0 B6R0.3 C#CC(C)=C(Br)Br Amb27242841 [0,0,0,0,0,0|2,0,2]=4 1 B6R0.3 C#CC(N)C(=O)O Amb28282694 [0,0,0,0,0,0|1,0,3]=4 2 B6R0.3 C#CC(O)C(=O)O Amb22731622 [0,0,0,0,0,0|1,0,3]=4 3 B6R0.3 C=C(Br)C(=O)CC Amb24406631 [0,0,0,0,0,0|3,0,1]=4 4 B6R0.3 C=C(Br)C(=O)NC Amb28050278 [0,0,0,0,0,0|4,0,0]=4 5 B6R0.3 C=C(Br)C(=O)OC Amb20621565 [0,0,0,0,0,0|4,0,0]=4 6 B6R0.3 C=C(Br)C(C)CC Amb22583745 [0,0,0,0,0,0|2,0,2]=4 7 B6R0.3 C=C(C#N)C(=O)O Amb18638894 [0,0,0,0,0,0|1,0,2]=3 8 B6R0.3 C=C(C)C(=O)CC Amb27486383 [0,0,0,0,0,0|3,0,1]=4 9 B6R0.3 C=C(C)C(=O)NC Amb17934099 [0,0,0,0,0,0|4,0,0]=4 10 B6R0.3 C=C(C)C(=O)OC Amb6608784 [0,0,0,0,0,0|4,0,0]=4 11 B6R0.3 C=C(C)C(C)C=O Amb18639176 [0,0,0,0,0,0|3,0,1]=4 12 B6R0.3 C=C(C)[C@@H](C)C=O Amb27838285 [0,0,0,0,0,0|3,0,1]=4 13 B6R0.3 C=C(C)\C(C)=C\C Amb27391210 [0,0,0,0,0,0|2,0,0]=2 14 B6R0.3 C=C(C=O)C(C)O Amb28050261 [0,0,0,0,0,0|2,0,2]=4 15 B6R0.3 C=C(CBr)C(=O)O Amb6296612 [0,0,0,0,0,0|1,0,2]=3 16 B6R0.3 C=C(CC)B(O)O Amb25888548 [0,0,0,0,0,0|1,0,3]=4 17 B6R0.3 C=C(CC)C(=O)Cl Amb22353554 [0,0,0,0,0,0|1,0,2]=3 18 B6R0.3 C=C(CC)C(=O)O Amb18639591 [0,0,0,0,0,0|0,0,2]=2 19 B6R0.3 C=C(CCl)C(=O)Cl Amb28340919 [0,0,0,0,0,0|2,0,2]=4 20 B6R0.3 C=C(CCl)C(=O)O Amb27851591 [0,0,0,0,0,0|1,0,2]=3 21 B6R0.3 C=C(CO)C(=O)O Amb18121817 [0,0,0,0,0,0|1,0,2]=3 22 B6R0.3 C=C(CO)C(C)=O Amb24571845 [0,0,0,0,0,0|2,0,2]=4 23 B6R0.3 C=C(CS)C(=O)O Amb27263242 [0,0,0,0,0,0|1,0,2]=3 24 B6R0.3 C=C(Cl)C(=O)OC Amb8516698 [0,0,0,0,0,0|4,0,0]=4 25 B6R0.3 C=C(Cl)\C(Cl)=C\Cl Amb27161166 [0,0,0,0,0,0|4,0,0]=4 26 B6R0.3 C=C(F)C(=O)CC Amb28317966 [0,0,0,0,0,0|3,0,1]=4 27 B6R0.3 C=C(F)C(=O)OC Amb10605555 [0,0,0,0,0,0|4,0,0]=4 28 B6R0.3 C=C(OC)C(=O)O Amb18639906 [0,0,0,0,0,0|1,0,1]=2 29 B6R0.3 C=C(OC)C(C)=O Amb28126662 [0,0,0,0,0,0|2,0,1]=3 30 B6R0.3 C=C(OC)C(C)O Amb28281957 [0,0,0,0,0,0|2,0,2]=4 31 B6R0.3 C=C(SC)C(=O)O Amb27882690 [0,0,0,0,0,0|1,0,1]=2 32 B6R0.3 C=C(SS)C(=O)O Amb27593809 [0,0,0,0,0,0|2,0,1]=3 33 B6R0.3 C=C=C(C)C(=O)O Amb17593066 [0,0,0,0,0,0|0,0,2]=2 34 B6R0.3 C=CC(=C)C(=O)O Amb24394371 [0,0,0,0,0,0|0,0,2]=2 35 B6R0.3 C=CC(=C)[C@@H](C)O Amb27196639 [0,0,0,0,0,0|1,0,3]=4 36 B6R0.3 C=CC(=O)C(=C)C Amb26842538 [0,0,0,0,0,0|3,0,1]=4 37 B6R0.3 C=CC(=O)C(=C)S Amb28381152 [0,0,0,0,0,0|2,1,1]=4 38 B6R0.3 C=CC(=O)C(C)O Amb27660466 [0,0,0,0,0,0|2,0,2]=4 39 B6R0.3 C=CC(=O)[C@@H](C)O Amb27838249 [0,0,0,0,0,0|2,0,2]=4 40 B6R0.3 C=CC(C)=C(C)C Amb28457266 [0,0,0,0,0,0|2,0,1]=3 41 B6R0.3 C=CC(C)C(=C)C Amb22228297 [0,0,0,0,0,0|2,0,2]=4 42 B6R0.3 C=CC(C)C(=O)O Amb21618706 [0,0,0,0,0,0|0,0,2]=2 43 B6R0.3 C=CC(C)C(C)O Amb26948663 [0,0,0,0,0,0|1,0,3]=4 44 B6R0.3 C=CC(C)C(N)=O Amb27167730 [0,0,0,0,0,0|1,0,2]=3 45 B6R0.3 C=CC(Cl)=C(F)F Amb10839865 [0,0,0,0,0,0|3,0,1]=4 46 B6R0.3 C=CC(Cl)C(=O)O Amb27216715 [0,0,0,0,0,0|1,0,2]=3 47 B6R0.3 C=CC(F)=C(F)F Amb10838414 [0,0,0,0,0,0|3,0,1]=4 48 B6R0.3 C=CC(N)C(=O)O Amb20240543 [0,0,0,0,0,0|1,0,2]=3 49 B6R0.3 C=CC(O)C(=O)O Amb24061247 [0,0,0,0,0,0|1,0,2]=3 50 B6R0.3 C=CC(O)C(C)=O Amb27838239 [0,0,0,0,0,0|2,0,2]=4 51 B6R0.3 C=CC(O)C(N)=O Amb27391902 [0,0,0,0,0,0|2,0,2]=4 52 B6R0.3 C=CC(S)C(=O)O Amb28069741 [0,0,0,0,0,0|1,0,2]=3 53 B6R0.3 C=CN(C)C(C)=O Amb8513334 [0,0,0,0,0,0|2,0,1]=3 54 B6R0.3 C=C[C@@H](C)C(=O)O Amb26350417 [0,0,0,0,0,0|0,0,2]=2 55 B6R0.3 C=C[C@@H](N)C(=O)O Amb22756048 [0,0,0,0,0,0|1,0,2]=3 56 B6R0.3 C=C[C@H](C)C(=O)O Amb25929549 [0,0,0,0,0,0|0,0,2]=2 57 B6R0.3 C=C[C@H](C)[C@H](C)O Amb27651702 [0,0,0,0,0,0|1,0,3]=4 58 B6R0.3 C=C[C@H](N)C(=O)O Amb2699113 [0,0,0,0,0,0|1,0,2]=3 59 B6R0.3 C=C[C@H](O)C(N)=O Amb28282656 [0,0,0,0,0,0|2,0,2]=4 60 B6R0.3 CC(=O)C(=N)NO Amb27433735 [0,0,0,0,0,0|4,0,0]=4 61 B6R0.3 CC(=O)C(=O)CBr Amb17506257 [0,0,0,0,0,0|3,0,1]=4 62 B6R0.3 CC(=O)C(=O)CCl Amb17506258 [0,0,0,0,0,0|3,0,1]=4 63 B6R0.3 CC(=O)C(=O)NO Amb26477907 [0,0,0,0,0,0|4,0,0]=4 64 B6R0.3 CC(=O)C(=O)O[Na] Amb18511533 [0,0,0,0,0,0|4,0,0]=4 65 B6R0.3 CC(=O)C(Br)C=O Amb17232509 [0,0,0,0,0,0|3,0,1]=4 66 B6R0.3 CC(=O)C(C)C#N Amb8847377 [0,0,0,0,0,0|2,0,2]=4 67 B6R0.3 CC(=O)C(C)C=N Amb28199842 [0,0,0,0,0,0|2,0,1]=3 68 B6R0.3 CC(=O)C(C)C=O Amb18639572 [0,0,0,0,0,0|2,0,1]=3 69 B6R0.3 CC(=O)C(C)CCl Amb26477594 [0,0,0,0,0,0|2,0,2]=4 70 B6R0.3 CC(=O)C(C)CO Amb10844844 [0,0,0,0,0,0|2,0,2]=4 71 B6R0.3 CC(=O)C(Cl)C=O Amb28137911 [0,0,0,0,0,0|3,0,1]=4 72 B6R0.3 CC(=O)N(C)CO Amb28191296 [0,0,0,0,0,0|3,0,1]=4 73 B6R0.3 CC(=O)N(C)N=O Amb25259815 [0,0,0,0,0,0|4,0,0]=4 74 B6R0.3 CC(=O)\C(Br)=C/Cl Amb27400332 [0,0,0,0,0,0|3,0,0]=3 75 B6R0.3 CC(=O)\C(Br)=C\N Amb27878489 [0,0,0,0,0,0|3,0,0]=3 76 B6R0.3 CC(=O)\C(Br)=C\O Amb17232510 [0,0,0,0,0,0|3,0,0]=3 77 B6R0.3 CC(=O)\C(C)=N/O Amb9787796 [0,0,0,0,0,0|3,0,0]=3 78 B6R0.3 CC(=O)\C(C)=N\N Amb27830523 [0,0,0,0,0,0|3,0,0]=3 79 B6R0.3 CC(=O)\C(C)=N\O Amb8389366 [0,0,0,0,0,0|3,0,0]=3 80 B6R0.3 CC(=O)\C(Cl)=C/Cl Amb28050173 [0,0,0,0,0,0|3,0,0]=3 81 B6R0.3 CC(=O)\C(Cl)=C\Cl Amb8393393 [0,0,0,0,0,0|3,0,0]=3 82 B6R0.3 CC(=O)\C(Cl)=C\O Amb27854622 [0,0,0,0,0,0|3,0,0]=3 83 B6R0.3 CC(=O)\C(F)=C\Cl Amb27838259 [0,0,0,0,0,0|3,0,0]=3 84 B6R0.3 CC(=S=S)C(N)=O Amb27639528 [0,0,0,0,0,0|3,0,0]=3 85 B6R0.3 CC(C#N)C(=O)O Amb17210512 [0,0,0,0,0,0|1,0,2]=3 86 B6R0.3 CC(C)=C(Br)C=O Amb18645747 [0,0,0,0,0,0|4,0,0]=4 87 B6R0.3 CC(C)=C(C)CCl Amb27804062 [0,0,0,0,0,0|3,0,1]=4 88 B6R0.3 CC(C)=C(C)CI Amb27838202 [0,0,0,0,0,0|3,0,1]=4 89 B6R0.3 CC(C)=C(C)CN Amb18121233 [0,0,0,0,0,0|3,0,1]=4 90 B6R0.3 CC(C)=C(C)CO Amb25107300 [0,0,0,0,0,0|3,0,1]=4 91 B6R0.3 CC(C)=C(Cl)C=O Amb18640665 [0,0,0,0,0,0|4,0,0]=4 92 B6R0.3 CC(C)=C(F)C=O Amb27964539 [0,0,0,0,0,0|4,0,0]=4 93 B6R0.3 CC(C=O)=C(Cl)Cl Amb27423413 [0,0,0,0,0,0|3,0,0]=3 94 B6R0.3 CC(C=O)C(=O)O Amb27784775 [0,0,0,0,0,0|1,0,1]=2 95 B6R0.3 CC(C=O)C(=O)[Na] Amb27439065 [0,0,0,0,0,0|2,0,1]=3 96 B6R0.3 CC(C=O)S(C)=O Amb29849577 [0,0,0,0,0,0|3,0,1]=4 97 B6R0.3 CC(CBr)=C(Cl)Cl Amb27481542 [0,0,0,0,0,0|3,0,1]=4 98 B6R0.3 CC(CBr)C(=O)O Amb22002601 [0,0,0,0,0,0|1,0,2]=3 99 B6R0.3 CC(CCl)C(=O)O Amb18522181 [0,0,0,0,0,0|1,0,2]=3 100 B6R0.3 CC(CF)C(=O)O Amb24432331 [0,0,0,0,0,0|1,0,2]=3 101 B6R0.3 CC(CN)C(=O)O Amb2699128 [0,0,0,0,0,0|1,0,2]=3 102 B6R0.3 CC(CN)C(=O)O Amb6773978 [0,0,0,0,0,0|1,0,2]=3 103 B6R0.3 CC(CN)C(=O)O Amb8631418 [0,0,0,0,0,0|1,0,2]=3 104 B6R0.3 CC(CO)=C(Cl)Cl Amb17593562 [0,0,0,0,0,0|3,0,1]=4 105 B6R0.3 CC(CO)C(=O)O Amb8011522 [0,0,0,0,0,0|1,0,2]=3 106 B6R0.3 CC(N=O)C(N)=O Amb26600137 [0,0,0,0,0,0|3,0,1]=4 107 B6R0.3 CC(NN)C(=O)O Amb18640367 [0,0,0,0,0,0|2,0,1]=3 108 B6R0.3 CC(O)C(=O)C=O Amb28287297 [0,0,0,0,0,0|3,0,1]=4 109 B6R0.3 CC(O)N(C)C=O Amb27191911 [0,0,0,0,0,0|3,0,1]=4 110 B6R0.3 CC(O)\C(F)=C\F Amb27844479 [0,0,0,0,0,0|3,0,1]=4 111 B6R0.3 CC(ON)C(=O)O Amb33038242 [0,0,0,0,0,0|2,0,1]=3 112 B6R0.3 CC(ON)C(N)=O Amb28318742 [0,0,0,0,0,0|3,0,1]=4 113 B6R0.3 CCC(=O)C(=O)Cl Amb27838251 [0,0,0,0,0,0|2,0,1]=3 114 B6R0.3 CCC(=O)C(=O)O Amb3940359 [0,0,0,0,0,0|1,0,1]=2 115 B6R0.3 CCC(=O)C(=O)[O-] Amb9825450 [0,0,0,0,0,0|1,0,2]=3 116 B6R0.3 CCC(=O)C(C)=O Amb8514604 [0,0,0,0,0,0|2,0,1]=3 117 B6R0.3 CCC(=O)C(C)O Amb24479536 [0,0,0,0,0,0|2,0,2]=4 118 B6R0.3 CCC(=O)C(N)=O Amb22011827 [0,0,0,0,0,0|2,0,1]=3 119 B6R0.3 CCC(=O)[C@@H](C)O Amb27835613 [0,0,0,0,0,0|2,0,2]=4 120 B6R0.3 CCC(=O)[C@H](C)O Amb28201619 [0,0,0,0,0,0|2,0,2]=4 121 B6R0.3 CCC(=S)C(=O)O Amb27872099 [0,0,0,0,0,0|1,0,1]=2 122 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [0,0,0,0,0,0|2,0,2]=4 123 B6R0.3 CCC(Br)C(=O)Cl Amb17666758 [0,0,0,0,0,0|2,0,2]=4 124 B6R0.3 CCC(Br)C(=O)O Amb5716858 [0,0,0,0,0,0|1,0,2]=3 125 B6R0.3 CCC(Br)C(C)=O Amb24615269 [0,0,0,0,0,0|2,0,2]=4 126 B6R0.3 CCC(Br)C(N)=O Amb13952819 [0,0,0,0,0,0|2,0,2]=4 127 B6R0.3 CCC(C)=C(C)C Amb4017694 [0,0,0,0,0,0|2,0,1]=3 128 B6R0.3 CCC(C)B(O)O Amb10071974 [0,0,0,0,0,0|1,0,3]=4 129 B6R0.3 CCC(C)C(=N)N Amb6740564 [0,0,0,0,0,0|2,0,2]=4 130 B6R0.3 CCC(C)C(=N)N Amb8630181 [0,0,0,0,0,0|2,0,2]=4 131 B6R0.3 CCC(C)C(=O)Cl Amb3939259 [0,0,0,0,0,0|1,0,2]=3 132 B6R0.3 CCC(C)C(=O)O Amb9703224 [0,0,0,0,0,0|0,0,2]=2 133 B6R0.3 CCC(C)C(C)=O Amb4605996 [0,0,0,0,0,0|1,0,2]=3 134 B6R0.3 CCC(C)C(C)O Amb8513435 [0,0,0,0,0,0|1,0,3]=4 135 B6R0.3 CCC(C)C(N)=O Amb33548100 [0,0,0,0,0,0|1,0,2]=3 136 B6R0.3 CCC(C)C(N)=S Amb6740516 [0,0,0,0,0,0|1,1,2]=4 137 B6R0.3 CCC(C)C(O)O Amb27826789 [0,0,0,0,0,0|0,0,4]=4 138 B6R0.3 CCC(C)S(=O)Cl Amb27841595 [0,0,0,0,0,0|2,0,2]=4 139 B6R0.3 CCC(C)S(=O)[O-] Amb19893328 [0,0,0,0,0,0|1,0,3]=4 140 B6R0.3 CCC(C)S(N)=O Amb32756501 [0,0,0,0,0,0|2,0,2]=4 141 B6R0.3 CCC(C)[C@@H](C)O Amb27946951 [0,0,0,0,0,0|1,0,3]=4 142 B6R0.3 CCC(C)[C@H](C)O Amb28281014 [0,0,0,0,0,0|1,0,3]=4 143 B6R0.3 CCC(C)[N+](=O)[O-] Amb4036169 [0,0,0,0,0,0|1,0,3]=4 144 B6R0.3 CCC(Cl)=C(Cl)Cl Amb27421317 [0,0,0,0,0,0|3,0,1]=4 145 B6R0.3 CCC(Cl)C(=O)Br Amb28384077 [0,0,0,0,0,0|2,0,2]=4 146 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [0,0,0,0,0,0|2,0,2]=4 147 B6R0.3 CCC(Cl)C(=O)O Amb4017887 [0,0,0,0,0,0|1,0,2]=3 148 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [0,0,0,0,0,0|2,0,2]=4 149 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [0,0,0,0,0,0|2,0,2]=4 150 B6R0.3 CCC(F)=C(F)F Amb10840895 [0,0,0,0,0,0|3,0,1]=4 151 B6R0.3 CCC(F)C(=O)O Amb25716167 [0,0,0,0,0,0|1,0,2]=3 152 B6R0.3 CCC(N)C(=O)Cl Amb17593240 [0,0,0,0,0,0|2,0,2]=4 153 B6R0.3 CCC(N)C(=O)O Amb9729506 [0,0,0,0,0,0|1,0,2]=3 154 B6R0.3 CCC(N)C(N)=O Amb1914080 [0,0,0,0,0,0|2,0,2]=4 155 B6R0.3 CCC(N)C(N)=O Amb33528521 [0,0,0,0,0,0|2,0,2]=4 156 B6R0.3 CCC(O)C(=O)O Amb6609018 [0,0,0,0,0,0|1,0,2]=3 157 B6R0.3 CCC(O)C(=O)[O-] Amb17943026 [0,0,0,0,0,0|1,0,3]=4 158 B6R0.3 CCC(O)C(C)=O Amb25336501 [0,0,0,0,0,0|2,0,2]=4 159 B6R0.3 CCC(O)C(N)=O Amb24116514 [0,0,0,0,0,0|2,0,2]=4 160 B6R0.3 CCC(S)C(=O)O Amb17501370 [0,0,0,0,0,0|1,0,2]=3 161 B6R0.3 CCC(S)C(C)=O Amb8393170 [0,0,0,0,0,0|2,0,2]=4 162 B6R0.3 CCN(C)C(=N)N Amb33552632 [0,0,0,0,0,0|3,0,1]=4 163 B6R0.3 CCN(C)C(=N)N Amb8890895 [0,0,0,0,0,0|3,0,1]=4 164 B6R0.3 CCN(C)C(=O)Cl Amb8390927 [0,0,0,0,0,0|2,0,1]=3 165 B6R0.3 CCN(C)C(=S)S Amb27430266 [0,0,0,0,0,0|1,2,1]=4 166 B6R0.3 CCN(C)C(C)=O Amb22753516 [0,0,0,0,0,0|2,0,1]=3 167 B6R0.3 CCN(N)C(C)=O Amb18639976 [0,0,0,0,0,0|3,0,1]=4 168 B6R0.3 CCN(N)C(N)=O Amb28184355 [0,0,0,0,0,0|3,0,1]=4 169 B6R0.3 CCN(O)C(C)=O Amb27652499 [0,0,0,0,0,0|3,0,1]=4 170 B6R0.3 CC[C@@H](Br)C(=O)O Amb9785161 [0,0,0,0,0,0|1,0,2]=3 171 B6R0.3 CC[C@@H](C)B(O)O Amb27784066 [0,0,0,0,0,0|1,0,3]=4 172 B6R0.3 CC[C@@H](C)C(=O)O Amb8384578 [0,0,0,0,0,0|0,0,2]=2 173 B6R0.3 CC[C@@H](C)C(C)=O Amb28283799 [0,0,0,0,0,0|1,0,2]=3 174 B6R0.3 CC[C@@H](C)[C@@H](C)O Amb27448466 [0,0,0,0,0,0|1,0,3]=4 175 B6R0.3 CC[C@@H](Cl)C(=O)Cl Amb27985877 [0,0,0,0,0,0|2,0,2]=4 176 B6R0.3 CC[C@@H](Cl)C(=O)O Amb22800493 [0,0,0,0,0,0|1,0,2]=3 177 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [0,0,0,0,0,0|2,0,2]=4 178 B6R0.3 CC[C@@H](N)C(=O)O Amb16233349 [0,0,0,0,0,0|1,0,2]=3 179 B6R0.3 CC[C@@H](N)C(=O)O Amb3940761 [0,0,0,0,0,0|1,0,2]=3 180 B6R0.3 CC[C@@H](N)C(C)=O Amb35594875 [0,0,0,0,0,0|2,0,2]=4 181 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [0,0,0,0,0,0|2,0,2]=4 182 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [0,0,0,0,0,0|2,0,2]=4 183 B6R0.3 CC[C@@H](O)C(=O)O Amb22369401 [0,0,0,0,0,0|1,0,2]=3 184 B6R0.3 CC[C@@H](O)C(N)=O Amb27792606 [0,0,0,0,0,0|2,0,2]=4 185 B6R0.3 CC[C@H](Br)C(=O)O Amb20242441 [0,0,0,0,0,0|1,0,2]=3 186 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [0,0,0,0,0,0|1,0,3]=4 187 B6R0.3 CC[C@H](C)C(=O)Cl Amb26463969 [0,0,0,0,0,0|1,0,2]=3 188 B6R0.3 CC[C@H](C)C(=O)O Amb8514667 [0,0,0,0,0,0|0,0,2]=2 189 B6R0.3 CC[C@H](C)C(N)=O Amb27440802 [0,0,0,0,0,0|1,0,2]=3 190 B6R0.3 CC[C@H](Cl)C(=O)O Amb25190040 [0,0,0,0,0,0|1,0,2]=3 191 B6R0.3 CC[C@H](N)C(=O)O Amb2694208 [0,0,0,0,0,0|1,0,2]=3 192 B6R0.3 CC[C@H](N)C(=O)O Amb8631089 [0,0,0,0,0,0|1,0,2]=3 193 B6R0.3 CC[C@H](N)C(C)=O Amb29849605 [0,0,0,0,0,0|2,0,2]=4 194 B6R0.3 CC[C@H](N)C(N)=O Amb8387112 [0,0,0,0,0,0|2,0,2]=4 195 B6R0.3 CC[C@H](N)C(N)=O Amb8395789 [0,0,0,0,0,0|2,0,2]=4 196 B6R0.3 CC[C@H](O)C(=O)O Amb4166324 [0,0,0,0,0,0|1,0,2]=3 197 B6R0.3 CC[C@H](S)C(=O)O Amb9785162 [0,0,0,0,0,0|1,0,2]=3 198 B6R0.3 CN(CCl)C(=O)Cl Amb25076174 [0,0,0,0,0,0|3,0,1]=4 199 B6R0.3 CN(N=O)C(N)=O Amb2694991 [0,0,0,0,0,0|4,0,0]=4 200 B6R0.3 CNC(=O)C(=O)O Amb2691295 [0,0,0,0,0,0|2,0,0]=2 201 B6R0.3 CNC(=O)C(C)=O Amb17399787 [0,0,0,0,0,0|3,0,0]=3 202 B6R0.3 CNC(=O)C(C)O Amb9421389 [0,0,0,0,0,0|3,0,1]=4 203 B6R0.3 CNC(=O)C(N)=S Amb27866513 [0,0,0,0,0,0|3,1,0]=4 204 B6R0.3 CNC(=O)N(C)O Amb27169733 [0,0,0,0,0,0|4,0,0]=4 205 B6R0.3 CNC(=O)[C@@H](C)O Amb27206795 [0,0,0,0,0,0|3,0,1]=4 206 B6R0.3 CNC(=O)[C@H](C)O Amb27458528 [0,0,0,0,0,0|3,0,1]=4 207 B6R0.3 CNC(=S)C(N)=S Amb27254208 [0,0,0,0,0,0|3,1,0]=4 208 B6R0.3 CNC(C)C(=O)O Amb19373699 [0,0,0,0,0,0|1,0,1]=2 209 B6R0.3 CNC(C)C(=O)O Amb9271766 [0,0,0,0,0,0|1,0,1]=2 210 B6R0.3 CNC(C)C(C)=O Amb24369529 [0,0,0,0,0,0|2,0,1]=3 211 B6R0.3 CNC(C)C(N)=O Amb33527202 [0,0,0,0,0,0|2,0,1]=3 212 B6R0.3 CNC(C)C(N)=O Amb7758120 [0,0,0,0,0,0|2,0,1]=3 213 B6R0.3 CNC(C)C(O)O Amb28348594 [0,0,0,0,0,0|1,0,3]=4 214 B6R0.3 CNC(O)C(=O)O Amb27229907 [0,0,0,0,0,0|2,0,1]=3 215 B6R0.3 CNN(C)C(N)=O Amb28134420 [0,0,0,0,0,0|3,0,0]=3 216 B6R0.3 CN[C@@H](C)C(=O)O Amb16233347 [0,0,0,0,0,0|1,0,1]=2 217 B6R0.3 CN[C@@H](C)C(=O)O Amb16233348 [0,0,0,0,0,0|1,0,1]=2 218 B6R0.3 CN[C@@H](C)C(C)O Amb29849613 [0,0,0,0,0,0|2,0,2]=4 219 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [0,0,0,0,0,0|2,0,1]=3 220 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [0,0,0,0,0,0|2,0,1]=3 221 B6R0.3 CN[C@H](C)C(=O)O Amb10844859 [0,0,0,0,0,0|1,0,1]=2 222 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [0,0,0,0,0,0|2,0,1]=3 223 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [0,0,0,0,0,0|2,0,1]=3 224 B6R0.3 COC(=O)C(=N)N Amb24708486 [0,0,0,0,0,0|4,0,0]=4 225 B6R0.3 COC(=O)C(=N)N Amb8630730 [0,0,0,0,0,0|4,0,0]=4 226 B6R0.3 COC(=O)C(=O)Cl Amb3940234 [0,0,0,0,0,0|3,0,0]=3 227 B6R0.3 COC(=O)C(=O)O Amb33545007 [0,0,0,0,0,0|2,0,0]=2 228 B6R0.3 COC(=O)C(=O)[O-] Amb22058088 [0,0,0,0,0,0|2,0,1]=3 229 B6R0.3 COC(=O)C(=O)[O-] Amb22411428 [0,0,0,0,0,0|2,0,1]=3 230 B6R0.3 COC(=O)C(C)=O Amb8513262 [0,0,0,0,0,0|3,0,0]=3 231 B6R0.3 COC(=O)C(C)O Amb8516704 [0,0,0,0,0,0|3,0,1]=4 232 B6R0.3 COC(=O)C(N)=O Amb22167666 [0,0,0,0,0,0|3,0,0]=3 233 B6R0.3 COC(=O)C(N)=S Amb19514933 [0,0,0,0,0,0|3,1,0]=4 234 B6R0.3 COC(=O)N(C)O Amb25823260 [0,0,0,0,0,0|4,0,0]=4 235 B6R0.3 COC(=O)[C@@H](C)O Amb3939701 [0,0,0,0,0,0|3,0,1]=4 236 B6R0.3 COC(=O)[C@H](C)O Amb3939672 [0,0,0,0,0,0|3,0,1]=4 237 B6R0.3 COC(Br)C(=O)O Amb27439128 [0,0,0,0,0,0|2,0,1]=3 238 B6R0.3 COC(Br)C(C)=O Amb25360111 [0,0,0,0,0,0|3,0,1]=4 239 B6R0.3 COC(C)C(=N)N Amb20622329 [0,0,0,0,0,0|3,0,1]=4 240 B6R0.3 COC(C)C(=N)N Amb22059004 [0,0,0,0,0,0|3,0,1]=4 241 B6R0.3 COC(C)C(=O)Cl Amb26005661 [0,0,0,0,0,0|2,0,1]=3 242 B6R0.3 COC(C)C(=O)O Amb9729215 [0,0,0,0,0,0|1,0,1]=2 243 B6R0.3 COC(C)C(C)=O Amb9666021 [0,0,0,0,0,0|2,0,1]=3 244 B6R0.3 COC(C)C(C)O Amb22757090 [0,0,0,0,0,0|2,0,2]=4 245 B6R0.3 COC(C)C(N)=O Amb6541307 [0,0,0,0,0,0|2,0,1]=3 246 B6R0.3 COC(C)C(N)=S Amb20622535 [0,0,0,0,0,0|2,1,1]=4 247 B6R0.3 COC(C)[C@H](C)O Amb27805786 [0,0,0,0,0,0|2,0,2]=4 248 B6R0.3 COC(Cl)C(=O)O Amb28280799 [0,0,0,0,0,0|2,0,1]=3 249 B6R0.3 COC(Cl)C(C)=O Amb28118971 [0,0,0,0,0,0|3,0,1]=4 250 B6R0.3 COC(F)C(=O)O Amb27764863 [0,0,0,0,0,0|2,0,1]=3 251 B6R0.3 COC(F)C(=O)[O-] Amb33447021 [0,0,0,0,0,0|2,0,2]=4 252 B6R0.3 COC(O)C(C)=O Amb27954086 [0,0,0,0,0,0|3,0,1]=4 253 B6R0.3 CON(C)C(=O)Cl Amb8517218 [0,0,0,0,0,0|3,0,0]=3 254 B6R0.3 CON(C)C(C)=O Amb2689133 [0,0,0,0,0,0|3,0,0]=3 255 B6R0.3 CON(C)C(N)=O Amb25305178 [0,0,0,0,0,0|3,0,0]=3 256 B6R0.3 CON(Cl)C(N)=O Amb27236900 [0,0,0,0,0,0|4,0,0]=4 257 B6R0.3 CO[C@@H](C)C(=O)Cl Amb26562182 [0,0,0,0,0,0|2,0,1]=3 258 B6R0.3 CO[C@@H](C)C(=O)O Amb8515766 [0,0,0,0,0,0|1,0,1]=2 259 B6R0.3 CO[C@@H](C)C(N)=O Amb8515768 [0,0,0,0,0,0|2,0,1]=3 260 B6R0.3 CO[C@H](C)C(=N)N Amb28043131 [0,0,0,0,0,0|3,0,1]=4 261 B6R0.3 CO[C@H](C)C(=O)Cl Amb27588755 [0,0,0,0,0,0|2,0,1]=3 262 B6R0.3 CO[C@H](C)C(=O)O Amb8515771 [0,0,0,0,0,0|1,0,1]=2 263 B6R0.3 CO[C@H](C)C(N)=O Amb17617080 [0,0,0,0,0,0|2,0,1]=3 264 B6R0.3 CO\C(F)=C(/F)Cl Amb26457966 [0,0,0,0,0,0|4,0,0]=4 265 B6R0.3 CSC(=O)C(C)=O Amb27861244 [0,0,0,0,0,0|3,0,0]=3 266 B6R0.3 CSC(=S)C(N)=O Amb28128369 [0,0,0,0,0,0|3,0,0]=3 267 B6R0.3 CSC(C)C(=O)O Amb6274567 [0,0,0,0,0,0|1,0,1]=2 268 B6R0.3 CSC(C)C(C)O Amb33550763 [0,0,0,0,0,0|2,0,2]=4 269 B6R0.3 CSC(C)C(N)=O Amb28047863 [0,0,0,0,0,0|2,0,1]=3 270 B6R0.3 CSC(Cl)C(=O)Cl Amb27392297 [0,0,0,0,0,0|3,0,1]=4 271 B6R0.3 CSC(N)C(=O)O Amb28383509 [0,0,0,0,0,0|2,0,1]=3 272 B6R0.3 CS[C@@H](C)[C@H](C)O Amb27765798 [0,0,0,0,0,0|2,0,2]=4 273 B6R0.3 CS[C@H](C)C(=O)O Amb26611205 [0,0,0,0,0,0|1,0,1]=2 274 B6R0.3 C[C@@H](CF)C(=O)O Amb33743265 [0,0,0,0,0,0|1,0,2]=3 275 B6R0.3 C[C@@H](CI)C(=O)O Amb28322539 [0,0,0,0,0,0|1,0,2]=3 276 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [0,0,0,0,0,0|1,0,2]=3 277 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [0,0,0,0,0,0|1,0,2]=3 278 B6R0.3 C[C@@H](CO)C(=O)O Amb10844567 [0,0,0,0,0,0|1,0,2]=3 279 B6R0.3 C[C@@H](CO)C(N)=O Amb27254152 [0,0,0,0,0,0|2,0,2]=4 280 B6R0.3 C[C@@H](ON)C(=O)O Amb27169414 [0,0,0,0,0,0|2,0,1]=3 281 B6R0.3 C[C@@H](ON)C(=O)O Amb33620846 [0,0,0,0,0,0|2,0,1]=3 282 B6R0.3 C[C@H](CBr)C(=O)O Amb27975404 [0,0,0,0,0,0|1,0,2]=3 283 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [0,0,0,0,0,0|2,0,2]=4 284 B6R0.3 C[C@H](CF)C(=O)O Amb33727262 [0,0,0,0,0,0|1,0,2]=3 285 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [0,0,0,0,0,0|1,0,2]=3 286 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [0,0,0,0,0,0|1,0,2]=3 287 B6R0.3 C[C@H](CO)C(=O)O Amb10844554 [0,0,0,0,0,0|1,0,2]=3 288 B6R0.3 C[C@H](NBr)C(=O)O Amb28050211 [0,0,0,0,0,0|2,0,1]=3 289 B6R0.3 C[C@H](NN)C(=O)O Amb28247936 [0,0,0,0,0,0|2,0,1]=3 290 B6R0.3 C[C@H](ON)C(=O)O Amb25853808 [0,0,0,0,0,0|2,0,1]=3 291 B6R0.3 C[C@H](ON)C(=O)O Amb33620847 [0,0,0,0,0,0|2,0,1]=3 292 B6R0.3 C\C(=C/Br)C(=O)O Amb4014496 [0,0,0,0,0,0|1,0,0]=1 293 B6R0.3 C\C(=C/Br)C(C)O Amb27848009 [0,0,0,0,0,0|2,0,1]=3 294 B6R0.3 C\C(=C/Br)C(N)=O Amb27658807 [0,0,0,0,0,0|2,0,0]=2 295 B6R0.3 C\C(=C/Cl)C(=O)Cl Amb27400291 [0,0,0,0,0,0|2,0,0]=2 296 B6R0.3 C\C(=C/Cl)C(C)O Amb27233447 [0,0,0,0,0,0|2,0,1]=3 297 B6R0.3 C\C(=C/F)C(=O)O Amb27469080 [0,0,0,0,0,0|1,0,0]=1 298 B6R0.3 C\C(=C/I)C(=O)O Amb27838211 [0,0,0,0,0,0|1,0,0]=1 299 B6R0.3 C\C(=C/N)C(=N)N Amb27879530 [0,0,0,0,0,0|3,0,0]=3 300 B6R0.3 C\C(=C/N)[N+](=O)[O-] Amb27459284 [0,0,0,0,0,0|2,0,1]=3 301 B6R0.3 C\C(=N/O)C(=O)O Amb28187271 [0,0,0,0,0,0|2,0,0]=2 302 B6R0.3 C\C(=N/O)[N+](=O)[O-] Amb17939341 [0,0,0,0,0,0|3,0,1]=4 303 B6R0.3 C\C(Br)=C(/C)C=O Amb18645749 [0,0,0,0,0,0|3,0,0]=3 304 B6R0.3 C\C(Br)=C(\C)CO Amb28319890 [0,0,0,0,0,0|3,0,1]=4 305 B6R0.3 C\C(Cl)=C(\C)C=O Amb27403540 [0,0,0,0,0,0|3,0,0]=3 306 B6R0.3 C\C(Cl)=C(\C)CCl Amb27254166 [0,0,0,0,0,0|3,0,1]=4 307 B6R0.3 C\C(Cl)=C(\C)CO Amb27638176 [0,0,0,0,0,0|3,0,1]=4 308 B6R0.3 C\C(O)=C(/C)C=O Amb27238606 [0,0,0,0,0,0|2,0,0]=2 309 B6R0.3 C\C(O)=C(\Br)C=O Amb27643424 [0,0,0,0,0,0|3,0,0]=3 310 B6R0.3 C\C(O)=C(\C)C=O Amb27210577 [0,0,0,0,0,0|2,0,0]=2 311 B6R0.3 C\C(S)=C(/C)C=O Amb18641908 [0,0,0,0,0,0|2,1,0]=3 312 B6R0.3 C\C=C(/Br)C(=O)O Amb18646193 [0,0,0,0,0,0|1,0,0]=1 313 B6R0.3 C\C=C(/Br)[C@H](C)Cl Amb28342257 [0,0,0,0,0,0|3,0,1]=4 314 B6R0.3 C\C=C(/C)B(O)O Amb26444000 [0,0,0,0,0,0|1,0,1]=2 315 B6R0.3 C\C=C(/C)C(=N)N Amb27838198 [0,0,0,0,0,0|2,0,0]=2 316 B6R0.3 C\C=C(/C)C(=O)Cl Amb8395514 [0,0,0,0,0,0|1,0,0]=1 317 B6R0.3 C\C=C(/C)C(=O)O Amb33723768 [0,0,0,0,0,0|0,0,0]=0 318 B6R0.3 C\C=C(/C)C(C)=O Amb2725616 [0,0,0,0,0,0|1,0,0]=1 319 B6R0.3 C\C=C(/C)C(C)C Amb4019536 [0,0,0,0,0,0|2,0,1]=3 320 B6R0.3 C\C=C(/C)C(C)Cl Amb28050209 [0,0,0,0,0,0|2,0,1]=3 321 B6R0.3 C\C=C(/F)C(=O)O Amb32663762 [0,0,0,0,0,0|1,0,0]=1 322 B6R0.3 C\C=C(/O)C(=O)O Amb22727962 [0,0,0,0,0,0|1,0,0]=1 323 B6R0.3 C\C=C(/O)C(N)=O Amb27837997 [0,0,0,0,0,0|2,0,0]=2 324 B6R0.3 C\C=C(\Br)C(=O)O Amb4014486 [0,0,0,0,0,0|1,0,0]=1 325 B6R0.3 C\C=C(\Br)C(N)=O Amb25919697 [0,0,0,0,0,0|2,0,0]=2 326 B6R0.3 C\C=C(\Br)[C@@H](C)O Amb28064198 [0,0,0,0,0,0|2,0,1]=3 327 B6R0.3 C\C=C(\C)B(O)O Amb25373747 [0,0,0,0,0,0|1,0,1]=2 328 B6R0.3 C\C=C(\C)C(=N)N Amb28131426 [0,0,0,0,0,0|2,0,0]=2 329 B6R0.3 C\C=C(\C)C(=O)O Amb3445181 [0,0,0,0,0,0|0,0,0]=0 330 B6R0.3 C\C=C(\C)C(N)=O Amb28318688 [0,0,0,0,0,0|1,0,0]=1 331 B6R0.3 C\C=C(\Cl)C(=O)O Amb28073985 [0,0,0,0,0,0|1,0,0]=1 332 B6R0.3 C\C=C(\Cl)C(C)O Amb28350374 [0,0,0,0,0,0|2,0,1]=3 333 B6R0.3 C\C=C(\I)C(=O)O Amb27841305 [0,0,0,0,0,0|1,0,0]=1 334 B6R0.3 C\N=C(/C)C(C)=O Amb27838250 [0,0,0,0,0,0|2,0,0]=2 335 B6R0.3 C\N=C(/C)C(C)Cl Amb27666870 [0,0,0,0,0,0|3,0,1]=4 336 B6R0.3 N#CC(N)C(=O)O Amb25328320 [0,0,0,0,0,0|2,0,2]=4 337 B6R0.3 N#CC(O)C(=O)O Amb27467286 [0,0,0,0,0,0|2,0,2]=4 338 B6R0.3 NC(=O)C(N)=S=O Amb28314240 [0,0,0,0,0,0|4,0,0]=4 339 B6R0.3 NC(=O)\C(Cl)=C\Cl Amb27468439 [0,0,0,0,0,0|3,0,0]=3 340 B6R0.3 NC(=O)\C(N)=N\O Amb16186552 [0,0,0,0,0,0|4,0,0]=4 341 B6R0.3 NC(CCl)C(=O)O Amb19651457 [0,0,0,0,0,0|2,0,2]=4 342 B6R0.3 NC(CCl)C(=O)O Amb21961077 [0,0,0,0,0,0|2,0,2]=4 343 B6R0.3 NC(CF)C(=O)O Amb10839589 [0,0,0,0,0,0|2,0,2]=4 344 B6R0.3 NC(CO)C(=O)O Amb9702805 [0,0,0,0,0,0|2,0,2]=4 345 B6R0.3 NC(CP)C(=O)O Amb27234251 [0,0,0,0,0,0|2,0,2]=4 346 B6R0.3 NC(CS)C(=O)O Amb13961966 [0,0,0,0,0,0|2,0,2]=4 347 B6R0.3 NC(CS)C(=O)O Amb22489523 [0,0,0,0,0,0|2,0,2]=4 348 B6R0.3 NC(CS)C(=O)O Amb6537913 [0,0,0,0,0,0|2,0,2]=4 349 B6R0.3 NC(CS)C(=O)O Amb6537914 [0,0,0,0,0,0|2,0,2]=4 350 B6R0.3 NC(C[NH3+])C(=O)O Amb4004471 [0,0,0,0,0,0|2,0,2]=4 351 B6R0.3 NCC(Br)C(=O)O Amb28385732 [0,0,0,0,0,0|2,0,2]=4 352 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [0,0,0,0,0,0|2,0,2]=4 353 B6R0.3 NCC(F)C(=O)O Amb22733051 [0,0,0,0,0,0|2,0,2]=4 354 B6R0.3 NCC(F)C(=O)O Amb2688010 [0,0,0,0,0,0|2,0,2]=4 355 B6R0.3 NCC(N)C(=O)O Amb22899095 [0,0,0,0,0,0|2,0,2]=4 356 B6R0.3 NCC(N)C(=O)O Amb2697095 [0,0,0,0,0,0|2,0,2]=4 357 B6R0.3 NCC(N)C(=O)O Amb8514284 [0,0,0,0,0,0|2,0,2]=4 358 B6R0.3 NCC(O)C(=O)O Amb8517492 [0,0,0,0,0,0|2,0,2]=4 359 B6R0.3 NCC(S)C(=O)O Amb17593238 [0,0,0,0,0,0|2,0,2]=4 360 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [0,0,0,0,0,0|2,0,2]=4 361 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [0,0,0,0,0,0|2,0,2]=4 362 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [0,0,0,0,0,0|2,0,2]=4 363 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [0,0,0,0,0,0|2,0,2]=4 364 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [0,0,0,0,0,0|2,0,2]=4 365 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [0,0,0,0,0,0|2,0,2]=4 366 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [0,0,0,0,0,0|2,0,2]=4 367 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [0,0,0,0,0,0|2,0,2]=4 368 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [0,0,0,0,0,0|2,0,2]=4 369 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [0,0,0,0,0,0|2,0,2]=4 370 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [0,0,0,0,0,0|2,0,2]=4 371 B6R0.3 NNC(=O)C(N)=O Amb6608760 [0,0,0,0,0,0|4,0,0]=4 372 B6R0.3 N[C@@H](C=S)C(=O)O Amb27838199 [0,0,0,0,0,0|2,0,1]=3 373 B6R0.3 N[C@@H](CBr)C(=O)O Amb27188433 [0,0,0,0,0,0|2,0,2]=4 374 B6R0.3 N[C@@H](CCl)C(=O)O Amb22232860 [0,0,0,0,0,0|2,0,2]=4 375 B6R0.3 N[C@@H](CCl)C(=O)O Amb8515277 [0,0,0,0,0,0|2,0,2]=4 376 B6R0.3 N[C@@H](CO)C(=O)O Amb22351170 [0,0,0,0,0,0|2,0,2]=4 377 B6R0.3 N[C@@H](CO)C(=O)O Amb8387621 [0,0,0,0,0,0|2,0,2]=4 378 B6R0.3 N[C@@H](CS)C(=O)O Amb3940755 [0,0,0,0,0,0|2,0,2]=4 379 B6R0.3 N[C@@H](CS)C(=O)O Amb8385453 [0,0,0,0,0,0|2,0,2]=4 380 B6R0.3 N[C@@H](CS)C(=O)O Amb9826090 [0,0,0,0,0,0|2,0,2]=4 381 B6R0.3 N[C@@H](C[SeH])C(=O)O Amb31031035 [0,0,0,0,0,0|2,0,2]=4 382 B6R0.3 N[C@H](CCl)C(=O)O Amb2699111 [0,0,0,0,0,0|2,0,2]=4 383 B6R0.3 N[C@H](CCl)C(=O)O Amb9813688 [0,0,0,0,0,0|2,0,2]=4 384 B6R0.3 N[C@H](CO)C(=O)O Amb2690463 [0,0,0,0,0,0|2,0,2]=4 385 B6R0.3 N[C@H](CS)C(=O)O Amb17942912 [0,0,0,0,0,0|2,0,2]=4 386 B6R0.3 N[C@H](CS)C(=O)O Amb8394603 [0,0,0,0,0,0|2,0,2]=4 387 B6R0.3 N[C@H](CS)C(=O)O Amb8628479 [0,0,0,0,0,0|2,0,2]=4 388 B6R0.3 N\C(=N/O)C(=O)O Amb24670890 [0,0,0,0,0,0|3,0,0]=3 389 B6R0.3 N\C(O)=C(\N)N=O Amb27844571 [0,0,0,0,0,0|4,0,0]=4 390 B6R0.3 O=C(Cl)\C(Cl)=C/Cl Amb28382553 [0,0,0,0,0,0|3,0,0]=3 391 B6R0.3 O=C(Cl)\C(Cl)=C\Cl Amb32409794 [0,0,0,0,0,0|3,0,0]=3 392 B6R0.3 O=C(O)C(=O)CBr Amb10068671 [0,0,0,0,0,0|2,0,1]=3 393 B6R0.3 O=C(O)C(=O)CBr Amb8389349 [0,0,0,0,0,0|2,0,1]=3 394 B6R0.3 O=C(O)C(=O)CCl Amb16233358 [0,0,0,0,0,0|2,0,1]=3 395 B6R0.3 O=C(O)C(=O)CI Amb27659477 [0,0,0,0,0,0|2,0,1]=3 396 B6R0.3 O=C(O)C(=O)CO Amb6600025 [0,0,0,0,0,0|2,0,1]=3 397 B6R0.3 O=C(O)C(=O)CS Amb6600041 [0,0,0,0,0,0|2,0,1]=3 398 B6R0.3 O=C(O)C(=O)NI Amb27643666 [0,0,0,0,0,0|3,0,0]=3 399 B6R0.3 O=C(O)C(=S)NS Amb27469030 [0,0,0,0,0,0|3,0,0]=3 400 B6R0.3 O=C(O)C(Br)CBr Amb8513574 [0,0,0,0,0,0|2,0,2]=4 401 B6R0.3 O=C(O)C(Br)CF Amb10605519 [0,0,0,0,0,0|2,0,2]=4 402 B6R0.3 O=C(O)C(Br)CO Amb18126327 [0,0,0,0,0,0|2,0,2]=4 403 B6R0.3 O=C(O)C(Cl)CCl Amb22228245 [0,0,0,0,0,0|2,0,2]=4 404 B6R0.3 O=C(O)C(Cl)CO Amb18124304 [0,0,0,0,0,0|2,0,2]=4 405 B6R0.3 O=C(O)C(Cl)CS Amb18643661 [0,0,0,0,0,0|2,0,2]=4 406 B6R0.3 O=C(O)C(F)CO Amb17593117 [0,0,0,0,0,0|2,0,2]=4 407 B6R0.3 O=C(O)C(O)CBr Amb24061932 [0,0,0,0,0,0|2,0,2]=4 408 B6R0.3 O=C(O)C(O)CCl Amb6371692 [0,0,0,0,0,0|2,0,2]=4 409 B6R0.3 O=C(O)C(O)CF Amb27476477 [0,0,0,0,0,0|2,0,2]=4 410 B6R0.3 O=C(O)C(O)CO Amb17593103 [0,0,0,0,0,0|2,0,2]=4 411 B6R0.3 O=C(O)C(O)CS Amb18642053 [0,0,0,0,0,0|2,0,2]=4 412 B6R0.3 O=C(O)C(S)CS Amb18643295 [0,0,0,0,0,0|2,0,2]=4 413 B6R0.3 O=C(O)[C@@H](Br)CO Amb10601700 [0,0,0,0,0,0|2,0,2]=4 414 B6R0.3 O=C(O)[C@@H](Cl)CO Amb27968485 [0,0,0,0,0,0|2,0,2]=4 415 B6R0.3 O=C(O)[C@@H](O)CBr Amb27858794 [0,0,0,0,0,0|2,0,2]=4 416 B6R0.3 O=C(O)[C@@H](O)CCl Amb22225325 [0,0,0,0,0,0|2,0,2]=4 417 B6R0.3 O=C(O)[C@@H](O)CF Amb24117272 [0,0,0,0,0,0|2,0,2]=4 418 B6R0.3 O=C(O)[C@@H](O)CO Amb22226732 [0,0,0,0,0,0|2,0,2]=4 419 B6R0.3 O=C(O)[C@H](Cl)CO Amb27759746 [0,0,0,0,0,0|2,0,2]=4 420 B6R0.3 O=C(O)[C@H](O)CBr Amb28137021 [0,0,0,0,0,0|2,0,2]=4 421 B6R0.3 O=C(O)[C@H](O)CF Amb27467272 [0,0,0,0,0,0|2,0,2]=4 422 B6R0.3 O=C(O)[C@H](O)CO Amb4166319 [0,0,0,0,0,0|2,0,2]=4 423 B6R0.3 O=C(O)\C(Br)=N\O Amb26949828 [0,0,0,0,0,0|3,0,0]=3 424 B6R0.3 O=C(O)\C(Cl)=C/Cl Amb17593560 [0,0,0,0,0,0|2,0,0]=2 425 B6R0.3 O=C(O)\C(Cl)=C/O Amb24479774 [0,0,0,0,0,0|2,0,0]=2 426 B6R0.3 O=C(O)\C(Cl)=C\Cl Amb32409784 [0,0,0,0,0,0|2,0,0]=2 427 B6R0.3 O=C(O)\C(Cl)=N\O Amb25839923 [0,0,0,0,0,0|3,0,0]=3 428 B6R0.3 O=C(O)\C(O)=C/O Amb27220871 [0,0,0,0,0,0|2,0,0]=2 429 B6R0.3 O=C([O-])C(=O)CF Amb10839900 [0,0,0,0,0,0|2,0,2]=4 430 B6R0.3 O=C([O-])C(=O)CS Amb22547761 [0,0,0,0,0,0|2,0,2]=4 431 B6R0.3 O=C([O-])C(=O)CS Amb9825929 [0,0,0,0,0,0|2,0,2]=4 432 B6R0.3 O=C([O-])\C(Cl)=C\Cl Amb28396444 [0,0,0,0,0,0|2,0,1]=3 433 B6R0.3 O=CC(Br)C(=O)O Amb27793774 [0,0,0,0,0,0|2,0,1]=3 434 B6R0.3 O=CC(Cl)=C(Cl)Cl Amb4007510 [0,0,0,0,0,0|4,0,0]=4 435 B6R0.3 O=CC(F)C(=O)O Amb22055301 [0,0,0,0,0,0|2,0,1]=3 436 B6R0.3 O=C[C@@H](O)C(=O)O Amb27629391 [0,0,0,0,0,0|2,0,1]=3 437 B6R0.3 [C-]#[N+]C(C)C(=O)O Amb27974746 [0,0,0,0,0,0|1,0,2]=3 438 B5R0.1 BC(=O)NCC Amb27430059 [1,0,0,0,0,0|2,0,1]=4 439 B5R0.1 C#CCC(=O)O Amb33532662 [1,0,0,0,0,0|0,0,3]=4 440 B5R0.1 C=C=CC(N)=O Amb28049015 [1,0,0,0,0,0|1,0,2]=4 441 B5R0.1 C=CC=C(C)C Amb22229813 [1,0,0,0,0,0|2,0,1]=4 442 B5R0.1 C=CCC(=O)Cl Amb33543701 [1,0,0,0,0,0|1,0,2]=4 443 B5R0.1 C=CCC(=O)O Amb3940098 [1,0,0,0,0,0|0,0,2]=3 444 B5R0.1 C=CCC(C)=O Amb8396482 [1,0,0,0,0,0|1,0,2]=4 445 B5R0.1 C=CCC(N)=O Amb17610156 [1,0,0,0,0,0|1,0,2]=4 446 B5R0.1 C=CCS(=O)O Amb33534190 [1,0,0,0,0,0|1,0,2]=4 447 B5R0.1 C=CC[PH](=O)O Amb8391287 [1,0,0,0,0,0|1,0,2]=4 448 B5R0.1 C=CNC(C)=O Amb24323579 [1,0,0,0,0,0|2,0,1]=4 449 B5R0.1 C=CNC(N)=O Amb25082241 [1,0,0,0,0,0|2,0,1]=4 450 B5R0.1 C=COC(=O)Cl Amb8514993 [1,0,0,0,0,0|2,0,1]=4 451 B5R0.1 C=COC(C)=O Amb8513382 [1,0,0,0,0,0|2,0,1]=4 452 B5R0.1 CC#CC(=O)Cl Amb27778056 [1,0,0,0,0,0|1,0,2]=4 453 B5R0.1 CC#CC(=O)O Amb2685714 [1,0,0,0,0,0|0,0,2]=3 454 B5R0.1 CC#CC(C)=O Amb17593016 [1,0,0,0,0,0|1,0,2]=4 455 B5R0.1 CC#CC(N)=O Amb10552409 [1,0,0,0,0,0|1,0,2]=4 456 B5R0.1 CC(=O)C=C=O Amb10603952 [1,0,0,0,0,0|2,0,1]=4 457 B5R0.1 CC(=O)C=[N+]=[N-] Amb27808588 [1,0,0,0,0,0|3,0,0]=4 458 B5R0.1 CC(=O)CC=N Amb28285098 [1,0,0,0,0,0|2,0,1]=4 459 B5R0.1 CC(=O)NC=O Amb27850191 [1,0,0,0,0,0|3,0,0]=4 460 B5R0.1 CC(=O)OC=O Amb25283525 [1,0,0,0,0,0|3,0,0]=4 461 B5R0.1 CC(=O)\C=C/N Amb25147403 [1,0,0,0,0,0|2,0,0]=3 462 B5R0.1 CC(=O)\C=C/[O-] Amb30876865 [1,0,0,0,0,0|2,0,0]=3 463 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [1,0,0,0,0,0|2,0,0]=3 464 B5R0.1 CC(=O)\C=C\N Amb8395283 [1,0,0,0,0,0|2,0,0]=3 465 B5R0.1 CC(=O)\C=C\[O-] Amb32644521 [1,0,0,0,0,0|2,0,0]=3 466 B5R0.1 CC(=O)\C=N/O Amb26474151 [1,0,0,0,0,0|3,0,0]=4 467 B5R0.1 CC(=O)\C=N\O Amb33719017 [1,0,0,0,0,0|3,0,0]=4 468 B5R0.1 CC(=O)\C=N\O Amb8395285 [1,0,0,0,0,0|3,0,0]=4 469 B5R0.1 CC(C)=CC=O Amb8385061 [1,0,0,0,0,0|3,0,0]=4 470 B5R0.1 CCC=C(Br)Br Amb25887651 [1,0,0,0,0,0|2,0,1]=4 471 B5R0.1 CCC=C(C)C Amb22336412 [1,0,0,0,0,0|2,0,1]=4 472 B5R0.1 CCC=C(F)F Amb10839842 [1,0,0,0,0,0|2,0,1]=4 473 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,0,0,0,0|1,0,2]=4 474 B5R0.1 CCCC(=O)Cl Amb2792903 [1,0,0,0,0,0|1,0,2]=4 475 B5R0.1 CCCC(=O)O Amb3939012 [1,0,0,0,0,0|0,0,2]=3 476 B5R0.1 CCCC(=O)[O-] Amb8514901 [1,0,0,0,0,0|0,0,3]=4 477 B5R0.1 CCCC(C)=O Amb6608910 [1,0,0,0,0,0|1,0,2]=4 478 B5R0.1 CCCC(N)=O Amb3886524 [1,0,0,0,0,0|1,0,2]=4 479 B5R0.1 CCCC(O)=S Amb22229383 [1,0,0,0,0,0|0,1,2]=4 480 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,0,0,0,0|2,0,1]=4 481 B5R0.1 CCNC(C)=O Amb2780415 [1,0,0,0,0,0|2,0,1]=4 482 B5R0.1 CCNC(N)=O Amb6608844 [1,0,0,0,0,0|2,0,1]=4 483 B5R0.1 CCOC(=O)Cl Amb2793045 [1,0,0,0,0,0|2,0,1]=4 484 B5R0.1 CCOC(=O)O Amb8393208 [1,0,0,0,0,0|1,0,1]=3 485 B5R0.1 CCOC(C)=O Amb3940488 [1,0,0,0,0,0|2,0,1]=4 486 B5R0.1 CCOC(N)=O Amb6608672 [1,0,0,0,0,0|2,0,1]=4 487 B5R0.1 CCO[PH](=O)O Amb22360741 [1,0,0,0,0,0|2,0,1]=4 488 B5R0.1 CCO[Si](=O)O Amb26569259 [1,0,0,0,0,0|1,1,1]=4 489 B5R0.1 CCSC(=O)Cl Amb8516064 [1,0,0,0,0,0|2,0,1]=4 490 B5R0.1 CNC=C(C)C Amb28313754 [1,0,0,0,0,0|3,0,0]=4 491 B5R0.1 CNCC(=O)O Amb6298808 [1,0,0,0,0,0|1,0,1]=3 492 B5R0.1 CNCC(=O)O Amb6599996 [1,0,0,0,0,0|1,0,1]=3 493 B5R0.1 CNCC(=O)[O-] Amb20246714 [1,0,0,0,0,0|1,0,2]=4 494 B5R0.1 CNCC(C)=O Amb17621974 [1,0,0,0,0,0|2,0,1]=4 495 B5R0.1 CNCC(C)=O Amb21959975 [1,0,0,0,0,0|2,0,1]=4 496 B5R0.1 CNCC(N)=O Amb19134307 [1,0,0,0,0,0|2,0,1]=4 497 B5R0.1 CNCC(N)=O Amb3940074 [1,0,0,0,0,0|2,0,1]=4 498 B5R0.1 CNCC(N)=O Amb9151172 [1,0,0,0,0,0|2,0,1]=4 499 B5R0.1 CNOC(N)=O Amb28341734 [1,0,0,0,0,0|3,0,0]=4 500 B5R0.1 COC=C(C)C Amb25063853 [1,0,0,0,0,0|3,0,0]=4 501 B5R0.1 COCC(=O)Cl Amb3939326 [1,0,0,0,0,0|2,0,1]=4 502 B5R0.1 COCC(=O)O Amb3939876 [1,0,0,0,0,0|1,0,1]=3 503 B5R0.1 COCC(C)=O Amb8513767 [1,0,0,0,0,0|2,0,1]=4 504 B5R0.1 COCC(N)=O Amb1153776 [1,0,0,0,0,0|2,0,1]=4 505 B5R0.1 CONC(C)=O Amb25046114 [1,0,0,0,0,0|3,0,0]=4 506 B5R0.1 CONC(N)=O Amb2417193 [1,0,0,0,0,0|3,0,0]=4 507 B5R0.1 CSCC(=O)Cl Amb24528357 [1,0,0,0,0,0|2,0,1]=4 508 B5R0.1 CSCC(=O)O Amb1152425 [1,0,0,0,0,0|1,0,1]=3 509 B5R0.1 CSCC(C)=O Amb20621731 [1,0,0,0,0,0|2,0,1]=4 510 B5R0.1 CSCC(N)=O Amb19515874 [1,0,0,0,0,0|2,0,1]=4 511 B5R0.1 CSNC(C)=O Amb22500292 [1,0,0,0,0,0|3,0,0]=4 512 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [1,0,0,0,0,0|2,0,1]=4 513 B5R0.1 C\C(Br)=C/C=O Amb27202112 [1,0,0,0,0,0|3,0,0]=4 514 B5R0.1 C\C(Br)=C\C=O Amb27201671 [1,0,0,0,0,0|3,0,0]=4 515 B5R0.1 C\C(N)=C/C=O Amb2612039 [1,0,0,0,0,0|3,0,0]=4 516 B5R0.1 C\C(O)=C\CN Amb33294274 [1,0,0,0,0,0|2,0,1]=4 517 B5R0.1 C\C=C/B(O)O Amb24547752 [1,0,0,0,0,0|1,0,1]=3 518 B5R0.1 C\C=C/C(=O)O Amb27779315 [1,0,0,0,0,0|0,0,0]=1 519 B5R0.1 C\C=C/C(C)=O Amb28351405 [1,0,0,0,0,0|1,0,0]=2 520 B5R0.1 C\C=C/C(C)C Amb20618870 [1,0,0,0,0,0|2,0,1]=4 521 B5R0.1 C\C=C\B(O)O Amb33964180 [1,0,0,0,0,0|1,0,1]=3 522 B5R0.1 C\C=C\C(=O)Br Amb25026006 [1,0,0,0,0,0|1,0,0]=2 523 B5R0.1 C\C=C\C(=O)Cl Amb8517577 [1,0,0,0,0,0|1,0,0]=2 524 B5R0.1 C\C=C\C(=O)O Amb8385856 [1,0,0,0,0,0|0,0,0]=1 525 B5R0.1 C\C=C\C(C)=O Amb33941980 [1,0,0,0,0,0|1,0,0]=2 526 B5R0.1 C\C=C\C(C)Br Amb24725263 [1,0,0,0,0,0|2,0,1]=4 527 B5R0.1 C\C=C\C(C)C Amb4019538 [1,0,0,0,0,0|2,0,1]=4 528 B5R0.1 C\C=C\C(C)Cl Amb24377224 [1,0,0,0,0,0|2,0,1]=4 529 B5R0.1 C\C=C\C(C)N Amb19514513 [1,0,0,0,0,0|2,0,1]=4 530 B5R0.1 C\C=C\C(C)N Amb33295164 [1,0,0,0,0,0|2,0,1]=4 531 B5R0.1 C\C=C\C(C)O Amb2721243 [1,0,0,0,0,0|1,0,1]=3 532 B5R0.1 C\C=C\C(N)=O Amb4025906 [1,0,0,0,0,0|1,0,0]=2 533 B5R0.1 C\C=C\C(O)O Amb26001148 [1,0,0,0,0,0|0,0,2]=3 534 B5R0.1 C\C=C\S(=O)[O-] Amb32754562 [1,0,0,0,0,0|1,0,1]=3 535 B5R0.1 C\C=C\[N+](=O)[O-] Amb25943859 [1,0,0,0,0,0|1,0,1]=3 536 B5R0.1 C\C=N\C(N)=S Amb28130286 [1,0,0,0,0,0|2,1,0]=4 537 B5R0.1 C\C=N\S(C)=O Amb35718869 [1,0,0,0,0,0|3,0,0]=4 538 B5R0.1 N#CCC(=O)O Amb2609022 [1,0,0,0,0,0|1,0,2]=4 539 B5R0.1 NC(=O)CC=O Amb25777522 [1,0,0,0,0,0|2,0,1]=4 540 B5R0.1 NC(=O)NC=O Amb8514974 [1,0,0,0,0,0|3,0,0]=4 541 B5R0.1 NC(=O)\C=C\I Amb27791850 [1,0,0,0,0,0|2,0,0]=3 542 B5R0.1 NCCC(=O)O Amb1935127 [1,0,0,0,0,0|1,0,2]=4 543 B5R0.1 NNCC(=O)O Amb32751165 [1,0,0,0,0,0|2,0,1]=4 544 B5R0.1 NNCC(=O)O Amb6740299 [1,0,0,0,0,0|2,0,1]=4 545 B5R0.1 NOCC(=O)O Amb1154237 [1,0,0,0,0,0|2,0,1]=4 546 B5R0.1 NOCC(=O)O Amb4324355 [1,0,0,0,0,0|2,0,1]=4 547 B5R0.1 NOCC(=O)O Amb8513076 [1,0,0,0,0,0|2,0,1]=4 548 B5R0.1 N\C=C\C(=O)O Amb27217920 [1,0,0,0,0,0|1,0,0]=2 549 B5R0.1 N\C=C\C(N)=O Amb27237320 [1,0,0,0,0,0|2,0,0]=3 550 B5R0.1 N\C=C\[N+](=O)[O-] Amb33482902 [1,0,0,0,0,0|2,0,1]=4 551 B5R0.1 O=C(Cl)\C=C/Cl Amb27463694 [1,0,0,0,0,0|2,0,0]=3 552 B5R0.1 O=C(O)C#CBr Amb17593707 [1,0,0,0,0,0|1,0,2]=4 553 B5R0.1 O=C(O)C#CCl Amb17593098 [1,0,0,0,0,0|1,0,2]=4 554 B5R0.1 O=C(O)CCBr Amb2685479 [1,0,0,0,0,0|1,0,2]=4 555 B5R0.1 O=C(O)CCCl Amb5395408 [1,0,0,0,0,0|1,0,2]=4 556 B5R0.1 O=C(O)CCF Amb10603694 [1,0,0,0,0,0|1,0,2]=4 557 B5R0.1 O=C(O)CCI Amb2688882 [1,0,0,0,0,0|1,0,2]=4 558 B5R0.1 O=C(O)CCO Amb2688785 [1,0,0,0,0,0|1,0,2]=4 559 B5R0.1 O=C(O)CCS Amb6608916 [1,0,0,0,0,0|1,0,2]=4 560 B5R0.1 O=C(O)CNO Amb24120360 [1,0,0,0,0,0|2,0,1]=4 561 B5R0.1 O=C(O)\C=C/Br Amb18644453 [1,0,0,0,0,0|1,0,0]=2 562 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [1,0,0,0,0,0|1,0,0]=2 563 B5R0.1 O=C(O)\C=C/I Amb28315824 [1,0,0,0,0,0|1,0,0]=2 564 B5R0.1 O=C(O)\C=C\Br Amb27423608 [1,0,0,0,0,0|1,0,0]=2 565 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [1,0,0,0,0,0|1,0,0]=2 566 B5R0.1 O=C(O)\C=C\I Amb30584673 [1,0,0,0,0,0|1,0,0]=2 567 B5R0.1 O=C(O)\C=C\O Amb26055842 [1,0,0,0,0,0|1,0,0]=2 568 B5R0.1 O=C(O)\C=C\S Amb28401590 [1,0,0,0,0,0|1,0,0]=2 569 B5R0.1 O=C(O)\C=N\O Amb20671938 [1,0,0,0,0,0|2,0,0]=3 570 B5R0.1 O=CC=C(Cl)Cl Amb24691205 [1,0,0,0,0,0|3,0,0]=4 571 B5R0.1 O=CCC(=O)O Amb22169407 [1,0,0,0,0,0|1,0,1]=3 572 B5R0.1 O=CCC(=O)[Na] Amb27949540 [1,0,0,0,0,0|2,0,1]=4 573 B5R0.1 O=S(Cl)\C=C/Cl Amb28436910 [1,0,0,0,0,0|3,0,0]=4 574 B5R0.1 OB(O)\C=C\Cl Amb25241162 [1,0,0,0,0,0|2,0,1]=4 575 B5R0.1 OB(O)\C=C\F Amb27487063 [1,0,0,0,0,0|2,0,1]=4 576 B5R0.3 C=C(C=O)CC Amb17940102 [1,0,0,0,0,0|0,0,2]=3 577 B5R0.3 C=C(C=O)OC Amb27863725 [1,0,0,0,0,0|1,0,1]=3 578 B5R0.3 C=C(CC)CO Amb33549724 [1,0,0,0,0,0|0,0,3]=4 579 B5R0.3 C=C=C(C)C=O Amb28049865 [1,0,0,0,0,0|0,0,2]=3 580 B5R0.3 C=CC(=C)CC Amb28141349 [1,0,0,0,0,0|1,0,2]=4 581 B5R0.3 C=CC(=C)OC Amb28145100 [1,0,0,0,0,0|2,0,1]=4 582 B5R0.3 C=CC(=O)C=C Amb22265893 [1,0,0,0,0,0|2,0,1]=4 583 B5R0.3 C=CC(=O)CC Amb3940490 [1,0,0,0,0,0|2,0,1]=4 584 B5R0.3 C=CC(=O)CO Amb28074769 [1,0,0,0,0,0|1,0,2]=4 585 B5R0.3 C=CC(=O)NC Amb9480402 [1,0,0,0,0,0|3,0,0]=4 586 B5R0.3 C=CC(=O)NO Amb28049735 [1,0,0,0,0,0|2,0,1]=4 587 B5R0.3 C=CC(=O)OC Amb22351400 [1,0,0,0,0,0|3,0,0]=4 588 B5R0.3 C=CC(=O)OC Amb2793072 [1,0,0,0,0,0|3,0,0]=4 589 B5R0.3 C=CC(Br)C=O Amb27477894 [1,0,0,0,0,0|1,0,2]=4 590 B5R0.3 C=CC(C)C=C Amb22337672 [1,0,0,0,0,0|1,0,2]=4 591 B5R0.3 C=CC(C)C=O Amb25737956 [1,0,0,0,0,0|0,0,2]=3 592 B5R0.3 C=CC(C)CC Amb8513436 [1,0,0,0,0,0|1,0,2]=4 593 B5R0.3 C=CC(C)CO Amb22347861 [1,0,0,0,0,0|0,0,3]=4 594 B5R0.3 C=CC(C)NC Amb33212401 [1,0,0,0,0,0|2,0,1]=4 595 B5R0.3 C=CC(C)NC Amb33530542 [1,0,0,0,0,0|2,0,1]=4 596 B5R0.3 C=CC(Cl)C=O Amb27477543 [1,0,0,0,0,0|1,0,2]=4 597 B5R0.3 C=CN(C)CC Amb27242626 [1,0,0,0,0,0|2,0,1]=4 598 B5R0.3 C=CN(C)N=O Amb24333902 [1,0,0,0,0,0|2,0,1]=4 599 B5R0.3 C=C[C@H](C)CO Amb27470174 [1,0,0,0,0,0|0,0,3]=4 600 B5R0.3 C=C\C(Br)=C\Cl Amb27407129 [1,0,0,0,0,0|2,0,1]=4 601 B5R0.3 C=C\C(C)=C/Br Amb27420834 [1,0,0,0,0,0|1,0,1]=3 602 B5R0.3 C=C\C(C)=C\N Amb27488688 [1,0,0,0,0,0|1,0,1]=3 603 B5R0.3 CC(C#N)C=O Amb9669144 [1,0,0,0,0,0|1,0,2]=4 604 B5R0.3 CC(C=O)C=O Amb17593026 [1,0,0,0,0,0|1,0,1]=3 605 B5R0.3 CC(C=O)CF Amb24638421 [1,0,0,0,0,0|1,0,2]=4 606 B5R0.3 CC(C=O)O[SiH3] Amb28284225 [1,0,0,0,0,0|1,1,1]=4 607 B5R0.3 CCC(=N)NO Amb19515903 [1,0,0,0,0,0|2,0,1]=4 608 B5R0.3 CCC(=O)C=O Amb22228532 [1,0,0,0,0,0|1,0,1]=3 609 B5R0.3 CCC(=O)CO Amb22227965 [1,0,0,0,0,0|1,0,2]=4 610 B5R0.3 CCC(=O)CO Amb33529428 [1,0,0,0,0,0|1,0,2]=4 611 B5R0.3 CCC(=O)NO Amb6273963 [1,0,0,0,0,0|2,0,1]=4 612 B5R0.3 CCC(Br)C=O Amb18124003 [1,0,0,0,0,0|1,0,2]=4 613 B5R0.3 CCC(C)C=O Amb3939899 [1,0,0,0,0,0|0,0,2]=3 614 B5R0.3 CCC(C)CO Amb3939046 [1,0,0,0,0,0|0,0,3]=4 615 B5R0.3 CCC(Cl)C=O Amb18122610 [1,0,0,0,0,0|1,0,2]=4 616 B5R0.3 CCN(C)C=O Amb20627285 [1,0,0,0,0,0|1,0,1]=3 617 B5R0.3 CCN(C)N=O Amb22055856 [1,0,0,0,0,0|2,0,1]=4 618 B5R0.3 CCN(N)C=O Amb24428031 [1,0,0,0,0,0|2,0,1]=4 619 B5R0.3 CC[C@@H](C)C=O Amb27759282 [1,0,0,0,0,0|0,0,2]=3 620 B5R0.3 CC[C@@H](C)CO Amb22799907 [1,0,0,0,0,0|0,0,3]=4 621 B5R0.3 CC[C@H](C)C=O Amb27837733 [1,0,0,0,0,0|0,0,2]=3 622 B5R0.3 CC[C@H](C)CO Amb10844611 [1,0,0,0,0,0|0,0,3]=4 623 B5R0.3 CC[C@H](N)C=O Amb27460588 [1,0,0,0,0,0|1,0,2]=4 624 B5R0.3 CC\C(C)=C\Cl Amb27848092 [1,0,0,0,0,0|1,0,1]=3 625 B5R0.3 CC\C(C)=N\O Amb8516521 [1,0,0,0,0,0|1,0,1]=3 626 B5R0.3 CC\C(N)=N/O Amb10609125 [1,0,0,0,0,0|2,0,1]=4 627 B5R0.3 CC\C(N)=N\O Amb1125701 [1,0,0,0,0,0|2,0,1]=4 