0 B7R1.4 Brc1ccoc1Br Amb6366140 [0,0,0,0,0,0|4,0,0]=4 1 B7R1.4 Brc1ccoc1I Amb26608371 [0,0,0,0,0,0|4,0,0]=4 2 B7R1.4 Brc1ccsc1Br Amb2237068 [0,0,0,0,0,0|4,0,0]=4 3 B7R1.4 Brc1ccsc1I Amb20620492 [0,0,0,0,0,0|4,0,0]=4 4 B7R1.4 Brc1sccc1I Amb20620493 [0,0,0,0,0,0|4,0,0]=4 5 B7R1.4 CC1=CCCC1=O Amb8514958 [0,0,0,0,0,0|2,1,1]=4 6 B7R1.4 CC1=CCCN1C Amb17938859 [0,0,0,0,0,0|2,0,2]=4 7 B7R1.4 CC1=CCN=C1C Amb27463558 [0,0,0,0,0,0|2,0,2]=4 8 B7R1.4 CC1=CCNC1C Amb27975662 [0,0,0,0,0,0|2,0,2]=4 9 B7R1.4 CC1=CCOC1=O Amb16231256 [0,0,0,0,0,0|2,1,1]=4 10 B7R1.4 CC1=CCSC1=S Amb27633752 [0,0,0,0,0,0|2,0,1]=3 11 B7R1.4 CC1=NCCN1C Amb28456778 [0,0,0,0,0,0|1,0,3]=4 12 B7R1.4 CC1=NONC1=N Amb22081472 [0,0,0,0,0,0|4,0,0]=4 13 B7R1.4 CC1C=CCC1C Amb27454828 [0,0,0,0,0,0|3,0,1]=4 14 B7R1.4 CC1C=CCC1O Amb28324626 [0,0,0,0,0,0|2,1,1]=4 15 B7R1.4 CC1C=COC1=O Amb27862334 [0,0,0,0,0,0|2,1,0]=3 16 B7R1.4 CC1C=NNC1=O Amb22232312 [0,0,0,0,0,0|2,1,0]=3 17 B7R1.4 CC1CCCC1=S Amb27483022 [0,0,0,0,0,0|2,0,2]=4 18 B7R1.4 CC1CCNC1=O Amb10603701 [0,0,0,0,0,0|1,1,2]=4 19 B7R1.4 CC1CN=CN1C Amb29888704 [0,0,0,0,0,0|3,0,1]=4 20 B7R1.4 CC1CNNC1=O Amb27228083 [0,0,0,0,0,0|2,1,1]=4 21 B7R1.4 CC1CONC1=O Amb33714888 [0,0,0,0,0,0|2,1,1]=4 22 B7R1.4 CC1NC=CC1=O Amb28201187 [0,0,0,0,0,0|3,0,1]=4 23 B7R1.4 CC1NCCN1C Amb27805583 [0,0,0,0,0,0|1,0,3]=4 24 B7R1.4 CC1OC=CC1=O Amb28053998 [0,0,0,0,0,0|3,1,0]=4 25 B7R1.4 CC1OCNC1=O Amb28046854 [0,0,0,0,0,0|2,1,1]=4 26 B7R1.4 CC1SCCC1=S Amb27792245 [0,0,0,0,0,0|3,0,1]=4 27 B7R1.4 CC1SCNC1=O Amb27211661 [0,0,0,0,0,0|2,1,1]=4 28 B7R1.4 CN1C=CNC1=O Amb20622459 [0,0,0,0,0,0|0,1,0]=1 29 B7R1.4 CN1C=CNC1=S Amb18542352 [0,0,0,0,0,0|0,0,0]=0 30 B7R1.4 CN1C=CSC1=N Amb19748668 [0,0,0,0,0,0|2,0,0]=2 31 B7R1.4 CN1C=CSC1=N Amb25788845 [0,0,0,0,0,0|2,0,0]=2 32 B7R1.4 CN1C=CSC1=[NH2+] Amb21933047 [0,0,0,0,0,0|2,0,0]=2 33 B7R1.4 CN1C=NCC1Br Amb27864430 [0,0,0,0,0,0|3,0,1]=4 34 B7R1.4 CN1CC=CC1=N Amb27850064 [0,0,0,0,0,0|2,0,1]=3 35 B7R1.4 CN1CC=CC1=O Amb22372248 [0,0,0,0,0,0|1,1,1]=3 36 B7R1.4 CN1CCCC1=N Amb20669437 [0,0,0,0,0,0|2,0,2]=4 37 B7R1.4 CN1CCCC1=O Amb22493780 [0,0,0,0,0,0|1,1,2]=4 38 B7R1.4 CN1CCCC1=O Amb6608842 [0,0,0,0,0,0|1,1,2]=4 39 B7R1.4 CN1CCCC1=S Amb10562641 [0,0,0,0,0,0|1,0,2]=3 40 B7R1.4 CN1CCN=C1N Amb18639451 [0,0,0,0,0,0|1,0,3]=4 41 B7R1.4 CN1CCN=C1N Amb32412656 [0,0,0,0,0,0|1,0,3]=4 42 B7R1.4 CN1CCN=C1N Amb6383421 [0,0,0,0,0,0|1,0,3]=4 43 B7R1.4 CN1CCN=C1S Amb8387135 [0,0,0,0,0,0|0,0,4]=4 44 B7R1.4 CN1CCNC1=O Amb5718647 [0,0,0,0,0,0|0,1,2]=3 45 B7R1.4 CN1CCNC1=S Amb2720707 [0,0,0,0,0,0|0,0,2]=2 46 B7R1.4 CN1CCOC1=O Amb22347786 [0,0,0,0,0,0|1,1,2]=4 47 B7R1.4 CN1CCSC1=N Amb3318644 [0,0,0,0,0,0|2,0,2]=4 48 B7R1.4 CN1CCSC1=N Amb4286381 [0,0,0,0,0,0|2,0,2]=4 49 B7R1.4 CN1CCSC1=S Amb17845152 [0,0,0,0,0,0|1,0,2]=3 50 B7R1.4 CN1CNC=C1N Amb27251521 [0,0,0,0,0,0|3,0,1]=4 51 B7R1.4 CN1CNCC1=O Amb26582942 [0,0,0,0,0,0|2,1,1]=4 52 B7R1.4 CN1CNCC1=O Amb28827643 [0,0,0,0,0,0|2,1,1]=4 53 B7R1.4 CN1N=CCC1=O Amb22233815 [0,0,0,0,0,0|2,1,0]=3 54 B7R1.4 CN1N=NNC1=O Amb22757905 [0,0,0,0,0,0|2,1,0]=3 55 B7R1.4 CN1NC=CC1=O Amb22002214 [0,0,0,0,0,0|2,1,0]=3 56 B7R1.4 CN1NCCC1=O Amb18559311 [0,0,0,0,0,0|2,1,1]=4 57 B7R1.4 CN1NN=NC1=S Amb19133221 [0,0,0,0,0,0|2,0,1]=3 58 B7R1.4 CN1SC=CC1=O Amb19133167 [0,0,0,0,0,0|2,1,0]=3 59 B7R1.4 CN1SC=CC1=O Amb20239425 [0,0,0,0,0,0|2,1,0]=3 60 B7R1.4 CN1SC=CC1=O Amb31289633 [0,0,0,0,0,0|2,1,0]=3 61 B7R1.4 CN1SC=CC1O Amb27198022 [0,0,0,0,0,0|2,1,1]=4 62 B7R1.4 C[C@@H]1C=CC[C@H]1C Amb25957944 [0,0,0,0,0,0|3,0,1]=4 63 B7R1.4 C[C@@H]1C=CC[C@H]1O Amb27486253 [0,0,0,0,0,0|2,1,1]=4 64 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [0,0,0,0,0,0|1,1,2]=4 65 B7R1.4 C[C@@H]1N=CN[C@H]1C Amb28129367 [0,0,0,0,0,0|3,0,1]=4 66 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [0,0,0,0,0,0|1,1,2]=4 67 B7R1.4 C[n+]1sccc1N Amb28320731 [0,0,0,0,0,0|3,0,1]=4 68 B7R1.4 Cc1cccn1C Amb2447020 [0,0,0,0,0,0|2,0,0]=2 69 B7R1.4 Cc1ccnn1C Amb1945868 [0,0,0,0,0,0|3,0,0]=3 70 B7R1.4 Cc1ccoc1C Amb8515826 [0,0,0,0,0,0|3,0,0]=3 71 B7R1.4 Cc1ccoc1O Amb33343228 [0,0,0,0,0,0|2,1,0]=3 72 B7R1.4 Cc1ccoc1S Amb27613044 [0,0,0,0,0,0|2,0,1]=3 73 B7R1.4 Cc1ccsc1Br Amb2236394 [0,0,0,0,0,0|3,0,0]=3 74 B7R1.4 Cc1ccsc1C Amb2447413 [0,0,0,0,0,0|3,0,0]=3 75 B7R1.4 Cc1ccsc1Cl Amb8396573 [0,0,0,0,0,0|3,0,0]=3 76 B7R1.4 Cc1ccsc1F Amb27459925 [0,0,0,0,0,0|3,0,0]=3 77 B7R1.4 Cc1ccsc1I Amb22898804 [0,0,0,0,0,0|3,0,0]=3 78 B7R1.4 Cc1ccsc1N Amb18679496 [0,0,0,0,0,0|3,0,0]=3 79 B7R1.4 Cc1ccsc1O Amb24639732 [0,0,0,0,0,0|2,1,0]=3 80 B7R1.4 Cc1ccsc1S Amb25747282 [0,0,0,0,0,0|2,0,1]=3 81 B7R1.4 Cc1cncn1C Amb22044022 [0,0,0,0,0,0|3,0,0]=3 82 B7R1.4 Cc1cnoc1C Amb4007674 [0,0,0,0,0,0|4,0,0]=4 83 B7R1.4 Cc1cnoc1Cl Amb28313653 [0,0,0,0,0,0|4,0,0]=4 84 B7R1.4 Cc1cnoc1N Amb18943767 [0,0,0,0,0,0|4,0,0]=4 85 B7R1.4 Cc1cnoc1O Amb25064746 [0,0,0,0,0,0|3,1,0]=4 86 B7R1.4 Cc1cnsc1Br Amb2616664 [0,0,0,0,0,0|4,0,0]=4 87 B7R1.4 Cc1cocc1C Amb17613311 [0,0,0,0,0,0|4,0,0]=4 88 B7R1.4 Cc1cocc1F Amb27971160 [0,0,0,0,0,0|4,0,0]=4 89 B7R1.4 Cc1cocc1I Amb24630674 [0,0,0,0,0,0|4,0,0]=4 90 B7R1.4 Cc1conc1C Amb27468671 [0,0,0,0,0,0|3,0,1]=4 91 B7R1.4 Cc1conc1N Amb18278180 [0,0,0,0,0,0|3,0,1]=4 92 B7R1.4 Cc1cscc1Br Amb2447459 [0,0,0,0,0,0|4,0,0]=4 93 B7R1.4 Cc1cscc1C Amb2782126 [0,0,0,0,0,0|4,0,0]=4 94 B7R1.4 Cc1cscc1I Amb27967883 [0,0,0,0,0,0|4,0,0]=4 95 B7R1.4 Cc1cscc1N Amb18833058 [0,0,0,0,0,0|4,0,0]=4 96 B7R1.4 Cc1cscc1N Amb20667756 [0,0,0,0,0,0|4,0,0]=4 97 B7R1.4 Cc1cscc1N Amb22234035 [0,0,0,0,0,0|4,0,0]=4 98 B7R1.4 Cc1cscc1O Amb26458243 [0,0,0,0,0,0|3,1,0]=4 99 B7R1.4 Cc1cscc1S Amb28239564 [0,0,0,0,0,0|3,0,1]=4 100 B7R1.4 Cc1csnc1Br Amb22490966 [0,0,0,0,0,0|3,0,1]=4 101 B7R1.4 Cc1nccn1C Amb2455761 [0,0,0,0,0,0|1,0,1]=2 102 B7R1.4 Cc1nccn1N Amb26062576 [0,0,0,0,0,0|2,0,1]=3 103 B7R1.4 Cc1nccn1O Amb27210147 [0,0,0,0,0,0|2,0,1]=3 104 B7R1.4 Cc1ncoc1Br Amb26896749 [0,0,0,0,0,0|4,0,0]=4 105 B7R1.4 Cc1ncoc1Br Amb33546754 [0,0,0,0,0,0|4,0,0]=4 106 B7R1.4 Cc1ncoc1C Amb22396059 [0,0,0,0,0,0|3,0,1]=4 107 B7R1.4 Cc1ncoc1N Amb22234804 [0,0,0,0,0,0|4,0,0]=4 108 B7R1.4 Cc1ncsc1Br Amb10067879 [0,0,0,0,0,0|4,0,0]=4 109 B7R1.4 Cc1ncsc1C Amb2687623 [0,0,0,0,0,0|3,0,1]=4 110 B7R1.4 Cc1ncsc1I Amb32685565 [0,0,0,0,0,0|4,0,0]=4 111 B7R1.4 Cc1ncsc1N Amb18943427 [0,0,0,0,0,0|4,0,0]=4 112 B7R1.4 Cc1ncsc1N Amb28555342 [0,0,0,0,0,0|4,0,0]=4 113 B7R1.4 Cc1ncsc1O Amb25268351 [0,0,0,0,0,0|3,1,0]=4 114 B7R1.4 Cc1ncsc1S Amb27184569 [0,0,0,0,0,0|3,0,1]=4 115 B7R1.4 Cc1nncn1C Amb9677417 [0,0,0,0,0,0|2,0,1]=3 116 B7R1.4 Cc1nncn1N Amb15701461 [0,0,0,0,0,0|3,0,1]=4 117 B7R1.4 Cc1nncn1N Amb19889144 [0,0,0,0,0,0|3,0,1]=4 118 B7R1.4 Cc1nnnn1C Amb16203809 [0,0,0,0,0,0|3,0,1]=4 119 B7R1.4 Cc1occc1Br Amb6572125 [0,0,0,0,0,0|4,0,0]=4 120 B7R1.4 Cc1occc1N Amb18203072 [0,0,0,0,0,0|4,0,0]=4 121 B7R1.4 Cc1occc1O Amb25178728 [0,0,0,0,0,0|3,1,0]=4 122 B7R1.4 Cc1occc1S Amb8393173 [0,0,0,0,0,0|3,0,1]=4 123 B7R1.4 Cc1ocnc1Br Amb24357642 [0,0,0,0,0,0|3,0,1]=4 124 B7R1.4 Cc1ocnc1Br Amb35748154 [0,0,0,0,0,0|3,0,1]=4 125 B7R1.4 Cc1sccc1Br Amb8393327 [0,0,0,0,0,0|4,0,0]=4 126 B7R1.4 Cc1sccc1Cl Amb27412961 [0,0,0,0,0,0|4,0,0]=4 127 B7R1.4 Cc1sccc1F Amb27607081 [0,0,0,0,0,0|4,0,0]=4 128 B7R1.4 Cc1sccc1I Amb27661837 [0,0,0,0,0,0|4,0,0]=4 129 B7R1.4 Cc1sccc1N Amb18833056 [0,0,0,0,0,0|4,0,0]=4 130 B7R1.4 Cc1sccc1N Amb22276099 [0,0,0,0,0,0|4,0,0]=4 131 B7R1.4 Cc1sccc1O Amb26621113 [0,0,0,0,0,0|3,1,0]=4 132 B7R1.4 Cc1scnc1Br Amb18824935 [0,0,0,0,0,0|3,0,1]=4 133 B7R1.4 Cc1scnc1N Amb23504020 [0,0,0,0,0,0|3,0,1]=4 134 B7R1.4 Cc1scnc1N Amb32668593 [0,0,0,0,0,0|3,0,1]=4 135 B7R1.4 Clc1ccsc1Br Amb5720097 [0,0,0,0,0,0|4,0,0]=4 136 B7R1.4 Clc1ccsc1Cl Amb2694396 [0,0,0,0,0,0|4,0,0]=4 137 B7R1.4 Clc1ccsc1I Amb25169530 [0,0,0,0,0,0|4,0,0]=4 138 B7R1.4 Clc1sccc1Br Amb2722493 [0,0,0,0,0,0|4,0,0]=4 139 B7R1.4 Cn1cccc1Br Amb18199426 [0,0,0,0,0,0|2,0,0]=2 140 B7R1.4 Cn1cccc1Cl Amb25212184 [0,0,0,0,0,0|2,0,0]=2 141 B7R1.4 Cn1cccc1I Amb24756601 [0,0,0,0,0,0|2,0,0]=2 142 B7R1.4 Cn1cccc1O Amb27652694 [0,0,0,0,0,0|1,1,0]=2 143 B7R1.4 Cn1cccc1S Amb25888537 [0,0,0,0,0,0|1,0,1]=2 144 B7R1.4 Cn1ccnc1Br Amb10068557 [0,0,0,0,0,0|1,0,1]=2 145 B7R1.4 Cn1ccnc1Br Amb10072116 [0,0,0,0,0,0|1,0,1]=2 146 B7R1.4 Cn1ccnc1Cl Amb10067351 [0,0,0,0,0,0|1,0,1]=2 147 B7R1.4 Cn1ccnc1F Amb33527039 [0,0,0,0,0,0|1,0,1]=2 148 B7R1.4 Cn1ccnc1F Amb8393432 [0,0,0,0,0,0|1,0,1]=2 149 B7R1.4 Cn1ccnc1I Amb2611265 [0,0,0,0,0,0|1,0,1]=2 150 B7R1.4 Cn1ccnc1N Amb22036573 [0,0,0,0,0,0|1,0,1]=2 151 B7R1.4 Cn1ccnc1N Amb22587602 [0,0,0,0,0,0|1,0,1]=2 152 B7R1.4 Cn1ccnc1N Amb8439274 [0,0,0,0,0,0|1,0,1]=2 153 B7R1.4 Cn1ccnc1S Amb1934346 [0,0,0,0,0,0|0,0,2]=2 154 B7R1.4 Cn1cncc1Br Amb2455854 [0,0,0,0,0,0|3,0,0]=3 155 B7R1.4 Cn1cncc1Cl Amb1158251 [0,0,0,0,0,0|3,0,0]=3 156 B7R1.4 Cn1cncc1Cl Amb20246711 [0,0,0,0,0,0|3,0,0]=3 157 B7R1.4 Cn1cncc1Cl Amb8628162 [0,0,0,0,0,0|3,0,0]=3 158 B7R1.4 Cn1cncc1F Amb24615838 [0,0,0,0,0,0|3,0,0]=3 159 B7R1.4 Cn1cncc1I Amb2455720 [0,0,0,0,0,0|3,0,0]=3 160 B7R1.4 Cn1cncc1N Amb18639036 [0,0,0,0,0,0|3,0,0]=3 161 B7R1.4 Cn1cncc1N Amb22263929 [0,0,0,0,0,0|3,0,0]=3 162 B7R1.4 Cn1cncc1O Amb27436828 [0,0,0,0,0,0|2,1,0]=3 163 B7R1.4 Cn1cnnc1Br Amb21964557 [0,0,0,0,0,0|2,0,1]=3 164 B7R1.4 Cn1cnnc1Cl Amb22059051 [0,0,0,0,0,0|2,0,1]=3 165 B7R1.4 Cn1cnnc1I Amb25922076 [0,0,0,0,0,0|2,0,1]=3 166 B7R1.4 Cn1cnnc1N Amb22491659 [0,0,0,0,0,0|2,0,1]=3 167 B7R1.4 Cn1cnnc1N Amb24271073 [0,0,0,0,0,0|2,0,1]=3 168 B7R1.4 Cn1cnnc1N Amb2477105 [0,0,0,0,0,0|2,0,1]=3 169 B7R1.4 Cn1cnnc1O Amb22157280 [0,0,0,0,0,0|1,1,1]=3 170 B7R1.4 Cn1cnnc1S Amb1042030 [0,0,0,0,0,0|1,0,2]=3 171 B7R1.4 Cn1nccc1Br Amb10603813 [0,0,0,0,0,0|3,0,0]=3 172 B7R1.4 Cn1nccc1Cl Amb24622347 [0,0,0,0,0,0|3,0,0]=3 173 B7R1.4 Cn1nccc1F Amb24269140 [0,0,0,0,0,0|3,0,0]=3 174 B7R1.4 Cn1nccc1I Amb7990079 [0,0,0,0,0,0|3,0,0]=3 175 B7R1.4 Cn1nccc1N Amb21890197 [0,0,0,0,0,0|3,0,0]=3 176 B7R1.4 Cn1nccc1N Amb535304 [0,0,0,0,0,0|3,0,0]=3 177 B7R1.4 Cn1nccc1O Amb13883681 [0,0,0,0,0,0|2,1,0]=3 178 B7R1.4 Cn1nccc1O Amb22233838 [0,0,0,0,0,0|2,1,0]=3 179 B7R1.4 Cn1nccc1S Amb28248390 [0,0,0,0,0,0|2,0,1]=3 180 B7R1.4 Cn1ncnc1Br Amb18829621 [0,0,0,0,0,0|2,0,1]=3 181 B7R1.4 Cn1ncnc1Cl Amb19517097 [0,0,0,0,0,0|2,0,1]=3 182 B7R1.4 Cn1ncnc1I Amb27982937 [0,0,0,0,0,0|2,0,1]=3 183 B7R1.4 Cn1ncnc1N Amb1043991 [0,0,0,0,0,0|2,0,1]=3 184 B7R1.4 Cn1ncnc1O Amb24756842 [0,0,0,0,0,0|1,1,1]=3 185 B7R1.4 Cn1ncnc1S Amb27166787 [0,0,0,0,0,0|1,0,2]=3 186 B7R1.4 Cn1nncc1Br Amb27153322 [0,0,0,0,0,0|4,0,0]=4 187 B7R1.4 Cn1nncc1I Amb19516174 [0,0,0,0,0,0|4,0,0]=4 188 B7R1.4 Cn1nncc1N Amb26967177 [0,0,0,0,0,0|4,0,0]=4 189 B7R1.4 Cn1nncc1S Amb27802007 [0,0,0,0,0,0|3,0,1]=4 190 B7R1.4 Cn1nnnc1Br Amb25215946 [0,0,0,0,0,0|3,0,1]=4 191 B7R1.4 Cn1nnnc1Cl Amb13951154 [0,0,0,0,0,0|3,0,1]=4 192 B7R1.4 Cn1nnnc1F Amb30017688 [0,0,0,0,0,0|3,0,1]=4 193 B7R1.4 Cn1nnnc1I Amb10669474 [0,0,0,0,0,0|3,0,1]=4 194 B7R1.4 Cn1nnnc1N Amb6315767 [0,0,0,0,0,0|3,0,1]=4 195 B7R1.4 Cn1nnnc1S Amb1934345 [0,0,0,0,0,0|2,0,2]=4 196 B7R1.4 Cn1nnnc1[S-] Amb15740825 [0,0,0,0,0,0|2,0,2]=4 197 B7R1.4 Cn1nnnc1[S-] Amb19748278 [0,0,0,0,0,0|2,0,2]=4 198 B7R1.4 Fc1ccoc1Br Amb18199675 [0,0,0,0,0,0|4,0,0]=4 199 B7R1.4 Fc1ccoc1F Amb27877614 [0,0,0,0,0,0|4,0,0]=4 200 B7R1.4 Fc1ccsc1Br Amb18522293 [0,0,0,0,0,0|4,0,0]=4 201 B7R1.4 Fc1ccsc1F Amb24562839 [0,0,0,0,0,0|4,0,0]=4 202 B7R1.4 Fc1sccc1Br Amb25802858 [0,0,0,0,0,0|4,0,0]=4 203 B7R1.4 NC1=CNNC1=O Amb24120355 [0,0,0,0,0,0|3,1,0]=4 204 B7R1.4 NC1=CNNC1=O Amb28827627 [0,0,0,0,0,0|3,1,0]=4 205 B7R1.4 NC1=CONC1=O Amb18203033 [0,0,0,0,0,0|3,1,0]=4 206 B7R1.4 NC1C=NNC1=O Amb18202634 [0,0,0,0,0,0|3,1,0]=4 207 B7R1.4 NN1C=NNC1=O Amb18548408 [0,0,0,0,0,0|2,1,0]=3 208 B7R1.4 NN1C=NNC1=S Amb18221777 [0,0,0,0,0,0|2,0,0]=2 209 B7R1.4 NN1CCNC1=O Amb5722000 [0,0,0,0,0,0|1,1,2]=4 210 B7R1.4 NN1N=CNC1=S Amb27422889 [0,0,0,0,0,0|2,0,0]=2 211 B7R1.4 Nc1ccnn1Br Amb25220209 [0,0,0,0,0,0|4,0,0]=4 212 B7R1.4 Nc1ccoc1Br Amb13884558 [0,0,0,0,0,0|4,0,0]=4 213 B7R1.4 Nc1ccsc1Br Amb13884557 [0,0,0,0,0,0|4,0,0]=4 214 B7R1.4 Nc1ccsc1Br Amb33553014 [0,0,0,0,0,0|4,0,0]=4 215 B7R1.4 Nc1ccsc1Cl Amb24054287 [0,0,0,0,0,0|4,0,0]=4 216 B7R1.4 Nc1ccsc1Cl Amb25077005 [0,0,0,0,0,0|4,0,0]=4 217 B7R1.4 Nc1ccsc1F Amb27958934 [0,0,0,0,0,0|4,0,0]=4 218 B7R1.4 Nc1ncnn1N Amb4007607 [0,0,0,0,0,0|3,0,1]=4 219 B7R1.4 Nc1nncn1N Amb2371085 [0,0,0,0,0,0|3,0,1]=4 220 B7R1.4 Nc1nncn1N Amb28994824 [0,0,0,0,0,0|3,0,1]=4 221 B7R1.4 Nc1nncn1N Amb431128 [0,0,0,0,0,0|3,0,1]=4 222 B7R1.4 Nc1sccc1Br Amb18190889 [0,0,0,0,0,0|4,0,0]=4 223 B7R1.4 Nc1sccc1Cl Amb23401705 [0,0,0,0,0,0|4,0,0]=4 224 B7R1.4 Nc1sccc1O Amb26606275 [0,0,0,0,0,0|4,0,0]=4 225 B7R1.4 Nn1ccnc1S Amb26989445 [0,0,0,0,0,0|1,0,2]=3 226 B7R1.4 Nn1cnnc1S Amb1205542 [0,0,0,0,0,0|2,0,2]=4 227 B7R1.4 Nn1cnnc1S Amb33743330 [0,0,0,0,0,0|2,0,2]=4 228 B7R1.4 O=C1C=CC=C1Br Amb28435335 [0,0,0,0,0,0|3,1,0]=4 229 B7R1.4 O=C1C=CC=C1O Amb27835626 [0,0,0,0,0,0|3,1,0]=4 230 B7R1.4 O=C1C=CCN1O Amb28255915 [0,0,0,0,0,0|2,1,1]=4 231 B7R1.4 O=C1C=CNC1=O Amb26887753 [0,0,0,0,0,0|2,1,0]=3 232 B7R1.4 O=C1NC=CN1O Amb26589882 [0,0,0,0,0,0|1,1,0]=2 233 B7R1.4 O=C1NOC=C1Br Amb24641631 [0,0,0,0,0,0|3,1,0]=4 234 B7R1.4 O=C1OC=CC1Br Amb22015332 [0,0,0,0,0,0|3,1,0]=4 235 B7R1.4 O=C1OC=CC1S Amb27624883 [0,0,0,0,0,0|3,1,0]=4 236 B7R1.4 O=C1OC=C[C@@H]1O Amb27472742 [0,0,0,0,0,0|3,1,0]=4 237 B7R1.4 Oc1occc1Br Amb18199810 [0,0,0,0,0,0|3,1,0]=4 238 B7R1.4 Oc1sccc1Br Amb22492529 [0,0,0,0,0,0|3,1,0]=4 239 B7R1.4 Oc1sccc1Cl Amb25296805 [0,0,0,0,0,0|3,1,0]=4 240 B7R1.4 On1ccnc1Cl Amb28246860 [0,0,0,0,0,0|2,0,1]=3 241 B7R1.4 S=C1SCC=C1Br Amb27438682 [0,0,0,0,0,0|3,0,1]=4 242 B7R1.4 S=C1SCC=C1Cl Amb28323649 [0,0,0,0,0,0|3,0,1]=4 243 B7R1.4 Sc1sccc1Br Amb26548900 [0,0,0,0,0,0|3,0,1]=4 244 B7R1.4 Sc1sccc1Cl Amb27832493 [0,0,0,0,0,0|3,0,1]=4 245 B6R1.2 BC1NC=CO1 Amb27424859 [1,0,0,0,0,0|2,0,1]=4 246 B6R1.2 Bc1ccco1 Amb28286917 [1,0,0,0,0,0|3,0,0]=4 247 B6R1.2 Bn1cccc1 Amb27463207 [1,0,0,0,0,0|2,0,0]=3 248 B6R1.2 Brc1ccc[se]1 Amb21964756 [1,0,0,0,0,0|3,0,0]=4 249 B6R1.2 Brc1ccco1 Amb2723041 [1,0,0,0,0,0|3,0,0]=4 250 B6R1.2 Brc1cccs1 Amb2685504 [1,0,0,0,0,0|3,0,0]=4 251 B6R1.2 Brc1ccoc1 Amb2720289 [1,0,0,0,0,0|3,0,0]=4 252 B6R1.2 Brc1ccsc1 Amb2685505 [1,0,0,0,0,0|3,0,0]=4 253 B6R1.2 Brc1ncco1 Amb10071482 [1,0,0,0,0,0|2,0,1]=4 254 B6R1.2 Brc1ncco1 Amb19514894 [1,0,0,0,0,0|2,0,1]=4 255 B6R1.2 Brc1nccs1 Amb535721 [1,0,0,0,0,0|2,0,1]=4 256 B6R1.2 CC1=CC=CC1 Amb26338978 [1,0,0,0,0,0|2,0,1]=4 257 B6R1.2 CC1C=CCC1 Amb17674168 [1,0,0,0,0,0|2,0,1]=4 258 B6R1.2 CC1C=CCN1 Amb24120626 [1,0,0,0,0,0|3,0,0]=4 259 B6R1.2 CC1C=CCS1 Amb27847945 [1,0,0,0,0,0|3,0,0]=4 