OCS)C(=O)O Amb27591629 [0,1,0,0,0,0|2,0,0]=3 2568 B7R0.5 N[C@@H](\C=C/F)C(=O)O Amb27447269 [0,1,0,0,0,0|1,0,2]=4 2569 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [0,1,0,0,0,0|1,0,1]=3 2570 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [0,1,0,0,0,0|1,0,0]=2 2571 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [0,1,0,0,0,0|1,0,0]=2 2572 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [0,1,0,0,0,0|1,0,0]=2 2573 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [0,1,0,0,0,0|2,0,0]=3 2574 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [0,1,0,0,0,0|2,0,0]=3 2575 B7R0.5 O=C(Cl)C(Br)CCCl Amb26515711 [0,1,0,0,0,0|2,0,0]=3 2576 B7R0.5 O=C(Cl)C(Cl)CSCl Amb28138021 [0,1,0,0,0,0|3,0,0]=4 2577 B7R0.5 O=C(O)C(=O)CCF Amb33377241 [0,1,0,0,0,0|1,0,1]=3 2578 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [0,1,0,0,0,0|1,0,1]=3 2579 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [0,1,0,0,0,0|1,0,0]=2 2580 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [0,1,0,0,0,0|1,0,0]=2 2581 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [0,1,0,0,0,0|1,0,0]=2 2582 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [0,1,0,0,0,0|1,0,0]=2 2583 B7R0.5 O=C(O)C(O)CCF Amb28071189 [0,1,0,0,0,0|1,0,0]=2 2584 B7R0.5 O=C(O)C(O)CCO Amb24689942 [0,1,0,0,0,0|1,0,0]=2 2585 B7R0.5 O=C(O)C(O)CNO Amb27405525 [0,1,0,0,0,0|2,0,0]=3 2586 B7R0.5 O=C(O)C(S)CCS Amb27634893 [0,1,0,0,0,0|1,0,0]=2 2587 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [0,1,0,0,0,0|1,0,0]=2 2588 B7R0.5 O=C(O)\C(Br)=C\CO Amb28291530 [0,1,0,0,0,0|1,0,2]=4 2589 B7R0.5 O=C(O)\C(Cl)=C\CBr Amb27875077 [0,1,0,0,0,0|1,0,2]=4 2590 B7R0.5 O=CCC(=O)C(=O)O Amb26326260 [0,1,0,0,0,0|1,0,2]=4 2591 B7R0.5 OCC\C(Br)=C(/O)Br Amb27967773 [0,1,0,0,0,0|2,0,1]=4 2592 B7R0.5 [NH3+]CCC([NH3+])C(=O)[O-] Amb33513240 [0,1,0,0,0,0|0,0,2]=3 2593 B7R0.6 C=C(Br)CCC(=O)O Amb18648212 [0,1,0,0,0,0|1,0,1]=3 2594 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [0,1,0,0,0,0|1,0,1]=3 2595 B7R0.6 C=C(C)CCC(C)=O Amb9024770 [0,1,0,0,0,0|2,0,1]=4 2596 B7R0.6 C=C(C)CCC(C)Br Amb27878705 [0,1,0,0,0,0|3,0,0]=4 2597 B7R0.6 C=C(C)CCC(C)N Amb18641752 [0,1,0,0,0,0|2,0,0]=3 2598 B7R0.6 C=C(C)CCC(C)O Amb24062974 [0,1,0,0,0,0|3,0,0]=4 2599 B7R0.6 C=C(C)CCC(N)=O Amb27838318 [0,1,0,0,0,0|2,0,1]=4 2600 B7R0.6 C=C(C)CC[C@@H](C)N Amb33199549 [0,1,0,0,0,0|2,0,0]=3 2601 B7R0.6 C=C(C)CC[C@@H](C)O Amb22896943 [0,1,0,0,0,0|3,0,0]=4 2602 B7R0.6 C=C(C)CC[C@H](C)N Amb33199548 [0,1,0,0,0,0|2,0,0]=3 2603 B7R0.6 C=C(C)CC[C@H](C)O Amb26446405 [0,1,0,0,0,0|3,0,0]=4 2604 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [0,1,0,0,0,0|2,0,1]=4 2605 B7R0.6 C=C(Cl)CCC(=O)O Amb18642971 [0,1,0,0,0,0|1,0,1]=3 2606 B7R0.6 C=C(Cl)CCC(C)=O Amb28316194 [0,1,0,0,0,0|2,0,1]=4 2607 B7R0.6 C=C(N)CCC(=O)O Amb27629351 [0,1,0,0,0,0|0,0,1]=2 2608 B7R0.6 CC(=O)CCB(O)O Amb25095502 [0,1,0,0,0,0|3,0,0]=4 2609 B7R0.6 CC(=O)CCC(=O)O Amb534169 [0,1,0,0,0,0|1,0,1]=3 2610 B7R0.6 CC(=O)CCC(=S)Cl Amb28049019 [0,1,0,0,0,0|2,0,1]=4 2611 B7R0.6 CC(=O)CCC(C)=O Amb2793010 [0,1,0,0,0,0|2,0,1]=4 2612 B7R0.6 CC(=O)CCC(C)=S Amb27226729 [0,1,0,0,0,0|2,0,1]=4 2613 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [0,1,0,0,0,0|2,0,0]=3 2614 B7R0.6 CC(=O)CCC(C)C Amb4605991 [0,1,0,0,0,0|2,0,0]=3 2615 B7R0.6 CC(=O)CCC(C)O Amb25829594 [0,1,0,0,0,0|2,0,0]=3 2616 B7R0.6 CC(=O)CCC(F)F Amb27413848 [0,1,0,0,0,0|2,0,0]=3 2617 B7R0.6 CC(=O)CCC(N)=O Amb17142854 [0,1,0,0,0,0|1,0,1]=3 2618 B7R0.6 CC(=O)CCC(O)=S Amb27267983 [0,1,0,0,0,0|1,1,1]=4 2619 B7R0.6 CC(=O)CCN(C)C Amb1129203 [0,1,0,0,0,0|3,0,0]=4 2620 B7R0.6 CC(=O)CCN(C)C Amb343601 [0,1,0,0,0,0|3,0,0]=4 2621 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [0,1,0,0,0,0|2,0,0]=3 2622 B7R0.6 CC(=O)CC[N+](=O)[O-] Amb18198961 [0,1,0,0,0,0|3,0,0]=4 2623 B7R0.6 CC(=O)CNC(C)C Amb28126943 [0,1,0,0,0,0|3,0,0]=4 2624 B7R0.6 CC(=O)CNC(C)C Amb32661638 [0,1,0,0,0,0|3,0,0]=4 2625 B7R0.6 CC(=O)COC(C)C Amb9665256 [0,1,0,0,0,0|3,0,0]=4 2626 B7R0.6 CC(=O)COC(F)F Amb27636211 [0,1,0,0,0,0|3,0,0]=4 2627 B7R0.6 CC(=O)CSC(C)C Amb22549127 [0,1,0,0,0,0|3,0,0]=4 2628 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,1,0,0,0,0|2,0,1]=4 2629 B7R0.6 CC(=O)NCC(C)C Amb3364211 [0,1,0,0,0,0|3,0,0]=4 2630 B7R0.6 CC(=O)NCC(C)N Amb18631377 [0,1,0,0,0,0|2,0,0]=3 2631 B7R0.6 CC(=O)NCC(C)O Amb9276316 [0,1,0,0,0,0|3,0,0]=4 2632 B7R0.6 CC(=O)NCC(Cl)Cl Amb27978268 [0,1,0,0,0,0|3,0,0]=4 2633 B7R0.6 CC(=O)NCC(F)F Amb27961410 [0,1,0,0,0,0|3,0,0]=4 2634 B7R0.6 CC(=O)NCC(N)=O Amb17231824 [0,1,0,0,0,0|2,0,1]=4 2635 B7R0.6 CC(=O)NCC(N)=S Amb17231879 [0,1,0,0,0,0|2,0,1]=4 2636 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,1,0,0,0,0|2,0,1]=4 2637 B7R0.6 CC(=O)OCC(C)Br Amb25360690 [0,1,0,0,0,0|3,0,0]=4 2638 B7R0.6 CC(=O)OCC(C)O Amb24056158 [0,1,0,0,0,0|3,0,0]=4 2639 B7R0.6 CC(=O)OCC(F)F Amb10839327 [0,1,0,0,0,0|3,0,0]=4 2640 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [0,1,0,0,0,0|2,0,1]=4 2641 B7R0.6 CC(=O)OCC(N)=S Amb9677330 [0,1,0,0,0,0|2,0,1]=4 2642 B7R0.6 CC(=O)OC[C@H](C)Br Amb27878701 [0,1,0,0,0,0|3,0,0]=4 2643 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [0,1,0,0,0,0|3,0,0]=4 2644 B7R0.6 CC(=O)SCC(C)O Amb27801534 [0,1,0,0,0,0|3,0,0]=4 2645 B7R0.6 CC(=O)SCC(Cl)Cl Amb4012737 [0,1,0,0,0,0|3,0,0]=4 2646 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [0,1,0,0,0,0|2,0,1]=4 2647 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [0,1,0,0,0,0|2,0,1]=4 2648 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [0,1,0,0,0,0|2,0,1]=4 2649 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [0,1,0,0,0,0|1,0,0]=2 2650 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [0,1,0,0,0,0|1,0,2]=4 2651 B7R0.6 CC(C)=CCC(C)N Amb27391176 [0,1,0,0,0,0|2,0,1]=4 2652 B7R0.6 CC(C)C#CC(=O)O Amb33544341 [0,1,0,0,0,0|1,0,2]=4 2653 B7R0.6 CC(C)CCB(O)O Amb13890540 [0,1,0,0,0,0|2,0,1]=4 2654 B7R0.6 CC(C)CCC(=N)N Amb19890005 [0,1,0,0,0,0|3,0,0]=4 2655 B7R0.6 CC(C)CCC(=N)N Amb6266403 [0,1,0,0,0,0|3,0,0]=4 2656 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [0,1,0,0,0,0|2,0,0]=3 2657 B7R0.6 CC(C)CCC(=O)O Amb1153016 [0,1,0,0,0,0|1,0,0]=2 2658 B7R0.6 CC(C)CCC(C)N Amb32405136 [0,1,0,0,0,0|2,0,1]=4 2659 B7R0.6 CC(C)CCC(C)N Amb9703135 [0,1,0,0,0,0|2,0,1]=4 2660 B7R0.6 CC(C)CCC(C)O Amb9748244 [0,1,0,0,0,0|2,0,1]=4 2661 B7R0.6 CC(C)CCC(N)=O Amb8997711 [0,1,0,0,0,0|2,0,0]=3 2662 B7R0.6 CC(C)CCC(N)=S Amb6248593 [0,1,0,0,0,0|2,1,0]=4 2663 B7R0.6 CC(C)CCN(C)O Amb33361677 [0,1,0,0,0,0|3,0,0]=4 2664 B7R0.6 CC(C)CCS(=O)Cl Amb27201771 [0,1,0,0,0,0|3,0,0]=4 2665 B7R0.6 CC(C)CCS(=O)[O-] Amb25914733 [0,1,0,0,0,0|2,0,1]=4 2666 B7R0.6 CC(C)CCS(N)=O Amb32720359 [0,1,0,0,0,0|3,0,0]=4 2667 B7R0.6 CC(C)CC[C@@H](C)N Amb26479301 [0,1,0,0,0,0|2,0,1]=4 2668 B7R0.6 CC(C)CC[C@@H](C)O Amb26500468 [0,1,0,0,0,0|2,0,1]=4 2669 B7R0.6 CC(C)CC[C@H](C)N Amb3941458 [0,1,0,0,0,0|2,0,1]=4 2670 B7R0.6 CC(C)CC[C@H](C)O Amb27768728 [0,1,0,0,0,0|2,0,1]=4 2671 B7R0.6 CC(C)CC[N+](=O)[O-] Amb17672612 [0,1,0,0,0,0|2,0,1]=4 2672 B7R0.6 CC(C)CNC(=O)Cl Amb35637064 [0,1,0,0,0,0|3,0,0]=4 2673 B7R0.6 CC(C)CNC(N)=O Amb1151241 [0,1,0,0,0,0|3,0,0]=4 2674 B7R0.6 CC(C)CNC(O)=S Amb27597328 [0,1,0,0,0,0|2,1,0]=4 2675 B7R0.6 CC(C)COC(=O)Cl Amb3940231 [0,1,0,0,0,0|3,0,0]=4 2676 B7R0.6 CC(C)COC(N)=O Amb4020010 [0,1,0,0,0,0|3,0,0]=4 2677 B7R0.6 CC(C)CON(=O)O Amb33780821 [0,1,0,0,0,0|3,0,0]=4 2678 B7R0.6 CC(C)CO[PH](=O)O Amb27252350 [0,1,0,0,0,0|3,0,0]=4 2679 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [0,1,0,0,0,0|3,0,0]=4 2680 B7R0.6 CC(C)NCC(=O)Cl Amb27441169 [0,1,0,0,0,0|3,0,0]=4 2681 B7R0.6 CC(C)NCC(=O)O Amb2372347 [0,1,0,0,0,0|2,0,0]=3 2682 B7R0.6 CC(C)NCC(=O)O Amb6892753 [0,1,0,0,0,0|2,0,0]=3 2683 B7R0.6 CC(C)NCC(N)=O Amb2370772 [0,1,0,0,0,0|3,0,0]=4 2684 B7R0.6 CC(C)NCC(N)=O Amb399843 [0,1,0,0,0,0|3,0,0]=4 2685 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [0,1,0,0,0,0|3,0,0]=4 2686 B7R0.6 CC(C)OCC(=O)O Amb6275796 [0,1,0,0,0,0|2,0,0]=3 2687 B7R0.6 CC(C)OCC(N)=O Amb26515707 [0,1,0,0,0,0|3,0,0]=4 2688 B7R0.6 CC(C)SCC(=O)O Amb1128460 [0,1,0,0,0,0|2,0,0]=3 2689 B7R0.6 CC(C)\C=C\C(=O)O Amb8517064 [0,1,0,0,0,0|1,0,2]=4 2690 B7R0.6 CC(Cl)C#CC(=O)O Amb28410751 [0,1,0,0,0,0|1,0,2]=4 2691 B7R0.6 CC(Cl)CCB(O)O Amb26366806 [0,1,0,0,0,0|2,0,1]=4 2692 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,1,0,0,0,0|2,0,0]=3 2693 B7R0.6 CC(Cl)CCS(=O)Cl Amb32720414 [0,1,0,0,0,0|3,0,0]=4 2694 B7R0.6 CC(Cl)CCS(=O)[O-] Amb32755731 [0,1,0,0,0,0|2,0,1]=4 2695 B7R0.6 CC(Cl)CCS(N)=O Amb32720415 [0,1,0,0,0,0|3,0,0]=4 2696 B7R0.6 CC(F)CCS(=O)Cl Amb32720694 [0,1,0,0,0,0|3,0,0]=4 2697 B7R0.6 CC(F)CCS(=O)[O-] Amb32754854 [0,1,0,0,0,0|2,0,1]=4 2698 B7R0.6 CC(F)CCS(N)=O Amb32720695 [0,1,0,0,0,0|3,0,0]=4 2699 B7R0.6 CC(I)CCC(=O)O Amb25938596 [0,1,0,0,0,0|1,0,0]=2 2700 B7R0.6 CC(N)C#CC(=O)O Amb27876109 [0,1,0,0,0,0|0,0,2]=3 2701 B7R0.6 CC(N)CC=C(Cl)Cl Amb29870254 [0,1,0,0,0,0|2,0,1]=4 2702 B7R0.6 CC(N)CCC(=O)O Amb17593212 [0,1,0,0,0,0|0,0,0]=1 2703 B7R0.6 CC(N)CCC(=O)O Amb19515603 [0,1,0,0,0,0|0,0,0]=1 2704 B7R0.6 CC(N)CCC(C)N Amb27251969 [0,1,0,0,0,0|2,0,1]=4 2705 B7R0.6 CC(N)CCC(C)O Amb18641930 [0,1,0,0,0,0|1,0,1]=3 2706 B7R0.6 CC(N)CCC(F)F Amb32659595 [0,1,0,0,0,0|2,0,1]=4 2707 B7R0.6 CC(N)CCC(F)F Amb32659596 [0,1,0,0,0,0|2,0,1]=4 2708 B7R0.6 CC(N)CCN(C)C Amb7969829 [0,1,0,0,0,0|3,0,0]=4 2709 B7R0.6 CC(N)CCN(C)C Amb9711596 [0,1,0,0,0,0|3,0,0]=4 2710 B7R0.6 CC(N)CCP(O)O Amb27468069 [0,1,0,0,0,0|1,0,1]=3 2711 B7R0.6 CC(N)CCS(=O)O Amb27839082 [0,1,0,0,0,0|1,0,0]=2 2712 B7R0.6 CC(N)CCS(C)=O Amb19337158 [0,1,0,0,0,0|2,0,0]=3 2713 B7R0.6 CC(N)CCS(C)=O Amb22059582 [0,1,0,0,0,0|2,0,0]=3 2714 B7R0.6 CC(N)CC[N+](=O)[O-] Amb33745572 [0,1,0,0,0,0|1,0,1]=3 2715 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [0,1,0,0,0,0|1,0,0]=2 2716 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,1,0,0,0,0|2,0,0]=3 2717 B7R0.6 CC(N)COC(N)=O Amb29849466 [0,1,0,0,0,0|2,0,0]=3 2718 B7R0.6 CC(N)SCC(=O)O Amb27401691 [0,1,0,0,0,0|1,0,0]=2 2719 B7R0.6 CC(N)\C=C\C(=O)O Amb33804531 [0,1,0,0,0,0|0,0,2]=3 2720 B7R0.6 CC(O)C#CC(=O)O Amb27803065 [0,1,0,0,0,0|1,0,2]=4 2721 B7R0.6 CC(O)CCB(O)O Amb24594819 [0,1,0,0,0,0|2,0,1]=4 2722 B7R0.6 CC(O)CCC(=N)N Amb29849256 [0,1,0,0,0,0|1,0,2]=4 2723 B7R0.6 CC(O)CCC(=O)O Amb18294804 [0,1,0,0,0,0|1,0,0]=2 2724 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [0,1,0,0,0,0|1,0,1]=3 2725 B7R0.6 CC(O)CCC(C)O Amb2688714 [0,1,0,0,0,0|2,0,1]=4 2726 B7R0.6 CC(O)CCC(F)F Amb28252655 [0,1,0,0,0,0|2,0,1]=4 2727 B7R0.6 CC(O)CCC(N)=S Amb28078352 [0,1,0,0,0,0|1,0,2]=4 2728 B7R0.6 CC(O)CCS(=O)[O-] Amb27662317 [0,1,0,0,0,0|2,0,1]=4 2729 B7R0.6 CC(O)COC(N)=O Amb26359577 [0,1,0,0,0,0|3,0,0]=4 2730 B7R0.6 CC(S)CCC(=O)O Amb8471198 [0,1,0,0,0,0|1,0,0]=2 2731 B7R0.6 CC(S)CCC(N)=O Amb28399630 [0,1,0,0,0,0|2,0,0]=3 2732 B7R0.6 CN(C)CCC(=O)Cl Amb26050113 [0,1,0,0,0,0|3,0,0]=4 2733 B7R0.6 CN(C)CCC(=O)Cl Amb32652940 [0,1,0,0,0,0|3,0,0]=4 2734 B7R0.6 CN(C)CCC(=O)O Amb19888182 [0,1,0,0,0,0|2,0,0]=3 2735 B7R0.6 CN(C)CCC(=O)O Amb6633385 [0,1,0,0,0,0|2,0,0]=3 2736 B7R0.6 CN(C)CCC(N)=O Amb17231825 [0,1,0,0,0,0|3,0,0]=4 2737 B7R0.6 CN(C)OCC(=O)O Amb28120004 [0,1,0,0,0,0|3,0,0]=4 2738 B7R0.6 CN(N)CCC(=O)O Amb2698078 [0,1,0,0,0,0|1,0,0]=2 2739 B7R0.6 CN(O)CCC(N)=O Amb27390605 [0,1,0,0,0,0|2,0,1]=4 2740 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [0,1,0,0,0,0|2,0,0]=3 2741 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [0,1,0,0,0,0|3,0,0]=4 2742 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [0,1,0,0,0,0|0,0,0]=1 2743 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [0,1,0,0,0,0|0,0,0]=1 2744 B7R0.6 C[C@@H](N)CCC(F)F Amb32811584 [0,1,0,0,0,0|2,0,1]=4 2745 B7R0.6 C[C@@H](N)CCN(C)C Amb28126846 [0,1,0,0,0,0|3,0,0]=4 2746 B7R0.6 C[C@@H](N)CC[N+](=O)[O-] Amb33731289 [0,1,0,0,0,0|1,0,1]=3 2747 B7R0.6 C[C@@H](O)CCC(F)F Amb33337801 [0,1,0,0,0,0|2,0,1]=4 2748 B7R0.6 C[C@@H](O)CC[C@@H](C)O Amb4166310 [0,1,0,0,0,0|2,0,1]=4 2749 B7R0.6 C[C@@H](O)CNC(N)=O Amb28315793 [0,1,0,0,0,0|3,0,0]=4 2750 B7R0.6 C[C@H](N)C#CC(=O)O Amb27644755 [0,1,0,0,0,0|0,0,2]=3 2751 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [0,1,0,0,0,0|0,0,0]=1 2752 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [0,1,0,0,0,0|0,0,0]=1 2753 B7R0.6 C[C@H](N)CCC(F)F Amb32811585 [0,1,0,0,0,0|2,0,1]=4 2754 B7R0.6 C[C@H](N)CCN(C)C Amb26640371 [0,1,0,0,0,0|3,0,0]=4 2755 B7R0.6 C[C@H](N)CC[C@H](C)N Amb27838291 [0,1,0,0,0,0|2,0,1]=4 2756 B7R0.6 C[C@H](N)CC[N+](=O)[O-] Amb33729333 [0,1,0,0,0,0|1,0,1]=3 2757 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [0,1,0,0,0,0|1,0,0]=2 2758 B7R0.6 C[C@H](O)CCC(F)F Amb33485344 [0,1,0,0,0,0|2,0,1]=4 2759 B7R0.6 C[C@H](O)CC[C@@H](C)O Amb26407371 [0,1,0,0,0,0|2,0,1]=4 2760 B7R0.6 C[C@H](O)CC[C@H](C)O Amb4166315 [0,1,0,0,0,0|2,0,1]=4 2761 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [0,1,0,0,0,0|1,0,0]=2 2762 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [0,1,0,0,0,0|2,0,0]=3 2763 B7R0.6 C[S+](C)CCC(=O)[O-] Amb20247306 [0,1,0,0,0,0|2,0,1]=4 2764 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [0,1,0,0,0,0|1,0,2]=4 2765 B7R0.6 N=C(N)CCC(=N)N Amb2696658 [0,1,0,0,0,0|2,0,1]=4 2766 B7R0.6 N=C(N)CCC(N)=O Amb25680023 [0,1,0,0,0,0|1,0,1]=3 2767 B7R0.6 N=C(N)NCC(=O)O Amb16231404 [0,1,0,0,0,0|1,0,1]=3 2768 B7R0.6 N=C(N)NCC(=O)O Amb2781642 [0,1,0,0,0,0|1,0,1]=3 2769 B7R0.6 N=C(N)SCC(=O)O Amb33544354 [0,1,0,0,0,0|1,0,1]=3 2770 B7R0.6 N=C(N)SCC(N)=O Amb22261500 [0,1,0,0,0,0|2,0,1]=4 2771 B7R0.6 NC(=O)CCC(=O)Cl Amb28240580 [0,1,0,0,0,0|1,0,1]=3 2772 B7R0.6 NC(=O)CCC(=O)O Amb2967294 [0,1,0,0,0,0|0,0,1]=2 2773 B7R0.6 NC(=O)CCC(Cl)Cl Amb32671996 [0,1,0,0,0,0|2,0,0]=3 2774 B7R0.6 NC(=O)CCC(N)=O Amb1353209 [0,1,0,0,0,0|1,0,1]=3 2775 B7R0.6 NC(=O)CCC(O)O Amb27254204 [0,1,0,0,0,0|2,0,0]=3 2776 B7R0.6 NC(=O)CNC(N)=S Amb9212104 [0,1,0,0,0,0|2,0,1]=4 2777 B7R0.6 NC(=O)CO[PH](=O)O Amb27392553 [0,1,0,0,0,0|2,0,1]=4 2778 B7R0.6 NC(=O)CSC(N)=S Amb27642551 [0,1,0,0,0,0|2,0,1]=4 2779 B7R0.6 NC(=O)NCC(=O)O Amb6366364 [0,1,0,0,0,0|1,0,1]=3 2780 B7R0.6 NC(=O)NCC(Cl)Cl Amb27763808 [0,1,0,0,0,0|3,0,0]=4 2781 B7R0.6 NC(=O)NCC(F)F Amb27827918 [0,1,0,0,0,0|3,0,0]=4 2782 B7R0.6 NC(=O)\C=C/C(=O)O Amb2719749 [0,1,0,0,0,0|0,0,3]=4 2783 B7R0.6 NC(=O)\C=C\C(=O)O Amb9277095 [0,1,0,0,0,0|0,0,3]=4 2784 B7R0.6 NC(=O)\N=C\C(=O)O Amb27592464 [0,1,0,0,0,0|1,0,2]=4 2785 B7R0.6 NC(=S)CCC(=O)O Amb18102382 [0,1,0,0,0,0|0,0,1]=2 2786 B7R0.6 NC(=S)NCC(=O)O Amb9786290 [0,1,0,0,0,0|1,0,1]=3 2787 B7R0.6 NC(=[NH2+])NCC(=O)[O-] Amb4244207 [0,1,0,0,0,0|1,0,2]=4 2788 B7R0.6 NS(=O)CC[N+](=O)[O-] Amb32720434 [0,1,0,0,0,0|2,0,1]=4 2789 B7R0.6 O=C(Cl)CCC(=O)Cl Amb3940240 [0,1,0,0,0,0|2,0,1]=4 2790 B7R0.6 O=C(Cl)NCC(F)F Amb35625623 [0,1,0,0,0,0|3,0,0]=4 2791 B7R0.6 O=C(Cl)OCC(Cl)Cl Amb27634817 [0,1,0,0,0,0|3,0,0]=4 2792 B7R0.6 O=C(Cl)OCC(F)F Amb27431456 [0,1,0,0,0,0|3,0,0]=4 2793 B7R0.6 O=C(O)C#CC(F)F Amb24455798 [0,1,0,0,0,0|1,0,2]=4 2794 B7R0.6 O=C(O)CC=C(Cl)Cl Amb17593875 [0,1,0,0,0,0|1,0,2]=4 2795 B7R0.6 O=C(O)CCB(O)O Amb24640288 [0,1,0,0,0,0|2,0,0]=3 2796 B7R0.6 O=C(O)CCC(=O)O Amb22168124 [0,1,0,0,0,0|1,0,1]=3 2797 B7R0.6 O=C(O)CCC(=O)O Amb2792874 [0,1,0,0,0,0|1,0,1]=3 2798 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [0,1,0,0,0,0|1,0,0]=2 2799 B7R0.6 O=C(O)CCC(F)F Amb20623135 [0,1,0,0,0,0|1,0,0]=2 2800 B7R0.6 O=C(O)CCN(F)F Amb28370344 [0,1,0,0,0,0|2,0,0]=3 2801 B7R0.6 O=C(O)CCP(O)O Amb27424479 [0,1,0,0,0,0|2,0,0]=3 2802 B7R0.6 O=C(O)CCS(=O)O Amb27144832 [0,1,0,0,0,0|2,0,0]=3 2803 B7R0.6 O=C(O)CC[N+](=O)[O-] Amb10843224 [0,1,0,0,0,0|2,0,0]=3 2804 B7R0.6 O=C(O)CC[SH](=O)=O Amb27410689 [0,1,0,0,0,0|2,0,0]=3 2805 B7R0.6 O=C(O)CNC(=O)S Amb27424662 [0,1,0,0,0,0|2,0,1]=4 2806 B7R0.6 O=C(O)CN[N+](=O)[O-] Amb26397226 [0,1,0,0,0,0|3,0,0]=4 2807 B7R0.6 O=C(O)COC(=O)Cl Amb27199161 [0,1,0,0,0,0|2,0,1]=4 2808 B7R0.6 O=C(O)COC(F)F Amb26635492 [0,1,0,0,0,0|2,0,0]=3 2809 B7R0.6 O=C(O)CSC(F)F Amb9215372 [0,1,0,0,0,0|2,0,0]=3 2810 B7R0.6 O=C(O)\C=C\C(Cl)Cl Amb26464246 [0,1,0,0,0,0|1,0,2]=4 2811 B7R0.6 O=C(O)\C=C\C(F)F Amb24340205 [0,1,0,0,0,0|1,0,2]=4 2812 B7R0.6 O=C([O-])CCC(=O)[O-] Amb33512742 [0,1,0,0,0,0|1,0,2]=4 2813 B7R0.6 O=C([O-])CCC(=O)[O-] Amb8514379 [0,1,0,0,0,0|1,0,2]=4 2814 B7R0.6 O=C([O-])CSC(F)F Amb33719493 [0,1,0,0,0,0|2,0,1]=4 2815 B7R0.6 O=S([O-])CCC(F)F Amb32755037 [0,1,0,0,0,0|2,0,1]=4 2816 B7R0.6 O=[N+]([O-])CCC(F)F Amb33485345 [0,1,0,0,0,0|2,0,1]=4 2817 B7R0.6 OC(O)CCC(O)O Amb26000162 [0,1,0,0,0,0|1,0,2]=4 2818 B7R0.6 [BH3-]C(=O)NCC(=O)O Amb27478291 [0,1,0,0,0,0|2,0,1]=4 2819 B7R0.8 CC(C)(C)CCCN Amb15701618 [0,1,0,0,0,0|2,0,1]=4 2820 B7R0.8 CC(C)(C)CCCN Amb17078776 [0,1,0,0,0,0|2,0,1]=4 2821 B7R0.8 CC(C)(Cl)CCCN Amb26578819 [0,1,0,0,0,0|2,0,1]=4 2822 B7R0.8 CC(C)(F)CCCN Amb26415060 [0,1,0,0,0,0|2,0,1]=4 2823 B7R0.8 CC(C)(F)CCCN Amb35749565 [0,1,0,0,0,0|2,0,1]=4 2824 B7R0.8 CC(C)(N)CCCN Amb18641912 [0,1,0,0,0,0|2,0,1]=4 2825 B7R0.8 CC(C)(O)CCCF Amb33196444 [0,1,0,0,0,0|2,0,1]=4 2826 B7R0.8 CC(C)(O)CCCN Amb17569908 [0,1,0,0,0,0|1,0,1]=3 2827 B7R0.8 CC(C)(O)CCCO Amb20668492 [0,1,0,0,0,0|2,0,1]=4 2828 B7R0.8 CC(C)(O)CCNN Amb25303050 [0,1,0,0,0,0|2,0,1]=4 2829 B7R0.8 CC(C)(O)CCNN Amb33473718 [0,1,0,0,0,0|2,0,1]=4 2830 B7R0.8 CC(Cl)(Cl)CCCN Amb26516833 [0,1,0,0,0,0|2,0,1]=4 2831 B7R0.8 CC(F)(F)CCCN Amb27838420 [0,1,0,0,0,0|2,0,1]=4 2832 B7R0.8 CC(F)(F)CCCN Amb28934853 [0,1,0,0,0,0|2,0,1]=4 2833 B7R0.8 CCCCC(C)(C)O Amb8513443 [0,1,0,0,0,0|2,0,1]=4 2834 B7R0.8 CCCCP(=O)(Cl)Cl Amb8515452 [0,1,0,0,0,0|3,0,0]=4 2835 B7R0.8 CCCCP(=O)(O)O Amb22053921 [0,1,0,0,0,0|2,0,0]=3 2836 B7R0.8 CCCCS(=O)(=O)Cl Amb3939750 [0,1,0,0,0,0|2,0,1]=4 2837 B7R0.8 CCCCS(=O)(=O)F Amb10610096 [0,1,0,0,0,0|2,0,1]=4 2838 B7R0.8 CCCCS(=O)(=O)O Amb10844727 [0,1,0,0,0,0|2,0,0]=3 2839 B7R0.8 CCCCS(=O)(=O)[O-] Amb8514323 [0,1,0,0,0,0|2,0,1]=4 2840 B7R0.8 CCCCS(=O)(=O)[O-] Amb9871422 [0,1,0,0,0,0|2,0,1]=4 2841 B7R0.8 CCCCS(N)(=O)=O Amb1132715 [0,1,0,0,0,0|2,0,1]=4 2842 B7R0.8 CCCC[Sn](O)(O)Cl Amb19894194 [0,1,0,0,0,0|2,0,1]=4 2843 B7R0.8 CCCNS(=O)(=O)O Amb27430064 [0,1,0,0,0,0|3,0,0]=4 2844 B7R0.8 CCCOP(=O)(O)O Amb27789994 [0,1,0,0,0,0|3,0,0]=4 2845 B7R0.8 CCCOP(C)(=O)O Amb24553958 [0,1,0,0,0,0|3,0,0]=4 2846 B7R0.8 CNCCP(=O)(O)O Amb27751957 [0,1,0,0,0,0|3,0,0]=4 2847 B7R0.8 CNCCS(=O)(=O)O Amb6825625 [0,1,0,0,0,0|3,0,0]=4 2848 B7R0.8 CP(=O)(O)CCC=O Amb27643443 [0,1,0,0,0,0|2,0,1]=4 2849 B7R0.8 CP(=O)(O)CCCN Amb634789 [0,1,0,0,0,0|1,0,0]=2 2850 B7R0.8 CP(=O)(O)NCCO Amb27652858 [0,1,0,0,0,0|3,0,0]=4 2851 B7R0.8 CP(=O)(O)OCCO Amb27397295 [0,1,0,0,0,0|3,0,0]=4 2852 B7R0.8 CP(=O)(O)SCCN Amb27227981 [0,1,0,0,0,0|2,0,0]=3 2853 B7R0.8 CP(C)(=O)CCCCl Amb27947970 [0,1,0,0,0,0|3,0,0]=4 2854 B7R0.8 CP(C)(=O)CCCN Amb24481153 [0,1,0,0,0,0|2,0,0]=3 2855 B7R0.8 CP(C)(=O)CCCN Amb33620909 [0,1,0,0,0,0|2,0,0]=3 2856 B7R0.8 CS(=N)(=O)CCCO Amb35788140 [0,1,0,0,0,0|3,0,0]=4 2857 B7R0.8 CS(=N)(=O)NCCN Amb30012675 [0,1,0,0,0,0|3,0,0]=4 2858 B7R0.8 CS(=O)(=O)CCCBr Amb18320185 [0,1,0,0,0,0|2,0,1]=4 2859 B7R0.8 CS(=O)(=O)CCCCl Amb18034011 [0,1,0,0,0,0|2,0,1]=4 2860 B7R0.8 CS(=O)(=O)CCCI Amb20623053 [0,1,0,0,0,0|2,0,1]=4 2861 B7R0.8 CS(=O)(=O)CCCN Amb10609368 [0,1,0,0,0,0|1,0,1]=3 2862 B7R0.8 CS(=O)(=O)CCCN Amb6718802 [0,1,0,0,0,0|1,0,1]=3 2863 B7R0.8 CS(=O)(=O)CCCO Amb10608209 [0,1,0,0,0,0|2,0,1]=4 2864 B7R0.8 CS(=O)(=O)CCCS Amb25092985 [0,1,0,0,0,0|2,0,1]=4 2865 B7R0.8 CS(=O)(=O)CCC[NH3+] Amb13883038 [0,1,0,0,0,0|1,0,2]=4 2866 B7R0.8 CS(=O)(=O)CCNN Amb19373824 [0,1,0,0,0,0|2,0,1]=4 2867 B7R0.8 CS(=O)(=O)CCNN Amb22058863 [0,1,0,0,0,0|2,0,1]=4 2868 B7R0.8 CS(=O)(=O)CCON Amb22896604 [0,1,0,0,0,0|2,0,1]=4 2869 B7R0.8 CS(=O)(=O)CCON Amb29848096 [0,1,0,0,0,0|2,0,1]=4 2870 B7R0.8 CS(=O)(=O)NCCN Amb10808618 [0,1,0,0,0,0|2,0,1]=4 2871 B7R0.8 CS(=O)(=O)NCCN Amb29844464 [0,1,0,0,0,0|2,0,1]=4 2872 B7R0.8 CS(=O)(=O)NCCN Amb6661016 [0,1,0,0,0,0|2,0,1]=4 2873 B7R0.8 CS(=O)(=O)OCCN Amb18626289 [0,1,0,0,0,0|2,0,1]=4 2874 B7R0.8 CS(=O)(=O)SCCN Amb10070010 [0,1,0,0,0,0|2,0,1]=4 2875 B7R0.8 CS(=O)(=O)SCCN Amb25363362 [0,1,0,0,0,0|2,0,1]=4 2876 B7R0.8 CS(=O)(=S)OCCN Amb24098412 [0,1,0,0,0,0|2,1,0]=4 2877 B7R0.8 CS(C)(=O)=NCCN Amb27954778 [0,1,0,0,0,0|3,0,0]=4 2878 B7R0.8 CS(C)(=O)=NCCN Amb32660951 [0,1,0,0,0,0|3,0,0]=4 2879 B7R0.8 CS(C)(=O)=NCCN Amb32687479 [0,1,0,0,0,0|3,0,0]=4 2880 B7R0.8 C[N+](C)(C)CCCN Amb28398669 [0,1,0,0,0,0|3,0,0]=4 2881 B7R0.8 C[N+](C)(C)CCCN Amb33495120 [0,1,0,0,0,0|3,0,0]=4 2882 B7R0.8 C[Si](C)(C)CCCN Amb33473678 [0,1,0,0,0,0|2,1,0]=4 2883 B7R0.8 C[Si](C)(C)CCCN Amb33473703 [0,1,0,0,0,0|2,1,0]=4 2884 B7R0.8 C[Si](C)(C)CCCN Amb33527717 [0,1,0,0,0,0|2,1,0]=4 2885 B7R0.8 C[Si](C)(F)CCCN Amb19894182 [0,1,0,0,0,0|2,1,0]=4 2886 B7R0.8 C[Si](C)(O)CCCN Amb27831951 [0,1,0,0,0,0|1,1,0]=3 2887 B7R0.8 NCCCC(Cl)(Cl)Cl Amb27595637 [0,1,0,0,0,0|2,0,1]=4 2888 B7R0.8 NCCCC(F)(F)Cl Amb35699085 [0,1,0,0,0,0|2,0,1]=4 2889 B7R0.8 NCCCC(F)(F)F Amb10606651 [0,1,0,0,0,0|2,0,1]=4 2890 B7R0.8 NCCCC(F)(F)F Amb10839708 [0,1,0,0,0,0|2,0,1]=4 2891 B7R0.8 NCCCC(N)(F)F Amb27204279 [0,1,0,0,0,0|2,0,1]=4 2892 B7R0.8 NCCCP(=O)(O)O Amb2714831 [0,1,0,0,0,0|1,0,0]=2 2893 B7R0.8 NCCCS(=O)(=O)F Amb33456377 [0,1,0,0,0,0|1,0,1]=3 2894 B7R0.8 NCCCS(=O)(=O)F Amb33463754 [0,1,0,0,0,0|1,0,1]=3 2895 B7R0.8 NCCCS(=O)(=O)O Amb3940464 [0,1,0,0,0,0|1,0,0]=2 2896 B7R0.8 NCCCS(=O)(=O)S Amb28436886 [0,1,0,0,0,0|1,0,1]=3 2897 B7R0.8 NCCCS(=O)(=O)[O-] Amb22002055 [0,1,0,0,0,0|1,0,1]=3 2898 B7R0.8 NCCCS(N)(=O)=O Amb10609522 [0,1,0,0,0,0|1,0,1]=3 2899 B7R0.8 NCCCS(N)(=O)=O Amb10609652 [0,1,0,0,0,0|1,0,1]=3 2900 B7R0.8 NCCC[Si](Cl)(Cl)Cl Amb26930071 [0,1,0,0,0,0|2,1,0]=4 2901 B7R0.8 NCCC[Si](O)(O)O Amb19894212 [0,1,0,0,0,0|0,1,1]=3 2902 B7R0.8 NCCNS(N)(=O)=O Amb33804488 [0,1,0,0,0,0|2,0,1]=4 2903 B7R0.8 NCCNS(N)(=O)=O Amb6262067 [0,1,0,0,0,0|2,0,1]=4 2904 B7R0.8 NCCOP(=O)(O)O Amb3941645 [0,1,0,0,0,0|2,0,0]=3 2905 B7R0.8 NCCOS(=O)(=O)O Amb8513052 [0,1,0,0,0,0|2,0,0]=3 2906 B7R0.8 NCCOS(N)(=O)=O Amb27762604 [0,1,0,0,0,0|2,0,1]=4 2907 B7R0.8 NCCO[P-](=O)(=O)O Amb27394652 [0,1,0,0,0,0|2,0,0]=3 2908 B7R0.8 NCCSS(=O)(=O)O Amb534608 [0,1,0,0,0,0|2,0,0]=3 2909 B7R0.8 NCCSS(=O)(=O)[O-] Amb597735 [0,1,0,0,0,0|2,0,1]=4 2910 B7R0.8 NNCCS(N)(=O)=O Amb7780241 [0,1,0,0,0,0|2,0,1]=4 2911 B7R0.8 NNCOP(=O)(O)O Amb27666230 [0,1,0,0,0,0|3,0,0]=4 2912 B7R0.8 NOCCS(=O)(=O)F Amb33463822 [0,1,0,0,0,0|2,0,1]=4 2913 B7R0.8 NS(=O)(=O)CCCBr Amb19374293 [0,1,0,0,0,0|2,0,1]=4 2914 B7R0.8 NS(=O)(=O)CCCCl Amb9518876 [0,1,0,0,0,0|2,0,1]=4 2915 B7R0.8 NS(=O)(=O)CCCF Amb19148047 [0,1,0,0,0,0|2,0,1]=4 2916 B7R0.8 NS(=O)(=O)CCCO Amb27867209 [0,1,0,0,0,0|2,0,1]=4 2917 B7R0.8 O=P(O)(O)CCCCl Amb22388825 [0,1,0,0,0,0|2,0,0]=3 2918 B7R0.8 O=P(O)(O)CCCO Amb28207371 [0,1,0,0,0,0|2,0,0]=3 2919 B7R0.8 O=P(O)(O)OCCO Amb26068184 [0,1,0,0,0,0|3,0,0]=4 2920 B7R0.8 O=S(=O)(Br)CCCBr Amb27982877 [0,1,0,0,0,0|2,0,1]=4 2921 B7R0.8 O=S(=O)(Cl)CCCBr Amb19338138 [0,1,0,0,0,0|2,0,1]=4 2922 B7R0.8 O=S(=O)(Cl)CCCCl Amb3939749 [0,1,0,0,0,0|2,0,1]=4 2923 B7R0.8 O=S(=O)(Cl)CCCF Amb19374916 [0,1,0,0,0,0|2,0,1]=4 2924 B7R0.8 O=S(=O)(Cl)CCCO Amb20667916 [0,1,0,0,0,0|2,0,1]=4 2925 B7R0.8 O=S(=O)(F)CCCBr Amb32716936 [0,1,0,0,0,0|2,0,1]=4 2926 B7R0.8 O=S(=O)(F)CCCCl Amb13952588 [0,1,0,0,0,0|2,0,1]=4 2927 B7R0.8 O=S(=O)(F)CCCF Amb19374915 [0,1,0,0,0,0|2,0,1]=4 2928 B7R0.8 O=S(=O)(F)CCCO Amb24739291 [0,1,0,0,0,0|2,0,1]=4 2929 B7R0.8 O=S(=O)(O)CCCBr Amb27391135 [0,1,0,0,0,0|2,0,0]=3 2930 B7R0.8 O=S(=O)(O)CCCI Amb29859913 [0,1,0,0,0,0|2,0,0]=3 2931 B7R0.8 O=S(=O)(O)CCCS Amb20620653 [0,1,0,0,0,0|2,0,0]=3 2932 B7R0.8 O=S(=O)(O)OCCCl Amb25064355 [0,1,0,0,0,0|3,0,0]=4 2933 B7R0.8 O=S(=O)(O)SCCCl Amb27233401 [0,1,0,0,0,0|3,0,0]=4 2934 B7R0.8 O=S(=O)(O)SCCO Amb27594594 [0,1,0,0,0,0|3,0,0]=4 2935 B7R0.8 O=S(=O)([O-])CCCBr Amb32646077 [0,1,0,0,0,0|2,0,1]=4 2936 B7R0.8 O=S(=O)([O-])CCCBr Amb6366415 [0,1,0,0,0,0|2,0,1]=4 2937 B7R0.8 O=S(=O)([O-])CCCO Amb22002047 [0,1,0,0,0,0|2,0,1]=4 2938 B7R0.8 O=S(=O)([O-])CCCS Amb2689070 [0,1,0,0,0,0|2,0,1]=4 2939 B7R1.2 C=C1CCC(Br)C1 Amb25135798 [0,0,0,1,0,0|3,0,0]=4 2940 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [0,0,0,1,0,0|2,0,1]=4 2941 B7R1.2 CC1=CC(C)CC1 Amb24479860 [0,0,0,1,0,0|3,0,0]=4 2942 B7R1.2 CC1=CC(N)CC1 Amb28186103 [0,0,0,1,0,0|2,0,0]=3 2943 B7R1.2 CC1=CCC(O)O1 Amb27241898 [0,0,0,1,0,0|2,0,1]=4 2944 B7R1.2 CC1=NCC(=O)O1 Amb27783804 [0,0,0,1,0,0|2,0,1]=4 2945 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [0,0,0,1,0,0|1,0,2]=4 2946 B7R1.2 CC1CC(=O)CN1 Amb28349308 [0,0,0,1,0,0|3,0,0]=4 2947 B7R1.2 CC1CC(=O)CO1 Amb25888380 [0,0,0,1,0,0|3,0,0]=4 2948 B7R1.2 CC1CC(=O)CS1 Amb23598370 [0,0,0,1,0,0|3,0,0]=4 2949 B7R1.2 CC1CCC(=O)C1 Amb8513672 [0,0,0,1,0,0|2,0,0]=3 2950 B7R1.2 CC1CCC(=O)N1 Amb19267101 [0,0,0,1,0,0|2,0,0]=3 2951 B7R1.2 CC1CCC(=O)O1 Amb6298321 [0,0,0,1,0,0|1,0,0]=2 2952 B7R1.2 CC1CCC(=O)S1 Amb27252897 [0,0,0,1,0,0|1,1,0]=3 2953 B7R1.2 CC1CCC(=S)N1 Amb27849283 [0,0,0,1,0,0|2,1,0]=4 2954 B7R1.2 CC1CCC(N)C1 Amb20669202 [0,0,0,1,0,0|2,0,1]=4 2955 B7R1.2 CC1CCC(N)C1 Amb24062164 [0,0,0,1,0,0|2,0,1]=4 2956 B7R1.2 CC1CCC(O)C1 Amb4605822 [0,0,0,1,0,0|2,0,1]=4 2957 B7R1.2 CC1CCC(O)N1 Amb28067624 [0,0,0,1,0,0|2,0,1]=4 2958 B7R1.2 CC1CN=C(Cl)O1 Amb27959043 [0,0,0,1,0,0|3,0,0]=4 2959 B7R1.2 CC1CN=C(N)O1 Amb26657342 [0,0,0,1,0,0|3,0,0]=4 2960 B7R1.2 CC1CN=C(N)O1 Amb33611634 [0,0,0,1,0,0|3,0,0]=4 2961 B7R1.2 CC1CNC(=O)C1 Amb10608004 [0,0,0,1,0,0|3,0,0]=4 2962 B7R1.2 CC1CNC(=O)N1 Amb17506853 [0,0,0,1,0,0|3,0,0]=4 2963 B7R1.2 CC1CNC(=O)O1 Amb19651732 [0,0,0,1,0,0|2,0,0]=3 2964 B7R1.2 CC1COC(=O)C1 Amb22231914 [0,0,0,1,0,0|3,0,0]=4 2965 B7R1.2 CC1COC(=O)N1 Amb19517037 [0,0,0,1,0,0|3,0,0]=4 2966 B7R1.2 CC1COC(=O)O1 Amb8513300 [0,0,0,1,0,0|2,0,0]=3 2967 B7R1.2 CC1COS(=O)O1 Amb22346070 [0,0,0,1,0,0|3,0,0]=4 2968 B7R1.2 CC1CSC(=O)N1 Amb28320497 [0,0,0,1,0,0|3,0,0]=4 2969 B7R1.2 CC1NC(=O)CS1 Amb27806202 [0,0,0,1,0,0|3,0,0]=4 2970 B7R1.2 CC1NCC(=O)N1 Amb28456791 [0,0,0,1,0,0|3,0,0]=4 2971 B7R1.2 CC1OC(=O)CS1 Amb25314322 [0,0,0,1,0,0|2,0,0]=3 2972 B7R1.2 CN1CCC(=O)C1 Amb22236123 [0,0,0,1,0,0|3,0,0]=4 2973 B7R1.2 CN1CCC(=O)C1 Amb8947873 [0,0,0,1,0,0|3,0,0]=4 2974 B7R1.2 CN1CCC(=O)N1 Amb24064860 [0,0,0,1,0,0|3,0,0]=4 2975 B7R1.2 CN1CCC(N)C1 Amb10610163 [0,0,0,1,0,0|3,0,0]=4 2976 B7R1.2 CN1CCC(N)C1 Amb8948079 [0,0,0,1,0,0|3,0,0]=4 2977 B7R1.2 CN1CC[C@@H](N)C1 Amb19891803 [0,0,0,1,0,0|3,0,0]=4 2978 B7R1.2 CN1CC[C@@H](N)C1 Amb8386824 [0,0,0,1,0,0|3,0,0]=4 2979 B7R1.2 CN1CC[C@H](N)C1 Amb19929627 [0,0,0,1,0,0|3,0,0]=4 2980 B7R1.2 CN1CC[C@H](N)C1 Amb20671398 [0,0,0,1,0,0|3,0,0]=4 2981 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [0,0,0,1,0,0|2,0,0]=3 2982 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [0,0,0,1,0,0|2,0,0]=3 2983 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [0,0,0,1,0,0|1,0,0]=2 2984 B7R1.2 C[C@@H]1CC[C@H](O)C1 Amb27853110 [0,0,0,1,0,0|2,0,1]=4 2985 B7R1.2 C[C@@H]1CN=C(N)O1 Amb33742469 [0,0,0,1,0,0|3,0,0]=4 2986 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [0,0,0,1,0,0|3,0,0]=4 2987 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [0,0,0,1,0,0|2,0,0]=3 2988 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [0,0,0,1,0,0|3,0,0]=4 2989 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [0,0,0,1,0,0|3,0,0]=4 2990 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [0,0,0,1,0,0|2,0,0]=3 2991 B7R1.2 C[C@@H]1COS(=O)O1 Amb27979548 [0,0,0,1,0,0|3,0,0]=4 2992 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [0,0,0,1,0,0|1,0,0]=2 2993 B7R1.2 C[C@H]1CN=C(N)O1 Amb33744016 [0,0,0,1,0,0|3,0,0]=4 2994 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [0,0,0,1,0,0|3,0,0]=4 2995 B7R1.2 C[C@H]1CNC(=O)N1 Amb27413051 [0,0,0,1,0,0|3,0,0]=4 2996 B7R1.2 C[C@H]1CNC(=S)O1 Amb27843992 [0,0,0,1,0,0|2,1,0]=4 2997 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [0,0,0,1,0,0|3,0,0]=4 2998 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [0,0,0,1,0,0|3,0,0]=4 2999 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [0,0,0,1,0,0|2,0,0]=3 3000 B7R1.2 ClC1=CC(Br)CC1 Amb27232977 [0,0,0,1,0,0|3,0,0]=4 3001 B7R1.2 NC1=CC(=O)CC1 Amb9753541 [0,0,0,1,0,0|1,0,1]=3 3002 B7R1.2 NC1=CC(=O)CS1 Amb22229937 [0,0,0,1,0,0|2,0,1]=4 3003 B7R1.2 NC1=CC(=O)NC1 Amb27454229 [0,0,0,1,0,0|2,0,1]=4 3004 B7R1.2 NC1=CCC(=O)N1 Amb25757914 [0,0,0,1,0,0|1,0,2]=4 3005 B7R1.2 NC1=NC(=O)CN1 Amb18639307 [0,0,0,1,0,0|2,0,1]=4 3006 B7R1.2 NC1=NC(=O)CO1 Amb9797441 [0,0,0,1,0,0|2,0,1]=4 3007 B7R1.2 NC1=NC(=O)CS1 Amb6364701 [0,0,0,1,0,0|2,0,1]=4 3008 B7R1.2 NC1=NC(=O)NC1 Amb22059492 [0,0,0,1,0,0|2,0,1]=4 3009 B7R1.2 NC1=NCC(=O)N1 Amb21964674 [0,0,0,1,0,0|2,0,1]=4 3010 B7R1.2 NC1=NCC(=O)N1 Amb475286 [0,0,0,1,0,0|2,0,1]=4 3011 B7R1.2 NC1=NCC(=O)S1 Amb25810910 [0,0,0,1,0,0|1,1,1]=4 3012 B7R1.2 NC1C=CC(=O)C1 Amb27445487 [0,0,0,1,0,0|1,0,2]=4 3013 B7R1.2 NC1CCC(=O)C1 Amb22494268 [0,0,0,1,0,0|1,0,0]=2 3014 B7R1.2 NC1CCC(=O)N1 Amb24480433 [0,0,0,1,0,0|1,0,0]=2 3015 B7R1.2 NC1CCC(=O)O1 Amb17593085 [0,0,0,1,0,0|0,0,0]=1 3016 B7R1.2 NC1CCC(F)C1 Amb23455257 [0,0,0,1,0,0|2,0,1]=4 3017 B7R1.2 NC1CCC(F)C1 Amb32652021 [0,0,0,1,0,0|2,0,1]=4 3018 B7R1.2 NC1CCC(N)C1 Amb22227723 [0,0,0,1,0,0|2,0,1]=4 3019 B7R1.2 NC1CCC(N)C1 Amb32667170 [0,0,0,1,0,0|2,0,1]=4 3020 B7R1.2 NC1CCC(N)C1 Amb32667206 [0,0,0,1,0,0|2,0,1]=4 3021 B7R1.2 NC1CCC(O)C1 Amb18561405 [0,0,0,1,0,0|1,0,1]=3 3022 B7R1.2 NC1CCC(O)C1 Amb19958405 [0,0,0,1,0,0|1,0,1]=3 3023 B7R1.2 NC1CCC(S)C1 Amb32788711 [0,0,0,1,0,0|1,1,1]=4 3024 B7R1.2 NC1CCS(=O)C1 Amb19149072 [0,0,0,1,0,0|2,0,0]=3 3025 B7R1.2 NC1CCS(=O)C1 Amb25133789 [0,0,0,1,0,0|2,0,0]=3 3026 B7R1.2 NC1CNC(=O)C1 Amb17760661 [0,0,0,1,0,0|2,0,0]=3 3027 B7R1.2 NC1CNC(=O)C1 Amb33544169 [0,0,0,1,0,0|2,0,0]=3 3028 B7R1.2 NC1COC(=O)C1 Amb30594428 [0,0,0,1,0,0|2,0,0]=3 3029 B7R1.2 NC1COC(=O)C1 Amb9782136 [0,0,0,1,0,0|2,0,0]=3 3030 B7R1.2 NC1CSC(=O)N1 Amb27596093 [0,0,0,1,0,0|2,0,0]=3 3031 B7R1.2 NC1N=CC(=O)S1 Amb27589031 [0,0,0,1,0,0|1,1,1]=4 3032 B7R1.2 NN1CC[C@H](O)C1 Amb27597182 [0,0,0,1,0,0|2,0,1]=4 3033 B7R1.2 N[C@@H]1CC[C@@H](F)C1 Amb25967798 [0,0,0,1,0,0|2,0,1]=4 3034 B7R1.2 N[C@@H]1CC[C@@H](N)C1 Amb26601894 [0,0,0,1,0,0|2,0,1]=4 3035 B7R1.2 N[C@@H]1CC[C@@H](N)C1 Amb33813727 [0,0,0,1,0,0|2,0,1]=4 3036 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Amb10066961 [0,0,0,1,0,0|1,0,1]=3 3037 B7R1.2 N[C@@H]1CC[C@@H](O)C1 Amb16233749 [0,0,0,1,0,0|1,0,1]=3 3038 B7R1.2 N[C@@H]1CC[C@H](F)C1 Amb24499537 [0,0,0,1,0,0|2,0,1]=4 3039 B7R1.2 N[C@@H]1CC[C@H](O)C1 Amb10066973 [0,0,0,1,0,0|1,0,1]=3 3040 B7R1.2 N[C@@H]1CC[C@H](O)C1 Amb22406236 [0,0,0,1,0,0|1,0,1]=3 3041 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [0,0,0,1,0,0|2,0,0]=3 3042 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [0,0,0,1,0,0|2,0,0]=3 3043 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [0,0,0,1,0,0|2,0,0]=3 3044 B7R1.2 N[C@@H]1COC(=O)C1 Amb16233747 [0,0,0,1,0,0|2,0,0]=3 3045 B7R1.2 N[C@@H]1COC(=O)C1 Amb26477774 [0,0,0,1,0,0|2,0,0]=3 3046 B7R1.2 N[C@H]1CCC(=O)N1 Amb27482175 [0,0,0,1,0,0|1,0,0]=2 3047 B7R1.2 N[C@H]1CC[C@@H](F)C1 Amb22886175 [0,0,0,1,0,0|2,0,1]=4 3048 B7R1.2 N[C@H]1CC[C@@H](F)C1 Amb25228459 [0,0,0,1,0,0|2,0,1]=4 3049 B7R1.2 N[C@H]1CC[C@@H](N)C1 Amb22746716 [0,0,0,1,0,0|2,0,1]=4 3050 B7R1.2 N[C@H]1CC[C@@H](N)C1 Amb22746800 [0,0,0,1,0,0|2,0,1]=4 3051 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb10066971 [0,0,0,1,0,0|1,0,1]=3 3052 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb22274622 [0,0,0,1,0,0|1,0,1]=3 3053 B7R1.2 N[C@H]1CC[C@@H](O)C1 Amb34916039 [0,0,0,1,0,0|1,0,1]=3 3054 B7R1.2 N[C@H]1CC[C@H](F)C1 Amb28128275 [0,0,0,1,0,0|2,0,1]=4 3055 B7R1.2 N[C@H]1CC[C@H](N)C1 Amb22823163 [0,0,0,1,0,0|2,0,1]=4 3056 B7R1.2 N[C@H]1CC[C@H](O)C1 Amb10066972 [0,0,0,1,0,0|1,0,1]=3 3057 B7R1.2 N[C@H]1CC[C@H](O)C1 Amb22386861 [0,0,0,1,0,0|1,0,1]=3 3058 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [0,0,0,1,0,0|2,0,0]=3 3059 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [0,0,0,1,0,0|2,0,0]=3 3060 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [0,0,0,1,0,0|2,0,0]=3 3061 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [0,0,0,1,0,0|2,0,0]=3 3062 B7R1.2 O=C1C=C(Br)CC1 Amb23399816 [0,0,0,1,0,0|2,0,1]=4 3063 B7R1.2 O=C1C=C(Cl)CC1 Amb9753542 [0,0,0,1,0,0|2,0,1]=4 3064 B7R1.2 O=C1C=C(O)CC1 Amb9901808 [0,0,0,1,0,0|2,0,1]=4 3065 B7R1.2 O=C1C=CC(Br)O1 Amb22001603 [0,0,0,1,0,0|1,0,2]=4 3066 B7R1.2 O=C1C=CC(Cl)O1 Amb27760027 [0,0,0,1,0,0|1,0,2]=4 3067 B7R1.2 O=C1C=CC(F)O1 Amb27778280 [0,0,0,1,0,0|1,0,2]=4 3068 B7R1.2 O=C1C=CC(O)O1 Amb24544763 [0,0,0,1,0,0|1,0,2]=4 3069 B7R1.2 O=C1CC(F)CO1 Amb24431109 [0,0,0,1,0,0|3,0,0]=4 3070 B7R1.2 O=C1CC(I)CO1 Amb27401189 [0,0,0,1,0,0|3,0,0]=4 3071 B7R1.2 O=C1CC(O)CN1 Amb19958404 [0,0,0,1,0,0|3,0,0]=4 3072 B7R1.2 O=C1CC(O)CO1 Amb4006296 [0,0,0,1,0,0|3,0,0]=4 3073 B7R1.2 O=C1CC(S)CN1 Amb25685875 [0,0,0,1,0,0|3,0,0]=4 3074 B7R1.2 O=C1CCC(=O)C1 Amb2696524 [0,0,0,1,0,0|2,0,1]=4 3075 B7R1.2 O=C1CCC(=O)N1 Amb2793049 [0,0,0,1,0,0|2,0,1]=4 3076 B7R1.2 O=C1CCC(=O)O1 Amb2793017 [0,0,0,1,0,0|1,0,1]=3 3077 B7R1.2 O=C1CCC(=O)S1 Amb2691584 [0,0,0,1,0,0|1,1,1]=4 3078 B7R1.2 O=C1CCC(=S)N1 Amb28122939 [0,0,0,1,0,0|2,0,1]=4 3079 B7R1.2 O=C1CCC(Br)C1 Amb24334292 [0,0,0,1,0,0|2,0,0]=3 3080 B7R1.2 O=C1CCC(Br)N1 Amb27592181 [0,0,0,1,0,0|2,0,0]=3 3081 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [0,0,0,1,0,0|1,0,0]=2 3082 B7R1.2 O=C1CCC(Cl)C1 Amb26585347 [0,0,0,1,0,0|2,0,0]=3 3083 B7R1.2 O=C1CCC(Cl)O1 Amb27477474 [0,0,0,1,0,0|1,0,0]=2 3084 B7R1.2 O=C1CCC(F)C1 Amb21963553 [0,0,0,1,0,0|2,0,0]=3 3085 B7R1.2 O=C1CCC(O)C1 Amb22057378 [0,0,0,1,0,0|2,0,0]=3 3086 B7R1.2 O=C1CCC(O)O1 Amb22740957 [0,0,0,1,0,0|1,0,0]=2 3087 B7R1.2 O=C1CCS(=O)C1 Amb27199097 [0,0,0,1,0,0|3,0,0]=4 3088 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [0,0,0,1,0,0|2,0,0]=3 3089 B7R1.2 O=C1CC[C@@H](O)N1 Amb27458284 [0,0,0,1,0,0|2,0,0]=3 3090 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [0,0,0,1,0,0|2,0,0]=3 3091 B7R1.2 O=C1CC[C@H](O)N1 Amb27881572 [0,0,0,1,0,0|2,0,0]=3 3092 B7R1.2 O=C1CNC(=O)O1 Amb2695392 [0,0,0,1,0,0|2,0,1]=4 3093 B7R1.2 O=C1CNC(=S)O1 Amb27393154 [0,0,0,1,0,0|2,0,1]=4 3094 B7R1.2 O=C1CNC(S)S1 Amb24460897 [0,0,0,1,0,0|2,1,0]=4 3095 B7R1.2 O=C1COC(=O)O1 Amb27837383 [0,0,0,1,0,0|2,0,1]=4 3096 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [0,0,0,1,0,0|3,0,0]=4 3097 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [0,0,0,1,0,0|3,0,0]=4 3098 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [0,0,0,1,0,0|3,0,0]=4 3099 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [0,0,0,1,0,0|3,0,0]=4 3100 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [0,0,0,1,0,0|3,0,0]=4 3101 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [0,0,0,1,0,0|3,0,0]=4 3102 B7R1.2 O=C1OC(O)CS1 Amb28066979 [0,0,0,1,0,0|2,0,0]=3 3103 B7R1.2 O=C1OCC(Cl)O1 Amb10842117 [0,0,0,1,0,0|2,0,0]=3 3104 B7R1.2 O=C1OCC(F)O1 Amb10841016 [0,0,0,1,0,0|2,0,0]=3 3105 B7R1.2 O=S1CCC(Br)C1 Amb27872345 [0,0,0,1,0,0|3,0,0]=4 3106 B7R1.2 O=S1CCC(O)C1 Amb26600157 [0,0,0,1,0,0|3,0,0]=4 3107 B7R1.2 O=S1CC[C@@H](O)C1 Amb28191911 [0,0,0,1,0,0|3,0,0]=4 3108 B7R1.2 OC1C=C(Br)CC1 Amb8391790 [0,0,0,1,0,0|3,0,0]=4 3109 B7R1.2 OC1C=C(I)CC1 Amb26903566 [0,0,0,1,0,0|3,0,0]=4 3110 B7R1.2 OC1CCC(O)C1 Amb8513837 [0,0,0,1,0,0|2,0,1]=4 3111 B7R1.2 OC1CCC(O)O1 Amb4018883 [0,0,0,1,0,0|1,0,2]=4 3112 B7R1.2 OC1CCN(O)C1 Amb27430271 [0,0,0,1,0,0|3,0,0]=4 3113 B7R1.2 O[C@@H]1C=C(Br)CC1 Amb24479014 [0,0,0,1,0,0|3,0,0]=4 3114 B7R1.2 O[C@@H]1CC[C@@H](O)C1 Amb24519755 [0,0,0,1,0,0|2,0,1]=4 3115 B7R1.2 O[C@H]1C=C(Br)CC1 Amb27213930 [0,0,0,1,0,0|3,0,0]=4 3116 B7R1.2 O[C@H]1CC[C@@H](O)C1 Amb26035335 [0,0,0,1,0,0|2,0,1]=4 3117 B7R1.2 O[C@H]1CC[C@H](O)C1 Amb26400686 [0,0,0,1,0,0|2,0,1]=4 3118 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [0,0,0,1,0,0|2,0,1]=4 3119 B7R1.3 BrC1=CCCCC1 Amb21856761 [0,0,0,1,0,0|3,0,0]=4 3120 B7R1.3 BrC1=CCCCO1 Amb24322651 [0,0,0,1,0,0|2,0,1]=4 3121 B7R1.3 BrC1=CCCNC1 Amb27173423 [0,0,0,1,0,0|2,0,1]=4 3122 B7R1.3 BrC1=CCCNC1 Amb32651839 [0,0,0,1,0,0|2,0,1]=4 3123 B7R1.3 BrC1=COCCC1 Amb24322600 [0,0,0,1,0,0|3,0,0]=4 3124 B7R1.3 BrC1CCCCO1 Amb24322575 [0,0,0,1,0,0|2,0,1]=4 3125 B7R1.3 BrC1CCCNC1 Amb22497824 [0,0,0,1,0,0|2,0,1]=4 3126 B7R1.3 BrC1CCCNC1 Amb8629039 [0,0,0,1,0,0|2,0,1]=4 3127 B7R1.3 C=C1CCCCC1 Amb8515603 [0,0,0,1,0,0|3,0,0]=4 3128 B7R1.3 C=C1CCCCN1 Amb27801038 [0,0,0,1,0,0|3,0,0]=4 3129 B7R1.3 C=C1CCCCO1 Amb28345156 [0,0,0,1,0,0|2,0,0]=3 3130 B7R1.3 C=C1CCCNC1 Amb19514641 [0,0,0,1,0,0|2,0,0]=3 3131 B7R1.3 C=C1CCCNC1 Amb22059305 [0,0,0,1,0,0|2,0,0]=3 3132 B7R1.3 C=C1CCCOC1 Amb27594580 [0,0,0,1,0,0|3,0,0]=4 3133 B7R1.3 C=C1CCCSC1 Amb22494848 [0,0,0,1,0,0|3,0,0]=4 3134 B7R1.3 C=C1OCCCO1 Amb25734089 [0,0,0,1,0,0|3,0,0]=4 3135 B7R1.3 CC1=CCCCC1 Amb8513524 [0,0,0,1,0,0|3,0,0]=4 3136 B7R1.3 CC1=CCCCO1 Amb24480530 [0,0,0,1,0,0|2,0,1]=4 3137 B7R1.3 CC1=CCCNC1 Amb23439963 [0,0,0,1,0,0|2,0,1]=4 3138 B7R1.3 CC1=CCCNC1 Amb25063349 [0,0,0,1,0,0|2,0,1]=4 3139 B7R1.3 CC1=NCCCC1 Amb27459940 [0,0,0,1,0,0|3,0,0]=4 3140 B7R1.3 CC1=NCCNC1 Amb22755966 [0,0,0,1,0,0|3,0,0]=4 3141 B7R1.3 CC1CCCCO1 Amb4035049 [0,0,0,1,0,0|2,0,1]=4 3142 B7R1.3 CC1CCCNC1 Amb22491688 [0,0,0,1,0,0|2,0,1]=4 3143 B7R1.3 CC1CCCNC1 Amb9703089 [0,0,0,1,0,0|2,0,1]=4 3144 B7R1.3 CN1CCCNC1 Amb18121429 [0,0,0,1,0,0|3,0,0]=4 3145 B7R1.3 C[C@@H]1CCCNC1 Amb24461444 [0,0,0,1,0,0|2,0,1]=4 3146 B7R1.3 C[C@@H]1CCCNC1 Amb33801279 [0,0,0,1,0,0|2,0,1]=4 3147 B7R1.3 C[C@H]1CCCNC1 Amb22745835 [0,0,0,1,0,0|2,0,1]=4 3148 B7R1.3 C[C@H]1CCCNC1 Amb8387001 [0,0,0,1,0,0|2,0,1]=4 3149 B7R1.3 C[SiH]1CCCCO1 Amb26582586 [0,0,0,1,0,0|2,1,0]=4 3150 B7R1.3 ClC1=CCCCC1 Amb9785147 [0,0,0,1,0,0|3,0,0]=4 3151 B7R1.3 ClC1=CCCCO1 Amb27449514 [0,0,0,1,0,0|2,0,1]=4 3152 B7R1.3 ClC1=CCCNC1 Amb32664385 [0,0,0,1,0,0|2,0,1]=4 3153 B7R1.3 ClC1=CCCNC1 Amb32664386 [0,0,0,1,0,0|2,0,1]=4 3154 B7R1.3 ClC1CCCCO1 Amb17673285 [0,0,0,1,0,0|2,0,1]=4 3155 B7R1.3 FC1=CCCNC1 Amb27181097 [0,0,0,1,0,0|2,0,1]=4 3156 B7R1.3 FC1=CCCNC1 Amb28314663 [0,0,0,1,0,0|2,0,1]=4 3157 B7R1.3 FC1=COCCC1 Amb24322810 [0,0,0,1,0,0|3,0,0]=4 3158 B7R1.3 FC1CCCCO1 Amb24322826 [0,0,0,1,0,0|2,0,1]=4 3159 B7R1.3 FC1CCCNC1 Amb13953137 [0,0,0,1,0,0|2,0,1]=4 3160 B7R1.3 FC1CCCNC1 Amb2688404 [0,0,0,1,0,0|2,0,1]=4 3161 B7R1.3 F[C@@H]1CCCNC1 Amb20242276 [0,0,0,1,0,0|2,0,1]=4 3162 B7R1.3 F[C@@H]1CCCNC1 Amb27619341 [0,0,0,1,0,0|2,0,1]=4 3163 B7R1.3 F[C@H]1CCCNC1 Amb20242275 [0,0,0,1,0,0|2,0,1]=4 3164 B7R1.3 IC1=CCCCC1 Amb27750996 [0,0,0,1,0,0|3,0,0]=4 3165 B7R1.3 IC1=COCCC1 Amb24322812 [0,0,0,1,0,0|3,0,0]=4 3166 B7R1.3 IC1CCCNC1 Amb22496356 [0,0,0,1,0,0|2,0,1]=4 3167 B7R1.3 N=C1CCCCC1 Amb26924126 [0,0,0,1,0,0|3,0,0]=4 3168 B7R1.3 N=C1CCCCN1 Amb17616049 [0,0,0,1,0,0|3,0,0]=4 3169 B7R1.3 N=C1CCCCN1 Amb2780013 [0,0,0,1,0,0|3,0,0]=4 3170 B7R1.3 N=C1NCCCO1 Amb23597225 [0,0,0,1,0,0|3,0,0]=4 3171 B7R1.3 N=C1NCCCO1 Amb28990985 [0,0,0,1,0,0|3,0,0]=4 3172 B7R1.3 NC1=CCCCC1 Amb28456773 [0,0,0,1,0,0|3,0,0]=4 3173 B7R1.3 NC1=NCCCC1 Amb3997189 [0,0,0,1,0,0|3,0,0]=4 3174 B7R1.3 NC1CCCNC1 Amb2694718 [0,0,0,1,0,0|2,0,1]=4 3175 B7R1.3 NC1CCCNC1 Amb2720311 [0,0,0,1,0,0|2,0,1]=4 3176 B7R1.3 NC1CCCNC1 Amb8385620 [0,0,0,1,0,0|2,0,1]=4 3177 B7R1.3 N[C@@H]1CCCNC1 Amb16233705 [0,0,0,1,0,0|2,0,1]=4 3178 B7R1.3 N[C@@H]1CCCNC1 Amb2695443 [0,0,0,1,0,0|2,0,1]=4 3179 B7R1.3 N[C@H]1CCCCO1 Amb27655590 [0,0,0,1,0,0|2,0,1]=4 3180 B7R1.3 N[C@H]1CCCNC1 Amb17134809 [0,0,0,1,0,0|2,0,1]=4 3181 B7R1.3 N[C@H]1CCCNC1 Amb2695444 [0,0,0,1,0,0|2,0,1]=4 3182 B7R1.3 O=C1C=CCCC1 Amb17843126 [0,0,0,1,0,0|2,0,0]=3 3183 B7R1.3 O=C1C=CCCN1 Amb22001783 [0,0,0,1,0,0|3,0,0]=4 3184 B7R1.3 O=C1C=CCCO1 Amb15693457 [0,0,0,1,0,0|1,0,2]=4 3185 B7R1.3 O=C1C=CCOC1 Amb22234519 [0,0,0,1,0,0|3,0,0]=4 3186 B7R1.3 O=C1C=CCSC1 Amb26544956 [0,0,0,1,0,0|3,0,0]=4 3187 B7R1.3 O=C1C=CNCC1 Amb2700614 [0,0,0,1,0,0|3,0,0]=4 3188 B7R1.3 O=C1C=COCC1 Amb22000873 [0,0,0,1,0,0|3,0,0]=4 3189 B7R1.3 O=C1C=CSCC1 Amb25375022 [0,0,0,1,0,0|3,0,0]=4 3190 B7R1.3 O=C1C=NCCN1 Amb28341190 [0,0,0,1,0,0|2,0,1]=4 3191 B7R1.3 O=C1CCC=CN1 Amb26365285 [0,0,0,1,0,0|2,0,1]=4 3192 B7R1.3 O=C1CCCCC1 Amb2793026 [0,0,0,1,0,0|2,0,0]=3 3193 B7R1.3 O=C1CCCCN1 Amb6892006 [0,0,0,1,0,0|2,0,0]=3 3194 B7R1.3 O=C1CCCCO1 Amb8513592 [0,0,0,1,0,0|1,0,0]=2 3195 B7R1.3 O=C1CCCCS1 Amb25186924 [0,0,0,1,0,0|1,1,0]=3 3196 B7R1.3 O=C1CCCNC1 Amb10070944 [0,0,0,1,0,0|1,0,0]=2 3197 B7R1.3 O=C1CCCNC1 Amb10602349 [0,0,0,1,0,0|1,0,0]=2 3198 B7R1.3 O=C1CCCNC1 Amb19958010 [0,0,0,1,0,0|1,0,0]=2 3199 B7R1.3 O=C1CCCNN1 Amb18061622 [0,0,0,1,0,0|1,0,0]=2 3200 B7R1.3 O=C1CCCOC1 Amb19373430 [0,0,0,1,0,0|2,0,0]=3 3201 B7R1.3 O=C1CCCON1 Amb26560803 [0,0,0,1,0,0|2,0,0]=3 3202 B7R1.3 O=C1CCCSC1 Amb13952257 [0,0,0,1,0,0|2,0,0]=3 3203 B7R1.3 O=C1CCN=CN1 Amb27447786 [0,0,0,1,0,0|3,0,0]=4 3204 B7R1.3 O=C1CCNCC1 Amb2690392 [0,0,0,1,0,0|3,0,0]=4 3205 B7R1.3 O=C1CCNCC1 Amb2793002 [0,0,0,1,0,0|3,0,0]=4 3206 B7R1.3 O=C1CCNCC1 Amb8394939 [0,0,0,1,0,0|3,0,0]=4 3207 B7R1.3 O=C1CCNCN1 Amb27458283 [0,0,0,1,0,0|3,0,0]=4 3208 B7R1.3 O=C1CCOCC1 Amb2725565 [0,0,0,1,0,0|3,0,0]=4 3209 B7R1.3 O=C1CCSCC1 Amb1154265 [0,0,0,1,0,0|3,0,0]=4 3210 B7R1.3 O=C1CNCCN1 Amb4138465 [0,0,0,1,0,0|2,0,0]=3 3211 B7R1.3 O=C1CNCCN1 Amb6334808 [0,0,0,1,0,0|2,0,0]=3 3212 B7R1.3 O=C1CNCCO1 Amb19958702 [0,0,0,1,0,0|2,0,0]=3 3213 B7R1.3 O=C1CNCCO1 Amb32410210 [0,0,0,1,0,0|2,0,0]=3 3214 B7R1.3 O=C1COCCN1 Amb15691115 [0,0,0,1,0,0|3,0,0]=4 3215 B7R1.3 O=C1COCCO1 Amb17933352 [0,0,0,1,0,0|2,0,0]=3 3216 B7R1.3 O=C1CSCCN1 Amb674722 [0,0,0,1,0,0|3,0,0]=4 3217 B7R1.3 O=C1CSCCO1 Amb28069740 [0,0,0,1,0,0|2,0,0]=3 3218 B7R1.3 O=C1CSCCS1 Amb24539369 [0,0,0,1,0,0|2,1,0]=4 3219 B7R1.3 O=C1CSCSC1 Amb19148039 [0,0,0,1,0,0|3,0,0]=4 3220 B7R1.3 O=C1N=CCCN1 Amb24480889 [0,0,0,1,0,0|3,0,0]=4 3221 B7R1.3 O=C1NCCCN1 Amb4034594 [0,0,0,1,0,0|3,0,0]=4 3222 B7R1.3 O=C1NCCCO1 Amb10608499 [0,0,0,1,0,0|2,0,0]=3 3223 B7R1.3 O=C1NCCCS1 Amb24117134 [0,0,0,1,0,0|2,1,0]=4 3224 B7R1.3 O=C1NCCNN1 Amb28341733 [0,0,0,1,0,0|2,0,0]=3 3225 B7R1.3 O=C1NNCCO1 Amb32683554 [0,0,0,1,0,0|2,0,0]=3 3226 B7R1.3 O=C1OCCCO1 Amb4034896 [0,0,0,1,0,0|2,0,0]=3 3227 B7R1.3 O=S1CCCNC1 Amb27195521 [0,0,0,1,0,0|2,0,0]=3 3228 B7R1.3 O=S1OCCCO1 Amb20240777 [0,0,0,1,0,0|3,0,0]=4 3229 B7R1.3 OC1=CN=NCC1 Amb22756935 [0,0,0,1,0,0|2,0,1]=4 3230 B7R1.3 OC1=NCCNC1 Amb22330543 [0,0,0,1,0,0|2,0,0]=3 3231 B7R1.3 OC1C=CCCC1 Amb4605824 [0,0,0,1,0,0|2,0,1]=4 3232 B7R1.3 OC1CCCCC1 Amb4605832 [0,0,0,1,0,0|2,0,1]=4 3233 B7R1.3 OC1CCCCN1 Amb8393085 [0,0,0,1,0,0|2,0,1]=4 3234 B7R1.3 OC1CCCCO1 Amb8517292 [0,0,0,1,0,0|1,0,2]=4 3235 B7R1.3 OC1CCCNC1 Amb3939221 [0,0,0,1,0,0|1,0,1]=3 3236 B7R1.3 OC1CCCNC1 Amb4036802 [0,0,0,1,0,0|1,0,1]=3 3237 B7R1.3 OC1CCCOC1 Amb16192108 [0,0,0,1,0,0|2,0,1]=4 3238 B7R1.3 OC1CCCSC1 Amb4034626 [0,0,0,1,0,0|2,0,1]=4 3239 B7R1.3 OC1CCONC1 Amb33017243 [0,0,0,1,0,0|2,0,1]=4 3240 B7R1.3 OC1CNCCO1 Amb13883759 [0,0,0,1,0,0|2,0,1]=4 3241 B7R1.3 OC1CNCCO1 Amb22011707 [0,0,0,1,0,0|2,0,1]=4 3242 B7R1.3 OC1CNCNC1 Amb27854350 [0,0,0,1,0,0|2,0,1]=4 3243 B7R1.3 ON1CCCCC1 Amb6468702 [0,0,0,1,0,0|3,0,0]=4 3244 B7R1.3 O[C@@H]1CCCNC1 Amb20241315 [0,0,0,1,0,0|1,0,1]=3 3245 B7R1.3 O[C@@H]1CCCNC1 Amb8628462 [0,0,0,1,0,0|1,0,1]=3 3246 B7R1.3 O[C@@H]1CCCOC1 Amb17942798 [0,0,0,1,0,0|2,0,1]=4 3247 B7R1.3 O[C@H]1C=CCCC1 Amb10601567 [0,0,0,1,0,0|2,0,1]=4 3248 B7R1.3 O[C@H]1CCCNC1 Amb10844804 [0,0,0,1,0,0|1,0,1]=3 3249 B7R1.3 O[C@H]1CCCNC1 Amb2688784 [0,0,0,1,0,0|1,0,1]=3 3250 B7R1.3 O[C@H]1CCCOC1 Amb20241306 [0,0,0,1,0,0|2,0,1]=4 3251 B7R1.3 S=C1CCCCN1 Amb5720520 [0,0,0,1,0,0|2,1,0]=4 3252 B7R1.3 S=C1NCCCO1 Amb22524560 [0,0,0,1,0,0|2,1,0]=4 3253 B7R1.3 SC1=COCCC1 Amb33319911 [0,0,0,1,0,0|2,1,0]=4 3254 B7R1.3 SC1CCCNC1 Amb22371077 [0,0,0,1,0,0|1,1,1]=4 3255 B7R1.3 SC1CCCNC1 Amb27453630 [0,0,0,1,0,0|1,1,1]=4 3256 B7R1.5 C=C1CC1CCI Amb27838218 [0,0,0,1,0,0|3,0,0]=4 3257 B7R1.5 C=C1CC1CCN Amb27850014 [0,0,0,1,0,0|2,0,0]=3 3258 B7R1.5 CC1CC1CCN Amb27835415 [0,0,0,1,0,0|2,0,1]=4 3259 B7R1.5 CCCC1ON1C Amb22232363 [0,0,0,1,0,0|3,0,0]=4 3260 B7R1.5 C[C@@H]1O[C@H]1CCO Amb27184243 [0,0,0,1,0,0|2,0,1]=4 3261 B7R1.5 C[C@H]1O[C@H]1CCBr Amb27454808 [0,0,0,1,0,0|2,0,1]=4 3262 B7R1.5 O=C1C=C1CCO Amb33330739 [0,0,0,1,0,0|2,0,1]=4 3263 B7R1.7 BrCCCC1CO1 Amb27407723 [0,0,0,1,0,0|2,0,1]=4 3264 B7R1.7 CCCCC1CO1 Amb17771532 [0,0,0,1,0,0|2,0,1]=4 3265 B7R1.7 CCCC[C@@H]1CO1 Amb22336297 [0,0,0,1,0,0|2,0,1]=4 3266 B7R1.7 CCCC[C@H]1CO1 Amb10982587 [0,0,0,1,0,0|2,0,1]=4 3267 B7R1.7 FCCCC1CO1 Amb33196122 [0,0,0,1,0,0|2,0,1]=4 3268 B7R1.7 ICCCC1CO1 Amb27838220 [0,0,0,1,0,0|2,0,1]=4 3269 B7R1.7 NCCCC1CC1 Amb18296303 [0,0,0,1,0,0|2,0,1]=4 3270 B7R1.7 NCCCC1CC1 Amb33548306 [0,0,0,1,0,0|2,0,1]=4 3271 B7R1.7 NCCCC1CO1 Amb27816302 [0,0,0,1,0,0|1,0,1]=3 3272 B7R1.7 OCCCC1CO1 Amb28294234 [0,0,0,1,0,0|2,0,1]=4 3273 B7R1.7 OCCC[C@@H]1CO1 Amb27394788 [0,0,0,1,0,0|2,0,1]=4 3274 B7R1.10 C#CC1CC(=O)C1 Amb27874486 [0,0,0,1,0,0|2,0,1]=4 3275 B7R1.10 C=C1CC(CBr)C1 Amb24365342 [0,0,0,1,0,0|3,0,0]=4 3276 B7R1.10 C=C1CC(CCl)C1 Amb33804034 [0,0,0,1,0,0|3,0,0]=4 3277 B7R1.10 C=C1CC(CN)C1 Amb10071401 [0,0,0,1,0,0|2,0,0]=3 3278 B7R1.10 C=C1CC(CN)C1 Amb10976021 [0,0,0,1,0,0|2,0,0]=3 3279 B7R1.10 C=C1CC(CO)C1 Amb25854323 [0,0,0,1,0,0|3,0,0]=4 3280 B7R1.10 C=CC1CC(=O)C1 Amb26409138 [0,0,0,1,0,0|2,0,1]=4 3281 B7R1.10 C=CC1CC(=O)N1 Amb26507633 [0,0,0,1,0,0|2,0,1]=4 3282 B7R1.10 C=C[C@@H]1CC(=O)N1 Amb27589344 [0,0,0,1,0,0|2,0,1]=4 3283 B7R1.10 CC1CC(CN)C1 Amb22886186 [0,0,0,1,0,0|2,0,1]=4 3284 B7R1.10 CC1CC(CN)C1 Amb23580259 [0,0,0,1,0,0|2,0,1]=4 3285 B7R1.10 CCC1CC(=O)C1 Amb24406738 [0,0,0,1,0,0|2,0,0]=3 3286 B7R1.10 CN1CC(CN)C1 Amb22737228 [0,0,0,1,0,0|3,0,0]=4 3287 B7R1.10 CN1CC(CN)C1 Amb30526874 [0,0,0,1,0,0|3,0,0]=4 3288 B7R1.10 COC1CC(=O)C1 Amb22754340 [0,0,0,1,0,0|3,0,0]=4 3289 B7R1.10 COC1CC(=O)N1 Amb27802279 [0,0,0,1,0,0|3,0,0]=4 3290 B7R1.10 CSC1CC(=O)C1 Amb32655823 [0,0,0,1,0,0|3,0,0]=4 3291 B7R1.10 CSC1CC(=O)N1 Amb25265230 [0,0,0,1,0,0|3,0,0]=4 3292 B7R1.10 CS[C@@H]1CC(=O)N1 Amb27981333 [0,0,0,1,0,0|3,0,0]=4 3293 B7R1.10 N#CC1CC(=O)C1 Amb10603718 [0,0,0,1,0,0|1,0,2]=4 3294 B7R1.10 NCC1CC(=O)C1 Amb18251063 [0,0,0,1,0,0|1,0,0]=2 3295 B7R1.10 NCC1CC(=O)C1 Amb22406094 [0,0,0,1,0,0|1,0,0]=2 3296 B7R1.10 NCC1CC(=O)N1 Amb25230632 [0,0,0,1,0,0|1,0,0]=2 3297 B7R1.10 NCC1CC(Br)C1 Amb32657206 [0,0,0,1,0,0|2,0,1]=4 3298 B7R1.10 NCC1CC(Cl)C1 Amb25103747 [0,0,0,1,0,0|2,0,1]=4 3299 B7R1.10 NCC1CC(Cl)C1 Amb33804262 [0,0,0,1,0,0|2,0,1]=4 3300 B7R1.10 NCC1CC(F)C1 Amb23440124 [0,0,0,1,0,0|2,0,1]=4 3301 B7R1.10 NCC1CC(F)C1 Amb31204637 [0,0,0,1,0,0|2,0,1]=4 3302 B7R1.10 NCC1CC(N)C1 Amb30039914 [0,0,0,1,0,0|2,0,1]=4 3303 B7R1.10 NCC1CC(O)C1 Amb21962033 [0,0,0,1,0,0|1,0,1]=3 3304 B7R1.10 NCC1CC(O)C1 Amb22405901 [0,0,0,1,0,0|1,0,1]=3 3305 B7R1.10 NC[C@H]1C[C@@H](Br)C1 Amb32676225 [0,0,0,1,0,0|2,0,1]=4 3306 B7R1.10 NC[C@H]1C[C@@H](F)C1 Amb26505928 [0,0,0,1,0,0|2,0,1]=4 3307 B7R1.10 NC[C@H]1C[C@@H](F)C1 Amb28989912 [0,0,0,1,0,0|2,0,1]=4 3308 B7R1.10 NC[C@H]1C[C@@H](N)C1 Amb30032540 [0,0,0,1,0,0|2,0,1]=4 3309 B7R1.10 NC[C@H]1C[C@@H](O)C1 Amb22831753 [0,0,0,1,0,0|1,0,1]=3 3310 B7R1.10 NC[C@H]1C[C@@H](O)C1 Amb22899743 [0,0,0,1,0,0|1,0,1]=3 3311 B7R1.10 NC[C@H]1C[C@H](Br)C1 Amb32676217 [0,0,0,1,0,0|2,0,1]=4 3312 B7R1.10 NC[C@H]1C[C@H](F)C1 Amb23440125 [0,0,0,1,0,0|2,0,1]=4 3313 B7R1.10 NC[C@H]1C[C@H](F)C1 Amb31291703 [0,0,0,1,0,0|2,0,1]=4 3314 B7R1.10 NC[C@H]1C[C@H](N)C1 Amb32696721 [0,0,0,1,0,0|2,0,1]=4 3315 B7R1.10 NC[C@H]1C[C@H](O)C1 Amb22899712 [0,0,0,1,0,0|1,0,1]=3 3316 B7R1.10 NC[C@H]1C[C@H](O)C1 Amb22899737 [0,0,0,1,0,0|1,0,1]=3 3317 B7R1.10 NN[C@H]1C[C@@H](O)C1 Amb34151267 [0,0,0,1,0,0|2,0,1]=4 3318 B7R1.10 NN[C@H]1C[C@H](O)C1 Amb34161650 [0,0,0,1,0,0|2,0,1]=4 3319 B7R1.10 O=C1CC(CBr)C1 Amb20671344 [0,0,0,1,0,0|2,0,0]=3 3320 B7R1.10 O=C1CC(CBr)O1 Amb26981027 [0,0,0,1,0,0|1,0,0]=2 3321 B7R1.10 O=C1CC(CCl)C1 Amb10610581 [0,0,0,1,0,0|2,0,0]=3 3322 B7R1.10 O=C1CC(CCl)O1 Amb28322279 [0,0,0,1,0,0|1,0,0]=2 3323 B7R1.10 O=C1CC(CF)C1 Amb26416198 [0,0,0,1,0,0|2,0,0]=3 3324 B7R1.10 O=C1CC(CI)N1 Amb27838210 [0,0,0,1,0,0|2,0,0]=3 3325 B7R1.10 O=C1CC(CO)C1 Amb16231082 [0,0,0,1,0,0|2,0,0]=3 3326 B7R1.10 O=C1CC(CO)N1 Amb22388379 [0,0,0,1,0,0|2,0,0]=3 3327 B7R1.10 O=C1C[C@H](CO)N1 Amb26887642 [0,0,0,1,0,0|2,0,0]=3 3328 B7R1.10 OC1CC(CBr)C1 Amb25986866 [0,0,0,1,0,0|2,0,1]=4 3329 B7R1.10 OC1CC(CF)C1 Amb34138419 [0,0,0,1,0,0|2,0,1]=4 3330 B7R1.10 OCC1CC(O)C1 Amb22284484 [0,0,0,1,0,0|2,0,1]=4 3331 B7R1.10 OC[C@H]1C[C@H](O)C1 Amb27490798 [0,0,0,1,0,0|2,0,1]=4 3332 B7R1.10 O[C@H]1C[C@@H](CBr)C1 Amb27850666 [0,0,0,1,0,0|2,0,1]=4 3333 B7R1.10 O[C@H]1C[C@@H](CF)C1 Amb34136579 [0,0,0,1,0,0|2,0,1]=4 3334 B7R1.10 O[C@H]1C[C@H](CBr)C1 Amb34164797 [0,0,0,1,0,0|2,0,1]=4 3335 B7R1.12 C=C(C)C1CC1N Amb33199895 [0,0,0,1,0,0|2,0,0]=3 3336 B7R1.12 C=C(C)[C@@H]1C[C@H]1N Amb33199897 [0,0,0,1,0,0|2,0,0]=3 3337 B7R1.12 C=C1CC1C(=O)O Amb9774969 [0,0,0,1,0,0|1,0,1]=3 3338 B7R1.12 C=C1CC1C(N)=O Amb28191145 [0,0,0,1,0,0|2,0,1]=4 3339 B7R1.12 CC(=O)C1CC1C Amb25720437 [0,0,0,1,0,0|2,0,0]=3 3340 B7R1.12 CC(=O)C1OC1C Amb25920285 [0,0,0,1,0,0|3,0,0]=4 3341 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [0,0,0,1,0,0|2,0,0]=3 3342 B7R1.12 CC(=O)[C@@H]1OC1C Amb27165592 [0,0,0,1,0,0|3,0,0]=4 3343 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [0,0,0,1,0,0|2,0,0]=3 3344 B7R1.12 CC(=O)[C@H]1O[C@H]1C Amb28052513 [0,0,0,1,0,0|3,0,0]=4 3345 B7R1.12 CC(=O)[C@H]1S[C@@H]1C Amb27231676 [0,0,0,1,0,0|3,0,0]=4 3346 B7R1.12 CC(C)C1CC1N Amb18280885 [0,0,0,1,0,0|2,0,1]=4 3347 B7R1.12 CC(C)C1CC1N Amb32663388 [0,0,0,1,0,0|2,0,1]=4 3348 B7R1.12 CC(C)[C@@H]1C[C@H]1N Amb24470295 [0,0,0,1,0,0|2,0,1]=4 3349 B7R1.12 CC(C)[C@@H]1C[C@H]1N Amb28643805 [0,0,0,1,0,0|2,0,1]=4 3350 B7R1.12 CC(O)C1CC1I Amb27867333 [0,0,0,1,0,0|2,0,1]=4 3351 B7R1.12 CC(O)[C@H]1C[C@@H]1C Amb27443623 [0,0,0,1,0,0|2,0,1]=4 3352 B7R1.12 CC1=CC1C(=O)O Amb27157805 [0,0,0,1,0,0|1,0,2]=4 3353 B7R1.12 CC1CC1C(=N)N Amb25139920 [0,0,0,1,0,0|3,0,0]=4 3354 B7R1.12 CC1CC1C(=N)N Amb32667599 [0,0,0,1,0,0|3,0,0]=4 3355 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [0,0,0,1,0,0|2,0,0]=3 3356 B7R1.12 CC1CC1C(=O)O Amb9703126 [0,0,0,1,0,0|1,0,0]=2 3357 B7R1.12 CC1CC1C(N)=O Amb8858378 [0,0,0,1,0,0|2,0,0]=3 3358 B7R1.12 CC1CC1C(N)=S Amb25302556 [0,0,0,1,0,0|2,1,0]=4 3359 B7R1.12 CC1CC1[C@@H](C)O Amb24683424 [0,0,0,1,0,0|2,0,1]=4 3360 B7R1.12 CC1CC1[C@H](C)O Amb25271040 [0,0,0,1,0,0|2,0,1]=4 3361 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,1,0,0|2,0,0]=3 3362 B7R1.12 CC1SC1C(=O)O Amb27195238 [0,0,0,1,0,0|2,0,0]=3 3363 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [0,0,0,1,0,0|2,0,0]=3 3364 B7R1.12 CN(C)C1CC1N Amb27805506 [0,0,0,1,0,0|3,0,0]=4 3365 B7R1.12 C[C@@H](O)[C@@H]1C[C@@H]1I Amb27439061 [0,0,0,1,0,0|2,0,1]=4 3366 B7R1.12 C[C@@H]1C[C@@H]1B(O)O Amb24329037 [0,0,0,1,0,0|2,0,1]=4 3367 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [0,0,0,1,0,0|1,0,0]=2 3368 B7R1.12 C[C@@H]1C[C@H]1C(=N)N Amb27252052 [0,0,0,1,0,0|3,0,0]=4 3369 B7R1.12 C[C@@H]1C[C@H]1C(=N)N Amb33483860 [0,0,0,1,0,0|3,0,0]=4 3370 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,1,0,0|2,0,0]=3 3371 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [0,0,0,1,0,0|1,0,0]=2 3372 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [0,0,0,1,0,0|2,0,0]=3 3373 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [0,0,0,1,0,0|2,0,0]=3 3374 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [0,0,0,1,0,0|2,0,0]=3 3375 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [0,0,0,1,0,0|2,0,0]=3 3376 B7R1.12 C[C@H](O)[C@@H]1C[C@H]1C Amb28065317 [0,0,0,1,0,0|2,0,1]=4 3377 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [0,0,0,1,0,0|1,0,0]=2 3378 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [0,0,0,1,0,0|2,0,0]=3 3379 B7R1.12 C[C@H]1C[C@H]1B(O)O Amb24515113 [0,0,0,1,0,0|2,0,1]=4 3380 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,1,0,0|1,0,0]=2 3381 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [0,0,0,1,0,0|2,0,0]=3 3382 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [0,0,0,1,0,0|2,0,0]=3 3383 B7R1.12 NC(=O)C1CC1Br Amb27838278 [0,0,0,1,0,0|2,0,0]=3 3384 B7R1.12 NC(=O)C1CC1F Amb26026786 [0,0,0,1,0,0|2,0,0]=3 3385 B7R1.12 NC(=O)C1CC1N Amb18279694 [0,0,0,1,0,0|1,0,0]=2 3386 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F Amb27758752 [0,0,0,1,0,0|2,0,0]=3 3387 B7R1.12 NC(=O)[C@@H]1C[C@H]1F Amb27403700 [0,0,0,1,0,0|2,0,0]=3 3388 B7R1.12 NC1CC1C(=O)O Amb7762823 [0,0,0,1,0,0|0,0,0]=1 3389 B7R1.12 NC1CC1C(F)F Amb24479843 [0,0,0,1,0,0|2,0,1]=4 3390 B7R1.12 NC1CC1C(F)F Amb32665008 [0,0,0,1,0,0|2,0,1]=4 3391 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [0,0,0,1,0,0|0,0,0]=1 3392 B7R1.12 N[C@@H]1C[C@@H]1C(F)F Amb27450063 [0,0,0,1,0,0|2,0,1]=4 3393 B7R1.12 N[C@@H]1C[C@@H]1C(F)F Amb32664600 [0,0,0,1,0,0|2,0,1]=4 3394 B7R1.12 N[C@@H]1C[C@H]1C(F)F Amb19375067 [0,0,0,1,0,0|2,0,1]=4 3395 B7R1.12 N[C@@H]1C[C@H]1C(F)F Amb32653046 [0,0,0,1,0,0|2,0,1]=4 3396 B7R1.12 N[C@H]1C[C@@H]1C(F)F Amb26432692 [0,0,0,1,0,0|2,0,1]=4 3397 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [0,0,0,1,0,0|0,0,0]=1 3398 B7R1.12 N[C@H]1C[C@H]1C(F)F Amb34915835 [0,0,0,1,0,0|2,0,1]=4 3399 B7R1.12 O=C(Cl)C1CC1=O Amb27838228 [0,0,0,1,0,0|2,0,1]=4 3400 B7R1.12 O=C(Cl)C1CC1Cl Amb27865442 [0,0,0,1,0,0|2,0,0]=3 3401 B7R1.12 O=C(Cl)C1CC1F Amb8389490 [0,0,0,1,0,0|2,0,0]=3 3402 B7R1.12 O=C(Cl)[C@@H]1C[C@@H]1Cl Amb28291528 [0,0,0,1,0,0|2,0,0]=3 3403 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,0,0,1,0,0|2,0,0]=3 3404 B7R1.12 O=C(O)C1CC1Br Amb27760446 [0,0,0,1,0,0|1,0,0]=2 3405 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [0,0,0,1,0,0|1,0,0]=2 3406 B7R1.12 O=C(O)C1CC1F Amb22490547 [0,0,0,1,0,0|1,0,0]=2 3407 B7R1.12 O=C(O)C1CC1I Amb26047069 [0,0,0,1,0,0|1,0,0]=2 3408 B7R1.12 O=C(O)C1CC1S Amb20246988 [0,0,0,1,0,0|1,0,0]=2 3409 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [0,0,0,1,0,0|1,0,0]=2 3410 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [0,0,0,1,0,0|1,0,0]=2 3411 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,1,0,0|1,0,0]=2 3412 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [0,0,0,1,0,0|1,0,0]=2 3413 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,1,0,0|1,0,0]=2 3414 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,1,0,0|1,0,0]=2 3415 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [0,0,0,1,0,0|1,0,0]=2 3416 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,1,0,0|1,0,0]=2 3417 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [0,0,0,1,0,0|1,0,0]=2 3418 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [0,0,0,1,0,0|1,0,0]=2 3419 