628 B5R0.3 CC\C(N)=N\O Amb19883708 [1,0,0,0,0,0|2,0,1]=4 629 B5R0.3 CN(C=O)C=O Amb24098492 [1,0,0,0,0,0|2,0,0]=3 630 B5R0.3 CN(C=O)CO Amb27253133 [1,0,0,0,0,0|2,0,1]=4 631 B5R0.3 CNC(=N)CO Amb23514994 [1,0,0,0,0,0|2,0,1]=4 632 B5R0.3 CNC(=O)CO Amb3375431 [1,0,0,0,0,0|2,0,1]=4 633 B5R0.3 CNC(=O)NO Amb25185417 [1,0,0,0,0,0|3,0,0]=4 634 B5R0.3 CNC(C)CO Amb32666213 [1,0,0,0,0,0|1,0,2]=4 635 B5R0.3 CNC(C)CO Amb9359998 [1,0,0,0,0,0|1,0,2]=4 636 B5R0.3 CN[C@@H](C)CO Amb26642150 [1,0,0,0,0,0|1,0,2]=4 637 B5R0.3 CN[C@@H](C)CO Amb32652325 [1,0,0,0,0,0|1,0,2]=4 638 B5R0.3 CN[C@H](C)CO Amb26440136 [1,0,0,0,0,0|1,0,2]=4 639 B5R0.3 CN[C@H](C)CO Amb32652448 [1,0,0,0,0,0|1,0,2]=4 640 B5R0.3 CN\C(C)=N/N Amb24738841 [1,0,0,0,0,0|3,0,0]=4 641 B5R0.3 COC(=O)C=O Amb29083438 [1,0,0,0,0,0|2,0,0]=3 642 B5R0.3 COC(=O)C=O Amb8384463 [1,0,0,0,0,0|2,0,0]=3 643 B5R0.3 COC(=O)CO Amb2778433 [1,0,0,0,0,0|2,0,1]=4 644 B5R0.3 COC(C)C=O Amb27875195 [1,0,0,0,0,0|1,0,1]=3 645 B5R0.3 COC(C)CO Amb19517078 [1,0,0,0,0,0|1,0,2]=4 646 B5R0.3 CON(C)C=O Amb22234045 [1,0,0,0,0,0|2,0,0]=3 647 B5R0.3 CON(C)CO Amb25745642 [1,0,0,0,0,0|2,0,1]=4 648 B5R0.3 CON(C)N=O Amb27168660 [1,0,0,0,0,0|3,0,0]=4 649 B5R0.3 CO[C@@H](C)C=O Amb28121215 [1,0,0,0,0,0|1,0,1]=3 650 B5R0.3 CO[C@@H](C)CO Amb8515772 [1,0,0,0,0,0|1,0,2]=4 651 B5R0.3 CO[C@H](C)C=O Amb28284155 [1,0,0,0,0,0|1,0,1]=3 652 B5R0.3 CO[C@H](C)CO Amb10603218 [1,0,0,0,0,0|1,0,2]=4 653 B5R0.3 CO\C(C)=C\I Amb27863468 [1,0,0,0,0,0|2,0,0]=3 654 B5R0.3 CO\C(Cl)=C\Cl Amb28121014 [1,0,0,0,0,0|3,0,0]=4 655 B5R0.3 CO\C(F)=C\Br Amb27837588 [1,0,0,0,0,0|3,0,0]=4 656 B5R0.3 CSC(=O)C=O Amb28284177 [1,0,0,0,0,0|2,0,0]=3 657 B5R0.3 CSC(C)C=O Amb27454927 [1,0,0,0,0,0|1,0,1]=3 658 B5R0.3 CSC(C)CO Amb24438636 [1,0,0,0,0,0|1,0,2]=4 659 B5R0.3 CSC(Cl)C=O Amb27233402 [1,0,0,0,0,0|2,0,1]=4 660 B5R0.3 CS\C(C)=C\Cl Amb27776645 [1,0,0,0,0,0|2,0,0]=3 661 B5R0.3 CS\C(N)=N\O Amb26628739 [1,0,0,0,0,0|3,0,0]=4 662 B5R0.3 C[C@@H](C=O)CBr Amb28200669 [1,0,0,0,0,0|1,0,2]=4 663 B5R0.3 C[C@@H](C=O)CO Amb27455063 [1,0,0,0,0,0|1,0,2]=4 664 B5R0.3 C\C(=C/Br)CBr Amb17612559 [1,0,0,0,0,0|2,0,1]=4 665 B5R0.3 C\C(=C/Br)CO Amb4014500 [1,0,0,0,0,0|1,0,1]=3 666 B5R0.3 C\C(=C/Cl)CS Amb24391502 [1,0,0,0,0,0|1,1,1]=4 667 B5R0.3 C\C(C#N)=C/Br Amb27837583 [1,0,0,0,0,0|2,0,1]=4 668 B5R0.3 C\C(C#N)=C/Cl Amb18120026 [1,0,0,0,0,0|2,0,1]=4 669 B5R0.3 C\C(C=O)=C/N Amb26887758 [1,0,0,0,0,0|1,0,0]=2 670 B5R0.3 C\C(C=O)=C\I Amb28240324 [1,0,0,0,0,0|1,0,0]=2 671 B5R0.3 C\C(C=O)=C\O Amb27947285 [1,0,0,0,0,0|1,0,0]=2 672 B5R0.3 C\C(CBr)=N/O Amb28366990 [1,0,0,0,0,0|2,0,1]=4 673 B5R0.3 C\C(CS)=N/O Amb22343051 [1,0,0,0,0,0|2,0,1]=4 674 B5R0.3 C\C=C(/Br)C=O Amb24478125 [1,0,0,0,0,0|1,0,0]=2 675 B5R0.3 C\C=C(/C)C#N Amb20622623 [1,0,0,0,0,0|1,0,1]=3 676 B5R0.3 C\C=C(/C)C=O Amb30526844 [1,0,0,0,0,0|0,0,0]=1 677 B5R0.3 C\C=C(/C)CBr Amb27954750 [1,0,0,0,0,0|1,0,1]=3 678 B5R0.3 C\C=C(/C)CC Amb26540266 [1,0,0,0,0,0|1,0,1]=3 679 B5R0.3 C\C=C(/C)CCl Amb33483104 [1,0,0,0,0,0|1,0,1]=3 680 B5R0.3 C\C=C(/C)CI Amb27750414 [1,0,0,0,0,0|1,0,1]=3 681 B5R0.3 C\C=C(/C)CO Amb26998405 [1,0,0,0,0,0|0,0,1]=2 682 B5R0.3 C\C=C(/Cl)C=O Amb18122386 [1,0,0,0,0,0|1,0,0]=2 683 B5R0.3 C\C=C(/F)CBr Amb22546798 [1,0,0,0,0,0|2,0,1]=4 684 B5R0.3 C\C=C(/F)CO Amb22546797 [1,0,0,0,0,0|1,0,1]=3 685 B5R0.3 C\C=C(/I)C=O Amb28049947 [1,0,0,0,0,0|1,0,0]=2 686 B5R0.3 C\C=C(/I)CN Amb27392321 [1,0,0,0,0,0|2,0,1]=4 687 B5R0.3 C\C=C(/N)C#N Amb27655651 [1,0,0,0,0,0|2,0,1]=4 688 B5R0.3 C\C=C(\Br)C=O Amb18124612 [1,0,0,0,0,0|1,0,0]=2 689 B5R0.3 C\C=C(\Br)CBr Amb28053383 [1,0,0,0,0,0|2,0,1]=4 690 B5R0.3 C\C=C(\Br)CN Amb27650590 [1,0,0,0,0,0|2,0,1]=4 691 B5R0.3 C\C=C(\Br)CO Amb25809972 [1,0,0,0,0,0|1,0,1]=3 692 B5R0.3 C\C=C(\C)C=O Amb24333046 [1,0,0,0,0,0|0,0,0]=1 693 B5R0.3 C\C=C(\C)CC Amb25332651 [1,0,0,0,0,0|1,0,1]=3 694 B5R0.3 C\C=C(\C)CCl Amb27655615 [1,0,0,0,0,0|1,0,1]=3 695 B5R0.3 C\C=C(\C)CO Amb26581579 [1,0,0,0,0,0|0,0,1]=2 696 B5R0.3 C\C=C(\Cl)CCl Amb25727694 [1,0,0,0,0,0|2,0,1]=4 697 B5R0.3 C\C=C(\F)CO Amb28384940 [1,0,0,0,0,0|1,0,1]=3 698 B5R0.3 C\C=C(\I)CBr Amb27263914 [1,0,0,0,0,0|2,0,1]=4 699 B5R0.3 C\N=C(/C)NC Amb28049638 [1,0,0,0,0,0|3,0,0]=4 700 B5R0.3 C\N=C(\C)NC Amb10552433 [1,0,0,0,0,0|3,0,0]=4 701 B5R0.3 N=CC(Br)C=O Amb28141456 [1,0,0,0,0,0|2,0,1]=4 702 B5R0.3 NC(C=O)C=O Amb22751007 [1,0,0,0,0,0|2,0,1]=4 703 B5R0.3 N\C(C=O)=C/O Amb28315747 [1,0,0,0,0,0|2,0,0]=3 704 B5R0.3 N\C=C(/Cl)C=O Amb26926530 [1,0,0,0,0,0|2,0,0]=3 705 B5R0.3 N\C=C(\Cl)C=O Amb26390929 [1,0,0,0,0,0|2,0,0]=3 706 B5R0.3 O=CC(=O)C=O Amb17593025 [1,0,0,0,0,0|2,0,0]=3 707 B5R0.3 O=CC(=O)CO Amb17593031 [1,0,0,0,0,0|2,0,1]=4 708 B5R0.3 O=CC(Br)C=O Amb2455922 [1,0,0,0,0,0|2,0,1]=4 709 B5R0.3 O=CC(Cl)C=O Amb8515721 [1,0,0,0,0,0|2,0,1]=4 710 B5R0.3 O=CC(F)C=O Amb22230729 [1,0,0,0,0,0|2,0,1]=4 711 B5R0.3 O=CC(I)C=O Amb24548139 [1,0,0,0,0,0|2,0,1]=4 712 B5R0.3 O=CC(O)C=O Amb17615780 [1,0,0,0,0,0|2,0,1]=4 713 B5R0.3 O=CN([Na])C=O Amb19884111 [1,0,0,0,0,0|3,0,0]=4 714 B5R0.3 O=C\C(Br)=C/O Amb24333812 [1,0,0,0,0,0|2,0,0]=3 715 B5R0.3 O=C\C(Br)=C\Cl Amb27226965 [1,0,0,0,0,0|2,0,0]=3 716 B5R0.3 O=C\C(Br)=C\O Amb24478132 [1,0,0,0,0,0|2,0,0]=3 717 B5R0.3 O=C\C(Cl)=C\Cl Amb18124305 [1,0,0,0,0,0|2,0,0]=3 718 B5R0.3 O=C\C(Cl)=N\O Amb27622504 [1,0,0,0,0,0|3,0,0]=4 719 B5R0.3 O=C\C(F)=C/O Amb27251562 [1,0,0,0,0,0|2,0,0]=3 720 B5R0.3 O=C\C(O)=C\O Amb27863726 [1,0,0,0,0,0|2,0,0]=3 721 B5R0.3 OC\C(Br)=C\Br Amb22348400 [1,0,0,0,0,0|2,0,1]=4 722 B5R0.3 OC\C(F)=C\F Amb27662411 [1,0,0,0,0,0|2,0,1]=4 723 B5R0.5 C=C(Br)C(=O)O Amb20620403 [1,0,0,0,0,0|1,0,0]=2 724 B5R0.5 C=C(Br)C(C)=O Amb17593709 [1,0,0,0,0,0|2,0,0]=3 725 B5R0.5 C=C(Br)C(C)C Amb22583736 [1,0,0,0,0,0|2,0,1]=4 726 B5R0.5 C=C(C)B(O)O Amb21857146 [1,0,0,0,0,0|1,0,1]=3 727 B5R0.5 C=C(C)C(=C)C Amb8517589 [1,0,0,0,0,0|2,0,0]=3 728 B5R0.5 C=C(C)C(=N)N Amb24683875 [1,0,0,0,0,0|2,0,0]=3 729 B5R0.5 C=C(C)C(=O)Cl Amb534203 [1,0,0,0,0,0|1,0,0]=2 730 B5R0.5 C=C(C)C(=O)O Amb6608998 [1,0,0,0,0,0|0,0,0]=1 731 B5R0.5 C=C(C)C(C)=O Amb17593021 [1,0,0,0,0,0|1,0,0]=2 732 B5R0.5 C=C(C)C(C)C Amb8513830 [1,0,0,0,0,0|2,0,1]=4 733 B5R0.5 C=C(C)C(C)Cl Amb24407204 [1,0,0,0,0,0|2,0,1]=4 734 B5R0.5 C=C(C)C(C)O Amb28282626 [1,0,0,0,0,0|1,0,1]=3 735 B5R0.5 C=C(C)C(N)=O Amb6609019 [1,0,0,0,0,0|1,0,0]=2 736 B5R0.5 C=C(C)C(N)=S Amb33200269 [1,0,0,0,0,0|1,1,0]=3 737 B5R0.5 C=C(C)[C@@H](C)N Amb33199904 [1,0,0,0,0,0|2,0,1]=4 738 B5R0.5 C=C(C)[C@@H](C)O Amb25834912 [1,0,0,0,0,0|1,0,1]=3 739 B5R0.5 C=C(C)[C@H](C)N Amb33199903 [1,0,0,0,0,0|2,0,1]=4 740 B5R0.5 C=C(C)[C@H](C)O Amb25294556 [1,0,0,0,0,0|1,0,1]=3 741 B5R0.5 C=C(Cl)C(=C)Cl Amb26390738 [1,0,0,0,0,0|3,0,0]=4 742 B5R0.5 C=C(Cl)C(=N)N Amb27469920 [1,0,0,0,0,0|3,0,0]=4 743 B5R0.5 C=C(Cl)C(=O)Cl Amb24478440 [1,0,0,0,0,0|2,0,0]=3 744 B5R0.5 C=C(Cl)C(=O)O Amb17933971 [1,0,0,0,0,0|1,0,0]=2 745 B5R0.5 C=C(Cl)C(C)=O Amb28284771 [1,0,0,0,0,0|2,0,0]=3 746 B5R0.5 C=C(Cl)C(N)=O Amb28143568 [1,0,0,0,0,0|2,0,0]=3 747 B5R0.5 C=C(F)C(=O)Cl Amb10838637 [1,0,0,0,0,0|2,0,0]=3 748 B5R0.5 C=C(F)C(=O)O Amb2688008 [1,0,0,0,0,0|1,0,0]=2 749 B5R0.5 C=C(F)C(=O)[O-] Amb22263484 [1,0,0,0,0,0|1,0,1]=3 750 B5R0.5 C=C(F)C(=O)[O-] Amb33620428 [1,0,0,0,0,0|1,0,1]=3 751 B5R0.5 C=C(F)C(C)=O Amb17593032 [1,0,0,0,0,0|2,0,0]=3 752 B5R0.5 C=C(F)C(N)=O Amb25312034 [1,0,0,0,0,0|2,0,0]=3 753 B5R0.5 CC(=N)N(C)C Amb20634458 [1,0,0,0,0,0|3,0,0]=4 754 B5R0.5 CC(=O)C(=N)N Amb24409561 [1,0,0,0,0,0|3,0,0]=4 755 B5R0.5 CC(=O)C(=O)Cl Amb17593107 [1,0,0,0,0,0|2,0,0]=3 756 B5R0.5 CC(=O)C(=O)O Amb932807 [1,0,0,0,0,0|1,0,0]=2 757 B5R0.5 CC(=O)C(=O)[O-] Amb22043412 [1,0,0,0,0,0|1,0,1]=3 758 B5R0.5 CC(=O)C(C)=O Amb6608675 [1,0,0,0,0,0|2,0,0]=3 759 B5R0.5 CC(=O)C(C)=S Amb27632834 [1,0,0,0,0,0|2,0,0]=3 760 B5R0.5 CC(=O)C(C)Br Amb8384405 [1,0,0,0,0,0|2,0,1]=4 761 B5R0.5 CC(=O)C(C)C Amb4605987 [1,0,0,0,0,0|1,0,1]=3 762 B5R0.5 CC(=O)C(C)Cl Amb9702838 [1,0,0,0,0,0|2,0,1]=4 763 B5R0.5 CC(=O)C(C)F Amb10841897 [1,0,0,0,0,0|2,0,1]=4 764 B5R0.5 CC(=O)C(C)I Amb28315734 [1,0,0,0,0,0|2,0,1]=4 765 B5R0.5 CC(=O)C(C)N Amb17593029 [1,0,0,0,0,0|2,0,1]=4 766 B5R0.5 CC(=O)C(C)N Amb19148817 [1,0,0,0,0,0|2,0,1]=4 767 B5R0.5 CC(=O)C(C)O Amb6608962 [1,0,0,0,0,0|2,0,1]=4 768 B5R0.5 CC(=O)C(C)S Amb8393169 [1,0,0,0,0,0|2,0,1]=4 769 B5R0.5 CC(=O)C(N)=O Amb17593028 [1,0,0,0,0,0|2,0,0]=3 770 B5R0.5 CC(=O)C(N)=S Amb33528965 [1,0,0,0,0,0|2,1,0]=4 771 B5R0.5 CC(=O)C(O)O Amb22436762 [1,0,0,0,0,0|1,0,2]=4 772 B5R0.5 CC(=O)N(C)C Amb24323347 [1,0,0,0,0,0|2,0,0]=3 773 B5R0.5 CC(=O)N(C)C Amb2793066 [1,0,0,0,0,0|2,0,0]=3 774 B5R0.5 CC(=O)N(C)N Amb17593037 [1,0,0,0,0,0|3,0,0]=4 775 B5R0.5 CC(=O)N(C)O Amb24066817 [1,0,0,0,0,0|3,0,0]=4 776 B5R0.5 CC(=O)[C@@H](C)N Amb22748924 [1,0,0,0,0,0|2,0,1]=4 777 B5R0.5 CC(=O)[C@H](C)N Amb26418661 [1,0,0,0,0,0|2,0,1]=4 778 B5R0.5 CC(=S)C(=O)O Amb27424126 [1,0,0,0,0,0|1,0,0]=2 779 B5R0.5 CC(=S)N(C)C Amb2720887 [1,0,0,0,0,0|2,1,0]=4 780 B5R0.5 CC(Br)C(=O)Br Amb7969424 [1,0,0,0,0,0|2,0,1]=4 781 B5R0.5 CC(Br)C(=O)Cl Amb6296592 [1,0,0,0,0,0|2,0,1]=4 782 B5R0.5 CC(Br)C(=O)O Amb2795764 [1,0,0,0,0,0|1,0,1]=3 783 B5R0.5 CC(Br)C(N)=O Amb2779903 [1,0,0,0,0,0|2,0,1]=4 784 B5R0.5 CC(C)=C(C)Br Amb22228669 [1,0,0,0,0,0|2,0,0]=3 785 B5R0.5 CC(C)=C(C)C Amb8513520 [1,0,0,0,0,0|2,0,0]=3 786 B5R0.5 CC(C)=[N+](C)[O-] Amb25088285 [1,0,0,0,0,0|2,0,1]=4 787 B5R0.5 CC(C)B(O)O Amb2447044 [1,0,0,0,0,0|1,0,2]=4 788 B5R0.5 CC(C)C(=N)N Amb2695035 [1,0,0,0,0,0|2,0,1]=4 789 B5R0.5 CC(C)C(=N)N Amb2725173 [1,0,0,0,0,0|2,0,1]=4 790 B5R0.5 CC(C)C(=O)Br Amb22731066 [1,0,0,0,0,0|1,0,1]=3 791 B5R0.5 CC(C)C(=O)Cl Amb3939052 [1,0,0,0,0,0|1,0,1]=3 792 B5R0.5 CC(C)C(=O)F Amb25848493 [1,0,0,0,0,0|1,0,1]=3 793 B5R0.5 CC(C)C(=O)I Amb26992316 [1,0,0,0,0,0|1,0,1]=3 794 B5R0.5 CC(C)C(=O)O Amb3939822 [1,0,0,0,0,0|0,0,1]=2 795 B5R0.5 CC(C)C(=O)S Amb33482574 [1,0,0,0,0,0|0,1,1]=3 796 B5R0.5 CC(C)C(C)O Amb9748261 [1,0,0,0,0,0|1,0,2]=4 797 B5R0.5 CC(C)C(N)=O Amb1153145 [1,0,0,0,0,0|1,0,1]=3 798 B5R0.5 CC(C)C(N)=S Amb6242688 [1,0,0,0,0,0|1,1,1]=4 799 B5R0.5 CC(C)N(=O)=O Amb8395293 [1,0,0,0,0,0|1,0,2]=4 800 B5R0.5 CC(C)N(=O)O Amb33789630 [1,0,0,0,0,0|1,0,1]=3 801 B5R0.5 CC(C)S(=O)Cl Amb27859539 [1,0,0,0,0,0|2,0,1]=4 802 B5R0.5 CC(C)S(=O)O Amb27245066 [1,0,0,0,0,0|1,0,1]=3 803 B5R0.5 CC(C)S(=O)[O-] Amb19929129 [1,0,0,0,0,0|1,0,2]=4 804 B5R0.5 CC(C)S(N)=O Amb25675545 [1,0,0,0,0,0|2,0,1]=4 805 B5R0.5 CC(C)[C@@H](C)O Amb13952942 [1,0,0,0,0,0|1,0,2]=4 806 B5R0.5 CC(C)[C@H](C)O Amb6366846 [1,0,0,0,0,0|1,0,2]=4 807 B5R0.5 CC(C)[N+](=O)[O-] Amb6608812 [1,0,0,0,0,0|1,0,2]=4 808 B5R0.5 CC(Cl)=C(Cl)Cl Amb22227671 [1,0,0,0,0,0|3,0,0]=4 809 B5R0.5 CC(Cl)C(=O)Cl Amb9703139 [1,0,0,0,0,0|2,0,1]=4 810 B5R0.5 CC(Cl)C(=O)F Amb27863699 [1,0,0,0,0,0|2,0,1]=4 811 B5R0.5 CC(Cl)C(=O)O Amb3940363 [1,0,0,0,0,0|1,0,1]=3 812 B5R0.5 CC(Cl)C(N)=O Amb9745753 [1,0,0,0,0,0|2,0,1]=4 813 B5R0.5 CC(Cl)S(=O)O Amb27983761 [1,0,0,0,0,0|2,0,1]=4 814 B5R0.5 CC(F)C(=O)O Amb10605770 [1,0,0,0,0,0|1,0,1]=3 815 B5R0.5 CC(F)C(N)=O Amb28248497 [1,0,0,0,0,0|2,0,1]=4 816 B5R0.5 CC(I)C(=O)O Amb26450528 [1,0,0,0,0,0|1,0,1]=3 817 B5R0.5 CC(I)C(N)=O Amb25684673 [1,0,0,0,0,0|2,0,1]=4 818 B5R0.5 CC(N)C(=O)O Amb32724352 [1,0,0,0,0,0|1,0,1]=3 819 B5R0.5 CC(N)C(=O)O Amb5716847 [1,0,0,0,0,0|1,0,1]=3 820 B5R0.5 CC(N)C(=O)S Amb27175379 [1,0,0,0,0,0|1,1,1]=4 821 B5R0.5 CC(N)C(N)=O Amb21958673 [1,0,0,0,0,0|2,0,1]=4 822 B5R0.5 CC(N)C(N)=O Amb33532935 [1,0,0,0,0,0|2,0,1]=4 823 B5R0.5 CC(O)C(=O)O Amb9703100 [1,0,0,0,0,0|1,0,1]=3 824 B5R0.5 CC(O)C(=O)[O-] Amb3499440 [1,0,0,0,0,0|1,0,2]=4 825 B5R0.5 CC(O)C(=O)[O-] Amb9787591 [1,0,0,0,0,0|1,0,2]=4 826 B5R0.5 CC(O)C(N)=O Amb6394657 [1,0,0,0,0,0|2,0,1]=4 827 B5R0.5 CC(S)C(=O)O Amb6608753 [1,0,0,0,0,0|1,0,1]=3 828 B5R0.5 CN(C)C(=N)N Amb22227685 [1,0,0,0,0,0|3,0,0]=4 829 B5R0.5 CN(C)C(=N)N Amb2696112 [1,0,0,0,0,0|3,0,0]=4 830 B5R0.5 CN(C)C(=N)N Amb33532288 [1,0,0,0,0,0|3,0,0]=4 831 B5R0.5 CN(C)C(=N)N Amb35826755 [1,0,0,0,0,0|3,0,0]=4 832 B5R0.5 CN(C)C(=N)N Amb9825626 [1,0,0,0,0,0|3,0,0]=4 833 B5R0.5 CN(C)C(=O)Cl Amb2793056 [1,0,0,0,0,0|2,0,0]=3 834 B5R0.5 CN(C)C(=O)O Amb22348477 [1,0,0,0,0,0|1,0,0]=2 835 B5R0.5 CN(C)C(=S)Cl Amb2725563 [1,0,0,0,0,0|2,1,0]=4 836 B5R0.5 CN(C)C(=S)[S-] Amb10552380 [1,0,0,0,0,0|1,2,0]=4 837 B5R0.5 CN(C)C(=S)[S-] Amb33512811 [1,0,0,0,0,0|1,2,0]=4 838 B5R0.5 CN(C)C(=S)[S-] Amb6608872 [1,0,0,0,0,0|1,2,0]=4 839 B5R0.5 CN(C)C(=[NH2+])Cl Amb9792929 [1,0,0,0,0,0|3,0,0]=4 840 B5R0.5 CN(C)C(N)=O Amb2604398 [1,0,0,0,0,0|2,0,0]=3 841 B5R0.5 CN(C)C(N)=S Amb1105826 [1,0,0,0,0,0|2,1,0]=4 842 B5R0.5 CN(C)C(N)=[Se] Amb8515163 [1,0,0,0,0,0|2,1,0]=4 843 B5R0.5 CN(C)S(=O)Cl Amb35789425 [1,0,0,0,0,0|3,0,0]=4 844 B5R0.5 CN(C)S(C)=O Amb28134615 [1,0,0,0,0,0|3,0,0]=4 845 B5R0.5 CN(C)[N+](=O)[O-] Amb28134683 [1,0,0,0,0,0|2,0,1]=4 846 B5R0.5 CN(N)C(N)=O Amb27167382 [1,0,0,0,0,0|3,0,0]=4 847 B5R0.5 C[C@@H](Br)C(=O)Br Amb27455066 [1,0,0,0,0,0|2,0,1]=4 848 B5R0.5 C[C@@H](Br)C(=O)Cl Amb26395930 [1,0,0,0,0,0|2,0,1]=4 849 B5R0.5 C[C@@H](Br)C(=O)O Amb8515030 [1,0,0,0,0,0|1,0,1]=3 850 B5R0.5 C[C@@H](Cl)C(=O)Cl Amb28140701 [1,0,0,0,0,0|2,0,1]=4 851 B5R0.5 C[C@@H](Cl)C(=O)O Amb2725594 [1,0,0,0,0,0|1,0,1]=3 852 B5R0.5 C[C@@H](I)C(=O)O Amb27878762 [1,0,0,0,0,0|1,0,1]=3 853 B5R0.5 C[C@@H](I)C(N)=O Amb27863419 [1,0,0,0,0,0|2,0,1]=4 854 B5R0.5 C[C@@H](N)C(=O)O Amb3940457 [1,0,0,0,0,0|1,0,1]=3 855 B5R0.5 C[C@@H](N)C(N)=O Amb2371905 [1,0,0,0,0,0|2,0,1]=4 856 B5R0.5 C[C@@H](N)C(N)=O Amb2778751 [1,0,0,0,0,0|2,0,1]=4 857 B5R0.5 C[C@@H](O)C(=O)Cl Amb28350419 [1,0,0,0,0,0|2,0,1]=4 858 B5R0.5 C[C@@H](O)C(=O)O Amb6600026 [1,0,0,0,0,0|1,0,1]=3 859 B5R0.5 C[C@@H](O)C(=O)[O-] Amb22350432 [1,0,0,0,0,0|1,0,2]=4 860 B5R0.5 C[C@@H](O)C(=O)[O-] Amb8514494 [1,0,0,0,0,0|1,0,2]=4 861 B5R0.5 C[C@@H](O)C(N)=O Amb3939680 [1,0,0,0,0,0|2,0,1]=4 862 B5R0.5 C[C@H](Br)C(=O)O Amb8515029 [1,0,0,0,0,0|1,0,1]=3 863 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [1,0,0,0,0,0|2,0,1]=4 864 B5R0.5 C[C@H](Cl)C(=O)F Amb28138044 [1,0,0,0,0,0|2,0,1]=4 865 B5R0.5 C[C@H](Cl)C(=O)O Amb17776586 [1,0,0,0,0,0|1,0,1]=3 866 B5R0.5 C[C@H](F)C(=O)O Amb27216697 [1,0,0,0,0,0|1,0,1]=3 867 B5R0.5 C[C@H](N)C(=O)O Amb33780861 [1,0,0,0,0,0|1,0,1]=3 868 B5R0.5 C[C@H](N)C(=O)O Amb6298336 [1,0,0,0,0,0|1,0,1]=3 869 B5R0.5 C[C@H](N)C(=O)S Amb28315892 [1,0,0,0,0,0|1,1,1]=4 870 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [1,0,0,0,0,0|2,0,1]=4 871 B5R0.5 C[C@H](N)C(N)=O Amb2371522 [1,0,0,0,0,0|2,0,1]=4 872 B5R0.5 C[C@H](N)C(N)=O Amb2778752 [1,0,0,0,0,0|2,0,1]=4 873 B5R0.5 C[C@H](N)C(N)=O Amb33822632 [1,0,0,0,0,0|2,0,1]=4 874 B5R0.5 C[C@H](O)C(=O)O Amb8386374 [1,0,0,0,0,0|1,0,1]=3 875 B5R0.5 C[C@H](O)C(=O)[O-] Amb17772234 [1,0,0,0,0,0|1,0,2]=4 876 B5R0.5 C[C@H](O)C(=O)[O-] Amb8515200 [1,0,0,0,0,0|1,0,2]=4 877 B5R0.5 C[C@H](O)C(N)=O Amb3939676 [1,0,0,0,0,0|2,0,1]=4 878 B5R0.5 C[C@H](S)C(=O)O Amb25147510 [1,0,0,0,0,0|1,0,1]=3 879 B5R0.5 C[N+](C)=C(Cl)Cl Amb8513704 [1,0,0,0,0,0|3,0,0]=4 880 B5R0.5 C\C(Br)=C(/C)Br Amb24741236 [1,0,0,0,0,0|3,0,0]=4 881 B5R0.5 C\C(Br)=C(\C)Br Amb27263950 [1,0,0,0,0,0|3,0,0]=4 882 B5R0.5 N=C(N)S(=O)O Amb6600572 [1,0,0,0,0,0|3,0,0]=4 883 B5R0.5 N=C(S)C(=O)O Amb18640468 [1,0,0,0,0,0|2,0,0]=3 884 B5R0.5 NC(=O)C(=O)O Amb32666615 [1,0,0,0,0,0|2,0,0]=3 885 B5R0.5 NC(=O)C(=O)O Amb3940455 [1,0,0,0,0,0|2,0,0]=3 886 B5R0.5 NC(=O)C(=O)[O-] Amb22053860 [1,0,0,0,0,0|2,0,1]=4 887 B5R0.5 NC(=O)C(=O)[O-] Amb22730546 [1,0,0,0,0,0|2,0,1]=4 888 B5R0.5 NC(=O)C(N)=O Amb3886526 [1,0,0,0,0,0|3,0,0]=4 889 B5R0.5 NC(Br)C(=O)O Amb25724348 [1,0,0,0,0,0|2,0,1]=4 890 B5R0.5 NC(O)C(=O)O Amb24663706 [1,0,0,0,0,0|2,0,1]=4 891 B5R0.5 NC(S)C(=O)O Amb27253385 [1,0,0,0,0,0|2,0,1]=4 892 B5R0.5 N[C@@H](S)C(=O)O Amb27788398 [1,0,0,0,0,0|2,0,1]=4 893 B5R0.5 O=C(Br)C(=O)Br Amb8513454 [1,0,0,0,0,0|3,0,0]=4 894 B5R0.5 O=C(Cl)C(=O)Cl Amb2793009 [1,0,0,0,0,0|3,0,0]=4 895 B5R0.5 O=C(F)C(=O)F Amb10840380 [1,0,0,0,0,0|3,0,0]=4 896 B5R0.5 O=C(O)C(=O)Br Amb27863598 [1,0,0,0,0,0|2,0,0]=3 897 B5R0.5 O=C(O)C(=O)O Amb10608980 [1,0,0,0,0,0|2,0,0]=3 898 B5R0.5 O=C(O)C(=O)O Amb19374136 [1,0,0,0,0,0|2,0,0]=3 899 B5R0.5 O=C(O)C(=O)O Amb22231343 [1,0,0,0,0,0|2,0,0]=3 900 B5R0.5 O=C(O)C(=O)O Amb22394874 [1,0,0,0,0,0|2,0,0]=3 901 B5R0.5 O=C(O)C(=O)O Amb22436461 [1,0,0,0,0,0|2,0,0]=3 902 B5R0.5 O=C(O)C(=O)O Amb7755827 [1,0,0,0,0,0|2,0,0]=3 903 B5R0.5 O=C(O)C(=O)O Amb8513282 [1,0,0,0,0,0|2,0,0]=3 904 B5R0.5 O=C(O)C(Br)I Amb17610018 [1,0,0,0,0,0|2,0,1]=4 905 B5R0.5 O=C(O)C(Cl)Cl Amb6891960 [1,0,0,0,0,0|2,0,1]=4 906 B5R0.5 O=C(O)C(Cl)I Amb17610937 [1,0,0,0,0,0|2,0,1]=4 907 B5R0.5 O=C(O)C(F)Br Amb10841090 [1,0,0,0,0,0|2,0,1]=4 908 B5R0.5 O=C(O)C(F)Cl Amb10838714 [1,0,0,0,0,0|2,0,1]=4 909 B5R0.5 O=C(O)C(F)F Amb1953492 [1,0,0,0,0,0|2,0,1]=4 910 B5R0.5 O=C(O)C(F)I Amb10838458 [1,0,0,0,0,0|2,0,1]=4 911 B5R0.5 O=C(O)C(I)I Amb17612865 [1,0,0,0,0,0|2,0,1]=4 912 B5R0.5 O=C(O)C(O)O Amb6608986 [1,0,0,0,0,0|2,0,1]=4 913 B5R0.5 O=C(O)[C@@H](F)Cl Amb26559563 [1,0,0,0,0,0|2,0,1]=4 914 B5R0.5 O=C(O)[C@@H](F)I Amb27827825 [1,0,0,0,0,0|2,0,1]=4 915 B5R0.5 O=C(O)[C@H](F)Br Amb28200717 [1,0,0,0,0,0|2,0,1]=4 916 B5R0.5 O=C([O-])C(=O)[O-] Amb17943075 [1,0,0,0,0,0|2,0,1]=4 917 B5R0.5 O=C([O-])C(=O)[O-] Amb21963194 [1,0,0,0,0,0|2,0,1]=4 918 B5R0.5 O=C([O-])C(=O)[O-] Amb22002099 [1,0,0,0,0,0|2,0,1]=4 919 B5R0.5 O=C([O-])C(=O)[O-] Amb22045394 [1,0,0,0,0,0|2,0,1]=4 920 B5R0.5 O=C([O-])C(=O)[O-] Amb22053543 [1,0,0,0,0,0|2,0,1]=4 921 B5R0.5 O=C([O-])C(=O)[O-] Amb22053547 [1,0,0,0,0,0|2,0,1]=4 922 B5R0.5 O=C([O-])C(=O)[O-] Amb8514326 [1,0,0,0,0,0|2,0,1]=4 923 B5R0.5 O=C([O-])C(=O)[O-] Amb8514363 [1,0,0,0,0,0|2,0,1]=4 924 B5R0.5 O=C([O-])C(=O)[O-] Amb8514364 [1,0,0,0,0,0|2,0,1]=4 925 B5R0.5 O=C([S-])C(=O)[S-] Amb22730472 [1,0,0,0,0,0|2,1,0]=4 926 B7R0.5 C#CCC(=O)C(=O)O Amb27601316 [0,1,0,0,0,0|1,0,2]=4 927 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [0,1,0,0,0,0|0,0,3]=4 928 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [0,1,0,0,0,0|0,0,3]=4 929 B7R0.5 C=C(C)C(=O)\C=C\C Amb24422389 [0,1,0,0,0,0|3,0,0]=4 930 B7R0.5 C=C(C)\C(Br)=C\CO Amb27651853 [0,1,0,0,0,0|3,0,0]=4 931 B7R0.5 C=C(C)\C(C)=C\C=O Amb27852094 [0,1,0,0,0,0|2,0,1]=4 932 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [0,1,0,0,0,0|0,0,2]=3 933 B7R0.5 C=C(CCF)C(=O)O Amb33480692 [0,1,0,0,0,0|0,0,2]=3 934 B7R0.5 C=C(CCN)C(=O)O Amb27267272 [0,1,0,0,0,0|0,0,2]=3 935 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [0,1,0,0,0,0|0,0,2]=3 936 B7R0.5 C=C(COC)C(=O)O Amb26978134 [0,1,0,0,0,0|0,0,2]=3 937 B7R0.5 C=C(CSC)C(=O)O Amb26953041 [0,1,0,0,0,0|0,0,2]=3 938 B7R0.5 C=C(O)C(O)\C=C\C Amb28140639 [0,1,0,0,0,0|2,0,1]=4 939 B7R0.5 C=C(\C=C\C)C(C)=O Amb25712751 [0,1,0,0,0,0|1,0,1]=3 940 B7R0.5 C=CCC(=C)C(=O)O Amb18641687 [0,1,0,0,0,0|0,0,2]=3 941 B7R0.5 C=CCC(=C)C(N)=O Amb27845092 [0,1,0,0,0,0|1,0,2]=4 942 B7R0.5 C=CCC(=O)C(=O)O Amb25890017 [0,1,0,0,0,0|1,0,1]=3 943 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [0,1,0,0,0,0|0,0,2]=3 944 B7R0.5 C=CCC(C)C(C)=O Amb19373098 [0,1,0,0,0,0|1,0,2]=4 945 B7R0.5 C=CCC(C)C(N)=O Amb27788519 [0,1,0,0,0,0|1,0,2]=4 946 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [0,1,0,0,0,0|1,0,2]=4 947 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [0,1,0,0,0,0|1,0,2]=4 948 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [0,1,0,0,0,0|1,0,2]=4 949 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [0,1,0,0,0,0|1,0,2]=4 950 B7R0.5 C=CCN(C)C(=O)Cl Amb33296757 [0,1,0,0,0,0|2,0,1]=4 951 B7R0.5 C=CCN(C)C(C)=O Amb4318131 [0,1,0,0,0,0|2,0,1]=4 952 B7R0.5 C=CCN(C)C(N)=O Amb27838344 [0,1,0,0,0,0|2,0,1]=4 953 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [0,1,0,0,0,0|1,0,2]=4 954 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [0,1,0,0,0,0|1,0,2]=4 955 B7R0.5 C=CC[C@H](C)C(C)=O Amb26641913 [0,1,0,0,0,0|1,0,2]=4 956 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [0,1,0,0,0,0|1,0,2]=4 957 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [0,1,0,0,0,0|1,0,2]=4 958 B7R0.5 C=C\C=C(/Cl)C(=O)O Amb18642910 [0,1,0,0,0,0|1,0,1]=3 959 B7R0.5 C=C\C=C(\C)C(=O)O Amb27221069 [0,1,0,0,0,0|0,0,1]=2 960 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [0,1,0,0,0,0|0,0,2]=3 961 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [0,1,0,0,0,0|1,0,2]=4 962 B7R0.5 CC(=O)C(=O)CC=O Amb24524264 [0,1,0,0,0,0|3,0,0]=4 963 B7R0.5 CC(=O)C(=O)CCCl Amb28077243 [0,1,0,0,0,0|2,0,1]=4 964 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [0,1,0,0,0,0|2,0,1]=4 965 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [0,1,0,0,0,0|1,0,2]=4 966 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [0,1,0,0,0,0|1,0,2]=4 967 B7R0.5 CC(=O)C(C)CCO Amb13881368 [0,1,0,0,0,0|1,0,2]=4 968 B7R0.5 CC(=O)C(C)NC=O Amb23442778 [0,1,0,0,0,0|2,0,1]=4 969 B7R0.5 CC(=O)C(C)OC=O Amb26492625 [0,1,0,0,0,0|2,0,1]=4 970 B7R0.5 CC(=O)N(C)CC=O Amb17080668 [0,1,0,0,0,0|3,0,0]=4 971 B7R0.5 CC(=O)N(C)CCBr Amb27592204 [0,1,0,0,0,0|2,0,1]=4 972 B7R0.5 CC(=O)N(C)CCCl Amb27480683 [0,1,0,0,0,0|2,0,1]=4 973 B7R0.5 CC(=O)N(C)CCN Amb17046786 [0,1,0,0,0,0|2,0,1]=4 974 B7R0.5 CC(=O)N(C)CCN Amb34137491 [0,1,0,0,0,0|2,0,1]=4 975 B7R0.5 CC(=O)N(C)CCO Amb5797447 [0,1,0,0,0,0|2,0,1]=4 976 B7R0.5 CC(=O)\C(C)=C\C=O Amb28208341 [0,1,0,0,0,0|1,0,1]=3 977 B7R0.5 CC(=O)\C(C)=C\CO Amb27472570 [0,1,0,0,0,0|1,0,0]=2 978 B7R0.5 CC(=O)\C(C)=N\C=O Amb28316244 [0,1,0,0,0,0|2,0,0]=3 979 B7R0.5 CC(C)=C(C)CC=O Amb27625010 [0,1,0,0,0,0|3,0,0]=4 980 B7R0.5 CC(C)=C(C)CCBr Amb25890211 [0,1,0,0,0,0|2,0,1]=4 981 B7R0.5 CC(C)=C(C)CCCl Amb27613488 [0,1,0,0,0,0|2,0,1]=4 982 B7R0.5 CC(C)=C(C)CCN Amb26481951 [0,1,0,0,0,0|2,0,1]=4 983 B7R0.5 CC(C)=C(C)CCO Amb26370445 [0,1,0,0,0,0|2,0,1]=4 984 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [0,1,0,0,0,0|0,0,3]=4 985 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [0,1,0,0,0,0|1,0,1]=3 986 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [0,1,0,0,0,0|1,0,2]=4 987 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [0,1,0,0,0,0|0,0,2]=3 988 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [0,1,0,0,0,0|1,0,2]=4 989 B7R0.5 CC(CCF)C(=O)O Amb24678386 [0,1,0,0,0,0|0,0,2]=3 990 B7R0.5 CC(CCN)=C(Br)Br Amb27484892 [0,1,0,0,0,0|2,0,1]=4 991 B7R0.5 CC(CCN)C(=O)O Amb20667970 [0,1,0,0,0,0|0,0,2]=3 992 B7R0.5 CC(CCN)C(=O)O Amb538221 [0,1,0,0,0,0|0,0,2]=3 993 B7R0.5 CC(CCO)C(=O)O Amb18641949 [0,1,0,0,0,0|0,0,2]=3 994 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [0,1,0,0,0,0|0,0,3]=4 995 B7R0.5 CC(CCO)C(N)=O Amb28280962 [0,1,0,0,0,0|1,0,2]=4 996 B7R0.5 CC(CNO)C(=O)O Amb28315956 [0,1,0,0,0,0|1,0,2]=4 997 B7R0.5 CC(CSS)C(=O)O Amb27437183 [0,1,0,0,0,0|1,0,2]=4 998 B7R0.5 CC(N=C=O)C(=O)O Amb33471295 [0,1,0,0,0,0|1,0,2]=4 999 B7R0.5 CC(N=C=S)C(=O)O Amb25945785 [0,1,0,0,0,0|1,0,2]=4 1000 B7R0.5 CC(N=[N+]=[N-])C(=O)O Amb27202649 [0,1,0,0,0,0|2,0,1]=4 1001 B7R0.5 CC(NC=O)C(=O)O Amb1144629 [0,1,0,0,0,0|1,0,1]=3 1002 B7R0.5 CC(NCO)C(=O)O Amb27468253 [0,1,0,0,0,0|1,0,1]=3 1003 B7R0.5 CC(OC=O)C(=O)O Amb27872094 [0,1,0,0,0,0|1,0,1]=3 1004 B7R0.5 CC(\N=N\O)C(=O)O Amb28251041 [0,1,0,0,0,0|2,0,1]=4 1005 B7R0.5 CC=C=C(C)C(C)N Amb27222315 [0,1,0,0,0,0|2,0,1]=4 1006 B7R0.5 CC=C=C(Cl)C(C)O Amb27763418 [0,1,0,0,0,0|2,0,1]=4 1007 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [0,1,0,0,0,0|1,0,1]=3 1008 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [0,1,0,0,0,0|2,0,1]=4 1009 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [0,1,0,0,0,0|1,0,2]=4 1010 B7R0.5 CCCC(C)=C(C)C Amb4019545 [0,1,0,0,0,0|2,0,1]=4 1011 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [0,1,0,0,0,0|1,0,2]=4 1012 B7R0.5 CCCC(C)C(=O)O Amb3938958 [0,1,0,0,0,0|0,0,2]=3 1013 B7R0.5 CCCC(C)C(C)=O Amb4034597 [0,1,0,0,0,0|1,0,2]=4 1014 B7R0.5 CCCC(C)C(N)=O Amb3886535 [0,1,0,0,0,0|1,0,2]=4 1015 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [0,1,0,0,0,0|1,0,2]=4 1016 B7R0.5 CCCC(F)C(=O)O Amb25842008 [0,1,0,0,0,0|1,0,2]=4 1017 B7R0.5 CCCC(N)C(=O)O Amb6262055 [0,1,0,0,0,0|1,0,2]=4 1018 B7R0.5 CCCC(O)C(=O)O Amb2818222 [0,1,0,0,0,0|1,0,2]=4 1019 B7R0.5 CCCC(S)C(=O)O Amb18124440 [0,1,0,0,0,0|1,0,2]=4 1020 B7R0.5 CCCN(C)C(=O)Cl Amb26478280 [0,1,0,0,0,0|2,0,1]=4 1021 B7R0.5 CCCN(C)C(N)=O Amb8898960 [0,1,0,0,0,0|2,0,1]=4 1022 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [0,1,0,0,0,0|0,0,2]=3 1023 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [0,1,0,0,0,0|1,0,2]=4 1024 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [0,1,0,0,0,0|1,0,2]=4 1025 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [0,1,0,0,0,0|1,0,2]=4 1026 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [0,1,0,0,0,0|1,0,2]=4 1027 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [0,1,0,0,0,0|0,0,2]=3 1028 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [0,1,0,0,0,0|1,0,2]=4 1029 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [0,1,0,0,0,0|1,0,2]=4 1030 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [0,1,0,0,0,0|1,0,2]=4 1031 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [0,1,0,0,0,0|1,0,2]=4 1032 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [0,1,0,0,0,0|1,0,2]=4 1033 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [0,1,0,0,0,0|1,0,2]=4 1034 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [0,1,0,0,0,0|1,0,1]=3 1035 B7R0.5 CCNC(=O)C(C)=O Amb17399798 [0,1,0,0,0,0|2,0,1]=4 1036 B7R0.5 CCNC(=O)C(N)=O Amb27969146 [0,1,0,0,0,0|2,0,1]=4 1037 B7R0.5 CCNC(C)C(=O)O Amb33527634 [0,1,0,0,0,0|0,0,2]=3 1038 B7R0.5 CCNC(C)C(=O)O Amb9326962 [0,1,0,0,0,0|0,0,2]=3 1039 B7R0.5 CCNC(C)C(N)=O Amb21959648 [0,1,0,0,0,0|1,0,2]=4 1040 B7R0.5 CCNC(C)C(N)=O Amb7758139 [0,1,0,0,0,0|1,0,2]=4 1041 B7R0.5 CCNC(O)C(=O)O Amb27259098 [0,1,0,0,0,0|1,0,2]=4 1042 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [0,1,0,0,0,0|0,0,2]=3 1043 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [0,1,0,0,0,0|0,0,2]=3 1044 B7R0.5 CCOC(=O)C(=O)Cl Amb932808 [0,1,0,0,0,0|2,0,1]=4 1045 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [0,1,0,0,0,0|1,0,1]=3 1046 B7R0.5 CCOC(=O)C(=O)[O-] Amb16192061 [0,1,0,0,0,0|1,0,2]=4 1047 B7R0.5 CCOC(=O)C(C)=O Amb2793051 [0,1,0,0,0,0|2,0,1]=4 1048 B7R0.5 CCOC(=O)C(N)=O Amb3886540 [0,1,0,0,0,0|2,0,1]=4 1049 B7R0.5 CCOC(=S)C(N)=O Amb10604171 [0,1,0,0,0,0|2,0,1]=4 1050 B7R0.5 CCOC(C)C(=O)O Amb9725271 [0,1,0,0,0,0|0,0,2]=3 1051 B7R0.5 CCOC(C)C(C)=O Amb9666103 [0,1,0,0,0,0|1,0,2]=4 1052 B7R0.5 CCOC(C)C(N)=O Amb19960053 [0,1,0,0,0,0|1,0,2]=4 1053 B7R0.5 CCOC(F)C(=O)O Amb27210743 [0,1,0,0,0,0|1,0,2]=4 1054 B7R0.5 CCON(C)C(N)=O Amb27829816 [0,1,0,0,0,0|2,0,1]=4 1055 B7R0.5 CCSC(=O)C(=O)O Amb28410577 [0,1,0,0,0,0|1,0,1]=3 1056 B7R0.5 CCSC(=O)C(C)=O Amb27972957 [0,1,0,0,0,0|2,0,1]=4 1057 B7R0.5 CCSC(C)C(=O)O Amb9721554 [0,1,0,0,0,0|0,0,2]=3 1058 B7R0.5 CCSC(C)C(N)=O Amb27830179 [0,1,0,0,0,0|1,0,2]=4 1059 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [0,1,0,0,0,0|0,0,0]=1 1060 B7R0.5 CC\C=C(/C)C(C)C Amb4016284 [0,1,0,0,0,0|2,0,1]=4 1061 B7R0.5 CC\C=C(/C)C(C)O Amb27761819 [0,1,0,0,0,0|1,0,1]=3 1062 B7R0.5 CC\C=C(/C)C(N)=O Amb27985331 [0,1,0,0,0,0|1,0,0]=2 1063 B7R0.5 CC\C=C(/Cl)C(C)=O Amb27199134 [0,1,0,0,0,0|2,0,0]=3 1064 B7R0.5 CC\C=C(/F)C(=O)O Amb27968785 [0,1,0,0,0,0|1,0,0]=2 1065 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [0,1,0,0,0,0|0,0,0]=1 1066 B7R0.5 CC\C=C(\C)C(C)N Amb27817590 [0,1,0,0,0,0|2,0,1]=4 1067 B7R0.5 CC\C=C(\C)[C@@H](C)O Amb27484789 [0,1,0,0,0,0|1,0,1]=3 1068 B7R0.5 CC\C=C(\Cl)C(C)=O Amb27486079 [0,1,0,0,0,0|2,0,0]=3 1069 B7R0.5 CN(CCBr)C(=O)Cl Amb33296909 [0,1,0,0,0,0|2,0,1]=4 1070 B7R0.5 CN(CCCl)C(=O)Cl Amb25285023 [0,1,0,0,0,0|2,0,1]=4 1071 B7R0.5 CN(CCN)C(N)=O Amb18953297 [0,1,0,0,0,0|2,0,1]=4 1072 B7R0.5 CNCC(C)C(=O)O Amb13952364 [0,1,0,0,0,0|0,0,2]=3 1073 B7R0.5 CNCC(C)C(=O)O Amb9400281 [0,1,0,0,0,0|0,0,2]=3 1074 B7R0.5 CNCC(C)C(N)=O Amb8943991 [0,1,0,0,0,0|1,0,2]=4 1075 B7R0.5 CNCC(N)C(=O)O Amb10845350 [0,1,0,0,0,0|1,0,2]=4 1076 B7R0.5 CNCC(O)C(=O)O Amb26894610 [0,1,0,0,0,0|1,0,2]=4 1077 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [0,1,0,0,0,0|1,0,2]=4 1078 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [0,1,0,0,0,0|1,0,2]=4 1079 B7R0.5 CN\C=C(/C)C(N)=O Amb27235593 [0,1,0,0,0,0|1,0,0]=2 1080 B7R0.5 CN\C=C(\C)C(C)=O Amb24640763 [0,1,0,0,0,0|1,0,0]=2 1081 B7R0.5 CN\C=C(\C)C(N)=O Amb28199153 [0,1,0,0,0,0|1,0,0]=2 1082 B7R0.5 CN\N=C(/C)C(=O)O Amb27489531 [0,1,0,0,0,0|1,0,0]=2 1083 B7R0.5 COCC(=O)C(C)=O Amb24694271 [0,1,0,0,0,0|2,0,1]=4 1084 B7R0.5 COCC(Br)C(=O)O Amb17594709 [0,1,0,0,0,0|1,0,2]=4 1085 B7R0.5 COCC(C)C(=O)O Amb33545090 [0,1,0,0,0,0|0,0,2]=3 1086 B7R0.5 COCC(C)C(C)=O Amb24683449 [0,1,0,0,0,0|1,0,2]=4 1087 B7R0.5 COCC(C)C(N)=O Amb27401584 [0,1,0,0,0,0|1,0,2]=4 1088 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [0,1,0,0,0,0|1,0,2]=4 1089 B7R0.5 COCC(N)C(=O)O Amb33551350 [0,1,0,0,0,0|1,0,2]=4 1090 B7R0.5 COCC(N)C(=O)O Amb6752055 [0,1,0,0,0,0|1,0,2]=4 1091 B7R0.5 COCC(O)C(=O)O Amb18124273 [0,1,0,0,0,0|1,0,2]=4 1092 B7R0.5 COCC(S)C(=O)O Amb27763656 [0,1,0,0,0,0|1,0,2]=4 1093 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [0,1,0,0,0,0|0,0,2]=3 1094 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [0,1,0,0,0,0|1,0,2]=4 1095 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [0,1,0,0,0,0|1,0,2]=4 1096 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [0,1,0,0,0,0|0,0,2]=3 1097 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [0,1,0,0,0,0|1,0,2]=4 1098 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [0,1,0,0,0,0|1,0,2]=4 1099 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [0,1,0,0,0,0|1,0,2]=4 1100 B7R0.5 CONC(C)C(N)=O Amb27657313 [0,1,0,0,0,0|2,0,1]=4 1101 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [0,1,0,0,0,0|1,0,1]=3 1102 B7R0.5 CO\C=C(/C)C(=O)O Amb18641867 [0,1,0,0,0,0|0,0,0]=1 1103 B7R0.5 CO\C=C(/F)C(=O)Cl Amb22641619 [0,1,0,0,0,0|2,0,0]=3 1104 B7R0.5 CO\C=C(/F)C(=O)O Amb28369284 [0,1,0,0,0,0|1,0,0]=2 1105 B7R0.5 CO\C=C(/F)C(C)=O Amb26343815 [0,1,0,0,0,0|2,0,0]=3 1106 B7R0.5 CO\C=C(/O)C(C)=O Amb27423656 [0,1,0,0,0,0|2,0,0]=3 1107 B7R0.5 CO\C=C(\C)C(C)=O Amb26391054 [0,1,0,0,0,0|1,0,0]=2 1108 B7R0.5 CO\C=C(\Cl)C(C)=O Amb27427743 [0,1,0,0,0,0|2,0,0]=3 1109 B7R0.5 CO\C=C(\F)C(=O)O Amb22641708 [0,1,0,0,0,0|1,0,0]=2 1110 B7R0.5 CO\C=C(\F)C(C)=O Amb27191747 [0,1,0,0,0,0|2,0,0]=3 1111 B7R0.5 CO\C=C(\I)C(=O)O Amb27228187 [0,1,0,0,0,0|1,0,0]=2 1112 B7R0.5 CO\C=C(\N)C(=O)O Amb27390812 [0,1,0,0,0,0|1,0,0]=2 1113 B7R0.5 CO\C=C(\O)C(C)=O Amb27435154 [0,1,0,0,0,0|2,0,0]=3 1114 B7R0.5 CO\N=C(/C)C(=O)O Amb28203933 [0,1,0,0,0,0|1,0,0]=2 1115 B7R0.5 CO\N=C(/Cl)C(C)=O Amb28322041 [0,1,0,0,0,0|3,0,0]=4 1116 B7R0.5 CSCC(C)C(=O)O Amb18967825 [0,1,0,0,0,0|0,0,2]=3 1117 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [0,1,0,0,0,0|1,0,2]=4 1118 B7R0.5 CSCC(N)C(=O)O Amb33804791 [0,1,0,0,0,0|1,0,2]=4 1119 B7R0.5 CSCC(N)C(=O)O Amb6280829 [0,1,0,0,0,0|1,0,2]=4 1120 B7R0.5 CSCC(O)C(=O)O Amb25131873 [0,1,0,0,0,0|1,0,2]=4 1121 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [0,1,0,0,0,0|0,0,2]=3 1122 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [0,1,0,0,0,0|1,0,2]=4 1123 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [0,1,0,0,0,0|1,0,2]=4 1124 B7R0.5 CS\C=C(/C)C(C)=O Amb24481401 [0,1,0,0,0,0|1,0,0]=2 1125 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [0,1,0,0,0,0|0,0,2]=3 1126 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [0,1,0,0,0,0|0,0,2]=3 1127 B7R0.5 C[C@@H](N=C=O)C(=O)O Amb33189209 [0,1,0,0,0,0|1,0,2]=4 1128 B7R0.5 C[C@@H](N=C=S)C(=O)O Amb33471579 [0,1,0,0,0,0|1,0,2]=4 1129 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O Amb28325865 [0,1,0,0,0,0|2,0,1]=4 1130 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O Amb32620194 [0,1,0,0,0,0|2,0,1]=4 1131 B7R0.5 C[C@@H](NC#N)C(=O)O Amb35634494 [0,1,0,0,0,0|1,0,2]=4 1132 B7R0.5 C[C@@H](NC=O)C(N)=O Amb27837549 [0,1,0,0,0,0|2,0,1]=4 1133 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [0,1,0,0,0,0|0,0,2]=3 1134 B7R0.5 C[C@H](N=C=O)C(=O)O Amb33471333 [0,1,0,0,0,0|1,0,2]=4 1135 B7R0.5 C[C@H](N=C=S)C(=O)O Amb33471562 [0,1,0,0,0,0|1,0,2]=4 1136 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O Amb32620189 [0,1,0,0,0,0|2,0,1]=4 1137 B7R0.5 C[C@H](NC#N)C(=O)O Amb30031667 [0,1,0,0,0,0|1,0,2]=4 1138 B7R0.5 C[C@H](NC=O)C(=O)O Amb28323701 [0,1,0,0,0,0|1,0,1]=3 1139 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [0,1,0,0,0,0|1,0,1]=3 1140 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [0,1,0,0,0,0|1,0,2]=4 1141 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [0,1,0,0,0,0|1,0,2]=4 1142 B7R0.5 C\C(=C/C#N)C(C)O Amb28194150 [0,1,0,0,0,0|1,0,2]=4 1143 B7R0.5 C\C(=C/C#N)C(N)=O Amb27838383 [0,1,0,0,0,0|1,0,1]=3 1144 B7R0.5 C\C(=C/C=O)C(=O)O Amb27165186 [0,1,0,0,0,0|0,0,1]=2 1145 B7R0.5 C\C(=C/C=O)C(N)=O Amb27838329 [0,1,0,0,0,0|1,0,1]=3 1146 B7R0.5 C\C(=C/CBr)C(F)F Amb27484050 [0,1,0,0,0,0|2,0,1]=4 1147 B7R0.5 C\C(=C/CCl)C(=O)O Amb25844891 [0,1,0,0,0,0|0,0,0]=1 1148 B7R0.5 C\C(=C/CCl)C(C)C Amb27408079 [0,1,0,0,0,0|2,0,1]=4 1149 B7R0.5 C\C(=C/CN)C(=O)O Amb25845292 [0,1,0,0,0,0|0,0,0]=1 1150 B7R0.5 C\C(=C/CN)C(C)C Amb28045473 [0,1,0,0,0,0|2,0,1]=4 1151 B7R0.5 C\C(=C/CN)C(F)F Amb27429494 [0,1,0,0,0,0|2,0,1]=4 1152 B7R0.5 C\C(=C/CN)C(N)=O Amb30030310 [0,1,0,0,0,0|1,0,0]=2 1153 B7R0.5 C\C(=C/CO)C(C)C Amb25662075 [0,1,0,0,0,0|2,0,1]=4 1154 B7R0.5 C\C(=C/CO)C(F)F Amb27852802 [0,1,0,0,0,0|2,0,1]=4 1155 B7R0.5 C\C(=C/CO)[C@@H](C)O Amb27255232 [0,1,0,0,0,0|1,0,1]=3 1156 B7R0.5 C\C(=C/CS)C(=O)O Amb28041309 [0,1,0,0,0,0|0,0,0]=1 1157 B7R0.5 C\C(Cl)=C(C)/C=C/Cl Amb27781522 [0,1,0,0,0,0|2,0,1]=4 1158 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [0,1,0,0,0,0|1,0,1]=3 1159 B7R0.5 C\C=C\C(C)C(C)=O Amb26585088 [0,1,0,0,0,0|1,0,1]=3 1160 B7R0.5 C\C=C\C(C)C(C)O Amb32944797 [0,1,0,0,0,0|1,0,2]=4 1161 B7R0.5 C\C=C\C(F)=C(F)F Amb27266115 [0,1,0,0,0,0|3,0,0]=4 1162 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [0,1,0,0,0,0|1,0,1]=3 1163 B7R0.5 C\C=C\C(O)C(C)=O Amb25912951 [0,1,0,0,0,0|2,0,1]=4 1164 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [0,1,0,0,0,0|1,0,1]=3 1165 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [0,1,0,0,0,0|1,0,1]=3 1166 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [0,1,0,0,0,0|1,0,1]=3 1167 B7R0.5 C\C=N\N(C)C(N)=S Amb27424754 [0,1,0,0,0,0|2,1,0]=4 1168 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [0,1,0,0,0,0|1,0,2]=4 1169 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [0,1,0,0,0,0|1,0,2]=4 1170 B7R0.5 NC(CCF)C(=O)O Amb25889337 [0,1,0,0,0,0|1,0,2]=4 1171 B7R0.5 NC(CCF)C(=O)O Amb28934889 [0,1,0,0,0,0|1,0,2]=4 1172 B7R0.5 NC(CCO)C(=O)O Amb8514287 [0,1,0,0,0,0|1,0,2]=4 1173 B7R0.5 NC(CCS)C(=O)O Amb19267093 [0,1,0,0,0,0|1,0,2]=4 1174 B7R0.5 NC(CCS)C(=O)O Amb3499433 [0,1,0,0,0,0|1,0,2]=4 1175 B7R0.5 NC(\C=C\F)C(=O)O Amb27666430 [0,1,0,0,0,0|1,0,2]=4 1176 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [0,1,0,0,0,0|1,0,2]=4 1177 B7R0.5 NCCC(F)C(=O)O Amb10838221 [0,1,0,0,0,0|1,0,2]=4 1178 B7R0.5 NCCC(F)C(=O)O Amb22229524 [0,1,0,0,0,0|1,0,2]=4 1179 B7R0.5 NCCC(N)C(=O)O Amb2697841 [0,1,0,0,0,0|1,0,2]=4 1180 B7R0.5 NCCC(N)C(=O)O Amb8514694 [0,1,0,0,0,0|1,0,2]=4 1181 B7R0.5 NCCC(O)C(=O)O Amb16232090 [0,1,0,0,0,0|1,0,2]=4 1182 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [0,1,0,0,0,0|1,0,2]=4 1183 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [0,1,0,0,0,0|1,0,2]=4 1184 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [0,1,0,0,0,0|1,0,2]=4 1185 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [0,1,0,0,0,0|1,0,2]=4 1186 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [0,1,0,0,0,0|1,0,2]=4 1187 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [0,1,0,0,0,0|1,0,2]=4 1188 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [0,1,0,0,0,0|1,0,2]=4 1189 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [0,1,0,0,0,0|1,0,2]=4 1190 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [0,1,0,0,0,0|1,0,2]=4 1191 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [0,1,0,0,0,0|1,0,2]=4 1192 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [0,1,0,0,0,0|1,0,2]=4 1193 B7R0.5 NC\C=C(/F)C(=O)O Amb33802627 [0,1,0,0,0,0|1,0,0]=2 1194 B7R0.5 NC\C=C(\F)C(=O)O Amb28340962 [0,1,0,0,0,0|1,0,0]=2 1195 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [0,1,0,0,0,0|1,0,2]=4 1196 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [0,1,0,0,0,0|1,0,2]=4 1197 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [0,1,0,0,0,0|1,0,2]=4 1198 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [0,1,0,0,0,0|1,0,2]=4 1199 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [0,1,0,0,0,0|1,0,2]=4 1200 B7R0.5 N[C@@H](OCS)C(=O)O Amb27591629 [0,1,0,0,0,0|2,0,1]=4 1201 B7R0.5 N[C@@H](\C=C/F)C(=O)O Amb27447269 [0,1,0,0,0,0|1,0,2]=4 1202 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [0,1,0,0,0,0|2,0,1]=4 1203 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [0,1,0,0,0,0|1,0,2]=4 1204 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [0,1,0,0,0,0|1,0,2]=4 1205 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [0,1,0,0,0,0|1,0,2]=4 1206 B7R0.5 O=C(O)C(=O)CCF Amb33377241 [0,1,0,0,0,0|1,0,1]=3 1207 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [0,1,0,0,0,0|1,0,1]=3 1208 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [0,1,0,0,0,0|1,0,2]=4 1209 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [0,1,0,0,0,0|1,0,2]=4 1210 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [0,1,0,0,0,0|1,0,2]=4 1211 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [0,1,0,0,0,0|1,0,2]=4 1212 B7R0.5 O=C(O)C(O)CCF Amb28071189 [0,1,0,0,0,0|1,0,2]=4 1213 B7R0.5 O=C(O)C(O)CCO Amb24689942 [0,1,0,0,0,0|1,0,2]=4 1214 B7R0.5 O=C(O)C(S)CCS Amb27634893 [0,1,0,0,0,0|1,0,2]=4 1215 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [0,1,0,0,0,0|1,0,2]=4 1216 B7R0.5 O=C(O)\C(Br)=C\CO Amb28291530 [0,1,0,0,0,0|1,0,0]=2 1217 B7R0.5 O=C(O)\C(Cl)=C\CBr Amb27875077 [0,1,0,0,0,0|1,0,0]=2 1218 B7R0.5 O=CCC(=O)C(=O)O Amb26326260 [0,1,0,0,0,0|2,0,0]=3 1219 B7R0.5 O=C\C=C(/Br)C(=O)O Amb28320595 [0,1,0,0,0,0|1,0,1]=3 1220 B7R0.5 O=C\C=C(/Cl)C(=O)O Amb27784434 [0,1,0,0,0,0|1,0,1]=3 1221 B7R0.5 OCC\C(Br)=C(/O)Br Amb27967773 [0,1,0,0,0,0|2,0,1]=4 1222 B7R0.10 C#CC(=O)C(C)NC