260 B6R1.2 CC1C=CNC1 Amb28040927 [1,0,0,0,0,0|1,0,1]=3 261 B6R1.2 CN1C=NCC1 Amb10565894 [1,0,0,0,0,0|0,0,3]=4 262 B6R1.2 CN1CC=CC1 Amb17938851 [1,0,0,0,0,0|1,0,2]=4 263 B6R1.2 CN1CCNC1 Amb25663131 [1,0,0,0,0,0|0,0,3]=4 264 B6R1.2 CN1CN=CN1 Amb27633594 [1,0,0,0,0,0|1,0,2]=4 265 B6R1.2 Cc1ccco1 Amb2447070 [1,0,0,0,0,0|3,0,0]=4 266 B6R1.2 Cc1cccs1 Amb2447069 [1,0,0,0,0,0|3,0,0]=4 267 B6R1.2 Cc1ccno1 Amb33544333 [1,0,0,0,0,0|2,0,1]=4 268 B6R1.2 Cc1ccns1 Amb22734260 [1,0,0,0,0,0|2,0,1]=4 269 B6R1.2 Cc1ccoc1 Amb2447077 [1,0,0,0,0,0|2,0,0]=3 270 B6R1.2 Cc1ccon1 Amb4005631 [1,0,0,0,0,0|3,0,0]=4 271 B6R1.2 Cc1ccsc1 Amb2447071 [1,0,0,0,0,0|2,0,0]=3 272 B6R1.2 Cc1ccsn1 Amb20621563 [1,0,0,0,0,0|3,0,0]=4 273 B6R1.2 Cc1cnco1 Amb23403175 [1,0,0,0,0,0|2,0,1]=4 274 B6R1.2 Cc1cncs1 Amb8396856 [1,0,0,0,0,0|2,0,1]=4 275 B6R1.2 Cc1cnoc1 Amb2697202 [1,0,0,0,0,0|2,0,1]=4 276 B6R1.2 Cc1cnsc1 Amb22370679 [1,0,0,0,0,0|2,0,1]=4 277 B6R1.2 Cc1cocn1 Amb33544147 [1,0,0,0,0,0|3,0,0]=4 278 B6R1.2 Cc1cscn1 Amb1163532 [1,0,0,0,0,0|3,0,0]=4 279 B6R1.2 Cc1ncco1 Amb17399783 [1,0,0,0,0,0|2,0,1]=4 280 B6R1.2 Cc1ncco1 Amb22757206 [1,0,0,0,0,0|2,0,1]=4 281 B6R1.2 Cc1nccs1 Amb2455765 [1,0,0,0,0,0|2,0,1]=4 282 B6R1.2 ClC1=CCC=C1 Amb22584067 [1,0,0,0,0,0|3,0,0]=4 283 B6R1.2 Clc1ccco1 Amb27805575 [1,0,0,0,0,0|3,0,0]=4 284 B6R1.2 Clc1cccs1 Amb2686481 [1,0,0,0,0,0|3,0,0]=4 285 B6R1.2 Clc1ccoc1 Amb24333769 [1,0,0,0,0,0|3,0,0]=4 286 B6R1.2 Clc1ccsc1 Amb2686482 [1,0,0,0,0,0|3,0,0]=4 287 B6R1.2 Clc1ncco1 Amb22054705 [1,0,0,0,0,0|2,0,1]=4 288 B6R1.2 Clc1ncco1 Amb32655821 [1,0,0,0,0,0|2,0,1]=4 289 B6R1.2 Clc1nccs1 Amb2455949 [1,0,0,0,0,0|2,0,1]=4 290 B6R1.2 Cn1cccc1 Amb6608780 [1,0,0,0,0,0|1,0,0]=2 291 B6R1.2 Cn1cccn1 Amb1088902 [1,0,0,0,0,0|2,0,0]=3 292 B6R1.2 Cn1ccnc1 Amb22337441 [1,0,0,0,0,0|0,0,1]=2 293 B6R1.2 Cn1ccnc1 Amb2689449 [1,0,0,0,0,0|0,0,1]=2 294 B6R1.2 Cn1ccnn1 Amb13883817 [1,0,0,0,0,0|1,0,1]=3 295 B6R1.2 Cn1cncn1 Amb520877 [1,0,0,0,0,0|1,0,1]=3 296 B6R1.2 Cn1cnnc1 Amb33550155 [1,0,0,0,0,0|1,0,1]=3 297 B6R1.2 Cn1cnnn1 Amb1090908 [1,0,0,0,0,0|2,0,1]=4 298 B6R1.2 Cn1nccn1 Amb22491223 [1,0,0,0,0,0|3,0,0]=4 299 B6R1.2 Cn1ncnn1 Amb1090461 [1,0,0,0,0,0|2,0,1]=4 300 B6R1.2 Fc1ccco1 Amb27470402 [1,0,0,0,0,0|3,0,0]=4 301 B6R1.2 Fc1cccs1 Amb8388025 [1,0,0,0,0,0|3,0,0]=4 302 B6R1.2 Fc1ccoc1 Amb26369802 [1,0,0,0,0,0|3,0,0]=4 303 B6R1.2 Fc1ccsc1 Amb33543454 [1,0,0,0,0,0|3,0,0]=4 304 B6R1.2 Fc1nccs1 Amb20621379 [1,0,0,0,0,0|2,0,1]=4 305 B6R1.2 Fn1ccnc1 Amb28133827 [1,0,0,0,0,0|1,0,1]=3 306 B6R1.2 IC1C=CC=C1 Amb25189843 [1,0,0,0,0,0|3,0,0]=4 307 B6R1.2 Ic1ccco1 Amb17672748 [1,0,0,0,0,0|3,0,0]=4 308 B6R1.2 Ic1cccs1 Amb2688889 [1,0,0,0,0,0|3,0,0]=4 309 B6R1.2 Ic1ccoc1 Amb24686192 [1,0,0,0,0,0|3,0,0]=4 310 B6R1.2 Ic1ccsc1 Amb8393328 [1,0,0,0,0,0|3,0,0]=4 311 B6R1.2 Ic1ncco1 Amb33547666 [1,0,0,0,0,0|2,0,1]=4 312 B6R1.2 Ic1nccs1 Amb6296420 [1,0,0,0,0,0|2,0,1]=4 313 B6R1.2 In1ccnc1 Amb25965700 [1,0,0,0,0,0|1,0,1]=3 314 B6R1.2 N=C1C=CNC1 Amb28135748 [1,0,0,0,0,0|2,0,1]=4 315 B6R1.2 N=C1NC=CS1 Amb22166858 [1,0,0,0,0,0|2,0,0]=3 316 B6R1.2 N=C1NCCN1 Amb21859025 [1,0,0,0,0,0|1,0,2]=4 317 B6R1.2 N=C1NN=NN1 Amb22492621 [1,0,0,0,0,0|3,0,0]=4 318 B6R1.2 NN1C=NNC1 Amb26369720 [1,0,0,0,0,0|2,0,1]=4 319 B6R1.2 N[c-]1cccc1 Amb34916047 [1,0,0,0,0,0|3,0,0]=4 320 B6R1.2 Nc1ccco1 Amb18203215 [1,0,0,0,0,0|3,0,0]=4 321 B6R1.2 Nc1ccoc1 Amb22230735 [1,0,0,0,0,0|3,0,0]=4 322 B6R1.2 Nc1ccsc1 Amb13889594 [1,0,0,0,0,0|3,0,0]=4 323 B6R1.2 Nc1ccsc1 Amb17935671 [1,0,0,0,0,0|3,0,0]=4 324 B6R1.2 Nc1ccsc1 Amb19515444 [1,0,0,0,0,0|3,0,0]=4 325 B6R1.2 Nc1ccsc1 Amb22405919 [1,0,0,0,0,0|3,0,0]=4 326 B6R1.2 Nc1ncco1 Amb6751913 [1,0,0,0,0,0|2,0,1]=4 327 B6R1.2 Nc1nccs1 Amb2609403 [1,0,0,0,0,0|2,0,1]=4 328 B6R1.2 Nc1nccs1 Amb2707210 [1,0,0,0,0,0|2,0,1]=4 329 B6R1.2 Nn1cccc1 Amb2684521 [1,0,0,0,0,0|2,0,0]=3 330 B6R1.2 Nn1cccn1 Amb22233569 [1,0,0,0,0,0|3,0,0]=4 331 B6R1.2 Nn1ccnc1 Amb22728066 [1,0,0,0,0,0|1,0,1]=3 332 B6R1.2 Nn1ccnc1 Amb24184022 [1,0,0,0,0,0|1,0,1]=3 333 B6R1.2 Nn1ccnn1 Amb2707214 [1,0,0,0,0,0|2,0,1]=4 334 B6R1.2 Nn1ccnn1 Amb32662759 [1,0,0,0,0,0|2,0,1]=4 335 B6R1.2 Nn1cncn1 Amb22739853 [1,0,0,0,0,0|2,0,1]=4 336 B6R1.2 Nn1cnnc1 Amb2546925 [1,0,0,0,0,0|2,0,1]=4 337 B6R1.2 O=C1C=CCN1 Amb20241082 [1,0,0,0,0,0|1,1,1]=4 338 B6R1.2 O=C1C=CNN1 Amb19958916 [1,0,0,0,0,0|2,1,0]=4 339 B6R1.2 O=C1C=CSN1 Amb19895016 [1,0,0,0,0,0|2,1,0]=4 340 B6R1.2 O=C1CC=CC1 Amb2686649 [1,0,0,0,0,0|2,1,0]=4 341 B6R1.2 O=C1CC=CN1 Amb22235167 [1,0,0,0,0,0|1,1,0]=3 342 B6R1.2 O=C1CC=NN1 Amb3428206 [1,0,0,0,0,0|2,1,0]=4 343 B6R1.2 O=C1N=CC=N1 Amb25138138 [1,0,0,0,0,0|0,1,2]=4 344 B6R1.2 O=C1NC=CN1 Amb19516737 [1,0,0,0,0,0|0,1,0]=2 345 B6R1.2 O=C1NC=CO1 Amb20671008 [1,0,0,0,0,0|1,1,0]=3 346 B6R1.2 O=C1NC=CS1 Amb19271596 [1,0,0,0,0,0|1,1,0]=3 347 B6R1.2 O=C1NC=NN1 Amb20243425 [1,0,0,0,0,0|1,1,0]=3 348 B6R1.2 O=C1NCCN1 Amb6357221 [1,0,0,0,0,0|0,1,2]=4 349 B6R1.2 O=C1NCCN1 Amb6608941 [1,0,0,0,0,0|0,1,2]=4 350 B6R1.2 O=C1NN=CO1 Amb20667671 [1,0,0,0,0,0|2,1,0]=4 351 B6R1.2 O=C1NN=CS1 Amb22491285 [1,0,0,0,0,0|2,1,0]=4 352 B6R1.2 O=C1OC=CO1 Amb20239430 [1,0,0,0,0,0|2,1,0]=4 353 B6R1.2 O=S1C=CC=C1 Amb27787698 [1,0,0,0,0,0|3,0,0]=4 354 B6R1.2 OC1C=CNN1 Amb33716474 [1,0,0,0,0,0|3,0,0]=4 355 B6R1.2 Oc1ccco1 Amb25991417 [1,0,0,0,0,0|2,1,0]=4 356 B6R1.2 Oc1cccs1 Amb17201836 [1,0,0,0,0,0|2,1,0]=4 357 B6R1.2 Oc1ccsc1 Amb16231253 [1,0,0,0,0,0|3,0,0]=4 358 B6R1.2 On1cccn1 Amb10067876 [1,0,0,0,0,0|3,0,0]=4 359 B6R1.2 On1ccnc1 Amb10552377 [1,0,0,0,0,0|1,0,1]=3 360 B6R1.2 S=C1C=CCO1 Amb27971151 [1,0,0,0,0,0|2,0,1]=4 361 B6R1.2 S=C1C=CSS1 Amb19132030 [1,0,0,0,0,0|3,0,0]=4 362 B6R1.2 S=C1CC=CN1 Amb27239207 [1,0,0,0,0,0|1,0,0]=2 363 B6R1.2 S=C1CCCN1 Amb2778514 [1,0,0,0,0,0|1,0,2]=4 364 B6R1.2 S=C1CN=CS1 Amb24093708 [1,0,0,0,0,0|3,0,0]=4 365 B6R1.2 S=C1COC=N1 Amb27636708 [1,0,0,0,0,0|2,0,1]=4 366 B6R1.2 S=C1NC=CN1 Amb19148165 [1,0,0,0,0,0|0,0,0]=1 367 B6R1.2 S=C1NC=CO1 Amb21936248 [1,0,0,0,0,0|1,0,0]=2 368 B6R1.2 S=C1NC=CS1 Amb22492748 [1,0,0,0,0,0|1,0,0]=2 369 B6R1.2 S=C1NC=NN1 Amb18012811 [1,0,0,0,0,0|1,0,0]=2 370 B6R1.2 S=C1NCCN1 Amb2720352 [1,0,0,0,0,0|0,0,2]=3 371 B6R1.2 S=C1NCCO1 Amb2371644 [1,0,0,0,0,0|1,0,2]=4 372 B6R1.2 S=C1NCCS1 Amb4010551 [1,0,0,0,0,0|1,0,2]=4 373 B6R1.2 S=C1SC=CS1 Amb20001458 [1,0,0,0,0,0|2,0,0]=3 374 B6R1.2 Sc1ccco1 Amb26641519 [1,0,0,0,0,0|2,0,1]=4 375 B6R1.2 Sc1cccs1 Amb2689075 [1,0,0,0,0,0|2,0,1]=4 376 B6R1.2 Sc1ccoc1 Amb25979686 [1,0,0,0,0,0|3,0,0]=4 377 B6R1.2 Sc1ccsc1 Amb16232450 [1,0,0,0,0,0|3,0,0]=4 378 B6R1.2 Sc1nccs1 Amb1137208 [1,0,0,0,0,0|1,0,2]=4 379 B6R1.2 Sn1ccnc1 Amb27959165 [1,0,0,0,0,0|1,0,1]=3 380 B6R1.2 [NH3+]n1cnnc1 Amb4004904 [1,0,0,0,0,0|2,0,1]=4 381 B6R1.2 [NH3+]n1cnnc1 Amb8488225 [1,0,0,0,0,0|2,0,1]=4 382 B6R1.2 [O-][n+]1ccsc1 Amb25684211 [1,0,0,0,0,0|2,0,1]=4 383 B6R1.2 [SiH2]=C1NC=CN1 Amb27225499 [1,0,0,0,0,0|1,0,0]=2 384 B8R1.11 BrCc1ccsc1Br Amb4477445 [0,1,0,0,0,0|3,0,0]=4 385 B8R1.11 C#Cc1cccn1C Amb27167273 [0,1,0,0,0,0|2,0,0]=3 386 B8R1.11 C#Cc1ccnn1C Amb23449731 [0,1,0,0,0,0|3,0,0]=4 387 B8R1.11 C#Cc1cncn1C Amb20672026 [0,1,0,0,0,0|3,0,0]=4 388 B8R1.11 C#Cc1nccn1C Amb8011465 [0,1,0,0,0,0|1,0,1]=3 389 B8R1.11 C#Cc1ncnn1C Amb26979688 [0,1,0,0,0,0|2,0,1]=4 390 B8R1.11 C#Cc1occc1C Amb26015975 [0,1,0,0,0,0|3,0,0]=4 391 B8R1.11 C#Cc1sccc1C Amb22489883 [0,1,0,0,0,0|3,0,0]=4 392 B8R1.11 C=CN1C=CCC1=O Amb27965825 [0,1,0,0,0,0|1,1,1]=4 393 B8R1.11 C=CN1C=CNC1=O Amb27948491 [0,1,0,0,0,0|0,1,1]=3 394 B8R1.11 C=Cc1cccn1C Amb26856954 [0,1,0,0,0,0|2,0,0]=3 395 B8R1.11 C=Cc1ccnn1C Amb26957295 [0,1,0,0,0,0|3,0,0]=4 396 B8R1.11 C=Cc1nccn1C Amb27668024 [0,1,0,0,0,0|1,0,1]=3 397 B8R1.11 C=Cc1occc1C Amb28049005 [0,1,0,0,0,0|3,0,0]=4 398 B8R1.11 C=Cc1sccc1C Amb24532317 [0,1,0,0,0,0|3,0,0]=4 399 B8R1.11 C=Cn1cccc1I Amb28436290 [0,1,0,0,0,0|2,0,1]=4 400 B8R1.11 C=Cn1ccnc1C Amb4034467 [0,1,0,0,0,0|1,0,2]=4 401 B8R1.11 CCC1=CC=CC1C Amb28247297 [0,1,0,0,0,0|3,0,0]=4 402 B8R1.11 CCC1=CNNC1=N Amb22492479 [0,1,0,0,0,0|3,0,0]=4 403 B8R1.11 CCC1C=CNC1=O Amb27882600 [0,1,0,0,0,0|1,1,0]=3 404 B8R1.11 CCN1C=CNC1=O Amb25776172 [0,1,0,0,0,0|0,1,0]=2 405 B8R1.11 CCN1C=CNC1=S Amb18542353 [0,1,0,0,0,0|0,0,0]=1 406 B8R1.11 CCN1C=CSC1=N Amb20228497 [0,1,0,0,0,0|2,0,0]=3 407 B8R1.11 CCN1C=CSC1=O Amb28285225 [0,1,0,0,0,0|1,1,0]=3 408 B8R1.11 CCN1CC=CC1=N Amb27629759 [0,1,0,0,0,0|2,0,1]=4 409 B8R1.11 CCN1CCNC1=O Amb19333131 [0,1,0,0,0,0|0,1,2]=4 410 B8R1.11 CCN1CCNC1=S Amb19886955 [0,1,0,0,0,0|0,0,2]=3 411 B8R1.11 CCN1N=CNC1=S Amb27593179 [0,1,0,0,0,0|1,0,0]=2 412 B8R1.11 CCN1N=NNC1=O Amb19132283 [0,1,0,0,0,0|2,1,0]=4 413 B8R1.11 CCN1N=NNC1=S Amb22087291 [0,1,0,0,0,0|2,0,0]=3 414 B8R1.11 CCc1cccn1N Amb20621247 [0,1,0,0,0,0|3,0,0]=4 415 B8R1.11 CCc1ccnn1C Amb6891586 [0,1,0,0,0,0|3,0,0]=4 416 B8R1.11 CCc1ccoc1Br Amb13884533 [0,1,0,0,0,0|3,0,0]=4 417 B8R1.11 CCc1ccsc1Br Amb13884511 [0,1,0,0,0,0|3,0,0]=4 418 B8R1.11 CCc1ccsc1C Amb25313892 [0,1,0,0,0,0|3,0,0]=4 419 B8R1.11 CCc1ccsc1Cl Amb27185548 [0,1,0,0,0,0|3,0,0]=4 420 B8R1.11 CCc1ccsc1I Amb26079787 [0,1,0,0,0,0|3,0,0]=4 421 B8R1.11 CCc1ccsc1N Amb28049025 [0,1,0,0,0,0|3,0,0]=4 422 B8R1.11 CCc1ccsc1O Amb26547659 [0,1,0,0,0,0|2,1,0]=4 423 B8R1.11 CCc1ccsc1S Amb32728959 [0,1,0,0,0,0|2,0,1]=4 424 B8R1.11 CCc1cncn1C Amb27848623 [0,1,0,0,0,0|3,0,0]=4 425 B8R1.11 CCc1nccn1N Amb25053354 [0,1,0,0,0,0|2,0,1]=4 426 B8R1.11 CCc1nncn1C Amb13952397 [0,1,0,0,0,0|2,0,1]=4 427 B8R1.11 CCn1cccc1N Amb25745952 [0,1,0,0,0,0|2,0,0]=3 428 B8R1.11 CCn1ccnc1Br Amb15701653 [0,1,0,0,0,0|1,0,1]=3 429 B8R1.11 CCn1ccnc1Br Amb22587411 [0,1,0,0,0,0|1,0,1]=3 430 B8R1.11 CCn1ccnc1C Amb27964894 [0,1,0,0,0,0|1,0,1]=3 431 B8R1.11 CCn1ccnc1Cl Amb10067353 [0,1,0,0,0,0|1,0,1]=3 432 B8R1.11 CCn1ccnc1F Amb35642427 [0,1,0,0,0,0|1,0,1]=3 433 B8R1.11 CCn1ccnc1I Amb26368117 [0,1,0,0,0,0|1,0,1]=3 434 B8R1.11 CCn1ccnc1N Amb18278257 [0,1,0,0,0,0|1,0,1]=3 435 B8R1.11 CCn1ccnc1S Amb2371689 [0,1,0,0,0,0|0,0,2]=3 436 B8R1.11 CCn1cncc1C Amb23571733 [0,1,0,0,0,0|3,0,0]=4 437 B8R1.11 CCn1cncc1N Amb18833100 [0,1,0,0,0,0|3,0,0]=4 438 B8R1.11 CCn1cncc1O Amb33226305 [0,1,0,0,0,0|2,1,0]=4 439 B8R1.11 CCn1cnnc1Br Amb27960713 [0,1,0,0,0,0|2,0,1]=4 440 B8R1.11 CCn1cnnc1C Amb13952400 [0,1,0,0,0,0|2,0,1]=4 441 B8R1.11 CCn1cnnc1N Amb18280508 [0,1,0,0,0,0|2,0,1]=4 442 B8R1.11 CCn1cnnc1N Amb28934814 [0,1,0,0,0,0|2,0,1]=4 443 B8R1.11 CCn1cnnc1S Amb1154601 [0,1,0,0,0,0|1,0,2]=4 444 B8R1.11 CCn1nccc1Br Amb33544247 [0,1,0,0,0,0|3,0,0]=4 445 B8R1.11 CCn1nccc1C Amb6888496 [0,1,0,0,0,0|3,0,0]=4 446 B8R1.11 CCn1nccc1Cl Amb23539596 [0,1,0,0,0,0|3,0,0]=4 447 B8R1.11 CCn1nccc1F Amb22008909 [0,1,0,0,0,0|3,0,0]=4 448 B8R1.11 CCn1nccc1I Amb22008931 [0,1,0,0,0,0|3,0,0]=4 449 B8R1.11 CCn1nccc1N Amb1107883 [0,1,0,0,0,0|3,0,0]=4 450 B8R1.11 CCn1nccc1O Amb25724305 [0,1,0,0,0,0|2,1,0]=4 451 B8R1.11 CCn1nccc1O Amb33744109 [0,1,0,0,0,0|2,1,0]=4 452 B8R1.11 CCn1nccc1S Amb33319694 [0,1,0,0,0,0|2,0,1]=4 453 B8R1.11 CCn1ncnc1Br Amb19516906 [0,1,0,0,0,0|2,0,1]=4 454 B8R1.11 CCn1ncnc1Cl Amb26426308 [0,1,0,0,0,0|2,0,1]=4 455 B8R1.11 CCn1ncnc1I Amb32685614 [0,1,0,0,0,0|2,0,1]=4 456 B8R1.11 CCn1ncnc1N Amb10607465 [0,1,0,0,0,0|2,0,1]=4 457 B8R1.11 CCn1ncnc1N Amb22586795 [0,1,0,0,0,0|2,0,1]=4 458 B8R1.11 CCn1ncnc1O Amb27235127 [0,1,0,0,0,0|1,1,1]=4 459 B8R1.11 CN1C=CNC1=S=O Amb27592389 [0,1,0,0,0,0|0,0,1]=2 460 B8R1.11 CNC1=CSSC1=S Amb27642550 [0,1,0,0,0,0|3,0,0]=4 461 B8R1.11 CNc1cccn1C Amb25718849 [0,1,0,0,0,0|2,0,0]=3 462 B8R1.11 CNc1ccnn1C Amb18278923 [0,1,0,0,0,0|3,0,0]=4 463 B8R1.11 CNc1ccnn1C Amb19318085 [0,1,0,0,0,0|3,0,0]=4 464 B8R1.11 CNc1ccsc1Cl Amb27838059 [0,1,0,0,0,0|3,0,0]=4 465 B8R1.11 CNc1cncn1C Amb23437090 [0,1,0,0,0,0|3,0,0]=4 466 B8R1.11 CNc1nccn1C Amb23437095 [0,1,0,0,0,0|1,0,1]=3 467 B8R1.11 CNc1nccn1C Amb8011071 [0,1,0,0,0,0|1,0,1]=3 468 B8R1.11 CNc1ncnn1C Amb27217274 [0,1,0,0,0,0|2,0,1]=4 469 B8R1.11 CNc1nncn1C Amb27436430 [0,1,0,0,0,0|2,0,1]=4 470 B8R1.11 CNc1nncn1C Amb32712058 [0,1,0,0,0,0|2,0,1]=4 471 B8R1.11 COC1C=CNC1=O Amb27850186 [0,1,0,0,0,0|1,1,0]=3 472 B8R1.11 CON1C=CNC1=O Amb24389098 [0,1,0,0,0,0|0,1,0]=2 473 B8R1.11 CON1NC=CC1=N Amb27639792 [0,1,0,0,0,0|3,0,0]=4 474 B8R1.11 COc1ccnn1C Amb22275956 [0,1,0,0,0,0|2,1,0]=4 475 B8R1.11 COc1ccoc1C Amb27462648 [0,1,0,0,0,0|3,0,0]=4 476 B8R1.11 COc1ccsc1Br Amb27980955 [0,1,0,0,0,0|3,0,0]=4 477 B8R1.11 COc1ccsc1C Amb25226814 [0,1,0,0,0,0|3,0,0]=4 478 B8R1.11 COc1nccn1C Amb27631760 [0,1,0,0,0,0|0,1,1]=3 479 B8R1.11 COc1nncn1C Amb27644565 [0,1,0,0,0,0|1,1,1]=4 480 B8R1.11 COc1occc1C Amb27625304 [0,1,0,0,0,0|2,1,0]=4 481 B8R1.11 COc1sccc1C Amb25064766 [0,1,0,0,0,0|2,1,0]=4 482 B8R1.11 COn1nccc1N Amb27838369 [0,1,0,0,0,0|3,0,0]=4 483 B8R1.11 CSC1=CNNC1=N Amb20629424 [0,1,0,0,0,0|3,0,0]=4 484 B8R1.11 CSc1ccoc1C Amb8393178 [0,1,0,0,0,0|3,0,0]=4 485 B8R1.11 CSc1ccsc1Br Amb27396274 [0,1,0,0,0,0|3,0,0]=4 486 B8R1.11 CSc1ccsc1C Amb24639247 [0,1,0,0,0,0|3,0,0]=4 487 B8R1.11 CSc1cncn1C Amb27239259 [0,1,0,0,0,0|2,0,1]=4 488 B8R1.11 CSc1nccn1C Amb27217595 [0,1,0,0,0,0|0,0,2]=3 489 B8R1.11 CSc1nccn1C Amb32664666 [0,1,0,0,0,0|0,0,2]=3 490 B8R1.11 CSc1nncn1C Amb3438637 [0,1,0,0,0,0|1,0,2]=4 491 B8R1.11 C\C=C1/C=CCC1=O Amb27861032 [0,1,0,0,0,0|2,1,0]=4 492 B8R1.11 C\C=C1\C=CCC1=O Amb28052392 [0,1,0,0,0,0|2,1,0]=4 493 B8R1.11 Cc1ccoc1C#N Amb25352891 [0,1,0,0,0,0|3,0,0]=4 494 B8R1.11 Cc1ccoc1C=O Amb6572128 [0,1,0,0,0,0|2,1,0]=4 495 B8R1.11 Cc1ccoc1CBr Amb18183895 [0,1,0,0,0,0|3,0,0]=4 496 B8R1.11 Cc1ccoc1CCl Amb8860567 [0,1,0,0,0,0|3,0,0]=4 497 B8R1.11 Cc1ccoc1CN Amb6572131 [0,1,0,0,0,0|3,0,0]=4 498 B8R1.11 Cc1ccoc1CO Amb6572130 [0,1,0,0,0,0|2,1,0]=4 499 B8R1.11 Cc1ccoc1CS Amb25969059 [0,1,0,0,0,0|2,0,1]=4 500 B8R1.11 Cc1ccsc1C#N Amb33528580 [0,1,0,0,0,0|3,0,0]=4 501 B8R1.11 Cc1ccsc1C=O Amb534988 [0,1,0,0,0,0|2,1,0]=4 502 B8R1.11 Cc1ccsc1CBr Amb18325320 [0,1,0,0,0,0|3,0,0]=4 503 B8R1.11 Cc1ccsc1CCl Amb33528081 [0,1,0,0,0,0|3,0,0]=4 504 B8R1.11 Cc1ccsc1CN Amb1128389 [0,1,0,0,0,0|3,0,0]=4 505 B8R1.11 Cc1ccsc1CN Amb6892658 [0,1,0,0,0,0|3,0,0]=4 506 B8R1.11 Cc1ccsc1CO Amb837436 [0,1,0,0,0,0|2,1,0]=4 507 B8R1.11 Cc1ccsc1CS Amb24526885 [0,1,0,0,0,0|2,0,1]=4 508 B8R1.11 Cc1ccsc1[Zn]Br Amb22000458 [0,1,0,0,0,0|3,0,0]=4 509 B8R1.11 Cc1cncn1CO Amb27395866 [0,1,0,0,0,0|3,0,0]=4 510 B8R1.11 Cc1nccn1C#N Amb25801189 [0,1,0,0,0,0|1,0,2]=4 511 B8R1.11 Cc1nccn1CN Amb28196152 [0,1,0,0,0,0|1,0,1]=3 512 B8R1.11 Cc1occc1CBr Amb18183894 [0,1,0,0,0,0|3,0,0]=4 513 B8R1.11 Cc1occc1CN Amb2724036 [0,1,0,0,0,0|3,0,0]=4 514 B8R1.11 Cc1occc1CN Amb33545796 [0,1,0,0,0,0|3,0,0]=4 515 B8R1.11 Cc1occc1CO Amb33545810 [0,1,0,0,0,0|3,0,0]=4 516 B8R1.11 Cc1occc1CS Amb24538700 [0,1,0,0,0,0|3,0,0]=4 517 B8R1.11 Cc1sccc1CN Amb18203029 [0,1,0,0,0,0|3,0,0]=4 518 B8R1.11 Cc1sccc1CN Amb31156120 [0,1,0,0,0,0|3,0,0]=4 519 B8R1.11 Cc1sccc1CO Amb28048918 [0,1,0,0,0,0|3,0,0]=4 520 B8R1.11 Cc1sccc1CS Amb32788874 [0,1,0,0,0,0|3,0,0]=4 521 B8R1.11 ClCc1ccsc1Cl Amb8396575 [0,1,0,0,0,0|3,0,0]=4 522 B8R1.11 Clc1sccc1CBr Amb8629632 [0,1,0,0,0,0|3,0,0]=4 523 B8R1.11 Clc1sccc1CI Amb35612749 [0,1,0,0,0,0|3,0,0]=4 524 B8R1.11 Cn1cccc1C#N Amb342676 [0,1,0,0,0,0|2,0,0]=3 525 B8R1.11 Cn1cccc1C=N Amb27638729 [0,1,0,0,0,0|2,0,0]=3 526 B8R1.11 Cn1cccc1C=O Amb2723053 [0,1,0,0,0,0|1,1,0]=3 527 B8R1.11 Cn1cccc1CBr Amb22301108 [0,1,0,0,0,0|2,0,0]=3 528 B8R1.11 Cn1cccc1CCl Amb22301109 [0,1,0,0,0,0|2,0,0]=3 529 B8R1.11 Cn1cccc1CI Amb22301110 [0,1,0,0,0,0|2,0,0]=3 530 B8R1.11 Cn1cccc1CN Amb2723054 [0,1,0,0,0,0|2,0,0]=3 531 B8R1.11 Cn1cccc1CO Amb837316 [0,1,0,0,0,0|1,1,0]=3 532 B8R1.11 Cn1cccc1CS Amb22301111 [0,1,0,0,0,0|1,0,1]=3 533 B8R1.11 Cn1cccc1C[O-] Amb22411415 [0,1,0,0,0,0|1,1,0]=3 534 B8R1.11 Cn1cccc1C[O-] Amb32411913 [0,1,0,0,0,0|1,1,0]=3 535 B8R1.11 Cn1ccnc1C#N Amb17621972 [0,1,0,0,0,0|1,0,1]=3 536 B8R1.11 Cn1ccnc1C=O Amb1107787 [0,1,0,0,0,0|0,1,1]=3 537 B8R1.11 Cn1ccnc1CBr Amb22301112 [0,1,0,0,0,0|1,0,1]=3 538 B8R1.11 Cn1ccnc1CBr Amb23385230 [0,1,0,0,0,0|1,0,1]=3 539 B8R1.11 Cn1ccnc1CCl Amb1092563 [0,1,0,0,0,0|1,0,1]=3 540 B8R1.11 Cn1ccnc1CCl Amb1154142 [0,1,0,0,0,0|1,0,1]=3 541 B8R1.11 Cn1ccnc1CF Amb22757473 [0,1,0,0,0,0|1,0,1]=3 542 B8R1.11 Cn1ccnc1CI Amb22301113 [0,1,0,0,0,0|1,0,1]=3 543 B8R1.11 Cn1ccnc1CN Amb1099139 [0,1,0,0,0,0|1,0,1]=3 544 B8R1.11 Cn1ccnc1CN Amb2154784 [0,1,0,0,0,0|1,0,1]=3 545 B8R1.11 Cn1ccnc1CN Amb21864560 [0,1,0,0,0,0|1,0,1]=3 546 B8R1.11 Cn1ccnc1CO Amb1679789 [0,1,0,0,0,0|0,1,1]=3 547 B8R1.11 Cn1ccnc1CO Amb20668539 [0,1,0,0,0,0|0,1,1]=3 548 B8R1.11 Cn1ccnc1CS Amb22301114 [0,1,0,0,0,0|0,0,2]=3 549 B8R1.11 Cn1ccnc1N=O Amb28456474 [0,1,0,0,0,0|0,1,1]=3 550 B8R1.11 Cn1ccnc1NN Amb22232098 [0,1,0,0,0,0|1,0,1]=3 551 B8R1.11 Cn1ccnc1NN Amb22587549 [0,1,0,0,0,0|1,0,1]=3 552 B8R1.11 Cn1ccnc1NN Amb32661098 [0,1,0,0,0,0|1,0,1]=3 553 B8R1.11 Cn1ccnc1NN Amb33552724 [0,1,0,0,0,0|1,0,1]=3 554 B8R1.11 Cn1ccnc1SCl Amb27193477 [0,1,0,0,0,0|0,0,2]=3 555 B8R1.11 Cn1cncc1C#N Amb33544441 [0,1,0,0,0,0|3,0,0]=4 556 B8R1.11 Cn1cncc1C=N Amb27598562 [0,1,0,0,0,0|3,0,0]=4 557 B8R1.11 Cn1cncc1C=O Amb2455726 [0,1,0,0,0,0|2,1,0]=4 558 B8R1.11 Cn1cncc1CBr Amb23412323 [0,1,0,0,0,0|3,0,0]=4 559 B8R1.11 Cn1cncc1CCl Amb10607768 [0,1,0,0,0,0|3,0,0]=4 560 B8R1.11 Cn1cncc1CCl Amb20623570 [0,1,0,0,0,0|3,0,0]=4 561 B8R1.11 Cn1cncc1CN Amb2723359 [0,1,0,0,0,0|3,0,0]=4 562 B8R1.11 Cn1cncc1CN Amb33542702 [0,1,0,0,0,0|3,0,0]=4 563 B8R1.11 Cn1cncc1CO Amb2723358 [0,1,0,0,0,0|2,1,0]=4 564 B8R1.11 Cn1cncc1CS Amb25294856 [0,1,0,0,0,0|2,0,1]=4 565 B8R1.11 Cn1cnnc1C#N Amb28048774 [0,1,0,0,0,0|2,0,1]=4 566 B8R1.11 Cn1cnnc1C=O Amb8010936 [0,1,0,0,0,0|1,1,1]=4 567 B8R1.11 Cn1cnnc1CBr Amb19737353 [0,1,0,0,0,0|2,0,1]=4 568 B8R1.11 Cn1cnnc1CBr Amb21961682 [0,1,0,0,0,0|2,0,1]=4 569 B8R1.11 Cn1cnnc1CCl Amb19517043 [0,1,0,0,0,0|2,0,1]=4 570 B8R1.11 Cn1cnnc1CCl Amb20668397 [0,1,0,0,0,0|2,0,1]=4 571 B8R1.11 Cn1cnnc1CN Amb33532934 [0,1,0,0,0,0|2,0,1]=4 572 B8R1.11 Cn1cnnc1CO Amb19516680 [0,1,0,0,0,0|1,1,1]=4 573 B8R1.11 Cn1cnnc1CS Amb27589346 [0,1,0,0,0,0|1,0,2]=4 574 B8R1.11 Cn1cnnc1NN Amb1102235 [0,1,0,0,0,0|2,0,1]=4 575 B8R1.11 Cn1cnnc1NN Amb33390593 [0,1,0,0,0,0|2,0,1]=4 576 B8R1.11 Cn1nccc1C#N Amb6890434 [0,1,0,0,0,0|3,0,0]=4 577 B8R1.11 Cn1nccc1C=O Amb1946120 [0,1,0,0,0,0|2,1,0]=4 578 B8R1.11 Cn1nccc1CBr Amb18790494 [0,1,0,0,0,0|3,0,0]=4 579 B8R1.11 Cn1nccc1CBr Amb24269193 [0,1,0,0,0,0|3,0,0]=4 580 B8R1.11 Cn1nccc1CCl Amb33547571 [0,1,0,0,0,0|3,0,0]=4 581 B8R1.11 Cn1nccc1CCl Amb6890380 [0,1,0,0,0,0|3,0,0]=4 582 B8R1.11 Cn1nccc1CN Amb1945791 [0,1,0,0,0,0|3,0,0]=4 583 B8R1.11 Cn1nccc1CN Amb21953680 [0,1,0,0,0,0|3,0,0]=4 584 B8R1.11 Cn1nccc1CN Amb2693488 [0,1,0,0,0,0|3,0,0]=4 585 B8R1.11 Cn1nccc1CO Amb6572285 [0,1,0,0,0,0|2,1,0]=4 586 B8R1.11 Cn1nccc1CS Amb27197783 [0,1,0,0,0,0|2,0,1]=4 587 B8R1.11 Cn1nccc1NN Amb23385274 [0,1,0,0,0,0|3,0,0]=4 588 B8R1.11 Cn1nccc1NN Amb26504840 [0,1,0,0,0,0|3,0,0]=4 589 B8R1.11 Cn1ncnc1C#N Amb25913629 [0,1,0,0,0,0|2,0,1]=4 590 B8R1.11 Cn1ncnc1C=O Amb18124223 [0,1,0,0,0,0|1,1,1]=4 591 B8R1.11 Cn1ncnc1CBr Amb25788408 [0,1,0,0,0,0|2,0,1]=4 592 B8R1.11 Cn1ncnc1CCl Amb19148189 [0,1,0,0,0,0|2,0,1]=4 593 B8R1.11 Cn1ncnc1CCl Amb22011466 [0,1,0,0,0,0|2,0,1]=4 594 B8R1.11 Cn1ncnc1CN Amb30982614 [0,1,0,0,0,0|2,0,1]=4 595 B8R1.11 Cn1ncnc1CN Amb32708537 [0,1,0,0,0,0|2,0,1]=4 596 B8R1.11 Cn1ncnc1CN Amb8010898 [0,1,0,0,0,0|2,0,1]=4 597 B8R1.11 Cn1ncnc1CO Amb10603121 [0,1,0,0,0,0|1,1,1]=4 598 B8R1.11 Cn1ncnc1CO Amb30585096 [0,1,0,0,0,0|1,1,1]=4 599 B8R1.11 Cn1ncnc1CO Amb32653381 [0,1,0,0,0,0|1,1,1]=4 600 B8R1.11 Cn1ncnc1CS Amb26907983 [0,1,0,0,0,0|1,0,2]=4 601 B8R1.11 Cn1ncnc1NN Amb24269248 [0,1,0,0,0,0|2,0,1]=4 602 B8R1.11 Cn1ncnc1NN Amb24273677 [0,1,0,0,0,0|2,0,1]=4 603 B8R1.11 Cn1ncnc1NN Amb32664215 [0,1,0,0,0,0|2,0,1]=4 604 B8R1.11 Fc1sccc1CCl Amb27790748 [0,1,0,0,0,0|3,0,0]=4 605 B8R1.11 N#Cc1cccn1N Amb18203413 [0,1,0,0,0,0|3,0,0]=4 606 B8R1.11 N#Cc1cccn1N Amb19958421 [0,1,0,0,0,0|3,0,0]=4 607 B8R1.11 N#Cc1nccn1O Amb26415870 [0,1,0,0,0,0|2,0,1]=4 608 B8R1.11 N#Cn1ccnc1Cl Amb27670051 [0,1,0,0,0,0|1,0,2]=4 609 B8R1.11 NCc1ccoc1I Amb28316238 [0,1,0,0,0,0|3,0,0]=4 610 B8R1.11 NCc1ccsc1Br Amb17722051 [0,1,0,0,0,0|3,0,0]=4 611 B8R1.11 NCc1ccsc1Br Amb2726139 [0,1,0,0,0,0|3,0,0]=4 612 B8R1.11 NCc1ccsc1Cl Amb24699492 [0,1,0,0,0,0|3,0,0]=4 613 B8R1.11 NCc1ccsc1I Amb28345753 [0,1,0,0,0,0|3,0,0]=4 614 B8R1.11 N\C=C1\C=CNC1=S Amb27796677 [0,1,0,0,0,0|1,0,1]=3 615 B8R1.11 Nc1cccn1CBr Amb28124567 [0,1,0,0,0,0|2,0,0]=3 616 B8R1.11 Nc1ccoc1C=S Amb25790738 [0,1,0,0,0,0|3,0,0]=4 617 B8R1.11 Nc1sccc1CO Amb27781063 [0,1,0,0,0,0|3,0,0]=4 618 B8R1.11 Nn1cccc1C=O Amb22496148 [0,1,0,0,0,0|2,1,0]=4 619 B8R1.11 Nn1ccnc1CO Amb27875461 [0,1,0,0,0,0|1,1,1]=4 620 B8R1.11 O=C1NCCN1CO Amb24761511 [0,1,0,0,0,0|0,1,2]=4 621 B8R1.11 O=C1NN=NN1CCl Amb27220899 [0,1,0,0,0,0|2,1,0]=4 622 B8R1.11 O=C1OC=CC1CO Amb28129883 [0,1,0,0,0,0|2,1,0]=4 623 B8R1.11 O=C1SC=NN1CCl Amb28364801 [0,1,0,0,0,0|2,1,0]=4 624 B8R1.11 O=C1SC=NN1CO Amb28318577 [0,1,0,0,0,0|2,1,0]=4 625 B8R1.11 O=CN1C=CCC1=O Amb27959098 [0,1,0,0,0,0|1,1,1]=4 626 B8R1.11 O=CN1CCNC1=S Amb26627399 [0,1,0,0,0,0|0,0,3]=4 627 B8R1.11 O=NN1C=CNC1=S Amb27838386 [0,1,0,0,0,0|1,0,0]=2 628 B8R1.11 O=NN1C=COC1=O Amb27170682 [0,1,0,0,0,0|2,1,0]=4 629 B8R1.11 O=NN1CCNC1=S Amb25062509 [0,1,0,0,0,0|1,0,2]=4 630 B8R1.11 OCN1C=CNC1=S Amb28250878 [0,1,0,0,0,0|0,0,0]=1 631 B8R1.11 OCc1ccoc1Br Amb26598755 [0,1,0,0,0,0|3,0,0]=4 632 B8R1.11 OCc1ccoc1Cl Amb26370317 [0,1,0,0,0,0|3,0,0]=4 633 B8R1.11 OCc1ccsc1Br Amb2724058 [0,1,0,0,0,0|3,0,0]=4 634 B8R1.11 OCc1ccsc1Cl Amb27205726 [0,1,0,0,0,0|3,0,0]=4 635 B8R1.11 SCc1ccsc1Br Amb32788192 [0,1,0,0,0,0|3,0,0]=4 636 B8R1.11 SCc1ccsc1Cl Amb32788653 [0,1,0,0,0,0|3,0,0]=4 637 B8R1.11 [C-]#[N+]c1ccnn1C Amb33323527 [0,1,0,0,0,0|3,0,0]=4 638 B8R1.11 [C-]#[N+]c1cncn1C Amb32877233 [0,1,0,0,0,0|3,0,0]=4 639 B8R1.11 [C-]#[N+]c1nccn1C Amb33427303 [0,1,0,0,0,0|1,0,1]=3 640 B8R1.18 C=C1CC(C)=NN1C Amb24060658 [0,1,0,0,0,0|3,0,0]=4 641 B8R1.18 CC1=C(C)NC(=O)C1 Amb27830150 [0,1,0,0,0,0|2,0,1]=4 642 B8R1.18 CC1=C(C)NC(=O)N1 Amb17933370 [0,1,0,0,0,0|3,0,0]=4 643 B8R1.18 CC1=C(C)NC(=S)N1 Amb19804201 [0,1,0,0,0,0|3,0,0]=4 644 B8R1.18 CC1=C(C)OC(=O)N1 Amb19516947 [0,1,0,0,0,0|3,0,0]=4 645 B8R1.18 CC1=C(C)OC(=S)N1 Amb19403669 [0,1,0,0,0,0|3,0,0]=4 646 B8R1.18 CC1=C(C)SC(=O)N1 Amb19281000 [0,1,0,0,0,0|3,0,0]=4 647 B8R1.18 CC1=C(C)SC(=S)N1 Amb21934308 [0,1,0,0,0,0|3,0,0]=4 648 B8R1.18 CC1=CC(=O)NC1=O Amb8997582 [0,1,0,0,0,0|1,1,0]=3 649 B8R1.18 CC1=CC(=O)NC1O Amb27838349 [0,1,0,0,0,0|1,1,1]=4 650 B8R1.18 CC1=CC(=O)NN1C Amb19149104 [0,1,0,0,0,0|3,0,0]=4 651 B8R1.18 CC1=CC(=O)NN1C Amb29083396 [0,1,0,0,0,0|3,0,0]=4 652 B8R1.18 CC1=CC(=O)OC1=O Amb6608948 [0,1,0,0,0,0|2,1,0]=4 653 B8R1.18 CC1=CC(C)C(=N)N1 Amb27877914 [0,1,0,0,0,0|2,0,0]=3 654 B8R1.18 CC1=CC(C)C(=O)C1 Amb28049000 [0,1,0,0,0,0|2,1,0]=4 655 B8R1.18 CC1=CN(C)C(=O)N1 Amb24482402 [0,1,0,0,0,0|0,1,0]=2 656 B8R1.18 CC1=CN(N)C(=O)N1 Amb28399196 [0,1,0,0,0,0|1,1,0]=3 657 B8R1.18 CC1=C[C@@H](O)NC1=O Amb27795813 [0,1,0,0,0,0|1,1,1]=4 658 B8R1.18 CC1=NN(C)C(=O)C1 Amb2228109 [0,1,0,0,0,0|2,1,0]=4 659 B8R1.18 CC1CC(=O)NC1=O Amb10609734 [0,1,0,0,0,0|1,1,1]=4 660 B8R1.18 CC1N=C(N)SC1=S Amb27839119 [0,1,0,0,0,0|3,0,0]=4 661 B8R1.18 CC1NC(=O)NC1=O Amb1150065 [0,1,0,0,0,0|2,1,0]=4 662 B8R1.18 CC1NC(=S)NC1=O Amb22263161 [0,1,0,0,0,0|2,1,0]=4 663 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,1,0,0,0,0|2,1,0]=4 664 B8R1.18 CC1SC(=N)NC1=O Amb2792627 [0,1,0,0,0,0|2,1,0]=4 665 B8R1.18 CC1SC(=O)NC1=O Amb21857287 [0,1,0,0,0,0|2,1,0]=4 666 B8R1.18 CC1SC(=S)NC1=O Amb27794294 [0,1,0,0,0,0|2,1,0]=4 667 B8R1.18 CN1C=C(Br)NC1=O Amb27184620 [0,1,0,0,0,0|0,1,0]=2 668 B8R1.18 CN1CC(=O)CC1=O Amb33543710 [0,1,0,0,0,0|1,1,1]=4 669 B8R1.18 CN1CC(=O)N=C1N Amb2613078 [0,1,0,0,0,0|1,0,2]=4 670 B8R1.18 CN1CC(=O)NC1=N Amb533503 [0,1,0,0,0,0|1,0,1]=3 671 B8R1.18 CN1CC(=O)NC1=O Amb3940344 [0,1,0,0,0,0|0,1,1]=3 672 B8R1.18 CN1CC(=O)NC1=S Amb28285209 [0,1,0,0,0,0|0,0,1]=2 673 B8R1.18 CN1CC(=O)OC1=O Amb22734007 [0,1,0,0,0,0|1,1,1]=4 674 B8R1.18 CN1CC(N)=NC1=O Amb20622526 [0,1,0,0,0,0|0,1,2]=4 675 B8R1.18 CN1N=C(Br)CC1=O Amb26629126 [0,1,0,0,0,0|2,1,0]=4 676 B8R1.18 CN1N=C(Br)NC1=O Amb19516854 [0,1,0,0,0,0|1,1,0]=3 677 B8R1.18 CN1N=C(Cl)NC1=O Amb19516833 [0,1,0,0,0,0|1,1,0]=3 678 B8R1.18 CN1N=C(N)CC1=O Amb18665066 [0,1,0,0,0,0|2,1,0]=4 679 B8R1.18 CN1N=C(N)SC1=N Amb27768004 [0,1,0,0,0,0|3,0,0]=4 680 B8R1.18 CN1N=C(N)SC1=O Amb25923030 [0,1,0,0,0,0|2,1,0]=4 681 B8R1.18 CN1N=C(N)SC1=S Amb27216703 [0,1,0,0,0,0|2,0,0]=3 682 B8R1.18 CN1NC(=N)CC1=O Amb19314983 [0,1,0,0,0,0|2,1,0]=4 683 B8R1.18 CN1NC(=O)C=C1N Amb19275424 [0,1,0,0,0,0|3,0,0]=4 684 B8R1.18 CN1NC(=O)N=C1S Amb19372561 [0,1,0,0,0,0|1,0,2]=4 685 B8R1.18 CN1NC(=O)NC1=O Amb25324546 [0,1,0,0,0,0|1,1,0]=3 686 B8R1.18 CN1NC(=O)NC1=S Amb19247572 [0,1,0,0,0,0|1,0,0]=2 687 B8R1.18 CN1NC(Cl)=CC1=N Amb28424391 [0,1,0,0,0,0|3,0,0]=4 688 B8R1.18 CN1NC(Cl)=NC1=O Amb22491272 [0,1,0,0,0,0|1,1,1]=4 689 B8R1.18 CN1NC(N)=CC1=O Amb22330561 [0,1,0,0,0,0|2,1,0]=4 690 B8R1.18 CN1OC(=O)C=C1N Amb25910818 [0,1,0,0,0,0|3,0,0]=4 691 B8R1.18 CN1OC(N)=CC1=O Amb25889242 [0,1,0,0,0,0|2,1,0]=4 692 B8R1.18 CN1SC(Cl)=CC1=O Amb19131238 [0,1,0,0,0,0|2,1,0]=4 693 B8R1.18 CN1SC(Cl)=CC1=O Amb22275942 [0,1,0,0,0,0|2,1,0]=4 694 B8R1.18 CN1SC(N)=NC1=O Amb27622049 [0,1,0,0,0,0|1,1,1]=4 695 B8R1.18 C[C@@H]1NC(=O)NC1=O Amb17617476 [0,1,0,0,0,0|2,1,0]=4 696 B8R1.18 C[C@@H]1NC(=S)NC1=O Amb27154771 [0,1,0,0,0,0|2,1,0]=4 697 B8R1.18 C[C@H]1CC(=O)NC1=O Amb28119095 [0,1,0,0,0,0|1,1,1]=4 698 B8R1.18 C[C@H]1NC(=O)NC1=O Amb17617475 [0,1,0,0,0,0|2,1,0]=4 699 B8R1.18 C[C@H]1NC(=S)NC1=O Amb27961227 [0,1,0,0,0,0|2,1,0]=4 700 B8R1.18 Cc1cc(Br)cn1C Amb18825264 [0,1,0,0,0,0|2,0,0]=3 701 B8R1.18 Cc1cc(Br)n(C)n1 Amb10067343 [0,1,0,0,0,0|3,0,0]=4 702 B8R1.18 Cc1cc(Br)n(C)n1 Amb22899729 [0,1,0,0,0,0|3,0,0]=4 703 B8R1.18 Cc1cc(Br)n(C)n1 Amb31308053 [0,1,0,0,0,0|3,0,0]=4 704 B8R1.18 Cc1cc(Br)nn1C Amb20619950 [0,1,0,0,0,0|3,0,0]=4 705 B8R1.18 Cc1cc(Br)oc1Br Amb21964709 [0,1,0,0,0,0|3,0,0]=4 706 B8R1.18 Cc1cc(Br)oc1C Amb28128216 [0,1,0,0,0,0|3,0,0]=4 707 B8R1.18 Cc1cc(Br)oc1O Amb18190940 [0,1,0,0,0,0|2,1,0]=4 708 B8R1.18 Cc1cc(Br)sc1Br Amb1159085 [0,1,0,0,0,0|3,0,0]=4 709 B8R1.18 Cc1cc(Br)sc1C Amb10600997 [0,1,0,0,0,0|3,0,0]=4 710 B8R1.18 Cc1cc(Br)sc1N Amb18190697 [0,1,0,0,0,0|3,0,0]=4 711 B8R1.18 Cc1cc(C)c(Br)o1 Amb27658519 [0,1,0,0,0,0|3,0,0]=4 712 B8R1.18 Cc1cc(C)c(Br)s1 Amb20669567 [0,1,0,0,0,0|3,0,0]=4 713 B8R1.18 Cc1cc(C)c(C)o1 Amb10606773 [0,1,0,0,0,0|3,0,0]=4 714 B8R1.18 Cc1cc(C)c(C)s1 Amb2691179 [0,1,0,0,0,0|3,0,0]=4 715 B8R1.18 Cc1cc(C)c(Cl)o1 Amb25064998 [0,1,0,0,0,0|3,0,0]=4 716 B8R1.18 Cc1cc(C)c(I)s1 Amb27970964 [0,1,0,0,0,0|3,0,0]=4 717 B8R1.18 Cc1cc(C)c(S)s1 Amb25135625 [0,1,0,0,0,0|2,0,1]=4 718 B8R1.18 Cc1cc(C)n(C)n1 Amb2592061 [0,1,0,0,0,0|3,0,0]=4 719 B8R1.18 Cc1cc(C)n(N)c1 Amb28253357 [0,1,0,0,0,0|3,0,0]=4 720 B8R1.18 Cc1cc(Cl)n(C)n1 Amb2724188 [0,1,0,0,0,0|3,0,0]=4 721 B8R1.18 Cc1cc(Cl)nn1C Amb22755179 [0,1,0,0,0,0|3,0,0]=4 722 B8R1.18 Cc1cc(Cl)oc1C Amb24437563 [0,1,0,0,0,0|3,0,0]=4 723 B8R1.18 Cc1cc(Cl)sc1Cl Amb4013235 [0,1,0,0,0,0|3,0,0]=4 724 B8R1.18 Cc1cc(F)n(C)n1 Amb22008914 [0,1,0,0,0,0|3,0,0]=4 725 B8R1.18 Cc1cc(I)n(C)n1 Amb19886669 [0,1,0,0,0,0|3,0,0]=4 726 B8R1.18 Cc1cc(I)nn1C Amb20619999 [0,1,0,0,0,0|3,0,0]=4 727 B8R1.18 Cc1cc(I)sc1I Amb22898805 [0,1,0,0,0,0|3,0,0]=4 728 B8R1.18 Cc1cc(N)cn1C Amb27409528 [0,1,0,0,0,0|2,0,0]=3 729 B8R1.18 Cc1cc(N)n(C)n1 Amb1152506 [0,1,0,0,0,0|3,0,0]=4 730 B8R1.18 Cc1cc(N)n(C)n1 Amb2720286 [0,1,0,0,0,0|3,0,0]=4 731 B8R1.18 Cc1cc(N)nn1C Amb22279524 [0,1,0,0,0,0|3,0,0]=4 732 B8R1.18 Cc1cc(N)nn1C Amb22735943 [0,1,0,0,0,0|3,0,0]=4 733 B8R1.18 Cc1cc(N)nn1C Amb2693441 [0,1,0,0,0,0|3,0,0]=4 734 B8R1.18 Cc1cc(N)sc1Br Amb18817136 [0,1,0,0,0,0|3,0,0]=4 735 B8R1.18 Cc1cc(N)sc1C Amb17096049 [0,1,0,0,0,0|3,0,0]=4 736 B8R1.18 Cc1cc(O)n(C)n1 Amb6374189 [0,1,0,0,0,0|2,1,0]=4 737 B8R1.18 Cc1cc(S)nn1C Amb25242728 [0,1,0,0,0,0|3,0,0]=4 738 B8R1.18 Cc1cn(C)[n+](C)c1 Amb22367587 [0,1,0,0,0,0|3,0,0]=4 739 B8R1.18 Cc1cn(C)c(Br)n1 Amb10069027 [0,1,0,0,0,0|1,0,1]=3 740 B8R1.18 Cc1cn(C)c(N)n1 Amb25883457 [0,1,0,0,0,0|1,0,1]=3 741 B8R1.18 Cc1cn(C)c(N)n1 Amb35751622 [0,1,0,0,0,0|1,0,1]=3 742 B8R1.18 Cc1nc(Br)cn1C Amb7093831 [0,1,0,0,0,0|1,0,1]=3 743 B8R1.18 Cc1nc(Br)n(C)n1 Amb18825066 [0,1,0,0,0,0|2,0,1]=4 744 B8R1.18 Cc1nc(Br)nn1C Amb18825072 [0,1,0,0,0,0|2,0,1]=4 745 B8R1.18 Cc1nc(Cl)n(C)n1 Amb19652022 [0,1,0,0,0,0|2,0,1]=4 746 B8R1.18 Cc1nc(Cl)nn1C Amb19517094 [0,1,0,0,0,0|2,0,1]=4 747 B8R1.18 Cc1nc(I)cn1C Amb27399651 [0,1,0,0,0,0|1,0,1]=3 748 B8R1.18 Cc1nc(N)cn1C Amb18522258 [0,1,0,0,0,0|1,0,1]=3 749 B8R1.18 Cc1nc(N)n(C)n1 Amb2459678 [0,1,0,0,0,0|2,0,1]=4 750 B8R1.18 Cc1nc(N)n(C)n1 Amb32990150 [0,1,0,0,0,0|2,0,1]=4 751 B8R1.18 Cc1nc(N)n(C)n1 Amb341615 [0,1,0,0,0,0|2,0,1]=4 752 B8R1.18 Cc1nc(N)nn1C Amb2785210 [0,1,0,0,0,0|2,0,1]=4 753 B8R1.18 Cc1nc(O)n(C)n1 Amb26608468 [0,1,0,0,0,0|1,1,1]=4 754 B8R1.18 Cc1sc(N)c[n+]1C Amb27842141 [0,1,0,0,0,0|2,0,1]=4 755 B8R1.18 Cn1cc(Br)nc1Br Amb10069030 [0,1,0,0,0,0|1,0,1]=3 756 B8R1.18 Cn1cc(Br)nc1N Amb25798460 [0,1,0,0,0,0|1,0,1]=3 757 B8R1.18 Cn1cc(I)nc1I Amb22750025 [0,1,0,0,0,0|1,0,1]=3 758 B8R1.18 Cn1cc(N)nc1Br Amb33191740 [0,1,0,0,0,0|1,0,1]=3 759 