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,1,0,0|1,0,0]=2 3420 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [0,0,0,1,0,0|1,0,0]=2 3421 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,1,0,0|1,0,0]=2 3422 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,1,0,0|1,0,0]=2 3423 B7R1.12 OB(O)C1CC1Br Amb24314265 [0,0,0,1,0,0|2,0,1]=4 3424 B7R1.14 CC1(C)CCCN1 Amb8428102 [0,0,0,1,0,0|2,0,1]=4 3425 B7R1.14 CC1(C)CCCN1 Amb9173089 [0,0,0,1,0,0|2,0,1]=4 3426 B7R1.14 CC1(O)CCCC1 Amb4037281 [0,0,0,1,0,0|2,0,1]=4 3427 B7R1.14 N=S1(=O)CCCC1 Amb22493673 [0,0,0,1,0,0|3,0,0]=4 3428 B7R1.14 O=S1(=O)CCCC1 Amb2973382 [0,0,0,1,0,0|2,0,1]=4 3429 B7R1.14 O=S1(=O)CCCN1 Amb6893202 [0,0,0,1,0,0|1,0,1]=3 3430 B7R1.14 O=S1(=O)CCCO1 Amb6608684 [0,0,0,1,0,0|2,0,1]=4 3431 B7R1.14 O=S1(=O)NCCN1 Amb21520325 [0,0,0,1,0,0|2,0,1]=4 3432 B7R1.14 O=S1(=O)NCCO1 Amb23440061 [0,0,0,1,0,0|2,0,1]=4 3433 B7R1.17 CC1(C)CCC1N Amb26419669 [0,0,0,1,0,0|2,0,1]=4 3434 B7R1.17 CC1(C)CCC1N Amb28827670 [0,0,0,1,0,0|2,0,1]=4 3435 B7R1.17 CC1(O)CCC1N Amb24117490 [0,0,0,1,0,0|1,0,1]=3 3436 B7R1.17 CC1(O)CCC1N Amb25968766 [0,0,0,1,0,0|1,0,1]=3 3437 B7R1.17 CC1CCS1(=O)=O Amb22364950 [0,0,0,1,0,0|2,0,1]=4 3438 B7R1.17 C[C@@]1(O)CC[C@H]1N Amb32664480 [0,0,0,1,0,0|1,0,1]=3 3439 B7R1.17 C[C@@]1(O)CC[C@H]1N Amb32664481 [0,0,0,1,0,0|1,0,1]=3 3440 B7R1.17 C[C@H]1CCS1(=O)=O Amb27661382 [0,0,0,1,0,0|2,0,1]=4 3441 B7R1.17 NC1CCC1(F)F Amb19148167 [0,0,0,1,0,0|2,0,1]=4 3442 B7R1.17 NC1CCC1(F)F Amb30594206 [0,0,0,1,0,0|2,0,1]=4 3443 B7R1.17 OC1(F)CCC1F Amb27211172 [0,0,0,1,0,0|2,0,1]=4 3444 B7R1.18 C=C(C)C1CCC1 Amb25662691 [0,0,0,1,0,0|3,0,0]=4 3445 B7R1.18 C=C(C)C1CCN1 Amb33199611 [0,0,0,1,0,0|2,0,0]=3 3446 B7R1.18 C=C(F)C1CCC1 Amb27403200 [0,0,0,1,0,0|3,0,0]=4 3447 B7R1.18 CC(=O)C1=CCC1 Amb23453500 [0,0,0,1,0,0|2,0,1]=4 3448 B7R1.18 CC(=O)C1CCC1 Amb4037098 [0,0,0,1,0,0|2,0,0]=3 3449 B7R1.18 CC(=O)C1CCN1 Amb28142364 [0,0,0,1,0,0|1,0,0]=2 3450 B7R1.18 CC(=O)C1CNC1 Amb23400009 [0,0,0,1,0,0|3,0,0]=4 3451 B7R1.18 CC(=O)C1CNC1 Amb23401240 [0,0,0,1,0,0|3,0,0]=4 3452 B7R1.18 CC(=O)C1CNC1 Amb33473586 [0,0,0,1,0,0|3,0,0]=4 3453 B7R1.18 CC(=O)C1COC1 Amb27397483 [0,0,0,1,0,0|3,0,0]=4 3454 B7R1.18 CC(=O)C1CSC1 Amb29849423 [0,0,0,1,0,0|3,0,0]=4 3455 B7R1.18 CC(=O)N1CCC1 Amb22008358 [0,0,0,1,0,0|3,0,0]=4 3456 B7R1.18 CC(C)C1CCN1 Amb32712115 [0,0,0,1,0,0|2,0,1]=4 3457 B7R1.18 CC(C)C1CCN1 Amb8010874 [0,0,0,1,0,0|2,0,1]=4 3458 B7R1.18 CC(C)[C@H]1CCN1 Amb27267401 [0,0,0,1,0,0|2,0,1]=4 3459 B7R1.18 CC(O)C1CCC1 Amb10603414 [0,0,0,1,0,0|2,0,1]=4 3460 B7R1.18 CC(O)C1CCO1 Amb26873978 [0,0,0,1,0,0|2,0,1]=4 3461 B7R1.18 C[C@@H](O)C1CCC1 Amb24478546 [0,0,0,1,0,0|2,0,1]=4 3462 B7R1.18 C[C@H](O)C1CCC1 Amb25145632 [0,0,0,1,0,0|2,0,1]=4 3463 B7R1.18 FC(F)C1CCN1 Amb27266051 [0,0,0,1,0,0|2,0,1]=4 3464 B7R1.18 FC(F)C1CCN1 Amb28827671 [0,0,0,1,0,0|2,0,1]=4 3465 B7R1.18 FC(F)C1CCN1 Amb33621065 [0,0,0,1,0,0|2,0,1]=4 3466 B7R1.18 FC(F)[C@@H]1CCN1 Amb34151302 [0,0,0,1,0,0|2,0,1]=4 3467 B7R1.18 FC(F)[C@H]1CCN1 Amb34165061 [0,0,0,1,0,0|2,0,1]=4 3468 B7R1.18 N=C(N)C1CCC1 Amb2695056 [0,0,0,1,0,0|3,0,0]=4 3469 B7R1.18 N=C(N)C1CCC1 Amb33528962 [0,0,0,1,0,0|3,0,0]=4 3470 B7R1.18 N=C(N)C1CCN1 Amb28410949 [0,0,0,1,0,0|2,0,0]=3 3471 B7R1.18 N=C(N)[C@@H]1CCN1 Amb27790002 [0,0,0,1,0,0|2,0,0]=3 3472 B7R1.18 NC(=O)C1CCC1 Amb33552668 [0,0,0,1,0,0|2,0,0]=3 3473 B7R1.18 NC(=O)C1CCN1 Amb22230240 [0,0,0,1,0,0|1,0,0]=2 3474 B7R1.18 NC(=O)C1CCN1 Amb22491865 [0,0,0,1,0,0|1,0,0]=2 3475 B7R1.18 NC(=O)C1CNC1 Amb10976072 [0,0,0,1,0,0|3,0,0]=4 3476 B7R1.18 NC(=O)C1CNC1 Amb20061301 [0,0,0,1,0,0|3,0,0]=4 3477 B7R1.18 NC(=O)C1CNC1 Amb21960249 [0,0,0,1,0,0|3,0,0]=4 3478 B7R1.18 NC(=O)C1CSC1 Amb27209831 [0,0,0,1,0,0|3,0,0]=4 3479 B7R1.18 NC(=O)N1CCC1 Amb25326782 [0,0,0,1,0,0|3,0,0]=4 3480 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [0,0,0,1,0,0|1,0,0]=2 3481 B7R1.18 NC(=S)C1CCC1 Amb18108358 [0,0,0,1,0,0|2,1,0]=4 3482 B7R1.18 NS(=O)C1CCC1 Amb32720395 [0,0,0,1,0,0|3,0,0]=4 3483 B7R1.18 O=C(Br)C1CCC1 Amb28291328 [0,0,0,1,0,0|2,0,0]=3 3484 B7R1.18 O=C(Cl)C1CCC1 Amb33528386 [0,0,0,1,0,0|2,0,0]=3 3485 B7R1.18 O=C(Cl)N1CCC1 Amb28144777 [0,0,0,1,0,0|3,0,0]=4 3486 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [0,0,0,1,0,0|1,0,1]=3 3487 B7R1.18 O=C(O)C1CCC1 Amb2686619 [0,0,0,1,0,0|1,0,0]=2 3488 B7R1.18 O=C(O)C1CCN1 Amb2371568 [0,0,0,1,0,0|0,0,0]=1 3489 B7R1.18 O=C(O)C1CCN1 Amb8391098 [0,0,0,1,0,0|0,0,0]=1 3490 B7R1.18 O=C(O)C1CCO1 Amb2383526 [0,0,0,1,0,0|1,0,0]=2 3491 B7R1.18 O=C(O)C1CCS1 Amb27209836 [0,0,0,1,0,0|1,0,0]=2 3492 B7R1.18 O=C(O)C1CNC1 Amb2444164 [0,0,0,1,0,0|2,0,0]=3 3493 B7R1.18 O=C(O)C1CNC1 Amb8384273 [0,0,0,1,0,0|2,0,0]=3 3494 B7R1.18 O=C(O)C1COC1 Amb33542663 [0,0,0,1,0,0|2,0,0]=3 3495 B7R1.18 O=C(O)C1CSC1 Amb20171470 [0,0,0,1,0,0|2,0,0]=3 3496 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [0,0,0,1,0,0|0,0,0]=1 3497 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [0,0,0,1,0,0|0,0,0]=1 3498 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [0,0,0,1,0,0|1,0,0]=2 3499 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [0,0,0,1,0,0|0,0,0]=1 3500 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [0,0,0,1,0,0|0,0,0]=1 3501 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [0,0,0,1,0,0|1,0,0]=2 3502 B7R1.18 O=C([O-])C1=CCC1 Amb34165365 [0,0,0,1,0,0|1,0,2]=4 3503 B7R1.18 O=S(Cl)C1CCC1 Amb32720394 [0,0,0,1,0,0|3,0,0]=4 3504 B7R1.18 O=S([O-])C1CCC1 Amb32755305 [0,0,0,1,0,0|2,0,1]=4 3505 B7R1.18 O=[N+]([O-])C1CCC1 Amb13883563 [0,0,0,1,0,0|2,0,1]=4 3506 B7R1.18 OB(O)C1CCC1 Amb10071491 [0,0,0,1,0,0|2,0,1]=4 3507 B7R1.20 C=C(C)CC1CC1 Amb27207160 [0,0,0,1,0,0|3,0,0]=4 3508 B7R1.20 C=C(C)CC1CO1 Amb33199536 [0,0,0,1,0,0|3,0,0]=4 3509 B7R1.20 CC(=O)CC1CC1 Amb10603417 [0,0,0,1,0,0|2,0,0]=3 3510 B7R1.20 CC(=O)NC1CC1 Amb3366973 [0,0,0,1,0,0|3,0,0]=4 3511 B7R1.20 CC(=O)OC1CO1 Amb25261586 [0,0,0,1,0,0|3,0,0]=4 3512 B7R1.20 CC(O)CC1CC1 Amb26536953 [0,0,0,1,0,0|2,0,1]=4 3513 B7R1.20 CN(O)CC1CC1 Amb33429117 [0,0,0,1,0,0|3,0,0]=4 3514 B7R1.20 C[C@@H](O)CC1CC1 Amb22896775 [0,0,0,1,0,0|2,0,1]=4 3515 B7R1.20 C[C@H](O)CC1CC1 Amb28050168 [0,0,0,1,0,0|2,0,1]=4 3516 B7R1.20 N=C(N)CC1CC1 Amb21964664 [0,0,0,1,0,0|3,0,0]=4 3517 B7R1.20 N=C(N)CC1CC1 Amb9423215 [0,0,0,1,0,0|3,0,0]=4 3518 B7R1.20 NC(=O)CC1CC1 Amb33552967 [0,0,0,1,0,0|2,0,0]=3 3519 B7R1.20 NC(=O)NC1CC1 Amb1152776 [0,0,0,1,0,0|3,0,0]=4 3520 B7R1.20 NC(=O)OC1CC1 Amb27265645 [0,0,0,1,0,0|3,0,0]=4 3521 B7R1.20 NC(=O)OC1CO1 Amb27184555 [0,0,0,1,0,0|3,0,0]=4 3522 B7R1.20 NC(=S)CC1CC1 Amb9423151 [0,0,0,1,0,0|2,1,0]=4 3523 B7R1.20 NS(=O)CC1CC1 Amb32720358 [0,0,0,1,0,0|3,0,0]=4 3524 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [0,0,0,1,0,0|2,0,0]=3 3525 B7R1.20 O=C(Cl)NC1CC1 Amb27848787 [0,0,0,1,0,0|3,0,0]=4 3526 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [0,0,0,1,0,0|3,0,0]=4 3527 B7R1.20 O=C(O)C=C1CC1 Amb8392543 [0,0,0,1,0,0|1,0,2]=4 3528 B7R1.20 O=C(O)CC1CC1 Amb2686657 [0,0,0,1,0,0|1,0,0]=2 3529 B7R1.20 O=C(O)CC1CO1 Amb25244347 [0,0,0,1,0,0|1,0,0]=2 3530 B7R1.20 O=C(O)C[C@@H]1CO1 Amb27253415 [0,0,0,1,0,0|1,0,0]=2 3531 B7R1.20 O=C(O)C[C@H]1CO1 Amb26068484 [0,0,0,1,0,0|1,0,0]=2 3532 B7R1.20 O=S(Cl)CC1CC1 Amb25914604 [0,0,0,1,0,0|3,0,0]=4 3533 B7R1.20 O=S([O-])CC1CC1 Amb27483189 [0,0,0,1,0,0|2,0,1]=4 3534 B7R1.20 O=[N+]([O-])CC1CO1 Amb23589333 [0,0,0,1,0,0|2,0,1]=4 3535 B7R1.23 CC1(C)CC1CN Amb10608232 [0,0,0,1,0,0|2,0,1]=4 3536 B7R1.23 CC1(C)CC1CN Amb19515077 [0,0,0,1,0,0|2,0,1]=4 3537 B7R1.23 CC1(C)C[C@@H]1CN Amb25932170 [0,0,0,1,0,0|2,0,1]=4 3538 B7R1.23 NCC1CC1(Cl)Cl Amb436369 [0,0,0,1,0,0|2,0,1]=4 3539 B7R1.23 NCC1CC1(F)F Amb19374753 [0,0,0,1,0,0|2,0,1]=4 3540 B4R0.1 C#CC(=O)O Amb6600128 [2,0,0,0,0,0|0,0,2]=4 3541 B4R0.1 C=C(Br)CN Amb13951282 [2,0,0,0,0,0|2,0,0]=4 3542 B4R0.1 C=C(C)CN Amb17749039 [2,0,0,0,0,0|2,0,0]=4 3543 B4R0.1 C=C(Cl)CC Amb22228725 [2,0,0,0,0,0|2,0,0]=4 3544 B4R0.1 C=C(Cl)CN Amb18948531 [2,0,0,0,0,0|2,0,0]=4 3545 B4R0.1 C=C(Cl)CN Amb19514508 [2,0,0,0,0,0|2,0,0]=4 3546 B4R0.1 C=C(F)CN Amb22008378 [2,0,0,0,0,0|2,0,0]=4 3547 B4R0.1 C=CC(=O)O Amb2792871 [2,0,0,0,0,0|0,0,2]=4 3548 B4R0.1 CC(=O)CBr Amb6673867 [2,0,0,0,0,0|2,0,0]=4 3549 B4R0.1 CC(=O)CCl Amb2792923 [2,0,0,0,0,0|2,0,0]=4 3550 B4R0.1 CC(=O)CI Amb22831972 [2,0,0,0,0,0|2,0,0]=4 3551 B4R0.1 CC(=O)CN Amb10603379 [2,0,0,0,0,0|1,0,0]=3 3552 B4R0.1 CC(=O)CN Amb22489444 [2,0,0,0,0,0|1,0,0]=3 3553 B4R0.1 CC(=O)CN Amb8393368 [2,0,0,0,0,0|1,0,0]=3 3554 B4R0.1 CC(=O)CO Amb2404925 [2,0,0,0,0,0|2,0,0]=4 3555 B4R0.1 CC(=O)CS Amb19148935 [2,0,0,0,0,0|2,0,0]=4 3556 B4R0.1 CC(=O)NN Amb1153969 [2,0,0,0,0,0|2,0,0]=4 3557 B4R0.1 CC(O)CN Amb3939026 [2,0,0,0,0,0|1,0,1]=4 3558 B4R0.1 CCB(O)O Amb8387605 [2,0,0,0,0,0|1,0,1]=4 3559 B4R0.1 CCC(=N)N Amb2695032 [2,0,0,0,0,0|2,0,0]=4 3560 B4R0.1 CCC(=N)N Amb6316131 [2,0,0,0,0,0|2,0,0]=4 3561 B4R0.1 CCC(=O)Br Amb8517649 [2,0,0,0,0,0|1,0,0]=3 3562 B4R0.1 CCC(=O)Cl Amb2792924 [2,0,0,0,0,0|1,0,0]=3 3563 B4R0.1 CCC(=O)F Amb10839798 [2,0,0,0,0,0|1,0,0]=3 3564 B4R0.1 CCC(=O)O Amb3938995 [2,0,0,0,0,0|0,0,0]=2 3565 B4R0.1 CCC(=O)S Amb26953905 [2,0,0,0,0,0|0,1,0]=3 3566 B4R0.1 CCC(=O)[O-] Amb22731204 [2,0,0,0,0,0|0,0,1]=3 3567 B4R0.1 CCC(=O)[O-] Amb8513417 [2,0,0,0,0,0|0,0,1]=3 3568 B4R0.1 CCC(C)=O Amb4606002 [2,0,0,0,0,0|1,0,0]=3 3569 B4R0.1 CCC(C)O Amb9748253 [2,0,0,0,0,0|1,0,1]=4 3570 B4R0.1 CCC(N)=O Amb3886522 [2,0,0,0,0,0|1,0,0]=3 3571 B4R0.1 CCC(N)=S Amb1114671 [2,0,0,0,0,0|1,1,0]=4 3572 B4R0.1 CCC(O)F Amb27763763 [2,0,0,0,0,0|1,0,1]=4 3573 B4R0.1 CCC(O)O Amb28280915 [2,0,0,0,0,0|0,0,2]=4 3574 B4R0.1 CCN(C)O Amb25746619 [2,0,0,0,0,0|2,0,0]=4 3575 B4R0.1 CCS(=O)Cl Amb24647938 [2,0,0,0,0,0|2,0,0]=4 3576 B4R0.1 CCS(=O)O Amb24332177 [2,0,0,0,0,0|1,0,0]=3 3577 B4R0.1 CCS(=O)[O-] Amb17943109 [2,0,0,0,0,0|1,0,1]=4 3578 B4R0.1 CCS(=O)[O-] Amb22411287 [2,0,0,0,0,0|1,0,1]=4 3579 B4R0.1 CCS(C)=O Amb25301908 [2,0,0,0,0,0|2,0,0]=4 3580 B4R0.1 CCS(N)=O Amb24734600 [2,0,0,0,0,0|2,0,0]=4 3581 B4R0.1 CC[C@@H](C)O Amb8514550 [2,0,0,0,0,0|1,0,1]=4 3582 B4R0.1 CC[C@H](C)O Amb4606006 [2,0,0,0,0,0|1,0,1]=4 3583 B4R0.1 CC[N+](=O)[O-] Amb6608854 [2,0,0,0,0,0|1,0,1]=4 3584 B4R0.1 CC[PH](=O)O Amb8391284 [2,0,0,0,0,0|1,0,0]=3 3585 B4R0.1 CNC(=O)Cl Amb17942998 [2,0,0,0,0,0|2,0,0]=4 3586 B4R0.1 CNC(=O)F Amb27778388 [2,0,0,0,0,0|2,0,0]=4 3587 B4R0.1 CNC(C)=O Amb3886523 [2,0,0,0,0,0|2,0,0]=4 3588 B4R0.1 CNC(N)=O Amb1152075 [2,0,0,0,0,0|2,0,0]=4 3589 B4R0.1 COC(=O)Cl Amb3940230 [2,0,0,0,0,0|2,0,0]=4 3590 B4R0.1 COC(=O)[O-] Amb25688001 [2,0,0,0,0,0|1,0,1]=4 3591 B4R0.1 COC(C)=O Amb6608821 [2,0,0,0,0,0|2,0,0]=4 3592 B4R0.1 COC(N)=O Amb6608701 [2,0,0,0,0,0|2,0,0]=4 3593 B4R0.1 CO[PH](=O)O Amb27489021 [2,0,0,0,0,0|2,0,0]=4 3594 B4R0.1 CSC(=O)Cl Amb22336225 [2,0,0,0,0,0|2,0,0]=4 3595 B4R0.1 CSC(N)=O Amb25082577 [2,0,0,0,0,0|2,0,0]=4 3596 B4R0.1 C[C@@H](O)CN Amb3940167 [2,0,0,0,0,0|1,0,1]=4 3597 B4R0.1 C[C@H](O)CN Amb3939339 [2,0,0,0,0,0|1,0,1]=4 3598 B4R0.1 N=C(N)CN Amb24053305 [2,0,0,0,0,0|2,0,0]=4 3599 B4R0.1 N=C(N)CN Amb8383568 [2,0,0,0,0,0|2,0,0]=4 3600 B4R0.1 NC(=O)CBr Amb4477263 [2,0,0,0,0,0|2,0,0]=4 3601 B4R0.1 NC(=O)CCl Amb1933827 [2,0,0,0,0,0|2,0,0]=4 3602 B4R0.1 NC(=O)CF Amb6891955 [2,0,0,0,0,0|2,0,0]=4 3603 B4R0.1 NC(=O)CI Amb2688829 [2,0,0,0,0,0|2,0,0]=4 3604 B4R0.1 NC(=O)CO Amb1804460 [2,0,0,0,0,0|2,0,0]=4 3605 B4R0.1 NC(=O)CS Amb2724286 [2,0,0,0,0,0|2,0,0]=4 3606 B4R0.1 NC(=O)C[SiH3] Amb27807227 [2,0,0,0,0,0|1,1,0]=4 3607 B4R0.1 NCB(O)O Amb24477493 [2,0,0,0,0,0|1,0,1]=4 3608 B4R0.1 NCB(O)O Amb32665365 [2,0,0,0,0,0|1,0,1]=4 3609 B4R0.1 NCC(=O)Br Amb27810916 [2,0,0,0,0,0|1,0,0]=3 3610 B4R0.1 NCC(=O)Cl Amb6740270 [2,0,0,0,0,0|1,0,0]=3 3611 B4R0.1 NCC(=O)O Amb2609025 [2,0,0,0,0,0|0,0,0]=2 3612 B4R0.1 NCC(=O)O Amb33869972 [2,0,0,0,0,0|0,0,0]=2 3613 B4R0.1 NCC(=O)O Amb8516646 [2,0,0,0,0,0|0,0,0]=2 3614 B4R0.1 NCC(=O)S Amb17593043 [2,0,0,0,0,0|0,1,0]=3 3615 B4R0.1 NCC(=O)[O-] Amb21962917 [2,0,0,0,0,0|0,0,1]=3 3616 B4R0.1 NCC(=O)[O-] Amb22493796 [2,0,0,0,0,0|0,0,1]=3 3617 B4R0.1 NCC(=O)[O-] Amb440282 [2,0,0,0,0,0|0,0,1]=3 3618 B4R0.1 NCC(=O)[O-] Amb5722007 [2,0,0,0,0,0|0,0,1]=3 3619 B4R0.1 NCC(N)=O Amb10604177 [2,0,0,0,0,0|1,0,0]=3 3620 B4R0.1 NCC(N)=O Amb22234569 [2,0,0,0,0,0|1,0,0]=3 3621 B4R0.1 NCC(N)=O Amb6609053 [2,0,0,0,0,0|1,0,0]=3 3622 B4R0.1 NCC(N)=S Amb22059483 [2,0,0,0,0,0|1,1,0]=4 3623 B4R0.1 NCC(N)=S Amb33527546 [2,0,0,0,0,0|1,1,0]=4 3624 B4R0.1 NC[N+](=O)[O-] Amb28284766 [2,0,0,0,0,0|1,0,1]=4 3625 B4R0.1 NC[PH](=O)O Amb776032 [2,0,0,0,0,0|1,0,0]=3 3626 B4R0.1 NNC(=O)O Amb33512897 [2,0,0,0,0,0|1,0,0]=3 3627 B4R0.1 NNC(N)=O Amb7757834 [2,0,0,0,0,0|2,0,0]=4 3628 B4R0.1 NNC(N)=O Amb8513311 [2,0,0,0,0,0|2,0,0]=4 3629 B4R0.1 O=C(Br)CBr Amb2793022 [2,0,0,0,0,0|2,0,0]=4 3630 B4R0.1 O=C(Br)CCl Amb27168386 [2,0,0,0,0,0|2,0,0]=4 3631 B4R0.1 O=C(Cl)CBr Amb6608953 [2,0,0,0,0,0|2,0,0]=4 3632 B4R0.1 O=C(Cl)CCl Amb2793043 [2,0,0,0,0,0|2,0,0]=4 3633 B4R0.1 O=C(Cl)CF Amb16185604 [2,0,0,0,0,0|2,0,0]=4 3634 B4R0.1 O=C(Cl)CI Amb22045163 [2,0,0,0,0,0|2,0,0]=4 3635 B4R0.1 O=C(F)CCl Amb10839258 [2,0,0,0,0,0|2,0,0]=4 3636 B4R0.1 O=C(I)CCl Amb27639296 [2,0,0,0,0,0|2,0,0]=4 3637 B4R0.1 O=C(O)C=S Amb28042222 [2,0,0,0,0,0|1,0,1]=4 3638 B4R0.1 O=C(O)CBr Amb6608658 [2,0,0,0,0,0|1,0,0]=3 3639 B4R0.1 O=C(O)CCl Amb2792919 [2,0,0,0,0,0|1,0,0]=3 3640 B4R0.1 O=C(O)CF Amb6740304 [2,0,0,0,0,0|1,0,0]=3 3641 B4R0.1 O=C(O)CI Amb1916034 [2,0,0,0,0,0|1,0,0]=3 3642 B4R0.1 O=C(O)CO Amb2793019 [2,0,0,0,0,0|1,0,0]=3 3643 B4R0.1 O=C(O)CS Amb6608659 [2,0,0,0,0,0|1,0,0]=3 3644 B4R0.1 O=C(O)C[Na] Amb28255644 [2,0,0,0,0,0|1,0,0]=3 3645 B4R0.1 O=C(O)O[Na] Amb22411585 [2,0,0,0,0,0|2,0,0]=4 3646 B4R0.1 O=C([O-])CO Amb22730982 [2,0,0,0,0,0|1,0,1]=4 3647 B4R0.1 O=C([O-])CO Amb8516148 [2,0,0,0,0,0|1,0,1]=4 3648 B4R0.1 O=C([O-])CS Amb8395172 [2,0,0,0,0,0|1,0,1]=4 3649 B4R0.1 O=CC(=O)O Amb3940872 [2,0,0,0,0,0|1,0,1]=4 3650 B4R0.1 O=CC(=O)O Amb6609044 [2,0,0,0,0,0|1,0,1]=4 3651 B4R0.1 O=S(O)CCl Amb27468736 [2,0,0,0,0,0|2,0,0]=4 3652 B4R0.1 O=S(O)CO Amb27621151 [2,0,0,0,0,0|2,0,0]=4 3653 B4R0.2 BOCCN Amb28363843 [2,0,0,0,0,0|2,0,0]=4 3654 B4R0.2 BrCCCBr Amb2686759 [2,0,0,0,0,0|2,0,0]=4 3655 B4R0.2 BrCCCI Amb18090828 [2,0,0,0,0,0|2,0,0]=4 3656 B4R0.2 C#CCCC Amb3940495 [2,0,0,0,0,0|1,0,1]=4 3657 B4R0.2 C#CCCN Amb10975966 [2,0,0,0,0,0|0,0,2]=4 3658 B4R0.2 C#CCCN Amb18280234 [2,0,0,0,0,0|0,0,2]=4 3659 B4R0.2 C#CCCO Amb2685716 [2,0,0,0,0,0|1,0,1]=4 3660 B4R0.2 C#CCCO Amb34916688 [2,0,0,0,0,0|1,0,1]=4 3661 B4R0.2 C#NCCC Amb31132336 [2,0,0,0,0,0|2,0,0]=4 3662 B4R0.2 C=C=CCN Amb22411512 [2,0,0,0,0,0|0,0,2]=4 3663 B4R0.2 C=C=CCN Amb22586635 [2,0,0,0,0,0|0,0,2]=4 3664 B4R0.2 C=CCC=O Amb25058716 [2,0,0,0,0,0|0,0,2]=4 3665 B4R0.2 C=CCCBr Amb2684977 [2,0,0,0,0,0|1,0,1]=4 3666 B4R0.2 C=CCCC Amb8514606 [2,0,0,0,0,0|1,0,0]=3 3667 B4R0.2 C=CCCCl Amb22229725 [2,0,0,0,0,0|1,0,1]=4 3668 B4R0.2 C=CCCF Amb27869562 [2,0,0,0,0,0|1,0,1]=4 3669 B4R0.2 C=CCCI Amb33546459 [2,0,0,0,0,0|1,0,1]=4 3670 B4R0.2 C=CCCN Amb10601640 [2,0,0,0,0,0|0,0,1]=3 3671 B4R0.2 C=CCCN Amb33484127 [2,0,0,0,0,0|0,0,1]=3 3672 B4R0.2 C=CCCN Amb5717434 [2,0,0,0,0,0|0,0,1]=3 3673 B4R0.2 C=CCCO Amb6609024 [2,0,0,0,0,0|1,0,1]=4 3674 B4R0.2 C=CCC[NH3+] Amb5718705 [2,0,0,0,0,0|0,0,2]=4 3675 B4R0.2 C=CCNC Amb3940004 [2,0,0,0,0,0|2,0,0]=4 3676 B4R0.2 C=CCNN Amb10603954 [2,0,0,0,0,0|1,0,1]=4 3677 B4R0.2 C=CCNN Amb22886671 [2,0,0,0,0,0|1,0,1]=4 3678 B4R0.2 C=CCNN Amb28984064 [2,0,0,0,0,0|1,0,1]=4 3679 B4R0.2 C=CCON Amb20620193 [2,0,0,0,0,0|1,0,1]=4 3680 B4R0.2 C=CCON Amb3941699 [2,0,0,0,0,0|1,0,1]=4 3681 B4R0.2 C=CCSC Amb3940478 [2,0,0,0,0,0|2,0,0]=4 3682 B4R0.2 C=CNCC Amb24120592 [2,0,0,0,0,0|2,0,0]=4 3683 B4R0.2 C=COCC Amb2447619 [2,0,0,0,0,0|2,0,0]=4 3684 B4R0.2 C=CSCC Amb10604172 [2,0,0,0,0,0|2,0,0]=4 3685 B4R0.2 C=NCCO Amb27827243 [2,0,0,0,0,0|2,0,0]=4 3686 B4R0.2 CC#CC=O Amb24477088 [2,0,0,0,0,0|0,0,2]=4 3687 B4R0.2 CCCC#N Amb6662840 [2,0,0,0,0,0|1,0,1]=4 3688 B4R0.2 CCCC=O Amb3940026 [2,0,0,0,0,0|0,0,0]=2 3689 B4R0.2 CCCCBr Amb2795761 [2,0,0,0,0,0|1,0,1]=4 3690 B4R0.2 CCCCCl Amb3940273 [2,0,0,0,0,0|1,0,1]=4 3691 B4R0.2 CCCCF Amb2688075 [2,0,0,0,0,0|1,0,1]=4 3692 B4R0.2 CCCCI Amb4606011 [2,0,0,0,0,0|1,0,1]=4 3693 B4R0.2 CCCCN Amb22002333 [2,0,0,0,0,0|0,0,1]=3 3694 B4R0.2 CCCCN Amb3939832 [2,0,0,0,0,0|0,0,1]=3 3695 B4R0.2 CCCCO Amb2793053 [2,0,0,0,0,0|0,0,1]=3 3696 B4R0.2 CCCCS Amb8513452 [2,0,0,0,0,0|0,1,1]=4 3697 B4R0.2 CCCC[SiH3] Amb19883792 [2,0,0,0,0,0|1,0,1]=4 3698 B4R0.2 CCCNC Amb1125050 [2,0,0,0,0,0|2,0,0]=4 3699 B4R0.2 CCCNC Amb13951517 [2,0,0,0,0,0|2,0,0]=4 3700 B4R0.2 CCCNN Amb22490873 [2,0,0,0,0,0|1,0,1]=4 3701 B4R0.2 CCCNN Amb6246347 [2,0,0,0,0,0|1,0,1]=4 3702 B4R0.2 CCCNN Amb9147579 [2,0,0,0,0,0|1,0,1]=4 3703 B4R0.2 CCCOC Amb22227974 [2,0,0,0,0,0|2,0,0]=4 3704 B4R0.2 CCCON Amb21929105 [2,0,0,0,0,0|1,0,1]=4 3705 B4R0.2 CCCON Amb4061686 [2,0,0,0,0,0|1,0,1]=4 3706 B4R0.2 CCCSC Amb22045208 [2,0,0,0,0,0|2,0,0]=4 3707 B4R0.2 CCN=C=O Amb3939325 [2,0,0,0,0,0|1,0,1]=4 3708 B4R0.2 CCNC=O Amb22229692 [2,0,0,0,0,0|1,0,0]=3 3709 B4R0.2 CCNC=S Amb24476965 [2,0,0,0,0,0|1,1,0]=4 3710 B4R0.2 CCNCO Amb28048578 [2,0,0,0,0,0|1,0,1]=4 3711 B4R0.2 CCOC=O Amb3429671 [2,0,0,0,0,0|1,0,0]=3 3712 B4R0.2 CCOCO Amb25042105 [2,0,0,0,0,0|1,0,1]=4 3713 B4R0.2 CC\C=C/I Amb27985379 [2,0,0,0,0,0|1,0,1]=4 3714 B4R0.2 CC\C=C\Cl Amb25024567 [2,0,0,0,0,0|1,0,1]=4 3715 B4R0.2 CC\C=C\I Amb28346900 [2,0,0,0,0,0|1,0,1]=4 3716 B4R0.2 CC\C=N\O Amb24369620 [2,0,0,0,0,0|1,0,1]=4 3717 B4R0.2 CNCC=O Amb28133605 [2,0,0,0,0,0|1,0,0]=3 3718 B4R0.2 CNCCN Amb19958520 [2,0,0,0,0,0|1,0,1]=4 3719 B4R0.2 CNCCN Amb8513507 [2,0,0,0,0,0|1,0,1]=4 3720 B4R0.2 CNCCO Amb2793086 [2,0,0,0,0,0|1,0,1]=4 3721 B4R0.2 COCC=O Amb3941034 [2,0,0,0,0,0|1,0,0]=3 3722 B4R0.2 COCCN Amb3939058 [2,0,0,0,0,0|1,0,1]=4 3723 B4R0.2 COCCO Amb4605828 [2,0,0,0,0,0|1,0,1]=4 3724 B4R0.2 CPCCO Amb27594723 [2,0,0,0,0,0|1,0,1]=4 3725 B4R0.2 CSCC=O Amb27250514 [2,0,0,0,0,0|1,0,0]=3 3726 B4R0.2 CSCCN Amb2724163 [2,0,0,0,0,0|1,0,1]=4 3727 B4R0.2 CSCCN Amb6754152 [2,0,0,0,0,0|1,0,1]=4 3728 B4R0.2 CSCCO Amb3568993 [2,0,0,0,0,0|1,0,1]=4 3729 B4R0.2 C\C=C/CC Amb8517400 [2,0,0,0,0,0|1,0,1]=4 3730 B4R0.2 C\C=C\C=O Amb6891937 [2,0,0,0,0,0|0,0,2]=4 3731 B4R0.2 C\C=C\CC Amb9134767 [2,0,0,0,0,0|1,0,1]=4 3732 B4R0.2 C\C=C\CN Amb22490422 [2,0,0,0,0,0|1,0,1]=4 3733 B4R0.2 C\C=C\CN Amb32693433 [2,0,0,0,0,0|1,0,1]=4 3734 B4R0.2 C\N=C\C=O Amb27849988 [2,0,0,0,0,0|1,0,1]=4 3735 B4R0.2 ClCCCBr Amb6608966 [2,0,0,0,0,0|2,0,0]=4 3736 B4R0.2 ClCCCCl Amb2793083 [2,0,0,0,0,0|2,0,0]=4 3737 B4R0.2 ClCCCI Amb2686137 [2,0,0,0,0,0|2,0,0]=4 3738 B4R0.2 FCCCBr Amb10845700 [2,0,0,0,0,0|2,0,0]=4 3739 B4R0.2 FCCCF Amb10839359 [2,0,0,0,0,0|2,0,0]=4 3740 B4R0.2 FCCCI Amb10838561 [2,0,0,0,0,0|2,0,0]=4 3741 B4R0.2 FCCCS Amb28344639 [2,0,0,0,0,0|1,1,0]=4 3742 B4R0.2 ICCCI Amb8514578 [2,0,0,0,0,0|2,0,0]=4 3743 B4R0.2 N#CCC=O Amb9669129 [2,0,0,0,0,0|0,0,2]=4 3744 B4R0.2 N#CCCN Amb19516480 [2,0,0,0,0,0|1,0,1]=4 3745 B4R0.2 N#CCCN Amb2720712 [2,0,0,0,0,0|1,0,1]=4 3746 B4R0.2 N#CCCO Amb534940 [2,0,0,0,0,0|0,0,2]=4 3747 B4R0.2 NCCC=S Amb28366830 [2,0,0,0,0,0|0,1,0]=3 3748 B4R0.2 NCCCBr Amb22489540 [2,0,0,0,0,0|1,0,0]=3 3749 B4R0.2 NCCCBr Amb6609025 [2,0,0,0,0,0|1,0,0]=3 3750 B4R0.2 NCCCBr Amb932825 [2,0,0,0,0,0|1,0,0]=3 3751 B4R0.2 NCCCCl Amb2720482 [2,0,0,0,0,0|1,0,0]=3 3752 B4R0.2 NCCCCl Amb6306670 [2,0,0,0,0,0|1,0,0]=3 3753 B4R0.2 NCCCF Amb16186035 [2,0,0,0,0,0|1,0,0]=3 3754 B4R0.2 NCCCF Amb19374917 [2,0,0,0,0,0|1,0,0]=3 3755 B4R0.2 NCCCI Amb33249705 [2,0,0,0,0,0|1,0,0]=3 3756 B4R0.2 NCCCN Amb21953130 [2,0,0,0,0,0|1,0,0]=3 3757 B4R0.2 NCCCN Amb21953284 [2,0,0,0,0,0|1,0,0]=3 3758 B4R0.2 NCCCN Amb2793020 [2,0,0,0,0,0|1,0,0]=3 3759 B4R0.2 NCCCO Amb22229163 [2,0,0,0,0,0|0,0,0]=2 3760 B4R0.2 NCCCO Amb2793042 [2,0,0,0,0,0|0,0,0]=2 3761 B4R0.2 NCCCS Amb17500723 [2,0,0,0,0,0|0,1,0]=3 3762 B4R0.2 NCCCS Amb18368606 [2,0,0,0,0,0|0,1,0]=3 3763 B4R0.2 NCCCS Amb20623313 [2,0,0,0,0,0|0,1,0]=3 3764 B4R0.2 NCCNN Amb24117221 [2,0,0,0,0,0|2,0,0]=4 3765 B4R0.2 NCCNN Amb27440245 [2,0,0,0,0,0|2,0,0]=4 3766 B4R0.2 NCCNO Amb24476856 [2,0,0,0,0,0|1,0,0]=3 3767 B4R0.2 NCCON Amb19958432 [2,0,0,0,0,0|2,0,0]=4 3768 B4R0.2 NCCON Amb22054301 [2,0,0,0,0,0|2,0,0]=4 3769 B4R0.2 NCCON Amb22233863 [2,0,0,0,0,0|2,0,0]=4 3770 B4R0.2 NC\C=C/I Amb23539306 [2,0,0,0,0,0|1,0,1]=4 3771 B4R0.2 NC\C=C\Br Amb32660939 [2,0,0,0,0,0|1,0,1]=4 3772 B4R0.2 NC\C=C\Cl Amb30584669 [2,0,0,0,0,0|1,0,1]=4 3773 B4R0.2 NC\C=C\Cl Amb32992834 [2,0,0,0,0,0|1,0,1]=4 3774 B4R0.2 NC\C=N\O Amb27403432 [2,0,0,0,0,0|1,0,1]=4 3775 B4R0.2 NNCCCl Amb26362372 [2,0,0,0,0,0|2,0,0]=4 3776 B4R0.2 NNCCF Amb24351032 [2,0,0,0,0,0|2,0,0]=4 3777 B4R0.2 NNCCF Amb33527627 [2,0,0,0,0,0|2,0,0]=4 3778 B4R0.2 NNCCO Amb2695098 [2,0,0,0,0,0|1,0,0]=3 3779 B4R0.2 NOCCF Amb22008453 [2,0,0,0,0,0|2,0,0]=4 3780 B4R0.2 NOCCF Amb25858004 [2,0,0,0,0,0|2,0,0]=4 3781 B4R0.2 NOCCO Amb17190317 [2,0,0,0,0,0|1,0,0]=3 3782 B4R0.2 N[NH2+]CCO Amb27867172 [2,0,0,0,0,0|1,0,0]=3 3783 B4R0.2 N\C=C/C=O Amb25246630 [2,0,0,0,0,0|0,0,2]=4 3784 B4R0.2 N\C=C\C=O Amb33946746 [2,0,0,0,0,0|0,0,2]=4 3785 B4R0.2 O=CCC=O Amb33512721 [2,0,0,0,0,0|1,0,1]=4 3786 B4R0.2 O=CCCCl Amb16233605 [2,0,0,0,0,0|1,0,0]=3 3787 B4R0.2 O=CCCF Amb21858609 [2,0,0,0,0,0|1,0,0]=3 3788 B4R0.2 O=CCCI Amb26847605 [2,0,0,0,0,0|1,0,0]=3 3789 B4R0.2 O=CCCO Amb24412391 [2,0,0,0,0,0|1,0,0]=3 3790 B4R0.2 O=CCCS Amb27755008 [2,0,0,0,0,0|1,0,0]=3 3791 B4R0.2 O=CNCO Amb27754843 [2,0,0,0,0,0|2,0,0]=4 3792 B4R0.2 O=CNCS Amb27846487 [2,0,0,0,0,0|2,0,0]=4 3793 B4R0.2 OCCCBr Amb932815 [2,0,0,0,0,0|1,0,0]=3 3794 B4R0.2 OCCCCl Amb6608905 [2,0,0,0,0,0|1,0,0]=3 3795 B4R0.2 OCCCF Amb2688406 [2,0,0,0,0,0|1,0,0]=3 3796 B4R0.2 OCCCI Amb2688881 [2,0,0,0,0,0|1,0,0]=3 3797 B4R0.2 OCCCO Amb2793089 [2,0,0,0,0,0|1,0,0]=3 3798 B4R0.2 OCCCS Amb8517566 [2,0,0,0,0,0|1,0,0]=3 3799 B4R0.2 OCCNBr Amb27265947 [2,0,0,0,0,0|2,0,0]=4 3800 B4R0.2 OCCNCl Amb27206146 [2,0,0,0,0,0|2,0,0]=4 3801 B4R0.2 OCCNF Amb27775764 [2,0,0,0,0,0|2,0,0]=4 3802 B4R0.2 OCNCCl Amb16224807 [2,0,0,0,0,0|2,0,0]=4 3803 B4R0.2 OCNCO Amb2793034 [2,0,0,0,0,0|2,0,0]=4 3804 B4R0.2 OCOCCl Amb28280946 [2,0,0,0,0,0|2,0,0]=4 3805 B4R0.2 OCSCO Amb27812260 [2,0,0,0,0,0|2,0,0]=4 3806 B4R0.2 ONCCF Amb25931834 [2,0,0,0,0,0|2,0,0]=4 3807 B4R0.2 O\C=C\CCl Amb27449221 [2,0,0,0,0,0|1,0,1]=4 3808 B4R0.2 PCCCP Amb22227719 [2,0,0,0,0,0|1,1,0]=4 3809 B4R0.2 SCCCBr Amb22270209 [2,0,0,0,0,0|1,1,0]=4 3810 B4R0.2 SCCCS Amb7809241 [2,0,0,0,0,0|1,1,0]=4 3811 B4R0.2 [C-]#[N+]CCC Amb24117082 [2,0,0,0,0,0|2,0,0]=4 3812 B4R0.2 [C-]#[N+]CCN Amb28047270 [2,0,0,0,0,0|1,0,1]=4 3813 B4R0.2 [SiH3]CCCCl Amb28346288 [2,0,0,0,0,0|1,1,0]=4 3814 B6R0.1 C#CC(=O)CCC Amb25696103 [1,1,0,0,0,0|1,0,0]=3 3815 B6R0.1 C#CC(=O)COC Amb27794422 [1,1,0,0,0,0|2,0,0]=4 3816 B6R0.1 C#CC(=O)CSC Amb27667610 [1,1,0,0,0,0|2,0,0]=4 3817 B6R0.1 C#CC(=O)NCC Amb24057137 [1,1,0,0,0,0|2,0,0]=4 3818 B6R0.1 C#CC(=O)OCC Amb2182884 [1,1,0,0,0,0|2,0,0]=4 3819 B6R0.1 C#CC(O)CCC Amb4034577 [1,1,0,0,0,0|1,0,1]=4 3820 B6R0.1 C#CCC(=O)OC Amb5722531 [1,1,0,0,0,0|0,0,2]=4 3821 B6R0.1 C#C[C@@H](O)CCC Amb26381982 [1,1,0,0,0,0|1,0,1]=4 3822 B6R0.1 C#C[C@H](O)CCC Amb26865453 [1,1,0,0,0,0|1,0,1]=4 3823 B6R0.1 C=C(C=O)CCF Amb28253937 [1,1,0,0,0,0|2,0,0]=4 3824 B6R0.1 C=C(C=O)COC Amb28066424 [1,1,0,0,0,0|2,0,0]=4 3825 B6R0.1 C=C(C=O)SCC Amb28050273 [1,1,0,0,0,0|2,0,0]=4 3826 B6R0.1 C=C(CBr)CCC Amb26493276 [1,1,0,0,0,0|2,0,0]=4 3827 B6R0.1 C=C(CC)CCC Amb22228810 [1,1,0,0,0,0|2,0,0]=4 3828 B6R0.1 C=C(CC)CCN Amb27974991 [1,1,0,0,0,0|2,0,0]=4 3829 B6R0.1 C=C(CCC)OC Amb27433625 [1,1,0,0,0,0|1,0,0]=3 3830 B6R0.1 C=C(CCl)CCC Amb25871331 [1,1,0,0,0,0|2,0,0]=4 3831 B6R0.1 C=C(CF)CCN Amb33379259 [1,1,0,0,0,0|2,0,0]=4 3832 B6R0.1 C=C(CN)CCC Amb33204217 [1,1,0,0,0,0|2,0,0]=4 3833 B6R0.1 C=C(CO)CCN Amb24426567 [1,1,0,0,0,0|1,0,0]=3 3834 B6R0.1 C=C(CO)CCO Amb25825219 [1,1,0,0,0,0|2,0,0]=4 3835 B6R0.1 C=CC(=O)CCC Amb8630773 [1,1,0,0,0,0|1,0,0]=3 3836 B6R0.1 C=CC(=O)CCCl Amb24446646 [1,1,0,0,0,0|2,0,0]=4 3837 B6R0.1 C=CC(=O)CCF Amb33480698 [1,1,0,0,0,0|2,0,0]=4 3838 B6R0.1 C=CC(=O)COC Amb22168158 [1,1,0,0,0,0|2,0,0]=4 3839 B6R0.1 C=CC(=O)CSC Amb26974013 [1,1,0,0,0,0|2,0,0]=4 3840 B6R0.1 C=CC(=O)NCC Amb9480404 [1,1,0,0,0,0|2,0,0]=4 3841 B6R0.1 C=CC(=O)OCC Amb3941513 [1,1,0,0,0,0|2,0,0]=4 3842 B6R0.1 C=CC(O)CCC Amb22002474 [1,1,0,0,0,0|1,0,1]=4 3843 B6R0.1 CC#CC(=O)OC Amb2689389 [1,1,0,0,0,0|0,0,2]=4 3844 B6R0.1 CC(CO)CCN Amb17506270 [1,1,0,0,0,0|1,0,1]=4 3845 B6R0.1 CCC(=O)CCBr Amb27401869 [1,1,0,0,0,0|2,0,0]=4 3846 B6R0.1 CCC(=O)CCI Amb27232362 [1,1,0,0,0,0|2,0,0]=4 3847 B6R0.1 CCC(=O)CCN Amb18202790 [1,1,0,0,0,0|1,0,0]=3 3848 B6R0.1 CCC(=O)CCO Amb26872941 [1,1,0,0,0,0|2,0,0]=4 3849 B6R0.1 CCC(=O)CCS Amb24733984 [1,1,0,0,0,0|2,0,0]=4 3850 B6R0.1 CCC(=O)CNC Amb26408381 [1,1,0,0,0,0|2,0,0]=4 3851 B6R0.1 CCC(=O)CNC Amb32410106 [1,1,0,0,0,0|2,0,0]=4 3852 B6R0.1 CCC(=O)COC Amb19515551 [1,1,0,0,0,0|2,0,0]=4 3853 B6R0.1 CCC(=O)CSC Amb8393183 [1,1,0,0,0,0|2,0,0]=4 3854 B6R0.1 CCC(=O)OCN Amb27592382 [1,1,0,0,0,0|2,0,0]=4 3855 B6R0.1 CCC(O)CCN Amb9286193 [1,1,0,0,0,0|1,0,1]=4 3856 B6R0.1 CCCC(=N)NC Amb27254401 [1,1,0,0,0,0|2,0,0]=4 3857 B6R0.1 CCCC(=O)CBr Amb24433274 [1,1,0,0,0,0|1,0,0]=3 3858 B6R0.1 CCCC(=O)CC Amb8513390 [1,1,0,0,0,0|1,0,0]=3 3859 B6R0.1 CCCC(=O)CCl Amb19372924 [1,1,0,0,0,0|1,0,0]=3 3860 B6R0.1 CCCC(=O)CI Amb27876205 [1,1,0,0,0,0|1,0,0]=3 3861 B6R0.1 CCCC(=O)CN Amb17593086 [1,1,0,0,0,0|1,0,0]=3 3862 B6R0.1 CCCC(=O)CN Amb28827644 [1,1,0,0,0,0|1,0,0]=3 3863 B6R0.1 CCCC(=O)CO Amb25125092 [1,1,0,0,0,0|0,0,0]=2 3864 B6R0.1 CCCC(=O)NC Amb3886531 [1,1,0,0,0,0|1,0,0]=3 3865 B6R0.1 CCCC(=O)NN Amb6366352 [1,1,0,0,0,0|1,0,0]=3 3866 B6R0.1 CCCC(=O)NO Amb6260495 [1,1,0,0,0,0|0,0,0]=2 3867 B6R0.1 CCCC(=O)OC Amb8516697 [1,1,0,0,0,0|0,0,0]=2 3868 B6R0.1 CCCC(=O)SC Amb8393184 [1,1,0,0,0,0|0,1,0]=3 3869 B6R0.1 CCCC(=S)NC Amb27259343 [1,1,0,0,0,0|1,1,0]=4 3870 B6R0.1 CCCC(=S)OC Amb22043317 [1,1,0,0,0,0|0,1,0]=3 3871 B6R0.1 CCCC(C)C=O Amb3939898 [1,1,0,0,0,0|1,0,1]=4 3872 B6R0.1 CCCC(C)CO Amb8999036 [1,1,0,0,0,0|1,0,1]=4 3873 B6R0.1 CCCC(C)OC Amb26319305 [1,1,0,0,0,0|1,0,1]=4 3874 B6R0.1 CCCC(C)ON Amb24424249 [1,1,0,0,0,0|1,0,1]=4 3875 B6R0.1 CCCC(Cl)C=O Amb18124277 [1,1,0,0,0,0|1,0,1]=4 3876 B6R0.1 CCCC(Cl)CO Amb25950697 [1,1,0,0,0,0|1,0,1]=4 3877 B6R0.1 CCCC(I)CO Amb27268581 [1,1,0,0,0,0|1,0,1]=4 3878 B6R0.1 CCCC(N)CO Amb3940003 [1,1,0,0,0,0|1,0,1]=4 3879 B6R0.1 CCCC(O)C#N Amb9294949 [1,1,0,0,0,0|1,0,1]=4 3880 B6R0.1 CCCC(O)CBr Amb24365915 [1,1,0,0,0,0|1,0,1]=4 3881 B6R0.1 CCCC(O)CC Amb4037277 [1,1,0,0,0,0|1,0,1]=4 3882 B6R0.1 CCCC(O)CCl Amb24470722 [1,1,0,0,0,0|1,0,1]=4 3883 B6R0.1 CCCC(O)CF Amb26604826 [1,1,0,0,0,0|1,0,1]=4 3884 B6R0.1 CCCC(O)CN Amb8630337 [1,1,0,0,0,0|1,0,1]=4 3885 B6R0.1 CCCC(O)CO Amb8385613 [1,1,0,0,0,0|0,0,2]=4 3886 B6R0.1 CCCC(O)OC Amb27447501 [1,1,0,0,0,0|0,0,2]=4 3887 B6R0.1 CCCN(C)N=O Amb25231763 [1,1,0,0,0,0|2,0,0]=4 3888 B6R0.1 CCCN(N)C=O Amb18121867 [1,1,0,0,0,0|2,0,0]=4 3889 B6R0.1 CCCN(O)C#N Amb28196833 [1,1,0,0,0,0|2,0,0]=4 3890 B6R0.1 CCC[C@@H](C)CO Amb22823174 [1,1,0,0,0,0|1,0,1]=4 3891 B6R0.1 CCC[C@@H](N)CO Amb22756532 [1,1,0,0,0,0|1,0,1]=4 3892 B6R0.1 CCC[C@@H](N)CO Amb3941479 [1,1,0,0,0,0|1,0,1]=4 3893 B6R0.1 CCC[C@@H](O)CC Amb25781736 [1,1,0,0,0,0|1,0,1]=4 3894 B6R0.1 CCC[C@@H](O)CCl Amb22736025 [1,1,0,0,0,0|1,0,1]=4 3895 B6R0.1 CCC[C@@H](O)CN Amb24428580 [1,1,0,0,0,0|1,0,1]=4 3896 B6R0.1 CCC[C@H](C)C=O Amb28248332 [1,1,0,0,0,0|1,0,1]=4 3897 B6R0.1 CCC[C@H](C)CO Amb27423081 [1,1,0,0,0,0|1,0,1]=4 3898 B6R0.1 CCC[C@H](F)C=O Amb27644096 [1,1,0,0,0,0|1,0,1]=4 3899 B6R0.1 CCC[C@H](N)C=O Amb27488589 [1,1,0,0,0,0|1,0,1]=4 3900 B6R0.1 CCC[C@H](N)CO Amb33869036 [1,1,0,0,0,0|1,0,1]=4 3901 B6R0.1 CCC[C@H](N)CO Amb3941480 [1,1,0,0,0,0|1,0,1]=4 3902 B6R0.1 CCC[C@H](O)CC Amb26022373 [1,1,0,0,0,0|1,0,1]=4 3903 B6R0.1 CCC[C@H](O)CCl Amb22735942 [1,1,0,0,0,0|1,0,1]=4 3904 B6R0.1 CCC[C@H](O)CF Amb28348521 [1,1,0,0,0,0|1,0,1]=4 3905 B6R0.1 CCC[C@H](O)CN Amb33204239 [1,1,0,0,0,0|1,0,1]=4 3906 B6R0.1 CCC\C(C)=N\O Amb24693854 [1,1,0,0,0,0|1,0,0]=3 3907 B6R0.1 CCC\C(Cl)=N\O Amb27829565 [1,1,0,0,0,0|1,0,0]=3 3908 B6R0.1 CCC\C(N)=N\N Amb2696446 [1,1,0,0,0,0|2,0,0]=4 3909 B6R0.1 CCC\C(N)=N\O Amb19890174 [1,1,0,0,0,0|1,0,0]=3 3910 B6R0.1 CCC\C(N)=N\O Amb2724965 [1,1,0,0,0,0|1,0,0]=3 3911 B6R0.1 CCNC(=O)CBr Amb2090261 [1,1,0,0,0,0|2,0,0]=4 3912 B6R0.1 CCNC(=O)CC Amb3886529 [1,1,0,0,0,0|2,0,0]=4 3913 B6R0.1 CCNC(=O)CCl Amb1643925 [1,1,0,0,0,0|2,0,0]=4 3914 B6R0.1 CCNC(=O)CF Amb28316230 [1,1,0,0,0,0|2,0,0]=4 3915 B6R0.1 CCNC(=O)CI Amb23512617 [1,1,0,0,0,0|2,0,0]=4 3916 B6R0.1 CCNC(=O)CN Amb21956656 [1,1,0,0,0,0|2,0,0]=4 3917 B6R0.1 CCNC(=O)CN Amb426696 [1,1,0,0,0,0|2,0,0]=4 3918 B6R0.1 CCNC(=O)CO Amb9421415 [1,1,0,0,0,0|1,0,0]=3 3919 B6R0.1 CCNC(=O)NC Amb24120627 [1,1,0,0,0,0|2,0,0]=4 3920 B6R0.1 CCNC(=O)NN Amb8854035 [1,1,0,0,0,0|2,0,0]=4 3921 B6R0.1 CCNC(=O)NO Amb28345704 [1,1,0,0,0,0|1,0,0]=3 3922 B6R0.1 CCNC(=O)OC Amb22734099 [1,1,0,0,0,0|1,0,0]=3 3923 B6R0.1 CCN\C(C)=N\O Amb28429781 [1,1,0,0,0,0|2,0,0]=4 3924 B6R0.1 CCOC(=N)CO Amb17593094 [1,1,0,0,0,0|2,0,0]=4 3925 B6R0.1 CCOC(=O)C#N Amb8513165 [1,1,0,0,0,0|2,0,0]=4 3926 B6R0.1 CCOC(=O)C=O Amb8394919 [1,1,0,0,0,0|1,0,1]=4 3927 B6R0.1 CCOC(=O)CBr Amb2687783 [1,1,0,0,0,0|2,0,0]=4 3928 B6R0.1 CCOC(=O)CC Amb8513446 [1,1,0,0,0,0|2,0,0]=4 3929 B6R0.1 CCOC(=O)CCl Amb3941486 [1,1,0,0,0,0|2,0,0]=4 3930 B6R0.1 CCOC(=O)CF Amb2687849 [1,1,0,0,0,0|2,0,0]=4 3931 B6R0.1 CCOC(=O)CI Amb8514613 [1,1,0,0,0,0|2,0,0]=4 3932 B6R0.1 CCOC(=O)CN Amb2697340 [1,1,0,0,0,0|2,0,0]=4 3933 B6R0.1 CCOC(=O)CN Amb8513174 [1,1,0,0,0,0|2,0,0]=4 3934 B6R0.1 CCOC(=O)CO Amb3939196 [1,1,0,0,0,0|1,0,0]=3 3935 B6R0.1 CCOC(=O)CS Amb6608734 [1,1,0,0,0,0|1,1,0]=4 3936 B6R0.1 CCOC(=O)C[NH3+] Amb24113741 [1,1,0,0,0,0|2,0,0]=4 3937 B6R0.1 CCOC(=O)NC Amb8516631 [1,1,0,0,0,0|2,0,0]=4 3938 B6R0.1 CCOC(=O)NCl Amb24381604 [1,1,0,0,0,0|2,0,0]=4 3939 B6R0.1 CCOC(=O)NN Amb2780496 [1,1,0,0,0,0|2,0,0]=4 3940 B6R0.1 CCOC(=O)NO Amb8384324 [1,1,0,0,0,0|1,0,0]=3 3941 B6R0.1 CCOC(=O)OC Amb22732530 [1,1,0,0,0,0|1,0,0]=3 3942 B6R0.1 CCO[PH](=O)OC Amb27961218 [1,1,0,0,0,0|2,0,0]=4 3943 B6R0.1 CCO\C(C)=N/O Amb5719848 [1,1,0,0,0,0|2,0,0]=4 3944 B6R0.1 CCO\C(C)=N\O Amb28050479 [1,1,0,0,0,0|2,0,0]=4 3945 B6R0.1 CCS(=O)CCN Amb18290914 [1,1,0,0,0,0|2,0,0]=4 3946 B6R0.1 CCS(=O)CCN Amb19373585 [1,1,0,0,0,0|2,0,0]=4 3947 B6R0.1 CCSC(=O)C=O Amb27403471 [1,1,0,0,0,0|1,0,1]=4 3948 B6R0.1 CCSC(=O)CC Amb22043397 [1,1,0,0,0,0|2,0,0]=4 3949 B6R0.1 CCSC(=O)NC Amb28368964 [1,1,0,0,0,0|2,0,0]=4 3950 B6R0.1 CCSC(=S)OC Amb28280041 [1,1,0,0,0,0|1,1,0]=4 3951 B6R0.1 CC[C@@H](O)CCN Amb26633884 [1,1,0,0,0,0|1,0,1]=4 3952 B6R0.1 CC[C@H](O)CCN Amb25284469 [1,1,0,0,0,0|1,0,1]=4 3953 B6R0.1 CC\C=C(/C)C=O Amb3940425 [1,1,0,0,0,0|1,0,1]=4 3954 B6R0.1 CC\C=C(/C)CO Amb22347713 [1,1,0,0,0,0|1,0,1]=4 3955 B6R0.1 CC\C=C(/Cl)C=O Amb28050393 [1,1,0,0,0,0|1,0,1]=4 3956 B6R0.1 CC\C=C(/O)C=O Amb27849683 [1,1,0,0,0,0|0,0,1]=3 3957 B6R0.1 CC\C=C(\C)CO Amb24677771 [1,1,0,0,0,0|1,0,1]=4 3958 B6R0.1 CC\C=C(\O)C=O Amb27195226 [1,1,0,0,0,0|0,0,1]=3 3959 B6R0.1 CNC(=N)CCN Amb27445460 [1,1,0,0,0,0|2,0,0]=4 3960 B6R0.1 CNC(=O)CCBr Amb17332890 [1,1,0,0,0,0|2,0,0]=4 3961 B6R0.1 CNC(=O)CCCl Amb1130566 [1,1,0,0,0,0|2,0,0]=4 3962 B6R0.1 CNC(=O)CCN Amb1139824 [1,1,0,0,0,0|1,0,0]=3 3963 B6R0.1 CNC(=O)CCN Amb6893005 [1,1,0,0,0,0|1,0,0]=3 3964 B6R0.1 CNC(=O)CCO Amb10608414 [1,1,0,0,0,0|2,0,0]=4 3965 B6R0.1 CNC(=O)CCS Amb25727705 [1,1,0,0,0,0|2,0,0]=4 3966 B6R0.1 CNC(=O)CNN Amb24744455 [1,1,0,0,0,0|2,0,0]=4 3967 B6R0.1 CNC(=O)COC Amb22275885 [1,1,0,0,0,0|2,0,0]=4 3968 B6R0.1 CNC(=O)CON Amb22740185 [1,1,0,0,0,0|2,0,0]=4 3969 B6R0.1 CNCC(=O)CF Amb33377251 [1,1,0,0,0,0|2,0,0]=4 3970 B6R0.1 CNCC(=O)NC Amb2371052 [1,1,0,0,0,0|2,0,0]=4 3971 B6R0.1 CNCC(=O)NC Amb423473 [1,1,0,0,0,0|2,0,0]=4 3972 B6R0.1 CNCC(=O)NN Amb16186920 [1,1,0,0,0,0|2,0,0]=4 3973 B6R0.1 CNCC(=O)NN Amb32667538 [1,1,0,0,0,0|2,0,0]=4 3974 B6R0.1 CNCC(=O)OC Amb1153975 [1,1,0,0,0,0|1,0,0]=3 3975 B6R0.1 CNCC(=O)OC Amb2371116 [1,1,0,0,0,0|1,0,0]=3 3976 B6R0.1 CNC\C(N)=N\O Amb24648670 [1,1,0,0,0,0|2,0,0]=4 3977 B6R0.1 CNNC(=O)OC Amb22411352 [1,1,0,0,0,0|2,0,0]=4 3978 B6R0.1 COC(=N)CCBr Amb27478260 [1,1,0,0,0,0|2,0,0]=4 3979 B6R0.1 COC(=N)CCCl Amb19958799 [1,1,0,0,0,0|2,0,0]=4 3980 B6R0.1 COC(=N)CCCl Amb22234673 [1,1,0,0,0,0|2,0,0]=4 3981 B6R0.1 COC(=N)CCO Amb17593095 [1,1,0,0,0,0|2,0,0]=4 3982 B6R0.1 COC(=O)CC#N Amb3940296 [1,1,0,0,0,0|0,0,2]=4 3983 B6R0.1 COC(=O)CC=O Amb18199826 [1,1,0,0,0,0|1,0,1]=4 3984 B6R0.1 COC(=O)CCBr Amb3940216 [1,1,0,0,0,0|1,0,0]=3 3985 B6R0.1 COC(=O)CCCl Amb8387395 [1,1,0,0,0,0|1,0,0]=3 3986 B6R0.1 COC(=O)CCI Amb24442243 [1,1,0,0,0,0|1,0,0]=3 3987 B6R0.1 COC(=O)CCN Amb1105940 [1,1,0,0,0,0|0,0,0]=2 3988 B6R0.1 COC(=O)CCN Amb2605985 [1,1,0,0,0,0|0,0,0]=2 3989 B6R0.1 COC(=O)CCO Amb8855137 [1,1,0,0,0,0|1,0,0]=3 3990 B6R0.1 COC(=O)CCS Amb2725528 [1,1,0,0,0,0|1,0,0]=3 3991 B6R0.1 COC(=O)CON Amb18640433 [1,1,0,0,0,0|1,0,0]=3 3992 B6R0.1 COC(=O)CON Amb29848090 [1,1,0,0,0,0|1,0,0]=3 3993 B6R0.1 COC(=O)CSC Amb2689527 [1,1,0,0,0,0|1,0,0]=3 3994 B6R0.1 COC(=O)OCCl Amb20623618 [1,1,0,0,0,0|2,0,0]=4 3995 B6R0.1 COC(=O)OCI Amb35753057 [1,1,0,0,0,0|2,0,0]=4 3996 B6R0.1 COC(=O)\C=C\N Amb8386481 [1,1,0,0,0,0|0,0,2]=4 3997 B6R0.1 COC(C)CCN Amb21961545 [1,1,0,0,0,0|1,0,1]=4 3998 B6R0.1 COC(C)CCN Amb33537917 [1,1,0,0,0,0|1,0,1]=4 3999 B6R0.1 COCC(=N)NO Amb21858420 [1,1,0,0,0,0|2,0,0]=4 4000 B6R0.1 COCC(=N)OC Amb28989427 [1,1,0,0,0,0|2,0,0]=4 4001 B6R0.1 COCC(=O)CCl Amb24523799 [1,1,0,0,0,0|2,0,0]=4 4002 B6R0.1 COCC(=O)CI Amb27414026 [1,1,0,0,0,0|2,0,0]=4 4003 B6R0.1 COCC(=O)CN Amb18833134 [1,1,0,0,0,0|2,0,0]=4 4004 B6R0.1 COCC(=O)NN Amb6548366 [1,1,0,0,0,0|2,0,0]=4 4005 B6R0.1 COCC(=O)OC Amb8513624 [1,1,0,0,0,0|1,0,0]=3 4006 B6R0.1 COC[C@@H](O)C=O Amb28132745 [1,1,0,0,0,0|1,0,1]=4 4007 B6R0.1 COC[C@H](O)C=O Amb27838256 [1,1,0,0,0,0|1,0,1]=4 4008 B6R0.1 COC\C(N)=N\O Amb8384549 [1,1,0,0,0,0|2,0,0]=4 4009 B6R0.1 CON(C)CCN Amb33292431 [1,1,0,0,0,0|2,0,0]=4 4010 B6R0.1 CON(C)CCN Amb8010468 [1,1,0,0,0,0|2,0,0]=4 4011 B6R0.1 CONC(=O)CO Amb28344874 [1,1,0,0,0,0|2,0,0]=4 4012 B6R0.1 COS(=O)CCBr Amb27403603 [1,1,0,0,0,0|2,0,0]=4 4013 B6R0.1 CO[PH](=O)CCBr Amb27657609 [1,1,0,0,0,0|2,0,0]=4 4014 B6R0.1 CO\C=C(/O)C=O Amb27797385 [1,1,0,0,0,0|1,0,1]=4 4015 B6R0.1 CSC(=O)CCO Amb27662309 [1,1,0,0,0,0|1,1,0]=4 4016 B6R0.1 CSCC(=O)CCl Amb25965373 [1,1,0,0,0,0|2,0,0]=4 4017 B6R0.1 CSCC(=O)CN Amb33225415 [1,1,0,0,0,0|2,0,0]=4 4018 B6R0.1 CSCC(=O)NN Amb22058723 [1,1,0,0,0,0|2,0,0]=4 4019 B6R0.1 CSCC(=O)NO Amb28057751 [1,1,0,0,0,0|1,0,0]=3 4020 B6R0.1 CSCC(O)C=O Amb27438538 [1,1,0,0,0,0|1,0,1]=4 4021 B6R0.1 CSC\C(N)=N\O Amb8385720 [1,1,0,0,0,0|2,0,0]=4 4022 B6R0.1 C[C@@H](CO)CCN Amb22801706 [1,1,0,0,0,0|1,0,1]=4 4023 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [1,1,0,0,0,0|1,0,0]=3 4024 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [1,1,0,0,0,0|1,0,0]=3 4025 B6R0.1 C\C(=C/N)CCN Amb27668659 [1,1,0,0,0,0|2,0,0]=4 4026 B6R0.1 C\C(CCCl)=N/O Amb27832450 [1,1,0,0,0,0|2,0,0]=4 4027 B6R0.1 C\C=C(/C)CCC Amb25744974 [1,1,0,0,0,0|2,0,0]=4 4028 B6R0.1 C\C=C(/C)CCN Amb18639509 [1,1,0,0,0,0|2,0,0]=4 4029 B6R0.1 C\C=C\C(=O)OC Amb8513568 [1,1,0,0,0,0|0,0,2]=4 4030 B6R0.1 N=C(CCO)NO Amb22491265 [1,1,0,0,0,0|2,0,0]=4 4031 B6R0.1 NCC(=O)CCF Amb26604148 [1,1,0,0,0,0|2,0,0]=4 4032 B6R0.1 NCCC(=O)CF Amb33377162 [1,1,0,0,0,0|1,0,0]=3 4033 B6R0.1 NCCC(=O)CN Amb18121893 [1,1,0,0,0,0|1,0,0]=3 4034 B6R0.1 NCCC(=O)NN Amb18559344 [1,1,0,0,0,0|1,0,0]=3 4035 B6R0.1 NCCC(=O)NO Amb33543073 [1,1,0,0,0,0|0,0,0]=2 4036 B6R0.1 NCCC(O)C=O Amb25682881 [1,1,0,0,0,0|0,0,1]=3 4037 B6R0.1 NCCC(O)CF Amb27862042 [1,1,0,0,0,0|1,0,1]=4 4038 B6R0.1 NCCC(O)CO Amb22232096 [1,1,0,0,0,0|0,0,2]=4 4039 B6R0.1 NCCC(O)CS Amb29854733 [1,1,0,0,0,0|0,1,1]=4 4040 B6R0.1 NCCS(=O)CCl Amb27413858 [1,1,0,0,0,0|2,0,0]=4 4041 B6R0.1 NCC[C@@H](O)CF Amb33377447 [1,1,0,0,0,0|1,0,1]=4 4042 B6R0.1 NCC[C@@H](O)CO Amb27759820 [1,1,0,0,0,0|0,0,2]=4 4043 B6R0.1 NCC[C@@H](O)CO Amb33331046 [1,1,0,0,0,0|0,0,2]=4 4044 B6R0.1 NCC[C@H](O)CF Amb33377446 [1,1,0,0,0,0|1,0,1]=4 4045 B6R0.1 NCC[C@H](O)CO Amb25804401 [1,1,0,0,0,0|0,0,2]=4 4046 B6R0.1 NCC[C@H](O)CO Amb33331041 [1,1,0,0,0,0|0,0,2]=4 4047 B6R0.1 NCC\C(N)=N\O Amb24761482 [1,1,0,0,0,0|1,0,0]=3 4048 B6R0.1 NNC(=O)CCO Amb20622339 [1,1,0,0,0,0|2,0,0]=4 4049 B6R0.1 NNC(=O)CCS Amb20622690 [1,1,0,0,0,0|2,0,0]=4 4050 B6R0.1 NNC(=O)CON Amb27956110 [1,1,0,0,0,0|2,0,0]=4 4051 B6R0.1 NNC(=O)CON Amb32671494 [1,1,0,0,0,0|2,0,0]=4 4052 B6R0.1 N\C(CCCl)=N/O Amb2695182 [1,1,0,0,0,0|2,0,0]=4 4053 B6R0.1 N\C(CCO)=N/O Amb1113605 [1,1,0,0,0,0|2,0,0]=4 4054 B6R0.1 O=C(CBr)CCBr Amb26567374 [1,1,0,0,0,0|2,0,0]=4 4055 B6R0.1 O=C(CBr)CCCl Amb27984732 [1,1,0,0,0,0|2,0,0]=4 4056 B6R0.1 O=C(CCBr)NO Amb28195718 [1,1,0,0,0,0|1,0,0]=3 4057 B6R0.1 O=C(CCCl)NO Amb25865278 [1,1,0,0,0,0|1,0,0]=3 4058 B6R0.1 O=C(CCl)CCCl Amb22395038 [1,1,0,0,0,0|2,0,0]=4 4059 B6R0.1 O=C(CCl)CCF Amb33413998 [1,1,0,0,0,0|2,0,0]=4 4060 B6R0.1 O=C(CF)CCF Amb28424077 [1,1,0,0,0,0|2,0,0]=4 4061 B6R0.1 O=C(CO)CCO Amb10603377 [1,1,0,0,0,0|1,0,0]=3 4062 B6R0.1 O=C(CO)NCO Amb27593459 [1,1,0,0,0,0|2,0,0]=4 4063 B6R0.1 O=C(NO)OCCl Amb29886186 [1,1,0,0,0,0|2,0,0]=4 4064 B6R0.1 O=CC(=O)CCO Amb28050238 [1,1,0,0,0,0|1,0,1]=4 4065 B6R0.1 O=CC(O)CCBr Amb27838276 [1,1,0,0,0,0|1,0,1]=4 4066 B6R0.1 O=CC(O)CCO Amb27955546 [1,1,0,0,0,0|1,0,1]=4 4067 B6R0.1 O=C[C@H](O)CCBr Amb28399793 [1,1,0,0,0,0|1,0,1]=4 4068 B6R0.1 [C-]#[N+]CC(=O)OC Amb2697203 [1,1,0,0,0,0|1,0,1]=4 4069 B6R0.2 C=C(Br)CC(C)C Amb22583739 [1,1,0,0,0,0|2,0,0]=4 4070 B6R0.2 C=C(C)CC(=O)O Amb6278832 [1,1,0,0,0,0|0,0,1]=3 4071 B6R0.2 C=C(C)CC(C)=O Amb17593075 [1,1,0,0,0,0|1,0,1]=4 4072 B6R0.2 C=C(C)CC(C)Br Amb24365286 [1,1,0,0,0,0|2,0,0]=4 4073 B6R0.2 C=C(C)CC(C)C Amb4019530 [1,1,0,0,0,0|2,0,0]=4 4074 B6R0.2 C=C(C)CC(C)Cl Amb24558200 [1,1,0,0,0,0|2,0,0]=4 4075 B6R0.2 C=C(C)CC(C)O Amb17593083 [1,1,0,0,0,0|2,0,0]=4 4076 B6R0.2 C=C(C)C[C@@H](C)N Amb33199541 [1,1,0,0,0,0|2,0,0]=4 4077 B6R0.2 C=C(C)C[C@@H](C)O Amb25888510 [1,1,0,0,0,0|2,0,0]=4 4078 B6R0.2 C=C(C)C[C@H](C)N Amb33199534 [1,1,0,0,0,0|2,0,0]=4 4079 B6R0.2 C=C(C)C[C@H](C)O Amb27466720 [1,1,0,0,0,0|2,0,0]=4 4080 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [1,1,0,0,0,0|0,0,2]=4 4081 B6R0.2 C=C(Cl)CC(C)Cl Amb28396615 [1,1,0,0,0,0|2,0,0]=4 4082 B6R0.2 C=C(I)CC(=O)O Amb27598435 [1,1,0,0,0,0|0,0,2]=4 4083 B6R0.2 CC(=O)CC(=O)F Amb28122452 [1,1,0,0,0,0|1,0,1]=4 4084 B6R0.2 CC(=O)CC(=O)O Amb377432 [1,1,0,0,0,0|0,0,1]=3 4085 B6R0.2 CC(=O)CC(=O)[O-] Amb31031013 [1,1,0,0,0,0|0,0,2]=4 4086 B6R0.2 CC(=O)CC(C)=O Amb2716228 [1,1,0,0,0,0|1,0,1]=4 4087 B6R0.2 CC(=O)CC(C)=S Amb28381251 [1,1,0,0,0,0|1,0,1]=4 4088 B6R0.2 CC(=O)CC(C)C Amb4605990 [1,1,0,0,0,0|1,0,0]=3 4089 B6R0.2 CC(=O)CC(C)Cl Amb17593234 [1,1,0,0,0,0|1,0,0]=3 4090 B6R0.2 CC(=O)CC(C)N Amb22587050 [1,1,0,0,0,0|1,0,0]=3 4091 B6R0.2 CC(=O)CC(C)N Amb2583230 [1,1,0,0,0,0|1,0,0]=3 4092 B6R0.2 CC(=O)CC(C)O Amb17593091 [1,1,0,0,0,0|1,0,0]=3 4093 B6R0.2 CC(=O)CC(C)S Amb24600676 [1,1,0,0,0,0|1,0,0]=3 4094 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [1,1,0,0,0,0|1,0,0]=3 4095 B6R0.2 CC(=O)CC(F)F Amb24669174 [1,1,0,0,0,0|2,0,0]=4 4096 B6R0.2 CC(=O)CC(N)=O Amb6608777 [1,1,0,0,0,0|1,0,1]=4 4097 B6R0.2 CC(=O)CN(C)C Amb9217324 [1,1,0,0,0,0|2,0,0]=4 4098 B6R0.2 CC(=O)C[C@@H](C)N Amb27493422 [1,1,0,0,0,0|1,0,0]=3 4099 B6R0.2 CC(=O)C[C@H](C)N Amb27222720 [1,1,0,0,0,0|1,0,0]=3 4100 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [1,1,0,0,0,0|1,0,1]=4 4101 B6R0.2 CC(=O)C[S+](C)Cl Amb27835653 [1,1,0,0,0,0|2,0,0]=4 4102 B6R0.2 CC(=O)NC(C)Br Amb27444682 [1,1,0,0,0,0|2,0,0]=4 4103 B6R0.2 CC(=O)NC(C)C Amb3366263 [1,1,0,0,0,0|2,0,0]=4 4104 B6R0.2 CC(=O)NC(C)N Amb27468729 [1,1,0,0,0,0|2,0,0]=4 4105 B6R0.2 CC(=O)OC(C)Br Amb19958925 [1,1,0,0,0,0|2,0,0]=4 4106 B6R0.2 CC(=O)OC(C)C Amb3940484 [1,1,0,0,0,0|2,0,0]=4 4107 B6R0.2 CC(=O)OC(C)Cl Amb24058273 [1,1,0,0,0,0|2,0,0]=4 4108 B6R0.2 CC(=O)OC(C)N Amb27184949 [1,1,0,0,0,0|2,0,0]=4 4109 B6R0.2 CC(=O)OC(C)O Amb27457187 [1,1,0,0,0,0|2,0,0]=4 4110 B6R0.2 CC(=S)CC(=O)O Amb28067768 [1,1,0,0,0,0|0,0,1]=3 4111 B6R0.2 CC(Br)CC(=O)O Amb8517108 [1,1,0,0,0,0|0,0,0]=2 4112 B6R0.2 CC(C)=CC(=O)O Amb1485519 [1,1,0,0,0,0|0,0,2]=4 4113 B6R0.2 CC(C)CB(O)O Amb2447316 [1,1,0,0,0,0|1,0,1]=4 4114 B6R0.2 CC(C)CC(=N)N Amb10066934 [1,1,0,0,0,0|2,0,0]=4 4115 B6R0.2 CC(C)CC(=N)N Amb2696279 [1,1,0,0,0,0|2,0,0]=4 4116 B6R0.2 CC(C)CC(=O)Br Amb26486664 [1,1,0,0,0,0|1,0,0]=3 4117 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [1,1,0,0,0,0|1,0,0]=3 4118 B6R0.2 CC(C)CC(=O)F Amb32667643 [1,1,0,0,0,0|1,0,0]=3 4119 B6R0.2 CC(C)CC(=O)O Amb3939848 [1,1,0,0,0,0|0,0,0]=2 4120 B6R0.2 CC(C)CC(C)O Amb6608920 [1,1,0,0,0,0|1,0,1]=4 4121 B6R0.2 CC(C)CC(N)=O Amb2722931 [1,1,0,0,0,0|1,0,0]=3 4122 B6R0.2 CC(C)CC(N)=S Amb6246355 [1,1,0,0,0,0|1,1,0]=4 4123 B6R0.2 CC(C)CC(N)O Amb28383510 [1,1,0,0,0,0|1,0,1]=4 4124 B6R0.2 CC(C)CC(O)O Amb27207854 [1,1,0,0,0,0|0,0,2]=4 4125 B6R0.2 CC(C)CN(C)O Amb33360311 [1,1,0,0,0,0|2,0,0]=4 4126 B6R0.2 CC(C)CS(=O)Cl Amb26409520 [1,1,0,0,0,0|2,0,0]=4 4127 B6R0.2 CC(C)CS(=O)[O-] Amb19930010 [1,1,0,0,0,0|1,0,1]=4 4128 B6R0.2 CC(C)CS(C)=O Amb27972160 [1,1,0,0,0,0|2,0,0]=4 4129 B6R0.2 CC(C)CS(N)=O Amb24527860 [1,1,0,0,0,0|2,0,0]=4 4130 B6R0.2 CC(C)C[C@@H](C)O Amb8517525 [1,1,0,0,0,0|1,0,1]=4 4131 B6R0.2 CC(C)C[C@H](C)O Amb8517526 [1,1,0,0,0,0|1,0,1]=4 4132 B6R0.2 CC(C)C[N+](=O)[O-] Amb17672613 [1,1,0,0,0,0|1,0,1]=4 4133 B6R0.2 CC(C)NC(=O)Cl Amb27780560 [1,1,0,0,0,0|2,0,0]=4 4134 B6R0.2 CC(C)NC(=O)S Amb27817487 [1,1,0,0,0,0|1,1,0]=4 4135 B6R0.2 CC(C)NC(N)=O Amb1104587 [1,1,0,0,0,0|2,0,0]=4 4136 B6R0.2 CC(C)OC(=O)Cl Amb3941687 [1,1,0,0,0,0|2,0,0]=4 4137 B6R0.2 CC(C)OC(N)=O Amb4017684 [1,1,0,0,0,0|2,0,0]=4 4138 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [1,1,0,0,0,0|2,0,0]=4 4139 B6R0.2 CC(Cl)CC(=O)Cl Amb28343061 [1,1,0,0,0,0|1,0,0]=3 4140 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [1,1,0,0,0,0|0,0,0]=2 4141 B6R0.2 CC(Cl)NC(N)=O Amb28130611 [1,1,0,0,0,0|2,0,0]=4 4142 B6R0.2 CC(Cl)OC(=O)Cl Amb6608999 [1,1,0,0,0,0|2,0,0]=4 4143 B6R0.2 CC(I)CC(=O)O Amb28398380 [1,1,0,0,0,0|0,0,0]=2 4144 B6R0.2 CC(N)CC(=O)O Amb8379759 [1,1,0,0,0,0|0,0,0]=2 4145 B6R0.2 CC(N)CC(=O)S Amb27413857 [1,1,0,0,0,0|0,1,0]=3 4146 B6R0.2 CC(N)CC(C)O Amb18640217 [1,1,0,0,0,0|1,0,1]=4 4147 B6R0.2 CC(N)CC(N)=O Amb18281237 [1,1,0,0,0,0|1,0,0]=3 4148 B6R0.2 CC(N)CC(N)=O Amb33532770 [1,1,0,0,0,0|1,0,0]=3 4149 B6R0.2 CC(N)CS(C)=O Amb33546327 [1,1,0,0,0,0|2,0,0]=4 4150 B6R0.2 CC(O)CC(=O)O Amb8513187 [1,1,0,0,0,0|0,0,0]=2 4151 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [1,1,0,0,0,0|0,0,1]=3 4152 B6R0.2 CC(O)CC(C)F Amb28065744 [1,1,0,0,0,0|1,0,1]=4 4153 B6R0.2 CC(O)CC(C)O Amb10068523 [1,1,0,0,0,0|1,0,1]=4 4154 B6R0.2 CC(O)CC(C)S Amb24122653 [1,1,0,0,0,0|1,0,1]=4 4155 B6R0.2 CC(O)CC(N)=O Amb26394320 [1,1,0,0,0,0|1,0,0]=3 4156 B6R0.2 CC(O)CC(N)=S Amb24479794 [1,1,0,0,0,0|1,1,0]=4 4157 B6R0.2 CC(O)CS(C)=O Amb28137235 [1,1,0,0,0,0|2,0,0]=4 4158 B6R0.2 CC(O)C[N+](=O)[O-] Amb9678341 [1,1,0,0,0,0|1,0,1]=4 4159 B6R0.2 CC(S)CC(=O)O Amb33538201 [1,1,0,0,0,0|0,0,0]=2 4160 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [1,1,0,0,0,0|2,0,0]=4 4161 B6R0.2 CN(C)CC(=O)Cl Amb3939582 [1,1,0,0,0,0|2,0,0]=4 4162 B6R0.2 CN(C)CC(=O)O Amb3319051 [1,1,0,0,0,0|1,0,0]=3 4163 B6R0.2 CN(C)CC(=O)O Amb3940366 [1,1,0,0,0,0|1,0,0]=3 4164 B6R0.2 CN(C)CC(N)=O Amb17231806 [1,1,0,0,0,0|2,0,0]=4 4165 B6R0.2 CN(C)CC(N)=O Amb33321491 [1,1,0,0,0,0|2,0,0]=4 4166 B6R0.2 CN(N)CC(=O)O Amb23592296 [1,1,0,0,0,0|1,0,0]=3 4167 B6R0.2 CN(O)CC(=O)O Amb29838290 [1,1,0,0,0,0|1,0,0]=3 4168 B6R0.2 CS(=O)CC(N)=O Amb24394100 [1,1,0,0,0,0|2,0,0]=4 4169 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [1,1,0,0,0,0|0,0,0]=2 4170 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [1,1,0,0,0,0|0,0,0]=2 4171 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [1,1,0,0,0,0|0,0,0]=2 4172 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [1,1,0,0,0,0|0,0,0]=2 4173 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [1,1,0,0,0,0|0,0,0]=2 4174 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [1,1,0,0,0,0|0,0,1]=3 4175 B6R0.2 C[C@@H](O)CS(C)=O Amb27457390 [1,1,0,0,0,0|2,0,0]=4 4176 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [1,1,0,0,0,0|0,0,0]=2 4177 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [1,1,0,0,0,0|0,0,0]=2 4178 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [1,1,0,0,0,0|0,0,0]=2 4179 B6R0.2 C[C@H](N)CC(N)=O Amb27873963 [1,1,0,0,0,0|1,0,0]=3 4180 B6R0.2 C[C@H](N)C[C@H](C)O Amb27593805 [1,1,0,0,0,0|1,0,1]=4 4181 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [1,1,0,0,0,0|0,0,0]=2 4182 B6R0.2 C[C@H](O)C[C@@H](C)F Amb27486566 [1,1,0,0,0,0|1,0,1]=4 4183 B6R0.2 C[C@H](O)C[C@@H](C)O Amb27273041 [1,1,0,0,0,0|1,0,1]=4 4184 B6R0.2 C[C@H](O)C[C@H](C)I Amb28042894 [1,1,0,0,0,0|1,0,1]=4 4185 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [1,1,0,0,0,0|1,0,1]=4 4186 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [1,1,0,0,0,0|2,0,0]=4 4187 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [1,1,0,0,0,0|1,0,0]=3 4188 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [1,1,0,0,0,0|1,0,0]=3 4189 B6R0.2 C[S+](C)CC(=O)[O-] Amb26065720 [1,1,0,0,0,0|1,0,1]=4 4190 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [1,1,0,0,0,0|0,0,2]=4 4191 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [1,1,0,0,0,0|0,0,2]=4 4192 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [1,1,0,0,0,0|0,0,2]=4 4193 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [1,1,0,0,0,0|0,0,2]=4 4194 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [1,1,0,0,0,0|0,0,2]=4 4195 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [1,1,0,0,0,0|0,0,2]=4 4196 B6R0.2 N=C(N)CC(N)=O Amb1981332 [1,1,0,0,0,0|1,0,1]=4 4197 B6R0.2 N=C(N)CC(N)=O Amb5719691 [1,1,0,0,0,0|1,0,1]=4 4198 B6R0.2 NC(=O)CC(=O)O Amb4034884 [1,1,0,0,0,0|0,0,1]=3 4199 B6R0.2 NC(=O)CC(=O)[O-] Amb22263088 [1,1,0,0,0,0|0,0,2]=4 4200 B6R0.2 NC(=O)CC(F)F Amb28401488 [1,1,0,0,0,0|2,0,0]=4 4201 B6R0.2 NC(=O)CC(N)=O Amb1971463 [1,1,0,0,0,0|1,0,1]=4 4202 B6R0.2 NC(=O)CC(N)=S Amb1155422 [1,1,0,0,0,0|1,0,1]=4 4203 B6R0.2 NC(=S)CC(=O)O Amb17465742 [1,1,0,0,0,0|0,0,1]=3 4204 B6R0.2 NC(N)=CC(=O)O Amb27618962 [1,1,0,0,0,0|0,0,2]=4 4205 B6R0.2 NC(S)CC(=O)O Amb27391244 [1,1,0,0,0,0|0,0,0]=2 4206 B6R0.2 O=C(O)CB(O)O Amb24053058 [1,1,0,0,0,0|2,0,0]=4 4207 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [1,1,0,0,0,0|1,0,1]=4 4208 B6R0.2 O=C(O)CC(=O)O Amb2689065 [1,1,0,0,0,0|1,0,1]=4 4209 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [1,1,0,0,0,0|1,0,0]=3 4210 B6R0.2 O=C(O)CC(F)F Amb22001551 [1,1,0,0,0,0|1,0,0]=3 4211 B6R0.2 O=C(O)CS(=O)O Amb27788997 [1,1,0,0,0,0|2,0,0]=4 4212 B6R0.2 O=C([O-])CC(F)F Amb24117960 [1,1,0,0,0,0|1,0,1]=4 4213 B6R0.2 O=S(O)CC(F)F Amb30035176 [1,1,0,0,0,0|2,0,0]=4 4214 B6R0.2 OC(=S)CC(F)F Amb34179023 [1,1,0,0,0,0|1,1,0]=4 4215 B6R0.3 C#CC(N)C(=O)O Amb28282694 [1,1,0,0,0,0|0,0,2]=4 4216 B6R0.3 C#CC(O)C(=O)O Amb22731622 [1,1,0,0,0,0|0,0,2]=4 4217 B6R0.3 C=C(Br)C(C)CC Amb22583745 [1,1,0,0,0,0|2,0,0]=4 4218 B6R0.3 C=C(C)C(C)CN Amb17593078 [1,1,0,0,0,0|2,0,0]=4 4219 B6R0.3 C=C(C)C(Cl)CC Amb27229374 [1,1,0,0,0,0|2,0,0]=4 4220 B6R0.3 C=C(C)C(F)CN Amb27784739 [1,1,0,0,0,0|2,0,0]=4 4221 B6R0.3 C=C(C)C(O)CC Amb26365874 [1,1,0,0,0,0|2,0,0]=4 4222 B6R0.3 C=C(C)C(O)CN Amb27844577 [1,1,0,0,0,0|2,0,0]=4 4223 B6R0.3 C=C(C)[C@@H](O)CN Amb33226186 [1,1,0,0,0,0|2,0,0]=4 4224 B6R0.3 C=C(C)[C@H](O)CN Amb33226204 [1,1,0,0,0,0|2,0,0]=4 4225 B6R0.3 C=C(CBr)C(=O)O Amb6296612 [1,1,0,0,0,0|1,0,1]=4 4226 B6R0.3 C=C(CC)C(=O)Cl Amb22353554 [1,1,0,0,0,0|1,0,1]=4 4227 B6R0.3 C=C(CC)C(=O)O Amb18639591 [1,1,0,0,0,0|0,0,1]=3 4228 B6R0.3 C=C(CCl)C(=O)O Amb27851591 [1,1,0,0,0,0|1,0,1]=4 4229 B6R0.3 C=C(CO)C(=O)O Amb18121817 [1,1,0,0,0,0|1,0,1]=4 4230 B6R0.3 C=C(CS)C(=O)O Amb27263242 [1,1,0,0,0,0|1,0,1]=4 4231 B6R0.3 C=C(OC)C(=O)O Amb18639906 [1,1,0,0,0,0|1,0,1]=4 4232 B6R0.3 C=C(SC)C(=O)O Amb27882690 [1,1,0,0,0,0|1,0,1]=4 4233 B6R0.3 C=CC(C)C(=O)O Amb21618706 [1,1,0,0,0,0|0,0,2]=4 4234 B6R0.3 C=CC(Cl)C(=O)O Amb27216715 [1,1,0,0,0,0|0,0,2]=4 4235 B6R0.3 C=CC(N)C(=O)O Amb20240543 [1,1,0,0,0,0|0,0,2]=4 4236 B6R0.3 C=CC(O)C(=O)O Amb24061247 [1,1,0,0,0,0|0,0,2]=4 4237 B6R0.3 C=CC(S)C(=O)O Amb28069741 [1,1,0,0,0,0|0,0,2]=4 4238 B6R0.3 C=C[C@@H](C)C(=O)O Amb26350417 [1,1,0,0,0,0|0,0,2]=4 4239 B6R0.3 C=C[C@@H](N)C(=O)O Amb22756048 [1,1,0,0,0,0|0,0,2]=4 4240 B6R0.3 C=C[C@H](C)C(=O)O Amb25929549 [1,1,0,0,0,0|0,0,2]=4 4241 B6R0.3 C=C[C@H](N)C(=O)O Amb2699113 [1,1,0,0,0,0|0,0,2]=4 4242 B6R0.3 CC(=O)C(Br)CBr Amb27597612 [1,1,0,0,0,0|2,0,0]=4 4243 B6R0.3 CC(=O)C(C)CCl Amb26477594 [1,1,0,0,0,0|2,0,0]=4 4244 B6R0.3 CC(=O)C(C)CO Amb10844844 [1,1,0,0,0,0|2,0,0]=4 4245 B6R0.3 CC(=O)C(Cl)CCl Amb27257955 [1,1,0,0,0,0|2,0,0]=4 4246 B6R0.3 CC(=O)C(O)CO Amb26463044 [1,1,0,0,0,0|2,0,0]=4 4247 B6R0.3 CC(=O)C([Na])CN Amb28423432 [1,1,0,0,0,0|1,0,0]=3 4248 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [1,1,0,0,0,0|2,0,0]=4 4249 B6R0.3 CC(=O)[C@H](N)CO Amb27451047 [1,1,0,0,0,0|2,0,0]=4 4250 B6R0.3 CC(C#N)C(=O)O Amb17210512 [1,1,0,0,0,0|0,0,2]=4 4251 B6R0.3 CC(C=O)C(=O)O Amb27784775 [1,1,0,0,0,0|1,0,1]=4 4252 B6R0.3 CC(CBr)C(=O)O Amb22002601 [1,1,0,0,0,0|1,0,0]=3 4253 B6R0.3 CC(CCl)C(=O)O Amb18522181 [1,1,0,0,0,0|1,0,0]=3 4254 B6R0.3 CC(CF)C(=O)O Amb24432331 [1,1,0,0,0,0|1,0,0]=3 4255 B6R0.3 CC(CN)C(=N)N Amb28282121 [1,1,0,0,0,0|2,0,0]=4 4256 B6R0.3 CC(CN)C(=O)O Amb2699128 [1,1,0,0,0,0|0,0,0]=2 4257 B6R0.3 CC(CN)C(=O)O Amb6773978 [1,1,0,0,0,0|0,0,0]=2 4258 B6R0.3 CC(CN)C(=O)O Amb8631418 [1,1,0,0,0,0|0,0,0]=2 4259 B6R0.3 CC(CN)S(C)=O Amb22157251 [1,1,0,0,0,0|2,0,0]=4 4260 B6R0.3 CC(CO)C(=O)O Amb8011522 [1,1,0,0,0,0|1,0,0]=3 4261 B6R0.3 CC(NN)C(=O)O Amb18640367 [1,1,0,0,0,0|1,0,0]=3 4262 B6R0.3 CC(O)C(C)CN Amb10068614 [1,1,0,0,0,0|1,0,1]=4 4263 B6R0.3 CC(O)C(N)CN Amb19328774 [1,1,0,0,0,0|1,0,1]=4 4264 B6R0.3 CC(O)C(N)CN Amb22059292 [1,1,0,0,0,0|1,0,1]=4 4265 B6R0.3 CC(O)C(O)CN Amb26871700 [1,1,0,0,0,0|1,0,1]=4 4266 B6R0.3 CC(O)[C@H](F)CN Amb27220559 [1,1,0,0,0,0|1,0,1]=4 4267 B6R0.3 CC(ON)C(=O)O Amb33038242 [1,1,0,0,0,0|1,0,0]=3 4268 B6R0.3 CC(ON)C(N)=O Amb28318742 [1,1,0,0,0,0|2,0,0]=4 4269 B6R0.3 CCC(=O)C(=O)Cl Amb27838251 [1,1,0,0,0,0|1,0,1]=4 4270 B6R0.3 CCC(=O)C(=O)O Amb3940359 [1,1,0,0,0,0|0,0,1]=3 4271 B6R0.3 CCC(=O)C(=O)[O-] Amb9825450 [1,1,0,0,0,0|0,0,2]=4 4272 B6R0.3 CCC(=O)C(C)=O Amb8514604 [1,1,0,0,0,0|1,0,1]=4 4273 B6R0.3 CCC(=O)C(N)=O Amb22011827 [1,1,0,0,0,0|1,0,1]=4 4274 B6R0.3 CCC(=S)C(=O)O Amb27872099 [1,1,0,0,0,0|0,0,1]=3 4275 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [1,1,0,0,0,0|1,0,0]=3 4276 B6R0.3 CCC(Br)C(=O)Cl Amb17666758 [1,1,0,0,0,0|1,0,0]=3 4277 B6R0.3 CCC(Br)C(=O)O Amb5716858 [1,1,0,0,0,0|0,0,0]=2 4278 B6R0.3 CCC(Br)C(C)=O Amb24615269 [1,1,0,0,0,0|1,0,0]=3 4279 B6R0.3 CCC(Br)C(N)=O Amb13952819 [1,1,0,0,0,0|1,0,0]=3 4280 B6R0.3 CCC(Br)[N+](=O)[O-] Amb17673702 [1,1,0,0,0,0|1,0,1]=4 4281 B6R0.3 CCC(C)B(O)O Amb10071974 [1,1,0,0,0,0|1,0,1]=4 4282 B6R0.3 CCC(C)C(=N)N Amb6740564 [1,1,0,0,0,0|2,0,0]=4 4283 B6R0.3 CCC(C)C(=N)N Amb8630181 [1,1,0,0,0,0|2,0,0]=4 4284 B6R0.3 CCC(C)C(=O)Cl Amb3939259 [1,1,0,0,0,0|1,0,0]=3 4285 B6R0.3 CCC(C)C(=O)O Amb9703224 [1,1,0,0,0,0|0,0,0]=2 4286 B6R0.3 CCC(C)C(C)=O Amb4605996 [1,1,0,0,0,0|1,0,0]=3 4287 B6R0.3 CCC(C)C(C)O Amb8513435 [1,1,0,0,0,0|1,0,1]=4 4288 B6R0.3 CCC(C)C(N)=O Amb33548100 [1,1,0,0,0,0|1,0,0]=3 4289 B6R0.3 CCC(C)C(N)=S Amb6740516 [1,1,0,0,0,0|1,1,0]=4 4290 B6R0.3 CCC(C)C(O)O Amb27826789 [1,1,0,0,0,0|0,0,2]=4 4291 B6R0.3 CCC(C)S(=O)Cl Amb27841595 [1,1,0,0,0,0|2,0,0]=4 4292 B6R0.3 CCC(C)S(=O)[O-] Amb19893328 [1,1,0,0,0,0|1,0,1]=4 4293 B6R0.3 CCC(C)S(N)=O Amb32756501 [1,1,0,0,0,0|2,0,0]=4 4294 B6R0.3 CCC(C)[C@@H](C)O Amb27946951 [1,1,0,0,0,0|1,0,1]=4 4295 B6R0.3 CCC(C)[C@H](C)O Amb28281014 [1,1,0,0,0,0|1,0,1]=4 4296 B6R0.3 CCC(C)[N+](=O)[O-] Amb4036169 [1,1,0,0,0,0|1,0,1]=4 4297 B6R0.3 CCC(Cl)C(=O)Br Amb28384077 [1,1,0,0,0,0|1,0,0]=3 4298 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [1,1,0,0,0,0|1,0,0]=3 4299 B6R0.3 CCC(Cl)C(=O)O Amb4017887 [1,1,0,0,0,0|0,0,0]=2 4300 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [1,1,0,0,0,0|1,0,0]=3 4301 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [1,1,0,0,0,0|1,0,0]=3 4302 B6R0.3 CCC(Cl)C(O)O Amb27400305 [1,1,0,0,0,0|0,0,2]=4 4303 B6R0.3 CCC(Cl)[N+](=O)[O-] Amb4016590 [1,1,0,0,0,0|1,0,1]=4 4304 B6R0.3 CCC(F)C(=N)N Amb32456109 [1,1,0,0,0,0|2,0,0]=4 4305 B6R0.3 CCC(F)C(=O)O Amb25716167 [1,1,0,0,0,0|0,0,0]=2 4306 B6R0.3 CCC(N)B(O)O Amb28367684 [1,1,0,0,0,0|1,0,1]=4 4307 B6R0.3 CCC(N)C(=O)Cl Amb17593240 [1,1,0,0,0,0|1,0,0]=3 4308 B6R0.3 CCC(N)C(=O)O Amb9729506 [1,1,0,0,0,0|0,0,0]=2 4309 B6R0.3 CCC(N)C(C)O Amb32662794 [1,1,0,0,0,0|1,0,1]=4 4310 B6R0.3 CCC(N)C(C)O Amb8855230 [1,1,0,0,0,0|1,0,1]=4 4311 B6R0.3 CCC(N)C(N)=O Amb1914080 [1,1,0,0,0,0|1,0,0]=3 4312 B6R0.3 CCC(N)C(N)=O Amb33528521 [1,1,0,0,0,0|1,0,0]=3 4313 B6R0.3 CCC(N)C(N)O Amb28348585 [1,1,0,0,0,0|1,0,1]=4 4314 B6R0.3 CCC(N)P(=O)=O Amb27786328 [1,1,0,0,0,0|1,0,1]=4 4315 B6R0.3 CCC(O)C(=N)N Amb33321504 [1,1,0,0,0,0|2,0,0]=4 4316 B6R0.3 CCC(O)C(=O)O Amb6609018 [1,1,0,0,0,0|0,0,0]=2 4317 B6R0.3 CCC(O)C(=O)[O-] Amb17943026 [1,1,0,0,0,0|0,0,1]=3 4318 B6R0.3 CCC(O)C(C)=O Amb25336501 [1,1,0,0,0,0|1,0,0]=3 4319 B6R0.3 CCC(O)C(C)O Amb2227553 [1,1,0,0,0,0|1,0,1]=4 4320 B6R0.3 CCC(O)C(N)=O Amb24116514 [1,1,0,0,0,0|1,0,0]=3 4321 B6R0.3 CCC(O)C(N)=S Amb23449332 [1,1,0,0,0,0|1,1,0]=4 4322 B6R0.3 CCC(O)S(=O)[O-] Amb27166943 [1,1,0,0,0,0|1,0,1]=4 4323 B6R0.3 CCC(S)C(=O)O Amb17501370 [1,1,0,0,0,0|0,0,0]=2 4324 B6R0.3 CCC(S)C(C)=O Amb8393170 [1,1,0,0,0,0|1,0,0]=3 4325 B6R0.3 CCN(C)C(=O)Cl Amb8390927 [1,1,0,0,0,0|2,0,0]=4 4326 B6R0.3 CCN(C)C(C)=O Amb22753516 [1,1,0,0,0,0|2,0,0]=4 4327 B6R0.3 CCN(N)C(C)=O Amb18639976 [1,1,0,0,0,0|2,0,0]=4 4328 B6R0.3 CCN(N)C(N)=O Amb28184355 [1,1,0,0,0,0|2,0,0]=4 4329 B6R0.3 CCN(O)C(C)=O Amb27652499 [1,1,0,0,0,0|2,0,0]=4 4330 B6R0.3 CC[C@@H](Br)C(=O)O Amb9785161 [1,1,0,0,0,0|0,0,0]=2 4331 B6R0.3 CC[C@@H](C)B(O)O Amb27784066 [1,1,0,0,0,0|1,0,1]=4 4332 B6R0.3 CC[C@@H](C)C(=O)O Amb8384578 [1,1,0,0,0,0|0,0,0]=2 4333 B6R0.3 CC[C@@H](C)C(C)=O Amb28283799 [1,1,0,0,0,0|1,0,0]=3 4334 B6R0.3 CC[C@@H](C)[C@@H](C)O Amb27448466 [1,1,0,0,0,0|1,0,1]=4 4335 B6R0.3 CC[C@@H](Cl)C(=O)Cl Amb27985877 [1,1,0,0,0,0|1,0,0]=3 