Amb28342098 [0,1,0,0,0,0|2,0,1]=4 1223 B7R0.10 C#CC(=O)N(C)CC Amb25106168 [0,1,0,0,0,0|2,0,1]=4 1224 B7R0.10 C#CC(=O)N(C)OC Amb28075088 [0,1,0,0,0,0|3,0,0]=4 1225 B7R0.10 C#CC(=O)[C@H](C)NC Amb30039170 [0,1,0,0,0,0|2,0,1]=4 1226 B7R0.10 C#CC(=O)\C(C)=C\C Amb28349031 [0,1,0,0,0,0|1,0,0]=2 1227 B7R0.10 C#C\C(C)=C(/Cl)CO Amb27423105 [0,1,0,0,0,0|1,0,2]=4 1228 B7R0.10 C=C(C#N)C(=O)OC Amb18641186 [0,1,0,0,0,0|1,0,2]=4 1229 B7R0.10 C=C(C=O)[C@@H](C)CC Amb27390187 [0,1,0,0,0,0|1,0,2]=4 1230 B7R0.10 C=C(CBr)C(=O)OC Amb8516917 [0,1,0,0,0,0|1,0,2]=4 1231 B7R0.10 C=C(CC)C(=O)CC Amb17593165 [0,1,0,0,0,0|1,0,2]=4 1232 B7R0.10 C=C(CC)C(=O)CO Amb27486129 [0,1,0,0,0,0|0,0,2]=3 1233 B7R0.10 C=C(CC)C(=O)NN Amb27654970 [0,1,0,0,0,0|1,0,2]=4 1234 B7R0.10 C=C(CC)C(=O)OC Amb24469857 [0,1,0,0,0,0|0,0,2]=3 1235 B7R0.10 C=C(CCl)C(=O)OC Amb19958340 [0,1,0,0,0,0|1,0,2]=4 1236 B7R0.10 C=C(CF)C(=O)OC Amb27864265 [0,1,0,0,0,0|1,0,2]=4 1237 B7R0.10 C=C(CN)C(=O)OC Amb27599562 [0,1,0,0,0,0|1,0,2]=4 1238 B7R0.10 C=C(CO)C(=O)OC Amb17933844 [0,1,0,0,0,0|1,0,2]=4 1239 B7R0.10 C=C(CO)\C(C)=C/C Amb28065375 [0,1,0,0,0,0|1,0,0]=2 1240 B7R0.10 C=C(OC)C(=C)OC Amb22338211 [0,1,0,0,0,0|2,0,1]=4 1241 B7R0.10 C=C(OC)C(=O)OC Amb28399073 [0,1,0,0,0,0|1,0,1]=3 1242 B7R0.10 C=C(OC)\C(Cl)=C\Cl Amb27847997 [0,1,0,0,0,0|3,0,0]=4 1243 B7R0.10 C=C(SC)C(=O)OC Amb27656814 [0,1,0,0,0,0|1,0,1]=3 1244 B7R0.10 C=C=C(C)C(=O)OC Amb32423561 [0,1,0,0,0,0|0,0,2]=3 1245 B7R0.10 C=CC(=C)C(=O)C=C Amb27185481 [0,1,0,0,0,0|1,0,2]=4 1246 B7R0.10 C=CC(=O)C(=O)C=C Amb27844983 [0,1,0,0,0,0|2,0,1]=4 1247 B7R0.10 C=CC(=O)C(C)CC Amb26350444 [0,1,0,0,0,0|1,0,2]=4 1248 B7R0.10 C=CC(=O)N(C)CC Amb9480867 [0,1,0,0,0,0|2,0,1]=4 1249 B7R0.10 C=CC(=O)N(C)OC Amb9492353 [0,1,0,0,0,0|3,0,0]=4 1250 B7R0.10 C=CC(=O)[C@H](C)NC Amb30039175 [0,1,0,0,0,0|2,0,1]=4 1251 B7R0.10 C=CC(=O)\C(C)=C/C Amb27434163 [0,1,0,0,0,0|1,0,0]=2 1252 B7R0.10 C=CC(Cl)C(=O)OC Amb33548059 [0,1,0,0,0,0|1,0,2]=4 1253 B7R0.10 C=CC(O)C(=O)OC Amb22734006 [0,1,0,0,0,0|1,0,2]=4 1254 B7R0.10 C=CC(O)\C(Cl)=C/C Amb27978659 [0,1,0,0,0,0|2,0,1]=4 1255 B7R0.10 C=C[C@H](O)\C(C)=C/C Amb28321314 [0,1,0,0,0,0|1,0,1]=3 1256 B7R0.10 CC(=C/Cl)\C(C)=C\Br Amb27758709 [0,1,0,0,0,0|3,0,0]=4 1257 B7R0.10 CC(=C/Cl)\C(Cl)=C\Cl Amb28052055 [0,1,0,0,0,0|3,0,0]=4 1258 B7R0.10 CC(=C/I)\C(C)=C\I Amb28434465 [0,1,0,0,0,0|3,0,0]=4 1259 B7R0.10 CC(=C\Cl)\C(Cl)=C/Cl Amb27240732 [0,1,0,0,0,0|3,0,0]=4 1260 B7R0.10 CC(=N/N)\C(C)=N\O Amb24504503 [0,1,0,0,0,0|3,0,0]=4 1261 B7R0.10 CC(=N/O)\C(C)=N\O Amb6608899 [0,1,0,0,0,0|3,0,0]=4 1262 B7R0.10 CC(=N/O)\C(N)=N\O Amb27654219 [0,1,0,0,0,0|3,0,0]=4 1263 B7R0.10 CC(CN)C(=O)NO Amb27756001 [0,1,0,0,0,0|1,0,2]=4 1264 B7R0.10 CCC(=O)C(=O)CC Amb6608779 [0,1,0,0,0,0|2,0,1]=4 1265 B7R0.10 CCC(=O)C(=O)CO Amb28316184 [0,1,0,0,0,0|1,0,1]=3 1266 B7R0.10 CCC(=O)C(=O)OC Amb17935757 [0,1,0,0,0,0|1,0,1]=3 1267 B7R0.10 CCC(=O)C(C)CC Amb22229845 [0,1,0,0,0,0|1,0,2]=4 1268 B7R0.10 CCC(=O)C(C)NC Amb25738187 [0,1,0,0,0,0|2,0,1]=4 1269 B7R0.10 CCC(=O)N(C)OC Amb8394947 [0,1,0,0,0,0|3,0,0]=4 1270 B7R0.10 CCC(=O)[C@H](C)CC Amb27835595 [0,1,0,0,0,0|1,0,2]=4 1271 B7R0.10 CCC(=O)[C@H](C)NC Amb30039186 [0,1,0,0,0,0|2,0,1]=4 1272 B7R0.10 CCC(=O)\C(Br)=C\O Amb28316206 [0,1,0,0,0,0|2,0,1]=4 1273 B7R0.10 CCC(=O)\C(C)=C/N Amb17778143 [0,1,0,0,0,0|2,0,0]=3 1274 B7R0.10 CCC(=O)\C(C)=C\Br Amb26477160 [0,1,0,0,0,0|2,0,0]=3 1275 B7R0.10 CCC(=O)\C(C)=C\Cl Amb28291599 [0,1,0,0,0,0|2,0,0]=3 1276 B7R0.10 CCC(=O)\C(C)=C\N Amb27798686 [0,1,0,0,0,0|2,0,0]=3 1277 B7R0.10 CCC(=O)\C(C)=N/N Amb28126724 [0,1,0,0,0,0|3,0,0]=4 1278 B7R0.10 CCC(=O)\C(C)=N/O Amb10552519 [0,1,0,0,0,0|2,0,1]=4 1279 B7R0.10 CCC(=O)\C(C)=N\C Amb27260482 [0,1,0,0,0,0|2,0,0]=3 1280 B7R0.10 CCC(=O)\C(C)=N\O Amb27460236 [0,1,0,0,0,0|2,0,1]=4 1281 B7R0.10 CCC(Br)C(=O)OC Amb1157544 [0,1,0,0,0,0|1,0,2]=4 1282 B7R0.10 CCC(C)C(=N)OC Amb20623203 [0,1,0,0,0,0|1,0,2]=4 1283 B7R0.10 CCC(C)C(=O)CBr Amb24483169 [0,1,0,0,0,0|1,0,2]=4 1284 B7R0.10 CCC(C)C(=O)CCl Amb20667851 [0,1,0,0,0,0|1,0,2]=4 1285 B7R0.10 CCC(C)C(=O)CN Amb26871505 [0,1,0,0,0,0|1,0,2]=4 1286 B7R0.10 CCC(C)C(=O)CO Amb24680373 [0,1,0,0,0,0|0,0,2]=3 1287 B7R0.10 CCC(C)C(=O)NN Amb9706124 [0,1,0,0,0,0|1,0,2]=4 1288 B7R0.10 CCC(C)C(=O)NO Amb6275767 [0,1,0,0,0,0|0,0,2]=3 1289 B7R0.10 CCC(C)C(O)C=O Amb28454245 [0,1,0,0,0,0|0,0,3]=4 1290 B7R0.10 CCC(C)\C(C)=N\O Amb28124153 [0,1,0,0,0,0|1,0,2]=4 1291 B7R0.10 CCC(C)\C(Cl)=N\O Amb27654809 [0,1,0,0,0,0|1,0,2]=4 1292 B7R0.10 CCC(C)\C(N)=N\O Amb19516921 [0,1,0,0,0,0|1,0,2]=4 1293 B7R0.10 CCC(C)\C(N)=N\O Amb22586630 [0,1,0,0,0,0|1,0,2]=4 1294 B7R0.10 CCC(Cl)C(=O)OC Amb21618748 [0,1,0,0,0,0|1,0,2]=4 1295 B7R0.10 CCC(N)C(=O)NO Amb21922881 [0,1,0,0,0,0|1,0,2]=4 1296 B7R0.10 CCC(N)C(=O)OC Amb17601372 [0,1,0,0,0,0|1,0,2]=4 1297 B7R0.10 CCC(N)C(=O)OC Amb9271765 [0,1,0,0,0,0|1,0,2]=4 1298 B7R0.10 CCC(O)C(=O)CO Amb28316154 [0,1,0,0,0,0|1,0,2]=4 1299 B7R0.10 CCC(O)C(=O)OC Amb4019849 [0,1,0,0,0,0|1,0,2]=4 1300 B7R0.10 CCC(S)C(=O)OC Amb26860434 [0,1,0,0,0,0|1,0,2]=4 1301 B7R0.10 CCN(C)C(=O)CBr Amb33541718 [0,1,0,0,0,0|2,0,1]=4 1302 B7R0.10 CCN(C)C(=O)CCl Amb8428074 [0,1,0,0,0,0|2,0,1]=4 1303 B7R0.10 CCN(C)C(=O)CI Amb27594155 [0,1,0,0,0,0|2,0,1]=4 1304 B7R0.10 CCN(C)C(=O)CN Amb34912728 [0,1,0,0,0,0|2,0,1]=4 1305 B7R0.10 CCN(C)C(=O)CN Amb8890853 [0,1,0,0,0,0|2,0,1]=4 1306 B7R0.10 CCN(C)C(=O)CO Amb9421550 [0,1,0,0,0,0|1,0,1]=3 1307 B7R0.10 CCN(C)C(=O)NN Amb8891099 [0,1,0,0,0,0|2,0,1]=4 1308 B7R0.10 CCN(C)C(=O)NO Amb32657190 [0,1,0,0,0,0|1,0,1]=3 1309 B7R0.10 CCN(C)\C(N)=N\O Amb25112225 [0,1,0,0,0,0|2,0,1]=4 1310 B7R0.10 CCN(N)C(=O)OC Amb33191318 [0,1,0,0,0,0|2,0,1]=4 1311 B7R0.10 CC[C@@H](Br)C(=O)OC Amb27607617 [0,1,0,0,0,0|1,0,2]=4 1312 B7R0.10 CC[C@@H](N)C(=O)NO Amb27602079 [0,1,0,0,0,0|1,0,2]=4 1313 B7R0.10 CC[C@@H](N)C(=O)OC Amb19944650 [0,1,0,0,0,0|1,0,2]=4 1314 B7R0.10 CC[C@@H](N)C(=O)OC Amb22057548 [0,1,0,0,0,0|1,0,2]=4 1315 B7R0.10 CC[C@H](C)C(=O)NC Amb27403795 [0,1,0,0,0,0|1,0,2]=4 1316 B7R0.10 CC[C@H](C)C(=O)OC Amb28145887 [0,1,0,0,0,0|0,0,2]=3 1317 B7R0.10 CC[C@H](N)C(=O)NO Amb27869261 [0,1,0,0,0,0|1,0,2]=4 1318 B7R0.10 CC[C@H](N)C(=O)OC Amb22167154 [0,1,0,0,0,0|1,0,2]=4 1319 B7R0.10 CC[C@H](N)C(=O)OC Amb27391053 [0,1,0,0,0,0|1,0,2]=4 1320 B7R0.10 CC[C@H](O)C(=O)CO Amb27433137 [0,1,0,0,0,0|1,0,2]=4 1321 B7R0.10 CC[C@H](O)C(=O)OC Amb26318042 [0,1,0,0,0,0|1,0,2]=4 1322 B7R0.10 CC\C(C)=C(/Br)CO Amb28188291 [0,1,0,0,0,0|1,0,1]=3 1323 B7R0.10 CC\C(C)=C(/C)C=O Amb27622928 [0,1,0,0,0,0|1,0,1]=3 1324 B7R0.10 CC\C(C)=C(/C)CO Amb25052170 [0,1,0,0,0,0|1,0,1]=3 1325 B7R0.10 CC\C(C)=C(/F)C=O Amb27948535 [0,1,0,0,0,0|1,0,1]=3 1326 B7R0.10 CC\C(C)=C(\C)CC Amb24099381 [0,1,0,0,0,0|2,0,1]=4 1327 B7R0.10 CC\C(Cl)=C(/C)C=O Amb27761558 [0,1,0,0,0,0|2,0,1]=4 1328 B7R0.10 CC\C(O)=C(/Br)C=O Amb28133175 [0,1,0,0,0,0|2,0,1]=4 1329 B7R0.10 CNC(=N)C(=O)NC Amb27879455 [0,1,0,0,0,0|3,0,0]=4 1330 B7R0.10 CNC(=O)C(=O)NC Amb534268 [0,1,0,0,0,0|3,0,0]=4 1331 B7R0.10 CNC(=O)C(=O)OC Amb26858133 [0,1,0,0,0,0|2,0,0]=3 1332 B7R0.10 CNC(=O)C(=S)SC Amb27461333 [0,1,0,0,0,0|3,0,0]=4 1333 B7R0.10 CNC(=O)C(C)NC Amb9764386 [0,1,0,0,0,0|2,0,1]=4 1334 B7R0.10 CNC(=O)C(C)SC Amb25742663 [0,1,0,0,0,0|2,0,1]=4 1335 B7R0.10 CNC(=O)C(N)=S=O Amb27253887 [0,1,0,0,0,0|3,0,0]=4 1336 B7R0.10 CNC(=O)N(C)C=O Amb27839124 [0,1,0,0,0,0|3,0,0]=4 1337 B7R0.10 CNC(=O)N(C)NC Amb27950213 [0,1,0,0,0,0|3,0,0]=4 1338 B7R0.10 CNC(=O)[C@@H](C)NC Amb23385262 [0,1,0,0,0,0|2,0,1]=4 1339 B7R0.10 CNC(=O)[C@H](C)NC Amb22587529 [0,1,0,0,0,0|2,0,1]=4 1340 B7R0.10 CNC(=O)[C@H](C)NC Amb23385248 [0,1,0,0,0,0|2,0,1]=4 1341 B7R0.10 CNC(=O)\C(C)=N\O Amb27839126 [0,1,0,0,0,0|3,0,0]=4 1342 B7R0.10 CNC(=O)\C(N)=N/O Amb19517087 [0,1,0,0,0,0|3,0,0]=4 1343 B7R0.10 CNC(=O)\C(N)=N\O Amb19651443 [0,1,0,0,0,0|3,0,0]=4 1344 B7R0.10 CNC(C)C(=O)CBr Amb27845352 [0,1,0,0,0,0|2,0,1]=4 1345 B7R0.10 CNC(C)C(=O)NO Amb27207236 [0,1,0,0,0,0|1,0,1]=3 1346 B7R0.10 CNC(C)C(=O)OC Amb18299580 [0,1,0,0,0,0|1,0,1]=3 1347 B7R0.10 CNC(C)C(=O)OC Amb21961535 [0,1,0,0,0,0|1,0,1]=3 1348 B7R0.10 CNC(C)\C(N)=N\O Amb27436763 [0,1,0,0,0,0|2,0,1]=4 1349 B7R0.10 CNN(C)C(=O)CCl Amb27592475 [0,1,0,0,0,0|3,0,0]=4 1350 B7R0.10 CN[C@@H](C)C(=O)OC Amb22587553 [0,1,0,0,0,0|1,0,1]=3 1351 B7R0.10 CN[C@@H](C)C(=O)OC Amb22745401 [0,1,0,0,0,0|1,0,1]=3 1352 B7R0.10 CN[C@H](C)C(=O)OC Amb22587562 [0,1,0,0,0,0|1,0,1]=3 1353 B7R0.10 CN[C@H](C)C(=O)OC Amb34153346 [0,1,0,0,0,0|1,0,1]=3 1354 B7R0.10 CN\C(O)=C(/O)C#N Amb28072304 [0,1,0,0,0,0|3,0,0]=4 1355 B7R0.10 COC(=O)C(=O)CBr Amb2455971 [0,1,0,0,0,0|2,0,1]=4 1356 B7R0.10 COC(=O)C(=O)CCl Amb25929741 [0,1,0,0,0,0|2,0,1]=4 1357 B7R0.10 COC(=O)C(=O)CF Amb27464331 [0,1,0,0,0,0|2,0,1]=4 1358 B7R0.10 COC(=O)C(=O)C[S-] Amb27397384 [0,1,0,0,0,0|2,0,1]=4 1359 B7R0.10 COC(=O)C(=O)NN Amb9753505 [0,1,0,0,0,0|3,0,0]=4 1360 B7R0.10 COC(=O)C(=O)OC Amb2793071 [0,1,0,0,0,0|2,0,0]=3 1361 B7R0.10 COC(=O)C(Br)C=O Amb28385653 [0,1,0,0,0,0|2,0,1]=4 1362 B7R0.10 COC(=O)C(Br)OC Amb21964964 [0,1,0,0,0,0|2,0,1]=4 1363 B7R0.10 COC(=O)C(Br)SC Amb27484075 [0,1,0,0,0,0|2,0,1]=4 1364 B7R0.10 COC(=O)C(C)C#N Amb17210509 [0,1,0,0,0,0|1,0,2]=4 1365 B7R0.10 COC(=O)C(C)C=O Amb18641861 [0,1,0,0,0,0|1,0,1]=3 1366 B7R0.10 COC(=O)C(C)CBr Amb23440928 [0,1,0,0,0,0|1,0,2]=4 1367 B7R0.10 COC(=O)C(C)CCl Amb25890022 [0,1,0,0,0,0|1,0,2]=4 1368 B7R0.10 COC(=O)C(C)CF Amb27205725 [0,1,0,0,0,0|1,0,2]=4 1369 B7R0.10 COC(=O)C(C)CN Amb13952562 [0,1,0,0,0,0|1,0,2]=4 1370 B7R0.10 COC(=O)C(C)CN Amb9400287 [0,1,0,0,0,0|1,0,2]=4 1371 B7R0.10 COC(=O)C(C)CO Amb9277786 [0,1,0,0,0,0|1,0,2]=4 1372 B7R0.10 COC(=O)C(C)CS Amb17673607 [0,1,0,0,0,0|1,0,2]=4 1373 B7R0.10 COC(=O)C(C)NO Amb28249757 [0,1,0,0,0,0|2,0,1]=4 1374 B7R0.10 COC(=O)C(C)ON Amb28194398 [0,1,0,0,0,0|2,0,1]=4 1375 B7R0.10 COC(=O)C(C)ON Amb33483516 [0,1,0,0,0,0|2,0,1]=4 1376 B7R0.10 COC(=O)C(C)SC Amb22043309 [0,1,0,0,0,0|1,0,1]=3 1377 B7R0.10 COC(=O)C(Cl)C=O Amb17621536 [0,1,0,0,0,0|2,0,1]=4 1378 B7R0.10 COC(=O)C(Cl)OC Amb22388783 [0,1,0,0,0,0|2,0,1]=4 1379 B7R0.10 COC(=O)C(O)C=O Amb27468135 [0,1,0,0,0,0|2,0,1]=4 1380 B7R0.10 COC(=O)C(O)OC Amb17593224 [0,1,0,0,0,0|2,0,1]=4 1381 B7R0.10 COC(=O)N(C)CCl Amb25890210 [0,1,0,0,0,0|2,0,1]=4 1382 B7R0.10 COC(=O)N(C)OC Amb26498638 [0,1,0,0,0,0|2,0,0]=3 1383 B7R0.10 COC(=O)[C@@H](C)C=O Amb25107069 [0,1,0,0,0,0|1,0,1]=3 1384 B7R0.10 COC(=O)[C@@H](C)CBr Amb22225306 [0,1,0,0,0,0|1,0,2]=4 1385 B7R0.10 COC(=O)[C@@H](C)CI Amb23437667 [0,1,0,0,0,0|1,0,2]=4 1386 B7R0.10 COC(=O)[C@@H](C)CN Amb27391189 [0,1,0,0,0,0|1,0,2]=4 1387 B7R0.10 COC(=O)[C@@H](C)CN Amb35788514 [0,1,0,0,0,0|1,0,2]=4 1388 B7R0.10 COC(=O)[C@@H](C)CO Amb17615445 [0,1,0,0,0,0|1,0,2]=4 1389 B7R0.10 COC(=O)[C@@H](C)NN Amb24117928 [0,1,0,0,0,0|2,0,1]=4 1390 B7R0.10 COC(=O)[C@@H](C)OC Amb27218042 [0,1,0,0,0,0|1,0,1]=3 1391 B7R0.10 COC(=O)[C@@H](C)ON Amb27763250 [0,1,0,0,0,0|2,0,1]=4 1392 B7R0.10 COC(=O)[C@@H](C)ON Amb33620849 [0,1,0,0,0,0|2,0,1]=4 1393 B7R0.10 COC(=O)[C@H](C)C=O Amb25889345 [0,1,0,0,0,0|1,0,1]=3 1394 B7R0.10 COC(=O)[C@H](C)CBr Amb10844721 [0,1,0,0,0,0|1,0,2]=4 1395 B7R0.10 COC(=O)[C@H](C)CO Amb17615446 [0,1,0,0,0,0|1,0,2]=4 1396 B7R0.10 COC(=O)[C@H](C)OC Amb28316057 [0,1,0,0,0,0|1,0,1]=3 1397 B7R0.10 COC(=O)[C@H](C)ON Amb24439736 [0,1,0,0,0,0|2,0,1]=4 1398 B7R0.10 COC(=O)[C@H](C)ON Amb33620848 [0,1,0,0,0,0|2,0,1]=4 1399 B7R0.10 COC(=O)\C(Br)=C/Cl Amb27955826 [0,1,0,0,0,0|2,0,0]=3 1400 B7R0.10 COC(=O)\C(Br)=C\Br Amb16234173 [0,1,0,0,0,0|2,0,0]=3 1401 B7R0.10 COC(=O)\C(Br)=C\Cl Amb27818193 [0,1,0,0,0,0|2,0,0]=3 1402 B7R0.10 COC(=O)\C(C)=C/Br Amb33249840 [0,1,0,0,0,0|1,0,0]=2 1403 B7R0.10 COC(=O)\C(C)=C\Br Amb26330519 [0,1,0,0,0,0|1,0,0]=2 1404 B7R0.10 COC(=O)\C(C)=N/O Amb25889365 [0,1,0,0,0,0|2,0,0]=3 1405 B7R0.10 COC(=O)\C(C)=N\O Amb28053741 [0,1,0,0,0,0|2,0,0]=3 1406 B7R0.10 COC(=O)\C(Cl)=C/Br Amb28325703 [0,1,0,0,0,0|2,0,0]=3 1407 B7R0.10 COC(=O)\C(Cl)=C\Cl Amb28193482 [0,1,0,0,0,0|2,0,0]=3 1408 B7R0.10 COC(=O)\C(Cl)=N/O Amb24665681 [0,1,0,0,0,0|3,0,0]=4 1409 B7R0.10 COC(=O)\C(Cl)=N\O Amb22741121 [0,1,0,0,0,0|3,0,0]=4 1410 B7R0.10 COC(=O)\C(F)=C\Cl Amb27881870 [0,1,0,0,0,0|2,0,0]=3 1411 B7R0.10 COC(=O)\C(N)=N\Cl Amb27839064 [0,1,0,0,0,0|3,0,0]=4 1412 B7R0.10 COC(=O)\C(N)=N\O Amb22741276 [0,1,0,0,0,0|3,0,0]=4 1413 B7R0.10 COC(C)C(=O)C=O Amb27622168 [0,1,0,0,0,0|1,0,2]=4 1414 B7R0.10 COC(C)C(=O)NN Amb2081552 [0,1,0,0,0,0|2,0,1]=4 1415 B7R0.10 COC(C)\C(Cl)=N\O Amb28436190 [0,1,0,0,0,0|2,0,1]=4 1416 B7R0.10 COC(C)\C(N)=N\O Amb19650787 [0,1,0,0,0,0|2,0,1]=4 1417 B7R0.10 CON(C)C(=O)C=O Amb28325250 [0,1,0,0,0,0|2,0,1]=4 1418 B7R0.10 CON(C)C(=O)CBr Amb20673706 [0,1,0,0,0,0|3,0,0]=4 1419 B7R0.10 CON(C)C(=O)CCl Amb3940847 [0,1,0,0,0,0|3,0,0]=4 1420 B7R0.10 CON(C)C(=O)CF Amb27392034 [0,1,0,0,0,0|3,0,0]=4 1421 B7R0.10 CON(C)C(=O)CN Amb18282074 [0,1,0,0,0,0|3,0,0]=4 1422 B7R0.10 CON(C)C(=O)CN Amb32644535 [0,1,0,0,0,0|3,0,0]=4 1423 B7R0.10 CON(C)C(=O)NN Amb28045836 [0,1,0,0,0,0|3,0,0]=4 1424 B7R0.10 CO\C(C)=C(/N)C#N Amb27241224 [0,1,0,0,0,0|3,0,0]=4 1425 B7R0.10 CO\C(O)=C(/N)N=O Amb27472458 [0,1,0,0,0,0|3,0,0]=4 1426 B7R0.10 CSC(=O)C(=O)CF Amb27861416 [0,1,0,0,0,0|3,0,0]=4 1427 B7R0.10 CSC(C)C(=O)NN Amb28204526 [0,1,0,0,0,0|2,0,1]=4 1428 B7R0.10 CSC(C)\C(C)=N\O Amb2781500 [0,1,0,0,0,0|2,0,1]=4 1429 B7R0.10 C\C(=C/O)C(O)CO Amb27441465 [0,1,0,0,0,0|1,0,2]=4 1430 B7R0.10 C\C(=N/O)C(=O)NN Amb27769328 [0,1,0,0,0,0|3,0,0]=4 1431 B7R0.10 C\C(=N\O)C(=O)CCl Amb27256425 [0,1,0,0,0,0|3,0,0]=4 1432 B7R0.10 C\C(=N\O)C(=O)CO Amb28249683 [0,1,0,0,0,0|2,0,0]=3 1433 B7R0.10 C\C(C=O)=C(\C)C=O Amb27434822 [0,1,0,0,0,0|2,0,0]=3 1434 B7R0.10 C\C=C(/Br)C(=O)OC Amb24618775 [0,1,0,0,0,0|1,0,0]=2 1435 B7R0.10 C\C=C(/C)C(=N)NO Amb27265589 [0,1,0,0,0,0|1,0,0]=2 1436 B7R0.10 C\C=C(/C)C(=O)C#N Amb27768636 [0,1,0,0,0,0|1,0,0]=2 1437 B7R0.10 C\C=C(/C)C(=O)CBr Amb28458579 [0,1,0,0,0,0|1,0,0]=2 1438 B7R0.10 C\C=C(/C)C(=O)CC Amb28066002 [0,1,0,0,0,0|1,0,0]=2 1439 B7R0.10 C\C=C(/C)C(=O)NC Amb27838362 [0,1,0,0,0,0|1,0,0]=2 1440 B7R0.10 C\C=C(/C)C(=O)OC Amb6296120 [0,1,0,0,0,0|0,0,0]=1 1441 B7R0.10 C\C=C(/C)C(=S)NC Amb28345690 [0,1,0,0,0,0|1,1,0]=3 1442 B7R0.10 C\C=C(/C)C(C)CC Amb25989296 [0,1,0,0,0,0|2,0,1]=4 1443 B7R0.10 C\C=C(/C)C(Cl)CC Amb28343053 [0,1,0,0,0,0|2,0,1]=4 1444 B7R0.10 C\C=C(/C)[C@H](O)CC Amb28350272 [0,1,0,0,0,0|1,0,1]=3 1445 B7R0.10 C\C=C(/N)C(=O)OC Amb27438851 [0,1,0,0,0,0|1,0,0]=2 1446 B7R0.10 C\C=C(\Br)C(=O)C#N Amb28199908 [0,1,0,0,0,0|2,0,0]=3 1447 B7R0.10 C\C=C(\C)C(=O)OC Amb19930194 [0,1,0,0,0,0|0,0,0]=1 1448 B7R0.10 C\C=C(\C)[C@@H](O)C#N Amb27950880 [0,1,0,0,0,0|1,0,1]=3 1449 B7R0.10 C\C=C(\Cl)C(O)C#N Amb28074658 [0,1,0,0,0,0|2,0,1]=4 1450 B7R0.10 NNC(=O)C(=O)NO Amb27769052 [0,1,0,0,0,0|3,0,0]=4 1451 B7R0.10 O=C(CCl)\C(Cl)=C/Cl Amb27392322 [0,1,0,0,0,0|3,0,0]=4 1452 B7R0.10 O=C(CO)C(=O)CO Amb28049023 [0,1,0,0,0,0|2,0,1]=4 1453 B7R0.10 O=CC(=O)C(=O)C=O Amb28398070 [0,1,0,0,0,0|2,0,1]=4 1454 B7R0.10 O=CC(=O)\C(Cl)=C/Cl Amb27632936 [0,1,0,0,0,0|2,0,1]=4 1455 B7R0.10 [C-]#[N+]C(C)C(=O)OC Amb2688983 [0,1,0,0,0,0|1,0,2]=4 1456 B7R0.10 [C-]#[N+][C@@H](C)C(=O)OC Amb25175826 [0,1,0,0,0,0|1,0,2]=4 1457 B7R0.10 [C-]#[N+][C@H](C)C(=O)OC Amb33733575 [0,1,0,0,0,0|1,0,2]=4 1458 B7R0.13 C#CC(C)(C)C(=O)O Amb5720022 [0,1,0,0,0,0|0,0,3]=4 1459 B7R0.13 C#CC(C)(N)C(=O)O Amb23504061 [0,1,0,0,0,0|0,0,3]=4 1460 B7R0.13 C#C[C@@](C)(Cl)C(=O)O Amb27246275 [0,1,0,0,0,0|0,0,3]=4 1461 B7R0.13 C#C[C@](C)(N)C(=O)O Amb24406693 [0,1,0,0,0,0|0,0,3]=4 1462 B7R0.13 C#C[C@](C)(O)C(=O)O Amb27949299 [0,1,0,0,0,0|0,0,3]=4 1463 B7R0.13 C=CC(C)(C)C(=O)O Amb3994191 [0,1,0,0,0,0|0,0,2]=3 1464 B7R0.13 C=CC(C)(C)C(C)=O Amb17593169 [0,1,0,0,0,0|1,0,2]=4 1465 B7R0.13 C=CC(C)(N)C(=O)O Amb18641826 [0,1,0,0,0,0|0,0,2]=3 1466 B7R0.13 C=CC(C)(O)C(=O)O Amb8388580 [0,1,0,0,0,0|0,0,2]=3 1467 B7R0.13 C=CC(F)(F)C(=O)O Amb27815269 [0,1,0,0,0,0|1,0,2]=4 1468 B7R0.13 C=C[C@@](C)(N)C(=O)O Amb25970753 [0,1,0,0,0,0|0,0,2]=3 1469 B7R0.13 CC(=O)C(C)(Br)C=O Amb27257818 [0,1,0,0,0,0|2,0,1]=4 1470 B7R0.13 CC(=O)C(C)(O)C=O Amb28070984 [0,1,0,0,0,0|2,0,1]=4 1471 B7R0.13 CC(Br)(CBr)C(=O)O Amb9703187 [0,1,0,0,0,0|1,0,2]=4 1472 B7R0.13 CC(Br)(CCl)C(=O)O Amb28282621 [0,1,0,0,0,0|1,0,2]=4 1473 B7R0.13 CC(C)(C#N)C(=O)O Amb9677775 [0,1,0,0,0,0|1,0,2]=4 1474 B7R0.13 CC(C)(C=O)C(=O)O Amb25260968 [0,1,0,0,0,0|1,0,1]=3 1475 B7R0.13 CC(C)(CBr)C(=O)O Amb2613668 [0,1,0,0,0,0|1,0,2]=4 1476 B7R0.13 CC(C)(CCl)C(=O)O Amb3940361 [0,1,0,0,0,0|1,0,2]=4 1477 B7R0.13 CC(C)(CF)C(=O)O Amb22000679 [0,1,0,0,0,0|1,0,2]=4 1478 B7R0.13 CC(C)(CN)C(=O)O Amb22371031 [0,1,0,0,0,0|1,0,2]=4 1479 B7R0.13 CC(C)(CN)C(=O)O Amb8396020 [0,1,0,0,0,0|1,0,2]=4 1480 B7R0.13 CC(C)(CO)C(=O)O Amb2613656 [0,1,0,0,0,0|1,0,2]=4 1481 B7R0.13 CC(C)(ON)C(=O)O Amb18641969 [0,1,0,0,0,0|2,0,1]=4 1482 B7R0.13 CC(C)(ON)C(=O)O Amb8390774 [0,1,0,0,0,0|2,0,1]=4 1483 B7R0.13 CC(C)(O[NH3+])C(=O)O Amb22167603 [0,1,0,0,0,0|2,0,1]=4 1484 B7R0.13 CC(F)(CBr)C(=O)O Amb28121309 [0,1,0,0,0,0|1,0,2]=4 1485 B7R0.13 CC(F)(CN)C(=O)O Amb27794896 [0,1,0,0,0,0|1,0,2]=4 1486 B7R0.13 CC(N)(CF)C(=O)O Amb27435532 [0,1,0,0,0,0|1,0,2]=4 1487 B7R0.13 CC(N)(CN)C(=O)O Amb25310586 [0,1,0,0,0,0|1,0,2]=4 1488 B7R0.13 CC(N)(CN)C(=O)O Amb33550422 [0,1,0,0,0,0|1,0,2]=4 1489 B7R0.13 CC(N)(CO)C(=O)O Amb2780027 [0,1,0,0,0,0|1,0,2]=4 1490 B7R0.13 CC(N)(CO)C(=O)O Amb28934875 [0,1,0,0,0,0|1,0,2]=4 1491 B7R0.13 CC(N)(CS)C(=O)O Amb18124446 [0,1,0,0,0,0|1,0,2]=4 1492 B7R0.13 CC(N)(CS)C(=O)O Amb24480151 [0,1,0,0,0,0|1,0,2]=4 1493 B7R0.13 CC(O)(CBr)C(=O)O Amb18522184 [0,1,0,0,0,0|1,0,2]=4 1494 B7R0.13 CC(O)(CCl)C(=O)O Amb26497884 [0,1,0,0,0,0|1,0,2]=4 1495 B7R0.13 CC(O)(CO)C(=O)O Amb33544570 [0,1,0,0,0,0|1,0,2]=4 1496 B7R0.13 CCC(C)(Br)C(=O)O Amb22228657 [0,1,0,0,0,0|0,0,2]=3 1497 B7R0.13 CCC(C)(C)C(=O)Cl Amb8394880 [0,1,0,0,0,0|1,0,2]=4 1498 B7R0.13 CCC(C)(C)C(=O)O Amb4605833 [0,1,0,0,0,0|0,0,2]=3 1499 B7R0.13 CCC(C)(C)C(=O)S Amb22734427 [0,1,0,0,0,0|0,1,2]=4 1500 B7R0.13 CCC(C)(C)C(C)=O Amb2687561 [0,1,0,0,0,0|1,0,2]=4 1501 B7R0.13 CCC(C)(C)C(N)=O Amb3886539 [0,1,0,0,0,0|1,0,2]=4 1502 B7R0.13 CCC(C)(Cl)C(=O)O Amb25730682 [0,1,0,0,0,0|0,0,2]=3 1503 B7R0.13 CCC(C)(Cl)C(N)=O Amb28075797 [0,1,0,0,0,0|1,0,2]=4 1504 B7R0.13 CCC(C)(N)C(=O)O Amb28934789 [0,1,0,0,0,0|0,0,2]=3 1505 B7R0.13 CCC(C)(N)C(=O)O Amb9728371 [0,1,0,0,0,0|0,0,2]=3 1506 B7R0.13 CCC(C)(N)C(N)=O Amb13952193 [0,1,0,0,0,0|1,0,2]=4 1507 B7R0.13 CCC(C)(N)C(N)=O Amb18949646 [0,1,0,0,0,0|1,0,2]=4 1508 B7R0.13 CCC(C)(O)C(=O)Cl Amb28042052 [0,1,0,0,0,0|1,0,2]=4 1509 B7R0.13 CCC(C)(O)C(=O)O Amb2609046 [0,1,0,0,0,0|0,0,2]=3 1510 B7R0.13 CCC(C)(O)C(C)=O Amb17593200 [0,1,0,0,0,0|1,0,2]=4 1511 B7R0.13 CCC(C)(O)C(N)=O Amb24116738 [0,1,0,0,0,0|1,0,2]=4 1512 B7R0.13 CCC(Cl)(Cl)C(=O)O Amb25274946 [0,1,0,0,0,0|1,0,2]=4 1513 B7R0.13 CCC(F)(F)C(=O)O Amb10982488 [0,1,0,0,0,0|1,0,2]=4 1514 B7R0.13 CCC(N)(S)C(=O)O Amb27229859 [0,1,0,0,0,0|1,0,2]=4 1515 B7R0.13 CCC(O)(O)C(=O)O Amb28428544 [0,1,0,0,0,0|1,0,2]=4 1516 B7R0.13 CC[C@@](C)(Cl)C(=O)O Amb27391076 [0,1,0,0,0,0|0,0,2]=3 1517 B7R0.13 CC[C@@](C)(N)C(=O)O Amb8515205 [0,1,0,0,0,0|0,0,2]=3 1518 B7R0.13 CC[C@@](C)(O)C(C)=O Amb24481445 [0,1,0,0,0,0|1,0,2]=4 1519 B7R0.13 CC[C@](C)(N)C(=O)O Amb16183896 [0,1,0,0,0,0|0,0,2]=3 1520 B7R0.13 CC[C@](C)(N)C(=O)O Amb33871585 [0,1,0,0,0,0|0,0,2]=3 1521 B7R0.13 CC[C@](C)(N)C(N)=O Amb27838327 [0,1,0,0,0,0|1,0,2]=4 1522 B7R0.13 CC[C@](C)(O)C(C)=O Amb27860292 [0,1,0,0,0,0|1,0,2]=4 1523 B7R0.13 CC[C@](C)(O)C(N)=O Amb27258058 [0,1,0,0,0,0|1,0,2]=4 1524 B7R0.13 CC[C@](N)(O)C(=O)O Amb28398612 [0,1,0,0,0,0|1,0,2]=4 1525 B7R0.13 CNC(C)(C)C(=O)O Amb30625191 [0,1,0,0,0,0|1,0,1]=3 1526 B7R0.13 CNC(C)(C)C(=O)O Amb4037017 [0,1,0,0,0,0|1,0,1]=3 1527 B7R0.13 CNC(C)(C)C(N)=O Amb18950551 [0,1,0,0,0,0|2,0,1]=4 1528 B7R0.13 CNC(C)(C)C(N)=O Amb33551780 [0,1,0,0,0,0|2,0,1]=4 1529 B7R0.13 COC(C)(C)C(=O)Cl Amb27421286 [0,1,0,0,0,0|2,0,1]=4 1530 B7R0.13 COC(C)(C)C(=O)O Amb7089070 [0,1,0,0,0,0|1,0,1]=3 1531 B7R0.13 COC(C)(C)C(C)=O Amb22169707 [0,1,0,0,0,0|2,0,1]=4 1532 B7R0.13 COC(C)(C)C(N)=O Amb27424664 [0,1,0,0,0,0|2,0,1]=4 1533 B7R0.13 COC(C)(Cl)C(C)=O Amb28321969 [0,1,0,0,0,0|2,0,1]=4 1534 B7R0.13 CSC(C)(C)C(=O)O Amb17501488 [0,1,0,0,0,0|1,0,1]=3 1535 B7R0.13 CSC(Cl)(Cl)C(=O)O Amb27835442 [0,1,0,0,0,0|2,0,1]=4 1536 B7R0.13 CSC(F)(F)C(=O)O Amb23586472 [0,1,0,0,0,0|2,0,1]=4 1537 B7R0.13 C[C@@](F)(CN)C(=O)O Amb27880722 [0,1,0,0,0,0|1,0,2]=4 1538 B7R0.13 C[C@@](N)(CO)C(=O)O Amb8515082 [0,1,0,0,0,0|1,0,2]=4 1539 B7R0.13 C[C@@](N)(CS)C(=O)O Amb16183893 [0,1,0,0,0,0|1,0,2]=4 1540 B7R0.13 C[C@@](N)(CS)C(=O)O Amb22757501 [0,1,0,0,0,0|1,0,2]=4 1541 B7R0.13 C[C@@](O)(CBr)C(=O)O Amb17610012 [0,1,0,0,0,0|1,0,2]=4 1542 B7R0.13 C[C@](N)(CN)C(=O)O Amb25690446 [0,1,0,0,0,0|1,0,2]=4 1543 B7R0.13 C[C@](N)(CO)C(=O)O Amb8515081 [0,1,0,0,0,0|1,0,2]=4 1544 B7R0.13 C[C@](O)(CBr)C(=O)O Amb22224875 [0,1,0,0,0,0|1,0,2]=4 1545 B7R0.13 C[C@](O)(CN)C(=O)O Amb27440648 [0,1,0,0,0,0|1,0,2]=4 1546 B7R0.13 C[C@](S)(CN)C(=O)O Amb27489167 [0,1,0,0,0,0|1,0,2]=4 1547 B7R0.14 CCC(C)S(=O)(=O)O Amb22372234 [0,1,0,0,0,0|1,0,2]=4 1548 B7R0.14 COC(=O)P(=O)(O)O Amb22388745 [0,1,0,0,0,0|3,0,0]=4 1549 B7R0.14 C\C(=C\Cl)S(C)(=O)=O Amb28285096 [0,1,0,0,0,0|2,0,1]=4 1550 B7R0.14 C\C=C(/C)C(C)(C)C Amb4019537 [0,1,0,0,0,0|2,0,1]=4 1551 B7R0.14 C\C=C(/C)[B-](F)(F)F Amb27244992 [0,1,0,0,0,0|3,0,0]=4 1552 B7R0.14 C\C=C(\C)C(C)(C)C Amb22734766 [0,1,0,0,0,0|2,0,1]=4 1553 B7R0.14 C\C=C(\C)[B-](F)(F)F Amb27653471 [0,1,0,0,0,0|3,0,0]=4 1554 B7R0.15 C=CC(C=C)C(=O)O Amb27663214 [0,1,0,0,0,0|0,0,3]=4 1555 B7R0.15 C=CC(CC)C(=O)O Amb28119400 [0,1,0,0,0,0|0,0,2]=3 1556 B7R0.15 C=CC(CC)C(C)=O Amb28315864 [0,1,0,0,0,0|1,0,2]=4 1557 B7R0.15 C=C\C(=C/Cl)[PH](=O)O Amb27235387 [0,1,0,0,0,0|1,0,2]=4 1558 B7R0.15 CC(=O)\C(=C\O)CBr Amb27165668 [0,1,0,0,0,0|2,0,0]=3 1559 B7R0.15 CC(=O)\C(C=O)=N\N Amb26943899 [0,1,0,0,0,0|3,0,0]=4 1560 B7R0.15 CC(=O)\C(C=O)=N\O Amb27848201 [0,1,0,0,0,0|3,0,0]=4 1561 B7R0.15 CC(=O)\C(CCl)=N/O Amb28315687 [0,1,0,0,0,0|3,0,0]=4 1562 B7R0.15 CC(=O)\C(CCl)=N\O Amb26041025 [0,1,0,0,0,0|3,0,0]=4 1563 B7R0.15 CCC(=C=O)C(=O)Cl Amb27668810 [0,1,0,0,0,0|1,0,2]=4 1564 B7R0.15 CCC(C#N)C(=O)O Amb17210513 [0,1,0,0,0,0|0,0,3]=4 1565 B7R0.15 CCC(C=O)C(=O)O Amb28410235 [0,1,0,0,0,0|1,0,1]=3 1566 B7R0.15 CCC(CBr)=C(C)C Amb27476236 [0,1,0,0,0,0|2,0,1]=4 1567 B7R0.15 CCC(CC)=C(C)C Amb4019512 [0,1,0,0,0,0|2,0,1]=4 1568 B7R0.15 CCC(CC)C(=O)Cl Amb3939475 [0,1,0,0,0,0|1,0,2]=4 1569 B7R0.15 CCC(CC)C(=O)O Amb4605826 [0,1,0,0,0,0|0,0,2]=3 1570 B7R0.15 CCC(CC)C(=O)[O-] Amb22585838 [0,1,0,0,0,0|0,0,3]=4 1571 B7R0.15 CCC(CC)C(C)=O Amb33536259 [0,1,0,0,0,0|1,0,2]=4 1572 B7R0.15 CCC(CC)C(N)=O Amb33550498 [0,1,0,0,0,0|1,0,2]=4 1573 B7R0.15 CCC(CCl)C(=O)Cl Amb28421936 [0,1,0,0,0,0|1,0,2]=4 1574 B7R0.15 CCC(CCl)C(=O)O Amb27424156 [0,1,0,0,0,0|0,0,2]=3 1575 B7R0.15 CCC(CF)C(=O)O Amb27625346 [0,1,0,0,0,0|0,0,2]=3 1576 B7R0.15 CCC(CN)C(=O)O Amb18987934 [0,1,0,0,0,0|0,0,2]=3 1577 B7R0.15 CCC(CN)C(=O)O Amb19514932 [0,1,0,0,0,0|0,0,2]=3 1578 B7R0.15 CCC(CN)C(N)=O Amb18294192 [0,1,0,0,0,0|1,0,2]=4 1579 B7R0.15 CCC(CO)C(=O)O Amb18641947 [0,1,0,0,0,0|0,0,2]=3 1580 B7R0.15 CCC(CO)C(=O)[O-] Amb28934895 [0,1,0,0,0,0|0,0,3]=4 1581 B7R0.15 CCC(CO)C(N)=O Amb28314312 [0,1,0,0,0,0|1,0,2]=4 1582 B7R0.15 CCC(NC)C(=O)O Amb10610245 [0,1,0,0,0,0|0,0,2]=3 1583 B7R0.15 CCC(NC)C(=O)O Amb9619833 [0,1,0,0,0,0|0,0,2]=3 1584 B7R0.15 CCC(NC)C(C)=O Amb28049011 [0,1,0,0,0,0|1,0,2]=4 1585 B7R0.15 CCC(NC)C(N)=O Amb15701261 [0,1,0,0,0,0|1,0,2]=4 1586 B7R0.15 CCC(NCl)C(=O)O Amb28387574 [0,1,0,0,0,0|1,0,2]=4 1587 B7R0.15 CCC(NN)C(=O)O Amb18641955 [0,1,0,0,0,0|1,0,2]=4 1588 B7R0.15 CCC(NO)C(=O)O Amb4019788 [0,1,0,0,0,0|1,0,2]=4 1589 B7R0.15 CCC(OC)C(=O)O Amb8472685 [0,1,0,0,0,0|0,0,2]=3 1590 B7R0.15 CCC(OC)C(C)=O Amb26004835 [0,1,0,0,0,0|1,0,2]=4 1591 B7R0.15 CCC(OC)C(N)=O Amb2027289 [0,1,0,0,0,0|1,0,2]=4 1592 B7R0.15 CCC(SC)C(=O)O Amb17501348 [0,1,0,0,0,0|0,0,2]=3 1593 B7R0.15 CCC(SC)C(C)=O Amb28460748 [0,1,0,0,0,0|1,0,2]=4 1594 B7R0.15 CCN(CC)C(=O)Cl Amb6608946 [0,1,0,0,0,0|2,0,1]=4 1595 B7R0.15 CCN(CC)C(C)=O Amb3358092 [0,1,0,0,0,0|2,0,1]=4 1596 B7R0.15 CCN(CC)C(N)=O Amb1128168 [0,1,0,0,0,0|2,0,1]=4 1597 B7R0.15 CCN(CC)C(O)=S Amb24698748 [0,1,0,0,0,0|1,1,1]=4 1598 B7R0.15 CCN(CCl)C(C)=O Amb27253146 [0,1,0,0,0,0|2,0,1]=4 1599 B7R0.15 CCN(OC)C(C)=O Amb28206794 [0,1,0,0,0,0|2,0,1]=4 1600 B7R0.15 CC[C@@H](CN)C(=O)O Amb27838297 [0,1,0,0,0,0|0,0,2]=3 1601 B7R0.15 CC[C@@H](CO)C(=O)O Amb22745321 [0,1,0,0,0,0|0,0,2]=3 1602 B7R0.15 CC[C@@H](NC)C(=O)O Amb28315876 [0,1,0,0,0,0|0,0,2]=3 1603 B7R0.15 CC[C@H](CN)C(=O)O Amb25790771 [0,1,0,0,0,0|0,0,2]=3 1604 B7R0.15 CC[C@H](CO)C(=O)O Amb16232065 [0,1,0,0,0,0|0,0,2]=3 1605 B7R0.15 CC[C@H](NC)C(=O)O Amb24505225 [0,1,0,0,0,0|0,0,2]=3 1606 B7R0.15 CC[C@H](NCl)C(=O)O Amb28193501 [0,1,0,0,0,0|1,0,2]=4 1607 B7R0.15 CC[C@H](NN)C(=O)O Amb28289412 [0,1,0,0,0,0|1,0,2]=4 1608 B7R0.15 CC[C@H](OC)C(C)=O Amb27243431 [0,1,0,0,0,0|1,0,2]=4 1609 B7R0.15 CC\C(=N/O)C(N)=O Amb27814540 [0,1,0,0,0,0|2,0,1]=4 1610 B7R0.15 CC\C(=N\O)C(C)=O Amb28198610 [0,1,0,0,0,0|2,0,1]=4 1611 B7R0.15 CC\C(C=O)=C(/C)Cl Amb27598544 [0,1,0,0,0,0|3,0,0]=4 1612 B7R0.15 CNC(CN)C(=O)O Amb23515020 [0,1,0,0,0,0|1,0,1]=3 1613 B7R0.15 CNC(CN)C(=O)O Amb28934876 [0,1,0,0,0,0|1,0,1]=3 1614 B7R0.15 CNC(CO)C(=O)O Amb26068513 [0,1,0,0,0,0|1,0,1]=3 1615 B7R0.15 CNC(CO)C(N)=O Amb18641957 [0,1,0,0,0,0|2,0,1]=4 1616 B7R0.15 CNC(CS)C(=O)O Amb2781760 [0,1,0,0,0,0|1,0,1]=3 1617 B7R0.15 CN[C@@H](CO)C(=O)O Amb16183860 [0,1,0,0,0,0|1,0,1]=3 1618 B7R0.15 CN[C@@H](CO)C(C)=O Amb26476298 [0,1,0,0,0,0|2,0,1]=4 1619 B7R0.15 CN[C@@H](CS)C(=O)O Amb27630049 [0,1,0,0,0,0|1,0,1]=3 1620 B7R0.15 CN[C@@H](CS)C(=O)O Amb33875997 [0,1,0,0,0,0|1,0,1]=3 1621 B7R0.15 CN[C@H](CO)C(=O)O Amb26948665 [0,1,0,0,0,0|1,0,1]=3 1622 B7R0.15 CN\C(CO)=C(\C)O Amb25210013 [0,1,0,0,0,0|2,0,0]=3 1623 B7R0.15 COC(CCl)C(=O)Cl Amb27404499 [0,1,0,0,0,0|2,0,1]=4 1624 B7R0.15 COC(CN)C(=O)O Amb22059584 [0,1,0,0,0,0|1,0,1]=3 1625 B7R0.15 COC(CN)C(=O)O Amb24271092 [0,1,0,0,0,0|1,0,1]=3 1626 B7R0.15 COC(OC)=C(C)C Amb28316141 [0,1,0,0,0,0|3,0,0]=4 1627 B7R0.15 COC(OC)C(=O)O Amb26446254 [0,1,0,0,0,0|1,0,1]=3 1628 B7R0.15 COC(OC)C(C)=O Amb6608846 [0,1,0,0,0,0|2,0,1]=4 1629 B7R0.15 COC(OC)C(N)=O Amb341268 [0,1,0,0,0,0|2,0,1]=4 1630 B7R0.15 CON(C=O)C(N)=O Amb27838331 [0,1,0,0,0,0|3,0,0]=4 1631 B7R0.15 CON(OC)C(N)=O Amb27596052 [0,1,0,0,0,0|3,0,0]=4 1632 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679591 [0,1,0,0,0,0|1,0,1]=3 1633 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679853 [0,1,0,0,0,0|1,0,1]=3 1634 B7R0.15 CO[C@@H](CO)C(=O)O Amb27409917 [0,1,0,0,0,0|1,0,1]=3 1635 B7R0.15 CO\C(C=O)=C(\C)Cl Amb28455196 [0,1,0,0,0,0|3,0,0]=4 1636 B7R0.15 CSC(C=O)C(=O)O Amb27399075 [0,1,0,0,0,0|1,0,1]=3 1637 B7R0.15 CSC(CCl)C(=O)O Amb24526774 [0,1,0,0,0,0|1,0,1]=3 1638 B7R0.15 CSC(CN)C(=O)O Amb28346880 [0,1,0,0,0,0|1,0,1]=3 1639 B7R0.15 CSC(SC)C(=O)O Amb28245282 [0,1,0,0,0,0|1,0,1]=3 1640 B7R0.15 CS\C(=C\O)C(C)=O Amb27974462 [0,1,0,0,0,0|2,0,0]=3 1641 B7R0.15 CS\C(=N/O)C(C)=O Amb27854932 [0,1,0,0,0,0|3,0,0]=4 1642 B7R0.15 C\C(O)=C(/C=O)CBr Amb27215400 [0,1,0,0,0,0|2,0,0]=3 1643 B7R0.15 C\C=C(/C#N)C(=O)O Amb27204254 [0,1,0,0,0,0|0,0,1]=2 1644 B7R0.15 C\C=C(/CBr)C(=O)O Amb18128301 [0,1,0,0,0,0|0,0,0]=1 1645 B7R0.15 C\C=C(/CC)C(=O)O Amb18641780 [0,1,0,0,0,0|0,0,0]=1 1646 B7R0.15 C\C=C(/CC)C(C)=O Amb27243013 [0,1,0,0,0,0|1,0,0]=2 1647 B7R0.15 C\C=C(/CC)C(C)C Amb24581918 [0,1,0,0,0,0|2,0,1]=4 1648 B7R0.15 C\C=C(/OC)C(C)=O Amb26917540 [0,1,0,0,0,0|1,0,0]=2 1649 B7R0.15 C\C=C(\C#N)C(N)=O Amb27655121 [0,1,0,0,0,0|1,0,1]=3 1650 B7R0.15 C\C=C(\C#N)C(N)=S Amb27259062 [0,1,0,0,0,0|1,1,1]=4 1651 B7R0.15 C\C=C(\CBr)C(=O)Cl Amb27243656 [0,1,0,0,0,0|1,0,0]=2 1652 B7R0.15 C\C=C(\CC)C(=N)N Amb27461004 [0,1,0,0,0,0|2,0,0]=3 1653 B7R0.15 C\C=C(\CO)C(=O)O Amb25306747 [0,1,0,0,0,0|0,0,0]=1 1654 B7R0.15 C\N=C(/NC)C(=O)O Amb28349086 [0,1,0,0,0,0|1,0,0]=2 1655 B7R0.15 C\N=C(/NC)C(C)O Amb27402325 [0,1,0,0,0,0|2,0,1]=4 1656 B7R0.15 C\N=C(/NC)S(=O)O Amb28189785 [0,1,0,0,0,0|2,0,0]=3 1657 B7R0.15 N#CC(=[N+]=[N-])C(=O)O Amb27228188 [0,1,0,0,0,0|2,0,1]=4 1658 B7R0.15 N#CC(CO)C(=O)O Amb27246245 [0,1,0,0,0,0|1,0,2]=4 1659 B7R0.15 N#C\C(=C/N)C(N)=O Amb17593144 [0,1,0,0,0,0|2,0,1]=4 1660 B7R0.15 N#C\C(=C/O)C(N)=O Amb27252623 [0,1,0,0,0,0|2,0,1]=4 1661 B7R0.15 N#C\C(=C\N)C(N)=O Amb28144958 [0,1,0,0,0,0|2,0,1]=4 1662 B7R0.15 N#C\C(=N/O)C(=O)O Amb26018397 [0,1,0,0,0,0|2,0,1]=4 1663 B7R0.15 NCC(CF)C(=O)O Amb26995116 [0,1,0,0,0,0|1,0,2]=4 1664 B7R0.15 NC[C@H](CO)C(=O)O Amb26873333 [0,1,0,0,0,0|1,0,2]=4 1665 B7R0.15 NNC(CO)C(=O)O Amb27595622 [0,1,0,0,0,0|2,0,1]=4 1666 B7R0.15 NNC(CS)C(=O)O Amb24117863 [0,1,0,0,0,0|2,0,1]=4 1667 B7R0.15 NNC(CS)C(=O)O Amb27834344 [0,1,0,0,0,0|2,0,1]=4 1668 B7R0.15 NOC(CO)C(=O)O Amb27173883 [0,1,0,0,0,0|2,0,1]=4 1669 B7R0.15 O=C(O)C(CBr)CBr Amb2778682 [0,1,0,0,0,0|1,0,2]=4 1670 B7R0.15 O=C(O)C(CI)CI Amb17779784 [0,1,0,0,0,0|1,0,2]=4 1671 B7R0.15 O=C(O)C(CO)NCl Amb28120918 [0,1,0,0,0,0|2,0,1]=4 1672 B7R0.15 O=C(O)C(CS)CS Amb26600542 [0,1,0,0,0,0|1,0,2]=4 1673 B7R0.15 O=C(O)[C@H](CS)NS Amb27750416 [0,1,0,0,0,0|2,0,1]=4 1674 B7R0.15 O=C([O-])\C(CO)=N\O Amb27432170 [0,1,0,0,0,0|2,0,1]=4 1675 B7R0.16 C=C(Br)C(N)C(=O)O Amb28193255 [0,1,0,0,0,0|1,0,2]=4 1676 B7R0.16 C=C(C(=O)O)C(=O)Cl Amb28056536 [0,1,0,0,0,0|1,0,1]=3 1677 B7R0.16 C=C(C(=O)O)C(C)C Amb17593189 [0,1,0,0,0,0|0,0,2]=3 1678 B7R0.16 C=C(C(=O)O)C(C)N Amb27794714 [0,1,0,0,0,0|0,0,2]=3 1679 B7R0.16 C=C(C(=O)O)C(F)F Amb24117234 [0,1,0,0,0,0|1,0,2]=4 1680 B7R0.16 C=C(C(=O)O)N(C)C Amb27162682 [0,1,0,0,0,0|1,0,1]=3 1681 B7R0.16 C=C(C(=O)O)[C@@H](C)N Amb27440248 [0,1,0,0,0,0|0,0,2]=3 1682 B7R0.16 C=C(C(=O)O)[C@H](C)O Amb27410183 [0,1,0,0,0,0|0,0,2]=3 1683 B7R0.16 C=C(C(C)=O)C(C)=O Amb27424014 [0,1,0,0,0,0|1,0,1]=3 1684 B7R0.16 C=C(C(C)=O)C(N)=O Amb27814821 [0,1,0,0,0,0|1,0,1]=3 1685 B7R0.16 C=C(C(C)=O)[C@@H](C)O Amb26964906 [0,1,0,0,0,0|1,0,2]=4 1686 B7R0.16 C=C(C(C)=O)[C@H](C)O Amb27424236 [0,1,0,0,0,0|1,0,2]=4 1687 B7R0.16 C=C(C(C)=O)[N+](=O)[O-] Amb28350563 [0,1,0,0,0,0|1,0,2]=4 1688 B7R0.16 C=C(C(N)=O)C(N)=O Amb27874113 [0,1,0,0,0,0|2,0,1]=4 1689 B7R0.16 C=C(C)C(=C)C(=O)O Amb33199524 [0,1,0,0,0,0|0,0,1]=2 1690 B7R0.16 C=C(C)C(Br)=C(C)C Amb28284189 [0,1,0,0,0,0|3,0,0]=4 1691 B7R0.16 C=C(C)C(C)C(=O)O Amb18641781 [0,1,0,0,0,0|0,0,1]=2 1692 B7R0.16 C=C(C)C(C)C(C)O Amb28045615 [0,1,0,0,0,0|1,0,2]=4 1693 B7R0.16 C=C(C)C(C)C(N)=O Amb26327976 [0,1,0,0,0,0|1,0,1]=3 1694 B7R0.16 C=C(C)C(Cl)C(C)=O Amb27633869 [0,1,0,0,0,0|2,0,1]=4 1695 B7R0.16 C=C(C)C(N)C(=C)O Amb27762325 [0,1,0,0,0,0|2,0,1]=4 1696 B7R0.16 C=C(C)C(N)C(=O)O Amb18641831 [0,1,0,0,0,0|1,0,1]=3 1697 B7R0.16 C=C(C)C(O)C(=O)O Amb27859701 [0,1,0,0,0,0|1,0,1]=3 1698 B7R0.16 C=C(C)C(O)C(N)=O Amb28123135 [0,1,0,0,0,0|2,0,1]=4 1699 B7R0.16 C=C(C)[C@@H](N)C(=O)O Amb26012631 [0,1,0,0,0,0|1,0,1]=3 1700 B7R0.16 C=C(C)[C@@H](O)C(=O)O Amb28071409 [0,1,0,0,0,0|1,0,1]=3 1701 B7R0.16 CC(=N)C(C)C(C)=O Amb28315572 [0,1,0,0,0,0|1,0,1]=3 1702 B7R0.16 CC(=O)C(=O)C(=O)O Amb24101563 [0,1,0,0,0,0|1,0,0]=2 1703 B7R0.16 CC(=O)C(=O)C(C)=O Amb17593178 [0,1,0,0,0,0|2,0,0]=3 1704 B7R0.16 CC(=O)C(=O)C(C)Br Amb24055325 [0,1,0,0,0,0|2,0,1]=4 1705 B7R0.16 CC(=O)C(=O)C(C)C Amb26614542 [0,1,0,0,0,0|2,0,1]=4 1706 B7R0.16 CC(=O)C(=O)N(C)C Amb17399799 [0,1,0,0,0,0|3,0,0]=4 1707 B7R0.16 CC(=O)C(=S)C(C)=O Amb24588939 [0,1,0,0,0,0|2,0,0]=3 1708 B7R0.16 CC(=O)C(=S)N(C)C Amb27409555 [0,1,0,0,0,0|3,0,0]=4 1709 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [0,1,0,0,0,0|2,0,1]=4 1710 B7R0.16 CC(=O)C(C)=C(C)C Amb17593162 [0,1,0,0,0,0|1,0,0]=2 1711 B7R0.16 CC(=O)C(C)C(=O)Cl Amb27971652 [0,1,0,0,0,0|1,0,1]=3 1712 B7R0.16 CC(=O)C(C)C(=S)S Amb27261425 [0,1,0,0,0,0|0,2,1]=4 1713 B7R0.16 CC(=O)C(C)C(C)=O Amb1152249 [0,1,0,0,0,0|1,0,1]=3 1714 B7R0.16 CC(=O)C(C)C(C)O Amb17593202 [0,1,0,0,0,0|1,0,2]=4 1715 B7R0.16 CC(=O)C(C)[C@@H](C)O Amb28316228 [0,1,0,0,0,0|1,0,2]=4 1716 B7R0.16 CC(=O)C(Cl)=C(C)C Amb28048939 [0,1,0,0,0,0|2,0,0]=3 1717 B7R0.16 CC(=O)C(Cl)C(C)=O Amb3940505 [0,1,0,0,0,0|2,0,1]=4 1718 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [0,1,0,0,0,0|1,0,1]=3 1719 B7R0.16 CC(=O)C(N)C(C)=O Amb18632931 [0,1,0,0,0,0|2,0,1]=4 1720 B7R0.16 CC(=O)C(N)C(C)=O Amb6893881 [0,1,0,0,0,0|2,0,1]=4 1721 B7R0.16 CC(=O)C(O)C(C)=O Amb28048968 [0,1,0,0,0,0|2,0,1]=4 1722 B7R0.16 CC(=O)N(C)C(=O)Cl Amb33338974 [0,1,0,0,0,0|2,0,0]=3 1723 B7R0.16 CC(=O)N(C)C(C)=O Amb2720846 [0,1,0,0,0,0|2,0,0]=3 1724 B7R0.16 CC(=O)N(C)C(C)C Amb28435200 [0,1,0,0,0,0|2,0,1]=4 1725 B7R0.16 CC(=O)N(O)C(C)=O Amb22750106 [0,1,0,0,0,0|3,0,0]=4 1726 B7R0.16 CC(=O)[C@@H](C)[C@@H](C)Cl Amb28325873 [0,1,0,0,0,0|1,0,2]=4 1727 B7R0.16 CC(=O)[C@@H](C)[C@H](C)O Amb26966954 [0,1,0,0,0,0|1,0,2]=4 1728 B7R0.16 CC(=O)[C@H](C)C(C)C Amb24753185 [0,1,0,0,0,0|1,0,2]=4 1729 B7R0.16 CC(=O)[C@H](C)[C@H](C)O Amb28249967 [0,1,0,0,0,0|1,0,2]=4 1730 B7R0.16 CC(=O)\C(C)=C(/C)N Amb25232464 [0,1,0,0,0,0|1,0,0]=2 1731 B7R0.16 CC(=O)\C(C)=C(\C)Br Amb27265798 [0,1,0,0,0,0|1,0,0]=2 1732 B7R0.16 CC(=O)\C(C)=C(\C)N Amb28316241 [0,1,0,0,0,0|1,0,0]=2 1733 B7R0.16 CC(=O)\C(F)=C(/C)F Amb27798095 [0,1,0,0,0,0|2,0,0]=3 1734 B7R0.16 CC(=O)\C(F)=C(/C)O Amb28384212 [0,1,0,0,0,0|2,0,0]=3 1735 B7R0.16 CC(=O)\C(F)=C(\C)F Amb24645401 [0,1,0,0,0,0|2,0,0]=3 1736 B7R0.16 CC(=O)\C(N)=C(/C)O Amb26452525 [0,1,0,0,0,0|2,0,0]=3 1737 B7R0.16 CC(=S)C(S)C(=O)O Amb27791825 [0,1,0,0,0,0|1,0,1]=3 1738 B7R0.16 CC(Br)C(=O)C(=O)O Amb23400913 [0,1,0,0,0,0|1,0,1]=3 1739 B7R0.16 CC(Br)C(Br)C(=O)O Amb4008645 [0,1,0,0,0,0|1,0,2]=4 1740 B7R0.16 CC(C(=O)O)C(=O)O Amb6600127 [0,1,0,0,0,0|1,0,1]=3 1741 B7R0.16 CC(C(=O)O)N(C)C Amb21955631 [0,1,0,0,0,0|1,0,1]=3 1742 B7R0.16 CC(C(=O)O)N(C)C Amb6653762 [0,1,0,0,0,0|1,0,1]=3 1743 B7R0.16 CC(C(=O)O)N(C)N Amb22372039 [0,1,0,0,0,0|1,0,1]=3 1744 B7R0.16 CC(C(=O)[O-])[C@H](C)O Amb27835918 [0,1,0,0,0,0|0,0,3]=4 1745 B7R0.16 CC(C(N)=O)C(=O)O Amb27401562 [0,1,0,0,0,0|1,0,1]=3 1746 B7R0.16 CC(C(N)=O)C(N)=O Amb4034611 [0,1,0,0,0,0|2,0,1]=4 1747 B7R0.16 CC(C)=C(Br)C(=O)O Amb17594579 [0,1,0,0,0,0|1,0,0]=2 1748 B7R0.16 CC(C)=C(C)B(O)O Amb21963206 [0,1,0,0,0,0|1,0,1]=3 1749 B7R0.16 CC(C)=C(C)C(=O)O Amb17593186 [0,1,0,0,0,0|0,0,0]=1 1750 B7R0.16 CC(C)=C(C)C(C)Br Amb27400438 [0,1,0,0,0,0|2,0,1]=4 1751 B7R0.16 CC(C)=C(C)C(C)C Amb22347879 [0,1,0,0,0,0|2,0,1]=4 1752 B7R0.16 CC(C)=C(Cl)C(=O)O Amb18642954 [0,1,0,0,0,0|1,0,0]=2 1753 B7R0.16 CC(C)=C(F)C(=O)O Amb20669103 [0,1,0,0,0,0|1,0,0]=2 1754 B7R0.16 CC(C)C(=N)C(=O)O Amb28073845 [0,1,0,0,0,0|1,0,1]=3 1755 B7R0.16 CC(C)C(=O)C(=O)Cl Amb27843357 [0,1,0,0,0,0|2,0,1]=4 1756 B7R0.16 CC(C)C(=O)C(=O)O Amb6600000 [0,1,0,0,0,0|1,0,1]=3 1757 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8393075 [0,1,0,0,0,0|1,0,2]=4 1758 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8513875 [0,1,0,0,0,0|1,0,2]=4 1759 B7R0.16 CC(C)C(=O)C(N)=O Amb28119959 [0,1,0,0,0,0|2,0,1]=4 1760 B7R0.16 CC(C)C(Br)C(=O)O Amb9703217 [0,1,0,0,0,0|1,0,2]=4 1761 B7R0.16 CC(C)C(C)C(=O)Cl Amb27645335 [0,1,0,0,0,0|1,0,2]=4 1762 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [0,1,0,0,0,0|0,0,2]=3 1763 B7R0.16 CC(C)C(Cl)C(=O)O Amb6739911 [0,1,0,0,0,0|1,0,2]=4 1764 B7R0.16 CC(C)C(F)C(=O)O Amb19957386 [0,1,0,0,0,0|1,0,2]=4 1765 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [0,1,0,0,0,0|1,0,2]=4 1766 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [0,1,0,0,0,0|1,0,2]=4 1767 B7R0.16 CC(C)C(S)C(=O)O Amb18282761 [0,1,0,0,0,0|1,0,2]=4 1768 B7R0.16 CC(C)N(C)C(=O)Cl Amb25807313 [0,1,0,0,0,0|2,0,1]=4 1769 B7R0.16 CC(C)[C@@H](Br)C(=O)O Amb8629113 [0,1,0,0,0,0|1,0,2]=4 1770 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [0,1,0,0,0,0|0,0,2]=3 1771 B7R0.16 CC(C)[C@@H](C)C(N)=O Amb27838382 [0,1,0,0,0,0|1,0,2]=4 1772 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [0,1,0,0,0,0|1,0,2]=4 1773 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [0,1,0,0,0,0|1,0,2]=4 1774 B7R0.16 CC(C)[C@H](Br)C(=O)O Amb8629114 [0,1,0,0,0,0|1,0,2]=4 1775 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [0,1,0,0,0,0|0,0,2]=3 1776 B7R0.16 CC(C)[C@H](C)C(N)=O Amb28345619 [0,1,0,0,0,0|1,0,2]=4 1777 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [0,1,0,0,0,0|1,0,2]=4 1778 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [0,1,0,0,0,0|1,0,2]=4 1779 B7R0.16 CC(Cl)C(C)C(=O)O Amb28325096 [0,1,0,0,0,0|0,0,2]=3 1780 B7R0.16 CC(Cl)C(Cl)C(=O)O Amb28396619 [0,1,0,0,0,0|1,0,2]=4 1781 B7R0.16 CC(Cl)N(C)C(=O)Cl Amb27656929 [0,1,0,0,0,0|2,0,1]=4 1782 B7R0.16 CC(F)C(=O)C(=O)O Amb27246511 [0,1,0,0,0,0|1,0,1]=3 1783 B7R0.16 CC(F)C(N)C(=O)O Amb10838661 [0,1,0,0,0,0|1,0,2]=4 1784 B7R0.16 CC(F)C(N)C(=O)O Amb32752736 [0,1,0,0,0,0|1,0,2]=4 1785 B7R0.16 CC(F)[C@@H](N)C(=O)O Amb28316197 [0,1,0,0,0,0|1,0,2]=4 1786 B7R0.16 CC(N)C(C)C(=O)O Amb18124261 [0,1,0,0,0,0|0,0,2]=3 1787 B7R0.16 CC(N)C(C)C(=O)O Amb28934866 [0,1,0,0,0,0|0,0,2]=3 1788 B7R0.16 CC(N)C(C)C(N)=O Amb27172764 [0,1,0,0,0,0|1,0,2]=4 1789 B7R0.16 CC(N)C(F)C(=O)O Amb27411861 [0,1,0,0,0,0|1,0,2]=4 1790 B7R0.16 CC(N)C(N)C(=O)O Amb22728051 [0,1,0,0,0,0|1,0,2]=4 1791 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [0,1,0,0,0,0|1,0,2]=4 1792 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [0,1,0,0,0,0|1,0,2]=4 1793 B7R0.16 CC(N)[C@H](N)C(=O)O Amb25083113 [0,1,0,0,0,0|1,0,2]=4 1794 B7R0.16 CC(N)[C@H](N)C(=O)O Amb33740158 [0,1,0,0,0,0|1,0,2]=4 1795 B7R0.16 CC(O)C(=O)C(=O)O Amb24481396 [0,1,0,0,0,0|1,0,1]=3 1796 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,1,0,0,0,0|1,0,2]=4 1797 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,1,0,0,0,0|0,0,2]=3 1798 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,1,0,0,0,0|1,0,2]=4 1799 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,1,0,0,0,0|1,0,2]=4 1800 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,1,0,0,0,0|1,0,2]=4 1801 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,1,0,0,0,0|1,0,2]=4 1802 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,1,0,0,0,0|1,0,2]=4 1803 B7R0.16 CC(S)C(=O)C(=O)O Amb28128312 [0,1,0,0,0,0|1,0,1]=3 1804 B7R0.16 CC(S)C(N)C(=O)O Amb17593434 [0,1,0,0,0,0|1,0,2]=4 1805 B7R0.16 CC(S)[C@@H](N)C(=O)O Amb24606864 [0,1,0,0,0,0|1,0,2]=4 1806 B7R0.16 