B8R1.18 Cn1cc(O)nc1N Amb6608731 [0,1,0,0,0,0|1,0,1]=3 760 B8R1.18 Cn1nc(Br)cc1Br Amb24675060 [0,1,0,0,0,0|3,0,0]=4 761 B8R1.18 Cn1nc(Br)cc1Cl Amb25219129 [0,1,0,0,0,0|3,0,0]=4 762 B8R1.18 Cn1nc(Br)cc1F Amb27256769 [0,1,0,0,0,0|3,0,0]=4 763 B8R1.18 Cn1nc(Br)cc1N Amb19957996 [0,1,0,0,0,0|3,0,0]=4 764 B8R1.18 Cn1nc(Br)cc1O Amb33295139 [0,1,0,0,0,0|2,1,0]=4 765 B8R1.18 Cn1nc(Br)cc1S Amb33430545 [0,1,0,0,0,0|2,0,1]=4 766 B8R1.18 Cn1nc(Br)nc1Br Amb2148780 [0,1,0,0,0,0|2,0,1]=4 767 B8R1.18 Cn1nc(Br)nc1Cl Amb33456964 [0,1,0,0,0,0|2,0,1]=4 768 B8R1.18 Cn1nc(Br)nc1F Amb32419611 [0,1,0,0,0,0|2,0,1]=4 769 B8R1.18 Cn1nc(Br)nc1I Amb33249785 [0,1,0,0,0,0|2,0,1]=4 770 B8R1.18 Cn1nc(Br)nc1N Amb28120565 [0,1,0,0,0,0|2,0,1]=4 771 B8R1.18 Cn1nc(Br)nc1N Amb30585375 [0,1,0,0,0,0|2,0,1]=4 772 B8R1.18 Cn1nc(Cl)cc1Cl Amb25163875 [0,1,0,0,0,0|3,0,0]=4 773 B8R1.18 Cn1nc(Cl)cc1N Amb23401230 [0,1,0,0,0,0|3,0,0]=4 774 B8R1.18 Cn1nc(Cl)cc1N Amb23401232 [0,1,0,0,0,0|3,0,0]=4 775 B8R1.18 Cn1nc(Cl)cc1N Amb23439271 [0,1,0,0,0,0|3,0,0]=4 776 B8R1.18 Cn1nc(Cl)nc1Cl Amb19516645 [0,1,0,0,0,0|2,0,1]=4 777 B8R1.18 Cn1nc(Cl)nc1N Amb18124368 [0,1,0,0,0,0|2,0,1]=4 778 B8R1.18 Cn1nc(Cl)nc1N Amb22587355 [0,1,0,0,0,0|2,0,1]=4 779 B8R1.18 Cn1nc(F)nc1Br Amb32419609 [0,1,0,0,0,0|2,0,1]=4 780 B8R1.18 Cn1nc(I)cc1F Amb28323337 [0,1,0,0,0,0|3,0,0]=4 781 B8R1.18 Cn1nc(I)cc1N Amb31209479 [0,1,0,0,0,0|3,0,0]=4 782 B8R1.18 Cn1nc(N)cc1Br Amb18647932 [0,1,0,0,0,0|3,0,0]=4 783 B8R1.18 Cn1nc(N)cc1Br Amb32681180 [0,1,0,0,0,0|3,0,0]=4 784 B8R1.18 Cn1nc(N)cc1Br Amb33620594 [0,1,0,0,0,0|3,0,0]=4 785 B8R1.18 Cn1nc(N)cc1Cl Amb22491046 [0,1,0,0,0,0|3,0,0]=4 786 B8R1.18 Cn1nc(N)cc1I Amb31209509 [0,1,0,0,0,0|3,0,0]=4 787 B8R1.18 Cn1nc(N)cc1N Amb18276052 [0,1,0,0,0,0|3,0,0]=4 788 B8R1.18 Cn1nc(N)cc1N Amb24053273 [0,1,0,0,0,0|3,0,0]=4 789 B8R1.18 Cn1nc(N)cc1O Amb18137622 [0,1,0,0,0,0|2,1,0]=4 790 B8R1.18 Cn1nc(N)nc1Br Amb26058420 [0,1,0,0,0,0|2,0,1]=4 791 B8R1.18 Cn1nc(N)nc1N Amb15701453 [0,1,0,0,0,0|2,0,1]=4 792 B8R1.18 Cn1nc(N)nc1N Amb22587344 [0,1,0,0,0,0|2,0,1]=4 793 B8R1.18 Cn1nc(O)cc1Cl Amb27791209 [0,1,0,0,0,0|3,0,0]=4 794 B8R1.18 Cn1sc(Cl)cc1=O Amb15691666 [0,1,0,0,0,0|2,1,0]=4 795 B8R1.18 NC1=CC(=O)NC1=O Amb27627676 [0,1,0,0,0,0|2,1,0]=4 796 B8R1.18 NN1CC(=O)NC1=O Amb1106079 [0,1,0,0,0,0|1,1,1]=4 797 B8R1.18 NN1CC(=O)NC1=O Amb2720280 [0,1,0,0,0,0|1,1,1]=4 798 B8R1.18 O=C1C=C(Br)C(=O)N1 Amb6739957 [0,1,0,0,0,0|2,1,0]=4 799 B8R1.18 O=C1C=C(O)C(=O)N1 Amb28323034 [0,1,0,0,0,0|2,1,0]=4 800 B8R1.18 O=C1CN([SiH3])C(=O)N1 Amb28071257 [0,1,0,0,0,0|0,2,1]=4 801 B8R1.18 [NH3+]N1CC(=O)NC1=O Amb4296932 [0,1,0,0,0,0|1,1,1]=4 802 B8R1.19 CC1(C)CCNC1=S Amb25265103 [0,1,0,0,0,0|1,0,2]=4 803 B8R1.19 CC1(C)N=CNC1=S Amb27168225 [0,1,0,0,0,0|2,0,0]=3 804 B8R1.50 C=C1N(C)C=CN1N Amb27800177 [0,1,0,0,0,0|1,0,0]=2 805 B8R1.50 C=C1N(C)CCN1C Amb28057160 [0,1,0,0,0,0|1,0,2]=4 806 B8R1.50 CC1=C(C)C(=O)NC1 Amb2778404 [0,1,0,0,0,0|1,1,1]=4 807 B8R1.50 CC1=C(C)C(=O)NN1 Amb21932497 [0,1,0,0,0,0|2,1,0]=4 808 B8R1.50 CC1=C(N)NNC1=O Amb18641725 [0,1,0,0,0,0|2,1,0]=4 809 B8R1.50 CC1=CSC(=S)N1C Amb22732075 [0,1,0,0,0,0|1,0,0]=2 810 B8R1.50 CC1=CSC(=S)N1O Amb19894617 [0,1,0,0,0,0|2,0,0]=3 811 B8R1.50 CC1=NNC(=O)C1C Amb3429410 [0,1,0,0,0,0|2,1,0]=4 812 B8R1.50 CC1=NNC(=O)N1C Amb22732220 [0,1,0,0,0,0|1,1,0]=3 813 B8R1.50 CC1=NNC(=O)N1N Amb18048389 [0,1,0,0,0,0|2,1,0]=4 814 B8R1.50 CC1C(=O)NN=C1N Amb17593175 [0,1,0,0,0,0|2,1,0]=4 815 B8R1.50 CC1C=CC(C)C1=O Amb28202330 [0,1,0,0,0,0|2,1,0]=4 816 B8R1.50 CC1COC(=S)N1C Amb24524261 [0,1,0,0,0,0|1,0,2]=4 817 B8R1.50 CC1NCC(=O)N1C Amb24742108 [0,1,0,0,0,0|1,0,2]=4 818 B8R1.50 CN1C(=N)NCC1=O Amb24700464 [0,1,0,0,0,0|1,0,1]=3 819 B8R1.50 CN1C(=N)NCC1=O Amb28934857 [0,1,0,0,0,0|1,0,1]=3 820 B8R1.50 CN1C(=O)C=CC1=O Amb1158022 [0,1,0,0,0,0|1,1,0]=3 821 B8R1.50 CN1C(=O)C=CC1=S Amb27835276 [0,1,0,0,0,0|1,0,0]=2 822 B8R1.50 CN1C(=O)CCC1=O Amb6368854 [0,1,0,0,0,0|1,1,1]=4 823 B8R1.50 CN1C(=O)CNC1=O Amb22002559 [0,1,0,0,0,0|0,1,1]=3 824 B8R1.50 CN1C(=O)CNC1=S Amb5435240 [0,1,0,0,0,0|0,0,1]=2 825 B8R1.50 CN1C(=O)COC1=O Amb21927685 [0,1,0,0,0,0|1,1,1]=4 826 B8R1.50 CN1C(=O)CSC1=O Amb1883006 [0,1,0,0,0,0|1,1,1]=4 827 B8R1.50 CN1C(=O)CSC1=S Amb2526313 [0,1,0,0,0,0|1,0,1]=3 828 B8R1.50 CN1C(=O)NN=C1S Amb19389548 [0,1,0,0,0,0|1,1,0]=3 829 B8R1.50 CN1C(=O)NNC1=O Amb22347867 [0,1,0,0,0,0|1,1,0]=3 830 B8R1.50 CN1C(=S)SCC1O Amb27486159 [0,1,0,0,0,0|1,0,2]=4 831 B8R1.50 CN1C=CC(O)C1=O Amb28207084 [0,1,0,0,0,0|1,1,0]=3 832 B8R1.50 CN1C=CN(C)C1=S Amb22734182 [0,1,0,0,0,0|0,0,0]=1 833 B8R1.50 CN1C=NC(=O)N1C Amb27651181 [0,1,0,0,0,0|1,1,1]=4 834 B8R1.50 CN1CC=C(Cl)C1=O Amb28255503 [0,1,0,0,0,0|1,1,1]=4 835 B8R1.50 CN1CC=C(N)C1=O Amb27971244 [0,1,0,0,0,0|1,1,1]=4 836 B8R1.50 CN1CCN(C)C1=N Amb30982079 [0,1,0,0,0,0|1,0,2]=4 837 B8R1.50 CN1CCN(C)C1=O Amb1195982 [0,1,0,0,0,0|0,1,2]=4 838 B8R1.50 CN1CCN(N)C1=O Amb24643625 [0,1,0,0,0,0|0,1,2]=4 839 B8R1.50 CN1N=CN(N)C1=O Amb28315713 [0,1,0,0,0,0|1,1,0]=3 840 B8R1.50 CN1N=NN(C)C1=O Amb28313687 [0,1,0,0,0,0|2,1,0]=4 841 B8R1.50 CN1N=NN(C)C1=S Amb21948803 [0,1,0,0,0,0|2,0,0]=3 842 B8R1.50 CN1OCC(N)C1=S Amb27620645 [0,1,0,0,0,0|2,0,1]=4 843 B8R1.50 C[C@H]1C=C[C@@H](C)C1=O Amb28316115 [0,1,0,0,0,0|2,1,0]=4 844 B8R1.50 Cc1c(Br)cnn1C Amb6752534 [0,1,0,0,0,0|3,0,0]=4 845 B8R1.50 Cc1c(Br)csc1Br Amb26004998 [0,1,0,0,0,0|3,0,0]=4 846 B8R1.50 Cc1c(Br)ncn1C Amb8393429 [0,1,0,0,0,0|3,0,0]=4 847 B8R1.50 Cc1c(Cl)cnn1C Amb9173511 [0,1,0,0,0,0|3,0,0]=4 848 B8R1.50 Cc1c(Cl)ncn1C Amb24270571 [0,1,0,0,0,0|3,0,0]=4 849 B8R1.50 Cc1c(I)cnn1C Amb33549217 [0,1,0,0,0,0|3,0,0]=4 850 B8R1.50 Cc1c(I)ncn1C Amb24270587 [0,1,0,0,0,0|3,0,0]=4 851 B8R1.50 Cc1c(N)cnn1C Amb15740794 [0,1,0,0,0,0|3,0,0]=4 852 B8R1.50 Cc1c(N)cnn1C Amb1933720 [0,1,0,0,0,0|3,0,0]=4 853 B8R1.50 Cc1c(N)cnn1C Amb2693462 [0,1,0,0,0,0|3,0,0]=4 854 B8R1.50 Cc1c(N)ncn1C Amb28428870 [0,1,0,0,0,0|3,0,0]=4 855 B8R1.50 Cc1c(N)ncn1C Amb30588576 [0,1,0,0,0,0|3,0,0]=4 856 B8R1.50 Cc1c(O)cnn1C Amb28316174 [0,1,0,0,0,0|3,0,0]=4 857 B8R1.50 Cc1c(S)cnn1C Amb24662569 [0,1,0,0,0,0|3,0,0]=4 858 B8R1.50 Cc1ccc(Br)n1C Amb27445374 [0,1,0,0,0,0|2,0,0]=3 859 B8R1.50 Cc1ccc(C)n1C Amb839357 [0,1,0,0,0,0|2,0,0]=3 860 B8R1.50 Cc1ccc(C)n1N Amb9786945 [0,1,0,0,0,0|3,0,0]=4 861 B8R1.50 Cc1ccn(O)c1C Amb27636587 [0,1,0,0,0,0|2,0,0]=3 862 B8R1.50 Cc1cnc(Br)n1C Amb10069040 [0,1,0,0,0,0|1,0,1]=3 863 B8R1.50 Cc1cnc(N)n1C Amb24579627 [0,1,0,0,0,0|1,0,1]=3 864 B8R1.50 Cc1cnc(S)n1C Amb27428500 [0,1,0,0,0,0|0,0,2]=3 865 B8R1.50 Cc1cnn(C)c1Br Amb24183368 [0,1,0,0,0,0|3,0,0]=4 866 B8R1.50 Cc1cnn(C)c1Cl Amb27250579 [0,1,0,0,0,0|3,0,0]=4 867 B8R1.50 Cc1cnn(C)c1F Amb27876990 [0,1,0,0,0,0|3,0,0]=4 868 B8R1.50 Cc1cnn(C)c1I Amb22272913 [0,1,0,0,0,0|3,0,0]=4 869 B8R1.50 Cc1cnn(C)c1N Amb10607664 [0,1,0,0,0,0|3,0,0]=4 870 B8R1.50 Cc1cnn(C)c1N Amb33535697 [0,1,0,0,0,0|3,0,0]=4 871 B8R1.50 Cc1cnn(C)c1O Amb26884832 [0,1,0,0,0,0|2,1,0]=4 872 B8R1.50 Cc1cnn(C)c1S Amb33320106 [0,1,0,0,0,0|2,0,1]=4 873 B8R1.50 Cc1cnn(N)c1C Amb27397414 [0,1,0,0,0,0|3,0,0]=4 874 B8R1.50 Cc1csc(C)[n+]1C Amb2779789 [0,1,0,0,0,0|2,0,1]=4 875 B8R1.50 Cc1n(O)cc[n+]1[O-] Amb1044005 [0,1,0,0,0,0|2,0,1]=4 876 B8R1.50 Cc1ncc(Br)n1C Amb2723385 [0,1,0,0,0,0|1,0,1]=3 877 B8R1.50 Cc1ncc(I)n1C Amb26370461 [0,1,0,0,0,0|1,0,1]=3 878 B8R1.50 Cc1ncc(N)n1C Amb35750403 [0,1,0,0,0,0|1,0,1]=3 879 B8R1.50 Cc1ncc(N)n1C Amb9770167 [0,1,0,0,0,0|1,0,1]=3 880 B8R1.50 Cc1ncc(O)n1C Amb27222570 [0,1,0,0,0,0|1,0,1]=3 881 B8R1.50 Cc1ncn(C)c1Br Amb22728023 [0,1,0,0,0,0|3,0,0]=4 882 B8R1.50 Cc1ncn(C)c1Cl Amb24270569 [0,1,0,0,0,0|3,0,0]=4 883 B8R1.50 Cc1ncn(C)c1I Amb22803219 [0,1,0,0,0,0|3,0,0]=4 884 B8R1.50 Cc1ncn(C)c1N Amb18277978 [0,1,0,0,0,0|3,0,0]=4 885 B8R1.50 Cc1ncn(C)c1N Amb30588547 [0,1,0,0,0,0|3,0,0]=4 886 B8R1.50 Cc1ncn(N)c1N Amb18275824 [0,1,0,0,0,0|3,0,0]=4 887 B8R1.50 Cc1nnc(Br)n1C Amb25265606 [0,1,0,0,0,0|2,0,1]=4 888 B8R1.50 Cc1nnc(I)n1C Amb28048974 [0,1,0,0,0,0|2,0,1]=4 889 B8R1.50 Cc1nnc(N)n1C Amb17064509 [0,1,0,0,0,0|2,0,1]=4 890 B8R1.50 Cc1nnc(N)n1C Amb24271085 [0,1,0,0,0,0|2,0,1]=4 891 B8R1.50 Cc1nnc(S)n1C Amb6335624 [0,1,0,0,0,0|1,0,2]=4 892 B8R1.50 Cc1nnc([S-])n1C Amb28991338 [0,1,0,0,0,0|1,0,2]=4 893 B8R1.50 Cc1scc(Br)c1C Amb25076813 [0,1,0,0,0,0|3,0,0]=4 894 B8R1.50 Cc1scc(N)[n+]1C Amb27771889 [0,1,0,0,0,0|2,0,1]=4 895 B8R1.50 Cc1scc(N)c1C Amb9132576 [0,1,0,0,0,0|3,0,0]=4 896 B8R1.50 Cn1c(Br)cnc1Br Amb10068576 [0,1,0,0,0,0|1,0,1]=3 897 B8R1.50 Cn1c(Br)cnc1N Amb25252240 [0,1,0,0,0,0|1,0,1]=3 898 B8R1.50 Cn1c(Cl)cnc1Cl Amb24382763 [0,1,0,0,0,0|1,0,1]=3 899 B8R1.50 Cn1c(Cl)nnc1Cl Amb24446553 [0,1,0,0,0,0|2,0,1]=4 900 B8R1.50 Cn1c(I)cnc1Cl Amb25082612 [0,1,0,0,0,0|1,0,1]=3 901 B8R1.50 Cn1c(I)cnc1I Amb2455807 [0,1,0,0,0,0|1,0,1]=3 902 B8R1.50 Cn1c(N)ccc1N Amb27453589 [0,1,0,0,0,0|2,0,0]=3 903 B8R1.50 Cn1c(N)cnc1Cl Amb33191742 [0,1,0,0,0,0|1,0,1]=3 904 B8R1.50 Cn1c(N)cnc1S Amb26421578 [0,1,0,0,0,0|0,0,2]=3 905 B8R1.50 Cn1c(N)nnc1Br Amb25252982 [0,1,0,0,0,0|2,0,1]=4 906 B8R1.50 Cn1c(N)nnc1N Amb25745217 [0,1,0,0,0,0|2,0,1]=4 907 B8R1.50 Cn1c(N)nnc1S Amb6892477 [0,1,0,0,0,0|1,0,2]=4 908 B8R1.50 Cn1c(O)cnc1Cl Amb29849307 [0,1,0,0,0,0|1,0,1]=3 909 B8R1.50 Cn1c(O)cnc1N Amb35710116 [0,1,0,0,0,0|1,0,1]=3 910 B8R1.50 Cn1c(O)nnc1S Amb2371039 [0,1,0,0,0,0|1,0,2]=4 911 B8R1.50 Cn1c(S)nnc1Cl Amb27398583 [0,1,0,0,0,0|1,0,2]=4 912 B8R1.50 Cn1c(S)nnc1S Amb6892480 [0,1,0,0,0,0|1,0,2]=4 913 B8R1.50 Cn1cc[n+](C)c1Cl Amb26395977 [0,1,0,0,0,0|1,0,1]=3 914 B8R1.50 Cn1cc[n+](C)c1N Amb27631170 [0,1,0,0,0,0|1,0,1]=3 915 B8R1.50 Cn1cnc(Br)c1Br Amb8629437 [0,1,0,0,0,0|3,0,0]=4 916 B8R1.50 Cn1cnc(Br)c1Cl Amb27873577 [0,1,0,0,0,0|3,0,0]=4 917 B8R1.50 Cn1cnc(Cl)c1Br Amb33430930 [0,1,0,0,0,0|3,0,0]=4 918 B8R1.50 Cn1cnc(Cl)c1Cl Amb4477161 [0,1,0,0,0,0|3,0,0]=4 919 B8R1.50 Cn1cnc(Cl)c1O Amb33481847 [0,1,0,0,0,0|2,1,0]=4 920 B8R1.50 Cn1cnc(F)c1Br Amb22886781 [0,1,0,0,0,0|3,0,0]=4 921 B8R1.50 Cn1cnc(I)c1Cl Amb1770088 [0,1,0,0,0,0|3,0,0]=4 922 B8R1.50 Cn1cnc(I)c1I Amb9753469 [0,1,0,0,0,0|3,0,0]=4 923 B8R1.50 Cn1cnc(N)c1Br Amb18825078 [0,1,0,0,0,0|3,0,0]=4 924 B8R1.50 Cn1cnc(N)c1N Amb27217026 [0,1,0,0,0,0|3,0,0]=4 925 B8R1.50 Cn1cnc(N)c1S Amb18203231 [0,1,0,0,0,0|2,0,1]=4 926 B8R1.50 Cn1ncc(Br)c1Br Amb28054281 [0,1,0,0,0,0|3,0,0]=4 927 B8R1.50 Cn1ncc(Br)c1Cl Amb32417727 [0,1,0,0,0,0|3,0,0]=4 928 B8R1.50 Cn1ncc(Br)c1F Amb24269161 [0,1,0,0,0,0|3,0,0]=4 929 B8R1.50 Cn1ncc(Br)c1I Amb32685590 [0,1,0,0,0,0|3,0,0]=4 930 B8R1.50 Cn1ncc(Br)c1N Amb2684359 [0,1,0,0,0,0|3,0,0]=4 931 B8R1.50 Cn1ncc(Br)c1N Amb28934836 [0,1,0,0,0,0|3,0,0]=4 932 B8R1.50 Cn1ncc(Br)c1N Amb32663680 [0,1,0,0,0,0|3,0,0]=4 933 B8R1.50 Cn1ncc(Br)c1O Amb26056091 [0,1,0,0,0,0|2,1,0]=4 934 B8R1.50 Cn1ncc(Cl)c1Br Amb26066934 [0,1,0,0,0,0|3,0,0]=4 935 B8R1.50 Cn1ncc(Cl)c1Cl Amb32417784 [0,1,0,0,0,0|3,0,0]=4 936 B8R1.50 Cn1ncc(Cl)c1I Amb24424735 [0,1,0,0,0,0|3,0,0]=4 937 B8R1.50 Cn1ncc(Cl)c1N Amb18124340 [0,1,0,0,0,0|3,0,0]=4 938 B8R1.50 Cn1ncc(F)c1Br Amb28140815 [0,1,0,0,0,0|3,0,0]=4 939 B8R1.50 Cn1ncc(F)c1Cl Amb27663493 [0,1,0,0,0,0|3,0,0]=4 940 B8R1.50 Cn1ncc(F)c1N Amb24729811 [0,1,0,0,0,0|3,0,0]=4 941 B8R1.50 Cn1ncc(F)c1N Amb33743585 [0,1,0,0,0,0|3,0,0]=4 942 B8R1.50 Cn1ncc(I)c1Br Amb35738845 [0,1,0,0,0,0|3,0,0]=4 943 B8R1.50 Cn1ncc(I)c1Cl Amb30017720 [0,1,0,0,0,0|3,0,0]=4 944 B8R1.50 Cn1ncc(I)c1F Amb31209922 [0,1,0,0,0,0|3,0,0]=4 945 B8R1.50 Cn1ncc(I)c1N Amb22803087 [0,1,0,0,0,0|3,0,0]=4 946 B8R1.50 Cn1ncc(N)c1Br Amb25675744 [0,1,0,0,0,0|3,0,0]=4 947 B8R1.50 Cn1ncc(N)c1Cl Amb24116970 [0,1,0,0,0,0|3,0,0]=4 948 B8R1.50 Cn1ncc(N)c1Cl Amb32667514 [0,1,0,0,0,0|3,0,0]=4 949 B8R1.50 Cn1ncc(N)c1I Amb27852268 [0,1,0,0,0,0|3,0,0]=4 950 B8R1.50 Cn1ncc(N)c1I Amb33098527 [0,1,0,0,0,0|3,0,0]=4 951 B8R1.50 Cn1ncc(N)c1N Amb16233708 [0,1,0,0,0,0|3,0,0]=4 952 B8R1.50 Cn1ncc(N)c1N Amb22740140 [0,1,0,0,0,0|3,0,0]=4 953 B8R1.50 Cn1ncc(N)c1N Amb22755069 [0,1,0,0,0,0|3,0,0]=4 954 B8R1.50 Cn1ncc(N)c1N Amb32683532 [0,1,0,0,0,0|3,0,0]=4 955 B8R1.50 Cn1ncc(O)c1Cl Amb29873420 [0,1,0,0,0,0|3,0,0]=4 956 B8R1.50 Cn1ncc(O)c1N Amb28045260 [0,1,0,0,0,0|3,0,0]=4 957 B8R1.50 Cn1ncc(S)c1Br Amb35619098 [0,1,0,0,0,0|3,0,0]=4 958 B8R1.50 Cn1ncc(S)c1Cl Amb35619096 [0,1,0,0,0,0|3,0,0]=4 959 B8R1.50 NN1C(=O)CNC1=O Amb2795837 [0,1,0,0,0,0|1,1,1]=4 960 B8R1.50 NN1C(=O)CSC1=S Amb1151961 [0,1,0,0,0,0|2,0,1]=4 961 B8R1.50 NN1C(=O)NNC1=O Amb18641860 [0,1,0,0,0,0|2,1,0]=4 962 B8R1.50 Nc1ccc(N)n1N Amb27251978 [0,1,0,0,0,0|3,0,0]=4 963 B8R1.50 Nc1ccc(N)n1O Amb27258621 [0,1,0,0,0,0|3,0,0]=4 964 B8R1.50 Nc1ccn(O)c1N Amb27165218 [0,1,0,0,0,0|3,0,0]=4 965 B8R1.50 Nc1ccn(O)c1O Amb28054793 [0,1,0,0,0,0|2,1,0]=4 966 B8R1.50 Nc1ncc(O)n1O Amb28341708 [0,1,0,0,0,0|2,0,1]=4 967 B8R1.50 O=C1C=CC(=O)N1Br Amb22051679 [0,1,0,0,0,0|2,1,0]=4 968 B8R1.50 O=C1C=CC(=O)N1Cl Amb22330567 [0,1,0,0,0,0|2,1,0]=4 969 B6R0.1 C=CCC(=O)CC Amb27173052 [0,0,1,0,0,0|2,1,0]=4 970 B6R0.1 C=CCC(=O)NC Amb24479782 [0,0,1,0,0,0|1,1,0]=3 971 B6R0.1 C=CCC(C)NC Amb18292023 [0,0,1,0,0,0|2,0,1]=4 972 B6R0.1 C=CC\C(C)=C\C Amb24479822 [0,0,1,0,0,0|3,0,0]=4 973 B6R0.1 C=CNC(=N)SC Amb27244029 [0,0,1,0,0,0|2,0,0]=3 974 B6R0.1 C=CNC(=O)C=C Amb27848738 [0,0,1,0,0,0|1,1,1]=4 975 B6R0.1 C=CNC(=O)OC Amb24479688 [0,0,1,0,0,0|1,1,0]=3 976 B6R0.1 C=COC(=O)CC Amb4018556 [0,0,1,0,0,0|2,1,0]=4 977 B6R0.1 C=CSC(=O)NC Amb27969936 [0,0,1,0,0,0|1,1,0]=3 978 B6R0.1 C=C\C(C)=C/C=O Amb18638879 [0,0,1,0,0,0|3,0,0]=4 979 B6R0.1 CCC(=O)NC=N Amb28341185 [0,0,1,0,0,0|2,1,0]=4 980 B6R0.1 CCCC(=S)NC Amb27259343 [0,0,1,0,0,0|1,0,2]=4 981 B6R0.1 CCNC(=N)NC Amb24404052 [0,0,1,0,0,0|1,0,2]=4 982 B6R0.1 CCNC(=N)NC Amb31217473 [0,0,1,0,0,0|1,0,2]=4 983 B6R0.1 CCNC(=O)NC Amb24120627 [0,0,1,0,0,0|0,1,2]=4 984 B6R0.1 CCNC(=S)NC Amb9237395 [0,0,1,0,0,0|0,0,2]=3 985 B6R0.1 CCNC(=S)NN Amb6364699 [0,0,1,0,0,0|1,0,2]=4 986 B6R0.1 CCNC(=S)SC Amb27216933 [0,0,1,0,0,0|1,0,2]=4 987 B6R0.1 CNC(=N)NN=O Amb28198073 [0,0,1,0,0,0|3,0,0]=4 988 B6R0.1 CNC(=O)NC#N Amb27262223 [0,0,1,0,0,0|1,1,1]=4 989 B6R0.1 CNC(=O)\C=C/Br Amb27425015 [0,0,1,0,0,0|2,1,0]=4 990 B6R0.1 CNC(=O)\C=C\I Amb27966681 [0,0,1,0,0,0|2,1,0]=4 991 B6R0.1 CNC(=S)CC#N Amb1980794 [0,0,1,0,0,0|2,0,1]=4 992 B6R0.1 CNC(=S)NC#N Amb13777308 [0,0,1,0,0,0|1,0,1]=3 993 B6R0.1 CNC(=S)NCO Amb26381911 [0,0,1,0,0,0|1,0,1]=3 994 B6R0.1 CNC(=S)NOC Amb28316081 [0,0,1,0,0,0|1,0,1]=3 995 B6R0.1 CNCC(=S)NC Amb28313782 [0,0,1,0,0,0|2,0,1]=4 996 B6R0.1 CNNC(=O)NC Amb27461318 [0,0,1,0,0,0|1,1,1]=4 997 B6R0.1 CNNC(=S)NC Amb26959720 [0,0,1,0,0,0|1,0,1]=3 998 B6R0.1 C\C(C=O)=C/C=O Amb27597073 [0,0,1,0,0,0|2,1,0]=4 999 B6R0.1 C\C=C\C(=S)NC Amb27252022 [0,0,1,0,0,0|1,0,1]=3 1000 B6R0.1 C\C=C\C(C)=C\Cl Amb27640596 [0,0,1,0,0,0|3,0,0]=4 1001 B6R0.1 C\C=N\N(C)C=O Amb10843590 [0,0,1,0,0,0|2,1,0]=4 1002 B6R0.3 C=C(C)C(=O)NC Amb17934099 [0,0,1,0,0,0|1,1,1]=4 1003 B6R0.3 C=C(C)C(=O)NN Amb24432473 [0,0,1,0,0,0|2,1,0]=4 1004 B6R0.3 C=CC(=O)C(=C)C Amb26842538 [0,0,1,0,0,0|2,1,0]=4 1005 B6R0.3 C=CC(=O)N(C)C Amb2721141 [0,0,1,0,0,0|1,1,1]=4 1006 B6R0.3 C=CC(C)=C(C)C Amb28457266 [0,0,1,0,0,0|3,0,0]=4 1007 B6R0.3 C=CC(C)C(=C)C Amb22228297 [0,0,1,0,0,0|3,0,0]=4 1008 B6R0.3 C=CC(C)C(=O)O Amb21618706 [0,0,1,0,0,0|2,1,0]=4 1009 B6R0.3 C=CC(C)C(C)N Amb30029109 [0,0,1,0,0,0|2,0,1]=4 1010 B6R0.3 C=CC(C)C(N)=O Amb27167730 [0,0,1,0,0,0|1,1,0]=3 1011 B6R0.3 C=CC(O)C(N)=O Amb27391902 [0,0,1,0,0,0|2,1,0]=4 1012 B6R0.3 C=CN(C)C(C)=O Amb8513334 [0,0,1,0,0,0|1,1,0]=3 1013 B6R0.3 C=C[C@@H](C)C(=O)O Amb26350417 [0,0,1,0,0,0|2,1,0]=4 1014 B6R0.3 C=C[C@H](C)C(=O)O Amb25929549 [0,0,1,0,0,0|2,1,0]=4 1015 B6R0.3 C=C[C@H](O)C(N)=O Amb28282656 [0,0,1,0,0,0|2,1,0]=4 1016 B6R0.3 CC(CO)C(N)=S Amb8869143 [0,0,1,0,0,0|2,0,1]=4 1017 B6R0.3 CCC(C)C(N)=S Amb6740516 [0,0,1,0,0,0|1,0,2]=4 1018 B6R0.3 CCN(C)C(=N)N Amb33552632 [0,0,1,0,0,0|1,0,2]=4 1019 B6R0.3 CCN(C)C(=N)N Amb8890895 [0,0,1,0,0,0|1,0,2]=4 1020 B6R0.3 CCN(C)C(=S)S Amb27430266 [0,0,1,0,0,0|1,0,2]=4 1021 B6R0.3 CN(C#N)C(N)=S Amb28043010 [0,0,1,0,0,0|1,0,1]=3 1022 B6R0.3 CN(C)C(=O)NN Amb8854108 [0,0,1,0,0,0|1,1,1]=4 1023 B6R0.3 CN(C)C(=O)NO Amb32667951 [0,0,1,0,0,0|1,1,1]=4 1024 B6R0.3 CN(C)C(=S)NN Amb8515840 [0,0,1,0,0,0|1,0,1]=3 1025 B6R0.3 CN(C)C(=S)SS Amb27430030 [0,0,1,0,0,0|2,0,1]=4 1026 B6R0.3 CN(C)C(=S)S[Na] Amb10071972 [0,0,1,0,0,0|2,0,1]=4 1027 B6R0.3 CN(CO)C([O-])=S Amb27443577 [0,0,1,0,0,0|2,0,1]=4 1028 B6R0.3 CN(N)C(=O)NO Amb28239328 [0,0,1,0,0,0|2,1,0]=4 1029 B6R0.3 CN(N=O)C(N)=O Amb2694991 [0,0,1,0,0,0|2,1,0]=4 1030 B6R0.3 CN(O)C(=O)NN Amb27831015 [0,0,1,0,0,0|2,1,0]=4 1031 B6R0.3 CNC(=N)N(C)C Amb26500975 [0,0,1,0,0,0|1,0,2]=4 1032 B6R0.3 CNC(=O)N(C)C Amb4020935 [0,0,1,0,0,0|0,1,2]=4 1033 B6R0.3 CNC(=O)N(C)Cl Amb27655891 [0,0,1,0,0,0|1,1,1]=4 1034 B6R0.3 CNC(=O)N(C)O Amb27169733 [0,0,1,0,0,0|1,1,1]=4 1035 B6R0.3 CNC(=S)N(C)C Amb2725065 [0,0,1,0,0,0|0,0,2]=3 1036 B6R0.3 CNC(=S)N(C)N Amb22497916 [0,0,1,0,0,0|1,0,1]=3 1037 B6R0.3 CNC(=S)N(C)N Amb32663561 [0,0,1,0,0,0|1,0,1]=3 1038 B6R0.3 CNN(C)C(N)=O Amb28134420 [0,0,1,0,0,0|1,1,1]=4 1039 B6R0.3 COC(C)C(N)=S Amb20622535 [0,0,1,0,0,0|2,0,1]=4 1040 B6R0.3 CON(C)C(N)=O Amb25305178 [0,0,1,0,0,0|1,1,1]=4 1041 B6R0.3 CSC(=S)N(C)C Amb24479844 [0,0,1,0,0,0|1,0,2]=4 1042 B6R0.3 C\C(=C/Br)C(N)=O Amb27658807 [0,0,1,0,0,0|2,1,0]=4 1043 B6R0.3 C\C(=C/N)C(=N)N Amb27879530 [0,0,1,0,0,0|3,0,0]=4 1044 B6R0.3 C\C=C(/C)C(=N)N Amb27838198 [0,0,1,0,0,0|2,0,1]=4 1045 B6R0.3 C\C=C(\C)C(=N)N Amb28131426 [0,0,1,0,0,0|2,0,1]=4 1046 B6R0.3 C\C=C(\C)C(N)=O Amb28318688 [0,0,1,0,0,0|1,1,1]=4 1047 B6R0.6 C=C\C=C\C=C\C Amb27627431 [0,0,1,0,0,0|3,0,0]=4 1048 B6R0.6 C=C\C=C\CNC Amb25244153 [0,0,1,0,0,0|2,0,1]=4 1049 B6R0.6 CC\C=C/CC=O Amb18639157 [0,0,1,0,0,0|2,1,0]=4 1050 B6R0.6 CC\C=C\C=C/Br Amb27392254 [0,0,1,0,0,0|3,0,0]=4 1051 B6R0.6 CC\C=C\C=C\Br Amb27233492 [0,0,1,0,0,0|3,0,0]=4 1052 B6R0.6 CO\C=C\C=C/Cl Amb27863084 [0,0,1,0,0,0|3,0,0]=4 1053 B6R0.6 C\C=C\C=C\C=O Amb33986154 [0,0,1,0,0,0|2,1,0]=4 1054 B6R1.4 CC1CNC1=O Amb24444140 [0,0,0,0,1,0|1,1,1]=4 1055 B6R1.4 CC1NNC1=O Amb35751853 [0,0,0,0,1,0|2,1,0]=4 1056 B6R1.4 C[C@H]1CNC1=O Amb27620602 [0,0,0,0,1,0|1,1,1]=4 1057 B6R1.4 O=C1C=CC1=O Amb22731249 [0,0,0,0,1,0|2,1,0]=4 1058 B8R1.4 C=C1C=C(C)C=CN1 Amb24070501 [0,0,0,0,0,1|2,0,0]=3 1059 B8R1.4 C=C1C=CNC(C)=C1 Amb24084773 [0,0,0,0,0,1|2,0,1]=4 1060 B8R1.4 CC1=CC(=O)C=CN1 Amb22492433 [0,0,0,0,0,1|3,0,0]=4 1061 B8R1.4 CC1=CC(=O)C=CN1 Amb33714765 [0,0,0,0,0,1|3,0,0]=4 1062 B8R1.4 CC1=CC(=O)NC=C1 Amb18034270 [0,0,0,0,0,1|1,1,0]=3 1063 B8R1.4 CC1=CC(=O)NC=N1 Amb19116078 [0,0,0,0,0,1|2,1,0]=4 1064 B8R1.4 CC1=CC(=O)NC=N1 Amb33621237 [0,0,0,0,0,1|2,1,0]=4 1065 B8R1.4 CC1=CC(=O)NN=C1 Amb19892393 [0,0,0,0,0,1|2,1,0]=4 1066 B8R1.4 CC1=CC(=S)C=CN1 Amb24062502 [0,0,0,0,0,1|3,0,0]=4 1067 B8R1.4 CC1=CC(=S)NC=N1 Amb18013063 [0,0,0,0,0,1|2,0,0]=3 1068 B8R1.4 CC1=CC(=S)NN=C1 Amb24370677 [0,0,0,0,0,1|2,0,0]=3 1069 B8R1.4 CC1=CC=CC(=O)N1 Amb18540672 [0,0,0,0,0,1|2,1,0]=4 1070 B8R1.4 CC1=CC=CC(=O)N1 Amb32789652 [0,0,0,0,0,1|2,1,0]=4 1071 B8R1.4 CC1=CC=CC(=O)O1 Amb20247496 [0,0,0,0,0,1|2,1,0]=4 1072 B8R1.4 CC1=CC=NC(=O)N1 Amb22371457 [0,0,0,0,0,1|1,1,1]=4 1073 B8R1.4 CC1=CC=NC(=S)N1 Amb18800681 [0,0,0,0,0,1|1,0,1]=3 1074 B8R1.4 CC1=CCNC(=O)O1 Amb23596886 [0,0,0,0,0,1|1,1,1]=4 1075 B8R1.4 CC1=NC(=O)C=CN1 Amb33552640 [0,0,0,0,0,1|3,0,0]=4 1076 B8R1.4 CC1=NC(=O)NC=C1 Amb19267100 [0,0,0,0,0,1|1,1,0]=3 1077 B8R1.4 CC1=NC(=O)NC=C1 Amb22168002 [0,0,0,0,0,1|1,1,0]=3 1078 B8R1.4 CC1=NC(=S)NC=C1 Amb22727957 [0,0,0,0,0,1|1,0,0]=2 1079 B8R1.4 CC1=NN(C)CCN1 Amb27982433 [0,0,0,0,0,1|1,0,2]=4 1080 B8R1.4 CC1C=CNC(=S)S1 Amb27838376 [0,0,0,0,0,1|1,0,0]=2 1081 B8R1.4 CC1C=CNC(S)=N1 Amb24395093 [0,0,0,0,0,1|1,0,1]=3 1082 B8R1.4 CC1C=NNC(N)=N1 Amb28364344 [0,0,0,0,0,1|3,0,0]=4 1083 B8R1.4 CC1CCNC(=S)N1 Amb27838373 [0,0,0,0,0,1|1,0,2]=4 1084 B8R1.4 CN1CC=CC(=O)C1 Amb27186211 [0,0,0,0,0,1|1,1,1]=4 1085 B8R1.4 CN1CCNC(=O)C1 Amb19958159 [0,0,0,0,0,1|0,1,2]=4 1086 B8R1.4 C[n+]1cccc(Br)c1 Amb10975994 [0,0,0,0,0,1|2,0,1]=4 1087 B8R1.4 C[n+]1cccc(Cl)c1 Amb2609543 [0,0,0,0,0,1|2,0,1]=4 1088 B8R1.4 C[n+]1cccc(O)c1 Amb10552608 [0,0,0,0,0,1|1,1,1]=4 1089 B8R1.4 C[n+]1cccc(O)c1 Amb10573234 [0,0,0,0,0,1|1,1,1]=4 1090 B8R1.4 C[n+]1cccc(O)c1 Amb19652047 [0,0,0,0,0,1|1,1,1]=4 1091 B8R1.4 C[n+]1cccc(O)c1 Amb32652599 [0,0,0,0,0,1|1,1,1]=4 1092 B8R1.4 C[n+]1cccc(O)c1 Amb4013611 [0,0,0,0,0,1|1,1,1]=4 1093 B8R1.4 Cc1cccc(Br)c1 Amb2685511 [0,0,0,0,0,1|3,0,0]=4 1094 B8R1.4 Cc1cccc(Br)n1 Amb2685342 [0,0,0,0,0,1|3,0,0]=4 1095 B8R1.4 Cc1cccc(C)c1 Amb6608996 [0,0,0,0,0,1|3,0,0]=4 1096 B8R1.4 Cc1cccc(C)n1 Amb22734688 [0,0,0,0,0,1|3,0,0]=4 1097 B8R1.4 Cc1cccc(C)n1 Amb2609959 [0,0,0,0,0,1|3,0,0]=4 1098 B8R1.4 Cc1cccc(Cl)c1 Amb6296593 [0,0,0,0,0,1|3,0,0]=4 1099 B8R1.4 Cc1cccc(Cl)n1 Amb3939995 [0,0,0,0,0,1|3,0,0]=4 1100 B8R1.4 Cc1cccc(F)c1 Amb2688427 [0,0,0,0,0,1|3,0,0]=4 1101 B8R1.4 Cc1cccc(F)n1 Amb2688234 [0,0,0,0,0,1|3,0,0]=4 1102 B8R1.4 Cc1cccc(I)c1 Amb2688892 [0,0,0,0,0,1|3,0,0]=4 1103 B8R1.4 Cc1cccc(I)n1 Amb16230965 [0,0,0,0,0,1|3,0,0]=4 1104 B8R1.4 Cc1cccc(N)c1 Amb2792819 [0,0,0,0,0,1|3,0,0]=4 1105 B8R1.4 Cc1cccc(N)c1 Amb4026398 [0,0,0,0,0,1|3,0,0]=4 1106 B8R1.4 Cc1cccc(N)n1 Amb1935084 [0,0,0,0,0,1|3,0,0]=4 1107 B8R1.4 Cc1cccc(O)c1 Amb3939017 [0,0,0,0,0,1|2,1,0]=4 1108 B8R1.4 Cc1cccc(O)n1 Amb2725655 [0,0,0,0,0,1|2,1,0]=4 1109 B8R1.4 Cc1cccc(S)c1 Amb2690595 [0,0,0,0,0,1|2,0,1]=4 1110 B8R1.4 Cc1cccc(S)n1 Amb17943113 [0,0,0,0,0,1|2,0,1]=4 1111 B8R1.4 Cc1ccnc(Br)c1 Amb4476992 [0,0,0,0,0,1|2,0,1]=4 1112 B8R1.4 Cc1ccnc(Br)n1 Amb8629076 [0,0,0,0,0,1|2,0,1]=4 1113 B8R1.4 Cc1ccnc(C)c1 Amb6891936 [0,0,0,0,0,1|2,0,1]=4 1114 B8R1.4 Cc1ccnc(C)n1 Amb22491311 [0,0,0,0,0,1|2,0,1]=4 1115 B8R1.4 Cc1ccnc(Cl)c1 Amb2686244 [0,0,0,0,0,1|2,0,1]=4 1116 B8R1.4 Cc1ccnc(Cl)n1 Amb2786105 [0,0,0,0,0,1|2,0,1]=4 1117 B8R1.4 Cc1ccnc(F)c1 Amb2447353 [0,0,0,0,0,1|2,0,1]=4 1118 B8R1.4 Cc1ccnc(I)c1 Amb19930103 [0,0,0,0,0,1|2,0,1]=4 1119 B8R1.4 Cc1ccnc(I)n1 Amb22497942 [0,0,0,0,0,1|2,0,1]=4 1120 B8R1.4 Cc1ccnc(N)c1 Amb1353207 [0,0,0,0,0,1|2,0,1]=4 1121 B8R1.4 Cc1ccnc(N)n1 Amb2684479 [0,0,0,0,0,1|2,0,1]=4 1122 B8R1.4 Cc1ccnc(O)n1 Amb2717748 [0,0,0,0,0,1|1,1,1]=4 1123 B8R1.4 Cc1ccnc(O)n1 Amb8397264 [0,0,0,0,0,1|1,1,1]=4 1124 B8R1.4 Cc1ccnc(S)c1 Amb22298792 [0,0,0,0,0,1|1,0,2]=4 1125 B8R1.4 Cc1ccnc(S)n1 Amb17758427 [0,0,0,0,0,1|1,0,2]=4 1126 B8R1.4 Cc1ccnc(S)n1 Amb3467894 [0,0,0,0,0,1|1,0,2]=4 1127 B8R1.4 FC1=CC=CN(Cl)N1 Amb24527704 [0,0,0,0,0,1|3,0,0]=4 1128 B8R1.4 FC1=CC=NC(=S)N1 Amb27590317 [0,0,0,0,0,1|2,0,1]=4 1129 B8R1.4 N=C1C=CNC(=O)N1 Amb22522784 [0,0,0,0,0,1|2,1,0]=4 1130 B8R1.4 NC1=CC(=O)NC=C1 Amb18641608 [0,0,0,0,0,1|2,1,0]=4 1131 B8R1.4 NC1=CC(=O)NC=C1 Amb33716235 [0,0,0,0,0,1|2,1,0]=4 1132 B8R1.4 NC1=CC(=S)NC=N1 Amb18523140 [0,0,0,0,0,1|3,0,0]=4 1133 B8R1.4 NC1=CC=CC(=S)N1 Amb23440527 [0,0,0,0,0,1|3,0,0]=4 1134 B8R1.4 NC1=NC(=O)C=CN1 Amb21951843 [0,0,0,0,0,1|3,0,0]=4 1135 B8R1.4 NC1=NC(=O)NC=C1 Amb18511886 [0,0,0,0,0,1|2,1,0]=4 1136 B8R1.4 NC1=NC(=S)NC=C1 Amb21683243 [0,0,0,0,0,1|2,0,0]=3 1137 B8R1.4 NC1C=CNC(=O)N1 Amb28397982 [0,0,0,0,0,1|2,1,0]=4 1138 B8R1.4 O=C1C=C(Br)C=CN1 Amb22292027 [0,0,0,0,0,1|2,1,0]=4 1139 B8R1.4 O=C1C=C(Cl)C=CN1 Amb18625105 [0,0,0,0,0,1|2,1,0]=4 1140 B8R1.4 O=C1C=C(F)C=CN1 Amb22008561 [0,0,0,0,0,1|2,1,0]=4 1141 B8R1.4 O=C1C=C(I)C=CN1 Amb19664790 [0,0,0,0,0,1|2,1,0]=4 1142 B8R1.4 O=C1C=C(O)C=CN1 Amb19958639 [0,0,0,0,0,1|2,1,0]=4 1143 B8R1.4 O=C1C=CNC(=O)N1 Amb18028577 [0,0,0,0,0,1|2,1,0]=4 1144 B8R1.4 O=C1C=CNC(=O)O1 Amb21937546 [0,0,0,0,0,1|2,1,0]=4 1145 B8R1.4 O=C1C=CNC(=S)C1 Amb27207898 [0,0,0,0,0,1|2,0,0]=3 1146 B8R1.4 O=C1C=CNC(=S)N1 Amb18028423 [0,0,0,0,0,1|2,0,0]=3 1147 B8R1.4 O=C1C=CNC(Cl)=C1 Amb22489481 [0,0,0,0,0,1|3,0,0]=4 1148 B8R1.4 O=C1C=NNC(=S)N1 Amb18028427 [0,0,0,0,0,1|3,0,0]=4 1149 B8R1.4 O=C1N=C(Cl)C=CN1 Amb22001986 [0,0,0,0,0,1|2,1,0]=4 1150 B8R1.4 O=C1NC=CC(=S)N1 Amb21964570 [0,0,0,0,0,1|2,1,0]=4 1151 B8R1.4 OC1=NC(=S)NC=C1 Amb19748546 [0,0,0,0,0,1|2,0,0]=3 1152 B8R1.4 S=C1C=C(Cl)C=CN1 Amb25268659 [0,0,0,0,0,1|2,0,0]=3 1153 B8R1.4 S=C1C=C(S)C=CN1 Amb28072789 [0,0,0,0,0,1|2,0,0]=3 1154 B8R1.4 S=C1C=CC=C(Br)N1 Amb24470776 [0,0,0,0,0,1|3,0,0]=4 1155 B8R1.4 S=C1C=CC=C(Cl)N1 Amb26006996 [0,0,0,0,0,1|3,0,0]=4 1156 B8R1.4 S=C1N=CC=C(Cl)N1 Amb22015367 [0,0,0,0,0,1|2,0,1]=4 1157 B8R1.5 CC1=C(C)NC=CN1 Amb28383183 [0,0,0,0,0,1|2,0,0]=3 1158 B8R1.5 CC1=CC=CNC1=O Amb18028406 [0,0,0,0,0,1|1,1,0]=3 1159 B8R1.5 CC1=CC=CNC1=S Amb33530577 [0,0,0,0,0,1|1,0,0]=2 1160 B8R1.5 CC1=CC=CNC1N Amb27633696 [0,0,0,0,0,1|2,0,1]=4 1161 B8R1.5 CC1=CC=NNC1=O Amb21960917 [0,0,0,0,0,1|1,1,0]=3 1162 B8R1.5 CC1=CN=CNC1=O Amb21937121 [0,0,0,0,0,1|1,1,0]=3 1163 B8R1.5 CC1=CN=CNC1=S Amb28253321 [0,0,0,0,0,1|1,0,0]=2 1164 B8R1.5 CC1=CNC=CC1=N Amb19205207 [0,0,0,0,0,1|3,0,0]=4 1165 B8R1.5 CC1=CNC=CC1=O Amb33714756 [0,0,0,0,0,1|2,1,0]=4 1166 B8R1.5 CC1=NC=CNC1=O Amb22436791 [0,0,0,0,0,1|1,1,0]=3 1167 B8R1.5 CC1=NC=CNC1=O Amb32653329 [0,0,0,0,0,1|1,1,0]=3 1168 B8R1.5 CC1C=NC=CC1=S Amb34915431 [0,0,0,0,0,1|2,0,0]=3 1169 B8R1.5 CC1CC=CCC1=O Amb17593140 [0,0,0,0,0,1|2,1,0]=4 1170 B8R1.5 CC1CC=NNC1=O Amb22752103 [0,0,0,0,0,1|1,1,1]=4 1171 B8R1.5 CN1C=CC=CC1=N Amb22011801 [0,0,0,0,0,1|2,0,0]=3 1172 B8R1.5 CN1C=CC=CC1=O Amb19664826 [0,0,0,0,0,1|1,1,0]=3 1173 B8R1.5 CN1C=CC=CC1Cl Amb28285206 [0,0,0,0,0,1|2,0,1]=4 1174 B8R1.5 CN1C=CC=NC1=O Amb22292010 [0,0,0,0,0,1|0,1,1]=3 1175 B8R1.5 CN1C=CC=NC1=S Amb25242705 [0,0,0,0,0,1|0,0,1]=2 1176 B8R1.5 CN1CCC=CC1=O Amb22500738 [0,0,0,0,0,1|1,1,1]=4 1177 B8R1.5 CN1CCCNC1=O Amb10608416 [0,0,0,0,0,1|0,1,2]=4 1178 B8R1.5 CN1CCCNC1=O Amb32665804 [0,0,0,0,0,1|0,1,2]=4 1179 B8R1.5 CN1CCCNC1=S Amb4012380 [0,0,0,0,0,1|0,0,2]=3 1180 B8R1.5 CN1CCNCC1=O Amb1834069 [0,0,0,0,0,1|0,1,2]=4 1181 B8R1.5 CN1CCNCC1=O Amb6540859 [0,0,0,0,0,1|0,1,2]=4 1182 B8R1.5 CN1N=CC=CC1=O Amb28122931 [0,0,0,0,0,1|1,1,0]=3 1183 B8R1.5 CN1N=CNCC1=O Amb27175377 [0,0,0,0,0,1|1,1,0]=3 1184 B8R1.5 C[C@@H]1NC=NNC1=O Amb28341242 [0,0,0,0,0,1|2,1,0]=4 1185 B8R1.5 C[n+]1ccccc1Cl Amb10074893 [0,0,0,0,0,1|2,0,1]=4 1186 B8R1.5 C[n+]1ccccc1Cl Amb5794569 [0,0,0,0,0,1|2,0,1]=4 1187 B8R1.5 C[n+]1ccccc1F Amb26628402 [0,0,0,0,0,1|2,0,1]=4 1188 B8R1.5 C[n+]1ccccc1F Amb33140972 [0,0,0,0,0,1|2,0,1]=4 1189 B8R1.5 C[n+]1ccccc1N Amb1145103 [0,0,0,0,0,1|2,0,1]=4 1190 B8R1.5 C[n+]1cccnc1N Amb27852410 [0,0,0,0,0,1|1,0,2]=4 1191 B8R1.5 Cc1cccc[n+]1C Amb1147466 [0,0,0,0,0,1|2,0,1]=4 1192 B8R1.5 Cc1ccccc1Br Amb2685510 [0,0,0,0,0,1|3,0,0]=4 1193 B8R1.5 Cc1ccccc1C Amb2447373 [0,0,0,0,0,1|3,0,0]=4 1194 B8R1.5 Cc1ccccc1Cl Amb1694836 [0,0,0,0,0,1|3,0,0]=4 1195 B8R1.5 Cc1ccccc1F Amb2688426 [0,0,0,0,0,1|3,0,0]=4 1196 B8R1.5 Cc1ccccc1I Amb2688891 [0,0,0,0,0,1|3,0,0]=4 1197 B8R1.5 Cc1ccccc1N Amb2793015 [0,0,0,0,0,1|3,0,0]=4 1198 B8R1.5 Cc1ccccc1O Amb2447562 [0,0,0,0,0,1|2,1,0]=4 1199 B8R1.5 Cc1ccccc1S Amb2690594 [0,0,0,0,0,1|2,0,1]=4 1200 B8R1.5 Cc1ccccc1[Mg+] Amb22733193 [0,0,0,0,0,1|3,0,0]=4 1201 B8R1.5 Cc1ccccc1[NH3+] Amb10565982 [0,0,0,0,0,1|3,0,0]=4 1202 B8R1.5 Cc1cccnc1Br Amb2447402 [0,0,0,0,0,1|2,0,1]=4 1203 B8R1.5 Cc1cccnc1C Amb8514941 [0,0,0,0,0,1|2,0,1]=4 1204 B8R1.5 Cc1cccnc1Cl Amb3940000 [0,0,0,0,0,1|2,0,1]=4 1205 B8R1.5 Cc1cccnc1F Amb2447290 [0,0,0,0,0,1|2,0,1]=4 1206 B8R1.5 Cc1cccnc1I Amb10069327 [0,0,0,0,0,1|2,0,1]=4 1207 B8R1.5 Cc1cccnc1N Amb16233775 [0,0,0,0,0,1|2,0,1]=4 1208 B8R1.5 Cc1cccnc1N Amb2694490 [0,0,0,0,0,1|2,0,1]=4 1209 B8R1.5 Cc1cccnc1O Amb2389971 [0,0,0,0,0,1|1,1,1]=4 1210 B8R1.5 Cc1cccnc1S Amb10573534 [0,0,0,0,0,1|1,0,2]=4 1211 B8R1.5 Cc1ccncc1Br Amb2609939 [0,0,0,0,0,1|2,0,1]=4 1212 B8R1.5 Cc1ccncc1C Amb2793076 [0,0,0,0,0,1|2,0,1]=4 1213 B8R1.5 Cc1ccncc1Cl Amb8393041 [0,0,0,0,0,1|2,0,1]=4 1214 B8R1.5 Cc1ccncc1F Amb2447281 [0,0,0,0,0,1|2,0,1]=4 1215 B8R1.5 Cc1ccncc1I Amb21858494 [0,0,0,0,0,1|2,0,1]=4 1216 B8R1.5 Cc1ccncc1N Amb2796181 [0,0,0,0,0,1|2,0,1]=4 1217 B8R1.5 Cc1ccncc1O Amb8630818 [0,0,0,0,0,1|1,1,1]=4 1218 B8R1.5 Cc1ccncc1S Amb24675739 [0,0,0,0,0,1|1,0,2]=4 1219 B8R1.5 Cc1ccnnc1C Amb26507989 [0,0,0,0,0,1|2,0,1]=4 1220 B8R1.5 Cc1ccnnc1Cl Amb16231020 [0,0,0,0,0,1|2,0,1]=4 1221 B8R1.5 Cc1ccnnc1Cl Amb23440184 [0,0,0,0,0,1|2,0,1]=4 1222 B8R1.5 Cc1ccnnc1N Amb18123964 [0,0,0,0,0,1|2,0,1]=4 1223 B8R1.5 Cc1cnccc1Br Amb8393017 [0,0,0,0,0,1|3,0,0]=4 1224 B8R1.5 Cc1cnccc1Br Amb8503379 [0,0,0,0,0,1|3,0,0]=4 1225 B8R1.5 Cc1cnccc1Br Amb8630971 [0,0,0,0,0,1|3,0,0]=4 1226 B8R1.5 Cc1cnccc1Cl Amb2686247 [0,0,0,0,0,1|3,0,0]=4 1227 B8R1.5 Cc1cnccc1Cl Amb8393026 [0,0,0,0,0,1|3,0,0]=4 1228 B8R1.5 Cc1cnccc1F Amb15691008 [0,0,0,0,0,1|3,0,0]=4 1229 B8R1.5 Cc1cnccc1F Amb22276539 [0,0,0,0,0,1|3,0,0]=4 1230 B8R1.5 Cc1cnccc1I Amb24066118 [0,0,0,0,0,1|3,0,0]=4 1231 B8R1.5 Cc1cnccc1I Amb32795033 [0,0,0,0,0,1|3,0,0]=4 1232 B8R1.5 Cc1cnccc1N Amb6429136 [0,0,0,0,0,1|3,0,0]=4 1233 B8R1.5 Cc1cnccc1O Amb8386832 [0,0,0,0,0,1|2,1,0]=4 1234 B8R1.5 Cc1cnccc1S Amb20670270 [0,0,0,0,0,1|2,0,1]=4 1235 B8R1.5 Cc1cncnc1Br Amb19957660 [0,0,0,0,0,1|2,0,1]=4 1236 B8R1.5 Cc1cncnc1C Amb24097057 [0,0,0,0,0,1|2,0,1]=4 1237 B8R1.5 Cc1cncnc1C Amb30585099 [0,0,0,0,0,1|2,0,1]=4 1238 B8R1.5 Cc1cncnc1Cl Amb19957387 [0,0,0,0,0,1|2,0,1]=4 1239 B8R1.5 Cc1cncnc1Cl Amb22756224 [0,0,0,0,0,1|2,0,1]=4 1240 B8R1.5 Cc1cncnc1F Amb27438598 [0,0,0,0,0,1|2,0,1]=4 1241 B8R1.5 Cc1cncnc1N Amb10603746 [0,0,0,0,0,1|2,0,1]=4 1242 B8R1.5 Cc1cncnc1O Amb8438965 [0,0,0,0,0,1|1,1,1]=4 1243 B8R1.5 Cc1ncccc1Br Amb2612474 [0,0,0,0,0,1|3,0,0]=4 1244 B8R1.5 Cc1ncccc1Cl Amb8630901 [0,0,0,0,0,1|3,0,0]=4 1245 B8R1.5 Cc1ncccc1F Amb15691011 [0,0,0,0,0,1|3,0,0]=4 1246 B8R1.5 Cc1ncccc1I Amb10602320 [0,0,0,0,0,1|3,0,0]=4 1247 B8R1.5 Cc1ncccc1N Amb8392991 [0,0,0,0,0,1|3,0,0]=4 1248 B8R1.5 Cc1ncccc1O Amb24062097 [0,0,0,0,0,1|2,1,0]=4 1249 B8R1.5 Cc1ncccc1O Amb2613384 [0,0,0,0,0,1|2,1,0]=4 1250 B8R1.5 Cc1ncccc1S Amb24062554 [0,0,0,0,0,1|2,0,1]=4 1251 B8R1.5 Cc1nccnc1Br Amb15701217 [0,0,0,0,0,1|2,0,1]=4 1252 B8R1.5 Cc1nccnc1C Amb8513879 [0,0,0,0,0,1|2,0,1]=4 1253 B8R1.5 Cc1nccnc1Cl Amb17515939 [0,0,0,0,0,1|2,0,1]=4 1254 B8R1.5 Cc1nccnc1F Amb24686578 [0,0,0,0,0,1|2,0,1]=4 1255 B8R1.5 Cc1nccnc1I Amb22751685 [0,0,0,0,0,1|2,0,1]=4 1256 B8R1.5 Cc1nccnc1N Amb16233707 [0,0,0,0,0,1|2,0,1]=4 1257 B8R1.5 Cc1nccnc1N Amb31217478 [0,0,0,0,0,1|2,0,1]=4 1258 B8R1.5 Cc1nccnc1S Amb22299180 [0,0,0,0,0,1|1,0,2]=4 1259 B8R1.5 Cn1ccccc1=O Amb2609945 [0,0,0,0,0,1|1,1,0]=3 1260 B8R1.5 Cn1cnccc1=O Amb2609512 [0,0,0,0,0,1|1,1,0]=3 1261 B8R1.5 FC1=CC=CNC1=S Amb33549260 [0,0,0,0,0,1|2,0,0]=3 1262 B8R1.5 FC1=NC=CNC1=S Amb22388303 [0,0,0,0,0,1|2,0,0]=3 1263 B8R1.5 NC1=CC=CNC1=O Amb18641609 [0,0,0,0,0,1|2,1,0]=4 1264 B8R1.5 NC1=CC=CNC1=S Amb19958555 [0,0,0,0,0,1|2,0,0]=3 1265 B8R1.5 NC1=CC=CON1N Amb28313952 [0,0,0,0,0,1|3,0,0]=4 1266 B8R1.5 NC1=CC=NNC1=O Amb18641632 [0,0,0,0,0,1|2,1,0]=4 1267 B8R1.5 NC1=CN=CNC1=O Amb33544216 [0,0,0,0,0,1|2,1,0]=4 1268 B8R1.5 NC1=CNC=CC1=O Amb22489482 [0,0,0,0,0,1|3,0,0]=4 1269 B8R1.5 NC1=NC=CNC1=O Amb22388516 [0,0,0,0,0,1|2,1,0]=4 1270 B8R1.5 NC1=NC=CNC1=S Amb24756997 [0,0,0,0,0,1|2,0,0]=3 1271 B8R1.5 NN1C=CC=CC1=O Amb18641421 [0,0,0,0,0,1|2,1,0]=4 1272 B8R1.5 O=C1C=CC=CN1O Amb20622284 [0,0,0,0,0,1|2,1,0]=4 1273 B8R1.5 O=C1C=CNC=C1I Amb22465984 [0,0,0,0,0,1|3,0,0]=4 1274 B8R1.5 O=C1NC=CC=C1Br Amb18542924 [0,0,0,0,0,1|2,1,0]=4 1275 B8R1.5 O=C1NC=CC=C1Cl Amb20243356 [0,0,0,0,0,1|2,1,0]=4 1276 B8R1.5 O=C1NC=CC=C1I Amb22001887 [0,0,0,0,0,1|2,1,0]=4 1277 B8R1.5 O=C1NC=CC=C1O Amb18537411 [0,0,0,0,0,1|2,1,0]=4 1278 B8R1.5 O=C1NC=CC=C1S Amb25261155 [0,0,0,0,0,1|2,1,0]=4 1279 B8R1.5 O=C1NC=CN=C1Cl Amb19148377 [0,0,0,0,0,1|2,1,0]=4 1280 B8R1.5 O=C1NC=CN=C1I Amb28316181 [0,0,0,0,0,1|2,1,0]=4 1281 B8R1.5 O=C1NC=CN=C1S Amb28316182 [0,0,0,0,0,1|2,1,0]=4 1282 B8R1.5 O=C1NC=CNC1=O Amb19894734 [0,0,0,0,0,1|2,1,0]=4 1283 B8R1.5 O=C1NC=CSC1O Amb27882387 [0,0,0,0,0,1|2,1,0]=4 1284 B8R1.5 O=C1NC=NC=C1F Amb22489479 [0,0,0,0,0,1|2,1,0]=4 1285 B8R1.5 O=C1NC=NC=C1I Amb22371454 [0,0,0,0,0,1|2,1,0]=4 1286 B8R1.5 O=C1NC=NC=C1O Amb22436766 [0,0,0,0,0,1|2,1,0]=4 1287 B8R1.5 O=C1NC=NC=C1O Amb22728033 [0,0,0,0,0,1|2,1,0]=4 1288 B8R1.5 O=C1NC=NC=C1S Amb28422458 [0,0,0,0,0,1|2,1,0]=4 1289 B8R1.5 O=C1NN=CC=C1Br Amb23455497 [0,0,0,0,0,1|2,1,0]=4 1290 B8R1.5 O=C1NN=CC=C1Cl Amb33543639 [0,0,0,0,0,1|2,1,0]=4 1291 B8R1.5 O=C1NN=CC=C1F Amb24659506 [0,0,0,0,0,1|2,1,0]=4 1292 B8R1.5 O=C1NN=CC=C1I Amb25329683 [0,0,0,0,0,1|2,1,0]=4 1293 B8R1.5 OC1=CC=NNC1=S Amb27440901 [0,0,0,0,0,1|2,0,0]=3 1294 B8R1.5 OC1=COC=CC1=S Amb24558826 [0,0,0,0,0,1|3,0,0]=4 1295 B8R1.5 OC1C=CC=NC1=S Amb25850841 [0,0,0,0,0,1|2,0,1]=4 1296 B8R1.5 ON1C=CC=CC1=S Amb26615251 [0,0,0,0,0,1|2,0,0]=3 1297 B8R1.5 S=C1NC=CC=C1Br Amb19374472 [0,0,0,0,0,1|2,0,0]=3 1298 B8R1.5 S=C1NC=CC=C1Cl Amb17933337 [0,0,0,0,0,1|2,0,0]=3 1299 B8R1.5 S=C1NC=NC=C1Br Amb25253477 [0,0,0,0,0,1|2,0,0]=3 1300 B5R0.1 C=CC=C(C)C Amb22229813 [1,0,1,0,0,0|2,0,0]=4 1301 B5R0.1 C=CCC(=C)C Amb22347764 [1,0,1,0,0,0|2,0,0]=4 1302 B5R0.1 C=CCC(=N)N Amb2695181 [1,0,1,0,0,0|2,0,0]=4 1303 B5R0.1 C=CCC(C)=O Amb8396482 [1,0,1,0,0,0|1,1,0]=4 1304 B5R0.1 C=CCC(N)=O Amb17610156 [1,0,1,0,0,0|1,1,0]=4 1305 B5R0.1 C=CNC(C)=O Amb24323579 [1,0,1,0,0,0|0,1,0]=3 1306 B5R0.1 C=CNC(C)C Amb28075363 [1,0,1,0,0,0|1,0,1]=4 1307 B5R0.1 C=CNC(N)=O Amb25082241 [1,0,1,0,0,0|0,1,0]=3 1308 B5R0.1 C=CNC(N)=S Amb2792471 [1,0,1,0,0,0|0,0,0]=2 1309 B5R0.1 C=COC(C)=O Amb8513382 [1,0,1,0,0,0|1,1,0]=4 1310 B5R0.1 C=NNC(C)=O Amb29626225 [1,0,1,0,0,0|1,1,0]=4 1311 B5R0.1 C=NNC(N)=S Amb28456485 [1,0,1,0,0,0|1,0,0]=3 1312 B5R0.1 CC(=O)NC=O Amb27850191 [1,0,1,0,0,0|1,1,0]=4 1313 B5R0.1 CC(=O)\C=C/N Amb25147403 [1,0,1,0,0,0|1,1,0]=4 1314 B5R0.1 CC(=O)\C=C\N Amb8395283 [1,0,1,0,0,0|1,1,0]=4 1315 B5R0.1 CCNC(N)=S Amb6608838 [1,0,1,0,0,0|0,0,2]=4 1316 B5R0.1 CN(C)\C=C\N Amb26443108 [1,0,1,0,0,0|0,0,1]=3 1317 B5R0.1 CN(C)\C=N\N Amb27437355 [1,0,1,0,0,0|1,0,1]=4 1318 B5R0.1 CNNC(N)=S Amb19514512 [1,0,1,0,0,0|1,0,1]=4 1319 B5R0.1 CONC(C)=S Amb27759908 [1,0,1,0,0,0|1,0,1]=4 1320 B5R0.1 C\C=N\C(N)=S Amb28130286 [1,0,1,0,0,0|0,0,2]=4 1321 B5R0.1 N=C(N)NC=O Amb4020732 [1,0,1,0,0,0|2,0,0]=4 1322 B5R0.1 NC(=O)NC=O Amb8514974 [1,0,1,0,0,0|1,1,0]=4 1323 B5R0.1 NC(=S)NCO Amb27461395 [1,0,1,0,0,0|1,0,1]=4 1324 B5R0.2 C#C\C=C\NC Amb27174076 [1,0,1,0,0,0|1,0,1]=4 1325 B5R0.2 C=CCCNC Amb18993048 [1,0,1,0,0,0|1,0,1]=4 1326 B5R0.2 C=CCCNC Amb33553635 [1,0,1,0,0,0|1,0,1]=4 1327 B5R0.2 C=CCONC Amb32411015 [1,0,1,0,0,0|2,0,0]=4 1328 B5R0.2 C=CC\C=C/C Amb26426294 [1,0,1,0,0,0|2,0,0]=4 1329 B5R0.2 C=CNCCC Amb27461242 [1,0,1,0,0,0|1,0,1]=4 1330 B5R0.2 C=C\C=C\CC Amb8513434 [1,0,1,0,0,0|2,0,0]=4 1331 B5R0.2 CCCNC=S Amb27754027 [1,0,1,0,0,0|0,0,2]=4 1332 B5R0.2 CC\C=C\C=O Amb33986391 [1,0,1,0,0,0|1,1,0]=4 1333 B5R0.2 CNC\C=C/I Amb23539307 [1,0,1,0,0,0|1,0,1]=4 1334 B5R0.2 CN\C=C\C=O Amb24564349 [1,0,1,0,0,0|0,1,0]=3 1335 B5R0.2 CN\C=C\NC Amb26415734 [1,0,1,0,0,0|0,0,1]=3 1336 B5R0.2 CO\C=C/C=O Amb28049941 [1,0,1,0,0,0|1,1,0]=4 1337 B5R0.2 CO\C=C\C=O Amb26873964 [1,0,1,0,0,0|1,1,0]=4 1338 B5R0.2 C\C=C/C=C/C Amb26318493 [1,0,1,0,0,0|2,0,0]=4 1339 B5R0.2 C\C=C\C=C\Br Amb27791828 [1,0,1,0,0,0|2,0,0]=4 1340 B5R0.2 C\C=C\C=C\C Amb27622458 [1,0,1,0,0,0|2,0,0]=4 1341 B5R0.2 C\C=C\CC=O Amb26655030 [1,0,1,0,0,0|1,1,0]=4 1342 B5R0.2 C\C=C\CNC Amb28049814 [1,0,1,0,0,0|1,0,1]=4 1343 B5R0.3 C=CC(=C)CC Amb28141349 [1,0,1,0,0,0|2,0,0]=4 1344 B5R0.3 C=CC(=C)OC Amb28145100 [1,0,1,0,0,0|2,0,0]=4 1345 B5R0.3 C=CC(=O)CC Amb3940490 [1,0,1,0,0,0|1,1,0]=4 1346 B5R0.3 C=CC(=O)NC Amb9480402 [1,0,1,0,0,0|0,1,0]=3 1347 B5R0.3 C=CC(=O)NN Amb25134207 [1,0,1,0,0,0|1,1,0]=4 1348 B5R0.3 C=CC(=O)NN Amb33330767 [1,0,1,0,0,0|1,1,0]=4 1349 B5R0.3 C=CC(=O)NO Amb28049735 [1,0,1,0,0,0|1,1,0]=4 1350 B5R0.3 C=CC(=O)OC Amb22351400 [1,0,1,0,0,0|1,1,0]=4 1351 B5R0.3 C=CC(=O)OC Amb2793072 [1,0,1,0,0,0|1,1,0]=4 1352 B5R0.3 C=CC(C)C=C Amb22337672 [1,0,1,0,0,0|2,0,0]=4 1353 B5R0.3 C=CC(C)C=O Amb25737956 [1,0,1,0,0,0|1,1,0]=4 1354 B5R0.3 C=CC(C)NC Amb33212401 [1,0,1,0,0,0|1,0,1]=4 1355 B5R0.3 C=CC(C)NC Amb33530542 [1,0,1,0,0,0|1,0,1]=4 1356 B5R0.3 C=CC(C)ON Amb22896392 [1,0,1,0,0,0|2,0,0]=4 1357 B5R0.3 C=CC(C)ON Amb25146282 [1,0,1,0,0,0|2,0,0]=4 1358 B5R0.3 C=CN(C)CC Amb27242626 [1,0,1,0,0,0|1,0,1]=4 1359 B5R0.3 C=CN(C)N=O Amb24333902 [1,0,1,0,0,0|1,1,0]=4 1360 B5R0.3 C=C\C(C)=C/Br Amb27420834 [1,0,1,0,0,0|2,0,0]=4 1361 B5R0.3 C=C\C(C)=C\N Amb27488688 [1,0,1,0,0,0|1,0,0]=3 1362 B5R0.3 CCC(=S)NN Amb26505324 [1,0,1,0,0,0|2,0,0]=4 1363 B5R0.3 CN(C=O)C=O Amb24098492 [1,0,1,0,0,0|1,1,0]=4 1364 B5R0.3 CNC(=N)NC Amb22731268 [1,0,1,0,0,0|1,0,1]=4 1365 B5R0.3 CNC(=N)NN Amb3429276 [1,0,1,0,0,0|2,0,0]=4 1366 B5R0.3 CNC(=O)NC Amb4037273 [1,0,1,0,0,0|0,1,1]=4 1367 B5R0.3 CNC(=O)NN Amb8854034 [1,0,1,0,0,0|1,1,0]=4 1368 B5R0.3 CNC(=O)NO Amb25185417 [1,0,1,0,0,0|1,1,0]=4 1369 B5R0.3 CNC(=S)C#N Amb8515444 [1,0,1,0,0,0|1,0,1]=4 1370 B5R0.3 CNC(=S)CCl Amb28411477 [1,0,1,0,0,0|1,0,1]=4 1371 B5R0.3 CNC(=S)CN Amb26326922 [1,0,1,0,0,0|1,0,1]=4 1372 B5R0.3 CNC(=S)NC Amb6891929 [1,0,1,0,0,0|0,0,1]=3 1373 B5R0.3 CNC(=S)NN Amb2689743 [1,0,1,0,0,0|1,0,0]=3 1374 B5R0.3 COC(=S)NN Amb22504666 [1,0,1,0,0,0|2,0,0]=4 1375 B5R0.3 CSC(=S)NN Amb9828277 [1,0,1,0,0,0|2,0,0]=4 1376 B5R0.3 C\C(C=O)=C/N Amb26887758 [1,0,1,0,0,0|1,1,0]=4 1377 B5R0.3 NNC(=S)NN Amb1202360 [1,0,1,0,0,0|2,0,0]=4 1378 B5R0.5 C=C(C)C(=C)C Amb8517589 [1,0,1,0,0,0|2,0,0]=4 1379 B5R0.5 C=C(C)C(=N)N Amb24683875 [1,0,1,0,0,0|2,0,0]=4 1380 B5R0.5 C=C(C)C(N)=O Amb6609019 [1,0,1,0,0,0|1,1,0]=4 1381 B5R0.5 C=C(C)C(N)=S Amb33200269 [1,0,1,0,0,0|1,0,0]=3 1382 B5R0.5 CC(=O)C(N)=S Amb33528965 [1,0,1,0,0,0|2,0,0]=4 1383 B5R0.5 CC(=S)N(C)C Amb2720887 [1,0,1,0,0,0|0,0,2]=4 1384 B5R0.5 CC(Br)C(N)=S Amb27971550 [1,0,1,0,0,0|2,0,0]=4 1385 B5R0.5 CC(C)C(N)=S Amb6242688 [1,0,1,0,0,0|1,0,1]=4 1386 B5R0.5 CC(Cl)C(N)=S Amb33328367 [1,0,1,0,0,0|2,0,0]=4 1387 B5R0.5 CC(N)C(N)=S Amb19374914 [1,0,1,0,0,0|2,0,0]=4 1388 B5R0.5 CC(N)C(N)=S Amb33527239 [1,0,1,0,0,0|2,0,0]=4 1389 B5R0.5 CN(C)C(=N)N Amb22227685 [1,0,1,0,0,0|1,0,1]=4 1390 B5R0.5 CN(C)C(=N)N Amb2696112 [1,0,1,0,0,0|1,0,1]=4 1391 B5R0.5 CN(C)C(=N)N Amb33532288 [1,0,1,0,0,0|1,0,1]=4 1392 B5R0.5 CN(C)C(=N)N Amb35826755 [1,0,1,0,0,0|1,0,1]=4 1393 B5R0.5 CN(C)C(=N)N Amb9825626 [1,0,1,0,0,0|1,0,1]=4 1394 B5R0.5 CN(C)C(=S)Cl Amb2725563 [1,0,1,0,0,0|1,0,1]=4 1395 B5R0.5 CN(C)C(=S)[S-] Amb10552380 [1,0,1,0,0,0|1,0,1]=4 1396 B5R0.5 CN(C)C(=S)[S-] Amb33512811 [1,0,1,0,0,0|1,0,1]=4 1397 B5R0.5 CN(C)C(=S)[S-] Amb6608872 [1,0,1,0,0,0|1,0,1]=4 1398 B5R0.5 CN(C)C(N)=O Amb2604398 [1,0,1,0,0,0|0,1,1]=4 1399 B5R0.5 CN(C)C(N)=S Amb1105826 [1,0,1,0,0,0|0,0,1]=3 1400 B5R0.5 CN(C)C(N)=[Se] Amb8515163 [1,0,1,0,0,0|0,1,1]=4 1401 B5R0.5 CN(N)C(=N)N Amb10552372 [1,0,1,0,0,0|2,0,0]=4 1402 B5R0.5 CN(N)C(=N)N Amb27595677 [1,0,1,0,0,0|2,0,0]=4 1403 B5R0.5 CN(N)C(=S)S Amb27856316 [1,0,1,0,0,0|2,0,0]=4 1404 B5R0.5 CN(N)C(N)=O Amb27167382 [1,0,1,0,0,0|1,1,0]=4 1405 B5R0.5 CN(N)C(N)=S Amb6298790 [1,0,1,0,0,0|1,0,0]=3 1406 B5R1.1 C1=CNCC1 Amb24476832 [2,0,0,0,0,0|1,0,1]=4 1407 B5R1.1 C1=COCN1 Amb20242493 [2,0,0,0,0,0|1,0,1]=4 1408 B5R1.1 C1=C[CH-]C=C1 Amb8517522 [2,0,0,0,0,0|2,0,0]=4 1409 B5R1.1 C1=NNCN1 Amb28186670 [2,0,0,0,0,0|1,0,1]=4 1410 B5R1.1 c1ccoc1 Amb6608834 [2,0,0,0,0,0|2,0,0]=4 1411 B5R1.1 c1ccsc1 Amb2694672 [2,0,0,0,0,0|2,0,0]=4 1412 B5R1.1 c1cocn1 Amb2608869 [2,0,0,0,0,0|1,0,1]=4 1413 B5R1.1 c1cscn1 Amb2690588 [2,0,0,0,0,0|1,0,1]=4 1414 B7R0.2 C=C\C(C)=C/C(N)=O Amb27195399 [0,1,1,0,0,0|2,0,0]=4 1415 B7R0.2 CN(C=O)CC(N)=O Amb27471534 [0,1,1,0,0,0|0,1,1]=4 1416 B7R0.2 CN(C=O)CC(N)=S Amb27963784 [0,1,1,0,0,0|0,1,1]=4 1417 B7R0.2 CNC(=N)NC(=N)N Amb31292535 [0,1,1,0,0,0|2,0,0]=4 1418 B7R0.2 CNC(=N)NC(=S)S Amb27976037 [0,1,1,0,0,0|2,0,0]=4 1419 B7R0.2 CNC(=N)NC(N)=S Amb27599951 [0,1,1,0,0,0|2,0,0]=4 1420 B7R0.2 CNC(=O)NC(C)=O Amb2782874 [0,1,1,0,0,0|0,1,1]=4 1421 B7R0.2 CNC(=S)C=C(C)C Amb27411406 [0,1,1,0,0,0|1,0,1]=4 1422 B7R0.2 CNC(=S)CC(C)=O Amb24096719 [0,1,1,0,0,0|1,0,1]=4 1423 B7R0.2 CNC(=S)CC(N)=S Amb1980798 [0,1,1,0,0,0|2,0,0]=4 1424 B7R0.2 CNC(=S)NC(=N)N Amb27831361 [0,1,1,0,0,0|1,0,0]=3 1425 B7R0.2 CNC(=S)NC(C)=O Amb24746594 [0,1,1,0,0,0|0,0,1]=3 1426 B7R0.2 CNC(=S)NN(C)C Amb2725023 [0,1,1,0,0,0|1,0,1]=4 1427 B7R0.2 CNC(=S)SC(C)=O Amb27185753 [0,1,1,0,0,0|1,0,1]=4 1428 B7R0.2 COC(=S)NC(C)=O Amb27155891 [0,1,1,0,0,0|1,0,1]=4 1429 B7R0.2 COC(=S)NC(N)=O Amb28456572 [0,1,1,0,0,0|2,0,0]=4 1430 B7R0.2 CSC(=S)NC(N)=S Amb26419511 [0,1,1,0,0,0|2,0,0]=4 1431 B7R0.3 C=CCCC(=O)NC Amb25041195 [0,1,1,0,0,0|1,1,0]=4 1432 B7R0.3 C=CCNC(=N)NC Amb27461337 [0,1,1,0,0,0|1,0,0]=3 1433 B7R0.3 C=CCNC(=N)SC Amb26381808 [0,1,1,0,0,0|2,0,0]=4 1434 B7R0.3 C=CCNC(=O)NN Amb18559722 [0,1,1,0,0,0|1,1,0]=4 1435 B7R0.3 C=CCNC(=O)NO Amb28134073 [0,1,1,0,0,0|1,1,0]=4 1436 B7R0.3 C=CCNC(=O)OC Amb17794125 [0,1,1,0,0,0|1,1,0]=4 1437 B7R0.3 C=CCNC(=S)NC Amb6876259 [0,1,1,0,0,0|0,0,0]=2 1438 B7R0.3 C=CCNC(=S)NN Amb6364698 [0,1,1,0,0,0|1,0,0]=3 1439 B7R0.3 C=CCNC(=S)NO Amb27225513 [0,1,1,0,0,0|1,0,0]=3 1440 B7R0.3 C=CCNC(=S)OC Amb28250523 [0,1,1,0,0,0|1,0,0]=3 1441 B7R0.3 C=CCOC(=S)CC Amb22168285 [0,1,1,0,0,0|2,0,0]=4 1442 B7R0.3 CCCNC(=S)NC Amb4016503 [0,1,1,0,0,0|0,0,2]=4 1443 B7R0.3 CCNNC(=S)NC Amb27175334 [0,1,1,0,0,0|0,0,2]=4 1444 B7R0.3 CNC(=S)NCCF Amb25693407 [0,1,1,0,0,0|0,0,2]=4 1445 B7R0.3 CNC(=S)NCCN Amb27838997 [0,1,1,0,0,0|0,0,2]=4 1446 B7R0.3 CNC(=S)NCCO Amb4303417 [0,1,1,0,0,0|0,0,2]=4 1447 B7R0.3 C\C=C\NC(=O)NC Amb24585267 [0,1,1,0,0,0|0,1,0]=3 1448 B7R0.3 C\C=C\NC(=O)OC Amb27838402 [0,1,1,0,0,0|1,1,0]=4 1449 B7R0.3 C\C=N\NC(=S)NC Amb27469672 [0,1,1,0,0,0|0,0,1]=3 1450 B7R0.5 C=CNC(=O)C(C)C Amb28252471 [0,1,1,0,0,0|1,1,0]=4 1451 B7R0.5 C=CNC(=O)C(C)O Amb27872694 [0,1,1,0,0,0|1,1,0]=4 1452 B7R0.5 C=COC(=O)N(C)C Amb27811374 [0,1,1,0,0,0|1,1,0]=4 1453 B7R0.5 CCNC(=S)N(C)N Amb28132494 [0,1,1,0,0,0|0,0,2]=4 1454 B7R0.5 CN(C)C(=O)NC=O Amb27391650 [0,1,1,0,0,0|1,1,0]=4 1455 B7R0.5 CN(C)C(=S)CC=O Amb27974853 [0,1,1,0,0,0|2,0,0]=4 1456 B7R0.5 C\C=N\N(C)C(N)=S Amb27424754 [0,1,1,0,0,0|2,0,0]=4 1457 B7R0.7 C=CNC(=O)NC=C Amb27839558 [0,1,1,0,0,0|0,1,1]=4 1458 B7R0.7 C=CNC(=O)NCC Amb27982432 [0,1,1,0,0,0|0,1,0]=3 1459 B7R0.7 CCNC(=S)NCC Amb6608832 [0,1,1,0,0,0|0,0,2]=4 1460 B7R0.7 CCNC(=S)NNC Amb28383236 [0,1,1,0,0,0|0,0,2]=4 1461 B7R0.7 CCNC(=S)NOC Amb27596114 [0,1,1,0,0,0|0,0,2]=4 1462 B7R0.7 OCNC(=S)NCO Amb6600540 [0,1,1,0,0,0|1,0,1]=4 1463 B7R0.10 CCN(N)C(=S)NC Amb28124059 [0,1,1,0,0,0|0,0,2]=4 1464 B7R0.10 CNC(=O)N(C)C=O Amb27839124 [0,1,1,0,0,0|1,1,0]=4 1465 B7R0.10 CNC(=S)N(C)N=O Amb28283977 [0,1,1,0,0,0|2,0,0]=4 1466 B7R0.10 CNC(=S)N(C)NC Amb25991068 [0,1,1,0,0,0|1,0,1]=4 1467 B7R0.10 CNC(=S)N(C)OC Amb25327413 [0,1,1,0,0,0|1,0,1]=4 1468 B7R0.10 C\C=C(/C)C(=S)NC Amb28345690 [0,1,1,0,0,0|1,0,1]=4 1469 B7R0.15 CCN(C#N)C(N)=S Amb27437029 [0,1,1,0,0,0|1,0,1]=4 1470 B7R0.15 CCN(CC)C(N)=S Amb1105215 [0,1,1,0,0,0|0,0,2]=4 1471 B7R0.15 CON(C=O)C(N)=O Amb27838331 [0,1,1,0,0,0|1,1,0]=4 1472 B7R0.16 C=C(C)C(C)C(N)=O Amb26327976 [0,1,1,0,0,0|1,1,0]=4 1473 B7R0.16 CN(C(N)=O)C(N)=O Amb27411152 [0,1,1,0,0,0|1,1,0]=4 1474 B7R0.16 CN(C)C(=S)N(C)C Amb2690582 [0,1,1,0,0,0|0,0,2]=4 1475 B7R0.16 CN(C)N(C)C(N)=S Amb27882735 [0,1,1,0,0,0|1,0,1]=4 1476 B7R0.1 CN\C=C/C=C\C#N Amb18123087 [0,1,1,0,0,0|2,0,0]=4 1477 B7R0.1 CN\C=C\C=C\C#N Amb28072925 [0,1,1,0,0,0|2,0,0]=4 1478 B7R0.4 CC\C=C\CC(N)=S Amb33225501 [0,1,1,0,0,0|2,0,0]=4 1479 B7R0.4 CC\C=N\NC(N)=S Amb24349578 [0,1,1,0,0,0|2,0,0]=4 1480 B7R0.4 CNCCNC(=S)S Amb28397261 [0,1,1,0,0,0|0,0,2]=4 1481 B7R0.4 CO\C=C/NC(C)=O Amb27391649 [0,1,1,0,0,0|1,1,0]=4 1482 B7R0.4 CO\C=C\NC(C)=O Amb28198239 [0,1,1,0,0,0|1,1,0]=4 1483 B7R0.4 C\C=C\CNC(N)=S Amb27267431 [0,1,1,0,0,0|1,0,1]=4 1484 B7R1.1 BrCc1ccoc1 Amb33543824 [1,1,0,0,0,0|2,0,0]=4 1485 B7R1.1 BrCc1ccsc1 Amb33528728 [1,1,0,0,0,0|2,0,0]=4 1486 B7R1.1 BrCn1cccc1 Amb28121283 [1,1,0,0,0,0|1,0,0]=3 1487 B7R1.1 BrCn1cccn1 Amb24557786 [1,1,0,0,0,0|2,0,0]=4 1488 B7R1.1 BrCn1cccn1 Amb33537342 [1,1,0,0,0,0|2,0,0]=4 1489 B7R1.1 C=Cn1cccc1 Amb25810319 [1,1,0,0,0,0|1,0,1]=4 1490 B7R1.1 C=Cn1ccnc1 Amb6608648 [1,1,0,0,0,0|0,0,2]=4 1491 B7R1.1 CCC1C=CC=C1 Amb2227637 [1,1,0,0,0,0|2,0,0]=4 1492 B7R1.1 CC[c-]1cccc1 Amb34916048 [1,1,0,0,0,0|2,0,0]=4 1493 B7R1.1 CCc1ccoc1 Amb28059964 [1,1,0,0,0,0|2,0,0]=4 1494 B7R1.1 CCc1ccsc1 Amb2687956 [1,1,0,0,0,0|2,0,0]=4 1495 B7R1.1 CCn1cccc1 Amb2687940 [1,1,0,0,0,0|1,0,0]=3 1496 B7R1.1 CCn1cccn1 Amb1934294 [1,1,0,0,0,0|2,0,0]=4 1497 B7R1.1 CCn1ccnc1 Amb7093335 [1,1,0,0,0,0|0,0,1]=3 1498 B7R1.1 CCn1ccnn1 Amb23441596 [1,1,0,0,0,0|1,0,1]=4 1499 B7R1.1 CCn1cncn1 Amb8386342 [1,1,0,0,0,0|1,0,1]=4 1500 B7R1.1 CCn1cnnc1 Amb25274251 [1,1,0,0,0,0|1,0,1]=4 1501 B7R1.1 CNc1ccsc1 Amb20620164 [1,1,0,0,0,0|2,0,0]=4 1502 B7R1.1 CNc1ccsc1 Amb28827635 [1,1,0,0,0,0|2,0,0]=4 1503 B7R1.1 COc1ccsc1 Amb8517358 [1,1,0,0,0,0|2,0,0]=4 1504 B7R1.1 COn1ccnn1 Amb28251423 [1,1,0,0,0,0|1,0,1]=4 1505 B7R1.1 CSc1ccsc1 Amb2780309 [1,1,0,0,0,0|2,0,0]=4 1506 B7R1.1 C[Se]c1ccsc1 Amb17779305 [1,1,0,0,0,0|2,0,0]=4 1507 B7R1.1 ClCc1ccoc1 Amb8999150 [1,1,0,0,0,0|2,0,0]=4 1508 B7R1.1 ClCc1ccsc1 Amb33528072 [1,1,0,0,0,0|2,0,0]=4 1509 B7R1.1 ClCn1cccn1 Amb10601542 [1,1,0,0,0,0|2,0,0]=4 1510 B7R1.1 ClCn1cccn1 Amb25084521 [1,1,0,0,0,0|2,0,0]=4 1511 B7R1.1 ClCn1ccnc1 Amb28059300 [1,1,0,0,0,0|0,0,1]=3 1512 B7R1.1 ClCn1ccnn1 Amb28457455 [1,1,0,0,0,0|1,0,1]=4 1513 B7R1.1 ClCn1cncn1 Amb8496587 [1,1,0,0,0,0|1,0,1]=4 1514 B7R1.1 FCn1cccn1 Amb32428321 [1,1,0,0,0,0|2,0,0]=4 1515 B7R1.1 FCn1ccnc1 Amb27862723 [1,1,0,0,0,0|0,0,1]=3 1516 B7R1.1 N#Cn1ccnc1 Amb6297967 [1,1,0,0,0,0|0,0,2]=4 1517 B7R1.1 NCc1ccoc1 Amb2723044 [1,1,0,0,0,0|2,0,0]=4 1518 B7R1.1 NCc1ccoc1 Amb2723045 [1,1,0,0,0,0|2,0,0]=4 1519 B7R1.1 NCc1ccsc1 Amb1140991 [1,1,0,0,0,0|2,0,0]=4 1520 B7R1.1 NCc1ccsc1 Amb6487448 [1,1,0,0,0,0|2,0,0]=4 1521 B7R1.1 NCn1cccc1 Amb27202741 [1,1,0,0,0,0|1,0,0]=3 1522 B7R1.1 O=C=C1CC=CN1 Amb27851531 [1,1,0,0,0,0|1,1,0]=4 1523 B7R1.1 O=C=C1NC=CN1 Amb27209383 [1,1,0,0,0,0|0,1,0]=3 1524 B7R1.1 O=Nn1ccnc1 Amb28286811 [1,1,0,0,0,0|1,0,1]=4 1525 B7R1.1 OCc1ccoc1 Amb837377 [1,1,0,0,0,0|2,0,0]=4 1526 B7R1.1 OCc1ccsc1 Amb837384 [1,1,0,0,0,0|2,0,0]=4 1527 B7R1.1 OCn1cccc1 Amb28400396 [1,1,0,0,0,0|1,0,0]=3 1528 B7R1.1 OCn1cccn1 Amb10552412 [1,1,0,0,0,0|2,0,0]=4 1529 B7R1.1 OCn1ccnc1 Amb5493972 [1,1,0,0,0,0|0,0,1]=3 1530 B7R1.1 OCn1cncn1 Amb1085763 [1,1,0,0,0,0|1,0,1]=4 1531 B7R1.1 S=Cc1ccco1 Amb28368735 [1,1,0,0,0,0|2,0,0]=4 1532 B7R1.1 S=Nc1nccs1 Amb27438253 [1,1,0,0,0,0|1,0,1]=4 1533 B7R1.1 SCc1ccoc1 Amb26593625 [1,1,0,0,0,0|2,0,0]=4 1534 B7R1.1 SCc1ccsc1 Amb28246879 [1,1,0,0,0,0|2,0,0]=4 1535 B7R1.1 [N-]=[N+]=C1NC=CS1 Amb27613199 [1,1,0,0,0,0|2,0,0]=4 1536 B7R1.2 C=C1CNC(=S)S1 Amb2610626 [1,1,0,0,0,0|1,0,1]=4 1537 B7R1.2 CC1=CC(=N)NN1 Amb19866695 [1,1,0,0,0,0|2,0,0]=4 1538 B7R1.2 CC1=CC(=N)NO1 Amb22330538 [1,1,0,0,0,0|2,0,0]=4 1539 B7R1.2 CC1=CC(=O)NC1 Amb24479892 [1,1,0,0,0,0|1,0,1]=4 1540 B7R1.2 CC1=CC(=O)NN1 Amb19770794 [1,1,0,0,0,0|2,0,0]=4 1541 B7R1.2 CC1=CC(=O)NO1 Amb19338707 [1,1,0,0,0,0|2,0,0]=4 1542 B7R1.2 CC1=CNC(=O)N1 Amb20667076 [1,1,0,0,0,0|0,1,0]=3 1543 B7R1.2 CC1=COC(=N)N1 Amb20637145 [1,1,0,0,0,0|2,0,0]=4 1544 B7R1.2 CC1=COC(=O)N1 Amb27185570 [1,1,0,0,0,0|1,1,0]=4 1545 B7R1.2 CC1=CSC(=N)N1 Amb22166852 [1,1,0,0,0,0|2,0,0]=4 1546 B7R1.2 CC1=CSC(=O)N1 Amb19372452 [1,1,0,0,0,0|1,1,0]=4 1547 B7R1.2 CC1=CSC(=S)N1 Amb22732376 [1,1,0,0,0,0|1,0,0]=3 1548 B7R1.2 CC1=NNC(=S)N1 Amb18114828 [1,1,0,0,0,0|1,0,0]=3 1549 B7R1.2 CC1=NNC(=S)O1 Amb19200119 [1,1,0,0,0,0|2,0,0]=4 1550 B7R1.2 CC1=NNC(=S)S1 Amb20654003 [1,1,0,0,0,0|2,0,0]=4 1551 B7R1.2 CC1=NOC(=S)N1 Amb19309843 [1,1,0,0,0,0|2,0,0]=4 1552 B7R1.2 CC1CNC(=S)N1 Amb2724258 [1,1,0,0,0,0|0,0,2]=4 1553 B7R1.2 CN1C=C(O)ON1 Amb27256987 [1,1,0,0,0,0|2,0,0]=4 1554 B7R1.2 CN1C=CC(=O)C1 Amb28201569 [1,1,0,0,0,0|1,0,1]=4 1555 B7R1.2 CN1C=NC(=N)C1 Amb27625244 [1,1,0,0,0,0|0,0,2]=4 1556 B7R1.2 CN1C=NC(=O)N1 Amb25949529 [1,1,0,0,0,0|1,0,1]=4 1557 B7R1.2 CN1C=NC(=S)C1 Amb27246808 [1,1,0,0,0,0|0,0,2]=4 1558 B7R1.2 C[n+]1cn(N)cn1 Amb22263398 [1,1,0,0,0,0|1,0,1]=4 1559 B7R1.2 Cc1ccn(C)c1 Amb24333650 [1,1,0,0,0,0|1,0,0]=3 1560 B7R1.2 Cc1ccn(C)n1 Amb1102391 [1,1,0,0,0,0|2,0,0]=4 1561 B7R1.2 Cc1ccn(C)n1 Amb32652720 [1,1,0,0,0,0|2,0,0]=4 1562 B7R1.2 Cc1ccn(N)n1 Amb25294398 [1,1,0,0,0,0|2,0,0]=4 1563 B7R1.2 Cc1cn(C)cn1 Amb20240808 [1,1,0,0,0,0|0,0,1]=3 1564 B7R1.2 Cc1cn(C)nn1 Amb22498162 [1,1,0,0,0,0|1,0,1]=4 1565 B7R1.2 Cc1cnn(C)c1 Amb15692569 [1,1,0,0,0,0|2,0,0]=4 1566 B7R1.2 Cc1cnn(O)c1 Amb28203190 [1,1,0,0,0,0|2,0,0]=4 1567 B7R1.2 Cc1coc(Br)c1 Amb10600631 [1,1,0,0,0,0|2,0,0]=4 1568 B7R1.2 Cc1coc(I)c1 Amb32685628 [1,1,0,0,0,0|2,0,0]=4 1569 B7R1.2 Cc1coc(N)c1 Amb10600632 [1,1,0,0,0,0|2,0,0]=4 1570 B7R1.2 Cc1csc(Br)c1 Amb10600630 [1,1,0,0,0,0|2,0,0]=4 1571 B7R1.2 Cc1csc(C)c1 Amb2447068 [1,1,0,0,0,0|2,0,0]=4 1572 B7R1.2 Cc1csc(Cl)c1 Amb26641847 [1,1,0,0,0,0|2,0,0]=4 1573 B7R1.2 Cc1csc(I)c1 Amb22496053 [1,1,0,0,0,0|2,0,0]=4 1574 B7R1.2 Cc1csc(N)c1 Amb19958131 [1,1,0,0,0,0|2,0,0]=4 1575 B7R1.2 Cc1csc(N)c1 Amb2778988 [1,1,0,0,0,0|2,0,0]=4 1576 B7R1.2 Cc1csc(O)c1 Amb20617904 [1,1,0,0,0,0|2,0,0]=4 1577 B7R1.2 Cc1csc(S)c1 Amb26419420 [1,1,0,0,0,0|2,0,0]=4 1578 B7R1.2 Cn1[c+]n(C)cc1 Amb22492502 [1,1,0,0,0,0|0,0,1]=3 1579 B7R1.2 Cn1c[n+](N)cn1 Amb25876216 [1,1,0,0,0,0|1,0,1]=4 1580 B7R1.2 Cn1cc(Br)cn1 Amb2447654 [1,1,0,0,0,0|2,0,0]=4 1581 B7R1.2 Cn1cc(Br)nn1 Amb19375028 [1,1,0,0,0,0|1,0,1]=4 1582 B7R1.2 Cn1cc(Cl)cn1 Amb9173509 [1,1,0,0,0,0|2,0,0]=4 1583 B7R1.2 Cn1cc(Cl)nn1 Amb26412072 [1,1,0,0,0,0|1,0,1]=4 1584 B7R1.2 Cn1cc(F)cn1 Amb23402169 [1,1,0,0,0,0|2,0,0]=4 1585 B7R1.2 Cn1cc(I)cn1 Amb8517060 [1,1,0,0,0,0|2,0,0]=4 1586 B7R1.2 Cn1cc(I)nn1 Amb32685569 [1,1,0,0,0,0|1,0,1]=4 1587 B7R1.2 Cn1cc(N)cn1 Amb15740846 [1,1,0,0,0,0|2,0,0]=4 1588 B7R1.2 Cn1cc(N)cn1 Amb2693437 [1,1,0,0,0,0|2,0,0]=4 1589 B7R1.2 Cn1cc(N)cn1 Amb6827128 [1,1,0,0,0,0|2,0,0]=4 1590 B7R1.2 Cn1cc(N)nn1 Amb10607638 [1,1,0,0,0,0|1,0,1]=4 1591 B7R1.2 Cn1cc(N)nn1 Amb33544834 [1,1,0,0,0,0|1,0,1]=4 1592 B7R1.2 Cn1cc(O)cn1 Amb33549858 [1,1,0,0,0,0|2,0,0]=4 1593 B7R1.2 Cn1cc(O)cn1 Amb33552990 [1,1,0,0,0,0|2,0,0]=4 1594 B7R1.2 Cn1cc(S)cn1 Amb7784830 [1,1,0,0,0,0|2,0,0]=4 1595 B7R1.2 Cn1cc(S)nn1 Amb33325350 [1,1,0,0,0,0|1,0,1]=4 1596 B7R1.2 Cn1cc([O-])[o+]n1 Amb22264900 [1,1,0,0,0,0|2,0,0]=4 1597 B7R1.2 Cn1cc[n+](C)c1 Amb22002226 [1,1,0,0,0,0|0,0,1]=3 1598 B7R1.2 Cn1cc[n+](C)c1 Amb33871551 [1,1,0,0,0,0|0,0,1]=3 1599 B7R1.2 Cn1cc[n+](C)c1 Amb4006031 [1,1,0,0,0,0|0,0,1]=3 1600 B7R1.2 Cn1cc[n+]([O-])n1 Amb21962954 [1,1,0,0,0,0|1,0,1]=4 1601 B7R1.2 Cn1ccc(Br)c1 Amb18243475 [1,1,0,0,0,0|1,0,0]=3 1602 B7R1.2 Cn1ccc(Br)n1 Amb10669443 [1,1,0,0,0,0|2,0,0]=4 1603 B7R1.2 Cn1ccc(Cl)n1 Amb6572473 [1,1,0,0,0,0|2,0,0]=4 1604 B7R1.2 Cn1ccc(I)n1 Amb2723921 [1,1,0,0,0,0|2,0,0]=4 1605 B7R1.2 Cn1ccc(N)c1 Amb18559366 [1,1,0,0,0,0|1,0,0]=3 1606 B7R1.2 Cn1ccc(N)c1 Amb22498085 [1,1,0,0,0,0|1,0,0]=3 1607 B7R1.2 Cn1ccc(N)n1 Amb1154592 [1,1,0,0,0,0|2,0,0]=4 1608 B7R1.2 Cn1ccc(O)n1 Amb22388466 [1,1,0,0,0,0|2,0,0]=4 1609 B7R1.2 Cn1ccc(S)n1 Amb25169408 [1,1,0,0,0,0|2,0,0]=4 1610 B7R1.2 Cn1cn[n+](C)c1 Amb4007048 [1,1,0,0,0,0|1,0,1]=4 1611 B7R1.2 Cn1cnc(Br)c1 Amb10069028 [1,1,0,0,0,0|0,0,1]=3 1612 B7R1.2 Cn1cnc(Br)c1 Amb20075710 [1,1,0,0,0,0|0,0,1]=3 1613 B7R1.2 Cn1cnc(Br)n1 Amb18829876 [1,1,0,0,0,0|1,0,1]=4 1614 B7R1.2 Cn1cnc(Cl)c1 Amb15701417 [1,1,0,0,0,0|0,0,1]=3 1615 B7R1.2 Cn1cnc(Cl)n1 Amb19517098 [1,1,0,0,0,0|1,0,1]=4 1616 B7R1.2 Cn1cnc(I)c1 Amb17938088 [1,1,0,0,0,0|0,0,1]=3 1617 B7R1.2 Cn1cnc(I)c1 Amb2455719 [1,1,0,0,0,0|0,0,1]=3 1618 B7R1.2 Cn1cnc(I)n1 Amb27652267 [1,1,0,0,0,0|1,0,1]=4 1619 B7R1.2 Cn1cnc(N)c1 Amb18200102 [1,1,0,0,0,0|0,0,1]=3 1620 B7R1.2 Cn1cnc(N)c1 Amb21858995 [1,1,0,0,0,0|0,0,1]=3 1621 B7R1.2 Cn1cnc(N)c1 Amb22371276 [1,1,0,0,0,0|0,0,1]=3 1622 B7R1.2 Cn1cnc(N)n1 Amb21954300 [1,1,0,0,0,0|1,0,1]=4 1623 B7R1.2 Cn1cnc(N)n1 Amb22586704 [1,1,0,0,0,0|1,0,1]=4 1624 B7R1.2 Cn1cnc(N)n1 Amb2784037 [1,1,0,0,0,0|1,0,1]=4 1625 B7R1.2 Cn1cnc(O)c1 Amb27471105 [1,1,0,0,0,0|0,0,1]=3 1626 B7R1.2 FC1=COC(=S)N1 Amb27842398 [1,1,0,0,0,0|1,0,0]=3 1627 B7R1.2 N=C1NC(=S)SS1 Amb19653977 [1,1,0,0,0,0|2,0,0]=4 1628 B7R1.2 N=C1NC=C(Br)S1 Amb22492595 [1,1,0,0,0,0|2,0,0]=4 1629 B7R1.2 N=C1NNC(=N)N1 Amb22730030 [1,1,0,0,0,0|2,0,0]=4 1630 B7R1.2 NC1=CCC(=O)N1 Amb25757914 [1,1,0,0,0,0|1,1,0]=4 1631 B7R1.2 NC1=NNC(=O)N1 Amb33527975 [1,1,0,0,0,0|1,1,0]=4 1632 B7R1.2 NC1=NNC(=S)N1 Amb19115709 [1,1,0,0,0,0|1,0,0]=3 1633 B7R1.2 NC1=NNC(=S)S1 Amb21933733 [1,1,0,0,0,0|2,0,0]=4 1634 B7R1.2 Nn1ccc(Br)c1 Amb26555283 [1,1,0,0,0,0|2,0,0]=4 1635 B7R1.2 Nn1cnc(O)c1 Amb27958962 [1,1,0,0,0,0|1,0,1]=4 1636 B7R1.2 O=C1C=CC(=O)N1 Amb1235242 [1,1,0,0,0,0|1,1,0]=4 1637 B7R1.2 O=C1CCC(=S)N1 Amb28122939 [1,1,0,0,0,0|1,0,1]=4 1638 B7R1.2 O=C1CNC(=O)N1 Amb3598086 [1,1,0,0,0,0|0,1,1]=4 1639 B7R1.2 O=C1CNC(=S)N1 Amb1151361 [1,1,0,0,0,0|0,0,1]=3 1640 B7R1.2 O=C1CNC(=S)O1 Amb27393154 [1,1,0,0,0,0|1,0,1]=4 1641 B7R1.2 O=C1CNC(=S)S1 Amb621648 [1,1,0,0,0,0|1,0,1]=4 1642 B7R1.2 O=C1CSC(=S)N1 Amb1008361 [1,1,0,0,0,0|1,0,1]=4 1643 B7R1.2 O=C1NC(=S)CO1 Amb28384997 [1,1,0,0,0,0|2,0,0]=4 1644 B7R1.2 O=C1NC(=S)CS1 Amb2469502 [1,1,0,0,0,0|2,0,0]=4 1645 B7R1.2 O=C1NC(S)=CO1 Amb27441431 [1,1,0,0,0,0|1,1,0]=4 1646 B7R1.2 O=C1NC(S)=CS1 Amb27972291 [1,1,0,0,0,0|1,1,0]=4 1647 B7R1.2 O=C1NC=C(Cl)S1 Amb28367152 [1,1,0,0,0,0|1,1,0]=4 1648 B7R1.2 O=C1NC=C(I)S1 Amb24623936 [1,1,0,0,0,0|1,1,0]=4 1649 B7R1.2 O=C1NCC(=S)N1 Amb2794498 [1,1,0,0,0,0|0,1,1]=4 1650 B7R1.2 O=C1NN=C(Cl)N1 Amb19516644 [1,1,0,0,0,0|1,1,0]=4 1651 B7R1.2 O=C1NNC(=O)N1 Amb20660475 [1,1,0,0,0,0|1,1,0]=4 1652 B7R1.2 O=C1NOC(=O)N1 Amb22002584 [1,1,0,0,0,0|1,1,0]=4 1653 B7R1.2 OC1=CNC(=S)S1 Amb26391172 [1,1,0,0,0,0|1,0,0]=3 1654 B7R1.2 OC1=COC(=S)N1 Amb26915057 [1,1,0,0,0,0|1,0,0]=3 1655 B7R1.2 OC1=CSC(=S)N1 Amb33827704 [1,1,0,0,0,0|1,0,0]=3 1656 B7R1.2 S=C1CC(Cl)=CS1 Amb27186087 [1,1,0,0,0,0|2,0,0]=4 1657 B7R1.2 S=C1CCC(=S)N1 Amb24479225 [1,1,0,0,0,0|1,0,1]=4 1658 B7R1.2 S=C1CSC(=S)N1 Amb2794521 [1,1,0,0,0,0|1,0,1]=4 1659 B7R1.2 S=C1NC(Cl)=CO1 Amb28255871 [1,1,0,0,0,0|1,0,0]=3 1660 B7R1.2 S=C1NC=C(Br)S1 Amb22491021 [1,1,0,0,0,0|1,0,0]=3 1661 B7R1.2 S=C1NNC(=S)S1 Amb21935678 [1,1,0,0,0,0|2,0,0]=4 1662 B7R1.2 [O-][n+]1ccn(O)c1 Amb1971431 [1,1,0,0,0,0|1,0,1]=4 1663 B7R1.15 C=C1C(=O)C=C1C Amb27802553 [0,1,0,0,1,0|2,0,0]=4 1664 B7R1.17 CC1(C)C=CC1=O Amb27486040 [0,1,0,0,1,0|1,1,0]=4 1665 B9R1.2 C#CC1=NC(=S)NC=C1 Amb27179554 [0,1,0,0,0,1|1,0,1]=4 1666 B9R1.2 C=CC1C=CNC(=S)N1 Amb27436576 [0,1,0,0,0,1|1,0,1]=4 1667 B9R1.2 CCC1=CC(=S)NN=C1 Amb30013481 [0,1,0,0,0,1|2,0,0]=4 1668 B9R1.2 CCC1=CC=CC(=S)N1 Amb35707039 [0,1,0,0,0,1|2,0,0]=4 1669 B9R1.2 CN1C=CCC(C#N)=C1 Amb24738249 [0,1,0,0,0,1|2,0,0]=4 1670 B9R1.2 CNC1=CC=NC(=S)N1 Amb24638441 [0,1,0,0,0,1|1,0,1]=4 1671 B9R1.2 CNC1=NC(=O)NC=C1 Amb28934984 [0,1,0,0,0,1|1,1,0]=4 1672 B9R1.2 COC1=CC(=O)NC=C1 Amb19958213 [0,1,0,0,0,1|1,1,0]=4 1673 B9R1.2 COC1=NC(=O)NC=C1 Amb24077352 [0,1,0,0,0,1|1,1,0]=4 1674 B9R1.2 CSC1=NC(=O)NC=C1 Amb22232091 [0,1,0,0,0,1|1,1,0]=4 1675 B9R1.2 NCC1=CC(=O)NC=C1 Amb21963528 [0,1,0,0,0,1|1,1,0]=4 1676 B9R1.2 NCC1=CC(=O)NC=C1 Amb21963542 [0,1,0,0,0,1|1,1,0]=4 1677 B9R1.2 N\N=C1\C=CNC(=S)N1 Amb24407118 [0,1,0,0,0,1|2,0,0]=4 1678 B9R1.2 O=C1C=C(CCl)C=CN1 Amb25959595 [0,1,0,0,0,1|1,1,0]=4 1679 B9R1.2 O=C1C=C(CO)C=CN1 Amb21960732 [0,1,0,0,0,1|1,1,0]=4 1680 B9R1.3 CC1=C(Br)C(=O)NC=C1 Amb20242526 [0,1,0,0,0,1|1,1,0]=4 1681 B9R1.3 CC1=C(C)C(=S)NC=N1 Amb24763482 [0,1,0,0,0,1|2,0,0]=4 1682 B9R1.3 CC1=C(Cl)C(=O)NC=C1 Amb23448400 [0,1,0,0,0,1|1,1,0]=4 1683 B9R1.3 CC1=C(F)C(=O)NC=C1 Amb24477858 [0,1,0,0,0,1|1,1,0]=4 1684 B9R1.3 CC1=C(O)C(=O)NC=C1 Amb24574176 [0,1,0,0,0,1|1,1,0]=4 1685 B9R1.3 CC1=CC=CN(C)C1=O Amb19128074 [0,1,0,0,0,1|2,0,0]=4 1686 B9R1.3 CN1C(=O)C=CNC1=S Amb22522665 [0,1,0,0,0,1|2,0,0]=4 1687 B9R1.3 CN1C(=S)C=CNC1=S Amb25196540 [0,1,0,0,0,1|2,0,0]=4 1688 B9R1.3 CN1C=CC=C(Br)C1=O Amb22751623 [0,1,0,0,0,1|2,0,0]=4 1689 B9R1.3 CN1C=CC=C(Cl)C1=O Amb23448395 [0,1,0,0,0,1|2,0,0]=4 1690 B9R1.3 CN1C=CC=C(I)C1=O Amb24381284 [0,1,0,0,0,1|2,0,0]=4 1691 B9R1.3 CN1C=CC=C(N)C1=O Amb18943835 [0,1,0,0,0,1|2,0,0]=4 1692 B9R1.3 CN1C=CC=C(N)C1=O Amb22899627 [0,1,0,0,0,1|2,0,0]=4 1693 B9R1.3 CN1C=CC=C(O)C1=O Amb20239347 [0,1,0,0,0,1|1,1,0]=4 1694 B9R1.3 CN1C=CCC(=O)C1=O Amb25031869 [0,1,0,0,0,1|1,1,0]=4 1695 B9R1.3 CN1C=CN=C(Br)C1=O Amb19047333 [0,1,0,0,0,1|1,0,1]=4 1696 B9R1.3 CN1C=CN=C(Cl)C1=O Amb19514674 [0,1,0,0,0,1|1,0,1]=4 1697 B9R1.3 CN1C=CN=C(F)C1=O Amb35642432 [0,1,0,0,0,1|1,0,1]=4 1698 B9R1.3 CN1C=CN=C(N)C1=O Amb18943716 [0,1,0,0,0,1|1,0,1]=4 1699 B9R1.3 CN1C=CN=C(O)C1=O Amb22059077 [0,1,0,0,0,1|0,1,1]=4 1700 B9R1.3 CN1C=CN=C(S)C1=O Amb24649932 [0,1,0,0,0,1|0,0,2]=4 1701 B9R1.3 CN1C=CNC(=O)C1=O Amb19307163 [0,1,0,0,0,1|0,1,0]=3 1702 B9R1.3 Cc1cccn(C)c1=S Amb2611999 [0,1,0,0,0,1|2,0,0]=4 1703 B9R1.3 Cn1cccc(Cl)c1=S Amb2612036 [0,1,0,0,0,1|2,0,0]=4 1704 B9R1.3 NN1C(=O)C=CNC1=S Amb28399849 [0,1,0,0,0,1|2,0,0]=4 1705 B9R1.34 C=C1C=C(C)C=C(C)N1 Amb24103119 [0,1,0,0,0,1|2,0,0]=4 1706 B9R1.34 CC1=CC(=O)NC(=O)N1 Amb18028578 [0,1,0,0,0,1|1,1,0]=4 1707 B9R1.34 CC1=CC(=O)NC(=S)N1 Amb19667875 [0,1,0,0,0,1|1,0,0]=3 1708 B9R1.34 CC1=CC(=O)NC(C)=C1 Amb20240634 [0,1,0,0,0,1|1,1,0]=4 1709 B9R1.34 CC1=CC(=O)NC(C)=N1 Amb19116070 [0,1,0,0,0,1|2,0,0]=4 1710 B9R1.34 CC1=CC(=O)NC(Cl)=C1 Amb24524213 [0,1,0,0,0,1|1,1,0]=4 1711 B9R1.34 CC1=CC(=O)NC(N)=C1 Amb19372509 [0,1,0,0,0,1|1,1,0]=4 1712 B9R1.34 CC1=CC(=O)NC(N)=N1 Amb18375870 [0,1,0,0,0,1|2,0,0]=4 1713 B9R1.34 CC1=CC(=O)NC(O)=C1 Amb20075946 [0,1,0,0,0,1|1,1,0]=4 1714 B9R1.34 CC1=CC(=S)NC(=S)N1 Amb20654147 [0,1,0,0,0,1|1,0,0]=3 1715 B9R1.34 CC1=CC(=S)NC(C)=N1 Amb18372524 [0,1,0,0,0,1|2,0,0]=4 1716 B9R1.34 CC1=CC(=S)SC(=S)N1 Amb27882746 [0,1,0,0,0,1|2,0,0]=4 1717 B9R1.34 CC1=CC(C)=NC(=O)N1 Amb19131987 [0,1,0,0,0,1|1,1,0]=4 1718 B9R1.34 CC1=CC(C)=NC(=O)N1 Amb19261104 [0,1,0,0,0,1|1,1,0]=4 1719 B9R1.34 CC1=CC(C)=NC(=O)N1 Amb35750037 [0,1,0,0,0,1|1,1,0]=4 1720 B9R1.34 CC1=CC(C)=NC(=S)N1 Amb18545466 [0,1,0,0,0,1|1,0,0]=3 1721 B9R1.34 CC1=CC(C)=NC(=S)N1 Amb19667991 [0,1,0,0,0,1|1,0,0]=3 1722 B9R1.34 CC1=CC(Cl)=NC(=S)N1 Amb22751477 [0,1,0,0,0,1|1,0,1]=4 1723 B9R1.34 CC1=CN(C)C=C(N)N1 Amb27493025 [0,1,0,0,0,1|1,0,0]=3 1724 B9R1.34 CC1=NC(=S)NC(C)=N1 Amb35742771 [0,1,0,0,0,1|2,0,0]=4 1725 B9R1.34 CC1=NC(=S)NC(N)=C1 Amb22492188 [0,1,0,0,0,1|1,0,0]=3 1726 B9R1.34 CC1CC(=O)NC(=S)S1 Amb27622206 [0,1,0,0,0,1|1,0,1]=4 1727 B9R1.34 CC1CC(=S)NC(=S)S1 Amb27166183 [0,1,0,0,0,1|1,0,1]=4 1728 B9R1.34 CC1CN(C)NC(=S)N1 Amb28250782 [0,1,0,0,0,1|0,0,2]=4 1729 B9R1.34 CN1CC(=O)NC(=O)C1 Amb449715 [0,1,0,0,0,1|0,1,1]=4 