4336 B6R0.3 CC[C@@H](Cl)C(=O)O Amb22800493 [1,1,0,0,0,0|0,0,0]=2 4337 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [1,1,0,0,0,0|1,0,0]=3 4338 B6R0.3 CC[C@@H](N)C(=O)O Amb16233349 [1,1,0,0,0,0|0,0,0]=2 4339 B6R0.3 CC[C@@H](N)C(=O)O Amb3940761 [1,1,0,0,0,0|0,0,0]=2 4340 B6R0.3 CC[C@@H](N)C(C)=O Amb35594875 [1,1,0,0,0,0|1,0,0]=3 4341 B6R0.3 CC[C@@H](N)C(C)O Amb28280672 [1,1,0,0,0,0|1,0,1]=4 4342 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [1,1,0,0,0,0|1,0,0]=3 4343 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [1,1,0,0,0,0|1,0,0]=3 4344 B6R0.3 CC[C@@H](N)[C@@H](C)O Amb24117050 [1,1,0,0,0,0|1,0,1]=4 4345 B6R0.3 CC[C@@H](O)C(=O)O Amb22369401 [1,1,0,0,0,0|0,0,0]=2 4346 B6R0.3 CC[C@@H](O)C(N)=O Amb27792606 [1,1,0,0,0,0|1,0,0]=3 4347 B6R0.3 CC[C@H](Br)C(=O)O Amb20242441 [1,1,0,0,0,0|0,0,0]=2 4348 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [1,1,0,0,0,0|1,0,1]=4 4349 B6R0.3 CC[C@H](C)C(=O)Cl Amb26463969 [1,1,0,0,0,0|1,0,0]=3 4350 B6R0.3 CC[C@H](C)C(=O)O Amb8514667 [1,1,0,0,0,0|0,0,0]=2 4351 B6R0.3 CC[C@H](C)C(N)=O Amb27440802 [1,1,0,0,0,0|1,0,0]=3 4352 B6R0.3 CC[C@H](Cl)C(=O)O Amb25190040 [1,1,0,0,0,0|0,0,0]=2 4353 B6R0.3 CC[C@H](N)C(=O)O Amb2694208 [1,1,0,0,0,0|0,0,0]=2 4354 B6R0.3 CC[C@H](N)C(=O)O Amb8631089 [1,1,0,0,0,0|0,0,0]=2 4355 B6R0.3 CC[C@H](N)C(C)=O Amb29849605 [1,1,0,0,0,0|1,0,0]=3 4356 B6R0.3 CC[C@H](N)C(N)=O Amb8387112 [1,1,0,0,0,0|1,0,0]=3 4357 B6R0.3 CC[C@H](N)C(N)=O Amb8395789 [1,1,0,0,0,0|1,0,0]=3 4358 B6R0.3 CC[C@H](N)[C@@H](C)O Amb24117049 [1,1,0,0,0,0|1,0,1]=4 4359 B6R0.3 CC[C@H](O)C(=O)O Amb4166324 [1,1,0,0,0,0|0,0,0]=2 4360 B6R0.3 CC[C@H](O)[C@@H](C)O Amb27972258 [1,1,0,0,0,0|1,0,1]=4 4361 B6R0.3 CC[C@H](O)[C@H](C)O Amb27664238 [1,1,0,0,0,0|1,0,1]=4 4362 B6R0.3 CC[C@H](S)C(=O)O Amb9785162 [1,1,0,0,0,0|0,0,0]=2 4363 B6R0.3 CNC(=O)C(=O)O Amb2691295 [1,1,0,0,0,0|1,0,1]=4 4364 B6R0.3 CNC(C)C(=O)O Amb19373699 [1,1,0,0,0,0|1,0,0]=3 4365 B6R0.3 CNC(C)C(=O)O Amb9271766 [1,1,0,0,0,0|1,0,0]=3 4366 B6R0.3 CNC(C)C(C)=O Amb24369529 [1,1,0,0,0,0|2,0,0]=4 4367 B6R0.3 CNC(C)C(N)=O Amb33527202 [1,1,0,0,0,0|2,0,0]=4 4368 B6R0.3 CNC(C)C(N)=O Amb7758120 [1,1,0,0,0,0|2,0,0]=4 4369 B6R0.3 CNC(O)C(=O)O Amb27229907 [1,1,0,0,0,0|1,0,0]=3 4370 B6R0.3 CN[C@@H](C)C(=O)O Amb16233347 [1,1,0,0,0,0|1,0,0]=3 4371 B6R0.3 CN[C@@H](C)C(=O)O Amb16233348 [1,1,0,0,0,0|1,0,0]=3 4372 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [1,1,0,0,0,0|2,0,0]=4 4373 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [1,1,0,0,0,0|2,0,0]=4 4374 B6R0.3 CN[C@H](C)C(=O)O Amb10844859 [1,1,0,0,0,0|1,0,0]=3 4375 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [1,1,0,0,0,0|2,0,0]=4 4376 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [1,1,0,0,0,0|2,0,0]=4 4377 B6R0.3 COC(=O)C(=O)O Amb33545007 [1,1,0,0,0,0|1,0,1]=4 4378 B6R0.3 COC(Br)C(=O)O Amb27439128 [1,1,0,0,0,0|1,0,0]=3 4379 B6R0.3 COC(Br)C(C)=O Amb25360111 [1,1,0,0,0,0|2,0,0]=4 4380 B6R0.3 COC(C)C(=O)Cl Amb26005661 [1,1,0,0,0,0|2,0,0]=4 4381 B6R0.3 COC(C)C(=O)O Amb9729215 [1,1,0,0,0,0|1,0,0]=3 4382 B6R0.3 COC(C)C(C)=O Amb9666021 [1,1,0,0,0,0|2,0,0]=4 4383 B6R0.3 COC(C)C(N)=O Amb6541307 [1,1,0,0,0,0|2,0,0]=4 4384 B6R0.3 COC(Cl)C(=O)O Amb28280799 [1,1,0,0,0,0|1,0,0]=3 4385 B6R0.3 COC(Cl)C(C)=O Amb28118971 [1,1,0,0,0,0|2,0,0]=4 4386 B6R0.3 COC(F)C(=O)O Amb27764863 [1,1,0,0,0,0|1,0,0]=3 4387 B6R0.3 COC(F)C(=O)[O-] Amb33447021 [1,1,0,0,0,0|1,0,1]=4 4388 B6R0.3 COC(O)C(C)=O Amb27954086 [1,1,0,0,0,0|2,0,0]=4 4389 B6R0.3 CO[C@@H](C)C(=O)Cl Amb26562182 [1,1,0,0,0,0|2,0,0]=4 4390 B6R0.3 CO[C@@H](C)C(=O)O Amb8515766 [1,1,0,0,0,0|1,0,0]=3 4391 B6R0.3 CO[C@@H](C)C(N)=O Amb8515768 [1,1,0,0,0,0|2,0,0]=4 4392 B6R0.3 CO[C@H](C)C(=O)Cl Amb27588755 [1,1,0,0,0,0|2,0,0]=4 4393 B6R0.3 CO[C@H](C)C(=O)O Amb8515771 [1,1,0,0,0,0|1,0,0]=3 4394 B6R0.3 CO[C@H](C)C(N)=O Amb17617080 [1,1,0,0,0,0|2,0,0]=4 4395 B6R0.3 CSC(C)C(=O)O Amb6274567 [1,1,0,0,0,0|1,0,0]=3 4396 B6R0.3 CSC(C)C(N)=O Amb28047863 [1,1,0,0,0,0|2,0,0]=4 4397 B6R0.3 CSC(Cl)C(=O)Cl Amb27392297 [1,1,0,0,0,0|2,0,0]=4 4398 B6R0.3 CSC(N)C(=O)O Amb28383509 [1,1,0,0,0,0|1,0,0]=3 4399 B6R0.3 CS[C@H](C)C(=O)O Amb26611205 [1,1,0,0,0,0|1,0,0]=3 4400 B6R0.3 C[C@@H](CF)C(=O)O Amb33743265 [1,1,0,0,0,0|1,0,0]=3 4401 B6R0.3 C[C@@H](CI)C(=O)O Amb28322539 [1,1,0,0,0,0|1,0,0]=3 4402 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [1,1,0,0,0,0|0,0,0]=2 4403 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [1,1,0,0,0,0|0,0,0]=2 4404 B6R0.3 C[C@@H](CO)C(=O)O Amb10844567 [1,1,0,0,0,0|1,0,0]=3 4405 B6R0.3 C[C@@H](CO)C(N)=O Amb27254152 [1,1,0,0,0,0|2,0,0]=4 4406 B6R0.3 C[C@@H](O)C(O)CN Amb28050484 [1,1,0,0,0,0|1,0,1]=4 4407 B6R0.3 C[C@@H](O)[C@H](N)CN Amb19374892 [1,1,0,0,0,0|1,0,1]=4 4408 B6R0.3 C[C@@H](ON)C(=O)O Amb27169414 [1,1,0,0,0,0|1,0,0]=3 4409 B6R0.3 C[C@@H](ON)C(=O)O Amb33620846 [1,1,0,0,0,0|1,0,0]=3 4410 B6R0.3 C[C@H](CBr)C(=O)O Amb27975404 [1,1,0,0,0,0|1,0,0]=3 4411 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [1,1,0,0,0,0|2,0,0]=4 4412 B6R0.3 C[C@H](CF)C(=O)O Amb33727262 [1,1,0,0,0,0|1,0,0]=3 4413 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [1,1,0,0,0,0|0,0,0]=2 4414 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [1,1,0,0,0,0|0,0,0]=2 4415 B6R0.3 C[C@H](CO)C(=O)O Amb10844554 [1,1,0,0,0,0|1,0,0]=3 4416 B6R0.3 C[C@H](NBr)C(=O)O Amb28050211 [1,1,0,0,0,0|2,0,0]=4 4417 B6R0.3 C[C@H](NN)C(=O)O Amb28247936 [1,1,0,0,0,0|1,0,0]=3 4418 B6R0.3 C[C@H](ON)C(=O)O Amb25853808 [1,1,0,0,0,0|1,0,0]=3 4419 B6R0.3 C[C@H](ON)C(=O)O Amb33620847 [1,1,0,0,0,0|1,0,0]=3 4420 B6R0.3 C\C=C(/Br)C(=O)O Amb18646193 [1,1,0,0,0,0|0,0,2]=4 4421 B6R0.3 C\C=C(/C)C(=O)O Amb33723768 [1,1,0,0,0,0|0,0,2]=4 4422 B6R0.3 C\C=C(/F)C(=O)O Amb32663762 [1,1,0,0,0,0|0,0,2]=4 4423 B6R0.3 C\C=C(/O)C(=O)O Amb22727962 [1,1,0,0,0,0|0,0,2]=4 4424 B6R0.3 C\C=C(\Br)C(=O)O Amb4014486 [1,1,0,0,0,0|0,0,2]=4 4425 B6R0.3 C\C=C(\C)C(=O)O Amb3445181 [1,1,0,0,0,0|0,0,2]=4 4426 B6R0.3 C\C=C(\Cl)C(=O)O Amb28073985 [1,1,0,0,0,0|0,0,2]=4 4427 B6R0.3 C\C=C(\I)C(=O)O Amb27841305 [1,1,0,0,0,0|0,0,2]=4 4428 B6R0.3 N#CC(N)C(=O)O Amb25328320 [1,1,0,0,0,0|0,0,2]=4 4429 B6R0.3 N#CC(O)C(=O)O Amb27467286 [1,1,0,0,0,0|0,0,2]=4 4430 B6R0.3 NC(=O)C(Br)CBr Amb8390579 [1,1,0,0,0,0|2,0,0]=4 4431 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [1,1,0,0,0,0|2,0,0]=4 4432 B6R0.3 NC(=O)C(N)CO Amb17593097 [1,1,0,0,0,0|2,0,0]=4 4433 B6R0.3 NC(=O)C(N)CO Amb2720301 [1,1,0,0,0,0|2,0,0]=4 4434 B6R0.3 NC(=O)C(N)CS Amb18641990 [1,1,0,0,0,0|2,0,0]=4 4435 B6R0.3 NC(=O)C(N)CS Amb33330875 [1,1,0,0,0,0|2,0,0]=4 4436 B6R0.3 NC(=O)C(O)CO Amb27169520 [1,1,0,0,0,0|2,0,0]=4 4437 B6R0.3 NC(=O)[C@@H](N)CO Amb6336612 [1,1,0,0,0,0|2,0,0]=4 4438 B6R0.3 NC(=O)[C@@H](N)CO Amb8387630 [1,1,0,0,0,0|2,0,0]=4 4439 B6R0.3 NC(=O)[C@@H](N)CS Amb23437751 [1,1,0,0,0,0|2,0,0]=4 4440 B6R0.3 NC(=O)[C@@H](O)CO Amb27816733 [1,1,0,0,0,0|2,0,0]=4 4441 B6R0.3 NC(=O)[C@H](N)CO Amb22886957 [1,1,0,0,0,0|2,0,0]=4 4442 B6R0.3 NC(=O)[C@H](N)CO Amb26505098 [1,1,0,0,0,0|2,0,0]=4 4443 B6R0.3 NC(CCl)C(=O)O Amb19651457 [1,1,0,0,0,0|1,0,0]=3 4444 B6R0.3 NC(CCl)C(=O)O Amb21961077 [1,1,0,0,0,0|1,0,0]=3 4445 B6R0.3 NC(CF)C(=O)O Amb10839589 [1,1,0,0,0,0|1,0,0]=3 4446 B6R0.3 NC(CO)C(=O)O Amb9702805 [1,1,0,0,0,0|1,0,0]=3 4447 B6R0.3 NC(CP)C(=O)O Amb27234251 [1,1,0,0,0,0|0,1,0]=3 4448 B6R0.3 NC(CS)C(=O)Cl Amb28050358 [1,1,0,0,0,0|2,0,0]=4 4449 B6R0.3 NC(CS)C(=O)O Amb13961966 [1,1,0,0,0,0|1,0,0]=3 4450 B6R0.3 NC(CS)C(=O)O Amb22489523 [1,1,0,0,0,0|1,0,0]=3 4451 B6R0.3 NC(CS)C(=O)O Amb6537913 [1,1,0,0,0,0|1,0,0]=3 4452 B6R0.3 NC(CS)C(=O)O Amb6537914 [1,1,0,0,0,0|1,0,0]=3 4453 B6R0.3 NC(CS)C(=O)S Amb27838279 [1,1,0,0,0,0|1,1,0]=4 4454 B6R0.3 NC(CS)S(=O)O Amb27238568 [1,1,0,0,0,0|2,0,0]=4 4455 B6R0.3 NC(C[NH3+])C(=O)O Amb4004471 [1,1,0,0,0,0|0,0,1]=3 4456 B6R0.3 NCC(Br)C(=O)O Amb28385732 [1,1,0,0,0,0|0,0,0]=2 4457 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [1,1,0,0,0,0|0,0,0]=2 4458 B6R0.3 NCC(F)C(=O)O Amb22733051 [1,1,0,0,0,0|0,0,0]=2 4459 B6R0.3 NCC(F)C(=O)O Amb2688010 [1,1,0,0,0,0|0,0,0]=2 4460 B6R0.3 NCC(F)C(N)=O Amb26984913 [1,1,0,0,0,0|1,0,0]=3 4461 B6R0.3 NCC(F)C(N)=O Amb32667436 [1,1,0,0,0,0|1,0,0]=3 4462 B6R0.3 NCC(N)C(=O)O Amb22899095 [1,1,0,0,0,0|0,0,0]=2 4463 B6R0.3 NCC(N)C(=O)O Amb2697095 [1,1,0,0,0,0|0,0,0]=2 4464 B6R0.3 NCC(N)C(=O)O Amb8514284 [1,1,0,0,0,0|0,0,0]=2 4465 B6R0.3 NCC(O)C(=O)O Amb8517492 [1,1,0,0,0,0|0,0,0]=2 4466 B6R0.3 NCC(O)C(N)=O Amb27164291 [1,1,0,0,0,0|1,0,0]=3 4467 B6R0.3 NCC(O)C(N)=O Amb28827639 [1,1,0,0,0,0|1,0,0]=3 4468 B6R0.3 NCC(S)C(=O)O Amb17593238 [1,1,0,0,0,0|0,0,0]=2 4469 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [1,1,0,0,0,0|0,0,0]=2 4470 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [1,1,0,0,0,0|0,0,0]=2 4471 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [1,1,0,0,0,0|0,0,0]=2 4472 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [1,1,0,0,0,0|0,0,0]=2 4473 B6R0.3 NC[C@@H](N)C(N)=O Amb27981260 [1,1,0,0,0,0|1,0,0]=3 4474 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [1,1,0,0,0,0|0,0,0]=2 4475 B6R0.3 NC[C@@H](O)C(N)=O Amb28282144 [1,1,0,0,0,0|1,0,0]=3 4476 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [1,1,0,0,0,0|0,0,0]=2 4477 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [1,1,0,0,0,0|0,0,0]=2 4478 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [1,1,0,0,0,0|0,0,0]=2 4479 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [1,1,0,0,0,0|0,0,0]=2 4480 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [1,1,0,0,0,0|0,0,0]=2 4481 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [1,1,0,0,0,0|0,0,0]=2 4482 B6R0.3 NC[C@H](O)C(N)=O Amb32645211 [1,1,0,0,0,0|1,0,0]=3 4483 B6R0.3 N[C@@H](C=S)C(=O)O Amb27838199 [1,1,0,0,0,0|1,0,1]=4 4484 B6R0.3 N[C@@H](CBr)C(=O)O Amb27188433 [1,1,0,0,0,0|1,0,0]=3 4485 B6R0.3 N[C@@H](CCl)C(=O)O Amb22232860 [1,1,0,0,0,0|1,0,0]=3 4486 B6R0.3 N[C@@H](CCl)C(=O)O Amb8515277 [1,1,0,0,0,0|1,0,0]=3 4487 B6R0.3 N[C@@H](CO)C(=O)O Amb22351170 [1,1,0,0,0,0|1,0,0]=3 4488 B6R0.3 N[C@@H](CO)C(=O)O Amb8387621 [1,1,0,0,0,0|1,0,0]=3 4489 B6R0.3 N[C@@H](CS)C(=O)O Amb3940755 [1,1,0,0,0,0|1,0,0]=3 4490 B6R0.3 N[C@@H](CS)C(=O)O Amb8385453 [1,1,0,0,0,0|1,0,0]=3 4491 B6R0.3 N[C@@H](CS)C(=O)O Amb9826090 [1,1,0,0,0,0|1,0,0]=3 4492 B6R0.3 N[C@@H](CS)S(=O)O Amb27391675 [1,1,0,0,0,0|2,0,0]=4 4493 B6R0.3 N[C@@H](C[SeH])C(=O)O Amb31031035 [1,1,0,0,0,0|1,0,0]=3 4494 B6R0.3 N[C@H](CCl)C(=O)Cl Amb28143184 [1,1,0,0,0,0|2,0,0]=4 4495 B6R0.3 N[C@H](CCl)C(=O)O Amb2699111 [1,1,0,0,0,0|1,0,0]=3 4496 B6R0.3 N[C@H](CCl)C(=O)O Amb9813688 [1,1,0,0,0,0|1,0,0]=3 4497 B6R0.3 N[C@H](CO)C(=O)Cl Amb28058341 [1,1,0,0,0,0|2,0,0]=4 4498 B6R0.3 N[C@H](CO)C(=O)O Amb2690463 [1,1,0,0,0,0|1,0,0]=3 4499 B6R0.3 N[C@H](CS)C(=O)Cl Amb27166396 [1,1,0,0,0,0|2,0,0]=4 4500 B6R0.3 N[C@H](CS)C(=O)O Amb17942912 [1,1,0,0,0,0|1,0,0]=3 4501 B6R0.3 N[C@H](CS)C(=O)O Amb8394603 [1,1,0,0,0,0|1,0,0]=3 4502 B6R0.3 N[C@H](CS)C(=O)O Amb8628479 [1,1,0,0,0,0|1,0,0]=3 4503 B6R0.3 O=C(Cl)C(Br)CBr Amb3940235 [1,1,0,0,0,0|2,0,0]=4 4504 B6R0.3 O=C(Cl)C(Br)CCl Amb28198806 [1,1,0,0,0,0|2,0,0]=4 4505 B6R0.3 O=C(Cl)C(Br)CF Amb28129447 [1,1,0,0,0,0|2,0,0]=4 4506 B6R0.3 O=C(Cl)C(Cl)CCl Amb3940236 [1,1,0,0,0,0|2,0,0]=4 4507 B6R0.3 O=C(O)C(=O)CBr Amb10068671 [1,1,0,0,0,0|1,0,1]=4 4508 B6R0.3 O=C(O)C(=O)CBr Amb8389349 [1,1,0,0,0,0|1,0,1]=4 4509 B6R0.3 O=C(O)C(=O)CCl Amb16233358 [1,1,0,0,0,0|1,0,1]=4 4510 B6R0.3 O=C(O)C(=O)CI Amb27659477 [1,1,0,0,0,0|1,0,1]=4 4511 B6R0.3 O=C(O)C(=O)CO Amb6600025 [1,1,0,0,0,0|1,0,1]=4 4512 B6R0.3 O=C(O)C(=O)CS Amb6600041 [1,1,0,0,0,0|1,0,1]=4 4513 B6R0.3 O=C(O)C(Br)CBr Amb8513574 [1,1,0,0,0,0|1,0,0]=3 4514 B6R0.3 O=C(O)C(Br)CF Amb10605519 [1,1,0,0,0,0|1,0,0]=3 4515 B6R0.3 O=C(O)C(Br)CO Amb18126327 [1,1,0,0,0,0|1,0,0]=3 4516 B6R0.3 O=C(O)C(Cl)CCl Amb22228245 [1,1,0,0,0,0|1,0,0]=3 4517 B6R0.3 O=C(O)C(Cl)CO Amb18124304 [1,1,0,0,0,0|1,0,0]=3 4518 B6R0.3 O=C(O)C(Cl)CS Amb18643661 [1,1,0,0,0,0|1,0,0]=3 4519 B6R0.3 O=C(O)C(F)CO Amb17593117 [1,1,0,0,0,0|1,0,0]=3 4520 B6R0.3 O=C(O)C(O)CBr Amb24061932 [1,1,0,0,0,0|1,0,0]=3 4521 B6R0.3 O=C(O)C(O)CCl Amb6371692 [1,1,0,0,0,0|1,0,0]=3 4522 B6R0.3 O=C(O)C(O)CF Amb27476477 [1,1,0,0,0,0|1,0,0]=3 4523 B6R0.3 O=C(O)C(O)CO Amb17593103 [1,1,0,0,0,0|1,0,0]=3 4524 B6R0.3 O=C(O)C(O)CS Amb18642053 [1,1,0,0,0,0|1,0,0]=3 4525 B6R0.3 O=C(O)C(S)CS Amb18643295 [1,1,0,0,0,0|1,0,0]=3 4526 B6R0.3 O=C(O)[C@@H](Br)CO Amb10601700 [1,1,0,0,0,0|1,0,0]=3 4527 B6R0.3 O=C(O)[C@@H](Cl)CO Amb27968485 [1,1,0,0,0,0|1,0,0]=3 4528 B6R0.3 O=C(O)[C@@H](O)CBr Amb27858794 [1,1,0,0,0,0|1,0,0]=3 4529 B6R0.3 O=C(O)[C@@H](O)CCl Amb22225325 [1,1,0,0,0,0|1,0,0]=3 4530 B6R0.3 O=C(O)[C@@H](O)CF Amb24117272 [1,1,0,0,0,0|1,0,0]=3 4531 B6R0.3 O=C(O)[C@@H](O)CO Amb22226732 [1,1,0,0,0,0|1,0,0]=3 4532 B6R0.3 O=C(O)[C@H](Cl)CO Amb27759746 [1,1,0,0,0,0|1,0,0]=3 4533 B6R0.3 O=C(O)[C@H](O)CBr Amb28137021 [1,1,0,0,0,0|1,0,0]=3 4534 B6R0.3 O=C(O)[C@H](O)CF Amb27467272 [1,1,0,0,0,0|1,0,0]=3 4535 B6R0.3 O=C(O)[C@H](O)CO Amb4166319 [1,1,0,0,0,0|1,0,0]=3 4536 B6R0.3 O=CC(Br)C(=O)O Amb27793774 [1,1,0,0,0,0|1,0,1]=4 4537 B6R0.3 O=CC(F)C(=O)O Amb22055301 [1,1,0,0,0,0|1,0,1]=4 4538 B6R0.3 O=C[C@@H](O)C(=O)O Amb27629391 [1,1,0,0,0,0|1,0,1]=4 4539 B6R0.3 [C-]#[N+]C(C)C(=O)O Amb27974746 [1,1,0,0,0,0|1,0,1]=4 4540 B6R0.5 CC(C)(O)CCN Amb33542214 [1,1,0,0,0,0|1,0,1]=4 4541 B6R0.5 CC(O)(O)CCN Amb27947542 [1,1,0,0,0,0|0,0,2]=4 4542 B6R0.5 CCCC(C)(C)O Amb8516075 [1,1,0,0,0,0|1,0,1]=4 4543 B6R0.5 CCCP(=O)(O)O Amb22230045 [1,1,0,0,0,0|1,0,0]=3 4544 B6R0.5 CCCS(=N)(N)=O Amb35711007 [1,1,0,0,0,0|2,0,0]=4 4545 B6R0.5 CCCS(=O)(=O)Cl Amb3939748 [1,1,0,0,0,0|1,0,1]=4 4546 B6R0.5 CCCS(=O)(=O)F Amb10610150 [1,1,0,0,0,0|1,0,1]=4 4547 B6R0.5 CCCS(=O)(=O)[O-] Amb8515942 [1,1,0,0,0,0|1,0,1]=4 4548 B6R0.5 CCCS(=O)(=O)[O-] Amb8517045 [1,1,0,0,0,0|1,0,1]=4 4549 B6R0.5 CCCS(=O)(=O)[S-] Amb22369121 [1,1,0,0,0,0|1,0,1]=4 4550 B6R0.5 CCCS(C)(=N)=O Amb32671061 [1,1,0,0,0,0|2,0,0]=4 4551 B6R0.5 CCCS(N)(=O)=O Amb1139748 [1,1,0,0,0,0|1,0,1]=4 4552 B6R0.5 CCC[Si](C)(C)O Amb27624611 [1,1,0,0,0,0|1,1,0]=4 4553 B6R0.5 CCNS(=O)(=O)O Amb19650770 [1,1,0,0,0,0|2,0,0]=4 4554 B6R0.5 CNCP(=O)(O)O Amb589043 [1,1,0,0,0,0|2,0,0]=4 4555 B6R0.5 CNCP(C)(=O)O Amb4300777 [1,1,0,0,0,0|2,0,0]=4 4556 B6R0.5 CP(C)(=O)CCN Amb25867261 [1,1,0,0,0,0|2,0,0]=4 4557 B6R0.5 CS(=N)(=O)CCN Amb33338808 [1,1,0,0,0,0|2,0,0]=4 4558 B6R0.5 CS(=N)(=O)CCN Amb33484345 [1,1,0,0,0,0|2,0,0]=4 4559 B6R0.5 CS(=O)(=O)CCN Amb3940999 [1,1,0,0,0,0|1,0,1]=4 4560 B6R0.5 CS(=O)(=O)CCN Amb6760642 [1,1,0,0,0,0|1,0,1]=4 4561 B6R0.5 C[S@](=N)(=O)CCN Amb33743772 [1,1,0,0,0,0|2,0,0]=4 4562 B6R0.5 NCCP(=O)(O)O Amb4297144 [1,1,0,0,0,0|1,0,0]=3 4563 B6R0.5 NCCS(=O)(=O)F Amb28434740 [1,1,0,0,0,0|1,0,1]=4 4564 B6R0.5 NCCS(=O)(=O)F Amb33457273 [1,1,0,0,0,0|1,0,1]=4 4565 B6R0.5 NCCS(=O)(=O)O Amb2695361 [1,1,0,0,0,0|1,0,0]=3 4566 B6R0.5 NCCS(N)(=O)=O Amb1102364 [1,1,0,0,0,0|1,0,1]=4 4567 B6R0.5 NCCS(N)(=O)=O Amb6892997 [1,1,0,0,0,0|1,0,1]=4 4568 B6R0.5 NCC[PH](=O)(=O)O Amb28365875 [1,1,0,0,0,0|1,0,0]=3 4569 B6R0.5 O=P(O)(O)CCBr Amb8479835 [1,1,0,0,0,0|2,0,0]=4 4570 B6R0.5 O=P(O)(O)CCCl Amb6297766 [1,1,0,0,0,0|2,0,0]=4 4571 B6R0.5 O=P(O)(O)CCO Amb22388824 [1,1,0,0,0,0|2,0,0]=4 4572 B6R0.5 O=S(=O)(O)CCBr Amb17938633 [1,1,0,0,0,0|2,0,0]=4 4573 B6R0.5 O=S(=O)(O)CCCl Amb33513054 [1,1,0,0,0,0|2,0,0]=4 4574 B6R0.5 O=S(=O)(O)CCO Amb8383477 [1,1,0,0,0,0|2,0,0]=4 4575 B6R0.5 O=S(=O)(O)CCS Amb22337676 [1,1,0,0,0,0|2,0,0]=4 4576 B6R0.6 C#CCCCC=C Amb22227961 [1,1,0,0,0,0|2,0,0]=4 4577 B6R0.6 C#CCCCC=O Amb17593060 [1,1,0,0,0,0|1,0,0]=3 4578 B6R0.6 C#CCCCCN Amb22059283 [1,1,0,0,0,0|1,0,1]=4 4579 B6R0.6 C#CCCCCN Amb33549738 [1,1,0,0,0,0|1,0,1]=4 4580 B6R0.6 C#CCCCCO Amb6336500 [1,1,0,0,0,0|1,0,1]=4 4581 B6R0.6 C#CCCCNC Amb29083253 [1,1,0,0,0,0|1,0,1]=4 4582 B6R0.6 C#CCCCNN Amb28456747 [1,1,0,0,0,0|1,0,1]=4 4583 B6R0.6 C#CCCCON Amb27879991 [1,1,0,0,0,0|1,0,1]=4 4584 B6R0.6 C#CCCNC=O Amb27447032 [1,1,0,0,0,0|1,0,1]=4 4585 B6R0.6 C#CCOCCN Amb18976416 [1,1,0,0,0,0|1,0,1]=4 4586 B6R0.6 C#CCOCCN Amb32718823 [1,1,0,0,0,0|1,0,1]=4 4587 B6R0.6 C#CCSCCN Amb33548267 [1,1,0,0,0,0|1,0,1]=4 4588 B6R0.6 C#CCSCCN Amb6263724 [1,1,0,0,0,0|1,0,1]=4 4589 B6R0.6 C=C=CCCC=O Amb28208489 [1,1,0,0,0,0|1,0,1]=4 4590 B6R0.6 C=C=CCCCCl Amb17939722 [1,1,0,0,0,0|2,0,0]=4 4591 B6R0.6 C=C=CCCCN Amb27222280 [1,1,0,0,0,0|1,0,0]=3 4592 B6R0.6 C=C=CCCCO Amb10605300 [1,1,0,0,0,0|2,0,0]=4 4593 B6R0.6 C=CCC#CCN Amb27639779 [1,1,0,0,0,0|1,0,1]=4 4594 B6R0.6 C=CCCCC#N Amb6298890 [1,1,0,0,0,0|1,0,1]=4 4595 B6R0.6 C=CCCCC=C Amb22227760 [1,1,0,0,0,0|2,0,0]=4 4596 B6R0.6 C=CCCCC=O Amb13883672 [1,1,0,0,0,0|1,0,0]=3 4597 B6R0.6 C=CCCCCBr Amb3940222 [1,1,0,0,0,0|2,0,0]=4 4598 B6R0.6 C=CCCCCC Amb3940498 [1,1,0,0,0,0|2,0,0]=4 4599 B6R0.6 C=CCCCCCl Amb2692039 [1,1,0,0,0,0|2,0,0]=4 4600 B6R0.6 C=CCCCCF Amb24409527 [1,1,0,0,0,0|2,0,0]=4 4601 B6R0.6 C=CCCCCI Amb26858458 [1,1,0,0,0,0|2,0,0]=4 4602 B6R0.6 C=CCCCCN Amb18639514 [1,1,0,0,0,0|1,0,0]=3 4603 B6R0.6 C=CCCCCO Amb3940341 [1,1,0,0,0,0|1,0,1]=4 4604 B6R0.6 C=CCCCNC Amb18523846 [1,1,0,0,0,0|1,0,0]=3 4605 B6R0.6 C=CCCCNC Amb32651835 [1,1,0,0,0,0|1,0,0]=3 4606 B6R0.6 C=CCCCNO Amb27437399 [1,1,0,0,0,0|1,0,0]=3 4607 B6R0.6 C=CCCCOC Amb24432882 [1,1,0,0,0,0|2,0,0]=4 4608 B6R0.6 C=CCCOCCl Amb2696084 [1,1,0,0,0,0|2,0,0]=4 4609 B6R0.6 C=CCCSCC Amb27213772 [1,1,0,0,0,0|2,0,0]=4 4610 B6R0.6 C=CCNCCC Amb22587187 [1,1,0,0,0,0|2,0,0]=4 4611 B6R0.6 C=CCNCCC Amb6683949 [1,1,0,0,0,0|2,0,0]=4 4612 B6R0.6 C=CCNCCCl Amb17334072 [1,1,0,0,0,0|2,0,0]=4 4613 B6R0.6 C=CCNCCN Amb17091015 [1,1,0,0,0,0|1,0,0]=3 4614 B6R0.6 C=CCNCCO Amb6706545 [1,1,0,0,0,0|2,0,0]=4 4615 B6R0.6 C=CCOCC=O Amb27402231 [1,1,0,0,0,0|1,0,1]=4 4616 B6R0.6 C=CCOCCBr Amb33531510 [1,1,0,0,0,0|2,0,0]=4 4617 B6R0.6 C=CCOCCC Amb3940491 [1,1,0,0,0,0|2,0,0]=4 4618 B6R0.6 C=CCOCCCl Amb2696085 [1,1,0,0,0,0|2,0,0]=4 4619 B6R0.6 C=CCOCCI Amb24739964 [1,1,0,0,0,0|2,0,0]=4 4620 B6R0.6 C=CCOCCN Amb32667523 [1,1,0,0,0,0|1,0,0]=3 4621 B6R0.6 C=CCOCCN Amb33530047 [1,1,0,0,0,0|1,0,0]=3 4622 B6R0.6 C=CCOCCO Amb3940609 [1,1,0,0,0,0|2,0,0]=4 4623 B6R0.6 C=CCSCC=O Amb18641509 [1,1,0,0,0,0|1,0,1]=4 4624 B6R0.6 C=CCSCCCl Amb28042684 [1,1,0,0,0,0|2,0,0]=4 4625 B6R0.6 C=CCSCCN Amb13951462 [1,1,0,0,0,0|1,0,0]=3 4626 B6R0.6 C=CCSCCN Amb6273787 [1,1,0,0,0,0|1,0,0]=3 4627 B6R0.6 C=COCCCC Amb8513427 [1,1,0,0,0,0|2,0,0]=4 4628 B6R0.6 C=COCCCCl Amb27613489 [1,1,0,0,0,0|2,0,0]=4 4629 B6R0.6 C=COCCCF Amb22008255 [1,1,0,0,0,0|2,0,0]=4 4630 B6R0.6 C=COCCCN Amb3997182 [1,1,0,0,0,0|1,0,0]=3 4631 B6R0.6 C=COCCNN Amb28421647 [1,1,0,0,0,0|2,0,0]=4 4632 B6R0.6 C=COCCON Amb22001402 [1,1,0,0,0,0|2,0,0]=4 4633 B6R0.6 C=CSCCCN Amb27800121 [1,1,0,0,0,0|1,0,0]=3 4634 B6R0.6 C=C\C=C\CCN Amb18639048 [1,1,0,0,0,0|1,0,1]=4 4635 B6R0.6 C=C\C=C\CCN Amb32679368 [1,1,0,0,0,0|1,0,1]=4 4636 B6R0.6 CCC#CCC=O Amb28396959 [1,1,0,0,0,0|1,0,1]=4 4637 B6R0.6 CCCC#CC=O Amb27244852 [1,1,0,0,0,0|1,0,1]=4 4638 B6R0.6 CCCCBOC Amb22728871 [1,1,0,0,0,0|2,0,0]=4 4639 B6R0.6 CCCCC=[N+]=[N-] Amb28184340 [1,1,0,0,0,0|2,0,0]=4 4640 B6R0.6 CCCCCC=O Amb3939522 [1,1,0,0,0,0|1,0,0]=3 4641 B6R0.6 CCCCCCN Amb2721179 [1,1,0,0,0,0|1,0,1]=4 4642 B6R0.6 CCCCCCN Amb3940465 [1,1,0,0,0,0|1,0,1]=4 4643 B6R0.6 CCCCCCO Amb3941500 [1,1,0,0,0,0|1,0,1]=4 4644 B6R0.6 CCCCCNC Amb3939381 [1,1,0,0,0,0|1,0,1]=4 4645 B6R0.6 CCCCCNN Amb32693399 [1,1,0,0,0,0|1,0,1]=4 4646 B6R0.6 CCCCCNN Amb6249376 [1,1,0,0,0,0|1,0,1]=4 4647 B6R0.6 CCCCCNO Amb25067859 [1,1,0,0,0,0|1,0,1]=4 4648 B6R0.6 CCCCCOC Amb9787609 [1,1,0,0,0,0|1,0,1]=4 4649 B6R0.6 CCCCCON Amb18122095 [1,1,0,0,0,0|1,0,1]=4 4650 B6R0.6 CCCCN=C=O Amb3939310 [1,1,0,0,0,0|1,0,1]=4 4651 B6R0.6 CCCCNC=O Amb4017838 [1,1,0,0,0,0|1,0,0]=3 4652 B6R0.6 CCCCNOC Amb24479420 [1,1,0,0,0,0|2,0,0]=4 4653 B6R0.6 CCCCOB=O Amb26900238 [1,1,0,0,0,0|2,0,0]=4 4654 B6R0.6 CCCCOC=O Amb6608882 [1,1,0,0,0,0|1,0,0]=3 4655 B6R0.6 CCCCOCO Amb24480826 [1,1,0,0,0,0|1,0,1]=4 4656 B6R0.6 CCCCON=O Amb8515227 [1,1,0,0,0,0|2,0,0]=4 4657 B6R0.6 CCCCSCO Amb27623932 [1,1,0,0,0,0|1,0,1]=4 4658 B6R0.6 CCCC\C=C\I Amb25173925 [1,1,0,0,0,0|2,0,0]=4 4659 B6R0.6 CCCNCCN Amb8515461 [1,1,0,0,0,0|1,0,1]=4 4660 B6R0.6 CCCNCCO Amb3939869 [1,1,0,0,0,0|1,0,1]=4 4661 B6R0.6 CCCOCCN Amb3939563 [1,1,0,0,0,0|1,0,1]=4 4662 B6R0.6 CCCOCCO Amb3939227 [1,1,0,0,0,0|1,0,1]=4 4663 B6R0.6 CCCSCCN Amb19888435 [1,1,0,0,0,0|1,0,1]=4 4664 B6R0.6 CCCSCCN Amb6268693 [1,1,0,0,0,0|1,0,1]=4 4665 B6R0.6 CCC\C=C/C=O Amb25885814 [1,1,0,0,0,0|1,0,1]=4 4666 B6R0.6 CCC\C=C\C=O Amb3940431 [1,1,0,0,0,0|1,0,1]=4 4667 B6R0.6 CCC\C=C\CO Amb32660968 [1,1,0,0,0,0|1,0,1]=4 4668 B6R0.6 CCNCCCN Amb17315269 [1,1,0,0,0,0|1,0,1]=4 4669 B6R0.6 CCNCCCO Amb6733726 [1,1,0,0,0,0|1,0,1]=4 4670 B6R0.6 CCNCNC=O Amb27252409 [1,1,0,0,0,0|2,0,0]=4 4671 B6R0.6 CCOCCC=O Amb25688261 [1,1,0,0,0,0|1,0,0]=3 4672 B6R0.6 CCOCCCN Amb3939347 [1,1,0,0,0,0|1,0,1]=4 4673 B6R0.6 CCOCCCO Amb3939322 [1,1,0,0,0,0|1,0,1]=4 4674 B6R0.6 CCOCNC=O Amb28252363 [1,1,0,0,0,0|2,0,0]=4 4675 B6R0.6 CCSCCC=O Amb27254551 [1,1,0,0,0,0|1,0,0]=3 4676 B6R0.6 CCSCCCN Amb6680223 [1,1,0,0,0,0|1,0,1]=4 4677 B6R0.6 CCSCCCO Amb3939588 [1,1,0,0,0,0|1,0,1]=4 4678 B6R0.6 CCSCCNO Amb33324087 [1,1,0,0,0,0|2,0,0]=4 4679 B6R0.6 CCSCNC=O Amb28315587 [1,1,0,0,0,0|2,0,0]=4 4680 B6R0.6 CC\C=C/CC=O Amb18639157 [1,1,0,0,0,0|1,0,1]=4 4681 B6R0.6 CC\C=C\CCN Amb17569886 [1,1,0,0,0,0|1,0,1]=4 4682 B6R0.6 CNCCCCCl Amb34916601 [1,1,0,0,0,0|1,0,1]=4 4683 B6R0.6 CNCCCCF Amb27231439 [1,1,0,0,0,0|1,0,1]=4 4684 B6R0.6 CNCCCCN Amb17334048 [1,1,0,0,0,0|1,0,1]=4 4685 B6R0.6 CNCCCCN Amb2698063 [1,1,0,0,0,0|1,0,1]=4 4686 B6R0.6 CNCCCCO Amb33539277 [1,1,0,0,0,0|0,0,1]=3 4687 B6R0.6 CNCCCNC Amb3940467 [1,1,0,0,0,0|2,0,0]=4 4688 B6R0.6 CNCCCOC Amb33801534 [1,1,0,0,0,0|2,0,0]=4 4689 B6R0.6 CNCCCOC Amb9204018 [1,1,0,0,0,0|2,0,0]=4 4690 B6R0.6 CNCCCON Amb27430260 [1,1,0,0,0,0|2,0,0]=4 4691 B6R0.6 CNCCCSC Amb6718995 [1,1,0,0,0,0|2,0,0]=4 4692 B6R0.6 CNCC\C=C\Cl Amb27605601 [1,1,0,0,0,0|1,0,1]=4 4693 B6R0.6 COCCCC=O Amb33530955 [1,1,0,0,0,0|1,0,0]=3 4694 B6R0.6 COCCCCBr Amb8855443 [1,1,0,0,0,0|1,0,1]=4 4695 B6R0.6 COCCCCCl Amb17942999 [1,1,0,0,0,0|1,0,1]=4 4696 B6R0.6 COCCCCI Amb25933499 [1,1,0,0,0,0|1,0,1]=4 4697 B6R0.6 COCCCCN Amb10610278 [1,1,0,0,0,0|0,0,1]=3 4698 B6R0.6 COCCCCN Amb6251056 [1,1,0,0,0,0|0,0,1]=3 4699 B6R0.6 COCCCCO Amb17666901 [1,1,0,0,0,0|1,0,1]=4 4700 B6R0.6 COCCCCS Amb24654696 [1,1,0,0,0,0|1,0,1]=4 4701 B6R0.6 COCCCNN Amb25887940 [1,1,0,0,0,0|1,0,1]=4 4702 B6R0.6 COCCCNN Amb33204509 [1,1,0,0,0,0|1,0,1]=4 4703 B6R0.6 COCCCNN Amb33553392 [1,1,0,0,0,0|1,0,1]=4 4704 B6R0.6 COCCCNO Amb33378127 [1,1,0,0,0,0|2,0,0]=4 4705 B6R0.6 COCCCON Amb18559290 [1,1,0,0,0,0|1,0,1]=4 4706 B6R0.6 COCCNC=O Amb24334241 [1,1,0,0,0,0|2,0,0]=4 4707 B6R0.6 COCOCC=O Amb27409311 [1,1,0,0,0,0|2,0,0]=4 4708 B6R0.6 COCOCCN Amb25314793 [1,1,0,0,0,0|1,0,1]=4 4709 B6R0.6 CONCCCN Amb26953498 [1,1,0,0,0,0|1,0,0]=3 4710 B6R0.6 CONCCCN Amb30584683 [1,1,0,0,0,0|1,0,0]=3 4711 B6R0.6 CONCCCN Amb32666616 [1,1,0,0,0,0|1,0,0]=3 4712 B6R0.6 CONCCCO Amb24479622 [1,1,0,0,0,0|2,0,0]=4 4713 B6R0.6 CONCCCO Amb33456216 [1,1,0,0,0,0|2,0,0]=4 4714 B6R0.6 CSCCCC=O Amb25992553 [1,1,0,0,0,0|1,0,0]=3 4715 B6R0.6 CSCCCCN Amb17500948 [1,1,0,0,0,0|0,1,1]=4 4716 B6R0.6 CSCCCCO Amb9825911 [1,1,0,0,0,0|1,0,1]=4 4717 B6R0.6 CSCCCNN Amb24093854 [1,1,0,0,0,0|2,0,0]=4 4718 B6R0.6 CSCCCNO Amb27948053 [1,1,0,0,0,0|2,0,0]=4 4719 B6R0.6 CSCCCON Amb27947150 [1,1,0,0,0,0|2,0,0]=4 4720 B6R0.6 CSCCNC=O Amb28437305 [1,1,0,0,0,0|2,0,0]=4 4721 B6R0.6 C\C=C/CCC=O Amb28202620 [1,1,0,0,0,0|1,0,1]=4 4722 B6R0.6 C\C=C/CCCC Amb24467666 [1,1,0,0,0,0|2,0,0]=4 4723 B6R0.6 C\C=C/CCCN Amb27658374 [1,1,0,0,0,0|1,0,0]=3 4724 B6R0.6 C\C=C/CCCO Amb17614951 [1,1,0,0,0,0|2,0,0]=4 4725 B6R0.6 C\C=C\CCC=O Amb17593074 [1,1,0,0,0,0|1,0,1]=4 4726 B6R0.6 C\C=C\CCCC Amb8515158 [1,1,0,0,0,0|2,0,0]=4 4727 B6R0.6 C\C=C\CCCI Amb25837122 [1,1,0,0,0,0|2,0,0]=4 4728 B6R0.6 C\C=C\CCCO Amb22347882 [1,1,0,0,0,0|2,0,0]=4 4729 B6R0.6 N#CCCCC=O Amb18120556 [1,1,0,0,0,0|0,0,1]=3 4730 B6R0.6 N#CCCCCN Amb30628578 [1,1,0,0,0,0|1,0,1]=4 4731 B6R0.6 N#CCCCCN Amb33532899 [1,1,0,0,0,0|1,0,1]=4 4732 B6R0.6 N#CCCCCO Amb33531864 [1,1,0,0,0,0|0,0,2]=4 4733 B6R0.6 N#CCCCNN Amb27650745 [1,1,0,0,0,0|1,0,1]=4 4734 B6R0.6 N#CCSCCN Amb6265754 [1,1,0,0,0,0|1,0,1]=4 4735 B6R0.6 N#CSCCCN Amb27881665 [1,1,0,0,0,0|1,0,1]=4 4736 B6R0.6 N#CSCCCN Amb32652034 [1,1,0,0,0,0|1,0,1]=4 4737 B6R0.6 N#N=NCCCN Amb22292017 [1,1,0,0,0,0|2,0,0]=4 4738 B6R0.6 NCC#CCCO Amb27175344 [1,1,0,0,0,0|0,0,2]=4 4739 B6R0.6 NCCCCC=O Amb26627836 [1,1,0,0,0,0|0,0,0]=2 4740 B6R0.6 NCCCCCBr Amb26581378 [1,1,0,0,0,0|1,0,1]=4 4741 B6R0.6 NCCCCCCl Amb17593241 [1,1,0,0,0,0|1,0,1]=4 4742 B6R0.6 NCCCCCF Amb28383861 [1,1,0,0,0,0|1,0,1]=4 4743 B6R0.6 NCCCCCF Amb35747648 [1,1,0,0,0,0|1,0,1]=4 4744 B6R0.6 NCCCCCI Amb27596855 [1,1,0,0,0,0|1,0,1]=4 4745 B6R0.6 NCCCCCN Amb22002397 [1,1,0,0,0,0|1,0,1]=4 4746 B6R0.6 NCCCCCN Amb8513099 [1,1,0,0,0,0|1,0,1]=4 4747 B6R0.6 NCCCCCO Amb3939337 [1,1,0,0,0,0|0,0,1]=3 4748 B6R0.6 NCCCCCS Amb33362345 [1,1,0,0,0,0|0,1,1]=4 4749 B6R0.6 NCCCCCS Amb33527075 [1,1,0,0,0,0|0,1,1]=4 4750 B6R0.6 NCCCCNO Amb24117989 [1,1,0,0,0,0|0,0,1]=3 4751 B6R0.6 NCCCCNO Amb27668394 [1,1,0,0,0,0|0,0,1]=3 4752 B6R0.6 NCCCCON Amb28188672 [1,1,0,0,0,0|0,0,1]=3 4753 B6R0.6 NCCCN=C=S Amb27790034 [1,1,0,0,0,0|0,1,1]=4 4754 B6R0.6 NCCCNC=O Amb5723517 [1,1,0,0,0,0|0,0,0]=2 4755 B6R0.6 NCCCOCF Amb33224234 [1,1,0,0,0,0|1,0,1]=4 4756 B6R0.6 NCCC\C=C/I Amb28050291 [1,1,0,0,0,0|1,0,0]=3 4757 B6R0.6 NCCNCCBr Amb27478238 [1,1,0,0,0,0|1,0,1]=4 4758 B6R0.6 NCCNCCN Amb5722362 [1,1,0,0,0,0|1,0,1]=4 4759 B6R0.6 NCCNCCO Amb6600573 [1,1,0,0,0,0|0,0,1]=3 4760 B6R0.6 NCCNCCS Amb24763096 [1,1,0,0,0,0|0,1,1]=4 4761 B6R0.6 NCCNCCS Amb33483741 [1,1,0,0,0,0|0,1,1]=4 4762 B6R0.6 NCCOCCBr Amb25888513 [1,1,0,0,0,0|1,0,1]=4 4763 B6R0.6 NCCOCCBr Amb35747990 [1,1,0,0,0,0|1,0,1]=4 4764 B6R0.6 NCCOCCCl Amb22036609 [1,1,0,0,0,0|1,0,1]=4 4765 B6R0.6 NCCOCCF Amb28320518 [1,1,0,0,0,0|1,0,1]=4 4766 B6R0.6 NCCOCCF Amb33536623 [1,1,0,0,0,0|1,0,1]=4 4767 B6R0.6 NCCOCCN Amb2583212 [1,1,0,0,0,0|1,0,1]=4 4768 B6R0.6 NCCOCCN Amb8504888 [1,1,0,0,0,0|1,0,1]=4 4769 B6R0.6 NCCOCCO Amb3939011 [1,1,0,0,0,0|0,0,1]=3 4770 B6R0.6 NCCOCCS Amb17502015 [1,1,0,0,0,0|0,1,1]=4 4771 B6R0.6 NCCOCCS Amb35789823 [1,1,0,0,0,0|0,1,1]=4 4772 B6R0.6 NCCSCCN Amb32679817 [1,1,0,0,0,0|1,0,1]=4 4773 B6R0.6 NCCSCCN Amb9695000 [1,1,0,0,0,0|1,0,1]=4 4774 B6R0.6 NCCSCCO Amb2725559 [1,1,0,0,0,0|0,0,1]=3 4775 B6R0.6 NC\C=C\CCN Amb24113141 [1,1,0,0,0,0|1,0,1]=4 4776 B6R0.6 NC\C=C\CCN Amb24113896 [1,1,0,0,0,0|1,0,1]=4 4777 B6R0.6 NC\C=C\CCO Amb27969293 [1,1,0,0,0,0|0,0,2]=4 4778 B6R0.6 NNCCCCO Amb24692523 [1,1,0,0,0,0|0,0,1]=3 4779 B6R0.6 NOCCCCF Amb27160797 [1,1,0,0,0,0|1,0,1]=4 4780 B6R0.6 NOCCCON Amb24711828 [1,1,0,0,0,0|1,0,1]=4 4781 B6R0.6 O=C=NCCCBr Amb27859638 [1,1,0,0,0,0|1,0,1]=4 4782 B6R0.6 O=C=NCCCCl Amb3939153 [1,1,0,0,0,0|1,0,1]=4 4783 B6R0.6 O=C=NCCCF Amb27838244 [1,1,0,0,0,0|1,0,1]=4 4784 B6R0.6 O=CCCCC=O Amb6600455 [1,1,0,0,0,0|1,0,0]=3 4785 B6R0.6 O=CCCCCBr Amb18126353 [1,1,0,0,0,0|1,0,0]=3 4786 B6R0.6 O=CCCCCCl Amb18123550 [1,1,0,0,0,0|1,0,0]=3 4787 B6R0.6 O=CCCCCO Amb10603837 [1,1,0,0,0,0|1,0,0]=3 4788 B6R0.6 O=CCCCN=O Amb27838215 [1,1,0,0,0,0|0,0,1]=3 4789 B6R0.6 O=CCC\C=C/Br Amb27838206 [1,1,0,0,0,0|1,0,1]=4 4790 B6R0.6 O=CCC\C=C\Cl Amb27955198 [1,1,0,0,0,0|1,0,1]=4 4791 B6R0.6 O=CNCCCO Amb27248821 [1,1,0,0,0,0|1,0,0]=3 4792 B6R0.6 O=C\C=C/CCO Amb27235316 [1,1,0,0,0,0|1,0,1]=4 4793 B6R0.6 O=C\C=C\CCF Amb33429802 [1,1,0,0,0,0|1,0,1]=4 4794 B6R0.6 O=[PH2]OCCCO Amb27218913 [1,1,0,0,0,0|2,0,0]=4 4795 B6R0.6 OCCCCCBr Amb10603824 [1,1,0,0,0,0|1,0,1]=4 4796 B6R0.6 OCCCCCCl Amb8386939 [1,1,0,0,0,0|1,0,1]=4 4797 B6R0.6 OCCCCCF Amb24479828 [1,1,0,0,0,0|1,0,1]=4 4798 B6R0.6 OCCCCCO Amb6296608 [1,1,0,0,0,0|1,0,1]=4 4799 B6R0.6 OCCCCNO Amb27396013 [1,1,0,0,0,0|0,0,1]=3 4800 B6R0.6 OCCC\C=C\Br Amb27483322 [1,1,0,0,0,0|2,0,0]=4 4801 B6R0.6 OCCC\C=C\I Amb27879078 [1,1,0,0,0,0|2,0,0]=4 4802 B6R0.6 OCCNCCF Amb27468539 [1,1,0,0,0,0|1,0,1]=4 4803 B6R0.6 OCCNCCO Amb22035219 [1,1,0,0,0,0|1,0,1]=4 4804 B6R0.6 OCCNCCO Amb3997179 [1,1,0,0,0,0|1,0,1]=4 4805 B6R0.6 OCCNCCS Amb18522180 [1,1,0,0,0,0|1,0,1]=4 4806 B6R0.6 OCCOCCBr Amb24057456 [1,1,0,0,0,0|1,0,1]=4 4807 B6R0.6 OCCOCCCl Amb3940337 [1,1,0,0,0,0|1,0,1]=4 4808 B6R0.6 OCCOCCF Amb17593119 [1,1,0,0,0,0|1,0,1]=4 4809 B6R0.6 OCCOCCI Amb27602214 [1,1,0,0,0,0|1,0,1]=4 4810 B6R0.6 OCCOCCO Amb32671216 [1,1,0,0,0,0|1,0,1]=4 4811 B6R0.6 OCCOCCO Amb6608789 [1,1,0,0,0,0|1,0,1]=4 4812 B6R0.6 OCCOCCS Amb22008751 [1,1,0,0,0,0|1,0,1]=4 4813 B6R0.6 OCCPCCO Amb27185495 [1,1,0,0,0,0|1,0,1]=4 4814 B6R0.6 OCCSCCCl Amb27413860 [1,1,0,0,0,0|1,0,1]=4 4815 B6R0.6 OCCSCCO Amb6891967 [1,1,0,0,0,0|1,0,1]=4 4816 B6R0.6 OCCSCCS Amb27829564 [1,1,0,0,0,0|1,0,1]=4 4817 B6R0.6 OC\C=C\CCF Amb33196119 [1,1,0,0,0,0|1,0,1]=4 4818 B6R0.6 OC\C=C\CCO Amb26017278 [1,1,0,0,0,0|1,0,1]=4 4819 B6R0.6 [N-]=[N+]=NCCC=O Amb28050185 [1,1,0,0,0,0|1,0,1]=4 4820 B6R0.6 [N-]=[N+]=NCCCN Amb19514442 [1,1,0,0,0,0|2,0,0]=4 4821 B6R0.6 [N-]=[N+]=NCCCN Amb34913295 [1,1,0,0,0,0|2,0,0]=4 4822 B8R0.2 C#C[C@@H](C)[C@H](C)C(=O)O Amb27257738 [0,2,0,0,0,0|1,0,1]=4 4823 B8R0.2 C#C[C@H](C)[C@@H](O)C(=O)O Amb27777980 [0,2,0,0,0,0|1,0,1]=4 4824 B8R0.2 C=C(C(=O)O)C(C)CC Amb18642655 [0,2,0,0,0,0|1,0,1]=4 4825 B8R0.2 C=C(C(=O)O)[C@@H](O)CC Amb28253249 [0,2,0,0,0,0|1,0,1]=4 4826 B8R0.2 C=C(C)[C@@H](O)[C@H](C)CN Amb28250843 [0,2,0,0,0,0|2,0,0]=4 4827 B8R0.2 C=CC(C)C(C)C(=O)O Amb18642611 [0,2,0,0,0,0|1,0,1]=4 4828 B8R0.2 C=CC(C)C(N)C(=O)O Amb18989861 [0,2,0,0,0,0|1,0,1]=4 4829 B8R0.2 C=CC(C)C(O)C(=O)O Amb18642750 [0,2,0,0,0,0|1,0,1]=4 4830 B8R0.2 C=CC(C)[C@@H](N)C(=O)O Amb25889532 [0,2,0,0,0,0|1,0,1]=4 4831 B8R0.2 C=CC(C)[C@H](N)C(=O)O Amb27761345 [0,2,0,0,0,0|1,0,1]=4 4832 B8R0.2 C=CC(N)C(C)C(=O)O Amb33036213 [0,2,0,0,0,0|1,0,1]=4 4833 B8R0.2 C=CC(O)C(C)C(=O)O Amb18642774 [0,2,0,0,0,0|1,0,1]=4 4834 B8R0.2 C=CC(O)C(N)C(=O)O Amb18642830 [0,2,0,0,0,0|1,0,1]=4 4835 B8R0.2 C=CC(O)[C@H](N)C(=O)O Amb28429839 [0,2,0,0,0,0|1,0,1]=4 4836 B8R0.2 C=C[C@@H](C)[C@H](N)C(=O)O Amb28129785 [0,2,0,0,0,0|1,0,1]=4 4837 B8R0.2 C=C[C@@H](C)[C@H](O)C(=O)O Amb27788648 [0,2,0,0,0,0|1,0,1]=4 4838 B8R0.2 C=C[C@H](C)[C@@H](N)C(=O)O Amb28067623 [0,2,0,0,0,0|1,0,1]=4 4839 B8R0.2 C=C[C@H](C)[C@H](Cl)C(=O)O Amb27601824 [0,2,0,0,0,0|1,0,1]=4 4840 B8R0.2 C=C[C@H](C)[C@H](F)C(=O)O Amb28285951 [0,2,0,0,0,0|1,0,1]=4 4841 B8R0.2 C=C[C@H](O)[C@@H](C)C(=O)O Amb28422977 [0,2,0,0,0,0|1,0,1]=4 4842 B8R0.2 C=C[C@H](O)[C@@H](N)C(=O)O Amb27236340 [0,2,0,0,0,0|1,0,1]=4 4843 B8R0.2 C=C[C@H](O)[C@H](C)C(=O)O Amb28285106 [0,2,0,0,0,0|1,0,1]=4 4844 B8R0.2 CC(=O)C(C)C(N)CO Amb27186035 [0,2,0,0,0,0|2,0,0]=4 4845 B8R0.2 CC(=O)C(O)C(O)CO Amb26636819 [0,2,0,0,0,0|2,0,0]=4 4846 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO Amb26654815 [0,2,0,0,0,0|2,0,0]=4 4847 B8R0.2 CC(=O)[C@H](O)[C@@H](O)CO Amb28201025 [0,2,0,0,0,0|2,0,0]=4 4848 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [0,2,0,0,0,0|2,0,0]=4 4849 B8R0.2 CC(C#N)C(N)C(=O)O Amb33065998 [0,2,0,0,0,0|0,0,2]=4 4850 B8R0.2 CC(C#N)[C@@H](N)C(=O)O Amb33308709 [0,2,0,0,0,0|0,0,2]=4 4851 B8R0.2 CC(C#N)[C@H](N)C(=O)O Amb33308645 [0,2,0,0,0,0|0,0,2]=4 4852 B8R0.2 CC(C(=O)O)C(N)CN Amb24532823 [0,2,0,0,0,0|0,0,0]=2 4853 B8R0.2 CC(CCl)C(N)C(=O)O Amb27470876 [0,2,0,0,0,0|1,0,0]=3 4854 B8R0.2 CC(CN)C(C)C(=O)O Amb27217450 [0,2,0,0,0,0|0,0,0]=2 4855 B8R0.2 CC(CN)C(F)C(=O)O Amb35750952 [0,2,0,0,0,0|0,0,0]=2 4856 B8R0.2 CC(CN)C(F)C(=O)O Amb35751592 [0,2,0,0,0,0|0,0,0]=2 4857 B8R0.2 CC(CN)C(O)C(=O)O Amb18642919 [0,2,0,0,0,0|0,0,0]=2 4858 B8R0.2 CC(CN)N(C)C(N)=O Amb18251133 [0,2,0,0,0,0|2,0,0]=4 4859 B8R0.2 CC(CO)C(C)C(=O)O Amb27255789 [0,2,0,0,0,0|1,0,0]=3 4860 B8R0.2 CC(CO)C(N)C(=O)O Amb27629815 [0,2,0,0,0,0|1,0,0]=3 4861 B8R0.2 CC(CO)C(N)C(N)=O Amb33308985 [0,2,0,0,0,0|2,0,0]=4 4862 B8R0.2 CC(CO)[C@@H](N)C(=O)O Amb33308939 [0,2,0,0,0,0|1,0,0]=3 4863 B8R0.2 CC(CO)[C@H](N)C(=O)O Amb25918803 [0,2,0,0,0,0|1,0,0]=3 4864 B8R0.2 CC(CS)C(C)C(=O)O Amb17593702 [0,2,0,0,0,0|1,0,0]=3 4865 B8R0.2 CC(NO)C(C)C(=O)O Amb27185439 [0,2,0,0,0,0|2,0,0]=4 4866 B8R0.2 CCC(=S)[C@H](N)C(=O)O Amb25111086 [0,2,0,0,0,0|1,0,1]=4 4867 B8R0.2 CCC(Br)C(=O)C(=O)O Amb27232743 [0,2,0,0,0,0|1,0,1]=4 4868 B8R0.2 CCC(C)C(=O)C(=O)O Amb2695339 [0,2,0,0,0,0|1,0,1]=4 4869 B8R0.2 CCC(C)C(Br)C(=O)O Amb4015586 [0,2,0,0,0,0|1,0,0]=3 4870 B8R0.2 CCC(C)C(Br)C(N)=O Amb27472685 [0,2,0,0,0,0|2,0,0]=4 4871 B8R0.2 CCC(C)C(C)C(=O)O Amb18290719 [0,2,0,0,0,0|1,0,0]=3 4872 B8R0.2 CCC(C)C(C)C(C)=O Amb4035878 [0,2,0,0,0,0|2,0,0]=4 4873 B8R0.2 CCC(C)C(Cl)C(=O)O Amb17593752 [0,2,0,0,0,0|1,0,0]=3 4874 B8R0.2 CCC(C)C(Cl)C(N)=O Amb27771780 [0,2,0,0,0,0|2,0,0]=4 4875 B8R0.2 CCC(C)C(N)C(=O)O Amb9702778 [0,2,0,0,0,0|1,0,0]=3 4876 B8R0.2 CCC(C)C(N)C(N)=O Amb1105283 [0,2,0,0,0,0|2,0,0]=4 4877 B8R0.2 CCC(C)C(N)C(N)=O Amb1152621 [0,2,0,0,0,0|2,0,0]=4 4878 B8R0.2 CCC(C)C(N)C(N)=O Amb33551930 [0,2,0,0,0,0|2,0,0]=4 4879 B8R0.2 CCC(C)C(O)C(=O)O Amb18288809 [0,2,0,0,0,0|1,0,0]=3 4880 B8R0.2 CCC(C)C(O)C(N)=O Amb24112761 [0,2,0,0,0,0|2,0,0]=4 4881 B8R0.2 CCC(C)C(S)C(=O)O Amb27667077 [0,2,0,0,0,0|1,0,0]=3 4882 B8R0.2 CCC(C)[C@@H](C)C(=O)O Amb10844494 [0,2,0,0,0,0|1,0,0]=3 4883 B8R0.2 CCC(C)[C@@H](N)C(=O)O Amb10844500 [0,2,0,0,0,0|1,0,0]=3 4884 B8R0.2 CCC(C)[C@H](Br)C(=O)Cl Amb27166137 [0,2,0,0,0,0|2,0,0]=4 4885 B8R0.2 CCC(C)[C@H](Br)C(=O)O Amb28183049 [0,2,0,0,0,0|1,0,0]=3 4886 B8R0.2 CCC(C)[C@H](C)C(=O)O Amb10844495 [0,2,0,0,0,0|1,0,0]=3 4887 B8R0.2 CCC(C)[C@H](Cl)C(=O)O Amb28314442 [0,2,0,0,0,0|1,0,0]=3 4888 B8R0.2 CCC(C)[C@H](N)C(=O)O Amb10844501 [0,2,0,0,0,0|1,0,0]=3 4889 B8R0.2 CCC(C)[C@H](N)C(C)=O Amb35617474 [0,2,0,0,0,0|2,0,0]=4 4890 B8R0.2 CCC(Cl)C(C)C(C)=O Amb27983787 [0,2,0,0,0,0|2,0,0]=4 4891 B8R0.2 CCC(F)C(=O)C(=O)O Amb27489910 [0,2,0,0,0,0|1,0,1]=4 4892 B8R0.2 CCC(F)C(Br)C(=O)O Amb27858717 [0,2,0,0,0,0|1,0,0]=3 4893 B8R0.2 CCC(N)C(F)C(=O)O Amb33036406 [0,2,0,0,0,0|1,0,0]=3 4894 B8R0.2 CCC(N)C(O)C(N)=O Amb28055940 [0,2,0,0,0,0|2,0,0]=4 4895 B8R0.2 CCC(O)C(C)C(=O)O Amb10844267 [0,2,0,0,0,0|1,0,0]=3 4896 B8R0.2 CCC(O)C(C)C(C)=O Amb26336386 [0,2,0,0,0,0|2,0,0]=4 4897 B8R0.2 CCC(O)C(F)C(=O)O Amb33136388 [0,2,0,0,0,0|1,0,0]=3 4898 B8R0.2 CCC(O)C(N)C(=O)O Amb18203168 [0,2,0,0,0,0|1,0,0]=3 4899 B8R0.2 CCC(O)[C@H](N)C(=O)O Amb24364655 [0,2,0,0,0,0|1,0,0]=3 4900 B8R0.2 CCN(C)C(C)C(=O)O Amb8890967 [0,2,0,0,0,0|2,0,0]=4 4901 B8R0.2 CCN(C)[C@@H](C)C(=O)O Amb27228167 [0,2,0,0,0,0|2,0,0]=4 4902 B8R0.2 CCN(N)C(C)C(=O)O Amb27655613 [0,2,0,0,0,0|2,0,0]=4 4903 B8R0.2 CC[C@@H](C)C(Cl)C(=O)O Amb27472040 [0,2,0,0,0,0|1,0,0]=3 4904 B8R0.2 CC[C@@H](C)[C@@H](Br)C(=O)Cl Amb27194351 [0,2,0,0,0,0|2,0,0]=4 4905 B8R0.2 CC[C@@H](C)[C@@H](C)C(C)=O Amb27949165 [0,2,0,0,0,0|2,0,0]=4 4906 B8R0.2 CC[C@@H](C)[C@@H](C)C(N)=O Amb28049888 [0,2,0,0,0,0|2,0,0]=4 4907 B8R0.2 CC[C@@H](C)[C@@H](Cl)C(=O)O Amb28130604 [0,2,0,0,0,0|1,0,0]=3 4908 B8R0.2 CC[C@@H](C)[C@@H](F)C(=O)O Amb28347222 [0,2,0,0,0,0|1,0,0]=3 4909 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O Amb8513329 [0,2,0,0,0,0|1,0,0]=3 4910 B8R0.2 CC[C@@H](C)[C@@H](O)C(=O)O Amb26063750 [0,2,0,0,0,0|1,0,0]=3 4911 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O Amb26866576 [0,2,0,0,0,0|1,0,0]=3 4912 B8R0.2 CC[C@@H](C)[C@H](C)C(C)=O Amb25024740 [0,2,0,0,0,0|2,0,0]=4 4913 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O Amb10068321 [0,2,0,0,0,0|1,0,0]=3 4914 B8R0.2 CC[C@@H](O)[C@@H](C)C(=O)O Amb27879857 [0,2,0,0,0,0|1,0,0]=3 4915 B8R0.2 CC[C@@H](O)[C@@H](C)C(C)=O Amb26600956 [0,2,0,0,0,0|2,0,0]=4 4916 B8R0.2 CC[C@@H](O)[C@H](O)C(C)=O Amb27861441 [0,2,0,0,0,0|2,0,0]=4 4917 B8R0.2 CC[C@H](Br)[C@H](Br)C(=O)O Amb16233350 [0,2,0,0,0,0|1,0,0]=3 4918 B8R0.2 CC[C@H](C)C(=O)C(=O)O Amb28075584 [0,2,0,0,0,0|1,0,1]=4 4919 B8R0.2 CC[C@H](C)C(C)C(=O)O Amb27950556 [0,2,0,0,0,0|1,0,0]=3 4920 B8R0.2 CC[C@H](C)C(C)C(N)=O Amb28049537 [0,2,0,0,0,0|2,0,0]=4 4921 B8R0.2 CC[C@H](C)C(N)C(=O)O Amb27209489 [0,2,0,0,0,0|1,0,0]=3 4922 B8R0.2 CC[C@H](C)[C@@H](Br)C(=O)O Amb23401386 [0,2,0,0,0,0|1,0,0]=3 4923 B8R0.2 CC[C@H](C)[C@@H](C)C(C)=O Amb27250604 [0,2,0,0,0,0|2,0,0]=4 4924 B8R0.2 CC[C@H](C)[C@@H](F)C(=O)O Amb27954743 [0,2,0,0,0,0|1,0,0]=3 4925 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O Amb8516280 [0,2,0,0,0,0|1,0,0]=3 4926 B8R0.2 CC[C@H](C)[C@H](Br)C(N)=O Amb27235575 [0,2,0,0,0,0|2,0,0]=4 4927 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)Cl Amb27768651 [0,2,0,0,0,0|2,0,0]=4 4928 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O Amb22388560 [0,2,0,0,0,0|1,0,0]=3 4929 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O Amb3940753 [0,2,0,0,0,0|1,0,0]=3 4930 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O Amb10878815 [0,2,0,0,0,0|2,0,0]=4 4931 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O Amb9813724 [0,2,0,0,0,0|2,0,0]=4 4932 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O Amb2694797 [0,2,0,0,0,0|1,0,0]=3 4933 B8R0.2 CC[C@H](N)[C@H](C)C(=O)O Amb27779460 [0,2,0,0,0,0|1,0,0]=3 4934 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O Amb26981388 [0,2,0,0,0,0|1,0,0]=3 4935 B8R0.2 CC[C@H](O)[C@H](Br)C(=O)O Amb28285137 [0,2,0,0,0,0|1,0,0]=3 4936 B8R0.2 CC[C@H](O)[C@H](C)C(C)=O Amb27590145 [0,2,0,0,0,0|2,0,0]=4 4937 B8R0.2 CC[C@H](O)[C@H](N)C(=O)O Amb26024594 [0,2,0,0,0,0|1,0,0]=3 4938 B8R0.2 CNC(C)C(N)C(=O)O Amb18642890 [0,2,0,0,0,0|2,0,0]=4 4939 B8R0.2 COC(C)C(Br)C(=O)O Amb16233352 [0,2,0,0,0,0|2,0,0]=4 4940 B8R0.2 COC(C)C(C)C(=O)O Amb10844268 [0,2,0,0,0,0|2,0,0]=4 4941 B8R0.2 COC(C)C(N)C(=O)O Amb17938689 [0,2,0,0,0,0|2,0,0]=4 4942 B8R0.2 COC(C)C(O)C(=O)O Amb27816478 [0,2,0,0,0,0|2,0,0]=4 4943 B8R0.2 COC(C)[C@@H](C)C(=O)O Amb33729616 [0,2,0,0,0,0|2,0,0]=4 4944 B8R0.2 COC(C)[C@@H](N)C(=O)O Amb25733335 [0,2,0,0,0,0|2,0,0]=4 4945 B8R0.2 COC(C)[C@H](C)C(=O)O Amb25722336 [0,2,0,0,0,0|2,0,0]=4 4946 B8R0.2 COC(C)[C@H](N)C(=O)O Amb25881538 [0,2,0,0,0,0|2,0,0]=4 4947 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O Amb26036938 [0,2,0,0,0,0|2,0,0]=4 4948 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O Amb8390422 [0,2,0,0,0,0|2,0,0]=4 4949 B8R0.2 CO[C@H](C)[C@@H](Br)C(=O)O Amb27392325 [0,2,0,0,0,0|2,0,0]=4 4950 B8R0.2 CO[C@H](C)[C@@H](Cl)C(=O)O Amb27424722 [0,2,0,0,0,0|2,0,0]=4 4951 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O Amb16183892 [0,2,0,0,0,0|2,0,0]=4 4952 B8R0.2 CO[C@H](C)[C@H](O)C(=O)O Amb25316180 [0,2,0,0,0,0|2,0,0]=4 4953 B8R0.2 CS[C@H](C)[C@H](N)C(=O)O Amb27771288 [0,2,0,0,0,0|2,0,0]=4 4954 B8R0.2 C[C@@H](CN)N(C)C(N)=O Amb27974325 [0,2,0,0,0,0|2,0,0]=4 4955 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb24117487 [0,2,0,0,0,0|1,0,0]=3 4956 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb27828649 [0,2,0,0,0,0|1,0,0]=3 4957 B8R0.2 C[C@@H](CO)[C@H](N)C(=O)O Amb24117488 [0,2,0,0,0,0|1,0,0]=3 4958 B8R0.2 C[C@H](C(=O)O)[C@@H](O)CN Amb28056248 [0,2,0,0,0,0|0,0,0]=2 4959 B8R0.2 C[C@H](CN)[C@@H](O)C(=O)O Amb27455474 [0,2,0,0,0,0|0,0,0]=2 4960 B8R0.2 NC(=O)[C@@H](F)[C@@H](O)CO Amb27668286 [0,2,0,0,0,0|2,0,0]=4 4961 B8R0.2 NC(=O)[C@H](O)[C@@H](O)CO Amb27814631 [0,2,0,0,0,0|2,0,0]=4 4962 B8R0.2 NC(C(=O)O)C(F)CO Amb27950986 [0,2,0,0,0,0|1,0,0]=3 4963 B8R0.2 NC(C(=O)O)C(O)CCl Amb27846402 [0,2,0,0,0,0|1,0,0]=3 4964 B8R0.2 NC(C(=O)O)C(O)CF Amb27592597 [0,2,0,0,0,0|1,0,0]=3 4965 B8R0.2 NC(C(=O)O)C(S)CO Amb27199680 [0,2,0,0,0,0|1,0,0]=3 4966 B8R0.2 NC(CO)C(N)C(=O)O Amb28208230 [0,2,0,0,0,0|1,0,0]=3 4967 B8R0.2 NCC(O)C(N)C(=O)O Amb27876292 [0,2,0,0,0,0|0,0,0]=2 4968 B8R0.2 NCC(O)C(O)C(=O)O Amb27830532 [0,2,0,0,0,0|0,0,0]=2 4969 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb27945588 [0,2,0,0,0,0|0,0,0]=2 4970 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb33209939 [0,2,0,0,0,0|0,0,0]=2 4971 B8R0.2 NC[C@@H](O)[C@H](N)C(=O)O Amb30884414 [0,2,0,0,0,0|0,0,0]=2 4972 B8R0.2 NC[C@H](F)[C@H](F)C(=O)O Amb27224824 [0,2,0,0,0,0|0,0,0]=2 4973 B8R0.2 N[C@@H](C(=O)O)C(O)CBr Amb28245344 [0,2,0,0,0,0|1,0,0]=3 4974 B8R0.2 N[C@@H](C(=O)O)C(S)CO Amb27233478 [0,2,0,0,0,0|1,0,0]=3 4975 B8R0.2 N[C@@H](C(=O)O)[C@H](O)CO Amb24671346 [0,2,0,0,0,0|1,0,0]=3 4976 B8R0.2 N[C@H](C(=O)O)C(O)CCl Amb27212707 [0,2,0,0,0,0|1,0,0]=3 4977 B8R0.2 N[C@H](C(=O)O)C(O)CO Amb28255690 [0,2,0,0,0,0|1,0,0]=3 4978 B8R0.2 N[C@H](C(=O)O)[C@@H](O)CO Amb25678241 [0,2,0,0,0,0|1,0,0]=3 4979 B8R0.2 O=C(O)C(=O)C(O)CO Amb27408895 [0,2,0,0,0,0|1,0,1]=4 4980 B8R0.2 O=C(O)C(Br)C(Br)CBr Amb22347644 [0,2,0,0,0,0|1,0,0]=3 4981 B8R0.2 O=C(O)C(O)C(O)CO Amb22495524 [0,2,0,0,0,0|1,0,0]=3 4982 B8R0.2 O=C(O)[C@@H](F)[C@H](O)CO Amb27195151 [0,2,0,0,0,0|1,0,0]=3 4983 B8R0.2 O=C(O)[C@H](O)C(O)CO Amb27229496 [0,2,0,0,0,0|1,0,0]=3 4984 B8R0.2 O=C(O)[C@H](O)[C@@H](O)CO Amb27849401 [0,2,0,0,0,0|1,0,0]=3 4985 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO Amb32644462 [0,2,0,0,0,0|1,0,0]=3 4986 B8R0.2 O=C([O-])C(O)C(O)CO Amb22733096 [0,2,0,0,0,0|1,0,1]=4 4987 B8R0.2 O=C([O-])[C@@H](O)[C@H](O)CO Amb22744783 [0,2,0,0,0,0|1,0,1]=4 4988 B8R0.2 O=C([O-])[C@@H](O)[C@H](O)CO Amb32414707 [0,2,0,0,0,0|1,0,1]=4 4989 B8R0.2 O=CC(O)C(O)C(=O)O Amb18124399 [0,2,0,0,0,0|1,0,1]=4 4990 B8R0.2 O=C[C@H](O)[C@H](O)C(=O)O Amb27266059 [0,2,0,0,0,0|1,0,1]=4 4991 B8R0.5 C#CCC(C)CC(C)=O Amb24707587 [0,2,0,0,0,0|2,0,0]=4 4992 B8R0.5 C#CCC(N)CC(=O)O Amb26909337 [0,2,0,0,0,0|1,0,0]=3 4993 B8R0.5 C#CC[C@@H](N)CC(=O)O Amb22746284 [0,2,0,0,0,0|1,0,0]=3 4994 B8R0.5 C#CC[C@@H](N)CC(=O)O Amb24539924 [0,2,0,0,0,0|1,0,0]=3 4995 B8R0.5 C=C(Br)CN(C)CCN Amb19028446 [0,2,0,0,0,0|2,0,0]=4 4996 B8R0.5 C=C(C)CC(C)CCN Amb27210688 [0,2,0,0,0,0|2,0,0]=4 4997 B8R0.5 C=C=CC(C)CC(=O)O Amb27631675 [0,2,0,0,0,0|1,0,1]=4 4998 B8R0.5 C=CCC(C)CC(=O)O Amb18642628 [0,2,0,0,0,0|1,0,0]=3 4999 B8R0.5 C=CCC(C)CC(C)=O Amb17593320 [0,2,0,0,0,0|2,0,0]=4 5000 B8R0.5 C=CCC(N)CC(=O)O Amb22641964 [0,2,0,0,0,0|1,0,0]=3 5001 B8R0.5 C=CCC(N)CC(=O)O Amb31307622 [0,2,0,0,0,0|1,0,0]=3 5002 B8R0.5 C=CCC(O)CC(=O)O Amb18642785 [0,2,0,0,0,0|1,0,0]=3 5003 B8R0.5 C=CCN(C)CC(=O)O Amb9301047 [0,2,0,0,0,0|1,0,1]=4 5004 B8R0.5 C=CC[C@@H](C)CC(C)=O Amb27974516 [0,2,0,0,0,0|2,0,0]=4 5005 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb22746166 [0,2,0,0,0,0|1,0,0]=3 5006 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb2699117 [0,2,0,0,0,0|1,0,0]=3 5007 B8R0.5 C=CC[C@@H](O)CC(=O)O Amb28073530 [0,2,0,0,0,0|1,0,0]=3 5008 B8R0.5 C=CC[C@H](N)CC(=O)O Amb2699116 [0,2,0,0,0,0|1,0,0]=3 5009 B8R0.5 C=CC[C@H](N)CC(=O)O Amb33726074 [0,2,0,0,0,0|1,0,0]=3 5010 B8R0.5 C=CC[C@H](O)CC(=O)O Amb28345940 [0,2,0,0,0,0|1,0,0]=3 5011 B8R0.5 CC(=O)CC(C)CC=O Amb28076874 [0,2,0,0,0,0|2,0,0]=4 5012 B8R0.5 CC(=O)CC(O)CCBr Amb28290412 [0,2,0,0,0,0|2,0,0]=4 5013 B8R0.5 CC(=O)CN(C)CCO Amb10608107 [0,2,0,0,0,0|2,0,0]=4 5014 B8R0.5 CC(=O)C[C@@H](O)CCBr Amb27400290 [0,2,0,0,0,0|2,0,0]=4 5015 B8R0.5 CC(=O)C[C@H](C)CC=O Amb27265839 [0,2,0,0,0,0|2,0,0]=4 5016 B8R0.5 CC(=O)NC(C)CCO Amb27656183 [0,2,0,0,0,0|2,0,0]=4 5017 B8R0.5 CC(=O)NC(C)CON Amb17138376 [0,2,0,0,0,0|2,0,0]=4 5018 B8R0.5 CC(=O)N[C@H](C)CCO Amb28454929 [0,2,0,0,0,0|2,0,0]=4 5019 B8R0.5 CC(=O)OC(C)CCCl Amb27801962 [0,2,0,0,0,0|2,0,0]=4 5020 B8R0.5 CC(CC#N)CC(=O)O Amb18642506 [0,2,0,0,0,0|0,0,1]=3 5021 B8R0.5 CC(CC(=O)O)N=C=O Amb33471303 [0,2,0,0,0,0|1,0,1]=4 5022 B8R0.5 CC(CC(=O)O)N=C=S Amb33471532 [0,2,0,0,0,0|1,0,1]=4 5023 B8R0.5 CC(CC(=O)O)NC#N Amb35634497 [0,2,0,0,0,0|0,0,2]=4 5024 B8R0.5 CC(CC(=O)O)NC=O Amb18967805 [0,2,0,0,0,0|1,0,1]=4 5025 B8R0.5 CC(CCF)CC(=O)O Amb24477914 [0,2,0,0,0,0|1,0,0]=3 5026 B8R0.5 CC(CCN)CC(=O)O Amb20667689 [0,2,0,0,0,0|0,0,0]=2 5027 B8R0.5 CC(CCN)CC(=O)O Amb24376646 [0,2,0,0,0,0|0,0,0]=2 5028 B8R0.5 CC(CCN)C[PH](=O)O Amb28250150 [0,2,0,0,0,0|1,0,0]=3 5029 B8R0.5 CC(CCN)NS(C)=O Amb27185835 [0,2,0,0,0,0|2,0,0]=4 5030 B8R0.5 CC(CCO)CC(=O)O Amb18642882 [0,2,0,0,0,0|1,0,0]=3 5031 B8R0.5 CC(O)CN(C)CCN Amb19020546 [0,2,0,0,0,0|1,0,1]=4 5032 B8R0.5 CC(O)CS(=O)CCN Amb27775615 [0,2,0,0,0,0|1,0,1]=4 5033 B8R0.5 CCCC(=O)CC(C)=O Amb9775079 [0,2,0,0,0,0|2,0,0]=4 5034 B8R0.5 CCCC(=O)CC(N)=O Amb28290969 [0,2,0,0,0,0|2,0,0]=4 5035 B8R0.5 CCCC(Br)CC(C)=O Amb27974270 [0,2,0,0,0,0|2,0,0]=4 5036 B8R0.5 CCCC(C)CC(=O)O Amb6749227 [0,2,0,0,0,0|1,0,0]=3 5037 B8R0.5 CCCC(C)CC(C)=O Amb22229841 [0,2,0,0,0,0|2,0,0]=4 5038 B8R0.5 CCCC(C)CC(N)=O Amb25146057 [0,2,0,0,0,0|2,0,0]=4 5039 B8R0.5 CCCC(C)NC(=O)Cl Amb35637095 [0,2,0,0,0,0|2,0,0]=4 5040 B8R0.5 CCCC(C)OC(=O)Cl Amb27205395 [0,2,0,0,0,0|2,0,0]=4 5041 B8R0.5 CCCC(C)OC(C)=O Amb22732559 [0,2,0,0,0,0|2,0,0]=4 5042 B8R0.5 CCCC(C)OC(N)=O Amb27150798 [0,2,0,0,0,0|2,0,0]=4 5043 B8R0.5 CCCC(Cl)OC(C)=O Amb27490997 [0,2,0,0,0,0|2,0,0]=4 5044 B8R0.5 CCCC(N)CC(=O)O Amb1993864 [0,2,0,0,0,0|1,0,0]=3 5045 B8R0.5 CCCC(N)CC(C)=O Amb28069229 [0,2,0,0,0,0|2,0,0]=4 5046 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [0,2,0,0,0,0|2,0,0]=4 5047 B8R0.5 CCCC(O)CC(=O)O Amb2699832 [0,2,0,0,0,0|1,0,0]=3 5048 B8R0.5 CCCC(O)CC(C)=O Amb17593376 [0,2,0,0,0,0|2,0,0]=4 5049 B8R0.5 CCCC(O)SC(C)=O Amb27807055 [0,2,0,0,0,0|2,0,0]=4 5050 B8R0.5 CCCN(C)CC(=O)O Amb19373314 [0,2,0,0,0,0|1,0,0]=3 5051 B8R0.5 CCCN(C)CC(=O)O Amb8899167 [0,2,0,0,0,0|1,0,0]=3 5052 B8R0.5 CCCN(O)CC(=O)O Amb27850231 [0,2,0,0,0,0|1,0,0]=3 5053 B8R0.5 CCCS(=O)CC(=O)O Amb10608037 [0,2,0,0,0,0|1,0,0]=3 5054 B8R0.5 CCCS(=O)CC(C)=O Amb27180126 [0,2,0,0,0,0|2,0,0]=4 5055 B8R0.5 CCC[C@@H](N)CC(=O)O Amb22225223 [0,2,0,0,0,0|1,0,0]=3 5056 B8R0.5 CCC[C@@H](N)CC(=O)O Amb24739278 [0,2,0,0,0,0|1,0,0]=3 5057 B8R0.5 CCC[C@@H](O)CC(=O)O Amb25188904 [0,2,0,0,0,0|1,0,0]=3 5058 B8R0.5 CCC[C@@H](O)CC(C)=O Amb25190233 [0,2,0,0,0,0|2,0,0]=4 5059 B8R0.5 CCC[C@H](C)CC(=O)O Amb10844381 [0,2,0,0,0,0|1,0,0]=3 5060 B8R0.5 CCC[C@H](C)NC(C)=O Amb27655527 [0,2,0,0,0,0|2,0,0]=4 5061 B8R0.5 CCC[C@H](N)CC(=O)O Amb22226359 [0,2,0,0,0,0|1,0,0]=3 5062 B8R0.5 CCC[C@H](N)CC(=O)O Amb27464904 [0,2,0,0,0,0|1,0,0]=3 5063 B8R0.5 CCC[C@H](O)CC(=O)O Amb25367955 [0,2,0,0,0,0|1,0,0]=3 5064 B8R0.5 CCC\C(C)=C\C(=O)O Amb33528454 [0,2,0,0,0,0|1,0,1]=4 5065 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,2,0,0,0,0|1,0,1]=4 5066 B8R0.5 CCNC(C)CC(=O)O Amb13952759 [0,2,0,0,0,0|1,0,0]=3 5067 B8R0.5 CCNC(C)CC(=O)O Amb9398369 [0,2,0,0,0,0|1,0,0]=3 5068 B8R0.5 CCNC(C)CC(N)=O Amb17231866 [0,2,0,0,0,0|2,0,0]=4 5069 B8R0.5 CCOC(=N)CC(=O)O Amb26612803 [0,2,0,0,0,0|1,0,1]=4 5070 B8R0.5 CCOC(=O)CC(=O)O Amb22492654 [0,2,0,0,0,0|1,0,1]=4 5071 B8R0.5 CCOC(=O)CC(=O)O Amb3939916 [0,2,0,0,0,0|1,0,1]=4 5072 B8R0.5 CCOC(C)CC(=O)O Amb9397849 [0,2,0,0,0,0|1,0,0]=3 5073 B8R0.5 CCOC(C)CC(C)=O Amb25291783 [0,2,0,0,0,0|2,0,0]=4 5074 B8R0.5 CCO[C@@H](C)CC(C)=O Amb27424691 [0,2,0,0,0,0|2,0,0]=4 5075 B8R0.5 CCO[C@H](O)CC(C)=O Amb27838621 [0,2,0,0,0,0|2,0,0]=4 5076 B8R0.5 CCSC(=O)CC(=O)O Amb27406351 [0,2,0,0,0,0|1,0,1]=4 5077 B8R0.5 CCSC(C)CC(=O)O Amb9398136 [0,2,0,0,0,0|1,0,0]=3 5078 B8R0.5 CC\C=C(/Br)CC(=O)O Amb28208655 [0,2,0,0,0,0|1,0,1]=4 5079 B8R0.5 CN(CC#N)CC(=O)O Amb9301061 [0,2,0,0,0,0|0,0,2]=4 5080 B8R0.5 CN(CCF)CC(N)=O Amb27254943 [0,2,0,0,0,0|2,0,0]=4 5081 B8R0.5 CN(CCN)CC(=O)O Amb18313585 [0,2,0,0,0,0|0,0,0]=2 5082 B8R0.5 CN(CCN)CC(=O)O Amb32701580 [0,2,0,0,0,0|0,0,0]=2 5083 B8R0.5 CN(CCO)CC(=O)O Amb5767486 [0,2,0,0,0,0|1,0,0]=3 5084 B8R0.5 CNCC(C)CC(C)O Amb27786755 [0,2,0,0,0,0|1,0,1]=4 5085 B8R0.5 CNCC(C)OC(N)=O Amb28078033 [0,2,0,0,0,0|2,0,0]=4 5086 B8R0.5 CNCC(O)CC(=O)O Amb28423259 [0,2,0,0,0,0|0,0,0]=2 5087 B8R0.5 CNCC(O)CC(=O)O Amb32661843 [0,2,0,0,0,0|0,0,0]=2 5088 B8R0.5 CNCC(O)CS(C)=O Amb27477065 [0,2,0,0,0,0|2,0,0]=4 5089 B8R0.5 CNC[C@H](N)CC(=O)O Amb27798881 [0,2,0,0,0,0|0,0,0]=2 5090 B8R0.5 COCC(=O)CC(=O)O Amb24093174 [0,2,0,0,0,0|1,0,1]=4 5091 B8R0.5 COCC(C)CC(=O)O Amb19024342 [0,2,0,0,0,0|1,0,0]=3 5092 B8R0.5 COCC(C)CC(C)=O Amb27464321 [0,2,0,0,0,0|2,0,0]=4 5093 B8R0.5 COCC(C)CC(N)=O Amb27860801 [0,2,0,0,0,0|2,0,0]=4 5094 B8R0.5 COCC(N)CC(=O)O Amb26641146 [0,2,0,0,0,0|1,0,0]=3 5095 B8R0.5 COCC(N)CC(N)=O Amb33308419 [0,2,0,0,0,0|2,0,0]=4 5096 B8R0.5 COCC(O)CC(=O)O Amb18832518 [0,2,0,0,0,0|1,0,0]=3 5097 B8R0.5 COC[C@@H](O)CC(=O)O Amb33428853 [0,2,0,0,0,0|1,0,0]=3 5098 B8R0.5 COC[C@H](N)CC(=O)O Amb33038388 [0,2,0,0,0,0|1,0,0]=3 5099 B8R0.5 COC[C@H](N)CC(=O)O Amb33330661 [0,2,0,0,0,0|1,0,0]=3 5100 B8R0.5 COC[C@H](O)CC(=O)O Amb33428852 [0,2,0,0,0,0|1,0,0]=3 5101 B8R0.5 CONC(C)CC(=O)O Amb26844930 [0,2,0,0,0,0|2,0,0]=4 5102 B8R0.5 CPCC(N)CC(=O)O Amb27184896 [0,2,0,0,0,0|0,1,0]=3 5103 B8R0.5 CSCC(C)CC(=O)O Amb33273729 [0,2,0,0,0,0|1,0,0]=3 5104 B8R0.5 CSCC(N)CC(=O)O Amb25960719 [0,2,0,0,0,0|1,0,0]=3 5105 B8R0.5 CSCC(O)CC(=O)O Amb24621046 [0,2,0,0,0,0|1,0,0]=3 5106 B8R0.5 CSC[C@@H](N)CC(=O)O Amb27961000 [0,2,0,0,0,0|1,0,0]=3 5107 B8R0.5 CSC[C@@H](O)CC(=O)O Amb33271747 [0,2,0,0,0,0|1,0,0]=3 5108 B8R0.5 CSC[C@H](O)CC(=O)O Amb33271746 [0,2,0,0,0,0|1,0,0]=3 5109 B8R0.5 C[C@@H](CC(=O)O)N=[N+]=[N-] Amb27657105 [0,2,0,0,0,0|1,0,1]=4 5110 B8R0.5 C[C@@H](O)CN(C)CCN Amb27174180 [0,2,0,0,0,0|1,0,1]=4 5111 B8R0.5 C[C@H](CC(=O)O)N=C=O Amb33471360 [0,2,0,0,0,0|1,0,1]=4 5112 B8R0.5 C[C@H](CC(=O)O)N=C=S Amb33471590 [0,2,0,0,0,0|1,0,1]=4 5113 B8R0.5 C[C@H](CCO)CC(=O)O Amb27461411 [0,2,0,0,0,0|1,0,0]=3 5114 B8R0.5 C\C(=C\C(=O)O)CCS Amb28345950 [0,2,0,0,0,0|1,0,1]=4 5115 B8R0.5 C\C=C\C(N)CC(=O)O Amb25975538 [0,2,0,0,0,0|1,0,1]=4 5116 B8R0.5 C\C=C\C(O)CC(=O)O Amb8398291 [0,2,0,0,0,0|1,0,1]=4 5117 B8R0.5 C\C=C\[C@H](C)CC(=O)O Amb28047718 [0,2,0,0,0,0|1,0,1]=4 5118 B8R0.5 N#CCC(O)CC(=O)O Amb27249794 [0,2,0,0,0,0|0,0,1]=3 5119 B8R0.5 N#CCC(O)CC(N)=O Amb27259184 [0,2,0,0,0,0|1,0,1]=4 5120 B8R0.5 N#CCS(=O)CC(=O)O Amb18984975 [0,2,0,0,0,0|0,0,2]=4 5121 B8R0.5 N#CC[C@@H](O)CC(N)=O Amb22225367 [0,2,0,0,0,0|1,0,1]=4 5122 B8R0.5 N#CC[C@H](O)CC(N)=O Amb22226710 [0,2,0,0,0,0|1,0,1]=4 5123 B8R0.5 NC(CCF)CC(=O)O Amb33038391 [0,2,0,0,0,0|1,0,0]=3 5124 B8R0.5 NCCC(=O)NC(N)=O Amb20623770 [0,2,0,0,0,0|1,0,1]=4 5125 B8R0.5 NCCC(=O)NC(N)=O Amb22058738 [0,2,0,0,0,0|1,0,1]=4 5126 B8R0.5 NCCC(N)CC(=O)O Amb26043872 [0,2,0,0,0,0|0,0,0]=2 5127 B8R0.5 NCCC(O)CC(=O)O Amb27882021 [0,2,0,0,0,0|0,0,0]=2 5128 B8R0.5 NCCC(O)CC(=O)O Amb31031000 [0,2,0,0,0,0|0,0,0]=2 5129 B8R0.5 NCCS(=O)CC(N)=O Amb28456172 [0,2,0,0,0,0|1,0,0]=3 5130 B8R0.5 NCC[C@H](N)CC(=O)O Amb10067021 [0,2,0,0,0,0|0,0,0]=2 5131 B8R0.5 NCC[C@H](N)CC(=O)O Amb35750363 [0,2,0,0,0,0|0,0,0]=2 5132 B8R0.5 N[C@H](CCO)CC(=O)O Amb27169169 [0,2,0,0,0,0|1,0,0]=3 5133 B8R0.5 O=C(O)CC(O)CCF Amb33196428 [0,2,0,0,0,0|1,0,0]=3 5134 B8R0.5 O=C(O)CC(O)CCO Amb31031042 [0,2,0,0,0,0|1,0,0]=3 5135 B8R0.5 O=C(O)CC(O)CNO Amb28044304 [0,2,0,0,0,0|0,0,0]=2 5136 B8R0.5 O=C(O)C[C@@H](O)CCF Amb33196426 [0,2,0,0,0,0|1,0,0]=3 5137 B8R0.5 O=C(O)C[C@H](O)CCF Amb33196427 [0,2,0,0,0,0|1,0,0]=3 5138 B8R0.5 O=C(O)\C=C(/Cl)CCO Amb27845284 [0,2,0,0,0,0|1,0,1]=4 5139 B8R0.16 C#CC(C#N)CC(=O)O Amb28144249 [0,2,0,0,0,0|0,0,2]=4 5140 B8R0.16 C=CC(C=C)CC(=O)O Amb18642422 [0,2,0,0,0,0|1,0,1]=4 5141 B8R0.16 C=CC(CC)CC(=O)O Amb18642661 [0,2,0,0,0,0|1,0,0]=3 5142 B8R0.16 C=C[C@@H](CC)CC(=O)O Amb27784737 [0,2,0,0,0,0|1,0,0]=3 5143 B8R0.16 CC(=O)OC(CN)CBr Amb28244785 [0,2,0,0,0,0|2,0,0]=4 5144 B8R0.16 CC(=O)SC(CN)CN Amb24117511 [0,2,0,0,0,0|2,0,0]=4 5145 B8R0.16 CCC(C#N)CC(=O)O Amb26871850 [0,2,0,0,0,0|1,0,0]=3 5146 B8R0.16 CCC(C=O)CC(C)=O Amb18642641 [0,2,0,0,0,0|2,0,0]=4 5147 B8R0.16 CCC(CC(=O)O)OC Amb19037306 [0,2,0,0,0,0|1,0,0]=3 5148 B8R0.16 CCC(CC(=O)O)SC Amb18316304 [0,2,0,0,0,0|1,0,0]=3 5149 B8R0.16 CCC(CC(C)=O)OC Amb25053006 [0,2,0,0,0,0|2,0,0]=4 5150 B8R0.16 CCC(CC(N)=O)NC Amb27666636 [0,2,0,0,0,0|2,0,0]=4 5151 B8R0.16 CCC(CC(N)=O)OC Amb2611703 [0,2,0,0,0,0|2,0,0]=4 5152 B8R0.16 CCC(CC(N)=O)SC Amb27809399 [0,2,0,0,0,0|2,0,0]=4 5153 B8R0.16 CCC(CC)CC(=O)O Amb6749211 [0,2,0,0,0,0|1,0,0]=3 5154 B8R0.16 CCC(CC)CC(C)=O Amb25791160 [0,2,0,0,0,0|2,0,0]=4 5155 B8R0.16 CCC(CC)CC(N)=O Amb28072905 [0,2,0,0,0,0|2,0,0]=4 5156 B8R0.16 CCC(CN)CC(=O)O Amb20669457 [0,2,0,0,0,0|0,0,0]=2 5157 B8R0.16 CCC(CN)CC(=O)O Amb22059482 [0,2,0,0,0,0|0,0,0]=2 5158 B8R0.16 CCC(CN)NC(C)=O Amb18112590 [0,2,0,0,0,0|2,0,0]=4 5159 B8R0.16 CCC(CN)NC(N)=O Amb18908302 [0,2,0,0,0,0|2,0,0]=4 5160 B8R0.16 CCN(C#N)CC(=O)O Amb35634503 [0,2,0,0,0,0|2,0,0]=4 5161 B8R0.16 CCN(C=O)CC(=O)O Amb18972736 [0,2,0,0,0,0|2,0,0]=4 5162 B8R0.16 CCN(CC)CC(=O)O Amb19258254 [0,2,0,0,0,0|2,0,0]=4 5163 B8R0.16 CCN(CC)CC(=O)O Amb2721806 [0,2,0,0,0,0|2,0,0]=4 5164 B8R0.16 CC[C@H](C=O)CC(=O)[O-] Amb28198369 [0,2,0,0,0,0|1,0,1]=4 5165 B8R0.16 CC\[N+](CC(=O)O)=N\[O-] Amb25365958 [0,2,0,0,0,0|2,0,0]=4 5166 B8R0.16 CNC(CN)CC(N)=O Amb28247281 [0,2,0,0,0,0|1,0,0]=3 5167 B8R0.16 COC(CC(=O)O)OC Amb22231899 [0,2,0,0,0,0|2,0,0]=4 5168 B8R0.16 COC(CCl)CC(C)=O Amb28364308 [0,2,0,0,0,0|2,0,0]=4 5169 B8R0.16 COC(CN)CC(=O)O Amb27806172 [0,2,0,0,0,0|0,0,0]=2 5170 B8R0.16 COC(CN)CC(=O)O Amb28555397 [0,2,0,0,0,0|0,0,0]=2 5171 B8R0.16 COC(CN)CC(N)=O Amb28189645 [0,2,0,0,0,0|1,0,0]=3 5172 B8R0.16 COC(CN)CC(N)=O Amb32952894 [0,2,0,0,0,0|1,0,0]=3 5173 B8R0.16 CSC(CC(=O)O)SC Amb27165674 [0,2,0,0,0,0|2,0,0]=4 5174 B8R0.16 CSC(CCl)CC(=O)O Amb28042698 [0,2,0,0,0,0|1,0,0]=3 5175 B8R0.16 C\C=C(/CC)CC(=O)O Amb27473412 [0,2,0,0,0,0|1,0,1]=4 5176 B8R0.16 NCC(CF)CC(=O)O Amb27244579 [0,2,0,0,0,0|0,0,0]=2 5177 B8R0.16 NCC(CO)CC(=O)O Amb22546422 [0,2,0,0,0,0|0,0,0]=2 5178 B8R0.16 NC\C(=C/F)CC(=O)O Amb27960296 [0,2,0,0,0,0|0,0,1]=3 5179 B8R0.16 O=C(Cl)CC(CF)CCl Amb27955884 [0,2,0,0,0,0|2,0,0]=4 5180 B8R0.16 O=C(Cl)C[C@@H](CF)CCl Amb27478061 [0,2,0,0,0,0|2,0,0]=4 5181 B8R0.16 O=C(O)CC(CF)CF Amb27448541 [0,2,0,0,0,0|1,0,0]=3 5182 B8R0.16 O=C(O)CC(CO)CCl Amb27468690 [0,2,0,0,0,0|1,0,0]=3 5183 B8R0.16 O=C(O)CN(CO)CO Amb27412887 [0,2,0,0,0,0|2,0,0]=4 5184 B8R0.19 C#CC(=O)NC(C)CN Amb18251099 [0,2,0,0,0,0|2,0,0]=4 5185 B8R0.19 C#CC(O)CC(=O)OC Amb28078873 [0,2,0,0,0,0|1,0,1]=4 5186 B8R0.19 C#CC(O)CC(C)CN Amb35584628 [0,2,0,0,0,0|1,0,1]=4 5187 B8R0.19 C#C[C@@H](N)CC(=O)OC Amb27393788 [0,2,0,0,0,0|1,0,1]=4 5188 B8R0.19 C=C(CBr)CC(=O)OC Amb28076120 [0,2,0,0,0,0|1,0,1]=4 5189 B8R0.19 C=C(CCl)CC(=O)OC Amb24053257 [0,2,0,0,0,0|1,0,1]=4 5190 B8R0.19 C=C(CO)CC(=O)OC Amb28455395 [0,2,0,0,0,0|1,0,1]=4 5191 B8R0.19 C=CC(=O)C[C@@H](C)CC Amb27838707 [0,2,0,0,0,0|2,0,0]=4 5192 B8R0.19 C=CC(=O)NC(C)CN Amb18908294 [0,2,0,0,0,0|2,0,0]=4 5193 B8R0.19 C=CC(=O)N[C@H](C)CN Amb28125066 [0,2,0,0,0,0|2,0,0]=4 5194 B8R0.19 CC(CN)CC(=O)NO Amb27395401 [0,2,0,0,0,0|0,0,0]=2 5195 B8R0.19 CC(CN)CC(C)CO Amb32759400 [0,2,0,0,0,0|1,0,1]=4 5196 B8R0.19 CC(CO)NC(=O)CO Amb27652814 [0,2,0,0,0,0|2,0,0]=4 5197 B8R0.19 CCC(=O)CC(=O)OC Amb2691582 [0,2,0,0,0,0|1,0,1]=4 5198 