CN(C(=O)Cl)C(=O)Cl Amb28127675 [0,1,0,0,0,0|3,0,0]=4 1807 B7R0.16 CN(C(N)=O)C(N)=O Amb27411152 [0,1,0,0,0,0|3,0,0]=4 1808 B7R0.16 CN(C)C(=N)C(=O)O Amb18641880 [0,1,0,0,0,0|2,0,0]=3 1809 B7R0.16 CN(C)C(=O)C(=O)O Amb2691325 [0,1,0,0,0,0|2,0,0]=3 1810 B7R0.16 CN(C)C(O)C(=O)O Amb28399618 [0,1,0,0,0,0|2,0,1]=4 1811 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb22587534 [0,1,0,0,0,0|1,0,1]=3 1812 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb28934882 [0,1,0,0,0,0|1,0,1]=3 1813 B7R0.16 C[C@@H](Cl)[C@@H](Cl)C(=O)O Amb28343001 [0,1,0,0,0,0|1,0,2]=4 1814 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(=O)O Amb28283911 [0,1,0,0,0,0|1,0,2]=4 1815 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb28286576 [0,1,0,0,0,0|1,0,2]=4 1816 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb32668519 [0,1,0,0,0,0|1,0,2]=4 1817 B7R0.16 C[C@@H](N)[C@@H](C)C(=O)O Amb25679842 [0,1,0,0,0,0|0,0,2]=3 1818 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb22745441 [0,1,0,0,0,0|1,0,2]=4 1819 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb24481409 [0,1,0,0,0,0|1,0,2]=4 1820 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,1,0,0,0,0|1,0,2]=4 1821 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,1,0,0,0,0|1,0,2]=4 1822 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,1,0,0,0,0|1,0,2]=4 1823 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,1,0,0,0,0|1,0,2]=4 1824 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,1,0,0,0,0|1,0,2]=4 1825 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,1,0,0,0,0|1,0,2]=4 1826 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,1,0,0,0,0|1,0,2]=4 1827 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,1,0,0,0,0|1,0,2]=4 1828 B7R0.16 C[C@@H](S)[C@H](N)C(=O)O Amb24117242 [0,1,0,0,0,0|1,0,2]=4 1829 B7R0.16 C[C@H](C(=O)O)N(C)C Amb22586633 [0,1,0,0,0,0|1,0,1]=3 1830 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,1,0,0,0,0|0,0,2]=3 1831 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)O Amb27955873 [0,1,0,0,0,0|1,0,2]=4 1832 B7R0.16 C[C@H](N)[C@@H](C)C(=O)O Amb26887656 [0,1,0,0,0,0|0,0,2]=3 1833 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [0,1,0,0,0,0|1,0,2]=4 1834 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb17678797 [0,1,0,0,0,0|1,0,2]=4 1835 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb26887696 [0,1,0,0,0,0|1,0,2]=4 1836 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,1,0,0,0,0|1,0,2]=4 1837 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,1,0,0,0,0|1,0,2]=4 1838 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,1,0,0,0,0|1,0,2]=4 1839 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,1,0,0,0,0|1,0,2]=4 1840 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,1,0,0,0,0|1,0,2]=4 1841 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,1,0,0,0,0|0,0,2]=3 1842 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,1,0,0,0,0|1,0,2]=4 1843 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,1,0,0,0,0|1,0,2]=4 1844 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,1,0,0,0,0|1,0,2]=4 1845 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,1,0,0,0,0|1,0,2]=4 1846 B7R0.16 C[PH](=O)C(O)C(=O)O Amb34916646 [0,1,0,0,0,0|2,0,1]=4 1847 B7R0.16 C\C(Br)=C(/C)C(=O)O Amb2611697 [0,1,0,0,0,0|0,0,0]=1 1848 B7R0.16 C\C(N)=C(/Cl)C(N)=O Amb26578835 [0,1,0,0,0,0|2,0,0]=3 1849 B7R0.16 C\C(O)=C(/N)C(N)=O Amb28429800 [0,1,0,0,0,0|2,0,0]=3 1850 B7R0.16 C\C(O)=C(\N)C(=O)O Amb27191761 [0,1,0,0,0,0|1,0,0]=2 1851 B7R0.16 C\C(O)=C(\O)C(=O)O Amb28282804 [0,1,0,0,0,0|1,0,0]=2 1852 B7R0.16 C\C(O)=C(\O)C(C)O Amb25227909 [0,1,0,0,0,0|2,0,1]=4 1853 B7R0.16 C\C(O)=C(\O)[C@@H](C)O Amb27862909 [0,1,0,0,0,0|2,0,1]=4 1854 B7R0.16 NC(=O)C(Cl)=C(Cl)Cl Amb2779164 [0,1,0,0,0,0|3,0,0]=4 1855 B7R0.16 NC(=O)[C@H](N)C(=O)O Amb28397054 [0,1,0,0,0,0|2,0,1]=4 1856 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,1,0,0,0,0|2,0,1]=4 1857 B7R0.16 O=C(Cl)C(=O)C(=O)Cl Amb26634429 [0,1,0,0,0,0|3,0,0]=4 1858 B7R0.16 O=C(Cl)C(Cl)=C(Cl)Cl Amb22366596 [0,1,0,0,0,0|3,0,0]=4 1859 B7R0.16 O=C(O)C(=O)C(=O)O Amb18641943 [0,1,0,0,0,0|2,0,0]=3 1860 B7R0.16 O=C(O)C(=O)C(Br)Br Amb24179214 [0,1,0,0,0,0|2,0,1]=4 1861 B7R0.16 O=C(O)C(=O)C(Cl)Br Amb27830042 [0,1,0,0,0,0|2,0,1]=4 1862 B7R0.16 O=C(O)C(Br)=C(Cl)Cl Amb27827769 [0,1,0,0,0,0|2,0,0]=3 1863 B7R0.16 O=C(O)C(Br)C(=O)O Amb17594708 [0,1,0,0,0,0|2,0,1]=4 1864 B7R0.16 O=C(O)C(Cl)=C(Cl)Cl Amb2724138 [0,1,0,0,0,0|2,0,0]=3 1865 B7R0.16 O=C(O)C(F)=C(Cl)Cl Amb25732891 [0,1,0,0,0,0|2,0,0]=3 1866 B7R0.16 O=C(O)C(F)=C(F)F Amb27409880 [0,1,0,0,0,0|2,0,0]=3 1867 B7R0.16 O=C(O)C(F)C(=O)O Amb24055884 [0,1,0,0,0,0|2,0,1]=4 1868 B7R0.16 O=C(O)C(O)C(=O)O Amb1215315 [0,1,0,0,0,0|2,0,1]=4 1869 B7R0.16 O=C(O)C(S)C(=O)O Amb28346986 [0,1,0,0,0,0|2,0,1]=4 1870 B7R1.4 Brc1ccoc1Br Amb6366140 [0,0,0,1,0,0|2,0,1]=4 1871 B7R1.4 Brc1ccoc1I Amb26608371 [0,0,0,1,0,0|2,0,1]=4 1872 B7R1.4 C=C1CCCC1=O Amb17593061 [0,0,0,1,0,0|1,0,2]=4 1873 B7R1.4 C=C1CCNC1=O Amb26415156 [0,0,0,1,0,0|1,0,2]=4 1874 B7R1.4 C=C1CCOC1=O Amb3941636 [0,0,0,1,0,0|0,0,2]=3 1875 B7R1.4 CC1=C(Br)CCC1 Amb24479762 [0,0,0,1,0,0|2,0,1]=4 1876 B7R1.4 CC1=C(C)CCC1 Amb22227705 [0,0,0,1,0,0|2,0,1]=4 1877 B7R1.4 CC1=C(S)CCO1 Amb16232456 [0,0,0,1,0,0|2,0,1]=4 1878 B7R1.4 CC1=CCCC1=O Amb8514958 [0,0,0,1,0,0|1,0,0]=2 1879 B7R1.4 CC1=CCCC1C Amb24479857 [0,0,0,1,0,0|2,0,1]=4 1880 B7R1.4 CC1=CCCC1O Amb25220686 [0,0,0,1,0,0|1,0,1]=3 1881 B7R1.4 CC1=CCCN1C Amb17938859 [0,0,0,1,0,0|3,0,0]=4 1882 B7R1.4 CC1=CCN=C1C Amb27463558 [0,0,0,1,0,0|2,0,0]=3 1883 B7R1.4 CC1=CCNC1C Amb27975662 [0,0,0,1,0,0|2,0,1]=4 1884 B7R1.4 CC1=CCOC1=O Amb16231256 [0,0,0,1,0,0|0,0,0]=1 1885 B7R1.4 CC1=CCSC1=S Amb27633752 [0,0,0,1,0,0|0,2,0]=3 1886 B7R1.4 CC1C=COC1=O Amb27862334 [0,0,0,1,0,0|0,0,2]=3 1887 B7R1.4 CC1C=NNC1=O Amb22232312 [0,0,0,1,0,0|2,0,1]=4 1888 B7R1.4 CC1CCCC1=O Amb8514830 [0,0,0,1,0,0|1,0,2]=4 1889 B7R1.4 CC1CCNC1=O Amb10603701 [0,0,0,1,0,0|1,0,2]=4 1890 B7R1.4 CC1CCOC1=O Amb16185414 [0,0,0,1,0,0|0,0,2]=3 1891 B7R1.4 CC1NCCC1=O Amb26950680 [0,0,0,1,0,0|2,0,1]=4 1892 B7R1.4 CC1NCCC1=O Amb32410228 [0,0,0,1,0,0|2,0,1]=4 1893 B7R1.4 CC1OCCC1=O Amb2725497 [0,0,0,1,0,0|2,0,1]=4 1894 B7R1.4 CC1OCNC1=O Amb28046854 [0,0,0,1,0,0|2,0,1]=4 1895 B7R1.4 CC1SCCC1=O Amb8392845 [0,0,0,1,0,0|2,0,1]=4 1896 B7R1.4 CC1SCNC1=O Amb27211661 [0,0,0,1,0,0|2,0,1]=4 1897 B7R1.4 CN1C=CNC1=O Amb20622459 [0,0,0,1,0,0|2,0,1]=4 1898 B7R1.4 CN1CCCC1=O Amb22493780 [0,0,0,1,0,0|2,0,1]=4 1899 B7R1.4 CN1CCCC1=O Amb6608842 [0,0,0,1,0,0|2,0,1]=4 1900 B7R1.4 CN1CCNC1=O Amb5718647 [0,0,0,1,0,0|2,0,1]=4 1901 B7R1.4 CN1CCOC1=O Amb22347786 [0,0,0,1,0,0|1,0,1]=3 1902 B7R1.4 CN1NCCC1=O Amb18559311 [0,0,0,1,0,0|3,0,0]=4 1903 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [0,0,0,1,0,0|1,0,2]=4 1904 B7R1.4 C[C@@H]1NCCC1=O Amb18197575 [0,0,0,1,0,0|2,0,1]=4 1905 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [0,0,0,1,0,0|1,0,2]=4 1906 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [0,0,0,1,0,0|1,0,2]=4 1907 B7R1.4 Cc1ccoc1C Amb8515826 [0,0,0,1,0,0|1,0,1]=3 1908 B7R1.4 Cc1ccoc1O Amb33343228 [0,0,0,1,0,0|0,0,2]=3 1909 B7R1.4 Cc1ccoc1S Amb27613044 [0,0,0,1,0,0|0,1,1]=3 1910 B7R1.4 Cc1ccsc1Br Amb2236394 [0,0,0,1,0,0|1,1,1]=4 1911 B7R1.4 Cc1ccsc1C Amb2447413 [0,0,0,1,0,0|1,1,1]=4 1912 B7R1.4 Cc1ccsc1Cl Amb8396573 [0,0,0,1,0,0|1,1,1]=4 1913 B7R1.4 Cc1ccsc1F Amb27459925 [0,0,0,1,0,0|1,1,1]=4 1914 B7R1.4 Cc1ccsc1I Amb22898804 [0,0,0,1,0,0|1,1,1]=4 1915 B7R1.4 Cc1ccsc1N Amb18679496 [0,0,0,1,0,0|1,1,1]=4 1916 B7R1.4 Cc1ccsc1O Amb24639732 [0,0,0,1,0,0|0,1,1]=3 1917 B7R1.4 Cc1ccsc1S Amb25747282 [0,0,0,1,0,0|0,2,1]=4 1918 B7R1.4 Cc1cnoc1C Amb4007674 [0,0,0,1,0,0|2,0,0]=3 1919 B7R1.4 Cc1cnoc1Cl Amb28313653 [0,0,0,1,0,0|2,0,0]=3 1920 B7R1.4 Cc1cnoc1N Amb18943767 [0,0,0,1,0,0|2,0,0]=3 1921 B7R1.4 Cc1cnoc1O Amb25064746 [0,0,0,1,0,0|1,0,1]=3 1922 B7R1.4 Cc1cnsc1Br Amb2616664 [0,0,0,1,0,0|2,1,0]=4 1923 B7R1.4 Cc1cocc1C Amb17613311 [0,0,0,1,0,0|3,0,0]=4 1924 B7R1.4 Cc1cocc1F Amb27971160 [0,0,0,1,0,0|3,0,0]=4 1925 B7R1.4 Cc1cocc1I Amb24630674 [0,0,0,1,0,0|3,0,0]=4 1926 B7R1.4 Cc1conc1C Amb27468671 [0,0,0,1,0,0|3,0,0]=4 1927 B7R1.4 Cc1conc1N Amb18278180 [0,0,0,1,0,0|3,0,0]=4 1928 B7R1.4 Cc1cscc1Br Amb2447459 [0,0,0,1,0,0|3,0,0]=4 1929 B7R1.4 Cc1cscc1C Amb2782126 [0,0,0,1,0,0|3,0,0]=4 1930 B7R1.4 Cc1cscc1I Amb27967883 [0,0,0,1,0,0|3,0,0]=4 1931 B7R1.4 Cc1cscc1N Amb18833058 [0,0,0,1,0,0|3,0,0]=4 1932 B7R1.4 Cc1cscc1N Amb20667756 [0,0,0,1,0,0|3,0,0]=4 1933 B7R1.4 Cc1cscc1N Amb22234035 [0,0,0,1,0,0|3,0,0]=4 1934 B7R1.4 Cc1cscc1O Amb26458243 [0,0,0,1,0,0|2,0,0]=3 1935 B7R1.4 Cc1cscc1S Amb28239564 [0,0,0,1,0,0|2,1,0]=4 1936 B7R1.4 Cc1csnc1Br Amb22490966 [0,0,0,1,0,0|3,0,0]=4 1937 B7R1.4 Cc1ncoc1Br Amb26896749 [0,0,0,1,0,0|2,0,1]=4 1938 B7R1.4 Cc1ncoc1Br Amb33546754 [0,0,0,1,0,0|2,0,1]=4 1939 B7R1.4 Cc1ncoc1C Amb22396059 [0,0,0,1,0,0|2,0,1]=4 1940 B7R1.4 Cc1ncoc1N Amb22234804 [0,0,0,1,0,0|2,0,1]=4 1941 B7R1.4 Cc1ncsc1O Amb25268351 [0,0,0,1,0,0|1,1,1]=4 1942 B7R1.4 Cc1nonc1O Amb1102107 [0,0,0,1,0,0|3,0,0]=4 1943 B7R1.4 Cc1occc1Br Amb6572125 [0,0,0,1,0,0|2,0,1]=4 1944 B7R1.4 Cc1occc1N Amb18203072 [0,0,0,1,0,0|2,0,1]=4 1945 B7R1.4 Cc1occc1O Amb25178728 [0,0,0,1,0,0|2,0,1]=4 1946 B7R1.4 Cc1occc1S Amb8393173 [0,0,0,1,0,0|2,0,1]=4 1947 B7R1.4 Cc1oncc1Br Amb18199818 [0,0,0,1,0,0|3,0,0]=4 1948 B7R1.4 Cc1oncc1I Amb2723393 [0,0,0,1,0,0|3,0,0]=4 1949 B7R1.4 Cc1oncc1N Amb18119789 [0,0,0,1,0,0|3,0,0]=4 1950 B7R1.4 Cc1oncc1N Amb20668399 [0,0,0,1,0,0|3,0,0]=4 1951 B7R1.4 Cc1oncc1S Amb33361110 [0,0,0,1,0,0|3,0,0]=4 1952 B7R1.4 Cc1sccc1O Amb26621113 [0,0,0,1,0,0|2,0,1]=4 1953 B7R1.4 Cn1cccc1O Amb27652694 [0,0,0,1,0,0|2,0,1]=4 1954 B7R1.4 Cn1cncc1O Amb27436828 [0,0,0,1,0,0|3,0,0]=4 1955 B7R1.4 Cn1cnnc1O Amb22157280 [0,0,0,1,0,0|3,0,0]=4 1956 B7R1.4 Fc1ccoc1Br Amb18199675 [0,0,0,1,0,0|2,0,1]=4 1957 B7R1.4 Fc1ccoc1F Amb27877614 [0,0,0,1,0,0|2,0,1]=4 1958 B7R1.4 NC1=CCOC1=O Amb22234102 [0,0,0,1,0,0|1,0,0]=2 1959 B7R1.4 NC1=CNNC1=O Amb24120355 [0,0,0,1,0,0|3,0,0]=4 1960 B7R1.4 NC1=CNNC1=O Amb28827627 [0,0,0,1,0,0|3,0,0]=4 1961 B7R1.4 NC1=CONC1=O Amb18203033 [0,0,0,1,0,0|3,0,0]=4 1962 B7R1.4 NC1CCOC1=O Amb17614991 [0,0,0,1,0,0|1,0,2]=4 1963 B7R1.4 NC1CCOC1=O Amb6609049 [0,0,0,1,0,0|1,0,2]=4 1964 B7R1.4 NC1CCOC1=O Amb9761351 [0,0,0,1,0,0|1,0,2]=4 1965 B7R1.4 NN1CCOC1=O Amb10068971 [0,0,0,1,0,0|2,0,1]=4 1966 B7R1.4 NN1CCOC1=O Amb33532698 [0,0,0,1,0,0|2,0,1]=4 1967 B7R1.4 N[C@@H]1CCOC1=O Amb10601656 [0,0,0,1,0,0|1,0,2]=4 1968 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [0,0,0,1,0,0|1,0,2]=4 1969 B7R1.4 N[C@@H]1CCOC1=O Amb3941712 [0,0,0,1,0,0|1,0,2]=4 1970 B7R1.4 N[C@H]1CCOC1=O Amb10982617 [0,0,0,1,0,0|1,0,2]=4 1971 B7R1.4 N[C@H]1CCOC1=O Amb541960 [0,0,0,1,0,0|1,0,2]=4 1972 B7R1.4 N[C@H]1CCOC1=O Amb5718691 [0,0,0,1,0,0|1,0,2]=4 1973 B7R1.4 Nc1ccoc1Br Amb13884558 [0,0,0,1,0,0|2,0,1]=4 1974 B7R1.4 Nc1csnc1O Amb27848643 [0,0,0,1,0,0|3,0,0]=4 1975 B7R1.4 Nc1oncc1Br Amb28247892 [0,0,0,1,0,0|3,0,0]=4 1976 B7R1.4 Nc1oncc1Cl Amb24385964 [0,0,0,1,0,0|3,0,0]=4 1977 B7R1.4 Nc1oncc1I Amb25865232 [0,0,0,1,0,0|3,0,0]=4 1978 B7R1.4 O=C1C=CC=C1Br Amb28435335 [0,0,0,1,0,0|2,0,1]=4 1979 B7R1.4 O=C1C=CC=C1O Amb27835626 [0,0,0,1,0,0|2,0,1]=4 1980 B7R1.4 O=C1C=CNC1=O Amb26887753 [0,0,0,1,0,0|2,0,1]=4 1981 B7R1.4 O=C1CCC=C1Br Amb10067494 [0,0,0,1,0,0|2,0,0]=3 1982 B7R1.4 O=C1CCC=C1I Amb26585706 [0,0,0,1,0,0|2,0,0]=3 1983 B7R1.4 O=C1CCC=C1O Amb17593067 [0,0,0,1,0,0|2,0,0]=3 1984 B7R1.4 O=C1CCCC1=O Amb24053064 [0,0,0,1,0,0|2,0,1]=4 1985 B7R1.4 O=C1CCNC1=O Amb21858086 [0,0,0,1,0,0|2,0,1]=4 1986 B7R1.4 O=C1CCOC1=O Amb27849805 [0,0,0,1,0,0|1,0,1]=3 1987 B7R1.4 O=C1CNC=C1O Amb27962752 [0,0,0,1,0,0|3,0,0]=4 1988 B7R1.4 O=C1COC=C1O Amb27838226 [0,0,0,1,0,0|3,0,0]=4 1989 B7R1.4 O=C1N=NC=C1Cl Amb25836875 [0,0,0,1,0,0|3,0,0]=4 1990 B7R1.4 O=C1NOC=C1Br Amb24641631 [0,0,0,1,0,0|3,0,0]=4 1991 B7R1.4 O=C1OC=CC1Br Amb22015332 [0,0,0,1,0,0|1,0,2]=4 1992 B7R1.4 O=C1OC=CC1S Amb27624883 [0,0,0,1,0,0|1,0,2]=4 1993 B7R1.4 O=C1OC=C[C@@H]1O Amb27472742 [0,0,0,1,0,0|1,0,2]=4 1994 B7R1.4 O=C1OCC=C1Br Amb10067498 [0,0,0,1,0,0|1,0,0]=2 1995 B7R1.4 O=C1OCC=C1Cl Amb23571857 [0,0,0,1,0,0|1,0,0]=2 1996 B7R1.4 O=C1OCC=C1F Amb28144969 [0,0,0,1,0,0|1,0,0]=2 1997 B7R1.4 O=C1OCCC1Br Amb3940058 [0,0,0,1,0,0|1,0,2]=4 1998 B7R1.4 O=C1OCCC1F Amb27642041 [0,0,0,1,0,0|1,0,2]=4 1999 B7R1.4 O=C1OCCC1I Amb24418518 [0,0,0,1,0,0|1,0,2]=4 2000 B7R1.4 O=C1OCCC1O Amb5718058 [0,0,0,1,0,0|1,0,2]=4 2001 B7R1.4 O=C1OCCC1S Amb25146639 [0,0,0,1,0,0|1,0,2]=4 2002 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [0,0,0,1,0,0|1,0,2]=4 2003 B7R1.4 O=C1OCC[C@H]1Br Amb27407127 [0,0,0,1,0,0|1,0,2]=4 2004 B7R1.4 O=C1OCC[C@H]1Cl Amb28207894 [0,0,0,1,0,0|1,0,2]=4 2005 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [0,0,0,1,0,0|1,0,2]=4 2006 B7R1.4 O=C1OCC[C@H]1S Amb27862288 [0,0,0,1,0,0|1,0,2]=4 2007 B7R1.4 O=C1OCNC1Br Amb25299209 [0,0,0,1,0,0|2,0,1]=4 2008 B7R1.4 O=C1O[Sr]OC1=O Amb22338392 [0,0,0,1,0,0|3,0,0]=4 2009 B7R1.4 O=C1SCC=C1Br Amb27462381 [0,0,0,1,0,0|1,1,0]=3 2010 B7R1.4 OC1CCC=C1Br Amb24429462 [0,0,0,1,0,0|2,0,1]=4 2011 B7R1.4 OC1CCC=C1Cl Amb25202022 [0,0,0,1,0,0|2,0,1]=4 2012 B7R1.4 O[C@@H]1CCC=C1Cl Amb28340922 [0,0,0,1,0,0|2,0,1]=4 2013 B7R1.4 Oc1cocc1O Amb28059187 [0,0,0,1,0,0|3,0,0]=4 2014 B7R1.4 Oc1nscc1Br Amb27438145 [0,0,0,1,0,0|3,0,0]=4 2015 B7R1.4 Oc1occc1Br Amb18199810 [0,0,0,1,0,0|1,0,2]=4 2016 B7R1.4 Oc1sccc1Br Amb22492529 [0,0,0,1,0,0|1,1,1]=4 2017 B7R1.4 Oc1sccc1Cl Amb25296805 [0,0,0,1,0,0|1,1,1]=4 2018 B7R1.4 S=C1SCC=C1Br Amb27438682 [0,0,0,1,0,0|1,2,0]=4 2019 B7R1.4 S=C1SCC=C1Cl Amb28323649 [0,0,0,1,0,0|1,2,0]=4 2020 B7R1.8 CCC1CCC1=O Amb28137082 [0,0,0,1,0,0|1,0,2]=4 2021 B7R1.8 COC1CCC1=O Amb22896543 [0,0,0,1,0,0|2,0,1]=4 2022 B7R1.8 CSC1CCC1=O Amb26054103 [0,0,0,1,0,0|2,0,1]=4 2023 B7R1.8 C\C=C1\CCC1=O Amb24512730 [0,0,0,1,0,0|1,0,0]=2 2024 B7R1.8 C\C=C1\CCC1O Amb27595035 [0,0,0,1,0,0|1,0,1]=3 2025 B7R1.8 O=CC1=C(Cl)CC1 Amb28050115 [0,0,0,1,0,0|3,0,0]=4 2026 B7R1.8 O=CC1=CCC1=O Amb27256480 [0,0,0,1,0,0|2,0,1]=4 2027 B7R1.12 C=C1CC1C(=O)O Amb9774969 [0,0,0,1,0,0|0,0,2]=3 2028 B7R1.12 C=C1CC1C(N)=O Amb28191145 [0,0,0,1,0,0|1,0,2]=4 2029 B7R1.12 CC(=O)C1CC1C Amb25720437 [0,0,0,1,0,0|1,0,2]=4 2030 B7R1.12 CC(=O)C1N=C1C Amb28050540 [0,0,0,1,0,0|2,0,1]=4 2031 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [0,0,0,1,0,0|1,0,2]=4 2032 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [0,0,0,1,0,0|1,0,2]=4 2033 B7R1.12 CC1=CC1C(=O)O Amb27157805 [0,0,0,1,0,0|0,0,2]=3 2034 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [0,0,0,1,0,0|1,0,2]=4 2035 B7R1.12 CC1CC1C(=O)O Amb9703126 [0,0,0,1,0,0|0,0,2]=3 2036 B7R1.12 CC1CC1C(N)=O Amb8858378 [0,0,0,1,0,0|1,0,2]=4 2037 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,1,0,0|1,0,2]=4 2038 B7R1.12 CC1SC1C(=O)O Amb27195238 [0,0,0,1,0,0|1,0,2]=4 2039 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [0,0,0,1,0,0|1,0,2]=4 2040 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [0,0,0,1,0,0|0,0,2]=3 2041 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,1,0,0|1,0,2]=4 2042 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [0,0,0,1,0,0|0,0,2]=3 2043 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [0,0,0,1,0,0|1,0,2]=4 2044 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [0,0,0,1,0,0|1,0,2]=4 2045 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [0,0,0,1,0,0|1,0,2]=4 2046 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [0,0,0,1,0,0|1,0,2]=4 2047 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [0,0,0,1,0,0|0,0,2]=3 2048 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [0,0,0,1,0,0|1,0,2]=4 2049 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,1,0,0|0,0,2]=3 2050 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [0,0,0,1,0,0|1,0,2]=4 2051 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [0,0,0,1,0,0|1,0,2]=4 2052 B7R1.12 NC1CC1C(=O)O Amb7762823 [0,0,0,1,0,0|1,0,2]=4 2053 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [0,0,0,1,0,0|1,0,2]=4 2054 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [0,0,0,1,0,0|1,0,2]=4 2055 B7R1.12 O=C(Cl)C1CC1=O Amb27838228 [0,0,0,1,0,0|2,0,1]=4 2056 B7R1.12 O=C(O)C1CC1Br Amb27760446 [0,0,0,1,0,0|1,0,2]=4 2057 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [0,0,0,1,0,0|1,0,2]=4 2058 B7R1.12 O=C(O)C1CC1F Amb22490547 [0,0,0,1,0,0|1,0,2]=4 2059 B7R1.12 O=C(O)C1CC1I Amb26047069 [0,0,0,1,0,0|1,0,2]=4 2060 B7R1.12 O=C(O)C1CC1S Amb20246988 [0,0,0,1,0,0|1,0,2]=4 2061 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [0,0,0,1,0,0|1,0,2]=4 2062 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [0,0,0,1,0,0|1,0,2]=4 2063 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,1,0,0|1,0,2]=4 2064 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [0,0,0,1,0,0|1,0,2]=4 2065 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,1,0,0|1,0,2]=4 2066 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,1,0,0|1,0,2]=4 2067 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [0,0,0,1,0,0|1,0,2]=4 2068 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,1,0,0|1,0,2]=4 2069 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [0,0,0,1,0,0|1,0,2]=4 2070 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [0,0,0,1,0,0|1,0,2]=4 2071 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,1,0,0|1,0,2]=4 2072 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [0,0,0,1,0,0|1,0,2]=4 2073 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,1,0,0|1,0,2]=4 2074 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,1,0,0|1,0,2]=4 2075 B7R1.15 C=C1C(=O)C=C1C Amb27802553 [0,0,0,1,0,0|1,0,1]=3 2076 B7R1.15 C=C1C(=O)NC1C Amb28350835 [0,0,0,1,0,0|1,0,2]=4 2077 B7R1.15 CC1=C(C)C(=O)C1 Amb27226738 [0,0,0,1,0,0|1,0,0]=2 2078 B7R1.15 CC1=C(N)CC1=O Amb27975652 [0,0,0,1,0,0|2,0,0]=3 2079 B7R1.15 CC1=C(O)CC1=O Amb27838185 [0,0,0,1,0,0|2,0,0]=3 2080 B7R1.15 CC1C(=O)CC1=O Amb24364046 [0,0,0,1,0,0|2,0,1]=4 2081 B7R1.15 CC1CC(=O)C1C Amb33551302 [0,0,0,1,0,0|1,0,2]=4 2082 B7R1.15 CC1NC(=O)C1C Amb22364651 [0,0,0,1,0,0|1,0,2]=4 2083 B7R1.15 C[C@@H]1C(=O)C[C@H]1C Amb27865634 [0,0,0,1,0,0|1,0,2]=4 2084 B7R1.15 C[C@H]1CC(=O)[C@@H]1C Amb27433516 [0,0,0,1,0,0|1,0,2]=4 2085 B7R1.15 C[C@H]1CC(=O)[C@H]1C Amb27788507 [0,0,0,1,0,0|1,0,2]=4 2086 B7R1.15 C[C@H]1OC(=O)[C@H]1N Amb27629736 [0,0,0,1,0,0|1,0,2]=4 2087 B7R1.15 O=C1C=C(O)C1=O Amb22171298 [0,0,0,1,0,0|3,0,0]=4 2088 B7R1.18 CC(=O)C1=CCC1 Amb23453500 [0,0,0,1,0,0|1,0,0]=2 2089 B7R1.18 CC(=O)C1CCC1 Amb4037098 [0,0,0,1,0,0|1,0,2]=4 2090 B7R1.18 CC(=O)C1CCN1 Amb28142364 [0,0,0,1,0,0|2,0,1]=4 2091 B7R1.18 CC(=O)N1C=CC1 Amb22001815 [0,0,0,1,0,0|2,0,1]=4 2092 B7R1.18 CC(=O)N1CCC1 Amb22008358 [0,0,0,1,0,0|2,0,1]=4 2093 B7R1.18 NC(=O)C1CCC1 Amb33552668 [0,0,0,1,0,0|1,0,2]=4 2094 B7R1.18 NC(=O)C1CCN1 Amb22230240 [0,0,0,1,0,0|2,0,1]=4 2095 B7R1.18 NC(=O)C1CCN1 Amb22491865 [0,0,0,1,0,0|2,0,1]=4 2096 B7R1.18 NC(=O)N1CCC1 Amb25326782 [0,0,0,1,0,0|2,0,1]=4 2097 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [0,0,0,1,0,0|2,0,1]=4 2098 B7R1.18 O=C(Br)C1CCC1 Amb28291328 [0,0,0,1,0,0|1,0,2]=4 2099 B7R1.18 O=C(Cl)C1CCC1 Amb33528386 [0,0,0,1,0,0|1,0,2]=4 2100 B7R1.18 O=C(Cl)N1CCC1 Amb28144777 [0,0,0,1,0,0|2,0,1]=4 2101 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [0,0,0,1,0,0|0,0,0]=1 2102 B7R1.18 O=C(O)C1CCC1 Amb2686619 [0,0,0,1,0,0|0,0,2]=3 2103 B7R1.18 O=C(O)C1CCN1 Amb2371568 [0,0,0,1,0,0|1,0,1]=3 2104 B7R1.18 O=C(O)C1CCN1 Amb8391098 [0,0,0,1,0,0|1,0,1]=3 2105 B7R1.18 O=C(O)C1CCO1 Amb2383526 [0,0,0,1,0,0|1,0,1]=3 2106 B7R1.18 O=C(O)C1CCS1 Amb27209836 [0,0,0,1,0,0|1,0,1]=3 2107 B7R1.18 O=C(O)C1CNC1 Amb2444164 [0,0,0,1,0,0|1,0,2]=4 2108 B7R1.18 O=C(O)C1CNC1 Amb8384273 [0,0,0,1,0,0|1,0,2]=4 2109 B7R1.18 O=C(O)C1COC1 Amb33542663 [0,0,0,1,0,0|1,0,2]=4 2110 B7R1.18 O=C(O)C1CSC1 Amb20171470 [0,0,0,1,0,0|1,0,2]=4 2111 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [0,0,0,1,0,0|1,0,1]=3 2112 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [0,0,0,1,0,0|1,0,1]=3 2113 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [0,0,0,1,0,0|1,0,1]=3 2114 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [0,0,0,1,0,0|1,0,1]=3 2115 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [0,0,0,1,0,0|1,0,1]=3 2116 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [0,0,0,1,0,0|1,0,1]=3 2117 B7R1.18 O=C([O-])C1=CCC1 Amb34165365 [0,0,0,1,0,0|0,0,1]=2 2118 B7R1.19 CC(=O)C1(C)CC1 Amb1161819 [0,0,0,1,0,0|1,0,2]=4 2119 B7R1.19 CC(=O)C1(C)CO1 Amb9677568 [0,0,0,1,0,0|2,0,1]=4 2120 B7R1.19 CC(=O)[C@@]1(C)CO1 Amb28050546 [0,0,0,1,0,0|2,0,1]=4 2121 B7R1.19 CC1(C(=O)Cl)CC1 Amb16230812 [0,0,0,1,0,0|1,0,2]=4 2122 B7R1.19 CC1(C(=O)O)CC1 Amb2779924 [0,0,0,1,0,0|0,0,2]=3 2123 B7R1.19 CC1(C(=O)O)CO1 Amb33542864 [0,0,0,1,0,0|1,0,1]=3 2124 B7R1.19 CC1(C(N)=O)CC1 Amb19958822 [0,0,0,1,0,0|1,0,2]=4 2125 B7R1.19 NC1(C(=O)O)CC1 Amb4296883 [0,0,0,1,0,0|1,0,2]=4 2126 B7R1.19 NC1(C(=O)O)CC1 Amb6223185 [0,0,0,1,0,0|1,0,2]=4 2127 B7R1.19 O=C(O)C1(Br)CC1 Amb33544592 [0,0,0,1,0,0|1,0,2]=4 2128 B7R1.19 O=C(O)C1(Cl)CC1 Amb25841916 [0,0,0,1,0,0|1,0,2]=4 2129 B7R1.19 O=C(O)C1(F)CC1 Amb22001836 [0,0,0,1,0,0|1,0,2]=4 2130 B7R1.19 O=C(O)C1(O)CC1 Amb6609000 [0,0,0,1,0,0|1,0,2]=4 2131 B7R1.22 CC(C=O)=C1CC1 Amb28251246 [0,0,0,1,0,0|3,0,0]=4 2132 B7R0.2 C#CC(C)CC(=O)O Amb27246384 [0,0,0,0,0,1|0,0,3]=4 2133 B7R0.2 C#C\C(C)=C\C(=O)O Amb27950241 [0,0,0,0,0,1|0,0,2]=3 2134 B7R0.2 C#C\C(C)=C\C(C)=O Amb28316205 [0,0,0,0,0,1|1,0,2]=4 2135 B7R0.2 C=C(C)\C=C(/C)C=O Amb27464033 [0,0,0,0,0,1|3,0,0]=4 2136 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [0,0,0,0,0,1|0,0,2]=3 2137 B7R0.2 C=C(CC)CC(N)=O Amb27394598 [0,0,0,0,0,1|1,0,2]=4 2138 B7R0.2 C=C(CC)OC(C)=O Amb25202254 [0,0,0,0,0,1|1,0,2]=4 2139 B7R0.2 C=C(O)\C=C(/C)OC Amb27635019 [0,0,0,0,0,1|2,0,0]=3 2140 B7R0.2 C=CC(=C)CC(C)=O Amb27668846 [0,0,0,0,0,1|1,0,2]=4 2141 B7R0.2 C=CC(=C)OC(C)=O Amb25694419 [0,0,0,0,0,1|1,0,2]=4 2142 B7R0.2 C=CC(=O)CC(C)=O Amb27470884 [0,0,0,0,0,1|2,0,1]=4 2143 B7R0.2 C=CC(=O)NC(N)=O Amb13951205 [0,0,0,0,0,1|2,0,1]=4 2144 B7R0.2 C=CC(=O)OC(N)=O Amb27863065 [0,0,0,0,0,1|2,0,1]=4 2145 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [0,0,0,0,0,1|0,0,2]=3 2146 B7R0.2 C=CC(C)CC(C)=O Amb27759897 [0,0,0,0,0,1|1,0,2]=4 2147 B7R0.2 C=CC(C)CC(N)=O Amb27168118 [0,0,0,0,0,1|1,0,2]=4 2148 B7R0.2 C=CC(C)NC(C)=O Amb27236925 [0,0,0,0,0,1|1,0,2]=4 2149 B7R0.2 C=CC(C)NC(O)=S Amb27208910 [0,0,0,0,0,1|0,1,2]=4 2150 B7R0.2 C=CC(C)OC(C)=O Amb4016456 [0,0,0,0,0,1|1,0,2]=4 2151 B7R0.2 C=CC(N)CC(=O)O Amb22641963 [0,0,0,0,0,1|1,0,2]=4 2152 B7R0.2 C=CC(N)CC(=O)O Amb31307621 [0,0,0,0,0,1|1,0,2]=4 2153 B7R0.2 C=CC(O)CC(=O)O Amb18641866 [0,0,0,0,0,1|1,0,2]=4 2154 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [0,0,0,0,0,1|0,0,2]=3 2155 B7R0.2 C=C[C@@H](N)CC(=O)O Amb28315938 [0,0,0,0,0,1|1,0,2]=4 2156 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [0,0,0,0,0,1|0,0,2]=3 2157 B7R0.2 C=C\C(Br)=C/C(C)=O Amb24505183 [0,0,0,0,0,1|2,0,1]=4 2158 B7R0.2 C=C\C(C)=C/C(=O)O Amb18641686 [0,0,0,0,0,1|0,0,1]=2 2159 B7R0.2 C=C\C(C)=C/C(C)=O Amb27210017 [0,0,0,0,0,1|1,0,1]=3 2160 B7R0.2 C=C\C(C)=C/C(C)O Amb28061923 [0,0,0,0,0,1|1,0,2]=4 2161 B7R0.2 C=C\C(C)=C/C(N)=O Amb27195399 [0,0,0,0,0,1|1,0,1]=3 2162 B7R0.2 C=C\C(C)=C\C(C)=O Amb25234874 [0,0,0,0,0,1|1,0,1]=3 2163 B7R0.2 C=C\C(O)=C/C(C)=O Amb24553056 [0,0,0,0,0,1|2,0,1]=4 2164 B7R0.2 CC(=O)C[C@@H](C)C=O Amb27470883 [0,0,0,0,0,1|2,0,1]=4 2165 B7R0.2 CC(=O)C[C@H](C)C=O Amb24379584 [0,0,0,0,0,1|2,0,1]=4 2166 B7R0.2 CC(=O)C\C(C)=N\N Amb28048941 [0,0,0,0,0,1|3,0,0]=4 2167 B7R0.2 CC(=O)C\C(C)=N\O Amb26568890 [0,0,0,0,0,1|3,0,0]=4 2168 B7R0.2 CC(=O)N[C@H](C)C=O Amb27838347 [0,0,0,0,0,1|2,0,1]=4 2169 B7R0.2 CC(=O)N\C(C)=C/S Amb27437872 [0,0,0,0,0,1|2,0,0]=3 2170 B7R0.2 CC(=O)N\C(C)=C\S Amb28384532 [0,0,0,0,0,1|2,0,0]=3 2171 B7R0.2 CC(=O)OC(C)C=O Amb18641863 [0,0,0,0,0,1|2,0,1]=4 2172 B7R0.2 CC(=O)O[C@H](C)C=O Amb28422009 [0,0,0,0,0,1|2,0,1]=4 2173 B7R0.2 CC(=O)\C=C(/C)C=O Amb27607120 [0,0,0,0,0,1|2,0,0]=3 2174 B7R0.2 CC(=O)\C=C(/C)CO Amb25240045 [0,0,0,0,0,1|2,0,1]=4 2175 B7R0.2 CC(=O)\C=C(\C)C=O Amb18641689 [0,0,0,0,0,1|2,0,0]=3 2176 B7R0.2 CC(=O)\C=C(\C)CO Amb24518297 [0,0,0,0,0,1|2,0,1]=4 2177 B7R0.2 CC(=O)\C=C(\C)NN Amb27839441 [0,0,0,0,0,1|3,0,0]=4 2178 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,0,0,0,0,1|1,0,2]=4 2179 B7R0.2 CC(CC(=O)O)NN Amb28346224 [0,0,0,0,0,1|2,0,1]=4 2180 B7R0.2 CC(CC(=O)O)NN Amb33141007 [0,0,0,0,0,1|2,0,1]=4 2181 B7R0.2 CC(CF)CC(=O)O Amb25990964 [0,0,0,0,0,1|1,0,2]=4 2182 B7R0.2 CC(CN)CC(=O)O Amb18124263 [0,0,0,0,0,1|1,0,2]=4 2183 B7R0.2 CC(CN)CC(=O)O Amb20669501 [0,0,0,0,0,1|1,0,2]=4 2184 B7R0.2 CC(CN)CC(=O)O Amb32752805 [0,0,0,0,0,1|1,0,2]=4 2185 B7R0.2 CC(CO)CC(=O)O Amb18198168 [0,0,0,0,0,1|1,0,2]=4 2186 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [0,0,0,0,0,1|1,0,1]=3 2187 B7R0.2 CCC(=O)CC(C)=O Amb9775078 [0,0,0,0,0,1|2,0,1]=4 2188 B7R0.2 CCC(=O)CC(N)=O Amb8384375 [0,0,0,0,0,1|2,0,1]=4 2189 B7R0.2 CCC(=O)NC(C)=O Amb27800787 [0,0,0,0,0,1|2,0,1]=4 2190 B7R0.2 CCC(=O)NC(N)=O Amb27643460 [0,0,0,0,0,1|2,0,1]=4 2191 B7R0.2 CCC(=O)OC(C)=O Amb21858081 [0,0,0,0,0,1|2,0,1]=4 2192 B7R0.2 CCC(C)CC(=O)Cl Amb10844649 [0,0,0,0,0,1|1,0,2]=4 2193 B7R0.2 CCC(C)CC(=O)O Amb2689581 [0,0,0,0,0,1|0,0,2]=3 2194 B7R0.2 CCC(C)CC(C)=O Amb10608208 [0,0,0,0,0,1|1,0,2]=4 2195 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,0,0,0,0,1|1,0,2]=4 2196 B7R0.2 CCC(C)NC(=O)Cl Amb27838339 [0,0,0,0,0,1|1,0,2]=4 2197 B7R0.2 CCC(C)NC(C)=O Amb3358085 [0,0,0,0,0,1|1,0,2]=4 2198 B7R0.2 CCC(C)NC(N)=O Amb9702507 [0,0,0,0,0,1|1,0,2]=4 2199 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [0,0,0,0,0,1|1,0,2]=4 2200 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [0,0,0,0,0,1|1,0,2]=4 2201 B7R0.2 CCC(N)CC(=O)O Amb1993862 [0,0,0,0,0,1|1,0,2]=4 2202 B7R0.2 CCC(N)CC(=O)O Amb8631361 [0,0,0,0,0,1|1,0,2]=4 2203 B7R0.2 CCC(O)CC(=O)O Amb10844270 [0,0,0,0,0,1|1,0,2]=4 2204 B7R0.2 CCN(C)CC(=O)O Amb33620688 [0,0,0,0,0,1|1,0,1]=3 2205 B7R0.2 CCN(C)CC(=O)O Amb8428140 [0,0,0,0,0,1|1,0,1]=3 2206 B7R0.2 CCN(C)CC(C)=O Amb8427987 [0,0,0,0,0,1|2,0,1]=4 2207 B7R0.2 CCN(C)CC(C)=O Amb9173327 [0,0,0,0,0,1|2,0,1]=4 2208 B7R0.2 CCN(C)CC(N)=O Amb27639873 [0,0,0,0,0,1|2,0,1]=4 2209 B7R0.2 CCN(O)CC(=O)O Amb28195485 [0,0,0,0,0,1|2,0,1]=4 2210 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,0,0,0,0,1|2,0,1]=4 2211 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [0,0,0,0,0,1|0,0,2]=3 2212 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [0,0,0,0,0,1|1,0,2]=4 2213 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [0,0,0,0,0,1|1,0,2]=4 2214 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [0,0,0,0,0,1|1,0,2]=4 2215 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [0,0,0,0,0,1|0,0,2]=3 2216 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [0,0,0,0,0,1|1,0,2]=4 2217 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [0,0,0,0,0,1|1,0,2]=4 2218 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [0,0,0,0,0,1|1,0,2]=4 2219 B7R0.2 CC\C(Br)=C\C(=O)O Amb27409320 [0,0,0,0,0,1|1,0,1]=3 2220 B7R0.2 CC\C(C)=C/C(=O)O Amb18281014 [0,0,0,0,0,1|0,0,1]=2 2221 B7R0.2 CC\C(C)=C/C(C)=O Amb27424977 [0,0,0,0,0,1|1,0,1]=3 2222 B7R0.2 CC\C(C)=C\C(=O)O Amb33528462 [0,0,0,0,0,1|0,0,1]=2 2223 B7R0.2 CC\C(C)=C\C(C)=O Amb27985733 [0,0,0,0,0,1|1,0,1]=3 2224 B7R0.2 CC\C(C)=C\C(C)O Amb28128461 [0,0,0,0,0,1|1,0,2]=4 2225 B7R0.2 CC\C(C)=N\S(C)=O Amb35675187 [0,0,0,0,0,1|2,0,1]=4 2226 B7R0.2 CC\C(F)=C/C(=O)O Amb27780201 [0,0,0,0,0,1|1,0,1]=3 2227 B7R0.2 CC\C(N)=C\C(=O)O Amb28145108 [0,0,0,0,0,1|1,0,1]=3 2228 B7R0.2 CC\C(N)=C\C(N)=O Amb27621383 [0,0,0,0,0,1|2,0,1]=4 2229 B7R0.2 CC\C(N)=N\C(C)=O Amb27391863 [0,0,0,0,0,1|2,0,1]=4 2230 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [0,0,0,0,0,1|1,0,1]=3 2231 B7R0.2 CC\C(S)=C\C(C)=O Amb27775797 [0,0,0,0,0,1|2,0,1]=4 2232 B7R0.2 CC\C([O-])=C\C(C)=O Amb19960031 [0,0,0,0,0,1|2,0,1]=4 2233 B7R0.2 CN(C=O)CC(N)=O Amb27471534 [0,0,0,0,0,1|3,0,0]=4 2234 B7R0.2 CN(CC(=O)O)N=O Amb17618622 [0,0,0,0,0,1|3,0,0]=4 2235 B7R0.2 CN(CO)CC(=O)O Amb27663224 [0,0,0,0,0,1|2,0,1]=4 2236 B7R0.2 CNC(=O)CC(=O)O Amb33529761 [0,0,0,0,0,1|2,0,0]=3 2237 B7R0.2 CNC(=O)CC(=O)[O-] Amb35747299 [0,0,0,0,0,1|2,0,1]=4 2238 B7R0.2 CNC(=O)CC(C)=O Amb6891968 [0,0,0,0,0,1|3,0,0]=4 2239 B7R0.2 CNC(=O)NC(C)=O Amb2782874 [0,0,0,0,0,1|3,0,0]=4 2240 B7R0.2 CNC(=S)CC(C)=O Amb24096719 [0,0,0,0,0,1|3,0,0]=4 2241 B7R0.2 CNC(=S)NC(C)=O Amb24746594 [0,0,0,0,0,1|3,0,0]=4 2242 B7R0.2 CNC(=S)SC(C)=O Amb27185753 [0,0,0,0,0,1|3,0,0]=4 2243 B7R0.2 CNC(C)CC(=O)O Amb21959674 [0,0,0,0,0,1|1,0,1]=3 2244 B7R0.2 CNC(C)CC(=O)O Amb9398363 [0,0,0,0,0,1|1,0,1]=3 2245 B7R0.2 CNC(C)CC(N)=O Amb17231826 [0,0,0,0,0,1|2,0,1]=4 2246 B7R0.2 CNC(C)CC(N)=O Amb19960012 [0,0,0,0,0,1|2,0,1]=4 2247 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [0,0,0,0,0,1|1,0,1]=3 2248 B7R0.2 CN\C(C)=C/C(C)=O Amb15691784 [0,0,0,0,0,1|2,0,0]=3 2249 B7R0.2 CN\C(C)=C\C(C)=O Amb27486166 [0,0,0,0,0,1|2,0,0]=3 2250 B7R0.2 CN\C(N)=N\C(C)=O Amb24120628 [0,0,0,0,0,1|3,0,0]=4 2251 B7R0.2 COC(=N)NC(C)=O Amb28436707 [0,0,0,0,0,1|3,0,0]=4 2252 B7R0.2 COC(=O)CC(=O)Cl Amb3939073 [0,0,0,0,0,1|3,0,0]=4 2253 B7R0.2 COC(=O)CC(=O)O Amb16232032 [0,0,0,0,0,1|2,0,0]=3 2254 B7R0.2 COC(=O)CC(=O)[O-] Amb2780363 [0,0,0,0,0,1|2,0,1]=4 2255 B7R0.2 COC(=O)CC(=O)[O-] Amb34915950 [0,0,0,0,0,1|2,0,1]=4 2256 B7R0.2 COC(=O)CC(C)=O Amb6608655 [0,0,0,0,0,1|3,0,0]=4 2257 B7R0.2 COC(=O)CC(N)=O Amb22043417 [0,0,0,0,0,1|3,0,0]=4 2258 B7R0.2 COC(=S)CC(N)=O Amb27230798 [0,0,0,0,0,1|3,0,0]=4 2259 B7R0.2 COC(=S)NC(C)=O Amb27155891 [0,0,0,0,0,1|3,0,0]=4 2260 B7R0.2 COC(=S)NC(N)=O Amb28456572 [0,0,0,0,0,1|3,0,0]=4 2261 B7R0.2 COC(C)CC(=O)O Amb4001695 [0,0,0,0,0,1|1,0,1]=3 2262 B7R0.2 COC(C)CC(C)=O Amb26512071 [0,0,0,0,0,1|2,0,1]=4 2263 B7R0.2 COC(C)CC(N)=O Amb27838372 [0,0,0,0,0,1|2,0,1]=4 2264 B7R0.2 COC(C)NC(C)=O Amb27839138 [0,0,0,0,0,1|2,0,1]=4 2265 B7R0.2 CON(C)CC(=O)O Amb8010467 [0,0,0,0,0,1|2,0,0]=3 2266 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [0,0,0,0,0,1|1,0,1]=3 2267 B7R0.2 CO[C@H](C)CC(C)=O Amb26494510 [0,0,0,0,0,1|2,0,1]=4 2268 B7R0.2 CO\C(C)=C/C(=O)O Amb2611888 [0,0,0,0,0,1|1,0,0]=2 2269 B7R0.2 CO\C(C)=C/C(C)=O Amb28145644 [0,0,0,0,0,1|2,0,0]=3 2270 B7R0.2 CO\C(C)=C\C(=O)O Amb27631657 [0,0,0,0,0,1|1,0,0]=2 2271 B7R0.2 CO\C(N)=C\C(C)=O Amb27947759 [0,0,0,0,0,1|3,0,0]=4 2272 B7R0.2 CSC(=O)NC(N)=O Amb27878953 [0,0,0,0,0,1|3,0,0]=4 2273 B7R0.2 CSC(C)CC(=O)O Amb18967824 [0,0,0,0,0,1|1,0,1]=3 2274 B7R0.2 CSC(C)CC(C)=O Amb25714199 [0,0,0,0,0,1|2,0,1]=4 2275 B7R0.2 CSC(C)CC(N)=O Amb27838848 [0,0,0,0,0,1|2,0,1]=4 2276 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [0,0,0,0,0,1|1,0,1]=3 2277 B7R0.2 CS\C(C)=C\C(C)=O Amb28315811 [0,0,0,0,0,1|2,0,0]=3 2278 B7R0.2 CS\C(N)=C/C(C)=O Amb8554013 [0,0,0,0,0,1|3,0,0]=4 2279 B7R0.2 CS\C(N)=C\C(C)=O Amb27420945 [0,0,0,0,0,1|3,0,0]=4 2280 B7R0.2 CS\C(N)=N\C(N)=O Amb25757974 [0,0,0,0,0,1|3,0,0]=4 2281 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [0,0,0,0,0,1|1,0,2]=4 2282 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [0,0,0,0,0,1|1,0,2]=4 2283 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [0,0,0,0,0,1|1,0,2]=4 2284 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [0,0,0,0,0,1|1,0,2]=4 2285 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [0,0,0,0,0,1|1,0,2]=4 2286 B7R0.2 C\C(=C/C(=O)Cl)CBr Amb27477400 [0,0,0,0,0,1|2,0,1]=4 2287 B7R0.2 C\C(=C/C(=O)Cl)CCl Amb28134682 [0,0,0,0,0,1|2,0,1]=4 2288 B7R0.2 C\C(=C/C(=O)O)CO Amb18641871 [0,0,0,0,0,1|1,0,1]=3 2289 B7R0.2 C\C(=C/C(N)=O)CN Amb28288035 [0,0,0,0,0,1|2,0,1]=4 2290 B7R0.2 C\C(=C/Cl)N=C(Cl)Cl Amb27477794 [0,0,0,0,0,1|3,0,0]=4 2291 B7R0.2 C\C(=C\Cl)CC(N)=O Amb27391105 [0,0,0,0,0,1|2,0,0]=3 2292 B7R0.2 C\C(C#N)=C/C(=O)O Amb27830669 [0,0,0,0,0,1|1,0,1]=3 2293 B7R0.2 C\C(C=O)=C\C(C)O Amb27802195 [0,0,0,0,0,1|2,0,1]=4 2294 B7R0.2 C\C(CC(=O)O)=N/O Amb28388976 [0,0,0,0,0,1|2,0,0]=3 2295 B7R0.2 C\C(O)=C\C(C)=N/O Amb27227992 [0,0,0,0,0,1|3,0,0]=4 2296 B7R0.2 C\C=C(/C)CC(C)=O Amb28066574 [0,0,0,0,0,1|1,0,0]=2 2297 B7R0.2 C\C=C(/C)CC(C)C Amb27459658 [0,0,0,0,0,1|2,0,1]=4 2298 B7R0.2 C\C=C(\C)CC(C)=O Amb27637813 [0,0,0,0,0,1|1,0,0]=2 2299 B7R0.2 C\C=C(\C)CC(C)C Amb24566930 [0,0,0,0,0,1|2,0,1]=4 2300 B7R0.2 C\C=C(\C)NC(C)=O Amb24468210 [0,0,0,0,0,1|1,0,0]=2 2301 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [0,0,0,0,0,1|1,0,0]=2 2302 B7R0.2 C\N=C(C)/C=C(\C)O Amb27637850 [0,0,0,0,0,1|2,0,0]=3 2303 B7R0.2 NC(=O)NC(=O)C=O Amb27964563 [0,0,0,0,0,1|3,0,0]=4 2304 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [0,0,0,0,0,1|2,0,1]=4 2305 B7R0.2 NC\C(I)=C\C(=O)O Amb28386476 [0,0,0,0,0,1|2,0,1]=4 2306 B7R0.2 NNC(=O)CC(=O)O Amb25073925 [0,0,0,0,0,1|3,0,0]=4 2307 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [0,0,0,0,0,1|2,0,1]=4 2308 B7R0.2 N\C(CC(=O)O)=N/O Amb8384544 [0,0,0,0,0,1|3,0,0]=4 2309 B7R0.2 O=C(O)CC(=O)CCl Amb18124484 [0,0,0,0,0,1|2,0,1]=4 2310 B7R0.2 O=C(O)C\C(Cl)=C\Cl Amb27812877 [0,0,0,0,0,1|2,0,0]=3 2311 B7R0.2 O=C(O)\C=C(/Br)CO Amb27424808 [0,0,0,0,0,1|2,0,1]=4 2312 B7R0.2 O=C(O)\C=C(\O)CBr Amb28458506 [0,0,0,0,0,1|2,0,1]=4 2313 B7R0.2 O=CN(O)CC(=O)O Amb25367291 [0,0,0,0,0,1|3,0,0]=4 2314 B7R0.2 O=C\C(Cl)=C/C(=O)O Amb27852924 [0,0,0,0,0,1|2,0,0]=3 2315 B4R0.1 C#CC(=C)C Amb1101959 [2,0,0,0,0,0|0,0,2]=4 2316 B4R0.1 C#CC(=O)O Amb6600128 [2,0,0,0,0,0|0,0,2]=4 2317 B4R0.1 C#CC(C)=O Amb2685717 [2,0,0,0,0,0|0,0,2]=4 2318 B4R0.1 C=C(Br)C=O Amb33546871 [2,0,0,0,0,0|1,0,0]=3 2319 B4R0.1 C=C(Br)CO Amb33535555 [2,0,0,0,0,0|1,0,1]=4 2320 B4R0.1 C=C(C)C#N Amb6608922 [2,0,0,0,0,0|1,0,1]=4 2321 B4R0.1 C=C(C)C=O Amb3941638 [2,0,0,0,0,0|0,0,0]=2 2322 B4R0.1 C=C(C)CBr Amb33531183 [2,0,0,0,0,0|1,0,1]=4 2323 B4R0.1 C=C(C)CCl Amb2792918 [2,0,0,0,0,0|1,0,1]=4 2324 B4R0.1 C=C(C)CF Amb26019368 [2,0,0,0,0,0|1,0,1]=4 2325 B4R0.1 C=C(C)CI Amb26588956 [2,0,0,0,0,0|1,0,1]=4 2326 B4R0.1 C=C(C)CN Amb17749039 [2,0,0,0,0,0|1,0,1]=4 2327 B4R0.1 C=C(C)CO Amb8513444 [2,0,0,0,0,0|0,0,1]=3 2328 B4R0.1 C=C(C)CS Amb19888160 [2,0,0,0,0,0|0,1,1]=4 2329 B4R0.1 C=C(C)NN Amb27234940 [2,0,0,0,0,0|2,0,0]=4 2330 B4R0.1 C=C(C)OC Amb6296633 [2,0,0,0,0,0|1,0,0]=3 2331 B4R0.1 C=C(C)[Mg]Br Amb22338432 [2,0,0,0,0,0|2,0,0]=4 2332 B4R0.1 C=C(Cl)C=O Amb26318564 [2,0,0,0,0,0|1,0,0]=3 2333 B4R0.1 C=C(Cl)CC Amb22228725 [2,0,0,0,0,0|1,0,1]=4 2334 B4R0.1 C=C(Cl)CO Amb9277799 [2,0,0,0,0,0|1,0,1]=4 2335 B4R0.1 C=C(F)C=O Amb27403515 [2,0,0,0,0,0|1,0,0]=3 2336 B4R0.1 C=C(F)CO Amb22008254 [2,0,0,0,0,0|1,0,1]=4 2337 B4R0.1 C=C(I)C=O Amb25747223 [2,0,0,0,0,0|1,0,0]=3 2338 B4R0.1 C=C(I)CO Amb27762751 [2,0,0,0,0,0|1,0,1]=4 2339 B4R0.1 C=CB(O)O Amb20248084 [2,0,0,0,0,0|1,0,1]=4 2340 B4R0.1 C=CC(=C)Br Amb24552661 [2,0,0,0,0,0|1,0,1]=4 2341 B4R0.1 C=CC(=C)Cl Amb22351555 [2,0,0,0,0,0|1,0,1]=4 2342 B4R0.1 C=CC(=N)N Amb22489590 [2,0,0,0,0,0|2,0,0]=4 2343 B4R0.1 C=CC(=O)Cl Amb17942845 [2,0,0,0,0,0|1,0,0]=3 2344 B4R0.1 C=CC(=O)O Amb2792871 [2,0,0,0,0,0|0,0,0]=2 2345 B4R0.1 C=CC(=O)[O-] Amb17942810 [2,0,0,0,0,0|0,0,1]=3 2346 B4R0.1 C=CC(=O)[O-] Amb22167662 [2,0,0,0,0,0|0,0,1]=3 2347 B4R0.1 C=CC(C)=O Amb6608725 [2,0,0,0,0,0|0,0,1]=3 2348 B4R0.1 C=CC(C)C Amb17666952 [2,0,0,0,0,0|1,0,1]=4 2349 B4R0.1 C=CC(C)O Amb3940379 [2,0,0,0,0,0|0,0,2]=4 2350 B4R0.1 C=CC(N)=O Amb3940456 [2,0,0,0,0,0|1,0,0]=3 2351 B4R0.1 C=CN(C)C Amb25244447 [2,0,0,0,0,0|2,0,0]=4 2352 B4R0.1 C=C[C@@H](C)O Amb26328808 [2,0,0,0,0,0|0,0,2]=4 2353 B4R0.1 C=C[N+](=O)[O-] Amb13883663 [2,0,0,0,0,0|1,0,1]=4 2354 B4R0.1 CC(=N)NO Amb22232230 [2,0,0,0,0,0|2,0,0]=4 2355 B4R0.1 CC(=O)C#N Amb17231798 [2,0,0,0,0,0|1,0,1]=4 2356 B4R0.1 CC(=O)C=O Amb3940421 [2,0,0,0,0,0|1,0,0]=3 2357 B4R0.1 CC(=O)C=S Amb28118569 [2,0,0,0,0,0|1,0,0]=3 2358 B4R0.1 CC(=O)CBr Amb6673867 [2,0,0,0,0,0|1,0,1]=4 2359 B4R0.1 CC(=O)CCl Amb2792923 [2,0,0,0,0,0|1,0,1]=4 2360 B4R0.1 CC(=O)CI Amb22831972 [2,0,0,0,0,0|1,0,1]=4 2361 B4R0.1 CC(=O)CN Amb10603379 [2,0,0,0,0,0|1,0,1]=4 2362 B4R0.1 CC(=O)CN Amb22489444 [2,0,0,0,0,0|1,0,1]=4 2363 B4R0.1 CC(=O)CN Amb8393368 [2,0,0,0,0,0|1,0,1]=4 2364 B4R0.1 CC(=O)CO Amb2404925 [2,0,0,0,0,0|1,0,1]=4 2365 B4R0.1 CC(=O)CS Amb19148935 [2,0,0,0,0,0|1,0,1]=4 2366 B4R0.1 CC(=O)NBr Amb17672559 [2,0,0,0,0,0|2,0,0]=4 2367 B4R0.1 CC(=O)NCl Amb17939326 [2,0,0,0,0,0|2,0,0]=4 2368 B4R0.1 CC(=O)NI Amb28247845 [2,0,0,0,0,0|2,0,0]=4 2369 B4R0.1 CC(=O)NN Amb1153969 [2,0,0,0,0,0|2,0,0]=4 2370 B4R0.1 CC(=O)NO Amb2781575 [2,0,0,0,0,0|2,0,0]=4 2371 B4R0.1 CC(=O)OCl Amb28074273 [2,0,0,0,0,0|2,0,0]=4 2372 B4R0.1 CC(=O)OO Amb8517283 [2,0,0,0,0,0|2,0,0]=4 2373 B4R0.1 CC(Br)C=O Amb8395192 [2,0,0,0,0,0|1,0,1]=4 2374 B4R0.1 CC(C)=C=O Amb17672588 [2,0,0,0,0,0|0,0,1]=3 2375 B4R0.1 CC(C)=CBr Amb10067297 [2,0,0,0,0,0|1,0,0]=3 2376 B4R0.1 CC(C)=CN Amb27597410 [2,0,0,0,0,0|1,0,0]=3 2377 B4R0.1 CC(C)=NN Amb24334355 [2,0,0,0,0,0|2,0,0]=4 2378 B4R0.1 CC(C)=NO Amb4136362 [2,0,0,0,0,0|1,0,0]=3 2379 B4R0.1 CC(C)=[N+]=[N-] Amb22228798 [2,0,0,0,0,0|2,0,0]=4 2380 B4R0.1 CC(C)C=O Amb3939852 [2,0,0,0,0,0|0,0,1]=3 2381 B4R0.1 CC(C)CO Amb3939148 [2,0,0,0,0,0|0,0,2]=4 2382 B4R0.1 CC(C)NO Amb22058701 [2,0,0,0,0,0|1,0,1]=4 2383 B4R0.1 CC(C)NO Amb8515003 [2,0,0,0,0,0|1,0,1]=4 2384 B4R0.1 CC(C)[IH2]=O Amb27985313 [2,0,0,0,0,0|1,0,1]=4 2385 B4R0.1 CC(Cl)C=O Amb10603585 [2,0,0,0,0,0|1,0,1]=4 2386 B4R0.1 CC(F)C=O Amb28366193 [2,0,0,0,0,0|1,0,1]=4 2387 B4R0.1 CC(N)C=O Amb24476907 [2,0,0,0,0,0|1,0,1]=4 2388 B4R0.1 CC(O)C=O Amb24477285 [2,0,0,0,0,0|1,0,1]=4 2389 B4R0.1 CC(S)C=O Amb25799633 [2,0,0,0,0,0|1,0,1]=4 2390 B4R0.1 CC=C(Br)Br Amb22733606 [2,0,0,0,0,0|2,0,0]=4 2391 B4R0.1 CC=C(C)C Amb8513245 [2,0,0,0,0,0|0,0,1]=3 2392 B4R0.1 CC=C(F)F Amb10840482 [2,0,0,0,0,0|2,0,0]=4 2393 B4R0.1 CCC(=O)Br Amb8517649 [2,0,0,0,0,0|1,0,1]=4 2394 B4R0.1 CCC(=O)Cl Amb2792924 [2,0,0,0,0,0|1,0,1]=4 2395 B4R0.1 CCC(=O)F Amb10839798 [2,0,0,0,0,0|1,0,1]=4 2396 B4R0.1 CCC(=O)O Amb3938995 [2,0,0,0,0,0|0,0,1]=3 2397 B4R0.1 CCC(=O)S Amb26953905 [2,0,0,0,0,0|0,1,1]=4 2398 B4R0.1 CCC(=O)[O-] Amb22731204 [2,0,0,0,0,0|0,0,2]=4 2399 B4R0.1 CCC(=O)[O-] Amb8513417 [2,0,0,0,0,0|0,0,2]=4 2400 B4R0.1 CCC(C)=O Amb4606002 [2,0,0,0,0,0|0,0,1]=3 2401 B4R0.1 CCC(C)O Amb9748253 [2,0,0,0,0,0|0,0,2]=4 2402 B4R0.1 CCC(N)=O Amb3886522 [2,0,0,0,0,0|1,0,1]=4 2403 B4R0.1 CCN(C)O Amb25746619 [2,0,0,0,0,0|1,0,1]=4 2404 B4R0.1 CCS(=O)O Amb24332177 [2,0,0,0,0,0|1,0,1]=4 2405 B4R0.1 CCS(C)=O Amb25301908 [2,0,0,0,0,0|1,0,1]=4 2406 B4R0.1 CC[C@@H](C)O Amb8514550 [2,0,0,0,0,0|0,0,2]=4 2407 B4R0.1 CC[C@H](C)O Amb4606006 [2,0,0,0,0,0|0,0,2]=4 2408 B4R0.1 CC[PH](=O)O Amb8391284 [2,0,0,0,0,0|1,0,1]=4 2409 B4R0.1 CN(C)C=O Amb2793011 [2,0,0,0,0,0|1,0,0]=3 2410 B4R0.1 CN(C)C=S Amb2720886 [2,0,0,0,0,0|1,1,0]=4 2411 B4R0.1 CN(C)CO Amb17673884 [2,0,0,0,0,0|1,0,1]=4 2412 B4R0.1 CN(C)N=O Amb17938637 [2,0,0,0,0,0|2,0,0]=4 2413 B4R0.1 CN(C)P=O Amb27424616 [2,0,0,0,0,0|2,0,0]=4 2414 B4R0.1 CN(Cl)C=O Amb28345656 [2,0,0,0,0,0|2,0,0]=4 2415 B4R0.1 CN(N)C=O Amb10843911 [2,0,0,0,0,0|2,0,0]=4 2416 B4R0.1 CN(O)C=O Amb28291395 [2,0,0,0,0,0|2,0,0]=4 2417 B4R0.1 CNC(=O)Cl Amb17942998 [2,0,0,0,0,0|2,0,0]=4 2418 B4R0.1 CNC(=O)F Amb27778388 [2,0,0,0,0,0|2,0,0]=4 2419 B4R0.1 CNC(C)=N Amb27407381 [2,0,0,0,0,0|2,0,0]=4 2420 B4R0.1 CNC(C)=N Amb28555318 [2,0,0,0,0,0|2,0,0]=4 2421 B4R0.1 CNC(C)=O Amb3886523 [2,0,0,0,0,0|1,0,0]=3 2422 B4R0.1 CNC(C)=S Amb23590663 [2,0,0,0,0,0|1,1,0]=4 2423 B4R0.1 CNC(N)=O Amb1152075 [2,0,0,0,0,0|2,0,0]=4 2424 B4R0.1 COC(=O)Cl Amb3940230 [2,0,0,0,0,0|2,0,0]=4 2425 B4R0.1 COC(=O)[O-] Amb25688001 [2,0,0,0,0,0|1,0,1]=4 2426 B4R0.1 COC(C)=N Amb10844798 [2,0,0,0,0,0|2,0,0]=4 2427 B4R0.1 COC(C)=N Amb6366201 [2,0,0,0,0,0|2,0,0]=4 2428 B4R0.1 COC(C)=O Amb6608821 [2,0,0,0,0,0|1,0,0]=3 2429 B4R0.1 COC(N)=O Amb6608701 [2,0,0,0,0,0|2,0,0]=4 2430 B4R0.1 CO[PH](=O)O Amb27489021 [2,0,0,0,0,0|2,0,0]=4 2431 B4R0.1 CSC(=O)Cl Amb22336225 [2,0,0,0,0,0|2,0,0]=4 2432 B4R0.1 CSC(C)=N Amb28344632 [2,0,0,0,0,0|2,0,0]=4 2433 B4R0.1 CSC(C)=S Amb25992258 [2,0,0,0,0,0|1,1,0]=4 2434 B4R0.1 CSC(N)=O Amb25082577 [2,0,0,0,0,0|2,0,0]=4 2435 B4R0.1 CSS(C)=O Amb25786159 [2,0,0,0,0,0|2,0,0]=4 2436 B4R0.1 C[C@@H](O)C=O Amb25745956 [2,0,0,0,0,0|1,0,1]=4 2437 B4R0.1 C[C@H](Cl)C=O Amb27244768 [2,0,0,0,0,0|1,0,1]=4 2438 B4R0.1 C[N+](C)=CBr Amb22730803 [2,0,0,0,0,0|2,0,0]=4 2439 B4R0.1 C[N+](C)=CCl Amb8515174 [2,0,0,0,0,0|2,0,0]=4 2440 B4R0.1 C[N+](C)=CO Amb22731321 [2,0,0,0,0,0|1,0,0]=3 2441 B4R0.1 C\C(Br)=C/Br Amb22730991 [2,0,0,0,0,0|2,0,0]=4 2442 B4R0.1 C\C(Br)=C\Br Amb25950913 [2,0,0,0,0,0|2,0,0]=4 2443 B4R0.1 C\C(Cl)=C/Cl Amb24077348 [2,0,0,0,0,0|2,0,0]=4 2444 B4R0.1 C\C(Cl)=C\Br Amb28386628 [2,0,0,0,0,0|2,0,0]=4 2445 B4R0.1 C\C(Cl)=N/O Amb27975235 [2,0,0,0,0,0|2,0,0]=4 2446 B4R0.1 C\C(Cl)=N\O Amb27843927 [2,0,0,0,0,0|2,0,0]=4 2447 B4R0.1 C\C(F)=C\Cl Amb25663106 [2,0,0,0,0,0|2,0,0]=4 2448 B4R0.1 C\C(N)=N/O Amb499287 [2,0,0,0,0,0|2,0,0]=4 2449 B4R0.1 C\C(N)=N\O Amb10610482 [2,0,0,0,0,0|2,0,0]=4 2450 B4R0.1 C\C(N)=N\O Amb2695158 [2,0,0,0,0,0|2,0,0]=4 2451 B4R0.1 C\C(O)=N\O Amb22492489 [2,0,0,0,0,0|2,0,0]=4 2452 B4R0.1 C\C=C(/C)Cl Amb25025045 [2,0,0,0,0,0|1,0,0]=3 2453 B4R0.1 C\C=C(\C)Br Amb20001493 [2,0,0,0,0,0|1,0,0]=3 2454 B4R0.1 C\C=C(\C)Cl Amb22731715 [2,0,0,0,0,0|1,0,0]=3 2455 B4R0.1 C\C=C(\C)N Amb26529209 [2,0,0,0,0,0|1,0,0]=3 2456 B4R0.1 C\C=C(\Cl)Br Amb24640149 [2,0,0,0,0,0|2,0,0]=4 2457 B4R0.1 NCC(=O)O Amb2609025 [2,0,0,0,0,0|1,0,1]=4 2458 B4R0.1 NCC(=O)O Amb33869972 [2,0,0,0,0,0|1,0,1]=4 2459 B4R0.1 NCC(=O)O Amb8516646 [2,0,0,0,0,0|1,0,1]=4 2460 B4R0.1 NNC(=O)O Amb33512897 [2,0,0,0,0,0|2,0,0]=4 2461 B4R0.1 O=C(O)C=S Amb28042222 [2,0,0,0,0,0|1,0,0]=3 2462 B4R0.1 O=C(O)CBr Amb6608658 [2,0,0,0,0,0|1,0,1]=4 2463 B4R0.1 O=C(O)CCl Amb2792919 [2,0,0,0,0,0|1,0,1]=4 2464 B4R0.1 O=C(O)CF Amb6740304 [2,0,0,0,0,0|1,0,1]=4 2465 B4R0.1 O=C(O)CI Amb1916034 [2,0,0,0,0,0|1,0,1]=4 2466 B4R0.1 O=C(O)CO Amb2793019 [2,0,0,0,0,0|1,0,1]=4 2467 B4R0.1 O=C(O)CS Amb6608659 [2,0,0,0,0,0|1,0,1]=4 2468 B4R0.1 O=C(O)C[Na] Amb28255644 [2,0,0,0,0,0|1,0,1]=4 2469 B4R0.1 O=C(O)O[Na] Amb22411585 [2,0,0,0,0,0|2,0,0]=4 2470 B4R0.1 O=CC(=O)O Amb3940872 [2,0,0,0,0,0|1,0,0]=3 2471 B4R0.1 O=CC(=O)O Amb6609044 [2,0,0,0,0,0|1,0,0]=3 2472 B4R0.1 OC=C(Br)Br Amb25747016 [2,0,0,0,0,0|2,0,0]=4 2473 B4R0.1 OC=C(Cl)Cl Amb27451973 [2,0,0,0,0,0|2,0,0]=4 2474 B4R0.2 C#C\C=C\C Amb22056026 [2,0,0,0,0,0|1,0,1]=4 2475 B4R0.2 C=CCC=O Amb25058716 [2,0,0,0,0,0|0,0,2]=4 2476 B4R0.2 C=CNC=O Amb10844823 [2,0,0,0,0,0|1,0,1]=4 2477 B4R0.2 C=COC=O Amb22734253 [2,0,0,0,0,0|1,0,1]=4 2478 B4R0.2 C=C\C=C/C Amb24477227 [2,0,0,0,0,0|1,0,0]=3 2479 B4R0.2 C=C\C=C\Br Amb26047680 [2,0,0,0,0,0|1,0,1]=4 2480 B4R0.2 C=C\C=C\C Amb17772326 [2,0,0,0,0,0|1,0,0]=3 2481 B4R0.2 C=C\C=C\Cl Amb26602085 [2,0,0,0,0,0|1,0,1]=4 2482 B4R0.2 C=C\C=N\O Amb25912911 [2,0,0,0,0,0|1,0,1]=4 2483 B4R0.2 CC#CC=O Amb24477088 [2,0,0,0,0,0|0,0,2]=4 2484 B4R0.2 CC=C=CC Amb17670597 [2,0,0,0,0,0|1,0,1]=4 2485 B4R0.2 CC=C=CI Amb17673291 [2,0,0,0,0,0|1,0,1]=4 2486 B4R0.2 CCCC=O Amb3940026 [2,0,0,0,0,0|0,0,2]=4 2487 B4R0.2 CCNC=O Amb22229692 [2,0,0,0,0,0|1,0,1]=4 2488 B4R0.2 CCOC=O Amb3429671 [2,0,0,0,0,0|1,0,1]=4 2489 B4R0.2 CC\C=C/I Amb27985379 [2,0,0,0,0,0|1,0,1]=4 2490 B4R0.2 CC\C=C\Cl Amb25024567 [2,0,0,0,0,0|1,0,1]=4 2491 B4R0.2 CC\C=C\I Amb28346900 [2,0,0,0,0,0|1,0,1]=4 2492 B4R0.2 CC\C=N\O Amb24369620 [2,0,0,0,0,0|1,0,1]=4 2493 B4R0.2 CNCC=O Amb28133605 [2,0,0,0,0,0|1,0,1]=4 2494 B4R0.2 CN\C=C\N Amb27403876 [2,0,0,0,0,0|2,0,0]=4 2495 B4R0.2 COCC=O Amb3941034 [2,0,0,0,0,0|1,0,1]=4 2496 B4R0.2 CO\C=C\Br Amb27259287 [2,0,0,0,0,0|2,0,0]=4 2497 B4R0.2 CSCC=O Amb27250514 [2,0,0,0,0,0|1,0,1]=4 2498 B4R0.2 CS\C=C\Br Amb27614429 [2,0,0,0,0,0|2,0,0]=4 2499 B4R0.2 CS\C=C\Cl Amb27244119 [2,0,0,0,0,0|2,0,0]=4 2500 B4R0.2 C\C=C/CC Amb8517400 [2,0,0,0,0,0|1,0,1]=4 2501 B4R0.2 C\C=C/CCl Amb28367227 [2,0,0,0,0,0|1,0,1]=4 2502 B4R0.2 C\C=C\C#N Amb6308547 [2,0,0,0,0,0|1,0,1]=4 2503 B4R0.2 C\C=C\C=O Amb6891937 [2,0,0,0,0,0|0,0,0]=2 2504 B4R0.2 C\C=C\CBr Amb3940083 [2,0,0,0,0,0|1,0,1]=4 2505 B4R0.2 C\C=C\CC Amb9134767 [2,0,0,0,0,0|1,0,1]=4 2506 B4R0.2 C\C=C\CCl Amb3940264 [2,0,0,0,0,0|1,0,1]=4 2507 B4R0.2 C\C=C\CI Amb26567317 [2,0,0,0,0,0|1,0,1]=4 2508 B4R0.2 C\C=C\CN Amb22490422 [2,0,0,0,0,0|1,0,1]=4 2509 B4R0.2 C\C=C\CN Amb32693433 [2,0,0,0,0,0|1,0,1]=4 2510 B4R0.2 C\C=C\CO Amb9277796 [2,0,0,0,0,0|0,0,1]=3 2511 B4R0.2 C\C=C\OC Amb25747348 [2,0,0,0,0,0|2,0,0]=4 2512 B4R0.2 C\C=C\SC Amb27782691 [2,0,0,0,0,0|2,0,0]=4 2513 B4R0.2 C\N=C\C=O Amb27849988 [2,0,0,0,0,0|1,0,0]=3 2514 B4R0.2 N\C=C/C=O Amb25246630 [2,0,0,0,0,0|1,0,0]=3 2515 B4R0.2 N\C=C\C=O Amb33946746 [2,0,0,0,0,0|1,0,0]=3 2516 B4R0.2 O=CC=S=O Amb27436150 [2,0,0,0,0,0|2,0,0]=4 2517 B4R0.2 O=CCC=O Amb33512721 [2,0,0,0,0,0|1,0,1]=4 2518 B4R0.2 O=CNC=O Amb25721263 [2,0,0,0,0,0|2,0,0]=4 2519 B4R0.2 O=CNC=O Amb33982955 [2,0,0,0,0,0|2,0,0]=4 2520 B4R0.2 O=C\C=C/Br Amb27876427 [2,0,0,0,0,0|1,0,0]=3 2521 B4R0.2 O=C\C=C/I Amb27863578 [2,0,0,0,0,0|1,0,0]=3 2522 B4R0.2 O=C\C=C\Cl Amb17593041 [2,0,0,0,0,0|1,0,0]=3 2523 B4R0.2 O=C\C=N\O Amb25746308 [2,0,0,0,0,0|2,0,0]=4 2524 B4R0.2 O=N\C=C\Cl Amb27403065 [2,0,0,0,0,0|2,0,0]=4 2525 B4R0.2 OC\C=C/I Amb23539305 [2,0,0,0,0,0|1,0,1]=4 2526 B4R0.2 OC\C=C\Br Amb32653556 [2,0,0,0,0,0|1,0,1]=4 2527 B4R0.2 OC\C=C\Cl Amb33531874 [2,0,0,0,0,0|1,0,1]=4 2528 B4R0.2 OC\C=C\I Amb24642752 [2,0,0,0,0,0|1,0,1]=4 2529 B4R0.2 O\C=C\CCl Amb27449221 [2,0,0,0,0,0|1,0,1]=4 2530 B6R0.1 C#CC(=O)\C=C\C Amb26354606 [1,1,0,0,0,0|1,0,0]=3 2531 B6R0.1 C#CC(O)\C=C\C Amb3354801 [1,1,0,0,0,0|1,0,1]=4 2532 B6R0.1 C=C=CC(=O)OC Amb24478408 [1,1,0,0,0,0|0,0,2]=4 2533 B6R0.1 C=CC(=O)\C=C\Cl Amb27233658 [1,1,0,0,0,0|2,0,0]=4 2534 B6R0.1 C=CNC(=O)OC Amb24479688 [1,1,0,0,0,0|1,0,1]=4 2535 B6R0.1 C=C\C=C(/C)CO Amb17843900 [1,1,0,0,0,0|1,0,1]=4 2536 B6R0.1 C=C\C=C(/Cl)C=O Amb27797386 [1,1,0,0,0,0|1,0,1]=4 2537 B6R0.1 C=C\C=C(\Br)C=O Amb18126250 [1,1,0,0,0,0|1,0,1]=4 2538 B6R0.1 CC#CC(=O)OC Amb2689389 [1,1,0,0,0,0|0,0,2]=4 2539 B6R0.1 CC=C=C(C)CO Amb28048302 [1,1,0,0,0,0|1,0,1]=4 2540 B6R0.1 CCC(=O)\C=C/Cl Amb28351606 [1,1,0,0,0,0|2,0,0]=4 2541 B6R0.1 CCC(=O)\C=C\Cl Amb17593220 [1,1,0,0,0,0|2,0,0]=4 2542 B6R0.1 CCC(=O)\C=C\N Amb26341655 [1,1,0,0,0,0|2,0,0]=4 2543 B6R0.1 CCCC(=O)CO Amb25125092 [1,1,0,0,0,0|0,0,2]=4 2544 B6R0.1 CCCC(=O)NO Amb6260495 [1,1,0,0,0,0|0,0,2]=4 2545 B6R0.1 CCCC(=O)OC Amb8516697 [1,1,0,0,0,0|0,0,2]=4 2546 B6R0.1 CCNC(=O)CO Amb9421415 [1,1,0,0,0,0|1,0,1]=4 2547 B6R0.1 CCNC(=O)NO Amb28345704 [1,1,0,0,0,0|1,0,1]=4 2548 B6R0.1 CCNC(=O)OC Amb22734099 [1,1,0,0,0,0|1,0,1]=4 2549 B6R0.1 CCOC(=O)CO Amb3939196 [1,1,0,0,0,0|1,0,1]=4 2550 B6R0.1 CCOC(=O)NO Amb8384324 [1,1,0,0,0,0|1,0,1]=4 2551 B6R0.1 CCOC(=O)OC Amb22732530 [1,1,0,0,0,0|1,0,1]=4 2552 B6R0.1 CC\C=C(/C)C=O Amb3940425 [1,1,0,0,0,0|1,0,1]=4 2553 B6R0.1 CC\C=C(/C)CO Amb22347713 [1,1,0,0,0,0|1,0,1]=4 2554 B6R0.1 CC\C=C(/Cl)C=O Amb28050393 [1,1,0,0,0,0|1,0,1]=4 2555 B6R0.1 CC\C=C(/O)C=O Amb27849683 [1,1,0,0,0,0|0,0,1]=3 2556 B6R0.1 CC\C=C(\C)CO Amb24677771 [1,1,0,0,0,0|1,0,1]=4 2557 B6R0.1 CC\C=C(\O)C=O Amb27195226 [1,1,0,0,0,0|0,0,1]=3 2558 B6R0.1 CNC(=O)\C=C/Br Amb27425015 [1,1,0,0,0,0|2,0,0]=4 2559 B6R0.1 CNC(=O)\C=C\I Amb27966681 [1,1,0,0,0,0|2,0,0]=4 2560 B6R0.1 CNCC(=O)OC Amb1153975 [1,1,0,0,0,0|1,0,1]=4 2561 B6R0.1 CNCC(=O)OC Amb2371116 [1,1,0,0,0,0|1,0,1]=4 2562 B6R0.1 CNNC(=O)OC Amb22411352 [1,1,0,0,0,0|2,0,0]=4 2563 B6R0.1 COC(=O)C=[N+]=[N-] Amb25746091 [1,1,0,0,0,0|2,0,0]=4 2564 B6R0.1 COC(=O)CC=O Amb18199826 [1,1,0,0,0,0|1,0,1]=4 2565 B6R0.1 COC(=O)CSC Amb2689527 [1,1,0,0,0,0|1,0,1]=4 2566 B6R0.1 COC(=O)\C=C/Br Amb10067501 [1,1,0,0,0,0|1,0,0]=3 2567 B6R0.1 COC(=O)\C=C/Cl Amb27878734 [1,1,0,0,0,0|1,0,0]=3 2568 B6R0.1 COC(=O)\C=C/I Amb2455616 [1,1,0,0,0,0|1,0,0]=3 2569 B6R0.1 COC(=O)\C=C\Br Amb33986032 [1,1,0,0,0,0|1,0,0]=3 2570 B6R0.1 COC(=O)\C=C\I Amb33986599 [1,1,0,0,0,0|1,0,0]=3 2571 B6R0.1 COC(=O)\C=C\N Amb8386481 [1,1,0,0,0,0|1,0,0]=3 2572 B6R0.1 COC(=O)\C=C\[O-] Amb32729428 [1,1,0,0,0,0|1,0,0]=3 2573 B6R0.1 COCC(=O)OC Amb8513624 [1,1,0,0,0,0|1,0,1]=4 2574 B6R0.1 CONC(=O)CO Amb28344874 [1,1,0,0,0,0|2,0,0]=4 2575 B6R0.1 CO\C=C(/Br)C=O Amb28198038 [1,1,0,0,0,0|2,0,0]=4 2576 B6R0.1 CO\C=C(/F)C=O Amb27831789 [1,1,0,0,0,0|2,0,0]=4 2577 B6R0.1 CO\C=C(/F)CO Amb22546782 [1,1,0,0,0,0|2,0,0]=4 2578 B6R0.1 CO\C=C(/O)C=O Amb27797385 [1,1,0,0,0,0|1,0,0]=3 2579 B6R0.1 CO\C=C(\F)C=O Amb27875481 [1,1,0,0,0,0|2,0,0]=4 2580 B6R0.1 CSCC(=O)NO Amb28057751 [1,1,0,0,0,0|1,0,1]=4 2581 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [1,1,0,0,0,0|1,0,1]=4 2582 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [1,1,0,0,0,0|1,0,1]=4 2583 B6R0.1 C\C(C=O)=C/C=O Amb27597073 [1,1,0,0,0,0|2,0,0]=4 2584 B6R0.1 C\C=C/C(Br)=C/Cl Amb27396622 [1,1,0,0,0,0|2,0,0]=4 2585 B6R0.1 C\C=C/C(Cl)=C\Br Amb27407128 [1,1,0,0,0,0|2,0,0]=4 2586 B6R0.1 C\C=C\C(=O)C#N Amb27434248 [1,1,0,0,0,0|1,0,0]=3 2587 B6R0.1 C\C=C\C(=O)C=O Amb27838207 [1,1,0,0,0,0|0,0,1]=3 2588 B6R0.1 C\C=C\C(=O)CC Amb8517594 [1,1,0,0,0,0|1,0,0]=3 2589 B6R0.1 C\C=C\C(=O)CCl Amb26438240 [1,1,0,0,0,0|1,0,0]=3 2590 B6R0.1 C\C=C\C(=O)NN Amb25796185 [1,1,0,0,0,0|1,0,0]=3 2591 B6R0.1 C\C=C\C(=O)OC Amb8513568 [1,1,0,0,0,0|0,0,0]=2 2592 B6R0.1 C\C=C\C(=S)NC Amb27252022 [1,1,0,0,0,0|1,1,0]=4 2593 B6R0.1 C\C=C\C(Br)=C\Cl Amb28248126 [1,1,0,0,0,0|2,0,0]=4 2594 B6R0.1 C\C=C\C(C)=C\Cl Amb27640596 [1,1,0,0,0,0|2,0,0]=4 2595 B6R0.1 C\C=C\C(C)CO Amb28074694 [1,1,0,0,0,0|1,0,1]=4 2596 B6R0.1 C\C=C\C(C)OC Amb27473820 [1,1,0,0,0,0|1,0,1]=4 2597 B6R0.1 C\C=C\C(F)CO Amb27207741 [1,1,0,0,0,0|1,0,1]=4 2598 B6R0.1 C\C=C\C(O)C#N Amb28070915 [1,1,0,0,0,0|1,0,1]=4 2599 B6R0.1 C\C=C\C(O)CC Amb22731799 [1,1,0,0,0,0|1,0,1]=4 2600 B6R0.1 C\C=C\C(O)CCl Amb25919359 [1,1,0,0,0,0|1,0,1]=4 2601 B6R0.1 C\C=C\C(O)CO Amb27764770 [1,1,0,0,0,0|0,0,2]=4 2602 B6R0.1 C\C=C\[C@@H](C)CO Amb27423303 [1,1,0,0,0,0|1,0,1]=4 2603 B6R0.1 C\C=C\[C@@H](O)CN Amb27814562 [1,1,0,0,0,0|1,0,1]=4 2604 B6R0.1 C\C=C\[C@@H](O)CO Amb27448465 [1,1,0,0,0,0|0,0,2]=4 2605 B6R0.1 C\C=C\[C@H](O)C#N Amb28281959 [1,1,0,0,0,0|1,0,1]=4 2606 B6R0.1 C\C=C\[C@H](O)CCl Amb28144520 [1,1,0,0,0,0|1,0,1]=4 2607 B6R0.1 O=C(\C=C/Br)CCl Amb28050548 [1,1,0,0,0,0|2,0,0]=4 2608 B6R0.1 O=C(\C=C\Cl)CCl Amb13952715 [1,1,0,0,0,0|2,0,0]=4 2609 B6R0.1 O=COC(=O)CO Amb27457699 [1,1,0,0,0,0|2,0,0]=4 2610 B6R0.1 O=C\C=C(/Br)C=O Amb27169466 [1,1,0,0,0,0|2,0,0]=4 2611 B6R0.2 C=C(C)C=C(C)C Amb8513505 [1,1,0,0,0,0|2,0,0]=4 2612 B6R0.2 C=C(C)CC(=O)O Amb6278832 [1,1,0,0,0,0|0,0,1]=3 2613 B6R0.2 C=C(C)CC(C)=O Amb17593075 [1,1,0,0,0,0|1,0,1]=4 2614 B6R0.2 C=C(C)OC(C)=O Amb6608981 [1,1,0,0,0,0|2,0,0]=4 2615 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [1,1,0,0,0,0|0,0,2]=4 2616 B6R0.2 C=C(I)CC(=O)O Amb27598435 [1,1,0,0,0,0|0,0,2]=4 2617 B6R0.2 CC(=O)C=C(C)C Amb2793052 [1,1,0,0,0,0|1,0,0]=3 2618 B6R0.2 CC(=O)C=C(N)N Amb27788295 [1,1,0,0,0,0|2,0,0]=4 2619 B6R0.2 CC(=O)CC(=O)F Amb28122452 [1,1,0,0,0,0|1,0,1]=4 2620 B6R0.2 CC(=O)CC(=O)O Amb377432 [1,1,0,0,0,0|0,0,1]=3 2621 B6R0.2 CC(=O)CC(=O)[O-] Amb31031013 [1,1,0,0,0,0|0,0,2]=4 2622 B6R0.2 CC(=O)CC(C)=O Amb2716228 [1,1,0,0,0,0|1,0,1]=4 2623 B6R0.2 CC(=O)CC(C)=S Amb28381251 [1,1,0,0,0,0|1,0,1]=4 2624 B6R0.2 CC(=O)CC(N)=O Amb6608777 [1,1,0,0,0,0|1,0,1]=4 2625 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [1,1,0,0,0,0|1,0,1]=4 2626 B6R0.2 CC(=O)NC(C)=O Amb4066511 [1,1,0,0,0,0|2,0,0]=4 2627 B6R0.2 CC(=O)NC(C)=S Amb28246616 [1,1,0,0,0,0|2,0,0]=4 2628 B6R0.2 CC(=O)NC(N)=O Amb6891959 [1,1,0,0,0,0|2,0,0]=4 2629 B6R0.2 CC(=O)OC(C)=O Amb2793035 [1,1,0,0,0,0|2,0,0]=4 2630 B6R0.2 CC(=O)OC(N)=O Amb28283882 [1,1,0,0,0,0|2,0,0]=4 2631 B6R0.2 CC(=O)SC(=O)Cl Amb32679653 [1,1,0,0,0,0|2,0,0]=4 2632 B6R0.2 CC(=O)SC(C)=O Amb4025813 [1,1,0,0,0,0|2,0,0]=4 2633 B6R0.2 CC(=O)[CH-]C(C)=O Amb34196937 [1,1,0,0,0,0|1,0,1]=4 2634 B6R0.2 CC(=O)[CH-]C(C)=O Amb9787378 [1,1,0,0,0,0|1,0,1]=4 2635 B6R0.2 CC(=O)\C=C(/C)N Amb1149988 [1,1,0,0,0,0|1,0,0]=3 2636 B6R0.2 CC(=O)\C=C(/C)S Amb27658727 [1,1,0,0,0,0|1,0,0]=3 2637 B6R0.2 CC(=O)\C=C(\C)Br Amb27838200 [1,1,0,0,0,0|1,0,0]=3 2638 B6R0.2 CC(=O)\C=C(\C)Cl Amb27196730 [1,1,0,0,0,0|1,0,0]=3 2639 B6R0.2 CC(=O)\C=C(\C)N Amb2720902 [1,1,0,0,0,0|1,0,0]=3 2640 B6R0.2 CC(=O)\C=C(\C)O Amb34915197 [1,1,0,0,0,0|1,0,0]=3 2641 B6R0.2 CC(=O)\C=C(\C)S Amb26910658 [1,1,0,0,0,0|1,0,0]=3 2642 B6R0.2 CC(=O)\C=C(\C)[O-] Amb19959976 [1,1,0,0,0,0|1,0,0]=3 2643 B6R0.2 CC(=O)\C=C(\C)[O-] Amb20239443 [1,1,0,0,0,0|1,0,0]=3 2644 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22045408 [1,1,0,0,0,0|1,0,0]=3 2645 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053071 [1,1,0,0,0,0|1,0,0]=3 2646 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053499 [1,1,0,0,0,0|1,0,0]=3 2647 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053500 [1,1,0,0,0,0|1,0,0]=3 2648 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053502 [1,1,0,0,0,0|1,0,0]=3 2649 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053503 [1,1,0,0,0,0|1,0,0]=3 2650 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053694 [1,1,0,0,0,0|1,0,0]=3 2651 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053940 [1,1,0,0,0,0|1,0,0]=3 2652 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22054020 [1,1,0,0,0,0|1,0,0]=3 2653 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22466635 [1,1,0,0,0,0|1,0,0]=3 2654 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22729908 [1,1,0,0,0,0|1,0,0]=3 2655 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22730050 [1,1,0,0,0,0|1,0,0]=3 2656 B6R0.2 CC(=O)\C=C(\C)[O-] Amb34915499 [1,1,0,0,0,0|1,0,0]=3 2657 B6R0.2 CC(=O)\N=C(/C)N Amb27796085 [1,1,0,0,0,0|2,0,0]=4 2658 B6R0.2 CC(=S)CC(=O)O Amb28067768 [1,1,0,0,0,0|0,0,1]=3 2659 B6R0.2 CC(Br)CC(=O)O Amb8517108 [1,1,0,0,0,0|0,0,2]=4 2660 B6R0.2 CC(C)=CB(O)O Amb2455988 [1,1,0,0,0,0|1,0,1]=4 2661 B6R0.2 CC(C)=CC(=O)Cl Amb2782315 [1,1,0,0,0,0|1,0,0]=3 2662 B6R0.2 CC(C)=CC(=O)O Amb1485519 [1,1,0,0,0,0|0,0,0]=2 2663 B6R0.2 CC(C)=CC(C)O Amb22229846 [1,1,0,0,0,0|1,0,1]=4 2664 B6R0.2 CC(C)=CC(N)=O Amb10561758 [1,1,0,0,0,0|1,0,0]=3 2665 B6R0.2 CC(C)=CC(N)=S Amb18108367 [1,1,0,0,0,0|1,1,0]=4 2666 B6R0.2 CC(C)=C[N+](=O)[O-] Amb22167019 [1,1,0,0,0,0|1,0,1]=4 2667 B6R0.2 CC(C)CC(=O)O Amb3939848 [1,1,0,0,0,0|0,0,2]=4 2668 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [1,1,0,0,0,0|0,0,2]=4 2669 B6R0.2 CC(I)CC(=O)O Amb28398380 [1,1,0,0,0,0|0,0,2]=4 2670 B6R0.2 CC(N)CC(=O)O Amb8379759 [1,1,0,0,0,0|0,0,2]=4 2671 B6R0.2 CC(O)CC(=O)O Amb8513187 [1,1,0,0,0,0|0,0,2]=4 2672 B6R0.2 CC(S)CC(=O)O Amb33538201 [1,1,0,0,0,0|0,0,2]=4 2673 B6R0.2 CN(C)CC(=O)O Amb3319051 [1,1,0,0,0,0|1,0,1]=4 2674 B6R0.2 CN(C)CC(=O)O Amb3940366 [1,1,0,0,0,0|1,0,1]=4 2675 B6R0.2 CN(N)CC(=O)O Amb23592296 [1,1,0,0,0,0|1,0,1]=4 2676 B6R0.2 CN(O)CC(=O)O Amb29838290 [1,1,0,0,0,0|1,0,1]=4 2677 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [1,1,0,0,0,0|0,0,2]=4 2678 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [1,1,0,0,0,0|0,0,2]=4 2679 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [1,1,0,0,0,0|0,0,2]=4 2680 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [1,1,0,0,0,0|0,0,2]=4 2681 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [1,1,0,0,0,0|0,0,2]=4 2682 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [1,1,0,0,0,0|0,0,2]=4 2683 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [1,1,0,0,0,0|0,0,2]=4 2684 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [1,1,0,0,0,0|0,0,2]=4 2685 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [1,1,0,0,0,0|0,0,2]=4 2686 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [1,1,0,0,0,0|1,0,1]=4 2687 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [1,1,0,0,0,0|1,0,1]=4 2688 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [1,1,0,0,0,0|0,0,0]=2 2689 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [1,1,0,0,0,0|0,0,0]=2 2690 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [1,1,0,0,0,0|0,0,0]=2 2691 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [1,1,0,0,0,0|0,0,0]=2 2692 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [1,1,0,0,0,0|0,0,0]=2 2693 B6R0.2 C\C(I)=C\C(N)=O Amb28058366 [1,1,0,0,0,0|1,0,0]=3 2694 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [1,1,0,0,0,0|0,0,0]=2 2695 B6R0.2 C\C(N)=C/C(N)=O Amb26600164 [1,1,0,0,0,0|1,0,0]=3 2696 B6R0.2 C\C(N)=C/[N+](=O)[O-] Amb32416117 [1,1,0,0,0,0|1,0,1]=4 2697 B6R0.2 C\C(N)=C\C(N)=S Amb19929130 [1,1,0,0,0,0|1,1,0]=4 2698 B6R0.2 C\C(N)=C\[N+](=O)[O-] Amb28130569 [1,1,0,0,0,0|1,0,1]=4 2699 B6R0.2 C\C(S)=C\C(N)=O Amb27596108 [1,1,0,0,0,0|1,0,0]=3 2700 B6R0.2 C\C([O-])=C\[N+](=O)[O-] Amb22549288 [1,1,0,0,0,0|1,0,1]=4 2701 B6R0.2 NC(=O)CC(=O)O Amb4034884 [1,1,0,0,0,0|1,0,1]=4 2702 B6R0.2 NC(=S)CC(=O)O Amb17465742 [1,1,0,0,0,0|1,0,1]=4 2703 B6R0.2 NC(N)=CC(=O)O Amb27618962 [1,1,0,0,0,0|1,0,0]=3 2704 B6R0.2 O=C(O)C=C(Br)Br Amb24435008 [1,1,0,0,0,0|1,0,0]=3 2705 B6R0.2 O=C(O)C=C(Cl)Cl Amb33544334 [1,1,0,0,0,0|1,0,0]=3 2706 B6R0.2 O=C(O)C=C(F)F Amb24116995 [1,1,0,0,0,0|1,0,0]=3 2707 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [1,1,0,0,0,0|1,0,1]=4 2708 B6R0.2 O=C(O)CC(=O)O Amb2689065 [1,1,0,0,0,0|1,0,1]=4 2709 B6R0.2 O=C(O)\C=C(\Cl)Br Amb27955839 [1,1,0,0,0,0|1,0,0]=3 2710 B6R0.4 C#C\C=C\C(=O)O Amb17593056 [1,1,0,0,0,0|0,0,1]=3 2711 B6R0.4 C=C(C)\C=C\CCl Amb25991091 [1,1,0,0,0,0|2,0,0]=4 2712 B6R0.4 C=C(C)\C=C\CN Amb33199533 [1,1,0,0,0,0|2,0,0]=4 2713 B6R0.4 C=C(C)\C=C\CO Amb33473880 [1,1,0,0,0,0|2,0,0]=4 2714 B6R0.4 C=C(F)\C=C\CCl Amb28363835 [1,1,0,0,0,0|2,0,0]=4 2715 B6R0.4 C=C=CCC(=O)O Amb26657414 [1,1,0,0,0,0|0,0,2]=4 2716 B6R0.4 C=CCCC(=O)O Amb3940112 [1,1,0,0,0,0|0,0,2]=4 2717 B6R0.4 C=CNCC(=O)O Amb28346027 [1,1,0,0,0,0|0,0,2]=4 2718 B6R0.4 C=COCC(=O)O Amb27247261 [1,1,0,0,0,0|0,0,2]=4 2719 B6R0.4 C=C\C=C/C(C)=O Amb27165543 [1,1,0,0,0,0|1,0,1]=4 2720 B6R0.4 C=C\C=C\C(=O)Cl Amb26530329 [1,1,0,0,0,0|1,0,1]=4 2721 B6R0.4 CC#CCC(=O)O Amb17939740 [1,1,0,0,0,0|0,0,2]=4 2722 B6R0.4 CC(=O)N\C=C/S Amb27246451 [1,1,0,0,0,0|2,0,0]=4 2723 B6R0.4 CC(=O)N\C=C\Cl Amb28132682 [1,1,0,0,0,0|2,0,0]=4 2724 B6R0.4 CC(=O)O\C=C/Br Amb27484017 [1,1,0,0,0,0|2,0,0]=4 2725 B6R0.4 CC(=O)\C=C/C#N Amb28050527 [1,1,0,0,0,0|1,0,1]=4 2726 B6R0.4 CC(=O)\C=C/C=O Amb27424884 [1,1,0,0,0,0|1,0,1]=4 2727 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [1,1,0,0,0,0|1,0,0]=3 2728 B6R0.4 CC(=O)\C=C\CF Amb33379250 [1,1,0,0,0,0|1,0,0]=3 2729 B6R0.4 CC(O)\C=C/CO Amb30621794 [1,1,0,0,0,0|1,0,1]=4 2730 B6R0.4 CC=C=CB(O)O Amb27397329 [1,1,0,0,0,0|1,0,1]=4 2731 B6R0.4 CC=C=CC(=O)O Amb17593065 [1,1,0,0,0,0|0,0,0]=2 2732 B6R0.4 CC=C=C[PH](=O)O Amb27430355 [1,1,0,0,0,0|1,0,0]=3 2733 B6R0.4 CCC#CC(=O)O Amb6336503 [1,1,0,0,0,0|0,0,2]=4 2734 B6R0.4 CCCCC(=O)O Amb3939877 [1,1,0,0,0,0|0,0,2]=4 2735 B6R0.4 CCNCC(=O)O Amb10609667 [1,1,0,0,0,0|0,0,2]=4 2736 B6R0.4 CCNCC(=O)O Amb7764661 [1,1,0,0,0,0|0,0,2]=4 2737 B6R0.4 CCOCC(=O)O Amb3939880 [1,1,0,0,0,0|0,0,2]=4 2738 B6R0.4 CCPCC(=O)O Amb28321137 [1,1,0,0,0,0|0,0,2]=4 2739 B6R0.4 CCSCC(=O)O Amb1125185 [1,1,0,0,0,0|0,0,2]=4 2740 B6R0.4 CC\C=C/C(=O)O Amb28429841 [1,1,0,0,0,0|0,0,0]=2 2741 B6R0.4 CC\C=C/C(C)=O Amb27835645 [1,1,0,0,0,0|1,0,0]=3 2742 B6R0.4 CC\C=C\B(O)O Amb24078362 [1,1,0,0,0,0|1,0,1]=4 2743 B6R0.4 CC\C=C\C(=N)N Amb33171614 [1,1,0,0,0,0|2,0,0]=4 2744 B6R0.4 CC\C=C\C(=O)Cl Amb2690073 [1,1,0,0,0,0|1,0,0]=3 2745 B6R0.4 CC\C=C\C(=O)O Amb6608967 [1,1,0,0,0,0|0,0,0]=2 2746 B6R0.4 CC\C=C\C(C)=O Amb26022886 [1,1,0,0,0,0|1,0,0]=3 2747 B6R0.4 CC\C=C\C(C)O Amb25888544 [1,1,0,0,0,0|1,0,1]=4 2748 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,1,0,0,0,0|1,0,0]=3 2749 B6R0.4 CC\C=C\C(N)=S Amb33272632 [1,1,0,0,0,0|1,1,0]=4 2750 B6R0.4 CC\C=C\[C@@H](C)O Amb33429815 [1,1,0,0,0,0|1,0,1]=4 2751 B6R0.4 CC\C=C\[C@H](C)O Amb33449173 [1,1,0,0,0,0|1,0,1]=4 2752 B6R0.4 CC\C=C\[N+](=O)[O-] Amb25190046 [1,1,0,0,0,0|1,0,1]=4 2753 B6R0.4 CC\N=C\C(=O)O Amb28041425 [1,1,0,0,0,0|0,0,1]=3 2754 B6R0.4 CC\N=C\C(C)=O Amb27854982 [1,1,0,0,0,0|1,0,1]=4 2755 B6R0.4 CNCCC(=O)O Amb10609760 [1,1,0,0,0,0|0,0,2]=4 2756 B6R0.4 CNCCC(=O)O Amb7766400 [1,1,0,0,0,0|0,0,2]=4 2757 B6R0.4 CN\C=C\C(C)=O Amb17593076 [1,1,0,0,0,0|1,0,0]=3 2758 B6R0.4 COCCC(=O)O Amb3938990 [1,1,0,0,0,0|0,0,2]=4 2759 B6R0.4 CO\C=C/C(C)=O Amb27264758 [1,1,0,0,0,0|1,0,0]=3 2760 B6R0.4 CO\C=C\C(=O)Cl Amb25349516 [1,1,0,0,0,0|1,0,0]=3 2761 B6R0.4 CO\C=C\C(=O)O Amb18121767 [1,1,0,0,0,0|0,0,0]=2 2762 B6R0.4 CO\C=C\C(C)=O Amb8385700 [1,1,0,0,0,0|1,0,0]=3 2763 B6R0.4 CO\C=C\C(N)=O Amb27153308 [1,1,0,0,0,0|1,0,0]=3 2764 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,1,0,0,0,0|1,0,0]=3 2765 B6R0.4 CSC#CC(=O)O Amb33309663 [1,1,0,0,0,0|0,0,2]=4 2766 B6R0.4 CSCCC(=O)O Amb3939879 [1,1,0,0,0,0|0,0,2]=4 2767 B6R0.4 CSSCC(=O)O Amb25378801 [1,1,0,0,0,0|1,0,1]=4 2768 B6R0.4 CS\C=C/C(C)=O Amb27471812 [1,1,0,0,0,0|1,0,0]=3 2769 B6R0.4 CS\C=C\C(=O)O Amb30584688 [1,1,0,0,0,0|0,0,0]=2 2770 B6R0.4 CS\C=C\[N+](=O)[O-] Amb35704405 [1,1,0,0,0,0|1,0,1]=4 2771 B6R0.4 C\C=C/CB(O)O Amb27620496 [1,1,0,0,0,0|1,0,1]=4 2772 B6R0.4 C\C=C/NC(C)=S Amb28282715 [1,1,0,0,0,0|1,1,0]=4 2773 B6R0.4 C\C=C\CC(=N)N Amb25176208 [1,1,0,0,0,0|2,0,0]=4 2774 B6R0.4 C\C=C\CC(=O)O Amb3941538 [1,1,0,0,0,0|0,0,0]=2 2775 B6R0.4 C\C=C\CC(N)=O Amb26589975 [1,1,0,0,0,0|1,0,0]=3 2776 B6R0.4 C\C=C\CS(=O)[O-] Amb26887775 [1,1,0,0,0,0|1,0,1]=4 2777 B6R0.4 C\C=C\C[C@H](C)O Amb27662307 [1,1,0,0,0,0|1,0,1]=4 2778 B6R0.4 C\C=C\NC(C)=S Amb27881690 [1,1,0,0,0,0|1,1,0]=4 2779 B6R0.4 C\C=N\NC(N)=O Amb24351023 [1,1,0,0,0,0|2,0,0]=4 2780 B6R0.4 C\N=C\CC(C)=O Amb28202181 [1,1,0,0,0,0|1,0,1]=4 2781 B6R0.4 N#C\C=C\C(=O)O Amb25853809 [1,1,0,0,0,0|0,0,1]=3 2782 B6R0.4 N=CNCC(=O)O Amb24670244 [1,1,0,0,0,0|1,0,1]=4 2783 B6R0.4 NC(=O)C\C=C/Cl Amb27593169 [1,1,0,0,0,0|2,0,0]=4 2784 B6R0.4 NCC#CC(=O)O Amb25703096 [1,1,0,0,0,0|0,0,2]=4 2785 B6R0.4 NCC#CC(=O)O Amb32666878 [1,1,0,0,0,0|0,0,2]=4 2786 B6R0.4 NCCCC(=O)O Amb1935210 [1,1,0,0,0,0|0,0,2]=4 2787 B6R0.4 NC\C=C/C(=O)O Amb24117018 [1,1,0,0,0,0|0,0,0]=2 2788 B6R0.4 NC\C=C\B(O)O Amb25824731 [1,1,0,0,0,0|1,0,1]=4 2789 B6R0.4 NC\C=C\C(=O)O Amb33422010 [1,1,0,0,0,0|0,0,0]=2 2790 B6R0.4 NC\C=C\C(=O)O Amb33422035 [1,1,0,0,0,0|0,0,0]=2 2791 B6R0.4 O=C(Cl)\C=C\CCl Amb33294776 [1,1,0,0,0,0|1,0,0]=3 2792 B6R0.4 O=C(O)C#CCCl Amb33544591 [1,1,0,0,0,0|0,0,2]=4 2793 B6R0.4 O=C(O)C#CCI Amb27860307 [1,1,0,0,0,0|0,0,2]=4 2794 B6R0.4 O=C(O)C#CCO Amb22002375 [1,1,0,0,0,0|0,0,2]=4 2795 B6R0.4 O=C(O)CCCBr Amb8393276 [1,1,0,0,0,0|0,0,2]=4 2796 B6R0.4 O=C(O)CCCCl Amb3940333 [1,1,0,0,0,0|0,0,2]=4 2797 B6R0.4 O=C(O)CCCF Amb17593104 [1,1,0,0,0,0|0,0,2]=4 2798 B6R0.4 O=C(O)CCCI Amb22295911 [1,1,0,0,0,0|0,0,2]=4 2799 B6R0.4 O=C(O)CCCO Amb18640332 [1,1,0,0,0,0|0,0,2]=4 2800 B6R0.4 O=C(O)CCCS Amb16185429 [1,1,0,0,0,0|0,0,2]=4 2801 B6R0.4 O=C(O)COCF Amb33378705 [1,1,0,0,0,0|1,0,1]=4 2802 B6R0.4 O=C(O)CPCO Amb28340565 [1,1,0,0,0,0|1,0,1]=4 2803 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [1,1,0,0,0,0|1,0,0]=3 2804 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [1,1,0,0,0,0|1,0,0]=3 2805 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [1,1,0,0,0,0|0,0,0]=2 2806 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [1,1,0,0,0,0|0,0,0]=2 2807 B6R0.4 O=C(O)\C=C\CF Amb33470171 [1,1,0,0,0,0|0,0,0]=2 2808 B6R0.4 O=C(O)\C=C\CO Amb32662006 [1,1,0,0,0,0|0,0,0]=2 2809 B6R0.4 O=C([O-])\C=C\CO Amb33542275 [1,1,0,0,0,0|0,0,1]=3 2810 B6R0.4 O=CCCC(=O)O Amb17673897 [1,1,0,0,0,0|1,0,1]=4 2811 B6R0.4 O=CNCC(=O)O Amb1911508 [1,1,0,0,0,0|1,0,1]=4 2812 B6R0.4 O=COCC(=O)O Amb26624011 [1,1,0,0,0,0|1,0,1]=4 2813 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [1,1,0,0,0,0|0,0,1]=3 2814 B6R0.4 O=[N+]([O-])\C=C\CF Amb33379297 [1,1,0,0,0,0|1,0,1]=4 2815 B6R0.4 OB(O)\C=C\CCl Amb33964181 [1,1,0,0,0,0|1,0,1]=4 2816 B6R0.4 OC\C=C\B(O)O Amb25354850 [1,1,0,0,0,0|1,0,1]=4 2817 B6R0.5 C\C=C\C(C)(C)O Amb24699156 [1,1,0,0,0,0|1,0,1]=4 2818 B6R0.5 C\C=C\P(C)(C)=O Amb33803003 [1,1,0,0,0,0|2,0,0]=4 2819 B6R0.5 C\C=C\S(=O)(=O)Cl Amb20669514 [1,1,0,0,0,0|1,0,1]=4 2820 B6R0.5 C\C=C\S(N)(=O)=O Amb33503425 [1,1,0,0,0,0|1,0,1]=4 2821 B6R0.5 O=P(O)(O)\C=C\Cl Amb27592182 [1,1,0,0,0,0|2,0,0]=4 2822 B6R0.8 C=CC(C)(O)C=O Amb27253396 [1,1,0,0,0,0|0,0,2]=4 2823 B6R0.8 C=C[C@@](C)(O)C=O Amb28255704 [1,1,0,0,0,0|0,0,2]=4 2824 B6R0.8 C=C[C@](C)(O)C=O Amb27849029 [1,1,0,0,0,0|0,0,2]=4 2825 B6R0.8 CC(C)(C=O)C=O Amb26866367 [1,1,0,0,0,0|1,0,1]=4 2826 B6R0.8 CCC(C)(C)C=O Amb19148820 [1,1,0,0,0,0|0,0,2]=4 2827 B6R0.8 CCC(C)(O)C=O Amb18639932 [1,1,0,0,0,0|0,0,2]=4 2828 B6R0.8 CC[C@](C)(O)C=O Amb27838212 [1,1,0,0,0,0|0,0,2]=4 2829 B6R0.8 COC(C)(C)C=O Amb25173664 [1,1,0,0,0,0|1,0,1]=4 2830 B6R0.8 CSC(C)(C)C=O Amb18124124 [1,1,0,0,0,0|1,0,1]=4 2831 B6R0.9 C=CC(C=O)OC Amb27195025 [1,1,0,0,0,0|0,0,2]=4 2832 B6R0.9 C=C\C(=C/Br)CC Amb27848004 [1,1,0,0,0,0|1,0,1]=4 2833 B6R0.9 C=C\C(=C/Cl)SC Amb27657756 [1,1,0,0,0,0|1,0,1]=4 2834 B6R0.9 C=C\C(C=O)=C/C Amb27393269 [1,1,0,0,0,0|0,0,1]=3 2835 B6R0.9 CCC(C=O)C=O Amb25798416 [1,1,0,0,0,0|1,0,1]=4 2836 B6R0.9 CCC(C=O)CC Amb3939947 [1,1,0,0,0,0|0,0,2]=4 2837 B6R0.9 CCC(C=O)CO Amb27986136 [1,1,0,0,0,0|0,0,2]=4 2838 B6R0.9 CCC(C=O)CS Amb27826916 [1,1,0,0,0,0|0,0,2]=4 2839 B6R0.9 CCC(C=O)OC Amb18121854 [1,1,0,0,0,0|0,0,2]=4 2840 B6R0.9 CCC(CC)=NO Amb2782908 [1,1,0,0,0,0|1,0,1]=4 2841 B6R0.9 CCN(C=O)CC Amb8513815 [1,1,0,0,0,0|1,0,1]=4 2842 B6R0.9 CC\C(=C/Cl)SC Amb28245041 [1,1,0,0,0,0|1,0,1]=4 2843 B6R0.9 CC\C(=C\Br)CO Amb28290248 [1,1,0,0,0,0|1,0,1]=4 2844 B6R0.9 CC\C(C=O)=C\Cl Amb27400355 [1,1,0,0,0,0|1,0,0]=3 2845 B6R0.9 CC\C(C=O)=C\N Amb28248353 [1,1,0,0,0,0|1,0,0]=3 2846 B6R0.9 CC\C(CO)=N\O Amb28401356 [1,1,0,0,0,0|1,0,1]=4 2847 B6R0.9 COC(=CBr)OC Amb26552819 [1,1,0,0,0,0|2,0,0]=4 2848 B6R0.9 COC(C=O)C=O Amb24622474 [1,1,0,0,0,0|1,0,1]=4 2849 B6R0.9 COC(C=O)OC Amb10071226 [1,1,0,0,0,0|1,0,1]=4 2850 B6R0.9 CO[C@@H](C=O)CO Amb27759414 [1,1,0,0,0,0|1,0,1]=4 2851 B6R0.9 CO\C(C=O)=C/N Amb28050517 [1,1,0,0,0,0|1,0,0]=3 2852 B6R0.9 CO\C(C=O)=C\Cl Amb27165654 [1,1,0,0,0,0|1,0,0]=3 2853 B6R0.9 CSC(C=O)C=O Amb27790218 [1,1,0,0,0,0|1,0,1]=4 2854 B6R0.9 C\C=C(/C#N)CC Amb18638703 [1,1,0,0,0,0|1,0,1]=4 2855 B6R0.9 C\C=C(/C#N)CCl Amb26006737 [1,1,0,0,0,0|1,0,1]=4 2856 B6R0.9 C\C=C(/C=O)CC Amb27838269 [1,1,0,0,0,0|0,0,0]=2 2857 B6R0.9 C\C=C(\C#N)CC Amb26395981 [1,1,0,0,0,0|1,0,1]=4 2858 B6R0.9 C\C=C(\C=O)CC Amb10606406 [1,1,0,0,0,0|0,0,0]=2 2859 B6R0.9 C\C=C(\C=O)CCl Amb27424657 [1,1,0,0,0,0|0,0,0]=2 2860 B6R0.9 C\C=C(\C=O)CO Amb28388682 [1,1,0,0,0,0|0,0,0]=2 2861 B6R0.9 C\C=C(\CC)CBr Amb27491794 [1,1,0,0,0,0|1,0,1]=4 2862 B6R0.9 C\C=C(\CC)CN Amb27185641 [1,1,0,0,0,0|1,0,1]=4 2863 B6R0.9 C\C=C(\CC)CO Amb27637925 [1,1,0,0,0,0|0,0,1]=3 2864 B6R0.9 O=CC(C=O)=CO Amb27194422 [1,1,0,0,0,0|1,0,1]=4 2865 B6R0.9 O=CC(C=O)=C[O-] Amb33756694 [1,1,0,0,0,0|1,0,1]=4 2866 B6R0.7 C=C(C)C(C)(C)O Amb22228300 [1,1,0,0,0,0|1,0,1]=4 2867 B6R0.7 C=C(C)P(=O)(Cl)Cl Amb4297383 [1,1,0,0,0,0|2,0,0]=4 2868 B6R0.7 C=C(C)S(=O)(=O)Cl Amb33544709 [1,1,0,0,0,0|1,0,1]=4 2869 B6R0.7 C=C(C)S(=O)(=O)F Amb27652693 [1,1,0,0,0,0|1,0,1]=4 2870 B6R0.7 C=C(C)S(C)(=O)=O Amb24690396 [1,1,0,0,0,0|1,0,1]=4 2871 B6R0.7 C=C(C)S(N)(=O)=O Amb25072742 [1,1,0,0,0,0|1,0,1]=4 2872 B6R0.7 CC(=O)C(C)(C)Br Amb2389573 [1,1,0,0,0,0|1,0,1]=4 2873 B6R0.7 CC(=O)C(C)(C)C Amb2690343 [1,1,0,0,0,0|1,0,1]=4 2874 B6R0.7 CC(=O)C(C)(C)Cl Amb2721559 [1,1,0,0,0,0|1,0,1]=4 2875 B6R0.7 CC(=O)C(C)(C)F Amb24479081 [1,1,0,0,0,0|1,0,1]=4 2876 B6R0.7 CC(=O)C(C)(C)N Amb1087903 [1,1,0,0,0,0|1,0,1]=4 2877 B6R0.7 CC(=O)C(C)(C)N Amb22283888 [1,1,0,0,0,0|1,0,1]=4 2878 B6R0.7 CC(=O)C(C)(C)O Amb4037279 [1,1,0,0,0,0|1,0,1]=4 2879 B6R0.7 CC(=O)C(C)(C)S Amb28146340 [1,1,0,0,0,0|1,0,1]=4 2880 B6R0.7 CC(=O)P(=O)(O)O Amb25229259 [1,1,0,0,0,0|2,0,0]=4 2881 B6R0.7 CC(=O)[Si](C)(C)C Amb19894190 [1,1,0,0,0,0|1,1,0]=4 2882 B6R0.7 CC(Br)(Br)C(=O)O Amb26856468 [1,1,0,0,0,0|1,0,1]=4 2883 B6R0.7 CC(C)(Br)C(=O)Br Amb8516518 [1,1,0,0,0,0|1,0,1]=4 2884 B6R0.7 CC(C)(Br)C(=O)Cl Amb18090808 [1,1,0,0,0,0|1,0,1]=4 2885 B6R0.7 CC(C)(Br)C(=O)O Amb8389348 [1,1,0,0,0,0|0,0,1]=3 2886 B6R0.7 CC(C)(Br)C(N)=O Amb10071123 [1,1,0,0,0,0|1,0,1]=4 2887 B6R0.7 CC(C)(C)C(=O)Cl Amb3939335 [1,1,0,0,0,0|1,0,1]=4 2888 B6R0.7 CC(C)(C)C(=O)O Amb3939854 [1,1,0,0,0,0|0,0,1]=3 2889 B6R0.7 CC(C)(C)C(=O)S Amb20240548 [1,1,0,0,0,0|0,1,1]=4 2890 B6R0.7 CC(C)(C)C(=O)[O-] Amb16192974 [1,1,0,0,0,0|0,0,2]=4 2891 B6R0.7 CC(C)(C)C(=O)[O-] Amb8516460 [1,1,0,0,0,0|0,0,2]=4 2892 B6R0.7 CC(C)(C)C(N)=O Amb1151239 [1,1,0,0,0,0|1,0,1]=4 2893 B6R0.7 CC(C)(C)S(=O)O Amb25194337 [1,1,0,0,0,0|1,0,1]=4 2894 B6R0.7 CC(C)(Cl)C(=O)Cl Amb20668299 [1,1,0,0,0,0|1,0,1]=4 2895 B6R0.7 CC(C)(Cl)C(=O)O Amb8390677 [1,1,0,0,0,0|0,0,1]=3 2896 B6R0.7 CC(C)(Cl)C(N)=O Amb24122839 [1,1,0,0,0,0|1,0,1]=4 2897 B6R0.7 CC(C)(F)C(=O)O Amb2688137 [1,1,0,0,0,0|0,0,1]=3 2898 B6R0.7 CC(C)(F)C(N)=O Amb20671475 [1,1,0,0,0,0|1,0,1]=4 2899 B6R0.7 CC(C)(N)C(=O)Cl Amb24479876 [1,1,0,0,0,0|1,0,1]=4 2900 B6R0.7 CC(C)(N)C(=O)O Amb6392202 [1,1,0,0,0,0|0,0,1]=3 2901 B6R0.7 CC(C)(N)C(N)=O Amb10608162 [1,1,0,0,0,0|1,0,1]=4 2902 B6R0.7 CC(C)(N)C(N)=O Amb10609802 [1,1,0,0,0,0|1,0,1]=4 2903 B6R0.7 CC(C)(O)C(=O)O Amb1159101 [1,1,0,0,0,0|0,0,1]=3 2904 B6R0.7 CC(C)(O)C(N)=O Amb8389355 [1,1,0,0,0,0|1,0,1]=4 2905 B6R0.7 CC(C)(S)C(=O)O Amb17501520 [1,1,0,0,0,0|0,0,1]=3 2906 B6R0.7 CC(C)P(=O)(O)O Amb4297373 [1,1,0,0,0,0|1,0,1]=4 2907 B6R0.7 CC(C)S(=O)(=O)O Amb27802966 [1,1,0,0,0,0|1,0,1]=4 2908 B6R0.7 CC(Cl)(Cl)C(=O)O Amb2720940 [1,1,0,0,0,0|1,0,1]=4 2909 B6R0.7 CC(F)(Br)C(=O)O Amb19895446 [1,1,0,0,0,0|1,0,1]=4 2910 B6R0.7 CC(F)(Cl)C(=O)O Amb22011870 [1,1,0,0,0,0|1,0,1]=4 2911 B6R0.7 CC(F)(F)C(=O)O Amb2687267 [1,1,0,0,0,0|1,0,1]=4 2912 B6R0.7 CC(N)(S)C(=O)O Amb27202694 [1,1,0,0,0,0|1,0,1]=4 2913 B6R0.7 CC(O)(Cl)C(=O)O Amb27877877 [1,1,0,0,0,0|1,0,1]=4 2914 B6R0.7 CC(O)(O)C(=O)O Amb25337924 [1,1,0,0,0,0|1,0,1]=4 2915 B8R0.2 C=C(C(=O)O)C(C)CC Amb18642655 [0,1,0,0,0,1|0,0,2]=4 2916 B8R0.2 C=C(C)C(O)\C(C)=C/C Amb27219805 [0,1,0,0,0,1|2,0,0]=4 2917 B8R0.2 C=C=C(C)C(O)C(=O)O Amb28284623 [0,1,0,0,0,1|0,0,2]=4 2918 B8R0.2 C=CC(=C)C(N)C(=O)O Amb28323133 [0,1,0,0,0,1|0,0,2]=4 2919 B8R0.2 C=CC(C)C(C)C(=O)O Amb18642611 [0,1,0,0,0,1|0,0,2]=4 2920 B8R0.2 C=CC(C)C(N)C(=O)O Amb18989861 [0,1,0,0,0,1|0,0,2]=4 2921 B8R0.2 C=CC(C)C(O)C(=O)O Amb18642750 [0,1,0,0,0,1|0,0,2]=4 2922 B8R0.2 C=CC(C)[C@@H](N)C(=O)O Amb25889532 [0,1,0,0,0,1|0,0,2]=4 2923 B8R0.2 C=CC(C)[C@H](N)C(=O)O Amb27761345 [0,1,0,0,0,1|0,0,2]=4 2924 B8R0.2 C=C[C@@H](C)[C@H](N)C(=O)O Amb28129785 [0,1,0,0,0,1|0,0,2]=4 2925 B8R0.2 C=C[C@@H](C)[C@H](O)C(=O)O Amb27788648 [0,1,0,0,0,1|0,0,2]=4 2926 B8R0.2 C=C[C@H](C)[C@@H](N)C(=O)O Amb28067623 [0,1,0,0,0,1|0,0,2]=4 2927 B8R0.2 C=C[C@H](C)[C@H](Cl)C(=O)O Amb27601824 [0,1,0,0,0,1|0,0,2]=4 2928 B8R0.2 C=C[C@H](C)[C@H](F)C(=O)O Amb28285951 [0,1,0,0,0,1|0,0,2]=4 2929 B8R0.2 C=C\C(C)=C(/C)C(=O)O Amb28060126 [0,1,0,0,0,1|0,0,1]=3 2930 B8R0.2 C=C\C(C)=C(\C)C(=O)O Amb27947979 [0,1,0,0,0,1|0,0,1]=3 2931 B8R0.2 C=C\C(Cl)=C(\O)C(=O)O Amb27750610 [0,1,0,0,0,1|1,0,1]=4 2932 B8R0.2 CC(C(=O)O)N(C)C=O Amb18284942 [0,1,0,0,0,1|2,0,0]=4 2933 B8R0.2 CCC(=O)C(=O)C(=O)O Amb31097725 [0,1,0,0,0,1|1,0,1]=4 2934 B8R0.2 CCC(=S)[C@H](N)C(=O)O Amb25111086 [0,1,0,0,0,1|1,0,1]=4 2935 B8R0.2 CCC(C)C(=O)C(=O)O Amb2695339 [0,1,0,0,0,1|0,0,2]=4 2936 B8R0.2 CCC(C)C(Br)C(=O)O Amb4015586 [0,1,0,0,0,1|0,0,2]=4 2937 B8R0.2 CCC(C)C(C)C(=O)O Amb18290719 [0,1,0,0,0,1|0,0,2]=4 2938 B8R0.2 CCC(C)C(Cl)C(=O)O Amb17593752 [0,1,0,0,0,1|0,0,2]=4 2939 B8R0.2 CCC(C)C(N)C(=O)O Amb9702778 [0,1,0,0,0,1|0,0,2]=4 2940 B8R0.2 CCC(C)C(O)C(=O)O Amb18288809 [0,1,0,0,0,1|0,0,2]=4 2941 B8R0.2 CCC(C)C(S)C(=O)O Amb27667077 [0,1,0,0,0,1|0,0,2]=4 2942 B8R0.2 CCC(C)[C@@H](C)C(=O)O Amb10844494 [0,1,0,0,0,1|0,0,2]=4 2943 B8R0.2 CCC(C)[C@@H](N)C(=O)O Amb10844500 [0,1,0,0,0,1|0,0,2]=4 2944 B8R0.2 CCC(C)[C@H](Br)C(=O)O Amb28183049 [0,1,0,0,0,1|0,0,2]=4 2945 B8R0.2 CCC(C)[C@H](C)C(=O)O Amb10844495 [0,1,0,0,0,1|0,0,2]=4 2946 B8R0.2 CCC(C)[C@H](Cl)C(=O)O Amb28314442 [0,1,0,0,0,1|0,0,2]=4 2947 B8R0.2 CCC(C)[C@H](N)C(=O)O Amb10844501 [0,1,0,0,0,1|0,0,2]=4 2948 B8R0.2 CCN(C)C(=O)C(=O)O Amb9304051 [0,1,0,0,0,1|1,0,1]=4 2949 B8R0.2 CCN(C)C(C)C(=O)O Amb8890967 [0,1,0,0,0,1|1,0,1]=4 2950 B8R0.2 CCN(C)[C@@H](C)C(=O)O Amb27228167 [0,1,0,0,0,1|1,0,1]=4 2951 B8R0.2 CC[C@@H](C)C(Cl)C(=O)O Amb27472040 [0,1,0,0,0,1|0,0,2]=4 2952 B8R0.2 CC[C@@H](C)[C@@H](Cl)C(=O)O Amb28130604 [0,1,0,0,0,1|0,0,2]=4 2953 B8R0.2 CC[C@@H](C)[C@@H](F)C(=O)O Amb28347222 [0,1,0,0,0,1|0,0,2]=4 2954 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O Amb8513329 [0,1,0,0,0,1|0,0,2]=4 2955 B8R0.2 CC[C@@H](C)[C@@H](O)C(=O)O Amb26063750 [0,1,0,0,0,1|0,0,2]=4 2956 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O Amb26866576 [0,1,0,0,0,1|0,0,2]=4 2957 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O Amb10068321 [0,1,0,0,0,1|0,0,2]=4 2958 B8R0.2 CC[C@H](C)C(=O)C(=O)O Amb28075584 [0,1,0,0,0,1|0,0,2]=4 2959 B8R0.2 CC[C@H](C)C(C)C(=O)O Amb27950556 [0,1,0,0,0,1|0,0,2]=4 2960 B8R0.2 CC[C@H](C)C(N)C(=O)O Amb27209489 [0,1,0,0,0,1|0,0,2]=4 2961 B8R0.2 CC[C@H](C)[C@@H](Br)C(=O)O Amb23401386 [0,1,0,0,0,1|0,0,2]=4 2962 B8R0.2 CC[C@H](C)[C@@H](F)C(=O)O Amb27954743 [0,1,0,0,0,1|0,0,2]=4 2963 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O Amb8516280 [0,1,0,0,0,1|0,0,2]=4 2964 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O Amb22388560 [0,1,0,0,0,1|0,0,2]=4 2965 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O Amb3940753 [0,1,0,0,0,1|0,0,2]=4 2966 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O Amb2694797 [0,1,0,0,0,1|0,0,2]=4 2967 B8R0.2 CC\C(C)=C(/C)C(=O)O Amb27424733 [0,1,0,0,0,1|0,0,1]=3 2968 B8R0.2 CC\C(C)=C(/C)C(C)=O Amb28421971 [0,1,0,0,0,1|1,0,1]=4 2969 B8R0.2 CC\C(C)=C(/C)C(N)=O Amb27791930 [0,1,0,0,0,1|1,0,1]=4 2970 B8R0.2 CC\C(O)=C(\C)C(=O)O Amb27253362 [0,1,0,0,0,1|1,0,1]=4 2971 B8R0.2 CNC(=O)C(C)C(=O)O Amb26367215 [0,1,0,0,0,1|2,0,0]=4 2972 B8R0.2 CNC(C)C(N)C(=O)O Amb18642890 [0,1,0,0,0,1|1,0,1]=4 2973 B8R0.2 CN\C(C)=C(/C)C(C)=O Amb27264901 [0,1,0,0,0,1|2,0,0]=4 2974 B8R0.2 CN\C(C)=C(\Cl)C(C)=O Amb27828096 [0,1,0,0,0,1|2,0,0]=4 2975 B8R0.2 COC(=O)C(C)C(=O)O Amb33545071 [0,1,0,0,0,1|2,0,0]=4 2976 B8R0.2 COC(=O)C(N)C(=O)O Amb27487566 [0,1,0,0,0,1|2,0,0]=4 2977 B8R0.2 COC(C)C(Br)C(=O)O Amb16233352 [0,1,0,0,0,1|1,0,1]=4 2978 B8R0.2 COC(C)C(C)C(=O)O Amb10844268 [0,1,0,0,0,1|1,0,1]=4 2979 B8R0.2 COC(C)C(N)C(=O)O Amb17938689 [0,1,0,0,0,1|1,0,1]=4 2980 B8R0.2 COC(C)C(O)C(=O)O Amb27816478 [0,1,0,0,0,1|1,0,1]=4 2981 B8R0.2 COC(C)[C@@H](C)C(=O)O Amb33729616 [0,1,0,0,0,1|1,0,1]=4 2982 B8R0.2 COC(C)[C@@H](N)C(=O)O Amb25733335 [0,1,0,0,0,1|1,0,1]=4 2983 B8R0.2 COC(C)[C@H](C)C(=O)O Amb25722336 [0,1,0,0,0,1|1,0,1]=4 2984 B8R0.2 COC(C)[C@H](N)C(=O)O Amb25881538 [0,1,0,0,0,1|1,0,1]=4 2985 B8R0.2 CON(C)C(=O)C(=O)O Amb28200907 [0,1,0,0,0,1|2,0,0]=4 2986 B8R0.2 CON(C)C(C)C(=O)O Amb27665034 [0,1,0,0,0,1|2,0,0]=4 2987 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O Amb26036938 [0,1,0,0,0,1|1,0,1]=4 2988 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O Amb8390422 [0,1,0,0,0,1|1,0,1]=4 2989 B8R0.2 CO[C@H](C)[C@@H](Br)C(=O)O Amb27392325 [0,1,0,0,0,1|1,0,1]=4 2990 B8R0.2 CO[C@H](C)[C@@H](Cl)C(=O)O Amb27424722 [0,1,0,0,0,1|1,0,1]=4 2991 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O Amb16183892 [0,1,0,0,0,1|1,0,1]=4 2992 B8R0.2 CO[C@H](C)[C@H](O)C(=O)O Amb25316180 [0,1,0,0,0,1|1,0,1]=4 2993 B8R0.2 CO\C(C)=C(/C)C(C)=O Amb25683972 [0,1,0,0,0,1|2,0,0]=4 2994 B8R0.2 CS[C@H](C)[C@H](N)C(=O)O Amb27771288 [0,1,0,0,0,1|1,0,1]=4 2995 B8R0.2 C\C(C=O)=C(/Cl)C(=O)O Amb27199263 [0,1,0,0,0,1|1,0,0]=3 2996 B8R0.2 C\C(C=O)=C(\Cl)C(=O)O Amb28130176 [0,1,0,0,0,1|1,0,0]=3 2997 B8R0.2 C\C=C(/Br)C(=O)C(=O)O Amb28145171 [0,1,0,0,0,1|1,0,0]=3 2998 B8R0.2 C\C=C(/C)C(C)C(=O)O Amb27810548 [0,1,0,0,0,1|0,0,0]=2 2999 B8R0.2 C\C=C(/C)C(N)C(=O)O Amb18642706 [0,1,0,0,0,1|0,0,0]=2 3000 B8R0.2 C\C=C(\Br)C(O)C(=O)O Amb27657537 [0,1,0,0,0,1|1,0,0]=3 3001 B8R0.2 C\C=C(\C)C(C)C(=O)O Amb27626047 [0,1,0,0,0,1|0,0,0]=2 3002 B8R0.2 C\C=C(\C)C(N)C(=O)O Amb27634383 [0,1,0,0,0,1|0,0,0]=2 3003 B8R0.2 C\C=C(\C)[C@H](N)C(=O)O Amb28424373 [0,1,0,0,0,1|0,0,0]=2 3004 B8R0.2 O=C(O)C(O)\C(Cl)=C/Cl Amb28282747 [0,1,0,0,0,1|2,0,0]=4 3005 B8R0.2 