B8R0.19 CCC(=O)CC(C)CC Amb9702836 [0,2,0,0,0,0|2,0,0]=4 5199 B8R0.19 CCC(=O)CC(O)CC Amb28144079 [0,2,0,0,0,0|2,0,0]=4 5200 B8R0.19 CCC(=O)N[C@@H](C)CN Amb27854133 [0,2,0,0,0,0|2,0,0]=4 5201 B8R0.19 CCC(=O)N[C@H](C)CN Amb27779792 [0,2,0,0,0,0|2,0,0]=4 5202 B8R0.19 CCC(Br)CC(=O)OC Amb27477901 [0,2,0,0,0,0|1,0,0]=3 5203 B8R0.19 CCC(C)CC(=O)CCl Amb22395327 [0,2,0,0,0,0|2,0,0]=4 5204 B8R0.19 CCC(C)CC(=O)CO Amb26515791 [0,2,0,0,0,0|1,0,0]=3 5205 B8R0.19 CCC(C)CC(=O)NO Amb28321295 [0,2,0,0,0,0|1,0,0]=3 5206 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [0,2,0,0,0,0|1,0,0]=3 5207 B8R0.19 CCC(C)C\C(N)=N\O Amb24415677 [0,2,0,0,0,0|2,0,0]=4 5208 B8R0.19 CCC(C)NC(=O)CO Amb5798172 [0,2,0,0,0,0|2,0,0]=4 5209 B8R0.19 CCC(Cl)CC(=O)OC Amb27971680 [0,2,0,0,0,0|1,0,0]=3 5210 B8R0.19 CCC(N)CC(=O)OC Amb18203185 [0,2,0,0,0,0|1,0,0]=3 5211 B8R0.19 CCC(N)CC(=O)OC Amb22264719 [0,2,0,0,0,0|1,0,0]=3 5212 B8R0.19 CCC(N)C\C(N)=N\O Amb24379538 [0,2,0,0,0,0|2,0,0]=4 5213 B8R0.19 CCC(O)CC(=O)OC Amb24425172 [0,2,0,0,0,0|1,0,0]=3 5214 B8R0.19 CCN(C)CC(=O)OC Amb8873255 [0,2,0,0,0,0|2,0,0]=4 5215 B8R0.19 CCS(=O)C[C@H](O)CN Amb28453779 [0,2,0,0,0,0|2,0,0]=4 5216 B8R0.19 CC[C@@H](C)CC(=O)OC Amb28059460 [0,2,0,0,0,0|1,0,0]=3 5217 B8R0.19 CC[C@@H](N)CC(=O)OC Amb20241226 [0,2,0,0,0,0|1,0,0]=3 5218 B8R0.19 CC[C@@H](N)CC(=O)OC Amb26016603 [0,2,0,0,0,0|1,0,0]=3 5219 B8R0.19 CC[C@@H](O)CC(=O)OC Amb22224793 [0,2,0,0,0,0|1,0,0]=3 5220 B8R0.19 CC[C@H](C)CC(=O)NC Amb27596095 [0,2,0,0,0,0|2,0,0]=4 5221 B8R0.19 CC[C@H](C)NC(=O)OC Amb28049899 [0,2,0,0,0,0|2,0,0]=4 5222 B8R0.19 CC[C@H](N)CC(=O)OC Amb27411455 [0,2,0,0,0,0|1,0,0]=3 5223 B8R0.19 CC[C@H](N)CC(=O)OC Amb33457880 [0,2,0,0,0,0|1,0,0]=3 5224 B8R0.19 CC[C@H](O)CC(=O)OC Amb20240681 [0,2,0,0,0,0|1,0,0]=3 5225 B8R0.19 CNC(=O)CC(C)CN Amb27961028 [0,2,0,0,0,0|1,0,0]=3 5226 B8R0.19 CNC(=O)CC(O)CO Amb25960171 [0,2,0,0,0,0|2,0,0]=4 5227 B8R0.19 CNC(=O)N[C@H](C)CN Amb27812083 [0,2,0,0,0,0|2,0,0]=4 5228 B8R0.19 CNC(C)CC(=O)OC Amb9398364 [0,2,0,0,0,0|2,0,0]=4 5229 B8R0.19 CN[C@H](C)CC(=O)OC Amb33495831 [0,2,0,0,0,0|2,0,0]=4 5230 B8R0.19 COC(=O)CC(=O)CCl Amb3940254 [0,2,0,0,0,0|1,0,1]=4 5231 B8R0.19 COC(=O)CC(=O)CF Amb27409309 [0,2,0,0,0,0|1,0,1]=4 5232 B8R0.19 COC(=O)CC(C)C#N Amb17334095 [0,2,0,0,0,0|0,0,2]=4 5233 B8R0.19 COC(=O)CC(C)C=O Amb18642765 [0,2,0,0,0,0|1,0,1]=4 5234 B8R0.19 COC(=O)CC(C)CBr Amb24692917 [0,2,0,0,0,0|1,0,0]=3 5235 B8R0.19 COC(=O)CC(C)CN Amb18642843 [0,2,0,0,0,0|0,0,0]=2 5236 B8R0.19 COC(=O)CC(C)CN Amb33457749 [0,2,0,0,0,0|0,0,0]=2 5237 B8R0.19 COC(=O)CC(C)OC Amb9397848 [0,2,0,0,0,0|2,0,0]=4 5238 B8R0.19 COC(=O)CC(C)SC Amb19374125 [0,2,0,0,0,0|2,0,0]=4 5239 B8R0.19 COC(=O)CC(F)C=O Amb27173133 [0,2,0,0,0,0|1,0,1]=4 5240 B8R0.19 COC(=O)CC(F)CBr Amb28400231 [0,2,0,0,0,0|1,0,0]=3 5241 B8R0.19 COC(=O)CC(F)CN Amb28400247 [0,2,0,0,0,0|0,0,0]=2 5242 B8R0.19 COC(=O)CC(N)CN Amb22264781 [0,2,0,0,0,0|0,0,0]=2 5243 B8R0.19 COC(=O)CC(O)CCl Amb20241285 [0,2,0,0,0,0|1,0,0]=3 5244 B8R0.19 COC(=O)CC(O)CF Amb26920791 [0,2,0,0,0,0|1,0,0]=3 5245 B8R0.19 COC(=O)CC(O)CN Amb25146166 [0,2,0,0,0,0|0,0,0]=2 5246 B8R0.19 COC(=O)CC(O)CN Amb32668884 [0,2,0,0,0,0|0,0,0]=2 5247 B8R0.19 COC(=O)CC(O)CO Amb6600485 [0,2,0,0,0,0|1,0,0]=3 5248 B8R0.19 COC(=O)CC([NH3+])C[NH3+] Amb24112943 [0,2,0,0,0,0|0,0,1]=3 5249 B8R0.19 COC(=O)C[C@@H](C)C=O Amb27863686 [0,2,0,0,0,0|1,0,1]=4 5250 B8R0.19 COC(=O)C[C@@H](C)CN Amb27216066 [0,2,0,0,0,0|0,0,0]=2 5251 B8R0.19 COC(=O)C[C@@H](C)CO Amb22747755 [0,2,0,0,0,0|1,0,0]=3 5252 B8R0.19 COC(=O)C[C@@H](O)CBr Amb23437907 [0,2,0,0,0,0|1,0,0]=3 5253 B8R0.19 COC(=O)C[C@@H](O)CCl Amb8394990 [0,2,0,0,0,0|1,0,0]=3 5254 B8R0.19 COC(=O)C[C@@H](O)CF Amb33358243 [0,2,0,0,0,0|1,0,0]=3 5255 B8R0.19 COC(=O)C[C@@H](O)CN Amb24113025 [0,2,0,0,0,0|0,0,0]=2 5256 B8R0.19 COC(=O)C[C@@H](O)CN Amb33330793 [0,2,0,0,0,0|0,0,0]=2 5257 B8R0.19 COC(=O)C[C@H](C)C=O Amb28366984 [0,2,0,0,0,0|1,0,1]=4 5258 B8R0.19 COC(=O)C[C@H](C)CN Amb27202560 [0,2,0,0,0,0|0,0,0]=2 5259 B8R0.19 COC(=O)C[C@H](C)CO Amb27831499 [0,2,0,0,0,0|1,0,0]=3 5260 B8R0.19 COC(=O)C[C@H](O)CBr Amb8384043 [0,2,0,0,0,0|1,0,0]=3 5261 B8R0.19 COC(=O)C[C@H](O)CCl Amb2695337 [0,2,0,0,0,0|1,0,0]=3 5262 B8R0.19 COC(=O)C[C@H](O)CF Amb33358247 [0,2,0,0,0,0|1,0,0]=3 5263 B8R0.19 COC(=O)C[C@H](O)CN Amb26604358 [0,2,0,0,0,0|0,0,0]=2 5264 B8R0.19 COC(=O)C[C@H](O)CN Amb33331047 [0,2,0,0,0,0|0,0,0]=2 5265 B8R0.19 COC(=O)C[C@H](O)CO Amb13883661 [0,2,0,0,0,0|1,0,0]=3 5266 B8R0.19 COC(=O)NC(=O)CN Amb28280461 [0,2,0,0,0,0|1,0,1]=4 5267 B8R0.19 COC(=O)NC(C)CN Amb18251139 [0,2,0,0,0,0|1,0,0]=3 5268 B8R0.19 COC(=O)N[C@@H](C)CN Amb28071139 [0,2,0,0,0,0|1,0,0]=3 5269 B8R0.19 COC(=O)N[C@@H](C)CO Amb27238443 [0,2,0,0,0,0|2,0,0]=4 5270 B8R0.19 COC(=O)N[C@H](C)CN Amb27794832 [0,2,0,0,0,0|1,0,0]=3 5271 B8R0.19 COC(=O)OC(C)CBr Amb28348252 [0,2,0,0,0,0|2,0,0]=4 5272 B8R0.19 COC(=O)OC(C)CO Amb28315454 [0,2,0,0,0,0|2,0,0]=4 5273 B8R0.19 COC(=O)O[C@H](C)CO Amb27981874 [0,2,0,0,0,0|2,0,0]=4 5274 B8R0.19 CON(C)CC(C)CN Amb28065787 [0,2,0,0,0,0|2,0,0]=4 5275 B8R0.19 C[C@H](CN)NC(=O)CN Amb27771512 [0,2,0,0,0,0|2,0,0]=4 5276 B8R0.19 NCC(=O)NC(N)CN Amb27413779 [0,2,0,0,0,0|2,0,0]=4 5277 B8R0.19 NNC(=O)CC(O)CCl Amb19942496 [0,2,0,0,0,0|2,0,0]=4 5278 B8R0.19 O=C(CO)CC(O)CO Amb26067178 [0,2,0,0,0,0|1,0,0]=3 5279 B8R0.19 O=CC(=O)CC(O)CO Amb28202610 [0,2,0,0,0,0|1,0,1]=4 5280 B8R0.19 O=CC(=O)C[C@@H](O)CO Amb27873015 [0,2,0,0,0,0|1,0,1]=4 5281 B8R0.19 O=CC(O)CC(=O)CO Amb28144194 [0,2,0,0,0,0|1,0,1]=4 5282 B8R0.19 O=CC(O)CC(O)CO Amb22731319 [0,2,0,0,0,0|1,0,1]=4 5283 B8R0.19 O=C[C@@H](O)C[C@@H](O)CO Amb27394636 [0,2,0,0,0,0|1,0,1]=4 5284 B8R0.19 O=C[C@@H](O)C[C@H](O)CO Amb28388612 [0,2,0,0,0,0|1,0,1]=4 5285 B8R0.19 O=C[C@H](O)CC(=O)CO Amb28121885 [0,2,0,0,0,0|1,0,1]=4 5286 B8R0.19 [C-]#[N+]C(C)CC(=O)OC Amb2688934 [0,2,0,0,0,0|2,0,0]=4 5287 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [0,2,0,0,0,0|1,0,1]=4 5288 B8R0.23 C=C(Br)CC(N)C(=O)O Amb24557771 [0,2,0,0,0,0|1,0,1]=4 5289 B8R0.23 C=C(Br)C[C@@H](N)C(=O)O Amb22746251 [0,2,0,0,0,0|1,0,1]=4 5290 B8R0.23 C=C(Br)C[C@H](N)C(=O)O Amb25918807 [0,2,0,0,0,0|1,0,1]=4 5291 B8R0.23 C=C(Br)[C@@H](O)CC(=O)O Amb27392180 [0,2,0,0,0,0|1,0,1]=4 5292 B8R0.23 C=C(C)C(C)CC(=O)O Amb18642614 [0,2,0,0,0,0|1,0,1]=4 5293 B8R0.23 C=C(C)C(N)CC(=O)O Amb2697570 [0,2,0,0,0,0|1,0,1]=4 5294 B8R0.23 C=C(C)C(O)CC(=O)O Amb18642756 [0,2,0,0,0,0|1,0,1]=4 5295 B8R0.23 C=C(C)C(O)CC(C)N Amb35583525 [0,2,0,0,0,0|2,0,0]=4 5296 B8R0.23 C=C(C)CC(C)C(=O)O Amb24471924 [0,2,0,0,0,0|1,0,1]=4 5297 B8R0.23 C=C(C)CC(N)C(=O)O Amb6280366 [0,2,0,0,0,0|1,0,1]=4 5298 B8R0.23 C=C(C)CC(O)C(=O)O Amb24534477 [0,2,0,0,0,0|1,0,1]=4 5299 B8R0.23 C=C(C)CC(O)C(C)N Amb35588698 [0,2,0,0,0,0|2,0,0]=4 5300 B8R0.23 C=C(C)CC(O)[C@@H](C)N Amb35624113 [0,2,0,0,0,0|2,0,0]=4 5301 B8R0.23 C=C(C)CC(O)[C@H](C)N Amb35737769 [0,2,0,0,0,0|2,0,0]=4 5302 B8R0.23 C=C(C)C[C@@H](C)C(=O)O Amb24340253 [0,2,0,0,0,0|1,0,1]=4 5303 B8R0.23 C=C(C)C[C@@H](C)[C@H](C)N Amb28074299 [0,2,0,0,0,0|2,0,0]=4 5304 B8R0.23 C=C(C)C[C@@H](N)C(=O)O Amb22801689 [0,2,0,0,0,0|1,0,1]=4 5305 B8R0.23 C=C(C)C[C@H](C)C(=O)O Amb10843988 [0,2,0,0,0,0|1,0,1]=4 5306 B8R0.23 C=C(C)C[C@H](N)C(=O)O Amb25757900 [0,2,0,0,0,0|1,0,1]=4 5307 B8R0.23 C=C(C)[C@@H](O)CC(=O)O Amb25789715 [0,2,0,0,0,0|1,0,1]=4 5308 B8R0.23 C=C(C)[C@H](C)CC(=O)O Amb27447241 [0,2,0,0,0,0|1,0,1]=4 5309 B8R0.23 C=C(C)[C@H](O)CC(=O)O Amb28286173 [0,2,0,0,0,0|1,0,1]=4 5310 B8R0.23 C=C(CC(=O)O)C(N)=O Amb22011744 [0,2,0,0,0,0|0,0,2]=4 5311 B8R0.23 C=C(CC(C)C)C(=O)O Amb33542856 [0,2,0,0,0,0|1,0,1]=4 5312 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb24411473 [0,2,0,0,0,0|1,0,1]=4 5313 B8R0.23 C=C(Cl)CC(N)C(=O)O Amb28935021 [0,2,0,0,0,0|1,0,1]=4 5314 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660529 [0,2,0,0,0,0|1,0,1]=4 5315 B8R0.23 C=C(Cl)C[C@@H](N)C(=O)O Amb32660530 [0,2,0,0,0,0|1,0,1]=4 5316 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb28059492 [0,2,0,0,0,0|1,0,1]=4 5317 B8R0.23 C=C(Cl)C[C@H](N)C(=O)O Amb32656263 [0,2,0,0,0,0|1,0,1]=4 5318 B8R0.23 C=C(F)CC(C)C(=O)O Amb27975781 [0,2,0,0,0,0|1,0,1]=4 5319 B8R0.23 C=C(F)CC(Cl)C(=O)O Amb27876022 [0,2,0,0,0,0|1,0,1]=4 5320 B8R0.23 C=C(F)C[C@@H](N)C(=O)O Amb27771842 [0,2,0,0,0,0|1,0,1]=4 5321 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,2,0,0,0,0|2,0,0]=4 5322 B8R0.23 CC(=O)C(Br)CC(=O)O Amb27834306 [0,2,0,0,0,0|1,0,1]=4 5323 B8R0.23 CC(=O)C(C)CC(=O)O Amb18292788 [0,2,0,0,0,0|1,0,1]=4 5324 B8R0.23 CC(=O)C(C)CC(C)C Amb24640121 [0,2,0,0,0,0|2,0,0]=4 5325 B8R0.23 CC(=O)C(Cl)CC(C)O Amb27454439 [0,2,0,0,0,0|2,0,0]=4 5326 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [0,2,0,0,0,0|1,0,1]=4 5327 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,2,0,0,0,0|1,0,1]=4 5328 B8R0.23 CC(=O)C(O)CC(=O)O Amb25341886 [0,2,0,0,0,0|1,0,1]=4 5329 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [0,2,0,0,0,0|2,0,0]=4 5330 B8R0.23 CC(=O)CC(Br)C(C)C Amb28436887 [0,2,0,0,0,0|2,0,0]=4 5331 B8R0.23 CC(=O)CC(C)C(=O)O Amb3939893 [0,2,0,0,0,0|1,0,1]=4 5332 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [0,2,0,0,0,0|1,0,1]=4 5333 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [0,2,0,0,0,0|1,0,1]=4 5334 B8R0.23 CC(=O)CC(N)C(C)C Amb27409984 [0,2,0,0,0,0|2,0,0]=4 5335 B8R0.23 CC(=O)CC(N)C(N)=O Amb27485103 [0,2,0,0,0,0|1,0,1]=4 5336 B8R0.23 CC(=O)CC(O)C(=O)O Amb22500917 [0,2,0,0,0,0|1,0,1]=4 5337 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [0,2,0,0,0,0|1,0,1]=4 5338 B8R0.23 CC(=O)C[C@@H](O)C(=O)O Amb26845481 [0,2,0,0,0,0|1,0,1]=4 5339 B8R0.23 CC(=O)C[C@@H](O)C(C)C Amb25135567 [0,2,0,0,0,0|2,0,0]=4 5340 B8R0.23 CC(=O)C[C@H](C)C(=O)O Amb26318005 [0,2,0,0,0,0|1,0,1]=4 5341 B8R0.23 CC(=O)C[C@H](C)C(C)C Amb28285288 [0,2,0,0,0,0|2,0,0]=4 5342 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [0,2,0,0,0,0|1,0,1]=4 5343 B8R0.23 CC(=O)C[C@H](O)C(=O)O Amb24358758 [0,2,0,0,0,0|1,0,1]=4 5344 B8R0.23 CC(=O)[C@@H](N)CC(C)C Amb28344512 [0,2,0,0,0,0|2,0,0]=4 5345 B8R0.23 CC(=O)[C@@H](N)CC(N)=O Amb28044564 [0,2,0,0,0,0|1,0,1]=4 5346 B8R0.23 CC(=O)[C@@H](O)CC(=O)O Amb28398474 [0,2,0,0,0,0|1,0,1]=4 5347 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [0,2,0,0,0,0|2,0,0]=4 5348 B8R0.23 CC(=O)[C@H](C)CC(=O)O Amb25360184 [0,2,0,0,0,0|1,0,1]=4 5349 B8R0.23 CC(=O)[C@H](N)CC(C)C Amb27490707 [0,2,0,0,0,0|2,0,0]=4 5350 B8R0.23 CC(Br)CC(=O)C(=O)O Amb28146183 [0,2,0,0,0,0|1,0,1]=4 5351 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [0,2,0,0,0,0|1,0,0]=3 5352 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,2,0,0,0,0|1,0,0]=3 5353 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,2,0,0,0,0|2,0,0]=4 5354 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [0,2,0,0,0,0|1,0,0]=3 5355 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [0,2,0,0,0,0|1,0,0]=3 5356 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [0,2,0,0,0,0|1,0,0]=3 5357 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,2,0,0,0,0|2,0,0]=4 5358 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [0,2,0,0,0,0|1,0,0]=3 5359 B8R0.23 CC(C)CC(=N)C(=O)O Amb27268516 [0,2,0,0,0,0|1,0,1]=4 5360 B8R0.23 CC(C)CC(=O)C(=O)O Amb8387123 [0,2,0,0,0,0|1,0,1]=4 5361 B8R0.23 CC(C)CC(Br)C(=O)Cl Amb26515942 [0,2,0,0,0,0|2,0,0]=4 5362 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [0,2,0,0,0,0|1,0,0]=3 5363 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [0,2,0,0,0,0|1,0,0]=3 5364 B8R0.23 CC(C)CC(Cl)C(=O)Cl Amb27400431 [0,2,0,0,0,0|2,0,0]=4 5365 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [0,2,0,0,0,0|1,0,0]=3 5366 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [0,2,0,0,0,0|1,0,0]=3 5367 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [0,2,0,0,0,0|1,0,0]=3 5368 B8R0.23 CC(C)CC(N)C(N)=O Amb6334827 [0,2,0,0,0,0|2,0,0]=4 5369 B8R0.23 CC(C)CC(N)C(N)=O Amb9729639 [0,2,0,0,0,0|2,0,0]=4 5370 B8R0.23 CC(C)CC(N)[PH](=O)O Amb27831348 [0,2,0,0,0,0|2,0,0]=4 5371 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [0,2,0,0,0,0|1,0,0]=3 5372 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [0,2,0,0,0,0|1,0,1]=4 5373 B8R0.23 CC(C)CC(O)[PH](=O)O Amb27255267 [0,2,0,0,0,0|2,0,0]=4 5374 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [0,2,0,0,0,0|1,0,0]=3 5375 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [0,2,0,0,0,0|1,0,0]=3 5376 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [0,2,0,0,0,0|1,0,0]=3 5377 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [0,2,0,0,0,0|1,0,0]=3 5378 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [0,2,0,0,0,0|1,0,0]=3 5379 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb16183944 [0,2,0,0,0,0|2,0,0]=4 5380 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,2,0,0,0,0|2,0,0]=4 5381 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [0,2,0,0,0,0|1,0,0]=3 5382 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [0,2,0,0,0,0|1,0,0]=3 5383 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [0,2,0,0,0,0|1,0,0]=3 5384 B8R0.23 CC(C)C[C@H](Br)C(N)=O Amb28197754 [0,2,0,0,0,0|2,0,0]=4 5385 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [0,2,0,0,0,0|1,0,0]=3 5386 B8R0.23 CC(C)C[C@H](Cl)C(=O)Cl Amb27657532 [0,2,0,0,0,0|2,0,0]=4 5387 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [0,2,0,0,0,0|1,0,0]=3 5388 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [0,2,0,0,0,0|1,0,0]=3 5389 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [0,2,0,0,0,0|1,0,0]=3 5390 B8R0.23 CC(C)C[C@H](N)C(=O)S Amb27810129 [0,2,0,0,0,0|1,1,0]=4 5391 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb10670112 [0,2,0,0,0,0|2,0,0]=4 5392 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb8515324 [0,2,0,0,0,0|2,0,0]=4 5393 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [0,2,0,0,0,0|1,0,0]=3 5394 B8R0.23 CC(C)N(C)CC(=O)O Amb10609863 [0,2,0,0,0,0|2,0,0]=4 5395 B8R0.23 CC(C)N(C)CC(=O)O Amb6639901 [0,2,0,0,0,0|2,0,0]=4 5396 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [0,2,0,0,0,0|2,0,0]=4 5397 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [0,2,0,0,0,0|2,0,0]=4 5398 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [0,2,0,0,0,0|2,0,0]=4 5399 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [0,2,0,0,0,0|2,0,0]=4 5400 B8R0.23 CC(C)OC(F)C(=O)O Amb28045324 [0,2,0,0,0,0|2,0,0]=4 5401 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [0,2,0,0,0,0|2,0,0]=4 5402 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [0,2,0,0,0,0|2,0,0]=4 5403 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,2,0,0,0,0|1,0,0]=3 5404 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [0,2,0,0,0,0|1,0,0]=3 5405 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [0,2,0,0,0,0|1,0,0]=3 5406 B8R0.23 CC(C)[C@@H](N)CC(N)=O Amb28340737 [0,2,0,0,0,0|2,0,0]=4 5407 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [0,2,0,0,0,0|1,0,0]=3 5408 B8R0.23 CC(C)[C@@H](O)CC(N)=O Amb27443470 [0,2,0,0,0,0|2,0,0]=4 5409 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [0,2,0,0,0,0|1,0,0]=3 5410 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [0,2,0,0,0,0|1,0,0]=3 5411 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,2,0,0,0,0|2,0,0]=4 5412 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [0,2,0,0,0,0|1,0,0]=3 5413 B8R0.23 CC(CC(=N)N)C(N)=O Amb27209796 [0,2,0,0,0,0|1,0,1]=4 5414 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,2,0,0,0,0|1,0,1]=4 5415 B8R0.23 CC(CC(=O)O)C(F)F Amb27441233 [0,2,0,0,0,0|1,0,0]=3 5416 B8R0.23 CC(CC(=O)O)C(N)=O Amb25737942 [0,2,0,0,0,0|0,0,1]=3 5417 B8R0.23 CC(CC(=O)O)C(N)N Amb27481204 [0,2,0,0,0,0|0,0,0]=2 5418 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [0,2,0,0,0,0|2,0,0]=4 5419 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [0,2,0,0,0,0|2,0,0]=4 5420 B8R0.23 CC(CC(=O)O)N(C)O Amb27639550 [0,2,0,0,0,0|2,0,0]=4 5421 B8R0.23 CC(CC(F)F)C(=O)O Amb22896466 [0,2,0,0,0,0|1,0,0]=3 5422 B8R0.23 CC(CC(N)=O)C(=O)O Amb27596628 [0,2,0,0,0,0|0,0,1]=3 5423 B8R0.23 CC(CC(N)=O)C(N)=O Amb2720769 [0,2,0,0,0,0|1,0,1]=4 5424 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [0,2,0,0,0,0|2,0,0]=4 5425 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [0,2,0,0,0,0|2,0,0]=4 5426 B8R0.23 CC(CN(C)N)C(=O)O Amb28145156 [0,2,0,0,0,0|1,0,0]=3 5427 B8R0.23 CC(CS(=O)O)C(=O)O Amb28118949 [0,2,0,0,0,0|2,0,0]=4 5428 B8R0.23 CC(CS(C)=O)C(=O)O Amb18974546 [0,2,0,0,0,0|2,0,0]=4 5429 B8R0.23 CC(C[PH](=O)O)C(=O)O Amb27477749 [0,2,0,0,0,0|2,0,0]=4 5430 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [0,2,0,0,0,0|1,0,0]=3 5431 B8R0.23 CC(N)C(C)NC(N)=O Amb27427383 [0,2,0,0,0,0|2,0,0]=4 5432 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [0,2,0,0,0,0|0,0,0]=2 5433 B8R0.23 CC(N)C(O)CC(N)=O Amb28184577 [0,2,0,0,0,0|1,0,0]=3 5434 B8R0.23 CC(N)C(O)C[PH](=O)O Amb28130506 [0,2,0,0,0,0|1,0,0]=3 5435 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [0,2,0,0,0,0|0,0,0]=2 5436 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [0,2,0,0,0,0|0,0,0]=2 5437 B8R0.23 CC(N)CN(C)C(N)=O Amb18203178 [0,2,0,0,0,0|2,0,0]=4 5438 B8R0.23 CC(N)[C@@H](O)C[PH](=O)O Amb27841881 [0,2,0,0,0,0|1,0,0]=3 5439 B8R0.23 CC(NC(=N)N)C(=O)O Amb22522920 [0,2,0,0,0,0|1,0,1]=4 5440 B8R0.23 CC(NC(N)=O)C(=O)O Amb9745673 [0,2,0,0,0,0|1,0,1]=4 5441 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [0,2,0,0,0,0|1,0,0]=3 5442 B8R0.23 CC(O)C(N)CC(N)=O Amb27246007 [0,2,0,0,0,0|2,0,0]=4 5443 B8R0.23 CC(O)CC(=O)C(=O)O Amb25789747 [0,2,0,0,0,0|1,0,1]=4 5444 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [0,2,0,0,0,0|1,0,0]=3 5445 B8R0.23 CC(O)CC(N)C(N)=O Amb33065888 [0,2,0,0,0,0|2,0,0]=4 5446 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [0,2,0,0,0,0|1,0,0]=3 5447 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [0,2,0,0,0,0|1,0,0]=3 5448 B8R0.23 CC(OC(F)F)C(=O)O Amb24358717 [0,2,0,0,0,0|2,0,0]=4 5449 B8R0.23 CC(\N=C(/N)S)C(=O)O Amb22229340 [0,2,0,0,0,0|1,0,1]=4 5450 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [0,2,0,0,0,0|2,0,0]=4 5451 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [0,2,0,0,0,0|2,0,0]=4 5452 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [0,2,0,0,0,0|2,0,0]=4 5453 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [0,2,0,0,0,0|2,0,0]=4 5454 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [0,2,0,0,0,0|2,0,0]=4 5455 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [0,2,0,0,0,0|2,0,0]=4 5456 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [0,2,0,0,0,0|2,0,0]=4 5457 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [0,2,0,0,0,0|2,0,0]=4 5458 B8R0.23 CN(CC(=O)O)C(=N)N Amb22167307 [0,2,0,0,0,0|1,0,1]=4 5459 B8R0.23 CN(CC(=O)O)C(=N)N Amb3940365 [0,2,0,0,0,0|1,0,1]=4 5460 B8R0.23 CN(CC(=O)O)C(=N)N Amb5638543 [0,2,0,0,0,0|1,0,1]=4 5461 B8R0.23 CN(CC(=O)O)C(N)=O Amb2371395 [0,2,0,0,0,0|1,0,1]=4 5462 B8R0.23 CN(N)C(=O)CC(=O)O Amb25326354 [0,2,0,0,0,0|1,0,1]=4 5463 B8R0.23 CS(=N)C[C@H](N)C(=O)O Amb27838573 [0,2,0,0,0,0|1,0,1]=4 5464 B8R0.23 CS(=O)CC(N)C(=O)O Amb18125279 [0,2,0,0,0,0|2,0,0]=4 5465 B8R0.23 CS(=O)C[C@@H](N)C(=O)O Amb22745418 [0,2,0,0,0,0|2,0,0]=4 5466 B8R0.23 CS(=O)C[C@H](N)C(=O)O Amb16232229 [0,2,0,0,0,0|2,0,0]=4 5467 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [0,2,0,0,0,0|1,0,1]=4 5468 B8R0.23 C[C@@H](CC(F)F)C(=O)O Amb33749533 [0,2,0,0,0,0|1,0,0]=3 5469 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [0,2,0,0,0,0|1,0,0]=3 5470 B8R0.23 C[C@@H](N)C(=O)CC(N)=O Amb28188661 [0,2,0,0,0,0|1,0,1]=4 5471 B8R0.23 C[C@@H](NC(N)=O)C(=O)O Amb27242972 [0,2,0,0,0,0|1,0,1]=4 5472 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [0,2,0,0,0,0|1,0,0]=3 5473 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [0,2,0,0,0,0|1,0,0]=3 5474 B8R0.23 C[C@@H](OC(F)F)C(=O)O Amb24389309 [0,2,0,0,0,0|2,0,0]=4 5475 B8R0.23 C[C@@H](OC(N)=O)C(=O)O Amb35655773 [0,2,0,0,0,0|1,0,1]=4 5476 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [0,2,0,0,0,0|1,0,1]=4 5477 B8R0.23 C[C@H](CC(=O)O)C(Cl)Cl Amb28292581 [0,2,0,0,0,0|1,0,0]=3 5478 B8R0.23 C[C@H](CC(=O)O)C(N)=O Amb28133461 [0,2,0,0,0,0|0,0,1]=3 5479 B8R0.23 C[C@H](CC(=O)O)S(C)=O Amb27410588 [0,2,0,0,0,0|2,0,0]=4 5480 B8R0.23 C[C@H](CC(F)F)C(=O)O Amb33727762 [0,2,0,0,0,0|1,0,0]=3 5481 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [0,2,0,0,0,0|0,0,0]=2 5482 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [0,2,0,0,0,0|0,0,0]=2 5483 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [0,2,0,0,0,0|0,0,0]=2 5484 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [0,2,0,0,0,0|0,0,0]=2 5485 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [0,2,0,0,0,0|0,0,0]=2 5486 B8R0.23 C[C@H](NC(=N)N)C(=O)O Amb24388432 [0,2,0,0,0,0|1,0,1]=4 5487 B8R0.23 C[C@H](NC(N)=O)C(=O)O Amb545023 [0,2,0,0,0,0|1,0,1]=4 5488 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [0,2,0,0,0,0|1,0,0]=3 5489 B8R0.23 C[C@H](OC(F)F)C(=O)O Amb26499188 [0,2,0,0,0,0|2,0,0]=4 5490 B8R0.23 C[S@@](=O)C[C@H](N)C(=O)O Amb35789128 [0,2,0,0,0,0|2,0,0]=4 5491 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb33756818 [0,2,0,0,0,0|2,0,0]=4 5492 B8R0.23 C[S@](=O)C[C@H](N)C(=O)O Amb35788678 [0,2,0,0,0,0|2,0,0]=4 5493 B8R0.23 C\C(=C\C(C)N)C(=O)O Amb25731207 [0,2,0,0,0,0|0,0,2]=4 5494 B8R0.23 NC(=O)C(N)CC(=O)O Amb18124347 [0,2,0,0,0,0|0,0,1]=3 5495 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666212 [0,2,0,0,0,0|0,0,1]=3 5496 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666239 [0,2,0,0,0,0|0,0,1]=3 5497 B8R0.23 NC(=O)C(N)CC(F)F Amb27409676 [0,2,0,0,0,0|2,0,0]=4 5498 B8R0.23 NC(=O)C(O)CC(=O)[O-] Amb33068981 [0,2,0,0,0,0|0,0,2]=4 5499 B8R0.23 NC(=O)CC(Br)C(=O)O Amb26012685 [0,2,0,0,0,0|0,0,1]=3 5500 B8R0.23 NC(=O)CC(Cl)C(=O)O Amb27478086 [0,2,0,0,0,0|0,0,1]=3 5501 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [0,2,0,0,0,0|0,0,1]=3 5502 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [0,2,0,0,0,0|0,0,1]=3 5503 B8R0.23 NC(=O)CC(N)C(F)F Amb32418214 [0,2,0,0,0,0|2,0,0]=4 5504 B8R0.23 NC(=O)CC(N)C(N)=O Amb18289248 [0,2,0,0,0,0|1,0,1]=4 5505 B8R0.23 NC(=O)CC(O)C(=O)O Amb27807542 [0,2,0,0,0,0|0,0,1]=3 5506 B8R0.23 NC(=O)CC(O)C(N)=O Amb27961515 [0,2,0,0,0,0|1,0,1]=4 5507 B8R0.23 NC(=O)CC(S)C(=O)O Amb27494183 [0,2,0,0,0,0|0,0,1]=3 5508 B8R0.23 NC(=O)C[C@@H](Br)C(=O)O Amb27858620 [0,2,0,0,0,0|0,0,1]=3 5509 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [0,2,0,0,0,0|0,0,1]=3 5510 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [0,2,0,0,0,0|0,0,1]=3 5511 B8R0.23 NC(=O)C[C@@H](N)C(N)=O Amb28423711 [0,2,0,0,0,0|1,0,1]=4 5512 B8R0.23 NC(=O)C[C@@H](O)C(=O)O Amb24681022 [0,2,0,0,0,0|0,0,1]=3 5513 B8R0.23 NC(=O)C[C@@H](O)C(N)=O Amb27258074 [0,2,0,0,0,0|1,0,1]=4 5514 B8R0.23 NC(=O)C[C@@H](S)C(=O)O Amb27234637 [0,2,0,0,0,0|0,0,1]=3 5515 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [0,2,0,0,0,0|0,0,1]=3 5516 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [0,2,0,0,0,0|0,0,1]=3 5517 B8R0.23 NC(=O)C[C@H](N)C(N)=O Amb16183882 [0,2,0,0,0,0|1,0,1]=4 5518 B8R0.23 NC(=O)C[C@H](S)C(=O)O Amb27253643 [0,2,0,0,0,0|0,0,1]=3 5519 B8R0.23 NC(=O)N(N)CC(=O)O Amb6296397 [0,2,0,0,0,0|1,0,1]=4 5520 B8R0.23 NC(=O)NC(O)C(=O)O Amb24592607 [0,2,0,0,0,0|1,0,1]=4 5521 B8R0.23 NC(=O)N[C@@H](O)C(=O)O Amb28287313 [0,2,0,0,0,0|1,0,1]=4 5522 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb19334954 [0,2,0,0,0,0|0,0,1]=3 5523 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb31291739 [0,2,0,0,0,0|0,0,1]=3 5524 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb32652393 [0,2,0,0,0,0|0,0,1]=3 5525 B8R0.23 NC(=O)[C@H](N)CC(=O)O Amb27768775 [0,2,0,0,0,0|0,0,1]=3 5526 B8R0.23 NC(=O)[C@H](N)CC(F)F Amb27163215 [0,2,0,0,0,0|2,0,0]=4 5527 B8R0.23 NC(=S)C[C@H](N)C(=O)O Amb28410343 [0,2,0,0,0,0|0,0,1]=3 5528 B8R0.23 NC(CB(O)O)C(=O)O Amb28285179 [0,2,0,0,0,0|2,0,0]=4 5529 B8R0.23 NC(CB(O)O)C(=O)O Amb33803309 [0,2,0,0,0,0|2,0,0]=4 5530 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [0,2,0,0,0,0|1,0,1]=4 5531 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22167994 [0,2,0,0,0,0|1,0,1]=4 5532 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22337568 [0,2,0,0,0,0|1,0,1]=4 5533 B8R0.23 NC(CC(=O)O)C(Cl)Cl Amb27964120 [0,2,0,0,0,0|1,0,0]=3 5534 B8R0.23 NC(CC(=O)O)C(F)F Amb23570587 [0,2,0,0,0,0|1,0,0]=3 5535 B8R0.23 NC(CC(Cl)Cl)C(=O)O Amb27791749 [0,2,0,0,0,0|1,0,0]=3 5536 B8R0.23 NC(CC(F)F)C(=O)O Amb13952714 [0,2,0,0,0,0|1,0,0]=3 5537 B8R0.23 NC(CC(F)F)C(=O)O Amb33546007 [0,2,0,0,0,0|1,0,0]=3 5538 B8R0.23 NC(CS(=O)O)C(=O)O Amb541272 [0,2,0,0,0,0|2,0,0]=4 5539 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [0,2,0,0,0,0|1,0,1]=4 5540 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [0,2,0,0,0,0|1,0,1]=4 5541 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Amb22801032 [0,2,0,0,0,0|1,0,1]=4 5542 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [0,2,0,0,0,0|1,0,1]=4 5543 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [0,2,0,0,0,0|1,0,1]=4 5544 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb26944439 [0,2,0,0,0,0|1,0,0]=3 5545 B8R0.23 N[C@@H](CC(F)F)C(=O)O Amb33482837 [0,2,0,0,0,0|1,0,0]=3 5546 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb6600148 [0,2,0,0,0,0|2,0,0]=4 5547 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb9809803 [0,2,0,0,0,0|2,0,0]=4 5548 B8R0.23 N[C@@H](C[SH](=O)=O)C(=O)O Amb27858626 [0,2,0,0,0,0|2,0,0]=4 5549 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [0,2,0,0,0,0|1,0,1]=4 5550 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb25117310 [0,2,0,0,0,0|1,0,0]=3 5551 B8R0.23 N[C@H](CC(F)F)C(=O)O Amb33743521 [0,2,0,0,0,0|1,0,0]=3 5552 B8R0.23 O=C(O)C(=O)CC(F)F Amb33337766 [0,2,0,0,0,0|1,0,1]=4 5553 B8R0.23 O=C(O)C(O)CC(F)F Amb25274709 [0,2,0,0,0,0|1,0,0]=3 5554 B8R0.23 O=C(O)C(O)CC(O)O Amb28397948 [0,2,0,0,0,0|1,0,0]=3 5555 B8R0.23 O=C(O)C(O)C[N+](=O)[O-] Amb6883775 [0,2,0,0,0,0|2,0,0]=4 5556 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [0,2,0,0,0,0|1,0,1]=4 5557 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [0,2,0,0,0,0|1,0,1]=4 5558 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [0,2,0,0,0,0|1,0,1]=4 5559 B8R0.23 O=C(O)CC(O)C(Cl)Cl Amb27985520 [0,2,0,0,0,0|1,0,0]=3 5560 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [0,2,0,0,0,0|1,0,1]=4 5561 B8R0.23 O=C(O)CS(=O)C(F)F Amb18979309 [0,2,0,0,0,0|2,0,0]=4 5562 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [0,2,0,0,0,0|1,0,1]=4 5563 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [0,2,0,0,0,0|1,0,1]=4 5564 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [0,2,0,0,0,0|1,0,1]=4 5565 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [0,2,0,0,0,0|1,0,1]=4 5566 B8R0.23 O=C(O)C[C@@H](O)C(F)F Amb33337779 [0,2,0,0,0,0|1,0,0]=3 5567 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [0,2,0,0,0,0|1,0,1]=4 5568 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [0,2,0,0,0,0|1,0,1]=4 5569 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [0,2,0,0,0,0|1,0,1]=4 5570 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [0,2,0,0,0,0|1,0,1]=4 5571 B8R0.23 O=C(O)C[C@H](O)C(F)F Amb33485299 [0,2,0,0,0,0|1,0,0]=3 5572 B8R0.23 O=C(O)[C@H](Cl)CC(Cl)Cl Amb27831354 [0,2,0,0,0,0|1,0,0]=3 5573 B8R0.24 CC(CN)CC(C)(C)O Amb27248537 [0,2,0,0,0,0|1,0,1]=4 5574 B8R0.24 CC(CN)CS(C)(=O)=O Amb18908423 [0,2,0,0,0,0|1,0,1]=4 5575 B8R0.24 CC(CN)OS(=O)(=O)O Amb27154843 [0,2,0,0,0,0|2,0,0]=4 5576 B8R0.24 CCC(N)CP(=O)(O)O Amb27407104 [0,2,0,0,0,0|2,0,0]=4 5577 B8R0.24 CCC(N)CS(=O)(=O)O Amb27454945 [0,2,0,0,0,0|2,0,0]=4 5578 B8R0.24 CP(=O)(O)C[C@H](O)CN Amb27247309 [0,2,0,0,0,0|1,0,0]=3 5579 B8R0.24 CS(=O)(=O)CC(Br)CN Amb33100698 [0,2,0,0,0,0|1,0,1]=4 5580 B8R0.24 CS(=O)(=O)CC(Cl)CN Amb33100696 [0,2,0,0,0,0|1,0,1]=4 5581 B8R0.24 CS(=O)(=O)CC(F)CN Amb33055777 [0,2,0,0,0,0|1,0,1]=4 5582 B8R0.24 CS(=O)(=O)CC(N)CN Amb33100512 [0,2,0,0,0,0|1,0,1]=4 5583 B8R0.24 CS(=O)(=O)CC(O)CN Amb17082823 [0,2,0,0,0,0|1,0,1]=4 5584 B8R0.24 CS(=O)(=O)CC(O)CN Amb30585170 [0,2,0,0,0,0|1,0,1]=4 5585 B8R0.24 CS(=O)(=O)C[C@@H](O)CN Amb27956613 [0,2,0,0,0,0|1,0,1]=4 5586 B8R0.24 CS(=O)(=O)C[C@H](O)CN Amb25705765 [0,2,0,0,0,0|1,0,1]=4 5587 B8R0.24 NCC(=O)CP(=O)(O)O Amb28141900 [0,2,0,0,0,0|1,0,1]=4 5588 B8R0.24 N[C@@H](CO)CS(=O)(=O)O Amb28118562 [0,2,0,0,0,0|2,0,0]=4 5589 B8R0.24 O=P(O)(O)CC(O)CCl Amb3354883 [0,2,0,0,0,0|2,0,0]=4 5590 B8R0.24 O=S(=O)(O)CC(O)CO Amb25802047 [0,2,0,0,0,0|2,0,0]=4 5591 B8R0.24 O=S(=O)(O)CC(O)CS Amb17594311 [0,2,0,0,0,0|2,0,0]=4 5592 B8R0.34 C=C(C)CC(C)(C)CN Amb25146071 [0,2,0,0,0,0|2,0,0]=4 5593 B8R0.34 C=C(C)CC(F)(F)CN Amb32810014 [0,2,0,0,0,0|2,0,0]=4 5594 B8R0.34 C=CC(C)(C)CC(=O)O Amb5718701 [0,2,0,0,0,0|1,0,1]=4 5595 B8R0.34 C=CC(C)(N)CC(=O)O Amb22641965 [0,2,0,0,0,0|1,0,1]=4 5596 B8R0.34 C=CC(C)(N)CC(=O)O Amb31307623 [0,2,0,0,0,0|1,0,1]=4 5597 B8R0.34 C=CC(C)(O)CC(=O)O Amb18642755 [0,2,0,0,0,0|1,0,1]=4 5598 B8R0.34 CC(=O)CC(C)(C)CBr Amb27185624 [0,2,0,0,0,0|2,0,0]=4 5599 B8R0.34 CC(=O)CC(C)(C)CO Amb24689736 [0,2,0,0,0,0|2,0,0]=4 5600 B8R0.34 CC(=O)CC(C)(Cl)CCl Amb27227718 [0,2,0,0,0,0|2,0,0]=4 5601 B8R0.34 CC(=O)NC(C)(C)CN Amb2606140 [0,2,0,0,0,0|2,0,0]=4 5602 B8R0.34 CC(=O)OC(C)(C)CN Amb28072952 [0,2,0,0,0,0|2,0,0]=4 5603 B8R0.34 CC(C)(C#N)CC(=O)O Amb25887307 [0,2,0,0,0,0|0,0,2]=4 5604 B8R0.34 CC(C)(C=O)CC(=O)O Amb28401504 [0,2,0,0,0,0|1,0,1]=4 5605 B8R0.34 CC(C)(CBr)CC(=O)Cl Amb27424627 [0,2,0,0,0,0|2,0,0]=4 5606 B8R0.34 CC(C)(CBr)CC(=O)O Amb24480039 [0,2,0,0,0,0|1,0,0]=3 5607 B8R0.34 CC(C)(CC(=O)O)NO Amb27859691 [0,2,0,0,0,0|2,0,0]=4 5608 B8R0.34 CC(C)(CF)CC(=O)O Amb26575195 [0,2,0,0,0,0|1,0,0]=3 5609 B8R0.34 CC(C)(CI)CC(=O)Cl Amb33295130 [0,2,0,0,0,0|2,0,0]=4 5610 B8R0.34 CC(C)(CI)CC(=O)O Amb33295131 [0,2,0,0,0,0|1,0,0]=3 5611 B8R0.34 CC(C)(CN)CC(=O)O Amb4245619 [0,2,0,0,0,0|0,0,0]=2 5612 B8R0.34 CC(C)(CN)CC(=O)O Amb578353 [0,2,0,0,0,0|0,0,0]=2 5613 B8R0.34 CC(C)(CN)CC(N)=S Amb27392556 [0,2,0,0,0,0|1,1,0]=4 5614 B8R0.34 CC(C)(CN)NC(N)=O Amb18203177 [0,2,0,0,0,0|2,0,0]=4 5615 B8R0.34 CC(C)(CO)CC(=O)O Amb24116870 [0,2,0,0,0,0|1,0,0]=3 5616 B8R0.34 CC(C)(CO)CC(=O)[O-] Amb24178915 [0,2,0,0,0,0|1,0,1]=4 5617 B8R0.34 CC(N)(CCl)CC(=O)O Amb22641961 [0,2,0,0,0,0|1,0,0]=3 5618 B8R0.34 CC(N)(CN)CC(=O)O Amb32787831 [0,2,0,0,0,0|0,0,0]=2 5619 B8R0.34 CC(N)(CN)CC(N)=O Amb32787386 [0,2,0,0,0,0|1,0,0]=3 5620 B8R0.34 CC(N)(CO)CC(=O)O Amb27162086 [0,2,0,0,0,0|1,0,0]=3 5621 B8R0.34 CC(O)(CCl)CC(=O)O Amb27409236 [0,2,0,0,0,0|1,0,0]=3 5622 B8R0.34 CC(O)(CN)CC(=O)O Amb25188898 [0,2,0,0,0,0|0,0,0]=2 5623 B8R0.34 CC(O)(CN)CC(=O)O Amb28935004 [0,2,0,0,0,0|0,0,0]=2 5624 B8R0.34 CC(O)CC(C)(C)CN Amb19148071 [0,2,0,0,0,0|1,0,1]=4 5625 B8R0.34 CC(O)CC(C)(C)CN Amb22059606 [0,2,0,0,0,0|1,0,1]=4 5626 B8R0.34 CC(O)CC(C)(O)CN Amb29850078 [0,2,0,0,0,0|1,0,1]=4 5627 B8R0.34 CCC(C)(C)CC(=O)Cl Amb25032181 [0,2,0,0,0,0|2,0,0]=4 5628 B8R0.34 CCC(C)(C)CC(=O)O Amb10573669 [0,2,0,0,0,0|1,0,0]=3 5629 B8R0.34 CCC(C)(C)CC(C)=O Amb22388941 [0,2,0,0,0,0|2,0,0]=4 5630 B8R0.34 CCC(C)(C)CC(N)=O Amb27217075 [0,2,0,0,0,0|2,0,0]=4 5631 B8R0.34 CCC(C)(F)CC(=O)O Amb27645740 [0,2,0,0,0,0|1,0,0]=3 5632 B8R0.34 CCC(C)(N)CC(=O)O Amb25853863 [0,2,0,0,0,0|1,0,0]=3 5633 B8R0.34 CCC(C)(N)CC(N)=O Amb33254471 [0,2,0,0,0,0|2,0,0]=4 5634 B8R0.34 CCC(C)(O)CC(=O)O Amb18298122 [0,2,0,0,0,0|1,0,0]=3 5635 B8R0.34 CCC(C)(S)CC(C)=O Amb26053261 [0,2,0,0,0,0|2,0,0]=4 5636 B8R0.34 CCC(F)(F)CC(=O)Cl Amb29880872 [0,2,0,0,0,0|2,0,0]=4 5637 B8R0.34 CCC(F)(F)CC(=O)O Amb32666992 [0,2,0,0,0,0|1,0,0]=3 5638 B8R0.34 CCC(F)(F)CC(C)=O Amb30010781 [0,2,0,0,0,0|2,0,0]=4 5639 B8R0.34 CCC(F)(F)CC(N)=O Amb29882358 [0,2,0,0,0,0|2,0,0]=4 5640 B8R0.34 CCS(=O)(=O)CC(=O)O Amb6277554 [0,2,0,0,0,0|2,0,0]=4 5641 B8R0.34 CC[C@@](C)(N)CC(=O)O Amb25738026 [0,2,0,0,0,0|1,0,0]=3 5642 B8R0.34 CC[Si](C)(C)CC(=O)O Amb28145155 [0,2,0,0,0,0|1,1,0]=4 5643 B8R0.34 COC(C)(C)CC(=O)O Amb25887304 [0,2,0,0,0,0|2,0,0]=4 5644 B8R0.34 CS(=O)CC(C)(O)CN Amb27237259 [0,2,0,0,0,0|2,0,0]=4 5645 B8R0.34 C[Si](C)(CCl)CC(=O)O Amb25107199 [0,2,0,0,0,0|1,1,0]=4 5646 B8R0.34 NCC(F)(F)CC(=O)O Amb19148532 [0,2,0,0,0,0|0,0,0]=2 5647 B8R0.34 NCC(F)(F)CC(=O)O Amb32693401 [0,2,0,0,0,0|0,0,0]=2 5648 B8R0.34 O=C(O)CC(F)(F)CBr Amb27592325 [0,2,0,0,0,0|1,0,0]=3 5649 B8R0.34 O=C(O)CC(F)(F)CCl Amb33741692 [0,2,0,0,0,0|1,0,0]=3 5650 B8R0.34 O=C(O)CC(F)(F)CF Amb33402041 [0,2,0,0,0,0|1,0,0]=3 5651 B8R0.1 C#CCC(=O)CCCC Amb8390126 [0,2,0,0,0,0|2,0,0]=4 5652 B8R0.1 C#CCCC(=O)CCO Amb24384003 [0,2,0,0,0,0|1,0,1]=4 5653 B8R0.1 C#CCCC(=O)COC Amb28041985 [0,2,0,0,0,0|1,0,1]=4 5654 B8R0.1 C#CCCC(=O)OCC Amb18636093 [0,2,0,0,0,0|1,0,1]=4 5655 B8R0.1 C=C=CC(=O)CCCCl Amb27470781 [0,2,0,0,0,0|2,0,0]=4 5656 B8R0.1 C=CCC(=O)CCCBr Amb27401886 [0,2,0,0,0,0|2,0,0]=4 5657 B8R0.1 C=CCC(=O)CCCC Amb10567269 [0,2,0,0,0,0|2,0,0]=4 5658 B8R0.1 C=CCC(=O)CCCN Amb27252862 [0,2,0,0,0,0|1,0,0]=3 5659 B8R0.1 C=CCC(=O)NCCN Amb18313529 [0,2,0,0,0,0|2,0,0]=4 5660 B8R0.1 C=CCCC(=O)NOC Amb27837663 [0,2,0,0,0,0|1,0,1]=4 5661 B8R0.1 C=CCCC(=O)OCC Amb10601809 [0,2,0,0,0,0|1,0,1]=4 5662 B8R0.1 CCCC(=O)CCCF Amb28182770 [0,2,0,0,0,0|2,0,0]=4 5663 B8R0.1 CCCC(=O)CCCN Amb27866597 [0,2,0,0,0,0|1,0,0]=3 5664 B8R0.1 CCCC(=O)NCCN Amb6242301 [0,2,0,0,0,0|2,0,0]=4 5665 B8R0.1 CCCCC(=N)OCC Amb20673140 [0,2,0,0,0,0|2,0,0]=4 5666 B8R0.1 CCCCC(=N)OCC Amb26549922 [0,2,0,0,0,0|2,0,0]=4 5667 B8R0.1 CCCCC(=O)CC#N Amb7768265 [0,2,0,0,0,0|2,0,0]=4 5668 B8R0.1 CCCCC(=O)CCC Amb3940685 [0,2,0,0,0,0|2,0,0]=4 5669 B8R0.1 CCCCC(=O)CCN Amb28186730 [0,2,0,0,0,0|2,0,0]=4 5670 B8R0.1 CCCCC(=O)CNC Amb25824276 [0,2,0,0,0,0|2,0,0]=4 5671 B8R0.1 CCCCC(=O)COC Amb19374627 [0,2,0,0,0,0|1,0,0]=3 5672 B8R0.1 CCCCC(=O)CSC Amb27837495 [0,2,0,0,0,0|1,1,0]=4 5673 B8R0.1 CCCCC(=O)N=C=O Amb17231844 [0,2,0,0,0,0|1,0,1]=4 5674 B8R0.1 CCCCC(=O)N=[N+]=[N-] Amb25888669 [0,2,0,0,0,0|2,0,0]=4 5675 B8R0.1 CCCCC(=O)OCC Amb6296060 [0,2,0,0,0,0|1,0,0]=3 5676 B8R0.1 CCCCC(=O)OCCl Amb28314260 [0,2,0,0,0,0|1,0,0]=3 5677 B8R0.1 CCCCC(=O)\C=C\Cl Amb24650002 [0,2,0,0,0,0|2,0,0]=4 5678 B8R0.1 CCCCC(=O)\C=C\O Amb26515841 [0,2,0,0,0,0|1,0,0]=3 5679 B8R0.1 CCCCC(=O)\C=N\O Amb27963887 [0,2,0,0,0,0|1,0,0]=3 5680 B8R0.1 CCCCS(=O)CCO Amb6752517 [0,2,0,0,0,0|2,0,0]=4 5681 B8R0.1 CCCC\C(C)=C\CO Amb28041191 [0,2,0,0,0,0|2,0,0]=4 5682 B8R0.1 CCCC\C(C)=N\OC Amb27169368 [0,2,0,0,0,0|2,0,0]=4 5683 B8R0.1 CCCC\C(F)=C\CO Amb28315526 [0,2,0,0,0,0|2,0,0]=4 5684 B8R0.1 CCCC\C(I)=C\CO Amb28057014 [0,2,0,0,0,0|2,0,0]=4 5685 B8R0.1 CCCC\C(N)=N\OC Amb27837654 [0,2,0,0,0,0|2,0,0]=4 5686 B8R0.1 CCCC\C(O)=C\C=O Amb27257932 [0,2,0,0,0,0|1,0,0]=3 5687 B8R0.1 CCCNC(=O)CCO Amb17334123 [0,2,0,0,0,0|2,0,0]=4 5688 B8R0.1 CCCNC(=O)OCC Amb17787091 [0,2,0,0,0,0|2,0,0]=4 5689 B8R0.1 CCCOC(=O)CCO Amb22504631 [0,2,0,0,0,0|2,0,0]=4 5690 B8R0.1 CCCOC(=O)NCO Amb25082749 [0,2,0,0,0,0|2,0,0]=4 5691 B8R0.1 CCCOC(=O)OCCl Amb22054704 [0,2,0,0,0,0|2,0,0]=4 5692 B8R0.1 CCNC(=O)CCCCl Amb1136094 [0,2,0,0,0,0|2,0,0]=4 5693 B8R0.1 CCNC(=O)CCCN Amb6270972 [0,2,0,0,0,0|1,0,0]=3 5694 B8R0.1 CCNC(=O)CCCO Amb17231872 [0,2,0,0,0,0|2,0,0]=4 5695 B8R0.1 CCNC(=O)CCON Amb27245128 [0,2,0,0,0,0|2,0,0]=4 5696 B8R0.1 CCNC(=O)NCCN Amb10808619 [0,2,0,0,0,0|2,0,0]=4 5697 B8R0.1 CCNC(=O)NCCN Amb2786291 [0,2,0,0,0,0|2,0,0]=4 5698 B8R0.1 CCNC(=O)OCCN Amb28132703 [0,2,0,0,0,0|2,0,0]=4 5699 B8R0.1 CCNCC(=O)OCC Amb33527965 [0,2,0,0,0,0|2,0,0]=4 5700 B8R0.1 CCOC(=N)CCCBr Amb20673080 [0,2,0,0,0,0|2,0,0]=4 5701 B8R0.1 CCOC(=N)CCCBr Amb26019479 [0,2,0,0,0,0|2,0,0]=4 5702 B8R0.1 CCOC(=N)CCCCl Amb8427994 [0,2,0,0,0,0|2,0,0]=4 5703 B8R0.1 CCOC(=N)CCCCl Amb9173329 [0,2,0,0,0,0|2,0,0]=4 5704 B8R0.1 CCOC(=N)CCCO Amb27390716 [0,2,0,0,0,0|2,0,0]=4 5705 B8R0.1 CCOC(=O)C#CCN Amb25369130 [0,2,0,0,0,0|0,0,2]=4 5706 B8R0.1 CCOC(=O)C#CCN Amb32686263 [0,2,0,0,0,0|0,0,2]=4 5707 B8R0.1 CCOC(=O)CCC#N Amb3941721 [0,2,0,0,0,0|0,0,2]=4 5708 B8R0.1 CCOC(=O)CCC=O Amb17593369 [0,2,0,0,0,0|1,0,1]=4 5709 B8R0.1 CCOC(=O)CCCBr Amb3940218 [0,2,0,0,0,0|1,0,0]=3 5710 B8R0.1 CCOC(=O)CCCCl Amb1153203 [0,2,0,0,0,0|1,0,0]=3 5711 B8R0.1 CCOC(=O)CCCN Amb2720231 [0,2,0,0,0,0|0,0,0]=2 5712 B8R0.1 CCOC(=O)CCCN Amb3938993 [0,2,0,0,0,0|0,0,0]=2 5713 B8R0.1 CCOC(=O)CCCO Amb22733346 [0,2,0,0,0,0|1,0,0]=3 5714 B8R0.1 CCOC(=O)CCCS Amb27424650 [0,2,0,0,0,0|1,0,0]=3 5715 B8R0.1 CCOC(=O)CCNC Amb28934933 [0,2,0,0,0,0|2,0,0]=4 5716 B8R0.1 CCOC(=O)CCNC Amb9026169 [0,2,0,0,0,0|2,0,0]=4 5717 B8R0.1 CCOC(=O)CCNN Amb23504114 [0,2,0,0,0,0|1,0,0]=3 5718 B8R0.1 CCOC(=O)CCNO Amb27406192 [0,2,0,0,0,0|2,0,0]=4 5719 B8R0.1 CCOC(=O)CCON Amb24481776 [0,2,0,0,0,0|1,0,0]=3 5720 B8R0.1 CCOC(=O)COCCl Amb28066573 [0,2,0,0,0,0|2,0,0]=4 5721 B8R0.1 CCOC(=O)CSCC Amb7755283 [0,2,0,0,0,0|2,0,0]=4 5722 B8R0.1 CCOC(=O)CSCCl Amb27267833 [0,2,0,0,0,0|2,0,0]=4 5723 B8R0.1 CCOC(=O)NCCCl Amb10601693 [0,2,0,0,0,0|2,0,0]=4 5724 B8R0.1 CCOC(=O)NCCN Amb18304505 [0,2,0,0,0,0|1,0,0]=3 5725 B8R0.1 CCOC(=O)NCCN Amb33552162 [0,2,0,0,0,0|1,0,0]=3 5726 B8R0.1 CCOC(=O)NCCO Amb3939457 [0,2,0,0,0,0|2,0,0]=4 5727 B8R0.1 CCOC(=O)OCCBr Amb24480075 [0,2,0,0,0,0|2,0,0]=4 5728 B8R0.1 CCOC(=O)OCCO Amb28072969 [0,2,0,0,0,0|2,0,0]=4 5729 B8R0.1 CCOC(=O)OCCS Amb26511404 [0,2,0,0,0,0|2,0,0]=4 5730 B8R0.1 CCOC(=O)SCCCl Amb27453639 [0,2,0,0,0,0|2,0,0]=4 5731 B8R0.1 CCOC(=O)\C=C\CN Amb2699143 [0,2,0,0,0,0|0,0,2]=4 5732 B8R0.1 CCOC(=O)\C=C\CN Amb29083404 [0,2,0,0,0,0|0,0,2]=4 5733 B8R0.1 CCOC(C)CCCN Amb28049325 [0,2,0,0,0,0|1,0,1]=4 5734 B8R0.1 CCOCC(=O)OCC Amb2720920 [0,2,0,0,0,0|2,0,0]=4 5735 B8R0.1 CCOCC(=O)OCCl Amb32677195 [0,2,0,0,0,0|2,0,0]=4 5736 B8R0.1 CCOCC(=O)\C=N\O Amb27232490 [0,2,0,0,0,0|2,0,0]=4 5737 B8R0.1 CCSC(=O)CCCBr Amb27440205 [0,2,0,0,0,0|1,1,0]=4 5738 B8R0.1 CCSC(=O)CCCCl Amb27412565 [0,2,0,0,0,0|1,1,0]=4 5739 B8R0.1 CN(CCO)CCCN Amb6702401 [0,2,0,0,0,0|2,0,0]=4 5740 B8R0.1 CNCC(=O)NCCN Amb18305784 [0,2,0,0,0,0|2,0,0]=4 5741 B8R0.1 COCC(=O)CCC=O Amb28343164 [0,2,0,0,0,0|1,0,1]=4 5742 B8R0.1 COCC(=O)CCCCl Amb27838444 [0,2,0,0,0,0|1,0,0]=3 5743 B8R0.1 COCC(=O)CCCO Amb27869244 [0,2,0,0,0,0|1,0,0]=3 5744 B8R0.1 COCC(=O)NCCCl Amb25889490 [0,2,0,0,0,0|2,0,0]=4 5745 B8R0.1 COCC(=O)NCCF Amb27222484 [0,2,0,0,0,0|2,0,0]=4 5746 B8R0.1 COCC(=O)NCCN Amb1142190 [0,2,0,0,0,0|1,0,0]=3 5747 B8R0.1 COCC(=O)NCCN Amb33620906 [0,2,0,0,0,0|1,0,0]=3 5748 B8R0.1 COCC(=O)NCCO Amb25828239 [0,2,0,0,0,0|2,0,0]=4 5749 B8R0.1 COCC(=O)OCCBr Amb33276573 [0,2,0,0,0,0|2,0,0]=4 5750 B8R0.1 COCC(=O)OCCCl Amb28137490 [0,2,0,0,0,0|2,0,0]=4 5751 B8R0.1 COCC(=O)OCCO Amb28366893 [0,2,0,0,0,0|2,0,0]=4 5752 B8R0.1 COCC(S)CCCN Amb32788185 [0,2,0,0,0,0|0,1,1]=4 5753 B8R0.1 COCCC(=O)COC Amb27441027 [0,2,0,0,0,0|2,0,0]=4 5754 B8R0.1 COCCC(=O)NOC Amb27776650 [0,2,0,0,0,0|2,0,0]=4 5755 B8R0.1 CONC(=O)CCC=O Amb27837664 [0,2,0,0,0,0|1,0,1]=4 5756 B8R0.1 CONC(=O)CCCO Amb27810629 [0,2,0,0,0,0|1,0,0]=3 5757 B8R0.1 CONC(=O)NCCF Amb27837628 [0,2,0,0,0,0|2,0,0]=4 5758 B8R0.1 CONC(=O)NCCO Amb27649685 [0,2,0,0,0,0|2,0,0]=4 5759 B8R0.1 CONC(=O)\C=C\CN Amb27947076 [0,2,0,0,0,0|0,0,2]=4 5760 B8R0.1 C\C(=C/CO)CCCN Amb27469758 [0,2,0,0,0,0|1,0,0]=3 5761 B8R0.1 C\C=C\C(=O)CCCC Amb22043314 [0,2,0,0,0,0|2,0,0]=4 5762 B8R0.1 C\C=C\C(=O)NCCN Amb18289751 [0,2,0,0,0,0|2,0,0]=4 5763 B8R0.1 N#CCC(=O)OCCN Amb27629739 [0,2,0,0,0,0|2,0,0]=4 5764 B8R0.1 N#CNC(=O)CCCCl Amb27404834 [0,2,0,0,0,0|2,0,0]=4 5765 B8R0.1 NCCCC(N)CCO Amb28285147 [0,2,0,0,0,0|1,0,1]=4 5766 B8R0.1 NCCCS(=O)CCF Amb27838501 [0,2,0,0,0,0|2,0,0]=4 5767 B8R0.1 NCCNC(=O)C#CBr Amb27806936 [0,2,0,0,0,0|2,0,0]=4 5768 B8R0.1 NCCNC(=O)CCN Amb19011419 [0,2,0,0,0,0|2,0,0]=4 5769 B8R0.1 NCCNC(=O)CCO Amb27624387 [0,2,0,0,0,0|1,0,0]=3 5770 B8R0.1 NCCNC(=O)CCS Amb17503831 [0,2,0,0,0,0|1,1,0]=4 5771 B8R0.1 NCCOC(=O)CCN Amb28201809 [0,2,0,0,0,0|2,0,0]=4 5772 B8R0.1 NOCC(=O)NCCO Amb27494090 [0,2,0,0,0,0|2,0,0]=4 5773 B8R0.1 O=C(CCBr)CCCCl Amb24434557 [0,2,0,0,0,0|2,0,0]=4 5774 B8R0.1 O=C(CCO)NCCO Amb28197638 [0,2,0,0,0,0|2,0,0]=4 5775 B8R0.1 O=C=NC(=O)CCCCl Amb17593678 [0,2,0,0,0,0|1,0,1]=4 5776 B8R0.1 [C-]#[N+]CCC(=O)OCC Amb2592648 [0,2,0,0,0,0|2,0,0]=4 5777 B8R0.1 [N-]=[N+]=NC(=O)NCCN Amb27955361 [0,2,0,0,0,0|2,0,0]=4 5778 B8R0.3 C#CC(=O)C(C)CCO Amb28125122 [0,2,0,0,0,0|2,0,0]=4 5779 B8R0.3 C#CC(=O)[C@@H](N)CCC Amb35662325 [0,2,0,0,0,0|2,0,0]=4 5780 B8R0.3 C#CC(=O)[C@H](N)CCC Amb35659947 [0,2,0,0,0,0|2,0,0]=4 5781 B8R0.3 C#CC(O)C(C)CCN Amb35624820 [0,2,0,0,0,0|1,0,1]=4 5782 B8R0.3 C#CCC(C)C(=O)OC Amb18115942 [0,2,0,0,0,0|1,0,1]=4 5783 B8R0.3 C#CCC(N)C(=O)OC Amb24426865 [0,2,0,0,0,0|1,0,1]=4 5784 B8R0.3 C#CCC(N)C(=O)OC Amb32663324 [0,2,0,0,0,0|1,0,1]=4 5785 B8R0.3 C#CC[C@@H](N)C(=O)OC Amb26919399 [0,2,0,0,0,0|1,0,1]=4 5786 B8R0.3 C#CC[C@H](N)C(=O)OC Amb22746034 [0,2,0,0,0,0|1,0,1]=4 5787 B8R0.3 C#CC[C@H](N)C(=O)OC Amb27870421 [0,2,0,0,0,0|1,0,1]=4 5788 B8R0.3 C=C(CCC)C(=O)OC Amb25689366 [0,2,0,0,0,0|1,0,1]=4 5789 B8R0.3 C=C(CCO)C(=O)OC Amb27258056 [0,2,0,0,0,0|1,0,1]=4 5790 B8R0.3 C=CC(=O)C(C)CCC Amb25967399 [0,2,0,0,0,0|2,0,0]=4 5791 B8R0.3 C=CC(=O)C(N)CCC Amb27251910 [0,2,0,0,0,0|2,0,0]=4 5792 B8R0.3 C=CC(=O)C(O)CCC Amb27461859 [0,2,0,0,0,0|2,0,0]=4 5793 B8R0.3 C=CC(O)C(O)CCN Amb27645553 [0,2,0,0,0,0|1,0,1]=4 5794 B8R0.3 C=CCC(C)C(=O)OC Amb27787724 [0,2,0,0,0,0|1,0,1]=4 5795 B8R0.3 C=CCC(Cl)C(=O)OC Amb25365264 [0,2,0,0,0,0|1,0,1]=4 5796 B8R0.3 C=CCC(N)C(=O)NO Amb28322025 [0,2,0,0,0,0|1,0,1]=4 5797 B8R0.3 C=CCC(N)C(=O)OC Amb18642703 [0,2,0,0,0,0|1,0,1]=4 5798 B8R0.3 C=CCC(N)C(=O)OC Amb22757544 [0,2,0,0,0,0|1,0,1]=4 5799 B8R0.3 C=CCC(O)C(=O)OC Amb28435077 [0,2,0,0,0,0|1,0,1]=4 5800 B8R0.3 C=CC[C@@H](N)C(=O)OC Amb24635550 [0,2,0,0,0,0|1,0,1]=4 5801 B8R0.3 C=CC[C@@H](N)C(=O)OC Amb33868785 [0,2,0,0,0,0|1,0,1]=4 5802 B8R0.3 C=CC[C@H](N)C(=O)OC Amb22750599 [0,2,0,0,0,0|1,0,1]=4 5803 B8R0.3 C=CC[C@H](N)C(=O)OC Amb24120340 [0,2,0,0,0,0|1,0,1]=4 5804 B8R0.3 CC(CCN)C(=O)CO Amb24478589 [0,2,0,0,0,0|0,0,0]=2 5805 B8R0.3 CC(CCN)C(=O)NN Amb27838428 [0,2,0,0,0,0|1,0,0]=3 5806 B8R0.3 CC(CCO)C(O)C=O Amb27614168 [0,2,0,0,0,0|1,0,1]=4 5807 B8R0.3 CCC(=O)C(C)CCN Amb18832550 [0,2,0,0,0,0|1,0,0]=3 5808 B8R0.3 CCC(=O)C(Cl)CCO Amb26477870 [0,2,0,0,0,0|2,0,0]=4 5809 B8R0.3 CCC(=O)N(C)CCN Amb17046787 [0,2,0,0,0,0|2,0,0]=4 5810 B8R0.3 CCC(O)C(C)CCN Amb18203142 [0,2,0,0,0,0|1,0,1]=4 5811 B8R0.3 CCCC(Br)C(=O)CBr Amb27229993 [0,2,0,0,0,0|2,0,0]=4 5812 B8R0.3 CCCC(Br)C(=O)OC Amb20621576 [0,2,0,0,0,0|1,0,0]=3 5813 B8R0.3 CCCC(C)C(=O)CC Amb17593350 [0,2,0,0,0,0|2,0,0]=4 5814 B8R0.3 CCCC(C)C(=O)CCl Amb24568325 [0,2,0,0,0,0|2,0,0]=4 5815 B8R0.3 CCCC(C)C(=O)CN Amb25686985 [0,2,0,0,0,0|2,0,0]=4 5816 B8R0.3 CCCC(Cl)C(=O)NC Amb27878145 [0,2,0,0,0,0|2,0,0]=4 5817 B8R0.3 CCCC(Cl)C(=O)OF Amb28399722 [0,2,0,0,0,0|1,0,0]=3 5818 B8R0.3 CCCC(Cl)\C(Cl)=N\O Amb27659357 [0,2,0,0,0,0|2,0,0]=4 5819 B8R0.3 CCCC(N)C(=O)NC Amb9514804 [0,2,0,0,0,0|2,0,0]=4 5820 B8R0.3 CCCC(N)C(=O)NO Amb22059373 [0,2,0,0,0,0|1,0,0]=3 5821 B8R0.3 CCCC(N)C(=O)OC Amb2786376 [0,2,0,0,0,0|1,0,0]=3 5822 B8R0.3 CCCC(N)C(=O)OC Amb33549293 [0,2,0,0,0,0|1,0,0]=3 5823 B8R0.3 CCCC(N)\C(N)=N\O Amb24749079 [0,2,0,0,0,0|2,0,0]=4 5824 B8R0.3 CCCC(N)\C(O)=N\O Amb20669260 [0,2,0,0,0,0|1,0,1]=4 5825 B8R0.3 CCCC(O)C(=O)CO Amb27802691 [0,2,0,0,0,0|1,0,0]=3 5826 B8R0.3 CCCC(O)C(=O)NC Amb25944249 [0,2,0,0,0,0|2,0,0]=4 5827 B8R0.3 CCCC(O)C(=O)OC Amb23454534 [0,2,0,0,0,0|1,0,0]=3 5828 B8R0.3 CCCN(N)C(=O)OC Amb33191592 [0,2,0,0,0,0|2,0,0]=4 5829 B8R0.3 CCC[C@@H](Br)C(=O)OC Amb27166248 [0,2,0,0,0,0|1,0,0]=3 5830 B8R0.3 CCC[C@@H](Cl)C(=O)OC Amb27179954 [0,2,0,0,0,0|1,0,0]=3 5831 B8R0.3 CCC[C@@H](N)C(=O)NN Amb27844787 [0,2,0,0,0,0|2,0,0]=4 5832 B8R0.3 CCC[C@@H](N)C(=O)NO Amb28314574 [0,2,0,0,0,0|1,0,0]=3 5833 B8R0.3 CCC[C@@H](N)C(=O)OC Amb25146086 [0,2,0,0,0,0|1,0,0]=3 5834 B8R0.3 CCC[C@@H](N)C(=O)OC Amb30526950 [0,2,0,0,0,0|1,0,0]=3 5835 B8R0.3 CCC[C@@H](O)C(=O)CO Amb27802757 [0,2,0,0,0,0|1,0,0]=3 5836 B8R0.3 CCC[C@@H](O)C(=O)OC Amb28344665 [0,2,0,0,0,0|1,0,0]=3 5837 B8R0.3 CCC[C@H](Br)C(=O)OC Amb28346240 [0,2,0,0,0,0|1,0,0]=3 5838 B8R0.3 CCC[C@H](C)C(=O)OC Amb28344077 [0,2,0,0,0,0|1,0,0]=3 5839 B8R0.3 CCC[C@H](F)C(=O)CC Amb28351547 [0,2,0,0,0,0|2,0,0]=4 5840 B8R0.3 CCC[C@H](N)C(=O)NC Amb25991661 [0,2,0,0,0,0|2,0,0]=4 5841 B8R0.3 CCC[C@H](N)C(=O)OC Amb10844887 [0,2,0,0,0,0|1,0,0]=3 5842 B8R0.3 CCC[C@H](N)C(=O)OC Amb17942871 [0,2,0,0,0,0|1,0,0]=3 5843 B8R0.3 CCC[C@H](O)C(=O)CO Amb27838685 [0,2,0,0,0,0|1,0,0]=3 5844 B8R0.3 CCNC(C)C(=O)OC Amb19003120 [0,2,0,0,0,0|2,0,0]=4 5845 B8R0.3 CCNC(C)C(=O)OC Amb32751752 [0,2,0,0,0,0|2,0,0]=4 5846 B8R0.3 CCN[C@@H](C)C(=O)OC Amb9228630 [0,2,0,0,0,0|2,0,0]=4 5847 B8R0.3 CCOC(Br)C(=O)OC Amb28342296 [0,2,0,0,0,0|2,0,0]=4 5848 B8R0.3 CCO[C@@H](C)C(=O)OC Amb28060813 [0,2,0,0,0,0|2,0,0]=4 5849 B8R0.3 CCSC(Cl)C(=O)OC Amb27845442 [0,2,0,0,0,0|2,0,0]=4 5850 B8R0.3 CN(CCO)C(=O)CO Amb5798177 [0,2,0,0,0,0|2,0,0]=4 5851 B8R0.3 CNC(=O)C(Br)CCBr Amb27750735 [0,2,0,0,0,0|2,0,0]=4 5852 B8R0.3 CNC(=O)C(C)CCN Amb26863529 [0,2,0,0,0,0|1,0,0]=3 5853 B8R0.3 CNC(=O)N(C)CCN Amb18908301 [0,2,0,0,0,0|2,0,0]=4 5854 B8R0.3 CNC(=O)[C@@H](N)CCN Amb28197475 [0,2,0,0,0,0|1,0,0]=3 5855 B8R0.3 CNCC(C)C(=O)NO Amb28120671 [0,2,0,0,0,0|2,0,0]=4 5856 B8R0.3 CNCC(C)C(=O)OC Amb9288459 [0,2,0,0,0,0|2,0,0]=4 5857 B8R0.3 CNCC(N)C(=O)OC Amb27758128 [0,2,0,0,0,0|2,0,0]=4 5858 B8R0.3 COC(=O)C(Br)CCBr Amb4441764 [0,2,0,0,0,0|1,0,0]=3 5859 B8R0.3 COC(=O)C(Br)CCCl Amb27424625 [0,2,0,0,0,0|1,0,0]=3 5860 B8R0.3 COC(=O)C(Br)CSC Amb28321151 [0,2,0,0,0,0|2,0,0]=4 5861 B8R0.3 COC(=O)C(C)CC#N Amb17334094 [0,2,0,0,0,0|0,0,2]=4 5862 B8R0.3 COC(=O)C(C)CC=O Amb18642746 [0,2,0,0,0,0|1,0,1]=4 5863 B8R0.3 COC(=O)C(C)CCBr Amb26493267 [0,2,0,0,0,0|1,0,0]=3 5864 B8R0.3 COC(=O)C(C)CCCl Amb16230918 [0,2,0,0,0,0|1,0,0]=3 5865 B8R0.3 COC(=O)C(C)CCN Amb26438013 [0,2,0,0,0,0|0,0,0]=2 5866 B8R0.3 COC(=O)C(C)CCN Amb31156338 [0,2,0,0,0,0|0,0,0]=2 5867 B8R0.3 COC(=O)C(C)CON Amb27944891 [0,2,0,0,0,0|1,0,0]=3 5868 B8R0.3 COC(=O)C(C)CSC Amb28203970 [0,2,0,0,0,0|2,0,0]=4 5869 B8R0.3 COC(=O)C(F)CCN Amb22388532 [0,2,0,0,0,0|0,0,0]=2 5870 B8R0.3 COC(=O)C(N)CC#N Amb26573884 [0,2,0,0,0,0|0,0,2]=4 5871 B8R0.3 COC(=O)C(N)CCBr Amb2695255 [0,2,0,0,0,0|1,0,0]=3 5872 B8R0.3 COC(=O)C(N)CCBr Amb4296941 [0,2,0,0,0,0|1,0,0]=3 5873 B8R0.3 COC(=O)C(N)CCCl Amb27855259 [0,2,0,0,0,0|1,0,0]=3 5874 B8R0.3 COC(=O)C(N)CCF Amb25066743 [0,2,0,0,0,0|1,0,0]=3 5875 B8R0.3 COC(=O)C(N)CCN Amb24113143 [0,2,0,0,0,0|0,0,0]=2 5876 B8R0.3 COC(=O)C(N)CCN Amb25733368 [0,2,0,0,0,0|0,0,0]=2 5877 B8R0.3 COC(=O)C(N)CCO Amb18305497 [0,2,0,0,0,0|1,0,0]=3 5878 B8R0.3 COC(=O)C(N)CON Amb27451370 [0,2,0,0,0,0|1,0,0]=3 5879 B8R0.3 COC(=O)C(N)CON Amb33329476 [0,2,0,0,0,0|1,0,0]=3 5880 B8R0.3 COC(=O)C(N)CSC Amb19878256 [0,2,0,0,0,0|2,0,0]=4 5881 B8R0.3 COC(=O)C(N)CSC Amb22052594 [0,2,0,0,0,0|2,0,0]=4 5882 B8R0.3 COC(=O)C(O)CC#N Amb25716720 [0,2,0,0,0,0|0,0,2]=4 5883 B8R0.3 COC(=O)C(O)CCBr Amb28385691 [0,2,0,0,0,0|1,0,0]=3 5884 B8R0.3 COC(=O)C(O)CCF Amb25114455 [0,2,0,0,0,0|1,0,0]=3 5885 B8R0.3 COC(=O)C(O)CCN Amb26960420 [0,2,0,0,0,0|0,0,0]=2 5886 B8R0.3 COC(=O)C(O)CSC Amb26009506 [0,2,0,0,0,0|2,0,0]=4 5887 B8R0.3 COC(=O)N(C)CCBr Amb27984717 [0,2,0,0,0,0|2,0,0]=4 5888 B8R0.3 COC(=O)N(C)CCCl Amb25916438 [0,2,0,0,0,0|2,0,0]=4 5889 B8R0.3 COC(=O)N(C)CCN Amb18975991 [0,2,0,0,0,0|1,0,0]=3 5890 B8R0.3 COC(=O)N(C)CCN Amb32667515 [0,2,0,0,0,0|1,0,0]=3 5891 B8R0.3 COC(=O)N(C)CCO Amb28049300 [0,2,0,0,0,0|2,0,0]=4 5892 B8R0.3 COC(=O)[C@@H](N)CCBr Amb2695271 [0,2,0,0,0,0|1,0,0]=3 5893 B8R0.3 COC(=O)[C@@H](N)CCBr Amb4296950 [0,2,0,0,0,0|1,0,0]=3 5894 B8R0.3 COC(=O)[C@@H](N)CCI Amb27806573 [0,2,0,0,0,0|1,0,0]=3 5895 B8R0.3 COC(=O)[C@@H](N)CCN Amb25727598 [0,2,0,0,0,0|0,0,0]=2 5896 B8R0.3 COC(=O)[C@@H](N)CCN Amb32658006 [0,2,0,0,0,0|0,0,0]=2 5897 B8R0.3 COC(=O)[C@@H](N)CCO Amb24746756 [0,2,0,0,0,0|1,0,0]=3 5898 B8R0.3 COC(=O)[C@@H](N)CSC Amb15701265 [0,2,0,0,0,0|2,0,0]=4 5899 B8R0.3 COC(=O)[C@@H](N)CSC Amb17322841 [0,2,0,0,0,0|2,0,0]=4 5900 B8R0.3 COC(=O)[C@@H](O)CCN Amb25146066 [0,2,0,0,0,0|0,0,0]=2 5901 B8R0.3 COC(=O)[C@@H](O)CCN Amb33457506 [0,2,0,0,0,0|0,0,0]=2 5902 B8R0.3 COC(=O)[C@@H](O)CCO Amb27406740 [0,2,0,0,0,0|1,0,0]=3 5903 B8R0.3 COC(=O)[C@H](C)CC=O Amb28388611 [0,2,0,0,0,0|1,0,1]=4 5904 B8R0.3 COC(=O)[C@H](C)CCO Amb28134520 [0,2,0,0,0,0|1,0,0]=3 5905 B8R0.3 COC(=O)[C@H](N)CCBr Amb2695267 [0,2,0,0,0,0|1,0,0]=3 5906 B8R0.3 COC(=O)[C@H](N)CCO Amb26475851 [0,2,0,0,0,0|1,0,0]=3 5907 B8R0.3 COC(=O)[C@H](N)CON Amb27949646 [0,2,0,0,0,0|1,0,0]=3 5908 B8R0.3 COC(=O)[C@H](N)CSC Amb27788444 [0,2,0,0,0,0|2,0,0]=4 5909 B8R0.3 COC(=O)[C@H](O)CCBr Amb27863444 [0,2,0,0,0,0|1,0,0]=3 5910 B8R0.3 COC(=O)[C@H](O)CCO Amb28315513 [0,2,0,0,0,0|1,0,0]=3 5911 B8R0.3 COC(=O)\C(C)=C\CN Amb28247882 [0,2,0,0,0,0|0,0,2]=4 5912 B8R0.3 COC(=O)\C(C)=C\CN Amb32683320 [0,2,0,0,0,0|0,0,2]=4 5913 B8R0.3 COC(=O)\C(F)=C\CN Amb33803457 [0,2,0,0,0,0|0,0,2]=4 5914 B8R0.3 COC(C)C(O)CCN Amb24538477 [0,2,0,0,0,0|1,0,1]=4 5915 B8R0.3 COCC(Br)C(=O)OC Amb10070673 [0,2,0,0,0,0|2,0,0]=4 5916 B8R0.3 COCC(Cl)C(=O)OC Amb27477958 [0,2,0,0,0,0|2,0,0]=4 5917 B8R0.3 COCC(N)C(=O)NO Amb27838499 [0,2,0,0,0,0|2,0,0]=4 5918 B8R0.3 COCC(N)C(=O)OC Amb23454660 [0,2,0,0,0,0|2,0,0]=4 5919 B8R0.3 COCC(N)C(=O)OC Amb32941874 [0,2,0,0,0,0|2,0,0]=4 5920 B8R0.3 COCC(O)C(=O)OC Amb23596463 [0,2,0,0,0,0|2,0,0]=4 5921 B8R0.3 COC[C@@H](N)C(=O)OC Amb33871640 [0,2,0,0,0,0|2,0,0]=4 5922 B8R0.3 COC[C@@H](O)C(=O)CO Amb27180388 [0,2,0,0,0,0|2,0,0]=4 5923 B8R0.3 COC[C@H](N)C(=O)OC Amb27882809 [0,2,0,0,0,0|2,0,0]=4 5924 B8R0.3 CSCC(O)C(=O)CO Amb28141435 [0,2,0,0,0,0|2,0,0]=4 5925 B8R0.3 C\C(=C/CN)C(=O)NO Amb35608836 [0,2,0,0,0,0|0,0,2]=4 5926 B8R0.3 NC(CCO)C(O)C=O Amb28123154 [0,2,0,0,0,0|1,0,1]=4 5927 B8R0.6 C#CC(=O)CCCCC Amb27844075 [0,2,0,0,0,0|2,0,0]=4 5928 B8R0.6 C#CC(=O)CCNCC Amb27252840 [0,2,0,0,0,0|2,0,0]=4 5929 B8R0.6 C#CC(=O)COCCN Amb28194342 [0,2,0,0,0,0|1,0,0]=3 5930 B8R0.6 C#CC(=O)CSCCC Amb27436447 [0,2,0,0,0,0|2,0,0]=4 5931 B8R0.6 C#CC(=O)NCCCF Amb27977478 [0,2,0,0,0,0|2,0,0]=4 5932 B8R0.6 C#CC(=O)NCCCN Amb18296191 [0,2,0,0,0,0|1,0,0]=3 5933 B8R0.6 C#CC(=O)OCCCC Amb25839203 [0,2,0,0,0,0|2,0,0]=4 5934 B8R0.6 C#CC(O)CCCCN Amb28341771 [0,2,0,0,0,0|1,0,1]=4 5935 B8R0.6 C#CCCCC(=O)CBr Amb27164981 [0,2,0,0,0,0|2,0,0]=4 5936 B8R0.6 C#CCCCC(=O)CC Amb27837514 [0,2,0,0,0,0|2,0,0]=4 5937 B8R0.6 C#CCCCC(=O)CN Amb27788268 [0,2,0,0,0,0|2,0,0]=4 5938 B8R0.6 C#CCCCC(=O)NC Amb27482425 [0,2,0,0,0,0|2,0,0]=4 5939 B8R0.6 C#CCCCC(=O)NN Amb28342617 [0,2,0,0,0,0|2,0,0]=4 5940 B8R0.6 C#CCCCC(=O)OC Amb2721693 [0,2,0,0,0,0|1,0,0]=3 5941 B8R0.6 C#CCCCC(=O)SC Amb27457790 [0,2,0,0,0,0|1,1,0]=4 5942 B8R0.6 C#CCCNC(=O)OC Amb24477847 [0,2,0,0,0,0|1,0,1]=4 5943 B8R0.6 C#CCCOC(=O)CO Amb27632704 [0,2,0,0,0,0|1,0,1]=4 5944 B8R0.6 C#CCNCC(=O)NO Amb28410283 [0,2,0,0,0,0|1,0,1]=4 5945 B8R0.6 C#CCNCC(=O)OC Amb6706474 [0,2,0,0,0,0|1,0,1]=4 5946 B8R0.6 C#CCOCC(=O)OC Amb9208653 [0,2,0,0,0,0|1,0,1]=4 5947 B8R0.6 C=C(C=O)CCCCC Amb18642442 [0,2,0,0,0,0|2,0,0]=4 5948 B8R0.6 C=C(C=O)CCCCCl Amb27621755 [0,2,0,0,0,0|2,0,0]=4 5949 B8R0.6 C=C(CC)CSCCN Amb27174810 [0,2,0,0,0,0|2,0,0]=4 5950 B8R0.6 C=C(CCCCCl)OC Amb27470874 [0,2,0,0,0,0|2,0,0]=4 5951 B8R0.6 C=C(CO)CCCC#N Amb27801561 [0,2,0,0,0,0|1,0,1]=4 5952 B8R0.6 C=C(CO)CCCCO Amb27405284 [0,2,0,0,0,0|2,0,0]=4 5953 B8R0.6 C=C(CO)CSCCO Amb27959258 [0,2,0,0,0,0|2,0,0]=4 5954 B8R0.6 C=C=CCCC(=O)OC Amb10605302 [0,2,0,0,0,0|1,0,1]=4 5955 B8R0.6 C=CC(=O)CCCCC Amb20671146 [0,2,0,0,0,0|2,0,0]=4 5956 B8R0.6 C=CC(=O)COCCN Amb27410002 [0,2,0,0,0,0|1,0,0]=3 5957 B8R0.6 C=CC(=O)CSCCC Amb28041993 [0,2,0,0,0,0|2,0,0]=4 5958 B8R0.6 C=CC(=O)NCCCC Amb9480528 [0,2,0,0,0,0|2,0,0]=4 5959 B8R0.6 C=CC(=O)NCCCO Amb33531592 [0,2,0,0,0,0|2,0,0]=4 5960 B8R0.6 C=CC(=O)OCCCC Amb3940493 [0,2,0,0,0,0|2,0,0]=4 5961 B8R0.6 C=CC(=O)OCCCC Amb3940920 [0,2,0,0,0,0|2,0,0]=4 5962 B8R0.6 C=CC(=O)OCCCN Amb24120374 [0,2,0,0,0,0|1,0,0]=3 5963 B8R0.6 C=CC(=O)OCCCN Amb30585183 [0,2,0,0,0,0|1,0,0]=3 5964 B8R0.6 C=CC(=O)OCCCO Amb22167329 [0,2,0,0,0,0|2,0,0]=4 5965 B8R0.6 C=CCCCC(=C)C=O Amb27802486 [0,2,0,0,0,0|2,0,0]=4 5966 B8R0.6 C=CCCCC(=O)CBr Amb27966828 [0,2,0,0,0,0|2,0,0]=4 5967 B8R0.6 C=CCCCC(=O)CC Amb27249620 [0,2,0,0,0,0|2,0,0]=4 5968 B8R0.6 C=CCCCC(=O)OC Amb22730759 [0,2,0,0,0,0|1,0,0]=3 5969 B8R0.6 C=CCCOC(=O)CO Amb27487083 [0,2,0,0,0,0|1,0,1]=4 5970 B8R0.6 C=CCNCC(=O)NO Amb27755815 [0,2,0,0,0,0|1,0,1]=4 5971 B8R0.6 C=CCNCC(=O)OC Amb6706546 [0,2,0,0,0,0|1,0,1]=4 5972 B8R0.6 C=CCOCC(=O)CO Amb27256454 [0,2,0,0,0,0|1,0,1]=4 5973 B8R0.6 C=CCOCC(=O)NO Amb28204931 [0,2,0,0,0,0|1,0,1]=4 5974 B8R0.6 C=CCOCC(=O)OC Amb7793827 [0,2,0,0,0,0|1,0,1]=4 5975 B8R0.6 C=CCSCC(=O)NO Amb27837659 [0,2,0,0,0,0|1,0,1]=4 5976 B8R0.6 C=COCCC(=O)OC Amb27394977 [0,2,0,0,0,0|1,0,1]=4 5977 B8R0.6 CC(CCCCN)NO Amb27956523 [0,2,0,0,0,0|1,0,1]=4 5978 B8R0.6 CC(CO)NCCCN Amb28367225 [0,2,0,0,0,0|1,0,1]=4 5979 B8R0.6 CC(CO)SCCCN Amb27755869 [0,2,0,0,0,0|1,0,1]=4 5980 B8R0.6 CCC(=O)CCCCO Amb27867195 [0,2,0,0,0,0|2,0,0]=4 5981 B8R0.6 CCC(=O)CSCCCl Amb28399270 [0,2,0,0,0,0|2,0,0]=4 5982 B8R0.6 CCC(=O)CSCCO Amb4165967 [0,2,0,0,0,0|2,0,0]=4 5983 B8R0.6 CCC(=O)NCCCBr Amb9209422 [0,2,0,0,0,0|2,0,0]=4 5984 B8R0.6 CCC(=O)NCCCCl Amb3886595 [0,2,0,0,0,0|2,0,0]=4 5985 B8R0.6 CCC(=O)NCCCI Amb27222536 [0,2,0,0,0,0|2,0,0]=4 5986 B8R0.6 CCC(=O)NCCCN Amb6280448 [0,2,0,0,0,0|1,0,0]=3 5987 B8R0.6 CCC(=O)NCCCO Amb5797471 [0,2,0,0,0,0|2,0,0]=4 5988 B8R0.6 CCC(=O)NCCON Amb17138375 [0,2,0,0,0,0|2,0,0]=4 5989 B8R0.6 CCC(=O)OCCCBr Amb27262082 [0,2,0,0,0,0|2,0,0]=4 5990 B8R0.6 CCC(=O)OCCCO Amb28138647 [0,2,0,0,0,0|2,0,0]=4 5991 B8R0.6 CCC(O)CCCNC Amb27655789 [0,2,0,0,0,0|1,0,1]=4 5992 B8R0.6 CCCC#CC(=O)OC Amb8517413 [0,2,0,0,0,0|1,0,1]=4 5993 B8R0.6 CCCCCC(=O)CC Amb8513554 [0,2,0,0,0,0|2,0,0]=4 5994 B8R0.6 CCCCCC(=O)CO Amb27956467 [0,2,0,0,0,0|1,0,0]=3 5995 B8R0.6 CCCCCC(=O)CS Amb27750258 [0,2,0,0,0,0|1,1,0]=4 5996 B8R0.6 CCCCCC(=O)NN Amb6540616 [0,2,0,0,0,0|2,0,0]=4 5997 B8R0.6 CCCCCC(=O)NO Amb2720996 [0,2,0,0,0,0|1,0,0]=3 5998 B8R0.6 CCCCCC(=O)OC Amb6608968 [0,2,0,0,0,0|1,0,0]=3 5999 B8R0.6 CCCCCC(O)C=O Amb18642802 [0,2,0,0,0,0|1,0,1]=4 6000 B8R0.6 CCCCC[C@H](O)C=O Amb28198840 [0,2,0,0,0,0|1,0,1]=4 6001 B8R0.6 CCCCC\C(C)=N\O Amb22338237 [0,2,0,0,0,0|2,0,0]=4 6002 B8R0.6 CCCCNC(=O)CBr Amb17327510 [0,2,0,0,0,0|2,0,0]=4 6003 B8R0.6 CCCCNC(=O)CC Amb3373336 [0,2,0,0,0,0|2,0,0]=4 6004 B8R0.6 CCCCNC(=O)CCl Amb1204239 [0,2,0,0,0,0|2,0,0]=4 6005 B8R0.6 CCCCNC(=O)CN Amb21958688 [0,2,0,0,0,0|2,0,0]=4 6006 B8R0.6 CCCCNC(=O)CN Amb5783028 [0,2,0,0,0,0|2,0,0]=4 6007 B8R0.6 CCCCNC(=O)CO Amb5798171 [0,2,0,0,0,0|1,0,0]=3 6008 B8R0.6 CCCCNC(=O)NC Amb1060752 [0,2,0,0,0,0|2,0,0]=4 6009 B8R0.6 CCCCNC(=O)NN Amb8853914 [0,2,0,0,0,0|2,0,0]=4 6010 B8R0.6 CCCCNC(=O)OC Amb3364701 [0,2,0,0,0,0|1,0,0]=3 6011 B8R0.6 CCCCNC(=S)NO Amb10574487 [0,2,0,0,0,0|1,1,0]=4 6012 B8R0.6 CCCCN\C(C)=N/O Amb27173635 [0,2,0,0,0,0|2,0,0]=4 6013 B8R0.6 CCCCN\C(N)=N\O Amb24735707 [0,2,0,0,0,0|2,0,0]=4 6014 B8R0.6 CCCCOC(=O)C=O Amb3941041 [0,2,0,0,0,0|1,0,1]=4 6015 B8R0.6 CCCCOC(=O)CCl Amb2724515 [0,2,0,0,0,0|2,0,0]=4 6016 B8R0.6 CCCCOC(=O)CN Amb19373374 [0,2,0,0,0,0|2,0,0]=4 6017 B8R0.6 CCCCOC(=O)CN Amb3939626 [0,2,0,0,0,0|2,0,0]=4 6018 B8R0.6 CCCCOC(=O)CO Amb9277787 [0,2,0,0,0,0|1,0,0]=3 6019 B8R0.6 CCCCOC(=O)CS Amb4034596 [0,2,0,0,0,0|1,1,0]=4 6020 B8R0.6 CCCCOC(=O)C[NH3+] Amb22733556 [0,2,0,0,0,0|2,0,0]=4 6021 B8R0.6 CCCCOC(=O)NC Amb24680085 [0,2,0,0,0,0|2,0,0]=4 6022 B8R0.6 CCCCOC(=O)OC Amb25921901 [0,2,0,0,0,0|1,0,0]=3 6023 B8R0.6 CCCCSC(=O)CBr Amb27627822 [0,2,0,0,0,0|2,0,0]=4 6024 B8R0.6 CCCCSC(=O)CCl Amb27660104 [0,2,0,0,0,0|2,0,0]=4 6025 B8R0.6 CCCC\C=C(/Br)C=O Amb28130465 [0,2,0,0,0,0|2,0,0]=4 6026 B8R0.6 CCCC\C=C(/Cl)C=O Amb27949654 [0,2,0,0,0,0|2,0,0]=4 6027 B8R0.6 CCCC\C=C(\Br)C=O Amb28196734 [0,2,0,0,0,0|2,0,0]=4 6028 B8R0.6 CCCC\C=C(\Cl)CO Amb28315452 [0,2,0,0,0,0|2,0,0]=4 6029 B8R0.6 CCCC\C=C(\F)CO Amb27835021 [0,2,0,0,0,0|2,0,0]=4 6030 B8R0.6 CCCNCC(=O)NC Amb6714452 [0,2,0,0,0,0|2,0,0]=4 6031 B8R0.6 CCCNCC(=O)NN Amb27495361 [0,2,0,0,0,0|2,0,0]=4 6032 B8R0.6 CCCNCC(=O)NO Amb27171730 [0,2,0,0,0,0|1,0,0]=3 6033 B8R0.6 CCCNCC(=O)OC Amb28934926 [0,2,0,0,0,0|1,0,0]=3 6034 B8R0.6 CCCNCC(=O)OC Amb6687123 [0,2,0,0,0,0|1,0,0]=3 6035 B8R0.6 CCCNC\C(N)=N\O Amb25147147 [0,2,0,0,0,0|2,0,0]=4 6036 B8R0.6 CCCOCC(=O)CBr Amb28319117 [0,2,0,0,0,0|2,0,0]=4 6037 B8R0.6 CCCOCC(=O)CC Amb27837457 [0,2,0,0,0,0|2,0,0]=4 6038 B8R0.6 CCCOCC(=O)CCl Amb27882673 [0,2,0,0,0,0|2,0,0]=4 6039 B8R0.6 CCCOC\C(N)=N\O Amb8874862 [0,2,0,0,0,0|2,0,0]=4 6040 B8R0.6 CCCSCC(=O)CC Amb27837484 [0,2,0,0,0,0|2,0,0]=4 6041 B8R0.6 CCCSCC(=O)NC Amb27162536 [0,2,0,0,0,0|2,0,0]=4 6042 B8R0.6 CCCSCC(=O)OC Amb7753194 [0,2,0,0,0,0|1,0,0]=3 6043 B8R0.6 CCCSC\C(N)=N\O Amb6680793 [0,2,0,0,0,0|2,0,0]=4 6044 B8R0.6 CCC\C=C/C(=O)OC Amb27423496 [0,2,0,0,0,0|1,0,1]=4 6045 B8R0.6 CCC\C=C\C(=O)OC Amb6366801 [0,2,0,0,0,0|1,0,1]=4 6046 B8R0.6 CCNCCC(=O)NC Amb28423128 [0,2,0,0,0,0|2,0,0]=4 6047 B8R0.6 CCNCCC(=O)NC Amb33528495 [0,2,0,0,0,0|2,0,0]=4 6048 B8R0.6 CCNCCC(=O)NN Amb8428177 [0,2,0,0,0,0|2,0,0]=4 6049 B8R0.6 CCNCCC(=O)OC Amb6739987 [0,2,0,0,0,0|1,0,0]=3 6050 B8R0.6 CCNCC\C(N)=N/O Amb19981295 [0,2,0,0,0,0|2,0,0]=4 6051 B8R0.6 CCOCCC(=N)OC Amb27606548 [0,2,0,0,0,0|2,0,0]=4 6052 B8R0.6 CCOCCC(=N)OC Amb32653542 [0,2,0,0,0,0|2,0,0]=4 6053 B8R0.6 CCOCCC(=O)CC Amb27837472 [0,2,0,0,0,0|2,0,0]=4 6054 B8R0.6 CCOCCC(=O)CCl Amb27591059 [0,2,0,0,0,0|2,0,0]=4 6055 B8R0.6 CCOCCC(=O)CN Amb27253736 [0,2,0,0,0,0|2,0,0]=4 6056 B8R0.6 CCOCCC(=O)NN Amb6541358 [0,2,0,0,0,0|2,0,0]=4 6057 B8R0.6 CCOCCC(=O)OC Amb7773814 [0,2,0,0,0,0|1,0,0]=3 6058 B8R0.6 CCOCC\C(N)=N\O Amb6266452 [0,2,0,0,0,0|2,0,0]=4 6059 B8R0.6 CCSCCC(=O)NN Amb27837509 [0,2,0,0,0,0|2,0,0]=4 6060 B8R0.6 CCSCCC(=O)OC Amb4016403 [0,2,0,0,0,0|1,0,0]=3 6061 B8R0.6 CCSCC\C(N)=N\O Amb6680782 [0,2,0,0,0,0|2,0,0]=4 6062 B8R0.6 CC\C(C)=N/CCCN Amb28060249 [0,2,0,0,0,0|2,0,0]=4 6063 B8R0.6 CC\C(C)=N\CCCN Amb27849925 [0,2,0,0,0,0|2,0,0]=4 6064 B8R0.6 CC\C=C\CC(=O)OC Amb8517644 [0,2,0,0,0,0|1,0,1]=4 6065 B8R0.6 CNC(=N)NCCCN Amb27858102 [0,2,0,0,0,0|2,0,0]=4 6066 B8R0.6 CNC(=O)CCCCBr Amb17235862 [0,2,0,0,0,0|2,0,0]=4 6067 B8R0.6 CNC(=O)CCCCN Amb27220816 [0,2,0,0,0,0|1,0,0]=3 6068 B8R0.6 CNC(=O)CCCCO Amb17231874 [0,2,0,0,0,0|2,0,0]=4 6069 B8R0.6 CNC(=O)CCCON Amb27230783 [0,2,0,0,0,0|1,0,0]=3 6070 B8R0.6 CNC(=O)CCCSC Amb18411875 [0,2,0,0,0,0|2,0,0]=4 6071 B8R0.6 CNC(=O)CCSCCl Amb27430707 [0,2,0,0,0,0|2,0,0]=4 6072 B8R0.6 CNC(=O)COCCN Amb19016737 [0,2,0,0,0,0|1,0,0]=3 6073 B8R0.6 CNC(=O)COCCN Amb24271094 [0,2,0,0,0,0|1,0,0]=3 6074 B8R0.6 CNC(=O)COCCO Amb28285253 [0,2,0,0,0,0|2,0,0]=4 6075 B8R0.6 CNC(=O)CSCCN Amb6264722 [0,2,0,0,0,0|1,0,0]=3 6076 B8R0.6 CNC(=O)NCCCCl Amb13951257 [0,2,0,0,0,0|2,0,0]=4 6077 B8R0.6 CNC(=O)NCCCF Amb27843538 [0,2,0,0,0,0|2,0,0]=4 6078 B8R0.6 CNC(=O)NCCCN Amb18908303 [0,2,0,0,0,0|1,0,0]=3 6079 B8R0.6 CNC(=O)NCCCN Amb33743450 [0,2,0,0,0,0|1,0,0]=3 6080 B8R0.6 CNC(=O)NCCCO Amb27161587 [0,2,0,0,0,0|2,0,0]=4 6081 B8R0.6 CNC(=O)OCCCN Amb27243133 [0,2,0,0,0,0|1,0,0]=3 6082 B8R0.6 CNC(=O)OCCCN Amb33803867 [0,2,0,0,0,0|1,0,0]=3 6083 B8R0.6 CNC(=O)SCCCCl Amb27750203 [0,2,0,0,0,0|2,0,0]=4 6084 B8R0.6 CNCC#CC(=O)OC Amb33168795 [0,2,0,0,0,0|0,0,2]=4 6085 B8R0.6 CNCCCC(=O)NC Amb18303609 [0,2,0,0,0,0|1,0,0]=3 6086 B8R0.6 CNCCCC(=O)NC Amb22098814 [0,2,0,0,0,0|1,0,0]=3 6087 B8R0.6 CNCCCC(=O)NO Amb28041873 [0,2,0,0,0,0|0,0,0]=2 6088 B8R0.6 CNCCCC(=O)OC Amb7969745 [0,2,0,0,0,0|0,0,0]=2 6089 B8R0.6 CNCCCC(=O)OC Amb8841493 [0,2,0,0,0,0|0,0,0]=2 6090 B8R0.6 CNCCCC(C)OC Amb17569936 [0,2,0,0,0,0|1,0,1]=4 6091 B8R0.6 CNCCC\C(N)=N\O Amb27464123 [0,2,0,0,0,0|1,0,0]=3 6092 B8R0.6 CNC\C=C\C(=O)OC Amb26535556 [0,2,0,0,0,0|0,0,2]=4 6093 B8R0.6 COC(=N)CCCCCl Amb32941935 [0,2,0,0,0,0|2,0,0]=4 6094 B8R0.6 COC(=N)COCCO Amb27857878 [0,2,0,0,0,0|2,0,0]=4 6095 B8R0.6 COC(=O)C#CCCN Amb32656224 [0,2,0,0,0,0|0,0,1]=3 6096 B8R0.6 COC(=O)C#CCCO Amb22230912 [0,2,0,0,0,0|1,0,1]=4 6097 B8R0.6 COC(=O)CC#CCO Amb28321358 [0,2,0,0,0,0|1,0,1]=4 6098 B8R0.6 COC(=O)CCCC#N Amb8961157 [0,2,0,0,0,0|0,0,1]=3 6099 B8R0.6 COC(=O)CCCCBr Amb3940220 [0,2,0,0,0,0|1,0,0]=3 6100 B8R0.6 COC(=O)CCCCCl Amb3940767 [0,2,0,0,0,0|1,0,0]=3 6101 B8R0.6 COC(=O)CCCCI Amb4018545 [0,2,0,0,0,0|1,0,0]=3 6102 B8R0.6 COC(=O)CCCCN Amb13951283 [0,2,0,0,0,0|0,0,0]=2 6103 B8R0.6 COC(=O)CCCCN Amb18642844 [0,2,0,0,0,0|0,0,0]=2 6104 B8R0.6 COC(=O)CCCCO Amb22641583 [0,2,0,0,0,0|1,0,0]=3 6105 B8R0.6 COC(=O)CCCCS Amb27218229 [0,2,0,0,0,0|1,0,0]=3 6106 B8R0.6 COC(=O)CCCON Amb25266351 [0,2,0,0,0,0|0,0,0]=2 6107 B8R0.6 COC(=O)CCCON Amb32753844 [0,2,0,0,0,0|0,0,0]=2 6108 B8R0.6 COC(=O)CCN=C=O Amb3905408 [0,2,0,0,0,0|1,0,1]=4 6109 B8R0.6 COC(=O)CCN=C=S Amb520874 [0,2,0,0,0,0|1,0,1]=4 6110 B8R0.6 COC(=O)CCN=[N+]=[N-] Amb22900901 [0,2,0,0,0,0|1,0,1]=4 6111 B8R0.6 COC(=O)CCSC#N Amb27624712 [0,2,0,0,0,0|0,0,2]=4 6112 B8R0.6 COC(=O)CC\C=C\Br Amb26433263 [0,2,0,0,0,0|1,0,1]=4 6113 B8R0.6 COC(=O)CNCC#N Amb6707511 [0,2,0,0,0,0|0,0,2]=4 6114 B8R0.6 COC(=O)CNCCF Amb27175508 [0,2,0,0,0,0|1,0,0]=3 6115 B8R0.6 COC(=O)CNCCN Amb27755951 [0,2,0,0,0,0|0,0,0]=2 6116 B8R0.6 COC(=O)CNCCS Amb28285258 [0,2,0,0,0,0|1,0,0]=3 6117 B8R0.6 COC(=O)COCCBr Amb27657286 [0,2,0,0,0,0|1,0,0]=3 6118 B8R0.6 COC(=O)COCCCl Amb8389878 [0,2,0,0,0,0|1,0,0]=3 6119 B8R0.6 COC(=O)COCCN Amb24401799 [0,2,0,0,0,0|0,0,0]=2 6120 B8R0.6 COC(=O)COCCN Amb33495145 [0,2,0,0,0,0|0,0,0]=2 6121 B8R0.6 COC(=O)COCCO Amb24113538 [0,2,0,0,0,0|1,0,0]=3 6122 B8R0.6 COC(=O)CSCCN Amb19268671 [0,2,0,0,0,0|0,0,0]=2 6123 B8R0.6 COC(=O)CSCCN Amb6272538 [0,2,0,0,0,0|0,0,0]=2 6124 B8R0.6 COC(=O)CSCCO Amb9245011 [0,2,0,0,0,0|1,0,0]=3 6125 B8R0.6 COC(=O)C\C=C\CBr Amb27444630 [0,2,0,0,0,0|1,0,1]=4 6126 B8R0.6 COC(=O)C\C=C\CCl Amb25084500 [0,2,0,0,0,0|1,0,1]=4 6127 B8R0.6 COC(=O)NCCC#N Amb28049746 [0,2,0,0,0,0|0,0,2]=4 6128 B8R0.6 COC(=O)NCCCF Amb27968335 [0,2,0,0,0,0|1,0,0]=3 6129 B8R0.6 COC(=O)OCCCF Amb24088642 [0,2,0,0,0,0|1,0,0]=3 6130 B8R0.6 COC(=O)\C=C\CCBr Amb22756459 [0,2,0,0,0,0|1,0,1]=4 6131 B8R0.6 COC(=O)\C=C\CCN Amb27617644 [0,2,0,0,0,0|0,0,1]=3 6132 B8R0.6 COC(=O)\C=C\CCO Amb26347391 [0,2,0,0,0,0|1,0,1]=4 6133 B8R0.6 COC(=S)SCCCF Amb27837959 [0,2,0,0,0,0|1,1,0]=4 6134 B8R0.6 COCCCC(=O)CCl Amb28255500 [0,2,0,0,0,0|2,0,0]=4 6135 B8R0.6 COCCCC(=O)CN Amb27632511 [0,2,0,0,0,0|2,0,0]=4 6136 B8R0.6 COCCCC(=O)NN Amb8455564 [0,2,0,0,0,0|2,0,0]=4 6137 B8R0.6 COCCCC(=O)OC Amb8952328 [0,2,0,0,0,0|1,0,0]=3 6138 B8R0.6 COCCC\C(N)=N\O Amb9728042 [0,2,0,0,0,0|2,0,0]=4 6139 B8R0.6 COCCNC(=O)CO Amb9421655 [0,2,0,0,0,0|2,0,0]=4 6140 B8R0.6 COCCNC(=O)OC Amb3361553 [0,2,0,0,0,0|2,0,0]=4 6141 B8R0.6 COCCOC(=O)OC Amb26026830 [0,2,0,0,0,0|2,0,0]=4 6142 B8R0.6 COCSCC(=O)OC Amb27972043 [0,2,0,0,0,0|2,0,0]=4 6143 B8R0.6 CON(C)CCCCN Amb28206802 [0,2,0,0,0,0|2,0,0]=4 6144 B8R0.6 CONCCC(=O)OC Amb26511384 [0,2,0,0,0,0|2,0,0]=4 6145 B8R0.6 CO[PH](=O)OCCCCl Amb27407755 [0,2,0,0,0,0|2,0,0]=4 6146 B8R0.6 CSCCC\C(N)=N\O Amb25324485 [0,2,0,0,0,0|2,0,0]=4 6147 B8R0.6 CSCCOC(=O)CO Amb28193244 [0,2,0,0,0,0|2,0,0]=4 6148 B8R0.6 C\C(=C/CCCBr)CO Amb28348616 [0,2,0,0,0,0|2,0,0]=4 6149 B8R0.6 C\C(=C/CCCN)CO Amb28077171 [0,2,0,0,0,0|1,0,0]=3 6150 B8R0.6 C\C(=C/Cl)COCCN Amb28049233 [0,2,0,0,0,0|2,0,0]=4 6151 B8R0.6 N#CCCCC(=O)C#N Amb27835198 [0,2,0,0,0,0|1,0,1]=4 6152 B8R0.6 N#CCCCC(=O)CBr Amb27791840 [0,2,0,0,0,0|1,0,1]=4 6153 B8R0.6 N#CCCC\C(N)=N\O Amb28251882 [0,2,0,0,0,0|1,0,1]=4 6154 B8R0.6 NCC(=O)NCCCCl Amb33483904 [0,2,0,0,0,0|2,0,0]=4 6155 B8R0.6 NCC(=O)NCCCCl Amb33483921 [0,2,0,0,0,0|2,0,0]=4 6156 B8R0.6 NCC(=O)OCCCO Amb27430485 [0,2,0,0,0,0|2,0,0]=4 6157 B8R0.6 NCCCCC(=O)NN Amb18061874 [0,2,0,0,0,0|1,0,0]=3 6158 B8R0.6 NCCCCC(N)CO Amb27403112 [0,2,0,0,0,0|1,0,1]=4 6159 B8R0.6 NCCCC[C@H](N)C=O Amb27230236 [0,2,0,0,0,0|1,0,1]=4 6160 B8R0.6 NCCCC[C@H](N)CO Amb25883920 [0,2,0,0,0,0|1,0,1]=4 6161 B8R0.6 NCCCC[C@H](N)CO Amb33801813 [0,2,0,0,0,0|1,0,1]=4 6162 B8R0.6 NCCCC\C(N)=N\O Amb26494974 [0,2,0,0,0,0|1,0,0]=3 6163 B8R0.6 NCCCNC(=O)CBr Amb27837527 [0,2,0,0,0,0|1,0,0]=3 6164 B8R0.6 NCCCNC(=O)CN Amb19011430 [0,2,0,0,0,0|1,0,0]=3 6165 B8R0.6 NCCCNC(=O)CO Amb28346767 [0,2,0,0,0,0|0,0,0]=2 6166 B8R0.6 NCCCNC(=O)CS Amb27391980 [0,2,0,0,0,0|0,1,0]=3 6167 B8R0.6 NCCCN\C(N)=N\O Amb27468839 [0,2,0,0,0,0|1,0,0]=3 6168 B8R0.6 NCCNCC(N)CO Amb27234820 [0,2,0,0,0,0|1,0,1]=4 6169 B8R0.6 NCCNCC(O)CO Amb28198046 [0,2,0,0,0,0|0,0,2]=4 6170 B8R0.6 NCCNC[C@H](N)CO Amb27218189 [0,2,0,0,0,0|1,0,1]=4 6171 B8R0.6 NCCNC[C@H](O)CO Amb27480727 [0,2,0,0,0,0|0,0,2]=4 6172 B8R0.6 NCCOCC(O)CF Amb27774801 [0,2,0,0,0,0|1,0,1]=4 6173 B8R0.6 NCCSCC(=O)NO Amb28455962 [0,2,0,0,0,0|0,0,0]=2 6174 B8R0.6 NNC(=O)CCCCS Amb27766833 [0,2,0,0,0,0|2,0,0]=4 6175 B8R0.6 NNC(=O)CSCCO Amb27432331 [0,2,0,0,0,0|2,0,0]=4 6176 B8R0.6 NNC(=O)NCCCF Amb27812049 [0,2,0,0,0,0|2,0,0]=4 6177 B8R0.6 NNC(=O)SCCCS Amb27768062 [0,2,0,0,0,0|2,0,0]=4 6178 B8R0.6 N\C(CCCCBr)=N\O Amb2695919 [0,2,0,0,0,0|2,0,0]=4 6179 B8R0.6 N\C(CCCCCl)=N\O Amb2696032 [0,2,0,0,0,0|2,0,0]=4 6180 B8R0.6 N\C(CCCCF)=N/O Amb27793943 [0,2,0,0,0,0|2,0,0]=4 6181 B8R0.6 O=C(CBr)NCCCF Amb28289230 [0,2,0,0,0,0|2,0,0]=4 6182 B8R0.6 O=C(CBr)NCCCO Amb17329705 [0,2,0,0,0,0|2,0,0]=4 6183 B8R0.6 O=C(CCCCBr)NO Amb27494446 [0,2,0,0,0,0|1,0,0]=3 6184 B8R0.6 O=C(CCCCCl)NO Amb28326259 [0,2,0,0,0,0|1,0,0]=3 6185 B8R0.6 O=C(CCl)NCCCCl Amb2125567 [0,2,0,0,0,0|2,0,0]=4 6186 B8R0.6 O=C(CCl)NCCCF Amb27198384 [0,2,0,0,0,0|2,0,0]=4 6187 B8R0.6 O=C(CCl)NCCCO Amb4477240 [0,2,0,0,0,0|2,0,0]=4 6188 B8R0.6 O=C(CCl)OCCCO Amb27198162 [0,2,0,0,0,0|2,0,0]=4 6189 B8R0.6 O=C(CO)NCCCO Amb5798092 [0,2,0,0,0,0|1,0,0]=3 6190 B8R0.6 O=C(CO)OCCCCl Amb27457140 [0,2,0,0,0,0|1,0,0]=3 6191 B8R0.6 O=C(CO)OCCCF Amb27765133 [0,2,0,0,0,0|1,0,0]=3 6192 B8R0.6 O=C(CS)NCCCF Amb27628663 [0,2,0,0,0,0|1,1,0]=4 6193 B8R0.6 O=C\C(F)=C\CCCCl Amb28429849 [0,2,0,0,0,0|2,0,0]=4 6194 B8R0.6 OC\C(F)=C\CCCCl Amb27623942 [0,2,0,0,0,0|2,0,0]=4 6195 B8R0.6 [C-]#[N+]CCCC(=O)OC Amb2688933 [0,2,0,0,0,0|0,0,1]=3 6196 B8R0.8 C#CCCC(=O)C(O)O Amb27405278 [0,2,0,0,0,0|1,0,1]=4 6197 B8R0.8 C#CCCC(=O)N(C)O Amb35735506 [0,2,0,0,0,0|1,0,1]=4 6198 B8R0.8 C#CCCC(C)C(=O)O Amb27464960 [0,2,0,0,0,0|1,0,0]=3 6199 B8R0.8 C#CCCC(C)C(N)=O Amb28341068 [0,2,0,0,0,0|2,0,0]=4 6200 B8R0.8 C#CCCC(N)C(=O)O Amb6277526 [0,2,0,0,0,0|1,0,0]=3 6201 B8R0.8 C#CCCC(N)C(N)=O Amb25703121 [0,2,0,0,0,0|2,0,0]=4 6202 B8R0.8 C#CCCC(O)C(N)=O Amb28057741 [0,2,0,0,0,0|2,0,0]=4 6203 B8R0.8 C#CCC[C@@H](N)C(=O)O Amb24088809 [0,2,0,0,0,0|1,0,0]=3 6204 B8R0.8 C#CCC[C@H](N)C(=O)O Amb24088866 [0,2,0,0,0,0|1,0,0]=3 6205 B8R0.8 C#CCC[C@H](N)C(=O)O Amb33744060 [0,2,0,0,0,0|1,0,0]=3 6206 B8R0.8 C#CCNC(C)C(=O)O Amb9327029 [0,2,0,0,0,0|1,0,1]=4 6207 B8R0.8 C#CCN[C@H](C)C(=O)O Amb27815665 [0,2,0,0,0,0|1,0,1]=4 6208 B8R0.8 C#CCOC(C)C(=O)O Amb9208661 [0,2,0,0,0,0|1,0,1]=4 6209 B8R0.8 C#CCO[C@H](C)C(=O)O Amb28042909 [0,2,0,0,0,0|1,0,1]=4 6210 B8R0.8 C#CCSC(C)C(=O)O Amb6274343 [0,2,0,0,0,0|1,0,1]=4 6211 B8R0.8 C=C(C)C(=O)CCCC Amb27968800 [0,2,0,0,0,0|2,0,0]=4 6212 B8R0.8 C=C(C)C(=O)NCCN Amb18908289 [0,2,0,0,0,0|2,0,0]=4 6213 B8R0.8 C=C(C)C(=O)NCCN Amb33484365 [0,2,0,0,0,0|2,0,0]=4 6214 B8R0.8 C=C(C)C(=O)OCCN Amb2720244 [0,2,0,0,0,0|2,0,0]=4 6215 B8R0.8 C=C(C)C(=O)OCCN Amb3941408 [0,2,0,0,0,0|2,0,0]=4 6216 B8R0.8 C=C(CCCC)C(=O)O Amb18642649 [0,2,0,0,0,0|1,0,0]=3 6217 B8R0.8 C=C(CCCC)C(C)=O Amb27260457 [0,2,0,0,0,0|2,0,0]=4 6218 B8R0.8 C=C(CCCC)C(C)O Amb27946944 [0,2,0,0,0,0|2,0,0]=4 6219 B8R0.8 C=C(CCCO)C(=O)O Amb28313844 [0,2,0,0,0,0|1,0,0]=3 6220 B8R0.8 C=C(CCCO)C(N)=O Amb27423225 [0,2,0,0,0,0|2,0,0]=4 6221 B8R0.8 C=C(CCOC)C(=O)O Amb26588153 [0,2,0,0,0,0|1,0,1]=4 6222 B8R0.8 C=C(CCSC)C(=O)O Amb27188177 [0,2,0,0,0,0|1,0,1]=4 6223 B8R0.8 C=C(COCC)C(=O)O Amb27444042 [0,2,0,0,0,0|1,0,1]=4 6224 B8R0.8 C=C(CSCC)C(=O)O Amb26023918 [0,2,0,0,0,0|1,0,1]=4 6225 B8R0.8 C=C(Cl)C(=O)NCCN Amb28074341 [0,2,0,0,0,0|2,0,0]=4 6226 B8R0.8 C=C=CCC(N)C(=O)O Amb25843448 [0,2,0,0,0,0|1,0,1]=4 6227 B8R0.8 C=C=CC[C@@H](N)C(=O)O Amb28070890 [0,2,0,0,0,0|1,0,1]=4 6228 B8R0.8 C=CCCC(=O)C(=O)O Amb25738669 [0,2,0,0,0,0|1,0,1]=4 6229 B8R0.8 C=CCCC(Br)C(=O)O Amb28047448 [0,2,0,0,0,0|1,0,0]=3 6230 B8R0.8 C=CCCC(C)C(=O)O Amb18642656 [0,2,0,0,0,0|1,0,0]=3 6231 B8R0.8 C=CCCC(C)C(C)=O Amb27470888 [0,2,0,0,0,0|2,0,0]=4 6232 B8R0.8 C=CCCC(N)C(=O)O Amb24383848 [0,2,0,0,0,0|1,0,0]=3 6233 B8R0.8 C=CCCC(N)C(=O)O Amb28934988 [0,2,0,0,0,0|1,0,0]=3 6234 B8R0.8 C=CCCC(N)C(N)=O Amb24333721 [0,2,0,0,0,0|2,0,0]=4 6235 B8R0.8 C=CCC[C@@H](N)C(=O)O Amb23439045 [0,2,0,0,0,0|1,0,0]=3 6236 B8R0.8 C=CCC[C@@H](N)C(N)=O Amb27168705 [0,2,0,0,0,0|2,0,0]=4 6237 B8R0.8 C=CCC[C@H](N)C(=O)O Amb28285244 [0,2,0,0,0,0|1,0,0]=3 6238 B8R0.8 C=CCC[C@H](O)C(=O)O Amb28122952 [0,2,0,0,0,0|1,0,0]=3 6239 B8R0.8 C=CCNC(C)C(=O)O Amb9326762 [0,2,0,0,0,0|1,0,1]=4 6240 B8R0.8 C=CCOC(C)C(=O)O Amb9208699 [0,2,0,0,0,0|1,0,1]=4 6241 B8R0.8 C=CCSC(C)C(=O)O Amb6273705 [0,2,0,0,0,0|1,0,1]=4 6242 B8R0.8 C=CSCC(N)C(=O)O Amb28321669 [0,2,0,0,0,0|1,0,1]=4 6243 B8R0.8 CC#CCC(C)C(=O)O Amb28281174 [0,2,0,0,0,0|1,0,1]=4 6244 B8R0.8 CC#CCC(N)C(=O)O Amb18988250 [0,2,0,0,0,0|1,0,1]=4 6245 B8R0.8 CC#CCC(N)C(=O)O Amb33551077 [0,2,0,0,0,0|1,0,1]=4 6246 B8R0.8 CC#CC[C@@H](N)C(=O)O Amb22746783 [0,2,0,0,0,0|1,0,1]=4 6247 B8R0.8 CC#CC[C@H](N)C(=O)O Amb27815040 [0,2,0,0,0,0|1,0,1]=4 6248 B8R0.8 CC(=O)C(=O)CCCBr Amb27955170 [0,2,0,0,0,0|1,0,1]=4 6249 B8R0.8 CC(=O)C(=O)CCCN Amb27666363 [0,2,0,0,0,0|0,0,1]=3 6250 B8R0.8 CC(=O)C(C)CCC#N Amb8394545 [0,2,0,0,0,0|1,0,1]=4 6251 B8R0.8 CC(=O)C(C)CCCF Amb27593343 [0,2,0,0,0,0|2,0,0]=4 6252 B8R0.8 CC(=O)C(C)CCCO Amb27628329 [0,2,0,0,0,0|2,0,0]=4 6253 B8R0.8 CC(=O)C(C)OCCN Amb18111235 [0,2,0,0,0,0|1,0,0]=3 6254 B8R0.8 CC(=O)C(Cl)CCCO Amb27860344 [0,2,0,0,0,0|2,0,0]=4 6255 B8R0.8 CC(=O)C(O)CCC=O Amb25965289 [0,2,0,0,0,0|2,0,0]=4 6256 B8R0.8 CC(=O)N(C)CCCBr Amb28189301 [0,2,0,0,0,0|2,0,0]=4 6257 B8R0.8 CC(=O)N(C)CCCN Amb32666496 [0,2,0,0,0,0|1,0,0]=3 6258 B8R0.8 CC(=O)N(C)CCCN Amb33533003 [0,2,0,0,0,0|1,0,0]=3 6259 B8R0.8 CC(=O)N(N)CCCN Amb27404575 [0,2,0,0,0,0|1,0,0]=3 6260 B8R0.8 CC(=O)[C@@H](N)CCCO Amb27835141 [0,2,0,0,0,0|2,0,0]=4 6261 B8R0.8 CC(Br)C(=O)NCCN Amb27272855 [0,2,0,0,0,0|2,0,0]=4 6262 B8R0.8 CC(C)C(=O)CCCCl Amb24340262 [0,2,0,0,0,0|2,0,0]=4 6263 B8R0.8 CC(C)C(=O)NCCN Amb19514844 [0,2,0,0,0,0|2,0,0]=4 6264 B8R0.8 CC(C)C(=O)NCCN Amb515798 [0,2,0,0,0,0|2,0,0]=4 6265 B8R0.8 CC(C)C(O)CCCN Amb18203175 [0,2,0,0,0,0|1,0,1]=4 6266 B8R0.8 CC(CCC#N)C(=O)O Amb24462559 [0,2,0,0,0,0|0,0,1]=3 6267 B8R0.8 CC(CCCCl)C(=O)O Amb2720283 [0,2,0,0,0,0|1,0,0]=3 6268 B8R0.8 CC(CCCF)C(=O)O Amb25244585 [0,2,0,0,0,0|1,0,0]=3 6269 B8R0.8 CC(CCCN)C(=O)O Amb25146072 [0,2,0,0,0,0|0,0,0]=2 6270 B8R0.8 CC(CCCN)C(=O)O Amb32686960 [0,2,0,0,0,0|0,0,0]=2 6271 B8R0.8 CC(CCCN)C(N)=O Amb27667997 [0,2,0,0,0,0|1,0,0]=3 6272 B8R0.8 CC(CN=C=O)C(=O)O Amb33471309 [0,2,0,0,0,0|1,0,1]=4 6273 B8R0.8 CC(CN=C=S)C(=O)O Amb33471538 [0,2,0,0,0,0|1,0,1]=4 6274 B8R0.8 CC(CNC#N)C(=O)O Amb35634505 [0,2,0,0,0,0|0,0,2]=4 6275 B8R0.8 CC(C\C=N\O)C(=O)O Amb27217284 [0,2,0,0,0,0|0,0,2]=4 6276 B8R0.8 CC(N)C(=O)NCCN Amb18290748 [0,2,0,0,0,0|2,0,0]=4 6277 B8R0.8 CC(N)C(=O)NCCN Amb33330598 [0,2,0,0,0,0|2,0,0]=4 6278 B8R0.8 CC(NCCF)C(N)=O Amb27453201 [0,2,0,0,0,0|2,0,0]=4 6279 B8R0.8 CC(NCCS)C(=O)O Amb28057720 [0,2,0,0,0,0|1,0,0]=3 6280 B8R0.8 CC(NCCS)C(N)=O Amb27168964 [0,2,0,0,0,0|2,0,0]=4 6281 B8R0.8 CC(O)C(=O)CCC=O Amb28430094 [0,2,0,0,0,0|1,0,1]=4 6282 B8R0.8 CC(O)C(=O)NCCO Amb2721070 [0,2,0,0,0,0|2,0,0]=4 6283 B8R0.8 CC(O)C(=O)OCCBr Amb33276524 [0,2,0,0,0,0|2,0,0]=4 6284 B8R0.8 CC(O)C(=O)OCCCl Amb26074602 [0,2,0,0,0,0|2,0,0]=4 6285 B8R0.8 CC(O)C(=O)OCCO Amb24061251 [0,2,0,0,0,0|2,0,0]=4 6286 B8R0.8 CC(O)C(C)NCCN Amb27869883 [0,2,0,0,0,0|1,0,1]=4 6287 B8R0.8 CC(O)C(C)OCCN Amb26484357 [0,2,0,0,0,0|1,0,1]=4 6288 B8R0.8 CC(O)C(C)SCCN Amb27816014 [0,2,0,0,0,0|1,0,1]=4 6289 B8R0.8 CC(OCC#N)C(=O)O Amb27465969 [0,2,0,0,0,0|0,0,2]=4 6290 B8R0.8 CC(OCCF)C(=O)O Amb27240801 [0,2,0,0,0,0|1,0,0]=3 6291 B8R0.8 CC(OCCN)C(=O)O Amb22546285 [0,2,0,0,0,0|0,0,0]=2 6292 B8R0.8 CC(OCCO)C(=O)O Amb6680915 [0,2,0,0,0,0|1,0,0]=3 6293 B8R0.8 CC(OCCS)C(=O)O Amb27857332 [0,2,0,0,0,0|1,0,0]=3 6294 B8R0.8 CC(SCC#N)C(=O)O Amb6260833 [0,2,0,0,0,0|0,0,2]=4 6295 B8R0.8 CC(SCCCl)C(=O)O Amb27404902 [0,2,0,0,0,0|1,0,0]=3 6296 B8R0.8 CC(SCCN)C(=O)O Amb17500447 [0,2,0,0,0,0|0,0,0]=2 6297 B8R0.8 CCCCC(=O)C(=O)O Amb18642761 [0,2,0,0,0,0|1,0,0]=3 6298 B8R0.8 CCCCC(=O)C(=O)[O-] Amb32664416 [0,2,0,0,0,0|1,0,1]=4 6299 B8R0.8 CCCCC(=O)C(Br)Br Amb28120327 [0,2,0,0,0,0|2,0,0]=4 6300 B8R0.8 CCCCC(=O)C(C)=O Amb2721315 [0,2,0,0,0,0|1,0,1]=4 6301 B8R0.8 CCCCC(=O)C(C)C Amb9024769 [0,2,0,0,0,0|2,0,0]=4 6302 B8R0.8 CCCCC(=O)C(C)Cl Amb17593705 [0,2,0,0,0,0|2,0,0]=4 6303 B8R0.8 CCCCC(=O)C(C)N Amb26583107 [0,2,0,0,0,0|2,0,0]=4 6304 B8R0.8 CCCCC(=O)C(Cl)Cl Amb17594228 [0,2,0,0,0,0|2,0,0]=4 6305 B8R0.8 CCCCC(=O)C(F)Cl Amb28385384 [0,2,0,0,0,0|2,0,0]=4 6306 B8R0.8 CCCCC(=O)C(F)F Amb26859892 [0,2,0,0,0,0|2,0,0]=4 6307 B8R0.8 CCCCC(=O)[C@@H](C)O Amb25829551 [0,2,0,0,0,0|1,0,0]=3 6308 B8R0.8 CCCCC(=O)[C@H](C)O Amb25097116 [0,2,0,0,0,0|1,0,0]=3 6309 B8R0.8 CCCCC(=O)[C@H](C)[NH3+] Amb22503703 [0,2,0,0,0,0|2,0,0]=4 6310 B8R0.8 CCCCC(Br)C(=O)Br Amb22347914 [0,2,0,0,0,0|2,0,0]=4 6311 B8R0.8 CCCCC(Br)C(=O)Cl Amb17569836 [0,2,0,0,0,0|2,0,0]=4 6312 B8R0.8 CCCCC(Br)C(=O)O Amb9703129 [0,2,0,0,0,0|1,0,0]=3 6313 B8R0.8 CCCCC(Br)C(N)=O Amb19514624 [0,2,0,0,0,0|2,0,0]=4 6314 B8R0.8 CCCCC(C)C(=O)O Amb3939937 [0,2,0,0,0,0|1,0,0]=3 6315 B8R0.8 CCCCC(C)C(C)=O Amb4034582 [0,2,0,0,0,0|2,0,0]=4 6316 B8R0.8 CCCCC(C)C(N)=O Amb8504697 [0,2,0,0,0,0|2,0,0]=4 6317 B8R0.8 CCCCC(Cl)C(=O)O Amb17593750 [0,2,0,0,0,0|1,0,0]=3 6318 B8R0.8 CCCCC(Cl)C(N)=O Amb27803407 [0,2,0,0,0,0|2,0,0]=4 6319 B8R0.8 CCCCC(F)C(=O)O Amb25238781 [0,2,0,0,0,0|1,0,0]=3 6320 B8R0.8 CCCCC(F)C(C)=O Amb27228475 [0,2,0,0,0,0|2,0,0]=4 6321 B8R0.8 CCCCC(F)C(N)=O Amb28060527 [0,2,0,0,0,0|2,0,0]=4 6322 B8R0.8 CCCCC(N)C(=O)O Amb4134813 [0,2,0,0,0,0|1,0,0]=3 6323 B8R0.8 CCCCC(N)C(C)=O Amb1099238 [0,2,0,0,0,0|2,0,0]=4 6324 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [0,2,0,0,0,0|2,0,0]=4 6325 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [0,2,0,0,0,0|2,0,0]=4 6326 B8R0.8 CCCCC(N)[PH](=O)O Amb27863480 [0,2,0,0,0,0|2,0,0]=4 6327 B8R0.8 CCCCC(O)C(=O)O Amb3941634 [0,2,0,0,0,0|1,0,0]=3 6328 B8R0.8 CCCCC(O)C(C)=O Amb27877068 [0,2,0,0,0,0|1,0,1]=4 6329 B8R0.8 CCCCC(O)C(N)=O Amb24116640 [0,2,0,0,0,0|1,0,1]=4 6330 B8R0.8 CCCCC(O)[PH](=O)O Amb27488929 [0,2,0,0,0,0|1,0,1]=4 6331 B8R0.8 CCCCC(S)C(=O)O Amb25323873 [0,2,0,0,0,0|1,0,0]=3 6332 B8R0.8 CCCCN(C)C(=O)Cl Amb17563097 [0,2,0,0,0,0|2,0,0]=4 6333 B8R0.8 CCCCN(C)C(N)=O Amb6245238 [0,2,0,0,0,0|2,0,0]=4 6334 B8R0.8 CCCCN(N)C(C)=O Amb33191476 [0,2,0,0,0,0|2,0,0]=4 6335 B8R0.8 CCCC[C@@H](C)C(=O)O Amb24590691 [0,2,0,0,0,0|1,0,0]=3 6336 B8R0.8 CCCC[C@@H](Cl)C(=O)O Amb27471038 [0,2,0,0,0,0|1,0,0]=3 6337 B8R0.8 CCCC[C@@H](N)C(=O)O Amb1995006 [0,2,0,0,0,0|1,0,0]=3 6338 B8R0.8 CCCC[C@H](Br)C(=O)O Amb28385588 [0,2,0,0,0,0|1,0,0]=3 6339 B8R0.8 CCCC[C@H](C)C(=O)O Amb25850678 [0,2,0,0,0,0|1,0,0]=3 6340 B8R0.8 CCCC[C@H](Cl)C(=O)Cl Amb28291526 [0,2,0,0,0,0|2,0,0]=4 6341 B8R0.8 CCCC[C@H](Cl)C(=O)O Amb27955265 [0,2,0,0,0,0|1,0,0]=3 6342 B8R0.8 CCCC[C@H](N)C(=O)O Amb1995007 [0,2,0,0,0,0|1,0,0]=3 6343 B8R0.8 CCCC[C@H](N)C(N)=O Amb9813732 [0,2,0,0,0,0|2,0,0]=4 6344 B8R0.8 CCCC[C@H](O)C(=O)O Amb27626002 [0,2,0,0,0,0|1,0,0]=3 6345 B8R0.8 CCCNC(=O)C(=O)O Amb9303791 [0,2,0,0,0,0|1,0,1]=4 6346 B8R0.8 CCCNC(=O)C(C)O Amb9421398 [0,2,0,0,0,0|2,0,0]=4 6347 B8R0.8 CCCNC(=O)N(C)O Amb27867919 [0,2,0,0,0,0|2,0,0]=4 6348 B8R0.8 CCCNC(=O)[C@@H](C)O Amb25317170 [0,2,0,0,0,0|2,0,0]=4 6349 B8R0.8 CCCNC(C)C(=O)O Amb9326994 [0,2,0,0,0,0|1,0,0]=3 6350 B8R0.8 CCCN[C@H](C)C(=O)O Amb28073462 [0,2,0,0,0,0|1,0,0]=3 6351 B8R0.8 CCCOC(=O)C(=O)O Amb28399593 [0,2,0,0,0,0|1,0,1]=4 6352 B8R0.8 CCCOC(=O)C(C)O Amb3939699 [0,2,0,0,0,0|2,0,0]=4 6353 B8R0.8 CCCOC(=O)[C@H](C)O Amb8517137 [0,2,0,0,0,0|2,0,0]=4 6354 B8R0.8 CCCOC(C)C(=O)O Amb8874518 [0,2,0,0,0,0|1,0,0]=3 6355 B8R0.8 CCCOC(C)C(N)=O Amb27424673 [0,2,0,0,0,0|2,0,0]=4 6356 B8R0.8 CCCSC(=S)C(=O)O Amb27808849 [0,2,0,0,0,0|1,0,1]=4 6357 B8R0.8 CCCSC(C)C(=O)O Amb6274283 [0,2,0,0,0,0|1,0,0]=3 6358 B8R0.8 CCCSC(C)C(N)=O Amb28070722 [0,2,0,0,0,0|2,0,0]=4 6359 B8R0.8 CCCSC(F)C(=O)O Amb27655346 [0,2,0,0,0,0|1,0,0]=3 6360 B8R0.8 CCCSC(N)C(=O)O Amb27865736 [0,2,0,0,0,0|1,0,0]=3 6361 B8R0.8 CCCSC(O)C(=O)O Amb27592135 [0,2,0,0,0,0|1,0,0]=3 6362 B8R0.8 CCC\C=C(/Br)C(=O)O Amb27816159 [0,2,0,0,0,0|1,0,1]=4 6363 B8R0.8 CCC\C=C(/C)C(=O)O Amb10844998 [0,2,0,0,0,0|1,0,1]=4 6364 B8R0.8 CCC\C=C(\F)C(=O)O Amb27448669 [0,2,0,0,0,0|1,0,1]=4 6365 B8R0.8 CCNCC(C)C(=O)O Amb13952782 [0,2,0,0,0,0|1,0,0]=3 6366 B8R0.8 CCNCC(C)C(=O)O Amb9400285 [0,2,0,0,0,0|1,0,0]=3 6367 B8R0.8 CCNCC(C)C(N)=O Amb8944545 [0,2,0,0,0,0|2,0,0]=4 6368 B8R0.8 CCNCC(O)C(N)=O Amb28049207 [0,2,0,0,0,0|2,0,0]=4 6369 B8R0.8 CCOCC(Br)C(=O)O Amb28458425 [0,2,0,0,0,0|1,0,0]=3 6370 B8R0.8 CCOCC(C)C(=O)O Amb9172215 [0,2,0,0,0,0|1,0,0]=3 6371 B8R0.8 CCOCC(C)C(N)=O Amb28067564 [0,2,0,0,0,0|2,0,0]=4 6372 B8R0.8 CCOCC(N)C(=O)O Amb28048685 [0,2,0,0,0,0|1,0,0]=3 6373 B8R0.8 CCOCC(N)C(=O)O Amb33542705 [0,2,0,0,0,0|1,0,0]=3 6374 B8R0.8 CCOCC(N)C(N)=O Amb26973746 [0,2,0,0,0,0|2,0,0]=4 6375 B8R0.8 CCOC[C@@H](C)C(=O)O Amb25790635 [0,2,0,0,0,0|1,0,0]=3 6376 B8R0.8 CCOC[C@@H](N)C(=O)O Amb25889733 [0,2,0,0,0,0|1,0,0]=3 6377 B8R0.8 CCOC[C@@H](N)C(=O)O Amb30585227 [0,2,0,0,0,0|1,0,0]=3 6378 B8R0.8 CCOC[C@@H](O)C(=O)O Amb33347463 [0,2,0,0,0,0|1,0,0]=3 6379 B8R0.8 CCOC[C@H](C)C(=O)O Amb10844265 [0,2,0,0,0,0|1,0,0]=3 6380 B8R0.8 CCOC[C@H](N)C(=O)O Amb22737184 [0,2,0,0,0,0|1,0,0]=3 6381 B8R0.8 CCOC[C@H](N)C(=O)O Amb24478577 [0,2,0,0,0,0|1,0,0]=3 6382 B8R0.8 CCSCC(C)C(=O)O Amb9400067 [0,2,0,0,0,0|1,0,0]=3 6383 B8R0.8 CCSCC(C)C(C)=O Amb27409600 [0,2,0,0,0,0|2,0,0]=4 6384 B8R0.8 CCSCC(N)C(=O)O Amb6257004 [0,2,0,0,0,0|1,0,0]=3 6385 B8R0.8 CCSCC(O)C(=O)O Amb27231753 [0,2,0,0,0,0|1,0,0]=3 6386 B8R0.8 CCSC[C@H](O)C(=O)O Amb27983830 [0,2,0,0,0,0|1,0,0]=3 6387 B8R0.8 CC\C=C\C(C)C(=O)O Amb33172515 [0,2,0,0,0,0|1,0,1]=4 6388 B8R0.8 CC\C=C\C(N)C(=O)O Amb33449874 [0,2,0,0,0,0|1,0,1]=4 6389 B8R0.8 CC\C=C\C(O)C(=O)O Amb27781864 [0,2,0,0,0,0|1,0,1]=4 6390 B8R0.8 CC\C=C\[C@@H](N)C(=O)O Amb27239476 [0,2,0,0,0,0|1,0,1]=4 6391 B8R0.8 CN(C)C(=O)CCCCl Amb1128819 [0,2,0,0,0,0|2,0,0]=4 6392 B8R0.8 CN(C)C(=O)CCCN Amb10610208 [0,2,0,0,0,0|1,0,0]=3 6393 B8R0.8 CN(C)C(=O)CCCN Amb10610229 [0,2,0,0,0,0|1,0,0]=3 6394 B8R0.8 CN(C)C(=O)CCCN Amb6276022 [0,2,0,0,0,0|1,0,0]=3 6395 B8R0.8 CN(C)C(=O)CCCO Amb17231873 [0,2,0,0,0,0|2,0,0]=4 6396 B8R0.8 CN(C)C(=O)CCNN Amb18642845 [0,2,0,0,0,0|2,0,0]=4 6397 B8R0.8 CN(C)C(=O)CCNN Amb32412172 [0,2,0,0,0,0|2,0,0]=4 6398 B8R0.8 CN(C)C(=O)NCCN Amb33532822 [0,2,0,0,0,0|2,0,0]=4 6399 B8R0.8 CN(C)C(=O)OCCN Amb25244890 [0,2,0,0,0,0|2,0,0]=4 6400 B8R0.8 CN(C)C(=O)OCCN Amb28555366 [0,2,0,0,0,0|2,0,0]=4 6401 B8R0.8 CN(CCCBr)C(=O)Cl Amb33296940 [0,2,0,0,0,0|2,0,0]=4 6402 B8R0.8 CN(CCCCl)C(=O)Cl Amb32668823 [0,2,0,0,0,0|2,0,0]=4 6403 B8R0.8 CNCCC(C)C(N)=O Amb28368198 [0,2,0,0,0,0|1,0,0]=3 6404 B8R0.8 CNCCN(C)C(=O)S Amb27473520 [0,2,0,0,0,0|1,1,0]=4 6405 B8R0.8 CNCCN(C)C(C)=O Amb20669225 [0,2,0,0,0,0|2,0,0]=4 6406 B8R0.8 CNCCN(C)C(N)=O Amb27765294 [0,2,0,0,0,0|2,0,0]=4 6407 B8R0.8 CNCCN(C)C(N)=O Amb32674843 [0,2,0,0,0,0|2,0,0]=4 6408 B8R0.8 COCCC(=O)C(=O)O Amb27959741 [0,2,0,0,0,0|1,0,1]=4 6409 B8R0.8 COCCC(Br)C(=O)Cl Amb27209614 [0,2,0,0,0,0|2,0,0]=4 6410 B8R0.8 COCCC(C)C(=O)O Amb18523823 [0,2,0,0,0,0|1,0,0]=3 6411 B8R0.8 COCCC(Cl)C(=O)Cl Amb28118917 [0,2,0,0,0,0|2,0,0]=4 6412 B8R0.8 COCCC(Cl)C(=O)O Amb27424361 [0,2,0,0,0,0|1,0,0]=3 6413 B8R0.8 COCCC(N)C(=O)O Amb32675454 [0,2,0,0,0,0|1,0,0]=3 6414 B8R0.8 COCCC(N)C(=O)O Amb6281324 [0,2,0,0,0,0|1,0,0]=3 6415 B8R0.8 COCCC(N)C(N)=O Amb18311365 [0,2,0,0,0,0|2,0,0]=4 6416 B8R0.8 COCCC(N)C(N)=O Amb32712112 [0,2,0,0,0,0|2,0,0]=4 6417 B8R0.8 COCCC(O)C(=O)O Amb27647966 [0,2,0,0,0,0|1,0,0]=3 6418 B8R0.8 COCCN(C)C(=O)O Amb32677018 [0,2,0,0,0,0|2,0,0]=4 6419 B8R0.8 COCC[C@@H](N)C(=O)O Amb16183870 [0,2,0,0,0,0|1,0,0]=3 6420 B8R0.8 COCC[C@H](N)C(=O)O Amb16183872 [0,2,0,0,0,0|1,0,0]=3 6421 B8R0.8 COCC[C@H](N)C(=O)O Amb24054991 [0,2,0,0,0,0|1,0,0]=3 6422 B8R0.8 COCOC(C)C(=O)O Amb28120688 [0,2,0,0,0,0|2,0,0]=4 6423 B8R0.8 COCSC(C)C(=O)O Amb28410278 [0,2,0,0,0,0|2,0,0]=4 6424 B8R0.8 CPOC[C@H](N)C(=O)O Amb27424475 [0,2,0,0,0,0|1,1,0]=4 6425 B8R0.8 CSCCC(=N)C(=O)O Amb27196552 [0,2,0,0,0,0|1,0,1]=4 6426 B8R0.8 CSCCC(=O)C(=O)O Amb18643588 [0,2,0,0,0,0|1,0,1]=4 6427 B8R0.8 CSCCC(C)C(=O)O Amb24739356 [0,2,0,0,0,0|1,0,0]=3 6428 B8R0.8 CSCCC(Cl)C(=O)O Amb27468599 [0,2,0,0,0,0|1,0,0]=3 6429 B8R0.8 CSCCC(Cl)C(N)=O Amb18185555 [0,2,0,0,0,0|2,0,0]=4 6430 B8R0.8 CSCCC(N)C(=O)O Amb9703095 [0,2,0,0,0,0|1,0,0]=3 6431 B8R0.8 CSCCC(N)C(C)=O Amb28388741 [0,2,0,0,0,0|2,0,0]=4 6432 B8R0.8 CSCCC(N)C(N)=O Amb17142872 [0,2,0,0,0,0|2,0,0]=4 6433 B8R0.8 CSCCC(N)C(N)=O Amb32752921 [0,2,0,0,0,0|2,0,0]=4 6434 B8R0.8 CSCCC(O)C(=O)O Amb18304609 [0,2,0,0,0,0|1,0,0]=3 6435 B8R0.8 CSCCC(O)C(=O)[O-] Amb8393072 [0,2,0,0,0,0|1,0,1]=4 6436 B8R0.8 CSCCC(O)C(N)=O Amb20669403 [0,2,0,0,0,0|2,0,0]=4 6437 B8R0.8 CSCC[C@@H](N)C(=O)O Amb2720567 [0,2,0,0,0,0|1,0,0]=3 6438 B8R0.8 CSCC[C@@H](N)C(=O)[O-] Amb32414686 [0,2,0,0,0,0|1,0,1]=4 6439 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [0,2,0,0,0,0|2,0,0]=4 6440 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [0,2,0,0,0,0|2,0,0]=4 6441 B8R0.8 CSCC[C@@H](O)C(=O)O Amb25124092 [0,2,0,0,0,0|1,0,0]=3 6442 B8R0.8 CSCC[C@H](Cl)C(=O)O Amb28286496 [0,2,0,0,0,0|1,0,0]=3 6443 B8R0.8 CSCC[C@H](N)C(=O)O Amb5720611 [0,2,0,0,0,0|1,0,0]=3 6444 B8R0.8 CSCC[C@H](N)C(C)=O Amb27763449 [0,2,0,0,0,0|2,0,0]=4 6445 B8R0.8 CSCC[C@H](N)C(N)=O Amb8390412 [0,2,0,0,0,0|2,0,0]=4 6446 B8R0.8 CSCC[C@H](N)C(N)=O Amb9813735 [0,2,0,0,0,0|2,0,0]=4 6447 B8R0.8 CSCC[C@H](O)C(=O)O Amb28285270 [0,2,0,0,0,0|1,0,0]=3 6448 B8R0.8 CSCOC(N)C(=O)O Amb27634144 [0,2,0,0,0,0|2,0,0]=4 6449 B8R0.8 CSCO[C@H](N)C(=O)O Amb28183053 [0,2,0,0,0,0|2,0,0]=4 6450 B8R0.8 CSOCC(N)C(=O)O Amb28285144 [0,2,0,0,0,0|2,0,0]=4 6451 B8R0.8 CSSCC(C)C(=O)O Amb27240302 [0,2,0,0,0,0|2,0,0]=4 6452 B8R0.8 CSSC[C@@H](N)C(=O)O Amb28381312 [0,2,0,0,0,0|2,0,0]=4 6453 B8R0.8 CSSC[C@H](N)C(=O)O Amb28118786 [0,2,0,0,0,0|2,0,0]=4 6454 B8R0.8 C[C@@H](CCC#N)C(=O)O Amb27870712 [0,2,0,0,0,0|0,0,1]=3 6455 B8R0.8 C[C@@H](CCCN)C(=O)O Amb28314637 [0,2,0,0,0,0|0,0,0]=2 6456 B8R0.8 C[C@@H](CN=[N+]=[N-])C(=O)O Amb27955982 [0,2,0,0,0,0|1,0,1]=4 6457 B8R0.8 C[C@@H](NCCF)C(=O)O Amb28073998 [0,2,0,0,0,0|1,0,0]=3 6458 B8R0.8 C[C@@H](NCCO)C(=O)O Amb26885478 [0,2,0,0,0,0|1,0,0]=3 6459 B8R0.8 C[C@@H](O)C(=O)NCCF Amb27485671 [0,2,0,0,0,0|2,0,0]=4 6460 B8R0.8 C[C@@H](O)C(=O)OCCBr Amb33051943 [0,2,0,0,0,0|2,0,0]=4 6461 B8R0.8 C[C@@H](OCCF)C(=O)O Amb27763930 [0,2,0,0,0,0|1,0,0]=3 6462 B8R0.8 C[C@@H](OCCO)C(=O)O Amb28318043 [0,2,0,0,0,0|1,0,0]=3 6463 B8R0.8 C[C@@H](SCCN)C(=O)O Amb27170977 [0,2,0,0,0,0|0,0,0]=2 6464 B8R0.8 C[C@H](N)C(=O)NCCN Amb27837481 [0,2,0,0,0,0|2,0,0]=4 6465 B8R0.8 C[C@H](NCC#N)C(=O)O Amb28079480 [0,2,0,0,0,0|0,0,2]=4 6466 B8R0.8 C[C@H](NCCN)[C@@H](C)O Amb27216624 [0,2,0,0,0,0|1,0,1]=4 6467 B8R0.8 C[C@H](NCCO)C(=O)O Amb28058421 [0,2,0,0,0,0|1,0,0]=3 6468 B8R0.8 C[C@H](O)C(=O)NCCN Amb27838528 [0,2,0,0,0,0|1,0,0]=3 6469 B8R0.8 C[C@H](O)C(=O)OCCBr Amb33051905 [0,2,0,0,0,0|2,0,0]=4 6470 B8R0.8 C[C@H](O)C(=O)OCCO Amb28325065 [0,2,0,0,0,0|2,0,0]=4 6471 B8R0.8 C[C@H](OCCN)C(=O)O Amb27479935 [0,2,0,0,0,0|0,0,0]=2 6472 B8R0.8 C[C@H](OCCO)C(=O)O Amb27398048 [0,2,0,0,0,0|1,0,0]=3 6473 B8R0.8 C[Se]CCC(N)C(=O)O Amb8514803 [0,2,0,0,0,0|1,0,0]=3 6474 B8R0.8 C[Se]CC[C@@H](N)C(=O)O Amb31031165 [0,2,0,0,0,0|1,0,0]=3 6475 B8R0.8 C[Se]CC[C@H](N)C(=O)O Amb8514895 [0,2,0,0,0,0|1,0,0]=3 6476 B8R0.8 C\C(=C/CCN)C(=O)O Amb28397850 [0,2,0,0,0,0|0,0,1]=3 6477 B8R0.8 C\C(=C/CON)C(=O)O Amb28207816 [0,2,0,0,0,0|0,0,2]=4 6478 B8R0.8 C\C=C\CC(C)C(=O)O Amb18642630 [0,2,0,0,0,0|1,0,1]=4 6479 B8R0.8 C\C=C\CC(F)C(=O)O Amb27959670 [0,2,0,0,0,0|1,0,1]=4 6480 B8R0.8 C\C=C\CC(N)C(=O)O Amb6256663 [0,2,0,0,0,0|1,0,1]=4 6481 B8R0.8 C\C=C\C[C@@H](N)C(=O)O Amb33065673 [0,2,0,0,0,0|1,0,1]=4 6482 B8R0.8 C\C=C\C[C@H](C)C(=O)O Amb28368854 [0,2,0,0,0,0|1,0,1]=4 6483 B8R0.8 C\C=C\C[C@H](N)C(=O)O Amb27768785 [0,2,0,0,0,0|1,0,1]=4 6484 B8R0.8 N#CCCC(Br)C(=O)O Amb27863558 [0,2,0,0,0,0|0,0,1]=3 6485 B8R0.8 N#CCCC(N)C(=O)O Amb18642589 [0,2,0,0,0,0|0,0,1]=3 6486 B8R0.8 N#CCCC(N)C(N)=O Amb26567424 [0,2,0,0,0,0|1,0,1]=4 6487 B8R0.8 N#CCCC(O)C(=O)O Amb28239951 [0,2,0,0,0,0|0,0,1]=3 6488 B8R0.8 N#CCCC([AlH5])C(=O)O Amb31132465 [0,2,0,0,0,0|0,0,1]=3 6489 B8R0.8 N#CCC[C@@H](N)C(=O)O Amb25063958 [0,2,0,0,0,0|0,0,1]=3 6490 B8R0.8 N#CCC[C@H](N)C(=O)O Amb16183912 [0,2,0,0,0,0|0,0,1]=3 6491 B8R0.8 N#CCC[C@H](O)C(=O)O Amb28144260 [0,2,0,0,0,0|0,0,1]=3 6492 B8R0.8 N#CNCC(O)C(=O)O Amb35634509 [0,2,0,0,0,0|0,0,2]=4 6493 B8R0.8 N#CNC[C@H](O)C(=O)O Amb35634507 [0,2,0,0,0,0|0,0,2]=4 6494 B8R0.8 N#CSCC(N)C(=O)O Amb17593655 [0,2,0,0,0,0|0,0,2]=4 6495 B8R0.8 N=C(NCCO)C(=O)O Amb18124348 [0,2,0,0,0,0|1,0,1]=4 6496 B8R0.8 NC(=O)C(=O)CCCCl Amb27450674 [0,2,0,0,0,0|1,0,1]=4 6497 B8R0.8 NC(=O)C(N)CCCF Amb27424739 [0,2,0,0,0,0|2,0,0]=4 6498 B8R0.8 NC(=O)C(N)CCCO Amb33066182 [0,2,0,0,0,0|2,0,0]=4 6499 B8R0.8 NC(CCCBr)C(=O)O Amb24480263 [0,2,0,0,0,0|1,0,0]=3 6500 B8R0.8 NC(CCCF)C(=O)O Amb25366994 [0,2,0,0,0,0|1,0,0]=3 6501 B8R0.8 NC(CCCO)C(=O)O Amb18642915 [0,2,0,0,0,0|1,0,0]=3 6502 B8R0.8 NC(CCCO)C(=O)O Amb22900028 [0,2,0,0,0,0|1,0,0]=3 6503 B8R0.8 NC(CCCS)C(=O)O Amb27947968 [0,2,0,0,0,0|1,0,0]=3 6504 B8R0.8 NC(CCNO)C(=O)O Amb28285114 [0,2,0,0,0,0|0,0,0]=2 6505 B8R0.8 NC(CN=C=S)C(=O)O Amb28281778 [0,2,0,0,0,0|1,0,1]=4 6506 B8R0.8 NC(C\C=C\Br)C(=O)O Amb27607572 [0,2,0,0,0,0|1,0,1]=4 6507 B8R0.8 NC(C\C=C\Cl)C(=O)O Amb33037023 [0,2,0,0,0,0|1,0,1]=4 6508 B8R0.8 NCCCC(Br)C(=O)O Amb17595166 [0,2,0,0,0,0|0,0,0]=2 6509 B8R0.8 NCCCC(F)C(=O)O Amb27235092 [0,2,0,0,0,0|0,0,0]=2 6510 B8R0.8 NCCCC(N)C(=O)O Amb22489477 [0,2,0,0,0,0|0,0,0]=2 6511 B8R0.8 NCCCC(N)C(=O)O Amb4006442 [0,2,0,0,0,0|0,0,0]=2 6512 B8R0.8 NCCCC(N)C(=O)O Amb9173756 [0,2,0,0,0,0|0,0,0]=2 6513 B8R0.8 NCCCC(N)C(=S)S Amb27657930 [0,2,0,0,0,0|0,2,0]=4 6514 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [0,2,0,0,0,0|1,0,0]=3 6515 B8R0.8 NCCCC(N)[PH](=O)O Amb27645413 [0,2,0,0,0,0|1,0,0]=3 6516 B8R0.8 NCCC[C@@H](N)C(=O)O Amb32411789 [0,2,0,0,0,0|0,0,0]=2 6517 B8R0.8 NCCC[C@@H](N)C(=O)O Amb6600152 [0,2,0,0,0,0|0,0,0]=2 6518 B8R0.8 NCCC[C@@H](N)C(=O)O Amb8390415 [0,2,0,0,0,0|0,0,0]=2 6519 B8R0.8 NCCC[C@H](N)C(=O)O Amb20240598 [0,2,0,0,0,0|0,0,0]=2 6520 B8R0.8 NCCC[C@H](N)C(=O)O Amb22746434 [0,2,0,0,0,0|0,0,0]=2 6521 B8R0.8 NCCC[C@H](N)C(=O)O Amb8513279 [0,2,0,0,0,0|0,0,0]=2 6522 B8R0.8 NCCC[C@H](N)C(=O)O Amb8627869 [0,2,0,0,0,0|0,0,0]=2 6523 B8R0.8 NCCC[C@H](O)C(=O)O Amb27804309 [0,2,0,0,0,0|0,0,0]=2 6524 B8R0.8 NCCNC(=O)C(F)F Amb28400156 [0,2,0,0,0,0|2,0,0]=4 6525 B8R0.8 NCCNC(=O)C(N)=O Amb21953023 [0,2,0,0,0,0|1,0,1]=4 6526 B8R0.8 NCC\C=C(\F)C(=O)O Amb27398392 [0,2,0,0,0,0|0,0,1]=3 6527 B8R0.8 NCOCC(N)C(=O)O Amb27429950 [0,2,0,0,0,0|0,0,0]=2 6528 B8R0.8 NCOC[C@@H](N)C(=O)O Amb27233969 [0,2,0,0,0,0|0,0,0]=2 6529 B8R0.8 NC\C=C\[C@H](N)C(=O)O Amb24580033 [0,2,0,0,0,0|0,0,1]=3 6530 B8R0.8 NOCCC(N)C(=O)O Amb17593409 [0,2,0,0,0,0|0,0,0]=2 6531 B8R0.8 NOCCC(N)C(=O)O Amb21858490 [0,2,0,0,0,0|0,0,0]=2 6532 B8R0.8 NOCC[C@H](N)C(=O)O Amb26346874 [0,2,0,0,0,0|0,0,0]=2 6533 B8R0.8 NOCC[C@H](N)C(=O)O Amb33038084 [0,2,0,0,0,0|0,0,0]=2 6534 B8R0.8 N[C@@H](CCCCl)C(=O)O Amb27227989 [0,2,0,0,0,0|1,0,0]=3 6535 B8R0.8 N[C@@H](CCCF)C(=O)O Amb27223043 [0,2,0,0,0,0|1,0,0]=3 6536 B8R0.8 N[C@@H](CCCO)C(=O)O Amb16183887 [0,2,0,0,0,0|1,0,0]=3 6537 B8R0.8 N[C@@H](CCNO)C(=O)O Amb24117852 [0,2,0,0,0,0|0,0,0]=2 6538 B8R0.8 N[C@@H](CSCO)C(=O)O Amb27470985 [0,2,0,0,0,0|1,0,0]=3 6539 B8R0.8 N[C@@H](CSN=O)C(=O)O Amb28182982 [0,2,0,0,0,0|1,0,1]=4 6540 B8R0.8 N[C@@H](C\C=C\Cl)C(=O)O Amb33065741 [0,2,0,0,0,0|1,0,1]=4 6541 B8R0.8 N[C@H](CCCBr)C(=O)O Amb26080278 [0,2,0,0,0,0|1,0,0]=3 6542 B8R0.8 N[C@H](CCCF)C(=O)O Amb26908418 [0,2,0,0,0,0|1,0,0]=3 6543 B8R0.8 N[C@H](CCCO)C(=O)O Amb28120579 [0,2,0,0,0,0|1,0,0]=3 6544 B8R0.8 N[C@H](CCCO)C(=O)O Amb34913429 [0,2,0,0,0,0|1,0,0]=3 6545 B8R0.8 N[C@H](CSN=O)C(=O)O Amb27845439 [0,2,0,0,0,0|1,0,1]=4 6546 B8R0.8 N[C@H](C\C=C\Cl)C(=O)O Amb33309034 [0,2,0,0,0,0|1,0,1]=4 6547 B8R0.8 O=C(Cl)C(=O)CCCBr Amb28313649 [0,2,0,0,0,0|1,0,1]=4 6548 B8R0.8 O=C(O)C(=O)CCCF Amb33196459 [0,2,0,0,0,0|1,0,0]=3 6549 B8R0.8 O=C(O)C(=O)CCCO Amb27470301 [0,2,0,0,0,0|1,0,0]=3 6550 B8R0.8 O=C(O)C(=O)CCCO Amb30666618 [0,2,0,0,0,0|1,0,0]=3 6551 B8R0.8 O=C(O)C(=O)CSCCl Amb33069677 [0,2,0,0,0,0|1,0,1]=4 6552 B8R0.8 O=C(O)C(Br)CCCCl Amb17595866 [0,2,0,0,0,0|1,0,0]=3 6553 B8R0.8 O=C(O)C(Br)CCCO Amb28313364 [0,2,0,0,0,0|1,0,0]=3 6554 B8R0.8 O=C(O)C(O)CC#CBr Amb27634839 [0,2,0,0,0,0|1,0,1]=4 6555 B8R0.8 O=C(O)C(O)CCCF Amb33196454 [0,2,0,0,0,0|1,0,0]=3 6556 B8R0.8 O=C(O)C(O)CCCO Amb18642939 [0,2,0,0,0,0|1,0,0]=3 6557 B8R0.8 O=C(O)[C@H](F)CN=C=S Amb33471626 [0,2,0,0,0,0|1,0,1]=4 6558 B8R0.8 O=C(OCCBr)C(O)O Amb33276619 [0,2,0,0,0,0|2,0,0]=4 6559 B8R0.8 O=C([O-])C(O)CCCO Amb28935028 [0,2,0,0,0,0|1,0,1]=4 6560 B8R0.8 O=C=NC[C@@H](F)C(=O)O Amb33037069 [0,2,0,0,0,0|1,0,1]=4 6561 B8R0.8 O=CCCC(=O)C(=O)O Amb27882544 [0,2,0,0,0,0|1,0,1]=4 6562 B8R0.8 O=CCCC(=O)C(=O)O Amb32670694 [0,2,0,0,0,0|1,0,1]=4 6563 B8R0.8 O=CNC[C@@H](O)C(=O)O Amb27637039 [0,2,0,0,0,0|1,0,1]=4 6564 B8R0.8 O=COCC(Cl)C(=O)O Amb27477082 [0,2,0,0,0,0|1,0,1]=4 6565 B8R0.8 [N-]=[N+]=NCC(N)C(=O)O Amb28342834 [0,2,0,0,0,0|1,0,1]=4 6566 B8R0.8 [N-]=[N+]=NCC(N)C(=O)O Amb35752605 [0,2,0,0,0,0|1,0,1]=4 6567 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O Amb26007532 [0,2,0,0,0,0|1,0,1]=4 6568 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O Amb33734276 [0,2,0,0,0,0|1,0,1]=4 6569 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O Amb25072668 [0,2,0,0,0,0|1,0,1]=4 6570 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O Amb30586485 [0,2,0,0,0,0|1,0,1]=4 6571 B8R0.9 C#CC(=C)CCC(=O)O Amb27655639 [0,2,0,0,0,0|1,0,1]=4 6572 B8R0.9 C#CC(=O)NCC(C)N Amb27406534 [0,2,0,0,0,0|2,0,0]=4 6573 B8R0.9 C#CC(C)CCC(N)=O Amb27602261 [0,2,0,0,0,0|2,0,0]=4 6574 B8R0.9 C#CC(C)NCC(=O)O Amb27207997 [0,2,0,0,0,0|1,0,1]=4 6575 B8R0.9 C#CC(C)SCC(=O)O Amb27168265 [0,2,0,0,0,0|1,0,1]=4 6576 B8R0.9 C#CC(F)CCC(=O)O Amb28041990 [0,2,0,0,0,0|1,0,0]=3 6577 B8R0.9 C#CC(N)CCC(=O)O Amb22352566 [0,2,0,0,0,0|0,0,0]=2 6578 B8R0.9 C#CC(O)CCC(C)N Amb35740609 [0,2,0,0,0,0|1,0,1]=4 6579 B8R0.9 C=C(C)CCC(=O)CN Amb27809573 [0,2,0,0,0,0|2,0,0]=4 6580 B8R0.9 C=C(C)CCC(C)CN Amb27180681 [0,2,0,0,0,0|2,0,0]=4 6581 B8R0.9 C=C(C)CCC(C)NC Amb27452757 [0,2,0,0,0,0|2,0,0]=4 6582 B8R0.9 C=C(C)CCC(N)CC Amb27395082 [0,2,0,0,0,0|2,0,0]=4 6583 B8R0.9 C=C(C)CCC(N)CN Amb27422880 [0,2,0,0,0,0|2,0,0]=4 6584 B8R0.9 C=C(C)CNC(C)CN Amb27166201 [0,2,0,0,0,0|2,0,0]=4 6585 B8R0.9 C=C(C)COC(C)CN Amb18630505 [0,2,0,0,0,0|2,0,0]=4 6586 B8R0.9 C=C(C=O)CCC(=O)O Amb27655564 [0,2,0,0,0,0|1,0,1]=4 6587 B8R0.9 C=CC(=C)CCC(=O)O Amb18642412 [0,2,0,0,0,0|1,0,1]=4 6588 B8R0.9 C=CC(=O)CCC(C)C Amb25341966 [0,2,0,0,0,0|2,0,0]=4 6589 B8R0.9 C=CC(=O)NCC(C)N Amb27837537 [0,2,0,0,0,0|2,0,0]=4 6590 B8R0.9 C=CC(C)CCC(C)=O Amb26390728 [0,2,0,0,0,0|2,0,0]=4 6591 B8R0.9 C=CC(C)OCC(=O)O Amb18642764 [0,2,0,0,0,0|1,0,1]=4 6592 B8R0.9 C=CC(N)CCC(=O)O Amb10843623 [0,2,0,0,0,0|0,0,0]=2 6593 B8R0.9 C=CC(N)CCC(=O)O Amb22056347 [0,2,0,0,0,0|0,0,0]=2 6594 B8R0.9 C=CC(O)CCC(=O)O Amb25785193 [0,2,0,0,0,0|1,0,0]=3 6595 B8R0.9 C=CC([NH3+])CCC(=O)O Amb10845648 [0,2,0,0,0,0|0,0,1]=3 6596 B8R0.9 C=C[C@H](N)CCC(=O)O Amb25694354 [0,2,0,0,0,0|0,0,0]=2 6597 B8R0.9 C=C[C@H](O)CCC(=O)O Amb27168215 [0,2,0,0,0,0|1,0,0]=3 6598 B8R0.9 CC(=O)CCC(=O)NN Amb25793418 [0,2,0,0,0,0|1,0,1]=4 6599 B8R0.9 CC(=O)CCC(=O)NO Amb26971070 [0,2,0,0,0,0|1,0,1]=4 6600 B8R0.9 CC(=O)CCC(C)C=O Amb18642612 [0,2,0,0,0,0|2,0,0]=4 6601 B8R0.9 CC(=O)CCC(C)CO Amb27838673 [0,2,0,0,0,0|2,0,0]=4 6602 B8R0.9 CC(=O)CCC(Cl)CCl Amb27259129 [0,2,0,0,0,0|2,0,0]=4 6603 B8R0.9 CC(=O)CCC(F)CCl Amb28060125 [0,2,0,0,0,0|2,0,0]=4 6604 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,2,0,0,0,0|2,0,0]=4 6605 B8R0.9 CC(=O)CCC(O)CF Amb28322193 [0,2,0,0,0,0|2,0,0]=4 6606 B8R0.9 CC(=O)CNC(=O)CN Amb25837037 [0,2,0,0,0,0|1,0,1]=4 6607 B8R0.9 CC(=O)CNC(C)CO Amb27614242 [0,2,0,0,0,0|2,0,0]=4 6608 B8R0.9 CC(=O)COC(=O)CN Amb27168864 [0,2,0,0,0,0|1,0,1]=4 6609 B8R0.9 CC(=O)COC(C)CN Amb18110559 [0,2,0,0,0,0|1,0,0]=3 6610 B8R0.9 CC(=O)NCC(=O)CN Amb35789045 [0,2,0,0,0,0|1,0,1]=4 6611 B8R0.9 CC(=O)NCC(=O)CN Amb35789904 [0,2,0,0,0,0|1,0,1]=4 6612 B8R0.9 CC(=O)NCC(C)CN Amb18300590 [0,2,0,0,0,0|1,0,0]=3 6613 B8R0.9 CC(=O)NCC(C)ON Amb17138377 [0,2,0,0,0,0|2,0,0]=4 6614 B8R0.9 CC(=O)NCC(N)NO Amb27413098 [0,2,0,0,0,0|2,0,0]=4 6615 B8R0.9 CC(=O)NC[C@@H](O)CO Amb27156658 [0,2,0,0,0,0|2,0,0]=4 6616 B8R0.9 CC(=O)NC[C@H](O)CCl Amb25760218 [0,2,0,0,0,0|2,0,0]=4 6617 B8R0.9 CC(=O)OCC(C)CBr Amb22386917 [0,2,0,0,0,0|2,0,0]=4 6618 B8R0.9 CC(=O)OCC(F)CO Amb27443281 [0,2,0,0,0,0|2,0,0]=4 6619 B8R0.9 CC(=O)OCC(N)CO Amb33140919 [0,2,0,0,0,0|2,0,0]=4 6620 B8R0.9 CC(=O)OCC(O)CCl Amb17593815 [0,2,0,0,0,0|2,0,0]=4 6621 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,2,0,0,0,0|2,0,0]=4 6622 B8R0.9 CC(=O)OCC(S)CCl Amb28056223 [0,2,0,0,0,0|2,0,0]=4 6623 B8R0.9 CC(=O)OC[C@@H](O)CCl Amb27469927 [0,2,0,0,0,0|2,0,0]=4 6624 B8R0.9 CC(=O)OC[C@H](C)CBr Amb28385279 [0,2,0,0,0,0|2,0,0]=4 6625 B8R0.9 CC(=O)SCC(C)CCl Amb4605870 [0,2,0,0,0,0|2,0,0]=4 6626 B8R0.9 CC(=O)SC[C@H](O)CO Amb27261704 [0,2,0,0,0,0|2,0,0]=4 6627 B8R0.9 CC(C#CC(=O)O)CN Amb33168959 [0,2,0,0,0,0|0,0,1]=3 6628 B8R0.9 CC(C#N)NCC(=O)O Amb18293465 [0,2,0,0,0,0|0,0,2]=4 6629 B8R0.9 CC(C)CCC(=O)CCl Amb20668816 [0,2,0,0,0,0|2,0,0]=4 6630 B8R0.9 CC(C)CCC(=O)CN Amb27599814 [0,2,0,0,0,0|2,0,0]=4 6631 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,2,0,0,0,0|1,0,0]=3 6632 B8R0.9 CC(C)CCC(=O)NN Amb6744504 [0,2,0,0,0,0|2,0,0]=4 6633 B8R0.9 CC(C)CCC(=O)NO Amb6744847 [0,2,0,0,0,0|1,0,0]=3 6634 B8R0.9 CC(C)CC\C(Cl)=N\O Amb28366200 [0,2,0,0,0,0|2,0,0]=4 6635 B8R0.9 CC(C)CC\C(N)=N\O Amb10205331 [0,2,0,0,0,0|2,0,0]=4 6636 B8R0.9 CC(C)CNC(=O)CO Amb9421416 [0,2,0,0,0,0|2,0,0]=4 6637 B8R0.9 CC(C)COC(=O)CO Amb27218940 [0,2,0,0,0,0|2,0,0]=4 6638 B8R0.9 CC(CBr)COC(N)=O Amb27879004 [0,2,0,0,0,0|2,0,0]=4 6639 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [0,2,0,0,0,0|0,0,0]=2 6640 B8R0.9 CC(CCl)CCC(=O)Cl Amb25921088 [0,2,0,0,0,0|2,0,0]=4 6641 B8R0.9 CC(CCl)CCC(=O)O Amb27838484 [0,2,0,0,0,0|1,0,0]=3 6642 B8R0.9 CC(CN)CCC(=O)O Amb22059189 [0,2,0,0,0,0|0,0,0]=2 6643 B8R0.9 CC(CN)CCC(=O)O Amb28935016 [0,2,0,0,0,0|0,0,0]=2 6644 B8R0.9 CC(CN)CCS(C)=O Amb28430263 [0,2,0,0,0,0|2,0,0]=4 6645 B8R0.9 CC(CN)CC[N+](=O)[O-] Amb33746654 [0,2,0,0,0,0|1,0,1]=4 6646 B8R0.9 CC(CN)CNC(N)=O Amb18994081 [0,2,0,0,0,0|1,0,0]=3 6647 B8R0.9 CC(CN)NC[C@@H](C)O Amb27768689 [0,2,0,0,0,0|1,0,1]=4 6648 B8R0.9 CC(CN)OCC(=O)O Amb18629591 [0,2,0,0,0,0|0,0,0]=2 6649 B8R0.9 CC(CN)SCC(=O)O Amb28142553 [0,2,0,0,0,0|0,0,0]=2 6650 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,2,0,0,0,0|2,0,0]=4 6651 B8R0.9 CC(CO)SCC(N)=O Amb27969999 [0,2,0,0,0,0|2,0,0]=4 6652 B8R0.9 CC(N)CCC(=O)NN Amb27945385 [0,2,0,0,0,0|1,0,0]=3 6653 B8R0.9 CC(N)CCC(=O)NO Amb27606094 [0,2,0,0,0,0|0,0,0]=2 6654 B8R0.9 CC(N)CC\C(N)=N\O Amb30008328 [0,2,0,0,0,0|1,0,0]=3 6655 B8R0.9 CC(O)CCC(=O)NN Amb19748590 [0,2,0,0,0,0|2,0,0]=4 6656 B8R0.9 CC(O)CC\C(N)=N\O Amb29852670 [0,2,0,0,0,0|2,0,0]=4 6657 B8R0.9 CC(\C=C\C(=O)O)CN Amb27234754 [0,2,0,0,0,0|0,0,1]=3 6658 B8R0.9 CCC(=N)SCC(=O)O Amb27412807 [0,2,0,0,0,0|1,0,1]=4 6659 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,2,0,0,0,0|1,0,0]=3 6660 B8R0.9 CCC(=O)CCC(C)=O Amb17593347 [0,2,0,0,0,0|2,0,0]=4 6661 B8R0.9 CCC(=O)CCC(C)C Amb9031667 [0,2,0,0,0,0|2,0,0]=4 6662 B8R0.9 CCC(=O)CCC(C)N Amb27866596 [0,2,0,0,0,0|1,0,0]=3 6663 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,2,0,0,0,0|1,0,1]=4 6664 B8R0.9 CCC(Br)CCC(=O)O Amb28367201 [0,2,0,0,0,0|1,0,0]=3 6665 B8R0.9 CCC(Br)COC(C)=O Amb26916647 [0,2,0,0,0,0|2,0,0]=4 6666 B8R0.9 CCC(C)C#CC(=O)O Amb28145990 [0,2,0,0,0,0|1,0,1]=4 6667 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,2,0,0,0,0|1,0,0]=3 6668 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,2,0,0,0,0|2,0,0]=4 6669 B8R0.9 CCC(C)CNC(=O)Cl Amb29881345 [0,2,0,0,0,0|2,0,0]=4 6670 B8R0.9 CCC(C)CNC(C)=O Amb27643953 [0,2,0,0,0,0|2,0,0]=4 6671 B8R0.9 CCC(C)CNC(N)=O Amb27258807 [0,2,0,0,0,0|2,0,0]=4 6672 B8R0.9 CCC(C)COC(=O)Cl Amb20246588 [0,2,0,0,0,0|2,0,0]=4 6673 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,2,0,0,0,0|1,0,0]=3 6674 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,2,0,0,0,0|1,0,0]=3 6675 B8R0.9 CCC(C)NCC(N)=O Amb6661064 [0,2,0,0,0,0|2,0,0]=4 6676 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,2,0,0,0,0|1,0,0]=3 6677 B8R0.9 CCC(C)OCC(C)=O Amb27803509 [0,2,0,0,0,0|2,0,0]=4 6678 B8R0.9 CCC(C)OCC(N)=O Amb27167179 [0,2,0,0,0,0|2,0,0]=4 6679 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,2,0,0,0,0|1,0,0]=3 6680 B8R0.9 CCC(C)SCC(N)=O Amb27603087 [0,2,0,0,0,0|2,0,0]=4 6681 B8R0.9 CCC(C)\C=C\C(=O)O Amb33171963 [0,2,0,0,0,0|1,0,1]=4 6682 B8R0.9 CCC(Cl)CCC(=O)Cl Amb24524189 [0,2,0,0,0,0|2,0,0]=4 6683 B8R0.9 CCC(Cl)CCC(=O)O Amb27955847 [0,2,0,0,0,0|1,0,0]=3 6684 B8R0.9 CCC(Cl)COC(=O)Cl Amb25967600 [0,2,0,0,0,0|2,0,0]=4 6685 B8R0.9 CCC(N)C#CC(=O)O Amb33168922 [0,2,0,0,0,0|0,0,2]=4 6686 B8R0.9 CCC(N)CCC(=O)O Amb21961489 [0,2,0,0,0,0|0,0,0]=2 6687 B8R0.9 CCC(N)CCC(=O)O Amb5717972 [0,2,0,0,0,0|0,0,0]=2 6688 B8R0.9 CCC(N)CCC(N)=O Amb27194979 [0,2,0,0,0,0|1,0,0]=3 6689 B8R0.9 CCC(N)CNC(N)=O Amb27437062 [0,2,0,0,0,0|2,0,0]=4 6690 B8R0.9 CCC(N)\C=C\C(=O)O Amb27867410 [0,2,0,0,0,0|0,0,2]=4 6691 B8R0.9 CCC(O)C#CC(=O)O Amb27169546 [0,2,0,0,0,0|1,0,1]=4 6692 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [0,2,0,0,0,0|1,0,0]=3 6693 B8R0.9 CCC(O)CCC(N)=O Amb27234638 [0,2,0,0,0,0|2,0,0]=4 6694 B8R0.9 CCC(O)CNC(N)=O Amb27235306 [0,2,0,0,0,0|2,0,0]=4 6695 B8R0.9 CCC(O)COC(N)=O Amb27175099 [0,2,0,0,0,0|2,0,0]=4 6696 B8R0.9 CCC(S)CCC(=O)O Amb27954753 [0,2,0,0,0,0|1,0,0]=3 6697 B8R0.9 CCN(C)CCC(=O)O Amb8428205 [0,2,0,0,0,0|1,0,0]=3 6698 B8R0.9 CCN(C)CCC(=O)O Amb8890954 [0,2,0,0,0,0|1,0,0]=3 6699 B8R0.9 CCS(=O)CCC(=O)O Amb9173461 [0,2,0,0,0,0|1,0,0]=3 6700 B8R0.9 CCS(=O)NCC(=O)O Amb28322707 [0,2,0,0,0,0|2,0,0]=4 6701 B8R0.9 CC[C@@H](Br)COC(C)=O Amb28254442 [0,2,0,0,0,0|2,0,0]=4 6702 B8R0.9 CC[C@@H](C)C#CC(=O)O Amb27975780 [0,2,0,0,0,0|1,0,1]=4 6703 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,2,0,0,0,0|1,0,0]=3 6704 B8R0.9 CC[C@@H](C)\C=C\C(=O)O Amb24117189 [0,2,0,0,0,0|1,0,1]=4 6705 B8R0.9 CC[C@@H](O)CCC(N)=O Amb27254154 [0,2,0,0,0,0|2,0,0]=4 6706 B8R0.9 CC[C@H](C)C#CC(=O)O Amb28132200 [0,2,0,0,0,0|1,0,1]=4 6707 B8R0.9 CC[C@H](C)CCC(C)=O Amb27447760 [0,2,0,0,0,0|2,0,0]=4 6708 B8R0.9 CC[C@H](C)CCC(N)=O Amb28346481 [0,2,0,0,0,0|2,0,0]=4 6709 B8R0.9 CC[C@H](C)COC(C)=O Amb27408010 [0,2,0,0,0,0|2,0,0]=4 6710 B8R0.9 CC[C@H](N)\C=C\C(=O)O Amb27878954 [0,2,0,0,0,0|0,0,2]=4 6711 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [0,2,0,0,0,0|1,0,0]=3 6712 B8R0.9 CC[C@H](O)CNC(C)=O Amb27762160 [0,2,0,0,0,0|2,0,0]=4 6713 B8R0.9 CC\C(C)=C\CC(=O)O Amb22011800 [0,2,0,0,0,0|1,0,1]=4 6714 B8R0.9 CN(C#N)CCC(=O)O Amb35634504 [0,2,0,0,0,0|0,0,2]=4 6715 B8R0.9 CN(C)CCC(=O)NO Amb27762089 [0,2,0,0,0,0|2,0,0]=4 6716 B8R0.9 CN(CCC(=O)O)N=O Amb17618592 [0,2,0,0,0,0|1,0,1]=4 6717 B8R0.9 CNC(=O)CCC(=O)O Amb2720937 [0,2,0,0,0,0|0,0,1]=3 6718 B8R0.9 CNC(=O)CCC(C)=O Amb17334107 [0,2,0,0,0,0|1,0,1]=4 6719 B8R0.9 CNC(=O)CCC(C)C Amb27165938 [0,2,0,0,0,0|2,0,0]=4 6720 B8R0.9 CNC(=O)CCC(C)N Amb33109814 [0,2,0,0,0,0|1,0,0]=3 6721 B8R0.9 CNC(=O)CCC(C)O Amb17334125 [0,2,0,0,0,0|2,0,0]=4 6722 B8R0.9 CNC(=O)CCC(Cl)Cl Amb32671998 [0,2,0,0,0,0|2,0,0]=4 6723 B8R0.9 CNC(=O)CCC(F)F Amb27837707 [0,2,0,0,0,0|2,0,0]=4 6724 B8R0.9 CNC(=O)CCC(N)=O Amb17334114 [0,2,0,0,0,0|1,0,1]=4 6725 B8R0.9 CNC(=O)CC[C@H](C)O Amb27799232 [0,2,0,0,0,0|2,0,0]=4 6726 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,2,0,0,0,0|1,0,1]=4 6727 B8R0.9 CNC(=O)OCC(=O)O Amb30018932 [0,2,0,0,0,0|1,0,1]=4 6728 B8R0.9 CNC(=O)OCC(C)N Amb35735119 [0,2,0,0,0,0|2,0,0]=4 6729 B8R0.9 CNC(=S)NCC(=O)O Amb4044376 [0,2,0,0,0,0|1,0,1]=4 6730 B8R0.9 CNC(C)CCS(C)=O Amb27791401 [0,2,0,0,0,0|2,0,0]=4 6731 B8R0.9 COC(=O)CCB(O)O Amb25705142 [0,2,0,0,0,0|2,0,0]=4 6732 B8R0.9 COC(=O)CCC(=O)Cl Amb3939311 [0,2,0,0,0,0|1,0,1]=4 6733 B8R0.9 COC(=O)CCC(=O)O Amb6538024 [0,2,0,0,0,0|1,0,1]=4 6734 B8R0.9 COC(=O)CCC(C)=O Amb13777321 [0,2,0,0,0,0|1,0,1]=4 6735 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,2,0,0,0,0|1,0,0]=3 6736 B8R0.9 COC(=O)CCC(C)C Amb9241809 [0,2,0,0,0,0|1,0,0]=3 6737 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,2,0,0,0,0|1,0,0]=3 6738 B8R0.9 COC(=O)CCC(C)I Amb27445524 [0,2,0,0,0,0|1,0,0]=3 6739 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,2,0,0,0,0|0,0,0]=2 6740 B8R0.9 COC(=O)CCC(C)N Amb35750839 [0,2,0,0,0,0|0,0,0]=2 6741 B8R0.9 COC(=O)CCC(C)O Amb26459430 [0,2,0,0,0,0|1,0,0]=3 6742 B8R0.9 COC(=O)CCC(C)S Amb28066829 [0,2,0,0,0,0|1,0,0]=3 6743 B8R0.9 COC(=O)CCC(C)[O-] Amb30988005 [0,2,0,0,0,0|1,0,0]=3 6744 B8R0.9 COC(=O)CCC(F)F Amb27770565 [0,2,0,0,0,0|1,0,0]=3 6745 B8R0.9 COC(=O)CCC(N)=O Amb24323351 [0,2,0,0,0,0|0,0,1]=3 6746 B8R0.9 COC(=O)CCC(N)=S Amb18108081 [0,2,0,0,0,0|0,0,1]=3 6747 B8R0.9 COC(=O)CCN(C)C Amb7757843 [0,2,0,0,0,0|2,0,0]=4 6748 B8R0.9 COC(=O)CCS(=O)Cl Amb25944850 [0,2,0,0,0,0|2,0,0]=4 6749 B8R0.9 COC(=O)CCS(=O)O Amb25967240 [0,2,0,0,0,0|2,0,0]=4 6750 B8R0.9 COC(=O)CCS(=O)[O-] Amb21520328 [0,2,0,0,0,0|2,0,0]=4 6751 B8R0.9 COC(=O)CCS(N)=O Amb32720304 [0,2,0,0,0,0|1,0,0]=3 6752 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,2,0,0,0,0|0,0,0]=2 6753 B8R0.9 COC(=O)CC[C@H](C)N Amb27950697 [0,2,0,0,0,0|0,0,0]=2 6754 B8R0.9 COC(=O)CC[N+](=O)[O-] Amb26494342 [0,2,0,0,0,0|2,0,0]=4 6755 B8R0.9 COC(=O)CNC(=N)N Amb27259956 [0,2,0,0,0,0|1,0,1]=4 6756 B8R0.9 COC(=O)CNC(C)C Amb6687063 [0,2,0,0,0,0|2,0,0]=4 6757 B8R0.9 COC(=O)CNC(N)=O Amb1126846 [0,2,0,0,0,0|1,0,1]=4 6758 B8R0.9 COC(=O)CNC(N)=S Amb9212124 [0,2,0,0,0,0|1,0,1]=4 6759 B8R0.9 COC(=O)COC(C)C Amb9206385 [0,2,0,0,0,0|2,0,0]=4 6760 B8R0.9 COC(=O)COC(Cl)Cl Amb22230457 [0,2,0,0,0,0|2,0,0]=4 6761 B8R0.9 COC(=O)CSC(=N)N Amb20676059 [0,2,0,0,0,0|1,0,1]=4 6762 B8R0.9 COC(=O)CSC(C)C Amb28049081 [0,2,0,0,0,0|2,0,0]=4 6763 B8R0.9 COC(=O)NCC(C)Cl Amb27401852 [0,2,0,0,0,0|2,0,0]=4 6764 B8R0.9 COC(=O)NCC(C)O Amb9285615 [0,2,0,0,0,0|2,0,0]=4 6765 B8R0.9 COC(=O)NCC(N)=O Amb27640170 [0,2,0,0,0,0|1,0,1]=4 6766 B8R0.9 COC(=O)NC[C@@H](C)O Amb28204216 [0,2,0,0,0,0|2,0,0]=4 6767 B8R0.9 COC(=O)OCC(F)F Amb24088551 [0,2,0,0,0,0|2,0,0]=4 6768 B8R0.9 COC(=O)SCC(C)Cl Amb28386344 [0,2,0,0,0,0|2,0,0]=4 6769 B8R0.9 COC(=O)\C=C\C(C)N Amb33069659 [0,2,0,0,0,0|0,0,2]=4 6770 B8R0.9 COC(=O)\C=C\C(C)N Amb33069671 [0,2,0,0,0,0|0,0,2]=4 6771 B8R0.9 COC(=O)\C=C\[C@@H](C)N Amb27252211 [0,2,0,0,0,0|0,0,2]=4 6772 B8R0.9 COC(C)CCC(=O)O Amb24271104 [0,2,0,0,0,0|1,0,0]=3 6773 B8R0.9 COC(C)CCC(C)=O Amb25880180 [0,2,0,0,0,0|2,0,0]=4 6774 B8R0.9 CON(C)CCC(=O)O Amb27881744 [0,2,0,0,0,0|2,0,0]=4 6775 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [0,2,0,0,0,0|1,0,0]=3 6776 B8R0.9 CS(=O)CCC(N)C#N Amb27236521 [0,2,0,0,0,0|2,0,0]=4 6777 B8R0.9 CS(=O)CCC(N)CO Amb27867840 [0,2,0,0,0,0|2,0,0]=4 6778 B8R0.9 CS(=O)CCC(O)CN Amb27403927 [0,2,0,0,0,0|2,0,0]=4 6779 B8R0.9 CSC(=O)CCC(C)C Amb25743840 [0,2,0,0,0,0|1,1,0]=4 6780 B8R0.9 CSC(=O)CCC(C)O Amb28065144 [0,2,0,0,0,0|1,1,0]=4 6781 B8R0.9 CSC(C)CCC(=O)O Amb22059071 [0,2,0,0,0,0|1,0,0]=3 6782 B8R0.9 CSC(C)CCC(N)=O Amb27247670 [0,2,0,0,0,0|2,0,0]=4 6783 B8R0.9 C[C@@H](CN)CC[N+](=O)[O-] Amb33744961 [0,2,0,0,0,0|1,0,1]=4 6784 B8R0.9 C[C@H](CN)CC[N+](=O)[O-] Amb33748017 [0,2,0,0,0,0|1,0,1]=4 6785 B8R0.9 C[C@H](O)CNC(=O)CO Amb27829811 [0,2,0,0,0,0|2,0,0]=4 6786 B8R0.9 C\C(CCC(=O)O)=N/O Amb25138471 [0,2,0,0,0,0|0,0,2]=4 6787 B8R0.9 C\C(CCC(C)C)=N/O Amb25235824 [0,2,0,0,0,0|2,0,0]=4 6788 B8R0.9 C\C(CCC(C)C)=N\O Amb24547350 [0,2,0,0,0,0|2,0,0]=4 6789 B8R0.9 N#CC(N)CCC(=O)O Amb27596135 [0,2,0,0,0,0|0,0,0]=2 6790 B8R0.9 N#CC(N)CCC(=O)O Amb30666632 [0,2,0,0,0,0|0,0,0]=2 6791 B8R0.9 N=C(CCl)NCC(=O)O Amb28282661 [0,2,0,0,0,0|1,0,1]=4 6792 B8R0.9 NC(=O)CCC(O)CO Amb28073389 [0,2,0,0,0,0|2,0,0]=4 6793 B8R0.9 NC(=O)CC[C@H](N)CF Amb27431484 [0,2,0,0,0,0|1,0,0]=3 6794 B8R0.9 NC(=O)CC[C@H](N)CO Amb24368577 [0,2,0,0,0,0|1,0,0]=3 6795 B8R0.9 NC(=O)OCC(Br)CBr Amb22732242 [0,2,0,0,0,0|2,0,0]=4 6796 B8R0.9 NC(=O)OCC(Cl)CCl Amb27771643 [0,2,0,0,0,0|2,0,0]=4 6797 B8R0.9 NC(=O)OCC(N)CO Amb27956487 [0,2,0,0,0,0|2,0,0]=4 6798 B8R0.9 NC(CCl)CCC(=O)O Amb27440510 [0,2,0,0,0,0|0,0,0]=2 6799 B8R0.9 NC(CF)CCC(=O)Cl Amb27876552 [0,2,0,0,0,0|1,0,0]=3 6800 B8R0.9 NC(CF)CCC(=O)O Amb19148378 [0,2,0,0,0,0|0,0,0]=2 6801 B8R0.9 NC(CF)CCC(=O)O Amb33473114 [0,2,0,0,0,0|0,0,0]=2 6802 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [0,2,0,0,0,0|0,0,0]=2 6803 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [0,2,0,0,0,0|0,0,0]=2 6804 B8R0.9 NC(CS)CCC(=O)O Amb27458291 [0,2,0,0,0,0|0,0,0]=2 6805 B8R0.9 NCC(=O)CCC(=O)O Amb2720232 [0,2,0,0,0,0|0,0,0]=2 6806 B8R0.9 NCC(=O)CCC(=O)O Amb5395775 [0,2,0,0,0,0|0,0,0]=2 6807 B8R0.9 NCC(=O)NCC(=O)O Amb1151360 [0,2,0,0,0,0|0,0,1]=3 6808 B8R0.9 NCC(=O)NCC(=O)O Amb8382637 [0,2,0,0,0,0|0,0,1]=3 6809 B8R0.9 NCC(=O)OCC(N)=O Amb27829178 [0,2,0,0,0,0|1,0,1]=4 6810 B8R0.9 NCC(N)CCC(=O)O Amb19328773 [0,2,0,0,0,0|0,0,0]=2 6811 B8R0.9 NCC(N)CCC(=O)O Amb27837536 [0,2,0,0,0,0|0,0,0]=2 6812 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [0,2,0,0,0,0|0,0,0]=2 6813 B8R0.9 NCC(O)CCC(=O)[O-] Amb33330648 [0,2,0,0,0,0|0,0,1]=3 6814 B8R0.9 NCC(O)CNC(N)=O Amb27838588 [0,2,0,0,0,0|1,0,0]=3 6815 B8R0.9 NCC(O)CNC(N)=O Amb33457634 [0,2,0,0,0,0|1,0,0]=3 6816 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [0,2,0,0,0,0|0,0,0]=2 6817 B8R0.9 NC[C@H](N)CCC(=O)O Amb28068164 [0,2,0,0,0,0|0,0,0]=2 6818 B8R0.9 NNC(=O)CCC(N)=O Amb595603 [0,2,0,0,0,0|1,0,1]=4 6819 B8R0.9 NNC(=O)NCC(=O)O Amb27623574 [0,2,0,0,0,0|1,0,1]=4 6820 B8R0.9 N[C@@H](CS)CCC(=O)O Amb28341808 [0,2,0,0,0,0|0,0,0]=2 6821 B8R0.9 N[C@H](CF)CCC(=O)O Amb32729481 [0,2,0,0,0,0|0,0,0]=2 6822 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [0,2,0,0,0,0|0,0,0]=2 6823 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [0,2,0,0,0,0|0,0,0]=2 6824 B8R0.9 O=C(Cl)OCC(Cl)CCl Amb27758582 [0,2,0,0,0,0|2,0,0]=4 6825 B8R0.9 O=C(O)CCC(=O)CCl Amb25736440 [0,2,0,0,0,0|1,0,0]=3 6826 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [0,2,0,0,0,0|1,0,0]=3 6827 B8R0.9 O=C(O)CCC(S)CS Amb27407074 [0,2,0,0,0,0|1,0,0]=3 6828 B8R0.9 O=C(O)CC\C(O)=N\O Amb24745795 [0,2,0,0,0,0|0,0,2]=4 6829 B8R0.9 O=C(O)CNC(=O)CCl Amb1144436 [0,2,0,0,0,0|1,0,1]=4 6830 B8R0.9 O=C(O)CNC(=O)CO Amb18124375 [0,2,0,0,0,0|1,0,1]=4 6831 B8R0.9 O=C(O)COC(=O)CCl Amb18644547 [0,2,0,0,0,0|1,0,1]=4 6832 B8R0.9 O=C(O)CSC(=O)CS Amb27213308 [0,2,0,0,0,0|1,0,1]=4 6833 B8R0.9 O=C(O)\C=C\C(O)CO Amb18642875 [0,2,0,0,0,0|1,0,1]=4 6834 B8R0.9 O=C(O)\C=C\[C@H](O)CO Amb27437218 [0,2,0,0,0,0|1,0,1]=4 6835 B8R0.9 O=CC(=O)CCC(=O)O Amb18642737 [0,2,0,0,0,0|1,0,1]=4 6836 B8R0.9 O=NN(O)CCC(=O)O Amb27495384 [0,2,0,0,0,0|1,0,1]=4 6837 B8R0.11 C=C=C(CCCBr)OC Amb27424624 [0,2,0,0,0,0|2,0,0]=4 6838 B8R0.11 C=C=C(CO)CCCC Amb28315430 [0,2,0,0,0,0|2,0,0]=4 6839 B8R0.11 CCC(CCCN)OC Amb26440196 [0,2,0,0,0,0|1,0,1]=4 6840 B8R0.11 CCCCC(C=O)CO Amb28144205 [0,2,0,0,0,0|1,0,1]=4 6841 B8R0.11 CCCCN(C=O)CO Amb28366870 [0,2,0,0,0,0|2,0,0]=4 6842 B8R0.11 CCCC\C(C=O)=C/N Amb27778578 [0,2,0,0,0,0|2,0,0]=4 6843 B8R0.11 CCCC\C(C=O)=C/O Amb27789093 [0,2,0,0,0,0|1,0,0]=3 6844 B8R0.11 CCCC\C(C=O)=C\N Amb27389633 [0,2,0,0,0,0|2,0,0]=4 6845 B8R0.11 CC\C(CCCCl)=N/O Amb27165091 [0,2,0,0,0,0|2,0,0]=4 6846 B8R0.11 COC(C=O)CCCCl Amb27810864 [0,2,0,0,0,0|1,0,1]=4 6847 B8R0.11 COC(CCCN)OC Amb22052692 [0,2,0,0,0,0|0,0,2]=4 6848 B8R0.11 C\C=C(/C=O)CCCO Amb27788394 [0,2,0,0,0,0|2,0,0]=4 6849 B8R0.11 N\C=C(/C=O)CCCO Amb25307863 [0,2,0,0,0,0|2,0,0]=4 6850 B8R0.25 C#CC(C)(O)CCCN Amb27950716 [0,2,0,0,0,0|1,0,1]=4 6851 B8R0.25 CC(C)(C=O)CCCN Amb28363707 [0,2,0,0,0,0|1,0,1]=4 6852 B8R0.25 CC(C)(CCCN)O[SiH3] Amb27493989 [0,2,0,0,0,0|1,0,1]=4 6853 B8R0.25 CC(C)(CO)CCCN Amb2719686 [0,2,0,0,0,0|1,0,1]=4 6854 B8R0.25 CC(O)(C#N)CCCN Amb27399191 [0,2,0,0,0,0|1,0,1]=4 6855 B8R0.25 CC(O)(CN)CCCN Amb28047823 [0,2,0,0,0,0|1,0,1]=4 6856 B8R0.25 CCCCS(=O)(=O)NO Amb17232119 [0,2,0,0,0,0|2,0,0]=4 6857 B8R0.25 CCCC[C@@](C)(O)C=O Amb27614157 [0,2,0,0,0,0|1,0,1]=4 6858 B8R0.25 CCP(=O)(O)CCCN Amb26898508 [0,2,0,0,0,0|1,0,0]=3 6859 B8R0.25 CCS(=O)(=O)CCCN Amb28934937 [0,2,0,0,0,0|1,0,1]=4 6860 B8R0.25 CCS(=O)(=O)CCCN Amb9303379 [0,2,0,0,0,0|1,0,1]=4 6861 B8R0.25 CNS(=O)(=O)CCCN Amb19005551 [0,2,0,0,0,0|1,0,1]=4 6862 B8R0.25 CNS(=O)(=O)CCCN Amb30585153 [0,2,0,0,0,0|1,0,1]=4 6863 B8R0.25 COC(C)(C)CCCN Amb17569946 [0,2,0,0,0,0|1,0,1]=4 6864 B8R0.25 COP(C)(=O)OCCN Amb27856346 [0,2,0,0,0,0|2,0,0]=4 6865 B8R0.25 COS(=O)(=O)CCCO Amb28049148 [0,2,0,0,0,0|2,0,0]=4 6866 B8R0.25 CO[Si](C)(C)CCCN Amb2684515 [0,2,0,0,0,0|1,1,0]=4 6867 B8R0.25 O=S(=O)(CCCCl)NO Amb28059369 [0,2,0,0,0,0|2,0,0]=4 6868 B8R0.7 C#CCCCCC(=O)Cl Amb28312904 [0,2,0,0,0,0|2,0,0]=4 6869 B8R0.7 C#CCCCCC(=O)O Amb2721485 [0,2,0,0,0,0|1,0,0]=3 6870 B8R0.7 C#CCCOCC(=O)O Amb28118359 [0,2,0,0,0,0|1,0,0]=3 6871 B8R0.7 C#CCCSCC(C)=O Amb27218867 [0,2,0,0,0,0|2,0,0]=4 6872 B8R0.7 C#CCOCCC(=O)O Amb9208654 [0,2,0,0,0,0|1,0,0]=3 6873 B8R0.7 C#CCOCCC(N)=O Amb27837665 [0,2,0,0,0,0|2,0,0]=4 6874 B8R0.7 C#CCSCCC(C)=O Amb27946691 [0,2,0,0,0,0|2,0,0]=4 6875 B8R0.7 C#CCSCCC(N)=O Amb27856148 [0,2,0,0,0,0|2,0,0]=4 6876 B8R0.7 C#C\C=C\CCC(=O)O Amb10605297 [0,2,0,0,0,0|1,0,1]=4 6877 B8R0.7 C=C(Br)CNCCCN Amb18330318 [0,2,0,0,0,0|2,0,0]=4 6878 B8R0.7 C=C(Br)COCCNC Amb18324681 [0,2,0,0,0,0|2,0,0]=4 6879 B8R0.7 C=C(C)CCSCCN Amb28123809 [0,2,0,0,0,0|2,0,0]=4 6880 B8R0.7 C=C(C)CNCCCN Amb28044366 [0,2,0,0,0,0|2,0,0]=4 6881 B8R0.7 C=C(C)CNCCNC Amb28457188 [0,2,0,0,0,0|2,0,0]=4 6882 B8R0.7 C=C(C)COCCCN Amb28123400 [0,2,0,0,0,0|2,0,0]=4 6883 B8R0.7 C=C(C)COCCNC Amb27217708 [0,2,0,0,0,0|2,0,0]=4 6884 B8R0.7 C=C(C)CSCCNC Amb28250295 [0,2,0,0,0,0|2,0,0]=4 6885 B8R0.7 C=C(C)C\C=C\CCN Amb27985774 [0,2,0,0,0,0|2,0,0]=4 6886 B8R0.7 C=C(Cl)COCCCN Amb28197915 [0,2,0,0,0,0|2,0,0]=4 6887 B8R0.7 C=C(Cl)CSCCNC Amb27421610 [0,2,0,0,0,0|2,0,0]=4 6888 B8R0.7 C=CC#CCCC(=O)O Amb28422492 [0,2,0,0,0,0|1,0,1]=4 6889 B8R0.7 C=CCCC#CC(=O)O Amb28201250 [0,2,0,0,0,0|1,0,1]=4 6890 B8R0.7 C=CCCCCC(=O)O Amb6299578 [0,2,0,0,0,0|1,0,0]=3 6891 B8R0.7 C=CCCCCC(C)=O Amb24546961 [0,2,0,0,0,0|2,0,0]=4 6892 B8R0.7 C=CCCCCC(N)=O Amb27236725 [0,2,0,0,0,0|2,0,0]=4 6893 B8R0.7 C=CCCCOC(C)=O Amb6366589 [0,2,0,0,0,0|2,0,0]=4 6894 B8R0.7 C=CCCNCC(N)=O Amb33545653 [0,2,0,0,0,0|2,0,0]=4 6895 B8R0.7 C=CCCOCC(=O)O Amb7793843 [0,2,0,0,0,0|1,0,0]=3 6896 B8R0.7 C=CCCOCC(C)=O Amb27465238 [0,2,0,0,0,0|2,0,0]=4 6897 B8R0.7 C=CCCSCC(=O)O Amb27810806 [0,2,0,0,0,0|1,0,0]=3 6898 B8R0.7 C=CCC\C=C\C(=O)O Amb25756053 [0,2,0,0,0,0|1,0,1]=4 6899 B8R0.7 C=CCNCCC(=O)O Amb33527032 [0,2,0,0,0,0|1,0,0]=3 6900 B8R0.7 C=CCNCCC(=O)O Amb7755724 [0,2,0,0,0,0|1,0,0]=3 6901 B8R0.7 C=CCNCCC(N)=O Amb8841114 [0,2,0,0,0,0|2,0,0]=4 6902 B8R0.7 C=CCOCCC(N)=O Amb27844989 [0,2,0,0,0,0|2,0,0]=4 6903 B8R0.7 C=CC\C=C\CC(=O)O Amb18642408 [0,2,0,0,0,0|1,0,1]=4 6904 B8R0.7 C=C\C=C\CCC(=O)O Amb10605294 [0,2,0,0,0,0|1,0,1]=4 6905 B8R0.7 C=NCCCNC(C)=O Amb27950176 [0,2,0,0,0,0|1,0,1]=4 6906 B8R0.7 CC#CCCCC(=O)O Amb28046337 [0,2,0,0,0,0|1,0,0]=3 6907 B8R0.7 CC#CCCCC(N)=O Amb27853693 [0,2,0,0,0,0|2,0,0]=4 6908 B8R0.7 CC#CCNCC(=O)O Amb28410306 [0,2,0,0,0,0|1,0,1]=4 6909 B8R0.7 CC(=O)CCC#CCCl Amb28203937 [0,2,0,0,0,0|2,0,0]=4 6910 B8R0.7 CC(=O)CCC#CCO Amb27867270 [0,2,0,0,0,0|2,0,0]=4 6911 B8R0.7 CC(=O)CCCCC#N Amb18642300 [0,2,0,0,0,0|1,0,1]=4 6912 B8R0.7 CC(=O)CCCCCBr Amb27401578 [0,2,0,0,0,0|2,0,0]=4 6913 B8R0.7 CC(=O)CCCCCCl Amb26591097 [0,2,0,0,0,0|2,0,0]=4 6914 B8R0.7 CC(=O)CCCCCN Amb22641918 [0,2,0,0,0,0|1,0,0]=3 6915 B8R0.7 CC(=O)CCCCCN Amb24113384 [0,2,0,0,0,0|1,0,0]=3 6916 B8R0.7 CC(=O)CCCCCO Amb27237283 [0,2,0,0,0,0|2,0,0]=4 6917 B8R0.7 CC(=O)CCCN=[N+]=[N-] Amb28457742 [0,2,0,0,0,0|1,0,1]=4 6918 B8R0.7 CC(=O)CCCOC=O Amb1033032 [0,2,0,0,0,0|2,0,0]=4 6919 B8R0.7 CC(=O)CCCSC#N Amb26984900 [0,2,0,0,0,0|1,0,1]=4 6920 B8R0.7 CC(=O)CCC\C=C\Cl Amb26336040 [0,2,0,0,0,0|2,0,0]=4 6921 B8R0.7 CC(=O)CCNCCO Amb24481900 [0,2,0,0,0,0|2,0,0]=4 6922 B8R0.7 CC(=O)CCOCCBr Amb32651831 [0,2,0,0,0,0|2,0,0]=4 6923 B8R0.7 CC(=O)CCOCCCl Amb27982282 [0,2,0,0,0,0|2,0,0]=4 6924 B8R0.7 CC(=O)CCOCCN Amb18628609 [0,2,0,0,0,0|1,0,0]=3 6925 B8R0.7 CC(=O)CCSCC#N Amb18927970 [0,2,0,0,0,0|1,0,1]=4 6926 B8R0.7 CC(=O)CC\C=C/CO Amb27828969 [0,2,0,0,0,0|2,0,0]=4 6927 B8R0.7 CC(=O)COCCCN Amb18630475 [0,2,0,0,0,0|1,0,0]=3 6928 B8R0.7 CC(=O)CSCCCF Amb28065634 [0,2,0,0,0,0|2,0,0]=4 6929 B8R0.7 CC(=O)C\C=C\CCCl Amb25729220 [0,2,0,0,0,0|2,0,0]=4 6930 B8R0.7 CC(=O)NCCCC#N Amb28049789 [0,2,0,0,0,0|1,0,1]=4 6931 B8R0.7 CC(=O)NCCCCCl Amb25883586 [0,2,0,0,0,0|2,0,0]=4 6932 B8R0.7 CC(=O)NCCCCF Amb27180576 [0,2,0,0,0,0|2,0,0]=4 6933 B8R0.7 CC(=O)NCCCCI Amb27768800 [0,2,0,0,0,0|2,0,0]=4 6934 B8R0.7 CC(=O)NCCCCN Amb17053700 [0,2,0,0,0,0|1,0,0]=3 6935 B8R0.7 CC(=O)NCCCCO Amb17102977 [0,2,0,0,0,0|2,0,0]=4 6936 B8R0.7 CC(=O)NCCCON Amb17138378 [0,2,0,0,0,0|1,0,0]=3 6937 B8R0.7 CC(=O)NCCCON Amb6308549 [0,2,0,0,0,0|1,0,0]=3 6938 B8R0.7 CC(=O)NOCCCF Amb28436015 [0,2,0,0,0,0|2,0,0]=4 6939 B8R0.7 CC(=O)NOCCCO Amb28205723 [0,2,0,0,0,0|2,0,0]=4 6940 B8R0.7 CC(=O)OCC#CCN Amb27424695 [0,2,0,0,0,0|1,0,1]=4 6941 B8R0.7 CC(=O)OCCCCBr Amb2725321 [0,2,0,0,0,0|2,0,0]=4 6942 B8R0.7 CC(=O)OCCCCCl Amb3940275 [0,2,0,0,0,0|2,0,0]=4 6943 B8R0.7 CC(=O)OCCCCI Amb2725257 [0,2,0,0,0,0|2,0,0]=4 6944 B8R0.7 CC(=O)OCCCCN Amb24657282 [0,2,0,0,0,0|1,0,0]=3 6945 B8R0.7 CC(=O)OCCCCO Amb25714960 [0,2,0,0,0,0|2,0,0]=4 6946 B8R0.7 CC(=O)OCCNC=O Amb27212825 [0,2,0,0,0,0|2,0,0]=4 6947 B8R0.7 CC(=O)OCCOCBr Amb8395197 [0,2,0,0,0,0|2,0,0]=4 6948 B8R0.7 CC(=O)OCCSCCl Amb28122692 [0,2,0,0,0,0|2,0,0]=4 6949 B8R0.7 CC(=O)OCOCCBr Amb28458426 [0,2,0,0,0,0|2,0,0]=4 6950 B8R0.7 CC(=O)SCCCC#N Amb17607671 [0,2,0,0,0,0|1,0,1]=4 6951 B8R0.7 CC(=O)SCCCC=O Amb22524698 [0,2,0,0,0,0|2,0,0]=4 6952 B8R0.7 CC(=O)SCCCCBr Amb22641871 [0,2,0,0,0,0|2,0,0]=4 6953 B8R0.7 CC(=O)SCCCCN Amb24117263 [0,2,0,0,0,0|1,0,0]=3 6954 B8R0.7 CC(=O)SCCCCN Amb27429858 [0,2,0,0,0,0|1,0,0]=3 6955 B8R0.7 CC(C)=CCCCCN Amb28345726 [0,2,0,0,0,0|2,0,0]=4 6956 B8R0.7 CC(C)=CCOCCN Amb19020763 [0,2,0,0,0,0|2,0,0]=4 6957 B8R0.7 CC(O)CCCNC=O Amb28318284 [0,2,0,0,0,0|1,0,1]=4 6958 B8R0.7 CC(O)CCNCCN Amb27768810 [0,2,0,0,0,0|1,0,1]=4 6959 B8R0.7 CC(O)COCCCN Amb28318924 [0,2,0,0,0,0|1,0,1]=4 6960 B8R0.7 CCC#CCCC(=O)O Amb28046178 [0,2,0,0,0,0|1,0,0]=3 6961 B8R0.7 CCCC#CCC(=O)O Amb17593307 [0,2,0,0,0,0|1,0,0]=3 6962 B8R0.7 CCCCC#CC(=O)O Amb2721486 [0,2,0,0,0,0|1,0,0]=3 6963 B8R0.7 CCCCC#CC(C)=O Amb17593278 [0,2,0,0,0,0|2,0,0]=4 6964 B8R0.7 CCCCC#CC(N)=O Amb27782976 [0,2,0,0,0,0|2,0,0]=4 6965 B8R0.7 CCCCCCC(=O)Cl Amb3940244 [0,2,0,0,0,0|2,0,0]=4 6966 B8R0.7 CCCCCCC(=O)O Amb34915914 [0,2,0,0,0,0|1,0,0]=3 6967 B8R0.7 CCCCCCC(=O)O Amb3499439 [0,2,0,0,0,0|1,0,0]=3 6968 B8R0.7 CCCCCCC(=O)[O-] Amb22729026 [0,2,0,0,0,0|1,0,1]=4 6969 B8R0.7 CCCCCCC(C)=O Amb6891961 [0,2,0,0,0,0|2,0,0]=4 6970 B8R0.7 CCCCCCC(N)=O Amb8858816 [0,2,0,0,0,0|2,0,0]=4 6971 B8R0.7 CCCCCNC(N)=O Amb6246936 [0,2,0,0,0,0|2,0,0]=4 6972 B8R0.7 CCCCCOC(=O)Cl Amb10844803 [0,2,0,0,0,0|2,0,0]=4 6973 B8R0.7 CCCCCOC(N)=O Amb27655610 [0,2,0,0,0,0|2,0,0]=4 6974 B8R0.7 CCCCNCC(=O)Cl Amb27189998 [0,2,0,0,0,0|2,0,0]=4 6975 B8R0.7 CCCCNCC(=O)O Amb7766471 [0,2,0,0,0,0|1,0,0]=3 6976 B8R0.7 CCCCNCC(N)=O Amb1126543 [0,2,0,0,0,0|2,0,0]=4 6977 B8R0.7 CCCCNCC(N)=O Amb7969721 [0,2,0,0,0,0|2,0,0]=4 6978 B8R0.7 CCCCOCC(=O)O Amb8514871 [0,2,0,0,0,0|1,0,0]=3 6979 B8R0.7 CCCCOCC(N)=O Amb27855875 [0,2,0,0,0,0|2,0,0]=4 6980 B8R0.7 CCCCONC(N)=O Amb2899789 [0,2,0,0,0,0|2,0,0]=4 6981 B8R0.7 CCCCSCC(=O)O Amb1138789 [0,2,0,0,0,0|1,0,0]=3 6982 B8R0.7 CCCC\C=C/C(C)=O Amb28074727 [0,2,0,0,0,0|2,0,0]=4 6983 B8R0.7 CCCC\C=C\C(=O)Cl Amb2688651 [0,2,0,0,0,0|2,0,0]=4 6984 B8R0.7 CCCC\C=C\C(=O)O Amb17778752 [0,2,0,0,0,0|1,0,0]=3 6985 B8R0.7 CCCC\C=C\C(=O)[O-] Amb17778116 [0,2,0,0,0,0|1,0,1]=4 6986 B8R0.7 CCCNCCC(=O)O Amb18633174 [0,2,0,0,0,0|1,0,0]=3 6987 B8R0.7 CCCNCCC(=O)O Amb2372065 [0,2,0,0,0,0|1,0,0]=3 6988 B8R0.7 CCCNCCC(C)=O Amb24700442 [0,2,0,0,0,0|2,0,0]=4 6989 B8R0.7 CCCNCC[PH](=O)O Amb28056179 [0,2,0,0,0,0|2,0,0]=4 6990 B8R0.7 CCCOCCC(=O)O Amb8874502 [0,2,0,0,0,0|1,0,0]=3 6991 B8R0.7 CCCOCCC(C)=O Amb8874915 [0,2,0,0,0,0|2,0,0]=4 6992 B8R0.7 CCCONCC(=O)O Amb27401902 [0,2,0,0,0,0|1,0,0]=3 6993 B8R0.7 CCCS\C=C/C(=O)O Amb18644291 [0,2,0,0,0,0|1,0,1]=4 6994 B8R0.7 CCC\C=C/CC(C)=O Amb27974039 [0,2,0,0,0,0|2,0,0]=4 6995 B8R0.7 CCC\C=C\CC(=O)O Amb18642602 [0,2,0,0,0,0|1,0,0]=3 6996 B8R0.7 CCC\C=C\CC(C)=O Amb33429740 [0,2,0,0,0,0|2,0,0]=4 6997 B8R0.7 CCNCC#CC(=O)O Amb33168956 [0,2,0,0,0,0|0,0,2]=4 6998 B8R0.7 CCNCCCC(=O)O Amb30585148 [0,2,0,0,0,0|0,0,0]=2 6999 B8R0.7 CCNCCCC(=O)O Amb6253896 [0,2,0,0,0,0|0,0,0]=2 7000 B8R0.7 CCNCCCC(N)=O Amb24709859 [0,2,0,0,0,0|1,0,0]=3 7001 B8R0.7 CCNCCCS(C)=O Amb27223315 [0,2,0,0,0,0|2,0,0]=4 7002 B8R0.7 CCNCCNC(C)=O Amb6732650 [0,2,0,0,0,0|2,0,0]=4 7003 B8R0.7 CCNCCSC(C)=O Amb27187142 [0,2,0,0,0,0|2,0,0]=4 7004 B8R0.7 CCOCCCC(=O)O Amb6257602 [0,2,0,0,0,0|1,0,0]=3 7005 B8R0.7 CCOCCNC(N)=O Amb9454688 [0,2,0,0,0,0|2,0,0]=4 7006 B8R0.7 CCOCCOC(=O)Cl Amb22228804 [0,2,0,0,0,0|2,0,0]=4 7007 B8R0.7 CCOCCOC(C)=O Amb8383625 [0,2,0,0,0,0|2,0,0]=4 7008 B8R0.7 CCOCCOC(N)=O Amb27760038 [0,2,0,0,0,0|2,0,0]=4 7009 B8R0.7 CCOC\C=C/C(=O)O Amb27807906 [0,2,0,0,0,0|1,0,1]=4 7010 B8R0.7 CCOC\C=C\C(=O)O Amb19020649 [0,2,0,0,0,0|1,0,1]=4 7011 B8R0.7 CCO\C=N\CC(=O)O Amb27440832 [0,2,0,0,0,0|1,0,1]=4 7012 B8R0.7 CCSCCCC(=O)O Amb6680204 [0,2,0,0,0,0|1,0,0]=3 7013 B8R0.7 CCSCCCC(C)=O Amb9660283 [0,2,0,0,0,0|2,0,0]=4 7014 B8R0.7 CCSCCNC(C)=O Amb27848944 [0,2,0,0,0,0|2,0,0]=4 7015 B8R0.7 CCSCCNC(N)=O Amb27639100 [0,2,0,0,0,0|2,0,0]=4 7016 B8R0.7 CCSC\C=C\C(=O)O Amb33449652 [0,2,0,0,0,0|1,0,1]=4 7017 B8R0.7 CCSSCCC(=O)O Amb27837279 [0,2,0,0,0,0|1,0,0]=3 7018 B8R0.7 CC\C=C/CCC(=O)O Amb25831265 [0,2,0,0,0,0|1,0,0]=3 7019 B8R0.7 CC\C=C\CCC(=O)O Amb18642608 [0,2,0,0,0,0|1,0,0]=3 7020 B8R0.7 CC\C=C\CCC(C)=O Amb24523649 [0,2,0,0,0,0|2,0,0]=4 7021 B8R0.7 CC\C=C\CCC(N)=O Amb27221048 [0,2,0,0,0,0|2,0,0]=4 7022 B8R0.7 CNCCCCC(=O)O Amb10605773 [0,2,0,0,0,0|0,0,0]=2 7023 B8R0.7 CNCCCCC(=O)O Amb24340485 [0,2,0,0,0,0|0,0,0]=2 7024 B8R0.7 CNCCCCC(C)O Amb17569923 [0,2,0,0,0,0|1,0,1]=4 7025 B8R0.7 CNCCCCC(N)=O Amb27780478 [0,2,0,0,0,0|1,0,0]=3 7026 B8R0.7 CNCCCNC(=S)S Amb26390720 [0,2,0,0,0,0|0,2,0]=4 7027 B8R0.7 CNCCCNC(C)=O Amb33547919 [0,2,0,0,0,0|1,0,0]=3 7028 B8R0.7 CNCCCNC(C)=O Amb34913785 [0,2,0,0,0,0|1,0,0]=3 7029 B8R0.7 CNCCCNC(C)=O Amb9464418 [0,2,0,0,0,0|1,0,0]=3 7030 B8R0.7 CNCCCNS(C)=O Amb27186838 [0,2,0,0,0,0|2,0,0]=4 7031 B8R0.7 CNCCOCC(=O)O Amb18630741 [0,2,0,0,0,0|0,0,0]=2 7032 B8R0.7 CNCCOCC(C)=O Amb18111838 [0,2,0,0,0,0|1,0,0]=3 7033 B8R0.7 CNCCOCC(N)=O Amb27447982 [0,2,0,0,0,0|1,0,0]=3 7034 B8R0.7 COCC#CCC(=O)O Amb27663198 [0,2,0,0,0,0|1,0,1]=4 7035 B8R0.7 COCCC#CC(=O)O Amb27392974 [0,2,0,0,0,0|1,0,1]=4 7036 B8R0.7 COCCCCC(=O)O Amb9207785 [0,2,0,0,0,0|1,0,0]=3 7037 B8R0.7 COCCCCC(C)=O Amb9659801 [0,2,0,0,0,0|2,0,0]=4 7038 B8R0.7 COCCCNC(=O)Cl Amb27791959 [0,2,0,0,0,0|2,0,0]=4 7039 B8R0.7 COCCCNC(C)=O Amb3358083 [0,2,0,0,0,0|2,0,0]=4 7040 B8R0.7 COCCCNC(N)=O Amb1105274 [0,2,0,0,0,0|2,0,0]=4 7041 B8R0.7 COCCCOC(C)=O Amb22732978 [0,2,0,0,0,0|2,0,0]=4 7042 B8R0.7 COCCNCC(=O)O Amb19514667 [0,2,0,0,0,0|1,0,0]=3 7043 B8R0.7 COCCNCC(=O)O Amb7766415 [0,2,0,0,0,0|1,0,0]=3 7044 B8R0.7 COCCNCC(N)=O Amb13951972 [0,2,0,0,0,0|2,0,0]=4 7045 B8R0.7 COCCNCC(N)=O Amb6707121 [0,2,0,0,0,0|2,0,0]=4 7046 B8R0.7 COCCOCC(=O)O Amb2721259 [0,2,0,0,0,0|1,0,0]=3 7047 B8R0.7 COCCOCC(C)=O Amb9665444 [0,2,0,0,0,0|2,0,0]=4 7048 B8R0.7 COCCSCC(=O)O Amb6245777 [0,2,0,0,0,0|1,0,0]=3 7049 B8R0.7 COCC\C=C\C(=O)O Amb33080389 [0,2,0,0,0,0|1,0,1]=4 7050 B8R0.7 COCOCCC(=O)O Amb27784860 [0,2,0,0,0,0|1,0,0]=3 7051 B8R0.7 COCSCCC(=O)O Amb27263382 [0,2,0,0,0,0|1,0,0]=3 7052 B8R0.7 CS(=O)CCCNC#N Amb27983375 [0,2,0,0,0,0|2,0,0]=4 7053 B8R0.7 CSCCCCC(=O)O Amb17503764 [0,2,0,0,0,0|1,0,0]=3 7054 B8R0.7 CSCCCCC(C)=O Amb27815140 [0,2,0,0,0,0|2,0,0]=4 7055 B8R0.7 CSCCCCC(N)=O Amb27662727 [0,2,0,0,0,0|2,0,0]=4 7056 B8R0.7 CSCCCOC(C)=O Amb8392861 [0,2,0,0,0,0|2,0,0]=4 7057 B8R0.7 CSCCNCC(=O)O Amb24401934 [0,2,0,0,0,0|1,0,0]=3 7058 B8R0.7 CSCCNCC(=O)O Amb28934977 [0,2,0,0,0,0|1,0,0]=3 7059 B8R0.7 CSCCNCC(N)=O Amb27850987 [0,2,0,0,0,0|2,0,0]=4 7060 B8R0.7 CSCCOCC(=O)O Amb27392229 [0,2,0,0,0,0|1,0,0]=3 7061 B8R0.7 CSCCSCC(=O)O Amb27964765 [0,2,0,0,0,0|1,0,0]=3 7062 B8R0.7 CSCC\C=C\C(=O)O Amb33475293 [0,2,0,0,0,0|1,0,1]=4 7063 B8R0.7 CSC\C=C\CC(=O)O Amb28072070 [0,2,0,0,0,0|1,0,1]=4 7064 B8R0.7 CSSCCCC(=O)O Amb25269470 [0,2,0,0,0,0|1,0,0]=3 7065 B8R0.7 C[C@H](O)CNCCCN Amb27755469 [0,2,0,0,0,0|1,0,1]=4 7066 B8R0.7 C\C=C\CCCC(=O)O Amb18642615 [0,2,0,0,0,0|1,0,0]=3 7067 B8R0.7 C\C=C\CCCC(C)=O Amb24466633 [0,2,0,0,0,0|2,0,0]=4 7068 B8R0.7 C\C=C\CSCC(=O)O Amb9727556 [0,2,0,0,0,0|1,0,1]=4 7069 B8R0.7 N#CCCCCC(=O)O Amb17593332 [0,2,0,0,0,0|0,0,1]=3 7070 B8R0.7 N#CCCCCC(N)=O Amb24108037 [0,2,0,0,0,0|1,0,1]=4 7071 B8R0.7 N#CCCCNC(N)=O Amb27644105 [0,2,0,0,0,0|1,0,1]=4 7072 B8R0.7 N#CCCNCC(=O)O Amb2720474 [0,2,0,0,0,0|0,0,1]=3 7073 B8R0.7 N#CCCSCC(=O)O Amb17502363 [0,2,0,0,0,0|0,0,1]=3 7074 B8R0.7 N#CCSCCC(=O)O Amb6277440 [0,2,0,0,0,0|0,0,1]=3 7075 B8R0.7 N#CCSCCC(N)=O Amb27430604 [0,2,0,0,0,0|1,0,1]=4 7076 B8R0.7 N#CC\C=C\CC(=O)O Amb27762977 [0,2,0,0,0,0|0,0,2]=4 7077 B8R0.7 N#CNC\C=C\C(=O)O Amb35634496 [0,2,0,0,0,0|0,0,2]=4 7078 B8R0.7 N#C\C=C\CCC(=O)O Amb27785050 [0,2,0,0,0,0|0,0,2]=4 7079 B8R0.7 N=C(N)NCCCCN Amb19929571 [0,2,0,0,0,0|2,0,0]=4 7080 B8R0.7 N=C(N)NCCCCN Amb2781574 [0,2,0,0,0,0|2,0,0]=4 7081 B8R0.7 N=C(N)NCCCCN Amb3941521 [0,2,0,0,0,0|2,0,0]=4 7082 B8R0.7 N=C(N)NOCCCN Amb24476677 [0,2,0,0,0,0|2,0,0]=4 7083 B8R0.7 NC(=O)C#CCCCCl Amb28133803 [0,2,0,0,0,0|2,0,0]=4 7084 B8R0.7 NC(=O)CCCCCBr Amb2685265 [0,2,0,0,0,0|2,0,0]=4 7085 B8R0.7 NC(=O)CCCCCCl Amb27392074 [0,2,0,0,0,0|2,0,0]=4 7086 B8R0.7 NC(=O)CCCCCF Amb27837777 [0,2,0,0,0,0|2,0,0]=4 7087 B8R0.7 NC(=O)CCCCCO Amb22524369 [0,2,0,0,0,0|2,0,0]=4 7088 B8R0.7 NC(=O)CCCN=C=S Amb19514658 [0,2,0,0,0,0|1,0,1]=4 7089 B8R0.7 NC(=O)CCNCCO Amb4303499 [0,2,0,0,0,0|2,0,0]=4 7090 B8R0.7 NC(=O)CCOCCO Amb28289325 [0,2,0,0,0,0|2,0,0]=4 7091 B8R0.7 NC(=O)CCSCCBr Amb28367265 [0,2,0,0,0,0|2,0,0]=4 7092 B8R0.7 NC(=O)CCSCCCl Amb27620677 [0,2,0,0,0,0|2,0,0]=4 7093 B8R0.7 NC(=O)CNCCCO Amb9246617 [0,2,0,0,0,0|2,0,0]=4 7094 B8R0.7 NC(=O)CSCCCCl Amb28397637 [0,2,0,0,0,0|2,0,0]=4 7095 B8R0.7 NC(=O)CSCCCO Amb27408312 [0,2,0,0,0,0|2,0,0]=4 7096 B8R0.7 NC(=O)CSCCCS Amb27965314 [0,2,0,0,0,0|2,0,0]=4 7097 B8R0.7 NC(=O)NCCCCBr Amb27614497 [0,2,0,0,0,0|2,0,0]=4 7098 B8R0.7 NC(=O)NCCCCF Amb27663218 [0,2,0,0,0,0|2,0,0]=4 7099 B8R0.7 NC(=O)NOCCCO Amb28189929 [0,2,0,0,0,0|2,0,0]=4 7100 B8R0.7 NCCCC#CC(=O)O Amb33168806 [0,2,0,0,0,0|0,0,0]=2 7101 B8R0.7 NCCCCCC(=O)Cl Amb17142873 [0,2,0,0,0,0|1,0,0]=3 7102 B8R0.7 NCCCCCC(=O)O Amb17607928 [0,2,0,0,0,0|0,0,0]=2 7103 B8R0.7 NCCCCCC(=O)O Amb1905625 [0,2,0,0,0,0|0,0,0]=2 7104 B8R0.7 NCCCCCC(=O)[O-] Amb28990947 [0,2,0,0,0,0|0,0,1]=3 7105 B8R0.7 NCCCCNC(=S)S Amb26625184 [0,2,0,0,0,0|0,2,0]=4 7106 B8R0.7 NCCCCNC(N)=O Amb19026975 [0,2,0,0,0,0|1,0,0]=3 7107 B8R0.7 NCCCCNC(N)=O Amb19374296 [0,2,0,0,0,0|1,0,0]=3 7108 B8R0.7 NCCCCNC(N)=S Amb28041776 [0,2,0,0,0,0|1,1,0]=4 7109 B8R0.7 NCCCOCC(=O)O Amb18111435 [0,2,0,0,0,0|0,0,0]=2 7110 B8R0.7 NCCCOCC(=O)O Amb31217489 [0,2,0,0,0,0|0,0,0]=2 7111 B8R0.7 NCCCSCC(=O)O Amb17500676 [0,2,0,0,0,0|0,0,0]=2 7112 B8R0.7 NCCC\C=C\C(=O)O Amb25221789 [0,2,0,0,0,0|0,0,0]=2 7113 B8R0.7 NCCNCCC(=O)O Amb20668304 [0,2,0,0,0,0|0,0,0]=2 7114 B8R0.7 NCCNCCC(=O)O Amb22058790 [0,2,0,0,0,0|0,0,0]=2 7115 B8R0.7 NCCNCCC(N)=O Amb27436823 [0,2,0,0,0,0|1,0,0]=3 7116 B8R0.7 NCCNCC[SH](=O)=O Amb27816609 [0,2,0,0,0,0|1,0,1]=4 7117 B8R0.7 NCCOCCC(=O)O Amb18630461 [0,2,0,0,0,0|0,0,0]=2 7118 B8R0.7 NCCOCCC(=O)O Amb33330744 [0,2,0,0,0,0|0,0,0]=2 7119 B8R0.7 NCCOCCC(N)=O Amb27751130 [0,2,0,0,0,0|1,0,0]=3 7120 B8R0.7 NCCSCCC(=O)O Amb21988844 [0,2,0,0,0,0|0,0,0]=2 7121 B8R0.7 NCCSSCC(=O)O Amb27658690 [0,2,0,0,0,0|0,0,0]=2 7122 B8R0.7 NC\C=C\C=C\C(=O)O Amb25146005 [0,2,0,0,0,0|0,0,2]=4 7123 B8R0.7 NOCCCCC(=O)O Amb27596055 [0,2,0,0,0,0|0,0,0]=2 7124 B8R0.7 O=C(Cl)CCCCCBr Amb2685267 [0,2,0,0,0,0|2,0,0]=4 7125 B8R0.7 O=C(Cl)CCCCCCl Amb10844967 [0,2,0,0,0,0|2,0,0]=4 7126 B8R0.7 O=C(Cl)CCCCCO Amb28056558 [0,2,0,0,0,0|2,0,0]=4 7127 B8R0.7 O=C(Cl)CCNCCCl Amb28121157 [0,2,0,0,0,0|2,0,0]=4 7128 B8R0.7 O=C(Cl)CCOCCCl Amb27966437 [0,2,0,0,0,0|2,0,0]=4 7129 B8R0.7 O=C(Cl)OCCCCCl Amb8515449 [0,2,0,0,0,0|2,0,0]=4 7130 B8R0.7 O=C(Cl)\C=C\CCCCl Amb27439280 [0,2,0,0,0,0|2,0,0]=4 7131 B8R0.7 O=C(F)CCCCCCl Amb27173031 [0,2,0,0,0,0|2,0,0]=4 7132 B8R0.7 O=C(O)CCC#CCO Amb27949900 [0,2,0,0,0,0|1,0,0]=3 7133 B8R0.7 O=C(O)CCCCCBr Amb2081955 [0,2,0,0,0,0|1,0,0]=3 7134 B8R0.7 O=C(O)CCCCCCl Amb18796646 [0,2,0,0,0,0|1,0,0]=3 7135 B8R0.7 O=C(O)CCCCCF Amb26063796 [0,2,0,0,0,0|1,0,0]=3 7136 B8R0.7 O=C(O)CCCCCI Amb22736492 [0,2,0,0,0,0|1,0,0]=3 7137 B8R0.7 O=C(O)CCCCCO Amb8515991 [0,2,0,0,0,0|1,0,0]=3 7138 B8R0.7 O=C(O)CCCCNO Amb28410171 [0,2,0,0,0,0|0,0,0]=2 7139 B8R0.7 O=C(O)CCCN=C=S Amb26330552 [0,2,0,0,0,0|0,0,1]=3 7140 B8R0.7 O=C(O)CCNCCF Amb27954272 [0,2,0,0,0,0|1,0,0]=3 7141 B8R0.7 O=C(O)CCNCCO Amb1110010 [0,2,0,0,0,0|1,0,0]=3 7142 B8R0.7 O=C(O)CCNCCS Amb28285239 [0,2,0,0,0,0|1,0,0]=3 7143 B8R0.7 O=C(O)CCOCCBr Amb24057757 [0,2,0,0,0,0|1,0,0]=3 7144 B8R0.7 O=C(O)CCOCCF Amb27807548 [0,2,0,0,0,0|1,0,0]=3 7145 B8R0.7 O=C(O)CCOCCO Amb6680916 [0,2,0,0,0,0|1,0,0]=3 7146 B8R0.7 O=C(O)CCOCCS Amb27226892 [0,2,0,0,0,0|1,0,0]=3 7147 B8R0.7 O=C(O)CCSCCBr Amb27468126 [0,2,0,0,0,0|1,0,0]=3 7148 B8R0.7 O=C(O)CCSCCF Amb27172860 [0,2,0,0,0,0|1,0,0]=3 7149 B8R0.7 O=C(O)CCSCCS Amb18126456 [0,2,0,0,0,0|1,0,0]=3 7150 B8R0.7 O=C(O)CNCCCCl Amb28055692 [0,2,0,0,0,0|1,0,0]=3 7151 B8R0.7 O=C(O)CNCCCF Amb27649256 [0,2,0,0,0,0|1,0,0]=3 7152 B8R0.7 O=C(O)CNCCCO Amb9325805 [0,2,0,0,0,0|1,0,0]=3 7153 B8R0.7 O=C(O)COCCCO Amb28288633 [0,2,0,0,0,0|1,0,0]=3 7154 B8R0.7 O=C(O)COC\C=C\Cl Amb27450817 [0,2,0,0,0,0|1,0,1]=4 7155 B8R0.7 O=C(O)C\C=C/CCO Amb28410474 [0,2,0,0,0,0|1,0,0]=3 7156 B8R0.7 O=C(O)C\C=C\CCO Amb27221056 [0,2,0,0,0,0|1,0,0]=3 7157 B8R0.7 O=C(O)C\C=C\CCS Amb27421360 [0,2,0,0,0,0|1,0,0]=3 7158 B8R0.7 O=C(O)\C=C/SCCO Amb27430273 [0,2,0,0,0,0|1,0,1]=4 7159 B8R0.7 O=C(O)\C=C\CCCCl Amb18644386 [0,2,0,0,0,0|1,0,0]=3 7160 B8R0.7 O=C(O)\C=C\NCCO Amb28056766 [0,2,0,0,0,0|1,0,1]=4 7161 B8R0.7 O=C(O)\C=C\SCCO Amb28281149 [0,2,0,0,0,0|1,0,1]=4 7162 B8R0.7 O=C([O-])CCCCCO Amb22491268 [0,2,0,0,0,0|1,0,1]=4 7163 B8R0.7 O=C=NCCCC(=O)O Amb26014000 [0,2,0,0,0,0|0,0,1]=3 7164 B8R0.7 O=CCCCCC(=O)O Amb18642763 [0,2,0,0,0,0|1,0,0]=3 7165 B8R0.7 O=CC\C=C\CC(=O)O Amb25911988 [0,2,0,0,0,0|1,0,1]=4 7166 B8R0.7 O=CNCCCC(=O)O Amb18305404 [0,2,0,0,0,0|0,0,0]=2 7167 B8R0.7 O=CNC\C=C\C(=O)O Amb28045342 [0,2,0,0,0,0|0,0,2]=4 7168 B8R0.7 O=COCCCC(=O)O Amb27217713 [0,2,0,0,0,0|1,0,0]=3 7169 B8R0.7 O=C\C=C\CCC(=O)O Amb26920160 [0,2,0,0,0,0|1,0,1]=4 7170 B8R0.7 [N-]=[N+]=NCCCC(=O)O Amb10575820 [0,2,0,0,0,0|0,0,1]=3 7171 B8R0.21 CC(C)(O)CCCCN Amb17569932 [0,2,0,0,0,0|1,0,1]=4 7172 B8R0.21 CC(C)(O)COCCN Amb28191872 [0,2,0,0,0,0|1,0,1]=4 7173 B8R0.21 CC(C)(O)COCCN Amb33620321 [0,2,0,0,0,0|1,0,1]=4 7174 B8R0.21 CC(C)(O)CSCCN Amb18523817 [0,2,0,0,0,0|1,0,1]=4 7175 B8R0.21 CCCCCS(=O)(=O)O Amb10844728 [0,2,0,0,0,0|2,0,0]=4 7176 B8R0.21 CCCCNS(=O)(=O)O Amb4018979 [0,2,0,0,0,0|2,0,0]=4 7177 B8R0.21 CCCCOP(=O)(O)O Amb24419212 [0,2,0,0,0,0|2,0,0]=4 7178 B8R0.21 CCCCOS(=O)(=O)O Amb22169780 [0,2,0,0,0,0|2,0,0]=4 7179 B8R0.21 CCNCCP(=O)(O)O Amb27400507 [0,2,0,0,0,0|2,0,0]=4 7180 B8R0.21 CNCCCC(C)(C)O Amb17569928 [0,2,0,0,0,0|1,0,1]=4 7181 B8R0.21 CNCCCS(=O)(=O)F Amb33463799 [0,2,0,0,0,0|1,0,1]=4 7182 B8R0.21 CNCCCS(C)(=O)=O Amb18304934 [0,2,0,0,0,0|1,0,1]=4 7183 B8R0.21 CNCCCS(C)(=O)=O Amb33527631 [0,2,0,0,0,0|1,0,1]=4 7184 B8R0.21 CNCCOP(=O)(O)O Amb25785079 [0,2,0,0,0,0|2,0,0]=4 7185 B8R0.21 CNCCOS(=O)(=O)O Amb27412361 [0,2,0,0,0,0|2,0,0]=4 7186 B8R0.21 CNCCSP(=O)(O)O Amb27749900 [0,2,0,0,0,0|2,0,0]=4 7187 B8R0.21 CNCCSS(=O)(=O)O Amb25772807 [0,2,0,0,0,0|2,0,0]=4 7188 B8R0.21 COCCCS(=O)(=O)O Amb22523485 [0,2,0,0,0,0|2,0,0]=4 7189 B8R0.21 CP(=O)(O)SCCCN Amb27760346 [0,2,0,0,0,0|1,0,0]=3 7190 B8R0.21 CS(=O)(=O)CCCCN Amb17138437 [0,2,0,0,0,0|1,0,1]=4 7191 B8R0.21 CS(=O)(=O)CCCCN Amb33552110 [0,2,0,0,0,0|1,0,1]=4 7192 B8R0.21 CS(=O)(=O)CCCNN Amb21618681 [0,2,0,0,0,0|1,0,1]=4 7193 B8R0.21 CS(=O)(=O)CCCNO Amb33053745 [0,2,0,0,0,0|1,0,1]=4 7194 B8R0.21 CS(=O)(=O)CCCON Amb25888915 [0,2,0,0,0,0|1,0,1]=4 7195 B8R0.21 CS(=O)(=O)NCCCN Amb33801433 [0,2,0,0,0,0|1,0,1]=4 7196 B8R0.21 CS(=O)(=O)NCCCN Amb6664983 [0,2,0,0,0,0|1,0,1]=4 7197 B8R0.21 CS(=O)(=O)OCCCN Amb18626294 [0,2,0,0,0,0|1,0,1]=4 7198 B8R0.21 CS(=O)(=O)SCCCN Amb10069437 [0,2,0,0,0,0|1,0,1]=4 7199 B8R0.21 CS(=O)(=O)SCCCN Amb17608278 [0,2,0,0,0,0|1,0,1]=4 7200 B8R0.21 CS(C)(=O)=NCCCN Amb27640367 [0,2,0,0,0,0|2,0,0]=4 7201 B8R0.21 N#CCCCS(=O)(=O)O Amb24428958 [0,2,0,0,0,0|1,0,1]=4 7202 B8R0.21 NCCCCP(=O)(O)O Amb4036798 [0,2,0,0,0,0|1,0,0]=3 7203 B8R0.21 NCCCCS(=O)(=O)F Amb33463776 [0,2,0,0,0,0|1,0,1]=4 7204 B8R0.21 NCCCCS(=O)(=O)O Amb28285138 [0,2,0,0,0,0|1,0,0]=3 7205 B8R0.21 NCCCCS(N)(=O)=O Amb19016662 [0,2,0,0,0,0|1,0,1]=4 7206 B8R0.21 NCCCCS(N)(=O)=O Amb33552095 [0,2,0,0,0,0|1,0,1]=4 7207 B8R0.21 NCCCNS(N)(=O)=O Amb33527131 [0,2,0,0,0,0|1,0,1]=4 7208 B8R0.21 NCCCNS(N)(=O)=O Amb6271793 [0,2,0,0,0,0|1,0,1]=4 7209 B8R0.21 NCCCO[Si](O)(O)O Amb26495041 [0,2,0,0,0,0|0,1,1]=4 7210 B8R0.21 NCCCSS(=O)(=O)O Amb25147112 [0,2,0,0,0,0|1,0,0]=3 7211 B8R0.21 NNCCCS(=O)(=O)O Amb28043284 [0,2,0,0,0,0|1,0,0]=3 7212 B8R0.21 NNCCOP(=O)(O)O Amb27455315 [0,2,0,0,0,0|2,0,0]=4 7213 B8R0.21 NOCCCS(N)(=O)=O Amb27420859 [0,2,0,0,0,0|1,0,1]=4 7214 B8R0.21 NP(=O)(O)CCCCCl Amb27659294 [0,2,0,0,0,0|2,0,0]=4 7215 B8R0.21 O=CCCCP(=O)(O)O Amb28143994 [0,2,0,0,0,0|2,0,0]=4 7216 B8R0.21 O=P(O)(O)CCCCBr Amb22832006 [0,2,0,0,0,0|2,0,0]=4 7217 B8R0.21 O=P(O)(O)CCCCCl Amb22388731 [0,2,0,0,0,0|2,0,0]=4 7218 B8R0.21 O=P(O)(O)CCCNO Amb17615049 [0,2,0,0,0,0|1,0,0]=3 7219 B8R0.21 O=P(O)(O)COCCBr Amb27830604 [0,2,0,0,0,0|2,0,0]=4 7220 B8R0.21 O=P(O)(O)OCCCO Amb28077881 [0,2,0,0,0,0|2,0,0]=4 7221 B8R0.21 O=S(=O)(O)CCCCO Amb25945104 [0,2,0,0,0,0|2,0,0]=4 7222 B8R0.21 O=S(=O)(O)CCCCS Amb26556587 [0,2,0,0,0,0|2,0,0]=4 7223 B8R0.21 O=S(=O)(O)CNCCO Amb28119895 [0,2,0,0,0,0|2,0,0]=4 7224 B8R0.21 O=S(=O)(O)NCCCO Amb19651459 [0,2,0,0,0,0|2,0,0]=4 7225 B8R0.21 O=S(=O)(O)OCCCCl Amb27771619 [0,2,0,0,0,0|2,0,0]=4 7226 B8R0.28 C=C(Br)CSCC(C)N Amb27464775 [0,2,0,0,0,0|2,0,0]=4 7227 B8R0.28 C=C(C)CCCC(=O)O Amb2699907 [0,2,0,0,0,0|1,0,0]=3 7228 B8R0.28 C=C(C)CCCC(C)=O Amb17739959 [0,2,0,0,0,0|2,0,0]=4 7229 B8R0.28 C=C(C)CCCC(N)=O Amb27837767 [0,2,0,0,0,0|2,0,0]=4 7230 B8R0.28 C=C(C)CCC[C@@H](C)N Amb28049331 [0,2,0,0,0,0|2,0,0]=4 7231 B8R0.28 C=C(C)CSCC(=O)O Amb6280447 [0,2,0,0,0,0|1,0,1]=4 7232 B8R0.28 C=C(Cl)CCCC(N)=O Amb27253854 [0,2,0,0,0,0|2,0,0]=4 7233 B8R0.28 C=C(F)CCCC(=O)O Amb22641515 [0,2,0,0,0,0|1,0,0]=3 7234 B8R0.28 CC(=O)CCCC(=O)O Amb1158049 [0,2,0,0,0,0|1,0,0]=3 7235 B8R0.28 CC(=O)CCCC(C)=O Amb24093532 [0,2,0,0,0,0|2,0,0]=4 7236 B8R0.28 CC(=O)CCCC(C)C Amb33532191 [0,2,0,0,0,0|2,0,0]=4 7237 B8R0.28 CC(=O)CCCC(C)N Amb27483216 [0,2,0,0,0,0|1,0,0]=3 7238 B8R0.28 CC(=O)CCCC(N)=O Amb25259665 [0,2,0,0,0,0|1,0,0]=3 7239 B8R0.28 CC(=O)CCCN(C)C Amb2778944 [0,2,0,0,0,0|1,0,0]=3 7240 B8R0.28 CC(=O)CCC[N+](=O)[O-] Amb18203187 [0,2,0,0,0,0|1,0,1]=4 7241 B8R0.28 CC(=O)CCNC(C)C Amb26463473 [0,2,0,0,0,0|2,0,0]=4 7242 B8R0.28 CC(=O)CCNN(C)C Amb27838684 [0,2,0,0,0,0|2,0,0]=4 7243 B8R0.28 CC(=O)CCOC(C)C Amb22229804 [0,2,0,0,0,0|2,0,0]=4 7244 B8R0.28 CC(=O)CNCC(C)C Amb25067661 [0,2,0,0,0,0|2,0,0]=4 7245 B8R0.28 CC(=O)CNCC(C)C Amb32663767 [0,2,0,0,0,0|2,0,0]=4 7246 B8R0.28 CC(=O)CNCC(C)O Amb24589662 [0,2,0,0,0,0|2,0,0]=4 7247 B8R0.28 CC(=O)CSCC(=O)O Amb26415891 [0,2,0,0,0,0|1,0,1]=4 7248 B8R0.28 CC(=O)CSCC(C)C Amb9269384 [0,2,0,0,0,0|2,0,0]=4 7249 B8R0.28 CC(=O)CSCC(C)F Amb28135753 [0,2,0,0,0,0|2,0,0]=4 7250 B8R0.28 CC(=O)CSCC(C)O Amb27215204 [0,2,0,0,0,0|2,0,0]=4 7251 B8R0.28 CC(=O)CSCC(F)F Amb27956449 [0,2,0,0,0,0|2,0,0]=4 7252 B8R0.28 CC(=O)CSCC(N)=O Amb27411260 [0,2,0,0,0,0|1,0,1]=4 7253 B8R0.28 CC(=O)NCCC(=O)O Amb1104704 [0,2,0,0,0,0|1,0,1]=4 7254 B8R0.28 CC(=O)NCCC(C)Cl Amb27952422 [0,2,0,0,0,0|2,0,0]=4 7255 B8R0.28 CC(=O)NCCC(N)=O Amb8997734 [0,2,0,0,0,0|1,0,1]=4 7256 B8R0.28 CC(=O)NCCC(N)=S Amb17232012 [0,2,0,0,0,0|1,0,1]=4 7257 B8R0.28 CC(=O)OCCC(=O)O Amb18642866 [0,2,0,0,0,0|1,0,1]=4 7258 B8R0.28 CC(=O)OCCC(C)C Amb2793054 [0,2,0,0,0,0|2,0,0]=4 7259 B8R0.28 CC(=O)OCCC(C)O Amb26357497 [0,2,0,0,0,0|2,0,0]=4 7260 B8R0.28 CC(=O)OCCC(C)S Amb25077156 [0,2,0,0,0,0|2,0,0]=4 7261 B8R0.28 CC(=O)OCCC(N)=O Amb25921090 [0,2,0,0,0,0|1,0,1]=4 7262 B8R0.28 CC(=O)OCCN(C)C Amb8516593 [0,2,0,0,0,0|2,0,0]=4 7263 B8R0.28 CC(=O)OCCS(N)=O Amb32720403 [0,2,0,0,0,0|2,0,0]=4 7264 B8R0.28 CC(=O)OCC[C@H](C)O Amb28192682 [0,2,0,0,0,0|2,0,0]=4 7265 B8R0.28 CC(=O)SCCC(=O)O Amb17607685 [0,2,0,0,0,0|1,0,1]=4 7266 B8R0.28 CC(=O)SCCN(C)C Amb27607143 [0,2,0,0,0,0|2,0,0]=4 7267 B8R0.28 CC(C)=CCCC(=O)O Amb10601609 [0,2,0,0,0,0|1,0,1]=4 7268 B8R0.28 CC(C)=CCCC(C)N Amb3371996 [0,2,0,0,0,0|2,0,0]=4 7269 B8R0.28 CC(C)=CCC[C@@H](C)N Amb27404604 [0,2,0,0,0,0|2,0,0]=4 7270 B8R0.28 CC(C)=CCC[C@H](C)N Amb27162485 [0,2,0,0,0,0|2,0,0]=4 7271 B8R0.28 CC(C)C#CCC(=O)O Amb26516061 [0,2,0,0,0,0|1,0,1]=4 7272 B8R0.28 CC(C)CC#CC(=O)O Amb28398479 [0,2,0,0,0,0|1,0,1]=4 7273 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [0,2,0,0,0,0|1,0,0]=3 7274 B8R0.28 CC(C)CCNC(N)=O Amb1104833 [0,2,0,0,0,0|2,0,0]=4 7275 B8R0.28 CC(C)CCOC(=O)Cl Amb27463593 [0,2,0,0,0,0|2,0,0]=4 7276 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [0,2,0,0,0,0|2,0,0]=4 7277 B8R0.28 CC(C)CNCC(=O)O Amb19373106 [0,2,0,0,0,0|1,0,0]=3 7278 B8R0.28 CC(C)CNCC(=O)O Amb7766417 [0,2,0,0,0,0|1,0,0]=3 7279 B8R0.28 CC(C)CNCC(N)=O Amb1118171 [0,2,0,0,0,0|2,0,0]=4 7280 B8R0.28 CC(C)CNCC(N)=O Amb6892556 [0,2,0,0,0,0|2,0,0]=4 7281 B8R0.28 CC(C)COCC(=O)O Amb2608476 [0,2,0,0,0,0|1,0,0]=3 7282 B8R0.28 CC(C)CSCC(=O)O Amb1134811 [0,2,0,0,0,0|1,0,0]=3 7283 B8R0.28 CC(C)C\C=C\C(=O)O Amb8392407 [0,2,0,0,0,0|1,0,1]=4 7284 B8R0.28 CC(C)NCCC(=O)O Amb1106349 [0,2,0,0,0,0|1,0,0]=3 7285 B8R0.28 CC(C)NCCC(=O)O Amb528114 [0,2,0,0,0,0|1,0,0]=3 7286 B8R0.28 CC(C)NCCC(N)=O Amb8841611 [0,2,0,0,0,0|2,0,0]=4 7287 B8R0.28 CC(C)NCC[PH](=O)O Amb28056178 [0,2,0,0,0,0|2,0,0]=4 7288 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [0,2,0,0,0,0|2,0,0]=4 7289 B8R0.28 CC(C)OCCC(=O)O Amb6260272 [0,2,0,0,0,0|1,0,0]=3 7290 B8R0.28 CC(C)SCCC(=O)O Amb6267279 [0,2,0,0,0,0|1,0,0]=3 7291 B8R0.28 CC(C)\C=C\CC(=O)O Amb17844074 [0,2,0,0,0,0|1,0,1]=4 7292 B8R0.28 CC(Cl)CCCC(=O)Cl Amb26491427 [0,2,0,0,0,0|2,0,0]=4 7293 B8R0.28 CC(Cl)CCCC(N)=O Amb27869185 [0,2,0,0,0,0|2,0,0]=4 7294 B8R0.28 CC(F)CCCC(=O)O Amb28144031 [0,2,0,0,0,0|1,0,0]=3 7295 B8R0.28 CC(N)CCCC(=O)O Amb22059416 [0,2,0,0,0,0|0,0,0]=2 7296 B8R0.28 CC(N)CCCC(=O)O Amb28934990 [0,2,0,0,0,0|0,0,0]=2 7297 B8R0.28 CC(N)CSCC(=O)O Amb27221487 [0,2,0,0,0,0|0,0,0]=2 7298 B8R0.28 CC(N)C\C=C\C(=O)O Amb27863954 [0,2,0,0,0,0|0,0,1]=3 7299 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [0,2,0,0,0,0|1,0,0]=3 7300 B8R0.28 CC(O)CCCC(=O)[O-] Amb17615415 [0,2,0,0,0,0|1,0,1]=4 7301 B8R0.28 CC(O)CCCC(N)=S Amb27265713 [0,2,0,0,0,0|1,0,1]=4 7302 B8R0.28 CC(O)CCCN(C)C Amb24271102 [0,2,0,0,0,0|1,0,1]=4 7303 B8R0.28 CC(O)CNCC(=O)O Amb9359979 [0,2,0,0,0,0|1,0,0]=3 7304 B8R0.28 CC(O)CNCC(=O)[O-] Amb35789181 [0,2,0,0,0,0|1,0,1]=4 7305 B8R0.28 CC(O)COCC(=O)O Amb27968624 [0,2,0,0,0,0|1,0,0]=3 7306 B8R0.28 CC(O)COCC(N)=O Amb27216633 [0,2,0,0,0,0|2,0,0]=4 7307 B8R0.28 CC(O)CSCC(=O)O Amb19005278 [0,2,0,0,0,0|1,0,0]=3 7308 B8R0.28 CN(C)CCCB(O)O Amb24069054 [0,2,0,0,0,0|1,0,1]=4 7309 B8R0.28 CN(C)CCCC(=N)N Amb32751305 [0,2,0,0,0,0|2,0,0]=4 7310 B8R0.28 CN(C)CCCC(=N)N Amb6278287 [0,2,0,0,0,0|2,0,0]=4 7311 B8R0.28 CN(C)CCCC(=O)Cl Amb27450969 [0,2,0,0,0,0|1,0,0]=3 7312 B8R0.28 CN(C)CCCC(=O)Cl Amb32409435 [0,2,0,0,0,0|1,0,0]=3 7313 B8R0.28 CN(C)CCCC(=O)O Amb2716225 [0,2,0,0,0,0|0,0,0]=2 7314 B8R0.28 CN(C)CCCC(=O)O Amb9176338 [0,2,0,0,0,0|0,0,0]=2 7315 B8R0.28 CN(C)CCCC(N)=O Amb25887462 [0,2,0,0,0,0|1,0,0]=3 7316 B8R0.28 CN(C)CCCC(N)=S Amb6256460 [0,2,0,0,0,0|1,1,0]=4 7317 B8R0.28 CN(C)CCCN(C)O Amb33272648 [0,2,0,0,0,0|2,0,0]=4 7318 B8R0.28 CN(C)CCCS(=O)[O-] Amb32755542 [0,2,0,0,0,0|1,0,1]=4 7319 B8R0.28 CN(C)CCC[N+](=O)[O-] Amb26394292 [0,2,0,0,0,0|1,0,1]=4 7320 B8R0.28 CN(C)CCNC(N)=O Amb1129425 [0,2,0,0,0,0|2,0,0]=4 7321 B8R0.28 CN(C)CCNC(N)=O Amb33552131 [0,2,0,0,0,0|2,0,0]=4 7322 B8R0.28 CN(C)CCNC(O)=S Amb25106929 [0,2,0,0,0,0|1,1,0]=4 7323 B8R0.28 CN(C)CCOC(N)=O Amb28423955 [0,2,0,0,0,0|2,0,0]=4 7324 B8R0.28 CN(C)C\C=C/C(=O)O Amb26347338 [0,2,0,0,0,0|0,0,2]=4 7325 B8R0.28 CN(C)C\C=C\C(=O)O Amb15695416 [0,2,0,0,0,0|0,0,2]=4 7326 B8R0.28 CN(C)C\C=C\C(=O)O Amb33716600 [0,2,0,0,0,0|0,0,2]=4 7327 B8R0.28 CN(C)C\C=C\C(=O)O Amb8395946 [0,2,0,0,0,0|0,0,2]=4 7328 B8R0.28 CN(C)NCCC(N)=O Amb28072486 [0,2,0,0,0,0|2,0,0]=4 7329 B8R0.28 C[C@@H](O)CCCN(C)C Amb33272247 [0,2,0,0,0,0|1,0,1]=4 7330 B8R0.28 C[C@H](N)C\C=C\C(=O)O Amb27784845 [0,2,0,0,0,0|0,0,1]=3 7331 B8R0.28 C[C@H](N)\C=C\CC(=O)O Amb28044026 [0,2,0,0,0,0|0,0,1]=3 7332 B8R0.28 C[C@H](O)CCCN(C)C Amb33272243 [0,2,0,0,0,0|1,0,1]=4 7333 B8R0.28 C[C@H](O)CNCC(N)=O Amb27879357 [0,2,0,0,0,0|2,0,0]=4 7334 B8R0.28 C[C@H](O)C\C=C\C(=O)O Amb27812394 [0,2,0,0,0,0|1,0,1]=4 7335 B8R0.28 C[NH+](C)CCCC(=O)O Amb9786711 [0,2,0,0,0,0|0,0,1]=3 7336 B8R0.28 N=C(N)CCCC(=N)N Amb2696308 [0,2,0,0,0,0|2,0,0]=4 7337 B8R0.28 N=C(N)CSCC(=O)O Amb28040821 [0,2,0,0,0,0|0,0,1]=3 7338 B8R0.28 N=C(N)CSCC(N)=O Amb23313355 [0,2,0,0,0,0|1,0,1]=4 7339 B8R0.28 N=C(N)NCCC(=O)O Amb3940732 [0,2,0,0,0,0|0,0,1]=3 7340 B8R0.28 N=C(N)NCCC(N)=O Amb27215299 [0,2,0,0,0,0|1,0,1]=4 7341 B8R0.28 N=C(N)NCCS(=O)O Amb25103204 [0,2,0,0,0,0|1,0,1]=4 7342 B8R0.28 N=C(N)NNCC(=O)O Amb27394477 [0,2,0,0,0,0|1,0,1]=4 7343 B8R0.28 N=C(N)NOCC(=O)O Amb27165927 [0,2,0,0,0,0|1,0,1]=4 7344 B8R0.28 N=C(N)SCCC(=O)O Amb1043190 [0,2,0,0,0,0|0,0,1]=3 7345 B8R0.28 NC(=O)CCCC(=O)O Amb5718388 [0,2,0,0,0,0|0,0,0]=2 7346 B8R0.28 NC(=O)CCC[N+](=O)[O-] Amb22432425 [0,2,0,0,0,0|1,0,1]=4 7347 B8R0.28 NC(=O)CCSC(F)F Amb27809296 [0,2,0,0,0,0|2,0,0]=4 7348 B8R0.28 NC(=O)CCSC(N)=O Amb28045967 [0,2,0,0,0,0|1,0,1]=4 7349 B8R0.28 NC(=O)CNCC(N)=O Amb6714597 [0,2,0,0,0,0|1,0,1]=4 7350 B8R0.28 NC(=O)COCC(=O)O Amb3429648 [0,2,0,0,0,0|0,0,1]=3 7351 B8R0.28 NC(=O)COCC(N)=O Amb4442013 [0,2,0,0,0,0|1,0,1]=4 7352 B8R0.28 NC(=O)CSCC(=O)O Amb1128074 [0,2,0,0,0,0|0,0,1]=3 7353 B8R0.28 NC(=O)CSCC(N)=O Amb6374270 [0,2,0,0,0,0|1,0,1]=4 7354 B8R0.28 NC(=O)NCCC(=O)O Amb6567400 [0,2,0,0,0,0|0,0,1]=3 7355 B8R0.28 NC(=O)NOCC(=O)O Amb28285979 [0,2,0,0,0,0|1,0,1]=4 7356 B8R0.28 NC(=O)SCCC(=O)O Amb28340935 [0,2,0,0,0,0|0,0,1]=3 7357 B8R0.28 NC(=S)CCCC(=O)O Amb27956588 [0,2,0,0,0,0|0,0,0]=2 7358 B8R0.28 NC(=S)NCCC(=O)O Amb27815302 [0,2,0,0,0,0|0,0,1]=3 7359 B8R0.28 NC(=S)SCCC(=O)O Amb4007391 [0,2,0,0,0,0|0,0,1]=3 7360 B8R0.28 O=C(Cl)CCCC(=O)Cl Amb3940242 [0,2,0,0,0,0|2,0,0]=4 7361 B8R0.28 O=C(Cl)NCCC(F)F Amb35625886 [0,2,0,0,0,0|2,0,0]=4 7362 B8R0.28 O=C(F)NCCN(F)F Amb27948227 [0,2,0,0,0,0|2,0,0]=4 7363 B8R0.28 O=C(O)CCCC(=O)O Amb4037276 [0,2,0,0,0,0|1,0,0]=3 7364 B8R0.28 O=C(O)CCCC(F)F Amb24117996 [0,2,0,0,0,0|1,0,0]=3 7365 B8R0.28 O=C(O)CCCN(Cl)Cl Amb28313437 [0,2,0,0,0,0|0,0,0]=2 7366 B8R0.28 O=C(O)CCC[N+](=O)[O-] Amb24711043 [0,2,0,0,0,0|0,0,1]=3 7367 B8R0.28 O=C(O)CCO[N+](=O)[O-] Amb21953424 [0,2,0,0,0,0|1,0,1]=4 7368 B8R0.28 O=C(O)CCSC(F)F Amb8840854 [0,2,0,0,0,0|1,0,0]=3 7369 B8R0.28 O=C(O)CNCC(=O)O Amb3940364 [0,2,0,0,0,0|1,0,1]=4 7370 B8R0.28 O=C(O)COCC(=O)O Amb4433967 [0,2,0,0,0,0|1,0,1]=4 7371 B8R0.28 O=C(O)COCC(F)F Amb27218102 [0,2,0,0,0,0|1,0,0]=3 7372 B8R0.28 O=C(O)CSCC(=O)O Amb6608738 [0,2,0,0,0,0|1,0,1]=4 7373 B8R0.28 O=C(O)CSCC(F)F Amb18791606 [0,2,0,0,0,0|1,0,0]=3 7374 B8R0.28 O=C([O-])COCC(=O)O Amb9787328 [0,2,0,0,0,0|1,0,1]=4 7375 B8R0.12 C#CCC(C)(C)C(=O)O Amb18636154 [0,2,0,0,0,0|1,0,1]=4 7376 B8R0.12 C#CC[C@](C)(N)C(=O)O Amb16183909 [0,2,0,0,0,0|1,0,1]=4 7377 B8R0.12 C=C(C)C(C)(C)CCN Amb33199747 [0,2,0,0,0,0|2,0,0]=4 7378 B8R0.12 C=C(C)C(F)(F)CCN Amb32810025 [0,2,0,0,0,0|2,0,0]=4 7379 B8R0.12 C=CCC(C)(C)C(=O)O Amb10603495 [0,2,0,0,0,0|1,0,1]=4 7380 B8R0.12 C=CCC(F)(F)C(=O)O Amb10982503 [0,2,0,0,0,0|1,0,1]=4 7381 B8R0.12 C=CC[C@@](C)(N)C(=O)O Amb8389450 [0,2,0,0,0,0|1,0,1]=4 7382 B8R0.12 C=CC[C@@](C)(O)C(=O)O Amb27412350 [0,2,0,0,0,0|1,0,1]=4 7383 B8R0.12 C=CC[C@](C)(N)C(=O)O Amb8514992 [0,2,0,0,0,0|1,0,1]=4 7384 B8R0.12 C=CC[C@](C)(O)C(=O)O Amb27958223 [0,2,0,0,0,0|1,0,1]=4 7385 B8R0.12 CC(=O)C(C)(C)CCO Amb27838668 [0,2,0,0,0,0|2,0,0]=4 7386 B8R0.12 CC(=O)C(F)(F)CCO Amb27476544 [0,2,0,0,0,0|2,0,0]=4 7387 B8R0.12 CC(C)(CC#N)C(=O)O Amb33545085 [0,2,0,0,0,0|0,0,2]=4 7388 B8R0.12 CC(C)(CCCl)C(=O)Cl Amb25824469 [0,2,0,0,0,0|2,0,0]=4 7389 B8R0.12 CC(C)(CCCl)C(=O)O Amb27953901 [0,2,0,0,0,0|1,0,0]=3 7390 B8R0.12 CC(C)(CCF)C(=O)O Amb27838513 [0,2,0,0,0,0|1,0,0]=3 7391 B8R0.12 CC(C)(CCN)C(=O)O Amb2694929 [0,2,0,0,0,0|0,0,0]=2 7392 B8R0.12 CC(C)(CCN)C(=O)O Amb8630069 [0,2,0,0,0,0|0,0,0]=2 7393 B8R0.12 CC(C)(CCO)C(=O)O Amb24763728 [0,2,0,0,0,0|1,0,0]=3 7394 B8R0.12 CC(C)(CCO)C(=O)[O-] Amb29083409 [0,2,0,0,0,0|1,0,1]=4 7395 B8R0.12 CC(N)(CCCl)C(N)=O Amb25887461 [0,2,0,0,0,0|2,0,0]=4 7396 B8R0.12 CC(N)(CCF)C(=O)O Amb27961476 [0,2,0,0,0,0|1,0,0]=3 7397 B8R0.12 CC(N)(CCF)C(=O)O Amb28934998 [0,2,0,0,0,0|1,0,0]=3 7398 B8R0.12 CC(N)(CCO)C(N)=O Amb30013972 [0,2,0,0,0,0|2,0,0]=4 7399 B8R0.12 CC(O)(CC#N)C(=O)O Amb27260344 [0,2,0,0,0,0|0,0,2]=4 7400 B8R0.12 CC(O)(CCF)C(=O)O Amb33379277 [0,2,0,0,0,0|1,0,0]=3 7401 B8R0.12 CCCC(C)(Br)C(N)=O Amb28292478 [0,2,0,0,0,0|2,0,0]=4 7402 B8R0.12 CCCC(C)(C)C(=O)Cl Amb22168276 [0,2,0,0,0,0|2,0,0]=4 7403 B8R0.12 CCCC(C)(C)C(=O)O Amb2720786 [0,2,0,0,0,0|1,0,0]=3 7404 B8R0.12 CCCC(C)(C)C(C)=O Amb26026773 [0,2,0,0,0,0|2,0,0]=4 7405 B8R0.12 CCCC(C)(C)C(N)=O Amb25887199 [0,2,0,0,0,0|2,0,0]=4 7406 B8R0.12 CCCC(C)(Cl)C(=O)O Amb17593751 [0,2,0,0,0,0|1,0,0]=3 7407 B8R0.12 CCCC(C)(F)C(=O)O Amb27797327 [0,2,0,0,0,0|1,0,0]=3 7408 B8R0.12 CCCC(C)(N)C(=O)O Amb9720287 [0,2,0,0,0,0|1,0,0]=3 7409 B8R0.12 CCCC(C)(O)C(=O)O Amb18288835 [0,2,0,0,0,0|1,0,0]=3 7410 B8R0.12 CCCC(C)(O)C(C)=O Amb26490520 [0,2,0,0,0,0|2,0,0]=4 7411 B8R0.12 CCCC(C)(O)C(N)=O Amb24116806 [0,2,0,0,0,0|2,0,0]=4 7412 B8R0.12 CCCC(Cl)(Cl)C(=O)O Amb2720219 [0,2,0,0,0,0|1,0,0]=3 7413 B8R0.12 CCCC(Cl)(Cl)C(C)=O Amb26875052 [0,2,0,0,0,0|2,0,0]=4 7414 B8R0.12 CCCC(F)(F)C(=O)Cl Amb27420905 [0,2,0,0,0,0|2,0,0]=4 7415 B8R0.12 CCCC(F)(F)C(=O)O Amb19929277 [0,2,0,0,0,0|1,0,0]=3 7416 B8R0.12 CCC[C@@](C)(N)C(=O)O Amb2699127 [0,2,0,0,0,0|1,0,0]=3 7417 B8R0.12 CCC[C@](C)(N)C(=O)O Amb16232632 [0,2,0,0,0,0|1,0,0]=3 7418 B8R0.12 CCNC(C)(C)C(=O)O Amb13952777 [0,2,0,0,0,0|2,0,0]=4 7419 B8R0.12 CCNC(C)(C)C(=O)O Amb9619876 [0,2,0,0,0,0|2,0,0]=4 7420 B8R0.12 CCOC(C)(C)C(=O)O Amb18976723 [0,2,0,0,0,0|2,0,0]=4 7421 B8R0.12 CCOC(Cl)(Cl)C(=O)O Amb27422864 [0,2,0,0,0,0|2,0,0]=4 7422 B8R0.12 CCSC(C)(C)C(=O)O Amb17501487 [0,2,0,0,0,0|2,0,0]=4 7423 B8R0.12 CCSC(F)(F)C(=O)O Amb28182780 [0,2,0,0,0,0|2,0,0]=4 7424 B8R0.12 CNCC(C)(C)C(=O)O Amb26557784 [0,2,0,0,0,0|2,0,0]=4 7425 B8R0.12 CNCC(C)(C)C(=O)O Amb33249638 [0,2,0,0,0,0|2,0,0]=4 7426 B8R0.12 CNCC(C)(O)C(=O)O Amb27478763 [0,2,0,0,0,0|2,0,0]=4 7427 B8R0.12 CNCC(F)(F)C(=O)O Amb22497225 [0,2,0,0,0,0|2,0,0]=4 7428 B8R0.12 CNCC(F)(F)C(=O)O Amb22523480 [0,2,0,0,0,0|2,0,0]=4 7429 B8R0.12 CNC[C@@](C)(N)C(=O)O Amb27975719 [0,2,0,0,0,0|2,0,0]=4 7430 B8R0.12 CNC[C@](C)(N)C(=O)O Amb25882845 [0,2,0,0,0,0|2,0,0]=4 7431 B8R0.12 COCC(C)(C)C(=O)O Amb10608195 [0,2,0,0,0,0|2,0,0]=4 7432 B8R0.12 COCC(C)(N)C(=O)O Amb18990135 [0,2,0,0,0,0|2,0,0]=4 7433 B8R0.12 COCC(C)(N)C(=O)O Amb20622455 [0,2,0,0,0,0|2,0,0]=4 7434 B8R0.12 COCC(C)(O)C(=O)O Amb18992608 [0,2,0,0,0,0|2,0,0]=4 7435 B8R0.12 COCC(F)(F)C(=O)O Amb24518571 [0,2,0,0,0,0|2,0,0]=4 7436 B8R0.12 COC[C@](C)(N)C(=O)O Amb24568285 [0,2,0,0,0,0|2,0,0]=4 7437 B8R0.12 CSCC(C)(C)C(=O)O Amb18124874 [0,2,0,0,0,0|2,0,0]=4 7438 B8R0.12 CSCC(C)(N)C(=O)O Amb18294541 [0,2,0,0,0,0|2,0,0]=4 7439 B8R0.12 CSCC(F)(F)C(=O)O Amb23590987 [0,2,0,0,0,0|2,0,0]=4 7440 B8R0.12 C[C@@](N)(CCO)C(=O)O Amb28048736 [0,2,0,0,0,0|1,0,0]=3 7441 B8R0.12 C[C@](N)(CCN)C(=O)O Amb25348479 [0,2,0,0,0,0|0,0,0]=2 7442 B8R0.12 N#CCC(F)(F)C(=O)O Amb27186473 [0,2,0,0,0,0|0,0,2]=4 7443 B8R0.12 NC(=O)C(Cl)(Cl)CCCl Amb27471978 [0,2,0,0,0,0|2,0,0]=4 7444 B8R0.12 NCCC(F)(F)C(=O)O Amb2697352 [0,2,0,0,0,0|0,0,0]=2 7445 B8R0.12 NCCC(F)(F)C(=O)O Amb31378944 [0,2,0,0,0,0|0,0,0]=2 7446 B8R0.12 NOCC(F)(F)C(=O)O Amb33171236 [0,2,0,0,0,0|1,0,0]=3 7447 B8R0.12 O=C(O)C(F)(F)CCF Amb32811300 [0,2,0,0,0,0|1,0,0]=3 7448 B8R0.12 O=C(O)C(F)(F)CNO Amb33170566 [0,2,0,0,0,0|2,0,0]=4 7449 B8R0.14 CC(CCN)S(=O)(=O)O Amb27231740 [0,2,0,0,0,0|1,0,0]=3 7450 B8R0.14 CC(CCN)S(C)(=O)=O Amb18251316 [0,2,0,0,0,0|1,0,1]=4 7451 B8R0.14 CC(CCO)P(=O)(O)O Amb28125457 [0,2,0,0,0,0|2,0,0]=4 7452 B8R0.14 CCCC(N)P(=O)(O)O Amb8516011 [0,2,0,0,0,0|2,0,0]=4 7453 B8R0.14 CCCC(N)S(=O)(=O)O Amb28075743 [0,2,0,0,0,0|2,0,0]=4 7454 B8R0.14 CCCC(O)P(=O)(O)O Amb26480670 [0,2,0,0,0,0|2,0,0]=4 7455 B8R0.14 CCCC(O)P(C)(=O)O Amb28315561 [0,2,0,0,0,0|2,0,0]=4 7456 B8R0.14 CCC[C@@H](O)P(=O)(O)O Amb27172583 [0,2,0,0,0,0|2,0,0]=4 7457 B8R0.14 C[C@H](CCO)P(=O)(O)O Amb27765916 [0,2,0,0,0,0|2,0,0]=4 7458 B8R0.14 N[C@@H](CCO)P(=O)(O)O Amb27424703 [0,2,0,0,0,0|2,0,0]=4 7459 B8R0.14 O=P(O)(O)[C@@H](O)CCF Amb27766537 [0,2,0,0,0,0|2,0,0]=4 7460 B8R0.15 C#CCC(C#N)C(=O)O Amb35741463 [0,2,0,0,0,0|1,0,1]=4 7461 B8R0.15 C#CC[C@H](CC)C(=O)O Amb28120786 [0,2,0,0,0,0|1,0,1]=4 7462 B8R0.15 C=C=C(CCC)C(=O)O Amb28045352 [0,2,0,0,0,0|1,0,1]=4 7463 B8R0.15 C=CC(SCC)C(=O)O Amb27757608 [0,2,0,0,0,0|2,0,0]=4 7464 B8R0.15 C=CCC(C#N)C(=O)O Amb27657209 [0,2,0,0,0,0|1,0,1]=4 7465 B8R0.15 C=CCC(C=O)C(=O)O Amb28313315 [0,2,0,0,0,0|1,0,1]=4 7466 B8R0.15 C=CCC(CC)C(=O)O Amb18642632 [0,2,0,0,0,0|1,0,1]=4 7467 B8R0.15 C=CCC(NO)C(=O)O Amb27768789 [0,2,0,0,0,0|1,0,1]=4 7468 B8R0.15 C=CC[C@@H](C=C)C(=O)O Amb28285259 [0,2,0,0,0,0|1,0,1]=4 7469 B8R0.15 C=C[C@@H](CCC)C(=O)O Amb27658640 [0,2,0,0,0,0|1,0,0]=3 7470 B8R0.15 CCC(CCF)C(=O)O Amb26321627 [0,2,0,0,0,0|1,0,0]=3 7471 B8R0.15 CCC(CCN)C(=O)O Amb24699884 [0,2,0,0,0,0|0,0,0]=2 7472 B8R0.15 CCC(CCN)C(=O)O Amb32662662 [0,2,0,0,0,0|0,0,0]=2 7473 B8R0.15 CCC(CCN)S(C)=O Amb27873664 [0,2,0,0,0,0|2,0,0]=4 7474 B8R0.15 CCC(CCO)C(=O)O Amb18642884 [0,2,0,0,0,0|1,0,0]=3 7475 B8R0.15 CCC(COC)C(=O)O Amb18124352 [0,2,0,0,0,0|2,0,0]=4 7476 B8R0.15 CCC(CSC)C(=O)O Amb33272061 [0,2,0,0,0,0|2,0,0]=4 7477 B8R0.15 CCCC(C#N)C(C)=O Amb24053569 [0,2,0,0,0,0|2,0,0]=4 7478 B8R0.15 CCCC(C=O)C(=O)O Amb27464964 [0,2,0,0,0,0|1,0,0]=3 7479 B8R0.15 CCCC(CBr)C(=O)Cl Amb27639323 [0,2,0,0,0,0|2,0,0]=4 7480 B8R0.15 CCCC(CC)C(=O)O Amb19009626 [0,2,0,0,0,0|1,0,0]=3 7481 B8R0.15 CCCC(CF)C(=O)O Amb27186472 [0,2,0,0,0,0|1,0,0]=3 7482 B8R0.15 CCCC(CN)C(=O)O Amb19373497 [0,2,0,0,0,0|1,0,0]=3 7483 B8R0.15 CCCC(CO)C(=O)O Amb25881510 [0,2,0,0,0,0|1,0,0]=3 7484 B8R0.15 CCCC(NC)C(=O)O Amb21961534 [0,2,0,0,0,0|1,0,0]=3 7485 B8R0.15 CCCC(NC)C(=O)O Amb22587444 [0,2,0,0,0,0|1,0,0]=3 7486 B8R0.15 CCCC(NC)C(=O)O Amb9496293 [0,2,0,0,0,0|1,0,0]=3 7487 B8R0.15 CCCC(NC)C(N)=O Amb19006602 [0,2,0,0,0,0|2,0,0]=4 7488 B8R0.15 CCCC(NO)C(=O)O Amb22372057 [0,2,0,0,0,0|1,0,0]=3 7489 B8R0.15 CCCC(OC)C(=O)O Amb8455302 [0,2,0,0,0,0|1,0,0]=3 7490 B8R0.15 CCCC(OC)C(C)=O Amb27207958 [0,2,0,0,0,0|2,0,0]=4 7491 B8R0.15 CCCC(SC)C(=O)O Amb28289849 [0,2,0,0,0,0|1,0,0]=3 7492 B8R0.15 CCC[C@@H](CO)C(=O)O Amb24571859 [0,2,0,0,0,0|1,0,0]=3 7493 B8R0.15 CCC[C@@H](NC)C(=O)O Amb25771939 [0,2,0,0,0,0|1,0,0]=3 7494 B8R0.15 CCC[C@@H](NC)C(=O)O Amb33801471 [0,2,0,0,0,0|1,0,0]=3 7495 B8R0.15 CCC[C@H](CN)C(=O)O Amb27460612 [0,2,0,0,0,0|1,0,0]=3 7496 B8R0.15 CCC[C@H](CO)C(=O)O Amb25063310 [0,2,0,0,0,0|1,0,0]=3 7497 B8R0.15 CCC[C@H](NC)C(=O)O Amb25062610 [0,2,0,0,0,0|1,0,0]=3 7498 B8R0.15 CCC[C@H](NC)C(=O)O Amb33456398 [0,2,0,0,0,0|1,0,0]=3 7499 B8R0.15 CCC[C@H](NC)C(N)=O Amb27475077 [0,2,0,0,0,0|2,0,0]=4 7500 B8R0.15 CCN(CCN)C(C)=O Amb17046897 [0,2,0,0,0,0|2,0,0]=4 7501 B8R0.15 CCNC(CC)C(=O)O Amb33339265 [0,2,0,0,0,0|2,0,0]=4 7502 B8R0.15 CCNC(CC)C(=O)O Amb9620054 [0,2,0,0,0,0|2,0,0]=4 7503 B8R0.15 CCN[C@@H](CC)C(=O)O Amb26019582 [0,2,0,0,0,0|2,0,0]=4 7504 B8R0.15 CCN[C@H](CC)C(=O)O Amb33347493 [0,2,0,0,0,0|2,0,0]=4 7505 B8R0.15 CCOC(CC)C(=O)O Amb9675410 [0,2,0,0,0,0|2,0,0]=4 7506 B8R0.15 CCOC(CS)C(=O)O Amb19037339 [0,2,0,0,0,0|2,0,0]=4 7507 B8R0.15 CCSC(CC)C(=O)O Amb9675503 [0,2,0,0,0,0|2,0,0]=4 7508 B8R0.15 CC[C@H](CCN)C(=O)O Amb27754665 [0,2,0,0,0,0|0,0,0]=2 7509 B8R0.15 CNC(CCO)C(=O)O Amb27390592 [0,2,0,0,0,0|1,0,0]=3 7510 B8R0.15 CNC(COC)C(=O)O Amb19304133 [0,2,0,0,0,0|2,0,0]=4 7511 B8R0.15 CNC(COC)C(=O)O Amb22059040 [0,2,0,0,0,0|2,0,0]=4 7512 B8R0.15 CNCC(C#N)C(=O)O Amb25756304 [0,2,0,0,0,0|2,0,0]=4 7513 B8R0.15 CNCC(CO)C(=O)O Amb26352745 [0,2,0,0,0,0|2,0,0]=4 7514 B8R0.15 CNCC(CO)C(=O)O Amb32661056 [0,2,0,0,0,0|2,0,0]=4 7515 B8R0.15 CN[C@H](COC)C(=O)O Amb33347473 [0,2,0,0,0,0|2,0,0]=4 7516 B8R0.15 COC(CC#N)C(=O)O Amb27157791 [0,2,0,0,0,0|0,0,2]=4 7517 B8R0.15 COC(CCF)C(=O)O Amb33379286 [0,2,0,0,0,0|1,0,0]=3 7518 B8R0.15 COC(CCN)C(=O)O Amb26631814 [0,2,0,0,0,0|0,0,0]=2 7519 B8R0.15 COC(CCN)C(=O)O Amb32661022 [0,2,0,0,0,0|0,0,0]=2 7520 B8R0.15 COCC(CN)C(=O)O Amb27219429 [0,2,0,0,0,0|2,0,0]=4 7521 B8R0.15 COCC(NO)C(=O)O Amb27247213 [0,2,0,0,0,0|2,0,0]=4 7522 B8R0.15 COCC(OC)C(=O)O Amb26627988 [0,2,0,0,0,0|2,0,0]=4 7523 B8R0.15 COCC(ON)C(=O)O Amb27251693 [0,2,0,0,0,0|2,0,0]=4 7524 B8R0.15 COCC(ON)C(=O)O Amb32670944 [0,2,0,0,0,0|2,0,0]=4 7525 B8R0.15 COCC(SC)C(=O)O Amb28046503 [0,2,0,0,0,0|2,0,0]=4 7526 B8R0.15 CSCC(CN)C(=O)O Amb33272062 [0,2,0,0,0,0|2,0,0]=4 7527 B8R0.15 C\C=C(/CCN)C(=O)O Amb27493438 [0,2,0,0,0,0|0,0,1]=3 7528 B8R0.15 N#CC(CCF)C(=O)O Amb35741465 [0,2,0,0,0,0|1,0,0]=3 7529 B8R0.15 N#CC(CCO)C(=O)O Amb35741464 [0,2,0,0,0,0|1,0,0]=3 7530 B8R0.15 N#CCC(C#N)C(=O)O Amb35621636 [0,2,0,0,0,0|0,0,2]=4 7531 B8R0.15 NCC(CCF)C(=O)O Amb33196465 [0,2,0,0,0,0|1,0,0]=3 7532 B8R0.15 NC\C=C(/CO)C(=O)O Amb27214653 [0,2,0,0,0,0|0,0,2]=4 7533 B8R0.15 O=C(O)C(CO)CCF Amb27876842 [0,2,0,0,0,0|1,0,0]=3 7534 B8R0.15 O=C(O)C(CS)CCS Amb27477377 [0,2,0,0,0,0|1,0,0]=3 7535 B8R0.15 O=C(O)[C@H](CS)NCO Amb27980938 [0,2,0,0,0,0|2,0,0]=4 7536 B8R0.29 C=C(C)CCC(C)(C)N Amb33200278 [0,2,0,0,0,0|2,0,0]=4 7537 B8R0.29 CC(=O)CCC(C)(C)C Amb27481983 [0,2,0,0,0,0|2,0,0]=4 7538 B8R0.29 CC(=O)CCC(C)(C)Cl Amb27260509 [0,2,0,0,0,0|2,0,0]=4 7539 B8R0.29 CC(=O)CCC(C)(C)F Amb26512496 [0,2,0,0,0,0|2,0,0]=4 7540 B8R0.29 CC(=O)CCC(C)(C)O Amb26961451 [0,2,0,0,0,0|2,0,0]=4 7541 B8R0.29 CC(=O)CCC(C)(F)F Amb26479040 [0,2,0,0,0,0|2,0,0]=4 7542 B8R0.29 CC(=O)CCC(F)(F)F Amb24055935 [0,2,0,0,0,0|2,0,0]=4 7543 B8R0.29 CC(=O)NCC(C)(C)N Amb18642812 [0,2,0,0,0,0|2,0,0]=4 7544 B8R0.29 CC(C)(Br)CCC(=O)O Amb27402242 [0,2,0,0,0,0|1,0,0]=3 7545 B8R0.29 CC(C)(C)CCC(=O)Cl Amb25105178 [0,2,0,0,0,0|2,0,0]=4 7546 B8R0.29 CC(C)(C)CCC(=O)O Amb8467936 [0,2,0,0,0,0|1,0,0]=3 7547 B8R0.29 CC(C)(C)CCC(N)=O Amb28349074 [0,2,0,0,0,0|2,0,0]=4 7548 B8R0.29 CC(C)(C)NCC(=O)O Amb10610332 [0,2,0,0,0,0|2,0,0]=4 7549 B8R0.29 CC(C)(C)NCC(=O)O Amb7766549 [0,2,0,0,0,0|2,0,0]=4 7550 B8R0.29 CC(C)(C)OCC(=O)O Amb2691328 [0,2,0,0,0,0|2,0,0]=4 7551 B8R0.29 CC(C)(C)SCC(=O)O Amb433078 [0,2,0,0,0,0|2,0,0]=4 7552 B8R0.29 CC(C)(C)[NH2+]CC(=O)O Amb2695316 [0,2,0,0,0,0|2,0,0]=4 7553 B8R0.29 CC(C)(Cl)CCC(=O)O Amb18644451 [0,2,0,0,0,0|1,0,0]=3 7554 B8R0.29 CC(C)(F)CCC(=O)O Amb26316862 [0,2,0,0,0,0|1,0,0]=3 7555 B8R0.29 CC(C)(F)OCC(=O)O Amb33225288 [0,2,0,0,0,0|2,0,0]=4 7556 B8R0.29 CC(C)(N)CCC(=O)O Amb13951332 [0,2,0,0,0,0|0,0,0]=2 7557 B8R0.29 CC(C)(N)CCC(=O)O Amb6740013 [0,2,0,0,0,0|0,0,0]=2 7558 B8R0.29 CC(C)(N)CNC(N)=O Amb8631174 [0,2,0,0,0,0|2,0,0]=4 7559 B8R0.29 CC(C)(N)CNC(N)=O Amb8631175 [0,2,0,0,0,0|2,0,0]=4 7560 B8R0.29 CC(C)(N)\C=C\C(=O)O Amb26640960 [0,2,0,0,0,0|0,0,2]=4 7561 B8R0.29 CC(C)(O)CCC(=O)[O-] Amb33552947 [0,2,0,0,0,0|1,0,1]=4 7562 B8R0.29 CC(C)(O)CCC(N)=O Amb27667598 [0,2,0,0,0,0|2,0,0]=4 7563 B8R0.29 CC(C)(S)CCC(=O)O Amb22489759 [0,2,0,0,0,0|1,0,0]=3 7564 B8R0.29 CC(C)CCS(=O)(=O)O Amb26996755 [0,2,0,0,0,0|2,0,0]=4 7565 B8R0.29 CC(F)(F)CCC(=O)O Amb6252611 [0,2,0,0,0,0|1,0,0]=3 7566 B8R0.29 CC(F)(F)OCC(=O)O Amb32809085 [0,2,0,0,0,0|2,0,0]=4 7567 B8R0.29 CC(N)CCP(=O)(O)O Amb27392223 [0,2,0,0,0,0|1,0,0]=3 7568 B8R0.29 CC(N)CCS(=O)(=O)F Amb33463870 [0,2,0,0,0,0|1,0,1]=4 7569 B8R0.29 CC(N)CCS(C)(=O)=O Amb18300587 [0,2,0,0,0,0|1,0,1]=4 7570 B8R0.29 CC(O)CCC(C)(C)N Amb18642848 [0,2,0,0,0,0|1,0,1]=4 7571 B8R0.29 CP(=O)(O)CCC(=O)O Amb1792559 [0,2,0,0,0,0|2,0,0]=4 7572 B8R0.29 CS(=O)(=O)CCC(=O)O Amb6275720 [0,2,0,0,0,0|2,0,0]=4 7573 B8R0.29 C[C@@H](N)CCP(C)(=O)Cl Amb28119076 [0,2,0,0,0,0|2,0,0]=4 7574 B8R0.29 C[C@@H](N)CCS(C)(=O)=O Amb33411441 [0,2,0,0,0,0|1,0,1]=4 7575 B8R0.29 C[C@@H](N)COS(=O)(=O)O Amb27598040 [0,2,0,0,0,0|2,0,0]=4 7576 B8R0.29 C[C@H](N)CCS(C)(=O)=O Amb33481789 [0,2,0,0,0,0|1,0,1]=4 7577 B8R0.29 C[N+](C)(C)CCC(=O)O Amb24117222 [0,2,0,0,0,0|2,0,0]=4 7578 B8R0.29 C[N+](C)(C)CCC(=O)O Amb33803200 [0,2,0,0,0,0|2,0,0]=4 7579 B8R0.29 C[N+](C)(N)CCC(=O)O Amb27878681 [0,2,0,0,0,0|1,0,0]=3 7580 B8R0.29 NC(=O)CCC(Cl)(Cl)Cl Amb27424705 [0,2,0,0,0,0|2,0,0]=4 7581 B8R0.29 NC(=O)CCC(F)(F)F Amb2702583 [0,2,0,0,0,0|2,0,0]=4 7582 B8R0.29 NS(=O)(=O)CCC(=O)O Amb6741826 [0,2,0,0,0,0|1,0,0]=3 7583 B8R0.29 NS(=O)(=O)NCC(=O)O Amb6277125 [0,2,0,0,0,0|2,0,0]=4 7584 B8R0.29 O=C(Br)CCC(F)(F)F Amb22360324 [0,2,0,0,0,0|2,0,0]=4 7585 B8R0.29 O=C(Cl)CCC(F)(F)F Amb19737369 [0,2,0,0,0,0|2,0,0]=4 7586 B8R0.29 O=C(O)CCC(Cl)(Cl)Cl Amb2725076 [0,2,0,0,0,0|1,0,0]=3 7587 B8R0.29 O=C(O)CCC(F)(F)Br Amb10838819 [0,2,0,0,0,0|1,0,0]=3 7588 B8R0.29 O=C(O)CCC(F)(F)Cl Amb27848419 [0,2,0,0,0,0|1,0,0]=3 7589 B8R0.29 O=C(O)CCC(F)(F)F Amb2778697 [0,2,0,0,0,0|1,0,0]=3 7590 B8R0.29 O=C(O)CCP(=O)(O)O Amb2228990 [0,2,0,0,0,0|2,0,0]=4 7591 B8R0.29 O=C(O)CCS(=O)(=O)O Amb17399954 [0,2,0,0,0,0|2,0,0]=4 7592 B8R0.29 O=C(O)CCS(=O)(=O)[O-] Amb28960294 [0,2,0,0,0,0|2,0,0]=4 7593 B8R0.29 O=C(O)COC(F)(F)F Amb9677564 [0,2,0,0,0,0|2,0,0]=4 7594 B8R0.29 O=C(O)CSC(F)(F)F Amb4443073 [0,2,0,0,0,0|2,0,0]=4 7595 B6R1.2 BrC1=CCCC1 Amb10067271 [1,0,0,1,0,0|2,0,0]=4 7596 B6R1.2 BrC1=CCCO1 Amb24322605 [1,0,0,1,0,0|1,0,1]=4 7597 B6R1.2 BrC1CCCO1 Amb24322808 [1,0,0,1,0,0|1,0,1]=4 7598 B6R1.2 C=C1CCCC1 Amb22337671 [1,0,0,1,0,0|2,0,0]=4 7599 B6R1.2 C=C1CCCS1 Amb28137153 [1,0,0,1,0,0|1,1,0]=4 7600 B6R1.2 C=C1CCNC1 Amb22490848 [1,0,0,1,0,0|2,0,0]=4 7601 B6R1.2 C=C1CCNC1 Amb27782898 [1,0,0,1,0,0|2,0,0]=4 7602 B6R1.2 C=C1OCCO1 Amb24477046 [1,0,0,1,0,0|2,0,0]=4 7603 B6R1.2 CC1=CCCC1 Amb8513250 [1,0,0,1,0,0|2,0,0]=4 7604 B6R1.2 CC1=CCCO1 Amb20621083 [1,0,0,1,0,0|1,0,1]=4 7605 B6R1.2 CC1=NCCC1 Amb8513341 [1,0,0,1,0,0|2,0,0]=4 7606 B6R1.2 CC1=NCCO1 Amb8395082 [1,0,0,1,0,0|2,0,0]=4 7607 B6R1.2 CC1=NNCC1 Amb8492492 [1,0,0,1,0,0|2,0,0]=4 7608 B6R1.2 CC1CCCO1 Amb8385612 [1,0,0,1,0,0|1,0,1]=4 7609 B6R1.2 CC1CCNO1 Amb27209819 [1,0,0,1,0,0|1,0,1]=4 7610 B6R1.2 ClC1=NCCO1 Amb8396614 [1,0,0,1,0,0|2,0,0]=4 7611 B6R1.2 IC1=CCCC1 Amb24332192 [1,0,0,1,0,0|2,0,0]=4 7612 B6R1.2 IC1=CCCO1 Amb24322816 [1,0,0,1,0,0|1,0,1]=4 7613 B6R1.2 N=C1CCCN1 Amb2371632 [1,0,0,1,0,0|2,0,0]=4 7614 B6R1.2 N=C1CCCN1 Amb501585 [1,0,0,1,0,0|2,0,0]=4 7615 B6R1.2 N=C1CCCS1 Amb10072429 [1,0,0,1,0,0|1,1,0]=4 7616 B6R1.2 N=C1CCCS1 Amb9825646 [1,0,0,1,0,0|1,1,0]=4 7617 B6R1.2 N=C1NCCO1 Amb20623979 [1,0,0,1,0,0|2,0,0]=4 7618 B6R1.2 NC1=NCCC1 Amb10976565 [1,0,0,1,0,0|2,0,0]=4 7619 B6R1.2 NC1=NCCC1 Amb8342250 [1,0,0,1,0,0|2,0,0]=4 7620 B6R1.2 NC1=NCCO1 Amb24325166 [1,0,0,1,0,0|2,0,0]=4 7621 B6R1.2 NC1=NNCC1 Amb22330617 [1,0,0,1,0,0|2,0,0]=4 7622 B6R1.2 NC1=NNCC1 Amb28555323 [1,0,0,1,0,0|2,0,0]=4 7623 B6R1.2 NC1CCCO1 Amb16233703 [1,0,0,1,0,0|1,0,1]=4 7624 B6R1.2 O=C1C=CCC1 Amb4019519 [1,0,0,1,0,0|1,0,1]=4 7625 B6R1.2 O=C1C=CCO1 Amb2792769 [1,0,0,1,0,0|0,0,2]=4 7626 B6R1.2 O=C1C=NCO1 Amb25786221 [1,0,0,1,0,0|1,0,1]=4 7627 B6R1.2 O=C1CC=NO1 Amb27654112 [1,0,0,1,0,0|0,0,2]=4 7628 B6R1.2 O=C1CCCC1 Amb2793024 [1,0,0,1,0,0|1,0,0]=3 7629 B6R1.2 O=C1CCCN1 Amb22169686 [1,0,0,1,0,0|1,0,0]=3 7630 B6R1.2 O=C1CCCN1 Amb6608645 [1,0,0,1,0,0|1,0,0]=3 7631 B6R1.2 O=C1CCCO1 Amb3940401 [1,0,0,1,0,0|0,0,0]=2 7632 B6R1.2 O=C1CCCS1 Amb22338102 [1,0,0,1,0,0|0,1,0]=3 7633 B6R1.2 O=C1CCNC1 Amb2700623 [1,0,0,1,0,0|1,0,0]=3 7634 B6R1.2 O=C1CCNC1 Amb8386645 [1,0,0,1,0,0|1,0,0]=3 7635 B6R1.2 O=C1CCNN1 Amb33551041 [1,0,0,1,0,0|1,0,0]=3 7636 B6R1.2 O=C1CCNN1 Amb3428540 [1,0,0,1,0,0|1,0,0]=3 7637 B6R1.2 O=C1CCOC1 Amb7990143 [1,0,0,1,0,0|2,0,0]=4 7638 B6R1.2 O=C1CCON1 Amb22235009 [1,0,0,1,0,0|2,0,0]=4 7639 B6R1.2 O=C1CCSC1 Amb2720904 [1,0,0,1,0,0|2,0,0]=4 7640 B6R1.2 O=C1CNCN1 Amb19957368 [1,0,0,1,0,0|2,0,0]=4 7641 B6R1.2 O=C1CNCS1 Amb27443758 [1,0,0,1,0,0|1,1,0]=4 7642 B6R1.2 O=C1COCN1 Amb28132686 [1,0,0,1,0,0|2,0,0]=4 7643 B6R1.2 O=C1CSCN1 Amb28187121 [1,0,0,1,0,0|2,0,0]=4 7644 B6R1.2 O=C1NCCN1 Amb6357221 [1,0,0,1,0,0|2,0,0]=4 7645 B6R1.2 O=C1NCCN1 Amb6608941 [1,0,0,1,0,0|2,0,0]=4 7646 B6R1.2 O=C1NCCO1 Amb6608807 [1,0,0,1,0,0|1,0,0]=3 7647 B6R1.2 O=C1NCCS1 Amb431322 [1,0,0,1,0,0|1,1,0]=4 7648 B6R1.2 O=C1OCCO1 Amb4057710 [1,0,0,1,0,0|1,0,0]=3 7649 B6R1.2 O=C1OCCS1 Amb27398683 [1,0,0,1,0,0|1,0,0]=3 7650 B6R1.2 O=S1CCCC1 Amb2690579 [1,0,0,1,0,0|2,0,0]=4 7651 B6R1.2 O=S1CCNC1 Amb28075495 [1,0,0,1,0,0|2,0,0]=4 7652 B6R1.2 O=S1OCCO1 Amb8383890 [1,0,0,1,0,0|2,0,0]=4 7653 B6R1.2 O=[PH]1CCCC1 Amb33804724 [1,0,0,1,0,0|2,0,0]=4 7654 B6R1.2 O=[PH]1OCCO1 Amb22346149 [1,0,0,1,0,0|2,0,0]=4 7655 B6R1.2 OC1=NNCC1 Amb2111955 [1,0,0,1,0,0|1,0,0]=3 7656 B6R1.2 OC1=NNCC1 Amb844737 [1,0,0,1,0,0|1,0,0]=3 7657 B6R1.2 OC1CCCC1 Amb3939016 [1,0,0,1,0,0|1,0,1]=4 7658 B6R1.2 OC1CCCN1 Amb28120620 [1,0,0,1,0,0|1,0,1]=4 7659 B6R1.2 OC1CCCO1 Amb17615892 [1,0,0,1,0,0|0,0,2]=4 7660 B6R1.2 OC1CCCS1 Amb27864587 [1,0,0,1,0,0|0,1,1]=4 7661 B6R1.2 OC1CCNC1 Amb22436788 [1,0,0,1,0,0|1,0,1]=4 7662 B6R1.2 OC1CCNC1 Amb2688790 [1,0,0,1,0,0|1,0,1]=4 7663 B6R1.2 OC1CCNC1 Amb2690449 [1,0,0,1,0,0|1,0,1]=4 7664 B6R1.2 ON1CCCC1 Amb30988006 [1,0,0,1,0,0|2,0,0]=4 7665 B6R1.2 ON1CCCC1 Amb4035438 [1,0,0,1,0,0|2,0,0]=4 7666 B6R1.2 O[C@@H]1CCNC1 Amb2688791 [1,0,0,1,0,0|1,0,1]=4 7667 B6R1.2 O[C@@H]1CCNC1 Amb3939360 [1,0,0,1,0,0|1,0,1]=4 7668 B6R1.2 O[C@H]1CCNC1 Amb2688792 [1,0,0,1,0,0|1,0,1]=4 7669 B6R1.2 O[C@H]1CCNC1 Amb33716680 [1,0,0,1,0,0|1,0,1]=4 7670 B6R1.2 O[C@H]1CCNC1 Amb8384246 [1,0,0,1,0,0|1,0,1]=4 7671 B6R1.2 S=C1CCCC1 Amb28049287 [1,0,0,1,0,0|1,1,0]=4 7672 B6R1.2 S=C1CCCN1 Amb2778514 [1,0,0,1,0,0|1,1,0]=4 7673 B6R1.2 S=C1CCCO1 Amb27808589 [1,0,0,1,0,0|0,1,0]=3 7674 B6R1.2 S=C1NCCO1 Amb2371644 [1,0,0,1,0,0|1,1,0]=4 7675 B6R1.3 CCCC1CO1 Amb17771535 [1,0,0,1,0,0|1,0,1]=4 7676 B6R1.3 CCC[C@@H]1CO1 Amb25348803 [1,0,0,1,0,0|1,0,1]=4 7677 B6R1.3 CCC[C@H]1CO1 Amb10982593 [1,0,0,1,0,0|1,0,1]=4 7678 B6R1.5 C=C1CC(C)C1 Amb27242578 [1,0,0,1,0,0|2,0,0]=4 7679 B6R1.5 C=C1CC(N)C1 Amb19929922 [1,0,0,1,0,0|2,0,0]=4 7680 B6R1.5 C=C1CC(N)C1 Amb28464229 [1,0,0,1,0,0|2,0,0]=4 7681 B6R1.5 CC1=CC(=O)C1 Amb27451158 [1,0,0,1,0,0|1,0,1]=4 7682 B6R1.5 CC1CC(=O)C1 Amb22284831 [1,0,0,1,0,0|1,0,0]=3 7683 B6R1.5 CC1CC(=O)N1 Amb28383498 [1,0,0,1,0,0|1,0,0]=3 7684 B6R1.5 CC1CC(=O)O1 Amb13777279 [1,0,0,1,0,0|0,0,0]=2 7685 B6R1.5 CC1CC(=O)S1 Amb27424521 [1,0,0,1,0,0|0,1,0]=3 7686 B6R1.5 CC1CC(C)O1 Amb22737240 [1,0,0,1,0,0|1,0,1]=4 7687 B6R1.5 CC1CC(O)C1 Amb22235436 [1,0,0,1,0,0|1,0,1]=4 7688 B6R1.5 CN1CC(=O)C1 Amb22292462 [1,0,0,1,0,0|2,0,0]=4 7689 B6R1.5 CN1CC(=O)C1 Amb30869395 [1,0,0,1,0,0|2,0,0]=4 7690 B6R1.5 C[C@@H]1CC(=O)N1 Amb26611068 [1,0,0,1,0,0|1,0,0]=3 7691 B6R1.5 C[C@@H]1C[C@@H](C)O1 Amb24332806 [1,0,0,1,0,0|1,0,1]=4 7692 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [1,0,0,1,0,0|0,0,0]=2 7693 B6R1.5 C[C@H]1C[C@@H](C)O1 Amb24333814 [1,0,0,1,0,0|1,0,1]=4 7694 B6R1.5 C[C@H]1C[C@@H](O)C1 Amb27472789 [1,0,0,1,0,0|1,0,1]=4 7695 B6R1.5 C[C@H]1C[C@H](O)C1 Amb26010738 [1,0,0,1,0,0|1,0,1]=4 7696 B6R1.5 NC1CC(=O)C1 Amb20241928 [1,0,0,1,0,0|1,0,0]=3 7697 B6R1.5 NC1CC(=O)C1 Amb23439093 [1,0,0,1,0,0|1,0,0]=3 7698 B6R1.5 NC1CC(O)C1 Amb20670971 [1,0,0,1,0,0|1,0,1]=4 7699 B6R1.5 NC1CC(O)C1 Amb8011533 [1,0,0,1,0,0|1,0,1]=4 7700 B6R1.5 NC1CS(=O)C1 Amb25757983 [1,0,0,1,0,0|2,0,0]=4 7701 B6R1.5 NC1CS(=O)C1 Amb32655803 [1,0,0,1,0,0|2,0,0]=4 7702 B6R1.5 N[C@H]1C[C@@H](O)C1 Amb10603190 [1,0,0,1,0,0|1,0,1]=4 7703 B6R1.5 N[C@H]1C[C@@H](O)C1 Amb22230425 [1,0,0,1,0,0|1,0,1]=4 7704 B6R1.5 N[C@H]1C[C@H](O)C1 Amb10604103 [1,0,0,1,0,0|1,0,1]=4 7705 B6R1.5 N[C@H]1C[C@H](O)C1 Amb33523572 [1,0,0,1,0,0|1,0,1]=4 7706 B6R1.5 O=C1CC(Br)C1 Amb33548005 [1,0,0,1,0,0|2,0,0]=4 7707 B6R1.5 O=C1CC(F)C1 Amb27260513 [1,0,0,1,0,0|2,0,0]=4 7708 B6R1.5 O=C1CC(F)N1 Amb24588463 [1,0,0,1,0,0|2,0,0]=4 7709 B6R1.5 O=C1CC(O)C1 Amb22235480 [1,0,0,1,0,0|2,0,0]=4 7710 B6R1.5 O=C1C[C@@H](Br)N1 Amb26634817 [1,0,0,1,0,0|2,0,0]=4 7711 B6R1.8 C=C1CC1CN Amb27837703 [1,0,0,1,0,0|2,0,0]=4 7712 B6R1.8 C=C1CC1CN Amb33734441 [1,0,0,1,0,0|2,0,0]=4 7713 B6R1.8 CCC1=CC1=O Amb28284229 [1,0,0,1,0,0|1,0,1]=4 7714 B6R1.8 CCC1OC1C Amb1141391 [1,0,0,1,0,0|1,0,1]=4 7715 B6R1.9 CC1CC1(C)O Amb22157187 [1,0,0,1,0,0|1,0,1]=4 7716 B6R1.10 CC1(O)CCC1 Amb17940165 [1,0,0,1,0,0|1,0,1]=4 7717 B6R1.10 N=S1(=O)CCC1 Amb31308363 [1,0,0,1,0,0|2,0,0]=4 7718 B6R1.10 O=S1(=O)CCC1 Amb13883572 [1,0,0,1,0,0|1,0,1]=4 7719 B6R1.10 O=S1(=O)CCN1 Amb9196967 [1,0,0,1,0,0|1,0,1]=4 7720 B6R1.11 C=C(Br)C1CC1 Amb22583737 [1,0,0,1,0,0|2,0,0]=4 7721 B6R1.11 C=C(C)C1CC1 Amb33542793 [1,0,0,1,0,0|2,0,0]=4 7722 B6R1.11 C=C(Cl)C1CC1 Amb28322133 [1,0,0,1,0,0|2,0,0]=4 7723 B6R1.11 CC(=O)C1CC1 Amb2686663 [1,0,0,1,0,0|1,0,0]=3 7724 B6R1.11 CC(=O)C1CO1 Amb4477044 [1,0,0,1,0,0|2,0,0]=4 7725 B6R1.11 CC(=S)C1CC1 Amb27424574 [1,0,0,1,0,0|1,1,0]=4 7726 B6R1.11 CC(O)C1CC1 Amb9748276 [1,0,0,1,0,0|1,0,1]=4 7727 B6R1.11 C[C@@H](O)C1CC1 Amb13952943 [1,0,0,1,0,0|1,0,1]=4 7728 B6R1.11 C[C@H](O)C1CC1 Amb13952945 [1,0,0,1,0,0|1,0,1]=4 7729 B6R1.11 N=C(N)C1CC1 Amb2686661 [1,0,0,1,0,0|2,0,0]=4 7730 B6R1.11 N=C(N)C1CC1 Amb2695053 [1,0,0,1,0,0|2,0,0]=4 7731 B6R1.11 NC(=O)C1CC1 Amb33546284 [1,0,0,1,0,0|1,0,0]=3 7732 B6R1.11 NC(=O)C1CO1 Amb6261241 [1,0,0,1,0,0|2,0,0]=4 7733 B6R1.11 NC(=O)C1CS1 Amb27217272 [1,0,0,1,0,0|2,0,0]=4 7734 B6R1.11 NC(=S)C1CC1 Amb6244950 [1,0,0,1,0,0|1,1,0]=4 7735 B6R1.11 NC(O)C1CC1 Amb22492754 [1,0,0,1,0,0|1,0,1]=4 7736 B6R1.11 NS(=O)C1CC1 Amb33071950 [1,0,0,1,0,0|2,0,0]=4 7737 B6R1.11 O=C(Br)C1CC1 Amb27457101 [1,0,0,1,0,0|1,0,0]=3 7738 B6R1.11 O=C(Cl)C1CC1 Amb3939317 [1,0,0,1,0,0|1,0,0]=3 7739 B6R1.11 O=C(I)C1CC1 Amb28315968 [1,0,0,1,0,0|1,0,0]=3 7740 B6R1.11 O=C(O)C1C=C1 Amb27185565 [1,0,0,1,0,0|0,0,2]=4 7741 B6R1.11 O=C(O)C1CC1 Amb2686655 [1,0,0,1,0,0|0,0,0]=2 7742 B6R1.11 O=C(O)C1CN1 Amb21864773 [1,0,0,1,0,0|0,0,0]=2 