O=C(O)C(O)\C(Cl)=C\Cl Amb27439350 [0,1,0,0,0,1|2,0,0]=4 3006 B8R0.2 O=C\C(Br)=C(/Br)C(=O)O Amb26008906 [0,1,0,0,0,1|2,0,0]=4 3007 B8R0.2 O=C\C(Br)=C(\Br)C(=O)O Amb2720702 [0,1,0,0,0,1|2,0,0]=4 3008 B8R0.2 O=C\C(Cl)=C(/Br)C(=O)O Amb4005286 [0,1,0,0,0,1|2,0,0]=4 3009 B8R0.2 O=C\C(Cl)=C(/Cl)C(=O)O Amb18602727 [0,1,0,0,0,1|2,0,0]=4 3010 B8R0.2 O=C\C(Cl)=C(/O)C(=O)O Amb28384527 [0,1,0,0,0,1|2,0,0]=4 3011 B8R0.2 O=C\C(Cl)=C(\Cl)C(=O)O Amb2720699 [0,1,0,0,0,1|2,0,0]=4 3012 B8R0.5 C#C\C=C(/C)CC(=O)O Amb28410538 [0,1,0,0,0,1|0,0,1]=3 3013 B8R0.5 C=C=CC(C)CC(=O)O Amb27631675 [0,1,0,0,0,1|0,0,2]=4 3014 B8R0.5 C=CCC(C)CC(=O)O Amb18642628 [0,1,0,0,0,1|0,0,2]=4 3015 B8R0.5 C=CCN(C)CC(=O)O Amb9301047 [0,1,0,0,0,1|1,0,1]=4 3016 B8R0.5 C=CC\C(C)=C/C(C)=O Amb27481811 [0,1,0,0,0,1|1,0,1]=4 3017 B8R0.5 CC#C\C(C)=C\C(N)=O Amb28456563 [0,1,0,0,0,1|1,0,1]=4 3018 B8R0.5 CC(=O)C\C(Br)=C\CCl Amb27957896 [0,1,0,0,0,1|2,0,0]=4 3019 B8R0.5 CC(=O)C\C(C)=C/C#N Amb28386612 [0,1,0,0,0,1|1,0,1]=4 3020 B8R0.5 CC(=O)C\C(C)=C\C#N Amb28053990 [0,1,0,0,0,1|1,0,1]=4 3021 B8R0.5 CC(=O)C\C(Cl)=C\CCl Amb27256456 [0,1,0,0,0,1|2,0,0]=4 3022 B8R0.5 CC(CC(=O)O)NC=O Amb18967805 [0,1,0,0,0,1|1,0,1]=4 3023 B8R0.5 CC(CCF)CC(=O)O Amb24477914 [0,1,0,0,0,1|0,0,2]=4 3024 B8R0.5 CC(CCN)CC(=O)O Amb20667689 [0,1,0,0,0,1|0,0,2]=4 3025 B8R0.5 CC(CCN)CC(=O)O Amb24376646 [0,1,0,0,0,1|0,0,2]=4 3026 B8R0.5 CC(CCO)CC(=O)O Amb18642882 [0,1,0,0,0,1|0,0,2]=4 3027 B8R0.5 CCCC(C)CC(=O)O Amb6749227 [0,1,0,0,0,1|0,0,2]=4 3028 B8R0.5 CCCN(C)CC(=O)O Amb19373314 [0,1,0,0,0,1|1,0,1]=4 3029 B8R0.5 CCCN(C)CC(=O)O Amb8899167 [0,1,0,0,0,1|1,0,1]=4 3030 B8R0.5 CCC[C@H](C)CC(=O)O Amb10844381 [0,1,0,0,0,1|0,0,2]=4 3031 B8R0.5 CCC\C(C)=C\C(=O)O Amb33528454 [0,1,0,0,0,1|0,0,1]=3 3032 B8R0.5 CCC\C(C)=C\C(C)=O Amb28289440 [0,1,0,0,0,1|1,0,1]=4 3033 B8R0.5 CCC\C(C)=C\C(N)=O Amb27799064 [0,1,0,0,0,1|1,0,1]=4 3034 B8R0.5 CCNC(=O)CC(=O)O Amb17399821 [0,1,0,0,0,1|1,0,1]=4 3035 B8R0.5 CCNC(C)CC(=O)O Amb13952759 [0,1,0,0,0,1|0,0,2]=4 3036 B8R0.5 CCNC(C)CC(=O)O Amb9398369 [0,1,0,0,0,1|0,0,2]=4 3037 B8R0.5 CCN\C(C)=C\C(C)=O Amb27843358 [0,1,0,0,0,1|1,0,1]=4 3038 B8R0.5 CCOC(=N)CC(=O)O Amb26612803 [0,1,0,0,0,1|1,0,1]=4 3039 B8R0.5 CCOC(=O)CC(=O)O Amb22492654 [0,1,0,0,0,1|1,0,1]=4 3040 B8R0.5 CCOC(=O)CC(=O)O Amb3939916 [0,1,0,0,0,1|1,0,1]=4 3041 B8R0.5 CCOC(C)CC(=O)O Amb9397849 [0,1,0,0,0,1|0,0,2]=4 3042 B8R0.5 CCO\C(C)=C/C(C)=O Amb25147210 [0,1,0,0,0,1|1,0,1]=4 3043 B8R0.5 CCO\C(C)=C\C(C)=O Amb28134099 [0,1,0,0,0,1|1,0,1]=4 3044 B8R0.5 CCO\C(N)=C\C(=O)O Amb28285256 [0,1,0,0,0,1|1,0,1]=4 3045 B8R0.5 CCSC(=O)CC(=O)O Amb27406351 [0,1,0,0,0,1|1,0,1]=4 3046 B8R0.5 CCSC(C)CC(=O)O Amb9398136 [0,1,0,0,0,1|0,0,2]=4 3047 B8R0.5 CC\C=C(/Br)CC(=O)O Amb28208655 [0,1,0,0,0,1|1,0,0]=3 3048 B8R0.5 CC\C=C(/C)C=C(C)C Amb22365218 [0,1,0,0,0,1|2,0,0]=4 3049 B8R0.5 CC\C=C(\C)C=C(C)C Amb27843473 [0,1,0,0,0,1|2,0,0]=4 3050 B8R0.5 CC\C=C(\C)CC(N)=O Amb27771837 [0,1,0,0,0,1|1,0,0]=3 3051 B8R0.5 CC\N=C(/C)CC(C)=O Amb28052216 [0,1,0,0,0,1|1,0,1]=4 3052 B8R0.5 CC\N=C(C)/C=C(/C)O Amb28076028 [0,1,0,0,0,1|1,0,1]=4 3053 B8R0.5 CC\N=C(C)/C=C(\C)O Amb28142992 [0,1,0,0,0,1|1,0,1]=4 3054 B8R0.5 CC\N=C(C)\C=C(\C)O Amb27967083 [0,1,0,0,0,1|1,0,1]=4 3055 B8R0.5 CN(CCN)CC(=O)O Amb18313585 [0,1,0,0,0,1|1,0,1]=4 3056 B8R0.5 CN(CCN)CC(=O)O Amb32701580 [0,1,0,0,0,1|1,0,1]=4 3057 B8R0.5 CN(CCO)CC(=O)O Amb5767486 [0,1,0,0,0,1|1,0,1]=4 3058 B8R0.5 CN\N=C(/C)CC(C)=O Amb27850029 [0,1,0,0,0,1|2,0,0]=4 3059 B8R0.5 COCC(=O)CC(=O)O Amb24093174 [0,1,0,0,0,1|1,0,1]=4 3060 B8R0.5 COCC(C)CC(=O)O Amb19024342 [0,1,0,0,0,1|0,0,2]=4 3061 B8R0.5 COC\C(C)=C\C(=O)O Amb25311787 [0,1,0,0,0,1|0,0,1]=3 3062 B8R0.5 COC\C(C)=C\C(C)=O Amb28323854 [0,1,0,0,0,1|1,0,1]=4 3063 B8R0.5 CONC(C)CC(=O)O Amb26844930 [0,1,0,0,0,1|1,0,1]=4 3064 B8R0.5 CON\C(C)=C/C(C)=O Amb27453399 [0,1,0,0,0,1|2,0,0]=4 3065 B8R0.5 CO\C=C(\C)CC(=O)O Amb27410916 [0,1,0,0,0,1|0,0,0]=2 3066 B8R0.5 CO\N=C(/C)CC(C)=O Amb25179533 [0,1,0,0,0,1|2,0,0]=4 3067 B8R0.5 CSCC(C)CC(=O)O Amb33273729 [0,1,0,0,0,1|0,0,2]=4 3068 B8R0.5 CS\C=C(\C)NC(C)=O Amb24660230 [0,1,0,0,0,1|1,0,0]=3 3069 B8R0.5 C[C@H](CCO)CC(=O)O Amb27461411 [0,1,0,0,0,1|0,0,2]=4 3070 B8R0.5 C\C(=C/C#N)CC(N)=O Amb27413062 [0,1,0,0,0,1|1,0,1]=4 3071 B8R0.5 C\C(=C\C(=O)O)CCS Amb28345950 [0,1,0,0,0,1|0,0,1]=3 3072 B8R0.5 C\C(C=C(Cl)Cl)=C/CCl Amb27758731 [0,1,0,0,0,1|2,0,0]=4 3073 B8R0.5 C\C=C\C(=O)NC(N)=O Amb27810821 [0,1,0,0,0,1|2,0,0]=4 3074 B8R0.5 C\C=C\C(C)=C\C(=O)O Amb28201686 [0,1,0,0,0,1|0,0,0]=2 3075 B8R0.5 C\C=C\C(C)=C\C(C)O Amb27219058 [0,1,0,0,0,1|1,0,1]=4 3076 B8R0.5 C\C=C\C(C)NC(C)=O Amb27405355 [0,1,0,0,0,1|1,0,1]=4 3077 B8R0.5 C\C=C\C(N)CC(=O)O Amb25975538 [0,1,0,0,0,1|1,0,1]=4 3078 B8R0.5 C\C=C\C(O)CC(=O)O Amb8398291 [0,1,0,0,0,1|1,0,1]=4 3079 B8R0.5 C\C=C\[C@@H](C)CC(C)=O Amb27598952 [0,1,0,0,0,1|1,0,1]=4 3080 B8R0.5 C\C=C\[C@H](C)CC(=O)O Amb28047718 [0,1,0,0,0,1|0,0,1]=3 3081 B8R0.5 C\C=C\[C@H](C)CC(C)=O Amb28246522 [0,1,0,0,0,1|1,0,1]=4 3082 B8R0.5 O=C(O)\C=C(/Cl)CCO Amb27845284 [0,1,0,0,0,1|1,0,1]=4 3083 B8R0.5 O=C(O)\C=C(Br)\C=N\O Amb27419952 [0,1,0,0,0,1|2,0,0]=4 3084 B8R0.5 O=C(O)\C=C(Cl)\C=N\O Amb28120674 [0,1,0,0,0,1|2,0,0]=4 3085 B8R0.16 C=CC(CC)CC(=O)O Amb18642661 [0,1,0,0,0,1|0,0,2]=4 3086 B8R0.16 C=C[C@@H](CC)CC(=O)O Amb27784737 [0,1,0,0,0,1|0,0,2]=4 3087 B8R0.16 C=C\C(=C/C(=O)O)CC Amb28058156 [0,1,0,0,0,1|0,0,1]=3 3088 B8R0.16 C=C\C(=C/C(C)=O)OC Amb26934531 [0,1,0,0,0,1|1,0,1]=4 3089 B8R0.16 CCC(=CC(=O)Cl)CC Amb27162214 [0,1,0,0,0,1|1,0,1]=4 3090 B8R0.16 CCC(=CC(=O)O)CC Amb6749110 [0,1,0,0,0,1|0,0,1]=3 3091 B8R0.16 CCC(CC(=O)O)OC Amb19037306 [0,1,0,0,0,1|0,0,2]=4 3092 B8R0.16 CCC(CC(=O)O)SC Amb18316304 [0,1,0,0,0,1|0,0,2]=4 3093 B8R0.16 CCC(CC)CC(=O)O Amb6749211 [0,1,0,0,0,1|0,0,2]=4 3094 B8R0.16 CCC(CN)CC(=O)O Amb20669457 [0,1,0,0,0,1|0,0,2]=4 3095 B8R0.16 CCC(CN)CC(=O)O Amb22059482 [0,1,0,0,0,1|0,0,2]=4 3096 B8R0.16 CCN(C=O)CC(=O)O Amb18972736 [0,1,0,0,0,1|2,0,0]=4 3097 B8R0.16 CCN(CC)CC(=O)O Amb19258254 [0,1,0,0,0,1|1,0,1]=4 3098 B8R0.16 CCN(CC)CC(=O)O Amb2721806 [0,1,0,0,0,1|1,0,1]=4 3099 B8R0.16 CC\C(=C\C(C)=O)NC Amb25921042 [0,1,0,0,0,1|1,0,1]=4 3100 B8R0.16 CN\C(=C/C(C)=O)OC Amb27640406 [0,1,0,0,0,1|2,0,0]=4 3101 B8R0.16 COC(=CC(C)=O)OC Amb28350890 [0,1,0,0,0,1|2,0,0]=4 3102 B8R0.16 COC(CC(=O)O)OC Amb22231899 [0,1,0,0,0,1|1,0,1]=4 3103 B8R0.16 COC(CN)CC(=O)O Amb27806172 [0,1,0,0,0,1|1,0,1]=4 3104 B8R0.16 COC(CN)CC(=O)O Amb28555397 [0,1,0,0,0,1|1,0,1]=4 3105 B8R0.16 CO\C(C=O)=C/C(C)=O Amb27233877 [0,1,0,0,0,1|2,0,0]=4 3106 B8R0.16 CSC(=CC(=O)O)SC Amb27592170 [0,1,0,0,0,1|1,0,0]=3 3107 B8R0.16 CSC(=CC(C)=O)SC Amb22490409 [0,1,0,0,0,1|2,0,0]=4 3108 B8R0.16 CSC(CC(=O)O)SC Amb27165674 [0,1,0,0,0,1|1,0,1]=4 3109 B8R0.16 CSC(CCl)CC(=O)O Amb28042698 [0,1,0,0,0,1|1,0,1]=4 3110 B8R0.16 C\C=C(/C#N)CC(C)=O Amb28195939 [0,1,0,0,0,1|1,0,1]=4 3111 B8R0.16 C\C=C(/CC)CC(=O)O Amb27473412 [0,1,0,0,0,1|0,0,0]=2 3112 B8R0.16 C\C=C(/CC)CC(N)=O Amb27830307 [0,1,0,0,0,1|1,0,0]=3 3113 B8R0.16 C\C=C(/CC)NC(C)=O Amb28208259 [0,1,0,0,0,1|1,0,0]=3 3114 B8R0.16 C\N=C(/NC)OC(C)=O Amb27404558 [0,1,0,0,0,1|2,0,0]=4 3115 B8R0.16 NC\C(=C/F)CC(=O)O Amb27960296 [0,1,0,0,0,1|1,0,0]=3 3116 B8R0.16 O=C\C(=C/C(=O)O)CCl Amb24656100 [0,1,0,0,0,1|1,0,0]=3 3117 B8R0.19 C=CC(=O)CC(=O)OC Amb17593339 [0,1,0,0,0,1|1,0,1]=4 3118 B8R0.19 C=CC(=O)\C=C(/C)CC Amb27154903 [0,1,0,0,0,1|1,0,1]=4 3119 B8R0.19 C=CC(C)=C=C(C)CO Amb28200259 [0,1,0,0,0,1|1,0,1]=4 3120 B8R0.19 CCC(=O)CC(=O)OC Amb2691582 [0,1,0,0,0,1|1,0,1]=4 3121 B8R0.19 CCC(=O)C\C(C)=C\Cl Amb27948586 [0,1,0,0,0,1|2,0,0]=4 3122 B8R0.19 CCC(=O)NC(=O)OC Amb27845509 [0,1,0,0,0,1|1,0,1]=4 3123 B8R0.19 CCC(=O)N\C(C)=N\C Amb27635245 [0,1,0,0,0,1|2,0,0]=4 3124 B8R0.19 CCC(=O)\C=C(/C)CC Amb27838819 [0,1,0,0,0,1|1,0,1]=4 3125 B8R0.19 CCC(=O)\C=C(\C)CC Amb28397482 [0,1,0,0,0,1|1,0,1]=4 3126 B8R0.19 CCC(=O)\C=C(\C)NC Amb27493053 [0,1,0,0,0,1|2,0,0]=4 3127 B8R0.19 CCC(C)CC(=O)CO Amb26515791 [0,1,0,0,0,1|0,0,2]=4 3128 B8R0.19 CCC(C)CC(=O)NO Amb28321295 [0,1,0,0,0,1|0,0,2]=4 3129 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [0,1,0,0,0,1|0,0,2]=4 3130 B8R0.19 CCC(C)NC(=O)CO Amb5798172 [0,1,0,0,0,1|0,0,2]=4 3131 B8R0.19 CCN(C)CC(=O)OC Amb8873255 [0,1,0,0,0,1|1,0,1]=4 3132 B8R0.19 CC[C@@H](C)CC(=O)OC Amb28059460 [0,1,0,0,0,1|0,0,2]=4 3133 B8R0.19 CC[C@H](C)NC(=O)OC Amb28049899 [0,1,0,0,0,1|0,0,2]=4 3134 B8R0.19 CC\C(C)=C\C(=O)OC Amb25334129 [0,1,0,0,0,1|0,0,1]=3 3135 B8R0.19 CC\C(N)=C\C(=O)OC Amb26515846 [0,1,0,0,0,1|1,0,1]=4 3136 B8R0.19 CNC(=O)CC(=O)OC Amb17399823 [0,1,0,0,0,1|2,0,0]=4 3137 B8R0.19 CNC(=O)\C=C(/C)OC Amb28119969 [0,1,0,0,0,1|2,0,0]=4 3138 B8R0.19 CNC(=S)NC(=O)OC Amb27945516 [0,1,0,0,0,1|2,0,0]=4 3139 B8R0.19 CNC(C)CC(=O)OC Amb9398364 [0,1,0,0,0,1|1,0,1]=4 3140 B8R0.19 CN[C@H](C)CC(=O)OC Amb33495831 [0,1,0,0,0,1|1,0,1]=4 3141 B8R0.19 CN\C(C)=C/C(=O)OC Amb2386651 [0,1,0,0,0,1|1,0,0]=3 3142 B8R0.19 CN\C(C)=C\C(=O)OC Amb24401759 [0,1,0,0,0,1|1,0,0]=3 3143 B8R0.19 COC(=N)CC(=O)OC Amb24476600 [0,1,0,0,0,1|2,0,0]=4 3144 B8R0.19 COC(=O)CC(=O)OC Amb6196416 [0,1,0,0,0,1|2,0,0]=4 3145 B8R0.19 COC(=O)CC(=S)OC Amb27399792 [0,1,0,0,0,1|2,0,0]=4 3146 B8R0.19 COC(=O)CC(C)C=O Amb18642765 [0,1,0,0,0,1|1,0,1]=4 3147 B8R0.19 COC(=O)CC(C)OC Amb9397848 [0,1,0,0,0,1|1,0,1]=4 3148 B8R0.19 COC(=O)CC(C)SC Amb19374125 [0,1,0,0,0,1|1,0,1]=4 3149 B8R0.19 COC(=O)CN(C)C=O Amb21856175 [0,1,0,0,0,1|2,0,0]=4 3150 B8R0.19 COC(=O)C[C@@H](C)C=O Amb27863686 [0,1,0,0,0,1|1,0,1]=4 3151 B8R0.19 COC(=O)C[C@H](C)C=O Amb28366984 [0,1,0,0,0,1|1,0,1]=4 3152 B8R0.19 COC(=O)NC(C)OC Amb27640252 [0,1,0,0,0,1|1,0,1]=4 3153 B8R0.19 COC(=O)OC(=O)OC Amb20240544 [0,1,0,0,0,1|2,0,0]=4 3154 B8R0.19 COC(=O)\C=C(/C)C=O Amb25702407 [0,1,0,0,0,1|1,0,0]=3 3155 B8R0.19 COC(=O)\C=C(/C)CBr Amb32644500 [0,1,0,0,0,1|1,0,1]=4 3156 B8R0.19 COC(=O)\C=C(/C)CCl Amb27202979 [0,1,0,0,0,1|1,0,1]=4 3157 B8R0.19 COC(=O)\C=C(/C)OC Amb21927982 [0,1,0,0,0,1|1,0,0]=3 3158 B8R0.19 COC(=O)\C=C(/N)OC Amb27601365 [0,1,0,0,0,1|2,0,0]=4 3159 B8R0.19 COC(=O)\C=C(/N)OC Amb33483252 [0,1,0,0,0,1|2,0,0]=4 3160 B8R0.19 COC(=O)\C=C(\C)CO Amb27827476 [0,1,0,0,0,1|1,0,1]=4 3161 B8R0.19 COC(=O)\N=C(/N)SC Amb27489326 [0,1,0,0,0,1|2,0,0]=4 3162 B8R0.19 C\C(=C/O)O\C(C)=C\O Amb27752351 [0,1,0,0,0,1|2,0,0]=4 3163 B8R0.19 C\C=C(/C)CC(N)CO Amb28422746 [0,1,0,0,0,1|1,0,1]=4 3164 B8R0.19 C\C=C(/C)CC(O)CC Amb27252008 [0,1,0,0,0,1|1,0,1]=4 3165 B8R0.19 C\C=C(/C)CC(O)CCl Amb27945574 [0,1,0,0,0,1|1,0,1]=4 3166 B8R0.19 C\C=C(\C)CC(N)CO Amb28410977 [0,1,0,0,0,1|1,0,1]=4 3167 B8R0.19 C\N=C(/C)CC(=O)OC Amb25888830 [0,1,0,0,0,1|1,0,0]=3 3168 B8R0.23 C=C(C)C(=C)CC(C)=O Amb28324025 [0,1,0,0,0,1|1,0,1]=4 3169 B8R0.23 C=C(C)C(=O)NC(N)=O Amb27232527 [0,1,0,0,0,1|2,0,0]=4 3170 B8R0.23 C=C(C)C(C)CC(=O)O Amb18642614 [0,1,0,0,0,1|0,0,1]=3 3171 B8R0.23 C=C(C)C(C)CC(C)=O Amb27607290 [0,1,0,0,0,1|1,0,1]=4 3172 B8R0.23 C=C(C)C(N)CC(=O)O Amb2697570 [0,1,0,0,0,1|1,0,1]=4 3173 B8R0.23 C=C(C)C(O)CC(=O)O Amb18642756 [0,1,0,0,0,1|1,0,1]=4 3174 B8R0.23 C=C(C)[C@@H](O)CC(=O)O Amb25789715 [0,1,0,0,0,1|1,0,1]=4 3175 B8R0.23 C=C(C)[C@H](C)CC(=O)O Amb27447241 [0,1,0,0,0,1|0,0,1]=3 3176 B8R0.23 C=C(C)[C@H](O)CC(=O)O Amb28286173 [0,1,0,0,0,1|1,0,1]=4 3177 B8R0.23 C=C(C)\C(C)=C\C(=O)O Amb17593311 [0,1,0,0,0,1|0,0,0]=2 3178 B8R0.23 C=C(C)\C(C)=C\C(C)=O Amb28130583 [0,1,0,0,0,1|1,0,0]=3 3179 B8R0.23 C=C(C)\C(Cl)=C/C(C)=O Amb27826885 [0,1,0,0,0,1|2,0,0]=4 3180 B8R0.23 C=C(C)\C(Cl)=C\C(C)=O Amb28052286 [0,1,0,0,0,1|2,0,0]=4 3181 B8R0.23 C=C(C)\C(O)=C\C(C)=O Amb27844297 [0,1,0,0,0,1|2,0,0]=4 3182 B8R0.23 C=C(CC(=O)O)C(=O)O Amb6608656 [0,1,0,0,0,1|1,0,1]=4 3183 B8R0.23 C=C(CC(=O)O)C(C)=O Amb27831643 [0,1,0,0,0,1|0,0,1]=3 3184 B8R0.23 C=C(CC(=O)O)C(N)=O Amb22011744 [0,1,0,0,0,1|1,0,1]=4 3185 B8R0.23 C=C(Cl)\C(C)=C\C(C)=O Amb27785458 [0,1,0,0,0,1|1,0,1]=4 3186 B8R0.23 C=C(OC(C)=O)C(C)=O Amb27838658 [0,1,0,0,0,1|1,0,1]=4 3187 B8R0.23 CC(=O)C(=O)CC(=O)O Amb17593364 [0,1,0,0,0,1|1,0,0]=3 3188 B8R0.23 CC(=O)C(Br)CC(=O)O Amb27834306 [0,1,0,0,0,1|1,0,1]=4 3189 B8R0.23 CC(=O)C(C)CC(=O)O Amb18292788 [0,1,0,0,0,1|0,0,1]=3 3190 B8R0.23 CC(=O)C(C)NC(N)=O Amb27778024 [0,1,0,0,0,1|1,0,1]=4 3191 B8R0.23 CC(=O)C(C)SC(=O)Cl Amb32679654 [0,1,0,0,0,1|1,0,1]=4 3192 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [0,1,0,0,0,1|1,0,1]=4 3193 B8R0.23 CC(=O)C(O)CC(=O)O Amb25341886 [0,1,0,0,0,1|1,0,1]=4 3194 B8R0.23 CC(=O)CC(=O)C(C)=O Amb25806867 [0,1,0,0,0,1|2,0,0]=4 3195 B8R0.23 CC(=O)CC(C)C(C)=O Amb26490545 [0,1,0,0,0,1|1,0,1]=4 3196 B8R0.23 CC(=O)CC(Cl)=C(C)C Amb28351823 [0,1,0,0,0,1|2,0,0]=4 3197 B8R0.23 CC(=O)CN(C)C(C)=O Amb27267241 [0,1,0,0,0,1|2,0,0]=4 3198 B8R0.23 CC(=O)C[C@H](C)C(C)=O Amb28051038 [0,1,0,0,0,1|1,0,1]=4 3199 B8R0.23 CC(=O)N(C)CC(=O)O Amb33526797 [0,1,0,0,0,1|1,0,0]=3 3200 B8R0.23 CC(=O)N(C)CC(N)=O Amb8999134 [0,1,0,0,0,1|2,0,0]=4 3201 B8R0.23 CC(=O)N(Cl)CC(=O)O Amb28366945 [0,1,0,0,0,1|2,0,0]=4 3202 B8R0.23 CC(=O)NC(=O)C(C)=O Amb28245557 [0,1,0,0,0,1|2,0,0]=4 3203 B8R0.23 CC(=O)NC(C)C(C)=O Amb3093787 [0,1,0,0,0,1|1,0,1]=4 3204 B8R0.23 CC(=O)N\C(C)=C(\C)[S-] Amb28285580 [0,1,0,0,0,1|1,0,0]=3 3205 B8R0.23 CC(=O)OC(=O)C(C)=O Amb26528827 [0,1,0,0,0,1|2,0,0]=4 3206 B8R0.23 CC(=O)OC(C)C(C)=O Amb4021650 [0,1,0,0,0,1|1,0,1]=4 3207 B8R0.23 CC(=O)ON(C)C(C)=O Amb4017292 [0,1,0,0,0,1|2,0,0]=4 3208 B8R0.23 CC(=O)O[C@@H](C)C(C)=O Amb26074254 [0,1,0,0,0,1|1,0,1]=4 3209 B8R0.23 CC(=O)[C@@H](O)CC(=O)O Amb28398474 [0,1,0,0,0,1|1,0,1]=4 3210 B8R0.23 CC(=O)[C@H](C)CC(=O)O Amb25360184 [0,1,0,0,0,1|0,0,1]=3 3211 B8R0.23 CC(=O)\C(Br)=C\C(=O)O Amb27983634 [0,1,0,0,0,1|1,0,0]=3 3212 B8R0.23 CC(=O)\C(C)=C/C(C)O Amb27838725 [0,1,0,0,0,1|1,0,1]=4 3213 B8R0.23 CC(=O)\C(C)=C\C(=O)O Amb27838567 [0,1,0,0,0,1|0,0,0]=2 3214 B8R0.23 CC(=O)\C(C)=C\[N+](=O)[O-] Amb26899998 [0,1,0,0,0,1|1,0,1]=4 3215 B8R0.23 CC(=O)\C=C(/C)C(=O)O Amb18642577 [0,1,0,0,0,1|2,0,0]=4 3216 B8R0.23 CC(=O)\C=C(/C)C(C)C Amb27649040 [0,1,0,0,0,1|1,0,1]=4 3217 B8R0.23 CC(=O)\C=C(/C)N(C)C Amb28429281 [0,1,0,0,0,1|2,0,0]=4 3218 B8R0.23 CC(=O)\N=C(/C)C(C)=O Amb26476592 [0,1,0,0,0,1|1,0,0]=3 3219 B8R0.23 CC(C)=C(C)CC(=O)O Amb18642613 [0,1,0,0,0,1|0,0,0]=2 3220 B8R0.23 CC(C)=C(C)NC(=S)[S-] Amb28046298 [0,1,0,0,0,1|0,2,0]=4 3221 B8R0.23 CC(C)=CC(C)=C(C)C Amb22365199 [0,1,0,0,0,1|2,0,0]=4 3222 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,1,0,0,0,1|0,0,2]=4 3223 B8R0.23 CC(C)N(C)CC(=O)O Amb10609863 [0,1,0,0,0,1|1,0,1]=4 3224 B8R0.23 CC(C)N(C)CC(=O)O Amb6639901 [0,1,0,0,0,1|1,0,1]=4 3225 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,1,0,0,0,1|0,0,2]=4 3226 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,1,0,0,0,1|1,0,1]=4 3227 B8R0.23 CC(CC(=O)O)C(N)=O Amb25737942 [0,1,0,0,0,1|1,0,1]=4 3228 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [0,1,0,0,0,1|1,0,1]=4 3229 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [0,1,0,0,0,1|1,0,1]=4 3230 B8R0.23 CC(CC(=O)O)N(C)O Amb27639550 [0,1,0,0,0,1|1,0,1]=4 3231 B8R0.23 CN(C)C(=O)CC(=O)O Amb17399822 [0,1,0,0,0,1|2,0,0]=4 3232 B8R0.23 CN(CC(=O)O)C(=N)N Amb22167307 [0,1,0,0,0,1|2,0,0]=4 3233 B8R0.23 CN(CC(=O)O)C(=N)N Amb3940365 [0,1,0,0,0,1|2,0,0]=4 3234 B8R0.23 CN(CC(=O)O)C(=N)N Amb5638543 [0,1,0,0,0,1|2,0,0]=4 3235 B8R0.23 CN(CC(=O)O)C(=O)Cl Amb27484119 [0,1,0,0,0,1|2,0,0]=4 3236 B8R0.23 CN(CC(=O)O)C(=S)S Amb1042470 [0,1,0,0,0,1|2,0,0]=4 3237 B8R0.23 CN(CC(=O)O)C(N)=O Amb2371395 [0,1,0,0,0,1|2,0,0]=4 3238 B8R0.23 CN(CC(=O)O)S(C)=O Amb27862060 [0,1,0,0,0,1|2,0,0]=4 3239 B8R0.23 CN(N)C(=O)CC(=O)O Amb25326354 [0,1,0,0,0,1|2,0,0]=4 3240 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [0,1,0,0,0,1|1,0,1]=4 3241 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [0,1,0,0,0,1|1,0,1]=4 3242 B8R0.23 C[C@H](CC(=O)O)C(N)=O Amb28133461 [0,1,0,0,0,1|1,0,1]=4 3243 B8R0.23 C[C@H](CC(=O)O)S(C)=O Amb27410588 [0,1,0,0,0,1|1,0,1]=4 3244 B8R0.23 C\C(=C/C(=O)O)C(=O)O Amb9703112 [0,1,0,0,0,1|1,0,0]=3 3245 B8R0.23 C\C(=C/C(=O)O)C(C)C Amb17506861 [0,1,0,0,0,1|0,0,1]=3 3246 B8R0.23 C\C(=C/C(=O)O)C(F)F Amb33620436 [0,1,0,0,0,1|1,0,1]=4 3247 B8R0.23 C\C(=C/C(=O)O)C(N)=O Amb28350555 [0,1,0,0,0,1|1,0,0]=3 3248 B8R0.23 C\C(=C/C(N)=O)C(=O)O Amb28060883 [0,1,0,0,0,1|2,0,0]=4 3249 B8R0.23 C\C(=C/C(N)=O)C(C)C Amb27468615 [0,1,0,0,0,1|1,0,1]=4 3250 B8R0.23 C\C(=C/C(N)=O)C(N)=O Amb27447197 [0,1,0,0,0,1|2,0,0]=4 3251 B8R0.23 C\C(=C\C(=O)O)C(=O)O Amb8391132 [0,1,0,0,0,1|1,0,0]=3 3252 B8R0.23 C\C(N)=[N+](\C)CC(=O)[O-] Amb25339595 [0,1,0,0,0,1|1,0,1]=4 3253 B8R0.23 NC(=O)\C(N)=C\C(=O)O Amb28046027 [0,1,0,0,0,1|2,0,0]=4 3254 B8R0.23 O=C(O)CC(=O)C(=O)O Amb3909986 [0,1,0,0,0,1|2,0,0]=4 3255 B8R0.23 O=C(O)CC(=S)C(=O)O Amb25304511 [0,1,0,0,0,1|2,0,0]=4 3256 B8R0.23 O=C(O)CC(Cl)=C(Cl)Cl Amb2227973 [0,1,0,0,0,1|2,0,0]=4 3257 B8R0.23 O=C(O)\C=C(/Br)C(=O)O Amb31275762 [0,1,0,0,0,1|2,0,0]=4 3258 B8R0.23 O=C(O)\C=C(/Cl)C(=O)O Amb4007497 [0,1,0,0,0,1|2,0,0]=4 3259 B8R0.23 O=C(O)\C=C(/F)C(=O)O Amb26860064 [0,1,0,0,0,1|2,0,0]=4 3260 B8R0.23 O=C(O)\C=C(/I)C(=O)O Amb10755055 [0,1,0,0,0,1|2,0,0]=4 3261 B8R0.23 O=C(O)\C=C(\Br)C(=O)O Amb25746120 [0,1,0,0,0,1|2,0,0]=4 3262 B8R0.23 O=C(O)\C=C(\F)C(=O)O Amb18124397 [0,1,0,0,0,1|2,0,0]=4 3263 B8R0.34 C=CC(C)(C)CC(=O)O Amb5718701 [0,1,0,0,0,1|0,0,2]=4 3264 B8R0.34 C=CC(C)(N)CC(=O)O Amb22641965 [0,1,0,0,0,1|0,0,2]=4 3265 B8R0.34 C=CC(C)(N)CC(=O)O Amb31307623 [0,1,0,0,0,1|0,0,2]=4 3266 B8R0.34 C=CC(C)(O)CC(=O)O Amb18642755 [0,1,0,0,0,1|0,0,2]=4 3267 B8R0.34 C=C[Si](C)(C)CC(=O)O Amb28255729 [0,1,0,0,0,1|0,1,1]=4 3268 B8R0.34 CC(C)(C=O)CC(=O)O Amb28401504 [0,1,0,0,0,1|1,0,1]=4 3269 B8R0.34 CCC(C)(C)CC(=O)O Amb10573669 [0,1,0,0,0,1|0,0,2]=4 3270 B8R0.34 CCC(C)(F)CC(=O)O Amb27645740 [0,1,0,0,0,1|0,0,2]=4 3271 B8R0.34 CCC(C)(N)CC(=O)O Amb25853863 [0,1,0,0,0,1|0,0,2]=4 3272 B8R0.34 CCC(C)(O)CC(=O)O Amb18298122 [0,1,0,0,0,1|0,0,2]=4 3273 B8R0.34 CC[C@@](C)(N)CC(=O)O Amb25738026 [0,1,0,0,0,1|0,0,2]=4 3274 B8R0.34 CC[Si](C)(C)CC(=O)O Amb28145155 [0,1,0,0,0,1|0,1,1]=4 3275 B8R0.34 COC(C)(C)CC(=O)O Amb25887304 [0,1,0,0,0,1|1,0,1]=4 3276 B8R0.3 C=C(C=O)C(C)\C=C\C Amb24513043 [0,2,0,0,0,0|1,0,1]=4 3277 B8R0.3 C=C(CC)C(=O)OCC Amb22353551 [0,2,0,0,0,0|0,0,2]=4 3278 B8R0.3 C=C(CCC)C(=O)OC Amb25689366 [0,2,0,0,0,0|0,0,2]=4 3279 B8R0.3 C=C(CCO)C(=O)OC Amb27258056 [0,2,0,0,0,0|0,0,2]=4 3280 B8R0.3 C=C(CNC)C(=O)OC Amb27968604 [0,2,0,0,0,0|0,0,2]=4 3281 B8R0.3 C=C(CO)C(C)\C=C\C Amb28065951 [0,2,0,0,0,0|1,0,1]=4 3282 B8R0.3 C=C(COC)C(=O)OC Amb27172332 [0,2,0,0,0,0|0,0,2]=4 3283 B8R0.3 C=C(NC=O)C(=O)OC Amb8392475 [0,2,0,0,0,0|1,0,1]=4 3284 B8R0.3 C=C(OCC)C(=O)OC Amb26329484 [0,2,0,0,0,0|0,0,2]=4 3285 B8R0.3 C=C=C(C)C(=O)OCC Amb25147228 [0,2,0,0,0,0|0,0,2]=4 3286 B8R0.3 C=CC(=O)C(=O)OCC Amb27771723 [0,2,0,0,0,0|1,0,1]=4 3287 B8R0.3 C=CC(O)\C(C)=C/CC Amb28049192 [0,2,0,0,0,0|1,0,1]=4 3288 B8R0.3 C=CCC(=O)C(=O)OC Amb27838686 [0,2,0,0,0,0|1,0,1]=4 3289 B8R0.3 C=CCC(=O)\C(C)=C/C Amb27844296 [0,2,0,0,0,0|1,0,0]=3 3290 B8R0.3 C=CCC(=O)\C(C)=C\C Amb27490452 [0,2,0,0,0,0|1,0,0]=3 3291 B8R0.3 C=CCC(C)C(=O)OC Amb27787724 [0,2,0,0,0,0|0,0,2]=4 3292 B8R0.3 CC(=C/Br)\C(C)=C\CO Amb28138006 [0,2,0,0,0,0|2,0,0]=4 3293 B8R0.3 CC(CCN)C(=O)CO Amb24478589 [0,2,0,0,0,0|0,0,2]=4 3294 B8R0.3 CC(\C=C\Br)=C(/C)CO Amb27424719 [0,2,0,0,0,0|1,0,1]=4 3295 B8R0.3 CC=C=C(C)C(=O)OC Amb32423553 [0,2,0,0,0,0|0,0,0]=2 3296 B8R0.3 CCC(=O)\C(C)=C/OC Amb27802564 [0,2,0,0,0,0|1,0,0]=3 3297 B8R0.3 CCC(=O)\C(C)=C\OC Amb28130153 [0,2,0,0,0,0|1,0,0]=3 3298 B8R0.3 CCC(C)C(=O)OCCl Amb27971607 [0,2,0,0,0,0|0,0,2]=4 3299 B8R0.3 CCC(C)C(=O)OCI Amb27603509 [0,2,0,0,0,0|0,0,2]=4 3300 B8R0.3 CCC(C)C(=O)\C=N\O Amb27787495 [0,2,0,0,0,0|0,0,2]=4 3301 B8R0.3 CCCC(=O)\C(C)=C\O Amb27838701 [0,2,0,0,0,0|2,0,0]=4 3302 B8R0.3 CCC[C@H](C)C(=O)OC Amb28344077 [0,2,0,0,0,0|0,0,2]=4 3303 B8R0.3 CCC\C(C)=C(/F)CO Amb28315467 [0,2,0,0,0,0|1,0,1]=4 3304 B8R0.3 CCN(C)C(=O)COC Amb27776393 [0,2,0,0,0,0|1,0,1]=4 3305 B8R0.3 CCN(C)C(=O)CON Amb27828300 [0,2,0,0,0,0|1,0,1]=4 3306 B8R0.3 CCNC(=O)C(=O)OC Amb27810841 [0,2,0,0,0,0|1,0,1]=4 3307 B8R0.3 CCNC(C)C(=O)OC Amb19003120 [0,2,0,0,0,0|0,0,2]=4 3308 B8R0.3 CCNC(C)C(=O)OC Amb32751752 [0,2,0,0,0,0|0,0,2]=4 3309 B8R0.3 CCN[C@@H](C)C(=O)OC Amb9228630 [0,2,0,0,0,0|0,0,2]=4 3310 B8R0.3 CCOC(=N)C(=O)OC Amb24657206 [0,2,0,0,0,0|1,0,1]=4 3311 B8R0.3 CCOC(=O)C(=N)SC Amb25795405 [0,2,0,0,0,0|2,0,0]=4 3312 B8R0.3 CCOC(=O)C(=O)C=O Amb28239382 [0,2,0,0,0,0|2,0,0]=4 3313 B8R0.3 CCOC(=O)C(=O)CC Amb15701231 [0,2,0,0,0,0|1,0,1]=4 3314 B8R0.3 CCOC(=O)C(=O)NC Amb3886555 [0,2,0,0,0,0|2,0,0]=4 3315 B8R0.3 CCOC(=O)C(=O)O[K] Amb22043915 [0,2,0,0,0,0|1,0,1]=4 3316 B8R0.3 CCOC(=O)C(=[NH2+])SC Amb31308298 [0,2,0,0,0,0|2,0,0]=4 3317 B8R0.3 CCOC(=O)C(C)=[N+]=[N-] Amb24481992 [0,2,0,0,0,0|2,0,0]=4 3318 B8R0.3 CCOC(=O)C(C)C=O Amb3939653 [0,2,0,0,0,0|1,0,1]=4 3319 B8R0.3 CCOC(=O)C(C)CC Amb8514839 [0,2,0,0,0,0|0,0,2]=4 3320 B8R0.3 CCOC(=O)C(C)NC Amb18523843 [0,2,0,0,0,0|1,0,1]=4 3321 B8R0.3 CCOC(=O)C(C)NC Amb28934943 [0,2,0,0,0,0|1,0,1]=4 3322 B8R0.3 CCOC(=O)C(C)OC Amb25692036 [0,2,0,0,0,0|1,0,1]=4 3323 B8R0.3 CCOC(=O)C(C)SC Amb19374135 [0,2,0,0,0,0|1,0,1]=4 3324 B8R0.3 CCOC(=O)[C@@H](C)NC Amb26604429 [0,2,0,0,0,0|1,0,1]=4 3325 B8R0.3 CCOC(=O)[C@@H](C)NC Amb35751392 [0,2,0,0,0,0|1,0,1]=4 3326 B8R0.3 CCOC(=O)[C@@H](C)OC Amb25146887 [0,2,0,0,0,0|1,0,1]=4 3327 B8R0.3 CCOC(=O)[C@H](C)CC Amb28255534 [0,2,0,0,0,0|0,0,2]=4 3328 B8R0.3 CCOC(=O)[C@H](C)NC Amb32721507 [0,2,0,0,0,0|1,0,1]=4 3329 B8R0.3 CCOC(=O)[C@H](C)OC Amb8515767 [0,2,0,0,0,0|1,0,1]=4 3330 B8R0.3 CCOC(=O)\C(Br)=C\Br Amb24339171 [0,2,0,0,0,0|2,0,0]=4 3331 B8R0.3 CCOC(=O)\C(C)=C/Br Amb30621741 [0,2,0,0,0,0|1,0,0]=3 3332 B8R0.3 CCOC(=O)\C(C)=C/Cl Amb25045062 [0,2,0,0,0,0|1,0,0]=3 3333 B8R0.3 CCOC(=O)\C(C)=C\Br Amb27880887 [0,2,0,0,0,0|1,0,0]=3 3334 B8R0.3 CCOC(=O)\C(C)=C\N Amb27875412 [0,2,0,0,0,0|1,0,0]=3 3335 B8R0.3 CCOC(=O)\C(C)=N/O Amb2459671 [0,2,0,0,0,0|2,0,0]=4 3336 B8R0.3 CCOC(=O)\C(Cl)=C/Cl Amb28119820 [0,2,0,0,0,0|2,0,0]=4 3337 B8R0.3 CCOC(=O)\C(F)=C\F Amb27985112 [0,2,0,0,0,0|2,0,0]=4 3338 B8R0.3 CCOC(=O)\C(F)=C\N Amb27860433 [0,2,0,0,0,0|2,0,0]=4 3339 B8R0.3 CCON(C)C(=O)OC Amb27806974 [0,2,0,0,0,0|1,0,1]=4 3340 B8R0.3 CCO[C@@H](C)C(=O)OC Amb28060813 [0,2,0,0,0,0|0,0,2]=4 3341 B8R0.3 CC\C=C(/C)C(=N)NO Amb27838505 [0,2,0,0,0,0|1,0,0]=3 3342 B8R0.3 CC\C=C(/C)C(=O)CC Amb28141260 [0,2,0,0,0,0|1,0,0]=3 3343 B8R0.3 CC\C=C(/C)C(=O)OC Amb22360680 [0,2,0,0,0,0|0,0,0]=2 3344 B8R0.3 CC\C=C(/C)C(O)CC Amb22052676 [0,2,0,0,0,0|1,0,1]=4 3345 B8R0.3 CC\C=C(\C)C(=O)CC Amb27449440 [0,2,0,0,0,0|1,0,0]=3 3346 B8R0.3 CC\C=C(\C)C(=O)NO Amb28454269 [0,2,0,0,0,0|0,0,0]=2 3347 B8R0.3 CC\C=C(\C)C(=O)OC Amb27798467 [0,2,0,0,0,0|0,0,0]=2 3348 B8R0.3 CC\C=C(\C)C(O)CC Amb27637528 [0,2,0,0,0,0|1,0,1]=4 3349 B8R0.3 CC\C=C(\C)C(O)CN Amb27240827 [0,2,0,0,0,0|1,0,1]=4 3350 B8R0.3 CC\C=C(\C)C(O)CO Amb28315536 [0,2,0,0,0,0|0,0,2]=4 3351 B8R0.3 CC\C=C(\C)[C@H](O)CC Amb27665467 [0,2,0,0,0,0|1,0,1]=4 3352 B8R0.3 CC\C=C(\N)C(=O)OC Amb27255558 [0,2,0,0,0,0|1,0,0]=3 3353 B8R0.3 CC\N=C(/C)C(=O)CC Amb28321879 [0,2,0,0,0,0|1,0,1]=4 3354 B8R0.3 CN(CCO)C(=O)CO Amb5798177 [0,2,0,0,0,0|1,0,1]=4 3355 B8R0.3 CNC(=O)\C(C)=C\C#N Amb28388282 [0,2,0,0,0,0|1,0,1]=4 3356 B8R0.3 CNC(=O)\C(C)=C\CN Amb30030279 [0,2,0,0,0,0|1,0,0]=3 3357 B8R0.3 CNCC(C)C(=O)NO Amb28120671 [0,2,0,0,0,0|0,0,2]=4 3358 B8R0.3 CNCC(C)C(=O)OC Amb9288459 [0,2,0,0,0,0|0,0,2]=4 3359 B8R0.3 CN\C=C(\C)C(=O)OC Amb28397516 [0,2,0,0,0,0|0,0,0]=2 3360 B8R0.3 CN\N=C(/C)C(=O)OC Amb27267461 [0,2,0,0,0,0|1,0,0]=3 3361 B8R0.3 COC(=O)C(=O)CC=O Amb26620730 [0,2,0,0,0,0|2,0,0]=4 3362 B8R0.3 COC(=O)C(=O)\C=C\[O-] Amb27596479 [0,2,0,0,0,0|1,0,1]=4 3363 B8R0.3 COC(=O)C(C)CC=O Amb18642746 [0,2,0,0,0,0|1,0,1]=4 3364 B8R0.3 COC(=O)C(C)CCBr Amb26493267 [0,2,0,0,0,0|0,0,2]=4 3365 B8R0.3 COC(=O)C(C)CCCl Amb16230918 [0,2,0,0,0,0|0,0,2]=4 3366 B8R0.3 COC(=O)C(C)CCN Amb26438013 [0,2,0,0,0,0|0,0,2]=4 3367 B8R0.3 COC(=O)C(C)CCN Amb31156338 [0,2,0,0,0,0|0,0,2]=4 3368 B8R0.3 COC(=O)C(C)CSC Amb28203970 [0,2,0,0,0,0|0,0,2]=4 3369 B8R0.3 COC(=O)N(C)CC=O Amb25216418 [0,2,0,0,0,0|2,0,0]=4 3370 B8R0.3 COC(=O)N(C)CCBr Amb27984717 [0,2,0,0,0,0|1,0,1]=4 3371 B8R0.3 COC(=O)N(C)CCCl Amb25916438 [0,2,0,0,0,0|1,0,1]=4 3372 B8R0.3 COC(=O)N(C)CCN Amb18975991 [0,2,0,0,0,0|1,0,1]=4 3373 B8R0.3 COC(=O)N(C)CCN Amb32667515 [0,2,0,0,0,0|1,0,1]=4 3374 B8R0.3 COC(=O)N(C)CCO Amb28049300 [0,2,0,0,0,0|1,0,1]=4 3375 B8R0.3 COC(=O)[C@@H](C)NC=O Amb25716179 [0,2,0,0,0,0|1,0,1]=4 3376 B8R0.3 COC(=O)[C@H](C)CC=O Amb28388611 [0,2,0,0,0,0|1,0,1]=4 3377 B8R0.3 COC(=O)[C@H](C)CCO Amb28134520 [0,2,0,0,0,0|0,0,2]=4 3378 B8R0.3 COC(=O)[C@H](C)NC=O Amb24476955 [0,2,0,0,0,0|1,0,1]=4 3379 B8R0.3 COC(=O)\C(Br)=C\C=O Amb27230610 [0,2,0,0,0,0|1,0,1]=4 3380 B8R0.3 COC(=O)\C(C)=C\CCl Amb19149007 [0,2,0,0,0,0|0,0,0]=2 3381 B8R0.3 COC(=O)\C(C)=C\CN Amb28247882 [0,2,0,0,0,0|0,0,0]=2 3382 B8R0.3 COC(=O)\C(C)=C\CN Amb32683320 [0,2,0,0,0,0|0,0,0]=2 3383 B8R0.3 COC(=O)\C(Cl)=C/C#N Amb17593649 [0,2,0,0,0,0|1,0,1]=4 3384 B8R0.3 COC(=O)\C(Cl)=C\C#N Amb27191749 [0,2,0,0,0,0|1,0,1]=4 3385 B8R0.3 COC(=O)\C(F)=C\CBr Amb28199281 [0,2,0,0,0,0|1,0,0]=3 3386 B8R0.3 COC(=O)\C(F)=C\CN Amb33803457 [0,2,0,0,0,0|1,0,0]=3 3387 B8R0.3 COCC(=O)N(C)OC Amb20672170 [0,2,0,0,0,0|2,0,0]=4 3388 B8R0.3 COCN(C)C(=O)CO Amb27472523 [0,2,0,0,0,0|1,0,1]=4 3389 B8R0.3 COCN(C)C(=O)OC Amb27201767 [0,2,0,0,0,0|1,0,1]=4 3390 B8R0.3 CONC(=O)C(C)SC Amb27837678 [0,2,0,0,0,0|1,0,1]=4 3391 B8R0.3 CONC(C)C(=O)OC Amb32729489 [0,2,0,0,0,0|1,0,1]=4 3392 B8R0.3 CO\C=C(/C)C(=O)OC Amb22547337 [0,2,0,0,0,0|0,0,0]=2 3393 B8R0.3 CO\C=C(/F)C(=O)OC Amb22641700 [0,2,0,0,0,0|1,0,0]=3 3394 B8R0.3 CO\C=C(/I)C(=O)OC Amb33986366 [0,2,0,0,0,0|1,0,0]=3 3395 B8R0.3 CO\C=C(\F)C(=O)OC Amb28049256 [0,2,0,0,0,0|1,0,0]=3 3396 B8R0.3 CO\C=C(\I)C(=O)OC Amb27755740 [0,2,0,0,0,0|1,0,0]=3 3397 B8R0.3 C\C(=C/CN)C(=O)NN Amb35608835 [0,2,0,0,0,0|1,0,0]=3 3398 B8R0.3 C\C(=C/CN)C(=O)NO Amb35608836 [0,2,0,0,0,0|0,0,0]=2 3399 B8R0.3 C\C(=C/Cl)C(=O)N=C=S Amb27859938 [0,2,0,0,0,0|1,1,0]=4 3400 B8R0.3 C\C(C=O)=C(\C)N=C=O Amb27440009 [0,2,0,0,0,0|2,0,0]=4 3401 B8R0.3 C\C(CO)=C(/C)CCO Amb17593379 [0,2,0,0,0,0|1,0,1]=4 3402 B8R0.3 C\C(CO)=C(\C)CCO Amb27214011 [0,2,0,0,0,0|1,0,1]=4 3403 B8R0.3 C\C=C(/C)C(=N)OCC Amb27784277 [0,2,0,0,0,0|1,0,0]=3 3404 B8R0.3 C\C=C(/C)C(=O)CCC Amb27838645 [0,2,0,0,0,0|1,0,0]=3 3405 B8R0.3 C\C=C(/C)C(=O)NCC Amb28049420 [0,2,0,0,0,0|1,0,0]=3 3406 B8R0.3 C\C=C(/C)C(=O)OCC Amb4021649 [0,2,0,0,0,0|0,0,0]=2 3407 B8R0.3 C\C=C(/Cl)C(=O)\C=C\C Amb27838619 [0,2,0,0,0,0|2,0,0]=4 3408 B8R0.3 C\C=C(/N)C(=O)OCC Amb27460193 [0,2,0,0,0,0|1,0,0]=3 3409 B8R0.3 C\C=C(\C)C(=O)N=[N+]=[N-] Amb27794617 [0,2,0,0,0,0|1,0,0]=3 3410 B8R0.3 C\C=C(\C)C(=O)OCC Amb27867863 [0,2,0,0,0,0|0,0,0]=2 3411 B8R0.3 C\C=C(\C)C(O)\C=C\C Amb27255199 [0,2,0,0,0,0|1,0,1]=4 3412 B8R0.3 C\C=C(\Cl)C(=O)CCCl Amb27666360 [0,2,0,0,0,0|2,0,0]=4 3413 B8R0.3 C\C=C\C(=O)C(=O)SC Amb24752931 [0,2,0,0,0,0|1,1,0]=4 3414 B8R0.3 C\C=C\C(=O)\C(C)=C\C Amb27838662 [0,2,0,0,0,0|1,0,0]=3 3415 B8R0.3 C\C=C\C(Br)C(=O)OC Amb27476466 [0,2,0,0,0,0|1,0,1]=4 3416 B8R0.8 C#CCCC(C)C(=O)O Amb27464960 [0,2,0,0,0,0|0,0,2]=4 3417 B8R0.8 C#CCNC(=O)C(=O)O Amb9303778 [0,2,0,0,0,0|2,0,0]=4 3418 B8R0.8 C#CCNC(C)C(=O)O Amb9327029 [0,2,0,0,0,0|1,0,1]=4 3419 B8R0.8 C#CCN[C@H](C)C(=O)O Amb27815665 [0,2,0,0,0,0|1,0,1]=4 3420 B8R0.8 C#CCOC(C)C(=O)O Amb9208661 [0,2,0,0,0,0|1,0,1]=4 3421 B8R0.8 C#CCO[C@H](C)C(=O)O Amb28042909 [0,2,0,0,0,0|1,0,1]=4 3422 B8R0.8 C#CCSC(C)C(=O)O Amb6274343 [0,2,0,0,0,0|1,0,1]=4 3423 B8R0.8 C=C(C)\C(C)=C\CCBr Amb27482356 [0,2,0,0,0,0|2,0,0]=4 3424 B8R0.8 C=C(C)\C(C)=C\CCCl Amb27592477 [0,2,0,0,0,0|2,0,0]=4 3425 B8R0.8 C=C(C)\C(C)=C\CCN Amb27838471 [0,2,0,0,0,0|2,0,0]=4 3426 B8R0.8 C=C(CCCC)C(=O)O Amb18642649 [0,2,0,0,0,0|0,0,2]=4 3427 B8R0.8 C=C(CCCO)C(=O)O Amb28313844 [0,2,0,0,0,0|0,0,2]=4 3428 B8R0.8 C=C(CCOC)C(=O)O Amb26588153 [0,2,0,0,0,0|0,0,2]=4 3429 B8R0.8 C=C(CCSC)C(=O)O Amb27188177 [0,2,0,0,0,0|0,0,2]=4 3430 B8R0.8 C=C(COCC)C(=O)O Amb27444042 [0,2,0,0,0,0|0,0,2]=4 3431 B8R0.8 C=C(CSCC)C(=O)O Amb26023918 [0,2,0,0,0,0|0,0,2]=4 3432 B8R0.8 C=C(OCOC)C(=O)O Amb27467648 [0,2,0,0,0,0|0,0,2]=4 3433 B8R0.8 C=C(\C=C\CC)C(=O)O Amb33267978 [0,2,0,0,0,0|0,0,1]=3 3434 B8R0.8 C=C(\C=C\CC)C(C)=O Amb25074493 [0,2,0,0,0,0|1,0,1]=4 3435 B8R0.8 C=CCCC(=O)C(=O)O Amb25738669 [0,2,0,0,0,0|1,0,1]=4 3436 B8R0.8 C=CCCC(C)C(=O)O Amb18642656 [0,2,0,0,0,0|0,0,2]=4 3437 B8R0.8 C=CCNC(=O)C(=O)O Amb9238894 [0,2,0,0,0,0|1,0,1]=4 3438 B8R0.8 C=CCNC(C)C(=O)O Amb9326762 [0,2,0,0,0,0|0,0,2]=4 3439 B8R0.8 C=CCOC(=O)C(=O)O Amb27849418 [0,2,0,0,0,0|1,0,1]=4 3440 B8R0.8 C=CCOC(C)C(=O)O Amb9208699 [0,2,0,0,0,0|0,0,2]=4 3441 B8R0.8 C=CCSC(=S)C(=O)O Amb27953379 [0,2,0,0,0,0|1,0,1]=4 3442 B8R0.8 C=CCSC(C)C(=O)O Amb6273705 [0,2,0,0,0,0|0,0,2]=4 3443 B8R0.8 C=CC\N=C(/C)C(C)=O Amb27875405 [0,2,0,0,0,0|1,0,1]=4 3444 B8R0.8 C=C\C=C\C(C)C(=O)O Amb27595636 [0,2,0,0,0,0|0,0,2]=4 3445 B8R0.8 C=C\C=C\[C@@H](C)C(=O)O Amb27188218 [0,2,0,0,0,0|0,0,2]=4 3446 B8R0.8 CC#CCC(C)C(=O)O Amb28281174 [0,2,0,0,0,0|0,0,2]=4 3447 B8R0.8 CC(=C=CCO)C(C)O Amb28281805 [0,2,0,0,0,0|1,0,1]=4 3448 B8R0.8 CC(=C=CCO)[C@H](C)O Amb27424947 [0,2,0,0,0,0|1,0,1]=4 3449 B8R0.8 CC(CCC#N)C(=O)O Amb24462559 [0,2,0,0,0,0|0,0,2]=4 3450 B8R0.8 CC(CCCCl)C(=O)O Amb2720283 [0,2,0,0,0,0|0,0,2]=4 3451 B8R0.8 CC(CCCF)C(=O)O Amb25244585 [0,2,0,0,0,0|0,0,2]=4 3452 B8R0.8 CC(CCCN)C(=O)O Amb25146072 [0,2,0,0,0,0|0,0,2]=4 3453 B8R0.8 CC(CCCN)C(=O)O Amb32686960 [0,2,0,0,0,0|0,0,2]=4 3454 B8R0.8 CC(C\C=N\O)C(=O)O Amb27217284 [0,2,0,0,0,0|1,0,1]=4 3455 B8R0.8 CC(NCCS)C(=O)O Amb28057720 [0,2,0,0,0,0|0,0,2]=4 3456 B8R0.8 CC(OCC#N)C(=O)O Amb27465969 [0,2,0,0,0,0|1,0,1]=4 3457 B8R0.8 CC(OCCF)C(=O)O Amb27240801 [0,2,0,0,0,0|0,0,2]=4 3458 B8R0.8 CC(OCCN)C(=O)O Amb22546285 [0,2,0,0,0,0|0,0,2]=4 3459 B8R0.8 CC(OCCO)C(=O)O Amb6680915 [0,2,0,0,0,0|0,0,2]=4 3460 B8R0.8 CC(OCCS)C(=O)O Amb27857332 [0,2,0,0,0,0|0,0,2]=4 3461 B8R0.8 CC(SCC#N)C(=O)O Amb6260833 [0,2,0,0,0,0|1,0,1]=4 3462 B8R0.8 CC(SCCCl)C(=O)O Amb27404902 [0,2,0,0,0,0|0,0,2]=4 3463 B8R0.8 CC(SCCN)C(=O)O Amb17500447 [0,2,0,0,0,0|0,0,2]=4 3464 B8R0.8 CCCCC(=O)C(=O)O Amb18642761 [0,2,0,0,0,0|1,0,1]=4 3465 B8R0.8 CCCCC(C)C(=O)O Amb3939937 [0,2,0,0,0,0|0,0,2]=4 3466 B8R0.8 CCCC[C@@H](C)C(=O)O Amb24590691 [0,2,0,0,0,0|0,0,2]=4 3467 B8R0.8 CCCC[C@H](C)C(=O)O Amb25850678 [0,2,0,0,0,0|0,0,2]=4 3468 B8R0.8 CCCNC(=O)C(=O)O Amb9303791 [0,2,0,0,0,0|1,0,1]=4 3469 B8R0.8 CCCNC(C)C(=O)O Amb9326994 [0,2,0,0,0,0|0,0,2]=4 3470 B8R0.8 CCCN[C@H](C)C(=O)O Amb28073462 [0,2,0,0,0,0|0,0,2]=4 3471 B8R0.8 CCCOC(=O)C(=O)O Amb28399593 [0,2,0,0,0,0|1,0,1]=4 3472 B8R0.8 CCCOC(C)C(=O)O Amb8874518 [0,2,0,0,0,0|0,0,2]=4 3473 B8R0.8 CCCSC(=S)C(=O)O Amb27808849 [0,2,0,0,0,0|1,0,1]=4 3474 B8R0.8 CCCSC(C)C(=O)O Amb6274283 [0,2,0,0,0,0|0,0,2]=4 3475 B8R0.8 CCC\C=C(/Br)C(=O)O Amb27816159 [0,2,0,0,0,0|1,0,0]=3 3476 B8R0.8 CCC\C=C(/C)C(=O)O Amb10844998 [0,2,0,0,0,0|0,0,0]=2 3477 B8R0.8 CCC\C=C(/C)C(C)=O Amb17593317 [0,2,0,0,0,0|1,0,0]=3 3478 B8R0.8 CCC\C=C(/F)C(C)=O Amb27227052 [0,2,0,0,0,0|2,0,0]=4 3479 B8R0.8 CCC\C=C(\C)[C@@H](C)O Amb27484961 [0,2,0,0,0,0|1,0,1]=4 3480 B8R0.8 CCC\C=C(\C)[N+](=O)[O-] Amb27185824 [0,2,0,0,0,0|1,0,1]=4 3481 B8R0.8 CCC\C=C(\F)C(=O)O Amb27448669 [0,2,0,0,0,0|1,0,0]=3 3482 B8R0.8 CCC\N=C(\C)C(C)=O Amb28255004 [0,2,0,0,0,0|1,0,1]=4 3483 B8R0.8 CCNCC(C)C(=O)O Amb13952782 [0,2,0,0,0,0|0,0,2]=4 3484 B8R0.8 CCNCC(C)C(=O)O Amb9400285 [0,2,0,0,0,0|0,0,2]=4 3485 B8R0.8 CCN\C=C(\C)C(C)=O Amb27469636 [0,2,0,0,0,0|1,0,0]=3 3486 B8R0.8 CCOCC(C)C(=O)O Amb9172215 [0,2,0,0,0,0|0,0,2]=4 3487 B8R0.8 CCOC[C@@H](C)C(=O)O Amb25790635 [0,2,0,0,0,0|0,0,2]=4 3488 B8R0.8 CCOC[C@H](C)C(=O)O Amb10844265 [0,2,0,0,0,0|0,0,2]=4 3489 B8R0.8 CCO\C=C(/Br)C(=O)O Amb27198193 [0,2,0,0,0,0|1,0,0]=3 3490 B8R0.8 CCO\C=C(/Br)C(C)=O Amb8393391 [0,2,0,0,0,0|2,0,0]=4 3491 B8R0.8 CCO\C=C(/C)C(=O)O Amb27249542 [0,2,0,0,0,0|0,0,0]=2 3492 B8R0.8 CCO\C=C(/C)C(C)=O Amb26853746 [0,2,0,0,0,0|1,0,0]=3 3493 B8R0.8 CCO\C=C(\Br)C(=O)O Amb27645304 [0,2,0,0,0,0|1,0,0]=3 3494 B8R0.8 CCO\C=C(\O)C(C)=O Amb27486167 [0,2,0,0,0,0|2,0,0]=4 3495 B8R0.8 CCO\N=C(/C)C(=O)O Amb27595574 [0,2,0,0,0,0|0,0,1]=3 3496 B8R0.8 CCO\N=C(/C)C(N)=O Amb27473490 [0,2,0,0,0,0|1,0,1]=4 3497 B8R0.8 CCSCC(C)C(=O)O Amb9400067 [0,2,0,0,0,0|0,0,2]=4 3498 B8R0.8 CC\C=C\C(=O)C(=O)O Amb27486094 [0,2,0,0,0,0|1,0,0]=3 3499 B8R0.8 CC\C=C\C(C)C(=O)O Amb33172515 [0,2,0,0,0,0|0,0,1]=3 3500 B8R0.8 CC\C=C\C(C)C(C)=O Amb25295311 [0,2,0,0,0,0|1,0,1]=4 3501 B8R0.8 CC\C=C\C(N)C(=O)O Amb33449874 [0,2,0,0,0,0|1,0,1]=4 3502 B8R0.8 CC\C=C\C(O)C(=O)O Amb27781864 [0,2,0,0,0,0|1,0,1]=4 3503 B8R0.8 CC\C=C\[C@@H](N)C(=O)O Amb27239476 [0,2,0,0,0,0|1,0,1]=4 3504 B8R0.8 COCCC(=O)C(=O)O Amb27959741 [0,2,0,0,0,0|1,0,1]=4 3505 B8R0.8 COCCC(C)C(=O)O Amb18523823 [0,2,0,0,0,0|0,0,2]=4 3506 B8R0.8 COCCN(C)C(=O)O Amb32677018 [0,2,0,0,0,0|1,0,1]=4 3507 B8R0.8 COCOC(C)C(=O)O Amb28120688 [0,2,0,0,0,0|0,0,2]=4 3508 B8R0.8 COCSC(C)C(=O)O Amb28410278 [0,2,0,0,0,0|0,0,2]=4 3509 B8R0.8 COC\C=C(/C)C(C)=O Amb27838769 [0,2,0,0,0,0|1,0,0]=3 3510 B8R0.8 COC\C=C(\Br)C(=O)O Amb24580462 [0,2,0,0,0,0|1,0,0]=3 3511 B8R0.8 COC\C=C(\C)C(=O)O Amb27169036 [0,2,0,0,0,0|0,0,0]=2 3512 B8R0.8 COC\C=C(\F)C(=O)O Amb27872029 [0,2,0,0,0,0|1,0,0]=3 3513 B8R0.8 CO\C=C\C(=O)C(=O)Cl Amb25135276 [0,2,0,0,0,0|2,0,0]=4 3514 B8R0.8 CO\C=C\C(=O)C(C)=O Amb27838487 [0,2,0,0,0,0|2,0,0]=4 3515 B8R0.8 CO\C=C\[C@@H](N)C(=O)O Amb27427471 [0,2,0,0,0,0|1,0,1]=4 3516 B8R0.8 CSCCC(=N)C(=O)O Amb27196552 [0,2,0,0,0,0|1,0,1]=4 3517 B8R0.8 CSCCC(=O)C(=O)O Amb18643588 [0,2,0,0,0,0|1,0,1]=4 3518 B8R0.8 CSCCC(C)C(=O)O Amb24739356 [0,2,0,0,0,0|0,0,2]=4 3519 B8R0.8 CSSCC(C)C(=O)O Amb27240302 [0,2,0,0,0,0|0,0,2]=4 3520 B8R0.8 CS\C=C/[C@H](N)C(=O)O Amb26006745 [0,2,0,0,0,0|1,0,1]=4 3521 B8R0.8 CS\C=C\C(N)C(=O)O Amb27759361 [0,2,0,0,0,0|1,0,1]=4 3522 B8R0.8 C[C@@H](CCC#N)C(=O)O Amb27870712 [0,2,0,0,0,0|0,0,2]=4 3523 B8R0.8 C[C@@H](CCCN)C(=O)O Amb28314637 [0,2,0,0,0,0|0,0,2]=4 3524 B8R0.8 C[C@@H](NCCF)C(=O)O Amb28073998 [0,2,0,0,0,0|0,0,2]=4 3525 B8R0.8 C[C@@H](NCCO)C(=O)O Amb26885478 [0,2,0,0,0,0|0,0,2]=4 3526 B8R0.8 C[C@@H](OCCF)C(=O)O Amb27763930 [0,2,0,0,0,0|0,0,2]=4 3527 B8R0.8 C[C@@H](OCCO)C(=O)O Amb28318043 [0,2,0,0,0,0|0,0,2]=4 3528 B8R0.8 C[C@@H](SCCN)C(=O)O Amb27170977 [0,2,0,0,0,0|0,0,2]=4 3529 B8R0.8 C[C@H](NCC#N)C(=O)O Amb28079480 [0,2,0,0,0,0|1,0,1]=4 3530 B8R0.8 C[C@H](NCCO)C(=O)O Amb28058421 [0,2,0,0,0,0|0,0,2]=4 3531 B8R0.8 C[C@H](OCCN)C(=O)O Amb27479935 [0,2,0,0,0,0|0,0,2]=4 3532 B8R0.8 C[C@H](OCCO)C(=O)O Amb27398048 [0,2,0,0,0,0|0,0,2]=4 3533 B8R0.8 C\C(=C/CCN)C(=O)O Amb28397850 [0,2,0,0,0,0|0,0,0]=2 3534 B8R0.8 C\C(=C/CON)C(=O)O Amb28207816 [0,2,0,0,0,0|0,0,0]=2 3535 B8R0.8 C\C=C/CC(=O)C(=O)O Amb27450808 [0,2,0,0,0,0|1,0,0]=3 3536 B8R0.8 C\C=C\C=C(/C)C(=O)O Amb27468745 [0,2,0,0,0,0|0,0,0]=2 3537 B8R0.8 C\C=C\C=C(/C)C(C)=O Amb27802596 [0,2,0,0,0,0|1,0,0]=3 3538 B8R0.8 C\C=C\C=C(/C)C(N)=O Amb27393697 [0,2,0,0,0,0|1,0,0]=3 3539 B8R0.8 C\C=C\C=C(/F)C(=O)O Amb27216973 [0,2,0,0,0,0|1,0,0]=3 3540 B8R0.8 C\C=C\C=C(/O)C(=O)O Amb28368858 [0,2,0,0,0,0|1,0,0]=3 3541 B8R0.8 C\C=C\CC(=O)C(=O)O Amb18642583 [0,2,0,0,0,0|1,0,0]=3 3542 B8R0.8 C\C=C\CC(C)C(=O)O Amb18642630 [0,2,0,0,0,0|0,0,1]=3 3543 B8R0.8 C\C=C\CC(C)C(C)=O Amb27799374 [0,2,0,0,0,0|1,0,1]=4 3544 B8R0.8 C\C=C\CC(F)C(=O)O Amb27959670 [0,2,0,0,0,0|1,0,1]=4 3545 B8R0.8 C\C=C\CC(N)C(=O)O Amb6256663 [0,2,0,0,0,0|1,0,1]=4 3546 B8R0.8 C\C=C\C[C@@H](N)C(=O)O Amb33065673 [0,2,0,0,0,0|1,0,1]=4 3547 B8R0.8 C\C=C\C[C@H](C)C(=O)O Amb28368854 [0,2,0,0,0,0|0,0,1]=3 3548 B8R0.8 C\C=C\C[C@H](C)C(C)=O Amb26891739 [0,2,0,0,0,0|1,0,1]=4 3549 B8R0.8 C\C=C\C[C@H](N)C(=O)O Amb27768785 [0,2,0,0,0,0|1,0,1]=4 3550 B8R0.8 N#CCNC(=O)C(=O)O Amb18063035 [0,2,0,0,0,0|2,0,0]=4 3551 B8R0.8 N=C(NCCO)C(=O)O Amb18124348 [0,2,0,0,0,0|1,0,1]=4 3552 B8R0.8 NCC\C=C(\F)C(=O)O Amb27398392 [0,2,0,0,0,0|1,0,0]=3 3553 B8R0.8 NC\C=C\[C@H](N)C(=O)O Amb24580033 [0,2,0,0,0,0|1,0,1]=4 3554 B8R0.8 O=C(O)C(=O)CCCF Amb33196459 [0,2,0,0,0,0|1,0,1]=4 3555 B8R0.8 O=C(O)C(=O)CCCO Amb27470301 [0,2,0,0,0,0|1,0,1]=4 3556 B8R0.8 O=C(O)C(=O)CCCO Amb30666618 [0,2,0,0,0,0|1,0,1]=4 3557 B8R0.8 O=C(O)C(=O)CSCCl Amb33069677 [0,2,0,0,0,0|1,0,1]=4 3558 B8R0.8 O=C(O)\C(Br)=C\C=N\O Amb27637647 [0,2,0,0,0,0|1,0,1]=4 3559 B8R0.8 O=C(O)\C(O)=C\C=C\Br Amb28048233 [0,2,0,0,0,0|1,0,1]=4 3560 B8R0.8 O=CCCC(=O)C(=O)O Amb27882544 [0,2,0,0,0,0|1,0,1]=4 3561 B8R0.8 O=CCCC(=O)C(=O)O Amb32670694 [0,2,0,0,0,0|1,0,1]=4 3562 B8R0.12 C=CCC(C)(C)C(=O)O Amb10603495 [0,2,0,0,0,0|0,0,2]=4 3563 B8R0.12 C=CC[C@@](C)(N)C(=O)O Amb8389450 [0,2,0,0,0,0|0,0,2]=4 3564 B8R0.12 C=CC[C@@](C)(O)C(=O)O Amb27412350 [0,2,0,0,0,0|0,0,2]=4 3565 B8R0.12 C=CC[C@](C)(N)C(=O)O Amb8514992 [0,2,0,0,0,0|0,0,2]=4 3566 B8R0.12 C=CC[C@](C)(O)C(=O)O Amb27958223 [0,2,0,0,0,0|0,0,2]=4 3567 B8R0.12 CC(C)(CCCl)C(=O)O Amb27953901 [0,2,0,0,0,0|0,0,2]=4 3568 B8R0.12 CC(C)(CCF)C(=O)O Amb27838513 [0,2,0,0,0,0|0,0,2]=4 3569 B8R0.12 CC(C)(CCN)C(=O)O Amb2694929 [0,2,0,0,0,0|0,0,2]=4 3570 B8R0.12 CC(C)(CCN)C(=O)O Amb8630069 [0,2,0,0,0,0|0,0,2]=4 3571 B8R0.12 CC(C)(CCO)C(=O)O Amb24763728 [0,2,0,0,0,0|0,0,2]=4 3572 B8R0.12 CC(C)(NC=O)C(=O)O Amb18281022 [0,2,0,0,0,0|1,0,1]=4 3573 B8R0.12 CC(C)(NC=S)C(=O)O Amb27949719 [0,2,0,0,0,0|1,0,1]=4 3574 B8R0.12 CC(C)(\C=C\Br)C(=O)O Amb24420866 [0,2,0,0,0,0|0,0,2]=4 3575 B8R0.12 CC(N)(CCF)C(=O)O Amb27961476 [0,2,0,0,0,0|0,0,2]=4 3576 B8R0.12 CC(N)(CCF)C(=O)O Amb28934998 [0,2,0,0,0,0|0,0,2]=4 3577 B8R0.12 CC(O)(CCF)C(=O)O Amb33379277 [0,2,0,0,0,0|0,0,2]=4 3578 B8R0.12 CCCC(C)(C)C(=O)O Amb2720786 [0,2,0,0,0,0|0,0,2]=4 3579 B8R0.12 CCCC(C)(Cl)C(=O)O Amb17593751 [0,2,0,0,0,0|0,0,2]=4 3580 B8R0.12 CCCC(C)(F)C(=O)O Amb27797327 [0,2,0,0,0,0|0,0,2]=4 3581 B8R0.12 CCCC(C)(N)C(=O)O Amb9720287 [0,2,0,0,0,0|0,0,2]=4 3582 B8R0.12 CCCC(C)(O)C(=O)O Amb18288835 [0,2,0,0,0,0|0,0,2]=4 3583 B8R0.12 CCC[C@@](C)(N)C(=O)O Amb2699127 [0,2,0,0,0,0|0,0,2]=4 3584 B8R0.12 CCC[C@](C)(N)C(=O)O Amb16232632 [0,2,0,0,0,0|0,0,2]=4 3585 B8R0.12 CCNC(C)(C)C(=O)O Amb13952777 [0,2,0,0,0,0|0,0,2]=4 3586 B8R0.12 CCNC(C)(C)C(=O)O Amb9619876 [0,2,0,0,0,0|0,0,2]=4 3587 B8R0.12 CCOC(C)(C)C(=O)O Amb18976723 [0,2,0,0,0,0|0,0,2]=4 3588 B8R0.12 CCSC(C)(C)C(=O)O Amb17501487 [0,2,0,0,0,0|0,0,2]=4 3589 B8R0.12 CNCC(C)(C)C(=O)O Amb26557784 [0,2,0,0,0,0|0,0,2]=4 3590 B8R0.12 CNCC(C)(C)C(=O)O Amb33249638 [0,2,0,0,0,0|0,0,2]=4 3591 B8R0.12 CNCC(C)(O)C(=O)O Amb27478763 [0,2,0,0,0,0|0,0,2]=4 3592 B8R0.12 CNC[C@@](C)(N)C(=O)O Amb27975719 [0,2,0,0,0,0|0,0,2]=4 3593 B8R0.12 CNC[C@](C)(N)C(=O)O Amb25882845 [0,2,0,0,0,0|0,0,2]=4 3594 B8R0.12 COCC(C)(C)C(=O)O Amb10608195 [0,2,0,0,0,0|0,0,2]=4 3595 B8R0.12 COCC(C)(N)C(=O)O Amb18990135 [0,2,0,0,0,0|0,0,2]=4 3596 B8R0.12 COCC(C)(N)C(=O)O Amb20622455 [0,2,0,0,0,0|0,0,2]=4 3597 B8R0.12 COCC(C)(O)C(=O)O Amb18992608 [0,2,0,0,0,0|0,0,2]=4 3598 B8R0.12 COC[C@](C)(N)C(=O)O Amb24568285 [0,2,0,0,0,0|0,0,2]=4 3599 B8R0.12 CSCC(C)(C)C(=O)O Amb18124874 [0,2,0,0,0,0|0,0,2]=4 3600 B8R0.12 CSCC(C)(N)C(=O)O Amb18294541 [0,2,0,0,0,0|0,0,2]=4 3601 B8R0.12 C[C@@](N)(CCO)C(=O)O Amb28048736 [0,2,0,0,0,0|0,0,2]=4 3602 B8R0.12 C[C@](N)(CCN)C(=O)O Amb25348479 [0,2,0,0,0,0|0,0,2]=4 3603 B8R0.12 C[C@](O)(NC=O)C(=O)O Amb27628573 [0,2,0,0,0,0|1,0,1]=4 3604 B8R0.12 C\C=C/C(C)(C)C(C)=O Amb27838714 [0,2,0,0,0,0|1,0,1]=4 3605 B8R0.12 C\C=C\C(C)(C)C(C)=O Amb26531337 [0,2,0,0,0,0|1,0,1]=4 3606 B8R0.12 C\C=C\C(C)(N)C(=O)O Amb24671255 [0,2,0,0,0,0|0,0,1]=3 3607 B8R0.15 C#CC[C@H](CC)C(=O)O Amb28120786 [0,2,0,0,0,0|0,0,2]=4 3608 B8R0.15 C=C=C(CCC)C(=O)O Amb28045352 [0,2,0,0,0,0|0,0,2]=4 3609 B8R0.15 C=CC(SCC)C(=O)O Amb27757608 [0,2,0,0,0,0|0,0,2]=4 3610 B8R0.15 C=CC(\C=C\C)C(=O)O Amb27214636 [0,2,0,0,0,0|0,0,2]=4 3611 B8R0.15 C=CCC(C=O)C(=O)O Amb28313315 [0,2,0,0,0,0|1,0,1]=4 3612 B8R0.15 C=CCC(CC)C(=O)O Amb18642632 [0,2,0,0,0,0|0,0,2]=4 3613 B8R0.15 C=CC[C@@H](C=C)C(=O)O Amb28285259 [0,2,0,0,0,0|0,0,2]=4 3614 B8R0.15 C=CC\C(=C/C)C(C)=O Amb28141546 [0,2,0,0,0,0|1,0,0]=3 3615 B8R0.15 C=C[C@@H](CCC)C(=O)O Amb27658640 [0,2,0,0,0,0|0,0,2]=4 3616 B8R0.15 C=C\C(=C\C=O)C(=O)O Amb27789887 [0,2,0,0,0,0|0,0,2]=4 3617 B8R0.15 C=C\C(=C\SC)C(C)=O Amb24752730 [0,2,0,0,0,0|1,0,1]=4 3618 B8R0.15 C=C\C=C(/C#N)C(=O)O Amb26642183 [0,2,0,0,0,0|0,0,2]=4 3619 B8R0.15 CC=C=C(CC)C(=O)O Amb28289600 [0,2,0,0,0,0|0,0,0]=2 3620 B8R0.15 CCC(CCF)C(=O)O Amb26321627 [0,2,0,0,0,0|0,0,2]=4 3621 B8R0.15 CCC(CCN)C(=O)O Amb24699884 [0,2,0,0,0,0|0,0,2]=4 3622 B8R0.15 CCC(CCN)C(=O)O Amb32662662 [0,2,0,0,0,0|0,0,2]=4 3623 B8R0.15 CCC(CCO)C(=O)O Amb18642884 [0,2,0,0,0,0|0,0,2]=4 3624 B8R0.15 CCC(COC)C(=O)O Amb18124352 [0,2,0,0,0,0|0,0,2]=4 3625 B8R0.15 CCC(CSC)C(=O)O Amb33272061 [0,2,0,0,0,0|0,0,2]=4 3626 B8R0.15 CCC(NC=O)C(=O)O Amb4016839 [0,2,0,0,0,0|1,0,1]=4 3627 B8R0.15 CCC(SSC)C(=O)O Amb27236075 [0,2,0,0,0,0|0,0,2]=4 3628 B8R0.15 CCCC(C=O)C(=O)O Amb27464964 [0,2,0,0,0,0|1,0,1]=4 3629 B8R0.15 CCCC(CC)C(=O)O Amb19009626 [0,2,0,0,0,0|0,0,2]=4 3630 B8R0.15 CCCC(CF)C(=O)O Amb27186472 [0,2,0,0,0,0|0,0,2]=4 3631 B8R0.15 CCCC(CN)C(=O)O Amb19373497 [0,2,0,0,0,0|0,0,2]=4 3632 B8R0.15 CCCC(CO)C(=O)O Amb25881510 [0,2,0,0,0,0|0,0,2]=4 3633 B8R0.15 CCCC(NC)C(=O)O Amb21961534 [0,2,0,0,0,0|0,0,2]=4 3634 B8R0.15 CCCC(NC)C(=O)O Amb22587444 [0,2,0,0,0,0|0,0,2]=4 3635 B8R0.15 CCCC(NC)C(=O)O Amb9496293 [0,2,0,0,0,0|0,0,2]=4 3636 B8R0.15 CCCC(OC)C(=O)O Amb8455302 [0,2,0,0,0,0|0,0,2]=4 3637 B8R0.15 CCCC(SC)C(=O)O Amb28289849 [0,2,0,0,0,0|0,0,2]=4 3638 B8R0.15 CCC[C@@H](CO)C(=O)O Amb24571859 [0,2,0,0,0,0|0,0,2]=4 3639 B8R0.15 CCC[C@@H](NC)C(=O)O Amb25771939 [0,2,0,0,0,0|0,0,2]=4 3640 B8R0.15 CCC[C@@H](NC)C(=O)O Amb33801471 [0,2,0,0,0,0|0,0,2]=4 3641 B8R0.15 CCC[C@H](CN)C(=O)O Amb27460612 [0,2,0,0,0,0|0,0,2]=4 3642 B8R0.15 CCC[C@H](CO)C(=O)O Amb25063310 [0,2,0,0,0,0|0,0,2]=4 3643 B8R0.15 CCC[C@H](NC)C(=O)O Amb25062610 [0,2,0,0,0,0|0,0,2]=4 3644 B8R0.15 CCC[C@H](NC)C(=O)O Amb33456398 [0,2,0,0,0,0|0,0,2]=4 3645 B8R0.15 CCC\C(=C/Br)C(C)=O Amb28366544 [0,2,0,0,0,0|2,0,0]=4 3646 B8R0.15 CCNC(CC)C(=O)O Amb33339265 [0,2,0,0,0,0|0,0,2]=4 3647 B8R0.15 CCNC(CC)C(=O)O Amb9620054 [0,2,0,0,0,0|0,0,2]=4 3648 B8R0.15 CCN[C@@H](CC)C(=O)O Amb26019582 [0,2,0,0,0,0|0,0,2]=4 3649 B8R0.15 CCN[C@H](CC)C(=O)O Amb33347493 [0,2,0,0,0,0|0,0,2]=4 3650 B8R0.15 CCOC(CC)C(=O)O Amb9675410 [0,2,0,0,0,0|0,0,2]=4 3651 B8R0.15 CCOC(CS)C(=O)O Amb19037339 [0,2,0,0,0,0|0,0,2]=4 3652 B8R0.15 CCSC(CC)C(=O)O Amb9675503 [0,2,0,0,0,0|0,0,2]=4 3653 B8R0.15 CC[C@H](CCN)C(=O)O Amb27754665 [0,2,0,0,0,0|0,0,2]=4 3654 B8R0.15 CC\C(=C/CBr)C(=O)O Amb27650570 [0,2,0,0,0,0|0,0,0]=2 3655 B8R0.15 CC\C(=C/OC)C(=O)O Amb28369278 [0,2,0,0,0,0|0,0,0]=2 3656 B8R0.15 CC\C(=C/OC)C(C)=O Amb27243435 [0,2,0,0,0,0|1,0,0]=3 3657 B8R0.15 CC\C(=C/SC)C(C)=O Amb28201656 [0,2,0,0,0,0|1,0,0]=3 3658 B8R0.15 CC\C(=N/OC)C(=O)O Amb27974474 [0,2,0,0,0,0|0,0,1]=3 3659 B8R0.15 CC\C=C(/CC)C(N)=O Amb27799023 [0,2,0,0,0,0|1,0,0]=3 3660 B8R0.15 CC\C=C(\CC)C(=O)O Amb27195307 [0,2,0,0,0,0|0,0,0]=2 3661 B8R0.15 CC\C=C(\CC)[N+](=O)[O-] Amb27797892 [0,2,0,0,0,0|1,0,1]=4 3662 B8R0.15 CC\C=C(\CO)C(C)O Amb27618233 [0,2,0,0,0,0|1,0,1]=4 3663 B8R0.15 CNC(CCO)C(=O)O Amb27390592 [0,2,0,0,0,0|0,0,2]=4 3664 B8R0.15 CNC(COC)C(=O)O Amb19304133 [0,2,0,0,0,0|0,0,2]=4 3665 B8R0.15 CNC(COC)C(=O)O Amb22059040 [0,2,0,0,0,0|0,0,2]=4 3666 B8R0.15 CNCC(CO)C(=O)O Amb26352745 [0,2,0,0,0,0|0,0,2]=4 3667 B8R0.15 CNCC(CO)C(=O)O Amb32661056 [0,2,0,0,0,0|0,0,2]=4 3668 B8R0.15 CN[C@H](COC)C(=O)O Amb33347473 [0,2,0,0,0,0|0,0,2]=4 3669 B8R0.15 CN\C=C(\C#N)C(C)=O Amb27216699 [0,2,0,0,0,0|1,0,1]=4 3670 B8R0.15 COC(CC#N)C(=O)O Amb27157791 [0,2,0,0,0,0|1,0,1]=4 3671 B8R0.15 COC(CCF)C(=O)O Amb33379286 [0,2,0,0,0,0|0,0,2]=4 3672 B8R0.15 COC(CCN)C(=O)O Amb26631814 [0,2,0,0,0,0|0,0,2]=4 3673 B8R0.15 COC(CCN)C(=O)O Amb32661022 [0,2,0,0,0,0|0,0,2]=4 3674 B8R0.15 COCC(CN)C(=O)O Amb27219429 [0,2,0,0,0,0|0,0,2]=4 3675 B8R0.15 COCC(OC)C(=O)O Amb26627988 [0,2,0,0,0,0|0,0,2]=4 3676 B8R0.15 COCC(SC)C(=O)O Amb28046503 [0,2,0,0,0,0|0,0,2]=4 3677 B8R0.15 CO\N=C(/C#N)C(=O)O Amb24470674 [0,2,0,0,0,0|1,0,1]=4 3678 B8R0.15 CSCC(CN)C(=O)O Amb33272062 [0,2,0,0,0,0|0,0,2]=4 3679 B8R0.15 C\C=C(/CCC)C(C)=O Amb27206702 [0,2,0,0,0,0|1,0,0]=3 3680 B8R0.15 C\C=C(/CCN)C(=O)O Amb27493438 [0,2,0,0,0,0|0,0,0]=2 3681 B8R0.15 C\C=C(/CNC)C(=O)O Amb27881689 [0,2,0,0,0,0|0,0,0]=2 3682 B8R0.15 C\C=C(/OCC)C(=O)O Amb18642768 [0,2,0,0,0,0|0,0,0]=2 3683 B8R0.15 C\C=C(\CNC)C(=O)O Amb27954442 [0,2,0,0,0,0|0,0,0]=2 3684 B8R0.15 C\C=C\[C@@H](CC)C(=O)O Amb28388676 [0,2,0,0,0,0|0,0,1]=3 3685 B8R0.15 C\C=N\[C@H](CO)C(=O)O Amb28423512 [0,2,0,0,0,0|0,0,1]=3 3686 B8R0.15 NCC(CCF)C(=O)O Amb33196465 [0,2,0,0,0,0|0,0,2]=4 3687 B8R0.15 NC\C=C(/CO)C(=O)O Amb27214653 [0,2,0,0,0,0|0,0,0]=2 3688 B8R0.15 O=C(O)C(CO)CCF Amb27876842 [0,2,0,0,0,0|0,0,2]=4 3689 B8R0.15 O=C(O)C(CS)CCS Amb27477377 [0,2,0,0,0,0|0,0,2]=4 3690 B8R0.15 O=C(O)[C@H](CS)NCO Amb27980938 [0,2,0,0,0,0|1,0,1]=4 3691 B8R0.15 O=C(O)\C(=C\CO)CO Amb27494197 [0,2,0,0,0,0|0,0,0]=2 3692 B8R0.15 O=CNC(CO)C(=O)O Amb18290435 [0,2,0,0,0,0|1,0,1]=4 3693 B8R0.15 O=CNC(CS)C(=O)O Amb20093366 [0,2,0,0,0,0|1,0,1]=4 3694 B8R0.15 O=CN[C@H](CO)C(=O)O Amb28248397 [0,2,0,0,0,0|1,0,1]=4 3695 B8R0.13 C=CC(C)(N)C(=O)OC Amb27393739 [0,2,0,0,0,0|0,0,2]=4 3696 B8R0.13 CCC(C)(Br)C(=O)OC Amb24643650 [0,2,0,0,0,0|0,0,2]=4 3697 B8R0.13 CCC(C)(C)C(=O)CO Amb27779511 [0,2,0,0,0,0|0,0,2]=4 3698 B8R0.13 CCC(C)(C)C(=O)OC Amb27399795 [0,2,0,0,0,0|0,0,2]=4 3699 B8R0.13 CCC(C)(Cl)C(=O)OC Amb25889480 [0,2,0,0,0,0|0,0,2]=4 3700 B8R0.13 CCC(C)(N)C(=O)NO Amb28285161 [0,2,0,0,0,0|0,0,2]=4 3701 B8R0.13 CCC(C)(N)C(=O)OC Amb18288973 [0,2,0,0,0,0|0,0,2]=4 3702 B8R0.13 CCC(C)(N)C(=O)OC Amb19514608 [0,2,0,0,0,0|0,0,2]=4 3703 B8R0.13 CCC(C)(O)C(=O)CO Amb26626775 [0,2,0,0,0,0|0,0,2]=4 3704 B8R0.13 CCC(C)(O)C(=O)OC Amb24116777 [0,2,0,0,0,0|0,0,2]=4 3705 B8R0.13 CC[C@@](C)(N)C(=O)OC Amb26505426 [0,2,0,0,0,0|0,0,2]=4 3706 B8R0.13 CC[C@](C)(N)C(=O)OC Amb19888376 [0,2,0,0,0,0|0,0,2]=4 3707 B8R0.13 CNC(C)(C)C(=O)OC Amb18523806 [0,2,0,0,0,0|1,0,1]=4 3708 B8R0.13 CNC(C)(C)C(=O)OC Amb22168216 [0,2,0,0,0,0|1,0,1]=4 3709 B8R0.13 COC(=O)C(C)(C)C=O Amb18642747 [0,2,0,0,0,0|1,0,1]=4 3710 B8R0.13 COC(=O)C(C)(C)OC Amb8455356 [0,2,0,0,0,0|1,0,1]=4 3711 B8R0.13 COC(=O)C(C)(O)OC Amb28133006 [0,2,0,0,0,0|1,0,1]=4 3712 B8R0.20 C=CC(SC)C(=O)OC Amb27196282 [0,2,0,0,0,0|0,0,2]=4 3713 B8R0.20 C=C[C@H](NC)C(=O)OC Amb27628533 [0,2,0,0,0,0|0,0,2]=4 3714 B8R0.20 CCC(C)\C(C=O)=C\O Amb27838676 [0,2,0,0,0,0|0,0,2]=4 3715 B8R0.20 CCC(C)\C(C=O)=N\O Amb28287725 [0,2,0,0,0,0|0,0,2]=4 3716 B8R0.20 CCC(CC)=C(C)C=O Amb18642443 [0,2,0,0,0,0|1,0,1]=4 3717 B8R0.20 CCC(CC)C(=O)NO Amb6263030 [0,2,0,0,0,0|0,0,2]=4 3718 B8R0.20 CCC(CC)C(=O)OC Amb4019616 [0,2,0,0,0,0|0,0,2]=4 3719 B8R0.20 CCC(CN)C(=O)OC Amb24698179 [0,2,0,0,0,0|0,0,2]=4 3720 B8R0.20 CCC(CN)C(=O)OC Amb28935005 [0,2,0,0,0,0|0,0,2]=4 3721 B8R0.20 CCC(CO)C(=O)OC Amb27750479 [0,2,0,0,0,0|0,0,2]=4 3722 B8R0.20 CCC(NC)C(=O)NO Amb35727246 [0,2,0,0,0,0|0,0,2]=4 3723 B8R0.20 CCC(NC)C(=O)OC Amb19516943 [0,2,0,0,0,0|0,0,2]=4 3724 B8R0.20 CCC(NC)C(=O)OC Amb33549577 [0,2,0,0,0,0|0,0,2]=4 3725 B8R0.20 CCC(OC)C(=O)NO Amb27665087 [0,2,0,0,0,0|0,0,2]=4 3726 B8R0.20 CCC(OC)C(=O)OC Amb8455373 [0,2,0,0,0,0|0,0,2]=4 3727 B8R0.20 CCC(SC)C(=O)NO Amb27614102 [0,2,0,0,0,0|0,0,2]=4 3728 B8R0.20 CCN(CC)C(=O)CO Amb1157486 [0,2,0,0,0,0|1,0,1]=4 3729 B8R0.20 CCN(CC)C(=O)NO Amb25874025 [0,2,0,0,0,0|1,0,1]=4 3730 B8R0.20 CCN(CCl)C(=O)OC Amb27243946 [0,2,0,0,0,0|1,0,1]=4 3731 B8R0.20 CC[C@@H](CN)C(=O)OC Amb25046723 [0,2,0,0,0,0|0,0,2]=4 3732 B8R0.20 CC[C@@H](CN)C(=O)OC Amb33482739 [0,2,0,0,0,0|0,0,2]=4 3733 B8R0.20 CC[C@@H](CO)C(=O)OC Amb27660097 [0,2,0,0,0,0|0,0,2]=4 3734 B8R0.20 CC[C@@H](NC)C(=O)OC Amb28057526 [0,2,0,0,0,0|0,0,2]=4 3735 B8R0.20 CC[C@H](C)\C(C=O)=C\O Amb27446671 [0,2,0,0,0,0|0,0,2]=4 3736 B8R0.20 CC[C@H](CN)C(=O)OC Amb25921089 [0,2,0,0,0,0|0,0,2]=4 3737 B8R0.20 CC[C@H](CN)C(=O)OC Amb33482740 [0,2,0,0,0,0|0,0,2]=4 3738 B8R0.20 CC[C@H](NC)C(=O)OC Amb26610759 [0,2,0,0,0,0|0,0,2]=4 3739 B8R0.20 CC[C@H](NC)C(=O)OC Amb33038477 [0,2,0,0,0,0|0,0,2]=4 3740 B8R0.20 CC\C(CO)=C(\C)OC Amb28315557 [0,2,0,0,0,0|1,0,1]=4 3741 B8R0.20 CNC(CCl)C(=O)OC Amb27463058 [0,2,0,0,0,0|1,0,1]=4 3742 B8R0.20 CNC(CN)C(=O)OC Amb27617811 [0,2,0,0,0,0|1,0,1]=4 3743 B8R0.20 CN[C@@H](CO)C(=O)OC Amb24116973 [0,2,0,0,0,0|1,0,1]=4 3744 B8R0.20 COC(=O)C(C=O)OC Amb27781038 [0,2,0,0,0,0|1,0,1]=4 3745 B8R0.20 COC(=O)C(C=O)SC Amb27424725 [0,2,0,0,0,0|1,0,1]=4 3746 B8R0.20 COC(=O)C(CN)OC Amb24440902 [0,2,0,0,0,0|1,0,1]=4 3747 B8R0.20 COC(=O)C(CN)OC Amb32661097 [0,2,0,0,0,0|1,0,1]=4 3748 B8R0.20 COC(=O)C(OC)OC Amb8516699 [0,2,0,0,0,0|1,0,1]=4 3749 B8R0.20 COC(=O)[C@@H](CN)OC Amb28364169 [0,2,0,0,0,0|1,0,1]=4 3750 B8R0.20 COC(=O)[C@H](CN)OC Amb28344815 [0,2,0,0,0,0|1,0,1]=4 3751 B8R0.20 COC(=O)[C@H](CN)OC Amb32679868 [0,2,0,0,0,0|1,0,1]=4 3752 B8R0.20 COC(=O)\C(=C/Cl)OC Amb27657671 [0,2,0,0,0,0|1,0,0]=3 3753 B8R0.20 COC(=O)\C(=C\Br)OC Amb27637710 [0,2,0,0,0,0|1,0,0]=3 3754 B8R0.20 COC(=O)\C(=C\O)OC Amb27406106 [0,2,0,0,0,0|1,0,0]=3 3755 B8R0.20 COC(=O)\C(=N\O)SC Amb24540911 [0,2,0,0,0,0|2,0,0]=4 3756 B8R0.20 COC(=O)\C(C#N)=C\Br Amb27640597 [0,2,0,0,0,0|1,0,1]=4 3757 B8R0.20 COC(=O)\C(C=O)=C\N Amb28129575 [0,2,0,0,0,0|1,0,1]=4 3758 B8R0.20 C\C=C(/C)C(CBr)OC Amb27483246 [0,2,0,0,0,0|1,0,1]=4 3759 B8R0.20 C\C=C(/C=O)C(=O)OC Amb27854939 [0,2,0,0,0,0|0,0,1]=3 3760 B8R0.20 C\C=C(/CBr)C(=O)OC Amb25328192 [0,2,0,0,0,0|0,0,0]=2 3761 B8R0.20 C\C=C(/CC)C(=N)NO Amb27843349 [0,2,0,0,0,0|1,0,0]=3 3762 B8R0.20 C\C=C(/CC)C(=O)NO Amb27653838 [0,2,0,0,0,0|0,0,0]=2 3763 B8R0.20 C\C=C(/CC)C(=S)NC Amb27423246 [0,2,0,0,0,0|1,1,0]=4 3764 B8R0.20 C\C=C(/CC)C(O)CN Amb27491795 [0,2,0,0,0,0|1,0,1]=4 3765 B8R0.20 C\C=C(/CC)C(O)CO Amb27660533 [0,2,0,0,0,0|0,0,2]=4 3766 B8R0.20 C\C=C(/OC)C(=O)CC Amb27180411 [0,2,0,0,0,0|1,0,0]=3 3767 B8R0.20 C\C=C(/OC)C(=O)OC Amb20668276 [0,2,0,0,0,0|0,0,0]=2 3768 B8R0.20 C\C=C(/SC)C(O)CC Amb27761616 [0,2,0,0,0,0|1,0,1]=4 3769 B8R0.20 C\C=C(\OC)C(=O)C#N Amb28202108 [0,2,0,0,0,0|1,0,0]=3 3770 B8R0.20 C\C=C(\OC)C(=O)OC Amb24532128 [0,2,0,0,0,0|0,0,0]=2 3771 B8R0.36 C=CC(C)(C#N)C(=O)O Amb27409887 [0,2,0,0,0,0|0,0,2]=4 3772 B8R0.36 C=CC(C)(CC)C(=O)O Amb26346491 [0,2,0,0,0,0|0,0,2]=4 3773 B8R0.36 C=CC(N)(CO)C(=O)O Amb18642831 [0,2,0,0,0,0|0,0,2]=4 3774 B8R0.36 C=C[C@@](N)(CC)C(=O)O Amb27814518 [0,2,0,0,0,0|0,0,2]=4 3775 B8R0.36 C=C[C@](C)(CC)C(=O)O Amb27971483 [0,2,0,0,0,0|0,0,2]=4 3776 B8R0.36 C=C[C@](N)(CC)C(=O)O Amb27462806 [0,2,0,0,0,0|0,0,2]=4 3777 B8R0.36 CCC(Br)(CC)C(=O)O Amb18127183 [0,2,0,0,0,0|0,0,2]=4 3778 B8R0.36 CCC(C)(C#N)C(=O)O Amb33544489 [0,2,0,0,0,0|0,0,2]=4 3779 B8R0.36 CCC(C)(CBr)C(=O)O Amb27954835 [0,2,0,0,0,0|0,0,2]=4 3780 B8R0.36 CCC(C)(CC)C(=O)O Amb16232089 [0,2,0,0,0,0|0,0,2]=4 3781 B8R0.36 CCC(C)(CN)C(=O)O Amb22157184 [0,2,0,0,0,0|0,0,2]=4 3782 B8R0.36 CCC(C)(CO)C(=O)O Amb25367931 [0,2,0,0,0,0|0,0,2]=4 3783 B8R0.36 CCC(C)(CS)C(=O)O Amb27945586 [0,2,0,0,0,0|0,0,2]=4 3784 B8R0.36 CCC(C)(C[NH3+])C(=O)O Amb28555365 [0,2,0,0,0,0|0,0,2]=4 3785 B8R0.36 CCC(C)(OC)C(=O)O Amb8455321 [0,2,0,0,0,0|0,0,2]=4 3786 B8R0.36 CCC(F)(CC)C(=O)O Amb24120633 [0,2,0,0,0,0|0,0,2]=4 3787 B8R0.36 CCC(N)(CC)C(=O)O Amb33550775 [0,2,0,0,0,0|0,0,2]=4 3788 B8R0.36 CCC(N)(CC)C(=O)O Amb4134829 [0,2,0,0,0,0|0,0,2]=4 3789 B8R0.36 CCC(N)(CN)C(=O)O Amb27875677 [0,2,0,0,0,0|0,0,2]=4 3790 B8R0.36 CCC(O)(CC)C(=O)O Amb8513562 [0,2,0,0,0,0|0,0,2]=4 3791 B8R0.36 CCC(O)(CCl)C(=O)O Amb27801584 [0,2,0,0,0,0|0,0,2]=4 3792 B8R0.36 CCC(O)(SC)C(=O)O Amb27262602 [0,2,0,0,0,0|0,0,2]=4 3793 B8R0.36 CC[C@](C)(C#N)C(=O)O Amb28187166 [0,2,0,0,0,0|0,0,2]=4 3794 B8R0.36 CC[C@](N)(CS)C(=O)O Amb27778924 [0,2,0,0,0,0|0,0,2]=4 3795 B8R0.36 CC[C@](O)(CBr)C(=O)O Amb27955829 [0,2,0,0,0,0|0,0,2]=4 3796 B8R0.36 CNC(C)(CO)C(=O)O Amb27165182 [0,2,0,0,0,0|1,0,1]=4 3797 B8R0.36 CSC(C)(CN)C(=O)O Amb27210830 [0,2,0,0,0,0|1,0,1]=4 3798 B8R0.36 CSC(C)(CS)C(=O)O Amb27865545 [0,2,0,0,0,0|1,0,1]=4 3799 B8R0.36 CSC(C)(SC)C(=O)O Amb27984802 [0,2,0,0,0,0|1,0,1]=4 3800 B8R0.37 C=C(Br)C(C)(C)C(=O)O Amb17595054 [0,2,0,0,0,0|0,0,2]=4 3801 B8R0.37 C=C(C)C(C)(C)C(=O)O Amb15701602 [0,2,0,0,0,0|0,0,1]=3 3802 B8R0.37 C=C(Cl)C(C)(C)C(=O)O Amb17613253 [0,2,0,0,0,0|0,0,2]=4 3803 B8R0.37 CC(=O)C(C)(C)C(=O)O Amb18642784 [0,2,0,0,0,0|0,0,1]=3 3804 B8R0.37 CC(=O)C(C)(C)C(C)=O Amb17593343 [0,2,0,0,0,0|1,0,1]=4 3805 B8R0.37 CC(=O)C(C)(C)C(N)=O Amb28143775 [0,2,0,0,0,0|1,0,1]=4 3806 B8R0.37 CC(=O)C(C)(Cl)C(C)=O Amb27227021 [0,2,0,0,0,0|1,0,1]=4 3807 B8R0.37 CC(=O)C(C)(F)C(C)=O Amb27607073 [0,2,0,0,0,0|1,0,1]=4 3808 B8R0.37 CC(=O)C(C)(O)C(=O)Cl Amb27227227 [0,2,0,0,0,0|1,0,1]=4 3809 B8R0.37 CC(=O)C(C)(O)C(=O)O Amb18642870 [0,2,0,0,0,0|0,0,1]=3 3810 B8R0.37 CC(Br)C(C)(Br)C(=O)O Amb2612513 [0,2,0,0,0,0|0,0,2]=4 3811 B8R0.37 CC(C)(C(=O)O)C(=O)Cl Amb17593749 [0,2,0,0,0,0|1,0,1]=4 3812 B8R0.37 CC(C)(C(=O)O)C(=O)O Amb2613653 [0,2,0,0,0,0|1,0,1]=4 3813 B8R0.37 CC(C)(C(=O)O)C(N)=S Amb17465757 [0,2,0,0,0,0|1,0,1]=4 3814 B8R0.37 CC(C)(C(N)=O)C(=O)O Amb8386802 [0,2,0,0,0,0|1,0,1]=4 3815 B8R0.37 CC(C)C(C)(C)C(=O)O Amb17593377 [0,2,0,0,0,0|0,0,2]=4 3816 B8R0.37 CC(C)C(C)(N)C(=O)O Amb4134845 [0,2,0,0,0,0|0,0,2]=4 3817 B8R0.37 CC(C)C(C)(O)C(=O)O Amb18286212 [0,2,0,0,0,0|0,0,2]=4 3818 B8R0.37 CC(C)[C@@](C)(N)C(=O)O Amb16183901 [0,2,0,0,0,0|0,0,2]=4 3819 B8R0.37 CC(C)[C@](C)(N)C(=O)O Amb10603127 [0,2,0,0,0,0|0,0,2]=4 3820 B8R0.37 CC(C)[C@](C)(O)C(=O)O Amb16231522 [0,2,0,0,0,0|0,0,2]=4 3821 B8R0.37 CC(Cl)C(C)(O)C(=O)O Amb27243989 [0,2,0,0,0,0|0,0,2]=4 3822 B8R0.37 CC(N)(C(=O)O)C(=O)O Amb28347069 [0,2,0,0,0,0|1,0,1]=4 3823 B8R0.37 CC(N)(C(N)=O)C(=O)O Amb27593792 [0,2,0,0,0,0|1,0,1]=4 3824 B8R0.37 CC(N)C(C)(C)C(=O)O Amb24681858 [0,2,0,0,0,0|0,0,2]=4 3825 B8R0.37 CC(O)C(C)(C)C(=O)O Amb18961474 [0,2,0,0,0,0|0,0,2]=4 3826 B8R0.37 CC(O)C(C)(N)C(=O)O Amb2780038 [0,2,0,0,0,0|0,0,2]=4 3827 B8R0.37 CC(O)C(C)(N)C(=O)O Amb30585196 [0,2,0,0,0,0|0,0,2]=4 3828 B8R0.37 CC(O)C(C)(O)C(=O)O Amb18124401 [0,2,0,0,0,0|0,0,2]=4 3829 B8R0.37 CN(C)C(C)(C)C(=O)O Amb33550826 [0,2,0,0,0,0|1,0,1]=4 3830 B8R0.37 CN(C)C(C)(C)C(=O)O Amb3976483 [0,2,0,0,0,0|1,0,1]=4 3831 B8R0.37 CN(Cl)C(C)(C)C(=O)O Amb28137981 [0,2,0,0,0,0|1,0,1]=4 3832 B8R0.37 C[C@@H](F)[C@@](C)(N)C(=O)O Amb26917123 [0,2,0,0,0,0|0,0,2]=4 3833 B8R0.37 C[C@@H](O)[C@@](C)(N)C(=O)O Amb26458741 [0,2,0,0,0,0|0,0,2]=4 3834 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O Amb27776914 [0,2,0,0,0,0|0,0,2]=4 3835 B8R0.37 C[C@H](O)[C@@](C)(N)C(=O)O Amb22232016 [0,2,0,0,0,0|0,0,2]=4 3836 B8R0.37 C[C@H](O)[C@](C)(N)C(=O)O Amb26390846 [0,2,0,0,0,0|0,0,2]=4 3837 B8R0.37 C[C@H](O)[C@](C)(O)C(=O)O Amb27974163 [0,2,0,0,0,0|0,0,2]=4 3838 B8R0.27 C=C(C(=O)O)C(C)(C)C Amb18642653 [0,2,0,0,0,0|0,0,2]=4 3839 B8R0.27 C=C(C(=O)O)C(C)(C)F Amb33271858 [0,2,0,0,0,0|0,0,2]=4 3840 B8R0.27 C=C(C(=O)O)C(C)(F)F Amb32810180 [0,2,0,0,0,0|0,0,2]=4 3841 B8R0.27 CC(=O)C(C)S(=O)(=O)O Amb28253583 [0,2,0,0,0,0|1,0,1]=4 3842 B8R0.27 CC(C(=O)O)C(C)(C)C Amb4477144 [0,2,0,0,0,0|0,0,2]=4 3843 B8R0.27 CC(C(=O)O)C(C)(C)F Amb10843986 [0,2,0,0,0,0|0,0,2]=4 3844 B8R0.27 CC(C(=O)O)C(C)(C)N Amb24459511 [0,2,0,0,0,0|0,0,2]=4 3845 B8R0.27 CC(C(=O)O)C(C)(C)O Amb10844263 [0,2,0,0,0,0|0,0,2]=4 3846 B8R0.27 CC(C(=O)O)C(C)(F)F Amb27626900 [0,2,0,0,0,0|0,0,2]=4 3847 B8R0.27 CC(C(=O)O)S(C)(=O)=O Amb6260939 [0,2,0,0,0,0|1,0,1]=4 3848 B8R0.27 CC(C(=O)O)[Si](C)(C)C Amb27945584 [0,2,0,0,0,0|0,1,1]=4 3849 B8R0.27 CC(C)(C)C(=O)C(=O)O Amb8384135 [0,2,0,0,0,0|1,0,1]=4 3850 B8R0.27 CC(C)(F)C(=O)C(=O)O Amb25079631 [0,2,0,0,0,0|1,0,1]=4 3851 B8R0.27 CC(C)=C(F)P(=O)(O)O Amb28132465 [0,2,0,0,0,0|2,0,0]=4 3852 B8R0.27 CC(F)(F)C(=O)C(=O)O Amb25997735 [0,2,0,0,0,0|1,0,1]=4 3853 B8R0.27 C[C@@H](C(=O)O)C(C)(C)C Amb10844023 [0,2,0,0,0,0|0,0,2]=4 3854 B8R0.27 C[C@@H](C(=O)O)C(C)(C)Cl Amb28399702 [0,2,0,0,0,0|0,0,2]=4 3855 B8R0.27 C[C@@H](C(=O)O)C(C)(C)O Amb10844262 [0,2,0,0,0,0|0,0,2]=4 3856 B8R0.27 C[C@@H](C(=O)O)C(C)(F)F Amb33728209 [0,2,0,0,0,0|0,0,2]=4 3857 B8R0.27 C[C@@H](C(=O)O)S(C)(=O)=O Amb27776748 [0,2,0,0,0,0|1,0,1]=4 3858 B8R0.27 C[C@H](C(=O)O)C(C)(C)C Amb10844034 [0,2,0,0,0,0|0,0,2]=4 3859 B8R0.27 C[C@H](C(=O)O)C(C)(F)F Amb33749542 [0,2,0,0,0,0|0,0,2]=4 3860 B8R0.18 C=C(C)C(CC)C(=O)O Amb18642606 [0,2,0,0,0,0|0,0,1]=3 3861 B8R0.18 C=C(C)C(CCl)=C(C)C Amb27173025 [0,2,0,0,0,0|2,0,0]=4 3862 B8R0.18 C=C(C)C(CN)C(=O)O Amb33199955 [0,2,0,0,0,0|0,0,1]=3 3863 B8R0.18 C=C(C)C(OC)C(=O)O Amb27219440 [0,2,0,0,0,0|0,0,1]=3 3864 B8R0.18 C=C(C)\C(=N/O)C(C)=O Amb27187180 [0,2,0,0,0,0|2,0,0]=4 3865 B8R0.18 C=CC(C(=O)O)=C(C)C Amb27170334 [0,2,0,0,0,0|0,0,1]=3 3866 B8R0.18 C=CC(C(=O)O)N(C)C Amb27757609 [0,2,0,0,0,0|0,0,2]=4 3867 B8R0.18 CC(=O)C(=CN)C(C)=O Amb2386494 [0,2,0,0,0,0|1,0,1]=4 3868 B8R0.18 CC(=O)C(=NN)C(C)=O Amb27257056 [0,2,0,0,0,0|2,0,0]=4 3869 B8R0.18 CC(=O)C(=NO)C(C)=O Amb1145803 [0,2,0,0,0,0|2,0,0]=4 3870 B8R0.18 CC(=O)C(CN)C(C)=O Amb28411438 [0,2,0,0,0,0|1,0,1]=4 3871 B8R0.18 CC(=O)\C(=C\N)C(N)=O Amb28072959 [0,2,0,0,0,0|1,0,1]=4 3872 B8R0.18 CC(=O)\C(=N\N)C(N)=O Amb27662582 [0,2,0,0,0,0|2,0,0]=4 3873 B8R0.18 CC(=O)\C(=N\O)C(N)=O Amb27484394 [0,2,0,0,0,0|2,0,0]=4 3874 B8R0.18 CC(=O)\C(C#N)=C(/C)Cl Amb27802802 [0,2,0,0,0,0|1,0,1]=4 3875 B8R0.18 CC(=O)\C(C#N)=C(/C)N Amb27156265 [0,2,0,0,0,0|1,0,1]=4 3876 B8R0.18 CC(=O)\C(C#N)=C(/C)O Amb28194592 [0,2,0,0,0,0|1,0,1]=4 3877 B8R0.18 CC(=O)\C(C=N)=C(/C)O Amb27838703 [0,2,0,0,0,0|1,0,1]=4 3878 B8R0.18 CC(C)=C(C#N)C(=O)O Amb3986874 [0,2,0,0,0,0|0,0,1]=3 3879 B8R0.18 CC(C)=C(CN)C(=O)O Amb28368080 [0,2,0,0,0,0|0,0,0]=2 3880 B8R0.18 CC(C)C(CF)C(=O)O Amb26965957 [0,2,0,0,0,0|0,0,2]=4 3881 B8R0.18 CC(C)C(CN)C(=O)O Amb18987935 [0,2,0,0,0,0|0,0,2]=4 3882 B8R0.18 CC(C)C(CN)C(=O)O Amb19375052 [0,2,0,0,0,0|0,0,2]=4 3883 B8R0.18 CC(C)C(CO)C(=O)O Amb24116921 [0,2,0,0,0,0|0,0,2]=4 3884 B8R0.18 CC(C)C(CS)C(=O)O Amb17593703 [0,2,0,0,0,0|0,0,2]=4 3885 B8R0.18 CC(C)[C@@H](CN)C(=O)O Amb22756745 [0,2,0,0,0,0|0,0,2]=4 3886 B8R0.18 CC(C)[C@@H](CN)C(=O)O Amb22756747 [0,2,0,0,0,0|0,0,2]=4 3887 B8R0.18 CC(C)[C@H](CN)C(=O)O Amb25283442 [0,2,0,0,0,0|0,0,2]=4 3888 B8R0.18 CC(C)[C@H](CN)C(=O)O Amb32620230 [0,2,0,0,0,0|0,0,2]=4 3889 B8R0.18 CC(C)[C@H](CO)C(=O)O Amb27249807 [0,2,0,0,0,0|0,0,2]=4 3890 B8R0.18 CC=C(C(=O)O)C(=O)O Amb27439270 [0,2,0,0,0,0|0,0,1]=3 3891 B8R0.18 CCC(C(=O)O)C(=O)O Amb6297197 [0,2,0,0,0,0|1,0,1]=4 3892 B8R0.18 CCC(C(=O)O)C(C)C Amb18972345 [0,2,0,0,0,0|0,0,2]=4 3893 B8R0.18 CCC(C(=O)O)C(C)O Amb18990651 [0,2,0,0,0,0|0,0,2]=4 3894 B8R0.18 CCC(C(=O)O)C(F)F Amb33337288 [0,2,0,0,0,0|0,0,2]=4 3895 B8R0.18 CCC(C(=O)O)N(C)C Amb33551144 [0,2,0,0,0,0|0,0,2]=4 3896 B8R0.18 CCC(C(=O)O)N(C)C Amb8455277 [0,2,0,0,0,0|0,0,2]=4 3897 B8R0.18 CCC(C(=O)O)N(C)N Amb25145584 [0,2,0,0,0,0|0,0,2]=4 3898 B8R0.18 CCC(C(=O)O)S(C)=O Amb18290930 [0,2,0,0,0,0|0,0,2]=4 3899 B8R0.18 CCC(C(C)=O)=C(C)C Amb27802654 [0,2,0,0,0,0|1,0,0]=3 3900 B8R0.18 CCC(C(C)=O)C(C)=O Amb2371444 [0,2,0,0,0,0|1,0,1]=4 3901 B8R0.18 CCC(C(N)=O)C(=O)O Amb28410332 [0,2,0,0,0,0|1,0,1]=4 3902 B8R0.18 CC[C@@H](C(=O)O)N(C)C Amb25823446 [0,2,0,0,0,0|0,0,2]=4 3903 B8R0.18 CC[C@@H](C(=O)O)[C@@H](C)O Amb28410568 [0,2,0,0,0,0|0,0,2]=4 3904 B8R0.18 CC[C@H](C(=O)O)N(C)C Amb32668789 [0,2,0,0,0,0|0,0,2]=4 3905 B8R0.18 CC[C@H](C(=O)O)[C@H](C)O Amb27655638 [0,2,0,0,0,0|0,0,2]=4 3906 B8R0.18 CC\C(C(C)=O)=C(/C)N Amb27816951 [0,2,0,0,0,0|1,0,0]=3 3907 B8R0.18 CC\C(C(C)=O)=C(\C)N Amb28346740 [0,2,0,0,0,0|1,0,0]=3 3908 B8R0.18 CN(C)C(CN)C(=O)O Amb26350112 [0,2,0,0,0,0|1,0,1]=4 3909 B8R0.18 CN(C)C(CO)C(=O)O Amb24407402 [0,2,0,0,0,0|1,0,1]=4 3910 B8R0.18 CN(C)[C@@H](CO)C(=O)O Amb27397686 [0,2,0,0,0,0|1,0,1]=4 3911 B8R0.18 CNC(C(=O)O)C(C)C Amb21961623 [0,2,0,0,0,0|0,0,2]=4 3912 B8R0.18 CNC(C(=O)O)C(C)C Amb4035989 [0,2,0,0,0,0|0,0,2]=4 3913 B8R0.18 CNC(C(=O)O)C(C)F Amb27596009 [0,2,0,0,0,0|0,0,2]=4 3914 B8R0.18 CN[C@@H](C(=O)O)C(C)C Amb22231334 [0,2,0,0,0,0|0,0,2]=4 3915 B8R0.18 CN[C@@H](C(=O)O)C(C)C Amb22749002 [0,2,0,0,0,0|0,0,2]=4 3916 B8R0.18 CN[C@@H](C(=O)O)C(C)O Amb22800385 [0,2,0,0,0,0|0,0,2]=4 3917 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,2,0,0,0,0|0,0,2]=4 3918 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb33812559 [0,2,0,0,0,0|0,0,2]=4 3919 B8R0.18 CN[C@H](C(=O)O)C(C)O Amb27446656 [0,2,0,0,0,0|0,0,2]=4 3920 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O Amb25887203 [0,2,0,0,0,0|0,0,2]=4 3921 B8R0.18 COC(C(=O)O)C(=O)O Amb27396318 [0,2,0,0,0,0|1,0,1]=4 3922 B8R0.18 COC(C(=O)O)C(C)C Amb33532796 [0,2,0,0,0,0|0,0,2]=4 3923 B8R0.18 COC(C(=O)O)C(C)O Amb26003623 [0,2,0,0,0,0|0,0,2]=4 3924 B8R0.18 COC(C(C)=O)C(C)=O Amb25913550 [0,2,0,0,0,0|1,0,1]=4 3925 B8R0.18 CON(C(C)=O)C(C)=O Amb22231327 [0,2,0,0,0,0|2,0,0]=4 3926 B8R0.18 CO[C@H](C(=O)O)C(C)C Amb27966715 [0,2,0,0,0,0|0,0,2]=4 3927 B8R0.18 CSC(C(=O)O)C(=O)O Amb27407760 [0,2,0,0,0,0|1,0,1]=4 3928 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,2,0,0,0,0|0,0,2]=4 3929 B8R0.18 C\C(N)=C(/C#N)C(=O)Cl Amb28068677 [0,2,0,0,0,0|1,0,1]=4 3930 B8R0.18 C\C(N)=C(\C#N)C(=O)O Amb13951423 [0,2,0,0,0,0|0,0,1]=3 3931 B8R0.18 C\C(N)=C(\C#N)C(N)=O Amb27630699 [0,2,0,0,0,0|1,0,1]=4 3932 B8R0.18 C\C(O)=C(\C#N)C(=O)O Amb27444896 [0,2,0,0,0,0|0,0,1]=3 3933 B8R0.18 C\C(O)=C(\C#N)C(N)=O Amb27460895 [0,2,0,0,0,0|1,0,1]=4 3934 B8R0.18 C\C=C(\C(N)=O)C(C)C Amb27647773 [0,2,0,0,0,0|1,0,0]=3 3935 B8R0.18 N#C\C(C(=O)O)=C(\N)Cl Amb27485933 [0,2,0,0,0,0|1,0,1]=4 3936 B8R0.18 NC=C(C(=O)O)C(=O)O Amb27236633 [0,2,0,0,0,0|1,0,1]=4 3937 B8R0.18 NCC(C(=O)O)C(=O)O Amb27408219 [0,2,0,0,0,0|1,0,1]=4 3938 B8R0.18 O=C(O)C(=CBr)C(=O)O Amb9825194 [0,2,0,0,0,0|1,0,1]=4 3939 B8R0.18 O=C(O)C(CO)C(=O)O Amb27849072 [0,2,0,0,0,0|1,0,1]=4 3940 B6R1.2 Bc1ccco1 Amb28286917 [1,0,0,1,0,0|1,0,1]=4 3941 B6R1.2 BrC1=CCCO1 Amb24322605 [1,0,0,1,0,0|1,0,1]=4 3942 B6R1.2 Brc1ccco1 Amb2723041 [1,0,0,1,0,0|1,0,1]=4 3943 B6R1.2 Brc1ccno1 Amb20242149 [1,0,0,1,0,0|2,0,0]=4 3944 B6R1.2 CC1=CCCO1 Amb20621083 [1,0,0,1,0,0|1,0,1]=4 3945 B6R1.2 Cc1ccco1 Amb2447070 [1,0,0,1,0,0|1,0,1]=4 3946 B6R1.2 Cc1ccno1 Amb33544333 [1,0,0,1,0,0|2,0,0]=4 3947 B6R1.2 ClC1=CCC=C1 Amb22584067 [1,0,0,1,0,0|2,0,0]=4 3948 B6R1.2 Clc1ccco1 Amb27805575 [1,0,0,1,0,0|1,0,1]=4 3949 B6R1.2 Fc1ccco1 Amb27470402 [1,0,0,1,0,0|1,0,1]=4 3950 B6R1.2 IC1=CCCO1 Amb24322816 [1,0,0,1,0,0|1,0,1]=4 3951 B6R1.2 Ic1ccco1 Amb17672748 [1,0,0,1,0,0|1,0,1]=4 3952 B6R1.2 NC1=NCC=C1 Amb25208790 [1,0,0,1,0,0|2,0,0]=4 3953 B6R1.2 Nc1ccco1 Amb18203215 [1,0,0,1,0,0|1,0,1]=4 3954 B6R1.2 Nc1ccno1 Amb33528297 [1,0,0,1,0,0|2,0,0]=4 3955 B6R1.2 O=C1C=CCC1 Amb4019519 [1,0,0,1,0,0|1,0,0]=3 3956 B6R1.2 O=C1C=CCN1 Amb20241082 [1,0,0,1,0,0|1,0,0]=3 3957 B6R1.2 O=C1C=CCO1 Amb2792769 [1,0,0,1,0,0|0,0,0]=2 3958 B6R1.2 O=C1C=CCS1 Amb22336458 [1,0,0,1,0,0|0,1,0]=3 3959 B6R1.2 O=C1C=CN=N1 Amb22230022 [1,0,0,1,0,0|2,0,0]=4 3960 B6R1.2 O=C1C=CNN1 Amb19958916 [1,0,0,1,0,0|2,0,0]=4 3961 B6R1.2 O=C1C=COC1 Amb24107591 [1,0,0,1,0,0|2,0,0]=4 3962 B6R1.2 O=C1C=CSN1 Amb19895016 [1,0,0,1,0,0|2,0,0]=4 3963 B6R1.2 O=C1C=CSS1 Amb27421370 [1,0,0,1,0,0|1,1,0]=4 3964 B6R1.2 O=C1C=NCN1 Amb26572891 [1,0,0,1,0,0|2,0,0]=4 3965 B6R1.2 O=C1C=NCO1 Amb25786221 [1,0,0,1,0,0|1,0,0]=3 3966 B6R1.2 O=C1CC=NO1 Amb27654112 [1,0,0,1,0,0|1,0,1]=4 3967 B6R1.2 O=C1CCCO1 Amb3940401 [1,0,0,1,0,0|0,0,2]=4 3968 B6R1.2 O=C1NC=CO1 Amb20671008 [1,0,0,1,0,0|1,0,1]=4 3969 B6R1.2 O=C1NCCO1 Amb6608807 [1,0,0,1,0,0|1,0,1]=4 3970 B6R1.2 O=C1OC=CO1 Amb20239430 [1,0,0,1,0,0|1,0,1]=4 3971 B6R1.2 O=C1OCCO1 Amb4057710 [1,0,0,1,0,0|1,0,1]=4 3972 B6R1.2 O=C1OCCS1 Amb27398683 [1,0,0,1,0,0|1,0,1]=4 3973 B6R1.2 OC1C=CCC1 Amb33546881 [1,0,0,1,0,0|1,0,1]=4 3974 B6R1.2 O[C@H]1C=CCC1 Amb28133982 [1,0,0,1,0,0|1,0,1]=4 3975 B6R1.2 Oc1ccco1 Amb25991417 [1,0,0,1,0,0|0,0,2]=4 3976 B6R1.2 Oc1cccs1 Amb17201836 [1,0,0,1,0,0|0,1,1]=4 3977 B6R1.2 Oc1ccon1 Amb33547602 [1,0,0,1,0,0|2,0,0]=4 3978 B6R1.2 Oc1ccsc1 Amb16231253 [1,0,0,1,0,0|2,0,0]=4 3979 B6R1.2 Oc1ccsn1 Amb22371253 [1,0,0,1,0,0|2,0,0]=4 3980 B6R1.2 S=C1C=CCO1 Amb27971151 [1,0,0,1,0,0|0,1,0]=3 3981 B6R1.2 Sc1ccco1 Amb26641519 [1,0,0,1,0,0|0,1,1]=4 3982 B6R1.3 C\C=C\C1CO1 Amb25146414 [1,0,0,1,0,0|1,0,1]=4 3983 B6R1.5 CC1=CC(=O)C1 Amb27451158 [1,0,0,1,0,0|1,0,0]=3 3984 B6R1.5 CC1CC(=O)O1 Amb13777279 [1,0,0,1,0,0|0,0,2]=4 3985 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [1,0,0,1,0,0|0,0,2]=4 3986 B6R1.8 CCC1=CC1=O Amb28284229 [1,0,0,1,0,0|1,0,1]=4 3987 B6R1.9 CC1=CS1(=O)=O Amb28069213 [1,0,0,1,0,0|1,0,1]=4 3988 B6R1.10 O=S1(=O)C=CC1 Amb15693055 [1,0,0,1,0,0|1,0,1]=4 3989 B6R1.11 O=C(O)C1C=C1 Amb27185565 [1,0,0,1,0,0|0,0,2]=4 3990 B6R1.11 O=C(O)C1CC1 Amb2686655 [1,0,0,1,0,0|0,0,2]=4 3991 B6R1.11 O=C(O)C1CN1 Amb21864773 [1,0,0,1,0,0|1,0,1]=4 3992 B6R1.11 O=C(O)C1CO1 Amb8395277 [1,0,0,1,0,0|1,0,1]=4 3993 B6R1.11 O=C(O)[C@@H]1CN1 Amb22745452 [1,0,0,1,0,0|1,0,1]=4 3994 B6R1.11 O=C(O)[C@@H]1CO1 Amb26994292 [1,0,0,1,0,0|1,0,1]=4 3995 B6R1.11 O=C(O)[C@@H]1CS1 Amb28396934 [1,0,0,1,0,0|1,0,1]=4 3996 B6R1.11 O=C(O)[C@H]1CS1 Amb27845518 [1,0,0,1,0,0|1,0,1]=4 3997 B6R1.4 CC1CCC1=O Amb17593022 [1,0,0,1,0,0|0,0,2]=4 3998 B6R1.4 CC1OCC1=O Amb23456088 [1,0,0,1,0,0|1,0,1]=4 3999 B6R1.4 O=C1C=CC1=O Amb22731249 [1,0,0,1,0,0|1,0,1]=4 4000 B6R1.4 O=C1CCC1=O Amb4036402 [1,0,0,1,0,0|1,0,1]=4 4001 B6R1.4 O=C1CNC1=O Amb27973276 [1,0,0,1,0,0|2,0,0]=4 4002 B6R1.6 BrC=C1COC1 Amb33483065 [1,0,0,1,0,0|1,0,1]=4 4003 B6R1.6 CC=C1CCC1 Amb27960500 [1,0,0,1,0,0|1,0,1]=4 4004 B6R1.6 ClCC1=CCC1 Amb27815042 [1,0,0,1,0,0|1,0,1]=4 4005 B6R1.6 O=CC1CCC1 Amb8009552 [1,0,0,1,0,0|0,0,2]=4 4006 B6R1.6 O=CC1CCN1 Amb25757222 [1,0,0,1,0,0|1,0,1]=4 4007 B6R1.6 O=CC1CCS1 Amb27644631 [1,0,0,1,0,0|1,0,1]=4 4008 B6R1.6 ON=C1CCC1 Amb2782887 [1,0,0,1,0,0|1,0,1]=4 4009 B6R1.7 CC1(C=O)CC1 Amb8010172 [1,0,0,1,0,0|0,0,2]=4 4010 B6R1.7 CC1(C=O)CO1 Amb28400192 [1,0,0,1,0,0|1,0,1]=4 4011 B6R1.12 CC1=C(Br)C1C Amb28383475 [1,0,0,1,0,0|1,0,1]=4 4012 B6R1.12 CC1=C(C)C1=O Amb28285879 [1,0,0,1,0,0|0,0,0]=2 4013 B8R1.1 C=C1C=C(OC)CO1 Amb28135014 [0,0,0,1,0,1|2,0,0]=4 4014 B8R1.1 C=CC1=CC(=O)CC1 Amb28455401 [0,0,0,1,0,1|1,0,1]=4 4015 B8R1.1 C=CC1COC(=O)C1 Amb22232189 [0,0,0,1,0,1|0,0,2]=4 4016 B8R1.1 C=CC1COC(=O)O1 Amb17942789 [0,0,0,1,0,1|0,0,2]=4 4017 B8R1.1 C=C[C@@H]1COC(=O)C1 Amb22232075 [0,0,0,1,0,1|0,0,2]=4 4018 B8R1.1 C=C[C@@H]1COC(=O)N1 Amb27461297 [0,0,0,1,0,1|0,0,2]=4 4019 B8R1.1 C=C[C@@H]1COC(=O)O1 Amb25946828 [0,0,0,1,0,1|0,0,2]=4 4020 B8R1.1 C=C[C@H]1COC(=O)C1 Amb22232080 [0,0,0,1,0,1|0,0,2]=4 4021 B8R1.1 C=C[C@H]1COC(=O)N1 Amb27174193 [0,0,0,1,0,1|0,0,2]=4 4022 B8R1.1 C=C[C@H]1COC(=O)O1 Amb26588639 [0,0,0,1,0,1|0,0,2]=4 4023 B8R1.1 CCC1=CC(=O)CC1 Amb25889297 [0,0,0,1,0,1|1,0,1]=4 4024 B8R1.1 CCC1=NOC(=O)C1 Amb26614539 [0,0,0,1,0,1|1,0,1]=4 4025 B8R1.1 CCC1COC(=O)C1 Amb27854064 [0,0,0,1,0,1|0,0,2]=4 4026 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,0,0,1,0,1|0,0,2]=4 4027 B8R1.1 CCC1COC(=O)O1 Amb2721339 [0,0,0,1,0,1|0,0,2]=4 4028 B8R1.1 CC[C@H]1COC(=O)N1 Amb27411564 [0,0,0,1,0,1|0,0,2]=4 4029 B8R1.1 CNC1=CC(=O)OC1 Amb27168193 [0,0,0,1,0,1|1,0,0]=3 4030 B8R1.1 CNC1COC(=O)C1 Amb26505382 [0,0,0,1,0,1|1,0,1]=4 4031 B8R1.1 COC1=CC(=O)CC1 Amb21864758 [0,0,0,1,0,1|2,0,0]=4 4032 B8R1.1 COC1=CC(=O)NC1 Amb33544946 [0,0,0,1,0,1|2,0,0]=4 4033 B8R1.1 COC1=CC(=O)OC1 Amb6366827 [0,0,0,1,0,1|1,0,0]=3 4034 B8R1.1 COC1=CC(=O)SC1 Amb28043936 [0,0,0,1,0,1|1,1,0]=4 4035 B8R1.1 COC1COC(=O)N1 Amb24372259 [0,0,0,1,0,1|1,0,1]=4 4036 B8R1.1 CSC1=COC(=O)N1 Amb27872292 [0,0,0,1,0,1|1,0,1]=4 4037 B8R1.1 CSC1=NC(=O)NC1 Amb27770345 [0,0,0,1,0,1|2,0,0]=4 4038 B8R1.1 CSC1COC(=O)O1 Amb27395888 [0,0,0,1,0,1|1,0,1]=4 4039 B8R1.1 C\C=C1/C=CC(=O)S1 Amb27638992 [0,0,0,1,0,1|1,0,1]=4 4040 B8R1.1 C\C=C1\CCC(=O)O1 Amb27421031 [0,0,0,1,0,1|1,0,0]=3 4041 B8R1.1 C\N=C1/CCC(=O)N1 Amb26457426 [0,0,0,1,0,1|2,0,0]=4 4042 B8R1.1 O=C1C=C(CBr)CO1 Amb17935686 [0,0,0,1,0,1|1,0,1]=4 4043 B8R1.1 O=C1C=C(CCl)CO1 Amb24481317 [0,0,0,1,0,1|1,0,1]=4 4044 B8R1.1 O=C1C=C(CI)CO1 Amb27613248 [0,0,0,1,0,1|1,0,1]=4 4045 B8R1.1 O=C1C=C(CO)CO1 Amb23557062 [0,0,0,1,0,1|1,0,1]=4 4046 B8R1.1 O=C1C=C(CS)CO1 Amb28316054 [0,0,0,1,0,1|1,0,1]=4 4047 B8R1.1 O=CC1=CC(=O)NC1 Amb27962554 [0,0,0,1,0,1|2,0,0]=4 4048 B8R1.1 O=CC1=NOC(=O)C1 Amb27209562 [0,0,0,1,0,1|2,0,0]=4 4049 B8R1.1 O=CC1COC(=O)C1 Amb26428572 [0,0,0,1,0,1|1,0,1]=4 4050 B8R1.1 O=CC1COC(=O)O1 Amb27446683 [0,0,0,1,0,1|1,0,1]=4 4051 B8R1.4 CC1=CC(=O)CCC1 Amb17776565 [0,0,0,1,0,1|1,0,1]=4 4052 B8R1.4 CC1=CC(=O)NC=C1 Amb18034270 [0,0,0,1,0,1|1,0,1]=4 4053 B8R1.4 CC1=CC(=O)NCC1 Amb27170325 [0,0,0,1,0,1|1,0,1]=4 4054 B8R1.4 CC1=CC(=O)NN=C1 Amb19892393 [0,0,0,1,0,1|2,0,0]=4 4055 B8R1.4 CC1=CC=CC(=O)N1 Amb18540672 [0,0,0,1,0,1|1,0,1]=4 4056 B8R1.4 CC1=CC=CC(=O)N1 Amb32789652 [0,0,0,1,0,1|1,0,1]=4 4057 B8R1.4 CC1=CC=CC(=O)O1 Amb20247496 [0,0,0,1,0,1|1,0,1]=4 4058 B8R1.4 CC1=CC=NC(=O)N1 Amb22371457 [0,0,0,1,0,1|1,0,1]=4 4059 B8R1.4 CC1=CCC=C(C)C1 Amb22227756 [0,0,0,1,0,1|2,0,0]=4 4060 B8R1.4 CC1=CCCC(=O)C1 Amb27661853 [0,0,0,1,0,1|1,0,0]=3 4061 B8R1.4 CC1=CCCC(=O)N1 Amb27949580 [0,0,0,1,0,1|1,0,0]=3 4062 B8R1.4 CC1=CCCC(=O)O1 Amb21520320 [0,0,0,1,0,1|1,0,0]=3 4063 B8R1.4 CC1=CCNC(=O)O1 Amb23596886 [0,0,0,1,0,1|1,0,0]=3 4064 B8R1.4 CC1=CN=CC(=O)N1 Amb20240903 [0,0,0,1,0,1|2,0,0]=4 4065 B8R1.4 CC1=CN=NC(=O)C1 Amb28984085 [0,0,0,1,0,1|2,0,0]=4 4066 B8R1.4 CC1=CSCC(=O)N1 Amb2386684 [0,0,0,1,0,1|2,0,0]=4 4067 B8R1.4 CC1=NC(=O)CCC1 Amb28239945 [0,0,0,1,0,1|1,0,1]=4 4068 B8R1.4 CC1=NC(=O)NC=C1 Amb19267100 [0,0,0,1,0,1|1,0,1]=4 4069 B8R1.4 CC1=NC(=O)NC=C1 Amb22168002 [0,0,0,1,0,1|1,0,1]=4 4070 B8R1.4 CC1CCOC(=O)N1 Amb27655650 [0,0,0,1,0,1|0,0,2]=4 4071 B8R1.4 CC1CCOC(=O)O1 Amb33714707 [0,0,0,1,0,1|0,0,2]=4 4072 B8R1.4 CN1CCOC(=O)C1 Amb21963307 [0,0,0,1,0,1|1,0,1]=4 4073 B8R1.4 CN1CCOC(=O)C1 Amb22491652 [0,0,0,1,0,1|1,0,1]=4 4074 B8R1.4 Cc1cccc(O)c1 Amb3939017 [0,0,0,1,0,1|1,0,1]=4 4075 B8R1.4 Cc1cccc(O)n1 Amb2725655 [0,0,0,1,0,1|1,0,1]=4 4076 B8R1.4 Cc1ccnc(O)n1 Amb2717748 [0,0,0,1,0,1|1,0,1]=4 4077 B8R1.4 Cc1ccnc(O)n1 Amb8397264 [0,0,0,1,0,1|1,0,1]=4 4078 B8R1.4 Cc1cncc(O)c1 Amb3978939 [0,0,0,1,0,1|2,0,0]=4 4079 B8R1.4 Cc1cncc(O)n1 Amb10599623 [0,0,0,1,0,1|2,0,0]=4 4080 B8R1.4 Cc1cnnc(O)c1 Amb32882487 [0,0,0,1,0,1|2,0,0]=4 4081 B8R1.4 Cc1cnnc(O)n1 Amb28315727 [0,0,0,1,0,1|2,0,0]=4 4082 B8R1.4 NC1=CCNC(=O)N1 Amb25799600 [0,0,0,1,0,1|2,0,0]=4 4083 B8R1.4 O=C1C=C(Cl)C=CO1 Amb22001907 [0,0,0,1,0,1|1,0,1]=4 4084 B8R1.4 O=C1C=COC(=O)C1 Amb25358147 [0,0,0,1,0,1|1,0,1]=4 4085 B8R1.4 O=C1CCOC(=O)C1 Amb26459895 [0,0,0,1,0,1|1,0,1]=4 4086 B8R1.4 O=C1NC(S)=CCS1 Amb27816433 [0,0,0,1,0,1|1,1,0]=4 4087 B8R1.18 C=C1CC(=O)OC1=O Amb3940408 [0,0,0,1,0,1|1,0,1]=4 4088 B8R1.18 CC1=C(C)NC(=O)C1 Amb27830150 [0,0,0,1,0,1|1,0,0]=3 4089 B8R1.18 CC1=C(C)NC(=O)N1 Amb17933370 [0,0,0,1,0,1|1,0,0]=3 4090 B8R1.18 CC1=C(C)NC(=S)N1 Amb19804201 [0,0,0,1,0,1|1,1,0]=4 4091 B8R1.18 CC1=C(C)OC(=O)N1 Amb19516947 [0,0,0,1,0,1|0,0,0]=2 4092 B8R1.18 CC1=C(C)OC(=O)O1 Amb19654027 [0,0,0,1,0,1|0,0,0]=2 4093 B8R1.18 CC1=C(C)OC(=S)N1 Amb19403669 [0,0,0,1,0,1|0,1,0]=3 4094 B8R1.18 CC1=C(C)SC(=O)N1 Amb19281000 [0,0,0,1,0,1|0,1,0]=3 4095 B8R1.18 CC1=C(C)SC(=O)S1 Amb27233795 [0,0,0,1,0,1|0,1,0]=3 4096 B8R1.18 CC1=C(C)SC(=S)N1 Amb21934308 [0,0,0,1,0,1|0,2,0]=4 4097 B8R1.18 CC1=C(C)[Se]C(=[Se])[Se]1 Amb19883899 [0,0,0,1,0,1|0,2,0]=4 4098 B8R1.18 CC1=CC(=O)CC1C Amb16191977 [0,0,0,1,0,1|1,0,1]=4 4099 B8R1.18 CC1=CC(=O)C[C@@H]1C Amb28316193 [0,0,0,1,0,1|1,0,1]=4 4100 B8R1.18 CC1=CC(=O)C[C@H]1C Amb28316192 [0,0,0,1,0,1|1,0,1]=4 4101 B8R1.18 CC1=CC(=O)NC1=O Amb8997582 [0,0,0,1,0,1|2,0,0]=4 4102 B8R1.18 CC1=CC(=O)NN1C Amb19149104 [0,0,0,1,0,1|2,0,0]=4 4103 B8R1.18 CC1=CC(=O)NN1C Amb29083396 [0,0,0,1,0,1|2,0,0]=4 4104 B8R1.18 CC1=CC(=O)OC1=O Amb6608948 [0,0,0,1,0,1|1,0,0]=3 4105 B8R1.18 CC1=CC(=O)OC1Br Amb25144076 [0,0,0,1,0,1|1,0,1]=4 4106 B8R1.18 CC1=CC(=O)OC1O Amb8389484 [0,0,0,1,0,1|1,0,1]=4 4107 B8R1.18 CC1CC(=O)OC1=O Amb3940407 [0,0,0,1,0,1|1,0,1]=4 4108 B8R1.18 CC1CC(=O)OC1C Amb27873473 [0,0,0,1,0,1|0,0,2]=4 4109 B8R1.18 CC1NC(=O)OC1=O Amb22236022 [0,0,0,1,0,1|1,0,1]=4 4110 B8R1.18 CC1NC(=O)OC1C Amb25747248 [0,0,0,1,0,1|0,0,2]=4 4111 B8R1.18 CC1OC(=O)C=C1N Amb27838294 [0,0,0,1,0,1|1,0,1]=4 4112 B8R1.18 CC1OC(=O)CC1=O Amb28290899 [0,0,0,1,0,1|1,0,1]=4 4113 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,0,0,1,0,1|1,0,1]=4 4114 B8R1.18 CC1OC(=O)OC1=O Amb28315579 [0,0,0,1,0,1|1,0,1]=4 4115 B8R1.18 CC1OC(=O)OC1C Amb27485944 [0,0,0,1,0,1|0,0,2]=4 4116 B8R1.18 CN1CC(=O)OC1=O Amb22734007 [0,0,0,1,0,1|2,0,0]=4 4117 B8R1.18 CN1OC(=O)C=C1N Amb25910818 [0,0,0,1,0,1|2,0,0]=4 4118 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,0,0,1,0,1|1,0,1]=4 4119 B8R1.18 C[C@@H]1NC(=O)OC1=O Amb2689575 [0,0,0,1,0,1|1,0,1]=4 4120 B8R1.18 C[C@@H]1NC(=O)O[C@@H]1C Amb28132650 [0,0,0,1,0,1|0,0,2]=4 4121 B8R1.18 C[C@H]1CC(=O)OC1=O Amb2609932 [0,0,0,1,0,1|1,0,1]=4 4122 B8R1.18 C[C@H]1CC(=O)O[C@H]1C Amb27471867 [0,0,0,1,0,1|0,0,2]=4 4123 B8R1.18 C[C@H]1NC(=O)OC1=O Amb2689574 [0,0,0,1,0,1|1,0,1]=4 4124 B8R1.18 Cc1cc(Br)c(C)o1 Amb27221663 [0,0,0,1,0,1|2,0,0]=4 4125 B8R1.18 Cc1cc(Br)oc1Br Amb21964709 [0,0,0,1,0,1|2,0,0]=4 4126 B8R1.18 Cc1cc(Br)oc1C Amb28128216 [0,0,0,1,0,1|1,0,0]=3 4127 B8R1.18 Cc1cc(Br)oc1O Amb18190940 [0,0,0,1,0,1|2,0,0]=4 4128 B8R1.18 Cc1cc(Br)sc1C Amb10600997 [0,0,0,1,0,1|1,1,0]=4 4129 B8R1.18 Cc1cc(C)c(Br)o1 Amb27658519 [0,0,0,1,0,1|2,0,0]=4 4130 B8R1.18 Cc1cc(C)c(C)o1 Amb10606773 [0,0,0,1,0,1|1,0,0]=3 4131 B8R1.18 Cc1cc(C)c(C)s1 Amb2691179 [0,0,0,1,0,1|1,1,0]=4 4132 B8R1.18 Cc1cc(C)c(Cl)o1 Amb25064998 [0,0,0,1,0,1|2,0,0]=4 4133 B8R1.18 Cc1cc(Cl)c(C)o1 Amb26573597 [0,0,0,1,0,1|2,0,0]=4 4134 B8R1.18 Cc1cc(Cl)oc1C Amb24437563 [0,0,0,1,0,1|1,0,0]=3 4135 B8R1.18 Cc1cc(N)sc1C Amb17096049 [0,0,0,1,0,1|1,1,0]=4 4136 B8R1.18 Cc1cc(S)c(C)o1 Amb8515791 [0,0,0,1,0,1|2,0,0]=4 4137 B8R1.18 Cc1nc(Br)oc1C Amb19516420 [0,0,0,1,0,1|1,0,0]=3 4138 B8R1.18 Cc1nc(Br)sc1C Amb22492292 [0,0,0,1,0,1|1,1,0]=4 4139 B8R1.18 Cc1nc(Br)sc1C Amb8496703 [0,0,0,1,0,1|1,1,0]=4 4140 B8R1.18 Cc1nc(C)c(Br)o1 Amb22499281 [0,0,0,1,0,1|2,0,0]=4 4141 B8R1.18 Cc1nc(C)c(C)o1 Amb8513842 [0,0,0,1,0,1|1,0,0]=3 4142 B8R1.18 Cc1nc(C)c(C)s1 Amb8629565 [0,0,0,1,0,1|1,1,0]=4 4143 B8R1.18 Cc1nc(Cl)sc1C Amb19314651 [0,0,0,1,0,1|1,1,0]=4 4144 B8R1.18 Cc1nc(F)sc1C Amb23452580 [0,0,0,1,0,1|1,1,0]=4 4145 B8R1.18 Cc1nc(N)c(C)o1 Amb27391348 [0,0,0,1,0,1|2,0,0]=4 4146 B8R1.18 Cc1nc(N)oc1C Amb21961491 [0,0,0,1,0,1|1,0,0]=3 4147 B8R1.18 Cc1nc(N)oc1C Amb33526413 [0,0,0,1,0,1|1,0,0]=3 4148 B8R1.18 Cc1nc(N)sc1C Amb1017289 [0,0,0,1,0,1|1,1,0]=4 4149 B8R1.18 Cc1nc(N)sc1C Amb2227569 [0,0,0,1,0,1|1,1,0]=4 4150 B8R1.18 Cc1nc(N)sc1C Amb2720246 [0,0,0,1,0,1|1,1,0]=4 4151 B8R1.18 Cc1nc(O)sc1N Amb18203198 [0,0,0,1,0,1|1,1,0]=4 4152 B8R1.18 Cc1nc(S)oc1C Amb2371783 [0,0,0,1,0,1|0,1,0]=3 4153 B8R1.18 Cc1nc(S)sc1C Amb2687624 [0,0,0,1,0,1|0,2,0]=4 4154 B8R1.18 Cc1oc(Br)cc1N Amb27227928 [0,0,0,1,0,1|2,0,0]=4 4155 B8R1.18 Cc1sc(O)cc1Br Amb33434920 [0,0,0,1,0,1|1,1,0]=4 4156 B8R1.18 Cc1sc(O)nc1N Amb28315633 [0,0,0,1,0,1|1,1,0]=4 4157 B8R1.18 O=C1C=C(Br)C(=O)O1 Amb15693391 [0,0,0,1,0,1|2,0,0]=4 4158 B8R1.18 O=C1C=C(F)C(=O)O1 Amb28049388 [0,0,0,1,0,1|2,0,0]=4 4159 B8R1.18 O=C1NC(=O)C(=S)O1 Amb27643395 [0,0,0,1,0,1|2,0,0]=4 4160 B8R1.18 O=C1NC(=P)C(=P)O1 Amb28364438 [0,0,0,1,0,1|2,0,0]=4 4161 B8R1.18 O=C1OC(Cl)=C(Cl)O1 Amb27212738 [0,0,0,1,0,1|2,0,0]=4 4162 B8R1.20 C=C1CC1CC(=O)O Amb25870954 [0,0,0,1,0,1|0,0,2]=4 4163 B8R1.20 CC1CC1CC(=O)O Amb25316515 [0,0,0,1,0,1|0,0,2]=4 4164 B8R1.20 CC1C\C1=C/C(=O)O Amb25256441 [0,0,0,1,0,1|0,0,1]=3 4165 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [0,0,0,1,0,1|0,0,2]=4 4166 B8R1.31 C=C1CCC1C(=O)O Amb28281144 [0,0,0,1,0,1|0,0,2]=4 4167 B8R1.31 CC(=O)C1=C(C)CC1 Amb28316170 [0,0,0,1,0,1|1,0,1]=4 4168 B8R1.31 CC1CCC1C(=O)O Amb21857447 [0,0,0,1,0,1|0,0,2]=4 4169 B8R1.31 CC1NCC1C(=O)O Amb26984410 [0,0,0,1,0,1|1,0,1]=4 4170 B8R1.31 CN1CCC1C(=O)O Amb22011586 [0,0,0,1,0,1|1,0,1]=4 4171 B8R1.31 CN1CC[C@@H]1C(=O)O Amb24183372 [0,0,0,1,0,1|1,0,1]=4 4172 B8R1.31 CN1CC[C@H]1C(=O)O Amb24699921 [0,0,0,1,0,1|1,0,1]=4 4173 B8R1.31 C[C@@H]1CC[C@@H]1C(=O)O Amb28203929 [0,0,0,1,0,1|0,0,2]=4 4174 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O Amb34913092 [0,0,0,1,0,1|1,0,1]=4 4175 B8R1.31 O=C(O)C1=C(Br)CC1 Amb28454412 [0,0,0,1,0,1|1,0,1]=4 4176 B8R1.31 O=C(O)C1=C(Cl)CC1 Amb33609521 [0,0,0,1,0,1|1,0,1]=4 4177 B8R1.31 O=C(O)C1CNC1=O Amb24524290 [0,0,0,1,0,1|2,0,0]=4 4178 B8R1.31 O=C(O)[C@@H]1CNC1=O Amb26452604 [0,0,0,1,0,1|2,0,0]=4 4179 B8R1.31 O=C(O)[C@H]1CNC1=O Amb34146450 [0,0,0,1,0,1|2,0,0]=4 4180 B8R1.34 O=C(O)C=C1CCC1 Amb20667794 [0,0,0,1,0,1|0,0,1]=3 4181 B8R1.34 O=C(O)C=C1CNC1 Amb27255049 [0,0,0,1,0,1|1,0,1]=4 4182 B8R1.34 O=C(O)C=C1CNC1 Amb34150330 [0,0,0,1,0,1|1,0,1]=4 4183 B8R1.34 O=C(O)C=C1COC1 Amb26866250 [0,0,0,1,0,1|1,0,1]=4 4184 B8R1.34 O=C(O)C=C1CSC1 Amb24379733 [0,0,0,1,0,1|1,0,1]=4 4185 B8R1.34 O=C(O)CC1CCC1 Amb2696078 [0,0,0,1,0,1|0,0,2]=4 4186 B8R1.34 O=C(O)CC1CCN1 Amb25068427 [0,0,0,1,0,1|1,0,1]=4 4187 B8R1.34 O=C(O)CC1CCO1 Amb28136625 [0,0,0,1,0,1|1,0,1]=4 4188 B8R1.34 O=C(O)CN1CCC1 Amb28934892 [0,0,0,1,0,1|1,0,1]=4 4189 B8R1.34 O=C(O)C[C@@H]1CCO1 Amb33715997 [0,0,0,1,0,1|1,0,1]=4 4190 B8R1.34 O=C(O)C[C@H]1CCO1 Amb26570015 [0,0,0,1,0,1|1,0,1]=4 4191 B8R1.42 CC1(CC(=O)O)CC1 Amb33544283 [0,0,0,1,0,1|0,0,2]=4 4192 B8R1.43 C=C[C@@H]1C[C@H]1C(=O)O Amb28347448 [0,0,0,1,0,1|0,0,2]=4 4193 B8R1.43 CCC1CC1C(=O)O Amb18961272 [0,0,0,1,0,1|0,0,2]=4 4194 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O Amb24112910 [0,0,0,1,0,1|0,0,2]=4 4195 B8R1.43 CC[C@H]1C[C@H]1C(=O)O Amb33098417 [0,0,0,1,0,1|0,0,2]=4 4196 B8R1.43 CO[C@@H]1C[C@H]1C(=O)O Amb24514838 [0,0,0,1,0,1|1,0,1]=4 4197 B8R1.43 O=C[C@H]1C[C@H]1C(=O)O Amb25911990 [0,0,0,1,0,1|1,0,1]=4 4198 B8R1.51 CC1=CCP(=O)(Cl)C1 Amb28143876 [0,0,0,1,0,1|2,0,0]=4 4199 B8R1.51 CC1=CCP(C)(=O)C1 Amb25127881 [0,0,0,1,0,1|2,0,0]=4 4200 B8R1.51 CC1=CCS(=O)(=O)C1 Amb1419574 [0,0,0,1,0,1|1,0,1]=4 4201 B8R1.67 C=C1C(C)C1C(=O)O Amb27985954 [0,0,0,1,0,1|0,0,2]=4 4202 B8R1.67 CC(=O)C1C(C)=C1C Amb28145774 [0,0,0,1,0,1|1,0,0]=3 4203 B8R1.67 CC1=C(C)C1C(N)=O Amb27831562 [0,0,0,1,0,1|1,0,0]=3 4204 B8R1.67 C[C@@H]1C(C(=O)O)[C@@H]1C Amb25937319 [0,0,0,1,0,1|0,0,2]=4 4205 B8R1.5 CC1=CC=CNC1=O Amb18028406 [0,1,0,1,0,0|1,0,1]=4 4206 B8R1.5 CC1=CC=NNC1=O Amb21960917 [0,1,0,1,0,0|1,0,1]=4 4207 B8R1.5 CC1=CCCCC1=O Amb15693479 [0,1,0,1,0,0|1,0,0]=3 4208 B8R1.5 CC1=CCCCC1O Amb22365276 [0,1,0,1,0,0|1,0,1]=4 4209 B8R1.5 CC1=CCOCC1O Amb28411303 [0,1,0,1,0,0|0,0,2]=4 4210 B8R1.5 CC1=CN=CNC1=O Amb21937121 [0,1,0,1,0,0|1,0,1]=4 4211 B8R1.5 CC1=CNC=CC1=O Amb33714756 [0,1,0,1,0,0|1,0,1]=4 4212 B8R1.5 CC1=COCCC1=O Amb28048981 [0,1,0,1,0,0|1,0,0]=3 4213 B8R1.5 CC1=NC=CNC1=O Amb22436791 [0,1,0,1,0,0|1,0,1]=4 4214 B8R1.5 CC1=NC=CNC1=O Amb32653329 [0,1,0,1,0,0|1,0,1]=4 4215 B8R1.5 CC1=NCCCC1=O Amb27803670 [0,1,0,1,0,0|1,0,1]=4 4216 B8R1.5 CC1=NCCN=C1O Amb25178610 [0,1,0,1,0,0|1,0,1]=4 4217 B8R1.5 CC1=NCCOC1=O Amb27623377 [0,1,0,1,0,0|0,0,1]=3 4218 B8R1.5 CC1CCCOC1=O Amb26933974 [0,1,0,1,0,0|0,0,2]=4 4219 B8R1.5 CC1CCOCC1=O Amb25718285 [0,1,0,1,0,0|0,0,2]=4 4220 B8R1.5 CN1CCOCC1=O Amb22301593 [0,1,0,1,0,0|1,0,1]=4 4221 B8R1.5 Cc1ccccc1O Amb2447562 [0,1,0,1,0,0|1,0,1]=4 4222 B8R1.5 Cc1cccnc1O Amb2389971 [0,1,0,1,0,0|1,0,1]=4 4223 B8R1.5 Cc1ccncc1O Amb8630818 [0,1,0,1,0,0|1,0,1]=4 4224 B8R1.5 Cc1cnccc1O Amb8386832 [0,1,0,1,0,0|1,0,1]=4 4225 B8R1.5 Cc1cncnc1O Amb8438965 [0,1,0,1,0,0|1,0,1]=4 4226 B8R1.5 Cc1ncccc1O Amb24062097 [0,1,0,1,0,0|1,0,1]=4 4227 B8R1.5 Cc1ncccc1O Amb2613384 [0,1,0,1,0,0|1,0,1]=4 4228 B8R1.5 Cc1ncncc1O Amb18641411 [0,1,0,1,0,0|2,0,0]=4 4229 B8R1.5 O=C1C=CCC=C1Cl Amb27181091 [0,1,0,1,0,0|2,0,0]=4 4230 B8R1.5 O=C1C=CCCC1=O Amb28049024 [0,1,0,1,0,0|2,0,0]=4 4231 B8R1.5 O=C1CCCC=C1Br Amb10067493 [0,1,0,1,0,0|2,0,0]=4 4232 B8R1.5 O=C1CCCC=C1F Amb28253992 [0,1,0,1,0,0|2,0,0]=4 4233 B8R1.5 O=C1CCCC=C1I Amb10601698 [0,1,0,1,0,0|2,0,0]=4 4234 B8R1.5 O=C1CCCC=C1O Amb2699837 [0,1,0,1,0,0|2,0,0]=4 4235 B8R1.5 O=C1CCCOC1=O Amb24662237 [0,1,0,1,0,0|1,0,1]=4 4236 B8R1.5 O=C1CCSC=C1Cl Amb27856607 [0,1,0,1,0,0|2,0,0]=4 4237 B8R1.5 O=C1COC=CC1=S Amb27835579 [0,1,0,1,0,0|1,0,1]=4 4238 B8R1.5 O=C1NCCC=C1Cl Amb26349713 [0,1,0,1,0,0|2,0,0]=4 4239 B8R1.5 O=C1NCCOC1=O Amb24120265 [0,1,0,1,0,0|1,0,1]=4 4240 B8R1.5 O=C1OC=CC=C1Br Amb26073988 [0,1,0,1,0,0|1,0,1]=4 4241 B8R1.5 O=C1OC=CC=C1Cl Amb20247271 [0,1,0,1,0,0|1,0,1]=4 4242 B8R1.5 O=C1OC=CC=C1I Amb20247272 [0,1,0,1,0,0|1,0,1]=4 4243 B8R1.5 O=C1OC=CC=C1O Amb17933813 [0,1,0,1,0,0|1,0,1]=4 4244 B8R1.5 O=C1OCC=CC1O Amb27795928 [0,1,0,1,0,0|1,0,1]=4 4245 B8R1.5 O=C1OCCC=C1Br Amb27838412 [0,1,0,1,0,0|1,0,0]=3 4246 B8R1.5 O=C1OCCOC1=O Amb4010211 [0,1,0,1,0,0|1,0,1]=4 4247 B8R1.7 CC(=O)C1=CCCC1 Amb22338190 [0,1,0,1,0,0|1,0,0]=3 4248 B8R1.7 CC(=O)C1=CCCN1 Amb27880337 [0,1,0,1,0,0|1,0,0]=3 4249 B8R1.7 CC(=O)C1=CCCO1 Amb25759909 [0,1,0,1,0,0|1,0,0]=3 4250 B8R1.7 CC(=O)C1=CNCC1 Amb27455189 [0,1,0,1,0,0|1,0,0]=3 4251 B8R1.7 CC(=O)C1=NCCO1 Amb24481446 [0,1,0,1,0,0|2,0,0]=4 4252 B8R1.7 CC(=O)C1=NCCS1 Amb8384455 [0,1,0,1,0,0|2,0,0]=4 4253 B8R1.7 CC(=O)C1=NCSC1 Amb27985534 [0,1,0,1,0,0|2,0,0]=4 4254 B8R1.7 CC(=O)C1CCC=N1 Amb22496787 [0,1,0,1,0,0|1,0,1]=4 4255 B8R1.7 CC(O)C1=CCCO1 Amb28369933 [0,1,0,1,0,0|1,0,1]=4 4256 B8R1.7 C[C@H](O)C1=CCCC1 Amb27781375 [0,1,0,1,0,0|1,0,1]=4 4257 B8R1.7 NC(=O)C1=CCCC1 Amb20622488 [0,1,0,1,0,0|1,0,0]=3 4258 B8R1.7 NC(=O)C1=COCC1 Amb27837543 [0,1,0,1,0,0|1,0,0]=3 4259 B8R1.7 NC(=O)C1=NCCN1 Amb1068371 [0,1,0,1,0,0|2,0,0]=4 4260 B8R1.7 NC(=O)C1C=CCC1 Amb25063981 [0,1,0,1,0,0|1,0,1]=4 4261 B8R1.7 NC(=O)N1C=CCC1 Amb27216170 [0,1,0,1,0,0|2,0,0]=4 4262 B8R1.7 NC(=O)N1CCC=N1 Amb27839165 [0,1,0,1,0,0|2,0,0]=4 4263 B8R1.7 O=C(Cl)C1=CCCC1 Amb25870845 [0,1,0,1,0,0|1,0,0]=3 4264 B8R1.7 O=C(O)C1=CCCC1 Amb3940288 [0,1,0,1,0,0|0,0,0]=2 4265 B8R1.7 O=C(O)C1=CCCN1 Amb17593173 [0,1,0,1,0,0|0,0,0]=2 4266 B8R1.7 O=C(O)C1=CCCO1 Amb19148920 [0,1,0,1,0,0|0,0,0]=2 4267 B8R1.7 O=C(O)C1=CCCS1 Amb18642795 [0,1,0,1,0,0|0,0,0]=2 4268 B8R1.7 O=C(O)C1=CCNC1 Amb26017269 [0,1,0,1,0,0|0,0,0]=2 4269 B8R1.7 O=C(O)C1=CCOC1 Amb24434391 [0,1,0,1,0,0|0,0,0]=2 4270 B8R1.7 O=C(O)C1=CCSC1 Amb18642797 [0,1,0,1,0,0|0,0,0]=2 4271 B8R1.7 O=C(O)C1=CN=S=N1 Amb17798585 [0,1,0,1,0,0|2,0,0]=4 4272 B8R1.7 O=C(O)C1=COCC1 Amb18124248 [0,1,0,1,0,0|0,0,0]=2 4273 B8R1.7 O=C(O)C1=CSCS1 Amb25330178 [0,1,0,1,0,0|1,0,0]=3 4274 B8R1.7 O=C(O)C1=NCCN1 Amb27787520 [0,1,0,1,0,0|1,0,0]=3 4275 B8R1.7 O=C(O)C1=NOCC1 Amb24353499 [0,1,0,1,0,0|1,0,0]=3 4276 B8R1.7 O=C(O)C1C=CCC1 Amb18641680 [0,1,0,1,0,0|0,0,1]=3 4277 B8R1.7 O=C(O)C1C=CCN1 Amb22899488 [0,1,0,1,0,0|0,0,2]=4 4278 B8R1.7 O=C(O)C1C=CCN1 Amb9804432 [0,1,0,1,0,0|0,0,2]=4 4279 B8R1.7 O=C(O)C1C=CCO1 Amb18641762 [0,1,0,1,0,0|0,0,2]=4 4280 B8R1.7 O=C(O)C1CC=CC1 Amb2694750 [0,1,0,1,0,0|0,0,2]=4 4281 B8R1.7 O=C(O)C1CCC=N1 Amb27849168 [0,1,0,1,0,0|0,0,1]=3 4282 B8R1.7 O=C(O)C1CCCC1 Amb3939849 [0,1,0,1,0,0|0,0,2]=4 4283 B8R1.7 O=C(O)C1CCCN1 Amb1157517 [0,1,0,1,0,0|0,0,2]=4 4284 B8R1.7 O=C(O)C1CCCN1 Amb22040086 [0,1,0,1,0,0|0,0,2]=4 4285 B8R1.7 O=C(O)C1CCCO1 Amb9702828 [0,1,0,1,0,0|0,0,2]=4 4286 B8R1.7 O=C(O)C1CCCS1 Amb18124363 [0,1,0,1,0,0|0,0,2]=4 4287 B8R1.7 O=C(O)C1CCNC1 Amb16230724 [0,1,0,1,0,0|0,0,2]=4 4288 B8R1.7 O=C(O)C1CCNC1 Amb16233446 [0,1,0,1,0,0|0,0,2]=4 4289 B8R1.7 O=C(O)C1CCNC1 Amb2694866 [0,1,0,1,0,0|0,0,2]=4 4290 B8R1.7 O=C(O)C1CCNO1 Amb28205451 [0,1,0,1,0,0|1,0,1]=4 4291 B8R1.7 O=C(O)C1CCNO1 Amb33329025 [0,1,0,1,0,0|1,0,1]=4 4292 B8R1.7 O=C(O)C1CCOC1 Amb33542759 [0,1,0,1,0,0|0,0,2]=4 4293 B8R1.7 O=C(O)C1CCSC1 Amb18124360 [0,1,0,1,0,0|0,0,2]=4 4294 B8R1.7 O=C(O)C1CCSS1 Amb8388097 [0,1,0,1,0,0|1,0,1]=4 4295 B8R1.7 O=C(O)C1CNCN1 Amb27597638 [0,1,0,1,0,0|1,0,1]=4 4296 B8R1.7 O=C(O)C1COC=N1 Amb28291372 [0,1,0,1,0,0|1,0,1]=4 4297 B8R1.7 O=C(O)C1COCN1 Amb2694915 [0,1,0,1,0,0|1,0,1]=4 4298 B8R1.7 O=C(O)C1COCN1 Amb2696354 [0,1,0,1,0,0|1,0,1]=4 4299 B8R1.7 O=C(O)C1COCO1 Amb27810510 [0,1,0,1,0,0|1,0,1]=4 4300 B8R1.7 O=C(O)C1CSCN1 Amb532947 [0,1,0,1,0,0|1,0,1]=4 4301 B8R1.7 O=C(O)C1NCCS1 Amb2444644 [0,1,0,1,0,0|1,0,1]=4 4302 B8R1.7 O=C(O)C1OCCO1 Amb24349582 [0,1,0,1,0,0|1,0,1]=4 4303 B8R1.7 O=C(O)C1SCCS1 Amb20669087 [0,1,0,1,0,0|1,0,1]=4 4304 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb16183937 [0,1,0,1,0,0|0,0,2]=4 4305 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb22750611 [0,1,0,1,0,0|0,0,2]=4 4306 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb3940757 [0,1,0,1,0,0|0,0,2]=4 4307 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb6754105 [0,1,0,1,0,0|0,0,2]=4 4308 B8R1.7 O=C(O)[C@@H]1CCCO1 Amb3940908 [0,1,0,1,0,0|0,0,2]=4 4309 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb6893875 [0,1,0,1,0,0|0,0,2]=4 4310 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb8630322 [0,1,0,1,0,0|0,0,2]=4 4311 B8R1.7 O=C(O)[C@@H]1CCOC1 Amb10603235 [0,1,0,1,0,0|0,0,2]=4 4312 B8R1.7 O=C(O)[C@@H]1CCON1 Amb26919409 [0,1,0,1,0,0|1,0,1]=4 4313 B8R1.7 O=C(O)[C@@H]1COCN1 Amb19515958 [0,1,0,1,0,0|1,0,1]=4 4314 B8R1.7 O=C(O)[C@@H]1CSC=N1 Amb35648199 [0,1,0,1,0,0|1,0,1]=4 4315 B8R1.7 O=C(O)[C@@H]1CSCN1 Amb3940400 [0,1,0,1,0,0|1,0,1]=4 4316 B8R1.7 O=C(O)[C@H]1C=CCC1 Amb27872028 [0,1,0,1,0,0|0,0,1]=3 4317 B8R1.7 O=C(O)[C@H]1C=CCN1 Amb34158387 [0,1,0,1,0,0|0,0,2]=4 4318 B8R1.7 O=C(O)[C@H]1CCC=N1 Amb28128325 [0,1,0,1,0,0|0,0,1]=3 4319 B8R1.7 O=C(O)[C@H]1CCCN1 Amb2720569 [0,1,0,1,0,0|0,0,2]=4 4320 B8R1.7 O=C(O)[C@H]1CCCO1 Amb3941554 [0,1,0,1,0,0|0,0,2]=4 4321 B8R1.7 O=C(O)[C@H]1CCNC1 Amb2700058 [0,1,0,1,0,0|0,0,2]=4 4322 B8R1.7 O=C(O)[C@H]1CCNC1 Amb6893874 [0,1,0,1,0,0|0,0,2]=4 4323 B8R1.7 O=C(O)[C@H]1CCOC1 Amb22226787 [0,1,0,1,0,0|0,0,2]=4 4324 B8R1.7 O=C(O)[C@H]1CCSC1 Amb28241390 [0,1,0,1,0,0|0,0,2]=4 4325 B8R1.7 O=C(O)[C@H]1CNCS1 Amb27414077 [0,1,0,1,0,0|1,0,1]=4 4326 B8R1.7 O=C(O)[C@H]1CSC=N1 Amb35641724 [0,1,0,1,0,0|1,0,1]=4 4327 B8R1.7 O=C(O)[C@H]1CSCN1 Amb544887 [0,1,0,1,0,0|1,0,1]=4 4328 B8R1.7 O=C(O)[C@H]1NCCS1 Amb25920370 [0,1,0,1,0,0|1,0,1]=4 4329 B8R1.7 O=C(O)c1ccc[se]1 Amb2611630 [0,1,0,1,0,0|0,0,2]=4 4330 B8R1.7 O=C(O)c1ccco1 Amb6335264 [0,1,0,1,0,0|0,0,2]=4 4331 B8R1.7 O=C(O)c1cccs1 Amb2690602 [0,1,0,1,0,0|0,0,2]=4 4332 B8R1.7 O=C(O)c1ccno1 Amb1152220 [0,1,0,1,0,0|1,0,1]=4 4333 B8R1.7 O=C(O)c1ccns1 Amb1091955 [0,1,0,1,0,0|1,0,1]=4 4334 B8R1.7 O=C(O)c1ccoc1 Amb2720344 [0,1,0,1,0,0|0,0,2]=4 4335 B8R1.7 O=C(O)c1ccon1 Amb8386353 [0,1,0,1,0,0|1,0,1]=4 4336 B8R1.7 O=C(O)c1ccsc1 Amb1156673 [0,1,0,1,0,0|0,0,2]=4 4337 B8R1.7 O=C(O)c1ccsn1 Amb19894963 [0,1,0,1,0,0|1,0,1]=4 4338 B8R1.7 O=C(O)c1cnco1 Amb1158212 [0,1,0,1,0,0|1,0,1]=4 4339 B8R1.7 O=C(O)c1cncs1 Amb1158214 [0,1,0,1,0,0|1,0,1]=4 4340 B8R1.7 O=C(O)c1cnns1 Amb3319162 [0,1,0,1,0,0|2,0,0]=4 4341 B8R1.7 O=C(O)c1cnoc1 Amb8878121 [0,1,0,1,0,0|1,0,1]=4 4342 B8R1.7 O=C(O)c1cnon1 Amb6316077 [0,1,0,1,0,0|2,0,0]=4 4343 B8R1.7 O=C(O)c1cnsc1 Amb2785373 [0,1,0,1,0,0|1,0,1]=4 4344 B8R1.7 O=C(O)c1cnsn1 Amb1091970 [0,1,0,1,0,0|2,0,0]=4 4345 B8R1.7 O=C(O)c1cocn1 Amb10071584 [0,1,0,1,0,0|1,0,1]=4 4346 B8R1.7 O=C(O)c1conn1 Amb28286788 [0,1,0,1,0,0|2,0,0]=4 4347 B8R1.7 O=C(O)c1cscn1 Amb17039667 [0,1,0,1,0,0|1,0,1]=4 4348 B8R1.7 O=C(O)c1cscn1 Amb2455731 [0,1,0,1,0,0|1,0,1]=4 4349 B8R1.7 O=C(O)c1csnn1 Amb535501 [0,1,0,1,0,0|2,0,0]=4 4350 B8R1.7 O=C(O)c1ncco1 Amb8009395 [0,1,0,1,0,0|1,0,1]=4 4351 B8R1.7 O=C(O)c1nccs1 Amb6572012 [0,1,0,1,0,0|1,0,1]=4 4352 B8R1.7 O=C(O)c1ncno1 Amb8009397 [0,1,0,1,0,0|2,0,0]=4 4353 B8R1.7 O=C(O)c1ncns1 Amb18203206 [0,1,0,1,0,0|2,0,0]=4 4354 B8R1.7 O=C(O)c1ncon1 Amb8009396 [0,1,0,1,0,0|2,0,0]=4 4355 B8R1.7 O=C(O)c1nnco1 Amb21964326 [0,1,0,1,0,0|2,0,0]=4 4356 B8R1.7 O=C(O)c1nncs1 Amb20241053 [0,1,0,1,0,0|2,0,0]=4 4357 B8R1.7 O=C([O-])C1CCC=N1 Amb33624430 [0,1,0,1,0,0|0,0,2]=4 4358 B8R1.7 O=[N+]([O-])C1=CCCC1 Amb27874503 [0,1,0,1,0,0|1,0,1]=4 4359 B8R1.7 OB(O)C1=CCCC1 Amb10068948 [0,1,0,1,0,0|1,0,1]=4 4360 B8R1.7 OB(O)C1=CCCO1 Amb22168857 [0,1,0,1,0,0|1,0,1]=4 4361 B8R1.7 OB(O)C1=CCNC1 Amb27807492 [0,1,0,1,0,0|1,0,1]=4 4362 B8R1.13 O=C1NC\C1=C\CCl Amb25174863 [0,1,0,1,0,0|1,0,0]=3 4363 B8R1.19 CC1(Br)CCOC1=O Amb3940887 [0,1,0,1,0,0|0,0,2]=4 4364 B8R1.19 CC1(C)CCOC1=O Amb10603955 [0,1,0,1,0,0|0,0,2]=4 4365 B8R1.19 CC1(N)CCOC1=O Amb28934923 [0,1,0,1,0,0|0,0,2]=4 4366 B8R1.19 C[C@]1(N)CCOC1=O Amb27629673 [0,1,0,1,0,0|0,0,2]=4 4367 B8R1.23 C=C1CC(C(=O)O)C1 Amb613197 [0,1,0,1,0,0|0,0,2]=4 4368 B8R1.23 CC(=O)C1=CC(C)C1 Amb27802162 [0,1,0,1,0,0|1,0,0]=3 4369 B8R1.23 CC(=O)C1C=C(C)C1 Amb24676939 [0,1,0,1,0,0|1,0,1]=4 4370 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [0,1,0,1,0,0|0,0,2]=4 4371 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [0,1,0,1,0,0|0,0,2]=4 4372 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [0,1,0,1,0,0|0,0,2]=4 4373 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [0,1,0,1,0,0|0,0,2]=4 4374 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [0,1,0,1,0,0|0,0,2]=4 4375 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [0,1,0,1,0,0|0,0,2]=4 4376 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [0,1,0,1,0,0|0,0,2]=4 4377 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [0,1,0,1,0,0|0,0,2]=4 4378 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [0,1,0,1,0,0|0,0,2]=4 4379 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [0,1,0,1,0,0|0,0,2]=4 4380 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [0,1,0,1,0,0|0,0,2]=4 4381 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [0,1,0,1,0,0|0,0,2]=4 4382 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [0,1,0,1,0,0|0,0,2]=4 4383 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [0,1,0,1,0,0|0,0,2]=4 4384 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [0,1,0,1,0,0|0,0,2]=4 4385 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [0,1,0,1,0,0|0,0,2]=4 4386 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [0,1,0,1,0,0|0,0,2]=4 4387 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [0,1,0,1,0,0|0,0,2]=4 4388 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [0,1,0,1,0,0|0,0,2]=4 4389 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [0,1,0,1,0,0|0,0,2]=4 4390 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [0,1,0,1,0,0|0,0,2]=4 4391 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [0,1,0,1,0,0|0,0,2]=4 4392 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [0,1,0,1,0,0|0,0,2]=4 4393 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [0,1,0,1,0,0|0,0,2]=4 4394 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [0,1,0,1,0,0|0,0,2]=4 4395 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [0,1,0,1,0,0|0,0,2]=4 4396 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [0,1,0,1,0,0|0,0,2]=4 4397 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [0,1,0,1,0,0|0,0,2]=4 4398 B8R1.23 O=C1CC(C(=O)O)C1 Amb33544325 [0,1,0,1,0,0|1,0,1]=4 4399 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [0,1,0,1,0,0|1,0,1]=4 4400 B8R1.23 O=C1CC(C(=O)O)O1 Amb26887454 [0,1,0,1,0,0|1,0,1]=4 4401 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [0,1,0,1,0,0|1,0,1]=4 4402 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [0,1,0,1,0,0|1,0,1]=4 4403 B8R1.30 C=C1CC1(C)C(C)=O Amb25913489 [0,1,0,1,0,0|1,0,1]=4 4404 B8R1.30 C=C1CC1(N)C(=O)O Amb22274582 [0,1,0,1,0,0|0,0,2]=4 4405 B8R1.30 CC1(C(=O)O)CC1Br Amb25889224 [0,1,0,1,0,0|0,0,2]=4 4406 B8R1.30 CC1(C(=O)O)CC1Cl Amb28325885 [0,1,0,1,0,0|0,0,2]=4 4407 B8R1.30 CC1(C(=O)O)CC1F Amb24445672 [0,1,0,1,0,0|0,0,2]=4 4408 B8R1.30 CC1CC1(C)C(=O)O Amb28456906 [0,1,0,1,0,0|0,0,2]=4 4409 B8R1.30 CC1CC1(F)C(=O)O Amb32679974 [0,1,0,1,0,0|0,0,2]=4 4410 B8R1.30 CC1CC1(N)C(=O)O Amb26066646 [0,1,0,1,0,0|0,0,2]=4 4411 B8R1.30 C[C@@H]1C[C@@]1(C)C(=O)O Amb24680945 [0,1,0,1,0,0|0,0,2]=4 4412 B8R1.30 C[C@@H]1C[C@@]1(O)C(=O)O Amb28133921 [0,1,0,1,0,0|0,0,2]=4 4413 B8R1.30 C[C@@H]1O[C@]1(C)C(=O)O Amb28057500 [0,1,0,1,0,0|0,0,2]=4 4414 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1Cl Amb28134278 [0,1,0,1,0,0|0,0,2]=4 4415 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1F Amb24053139 [0,1,0,1,0,0|0,0,2]=4 4416 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Br Amb27222642 [0,1,0,1,0,0|0,0,2]=4 4417 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Cl Amb28196682 [0,1,0,1,0,0|0,0,2]=4 4418 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1F Amb26656665 [0,1,0,1,0,0|0,0,2]=4 4419 B8R1.30 C[C@H]1C[C@@]1(C)C(=O)O Amb27789627 [0,1,0,1,0,0|0,0,2]=4 4420 B8R1.30 C[C@H]1C[C@@]1(Cl)C(=O)O Amb28286348 [0,1,0,1,0,0|0,0,2]=4 4421 B8R1.30 C[C@H]1C[C@]1(N)C(=O)O Amb27873946 [0,1,0,1,0,0|0,0,2]=4 4422 B8R1.30 C[C@H]1C[C@]1(O)C(=O)O Amb27881113 [0,1,0,1,0,0|0,0,2]=4 4423 B8R1.30 C[C@]1(C(=O)O)C[C@@H]1F Amb26987734 [0,1,0,1,0,0|0,0,2]=4 4424 B8R1.30 C[C@]1(C(=O)O)C[C@H]1F Amb26870422 [0,1,0,1,0,0|0,0,2]=4 4425 B8R1.37 CC\C=C(/C)C1CO1 Amb28342163 [0,1,0,1,0,0|1,0,1]=4 4426 B8R1.46 CSC1=CC(=O)C1=O Amb27267163 [0,1,0,1,0,0|2,0,0]=4 4427 B8R1.54 C=C(C(=O)O)C1CC1 Amb24481397 [0,1,0,1,0,0|0,0,2]=4 4428 B8R1.54 CC(=O)C(C)=C1CC1 Amb28320841 [0,1,0,1,0,0|1,0,0]=3 4429 B8R1.54 CC(C(=O)O)=C1CC1 Amb24450586 [0,1,0,1,0,0|0,0,0]=2 4430 B8R1.54 CC(C(=O)O)C1CC1 Amb33537630 [0,1,0,1,0,0|0,0,2]=4 4431 B8R1.54 C[C@@H](C(=O)O)C1CC1 Amb33732043 [0,1,0,1,0,0|0,0,2]=4 4432 B8R1.54 C[C@H](C(=O)O)C1CC1 Amb33744363 [0,1,0,1,0,0|0,0,2]=4 4433 B8R1.54 O=C(O)C(=O)C1CC1 Amb16233327 [0,1,0,1,0,0|1,0,1]=4 4434 B8R1.78 CC1(C(=O)O)CCC1 Amb33544631 [0,1,0,1,0,0|0,0,2]=4 4435 B8R1.78 CC1(C(=O)O)CCN1 Amb24483061 [0,1,0,1,0,0|0,0,2]=4 4436 B8R1.78 CC1(C(=O)O)CCN1 Amb33483840 [0,1,0,1,0,0|0,0,2]=4 4437 B8R1.78 CC1(C(=O)O)CCN1 Amb34138205 [0,1,0,1,0,0|0,0,2]=4 4438 B8R1.78 CC1(C(=O)O)CCO1 Amb22001906 [0,1,0,1,0,0|0,0,2]=4 4439 B8R1.78 CC1(C(=O)O)CNC1 Amb24077476 [0,1,0,1,0,0|0,0,2]=4 4440 B8R1.78 CC1(C(=O)O)CNC1 Amb24561978 [0,1,0,1,0,0|0,0,2]=4 4441 B8R1.78 CC1(C(=O)O)COC1 Amb33543882 [0,1,0,1,0,0|0,0,2]=4 4442 B8R1.78 CC1(C(=O)O)CSC1 Amb21960451 [0,1,0,1,0,0|0,0,2]=4 4443 B8R1.78 NC1(C(=O)O)CCC1 Amb2694933 [0,1,0,1,0,0|0,0,2]=4 4444 B8R1.78 NC1(C(=O)O)CCC1 Amb8630070 [0,1,0,1,0,0|0,0,2]=4 4445 B8R1.78 O=C(O)C1(Br)CCC1 Amb495556 [0,1,0,1,0,0|0,0,2]=4 4446 B8R1.78 O=C(O)C1(Cl)CCC1 Amb24422884 [0,1,0,1,0,0|0,0,2]=4 4447 B8R1.78 O=C(O)C1(F)CCC1 Amb22886536 [0,1,0,1,0,0|0,0,2]=4 4448 B8R1.78 O=C(O)C1(O)CCC1 Amb495557 [0,1,0,1,0,0|0,0,2]=4 4449 B8R1.78 O=C(O)C1(S)CCC1 Amb34159631 [0,1,0,1,0,0|0,0,2]=4 4450 B8R1.11 C#Cc1occc1C Amb26015975 [0,1,0,1,0,0|1,0,1]=4 4451 B8R1.11 C=CC1=CCCC1=O Amb27854964 [0,1,0,1,0,0|1,0,1]=4 4452 B8R1.11 C=CN1CCOC1=O Amb24595910 [0,1,0,1,0,0|1,0,1]=4 4453 B8R1.11 C=Cc1occc1C Amb28049005 [0,1,0,1,0,0|1,0,1]=4 4454 B8R1.11 CC1=C(C=O)CCO1 Amb28320103 [0,1,0,1,0,0|2,0,0]=4 4455 B8R1.11 CC1=C(C=O)SCC1 Amb18642671 [0,1,0,1,0,0|0,1,1]=4 4456 B8R1.11 CC1=C(CO)CCO1 Amb8392376 [0,1,0,1,0,0|1,0,1]=4 4457 B8R1.11 CCC1=CCCC1=O Amb17778667 [0,1,0,1,0,0|1,0,0]=3 4458 B8R1.11 CCC1=CCSC1=O Amb27967999 [0,1,0,1,0,0|0,1,0]=3 4459 B8R1.11 CCC1CCOC1=O Amb23538353 [0,1,0,1,0,0|0,0,2]=4 4460 B8R1.11 CCC1COCC1=O Amb29866231 [0,1,0,1,0,0|0,0,2]=4 4461 B8R1.11 CCc1ccoc1Br Amb13884533 [0,1,0,1,0,0|1,0,1]=4 4462 B8R1.11 CCc1ccsc1O Amb26547659 [0,1,0,1,0,0|0,1,1]=4 4463 B8R1.11 CCc1cnoc1N Amb18278950 [0,1,0,1,0,0|2,0,0]=4 4464 B8R1.11 CNC1=CCCC1=O Amb28457232 [0,1,0,1,0,0|1,0,0]=3 4465 B8R1.11 CN[C@H]1CCOC1=O Amb28288608 [0,1,0,1,0,0|0,0,2]=4 4466 B8R1.11 CNc1cnoc1C Amb27153306 [0,1,0,1,0,0|2,0,0]=4 4467 B8R1.11 COC1=CCCC1=O Amb28316240 [0,1,0,1,0,0|1,0,0]=3 4468 B8R1.11 COC1=CCOC1=O Amb28129835 [0,1,0,1,0,0|0,0,0]=2 4469 B8R1.11 COC1CCOC1=O Amb28127714 [0,1,0,1,0,0|0,0,2]=4 4470 B8R1.11 CON1CCOC1=O Amb25769302 [0,1,0,1,0,0|1,0,1]=4 4471 B8R1.11 COc1ccoc1C Amb27462648 [0,1,0,1,0,0|1,0,1]=4 4472 B8R1.11 COc1cscc1C Amb24524146 [0,1,0,1,0,0|2,0,0]=4 4473 B8R1.11 COc1occc1C Amb27625304 [0,1,0,1,0,0|0,0,2]=4 4474 B8R1.11 COc1sccc1C Amb25064766 [0,1,0,1,0,0|0,1,1]=4 4475 B8R1.11 CSC1=CCCC1=O Amb28351431 [0,1,0,1,0,0|1,0,0]=3 4476 B8R1.11 CSc1ccoc1C Amb8393178 [0,1,0,1,0,0|1,0,1]=4 4477 B8R1.11 C\C=C1/C=CCC1=O Amb27861032 [0,1,0,1,0,0|1,0,1]=4 4478 B8R1.11 C\C=C1\C=CCC1=O Amb28052392 [0,1,0,1,0,0|1,0,1]=4 4479 B8R1.11 C\C=C1\CCCC1=O Amb25205820 [0,1,0,1,0,0|1,0,0]=3 4480 B8R1.11 C\C=C1\CCNC1=O Amb28397116 [0,1,0,1,0,0|1,0,0]=3 4481 B8R1.11 Cc1ccoc1C#N Amb25352891 [0,1,0,1,0,0|1,0,1]=4 4482 B8R1.11 Cc1ccoc1C=O Amb6572128 [0,1,0,1,0,0|0,0,1]=3 4483 B8R1.11 Cc1ccoc1CBr Amb18183895 [0,1,0,1,0,0|1,0,1]=4 4484 B8R1.11 Cc1ccoc1CCl Amb8860567 [0,1,0,1,0,0|1,0,1]=4 4485 B8R1.11 Cc1ccoc1CN Amb6572131 [0,1,0,1,0,0|1,0,1]=4 4486 B8R1.11 Cc1ccoc1CO Amb6572130 [0,1,0,1,0,0|0,0,2]=4 4487 B8R1.11 Cc1ccoc1CS Amb25969059 [0,1,0,1,0,0|0,1,1]=4 4488 B8R1.11 Cc1ccsc1C=O Amb534988 [0,1,0,1,0,0|0,1,1]=4 4489 B8R1.11 Cc1ccsc1CO Amb837436 [0,1,0,1,0,0|0,1,1]=4 4490 B8R1.11 Cc1cnoc1C#N Amb33620875 [0,1,0,1,0,0|2,0,0]=4 4491 B8R1.11 Cc1cnoc1C=O Amb8010953 [0,1,0,1,0,0|1,0,0]=3 4492 B8R1.11 Cc1cnoc1CBr Amb25675743 [0,1,0,1,0,0|2,0,0]=4 4493 B8R1.11 Cc1cnoc1CCl Amb30633455 [0,1,0,1,0,0|2,0,0]=4 4494 B8R1.11 Cc1cnoc1CO Amb24467683 [0,1,0,1,0,0|1,0,1]=4 4495 B8R1.11 Cc1cnsc1C=O Amb8010958 [0,1,0,1,0,0|1,1,0]=4 4496 B8R1.11 Cc1cocc1C=O Amb18641606 [0,1,0,1,0,0|2,0,0]=4 4497 B8R1.11 Cc1conc1C=O Amb8010950 [0,1,0,1,0,0|2,0,0]=4 4498 B8R1.11 Cc1conc1CO Amb24593199 [0,1,0,1,0,0|2,0,0]=4 4499 B8R1.11 Cc1cscc1C=O Amb2447064 [0,1,0,1,0,0|2,0,0]=4 4500 B8R1.11 Cc1cscc1CO Amb24483178 [0,1,0,1,0,0|2,0,0]=4 4501 B8R1.11 Cc1csnc1C=O Amb8010954 [0,1,0,1,0,0|2,0,0]=4 4502 B8R1.11 Cc1ncoc1C=O Amb8010969 [0,1,0,1,0,0|1,0,1]=4 4503 B8R1.11 Cc1nnoc1C=O Amb8010988 [0,1,0,1,0,0|2,0,0]=4 4504 B8R1.11 Cc1occc1CBr Amb18183894 [0,1,0,1,0,0|1,0,1]=4 4505 B8R1.11 Cc1occc1CN Amb2724036 [0,1,0,1,0,0|1,0,1]=4 4506 B8R1.11 Cc1occc1CN Amb33545796 [0,1,0,1,0,0|1,0,1]=4 4507 B8R1.11 Cc1occc1CO Amb33545810 [0,1,0,1,0,0|1,0,1]=4 4508 B8R1.11 Cc1occc1CS Amb24538700 [0,1,0,1,0,0|1,0,1]=4 4509 B8R1.11 Cc1oncc1CBr Amb26887603 [0,1,0,1,0,0|2,0,0]=4 4510 B8R1.11 Cc1oncc1CCl Amb22754839 [0,1,0,1,0,0|2,0,0]=4 4511 B8R1.11 Cc1oncc1CN Amb18941785 [0,1,0,1,0,0|2,0,0]=4 4512 B8R1.11 Cc1oncc1CN Amb33534120 [0,1,0,1,0,0|2,0,0]=4 4513 B8R1.11 Cc1oncc1CO Amb22754687 [0,1,0,1,0,0|2,0,0]=4 4514 B8R1.11 Cc1oncc1CS Amb33474163 [0,1,0,1,0,0|2,0,0]=4 4515 B8R1.11 N#CC1=CCCC1=O Amb28253685 [0,1,0,1,0,0|1,0,1]=4 4516 B8R1.11 NCC1CCOC1=O Amb28398456 [0,1,0,1,0,0|0,0,2]=4 4517 B8R1.11 NCC1CCOC1=O Amb32653583 [0,1,0,1,0,0|0,0,2]=4 4518 B8R1.11 NCc1ccoc1I Amb28316238 [0,1,0,1,0,0|1,0,1]=4 4519 B8R1.11 NCc1cnoc1N Amb28368690 [0,1,0,1,0,0|2,0,0]=4 4520 B8R1.11 NCc1conc1O Amb26968699 [0,1,0,1,0,0|2,0,0]=4 4521 B8R1.11 N\C=C1/CCCC1=O Amb28324124 [0,1,0,1,0,0|2,0,0]=4 4522 B8R1.11 N\C=C1\CCOC1=O Amb24575038 [0,1,0,1,0,0|1,0,0]=3 4523 B8R1.11 Nc1ccoc1C=O Amb18203397 [0,1,0,1,0,0|1,0,1]=4 4524 B8R1.11 O=C1CCC=C1CBr Amb27232822 [0,1,0,1,0,0|1,0,0]=3 4525 B8R1.11 O=C1CCC\C1=C/[O-] Amb19515665 [0,1,0,1,0,0|2,0,0]=4 4526 B8R1.11 O=C1CCC\C1=C\O Amb32439040 [0,1,0,1,0,0|2,0,0]=4 4527 B8R1.11 O=C1CCO\C1=C\O Amb25929807 [0,1,0,1,0,0|2,0,0]=4 4528 B8R1.11 O=C1OC=CC1CO Amb28129883 [0,1,0,1,0,0|0,0,2]=4 4529 B8R1.11 O=C1OCC=C1CBr Amb27632284 [0,1,0,1,0,0|0,0,0]=2 4530 B8R1.11 O=C1OCCC1CO Amb26431337 [0,1,0,1,0,0|0,0,2]=4 4531 B8R1.11 O=C1OCC\C1=N\O Amb2610304 [0,1,0,1,0,0|1,0,1]=4 4532 B8R1.11 O=C1OCOC1CCl Amb28367648 [0,1,0,1,0,0|1,0,1]=4 4533 B8R1.11 O=C1OCO\C1=C\Cl Amb28194356 [0,1,0,1,0,0|1,0,0]=3 4534 B8R1.11 O=CC1CCOC1=O Amb17593177 [0,1,0,1,0,0|1,0,1]=4 4535 B8R1.11 O=CC1COCC1=O Amb27165171 [0,1,0,1,0,0|1,0,1]=4 4536 B8R1.11 O=Cc1occc1Br Amb2447448 [0,1,0,1,0,0|1,0,1]=4 4537 B8R1.11 O=Cc1occc1Cl Amb18202965 [0,1,0,1,0,0|1,0,1]=4 4538 B8R1.11 O=Cc1occc1F Amb18203365 [0,1,0,1,0,0|1,0,1]=4 4539 B8R1.11 O=Cc1occc1I Amb25089234 [0,1,0,1,0,0|1,0,1]=4 4540 B8R1.11 O=Cc1occc1O Amb28186907 [0,1,0,1,0,0|1,0,1]=4 4541 B8R1.11 O=Cc1oncc1Br Amb18191116 [0,1,0,1,0,0|2,0,0]=4 4542 B8R1.11 O=Cc1oncc1Cl Amb18199347 [0,1,0,1,0,0|2,0,0]=4 4543 B8R1.11 O=Nc1occc1O Amb27202170 [0,1,0,1,0,0|1,0,1]=4 4544 B8R1.11 OCc1ccoc1Br Amb26598755 [0,1,0,1,0,0|1,0,1]=4 4545 B8R1.11 OCc1ccoc1Cl Amb26370317 [0,1,0,1,0,0|1,0,1]=4 4546 B8R1.11 OCc1cnoc1Br Amb27793615 [0,1,0,1,0,0|2,0,0]=4 4547 B8R1.12 O=CC1=C(C=O)CC1 Amb28255728 [0,1,0,1,0,0|2,0,0]=4 4548 B8R1.25 CC1=C(C)C(C)C1=O Amb28201047 [0,1,0,1,0,0|1,0,0]=3 4549 B8R1.25 CC1=C(O)C(C)C1=O Amb28316188 [0,1,0,1,0,0|2,0,0]=4 4550 B8R1.25 Cc1c(O)c(=O)c1=O Amb8439679 [0,1,0,1,0,0|1,0,0]=3 4551 B8R1.25 NC1=C(O)C(=O)C1=O Amb24668985 [0,1,0,1,0,0|2,0,0]=4 4552 B8R1.25 O=C1C(=O)C(Br)=C1O Amb28324230 [0,1,0,1,0,0|2,0,0]=4 4553 B8R1.25 O=C1C(=O)C(O)=C1O Amb17743969 [0,1,0,1,0,0|2,0,0]=4 4554 B8R1.38 CCC(O)C1=CCC1 Amb27171312 [0,1,0,1,0,0|1,0,1]=4 4555 B8R1.38 CNC(=O)C1=CCC1 Amb27838027 [0,1,0,1,0,0|1,0,0]=3 4556 B8R1.38 COC(=O)C1=CCC1 Amb24689222 [0,1,0,1,0,0|0,0,0]=2 4557 B8R1.38 COC(=O)C1C=CC1 Amb33715996 [0,1,0,1,0,0|0,0,2]=4 4558 B8R1.38 COC(=O)C1CCC1 Amb6366581 [0,1,0,1,0,0|0,0,2]=4 4559 B8R1.38 COC(=O)C1CCN1 Amb2699142 [0,1,0,1,0,0|1,0,1]=4 4560 B8R1.38 COC(=O)C1CCN1 Amb33544519 [0,1,0,1,0,0|1,0,1]=4 4561 B8R1.38 COC(=O)[C@@H]1CCN1 Amb19888362 [0,1,0,1,0,0|1,0,1]=4 4562 B8R1.38 COC(=O)[C@@H]1CCN1 Amb22405994 [0,1,0,1,0,0|1,0,1]=4 4563 B8R1.38 COC(=O)[C@H]1CCN1 Amb22737543 [0,1,0,1,0,0|1,0,1]=4 4564 B8R1.38 COC(=O)[C@H]1CCN1 Amb24694404 [0,1,0,1,0,0|1,0,1]=4 4565 B8R1.38 O=C(CO)C1CCC1 Amb28188903 [0,1,0,1,0,0|0,0,2]=4 4566 B8R1.38 O=C(CO)N1CCC1 Amb9421597 [0,1,0,1,0,0|1,0,1]=4 4567 B8R1.38 O=C(NO)C1CCC1 Amb6265921 [0,1,0,1,0,0|0,0,2]=4 4568 B8R1.38 O=C(NO)C1CCN1 Amb27659056 [0,1,0,1,0,0|1,0,1]=4 4569 B8R1.38 OCC(F)=C1CCC1 Amb32645996 [0,1,0,1,0,0|1,0,1]=4 4570 B8R1.39 COC(=O)C1(C)CC1 Amb10604239 [0,1,0,1,0,0|0,0,2]=4 4571 B8R1.39 COC(=O)C1(C)CO1 Amb17672313 [0,1,0,1,0,0|1,0,1]=4 4572 B8R1.50 C=C1C(=O)OCC1N Amb18641720 [0,1,0,1,0,0|0,0,2]=4 4573 B8R1.50 C=C1C(=O)OCC1O Amb27768713 [0,1,0,1,0,0|0,0,2]=4 4574 B8R1.50 C=C1C(=O)OC[C@H]1O Amb27945232 [0,1,0,1,0,0|0,0,2]=4 4575 B8R1.50 CC1=C(Br)C(=N)ON1 Amb19303493 [0,1,0,1,0,0|2,0,0]=4 4576 B8R1.50 CC1=C(Br)C(=O)CC1 Amb10067495 [0,1,0,1,0,0|1,0,1]=4 4577 B8R1.50 CC1=C(Br)C(=O)NN1 Amb20667742 [0,1,0,1,0,0|2,0,0]=4 4578 B8R1.50 CC1=C(Br)C(O)CC1 Amb27225613 [0,1,0,1,0,0|1,0,1]=4 4579 B8R1.50 CC1=C(Br)COC1=O Amb27854509 [0,1,0,1,0,0|0,0,0]=2 4580 B8R1.50 CC1=C(C)C(=O)CC1 Amb22351730 [0,1,0,1,0,0|1,0,0]=3 4581 B8R1.50 CC1=C(C)C(=O)N=N1 Amb26890918 [0,1,0,1,0,0|1,0,0]=3 4582 B8R1.50 CC1=C(C)C(=O)NC1 Amb2778404 [0,1,0,1,0,0|1,0,0]=3 4583 B8R1.50 CC1=C(C)C(=O)NN1 Amb21932497 [0,1,0,1,0,0|1,0,0]=3 4584 B8R1.50 CC1=C(C)[C@H](O)CC1 Amb27785280 [0,1,0,1,0,0|1,0,1]=4 4585 B8R1.50 CC1=C(Cl)C(=O)OC1 Amb26020563 [0,1,0,1,0,0|1,0,0]=3 4586 B8R1.50 CC1=C(Cl)C(=O)ON1 Amb27431251 [0,1,0,1,0,0|1,0,0]=3 4587 B8R1.50 CC1=C(Cl)CCC1=O Amb27972997 [0,1,0,1,0,0|1,0,0]=3 4588 B8R1.50 CC1=C(Cl)CC[C@@H]1O Amb27650530 [0,1,0,1,0,0|1,0,1]=4 4589 B8R1.50 CC1=C(Cl)CC[C@H]1O Amb28138741 [0,1,0,1,0,0|1,0,1]=4 4590 B8R1.50 CC1=C(N)C(=N)ON1 Amb28249044 [0,1,0,1,0,0|2,0,0]=4 4591 B8R1.50 CC1=C(N)C(=O)NN1 Amb28934850 [0,1,0,1,0,0|2,0,0]=4 4592 B8R1.50 CC1=C(N)C(=O)NN1 Amb32661104 [0,1,0,1,0,0|2,0,0]=4 4593 B8R1.50 CC1=C(N)NNC1=O Amb18641725 [0,1,0,1,0,0|2,0,0]=4 4594 B8R1.50 CC1=C(N)OCC1=O Amb27839546 [0,1,0,1,0,0|1,0,0]=3 4595 B8R1.50 CC1=C(O)C(=O)CC1 Amb4004294 [0,1,0,1,0,0|0,0,1]=3 4596 B8R1.50 CC1=C(O)C(=O)CO1 Amb8386149 [0,1,0,1,0,0|1,0,0]=3 4597 B8R1.50 CC1=C(O)C(=O)CS1 Amb27273133 [0,1,0,1,0,0|1,0,0]=3 4598 B8R1.50 CC1=C(O)C(=O)OC1 Amb23571854 [0,1,0,1,0,0|1,0,0]=3 4599 B8R1.50 CC1=C(O)C(=O)SC1 Amb24638526 [0,1,0,1,0,0|1,0,1]=4 4600 B8R1.50 CC1=C(O)COC1=O Amb2611869 [0,1,0,1,0,0|0,0,0]=2 4601 B8R1.50 CC1=CCC(=O)C1O Amb27828885 [0,1,0,1,0,0|0,0,1]=3 4602 B8R1.50 CC1=CCC(C)C1=O Amb17778666 [0,1,0,1,0,0|1,0,0]=3 4603 B8R1.50 CC1=CSC(C)C1=O Amb28124245 [0,1,0,1,0,0|2,0,0]=4 4604 B8R1.50 CC1=NNC(=O)C1C Amb3429410 [0,1,0,1,0,0|1,0,1]=4 4605 B8R1.50 CC1=NNC(=O)N1C Amb22732220 [0,1,0,1,0,0|2,0,0]=4 4606 B8R1.50 CC1=NOC(=O)C1C Amb19958218 [0,1,0,1,0,0|0,0,1]=3 4607 B8R1.50 CC1C(=O)CCC1=O Amb974862 [0,1,0,1,0,0|1,0,1]=4 4608 B8R1.50 CC1C(=O)COC1=O Amb4035239 [0,1,0,1,0,0|0,0,1]=3 4609 B8R1.50 CC1C(=O)OC[C@@H]1O Amb27208229 [0,1,0,1,0,0|0,0,2]=4 4610 B8R1.50 CC1C(=O)OC[C@H]1O Amb27484790 [0,1,0,1,0,0|0,0,2]=4 4611 B8R1.50 CC1COC(=O)C1=O Amb27262699 [0,1,0,1,0,0|1,0,1]=4 4612 B8R1.50 CC1NCN(O)C1=O Amb28251778 [0,1,0,1,0,0|1,0,1]=4 4613 B8R1.50 CC1OCC(=O)C1C Amb29866230 [0,1,0,1,0,0|0,0,2]=4 4614 B8R1.50 CC1OCC(O)C1=O Amb28048942 [0,1,0,1,0,0|1,0,1]=4 4615 B8R1.50 CN1C(=O)CCC1=O Amb6368854 [0,1,0,1,0,0|2,0,0]=4 4616 B8R1.50 CN1C(=O)CNC1=O Amb22002559 [0,1,0,1,0,0|2,0,0]=4 4617 B8R1.50 CN1C(=O)COC1=O Amb21927685 [0,1,0,1,0,0|1,0,0]=3 4618 B8R1.50 CN1C(=O)CSC1=O Amb1883006 [0,1,0,1,0,0|1,1,0]=4 4619 B8R1.50 CN1C=CC(O)C1=O Amb28207084 [0,1,0,1,0,0|1,0,1]=4 4620 B8R1.50 CN1CC=C(Cl)C1=O Amb28255503 [0,1,0,1,0,0|2,0,0]=4 4621 B8R1.50 CN1CC=C(N)C1=O Amb27971244 [0,1,0,1,0,0|2,0,0]=4 4622 B8R1.50 CN1CCC(O)C1=O Amb20622738 [0,1,0,1,0,0|1,0,1]=4 4623 B8R1.50 C[C@@H]1C(=O)OC[C@@H]1N Amb28055949 [0,1,0,1,0,0|0,0,2]=4 4624 B8R1.50 C[C@@H]1COC(=O)[C@@H]1C Amb28411565 [0,1,0,1,0,0|0,0,2]=4 4625 B8R1.50 C[C@H]1C(=O)OC[C@H]1N Amb27635064 [0,1,0,1,0,0|0,0,2]=4 4626 B8R1.50 Cc1c(N)on[n+]1C Amb27166157 [0,1,0,1,0,0|2,0,0]=4 4627 B8R1.50 Cc1c(O)cnn1C Amb28316174 [0,1,0,1,0,0|2,0,0]=4 4628 B8R1.50 Cc1c(O)noc1N Amb23504024 [0,1,0,1,0,0|1,0,1]=4 4629 B8R1.50 Cc1ccn(O)c1C Amb27636587 [0,1,0,1,0,0|1,0,1]=4 4630 B8R1.50 Cc1cnn(C)c1O Amb26884832 [0,1,0,1,0,0|2,0,0]=4 4631 B8R1.50 Cc1csc(C)c1O Amb27597766 [0,1,0,1,0,0|2,0,0]=4 4632 B8R1.50 Cc1csc(C)c1O Amb35789434 [0,1,0,1,0,0|2,0,0]=4 4633 B8R1.50 Cc1csc(O)c1Br Amb33434243 [0,1,0,1,0,0|1,1,0]=4 4634 B8R1.50 Cc1ncc(O)n1C Amb27222570 [0,1,0,1,0,0|2,0,0]=4 4635 B8R1.50 Cc1noc(Br)c1Cl Amb26056005 [0,1,0,1,0,0|2,0,0]=4 4636 B8R1.50 Cc1noc(C)c1Br Amb2685145 [0,1,0,1,0,0|2,0,0]=4 4637 B8R1.50 Cc1noc(C)c1C Amb2447075 [0,1,0,1,0,0|1,0,0]=3 4638 B8R1.50 Cc1noc(C)c1Cl Amb15701448 [0,1,0,1,0,0|2,0,0]=4 4639 B8R1.50 Cc1noc(C)c1I Amb1210680 [0,1,0,1,0,0|2,0,0]=4 4640 B8R1.50 Cc1noc(C)c1N Amb1945407 [0,1,0,1,0,0|2,0,0]=4 4641 B8R1.50 Cc1noc(C)c1N Amb2693446 [0,1,0,1,0,0|2,0,0]=4 4642 B8R1.50 Cc1noc(C)c1O Amb25353521 [0,1,0,1,0,0|2,0,0]=4 4643 B8R1.50 Cc1noc(C)c1S Amb33422543 [0,1,0,1,0,0|2,0,0]=4 4644 B8R1.50 Cc1noc(Cl)c1C Amb24392853 [0,1,0,1,0,0|1,0,0]=3 4645 B8R1.50 Cc1noc(Cl)c1Cl Amb27593904 [0,1,0,1,0,0|2,0,0]=4 4646 B8R1.50 Cc1noc(N)c1Br Amb10602829 [0,1,0,1,0,0|2,0,0]=4 4647 B8R1.50 Cc1noc(N)c1C Amb2725480 [0,1,0,1,0,0|1,0,0]=3 4648 B8R1.50 Cc1noc(N)c1Cl Amb3205409 [0,1,0,1,0,0|2,0,0]=4 4649 B8R1.50 Cc1noc(N)c1I Amb6892949 [0,1,0,1,0,0|2,0,0]=4 4650 B8R1.50 Cc1noc(O)c1Cl Amb26505435 [0,1,0,1,0,0|1,0,1]=4 4651 B8R1.50 Cc1onc(Br)c1C Amb2455737 [0,1,0,1,0,0|1,0,0]=3 4652 B8R1.50 Cc1onc(Br)c1N Amb35747976 [0,1,0,1,0,0|2,0,0]=4 4653 B8R1.50 Cc1onc(Br)c1N Amb35748095 [0,1,0,1,0,0|2,0,0]=4 4654 B8R1.50 Cc1onc(Cl)c1C Amb23537388 [0,1,0,1,0,0|1,0,0]=3 4655 B8R1.50 Cc1onc(N)c1Br Amb2684358 [0,1,0,1,0,0|2,0,0]=4 4656 B8R1.50 Cc1onc(N)c1C Amb32661289 [0,1,0,1,0,0|1,0,0]=3 4657 B8R1.50 Cc1onc(N)c1C Amb9787036 [0,1,0,1,0,0|1,0,0]=3 4658 B8R1.50 Cc1onc(N)c1Cl Amb17621525 [0,1,0,1,0,0|2,0,0]=4 4659 B8R1.50 Cc1onc(N)c1I Amb10068335 [0,1,0,1,0,0|2,0,0]=4 4660 B8R1.50 Cc1onc(O)c1Br Amb21896415 [0,1,0,1,0,0|1,0,1]=4 4661 B8R1.50 Cc1onc(O)c1C Amb10552497 [0,1,0,1,0,0|0,0,1]=3 4662 B8R1.50 Cc1scc(Br)c1C Amb25076813 [0,1,0,1,0,0|1,1,0]=4 4663 B8R1.50 Cc1scc(N)c1C Amb9132576 [0,1,0,1,0,0|1,1,0]=4 4664 B8R1.50 Cc1snc(O)c1Br Amb2420513 [0,1,0,1,0,0|1,1,0]=4 4665 B8R1.50 N=C1COC(=O)C1N Amb27839054 [0,1,0,1,0,0|1,0,1]=4 4666 B8R1.50 NC1=C(O)CCC1=O Amb27203866 [0,1,0,1,0,0|2,0,0]=4 4667 B8R1.50 NC1=C(O)COC1=O Amb27830449 [0,1,0,1,0,0|1,0,0]=3 4668 B8R1.50 O=C1CCC(Br)=C1O Amb24677469 [0,1,0,1,0,0|1,0,1]=4 4669 B8R1.50 O=C1CCC(Cl)=C1Cl Amb27409520 [0,1,0,1,0,0|2,0,0]=4 4670 B8R1.50 O=C1CCC(Cl)=C1O Amb28316155 [0,1,0,1,0,0|1,0,1]=4 4671 B8R1.50 O=C1CCC(O)=C1Br Amb25205766 [0,1,0,1,0,0|2,0,0]=4 4672 B8R1.50 O=C1CCC(O)=C1O Amb17593179 [0,1,0,1,0,0|1,0,1]=4 4673 B8R1.50 O=C1COC(=O)C1Br Amb17594578 [0,1,0,1,0,0|1,0,1]=4 4674 B8R1.50 O=C1COC(=O)C1Cl Amb534802 [0,1,0,1,0,0|1,0,1]=4 4675 B8R1.50 O=C1NCC(O)=C1O Amb27815039 [0,1,0,1,0,0|2,0,0]=4 4676 B8R1.50 O=C1OCC(Br)=C1Br Amb10067289 [0,1,0,1,0,0|1,0,0]=3 4677 B8R1.50 O=C1OCC(Cl)=C1Cl Amb24551013 [0,1,0,1,0,0|1,0,0]=3 4678 B8R1.50 O=C1OCC(O)=C1Br Amb5751200 [0,1,0,1,0,0|1,0,0]=3 4679 B8R1.50 O=C1OCC(O)=C1F Amb27812981 [0,1,0,1,0,0|1,0,0]=3 4680 B8R1.50 O=C1OCC(O)=C1O Amb23505710 [0,1,0,1,0,0|1,0,0]=3 4681 B8R1.63 C=CC1(C(=O)O)CC1 Amb28314261 [0,1,0,1,0,0|0,0,2]=4 4682 B8R1.63 CCC1(C(=O)O)CC1 Amb18560530 [0,1,0,1,0,0|0,0,2]=4 4683 B8R1.63 CNC1(C(=O)O)CC1 Amb22757078 [0,1,0,1,0,0|0,0,2]=4 4684 B8R1.63 CNC1(C(=O)O)CC1 Amb27413357 [0,1,0,1,0,0|0,0,2]=4 4685 B8R1.63 CNC1(C(=O)O)CC1 Amb31157030 [0,1,0,1,0,0|0,0,2]=4 4686 B8R1.63 COC1(C(=O)O)CC1 Amb24358755 [0,1,0,1,0,0|0,0,2]=4 4687 B8R1.63 CSC1(C(=O)O)CC1 Amb24481335 [0,1,0,1,0,0|0,0,2]=4 4688 B8R1.63 NCC1(C(=O)O)CC1 Amb10607863 [0,1,0,1,0,0|0,0,2]=4 4689 B8R1.63 NCC1(C(=O)O)CC1 Amb21959700 [0,1,0,1,0,0|0,0,2]=4 4690 B8R1.63 O=C(O)C1(CBr)CC1 Amb26586671 [0,1,0,1,0,0|0,0,2]=4 4691 B8R1.63 O=C(O)C1(CF)CC1 Amb24054902 [0,1,0,1,0,0|0,0,2]=4 4692 B8R1.63 O=C(O)C1(CO)CC1 Amb33545077 [0,1,0,1,0,0|0,0,2]=4 4693 B8R1.63 O=C(O)C1(CS)CC1 Amb27950685 [0,1,0,1,0,0|0,0,2]=4 4694 B8R1.63 O=C(O)[C@@]1(CF)CO1 Amb28128326 [0,1,0,1,0,0|1,0,1]=4 4695 B8R1.63 O=CC1(C(=O)O)CC1 Amb33544742 [0,1,0,1,0,0|1,0,1]=4 4696 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [0,1,0,1,0,0|0,0,2]=4 4697 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [0,1,0,1,0,0|0,0,2]=4 4698 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [0,1,0,1,0,0|0,0,2]=4 4699 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [0,1,0,1,0,0|0,0,2]=4 4700 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,2,0,0|0,0,2]=4 4701 B8R2.38 O=C1OC[C@H]2C[C@@H]12 Amb27421949 [0,0,0,2,0,0|0,0,2]=4 4702 B8R2.66 O=C(O)C12CC1C2 Amb24732235 [0,0,0,2,0,0|0,0,2]=4 4703 B8R0.9 C=C(C=O)CCC(=O)O Amb27655564 [0,0,0,0,0,2|1,0,1]=4 4704 B8R0.9 C=C(\C=C\C(=O)O)CC Amb27229488 [0,0,0,0,0,2|0,0,2]=4 4705 B8R0.9 C=CC(=C)CCC(=O)O Amb18642412 [0,0,0,0,0,2|0,0,2]=4 4706 B8R0.9 C=CC(=O)NCC(=O)O Amb33532656 [0,0,0,0,0,2|1,0,1]=4 4707 B8R0.9 C=CC(=O)OCC(=O)O Amb27241348 [0,0,0,0,0,2|1,0,1]=4 4708 B8R0.9 C=CC(=O)SCC(=O)O Amb27755823 [0,0,0,0,0,2|1,0,1]=4 4709 B8R0.9 C=CC(C)OCC(=O)O Amb18642764 [0,0,0,0,0,2|0,0,2]=4 4710 B8R0.9 C=C\C(C)=C\CC(=O)O Amb33276241 [0,0,0,0,0,2|0,0,1]=3 4711 B8R0.9 CC(=O)N\C=C(\C)C=O Amb18642508 [0,0,0,0,0,2|2,0,0]=4 4712 B8R0.9 CC(=O)OC\C(C)=C/Cl Amb27793522 [0,0,0,0,0,2|2,0,0]=4 4713 B8R0.9 CC(=O)OC\C(C)=C\Br Amb27803059 [0,0,0,0,0,2|2,0,0]=4 4714 B8R0.9 CC(=O)O\C=C(\C)C=O Amb27966540 [0,0,0,0,0,2|2,0,0]=4 4715 B8R0.9 CC(\C=C\C(=O)O)=C/Br Amb27650571 [0,0,0,0,0,2|1,0,0]=3 4716 B8R0.9 CCC(=N)SCC(=O)O Amb27412807 [0,0,0,0,0,2|1,0,1]=4 4717 B8R0.9 CCC(=O)CCC(=O)O Amb2099579 [0,0,0,0,0,2|1,0,1]=4 4718 B8R0.9 CCC(=O)NCC(=O)O Amb1120037 [0,0,0,0,0,2|1,0,1]=4 4719 B8R0.9 CCC(=O)\C=C/C(=O)O Amb27838748 [0,0,0,0,0,2|1,0,1]=4 4720 B8R0.9 CCC(=O)\C=C\C(=O)O Amb18642585 [0,0,0,0,0,2|1,0,1]=4 4721 B8R0.9 CCC(C)C#CC(=O)O Amb28145990 [0,0,0,0,0,2|0,0,2]=4 4722 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,0,0,0,0,2|0,0,2]=4 4723 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,0,0,0,0,2|0,0,2]=4 4724 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,0,0,0,0,2|0,0,2]=4 4725 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,0,0,0,0,2|0,0,2]=4 4726 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,0,0,0,0,2|0,0,2]=4 4727 B8R0.9 CCC(C)\C=C\C(=O)O Amb33171963 [0,0,0,0,0,2|0,0,2]=4 4728 B8R0.9 CCN(C)CCC(=O)O Amb8428205 [0,0,0,0,0,2|1,0,1]=4 4729 B8R0.9 CCN(C)CCC(=O)O Amb8890954 [0,0,0,0,0,2|1,0,1]=4 4730 B8R0.9 CC[C@@H](C)C#CC(=O)O Amb27975780 [0,0,0,0,0,2|0,0,2]=4 4731 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,0,0,0,0,2|0,0,2]=4 4732 B8R0.9 CC[C@@H](C)\C=C\C(=O)O Amb24117189 [0,0,0,0,0,2|0,0,2]=4 4733 B8R0.9 CC[C@H](C)C#CC(=O)O Amb28132200 [0,0,0,0,0,2|0,0,2]=4 4734 B8R0.9 CC\C(C)=C\CC(=O)O Amb22011800 [0,0,0,0,0,2|0,0,1]=3 4735 B8R0.9 CC\C(C)=N/NC(N)=O Amb2612373 [0,0,0,0,0,2|1,0,1]=4 4736 B8R0.9 CNC(=O)CCC(=O)O Amb2720937 [0,0,0,0,0,2|2,0,0]=4 4737 B8R0.9 CNC(=O)NCC(=O)O Amb1130948 [0,0,0,0,0,2|2,0,0]=4 4738 B8R0.9 CNC(=O)OCC(=O)O Amb30018932 [0,0,0,0,0,2|2,0,0]=4 4739 B8R0.9 CNC(=O)\C=C/C(=O)O Amb2720469 [0,0,0,0,0,2|2,0,0]=4 4740 B8R0.9 CNC(=O)\C=C\C(=O)O Amb9277097 [0,0,0,0,0,2|2,0,0]=4 4741 B8R0.9 CNC(=S)NCC(=O)O Amb4044376 [0,0,0,0,0,2|2,0,0]=4 4742 B8R0.9 COC(=O)CCC(=O)O Amb6538024 [0,0,0,0,0,2|2,0,0]=4 4743 B8R0.9 COC(=O)NCC(=O)O Amb3941451 [0,0,0,0,0,2|2,0,0]=4 4744 B8R0.9 COC(=O)OCC(=O)O Amb8393899 [0,0,0,0,0,2|2,0,0]=4 4745 B8R0.9 COC(=O)\C=C/C(=O)O Amb6295872 [0,0,0,0,0,2|2,0,0]=4 4746 B8R0.9 COC(=O)\C=C\C(=O)O Amb33511119 [0,0,0,0,0,2|2,0,0]=4 4747 B8R0.9 COC(=S)SCC(=O)O Amb26653180 [0,0,0,0,0,2|2,0,0]=4 4748 B8R0.9 COC(C)CCC(=O)O Amb24271104 [0,0,0,0,0,2|1,0,1]=4 4749 B8R0.9 COC(C)\C=C\C(=O)O Amb27203687 [0,0,0,0,0,2|1,0,1]=4 4750 B8R0.9 CON(C)CCC(=O)O Amb27881744 [0,0,0,0,0,2|2,0,0]=4 4751 B8R0.9 CON(C)\C=C\C(=O)O Amb35734889 [0,0,0,0,0,2|2,0,0]=4 4752 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [0,0,0,0,0,2|1,0,1]=4 4753 B8R0.9 CO\C(C)=C\CC(=O)O Amb27963206 [0,0,0,0,0,2|1,0,0]=3 4754 B8R0.9 CSC(C)CCC(=O)O Amb22059071 [0,0,0,0,0,2|1,0,1]=4 4755 B8R0.9 C\C(C#N)=C\CC(=O)O Amb27196398 [0,0,0,0,0,2|1,0,1]=4 4756 B8R0.9 C\C(C=O)=N/NC(N)=O Amb27769079 [0,0,0,0,0,2|2,0,0]=4 4757 B8R0.9 C\C(CCC(=O)O)=N/O Amb25138471 [0,0,0,0,0,2|2,0,0]=4 4758 B8R0.9 C\C=C(C)/C=C/C(=O)O Amb27838460 [0,0,0,0,0,2|0,0,0]=2 4759 B8R0.9 C\C=C(C)/C=C/C(C)=O Amb27428251 [0,0,0,0,0,2|1,0,0]=3 4760 B8R0.9 C\C=C(C)\C=C/C(C)=O Amb28199822 [0,0,0,0,0,2|1,0,0]=3 4761 B8R0.9 C\C=C(C)\C=C\C(=O)O Amb18642399 [0,0,0,0,0,2|0,0,0]=2 4762 B8R0.9 C\C=C(Cl)\C=C\C(=O)O Amb28137785 [0,0,0,0,0,2|1,0,0]=3 4763 B8R0.9 C\C=C(F)\C=C\C(=O)O Amb27826588 [0,0,0,0,0,2|1,0,0]=3 4764 B8R0.9 C\C=C(\C)C#CC(C)O Amb27956625 [0,0,0,0,0,2|1,0,1]=4 4765 B8R0.9 C\C=C(\C)CCC(C)=O Amb24610198 [0,0,0,0,0,2|1,0,0]=3 4766 B8R0.9 C\C=C(\C)OCC(C)=O Amb27844138 [0,0,0,0,0,2|1,0,0]=3 4767 B8R0.9 O=C(O)CS\C(Cl)=C\Cl Amb27858758 [0,0,0,0,0,2|2,0,0]=4 4768 B8R0.9 O=CC(=O)CCC(=O)O Amb18642737 [0,0,0,0,0,2|2,0,0]=4