7743 B6R1.11 O=C(O)C1CO1 Amb8395277 [1,0,0,1,0,0|1,0,0]=3 7744 B6R1.11 O=C(O)C1NN1 Amb27949037 [1,0,0,1,0,0|1,0,0]=3 7745 B6R1.11 O=C(O)[C@@H]1CN1 Amb22745452 [1,0,0,1,0,0|0,0,0]=2 7746 B6R1.11 O=C(O)[C@@H]1CO1 Amb26994292 [1,0,0,1,0,0|1,0,0]=3 7747 B6R1.11 O=C(O)[C@@H]1CS1 Amb28396934 [1,0,0,1,0,0|1,0,0]=3 7748 B6R1.11 O=C(O)[C@H]1CS1 Amb27845518 [1,0,0,1,0,0|1,0,0]=3 7749 B6R1.11 O=C([O-])C1CO1 Amb22492453 [1,0,0,1,0,0|1,0,1]=4 7750 B6R1.11 O=S(Cl)C1CC1 Amb25662827 [1,0,0,1,0,0|2,0,0]=4 7751 B6R1.11 O=S(O)C1CC1 Amb24334290 [1,0,0,1,0,0|1,0,0]=3 7752 B6R1.11 O=S([O-])C1CC1 Amb2694437 [1,0,0,1,0,0|1,0,1]=4 7753 B6R1.11 O=[N+]([O-])C1CC1 Amb25768805 [1,0,0,1,0,0|1,0,1]=4 7754 B6R1.11 O=[PH](O)C1CC1 Amb8391285 [1,0,0,1,0,0|1,0,0]=3 7755 B6R1.11 OB(O)C1CC1 Amb2455832 [1,0,0,1,0,0|1,0,1]=4 7756 B6R1.11 OC(O)C1CC1 Amb28062492 [1,0,0,1,0,0|0,0,2]=4 7757 B6R1.1 C1#CNCCC1 Amb27837888 [1,0,0,1,0,0|1,0,1]=4 7758 B6R1.1 C1=CCCCC1 Amb6608805 [1,0,0,1,0,0|2,0,0]=4 7759 B6R1.1 C1=CCNCC1 Amb2720330 [1,0,0,1,0,0|1,0,1]=4 7760 B6R1.1 C1=CCNCC1 Amb3941710 [1,0,0,1,0,0|1,0,1]=4 7761 B6R1.1 C1=CNCCC1 Amb24389577 [1,0,0,1,0,0|1,0,0]=3 7762 B6R1.1 C1=CNCCN1 Amb27413386 [1,0,0,1,0,0|2,0,0]=4 7763 B6R1.1 C1=COCCC1 Amb6609004 [1,0,0,1,0,0|1,0,1]=4 7764 B6R1.1 C1=COCCN1 Amb27413503 [1,0,0,1,0,0|2,0,0]=4 7765 B6R1.1 C1=NCCCC1 Amb27752613 [1,0,0,1,0,0|2,0,0]=4 7766 B6R1.1 C1=NCCCN1 Amb17620508 [1,0,0,1,0,0|2,0,0]=4 7767 B6R1.1 C1=NNCNC1 Amb28074859 [1,0,0,1,0,0|2,0,0]=4 7768 B6R1.1 C1=NSCCC1 Amb27266087 [1,0,0,1,0,0|2,0,0]=4 7769 B6R1.1 C1CCNCC1 Amb2792840 [1,0,0,1,0,0|1,0,1]=4 7770 B6R1.1 C1CCNCC1 Amb2816589 [1,0,0,1,0,0|1,0,1]=4 7771 B6R1.1 C1CCNNC1 Amb10975991 [1,0,0,1,0,0|1,0,1]=4 7772 B6R1.1 C1CCNNC1 Amb18559485 [1,0,0,1,0,0|1,0,1]=4 7773 B6R1.1 C1CCNNC1 Amb22263856 [1,0,0,1,0,0|1,0,1]=4 7774 B6R1.1 C1CCONC1 Amb22586922 [1,0,0,1,0,0|0,0,1]=3 7775 B6R1.1 C1CCONC1 Amb6365589 [1,0,0,1,0,0|0,0,1]=3 7776 B6R1.1 C1CNCNC1 Amb4297135 [1,0,0,1,0,0|2,0,0]=4 7777 B6R1.1 C1CNCOC1 Amb17506190 [1,0,0,1,0,0|2,0,0]=4 7778 B6R1.1 C1CNCOC1 Amb32652717 [1,0,0,1,0,0|2,0,0]=4 7779 B6R1.1 C1CNCSC1 Amb20622778 [1,0,0,1,0,0|2,0,0]=4 7780 B6R1.1 C1CNCSC1 Amb22356248 [1,0,0,1,0,0|2,0,0]=4 7781 B6R1.4 C=C1CCC1C Amb27424508 [1,0,0,1,0,0|2,0,0]=4 7782 B6R1.4 C=C1CCC1Cl Amb27637701 [1,0,0,1,0,0|2,0,0]=4 7783 B6R1.4 CC1CCC1=O Amb17593022 [1,0,0,1,0,0|1,0,0]=3 7784 B6R1.4 CC1CCC1N Amb26081246 [1,0,0,1,0,0|1,0,1]=4 7785 B6R1.4 CC1CCC1N Amb33550388 [1,0,0,1,0,0|1,0,1]=4 7786 B6R1.4 CC1CCC1O Amb33546533 [1,0,0,1,0,0|1,0,1]=4 7787 B6R1.4 CC1CNC1=O Amb24444140 [1,0,0,1,0,0|2,0,0]=4 7788 B6R1.4 CC1COC1=O Amb25794274 [1,0,0,1,0,0|2,0,0]=4 7789 B6R1.4 CC1OCC1=O Amb23456088 [1,0,0,1,0,0|2,0,0]=4 7790 B6R1.4 C[C@@H]1CC[C@H]1N Amb27461478 [1,0,0,1,0,0|1,0,1]=4 7791 B6R1.4 C[C@@H]1CC[C@H]1N Amb31030976 [1,0,0,1,0,0|1,0,1]=4 7792 B6R1.4 C[C@@H]1CC[C@H]1O Amb28053300 [1,0,0,1,0,0|1,0,1]=4 7793 B6R1.4 C[C@H]1CNC1=O Amb27620602 [1,0,0,1,0,0|2,0,0]=4 7794 B6R1.4 NC1CCC1=O Amb22896568 [1,0,0,1,0,0|0,0,0]=2 7795 B6R1.4 NC1CCC1=O Amb25887804 [1,0,0,1,0,0|0,0,0]=2 7796 B6R1.4 NC1CCC1F Amb33715804 [1,0,0,1,0,0|1,0,1]=4 7797 B6R1.4 NC1CCC1N Amb27872038 [1,0,0,1,0,0|1,0,1]=4 7798 B6R1.4 NC1CCC1O Amb19148610 [1,0,0,1,0,0|0,0,1]=3 7799 B6R1.4 NC1CCC1O Amb31291441 [1,0,0,1,0,0|0,0,1]=3 7800 B6R1.4 NC1CNC1=O Amb18832512 [1,0,0,1,0,0|1,0,0]=3 7801 B6R1.4 NC1CNC1=O Amb32671465 [1,0,0,1,0,0|1,0,0]=3 7802 B6R1.4 NN1CCC1=O Amb27860475 [1,0,0,1,0,0|1,0,0]=3 7803 B6R1.4 NN1CCC1=O Amb30625658 [1,0,0,1,0,0|1,0,0]=3 7804 B6R1.4 N[C@@H]1CC[C@@H]1F Amb33620889 [1,0,0,1,0,0|1,0,1]=4 7805 B6R1.4 N[C@@H]1CC[C@@H]1F Amb33747380 [1,0,0,1,0,0|1,0,1]=4 7806 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22757952 [1,0,0,1,0,0|0,0,1]=3 7807 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22823228 [1,0,0,1,0,0|0,0,1]=3 7808 B6R1.4 N[C@@H]1CC[C@H]1O Amb22757953 [1,0,0,1,0,0|0,0,1]=3 7809 B6R1.4 N[C@@H]1CC[C@H]1O Amb22823232 [1,0,0,1,0,0|0,0,1]=3 7810 B6R1.4 N[C@@H]1CC[C@H]1O Amb33719048 [1,0,0,1,0,0|0,0,1]=3 7811 B6R1.4 N[C@@H]1CNC1=O Amb22751418 [1,0,0,1,0,0|1,0,0]=3 7812 B6R1.4 N[C@@H]1CNC1=O Amb30982058 [1,0,0,1,0,0|1,0,0]=3 7813 B6R1.4 N[C@@H]1COC1=O Amb22748014 [1,0,0,1,0,0|1,0,0]=3 7814 B6R1.4 N[C@H]1CC[C@@H]1O Amb24579886 [1,0,0,1,0,0|0,0,1]=3 7815 B6R1.4 N[C@H]1CC[C@H]1N Amb25067470 [1,0,0,1,0,0|1,0,1]=4 7816 B6R1.4 N[C@H]1CC[C@H]1O Amb24580190 [1,0,0,1,0,0|0,0,1]=3 7817 B6R1.4 N[C@H]1CNC1=O Amb25811302 [1,0,0,1,0,0|1,0,0]=3 7818 B6R1.4 N[C@H]1CNC1=O Amb31291144 [1,0,0,1,0,0|1,0,0]=3 7819 B6R1.4 N[C@H]1COC1=O Amb28315731 [1,0,0,1,0,0|1,0,0]=3 7820 B6R1.4 N[C@H]1CSC1=O Amb27391192 [1,0,0,1,0,0|1,0,0]=3 7821 B6R1.4 O=C1CCC1=O Amb4036402 [1,0,0,1,0,0|1,0,1]=4 7822 B6R1.4 O=C1CCC1Br Amb21964157 [1,0,0,1,0,0|1,0,0]=3 7823 B6R1.4 O=C1CCC1Cl Amb33544158 [1,0,0,1,0,0|1,0,0]=3 7824 B6R1.4 O=C1CCC1O Amb17593027 [1,0,0,1,0,0|1,0,0]=3 7825 B6R1.4 O=C1NCC1O Amb24689689 [1,0,0,1,0,0|2,0,0]=4 7826 B6R1.4 OC1CCC1F Amb34138084 [1,0,0,1,0,0|1,0,1]=4 7827 B6R1.4 OC1CCC1O Amb27647204 [1,0,0,1,0,0|1,0,1]=4 7828 B6R1.4 O[C@@H]1CC[C@H]1O Amb28053810 [1,0,0,1,0,0|1,0,1]=4 7829 B6R1.4 O[C@@H]1CC[C@H]1S Amb27420494 [1,0,0,1,0,0|1,0,1]=4 7830 B6R1.4 O[C@H]1CC[C@H]1O Amb24505810 [1,0,0,1,0,0|1,0,1]=4 7831 B6R1.6 BrCC1C=CC1 Amb27188357 [1,0,0,1,0,0|2,0,0]=4 7832 B6R1.6 BrCC1CCO1 Amb2383525 [1,0,0,1,0,0|1,0,1]=4 7833 B6R1.6 C#CC1CCN1 Amb33169081 [1,0,0,1,0,0|1,0,1]=4 7834 B6R1.6 C#CC1CCN1 Amb33457292 [1,0,0,1,0,0|1,0,1]=4 7835 B6R1.6 C=CC1CCC1 Amb27254044 [1,0,0,1,0,0|2,0,0]=4 7836 B6R1.6 C=C[C@H]1CCN1 Amb27164530 [1,0,0,1,0,0|1,0,0]=3 7837 B6R1.6 CCC1CCN1 Amb24117042 [1,0,0,1,0,0|1,0,1]=4 7838 B6R1.6 CCC1CCN1 Amb32661102 [1,0,0,1,0,0|1,0,1]=4 7839 B6R1.6 CNC1CCN1 Amb28989493 [1,0,0,1,0,0|2,0,0]=4 7840 B6R1.6 ClCC1CCO1 Amb22495451 [1,0,0,1,0,0|1,0,1]=4 7841 B6R1.6 FCC1CCN1 Amb27424499 [1,0,0,1,0,0|1,0,1]=4 7842 B6R1.6 FCC1CCN1 Amb33715680 [1,0,0,1,0,0|1,0,1]=4 7843 B6R1.6 FC[C@@H]1CCN1 Amb33715681 [1,0,0,1,0,0|1,0,1]=4 7844 B6R1.6 FC[C@H]1CCN1 Amb34142363 [1,0,0,1,0,0|1,0,1]=4 7845 B6R1.6 ICC1CCO1 Amb13883581 [1,0,0,1,0,0|1,0,1]=4 7846 B6R1.6 N#CC1CCN1 Amb24117065 [1,0,0,1,0,0|1,0,1]=4 7847 B6R1.6 N#CC1CCN1 Amb33984623 [1,0,0,1,0,0|1,0,1]=4 7848 B6R1.6 N#CC1CCN1 Amb34199861 [1,0,0,1,0,0|1,0,1]=4 7849 B6R1.6 N#C[C@@H]1CCN1 Amb31307946 [1,0,0,1,0,0|1,0,1]=4 7850 B6R1.6 N#C[C@@H]1CCN1 Amb33715682 [1,0,0,1,0,0|1,0,1]=4 7851 B6R1.6 N#C[C@H]1CCN1 Amb28250094 [1,0,0,1,0,0|1,0,1]=4 7852 B6R1.6 N#C[C@H]1CCN1 Amb34160852 [1,0,0,1,0,0|1,0,1]=4 7853 B6R1.6 N#C[C@H]1CCN1 Amb34165555 [1,0,0,1,0,0|1,0,1]=4 7854 B6R1.6 NCC1C=CC1 Amb32658178 [1,0,0,1,0,0|1,0,0]=3 7855 B6R1.6 NCC1CCC1 Amb6255393 [1,0,0,1,0,0|1,0,1]=4 7856 B6R1.6 NCC1CCC1 Amb7969499 [1,0,0,1,0,0|1,0,1]=4 7857 B6R1.6 NCC1CCN1 Amb19929583 [1,0,0,1,0,0|1,0,1]=4 7858 B6R1.6 NCC1CCN1 Amb22371586 [1,0,0,1,0,0|1,0,1]=4 7859 B6R1.6 NCC1CCN1 Amb33870298 [1,0,0,1,0,0|1,0,1]=4 7860 B6R1.6 NCC1CCO1 Amb19895255 [1,0,0,1,0,0|0,0,1]=3 7861 B6R1.6 NCC1CCS1 Amb33329371 [1,0,0,1,0,0|0,1,1]=4 7862 B6R1.6 NCC1CNC1 Amb19958330 [1,0,0,1,0,0|2,0,0]=4 7863 B6R1.6 NCC1CNC1 Amb22001661 [1,0,0,1,0,0|2,0,0]=4 7864 B6R1.6 NCC1COC1 Amb19957367 [1,0,0,1,0,0|2,0,0]=4 7865 B6R1.6 NCC1COC1 Amb22270011 [1,0,0,1,0,0|2,0,0]=4 7866 B6R1.6 NCC1CSC1 Amb22737306 [1,0,0,1,0,0|2,0,0]=4 7867 B6R1.6 NCC1CSC1 Amb23439787 [1,0,0,1,0,0|2,0,0]=4 7868 B6R1.6 NC[C@@H]1CCO1 Amb34141504 [1,0,0,1,0,0|0,0,1]=3 7869 B6R1.6 NC[C@H]1CCO1 Amb33805341 [1,0,0,1,0,0|0,0,1]=3 7870 B6R1.6 O=CC1CCC1 Amb8009552 [1,0,0,1,0,0|1,0,0]=3 7871 B6R1.6 O=CC1CCN1 Amb25757222 [1,0,0,1,0,0|0,0,0]=2 7872 B6R1.6 O=CC1CCS1 Amb27644631 [1,0,0,1,0,0|1,0,0]=3 7873 B6R1.6 O=CC1CNC1 Amb25919428 [1,0,0,1,0,0|2,0,0]=4 7874 B6R1.6 O=CC1COC1 Amb21857829 [1,0,0,1,0,0|2,0,0]=4 7875 B6R1.6 OCC1C=CC1 Amb26987497 [1,0,0,1,0,0|2,0,0]=4 7876 B6R1.6 OCC1CCC1 Amb2686620 [1,0,0,1,0,0|1,0,1]=4 7877 B6R1.6 OCC1CCN1 Amb21963462 [1,0,0,1,0,0|0,0,1]=3 7878 B6R1.6 OCC1CCN1 Amb32682448 [1,0,0,1,0,0|0,0,1]=3 7879 B6R1.6 OCC1CCO1 Amb21960943 [1,0,0,1,0,0|1,0,1]=4 7880 B6R1.6 OC[C@@H]1CCN1 Amb22406086 [1,0,0,1,0,0|0,0,1]=3 7881 B6R1.6 OC[C@@H]1CCN1 Amb34913959 [1,0,0,1,0,0|0,0,1]=3 7882 B6R1.6 OC[C@H]1CCN1 Amb22233159 [1,0,0,1,0,0|0,0,1]=3 7883 B6R1.6 OC[C@H]1CCN1 Amb33859052 [1,0,0,1,0,0|0,0,1]=3 7884 B6R1.6 OC[C@H]1CCO1 Amb24559274 [1,0,0,1,0,0|1,0,1]=4 7885 B8R1.1 C=C1COC(CC)C1 Amb35614622 [0,1,0,1,0,0|2,0,0]=4 7886 B8R1.1 C=CC1CCC(=O)C1 Amb26592031 [0,1,0,1,0,0|2,0,0]=4 7887 B8R1.1 C=CC1CCC(=O)N1 Amb20622087 [0,1,0,1,0,0|2,0,0]=4 7888 B8R1.1 C=CC1CCC(=O)O1 Amb33249669 [0,1,0,1,0,0|1,0,0]=3 7889 B8R1.1 C=CC1CNC(=O)O1 Amb25064259 [0,1,0,1,0,0|1,0,1]=4 7890 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,1,0,1,0,0|1,0,1]=4 7891 B8R1.1 C=CC1COC(=O)O1 Amb17942789 [0,1,0,1,0,0|1,0,1]=4 7892 B8R1.1 C=C[C@@H]1CCC(=O)N1 Amb27838334 [0,1,0,1,0,0|2,0,0]=4 7893 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,1,0,1,0,0|1,0,1]=4 7894 B8R1.1 C=C[C@@H]1COC(=O)O1 Amb25946828 [0,1,0,1,0,0|1,0,1]=4 7895 B8R1.1 C=C[C@H]1CCC(=O)N1 Amb27459295 [0,1,0,1,0,0|2,0,0]=4 7896 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,1,0,1,0,0|1,0,1]=4 7897 B8R1.1 C=C[C@H]1COC(=O)O1 Amb26588639 [0,1,0,1,0,0|1,0,1]=4 7898 B8R1.1 CC1=NOC(CBr)C1 Amb23571392 [0,1,0,1,0,0|2,0,0]=4 7899 B8R1.1 CC1=NOC(CCl)C1 Amb23571110 [0,1,0,1,0,0|2,0,0]=4 7900 B8R1.1 CC1=NOC(CN)C1 Amb21955831 [0,1,0,1,0,0|1,0,0]=3 7901 B8R1.1 CC1=NOC(CN)C1 Amb8010054 [0,1,0,1,0,0|1,0,0]=3 7902 B8R1.1 CC1=NOC(CO)C1 Amb9902086 [0,1,0,1,0,0|2,0,0]=4 7903 B8R1.1 CC1=NO[C@H](CO)C1 Amb28455073 [0,1,0,1,0,0|2,0,0]=4 7904 B8R1.1 CC1CC(CN)CO1 Amb28193268 [0,1,0,1,0,0|1,0,1]=4 7905 B8R1.1 CC1CCC(CN)O1 Amb33551292 [0,1,0,1,0,0|1,0,1]=4 7906 B8R1.1 CC1COC(CN)C1 Amb32660866 [0,1,0,1,0,0|1,0,1]=4 7907 B8R1.1 CC1OC(CN)CS1 Amb27655559 [0,1,0,1,0,0|1,0,1]=4 7908 B8R1.1 CC1OCC(CN)O1 Amb28049004 [0,1,0,1,0,0|1,0,1]=4 7909 B8R1.1 CCC1=CC(=O)CC1 Amb25889297 [0,1,0,1,0,0|2,0,0]=4 7910 B8R1.1 CCC1=CCC(=O)O1 Amb27974572 [0,1,0,1,0,0|1,0,1]=4 7911 B8R1.1 CCC1=NOC(=O)C1 Amb26614539 [0,1,0,1,0,0|1,0,1]=4 7912 B8R1.1 CCC1C=CC(=O)O1 Amb23571855 [0,1,0,1,0,0|1,0,1]=4 7913 B8R1.1 CCC1CC(=O)CO1 Amb27856666 [0,1,0,1,0,0|1,0,0]=3 7914 B8R1.1 CCC1CC(=O)NN1 Amb29862365 [0,1,0,1,0,0|2,0,0]=4 7915 B8R1.1 CCC1CCC(=O)N1 Amb19516715 [0,1,0,1,0,0|2,0,0]=4 7916 B8R1.1 CCC1CCC(=O)O1 Amb3941505 [0,1,0,1,0,0|1,0,0]=3 7917 B8R1.1 CCC1CNC(=O)C1 Amb10608005 [0,1,0,1,0,0|2,0,0]=4 7918 B8R1.1 CCC1CNC(=O)N1 Amb17506855 [0,1,0,1,0,0|2,0,0]=4 7919 B8R1.1 CCC1CNC(=O)O1 Amb27237218 [0,1,0,1,0,0|1,0,0]=3 7920 B8R1.1 CCC1COC(=O)C1 Amb27854064 [0,1,0,1,0,0|1,0,0]=3 7921 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,1,0,1,0,0|2,0,0]=4 7922 B8R1.1 CCC1COC(=O)O1 Amb2721339 [0,1,0,1,0,0|1,0,0]=3 7923 B8R1.1 CC[C@@H]1C=CC(=O)O1 Amb27954643 [0,1,0,1,0,0|1,0,1]=4 7924 B8R1.1 CC[C@@H]1CCC(=O)O1 Amb26626757 [0,1,0,1,0,0|1,0,0]=3 7925 B8R1.1 CC[C@H]1C=CC(=O)O1 Amb28195329 [0,1,0,1,0,0|1,0,1]=4 7926 B8R1.1 CC[C@H]1CCC(=O)O1 Amb25795415 [0,1,0,1,0,0|1,0,0]=3 7927 B8R1.1 CC[C@H]1CNC(=O)O1 Amb27954656 [0,1,0,1,0,0|1,0,0]=3 7928 B8R1.1 CC[C@H]1COC(=O)N1 Amb27411564 [0,1,0,1,0,0|2,0,0]=4 7929 B8R1.1 CNC1CCC(=O)C1 Amb28316112 [0,1,0,1,0,0|1,0,0]=3 7930 B8R1.1 CNC1CCC(O)C1 Amb27595077 [0,1,0,1,0,0|1,0,1]=4 7931 B8R1.1 CNC1CNC(=O)C1 Amb25851765 [0,1,0,1,0,0|2,0,0]=4 7932 B8R1.1 CNC1COC(=O)C1 Amb26505382 [0,1,0,1,0,0|2,0,0]=4 7933 B8R1.1 COC1CC(=O)CO1 Amb27409395 [0,1,0,1,0,0|2,0,0]=4 7934 B8R1.1 COC1CCC(=O)C1 Amb24483163 [0,1,0,1,0,0|2,0,0]=4 7935 B8R1.1 COC1CCC(=O)N1 Amb17617087 [0,1,0,1,0,0|2,0,0]=4 7936 B8R1.1 COC1CCC(N)C1 Amb24183578 [0,1,0,1,0,0|1,0,1]=4 7937 B8R1.1 COC1CCC(N)C1 Amb33541943 [0,1,0,1,0,0|1,0,1]=4 7938 B8R1.1 CON1CCC(N)C1 Amb26642296 [0,1,0,1,0,0|2,0,0]=4 7939 B8R1.1 CO[C@@H]1CC[C@@H](N)C1 Amb31308566 [0,1,0,1,0,0|1,0,1]=4 7940 B8R1.1 CO[C@@H]1CC[C@@H](N)C1 Amb34164914 [0,1,0,1,0,0|1,0,1]=4 7941 B8R1.1 CO[C@H]1CC[C@@H](N)C1 Amb27630701 [0,1,0,1,0,0|1,0,1]=4 7942 B8R1.1 CO[C@H]1CC[C@@H](N)C1 Amb34912797 [0,1,0,1,0,0|1,0,1]=4 7943 B8R1.1 CO[C@H]1CC[C@H](N)C1 Amb33871487 [0,1,0,1,0,0|1,0,1]=4 7944 B8R1.1 CSC1CCC(=O)C1 Amb28184431 [0,1,0,1,0,0|2,0,0]=4 7945 B8R1.1 CSC1COC(=O)O1 Amb27395888 [0,1,0,1,0,0|2,0,0]=4 7946 B8R1.1 C[C@@H]1C=C(C=O)CC1 Amb25760068 [0,1,0,1,0,0|2,0,0]=4 7947 B8R1.1 C[C@@H]1CCC(CN)O1 Amb33423847 [0,1,0,1,0,0|1,0,1]=4 7948 B8R1.1 C[C@@H]1O[C@H](CN)CS1 Amb27430407 [0,1,0,1,0,0|1,0,1]=4 7949 B8R1.1 C[C@H]1C=C(C=O)CC1 Amb25839230 [0,1,0,1,0,0|2,0,0]=4 7950 B8R1.1 C[C@H]1C=C(CO)CC1 Amb27452870 [0,1,0,1,0,0|2,0,0]=4 7951 B8R1.1 C\C=C1\CCC(=O)O1 Amb27421031 [0,1,0,1,0,0|1,0,1]=4 7952 B8R1.1 ClCC1CC(Br)=NO1 Amb23449511 [0,1,0,1,0,0|2,0,0]=4 7953 B8R1.1 N#CC1=CC(N)CC1 Amb24524262 [0,1,0,1,0,0|2,0,0]=4 7954 B8R1.1 N#CC1CCC(=O)C1 Amb22886979 [0,1,0,1,0,0|1,0,1]=4 7955 B8R1.1 N#CC1CCC(=O)N1 Amb26361514 [0,1,0,1,0,0|1,0,1]=4 7956 B8R1.1 N#CC1CNC(=O)O1 Amb26984953 [0,1,0,1,0,0|0,0,2]=4 7957 B8R1.1 N#CC1COC(=O)O1 Amb35788458 [0,1,0,1,0,0|0,0,2]=4 7958 B8R1.1 N#C[C@H]1CCC(=O)C1 Amb26562820 [0,1,0,1,0,0|1,0,1]=4 7959 B8R1.1 N#C[C@H]1CCC(=O)N1 Amb27404492 [0,1,0,1,0,0|1,0,1]=4 7960 B8R1.1 NC1=NCC(CBr)O1 Amb2721921 [0,1,0,1,0,0|2,0,0]=4 7961 B8R1.1 NC1=NCC(CBr)O1 Amb33328591 [0,1,0,1,0,0|2,0,0]=4 7962 B8R1.1 NC1=NCC(CCl)O1 Amb26392039 [0,1,0,1,0,0|2,0,0]=4 7963 B8R1.1 NC1=NCC(CO)O1 Amb27596592 [0,1,0,1,0,0|2,0,0]=4 7964 B8R1.1 NC1=NC[C@@H](CCl)O1 Amb27839394 [0,1,0,1,0,0|2,0,0]=4 7965 B8R1.1 NC1CC=C(CO)C1 Amb28136321 [0,1,0,1,0,0|1,0,1]=4 7966 B8R1.1 NC1CCC(CO)C1 Amb18641837 [0,1,0,1,0,0|1,0,1]=4 7967 B8R1.1 NC1CCC(CO)C1 Amb32666336 [0,1,0,1,0,0|1,0,1]=4 7968 B8R1.1 NCC1=CNC(=O)O1 Amb27790043 [0,1,0,1,0,0|0,0,2]=4 7969 B8R1.1 NCC1=NC(=O)CS1 Amb35679385 [0,1,0,1,0,0|1,0,1]=4 7970 B8R1.1 NCC1=NC(=O)ON1 Amb28934819 [0,1,0,1,0,0|1,0,1]=4 7971 B8R1.1 NCC1=NNC(=O)C1 Amb18833077 [0,1,0,1,0,0|1,0,1]=4 7972 B8R1.1 NCC1=NNC(=O)O1 Amb26630995 [0,1,0,1,0,0|1,0,1]=4 7973 B8R1.1 NCC1=NOC(=O)C1 Amb18833041 [0,1,0,1,0,0|0,0,1]=3 7974 B8R1.1 NCC1C=CC(=O)O1 Amb27842373 [0,1,0,1,0,0|0,0,1]=3 7975 B8R1.1 NCC1CC(Br)=NO1 Amb22169739 [0,1,0,1,0,0|1,0,0]=3 7976 B8R1.1 NCC1CC(Cl)=NO1 Amb28341795 [0,1,0,1,0,0|1,0,0]=3 7977 B8R1.1 NCC1CC(O)CN1 Amb22059798 [0,1,0,1,0,0|1,0,1]=4 7978 B8R1.1 NCC1CCC(=O)C1 Amb24644946 [0,1,0,1,0,0|1,0,0]=3 7979 B8R1.1 NCC1CCC(=O)N1 Amb19330383 [0,1,0,1,0,0|1,0,0]=3 7980 B8R1.1 NCC1CCC(=O)N1 Amb2154785 [0,1,0,1,0,0|1,0,0]=3 7981 B8R1.1 NCC1CCC(=O)N1 Amb2699145 [0,1,0,1,0,0|1,0,0]=3 7982 B8R1.1 NCC1CCC(=O)O1 Amb24482045 [0,1,0,1,0,0|0,0,0]=2 7983 B8R1.1 NCC1CCC(=O)O1 Amb28934914 [0,1,0,1,0,0|0,0,0]=2 7984 B8R1.1 NCC1CCC(O)C1 Amb22886211 [0,1,0,1,0,0|1,0,1]=4 7985 B8R1.1 NCC1CCC(O)C1 Amb33547590 [0,1,0,1,0,0|1,0,1]=4 7986 B8R1.1 NCC1CNC(=O)C1 Amb22899752 [0,1,0,1,0,0|1,0,0]=3 7987 B8R1.1 NCC1CNC(=O)C1 Amb32434789 [0,1,0,1,0,0|1,0,0]=3 7988 B8R1.1 NCC1CNC(=O)C1 Amb8009790 [0,1,0,1,0,0|1,0,0]=3 7989 B8R1.1 NCC1CNC(=O)N1 Amb32666643 [0,1,0,1,0,0|1,0,0]=3 7990 B8R1.1 NCC1CNC(=O)N1 Amb33339243 [0,1,0,1,0,0|1,0,0]=3 7991 B8R1.1 NCC1CNC(=O)O1 Amb17506099 [0,1,0,1,0,0|0,0,0]=2 7992 B8R1.1 NCC1CNC(=O)O1 Amb33527727 [0,1,0,1,0,0|0,0,0]=2 7993 B8R1.1 NCC1COC(=O)N1 Amb27852206 [0,1,0,1,0,0|1,0,0]=3 7994 B8R1.1 NCC1COC(=O)N1 Amb28934922 [0,1,0,1,0,0|1,0,0]=3 7995 B8R1.1 NC[C@@H]1CC(Br)=NO1 Amb27409100 [0,1,0,1,0,0|1,0,0]=3 7996 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb22746678 [0,1,0,1,0,0|1,0,0]=3 7997 B8R1.1 NC[C@@H]1CCC(=O)N1 Amb2699146 [0,1,0,1,0,0|1,0,0]=3 7998 B8R1.1 NC[C@@H]1CC[C@@H](O)C1 Amb10066974 [0,1,0,1,0,0|1,0,1]=4 7999 B8R1.1 NC[C@@H]1CC[C@H](O)C1 Amb10066982 [0,1,0,1,0,0|1,0,1]=4 8000 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439750 [0,1,0,1,0,0|1,0,0]=3 8001 B8R1.1 NC[C@@H]1CNC(=O)C1 Amb23439751 [0,1,0,1,0,0|1,0,0]=3 8002 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb24183560 [0,1,0,1,0,0|0,0,0]=2 8003 B8R1.1 NC[C@@H]1CNC(=O)O1 Amb25127772 [0,1,0,1,0,0|0,0,0]=2 8004 B8R1.1 NC[C@@H]1C[C@@H](O)CN1 Amb27850549 [0,1,0,1,0,0|1,0,1]=4 8005 B8R1.1 NC[C@H]1CCC(=O)N1 Amb2699147 [0,1,0,1,0,0|1,0,0]=3 8006 B8R1.1 NC[C@H]1CCC(=O)N1 Amb32721612 [0,1,0,1,0,0|1,0,0]=3 8007 B8R1.1 NC[C@H]1CC[C@@H](O)C1 Amb10066975 [0,1,0,1,0,0|1,0,1]=4 8008 B8R1.1 NC[C@H]1CNC(=O)C1 Amb27797276 [0,1,0,1,0,0|1,0,0]=3 8009 B8R1.1 NC[C@H]1CNC(=O)C1 Amb31204575 [0,1,0,1,0,0|1,0,0]=3 8010 B8R1.1 NC[C@H]1CNC(=O)O1 Amb27403470 [0,1,0,1,0,0|0,0,0]=2 8011 B8R1.1 NC[C@H]1CNC(=O)O1 Amb30869777 [0,1,0,1,0,0|0,0,0]=2 8012 B8R1.1 N[C@@H]1CC=C(CO)C1 Amb27839180 [0,1,0,1,0,0|1,0,1]=4 8013 B8R1.1 N[C@@H]1CC[C@@H](CO)C1 Amb24603976 [0,1,0,1,0,0|1,0,1]=4 8014 B8R1.1 N[C@@H]1CC[C@H](CO)C1 Amb24526904 [0,1,0,1,0,0|1,0,1]=4 8015 B8R1.1 N[C@H]1CC[C@@H](CO)C1 Amb26949648 [0,1,0,1,0,0|1,0,1]=4 8016 B8R1.1 N[C@H]1CC[C@@H](CO)C1 Amb32661812 [0,1,0,1,0,0|1,0,1]=4 8017 B8R1.1 O=C1C=CC(CBr)O1 Amb24423424 [0,1,0,1,0,0|1,0,1]=4 8018 B8R1.1 O=C1C=C[C@@H](CBr)O1 Amb28128549 [0,1,0,1,0,0|1,0,1]=4 8019 B8R1.1 O=C1C=C[C@@H](CO)O1 Amb3939187 [0,1,0,1,0,0|1,0,1]=4 8020 B8R1.1 O=C1C=C[C@H](CO)O1 Amb2699833 [0,1,0,1,0,0|1,0,1]=4 8021 B8R1.1 O=C1CC(CBr)CN1 Amb33548071 [0,1,0,1,0,0|2,0,0]=4 8022 B8R1.1 O=C1CC(CCl)CN1 Amb27259904 [0,1,0,1,0,0|2,0,0]=4 8023 B8R1.1 O=C1CC(CF)CN1 Amb33379247 [0,1,0,1,0,0|2,0,0]=4 8024 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,1,0,1,0,0|1,0,0]=3 8025 B8R1.1 O=C1CC(CI)CN1 Amb25031171 [0,1,0,1,0,0|2,0,0]=4 8026 B8R1.1 O=C1CC(CO)CN1 Amb9902173 [0,1,0,1,0,0|2,0,0]=4 8027 B8R1.1 O=C1CC(CO)CO1 Amb22886806 [0,1,0,1,0,0|1,0,0]=3 8028 B8R1.1 O=C1CC(CO)NN1 Amb35686080 [0,1,0,1,0,0|2,0,0]=4 8029 B8R1.1 O=C1CC(CS)CN1 Amb27850787 [0,1,0,1,0,0|2,0,0]=4 8030 B8R1.1 O=C1CC=C(CO)O1 Amb26977633 [0,1,0,1,0,0|1,0,1]=4 8031 B8R1.1 O=C1CCC(CBr)N1 Amb22492782 [0,1,0,1,0,0|2,0,0]=4 8032 B8R1.1 O=C1CCC(CBr)N1 Amb32752580 [0,1,0,1,0,0|2,0,0]=4 8033 B8R1.1 O=C1CCC(CBr)O1 Amb22587611 [0,1,0,1,0,0|1,0,0]=3 8034 B8R1.1 O=C1CCC(CCl)N1 Amb25125270 [0,1,0,1,0,0|2,0,0]=4 8035 B8R1.1 O=C1CCC(CCl)O1 Amb10608418 [0,1,0,1,0,0|1,0,0]=3 8036 B8R1.1 O=C1CCC(CF)N1 Amb27838313 [0,1,0,1,0,0|2,0,0]=4 8037 B8R1.1 O=C1CCC(CI)C1 Amb27481152 [0,1,0,1,0,0|2,0,0]=4 8038 B8R1.1 O=C1CCC(CI)N1 Amb25955610 [0,1,0,1,0,0|2,0,0]=4 8039 B8R1.1 O=C1CCC(CI)O1 Amb25718848 [0,1,0,1,0,0|1,0,0]=3 8040 B8R1.1 O=C1CCC(CO)C1 Amb22168734 [0,1,0,1,0,0|2,0,0]=4 8041 B8R1.1 O=C1CCC(CO)N1 Amb33544815 [0,1,0,1,0,0|2,0,0]=4 8042 B8R1.1 O=C1CCC(CO)O1 Amb20240701 [0,1,0,1,0,0|1,0,0]=3 8043 B8R1.1 O=C1CCC(CO)S1 Amb28202904 [0,1,0,1,0,0|1,1,0]=4 8044 B8R1.1 O=C1CCC(CS)C1 Amb27828867 [0,1,0,1,0,0|2,0,0]=4 8045 B8R1.1 O=C1CCC(CS)N1 Amb32788463 [0,1,0,1,0,0|2,0,0]=4 8046 B8R1.1 O=C1CC[C@@H](CBr)N1 Amb2694702 [0,1,0,1,0,0|2,0,0]=4 8047 B8R1.1 O=C1CC[C@@H](CBr)N1 Amb32664923 [0,1,0,1,0,0|2,0,0]=4 8048 B8R1.1 O=C1CC[C@@H](CBr)O1 Amb24483198 [0,1,0,1,0,0|1,0,0]=3 8049 B8R1.1 O=C1CC[C@@H](CI)O1 Amb27175447 [0,1,0,1,0,0|1,0,0]=3 8050 B8R1.1 O=C1CC[C@@H](CO)N1 Amb2371840 [0,1,0,1,0,0|2,0,0]=4 8051 B8R1.1 O=C1CC[C@@H](CO)O1 Amb8515911 [0,1,0,1,0,0|1,0,0]=3 8052 B8R1.1 O=C1CC[C@H](CBr)C1 Amb26032409 [0,1,0,1,0,0|2,0,0]=4 8053 B8R1.1 O=C1CC[C@H](CBr)N1 Amb2695539 [0,1,0,1,0,0|2,0,0]=4 8054 B8R1.1 O=C1CC[C@H](CCl)N1 Amb26508557 [0,1,0,1,0,0|2,0,0]=4 8055 B8R1.1 O=C1CC[C@H](CO)N1 Amb2694795 [0,1,0,1,0,0|2,0,0]=4 8056 B8R1.1 O=C1CC[C@H](CO)O1 Amb4037005 [0,1,0,1,0,0|1,0,0]=3 8057 B8R1.1 O=C1CNC(CCl)C1 Amb27864068 [0,1,0,1,0,0|2,0,0]=4 8058 B8R1.1 O=C1COC(CO)C1 Amb24117838 [0,1,0,1,0,0|1,0,0]=3 8059 B8R1.1 O=C1COC(CO)N1 Amb27789986 [0,1,0,1,0,0|2,0,0]=4 8060 B8R1.1 O=C1C[C@@H](CBr)CO1 Amb27590526 [0,1,0,1,0,0|1,0,0]=3 8061 B8R1.1 O=C1C[C@@H](CO)CN1 Amb24515579 [0,1,0,1,0,0|2,0,0]=4 8062 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,1,0,1,0,0|1,0,0]=3 8063 B8R1.1 O=C1C[C@H](CO)CN1 Amb25745471 [0,1,0,1,0,0|2,0,0]=4 8064 B8R1.1 O=C1NC(CCl)CO1 Amb28282690 [0,1,0,1,0,0|2,0,0]=4 8065 B8R1.1 O=C1NC(CF)CO1 Amb33358226 [0,1,0,1,0,0|2,0,0]=4 8066 B8R1.1 O=C1NC(CO)CO1 Amb22410779 [0,1,0,1,0,0|2,0,0]=4 8067 B8R1.1 O=C1NC(CO)CS1 Amb27170689 [0,1,0,1,0,0|2,0,0]=4 8068 B8R1.1 O=C1NCC(CBr)O1 Amb24530204 [0,1,0,1,0,0|1,0,0]=3 8069 B8R1.1 O=C1NCC(CBr)S1 Amb7968758 [0,1,0,1,0,0|1,1,0]=4 8070 B8R1.1 O=C1NCC(CCl)O1 Amb1152954 [0,1,0,1,0,0|1,0,0]=3 8071 B8R1.1 O=C1NCC(CF)O1 Amb33379234 [0,1,0,1,0,0|1,0,0]=3 8072 B8R1.1 O=C1NCC(CI)O1 Amb28282085 [0,1,0,1,0,0|1,0,0]=3 8073 B8R1.1 O=C1NCC(CO)O1 Amb9421413 [0,1,0,1,0,0|1,0,0]=3 8074 B8R1.1 O=C1NCC(CS)O1 Amb25725846 [0,1,0,1,0,0|1,0,0]=3 8075 B8R1.1 O=C1NC[C@@H](CBr)O1 Amb27401944 [0,1,0,1,0,0|1,0,0]=3 8076 B8R1.1 O=C1NC[C@@H](CCl)O1 Amb22232513 [0,1,0,1,0,0|1,0,0]=3 8077 B8R1.1 O=C1NC[C@@H](CO)N1 Amb33482781 [0,1,0,1,0,0|2,0,0]=4 8078 B8R1.1 O=C1NC[C@@H](CO)O1 Amb24183552 [0,1,0,1,0,0|1,0,0]=3 8079 B8R1.1 O=C1NC[C@H](CCl)O1 Amb25077275 [0,1,0,1,0,0|1,0,0]=3 8080 B8R1.1 O=C1NC[C@H](CO)N1 Amb33620311 [0,1,0,1,0,0|2,0,0]=4 8081 B8R1.1 O=C1NC[C@H](CO)O1 Amb22737250 [0,1,0,1,0,0|1,0,0]=3 8082 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,1,0,1,0,0|2,0,0]=4 8083 B8R1.1 O=C1N[C@@H](CO)CO1 Amb26396455 [0,1,0,1,0,0|2,0,0]=4 8084 B8R1.1 O=C1N[C@H](CI)CO1 Amb28048135 [0,1,0,1,0,0|2,0,0]=4 8085 B8R1.1 O=C1N[C@H](CO)CO1 Amb26653948 [0,1,0,1,0,0|2,0,0]=4 8086 B8R1.1 O=C1N[C@H](CO)CS1 Amb27655608 [0,1,0,1,0,0|2,0,0]=4 8087 B8R1.1 O=C1OCC(CCl)O1 Amb3940630 [0,1,0,1,0,0|1,0,0]=3 8088 B8R1.1 O=C1OCC(CF)O1 Amb28348445 [0,1,0,1,0,0|1,0,0]=3 8089 B8R1.1 O=C1OCC(CO)O1 Amb3939438 [0,1,0,1,0,0|1,0,0]=3 8090 B8R1.1 O=C1OCC(CS)O1 Amb32650873 [0,1,0,1,0,0|1,0,0]=3 8091 B8R1.1 O=C1SCC(CCl)S1 Amb27975820 [0,1,0,1,0,0|1,1,0]=4 8092 B8R1.1 O=C1SCC(CO)S1 Amb27394779 [0,1,0,1,0,0|1,1,0]=4 8093 B8R1.1 O=CC1CCC(=O)C1 Amb18124240 [0,1,0,1,0,0|2,0,0]=4 8094 B8R1.1 O=CC1CCC(=O)N1 Amb24113125 [0,1,0,1,0,0|2,0,0]=4 8095 B8R1.1 O=CC1COC(=O)C1 Amb26428572 [0,1,0,1,0,0|1,0,1]=4 8096 B8R1.1 O=CC1COC(=O)O1 Amb27446683 [0,1,0,1,0,0|1,0,1]=4 8097 B8R1.1 O=C[C@@H]1CCC(=O)N1 Amb27390986 [0,1,0,1,0,0|2,0,0]=4 8098 B8R1.1 O=C[C@H]1CCC(=O)O1 Amb27964499 [0,1,0,1,0,0|1,0,0]=3 8099 B8R1.1 O=C[C@H]1CCC(=O)S1 Amb27792268 [0,1,0,1,0,0|1,1,0]=4 8100 B8R1.1 O=S1COC(CCl)C1 Amb27257436 [0,1,0,1,0,0|2,0,0]=4 8101 B8R1.1 O=S1OCC(CBr)O1 Amb27873947 [0,1,0,1,0,0|2,0,0]=4 8102 B8R1.1 O=S1OCC(CCl)O1 Amb24624110 [0,1,0,1,0,0|2,0,0]=4 8103 B8R1.1 O=S1OCC(CF)O1 Amb21951909 [0,1,0,1,0,0|2,0,0]=4 8104 B8R1.1 O=S1OCC(CO)O1 Amb25802802 [0,1,0,1,0,0|2,0,0]=4 8105 B8R1.1 O=[PH]1OCC(CCl)O1 Amb27984375 [0,1,0,1,0,0|2,0,0]=4 8106 B8R1.1 OCC1CC(Br)=NO1 Amb23449512 [0,1,0,1,0,0|2,0,0]=4 8107 B8R1.1 OCC1CC(Cl)=NO1 Amb28381642 [0,1,0,1,0,0|2,0,0]=4 8108 B8R1.1 OCC1CN=C(S)O1 Amb25092005 [0,1,0,1,0,0|1,1,0]=4 8109 B8R1.1 OCC1CNC(O)=N1 Amb24602100 [0,1,0,1,0,0|2,0,0]=4 8110 B8R1.1 OCC1CSC(=S)O1 Amb28190348 [0,1,0,1,0,0|1,1,0]=4 8111 B8R1.1 S=C1OC(CCl)CS1 Amb27461326 [0,1,0,1,0,0|1,1,0]=4 8112 B8R1.1 [NH3+]C[C@@H]1CCC(=O)O1 Amb28464028 [0,1,0,1,0,0|0,0,1]=3 8113 B8R1.4 C=C1CCCC(=O)C1 Amb28132034 [0,1,0,1,0,0|2,0,0]=4 8114 B8R1.4 C=C1CNCC(C)C1 Amb35719512 [0,1,0,1,0,0|2,0,0]=4 8115 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,1,0,1,0,0|2,0,0]=4 8116 B8R1.4 CC1=CC(N)CNC1 Amb32989560 [0,1,0,1,0,0|2,0,0]=4 8117 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,1,0,1,0,0|1,0,1]=4 8118 B8R1.4 CC1=NC(=O)CCC1 Amb28239945 [0,1,0,1,0,0|2,0,0]=4 8119 B8R1.4 CC1CC(=O)CCN1 Amb1087926 [0,1,0,1,0,0|2,0,0]=4 8120 B8R1.4 CC1CC(=O)CCN1 Amb19515809 [0,1,0,1,0,0|2,0,0]=4 8121 B8R1.4 CC1CC(=O)CCN1 Amb30585094 [0,1,0,1,0,0|2,0,0]=4 8122 B8R1.4 CC1CC(=O)CCO1 Amb18833037 [0,1,0,1,0,0|2,0,0]=4 8123 B8R1.4 CC1CC(=O)CCS1 Amb27256424 [0,1,0,1,0,0|2,0,0]=4 8124 B8R1.4 CC1CC=CC(=O)C1 Amb4034490 [0,1,0,1,0,0|2,0,0]=4 8125 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,1,0,1,0,0|1,0,1]=4 8126 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,1,0,1,0,0|2,0,0]=4 8127 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,1,0,1,0,0|2,0,0]=4 8128 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,1,0,1,0,0|1,0,0]=3 8129 B8R1.4 CC1CCNC(=O)C1 Amb20668125 [0,1,0,1,0,0|2,0,0]=4 8130 B8R1.4 CC1CCNC(=O)N1 Amb27193730 [0,1,0,1,0,0|2,0,0]=4 8131 B8R1.4 CC1CCOC(=O)N1 Amb27655650 [0,1,0,1,0,0|2,0,0]=4 8132 B8R1.4 CC1CCOC(=O)O1 Amb33714707 [0,1,0,1,0,0|1,0,0]=3 8133 B8R1.4 CC1CCOS(=O)O1 Amb4010773 [0,1,0,1,0,0|2,0,0]=4 8134 B8R1.4 CC1CNCC(=O)C1 Amb26048394 [0,1,0,1,0,0|1,0,0]=3 8135 B8R1.4 CC1CNCC(=O)C1 Amb33494302 [0,1,0,1,0,0|1,0,0]=3 8136 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,1,0,1,0,0|2,0,0]=4 8137 B8R1.4 CC1CNCC(=O)N1 Amb32410668 [0,1,0,1,0,0|2,0,0]=4 8138 B8R1.4 CC1CNCC(O)C1 Amb24507417 [0,1,0,1,0,0|1,0,1]=4 8139 B8R1.4 CC1CNCC(O)C1 Amb28934840 [0,1,0,1,0,0|1,0,1]=4 8140 B8R1.4 CC1CNNC(=O)C1 Amb27800916 [0,1,0,1,0,0|1,0,0]=3 8141 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,1,0,1,0,0|2,0,0]=4 8142 B8R1.4 CC1NCCC(=O)N1 Amb32418334 [0,1,0,1,0,0|2,0,0]=4 8143 B8R1.4 CN1CCCC(=O)C1 Amb10602467 [0,1,0,1,0,0|1,0,0]=3 8144 B8R1.4 CN1CCCC(=O)C1 Amb22304741 [0,1,0,1,0,0|1,0,0]=3 8145 B8R1.4 CN1CCCC(=O)C1 Amb31204623 [0,1,0,1,0,0|1,0,0]=3 8146 B8R1.4 CN1CCCC(O)C1 Amb33623580 [0,1,0,1,0,0|1,0,1]=4 8147 B8R1.4 CN1CCCC(O)C1 Amb534752 [0,1,0,1,0,0|1,0,1]=4 8148 B8R1.4 CN1CCC[C@@H](O)C1 Amb22225150 [0,1,0,1,0,0|1,0,1]=4 8149 B8R1.4 CN1CCC[C@H](O)C1 Amb22225471 [0,1,0,1,0,0|1,0,1]=4 8150 B8R1.4 CN1CCNC(=O)C1 Amb19958159 [0,1,0,1,0,0|2,0,0]=4 8151 B8R1.4 CN1CCOC(=O)C1 Amb21963307 [0,1,0,1,0,0|2,0,0]=4 8152 B8R1.4 CN1CCOC(=O)C1 Amb22491652 [0,1,0,1,0,0|2,0,0]=4 8153 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb22748911 [0,1,0,1,0,0|2,0,0]=4 8154 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb23439312 [0,1,0,1,0,0|2,0,0]=4 8155 B8R1.4 C[C@@H]1CC(=O)CCN1 Amb27593729 [0,1,0,1,0,0|2,0,0]=4 8156 B8R1.4 C[C@@H]1CC(=O)CCO1 Amb23440042 [0,1,0,1,0,0|2,0,0]=4 8157 B8R1.4 C[C@@H]1CC=CC(=O)C1 Amb27762503 [0,1,0,1,0,0|2,0,0]=4 8158 B8R1.4 C[C@@H]1CCCC(=O)C1 Amb21618704 [0,1,0,1,0,0|2,0,0]=4 8159 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,1,0,1,0,0|2,0,0]=4 8160 B8R1.4 C[C@@H]1CCCC(=O)O1 Amb4166295 [0,1,0,1,0,0|1,0,0]=3 8161 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,1,0,1,0,0|2,0,0]=4 8162 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,1,0,1,0,0|2,0,0]=4 8163 B8R1.4 C[C@@H]1CNC[C@H](O)C1 Amb27212277 [0,1,0,1,0,0|1,0,1]=4 8164 B8R1.4 C[C@@H]1CNC[C@H](O)C1 Amb28644756 [0,1,0,1,0,0|1,0,1]=4 8165 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,1,0,1,0,0|2,0,0]=4 8166 B8R1.4 C[C@H]1CC(=O)CCN1 Amb22406027 [0,1,0,1,0,0|2,0,0]=4 8167 B8R1.4 C[C@H]1CC(=O)CCN1 Amb28072876 [0,1,0,1,0,0|2,0,0]=4 8168 B8R1.4 C[C@H]1CC(=O)CCN1 Amb33801725 [0,1,0,1,0,0|2,0,0]=4 8169 B8R1.4 C[C@H]1CC(=O)CCO1 Amb27969730 [0,1,0,1,0,0|2,0,0]=4 8170 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,1,0,1,0,0|1,0,1]=4 8171 B8R1.4 C[C@H]1CCCC(=O)C1 Amb22799724 [0,1,0,1,0,0|2,0,0]=4 8172 B8R1.4 C[C@H]1CCCC(=O)O1 Amb26865751 [0,1,0,1,0,0|1,0,0]=3 8173 B8R1.4 C[C@H]1CCNC(=O)C1 Amb25739591 [0,1,0,1,0,0|2,0,0]=4 8174 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,1,0,1,0,0|2,0,0]=4 8175 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,1,0,1,0,0|2,0,0]=4 8176 B8R1.4 C[C@H]1CNC[C@@H](O)C1 Amb28057034 [0,1,0,1,0,0|1,0,1]=4 8177 B8R1.4 C[C@H]1CNC[C@H](O)C1 Amb27630532 [0,1,0,1,0,0|1,0,1]=4 8178 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,1,0,1,0,0|2,0,0]=4 8179 B8R1.4 NC1=CC(=O)CCC1 Amb1151335 [0,1,0,1,0,0|1,0,0]=3 8180 B8R1.4 NC1=CC(=O)COC1 Amb25785409 [0,1,0,1,0,0|1,0,1]=4 8181 B8R1.4 NC1=CC(=O)CSC1 Amb28066865 [0,1,0,1,0,0|1,0,1]=4 8182 B8R1.4 NC1=CC(=O)NCC1 Amb22229455 [0,1,0,1,0,0|1,0,1]=4 8183 B8R1.4 NC1=CC(=S)CCC1 Amb27839581 [0,1,0,1,0,0|1,1,0]=4 8184 B8R1.4 NC1=CC(O)CCC1 Amb28127332 [0,1,0,1,0,0|1,0,1]=4 8185 B8R1.4 NC1CCCC(=O)C1 Amb23440459 [0,1,0,1,0,0|1,0,0]=3 8186 B8R1.4 NC1CCCC(=O)C1 Amb8387391 [0,1,0,1,0,0|1,0,0]=3 8187 B8R1.4 NC1CCCC(O)C1 Amb22491291 [0,1,0,1,0,0|1,0,1]=4 8188 B8R1.4 NC1CCCC(O)C1 Amb9717357 [0,1,0,1,0,0|1,0,1]=4 8189 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,1,0,1,0,0|1,0,0]=3 8190 B8R1.4 NC1CCNC(=O)C1 Amb19957631 [0,1,0,1,0,0|1,0,0]=3 8191 B8R1.4 NC1CCNC(=O)C1 Amb21960626 [0,1,0,1,0,0|1,0,0]=3 8192 B8R1.4 NC1COCC(=O)C1 Amb33623050 [0,1,0,1,0,0|1,0,0]=3 8193 B8R1.4 NC1COCC(=O)C1 Amb33716160 [0,1,0,1,0,0|1,0,0]=3 8194 B8R1.4 NC1COCC(O)C1 Amb24526934 [0,1,0,1,0,0|1,0,1]=4 8195 B8R1.4 NC1COCC(O)C1 Amb31291238 [0,1,0,1,0,0|1,0,1]=4 8196 B8R1.4 N[C@@H]1CCCS(=O)C1 Amb25168909 [0,1,0,1,0,0|2,0,0]=4 8197 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 Amb24074365 [0,1,0,1,0,0|1,0,1]=4 8198 B8R1.4 N[C@@H]1CCC[C@@H](O)C1 Amb24671187 [0,1,0,1,0,0|1,0,1]=4 8199 B8R1.4 N[C@@H]1CCC[C@H](O)C1 Amb33870222 [0,1,0,1,0,0|1,0,1]=4 8200 B8R1.4 N[C@@H]1CCNC(=O)C1 Amb27489147 [0,1,0,1,0,0|1,0,0]=3 8201 B8R1.4 N[C@H]1CCCS(=O)C1 Amb27838286 [0,1,0,1,0,0|2,0,0]=4 8202 B8R1.4 N[C@H]1CCC[C@@H](O)C1 Amb22746547 [0,1,0,1,0,0|1,0,1]=4 8203 B8R1.4 N[C@H]1CCC[C@@H](O)C1 Amb22752827 [0,1,0,1,0,0|1,0,1]=4 8204 B8R1.4 N[C@H]1CCC[C@H](O)C1 Amb22828171 [0,1,0,1,0,0|1,0,1]=4 8205 B8R1.4 N[C@H]1CCC[C@H](O)C1 Amb22886176 [0,1,0,1,0,0|1,0,1]=4 8206 B8R1.4 N[C@H]1CCNC(=O)C1 Amb25168718 [0,1,0,1,0,0|1,0,0]=3 8207 B8R1.4 N[C@H]1COC[C@H](O)C1 Amb26008196 [0,1,0,1,0,0|1,0,1]=4 8208 B8R1.4 O=C1C=C(Br)CCC1 Amb33542768 [0,1,0,1,0,0|2,0,0]=4 8209 B8R1.4 O=C1C=C(Cl)CCC1 Amb2697044 [0,1,0,1,0,0|2,0,0]=4 8210 B8R1.4 O=C1C=C(I)CCC1 Amb25706767 [0,1,0,1,0,0|2,0,0]=4 8211 B8R1.4 O=C1C=C(O)CCC1 Amb17844413 [0,1,0,1,0,0|2,0,0]=4 8212 B8R1.4 O=C1C=CCC(O)C1 Amb27227199 [0,1,0,1,0,0|2,0,0]=4 8213 B8R1.4 O=C1C=[N+]([O-])CCC1 Amb27751417 [0,1,0,1,0,0|1,0,1]=4 8214 B8R1.4 O=C1CC(F)CCN1 Amb27459538 [0,1,0,1,0,0|2,0,0]=4 8215 B8R1.4 O=C1CC(O)CCN1 Amb10602744 [0,1,0,1,0,0|2,0,0]=4 8216 B8R1.4 O=C1CCCC(=O)C1 Amb932798 [0,1,0,1,0,0|2,0,0]=4 8217 B8R1.4 O=C1CCCC(=O)N1 Amb8386485 [0,1,0,1,0,0|2,0,0]=4 8218 B8R1.4 O=C1CCCC(=O)O1 Amb6608952 [0,1,0,1,0,0|1,0,0]=3 8219 B8R1.4 O=C1CCCC(=O)S1 Amb27849467 [0,1,0,1,0,0|1,1,0]=4 8220 B8R1.4 O=C1CCCC(Br)C1 Amb27850962 [0,1,0,1,0,0|2,0,0]=4 8221 B8R1.4 O=C1CCCC(Cl)C1 Amb26946112 [0,1,0,1,0,0|2,0,0]=4 8222 B8R1.4 O=C1CCCC(Cl)N1 Amb28423467 [0,1,0,1,0,0|2,0,0]=4 8223 B8R1.4 O=C1CCCC(F)C1 Amb24578309 [0,1,0,1,0,0|2,0,0]=4 8224 B8R1.4 O=C1CCCC(I)C1 Amb24436778 [0,1,0,1,0,0|2,0,0]=4 8225 B8R1.4 O=C1CCCC(O)C1 Amb22754759 [0,1,0,1,0,0|2,0,0]=4 8226 B8R1.4 O=C1CCCC(O)N1 Amb26394230 [0,1,0,1,0,0|2,0,0]=4 8227 B8R1.4 O=C1CCC[C@@H](O)C1 Amb25320136 [0,1,0,1,0,0|2,0,0]=4 8228 B8R1.4 O=C1CCC[C@H](O)C1 Amb27432456 [0,1,0,1,0,0|2,0,0]=4 8229 B8R1.4 O=C1CCNC(=O)O1 Amb22011553 [0,1,0,1,0,0|1,0,1]=4 8230 B8R1.4 O=C1CCOC(=O)C1 Amb26459895 [0,1,0,1,0,0|1,0,1]=4 8231 B8R1.4 O=C1CNCC(=O)C1 Amb26464137 [0,1,0,1,0,0|1,0,1]=4 8232 B8R1.4 O=C1COCC(=O)O1 Amb1214326 [0,1,0,1,0,0|1,0,1]=4 8233 B8R1.4 O=C1CSCC(=O)O1 Amb2725405 [0,1,0,1,0,0|1,0,1]=4 8234 B8R1.4 O=C1C[C@@H](O)CCN1 Amb22744924 [0,1,0,1,0,0|2,0,0]=4 8235 B8R1.4 O=C1C[C@H](O)CCN1 Amb17845212 [0,1,0,1,0,0|2,0,0]=4 8236 B8R1.4 OC1CNCC(F)C1 Amb27449555 [0,1,0,1,0,0|1,0,1]=4 8237 B8R1.4 OC1CNCC(F)C1 Amb32684603 [0,1,0,1,0,0|1,0,1]=4 8238 B8R1.4 OC1CNCC(O)C1 Amb23454681 [0,1,0,1,0,0|1,0,1]=4 8239 B8R1.4 OC1CNCC(O)C1 Amb32665993 [0,1,0,1,0,0|1,0,1]=4 8240 B8R1.4 O[C@@H]1CNC[C@@H](F)C1 Amb34915397 [0,1,0,1,0,0|1,0,1]=4 8241 B8R1.4 O[C@@H]1CNC[C@H](F)C1 Amb28722811 [0,1,0,1,0,0|1,0,1]=4 8242 B8R1.4 O[C@@H]1CNC[C@H](O)C1 Amb27171046 [0,1,0,1,0,0|1,0,1]=4 8243 B8R1.4 O[C@@H]1CNC[C@H](O)C1 Amb30526702 [0,1,0,1,0,0|1,0,1]=4 8244 B8R1.4 O[C@H]1CNC[C@@H](F)C1 Amb32667282 [0,1,0,1,0,0|1,0,1]=4 8245 B8R1.4 O[C@H]1CNC[C@H](F)C1 Amb32665299 [0,1,0,1,0,0|1,0,1]=4 8246 B8R1.4 O[C@H]1CNC[C@H](F)C1 Amb32665520 [0,1,0,1,0,0|1,0,1]=4 8247 B8R1.4 O[C@H]1CNC[C@H](O)C1 Amb27871441 [0,1,0,1,0,0|1,0,1]=4 8248 B8R1.18 C=C1CC(C)OC1=O Amb8389608 [0,1,0,1,0,0|1,0,1]=4 8249 B8R1.18 CC1CC(=O)C(C)C1 Amb26510571 [0,1,0,1,0,0|2,0,0]=4 8250 B8R1.18 CC1CC(=O)CC1C Amb25933629 [0,1,0,1,0,0|2,0,0]=4 8251 B8R1.18 CC1CC(=O)NC1C Amb20623595 [0,1,0,1,0,0|2,0,0]=4 8252 B8R1.18 CC1CC(=O)NC1O Amb27975748 [0,1,0,1,0,0|2,0,0]=4 8253 B8R1.18 CC1CC(=O)OC1=O Amb3940407 [0,1,0,1,0,0|1,0,1]=4 8254 B8R1.18 CC1CC(=O)OC1C Amb27873473 [0,1,0,1,0,0|1,0,0]=3 8255 B8R1.18 CC1CC(=O)OC1O Amb26536810 [0,1,0,1,0,0|1,0,0]=3 8256 B8R1.18 CC1CC(Br)C(=O)O1 Amb6608903 [0,1,0,1,0,0|1,0,0]=3 8257 B8R1.18 CC1CC(C)C(=O)N1 Amb24698782 [0,1,0,1,0,0|2,0,0]=4 8258 B8R1.18 CC1CC(C)C(=O)O1 Amb4017434 [0,1,0,1,0,0|1,0,0]=3 8259 B8R1.18 CC1CC(N)C(=O)O1 Amb32653104 [0,1,0,1,0,0|1,0,0]=3 8260 B8R1.18 CC1CC(N)C(=O)O1 Amb448594 [0,1,0,1,0,0|1,0,0]=3 8261 B8R1.18 CC1CC(O)C(=O)N1 Amb27784846 [0,1,0,1,0,0|2,0,0]=4 8262 B8R1.18 CC1CC(O)C(=O)O1 Amb27451083 [0,1,0,1,0,0|1,0,0]=3 8263 B8R1.18 CC1CC(O)CC1N Amb25169593 [0,1,0,1,0,0|1,0,1]=4 8264 B8R1.18 CC1C[C@@H](C)CC1=O Amb27424916 [0,1,0,1,0,0|2,0,0]=4 8265 B8R1.18 CC1C[C@H](N)C(=O)O1 Amb27844768 [0,1,0,1,0,0|1,0,0]=3 8266 B8R1.18 CC1NC(=O)CC1O Amb27792924 [0,1,0,1,0,0|2,0,0]=4 8267 B8R1.18 CC1NC(=O)OC1C Amb25747248 [0,1,0,1,0,0|2,0,0]=4 8268 B8R1.18 CC1OC(=O)CC1=O Amb28290899 [0,1,0,1,0,0|1,0,1]=4 8269 B8R1.18 CC1OC(=O)OC1C Amb27485944 [0,1,0,1,0,0|2,0,0]=4 8270 B8R1.18 CN1CC(N)CC1=O Amb19373494 [0,1,0,1,0,0|2,0,0]=4 8271 B8R1.18 CN1CC(N)CC1=O Amb8010271 [0,1,0,1,0,0|2,0,0]=4 8272 B8R1.18 CN1C[C@@H](N)CC1=O Amb24401527 [0,1,0,1,0,0|2,0,0]=4 8273 B8R1.18 CN1C[C@H](N)CC1=O Amb33295339 [0,1,0,1,0,0|2,0,0]=4 8274 B8R1.18 C[C@@H]1CC(=O)C[C@H]1C Amb24470272 [0,1,0,1,0,0|2,0,0]=4 8275 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,1,0,1,0,0|1,0,1]=4 8276 B8R1.18 C[C@@H]1C[C@@H](Cl)C(=O)O1 Amb25288126 [0,1,0,1,0,0|1,0,0]=3 8277 B8R1.18 C[C@@H]1NC(=O)O[C@@H]1C Amb28132650 [0,1,0,1,0,0|2,0,0]=4 8278 B8R1.18 C[C@@H]1OC(=O)C[C@H]1Cl Amb27252234 [0,1,0,1,0,0|1,0,0]=3 8279 B8R1.18 C[C@H]1CC(=O)C[C@H]1C Amb22230244 [0,1,0,1,0,0|2,0,0]=4 8280 B8R1.18 C[C@H]1CC(=O)OC1=O Amb2609932 [0,1,0,1,0,0|1,0,1]=4 8281 B8R1.18 C[C@H]1CC(=O)O[C@H]1C Amb27471867 [0,1,0,1,0,0|1,0,0]=3 8282 B8R1.18 C[C@H]1CC(=O)[C@H](C)C1 Amb28429622 [0,1,0,1,0,0|2,0,0]=4 8283 B8R1.18 C[C@H]1C[C@@H](C)C(=O)O1 Amb28060142 [0,1,0,1,0,0|1,0,0]=3 8284 B8R1.18 C[C@H]1C[C@@H](C)NC1=O Amb27619178 [0,1,0,1,0,0|2,0,0]=4 8285 B8R1.18 C[C@H]1C[C@H](O)C(=O)O1 Amb27852763 [0,1,0,1,0,0|1,0,0]=3 8286 B8R1.18 C[C@H]1NC(=O)C[C@@H]1O Amb28128239 [0,1,0,1,0,0|2,0,0]=4 8287 B8R1.18 C[C@H]1NC(=O)C[C@@H]1S Amb28388503 [0,1,0,1,0,0|2,0,0]=4 8288 B8R1.18 C[C@H]1NC(=O)C[C@H]1O Amb28131156 [0,1,0,1,0,0|2,0,0]=4 8289 B8R1.18 C[C@H]1NC(=O)C[C@H]1S Amb27621424 [0,1,0,1,0,0|2,0,0]=4 8290 B8R1.18 C[C@H]1OC(=O)C[C@@H]1N Amb27973900 [0,1,0,1,0,0|1,0,0]=3 8291 B8R1.18 C[C@H]1OC(=O)C[C@H]1O Amb27775518 [0,1,0,1,0,0|1,0,0]=3 8292 B8R1.18 NC1CC(=O)CC1N Amb27486601 [0,1,0,1,0,0|1,0,0]=3 8293 B8R1.18 NC1CC(=O)OC1=O Amb27216215 [0,1,0,1,0,0|1,0,1]=4 8294 B8R1.18 NC1CC(N)C(O)C1 Amb26318240 [0,1,0,1,0,0|1,0,1]=4 8295 B8R1.18 NC1CC(O)C(F)C1 Amb27191992 [0,1,0,1,0,0|1,0,1]=4 8296 B8R1.18 NC1CC(O)C(O)C1 Amb25882186 [0,1,0,1,0,0|1,0,1]=4 8297 B8R1.18 NC1CC(O)C(O)C1 Amb32753507 [0,1,0,1,0,0|1,0,1]=4 8298 B8R1.18 NC1CC(O)CC1N Amb25780569 [0,1,0,1,0,0|1,0,1]=4 8299 B8R1.18 NC1CC(O)CC1N Amb32753506 [0,1,0,1,0,0|1,0,1]=4 8300 B8R1.18 NC1CC(O)CC1O Amb27431336 [0,1,0,1,0,0|1,0,1]=4 8301 B8R1.18 NC1C[C@H](O)[C@H](O)C1 Amb26454569 [0,1,0,1,0,0|1,0,1]=4 8302 B8R1.18 NC1C[C@H](O)[C@H](O)C1 Amb30585141 [0,1,0,1,0,0|1,0,1]=4 8303 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb25992097 [0,1,0,1,0,0|1,0,1]=4 8304 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb8631355 [0,1,0,1,0,0|1,0,1]=4 8305 B8R1.18 N[C@@H]1C[C@H](O)C[C@H]1O Amb26952064 [0,1,0,1,0,0|1,0,1]=4 8306 B8R1.18 N[C@@H]1C[C@H](O)C[C@H]1O Amb35752607 [0,1,0,1,0,0|1,0,1]=4 8307 B8R1.18 N[C@@H]1C[C@H](O)[C@H](O)C1 Amb31291163 [0,1,0,1,0,0|1,0,1]=4 8308 B8R1.18 N[C@@H]1C[C@H](O)[C@H](O)C1 Amb32680772 [0,1,0,1,0,0|1,0,1]=4 8309 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,1,0,1,0,0|1,0,1]=4 8310 B8R1.18 N[C@H]1CC(=O)O[C@H]1O Amb28196677 [0,1,0,1,0,0|1,0,0]=3 8311 B8R1.18 N[C@H]1C[C@@H](N)[C@H](O)C1 Amb27777928 [0,1,0,1,0,0|1,0,1]=4 8312 B8R1.18 N[C@H]1C[C@@H](O)C[C@H]1N Amb27220742 [0,1,0,1,0,0|1,0,1]=4 8313 B8R1.18 N[C@H]1C[C@@H](O)C[C@H]1N Amb32682415 [0,1,0,1,0,0|1,0,1]=4 8314 B8R1.18 N[C@H]1C[C@H](O)C[C@@H]1O Amb27881771 [0,1,0,1,0,0|1,0,1]=4 8315 B8R1.18 N[C@H]1C[C@H](O)C[C@H]1N Amb24604338 [0,1,0,1,0,0|1,0,1]=4 8316 B8R1.18 N[C@H]1C[C@H](O)C[C@H]1N Amb32682336 [0,1,0,1,0,0|1,0,1]=4 8317 B8R1.18 N[C@H]1C[C@H](O)[C@H](O)C1 Amb25024569 [0,1,0,1,0,0|1,0,1]=4 8318 B8R1.18 N[C@H]1C[C@H](O)[C@H](O)C1 Amb30585207 [0,1,0,1,0,0|1,0,1]=4 8319 B8R1.18 O=C1CC(Cl)C(=O)O1 Amb24677749 [0,1,0,1,0,0|1,0,1]=4 8320 B8R1.18 O=C1CC(O)C(=O)O1 Amb27399619 [0,1,0,1,0,0|1,0,1]=4 8321 B8R1.18 O=C1C[C@@H](F)C(=O)O1 Amb28286140 [0,1,0,1,0,0|1,0,1]=4 8322 B8R1.18 O=C1C[C@@H](O)[C@H](O)C1 Amb27841798 [0,1,0,1,0,0|2,0,0]=4 8323 B8R1.18 O=C1C[C@H](F)C(=O)O1 Amb27406936 [0,1,0,1,0,0|1,0,1]=4 8324 B8R1.18 O=C1OC(Cl)C(Cl)O1 Amb20670724 [0,1,0,1,0,0|2,0,0]=4 8325 B8R1.18 O=C1OC(O)CC1O Amb27761542 [0,1,0,1,0,0|1,0,0]=3 8326 B8R1.18 O=C1O[C@@H](Cl)[C@H](Cl)O1 Amb25061412 [0,1,0,1,0,0|2,0,0]=4 8327 B8R1.20 C=C1CC1CC(=O)O Amb25870954 [0,1,0,1,0,0|1,0,0]=3 8328 B8R1.20 C=C1CC1CC(C)=O Amb28326031 [0,1,0,1,0,0|2,0,0]=4 8329 B8R1.20 C=C1CC1CC(N)=O Amb25138537 [0,1,0,1,0,0|2,0,0]=4 8330 B8R1.20 CC(=O)CC1CC1C Amb26916692 [0,1,0,1,0,0|2,0,0]=4 8331 B8R1.20 CC(=O)CC1OC1C Amb27767850 [0,1,0,1,0,0|2,0,0]=4 8332 B8R1.20 CC(=O)C[C@H]1C[C@H]1C Amb28121459 [0,1,0,1,0,0|2,0,0]=4 8333 B8R1.20 CC(=O)NC1CC1N Amb32663550 [0,1,0,1,0,0|1,0,0]=3 8334 B8R1.20 CC(=O)NC1CC1N Amb9457357 [0,1,0,1,0,0|1,0,0]=3 8335 B8R1.20 CC(=O)N[C@@H]1C[C@H]1N Amb32664511 [0,1,0,1,0,0|1,0,0]=3 8336 B8R1.20 CC(=O)N[C@@H]1C[C@H]1N Amb32664512 [0,1,0,1,0,0|1,0,0]=3 8337 B8R1.20 CC1CC1CC(=O)O Amb25316515 [0,1,0,1,0,0|1,0,0]=3 8338 B8R1.20 CC1CC1NC(=O)Cl Amb35625773 [0,1,0,1,0,0|2,0,0]=4 8339 B8R1.20 CC1C\C1=C/C(=O)O Amb25256441 [0,1,0,1,0,0|1,0,1]=4 8340 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [0,1,0,1,0,0|1,0,0]=3 8341 B8R1.20 C[C@@H]1C[C@H]1NC(N)=O Amb28059830 [0,1,0,1,0,0|2,0,0]=4 8342 B8R1.20 NC1CC1CC(=O)O Amb27201670 [0,1,0,1,0,0|0,0,0]=2 8343 B8R1.20 N[C@@H]1C[C@H]1CC(=O)O Amb27252154 [0,1,0,1,0,0|0,0,0]=2 8344 B8R1.20 O=C(O)CC1CC1O Amb27981662 [0,1,0,1,0,0|1,0,0]=3 8345 B8R1.31 C=C1CCC1C(=O)O Amb28281144 [0,1,0,1,0,0|1,0,0]=3 8346 B8R1.31 CC(=O)C1CCC1=O Amb26910118 [0,1,0,1,0,0|2,0,0]=4 8347 B8R1.31 CC(=O)C1CCC1O Amb33213172 [0,1,0,1,0,0|2,0,0]=4 8348 B8R1.31 CC(=O)N1CCC1C Amb27603227 [0,1,0,1,0,0|2,0,0]=4 8349 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C Amb26866992 [0,1,0,1,0,0|2,0,0]=4 8350 B8R1.31 CC(=O)[C@H]1CC[C@H]1C Amb26361346 [0,1,0,1,0,0|2,0,0]=4 8351 B8R1.31 CC1CCC1C(=O)O Amb21857447 [0,1,0,1,0,0|1,0,0]=3 8352 B8R1.31 CC1NCC1C(=O)O Amb26984410 [0,1,0,1,0,0|1,0,0]=3 8353 B8R1.31 CN1CCC1C(=O)O Amb22011586 [0,1,0,1,0,0|0,0,0]=2 8354 B8R1.31 CN1CC[C@@H]1C(=O)O Amb24183372 [0,1,0,1,0,0|0,0,0]=2 8355 B8R1.31 CN1CC[C@H]1C(=O)O Amb24699921 [0,1,0,1,0,0|0,0,0]=2 8356 B8R1.31 C[C@@H]1CC[C@@H]1C(=O)O Amb28203929 [0,1,0,1,0,0|1,0,0]=3 8357 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb24597629 [0,1,0,1,0,0|0,0,0]=2 8358 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb33620541 [0,1,0,1,0,0|0,0,0]=2 8359 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O Amb34913092 [0,1,0,1,0,0|1,0,0]=3 8360 B8R1.31 C[C@H]1CC[C@H]1C(N)=O Amb27237000 [0,1,0,1,0,0|2,0,0]=4 8361 B8R1.31 NC(=O)C1CCC1F Amb32943793 [0,1,0,1,0,0|2,0,0]=4 8362 B8R1.31 NC(=O)C1CCC1N Amb20248288 [0,1,0,1,0,0|1,0,0]=3 8363 B8R1.31 NC(=O)[C@@H]1CC[C@H]1N Amb27225132 [0,1,0,1,0,0|1,0,0]=3 8364 B8R1.31 NC1CCC1C(=O)O Amb26979562 [0,1,0,1,0,0|0,0,0]=2 8365 B8R1.31 NC1COC1C(=O)O Amb28428430 [0,1,0,1,0,0|0,0,0]=2 8366 B8R1.31 NN1CC[C@H]1C(=O)O Amb27261518 [0,1,0,1,0,0|0,0,0]=2 8367 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24117048 [0,1,0,1,0,0|0,0,0]=2 8368 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24183584 [0,1,0,1,0,0|0,0,0]=2 8369 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb25976891 [0,1,0,1,0,0|0,0,0]=2 8370 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb31291972 [0,1,0,1,0,0|0,0,0]=2 8371 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Amb24681491 [0,1,0,1,0,0|0,0,0]=2 8372 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb27187220 [0,1,0,1,0,0|0,0,0]=2 8373 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb33805288 [0,1,0,1,0,0|0,0,0]=2 8374 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb25911896 [0,1,0,1,0,0|0,0,0]=2 8375 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb33801366 [0,1,0,1,0,0|0,0,0]=2 8376 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Amb25324265 [0,1,0,1,0,0|0,0,0]=2 8377 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Amb25929776 [0,1,0,1,0,0|0,0,0]=2 8378 B8R1.31 O=C(O)C1=C(Br)CC1 Amb28454412 [0,1,0,1,0,0|1,0,1]=4 8379 B8R1.31 O=C(O)C1=C(Cl)CC1 Amb33609521 [0,1,0,1,0,0|1,0,1]=4 8380 B8R1.31 O=C(O)C1C=CC1Br Amb27220099 [0,1,0,1,0,0|1,0,1]=4 8381 B8R1.31 O=C(O)C1C=CC1O Amb27475863 [0,1,0,1,0,0|1,0,1]=4 8382 B8R1.31 O=C(O)C1CCC1Cl Amb27490061 [0,1,0,1,0,0|1,0,0]=3 8383 B8R1.31 O=C(O)C1CCC1F Amb27835547 [0,1,0,1,0,0|1,0,0]=3 8384 B8R1.31 O=C(O)C1CCC1O Amb24481384 [0,1,0,1,0,0|1,0,0]=3 8385 B8R1.31 O=C(O)C1CNC1=O Amb24524290 [0,1,0,1,0,0|1,0,1]=4 8386 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O Amb27619188 [0,1,0,1,0,0|1,0,0]=3 8387 B8R1.31 O=C(O)[C@@H]1CNC1=O Amb26452604 [0,1,0,1,0,0|1,0,1]=4 8388 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O Amb34913090 [0,1,0,1,0,0|1,0,0]=3 8389 B8R1.31 O=C(O)[C@H]1CNC1=O Amb34146450 [0,1,0,1,0,0|1,0,1]=4 8390 B8R1.34 C=C(C)CC1CNC1 Amb24576858 [0,1,0,1,0,0|2,0,0]=4 8391 B8R1.34 CC(=O)CC1CCC1 Amb20668826 [0,1,0,1,0,0|2,0,0]=4 8392 B8R1.34 CC(=O)CC1CNC1 Amb26366652 [0,1,0,1,0,0|1,0,0]=3 8393 B8R1.34 CC(=O)CC1COC1 Amb22728373 [0,1,0,1,0,0|2,0,0]=4 8394 B8R1.34 CC(=O)NC1CNC1 Amb21960869 [0,1,0,1,0,0|2,0,0]=4 8395 B8R1.34 CC(=O)NC1CNC1 Amb8011307 [0,1,0,1,0,0|2,0,0]=4 8396 B8R1.34 CC(=O)OC1CNC1 Amb21956164 [0,1,0,1,0,0|2,0,0]=4 8397 B8R1.34 CC(=O)OC1CNC1 Amb21959342 [0,1,0,1,0,0|2,0,0]=4 8398 B8R1.34 CC(=O)OC1CNC1 Amb30594705 [0,1,0,1,0,0|2,0,0]=4 8399 B8R1.34 CC(=O)SC1CNC1 Amb26017419 [0,1,0,1,0,0|2,0,0]=4 8400 B8R1.34 CC(=O)SC1CNC1 Amb34154195 [0,1,0,1,0,0|2,0,0]=4 8401 B8R1.34 CC(O)CC1CNC1 Amb35622518 [0,1,0,1,0,0|1,0,1]=4 8402 B8R1.34 CS(=O)CC1CNC1 Amb26615132 [0,1,0,1,0,0|2,0,0]=4 8403 B8R1.34 CS(=O)CC1CNC1 Amb35752883 [0,1,0,1,0,0|2,0,0]=4 8404 B8R1.34 NC(=O)CC1CNC1 Amb25890059 [0,1,0,1,0,0|1,0,0]=3 8405 B8R1.34 NC(=O)CC1CNC1 Amb28819957 [0,1,0,1,0,0|1,0,0]=3 8406 B8R1.34 NC(=O)NC1CCC1 Amb24692278 [0,1,0,1,0,0|2,0,0]=4 8407 B8R1.34 NC(=O)NC1CNC1 Amb27624358 [0,1,0,1,0,0|2,0,0]=4 8408 B8R1.34 NC(=O)NC1CNC1 Amb35745883 [0,1,0,1,0,0|2,0,0]=4 8409 B8R1.34 NC(=O)OC1CCC1 Amb27976028 [0,1,0,1,0,0|2,0,0]=4 8410 B8R1.34 NC(=O)OC1CNC1 Amb23598269 [0,1,0,1,0,0|2,0,0]=4 8411 B8R1.34 NC(=O)OC1CNC1 Amb33329462 [0,1,0,1,0,0|2,0,0]=4 8412 B8R1.34 O=C(Cl)CC1CCC1 Amb22491179 [0,1,0,1,0,0|2,0,0]=4 8413 B8R1.34 O=C(Cl)NC1CCC1 Amb35625531 [0,1,0,1,0,0|2,0,0]=4 8414 B8R1.34 O=C(Cl)OC1CCC1 Amb33532032 [0,1,0,1,0,0|2,0,0]=4 8415 B8R1.34 O=C(O)C=C1CCC1 Amb20667794 [0,1,0,1,0,0|1,0,1]=4 8416 B8R1.34 O=C(O)C=C1CNC1 Amb27255049 [0,1,0,1,0,0|0,0,2]=4 8417 B8R1.34 O=C(O)C=C1CNC1 Amb34150330 [0,1,0,1,0,0|0,0,2]=4 8418 B8R1.34 O=C(O)CC1CCC1 Amb2696078 [0,1,0,1,0,0|1,0,0]=3 8419 B8R1.34 O=C(O)CC1CCN1 Amb25068427 [0,1,0,1,0,0|0,0,0]=2 8420 B8R1.34 O=C(O)CC1CCO1 Amb28136625 [0,1,0,1,0,0|1,0,0]=3 8421 B8R1.34 O=C(O)CC1CNC1 Amb21856240 [0,1,0,1,0,0|0,0,0]=2 8422 B8R1.34 O=C(O)CC1CNC1 Amb22057370 [0,1,0,1,0,0|0,0,0]=2 8423 B8R1.34 O=C(O)CC1CNC1 Amb22739043 [0,1,0,1,0,0|0,0,0]=2 8424 B8R1.34 O=C(O)CC1COC1 Amb18199145 [0,1,0,1,0,0|1,0,0]=3 8425 B8R1.34 O=C(O)CC1CSC1 Amb26049907 [0,1,0,1,0,0|1,0,0]=3 8426 B8R1.34 O=C(O)CN1CCC1 Amb28934892 [0,1,0,1,0,0|1,0,0]=3 8427 B8R1.34 O=C(O)C[C@@H]1CCO1 Amb33715997 [0,1,0,1,0,0|1,0,0]=3 8428 B8R1.34 O=C(O)C[C@H]1CCO1 Amb26570015 [0,1,0,1,0,0|1,0,0]=3 8429 B8R1.34 O=C([O-])CC1COC1 Amb32664987 [0,1,0,1,0,0|1,0,1]=4 8430 B8R1.34 O=S(O)CC1CCC1 Amb27426399 [0,1,0,1,0,0|2,0,0]=4 8431 B8R1.34 O=S([O-])CC1CNC1 Amb32755470 [0,1,0,1,0,0|1,0,1]=4 8432 B8R1.40 C=CC(=O)CC1CC1 Amb27203132 [0,1,0,1,0,0|2,0,0]=4 8433 B8R1.40 CCC(=O)CC1CC1 Amb26322177 [0,1,0,1,0,0|2,0,0]=4 8434 B8R1.40 CCC(=O)CC1CO1 Amb28316245 [0,1,0,1,0,0|2,0,0]=4 8435 B8R1.40 COC(=O)CC1CC1 Amb20622313 [0,1,0,1,0,0|1,0,0]=3 8436 B8R1.40 COC(=O)NC1CC1 Amb17869115 [0,1,0,1,0,0|2,0,0]=4 8437 B8R1.40 NCC(=O)CC1CC1 Amb18203369 [0,1,0,1,0,0|2,0,0]=4 8438 B8R1.40 NCC(=O)CC1CC1 Amb32410146 [0,1,0,1,0,0|2,0,0]=4 8439 B8R1.40 NNC(=O)CC1CC1 Amb8858841 [0,1,0,1,0,0|2,0,0]=4 8440 B8R1.40 N\C(CC1CC1)=N/O Amb33531894 [0,1,0,1,0,0|2,0,0]=4 8441 B8R1.40 O=C(CBr)CC1CC1 Amb33545541 [0,1,0,1,0,0|2,0,0]=4 8442 B8R1.40 O=C(CCl)CC1CC1 Amb22395343 [0,1,0,1,0,0|2,0,0]=4 8443 B8R1.40 O=C(CO)NC1CC1 Amb5798093 [0,1,0,1,0,0|2,0,0]=4 8444 B8R1.40 O=CC(O)CC1CC1 Amb27490937 [0,1,0,1,0,0|1,0,1]=4 8445 B8R1.42 CC(=O)CC1(C)CC1 Amb10607353 [0,1,0,1,0,0|2,0,0]=4 8446 B8R1.42 CC(=O)CC1(N)CC1 Amb28073167 [0,1,0,1,0,0|2,0,0]=4 8447 B8R1.42 CC1(CC(=O)O)CC1 Amb33544283 [0,1,0,1,0,0|1,0,0]=3 8448 B8R1.42 CC1(CC(=O)O)N=N1 Amb27424155 [0,1,0,1,0,0|1,0,1]=4 8449 B8R1.42 NC(=O)CC1(N)CC1 Amb26530454 [0,1,0,1,0,0|2,0,0]=4 8450 B8R1.42 NC1(CC(=O)O)CC1 Amb18833024 [0,1,0,1,0,0|1,0,0]=3 8451 B8R1.42 NC1(CC(=O)O)CC1 Amb33550832 [0,1,0,1,0,0|1,0,0]=3 8452 B8R1.42 O=C(O)CC1(Br)CC1 Amb27261767 [0,1,0,1,0,0|1,0,0]=3 8453 B8R1.42 O=C(O)CC1(Cl)CC1 Amb35743975 [0,1,0,1,0,0|1,0,0]=3 8454 B8R1.42 O=C(O)CC1(F)CC1 Amb28434812 [0,1,0,1,0,0|1,0,0]=3 8455 B8R1.42 O=C(O)CC1(O)CC1 Amb24117238 [0,1,0,1,0,0|1,0,0]=3 8456 B8R1.43 C#CC1CC1C(=O)O Amb27398329 [0,1,0,1,0,0|1,0,0]=3 8457 B8R1.43 C#C[C@H]1C[C@@H]1C(=O)O Amb24076488 [0,1,0,1,0,0|1,0,0]=3 8458 B8R1.43 C#C[C@H]1C[C@H]1C(=O)O Amb28073511 [0,1,0,1,0,0|1,0,0]=3 8459 B8R1.43 C=C(C)C1CC1CN Amb33199508 [0,1,0,1,0,0|2,0,0]=4 8460 B8R1.43 C=C(C)[C@@H]1C[C@H]1CN Amb33199509 [0,1,0,1,0,0|2,0,0]=4 8461 B8R1.43 C=CC1CC1C(C)=O Amb28075229 [0,1,0,1,0,0|2,0,0]=4 8462 B8R1.43 C=C[C@@H]1C[C@H]1C(=O)O Amb28347448 [0,1,0,1,0,0|1,0,0]=3 8463 B8R1.43 C=C[C@@H]1C[C@H]1C(C)=O Amb27420181 [0,1,0,1,0,0|2,0,0]=4 8464 B8R1.43 CC(=O)C1CC1C=O Amb27809942 [0,1,0,1,0,0|2,0,0]=4 8465 B8R1.43 CC(=O)C1CC1CN Amb33132446 [0,1,0,1,0,0|1,0,0]=3 8466 B8R1.43 CC(=O)[C@@H]1C[C@@H]1CN Amb33132469 [0,1,0,1,0,0|1,0,0]=3 8467 B8R1.43 CC(=O)[C@@H]1C[C@@H]1CO Amb28074697 [0,1,0,1,0,0|2,0,0]=4 8468 B8R1.43 CC(=O)[C@@H]1C[C@H]1C#N Amb28062975 [0,1,0,1,0,0|1,0,1]=4 8469 B8R1.43 CC(=O)[C@@H]1C[C@H]1CCl Amb27447264 [0,1,0,1,0,0|2,0,0]=4 8470 B8R1.43 CC(=O)[C@@H]1C[C@H]1CO Amb26561383 [0,1,0,1,0,0|2,0,0]=4 8471 B8R1.43 CC(=O)[C@H]1C[C@H]1C=O Amb27186674 [0,1,0,1,0,0|2,0,0]=4 8472 B8R1.43 CCC1CC1C(=O)Cl Amb27778180 [0,1,0,1,0,0|2,0,0]=4 8473 B8R1.43 CCC1CC1C(=O)O Amb18961272 [0,1,0,1,0,0|1,0,0]=3 8474 B8R1.43 CCC1OC1C(C)=O Amb27206899 [0,1,0,1,0,0|2,0,0]=4 8475 B8R1.43 CCC1OC1C(N)=O Amb27461385 [0,1,0,1,0,0|2,0,0]=4 8476 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O Amb24112910 [0,1,0,1,0,0|1,0,0]=3 8477 B8R1.43 CC[C@@H]1O[C@@H]1C(=O)O Amb27855470 [0,1,0,1,0,0|1,0,0]=3 8478 B8R1.43 CC[C@@H]1O[C@@H]1C(C)=O Amb27854614 [0,1,0,1,0,0|2,0,0]=4 8479 B8R1.43 CC[C@H]1C[C@H]1C(=O)O Amb33098417 [0,1,0,1,0,0|1,0,0]=3 8480 B8R1.43 CC[C@H]1O[C@@H]1C(=O)O Amb27811556 [0,1,0,1,0,0|1,0,0]=3 8481 B8R1.43 CC[C@H]1O[C@H]1C(=O)O Amb27222314 [0,1,0,1,0,0|1,0,0]=3 8482 B8R1.43 COC1CC1C(=O)Cl Amb35717346 [0,1,0,1,0,0|2,0,0]=4 8483 B8R1.43 COC1CC1C(N)=O Amb35671242 [0,1,0,1,0,0|2,0,0]=4 8484 B8R1.43 CO[C@@H]1C[C@H]1C(=O)O Amb24514838 [0,1,0,1,0,0|1,0,0]=3 8485 B8R1.43 CO[C@@H]1C[C@H]1C(C)=O Amb27407296 [0,1,0,1,0,0|2,0,0]=4 8486 B8R1.43 N#CC1CC1C(=O)O Amb24183452 [0,1,0,1,0,0|0,0,1]=3 8487 B8R1.43 N#C[C@@H]1C[C@@H]1C(=O)O Amb24183522 [0,1,0,1,0,0|0,0,1]=3 8488 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O Amb24183456 [0,1,0,1,0,0|0,0,1]=3 8489 B8R1.43 N#C[C@H]1C[C@@H]1C(=O)O Amb33805321 [0,1,0,1,0,0|0,0,1]=3 8490 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O Amb25168974 [0,1,0,1,0,0|0,0,1]=3 8491 B8R1.43 NC(=O)C1CC1CO Amb23538670 [0,1,0,1,0,0|2,0,0]=4 8492 B8R1.43 NCC1CC1C(=O)O Amb2694938 [0,1,0,1,0,0|0,0,0]=2 8493 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb24680970 [0,1,0,1,0,0|0,0,0]=2 8494 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb32992808 [0,1,0,1,0,0|0,0,0]=2 8495 B8R1.43 NC[C@@H]1C[C@@H]1C(N)=O Amb33042252 [0,1,0,1,0,0|1,0,0]=3 8496 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O Amb27205078 [0,1,0,1,0,0|0,0,0]=2 8497 B8R1.43 NC[C@H]1C[C@@H]1C(=O)O Amb27252099 [0,1,0,1,0,0|0,0,0]=2 8498 B8R1.43 NC[C@H]1C[C@H]1C(=O)O Amb28069146 [0,1,0,1,0,0|0,0,0]=2 8499 B8R1.43 NNC1CC1C(=O)O Amb10576221 [0,1,0,1,0,0|0,0,0]=2 8500 B8R1.43 O=C(O)C1CC1CBr Amb27407770 [0,1,0,1,0,0|1,0,0]=3 8501 B8R1.43 O=C(O)C1CC1CCl Amb26895220 [0,1,0,1,0,0|1,0,0]=3 8502 B8R1.43 O=C(O)C1CC1CO Amb25173469 [0,1,0,1,0,0|1,0,0]=3 8503 B8R1.43 O=C(O)[C@@H]1C[C@@H]1CO Amb28198703 [0,1,0,1,0,0|1,0,0]=3 8504 B8R1.43 O=C(O)[C@@H]1C[C@H]1CBr Amb26552185 [0,1,0,1,0,0|1,0,0]=3 8505 B8R1.43 O=C(O)[C@@H]1C[C@H]1CF Amb33098414 [0,1,0,1,0,0|1,0,0]=3 8506 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO Amb25231147 [0,1,0,1,0,0|1,0,0]=3 8507 B8R1.43 O=C(O)[C@H]1C[C@H]1CO Amb26916980 [0,1,0,1,0,0|1,0,0]=3 8508 B8R1.43 O=C([O-])C1CC1CO Amb33534503 [0,1,0,1,0,0|1,0,1]=4 8509 B8R1.43 O=C([O-])[C@@H]1C[C@H]1CO Amb35789135 [0,1,0,1,0,0|1,0,1]=4 8510 B8R1.43 O=C[C@H]1C[C@H]1C(=O)O Amb25911990 [0,1,0,1,0,0|1,0,0]=3 8511 B8R1.51 CC1(C)CCC(=O)C1 Amb19516867 [0,1,0,1,0,0|2,0,0]=4 8512 B8R1.51 CC1(C)CCC(=O)N1 Amb9173662 [0,1,0,1,0,0|2,0,0]=4 8513 B8R1.51 CC1(C)CCC(=O)O1 Amb8631207 [0,1,0,1,0,0|1,0,0]=3 8514 B8R1.51 CC1(C)CNC(=O)O1 Amb16202554 [0,1,0,1,0,0|2,0,0]=4 8515 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,1,0,1,0,0|2,0,0]=4 8516 B8R1.51 CC1(C)NCC(=O)O1 Amb27969182 [0,1,0,1,0,0|2,0,0]=4 8517 B8R1.51 CC1(C)OCC(=O)O1 Amb10601611 [0,1,0,1,0,0|2,0,0]=4 8518 B8R1.51 CC1(F)CCC(=O)O1 Amb27597762 [0,1,0,1,0,0|1,0,0]=3 8519 B8R1.51 CC1(F)COC(=O)O1 Amb27420932 [0,1,0,1,0,0|2,0,0]=4 8520 B8R1.51 CC1(O)CCC(N)C1 Amb24483255 [0,1,0,1,0,0|1,0,1]=4 8521 B8R1.51 CC1(O)CCC(N)C1 Amb33951111 [0,1,0,1,0,0|1,0,1]=4 8522 B8R1.51 CC1CCS(=O)(=O)N1 Amb24556783 [0,1,0,1,0,0|1,0,1]=4 8523 B8R1.51 CC1CCS(=O)(=O)O1 Amb26382065 [0,1,0,1,0,0|2,0,0]=4 8524 B8R1.51 CC1CNS(=O)(=O)C1 Amb24117862 [0,1,0,1,0,0|1,0,1]=4 8525 B8R1.51 NC1CCS(=O)(=O)C1 Amb1080886 [0,1,0,1,0,0|1,0,1]=4 8526 B8R1.51 NC1CCS(=O)(=O)C1 Amb1152771 [0,1,0,1,0,0|1,0,1]=4 8527 B8R1.51 NC1CCS(=O)(=O)C1 Amb8508170 [0,1,0,1,0,0|1,0,1]=4 8528 B8R1.51 NC1CC[S+](=O)([O-])C1 Amb17726901 [0,1,0,1,0,0|1,0,1]=4 8529 B8R1.51 N[C@@H]1CCS(=O)(=O)C1 Amb33872364 [0,1,0,1,0,0|1,0,1]=4 8530 B8R1.51 N[C@H]1CCS(=O)(=O)C1 Amb30634357 [0,1,0,1,0,0|1,0,1]=4 8531 B8R1.51 O=C1CCC(Cl)(Cl)C1 Amb28141254 [0,1,0,1,0,0|2,0,0]=4 8532 B8R1.51 O=C1CCC(F)(F)C1 Amb21963547 [0,1,0,1,0,0|2,0,0]=4 8533 B8R1.51 O=C1CCS(=O)(=O)O1 Amb17399828 [0,1,0,1,0,0|2,0,0]=4 8534 B8R1.53 CC1(C)CC(CN)O1 Amb23440280 [0,1,0,1,0,0|1,0,1]=4 8535 B8R1.53 CC1(O)CC(CN)C1 Amb28316232 [0,1,0,1,0,0|1,0,1]=4 8536 B8R1.53 CC1(O)CC(CN)C1 Amb34138133 [0,1,0,1,0,0|1,0,1]=4 8537 B8R1.53 C[C@]1(O)C[C@@H](CN)C1 Amb23440242 [0,1,0,1,0,0|1,0,1]=4 8538 B8R1.53 C[C@]1(O)C[C@H](CN)C1 Amb23440209 [0,1,0,1,0,0|1,0,1]=4 8539 B8R1.53 C[C@]1(O)C[C@H](CN)C1 Amb34193001 [0,1,0,1,0,0|1,0,1]=4 8540 B8R1.53 NCC1CS(=O)(=O)C1 Amb27641918 [0,1,0,1,0,0|1,0,1]=4 8541 B8R1.53 NCC1CS(=O)(=O)C1 Amb32664936 [0,1,0,1,0,0|1,0,1]=4 8542 B8R1.62 CC1(CCl)CC(=O)N1 Amb27974580 [0,1,0,1,0,0|2,0,0]=4 8543 B8R1.62 CC1(CN)CC(O)C1 Amb33361268 [0,1,0,1,0,0|1,0,1]=4 8544 B8R1.62 CC1(CO)CC(=O)C1 Amb22406263 [0,1,0,1,0,0|2,0,0]=4 8545 B8R1.62 CCC1(F)CC(=O)C1 Amb28146639 [0,1,0,1,0,0|2,0,0]=4 8546 B8R1.62 NCC1(O)CC(O)C1 Amb34150727 [0,1,0,1,0,0|1,0,1]=4 8547 B8R1.62 O=C1CC(Cl)(CCl)O1 Amb27493123 [0,1,0,1,0,0|1,0,0]=3 8548 B8R1.67 C=C1C(C)C1C(=O)O Amb27985954 [0,1,0,1,0,0|1,0,1]=4 8549 B8R1.67 CC(=O)C1[C@H](C)[C@H]1C Amb25985971 [0,1,0,1,0,0|2,0,0]=4 8550 B8R1.67 CC(=O)[C@H]1[C@@H](Cl)[C@@H]1C Amb27865414 [0,1,0,1,0,0|2,0,0]=4 8551 B8R1.67 CC(=O)[C@H]1[C@H](C)[C@@H]1Br Amb27204152 [0,1,0,1,0,0|2,0,0]=4 8552 B8R1.67 CC(=O)[C@H]1[C@H](C)[C@H]1Cl Amb27880620 [0,1,0,1,0,0|2,0,0]=4 8553 B8R1.67 CC1C(Cl)C1C(=O)O Amb32656377 [0,1,0,1,0,0|1,0,0]=3 8554 B8R1.67 C[C@@H]1C(C(=O)O)[C@@H]1C Amb25937319 [0,1,0,1,0,0|1,0,0]=3 8555 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 8556 B8R1.67 O=C(O)C1C(Cl)C1Cl Amb25918156 [0,1,0,1,0,0|1,0,0]=3 8557 B8R1.83 C#CC(=O)C1CC1C Amb27626468 [0,1,0,1,0,0|2,0,0]=4 8558 B8R1.83 C=C1CC1C(=O)OC Amb28284472 [0,1,0,1,0,0|1,0,1]=4 8559 B8R1.83 C=CC(=O)C1CC1C Amb25173576 [0,1,0,1,0,0|2,0,0]=4 8560 B8R1.83 CC1CC1C(=O)C=O Amb27882956 [0,1,0,1,0,0|1,0,1]=4 8561 B8R1.83 CC1CC1C(=O)CCl Amb24104125 [0,1,0,1,0,0|2,0,0]=4 8562 B8R1.83 CC1CC1C(=O)CN Amb24524253 [0,1,0,1,0,0|2,0,0]=4 8563 B8R1.83 CC1CC1C(=O)NN Amb9708926 [0,1,0,1,0,0|2,0,0]=4 8564 B8R1.83 CC1CC1\C(N)=N\O Amb25186813 [0,1,0,1,0,0|2,0,0]=4 8565 B8R1.83 CCC(=O)C1CC1C Amb26336728 [0,1,0,1,0,0|2,0,0]=4 8566 B8R1.83 CCC(=O)[C@@H]1C[C@@H]1Br Amb27197919 [0,1,0,1,0,0|2,0,0]=4 8567 B8R1.83 CNC(=O)C1CC1C Amb27469589 [0,1,0,1,0,0|2,0,0]=4 8568 B8R1.83 CNC(=O)[C@@H]1C[C@H]1C Amb27165349 [0,1,0,1,0,0|2,0,0]=4 8569 B8R1.83 CNC(=O)[C@H]1C[C@@H]1C Amb27651146 [0,1,0,1,0,0|2,0,0]=4 8570 B8R1.83 COC(=O)C1CC1Br Amb27864121 [0,1,0,1,0,0|1,0,0]=3 8571 B8R1.83 COC(=O)C1CC1C Amb9241819 [0,1,0,1,0,0|1,0,0]=3 8572 B8R1.83 COC(=O)C1OC1C Amb22055865 [0,1,0,1,0,0|2,0,0]=4 8573 B8R1.83 COC(=O)[C@@H]1C[C@H]1C Amb27205901 [0,1,0,1,0,0|1,0,0]=3 8574 B8R1.83 COC(=O)[C@@H]1C[C@H]1F Amb28072373 [0,1,0,1,0,0|1,0,0]=3 8575 B8R1.83 COC(=O)[C@@H]1N[C@H]1C Amb24120620 [0,1,0,1,0,0|2,0,0]=4 8576 B8R1.83 COC(=O)[C@@H]1O[C@H]1C Amb27880914 [0,1,0,1,0,0|2,0,0]=4 8577 B8R1.2 CCC1=CNCCC1 Amb27404529 [0,1,0,1,0,0|2,0,0]=4 8578 B8R1.2 COC1=CCCCC1 Amb10601667 [0,1,0,1,0,0|2,0,0]=4 8579 B8R1.2 COC1=NCCCC1 Amb2689803 [0,1,0,1,0,0|2,0,0]=4 8580 B8R1.2 COC1=NCCNC1 Amb33218461 [0,1,0,1,0,0|2,0,0]=4 8581 B8R1.2 COC1CCCNC1 Amb22586710 [0,1,0,1,0,0|1,0,1]=4 8582 B8R1.2 COC1CCCNC1 Amb33528076 [0,1,0,1,0,0|1,0,1]=4 8583 B8R1.2 COC1CCCNC1 Amb9752773 [0,1,0,1,0,0|1,0,1]=4 8584 B8R1.2 CO[C@@H]1CCCNC1 Amb22225358 [0,1,0,1,0,0|1,0,1]=4 8585 B8R1.2 CO[C@@H]1CCCNC1 Amb31204718 [0,1,0,1,0,0|1,0,1]=4 8586 B8R1.2 CO[C@H]1CCCNC1 Amb22226700 [0,1,0,1,0,0|1,0,1]=4 8587 B8R1.2 CO[C@H]1CCCNC1 Amb22756499 [0,1,0,1,0,0|1,0,1]=4 8588 B8R1.2 C\C=C1/CCCNC1 Amb31161500 [0,1,0,1,0,0|2,0,0]=4 8589 B8R1.2 N#CC1=CNCCC1 Amb16191903 [0,1,0,1,0,0|2,0,0]=4 8590 B8R1.2 O=CC1=CCCCC1 Amb33545149 [0,1,0,1,0,0|2,0,0]=4 8591 B8R1.2 O=CC1=CCCNC1 Amb27833007 [0,1,0,1,0,0|1,0,1]=4 8592 B8R1.2 O=CC1=COCCC1 Amb2433566 [0,1,0,1,0,0|2,0,0]=4 8593 B8R1.2 O=CC1=CSCCC1 Amb28316147 [0,1,0,1,0,0|2,0,0]=4 8594 B8R1.2 O=CC1CCCCO1 Amb8009759 [0,1,0,1,0,0|1,0,1]=4 8595 B8R1.2 O=CC1CCCNC1 Amb18833063 [0,1,0,1,0,0|1,0,1]=4 8596 B8R1.2 O=NN1CCCCO1 Amb27472845 [0,1,0,1,0,0|2,0,0]=4 8597 B8R1.2 OCC1=CCCCC1 Amb24122911 [0,1,0,1,0,0|2,0,0]=4 8598 B8R1.2 OCC1=COCCC1 Amb24426430 [0,1,0,1,0,0|2,0,0]=4 8599 B8R1.2 OCC1=NOCCC1 Amb25675358 [0,1,0,1,0,0|2,0,0]=4 8600 B8R1.2 OCC1CCCNC1 Amb22001796 [0,1,0,1,0,0|1,0,1]=4 8601 B8R1.2 OCC1CCCNC1 Amb2695684 [0,1,0,1,0,0|1,0,1]=4 8602 B8R1.2 OC[C@@H]1CCCNC1 Amb10603201 [0,1,0,1,0,0|1,0,1]=4 8603 B8R1.2 OC[C@@H]1CCCNC1 Amb22504548 [0,1,0,1,0,0|1,0,1]=4 8604 B8R1.2 OC[C@@H]1CCCNN1 Amb28138668 [0,1,0,1,0,0|1,0,1]=4 8605 B8R1.2 OC[C@H]1CCCNC1 Amb10603243 [0,1,0,1,0,0|1,0,1]=4 8606 B8R1.2 OC[C@H]1CCCNC1 Amb22388477 [0,1,0,1,0,0|1,0,1]=4 8607 B8R1.2 ON=C1CCCCC1 Amb6364727 [0,1,0,1,0,0|2,0,0]=4 8608 B8R1.2 ONC1CCCNC1 Amb28048987 [0,1,0,1,0,0|1,0,1]=4 8609 B8R1.2 O\N=C1/C=CCCC1 Amb28316146 [0,1,0,1,0,0|2,0,0]=4 8610 B8R1.2 O\N=C1/CNCCS1 Amb27838324 [0,1,0,1,0,0|2,0,0]=4 8611 B8R1.2 O\N=C1\CCCCN1 Amb4136429 [0,1,0,1,0,0|2,0,0]=4 8612 B8R1.3 C=C1CCC(C)NC1 Amb27626150 [0,1,0,1,0,0|2,0,0]=4 8613 B8R1.3 C=C1CCC(C)OC1 Amb30011003 [0,1,0,1,0,0|2,0,0]=4 8614 B8R1.3 C=C1CCC(N)CC1 Amb23599023 [0,1,0,1,0,0|2,0,0]=4 8615 B8R1.3 C=C1CCC(N)CC1 Amb33537570 [0,1,0,1,0,0|2,0,0]=4 8616 B8R1.3 CC1=CC[C@@H](N)CC1 Amb27493017 [0,1,0,1,0,0|2,0,0]=4 8617 B8R1.3 CC1=CC[C@H](N)CC1 Amb28365931 [0,1,0,1,0,0|2,0,0]=4 8618 B8R1.3 CC1C=CC(=O)CC1 Amb24556470 [0,1,0,1,0,0|2,0,0]=4 8619 B8R1.3 CC1CCC(=O)CC1 Amb6608654 [0,1,0,1,0,0|2,0,0]=4 8620 B8R1.3 CC1CCC(=O)CN1 Amb26979747 [0,1,0,1,0,0|1,0,0]=3 8621 B8R1.3 CC1CCC(=O)CN1 Amb32686523 [0,1,0,1,0,0|1,0,0]=3 8622 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,1,0,1,0,0|1,0,0]=3 8623 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,1,0,1,0,0|1,1,0]=4 8624 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,1,0,1,0,0|2,0,0]=4 8625 B8R1.3 CC1CCC(=O)NN1 Amb27443930 [0,1,0,1,0,0|1,0,0]=3 8626 B8R1.3 CC1CCC(=O)OC1 Amb27667524 [0,1,0,1,0,0|1,0,0]=3 8627 B8R1.3 CC1CCC(N)CO1 Amb35709402 [0,1,0,1,0,0|1,0,1]=4 8628 B8R1.3 CC1CCC(O)CN1 Amb18641838 [0,1,0,1,0,0|1,0,1]=4 8629 B8R1.3 CC1CCC(O)CN1 Amb28934843 [0,1,0,1,0,0|1,0,1]=4 8630 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,1,0,1,0,0|2,0,0]=4 8631 B8R1.3 CC1CNC(=O)CN1 Amb34912937 [0,1,0,1,0,0|2,0,0]=4 8632 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,1,0,1,0,0|2,0,0]=4 8633 B8R1.3 CC1OCC(=O)CO1 Amb28316125 [0,1,0,1,0,0|2,0,0]=4 8634 B8R1.3 C[C@@H]1C=CC(=O)CC1 Amb28144188 [0,1,0,1,0,0|2,0,0]=4 8635 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,1,0,1,0,0|1,0,0]=3 8636 B8R1.3 C[C@@H]1CCC(=O)OC1 Amb26004046 [0,1,0,1,0,0|1,0,0]=3 8637 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb22886214 [0,1,0,1,0,0|1,0,1]=4 8638 B8R1.3 C[C@@H]1CC[C@@H](O)CN1 Amb25175824 [0,1,0,1,0,0|1,0,1]=4 8639 B8R1.3 C[C@@H]1CC[C@H](O)CN1 Amb22886213 [0,1,0,1,0,0|1,0,1]=4 8640 B8R1.3 C[C@@H]1CC[C@H](O)CN1 Amb26440123 [0,1,0,1,0,0|1,0,1]=4 8641 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,1,0,1,0,0|2,0,0]=4 8642 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,1,0,1,0,0|2,0,0]=4 8643 B8R1.3 C[C@@H]1CNC(=O)CO1 Amb27470503 [0,1,0,1,0,0|2,0,0]=4 8644 B8R1.3 C[C@H]1CCC(=O)NC1 Amb27838374 [0,1,0,1,0,0|2,0,0]=4 8645 B8R1.3 C[C@H]1CC[C@@H](O)CN1 Amb27420157 [0,1,0,1,0,0|1,0,1]=4 8646 B8R1.3 C[C@H]1CC[C@@H](O)CN1 Amb34140397 [0,1,0,1,0,0|1,0,1]=4 8647 B8R1.3 C[C@H]1CC[C@H](O)CN1 Amb24575263 [0,1,0,1,0,0|1,0,1]=4 8648 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,1,0,1,0,0|2,0,0]=4 8649 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,1,0,1,0,0|2,0,0]=4 8650 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,1,0,1,0,0|2,0,0]=4 8651 B8R1.3 NC1CCC(=O)CC1 Amb10067105 [0,1,0,1,0,0|1,0,0]=3 8652 B8R1.3 NC1CCC(=O)CC1 Amb21862513 [0,1,0,1,0,0|1,0,0]=3 8653 B8R1.3 NC1CCC(=O)NC1 Amb13952208 [0,1,0,1,0,0|1,0,0]=3 8654 B8R1.3 NC1CCC(=O)NC1 Amb18833034 [0,1,0,1,0,0|1,0,0]=3 8655 B8R1.3 NC1CCC(O)CC1 Amb2684385 [0,1,0,1,0,0|1,0,1]=4 8656 B8R1.3 NC1CCC(O)CC1 Amb8627755 [0,1,0,1,0,0|1,0,1]=4 8657 B8R1.3 NC1CCS(=O)CC1 Amb18943776 [0,1,0,1,0,0|2,0,0]=4 8658 B8R1.3 NC1CCS(=O)CC1 Amb21988665 [0,1,0,1,0,0|2,0,0]=4 8659 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb2699221 [0,1,0,1,0,0|1,0,0]=3 8660 B8R1.3 N[C@@H]1CCC(=O)NC1 Amb27432343 [0,1,0,1,0,0|1,0,0]=3 8661 B8R1.3 N[C@H]1CCC(=O)NC1 Amb22748949 [0,1,0,1,0,0|1,0,0]=3 8662 B8R1.3 N[C@H]1CCC(=O)NC1 Amb2699220 [0,1,0,1,0,0|1,0,0]=3 8663 B8R1.3 N[C@H]1CC[C@@H](O)CC1 Amb10071293 [0,1,0,1,0,0|1,0,1]=4 8664 B8R1.3 N[C@H]1CC[C@@H](O)CC1 Amb2684002 [0,1,0,1,0,0|1,0,1]=4 8665 B8R1.3 N[C@H]1CC[C@H](O)CC1 Amb2720456 [0,1,0,1,0,0|1,0,1]=4 8666 B8R1.3 N[C@H]1CC[C@H](O)CC1 Amb9825572 [0,1,0,1,0,0|1,0,1]=4 8667 B8R1.3 O=C1C=CC(O)CC1 Amb28048996 [0,1,0,1,0,0|2,0,0]=4 8668 B8R1.3 O=C1CCC(=O)NC1 Amb15692796 [0,1,0,1,0,0|1,0,1]=4 8669 B8R1.3 O=C1CCC(=O)NN1 Amb22365926 [0,1,0,1,0,0|1,0,1]=4 8670 B8R1.3 O=C1CCC(=O)OC1 Amb26404271 [0,1,0,1,0,0|1,0,1]=4 8671 B8R1.3 O=C1CCC(Br)CC1 Amb28342260 [0,1,0,1,0,0|2,0,0]=4 8672 B8R1.3 O=C1CCC(Cl)CC1 Amb26585218 [0,1,0,1,0,0|2,0,0]=4 8673 B8R1.3 O=C1CCC(F)CC1 Amb20671078 [0,1,0,1,0,0|2,0,0]=4 8674 B8R1.3 O=C1CCC(I)CC1 Amb27232393 [0,1,0,1,0,0|2,0,0]=4 8675 B8R1.3 O=C1CCC(O)CC1 Amb2699831 [0,1,0,1,0,0|2,0,0]=4 8676 B8R1.3 O=C1CCC(O)CN1 Amb10066907 [0,1,0,1,0,0|2,0,0]=4 8677 B8R1.3 O=C1CCC(O)CO1 Amb26345105 [0,1,0,1,0,0|1,0,0]=3 8678 B8R1.3 O=C1CC[C@@H](O)CN1 Amb2698033 [0,1,0,1,0,0|2,0,0]=4 8679 B8R1.3 O=C1CC[C@H](O)CN1 Amb2698032 [0,1,0,1,0,0|2,0,0]=4 8680 B8R1.3 O=C1NCC(O)CO1 Amb27210928 [0,1,0,1,0,0|2,0,0]=4 8681 B8R1.5 C=C1CCCCC1=O Amb18561347 [0,1,0,1,0,0|2,0,0]=4 8682 B8R1.5 C=C1CCCCC1O Amb28316215 [0,1,0,1,0,0|2,0,0]=4 8683 B8R1.5 CC1=C(C)NCCC1 Amb27489342 [0,1,0,1,0,0|2,0,0]=4 8684 B8R1.5 CC1=CCCCC1=O Amb15693479 [0,1,0,1,0,0|2,0,0]=4 8685 B8R1.5 CC1=NCCCC1=O Amb27803670 [0,1,0,1,0,0|1,0,1]=4 8686 B8R1.5 CC1CCC=CC1=O Amb17593138 [0,1,0,1,0,0|2,0,0]=4 8687 B8R1.5 CC1CCCCC1=O Amb6608749 [0,1,0,1,0,0|2,0,0]=4 8688 B8R1.5 CC1CCCNC1=O Amb2778949 [0,1,0,1,0,0|1,0,1]=4 8689 B8R1.5 CC1CCCOC1=O Amb26933974 [0,1,0,1,0,0|1,0,0]=3 8690 B8R1.5 CC1CCNCC1=O Amb28990014 [0,1,0,1,0,0|1,0,0]=3 8691 B8R1.5 CC1CCNCC1=O Amb8388554 [0,1,0,1,0,0|1,0,0]=3 8692 B8R1.5 CC1CCNCC1O Amb22406220 [0,1,0,1,0,0|1,0,1]=4 8693 B8R1.5 CC1CCNCC1O Amb23440259 [0,1,0,1,0,0|1,0,1]=4 8694 B8R1.5 CC1CCOCC1=O Amb25718285 [0,1,0,1,0,0|2,0,0]=4 8695 B8R1.5 CC1NCCCC1=O Amb26633057 [0,1,0,1,0,0|1,0,0]=3 8696 B8R1.5 CC1NCCCC1=O Amb32695440 [0,1,0,1,0,0|1,0,0]=3 8697 B8R1.5 CC1NCCCC1O Amb27839609 [0,1,0,1,0,0|1,0,1]=4 8698 B8R1.5 CC1NCCCC1O Amb28934842 [0,1,0,1,0,0|1,0,1]=4 8699 B8R1.5 CC1NCCNC1=O Amb5846691 [0,1,0,1,0,0|2,0,0]=4 8700 B8R1.5 CC1NCCNC1=O Amb9778910 [0,1,0,1,0,0|2,0,0]=4 8701 B8R1.5 CC1NCCSC1=O Amb27489291 [0,1,0,1,0,0|2,0,0]=4 8702 B8R1.5 CC1OCCCC1=O Amb28048940 [0,1,0,1,0,0|2,0,0]=4 8703 B8R1.5 CC1SCCCC1=O Amb25989585 [0,1,0,1,0,0|2,0,0]=4 8704 B8R1.5 CN1CCCNC1=O Amb10608416 [0,1,0,1,0,0|2,0,0]=4 8705 B8R1.5 CN1CCCNC1=O Amb32665804 [0,1,0,1,0,0|2,0,0]=4 8706 B8R1.5 CN1CCNCC1=O Amb1834069 [0,1,0,1,0,0|2,0,0]=4 8707 B8R1.5 CN1CCNCC1=O Amb6540859 [0,1,0,1,0,0|2,0,0]=4 8708 B8R1.5 CN1NCCCC1=O Amb18559232 [0,1,0,1,0,0|1,0,0]=3 8709 B8R1.5 C[C@@H]1CCC=CC1=O Amb28316223 [0,1,0,1,0,0|2,0,0]=4 8710 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb22886317 [0,1,0,1,0,0|1,0,1]=4 8711 B8R1.5 C[C@@H]1CCNC[C@@H]1O Amb24694415 [0,1,0,1,0,0|1,0,1]=4 8712 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb22886316 [0,1,0,1,0,0|1,0,1]=4 8713 B8R1.5 C[C@@H]1CCNC[C@H]1O Amb24553941 [0,1,0,1,0,0|1,0,1]=4 8714 B8R1.5 C[C@@H]1NCCC[C@@H]1O Amb26431095 [0,1,0,1,0,0|1,0,1]=4 8715 B8R1.5 C[C@@H]1NCCC[C@@H]1O Amb32680789 [0,1,0,1,0,0|1,0,1]=4 8716 B8R1.5 C[C@@H]1NCCNC1=O Amb18203363 [0,1,0,1,0,0|2,0,0]=4 8717 B8R1.5 C[C@@H]1OCCCC1=O Amb28202118 [0,1,0,1,0,0|2,0,0]=4 8718 B8R1.5 C[C@H]1CCC=CC1=O Amb28316171 [0,1,0,1,0,0|2,0,0]=4 8719 B8R1.5 C[C@H]1CCCNC1=O Amb27648584 [0,1,0,1,0,0|1,0,1]=4 8720 B8R1.5 C[C@H]1CCNC[C@@H]1O Amb26892110 [0,1,0,1,0,0|1,0,1]=4 8721 B8R1.5 C[C@H]1CCNC[C@@H]1O Amb33726126 [0,1,0,1,0,0|1,0,1]=4 8722 B8R1.5 C[C@H]1CCNC[C@H]1O Amb25339261 [0,1,0,1,0,0|1,0,1]=4 8723 B8R1.5 C[C@H]1CCNC[C@H]1O Amb32409390 [0,1,0,1,0,0|1,0,1]=4 8724 B8R1.5 C[C@H]1NCCNC1=O Amb22336965 [0,1,0,1,0,0|2,0,0]=4 8725 B8R1.5 NC1=NCCCC1=O Amb28399329 [0,1,0,1,0,0|1,0,1]=4 8726 B8R1.5 NC1CCCCC1=O Amb17939051 [0,1,0,1,0,0|2,0,0]=4 8727 B8R1.5 NC1CCCCC1=O Amb22001819 [0,1,0,1,0,0|2,0,0]=4 8728 B8R1.5 NC1CCCNC1=O Amb1088746 [0,1,0,1,0,0|1,0,1]=4 8729 B8R1.5 NC1CCCNC1=O Amb8428208 [0,1,0,1,0,0|1,0,1]=4 8730 B8R1.5 NC1CCNCC1O Amb22388661 [0,1,0,1,0,0|1,0,1]=4 8731 B8R1.5 NC1CCONC1=O Amb22295935 [0,1,0,1,0,0|2,0,0]=4 8732 B8R1.5 NN1CCCCC1=O Amb13952152 [0,1,0,1,0,0|2,0,0]=4 8733 B8R1.5 NN1CCCCC1=O Amb22275946 [0,1,0,1,0,0|2,0,0]=4 8734 B8R1.5 NN1CCCNC1=O Amb25343173 [0,1,0,1,0,0|2,0,0]=4 8735 B8R1.5 NN1CCCOC1=O Amb17608306 [0,1,0,1,0,0|2,0,0]=4 8736 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,1,0,1,0,0|1,0,1]=4 8737 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,1,0,1,0,0|1,0,1]=4 8738 B8R1.5 N[C@@H]1CCNC[C@H]1O Amb27421907 [0,1,0,1,0,0|1,0,1]=4 8739 B8R1.5 N[C@H]1CCCNC1=O Amb10603272 [0,1,0,1,0,0|1,0,1]=4 8740 B8R1.5 N[C@H]1CCCNC1=O Amb8631316 [0,1,0,1,0,0|1,0,1]=4 8741 B8R1.5 N[C@H]1CCNC[C@@H]1O Amb28052491 [0,1,0,1,0,0|1,0,1]=4 8742 B8R1.5 N[C@H]1CCNC[C@H]1O Amb27815748 [0,1,0,1,0,0|1,0,1]=4 8743 B8R1.5 O=C1C=CCCC1Br Amb27477843 [0,1,0,1,0,0|2,0,0]=4 8744 B8R1.5 O=C1C=CCCC1O Amb27165534 [0,1,0,1,0,0|2,0,0]=4 8745 B8R1.5 O=C1CCCC=C1Br Amb10067493 [0,1,0,1,0,0|2,0,0]=4 8746 B8R1.5 O=C1CCCC=C1F Amb28253992 [0,1,0,1,0,0|2,0,0]=4 8747 B8R1.5 O=C1CCCC=C1I Amb10601698 [0,1,0,1,0,0|2,0,0]=4 8748 B8R1.5 O=C1CCCC=C1O Amb2699837 [0,1,0,1,0,0|1,0,0]=3 8749 B8R1.5 O=C1CCCCC1=O Amb1154131 [0,1,0,1,0,0|1,0,1]=4 8750 B8R1.5 O=C1CCCCC1Br Amb8394127 [0,1,0,1,0,0|2,0,0]=4 8751 B8R1.5 O=C1CCCCC1Cl Amb1154371 [0,1,0,1,0,0|2,0,0]=4 8752 B8R1.5 O=C1CCCCC1F Amb10605769 [0,1,0,1,0,0|2,0,0]=4 8753 B8R1.5 O=C1CCCCC1I Amb28239314 [0,1,0,1,0,0|2,0,0]=4 8754 B8R1.5 O=C1CCCCC1O Amb8390042 [0,1,0,1,0,0|1,0,0]=3 8755 B8R1.5 O=C1CCCCC1S Amb25839265 [0,1,0,1,0,0|1,1,0]=4 8756 B8R1.5 O=C1CCCC[C@@H]1F Amb24379012 [0,1,0,1,0,0|2,0,0]=4 8757 B8R1.5 O=C1CCCC[C@@H]1O Amb28316212 [0,1,0,1,0,0|1,0,0]=3 8758 B8R1.5 O=C1CCCC[C@H]1Cl Amb28119800 [0,1,0,1,0,0|2,0,0]=4 8759 B8R1.5 O=C1CCCNC1=O Amb2445649 [0,1,0,1,0,0|0,0,1]=3 8760 B8R1.5 O=C1CCCOC1=O Amb24662237 [0,1,0,1,0,0|1,0,1]=4 8761 B8R1.5 O=C1CCCSC1Cl Amb26534671 [0,1,0,1,0,0|2,0,0]=4 8762 B8R1.5 O=C1CCNCC1O Amb24075970 [0,1,0,1,0,0|2,0,0]=4 8763 B8R1.5 O=C1CCNCC1O Amb27230548 [0,1,0,1,0,0|2,0,0]=4 8764 B8R1.5 O=C1CCNCN1O Amb24120639 [0,1,0,1,0,0|2,0,0]=4 8765 B8R1.5 O=C1CCOCC1O Amb26966688 [0,1,0,1,0,0|2,0,0]=4 8766 B8R1.5 O=C1CCSCC1O Amb27762936 [0,1,0,1,0,0|2,0,0]=4 8767 B8R1.5 O=C1CCSC[C@@H]1O Amb28316128 [0,1,0,1,0,0|2,0,0]=4 8768 B8R1.5 O=C1COCCC1Br Amb24416092 [0,1,0,1,0,0|2,0,0]=4 8769 B8R1.5 O=C1COCCC1F Amb28048950 [0,1,0,1,0,0|2,0,0]=4 8770 B8R1.5 O=C1COCC[C@H]1F Amb27207103 [0,1,0,1,0,0|2,0,0]=4 8771 B8R1.5 O=C1NCCC=C1Cl Amb26349713 [0,1,0,1,0,0|1,0,1]=4 8772 B8R1.5 O=C1NCCCC1Br Amb33543864 [0,1,0,1,0,0|1,0,1]=4 8773 B8R1.5 O=C1NCCCC1F Amb13888988 [0,1,0,1,0,0|1,0,1]=4 8774 B8R1.5 O=C1NCCCC1O Amb10602315 [0,1,0,1,0,0|0,0,1]=3 8775 B8R1.5 O=C1NCCC[C@@H]1O Amb22226682 [0,1,0,1,0,0|0,0,1]=3 8776 B8R1.5 O=C1NCCC[C@H]1O Amb22225342 [0,1,0,1,0,0|0,0,1]=3 8777 B8R1.5 O=C1NCCNC1=O Amb4005151 [0,1,0,1,0,0|1,0,1]=4 8778 B8R1.5 O=C1NCCOC1=O Amb24120265 [0,1,0,1,0,0|1,0,1]=4 8779 B8R1.5 O=C1NNCCC1Cl Amb26453975 [0,1,0,1,0,0|1,0,0]=3 8780 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,1,0,1,0,0|1,0,0]=3 8781 B8R1.5 O=C1OCCCC1Cl Amb28195106 [0,1,0,1,0,0|1,0,0]=3 8782 B8R1.5 O=C1OCCCC1O Amb19959000 [0,1,0,1,0,0|1,0,0]=3 8783 B8R1.5 O=C1OCCSC1Br Amb27776793 [0,1,0,1,0,0|2,0,0]=4 8784 B8R1.5 OC1CCNCC1O Amb22493773 [0,1,0,1,0,0|1,0,1]=4 8785 B8R1.5 OC1CCNCC1O Amb33992215 [0,1,0,1,0,0|1,0,1]=4 8786 B8R1.5 OC1CNCCC1F Amb22886287 [0,1,0,1,0,0|1,0,1]=4 8787 B8R1.5 OC1CNCCC1F Amb28423403 [0,1,0,1,0,0|1,0,1]=4 8788 B8R1.5 O[C@@H]1CCNC[C@H]1O Amb22746225 [0,1,0,1,0,0|1,0,1]=4 8789 B8R1.5 O[C@@H]1CCNC[C@H]1O Amb22748912 [0,1,0,1,0,0|1,0,1]=4 8790 B8R1.5 O[C@@H]1CNCC[C@H]1F Amb22739017 [0,1,0,1,0,0|1,0,1]=4 8791 B8R1.5 O[C@@H]1CNCC[C@H]1F Amb23439238 [0,1,0,1,0,0|1,0,1]=4 8792 B8R1.5 O[C@H]1CCNC[C@@H]1O Amb33805289 [0,1,0,1,0,0|1,0,1]=4 8793 B8R1.5 O[C@H]1CCNC[C@@H]1O Amb8630297 [0,1,0,1,0,0|1,0,1]=4 8794 B8R1.5 O[C@H]1CCNC[C@H]1O Amb15701275 [0,1,0,1,0,0|1,0,1]=4 8795 B8R1.5 O[C@H]1CCNC[C@H]1O Amb22754314 [0,1,0,1,0,0|1,0,1]=4 8796 B8R1.5 O[C@H]1CNCC[C@@H]1Cl Amb27960302 [0,1,0,1,0,0|1,0,1]=4 8797 B8R1.5 O[C@H]1CNCC[C@H]1Br Amb27211495 [0,1,0,1,0,0|1,0,1]=4 8798 B8R1.5 O[C@H]1CNCC[C@H]1F Amb33875431 [0,1,0,1,0,0|1,0,1]=4 8799 B8R1.5 O[C@H]1CNCC[C@H]1O Amb22406028 [0,1,0,1,0,0|1,0,1]=4 8800 B8R1.5 O[C@H]1CNCC[C@H]1O Amb8630296 [0,1,0,1,0,0|1,0,1]=4 8801 B8R1.10 NCCC=C1COC1 Amb35659250 [0,1,0,1,0,0|1,0,1]=4 8802 B8R1.13 CCCC1CNC1=O Amb27413136 [0,1,0,1,0,0|2,0,0]=4 8803 B8R1.13 NCCN1CCC1=O Amb27445366 [0,1,0,1,0,0|2,0,0]=4 8804 B8R1.13 O=C1CCC1CCCl Amb27252476 [0,1,0,1,0,0|2,0,0]=4 8805 B8R1.17 CCC[C@@H]1O[C@@H]1C=O Amb28142382 [0,1,0,1,0,0|1,0,1]=4 8806 B8R1.17 CC[C@@H]1O[C@H]1CCN Amb27810614 [0,1,0,1,0,0|1,0,1]=4 8807 B8R1.17 CC[C@H]1O[C@@H]1CCN Amb28369654 [0,1,0,1,0,0|1,0,1]=4 8808 B8R1.17 O=CC1OC1CCBr Amb27657238 [0,1,0,1,0,0|1,0,1]=4 8809 B8R1.22 C=C1CCCNCC1 Amb30982578 [0,1,0,1,0,0|2,0,0]=4 8810 B8R1.22 C=C1OCCCCO1 Amb22228877 [0,1,0,1,0,0|2,0,0]=4 8811 B8R1.22 O=C1C=CCCCC1 Amb10601704 [0,1,0,1,0,0|2,0,0]=4 8812 B8R1.22 O=C1C=CCCCN1 Amb22500450 [0,1,0,1,0,0|2,0,0]=4 8813 B8R1.22 O=C1C=CNCCS1 Amb27655609 [0,1,0,1,0,0|2,0,0]=4 8814 B8R1.22 O=C1CC=CCCC1 Amb24450177 [0,1,0,1,0,0|2,0,0]=4 8815 B8R1.22 O=C1CCC=COC1 Amb27812549 [0,1,0,1,0,0|1,0,1]=4 8816 B8R1.22 O=C1CCCCCC1 Amb4135729 [0,1,0,1,0,0|2,0,0]=4 8817 B8R1.22 O=C1CCCCCN1 Amb6364991 [0,1,0,1,0,0|2,0,0]=4 8818 B8R1.22 O=C1CCCCCO1 Amb8513719 [0,1,0,1,0,0|1,0,0]=3 8819 B8R1.22 O=C1CCCCCS1 Amb25810807 [0,1,0,1,0,0|1,1,0]=4 8820 B8R1.22 O=C1CCCCC[N-]1 Amb24117486 [0,1,0,1,0,0|2,0,0]=4 8821 B8R1.22 O=C1CCCCNC1 Amb22000936 [0,1,0,1,0,0|1,0,0]=3 8822 B8R1.22 O=C1CCCCNC1 Amb25922210 [0,1,0,1,0,0|1,0,0]=3 8823 B8R1.22 O=C1CCCNCC1 Amb8393630 [0,1,0,1,0,0|1,0,0]=3 8824 B8R1.22 O=C1CCCNCC1 Amb9174228 [0,1,0,1,0,0|1,0,0]=3 8825 B8R1.22 O=C1CCCOCC1 Amb25873789 [0,1,0,1,0,0|2,0,0]=4 8826 B8R1.22 O=C1CCCSCC1 Amb25318842 [0,1,0,1,0,0|2,0,0]=4 8827 B8R1.22 O=C1CCCSCN1 Amb27879423 [0,1,0,1,0,0|2,0,0]=4 8828 B8R1.22 O=C1CCNCCN1 Amb10069937 [0,1,0,1,0,0|2,0,0]=4 8829 B8R1.22 O=C1CCNCCN1 Amb1107713 [0,1,0,1,0,0|2,0,0]=4 8830 B8R1.22 O=C1CCNCCN1 Amb483265 [0,1,0,1,0,0|2,0,0]=4 8831 B8R1.22 O=C1CCNCCO1 Amb27760600 [0,1,0,1,0,0|1,0,0]=3 8832 B8R1.22 O=C1CCNNCC1 Amb28421828 [0,1,0,1,0,0|2,0,0]=4 8833 B8R1.22 O=C1CCOCCN1 Amb13951193 [0,1,0,1,0,0|2,0,0]=4 8834 B8R1.22 O=C1CCOCOC1 Amb27434094 [0,1,0,1,0,0|2,0,0]=4 8835 B8R1.22 O=C1CCSCCN1 Amb21912439 [0,1,0,1,0,0|2,0,0]=4 8836 B8R1.22 O=C1CNCCCN1 Amb22754482 [0,1,0,1,0,0|1,0,0]=3 8837 B8R1.22 O=C1CNCCCN1 Amb6739889 [0,1,0,1,0,0|1,0,0]=3 8838 B8R1.22 O=C1CNCCNC1 Amb30867934 [0,1,0,1,0,0|1,0,0]=3 8839 B8R1.22 O=C1COCCCN1 Amb22371065 [0,1,0,1,0,0|2,0,0]=4 8840 B8R1.22 O=C1COCCOC1 Amb22284314 [0,1,0,1,0,0|2,0,0]=4 8841 B8R1.22 O=C1CSCCSC1 Amb8503291 [0,1,0,1,0,0|2,0,0]=4 8842 B8R1.22 O=C1NCCCCN1 Amb25960043 [0,1,0,1,0,0|2,0,0]=4 8843 B8R1.22 O=C1NCCCCO1 Amb27405440 [0,1,0,1,0,0|1,0,0]=3 8844 B8R1.22 O=C1OCCCCO1 Amb25350626 [0,1,0,1,0,0|1,0,0]=3 8845 B8R1.22 O=S1CCCNCC1 Amb21856414 [0,1,0,1,0,0|2,0,0]=4 8846 B8R1.22 O=S1OCCCCO1 Amb9787325 [0,1,0,1,0,0|2,0,0]=4 8847 B8R1.22 OC1CCCCNC1 Amb22371121 [0,1,0,1,0,0|1,0,1]=4 8848 B8R1.22 OC1CCCCNC1 Amb22886250 [0,1,0,1,0,0|1,0,1]=4 8849 B8R1.22 OC1CCCNCC1 Amb19958701 [0,1,0,1,0,0|1,0,1]=4 8850 B8R1.22 OC1CCCNCC1 Amb2695607 [0,1,0,1,0,0|1,0,1]=4 8851 B8R1.22 OC1CNCCNC1 Amb30867933 [0,1,0,1,0,0|1,0,1]=4 8852 B8R1.22 OC1CNCCNC1 Amb8630419 [0,1,0,1,0,0|1,0,1]=4 8853 B8R1.22 OC1CNCCOC1 Amb22886365 [0,1,0,1,0,0|1,0,1]=4 8854 B8R1.22 OC1CNCCOC1 Amb27258663 [0,1,0,1,0,0|1,0,1]=4 8855 B8R1.22 O[C@@H]1CNCCOC1 Amb22325588 [0,1,0,1,0,0|1,0,1]=4 8856 B8R1.22 O[C@H]1CNCCOC1 Amb28074197 [0,1,0,1,0,0|1,0,1]=4 8857 B8R1.38 C#CC(=O)C1CCC1 Amb27390977 [0,1,0,1,0,0|2,0,0]=4 8858 B8R1.38 C=CC(=O)C1CCC1 Amb25968097 [0,1,0,1,0,0|2,0,0]=4 8859 B8R1.38 CC(CO)C1CCN1 Amb27631681 [0,1,0,1,0,0|1,0,1]=4 8860 B8R1.38 CCC(=O)C1CCC1 Amb17593163 [0,1,0,1,0,0|2,0,0]=4 8861 B8R1.38 CCC(=O)C1CCO1 Amb28368772 [0,1,0,1,0,0|2,0,0]=4 8862 B8R1.38 CNC(=O)C1CCC1 Amb22231329 [0,1,0,1,0,0|2,0,0]=4 8863 B8R1.38 CNC(=O)[C@H]1CCN1 Amb27837634 [0,1,0,1,0,0|1,0,0]=3 8864 B8R1.38 COC(=O)C1=CCC1 Amb24689222 [0,1,0,1,0,0|1,0,1]=4 8865 B8R1.38 COC(=O)C1C=CC1 Amb33715996 [0,1,0,1,0,0|1,0,1]=4 8866 B8R1.38 COC(=O)C1CCC1 Amb6366581 [0,1,0,1,0,0|1,0,0]=3 8867 B8R1.38 COC(=O)C1CCN1 Amb2699142 [0,1,0,1,0,0|0,0,0]=2 8868 B8R1.38 COC(=O)C1CCN1 Amb33544519 [0,1,0,1,0,0|0,0,0]=2 8869 B8R1.38 COC(=O)C1CNC1 Amb10604008 [0,1,0,1,0,0|2,0,0]=4 8870 B8R1.38 COC(=O)C1CNC1 Amb13883580 [0,1,0,1,0,0|2,0,0]=4 8871 B8R1.38 COC(=O)C1COC1 Amb21961760 [0,1,0,1,0,0|2,0,0]=4 8872 B8R1.38 COC(=O)[C@@H]1CCN1 Amb19888362 [0,1,0,1,0,0|0,0,0]=2 8873 B8R1.38 COC(=O)[C@@H]1CCN1 Amb22405994 [0,1,0,1,0,0|0,0,0]=2 8874 B8R1.38 COC(=O)[C@H]1CCN1 Amb22737543 [0,1,0,1,0,0|0,0,0]=2 8875 B8R1.38 COC(=O)[C@H]1CCN1 Amb24694404 [0,1,0,1,0,0|0,0,0]=2 8876 B8R1.38 C\C(=N/O)C1CCC1 Amb27871299 [0,1,0,1,0,0|2,0,0]=4 8877 B8R1.38 N=C(NO)C1CCC1 Amb22265719 [0,1,0,1,0,0|2,0,0]=4 8878 B8R1.38 NCC(=O)C1CCC1 Amb24524254 [0,1,0,1,0,0|2,0,0]=4 8879 B8R1.38 NCC(=O)C1CCC1 Amb29083365 [0,1,0,1,0,0|2,0,0]=4 8880 B8R1.38 NNC(=O)C1CCC1 Amb6393395 [0,1,0,1,0,0|2,0,0]=4 8881 B8R1.38 NNC(=O)C1CCN1 Amb27490207 [0,1,0,1,0,0|1,0,0]=3 8882 B8R1.38 NNC(=O)[C@H]1CCN1 Amb27604154 [0,1,0,1,0,0|1,0,0]=3 8883 B8R1.38 N\C(=N/O)C1CCC1 Amb33546908 [0,1,0,1,0,0|2,0,0]=4 8884 B8R1.38 O=C(CBr)C1CCC1 Amb20622821 [0,1,0,1,0,0|2,0,0]=4 8885 B8R1.38 O=C(CCl)C1CCC1 Amb26987586 [0,1,0,1,0,0|2,0,0]=4 8886 B8R1.38 O=C(CO)C1CCC1 Amb28188903 [0,1,0,1,0,0|1,0,0]=3 8887 B8R1.38 O=C(CO)N1CCC1 Amb9421597 [0,1,0,1,0,0|2,0,0]=4 8888 B8R1.38 O=C(NO)C1CCC1 Amb6265921 [0,1,0,1,0,0|1,0,0]=3 8889 B8R1.38 O=C(NO)C1CCN1 Amb27659056 [0,1,0,1,0,0|0,0,0]=2 8890 B8R1.38 O=CC(=O)C1CCC1 Amb28315726 [0,1,0,1,0,0|1,0,1]=4 8891 B8R1.46 CC1C(=O)NC1CO Amb27785549 [0,1,0,1,0,0|2,0,0]=4 8892 B8R1.46 CC[C@@H]1NC(=O)[C@H]1C Amb27188452 [0,1,0,1,0,0|2,0,0]=4 8893 B8R1.46 NC1C(=O)NC1CCl Amb27429760 [0,1,0,1,0,0|2,0,0]=4 8894 B8R1.46 NC1C(=O)NC1CO Amb27985586 [0,1,0,1,0,0|2,0,0]=4 8895 B8R1.46 N[C@@H]1C(=O)N[C@@H]1CO Amb28058411 [0,1,0,1,0,0|2,0,0]=4 8896 B8R1.46 O=C1CC(CO)C1F Amb27973059 [0,1,0,1,0,0|2,0,0]=4 8897 B8R1.46 O=C1C[C@H](CO)N1O Amb27833657 [0,1,0,1,0,0|1,0,0]=3 8898 B8R1.46 O=C1O[C@H](CO)[C@H]1O Amb27659903 [0,1,0,1,0,0|1,0,0]=3 8899 B8R1.47 COC1CC(CN)C1 Amb25211144 [0,1,0,1,0,0|1,0,1]=4 8900 B8R1.47 COC1CC(CN)C1 Amb32752772 [0,1,0,1,0,0|1,0,1]=4 8901 B8R1.47 CO[C@H]1C[C@@H](CN)C1 Amb24099388 [0,1,0,1,0,0|1,0,1]=4 8902 B8R1.47 CO[C@H]1C[C@@H](CN)C1 Amb31028906 [0,1,0,1,0,0|1,0,1]=4 8903 B8R1.47 CO[C@H]1C[C@H](CN)C1 Amb24529098 [0,1,0,1,0,0|1,0,1]=4 8904 B8R1.47 CO[C@H]1C[C@H](CN)C1 Amb30585136 [0,1,0,1,0,0|1,0,1]=4 8905 B8R1.47 NCC1CC(CO)C1 Amb22304838 [0,1,0,1,0,0|1,0,1]=4 8906 B8R1.47 NCC1CC(CO)C1 Amb34158424 [0,1,0,1,0,0|1,0,1]=4 8907 B8R1.47 NCC1CC(ON)C1 Amb27839473 [0,1,0,1,0,0|1,0,1]=4 8908 B8R1.47 NC[C@H]1C[C@@H](CO)C1 Amb23385251 [0,1,0,1,0,0|1,0,1]=4 8909 B8R1.47 NC[C@H]1C[C@H](CO)C1 Amb22757883 [0,1,0,1,0,0|1,0,1]=4 8910 B8R1.47 NC[C@H]1C[C@H](CO)C1 Amb23385245 [0,1,0,1,0,0|1,0,1]=4 8911 B8R1.47 OCC1CC(=NO)C1 Amb23570500 [0,1,0,1,0,0|2,0,0]=4 8912 B8R1.50 C=C1C(=O)CCC1C Amb27199153 [0,1,0,1,0,0|2,0,0]=4 8913 B8R1.50 C=C1C(=O)OCC1N Amb18641720 [0,1,0,1,0,0|2,0,0]=4 8914 B8R1.50 CC1=C(O)C(=O)CC1 Amb4004294 [0,1,0,1,0,0|1,0,1]=4 8915 B8R1.50 CC1CCC(=O)C1=O Amb4477353 [0,1,0,1,0,0|1,0,1]=4 8916 B8R1.50 CC1CCC(=O)C1C Amb27485174 [0,1,0,1,0,0|2,0,0]=4 8917 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,1,0,1,0,0|2,0,0]=4 8918 B8R1.50 CC1CCC(=O)N1C Amb15693449 [0,1,0,1,0,0|2,0,0]=4 8919 B8R1.50 CC1CCC(N)C1O Amb27595668 [0,1,0,1,0,0|1,0,1]=4 8920 B8R1.50 CC1OCC(=O)C1O Amb28131956 [0,1,0,1,0,0|2,0,0]=4 8921 B8R1.50 CN1C(=O)CCC1O Amb17615583 [0,1,0,1,0,0|2,0,0]=4 8922 B8R1.50 CN1CCC(N)C1=O Amb22491599 [0,1,0,1,0,0|2,0,0]=4 8923 B8R1.50 CN1CCC(N)C1=O Amb33538759 [0,1,0,1,0,0|2,0,0]=4 8924 B8R1.50 CN1CC[C@@H](N)C1=O Amb25303747 [0,1,0,1,0,0|2,0,0]=4 8925 B8R1.50 CN1CC[C@H](N)C1=O Amb25889201 [0,1,0,1,0,0|2,0,0]=4 8926 B8R1.50 C[C@@H]1C(=O)CC[C@@H]1O Amb28253966 [0,1,0,1,0,0|2,0,0]=4 8927 B8R1.50 C[C@@H]1C(=O)OC[C@@H]1N Amb28055949 [0,1,0,1,0,0|2,0,0]=4 8928 B8R1.50 C[C@H]1C(=O)OC[C@H]1N Amb27635064 [0,1,0,1,0,0|2,0,0]=4 8929 B8R1.50 NC1CCC(O)C1O Amb24451909 [0,1,0,1,0,0|0,0,2]=4 8930 B8R1.50 NC1CCN(O)C1=O Amb8631273 [0,1,0,1,0,0|1,0,0]=3 8931 B8R1.50 NC1CNC(=O)C1N Amb18641832 [0,1,0,1,0,0|2,0,0]=4 8932 B8R1.50 N[C@@H]1CCN(O)C1=O Amb22362895 [0,1,0,1,0,0|1,0,0]=3 8933 B8R1.50 N[C@@H]1CC[C@@H](O)[C@@H]1O Amb30526898 [0,1,0,1,0,0|0,0,2]=4 8934 B8R1.50 N[C@@H]1CC[C@@H](O)[C@H]1O Amb25314143 [0,1,0,1,0,0|0,0,2]=4 8935 B8R1.50 N[C@@H]1CC[C@@H](O)[C@H]1O Amb30526901 [0,1,0,1,0,0|0,0,2]=4 8936 B8R1.50 N[C@@H]1CC[C@H](O)[C@@H]1O Amb30526913 [0,1,0,1,0,0|0,0,2]=4 8937 B8R1.50 N[C@@H]1CC[C@H](O)[C@H]1O Amb27963725 [0,1,0,1,0,0|0,0,2]=4 8938 B8R1.50 N[C@@H]1CC[C@H](O)[C@H]1O Amb30526890 [0,1,0,1,0,0|0,0,2]=4 8939 B8R1.50 N[C@H]1CCN(O)C1=O Amb25345964 [0,1,0,1,0,0|1,0,0]=3 8940 B8R1.50 N[C@H]1CC[C@H](O)[C@@H]1O Amb28399393 [0,1,0,1,0,0|0,0,2]=4 8941 B8R1.50 O=C1CCC(=O)C1O Amb24443990 [0,1,0,1,0,0|1,0,1]=4 8942 B8R1.50 O=C1CCC(=O)N1O Amb1152089 [0,1,0,1,0,0|1,0,1]=4 8943 B8R1.50 O=C1CCC(Br)=C1O Amb24677469 [0,1,0,1,0,0|1,0,1]=4 8944 B8R1.50 O=C1CCC(Cl)=C1O Amb28316155 [0,1,0,1,0,0|1,0,1]=4 8945 B8R1.50 O=C1CCC(F)C1Br Amb27875964 [0,1,0,1,0,0|2,0,0]=4 8946 B8R1.50 O=C1CCC(O)=C1O Amb17593179 [0,1,0,1,0,0|1,0,1]=4 8947 B8R1.50 O=C1CCC(O)N1O Amb27214701 [0,1,0,1,0,0|1,0,0]=3 8948 B8R1.50 O=C1CC[C@H](O)[C@@H]1O Amb28253888 [0,1,0,1,0,0|1,0,0]=3 8949 B8R1.50 O=C1NCC(O)C1O Amb27813982 [0,1,0,1,0,0|2,0,0]=4 8950 B8R1.50 O=C1OCC(O)C1O Amb22730078 [0,1,0,1,0,0|2,0,0]=4 8951 B8R1.50 O=C1OC[C@@H](O)[C@@H]1O Amb24609731 [0,1,0,1,0,0|2,0,0]=4 8952 B8R1.50 O=C1OC[C@@H](O)[C@H]1O Amb8515014 [0,1,0,1,0,0|2,0,0]=4 8953 B8R1.50 O=C1OC[C@H](O)[C@@H]1O Amb27440225 [0,1,0,1,0,0|2,0,0]=4 8954 B8R1.50 O=C1OC[C@H](O)[C@H]1O Amb15692412 [0,1,0,1,0,0|2,0,0]=4 8955 B8R1.52 CC1(CO)CCCN1 Amb15701544 [0,1,0,1,0,0|1,0,1]=4 8956 B8R1.52 COP1(=O)NCCO1 Amb27184925 [0,1,0,1,0,0|2,0,0]=4 8957 B8R1.52 C[C@@]1(CO)CCCN1 Amb23439746 [0,1,0,1,0,0|1,0,1]=4 8958 B8R1.52 C[C@@]1(CO)CCCN1 Amb25367466 [0,1,0,1,0,0|1,0,1]=4 8959 B8R1.52 C[C@]1(CO)CCCN1 Amb25783618 [0,1,0,1,0,0|1,0,1]=4 8960 B8R1.52 C[C@]1(CO)CCCN1 Amb31204568 [0,1,0,1,0,0|1,0,1]=4 8961 B8R1.52 O=CC1(O)CCCC1 Amb18124253 [0,1,0,1,0,0|1,0,1]=4 8962 B8R1.6 C=C1CN(CCN)C1 Amb35614364 [0,1,0,1,0,0|2,0,0]=4 8963 B8R1.6 C=CCC1CC(=O)N1 Amb24453069 [0,1,0,1,0,0|2,0,0]=4 8964 B8R1.6 CCCC1CC(=O)C1 Amb27398824 [0,1,0,1,0,0|2,0,0]=4 8965 B8R1.6 CCCC1CC(=O)N1 Amb26494598 [0,1,0,1,0,0|2,0,0]=4 8966 B8R1.6 CCC[C@H]1CC(=O)N1 Amb27184591 [0,1,0,1,0,0|2,0,0]=4 8967 B8R1.6 CCOC1CC(=O)C1 Amb33530910 [0,1,0,1,0,0|2,0,0]=4 8968 B8R1.6 CNCC1CC(O)C1 Amb25732572 [0,1,0,1,0,0|1,0,1]=4 8969 B8R1.6 CNC[C@H]1C[C@@H](O)C1 Amb22831752 [0,1,0,1,0,0|1,0,1]=4 8970 B8R1.6 COCC1CC(=O)C1 Amb25771052 [0,1,0,1,0,0|2,0,0]=4 8971 B8R1.6 N#CCC1CC(=O)C1 Amb30869389 [0,1,0,1,0,0|1,0,1]=4 8972 B8R1.6 N#CCC1CC(=O)N1 Amb27630655 [0,1,0,1,0,0|1,0,1]=4 8973 B8R1.6 NCCC1CC(O)C1 Amb24715768 [0,1,0,1,0,0|1,0,1]=4 8974 B8R1.6 NCCC1CC(O)C1 Amb28934909 [0,1,0,1,0,0|1,0,1]=4 8975 B8R1.6 NCCN1CC(O)C1 Amb26419589 [0,1,0,1,0,0|1,0,1]=4 8976 B8R1.6 NCC[C@H]1C[C@@H](O)C1 Amb30526926 [0,1,0,1,0,0|1,0,1]=4 8977 B8R1.6 NCC[C@H]1C[C@H](O)C1 Amb30526899 [0,1,0,1,0,0|1,0,1]=4 8978 B8R1.6 O=C1CC(CCBr)C1 Amb28385574 [0,1,0,1,0,0|2,0,0]=4 8979 B8R1.6 O=C1CC(CCBr)N1 Amb28255540 [0,1,0,1,0,0|2,0,0]=4 8980 B8R1.6 O=C1CC(CCCl)C1 Amb27832893 [0,1,0,1,0,0|2,0,0]=4 8981 B8R1.6 O=C1CC(CCO)N1 Amb27467326 [0,1,0,1,0,0|2,0,0]=4 8982 B8R1.6 O=C1C[C@@H](CCO)N1 Amb27838874 [0,1,0,1,0,0|2,0,0]=4 8983 B8R1.6 O=CC[C@@H]1CC(=O)N1 Amb27402326 [0,1,0,1,0,0|2,0,0]=4 8984 B8R1.7 C=C(C)C1CCCN1 Amb23536664 [0,1,0,1,0,0|2,0,0]=4 8985 B8R1.7 C=C(C)C1CCNC1 Amb27460933 [0,1,0,1,0,0|2,0,0]=4 8986 B8R1.7 C=C(C)[C@@H]1CCCN1 Amb28186967 [0,1,0,1,0,0|2,0,0]=4 8987 B8R1.7 CC(=O)C1=CCCC1 Amb22338190 [0,1,0,1,0,0|2,0,0]=4 8988 B8R1.7 CC(=O)C1=CCCN1 Amb27880337 [0,1,0,1,0,0|1,0,1]=4 8989 B8R1.7 CC(=O)C1=CNCC1 Amb27455189 [0,1,0,1,0,0|1,0,1]=4 8990 B8R1.7 CC(=O)C1CC=CN1 Amb26979687 [0,1,0,1,0,0|1,0,1]=4 8991 B8R1.7 CC(=O)C1CCC=N1 Amb22496787 [0,1,0,1,0,0|1,0,1]=4 8992 B8R1.7 CC(=O)C1CCCC1 Amb2612425 [0,1,0,1,0,0|2,0,0]=4 8993 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [0,1,0,1,0,0|1,0,0]=3 8994 B8R1.7 CC(=O)C1CCCN1 Amb33870768 [0,1,0,1,0,0|1,0,0]=3 8995 B8R1.7 CC(=O)C1CCCO1 Amb23590167 [0,1,0,1,0,0|2,0,0]=4 8996 B8R1.7 CC(=O)C1CCCS1 Amb27838322 [0,1,0,1,0,0|2,0,0]=4 8997 B8R1.7 CC(=O)C1CCNC1 Amb18833067 [0,1,0,1,0,0|1,0,0]=3 8998 B8R1.7 CC(=O)C1CCNC1 Amb22899078 [0,1,0,1,0,0|1,0,0]=3 8999 B8R1.7 CC(=O)C1CCOC1 Amb18833038 [0,1,0,1,0,0|2,0,0]=4 9000 B8R1.7 CC(=O)C1CCSC1 Amb27412975 [0,1,0,1,0,0|2,0,0]=4 9001 B8R1.7 CC(=O)C1NCCS1 Amb22757393 [0,1,0,1,0,0|1,0,0]=3 9002 B8R1.7 CC(=O)C1OCCO1 Amb24053150 [0,1,0,1,0,0|2,0,0]=4 9003 B8R1.7 CC(=O)C1OCCS1 Amb27262730 [0,1,0,1,0,0|2,0,0]=4 9004 B8R1.7 CC(=O)N1CCCC1 Amb3358093 [0,1,0,1,0,0|2,0,0]=4 9005 B8R1.7 CC(=O)N1CCNC1 Amb27795361 [0,1,0,1,0,0|2,0,0]=4 9006 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb27170693 [0,1,0,1,0,0|1,0,0]=3 9007 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb31291120 [0,1,0,1,0,0|1,0,0]=3 9008 B8R1.7 CC(=O)[C@@H]1CCCO1 Amb22746525 [0,1,0,1,0,0|2,0,0]=4 9009 B8R1.7 CC(=O)[C@@H]1CCNC1 Amb30039124 [0,1,0,1,0,0|1,0,0]=3 9010 B8R1.7 CC(=O)[C@H]1CCCN1 Amb27453624 [0,1,0,1,0,0|1,0,0]=3 9011 B8R1.7 CC(=O)[C@H]1CCCO1 Amb25173839 [0,1,0,1,0,0|2,0,0]=4 9012 B8R1.7 CC(=O)[C@H]1CCNC1 Amb33132071 [0,1,0,1,0,0|1,0,0]=3 9013 B8R1.7 CC(O)C1CCCN1 Amb17231822 [0,1,0,1,0,0|1,0,1]=4 9014 B8R1.7 CC(O)C1CCNC1 Amb22886901 [0,1,0,1,0,0|1,0,1]=4 9015 B8R1.7 CC(O)C1CCNC1 Amb9782643 [0,1,0,1,0,0|1,0,1]=4 9016 B8R1.7 CC(O)[C@@H]1CCCN1 Amb24685154 [0,1,0,1,0,0|1,0,1]=4 9017 B8R1.7 CC(O)[C@@H]1CCNC1 Amb35603308 [0,1,0,1,0,0|1,0,1]=4 9018 B8R1.7 CC(O)[C@H]1CCCN1 Amb26394098 [0,1,0,1,0,0|1,0,1]=4 9019 B8R1.7 CC(O)[C@H]1CCNC1 Amb35662397 [0,1,0,1,0,0|1,0,1]=4 9020 B8R1.7 C[C@H](O)C1CCNC1 Amb27264787 [0,1,0,1,0,0|1,0,1]=4 9021 B8R1.7 N=C(N)C1CCCN1 Amb24549144 [0,1,0,1,0,0|2,0,0]=4 9022 B8R1.7 N=C(N)C1CCCN1 Amb32718817 [0,1,0,1,0,0|2,0,0]=4 9023 B8R1.7 N=C(N)C1CCNC1 Amb17934233 [0,1,0,1,0,0|2,0,0]=4 9024 B8R1.7 N=C(N)C1CCNC1 Amb24502578 [0,1,0,1,0,0|2,0,0]=4 9025 B8R1.7 N=C(N)C1CCNC1 Amb30585137 [0,1,0,1,0,0|2,0,0]=4 9026 B8R1.7 NC(=O)C1=CCCC1 Amb20622488 [0,1,0,1,0,0|2,0,0]=4 9027 B8R1.7 NC(=O)C1=NCCN1 Amb1068371 [0,1,0,1,0,0|1,0,1]=4 9028 B8R1.7 NC(=O)C1C=CCC1 Amb25063981 [0,1,0,1,0,0|2,0,0]=4 9029 B8R1.7 NC(=O)C1C=CCN1 Amb27246432 [0,1,0,1,0,0|1,0,1]=4 9030 B8R1.7 NC(=O)C1CCCC1 Amb8858372 [0,1,0,1,0,0|2,0,0]=4 9031 B8R1.7 NC(=O)C1CCCN1 Amb2720282 [0,1,0,1,0,0|1,0,0]=3 9032 B8R1.7 NC(=O)C1CCCN1 Amb9724672 [0,1,0,1,0,0|1,0,0]=3 9033 B8R1.7 NC(=O)C1CCCO1 Amb33545693 [0,1,0,1,0,0|2,0,0]=4 9034 B8R1.7 NC(=O)C1CCNC1 Amb19373271 [0,1,0,1,0,0|1,0,0]=3 9035 B8R1.7 NC(=O)C1CCNC1 Amb9728548 [0,1,0,1,0,0|1,0,0]=3 9036 B8R1.7 NC(=O)C1CCOC1 Amb9677690 [0,1,0,1,0,0|2,0,0]=4 9037 B8R1.7 NC(=O)C1CSCN1 Amb2967256 [0,1,0,1,0,0|1,0,0]=3 9038 B8R1.7 NC(=O)C1NCCS1 Amb27655014 [0,1,0,1,0,0|1,0,0]=3 9039 B8R1.7 NC(=O)N1CCCC1 Amb1107229 [0,1,0,1,0,0|2,0,0]=4 9040 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [0,1,0,1,0,0|1,0,0]=3 9041 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb2690398 [0,1,0,1,0,0|1,0,0]=3 9042 B8R1.7 NC(=O)[C@@H]1CCCO1 Amb4166303 [0,1,0,1,0,0|2,0,0]=4 9043 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb20671394 [0,1,0,1,0,0|1,0,0]=3 9044 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb22405894 [0,1,0,1,0,0|1,0,0]=3 9045 B8R1.7 NC(=O)[C@@H]1CCOC1 Amb27413583 [0,1,0,1,0,0|2,0,0]=4 9046 B8R1.7 NC(=O)[C@@H]1COCN1 Amb27194677 [0,1,0,1,0,0|1,0,0]=3 9047 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [0,1,0,1,0,0|1,0,0]=3 9048 B8R1.7 NC(=O)[C@H]1CCCN1 Amb2690397 [0,1,0,1,0,0|1,0,0]=3 9049 B8R1.7 NC(=O)[C@H]1CCNC1 Amb20671395 [0,1,0,1,0,0|1,0,0]=3 9050 B8R1.7 NC(=O)[C@H]1CCNC1 Amb22405893 [0,1,0,1,0,0|1,0,0]=3 9051 B8R1.7 NC(=O)[C@H]1CCOC1 Amb33228699 [0,1,0,1,0,0|2,0,0]=4 9052 B8R1.7 NC(=O)[C@H]1CNCO1 Amb27838356 [0,1,0,1,0,0|2,0,0]=4 9053 B8R1.7 NC(=O)[C@H]1CNCS1 Amb27488571 [0,1,0,1,0,0|2,0,0]=4 9054 B8R1.7 NC(=S)C1CCCN1 Amb19148043 [0,1,0,1,0,0|1,1,0]=4 9055 B8R1.7 NC(=S)C1CCNC1 Amb35605372 [0,1,0,1,0,0|1,1,0]=4 9056 B8R1.7 NC(=S)N1CCCN1 Amb27838409 [0,1,0,1,0,0|1,1,0]=4 9057 B8R1.7 NC(=S)[C@@H]1CCCN1 Amb24588473 [0,1,0,1,0,0|1,1,0]=4 9058 B8R1.7 NC(=S)[C@H]1CCCN1 Amb24469314 [0,1,0,1,0,0|1,1,0]=4 9059 B8R1.7 O=C(Br)C1CCCC1 Amb27793826 [0,1,0,1,0,0|2,0,0]=4 9060 B8R1.7 O=C(Cl)C1=CCCC1 Amb25870845 [0,1,0,1,0,0|2,0,0]=4 9061 B8R1.7 O=C(Cl)C1CCCC1 Amb3939172 [0,1,0,1,0,0|2,0,0]=4 9062 B8R1.7 O=C(Cl)C1CCCN1 Amb27258805 [0,1,0,1,0,0|1,0,0]=3 9063 B8R1.7 O=C(Cl)C1CCCO1 Amb5747111 [0,1,0,1,0,0|2,0,0]=4 9064 B8R1.7 O=C(Cl)C1CCCS1 Amb25189766 [0,1,0,1,0,0|2,0,0]=4 9065 B8R1.7 O=C(Cl)C1CCNC1 Amb28316213 [0,1,0,1,0,0|1,0,0]=3 9066 B8R1.7 O=C(Cl)C1CCOC1 Amb9677595 [0,1,0,1,0,0|2,0,0]=4 9067 B8R1.7 O=C(Cl)C1CCSC1 Amb27778382 [0,1,0,1,0,0|2,0,0]=4 9068 B8R1.7 O=C(Cl)C1CSCN1 Amb17142875 [0,1,0,1,0,0|1,0,0]=3 9069 B8R1.7 O=C(Cl)N1CCCC1 Amb8516771 [0,1,0,1,0,0|2,0,0]=4 9070 B8R1.7 O=C(Cl)[C@@H]1CCCN1 Amb28313801 [0,1,0,1,0,0|1,0,0]=3 9071 B8R1.7 O=C(O)C1=CCCC1 Amb3940288 [0,1,0,1,0,0|1,0,0]=3 9072 B8R1.7 O=C(O)C1=CCCN1 Amb17593173 [0,1,0,1,0,0|0,0,1]=3 9073 B8R1.7 O=C(O)C1=CCCO1 Amb19148920 [0,1,0,1,0,0|1,0,1]=4 9074 B8R1.7 O=C(O)C1=CCCS1 Amb18642795 [0,1,0,1,0,0|1,0,1]=4 9075 B8R1.7 O=C(O)C1=CCNC1 Amb26017269 [0,1,0,1,0,0|0,0,2]=4 9076 B8R1.7 O=C(O)C1=CCOC1 Amb24434391 [0,1,0,1,0,0|1,0,1]=4 9077 B8R1.7 O=C(O)C1=CCSC1 Amb18642797 [0,1,0,1,0,0|1,0,1]=4 9078 B8R1.7 O=C(O)C1=COCC1 Amb18124248 [0,1,0,1,0,0|1,0,1]=4 9079 B8R1.7 O=C(O)C1=NCCN1 Amb27787520 [0,1,0,1,0,0|0,0,1]=3 9080 B8R1.7 O=C(O)C1=NOCC1 Amb24353499 [0,1,0,1,0,0|0,0,2]=4 9081 B8R1.7 O=C(O)C1C=CCC1 Amb18641680 [0,1,0,1,0,0|1,0,0]=3 9082 B8R1.7 O=C(O)C1C=CCN1 Amb22899488 [0,1,0,1,0,0|0,0,1]=3 9083 B8R1.7 O=C(O)C1C=CCN1 Amb9804432 [0,1,0,1,0,0|0,0,1]=3 9084 B8R1.7 O=C(O)C1C=CCO1 Amb18641762 [0,1,0,1,0,0|1,0,1]=4 9085 B8R1.7 O=C(O)C1CC=CC1 Amb2694750 [0,1,0,1,0,0|1,0,1]=4 9086 B8R1.7 O=C(O)C1CC=NN1 Amb18641765 [0,1,0,1,0,0|0,0,1]=3 9087 B8R1.7 O=C(O)C1CC=NO1 Amb27216537 [0,1,0,1,0,0|0,0,2]=4 9088 B8R1.7 O=C(O)C1CCC=N1 Amb27849168 [0,1,0,1,0,0|0,0,1]=3 9089 B8R1.7 O=C(O)C1CCCC1 Amb3939849 [0,1,0,1,0,0|1,0,0]=3 9090 B8R1.7 O=C(O)C1CCCN1 Amb1157517 [0,1,0,1,0,0|0,0,0]=2 9091 B8R1.7 O=C(O)C1CCCN1 Amb22040086 [0,1,0,1,0,0|0,0,0]=2 9092 B8R1.7 O=C(O)C1CCCO1 Amb9702828 [0,1,0,1,0,0|1,0,0]=3 9093 B8R1.7 O=C(O)C1CCCS1 Amb18124363 [0,1,0,1,0,0|1,0,0]=3 9094 B8R1.7 O=C(O)C1CCNC1 Amb16230724 [0,1,0,1,0,0|0,0,0]=2 9095 B8R1.7 O=C(O)C1CCNC1 Amb16233446 [0,1,0,1,0,0|0,0,0]=2 9096 B8R1.7 O=C(O)C1CCNC1 Amb2694866 [0,1,0,1,0,0|0,0,0]=2 9097 B8R1.7 O=C(O)C1CCNO1 Amb28205451 [0,1,0,1,0,0|0,0,0]=2 9098 B8R1.7 O=C(O)C1CCNO1 Amb33329025 [0,1,0,1,0,0|0,0,0]=2 9099 B8R1.7 O=C(O)C1CCOC1 Amb33542759 [0,1,0,1,0,0|1,0,0]=3 9100 B8R1.7 O=C(O)C1CCSC1 Amb18124360 [0,1,0,1,0,0|1,0,0]=3 9101 B8R1.7 O=C(O)C1CCSS1 Amb8388097 [0,1,0,1,0,0|1,0,0]=3 9102 B8R1.7 O=C(O)C1CNCN1 Amb27597638 [0,1,0,1,0,0|0,0,0]=2 9103 B8R1.7 O=C(O)C1COC=N1 Amb28291372 [0,1,0,1,0,0|0,0,2]=4 9104 B8R1.7 O=C(O)C1COCN1 Amb2694915 [0,1,0,1,0,0|0,0,0]=2 9105 B8R1.7 O=C(O)C1COCN1 Amb2696354 [0,1,0,1,0,0|0,0,0]=2 9106 B8R1.7 O=C(O)C1COCO1 Amb27810510 [0,1,0,1,0,0|1,0,0]=3 9107 B8R1.7 O=C(O)C1CSCN1 Amb532947 [0,1,0,1,0,0|0,0,0]=2 9108 B8R1.7 O=C(O)C1CSSC1 Amb17593735 [0,1,0,1,0,0|2,0,0]=4 9109 B8R1.7 O=C(O)C1NCCS1 Amb2444644 [0,1,0,1,0,0|0,0,0]=2 9110 B8R1.7 O=C(O)C1OCCO1 Amb24349582 [0,1,0,1,0,0|1,0,0]=3 9111 B8R1.7 O=C(O)C1SCCS1 Amb20669087 [0,1,0,1,0,0|1,0,0]=3 9112 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb16183937 [0,1,0,1,0,0|0,0,1]=3 9113 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb22750611 [0,1,0,1,0,0|0,0,1]=3 9114 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb3940757 [0,1,0,1,0,0|0,0,0]=2 9115 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb6754105 [0,1,0,1,0,0|0,0,0]=2 9116 B8R1.7 O=C(O)[C@@H]1CCCO1 Amb3940908 [0,1,0,1,0,0|1,0,0]=3 9117 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb6893875 [0,1,0,1,0,0|0,0,0]=2 9118 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb8630322 [0,1,0,1,0,0|0,0,0]=2 9119 B8R1.7 O=C(O)[C@@H]1CCOC1 Amb10603235 [0,1,0,1,0,0|1,0,0]=3 9120 B8R1.7 O=C(O)[C@@H]1CCON1 Amb26919409 [0,1,0,1,0,0|0,0,0]=2 9121 B8R1.7 O=C(O)[C@@H]1COCN1 Amb19515958 [0,1,0,1,0,0|0,0,0]=2 9122 B8R1.7 O=C(O)[C@@H]1CSC=N1 Amb35648199 [0,1,0,1,0,0|0,0,2]=4 9123 B8R1.7 O=C(O)[C@@H]1CSCN1 Amb3940400 [0,1,0,1,0,0|0,0,0]=2 9124 B8R1.7 O=C(O)[C@H]1C=CCC1 Amb27872028 [0,1,0,1,0,0|1,0,0]=3 9125 B8R1.7 O=C(O)[C@H]1C=CCN1 Amb34158387 [0,1,0,1,0,0|0,0,1]=3 9126 B8R1.7 O=C(O)[C@H]1CCC=N1 Amb28128325 [0,1,0,1,0,0|0,0,1]=3 9127 B8R1.7 O=C(O)[C@H]1CCCN1 Amb2720569 [0,1,0,1,0,0|0,0,0]=2 9128 B8R1.7 O=C(O)[C@H]1CCCO1 Amb3941554 [0,1,0,1,0,0|1,0,0]=3 9129 B8R1.7 O=C(O)[C@H]1CCNC1 Amb2700058 [0,1,0,1,0,0|0,0,0]=2 9130 B8R1.7 O=C(O)[C@H]1CCNC1 Amb6893874 [0,1,0,1,0,0|0,0,0]=2 9131 B8R1.7 O=C(O)[C@H]1CCOC1 Amb22226787 [0,1,0,1,0,0|1,0,0]=3 9132 B8R1.7 O=C(O)[C@H]1CCSC1 Amb28241390 [0,1,0,1,0,0|1,0,0]=3 9133 B8R1.7 O=C(O)[C@H]1CNCS1 Amb27414077 [0,1,0,1,0,0|1,0,0]=3 9134 B8R1.7 O=C(O)[C@H]1CSC=N1 Amb35641724 [0,1,0,1,0,0|0,0,2]=4 9135 B8R1.7 O=C(O)[C@H]1CSCN1 Amb544887 [0,1,0,1,0,0|0,0,0]=2 9136 B8R1.7 O=C(O)[C@H]1NCCS1 Amb25920370 [0,1,0,1,0,0|0,0,0]=2 9137 B8R1.7 O=C(S)C1CCCO1 Amb27827519 [0,1,0,1,0,0|1,1,0]=4 9138 B8R1.7 O=C(S)[C@@H]1CCCN1 Amb27468669 [0,1,0,1,0,0|0,1,0]=3 9139 B8R1.7 O=C(S)[C@@H]1CCCO1 Amb24117867 [0,1,0,1,0,0|1,1,0]=4 9140 B8R1.7 O=C([O-])C1CCC=N1 Amb33624430 [0,1,0,1,0,0|0,0,2]=4 9141 B8R1.7 O=C([O-])[C@@H]1CCCN1 Amb34160472 [0,1,0,1,0,0|0,0,1]=3 9142 B8R1.7 O=S(O)C1NCCN1 Amb27846291 [0,1,0,1,0,0|1,0,0]=3 9143 B8R1.7 O=[PH](O)C1CCCN1 Amb27450678 [0,1,0,1,0,0|1,0,0]=3 9144 B8R1.7 OB(O)C1CCNC1 Amb22490638 [0,1,0,1,0,0|1,0,1]=4 9145 B8R1.7 OC(O)[C@H]1CCCN1 Amb27836006 [0,1,0,1,0,0|0,0,2]=4 9146 B8R1.19 CC1(O)CCCC1N Amb22295747 [0,1,0,1,0,0|1,0,1]=4 9147 B8R1.19 CC1(O)CCCC1N Amb32674775 [0,1,0,1,0,0|1,0,1]=4 9148 B8R1.19 CC1CCNS1(=O)=O Amb33298956 [0,1,0,1,0,0|1,0,1]=4 9149 B8R1.19 CN1CCCS1(=O)=O Amb19959571 [0,1,0,1,0,0|1,0,1]=4 9150 B8R1.19 C[C@]1(O)CCC[C@@H]1N Amb28059560 [0,1,0,1,0,0|1,0,1]=4 9151 B8R1.19 NC1CCCS1(=O)=O Amb27421871 [0,1,0,1,0,0|1,0,1]=4 9152 B8R1.19 NN1CCCS1(=O)=O Amb27603099 [0,1,0,1,0,0|1,0,1]=4 9153 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [0,1,0,1,0,0|2,0,0]=4 9154 B8R1.35 CC(=O)CCC1CO1 Amb28388031 [0,1,0,1,0,0|2,0,0]=4 9155 B8R1.35 CC(=O)CNC1CC1 Amb27831542 [0,1,0,1,0,0|2,0,0]=4 9156 B8R1.35 CC(=O)NCC1CC1 Amb2782861 [0,1,0,1,0,0|2,0,0]=4 9157 B8R1.35 CC(=O)NCC1CO1 Amb23557281 [0,1,0,1,0,0|2,0,0]=4 9158 B8R1.35 CC(=O)NC[C@@H]1CO1 Amb27871512 [0,1,0,1,0,0|2,0,0]=4 9159 B8R1.35 CC(=O)NC[C@H]1CO1 Amb25068125 [0,1,0,1,0,0|2,0,0]=4 9160 B8R1.35 CC(=O)OCC1CO1 Amb10789133 [0,1,0,1,0,0|2,0,0]=4 9161 B8R1.35 CC(=O)OC[C@@H]1CO1 Amb27391694 [0,1,0,1,0,0|2,0,0]=4 9162 B8R1.35 NC(=O)CCC1CC1 Amb28066625 [0,1,0,1,0,0|2,0,0]=4 9163 B8R1.35 NC(=O)CCC1CO1 Amb28252693 [0,1,0,1,0,0|2,0,0]=4 9164 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,1,0,1,0,0|2,0,0]=4 9165 B8R1.35 NC(=O)CNC1CC1 Amb6246049 [0,1,0,1,0,0|2,0,0]=4 9166 B8R1.35 NC(=O)NCC1CC1 Amb1138798 [0,1,0,1,0,0|2,0,0]=4 9167 B8R1.35 NC(=O)OCC1CC1 Amb27668381 [0,1,0,1,0,0|2,0,0]=4 9168 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [0,1,0,1,0,0|2,0,0]=4 9169 B8R1.35 O=C(Cl)NCC1CC1 Amb27410108 [0,1,0,1,0,0|2,0,0]=4 9170 B8R1.35 O=C(Cl)OCC1CC1 Amb33528888 [0,1,0,1,0,0|2,0,0]=4 9171 B8R1.35 O=C(O)C#CC1CC1 Amb1036650 [0,1,0,1,0,0|1,0,1]=4 9172 B8R1.35 O=C(O)CCC1=CC1 Amb28364765 [0,1,0,1,0,0|1,0,0]=3 9173 B8R1.35 O=C(O)CCC1CC1 Amb2686667 [0,1,0,1,0,0|1,0,0]=3 9174 B8R1.35 O=C(O)CCC1CO1 Amb27667995 [0,1,0,1,0,0|1,0,0]=3 9175 B8R1.35 O=C(O)CNC1CC1 Amb7766401 [0,1,0,1,0,0|1,0,0]=3 9176 B8R1.35 O=C(O)CNC1CC1 Amb9677481 [0,1,0,1,0,0|1,0,0]=3 9177 B8R1.35 O=C(O)COC1CC1 Amb27214838 [0,1,0,1,0,0|1,0,0]=3 9178 B8R1.35 O=C(O)CSC1CC1 Amb6760620 [0,1,0,1,0,0|1,0,0]=3 9179 B8R1.35 O=C(O)\C=C/C1CC1 Amb28247513 [0,1,0,1,0,0|1,0,1]=4 9180 B8R1.35 O=C(O)\C=C\C1CC1 Amb18285135 [0,1,0,1,0,0|1,0,1]=4 9181 B8R1.35 O=C(O)\C=C\C1CC1 Amb33714766 [0,1,0,1,0,0|1,0,1]=4 9182 B8R1.35 O=C(O)\C=C\C1CO1 Amb24548089 [0,1,0,1,0,0|1,0,1]=4 9183 B8R1.48 NCC1CCS1(=O)=O Amb28249163 [0,1,0,1,0,0|1,0,1]=4 9184 B8R1.48 NCC1CCS1(=O)=O Amb33329372 [0,1,0,1,0,0|1,0,1]=4 9185 B8R1.72 CC1(O)CCCNC1 Amb10607739 [0,1,0,1,0,0|1,0,1]=4 9186 B8R1.72 CC1(O)CCCNC1 Amb22491963 [0,1,0,1,0,0|1,0,1]=4 9187 B8R1.72 C[C@]1(O)CCCNC1 Amb27470163 [0,1,0,1,0,0|1,0,1]=4 9188 B8R1.72 O=P1(O)CCNCC1 Amb28398023 [0,1,0,1,0,0|2,0,0]=4 9189 B8R1.72 O=P1(O)OCCCO1 Amb27881859 [0,1,0,1,0,0|2,0,0]=4 9190 B8R1.72 O=S1(=O)CCCCN1 Amb10068561 [0,1,0,1,0,0|1,0,1]=4 9191 B8R1.72 O=S1(=O)CCCCO1 Amb6608747 [0,1,0,1,0,0|2,0,0]=4 9192 B8R1.72 O=S1(=O)CCCNC1 Amb27838312 [0,1,0,1,0,0|1,0,1]=4 9193 B8R1.72 O=S1(=O)CCCNC1 Amb32670599 [0,1,0,1,0,0|1,0,1]=4 9194 B8R1.72 O=S1(=O)CCNCN1 Amb15691496 [0,1,0,1,0,0|1,0,1]=4 9195 B8R1.72 O=S1(=O)COCCN1 Amb19516827 [0,1,0,1,0,0|1,0,1]=4 9196 B8R1.72 O=S1(=O)NCCCN1 Amb21857783 [0,1,0,1,0,0|1,0,1]=4 9197 B8R1.72 O=S1(=O)NCCCO1 Amb33098585 [0,1,0,1,0,0|1,0,1]=4 9198 B8R1.23 C=C1CC(C(=O)O)C1 Amb613197 [0,1,0,1,0,0|1,0,1]=4 9199 B8R1.23 CC(=O)C1CC(C)C1 Amb23590280 [0,1,0,1,0,0|2,0,0]=4 9200 B8R1.23 CC(=O)C1CC(N)C1 Amb29880102 [0,1,0,1,0,0|1,0,0]=3 9201 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,1,0,1,0,0|2,0,0]=4 9202 B8R1.23 CC(=O)N1CC(N)C1 Amb19329932 [0,1,0,1,0,0|2,0,0]=4 9203 B8R1.23 CC(=O)N1CC(N)C1 Amb22406088 [0,1,0,1,0,0|2,0,0]=4 9204 B8R1.23 CC(=O)N1CC(N)C1 Amb33339040 [0,1,0,1,0,0|2,0,0]=4 9205 B8R1.23 CC(=O)[C@H]1C[C@@H](C)C1 Amb28253646 [0,1,0,1,0,0|2,0,0]=4 9206 B8R1.23 CC(C)C1CC(=O)C1 Amb25806486 [0,1,0,1,0,0|2,0,0]=4 9207 B8R1.23 CC(C)C1CC(=O)N1 Amb26450589 [0,1,0,1,0,0|2,0,0]=4 9208 B8R1.23 CC(C)[C@@H]1CC(=O)N1 Amb28363876 [0,1,0,1,0,0|2,0,0]=4 9209 B8R1.23 CC(Cl)C1CC(=O)O1 Amb27878702 [0,1,0,1,0,0|1,0,0]=3 9210 B8R1.23 CC(F)C1CC(=O)C1 Amb34159489 [0,1,0,1,0,0|2,0,0]=4 9211 B8R1.23 CC(N)C1CC(O)C1 Amb34164942 [0,1,0,1,0,0|1,0,1]=4 9212 B8R1.23 CC(O)C1CC(=O)C1 Amb34159488 [0,1,0,1,0,0|2,0,0]=4 9213 B8R1.23 CC(O)C1CC(N)C1 Amb35625271 [0,1,0,1,0,0|1,0,1]=4 9214 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [0,1,0,1,0,0|1,0,0]=3 9215 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [0,1,0,1,0,0|0,0,0]=2 9216 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [0,1,0,1,0,0|0,0,0]=2 9217 B8R1.23 CC1CC(C(N)=O)C1 Amb27954948 [0,1,0,1,0,0|2,0,0]=4 9218 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [0,1,0,1,0,0|2,0,0]=4 9219 B8R1.23 C[C@@H](N)C1CC(O)C1 Amb34912829 [0,1,0,1,0,0|1,0,1]=4 9220 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [0,1,0,1,0,0|0,0,0]=2 9221 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [0,1,0,1,0,0|0,0,0]=2 9222 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [0,1,0,1,0,0|0,0,0]=2 9223 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [0,1,0,1,0,0|0,0,0]=2 9224 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [0,1,0,1,0,0|1,0,0]=3 9225 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [0,1,0,1,0,0|1,0,0]=3 9226 B8R1.23 NC(=O)C1CC(=O)N1 Amb27214249 [0,1,0,1,0,0|1,0,1]=4 9227 B8R1.23 NC(=O)C1CC(Cl)C1 Amb27424316 [0,1,0,1,0,0|2,0,0]=4 9228 B8R1.23 NC(=O)C1CC(F)C1 Amb27946575 [0,1,0,1,0,0|2,0,0]=4 9229 B8R1.23 NC(=O)C1CC(N)C1 Amb20622654 [0,1,0,1,0,0|1,0,0]=3 9230 B8R1.23 NC(=O)C1CC(N)C1 Amb32664988 [0,1,0,1,0,0|1,0,0]=3 9231 B8R1.23 NC(=O)N1CC(N)C1 Amb27632971 [0,1,0,1,0,0|2,0,0]=4 9232 B8R1.23 NC(=O)N1CC(N)C1 Amb33483188 [0,1,0,1,0,0|2,0,0]=4 9233 B8R1.23 NC(=O)[C@H]1C[C@@H](Cl)C1 Amb27882303 [0,1,0,1,0,0|2,0,0]=4 9234 B8R1.23 NC(=O)[C@H]1C[C@@H](N)C1 Amb22896793 [0,1,0,1,0,0|1,0,0]=3 9235 B8R1.23 NC(=O)[C@H]1C[C@@H](N)C1 Amb32664685 [0,1,0,1,0,0|1,0,0]=3 9236 B8R1.23 NC(=O)[C@H]1C[C@H](Cl)C1 Amb27882281 [0,1,0,1,0,0|2,0,0]=4 9237 B8R1.23 NC(=O)[C@H]1C[C@H](N)C1 Amb22896794 [0,1,0,1,0,0|1,0,0]=3 9238 B8R1.23 NC(=O)[C@H]1C[C@H](N)C1 Amb32668185 [0,1,0,1,0,0|1,0,0]=3 9239 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [0,1,0,1,0,0|0,0,0]=2 9240 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [0,1,0,1,0,0|0,0,0]=2 9241 B8R1.23 NS(=O)C1CC(=O)C1 Amb32720658 [0,1,0,1,0,0|2,0,0]=4 9242 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [0,1,0,1,0,0|0,0,0]=2 9243 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [0,1,0,1,0,0|0,0,0]=2 9244 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [0,1,0,1,0,0|0,0,0]=2 9245 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [0,1,0,1,0,0|0,0,0]=2 9246 B8R1.23 O=C(Cl)C1CC(Cl)C1 Amb24739809 [0,1,0,1,0,0|2,0,0]=4 9247 B8R1.23 O=C(Cl)C1CC(F)C1 Amb28049013 [0,1,0,1,0,0|2,0,0]=4 9248 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [0,1,0,1,0,0|1,0,0]=3 9249 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [0,1,0,1,0,0|1,0,0]=3 9250 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [0,1,0,1,0,0|1,0,0]=3 9251 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [0,1,0,1,0,0|1,0,0]=3 9252 B8R1.23 O=C(O)C1CS(=O)C1 Amb26056015 [0,1,0,1,0,0|2,0,0]=4 9253 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [0,1,0,1,0,0|1,0,0]=3 9254 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [0,1,0,1,0,0|1,0,0]=3 9255 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [0,1,0,1,0,0|1,0,0]=3 9256 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [0,1,0,1,0,0|1,0,0]=3 9257 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [0,1,0,1,0,0|1,0,0]=3 9258 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [0,1,0,1,0,0|1,0,0]=3 9259 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [0,1,0,1,0,0|1,0,0]=3 9260 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [0,1,0,1,0,0|1,0,0]=3 9261 B8R1.23 O=C1CC(C(=O)O)C1 Amb33544325 [0,1,0,1,0,0|1,0,1]=4 9262 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [0,1,0,1,0,0|0,0,1]=3 9263 B8R1.23 O=C1CC(C(=O)O)O1 Amb26887454 [0,1,0,1,0,0|1,0,1]=4 9264 B8R1.23 O=C1CC(C(Cl)Cl)O1 Amb27952844 [0,1,0,1,0,0|1,0,0]=3 9265 B8R1.23 O=C1CC(C(F)F)C1 Amb27805522 [0,1,0,1,0,0|2,0,0]=4 9266 B8R1.23 O=C1CC(S(=O)O)N1 Amb27595618 [0,1,0,1,0,0|1,0,1]=4 9267 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [0,1,0,1,0,0|0,0,1]=3 9268 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [0,1,0,1,0,0|0,0,1]=3 9269 B8R1.30 C=C1CC1(N)C(=O)O Amb22274582 [0,1,0,1,0,0|1,0,1]=4 9270 B8R1.30 CC(=O)[C@@]1(C)C[C@H]1C Amb28131473 [0,1,0,1,0,0|2,0,0]=4 9271 B8R1.30 CC(=O)[C@]1(C)C[C@H]1C Amb28054445 [0,1,0,1,0,0|2,0,0]=4 9272 B8R1.30 CC(=O)[C@]1(C)C[C@H]1Cl Amb27965058 [0,1,0,1,0,0|2,0,0]=4 9273 B8R1.30 CC1(C(=O)Cl)CC1Br Amb27637734 [0,1,0,1,0,0|2,0,0]=4 9274 B8R1.30 CC1(C(=O)O)CC1Br Amb25889224 [0,1,0,1,0,0|1,0,0]=3 9275 B8R1.30 CC1(C(=O)O)CC1Cl Amb28325885 [0,1,0,1,0,0|1,0,0]=3 9276 B8R1.30 CC1(C(=O)O)CC1F Amb24445672 [0,1,0,1,0,0|1,0,0]=3 9277 B8R1.30 CC1CC1(C)C(=O)O Amb28456906 [0,1,0,1,0,0|1,0,0]=3 9278 B8R1.30 CC1CC1(F)C(=O)O Amb32679974 [0,1,0,1,0,0|1,0,0]=3 9279 B8R1.30 CC1CC1(N)C(=O)O Amb26066646 [0,1,0,1,0,0|1,0,0]=3 9280 B8R1.30 CC1CC1(N)C(N)=O Amb28434643 [0,1,0,1,0,0|2,0,0]=4 9281 B8R1.30 C[C@@H]1C[C@@]1(C)C(=O)O Amb24680945 [0,1,0,1,0,0|1,0,0]=3 9282 B8R1.30 C[C@@H]1C[C@@]1(N)C(N)=O Amb27969162 [0,1,0,1,0,0|2,0,0]=4 9283 B8R1.30 C[C@@H]1C[C@@]1(O)C(=O)O Amb28133921 [0,1,0,1,0,0|1,0,0]=3 9284 B8R1.30 C[C@@H]1O[C@]1(C)C(=O)O Amb28057500 [0,1,0,1,0,0|2,0,0]=4 9285 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1Cl Amb28134278 [0,1,0,1,0,0|1,0,0]=3 9286 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1F Amb24053139 [0,1,0,1,0,0|1,0,0]=3 9287 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Br Amb27222642 [0,1,0,1,0,0|1,0,0]=3 9288 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Cl Amb28196682 [0,1,0,1,0,0|1,0,0]=3 9289 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1F Amb26656665 [0,1,0,1,0,0|1,0,0]=3 9290 B8R1.30 C[C@H]1C[C@@]1(C)C(=O)O Amb27789627 [0,1,0,1,0,0|1,0,0]=3 9291 B8R1.30 C[C@H]1C[C@@]1(Cl)C(=O)O Amb28286348 [0,1,0,1,0,0|1,0,0]=3 9292 B8R1.30 C[C@H]1C[C@]1(N)C(=O)O Amb27873946 [0,1,0,1,0,0|1,0,0]=3 9293 B8R1.30 C[C@H]1C[C@]1(N)C(N)=O Amb27419998 [0,1,0,1,0,0|2,0,0]=4 9294 B8R1.30 C[C@H]1C[C@]1(O)C(=O)O Amb27881113 [0,1,0,1,0,0|1,0,0]=3 9295 B8R1.30 C[C@]1(C(=O)O)C[C@@H]1F Amb26987734 [0,1,0,1,0,0|1,0,0]=3 9296 B8R1.30 C[C@]1(C(=O)O)C[C@H]1F Amb26870422 [0,1,0,1,0,0|1,0,0]=3 9297 B8R1.30 NC1(C(=O)O)CC1Br Amb27430541 [0,1,0,1,0,0|1,0,0]=3 9298 B8R1.30 NC1(C(=O)O)CC1Cl Amb27596928 [0,1,0,1,0,0|1,0,0]=3 9299 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Br Amb28411230 [0,1,0,1,0,0|1,0,0]=3 9300 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Cl Amb25245700 [0,1,0,1,0,0|1,0,0]=3 9301 B8R1.30 N[C@@]1(C(=O)O)C[C@H]1Cl Amb28436769 [0,1,0,1,0,0|1,0,0]=3 9302 B8R1.30 N[C@]1(C(=O)O)C[C@@H]1Cl Amb26587370 [0,1,0,1,0,0|1,0,0]=3 9303 B8R1.30 N[C@]1(C(=O)O)C[C@H]1Cl Amb22748908 [0,1,0,1,0,0|1,0,0]=3 9304 B8R1.54 C=C(C(=O)O)C1CC1 Amb24481397 [0,1,0,1,0,0|1,0,1]=4 9305 B8R1.54 CC(=O)C(C)C1CC1 Amb25798488 [0,1,0,1,0,0|2,0,0]=4 9306 B8R1.54 CC(=O)C(N)C1CC1 Amb27668423 [0,1,0,1,0,0|2,0,0]=4 9307 B8R1.54 CC(C(=O)O)C1CC1 Amb33537630 [0,1,0,1,0,0|1,0,0]=3 9308 B8R1.54 C[C@@H](C(=O)O)C1CC1 Amb33732043 [0,1,0,1,0,0|1,0,0]=3 9309 B8R1.54 C[C@H](C(=O)O)C1CC1 Amb33744363 [0,1,0,1,0,0|1,0,0]=3 9310 B8R1.54 NC(=O)C(Cl)C1CC1 Amb26875098 [0,1,0,1,0,0|2,0,0]=4 9311 B8R1.54 NC(=O)C(N)C1CC1 Amb18282442 [0,1,0,1,0,0|2,0,0]=4 9312 B8R1.54 NC(=O)C(N)C1CC1 Amb28991331 [0,1,0,1,0,0|2,0,0]=4 9313 B8R1.54 NC(=O)C(O)C1CC1 Amb20630809 [0,1,0,1,0,0|2,0,0]=4 9314 B8R1.54 NC(=O)[C@H](N)C1CC1 Amb27436476 [0,1,0,1,0,0|2,0,0]=4 9315 B8R1.54 NC(C(=O)O)C1CC1 Amb19515010 [0,1,0,1,0,0|1,0,0]=3 9316 B8R1.54 NC(C(=O)O)C1CC1 Amb2696737 [0,1,0,1,0,0|1,0,0]=3 9317 B8R1.54 N[C@@H](C(=O)O)C1CC1 Amb2699141 [0,1,0,1,0,0|1,0,0]=3 9318 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb19929447 [0,1,0,1,0,0|1,0,0]=3 9319 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb2694840 [0,1,0,1,0,0|1,0,0]=3 9320 B8R1.54 O=C(O)C(=O)C1CC1 Amb16233327 [0,1,0,1,0,0|1,0,1]=4 9321 B8R1.54 O=C(O)C(F)C1CC1 Amb25936979 [0,1,0,1,0,0|1,0,0]=3 9322 B8R1.54 O=C(O)C(O)C1CC1 Amb18282441 [0,1,0,1,0,0|1,0,0]=3 9323 B8R1.78 CC(=O)C1(C)CCC1 Amb27249451 [0,1,0,1,0,0|2,0,0]=4 9324 B8R1.78 CC(=O)C1(C)CCN1 Amb35747959 [0,1,0,1,0,0|1,0,0]=3 9325 B8R1.78 CC(=O)C1(C)CCN1 Amb35748148 [0,1,0,1,0,0|1,0,0]=3 9326 B8R1.78 CC(=O)C1(N)CCC1 Amb26578364 [0,1,0,1,0,0|2,0,0]=4 9327 B8R1.78 CC(=O)C1(O)CCC1 Amb33328556 [0,1,0,1,0,0|2,0,0]=4 9328 B8R1.78 CC1(C(=O)Cl)CCC1 Amb24533834 [0,1,0,1,0,0|2,0,0]=4 9329 B8R1.78 CC1(C(=O)O)CCC1 Amb33544631 [0,1,0,1,0,0|1,0,0]=3 9330 B8R1.78 CC1(C(=O)O)CCN1 Amb24483061 [0,1,0,1,0,0|0,0,0]=2 9331 B8R1.78 CC1(C(=O)O)CCN1 Amb33483840 [0,1,0,1,0,0|0,0,0]=2 9332 B8R1.78 CC1(C(=O)O)CCN1 Amb34138205 [0,1,0,1,0,0|0,0,0]=2 9333 B8R1.78 CC1(C(=O)O)CCO1 Amb22001906 [0,1,0,1,0,0|1,0,0]=3 9334 B8R1.78 CC1(C(=O)O)CNC1 Amb24077476 [0,1,0,1,0,0|2,0,0]=4 9335 B8R1.78 CC1(C(=O)O)CNC1 Amb24561978 [0,1,0,1,0,0|2,0,0]=4 9336 B8R1.78 CC1(C(=O)O)COC1 Amb33543882 [0,1,0,1,0,0|2,0,0]=4 9337 B8R1.78 CC1(C(=O)O)CSC1 Amb21960451 [0,1,0,1,0,0|2,0,0]=4 9338 B8R1.78 CC1(C(N)=O)CCC1 Amb28396894 [0,1,0,1,0,0|2,0,0]=4 9339 B8R1.78 NC(=O)C1(Br)CCC1 Amb24481413 [0,1,0,1,0,0|2,0,0]=4 9340 B8R1.78 NC(=O)C1(N)CCC1 Amb18523727 [0,1,0,1,0,0|2,0,0]=4 9341 B8R1.78 NC(=O)C1(N)CCC1 Amb33550276 [0,1,0,1,0,0|2,0,0]=4 9342 B8R1.78 NC(=O)C1(O)CCC1 Amb24122570 [0,1,0,1,0,0|2,0,0]=4 9343 B8R1.78 NC1(C(=O)Cl)CCC1 Amb32409362 [0,1,0,1,0,0|2,0,0]=4 9344 B8R1.78 NC1(C(=O)F)CCC1 Amb34148081 [0,1,0,1,0,0|2,0,0]=4 9345 B8R1.78 NC1(C(=O)O)CCC1 Amb2694933 [0,1,0,1,0,0|1,0,0]=3 9346 B8R1.78 NC1(C(=O)O)CCC1 Amb8630070 [0,1,0,1,0,0|1,0,0]=3 9347 B8R1.78 NC1(C(=O)O)CNC1 Amb19895006 [0,1,0,1,0,0|2,0,0]=4 9348 B8R1.78 NC1(C(=O)O)CNC1 Amb21960937 [0,1,0,1,0,0|2,0,0]=4 9349 B8R1.78 NC1(C(=O)O)COC1 Amb18199133 [0,1,0,1,0,0|2,0,0]=4 9350 B8R1.78 NC1(C(=O)O)COC1 Amb33109883 [0,1,0,1,0,0|2,0,0]=4 9351 B8R1.78 NC1(C(=O)O)CSC1 Amb21927718 [0,1,0,1,0,0|2,0,0]=4 9352 B8R1.78 O=C(Cl)C1(Br)CCC1 Amb26358748 [0,1,0,1,0,0|2,0,0]=4 9353 B8R1.78 O=C(Cl)C1(Cl)CCC1 Amb33127943 [0,1,0,1,0,0|2,0,0]=4 9354 B8R1.78 O=C(O)C1(Br)CCC1 Amb495556 [0,1,0,1,0,0|1,0,0]=3 9355 B8R1.78 O=C(O)C1(Cl)CCC1 Amb24422884 [0,1,0,1,0,0|1,0,0]=3 9356 B8R1.78 O=C(O)C1(F)CCC1 Amb22886536 [0,1,0,1,0,0|1,0,0]=3 9357 B8R1.78 O=C(O)C1(F)CNC1 Amb23440120 [0,1,0,1,0,0|2,0,0]=4 9358 B8R1.78 O=C(O)C1(O)CCC1 Amb495557 [0,1,0,1,0,0|1,0,0]=3 9359 B8R1.78 O=C(O)C1(O)CNC1 Amb24122891 [0,1,0,1,0,0|2,0,0]=4 9360 B8R1.78 O=C(O)C1(O)CNC1 Amb28934838 [0,1,0,1,0,0|2,0,0]=4 9361 B8R1.78 O=C(O)C1(O)COC1 Amb25714262 [0,1,0,1,0,0|2,0,0]=4 9362 B8R1.78 O=C(O)C1(S)CCC1 Amb34159631 [0,1,0,1,0,0|1,0,0]=3 9363 B8R1.69 CC1(N)CCC1(C)O Amb24117489 [0,1,0,1,0,0|1,0,1]=4 9364 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,1,0,1,0,0|2,0,0]=4 9365 B8R1.77 CC(=O)C1CC1(C)O Amb27963572 [0,1,0,1,0,0|2,0,0]=4 9366 B8R1.77 CC(=O)C1CC1(Cl)Cl Amb25890324 [0,1,0,1,0,0|2,0,0]=4 9367 B8R1.77 CC(=O)C1CC1(F)F Amb25219948 [0,1,0,1,0,0|2,0,0]=4 9368 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [0,1,0,1,0,0|1,0,0]=3 9369 B8R1.77 CC1(C)CC1C(=O)Cl Amb16230811 [0,1,0,1,0,0|2,0,0]=4 9370 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [0,1,0,1,0,0|1,0,0]=3 9371 B8R1.77 CC1(C)CC1C(N)=O Amb2778846 [0,1,0,1,0,0|2,0,0]=4 9372 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [0,1,0,1,0,0|1,0,0]=3 9373 B8R1.77 CC1(C)C[C@@H]1C(N)=O Amb4166316 [0,1,0,1,0,0|2,0,0]=4 9374 B8R1.77 CC1(C)C[C@H]1C(N)=O Amb10072071 [0,1,0,1,0,0|2,0,0]=4 9375 B8R1.77 CC1(C)OC1C(=O)O Amb24481352 [0,1,0,1,0,0|2,0,0]=4 9376 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [0,1,0,1,0,0|1,0,0]=3 9377 B8R1.77 NC(=O)C1CC1(Cl)Cl Amb2722922 [0,1,0,1,0,0|2,0,0]=4 9378 B8R1.77 NC(=O)C1CC1(F)F Amb24715693 [0,1,0,1,0,0|2,0,0]=4 9379 B8R1.77 O=C(Cl)C1CC1(Cl)Cl Amb16230810 [0,1,0,1,0,0|2,0,0]=4 9380 B8R1.77 O=C(Cl)C1CC1(F)F Amb27864246 [0,1,0,1,0,0|2,0,0]=4 9381 B8R1.77 O=C(Cl)[C@@H]1C[C@@]1(F)Cl Amb27768018 [0,1,0,1,0,0|2,0,0]=4 9382 B8R1.77 O=C(Cl)[C@@H]1C[C@]1(F)Cl Amb27249625 [0,1,0,1,0,0|2,0,0]=4 9383 B8R1.77 O=C(O)C1CC1(Cl)Cl Amb1106460 [0,1,0,1,0,0|1,0,0]=3 9384 B8R1.77 O=C(O)C1CC1(F)Br Amb25952257 [0,1,0,1,0,0|1,0,0]=3 9385 B8R1.77 O=C(O)C1CC1(F)Cl Amb10841879 [0,1,0,1,0,0|1,0,0]=3 9386 B8R1.77 O=C(O)C1CC1(F)F Amb2691845 [0,1,0,1,0,0|1,0,0]=3 9387 B8R1.77 O=C(O)[C@@H]1CC1(F)F Amb30869365 [0,1,0,1,0,0|1,0,0]=3 9388 B8R1.77 O=C(O)[C@@H]1C[C@@]1(F)Cl Amb28252683 [0,1,0,1,0,0|1,0,0]=3 9389 B8R1.77 O=C(O)[C@H]1CC1(Cl)Cl Amb27444143 [0,1,0,1,0,0|1,0,0]=3 9390 B8R1.77 O=C(O)[C@H]1CC1(F)F Amb33802940 [0,1,0,1,0,0|1,0,0]=3 9391 B8R1.55 CC(C)(O)C1CCN1 Amb28052852 [0,1,0,1,0,0|1,0,1]=4 9392 B8R1.55 CC(C)(O)C1CCN1 Amb31308072 [0,1,0,1,0,0|1,0,1]=4 9393 B8R1.55 CC(C)(O)[C@@H]1CCN1 Amb33714482 [0,1,0,1,0,0|1,0,1]=4 9394 B8R1.55 CC(C)(O)[C@H]1CCN1 Amb33801014 [0,1,0,1,0,0|1,0,1]=4 9395 B8R2.4 O=C1CC2CC1C2 Amb24426322 [0,0,0,2,0,0|2,0,0]=4 9396 B8R2.4 O=C1NC2CC1C2 Amb27848619 [0,0,0,2,0,0|2,0,0]=4 9397 B8R2.18 O=C1CC2CC2C1 Amb25750119 [0,0,0,2,0,0|2,0,0]=4 9398 B8R2.18 O=C1CC2OC2C1 Amb25050255 [0,0,0,2,0,0|2,0,0]=4 9399 B8R2.18 O=C1C[C@@H]2C[C@@H]2C1 Amb28350467 [0,0,0,2,0,0|2,0,0]=4 9400 B8R2.38 O=C1C=C[C@@H]2C[C@H]12 Amb28052364 [0,0,0,2,0,0|2,0,0]=4 9401 B8R2.38 O=C1CCC2CC12 Amb22736104 [0,0,0,2,0,0|2,0,0]=4 9402 B8R2.38 O=C1CCC2OC12 Amb28141441 [0,0,0,2,0,0|2,0,0]=4 9403 B8R2.38 O=C1CC[C@@H]2C[C@H]12 Amb24623125 [0,0,0,2,0,0|2,0,0]=4 9404 B8R2.38 O=C1CC[C@H]2C[C@@H]12 Amb27845572 [0,0,0,2,0,0|2,0,0]=4 9405 B8R2.38 O=C1CNC2CC12 Amb34142462 [0,0,0,2,0,0|1,0,0]=3 9406 B8R2.38 O=C1CN[C@@H]2C[C@H]12 Amb27630008 [0,0,0,2,0,0|1,0,0]=3 9407 B8R2.38 O=C1NCC2CC12 Amb22546330 [0,0,0,2,0,0|2,0,0]=4 9408 B8R2.38 O=C1NC[C@@H]2C[C@H]12 Amb27961231 [0,0,0,2,0,0|2,0,0]=4 9409 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,2,0,0|1,0,0]=3 9410 B8R2.38 O=C1OC[C@H]2C[C@@H]12 Amb27421949 [0,0,0,2,0,0|1,0,0]=3 9411 B8R2.2 OC12CNCC1C2 Amb19375437 [0,0,0,2,0,0|1,0,1]=4 9412 B8R2.2 OC12CNCC1C2 Amb29083231 [0,0,0,2,0,0|1,0,1]=4 9413 B8R2.11 O=C1C2CCCC12 Amb27838225 [0,0,0,2,0,0|2,0,0]=4 9414 B8R2.23 C1NCC2CC1O2 Amb19148434 [0,0,0,2,0,0|1,0,1]=4 9415 B8R2.23 C1NCC2CC1O2 Amb22491904 [0,0,0,2,0,0|1,0,1]=4 9416 B8R2.25 C1CNC2OC2C1 Amb27803715 [0,0,0,2,0,0|1,0,1]=4 9417 B8R2.53 O=C1CC2(CC2)C1 Amb24106341 [0,0,0,2,0,0|2,0,0]=4 9418 B8R2.66 O=C(O)C12CC1C2 Amb24732235 [0,0,0,2,0,0|1,0,0]=3 9419 B8R2.66 O=C([O-])C12CC1C2 Amb32662743 [0,0,0,2,0,0|1,0,1]=4