1730 B9R1.34 NC1=CC(=O)NC(=S)N1 Amb18012807 [0,1,0,0,0,1|2,0,0]=4 1731 B9R1.34 NC1=CC(=O)NC(=S)N1 Amb19130496 [0,1,0,0,0,1|2,0,0]=4 1732 B9R1.34 NC1=CC(N)=NC(=S)N1 Amb20648501 [0,1,0,0,0,1|2,0,0]=4 1733 B9R1.34 NC1=NC(=S)NC(Cl)=C1 Amb24596501 [0,1,0,0,0,1|2,0,0]=4 1734 B9R1.66 CC1(C)C=CNC(S)=N1 Amb27596671 [0,1,0,0,0,1|1,0,1]=4 1735 B9R1.69 CC1=C(C)NC(=S)C=C1 Amb27179847 [0,1,0,0,0,1|2,0,0]=4 1736 B9R1.69 CC1=C(F)C=NC(=S)N1 Amb28289146 [0,1,0,0,0,1|1,0,1]=4 1737 B9R1.69 CC1=CC(=O)NC=C1Br Amb18040562 [0,1,0,0,0,1|1,1,0]=4 1738 B9R1.69 CC1=CC(=O)NC=C1Br Amb33266063 [0,1,0,0,0,1|1,1,0]=4 1739 B9R1.69 CC1=CC(=O)NC=C1F Amb24401662 [0,1,0,0,0,1|1,1,0]=4 1740 B9R1.69 CC1=CC(=O)NC=C1N Amb22059188 [0,1,0,0,0,1|1,1,0]=4 1741 B9R1.69 CC1=CC(=S)N(O)C=C1 Amb23592269 [0,1,0,0,0,1|1,0,0]=3 1742 B9R1.69 CC1=CC(=S)NN=C1C Amb33853566 [0,1,0,0,0,1|2,0,0]=4 1743 B9R1.69 CC1=CN(C)C=CC1=O Amb26494391 [0,1,0,0,0,1|2,0,0]=4 1744 B9R1.69 CC1=CN(C)C=CN1C Amb26455643 [0,1,0,0,0,1|1,0,0]=3 1745 B9R1.69 CC1=CNC(=S)NC1=O Amb18363105 [0,1,0,0,0,1|2,0,0]=4 1746 B9R1.69 CC1=CNC(=S)SC1=S Amb28343138 [0,1,0,0,0,1|2,0,0]=4 1747 B9R1.69 CC1=CNC(=S)SC1C Amb28061073 [0,1,0,0,0,1|1,0,0]=3 1748 B9R1.69 CC1=NN(C)C(=O)C=C1 Amb20245716 [0,1,0,0,0,1|2,0,0]=4 1749 B9R1.69 CC1C=CN(C)C(=S)N1 Amb27391164 [0,1,0,0,0,1|1,0,0]=3 1750 B9R1.69 CC1C=CN(N)C(=O)N1 Amb27268924 [0,1,0,0,0,1|1,1,0]=4 1751 B9R1.69 CN1C=C(Br)C=CC1=O Amb19127382 [0,1,0,0,0,1|2,0,0]=4 1752 B9R1.69 CN1C=C(Br)C=CC1=S Amb27242585 [0,1,0,0,0,1|2,0,0]=4 1753 B9R1.69 CN1C=C(Br)N=CC1=O Amb19957883 [0,1,0,0,0,1|1,0,1]=4 1754 B9R1.69 CN1C=C(Cl)C=CC1=O Amb19127719 [0,1,0,0,0,1|2,0,0]=4 1755 B9R1.69 CN1C=C(Cl)N=CC1=O Amb27466511 [0,1,0,0,0,1|1,0,1]=4 1756 B9R1.69 CN1C=C(F)C=CC1=O Amb19127846 [0,1,0,0,0,1|2,0,0]=4 1757 B9R1.69 CN1C=C(I)C=CC1=O Amb25124951 [0,1,0,0,0,1|2,0,0]=4 1758 B9R1.69 CN1C=C(N)C=CC1=O Amb18030063 [0,1,0,0,0,1|2,0,0]=4 1759 B9R1.69 CN1C=C(N)C=CC1=O Amb19372742 [0,1,0,0,0,1|2,0,0]=4 1760 B9R1.69 CN1C=C(N)C=CC1=O Amb22405882 [0,1,0,0,0,1|2,0,0]=4 1761 B9R1.69 CN1C=C(O)C=CC1=O Amb22371453 [0,1,0,0,0,1|1,1,0]=4 1762 B9R1.69 CN1C=CC(=O)C(Br)=C1 Amb22750543 [0,1,0,0,0,1|2,0,0]=4 1763 B9R1.69 CN1C=CC(=O)C(Cl)=C1 Amb25744517 [0,1,0,0,0,1|2,0,0]=4 1764 B9R1.69 CN1C=CC(=O)C(I)=C1 Amb28428506 [0,1,0,0,0,1|2,0,0]=4 1765 B9R1.69 CN1C=CC(=O)C(N)=C1 Amb23586003 [0,1,0,0,0,1|2,0,0]=4 1766 B9R1.69 CN1C=CC(=O)C(O)=C1 Amb21520366 [0,1,0,0,0,1|1,1,0]=4 1767 B9R1.69 CN1CC(=O)NCC1=O Amb24271107 [0,1,0,0,0,1|0,1,1]=4 1768 B9R1.69 CN1N=C(Br)C=CC1=O Amb19516718 [0,1,0,0,0,1|2,0,0]=4 1769 B9R1.69 CN1N=C(Cl)C=CC1=O Amb19850237 [0,1,0,0,0,1|2,0,0]=4 1770 B9R1.69 CN1N=C(F)C=CC1=O Amb23400494 [0,1,0,0,0,1|2,0,0]=4 1771 B9R1.69 CN1N=C(N)C=CC1=O Amb18862303 [0,1,0,0,0,1|2,0,0]=4 1772 B9R1.69 CN1N=C(N)C=CC1=S Amb25111966 [0,1,0,0,0,1|2,0,0]=4 1773 B9R1.69 CN1N=C(O)C=CC1=O Amb19650751 [0,1,0,0,0,1|1,1,0]=4 1774 B9R1.69 Cn1cc(Br)ccc1=O Amb22229889 [0,1,0,0,0,1|2,0,0]=4 1775 B9R1.69 Cn1ccc(=O)c(O)c1 Amb22504110 [0,1,0,0,0,1|1,1,0]=4 1776 B9R1.69 NN1C=CC(=S)NC1=S Amb27236885 [0,1,0,0,0,1|2,0,0]=4 1777 B9R1.69 O=C1NC(=S)NC=C1F Amb21857036 [0,1,0,0,0,1|2,0,0]=4 1778 B9R1.15 CC1C=CNC=C1C=O Amb27872192 [0,1,0,0,0,1|1,1,0]=4 1779 B9R1.15 CCC1=CC=NNC1=O Amb22276525 [0,1,0,0,0,1|1,1,0]=4 1780 B9R1.15 CCC1=CN=CNC1=S Amb35707042 [0,1,0,0,0,1|1,0,0]=3 1781 B9R1.15 CCC1=NC=CNC1=O Amb21912469 [0,1,0,0,0,1|1,1,0]=4 1782 B9R1.15 CCC1=NC=CNC1=O Amb33482713 [0,1,0,0,0,1|1,1,0]=4 1783 B9R1.15 CCN1C=CC=CC1=O Amb22359913 [0,1,0,0,0,1|1,1,0]=4 1784 B9R1.15 CCN1C=CC=NC1=O Amb28383514 [0,1,0,0,0,1|0,1,1]=4 1785 B9R1.15 CCN1C=CCN=C1C Amb27202051 [0,1,0,0,0,1|1,0,1]=4 1786 B9R1.15 CCN1C=CN=CC1=O Amb27656452 [0,1,0,0,0,1|0,1,1]=4 1787 B9R1.15 CCN1C=NC=CC1=O Amb22522565 [0,1,0,0,0,1|1,1,0]=4 1788 B9R1.15 CCN1N=CC=CC1=O Amb27982804 [0,1,0,0,0,1|1,1,0]=4 1789 B9R1.15 COC1=CC=CNC1=O Amb18364335 [0,1,0,0,0,1|1,1,0]=4 1790 B9R1.15 COC1=CC=CNC1=O Amb28934991 [0,1,0,0,0,1|1,1,0]=4 1791 B9R1.15 COC1=CC=CNC1=S Amb21520451 [0,1,0,0,0,1|1,0,0]=3 1792 B9R1.15 COC1=CC=NNC1=O Amb24309185 [0,1,0,0,0,1|1,1,0]=4 1793 B9R1.15 COC1=CN=CNC1=O Amb21963503 [0,1,0,0,0,1|1,1,0]=4 1794 B9R1.15 COC1SC=CNC1=O Amb27948263 [0,1,0,0,0,1|1,1,0]=4 1795 B9R1.15 CSC1=CC=CNC1=O Amb27424642 [0,1,0,0,0,1|1,1,0]=4 1796 B9R1.15 CSC1=CN=CNC1=O Amb29838309 [0,1,0,0,0,1|1,1,0]=4 1797 B9R1.15 N#CC1=CC=CNC1=S Amb19887168 [0,1,0,0,0,1|1,0,1]=4 1798 B9R1.15 NCC1=CC=CNC1=O Amb18043158 [0,1,0,0,0,1|1,1,0]=4 1799 B9R1.15 NCC1=CC=CNC1=O Amb22054312 [0,1,0,0,0,1|1,1,0]=4 1800 B9R1.15 NCC1=CN=CNC1=O Amb18251092 [0,1,0,0,0,1|1,1,0]=4 1801 B9R1.15 O=C1NC=CC=C1CBr Amb18925116 [0,1,0,0,0,1|1,1,0]=4 1802 B9R1.15 O=C1NC=CC=C1CO Amb18922455 [0,1,0,0,0,1|1,1,0]=4 1803 B9R1.15 O=C1NC=NC=C1CO Amb27228831 [0,1,0,0,0,1|1,1,0]=4 1804 B9R1.15 OCC1=CC=CNC1=S Amb25210908 [0,1,0,0,0,1|1,0,0]=3 1805 B9R1.14 C#Cc1nccn1CC Amb24391282 [0,2,0,0,0,0|1,0,1]=4 1806 B9R1.14 C=Cc1nccn1CC Amb25268534 [0,2,0,0,0,0|1,0,1]=4 1807 B9R1.14 CCN1C=CNC1SC Amb27204380 [0,2,0,0,0,0|0,0,2]=4 1808 B9R1.14 CCc1cccn1CC Amb27843474 [0,2,0,0,0,0|2,0,0]=4 1809 B9R1.14 CCn1cccc1C#N Amb18124278 [0,2,0,0,0,0|2,0,0]=4 1810 B9R1.14 CCn1cccc1C=O Amb33531562 [0,2,0,0,0,0|1,1,0]=4 1811 B9R1.14 CCn1cccc1CBr Amb22270986 [0,2,0,0,0,0|2,0,0]=4 1812 B9R1.14 CCn1cccc1CN Amb18251089 [0,2,0,0,0,0|2,0,0]=4 1813 B9R1.14 CCn1cccc1CO Amb837266 [0,2,0,0,0,0|1,1,0]=4 1814 B9R1.14 CCn1cccc1CS Amb22270990 [0,2,0,0,0,0|1,0,1]=4 1815 B9R1.14 CCn1cccc1C[O-] Amb22411416 [0,2,0,0,0,0|1,1,0]=4 1816 B9R1.14 CCn1cccc1C[O-] Amb32411914 [0,2,0,0,0,0|1,1,0]=4 1817 B9R1.14 CCn1ccnc1C#N Amb27645707 [0,2,0,0,0,0|1,0,1]=4 1818 B9R1.14 CCn1ccnc1C=O Amb7093336 [0,2,0,0,0,0|0,1,1]=4 1819 B9R1.14 CCn1ccnc1CBr Amb22271011 [0,2,0,0,0,0|1,0,1]=4 1820 B9R1.14 CCn1ccnc1CBr Amb32645743 [0,2,0,0,0,0|1,0,1]=4 1821 B9R1.14 CCn1ccnc1CCl Amb13952564 [0,2,0,0,0,0|1,0,1]=4 1822 B9R1.14 CCn1ccnc1CCl Amb2797430 [0,2,0,0,0,0|1,0,1]=4 1823 B9R1.14 CCn1ccnc1CI Amb22271012 [0,2,0,0,0,0|1,0,1]=4 1824 B9R1.14 CCn1ccnc1CN Amb21959843 [0,2,0,0,0,0|1,0,1]=4 1825 B9R1.14 CCn1ccnc1CN Amb2797428 [0,2,0,0,0,0|1,0,1]=4 1826 B9R1.14 CCn1ccnc1CO Amb7093337 [0,2,0,0,0,0|0,1,1]=4 1827 B9R1.14 CCn1ccnc1CS Amb22271015 [0,2,0,0,0,0|0,0,2]=4 1828 B9R1.14 CCn1ccnc1NC Amb18284804 [0,2,0,0,0,0|1,0,1]=4 1829 B9R1.14 CCn1ccnc1NN Amb27837522 [0,2,0,0,0,0|1,0,1]=4 1830 B9R1.14 CCn1ccnc1NN Amb31207693 [0,2,0,0,0,0|1,0,1]=4 1831 B9R1.14 COn1cccc1C=O Amb27801782 [0,2,0,0,0,0|1,1,0]=4 1832 B9R1.14 CSc1nccn1CO Amb28315520 [0,2,0,0,0,0|0,0,2]=4 1833 B9R1.14 OCc1nccn1CO Amb27167644 [0,2,0,0,0,0|0,1,1]=4 1834 B9R1.14 [C-]#[N+]c1nccn1CC Amb33415954 [0,2,0,0,0,0|1,0,1]=4 1835 B9R1.22 CCN1C=C(C)NC1=O Amb27838545 [0,2,0,0,0,0|0,1,0]=3 1836 B9R1.22 CCN1N=C(Br)NC1=O Amb19516844 [0,2,0,0,0,0|1,1,0]=4 1837 B9R1.22 CCN1NC(=O)NC1=S Amb27751377 [0,2,0,0,0,0|1,0,0]=3 1838 B9R1.22 CCc1nc(Br)cn1C Amb24317728 [0,2,0,0,0,0|1,0,1]=4 1839 B9R1.22 CCc1nc(N)cn1C Amb18686818 [0,2,0,0,0,0|1,0,1]=4 1840 B9R1.22 CCn1cc(Br)nc1C Amb7093832 [0,2,0,0,0,0|1,0,1]=4 1841 B9R1.22 CCn1cc(C)nc1C Amb27837712 [0,2,0,0,0,0|1,0,1]=4 1842 B9R1.22 CCn1cc(C)nc1S Amb27216528 [0,2,0,0,0,0|0,0,2]=4 1843 B9R1.22 CCn1cc(I)nc1N Amb28146283 [0,2,0,0,0,0|1,0,1]=4 1844 B9R1.22 CCn1cc(N)nc1Br Amb33191743 [0,2,0,0,0,0|1,0,1]=4 1845 B9R1.22 CCn1cc(N)nc1C Amb18832800 [0,2,0,0,0,0|1,0,1]=4 1846 B9R1.22 C\C=C1/CC(=O)NC1=S Amb27815223 [0,2,0,0,0,0|1,0,1]=4 1847 B9R1.22 Cc1cc(C)n(CO)c1 Amb28315498 [0,2,0,0,0,0|2,0,0]=4 1848 B9R1.22 Cc1cn(C)c(C#N)n1 Amb18642005 [0,2,0,0,0,0|1,0,1]=4 1849 B9R1.22 Cc1cn(C)c(C=O)n1 Amb8010959 [0,2,0,0,0,0|0,1,1]=4 1850 B9R1.22 Cc1cn(C)c(CCl)n1 Amb33620474 [0,2,0,0,0,0|1,0,1]=4 1851 B9R1.22 Cc1cn(C)c(CO)n1 Amb24269254 [0,2,0,0,0,0|0,1,1]=4 1852 B9R1.22 Cc1cn(C)c(NN)n1 Amb24270960 [0,2,0,0,0,0|1,0,1]=4 1853 B9R1.22 Cc1cn(C)c(NN)n1 Amb30594750 [0,2,0,0,0,0|1,0,1]=4 1854 B9R1.22 Cn1cc(Br)cc1C#N Amb19134387 [0,2,0,0,0,0|2,0,0]=4 1855 B9R1.22 Cn1cc(Br)cc1C=O Amb22408738 [0,2,0,0,0,0|1,1,0]=4 1856 B9R1.22 Cn1cc(Br)cc1CN Amb18253004 [0,2,0,0,0,0|2,0,0]=4 1857 B9R1.22 Cn1cc(Br)cc1CN Amb35788172 [0,2,0,0,0,0|2,0,0]=4 1858 B9R1.22 Cn1cc(Br)nc1C=O Amb18129386 [0,2,0,0,0,0|0,1,1]=4 1859 B9R1.22 Cn1cc(Br)nc1CO Amb27406876 [0,2,0,0,0,0|0,1,1]=4 1860 B9R1.22 Cn1cc(Cl)cc1C=O Amb27409914 [0,2,0,0,0,0|1,1,0]=4 1861 B9R1.22 Cn1cc(Cl)cc1CN Amb18251280 [0,2,0,0,0,0|2,0,0]=4 1862 B9R1.22 Cn1cc(Cl)nc1C=O Amb27659208 [0,2,0,0,0,0|0,1,1]=4 1863 B9R1.22 Cn1cc(N)cc1C#N Amb24444716 [0,2,0,0,0,0|2,0,0]=4 1864 B9R1.22 O=C1CN(CO)C(=O)N1 Amb27482587 [0,2,0,0,0,0|0,1,1]=4 1865 B9R1.27 CCN1C(=O)C=CC1=O Amb1158215 [0,2,0,0,0,0|1,1,0]=4 1866 B9R1.27 CCN1C(=O)CC=C1C Amb25060318 [0,2,0,0,0,0|1,1,0]=4 1867 B9R1.27 CCN1C(=O)CNC1=O Amb9252835 [0,2,0,0,0,0|0,1,1]=4 1868 B9R1.27 CCN1C(=O)CNC1=S Amb927815 [0,2,0,0,0,0|0,0,1]=3 1869 B9R1.27 CCN1C(=O)CSC1=S Amb2780011 [0,2,0,0,0,0|1,0,1]=4 1870 B9R1.27 CCN1C(=O)NC=C1C Amb27782890 [0,2,0,0,0,0|0,1,0]=3 1871 B9R1.27 CCN1C(=O)NN=C1C Amb22235089 [0,2,0,0,0,0|1,1,0]=4 1872 B9R1.27 CCN1C(=O)NNC1=O Amb27222125 [0,2,0,0,0,0|1,1,0]=4 1873 B9R1.27 CCN1C(=S)NN=C1C Amb19747691 [0,2,0,0,0,0|1,0,0]=3 1874 B9R1.27 CCc1c(C)ccn1C Amb28145539 [0,2,0,0,0,0|2,0,0]=4 1875 B9R1.27 CCn1c(C)cnc1Cl Amb7093857 [0,2,0,0,0,0|1,0,1]=4 1876 B9R1.27 CCn1c(Cl)cnc1C Amb19514688 [0,2,0,0,0,0|1,0,1]=4 1877 B9R1.27 CCn1c(O)cnc1N Amb35710117 [0,2,0,0,0,0|1,0,1]=4 1878 B9R1.27 CN=C1N(C)C=CN1C Amb26403888 [0,2,0,0,0,0|1,0,0]=3 1879 B9R1.27 CNn1c(N)ccc1N Amb28397853 [0,2,0,0,0,0|2,0,0]=4 1880 B9R1.27 CON1C(=O)CNC1=O Amb27857149 [0,2,0,0,0,0|0,1,1]=4 1881 B9R1.27 Cc1ccc(C)n1CO Amb26930214 [0,2,0,0,0,0|2,0,0]=4 1882 B9R1.27 Cc1ccn(C)c1C=O Amb18832960 [0,2,0,0,0,0|1,1,0]=4 1883 B9R1.27 Cc1ccn(C)c1CO Amb23441151 [0,2,0,0,0,0|1,1,0]=4 1884 B9R1.27 Cn1ccc(Br)c1C#N Amb22751195 [0,2,0,0,0,0|2,0,0]=4 1885 B9R1.27 Cn1ccc(Cl)c1C#N Amb22751194 [0,2,0,0,0,0|2,0,0]=4 1886 B9R1.27 Cn1ccc(N)c1C#N Amb22751193 [0,2,0,0,0,0|2,0,0]=4 1887 B9R1.27 O=C1C=CC(=O)N1CBr Amb28386005 [0,2,0,0,0,0|1,1,0]=4 1888 B9R1.27 O=C1C=CC(=O)N1CO Amb17616653 [0,2,0,0,0,0|1,1,0]=4 1889 B9R1.27 O=C1NNC(=O)N1CO Amb27803769 [0,2,0,0,0,0|1,1,0]=4 1890 B9R1.33 BrCCn1ccnc1Br Amb27268689 [0,2,0,0,0,0|1,0,1]=4 1891 B9R1.33 C#CCN1C=CSC1=N Amb27392717 [0,2,0,0,0,0|2,0,0]=4 1892 B9R1.33 C#CCN1C=NNC1=O Amb27662895 [0,2,0,0,0,0|1,1,0]=4 1893 B9R1.33 C#CCc1cccn1C Amb25308963 [0,2,0,0,0,0|2,0,0]=4 1894 B9R1.33 C#CCc1nccn1C Amb24339314 [0,2,0,0,0,0|1,0,1]=4 1895 B9R1.33 C#CCn1ccnc1C Amb19291616 [0,2,0,0,0,0|1,0,1]=4 1896 B9R1.33 C=CCN1C=CNC1=O Amb22896428 [0,2,0,0,0,0|0,1,0]=3 1897 B9R1.33 C=CCN1C=CNC1=S Amb18039832 [0,2,0,0,0,0|0,0,0]=2 1898 B9R1.33 C=CCN1C=CSC1=N Amb28049661 [0,2,0,0,0,0|2,0,0]=4 1899 B9R1.33 C=CCN1C=NNC1=S Amb19813683 [0,2,0,0,0,0|1,0,0]=3 1900 B9R1.33 C=CCN1CCNC1=S Amb25146203 [0,2,0,0,0,0|0,0,2]=4 1901 B9R1.33 C=CCN1N=CNC1=O Amb28207999 [0,2,0,0,0,0|1,1,0]=4 1902 B9R1.33 C=CCN1N=NNC1=S Amb22087675 [0,2,0,0,0,0|2,0,0]=4 1903 B9R1.33 C=CCc1cccn1C Amb26872959 [0,2,0,0,0,0|2,0,0]=4 1904 B9R1.33 C=CCn1ccnc1Br Amb17401099 [0,2,0,0,0,0|1,0,1]=4 1905 B9R1.33 C=CCn1ccnc1C Amb8384842 [0,2,0,0,0,0|1,0,1]=4 1906 B9R1.33 C=CCn1ccnc1N Amb25774362 [0,2,0,0,0,0|1,0,1]=4 1907 B9R1.33 C=CSc1nccn1C Amb25974062 [0,2,0,0,0,0|0,0,2]=4 1908 B9R1.33 CCCN1C=CCC1=O Amb27792230 [0,2,0,0,0,0|1,1,0]=4 1909 B9R1.33 CCCN1C=CNC1=S Amb18542355 [0,2,0,0,0,0|0,0,0]=2 1910 B9R1.33 CCCN1C=CSC1=N Amb28344627 [0,2,0,0,0,0|2,0,0]=4 1911 B9R1.33 CCCN1CCNC1=S Amb4035798 [0,2,0,0,0,0|0,0,2]=4 1912 B9R1.33 CCCc1cccn1C Amb27259846 [0,2,0,0,0,0|2,0,0]=4 1913 B9R1.33 CCCn1cccc1C Amb27186235 [0,2,0,0,0,0|2,0,0]=4 1914 B9R1.33 CCCn1ccnc1Br Amb17401245 [0,2,0,0,0,0|1,0,1]=4 1915 B9R1.33 CCCn1ccnc1C Amb24529103 [0,2,0,0,0,0|1,0,1]=4 1916 B9R1.33 CCCn1ccnc1I Amb32685566 [0,2,0,0,0,0|1,0,1]=4 1917 B9R1.33 CCCn1ccnc1N Amb18281317 [0,2,0,0,0,0|1,0,1]=4 1918 B9R1.33 CCCn1ccnc1S Amb419350 [0,2,0,0,0,0|0,0,2]=4 1919 B9R1.33 CCNc1nccn1C Amb18959122 [0,2,0,0,0,0|1,0,1]=4 1920 B9R1.33 CCON1C=CCC1=O Amb28196432 [0,2,0,0,0,0|1,1,0]=4 1921 B9R1.33 CCSC1NC=CN1C Amb27837981 [0,2,0,0,0,0|0,0,2]=4 1922 B9R1.33 CNCc1cccn1C Amb6332084 [0,2,0,0,0,0|2,0,0]=4 1923 B9R1.33 CNCc1nccn1C Amb2371181 [0,2,0,0,0,0|1,0,1]=4 1924 B9R1.33 CNCc1nccn1C Amb440114 [0,2,0,0,0,0|1,0,1]=4 1925 B9R1.33 COCc1nccn1C Amb33328565 [0,2,0,0,0,0|0,1,1]=4 1926 B9R1.33 COCn1ccnc1Br Amb23401116 [0,2,0,0,0,0|1,0,1]=4 1927 B9R1.33 COCn1ccnc1C Amb23401111 [0,2,0,0,0,0|1,0,1]=4 1928 B9R1.33 COCn1ccnc1Cl Amb32670226 [0,2,0,0,0,0|1,0,1]=4 1929 B9R1.33 COCn1ccnc1F Amb25887267 [0,2,0,0,0,0|1,0,1]=4 1930 B9R1.33 COCn1ccnc1N Amb33165780 [0,2,0,0,0,0|1,0,1]=4 1931 B9R1.33 CSCc1nccn1C Amb26052795 [0,2,0,0,0,0|0,0,2]=4 1932 B9R1.33 Cc1cccn1CCBr Amb27863512 [0,2,0,0,0,0|2,0,0]=4 1933 B9R1.33 Cc1ccsc1N=C=S Amb27771108 [0,2,0,0,0,0|2,0,0]=4 1934 B9R1.33 Cc1nccn1CC#N Amb6260979 [0,2,0,0,0,0|1,0,1]=4 1935 B9R1.33 Cc1nccn1CCBr Amb10609382 [0,2,0,0,0,0|1,0,1]=4 1936 B9R1.33 Cc1nccn1CCBr Amb6255204 [0,2,0,0,0,0|1,0,1]=4 1937 B9R1.33 Cc1nccn1CCCl Amb22587120 [0,2,0,0,0,0|1,0,1]=4 1938 B9R1.33 Cc1nccn1CCCl Amb8828369 [0,2,0,0,0,0|1,0,1]=4 1939 B9R1.33 Cc1nccn1CCN Amb17659444 [0,2,0,0,0,0|1,0,1]=4 1940 B9R1.33 Cc1nccn1CCN Amb21955194 [0,2,0,0,0,0|1,0,1]=4 1941 B9R1.33 Cc1nccn1CCN Amb29083248 [0,2,0,0,0,0|1,0,1]=4 1942 B9R1.33 Cc1nccn1CCN Amb33543300 [0,2,0,0,0,0|1,0,1]=4 1943 B9R1.33 Cc1nccn1CCN Amb34930379 [0,2,0,0,0,0|1,0,1]=4 1944 B9R1.33 Cc1nccn1CCO Amb6307699 [0,2,0,0,0,0|1,0,1]=4 1945 B9R1.33 Cc1nccn1CCS Amb20668959 [0,2,0,0,0,0|1,0,1]=4 1946 B9R1.33 ClCCn1ccnc1Cl Amb26594407 [0,2,0,0,0,0|1,0,1]=4 1947 B9R1.33 Cn1cccc1CC#N Amb6306524 [0,2,0,0,0,0|2,0,0]=4 1948 B9R1.33 Cn1cccc1CC=O Amb27244764 [0,2,0,0,0,0|1,1,0]=4 1949 B9R1.33 Cn1cccc1CCBr Amb33113563 [0,2,0,0,0,0|2,0,0]=4 1950 B9R1.33 Cn1cccc1CCCl Amb24419304 [0,2,0,0,0,0|2,0,0]=4 1951 B9R1.33 Cn1cccc1CCN Amb7796008 [0,2,0,0,0,0|2,0,0]=4 1952 B9R1.33 Cn1cccc1CCO Amb19957346 [0,2,0,0,0,0|1,1,0]=4 1953 B9R1.33 Cn1cccc1CCS Amb25282882 [0,2,0,0,0,0|1,0,1]=4 1954 B9R1.33 Cn1cccc1CNN Amb19664698 [0,2,0,0,0,0|2,0,0]=4 1955 B9R1.33 Cn1cccc1CNO Amb26515826 [0,2,0,0,0,0|1,1,0]=4 1956 B9R1.33 Cn1cccc1CON Amb25837380 [0,2,0,0,0,0|1,1,0]=4 1957 B9R1.33 Cn1cccc1N=C=O Amb26966988 [0,2,0,0,0,0|1,1,0]=4 1958 B9R1.33 Cn1cccc1N=C=S Amb25889409 [0,2,0,0,0,0|1,0,0]=3 1959 B9R1.33 Cn1cccc1OC=O Amb27636461 [0,2,0,0,0,0|1,1,0]=4 1960 B9R1.33 Cn1cccc1\C=C\Br Amb33134919 [0,2,0,0,0,0|2,0,0]=4 1961 B9R1.33 Cn1cccc1\C=N\N Amb28365831 [0,2,0,0,0,0|2,0,0]=4 1962 B9R1.33 Cn1cccc1\C=N\O Amb3520695 [0,2,0,0,0,0|1,1,0]=4 1963 B9R1.33 Cn1ccnc1CC#N Amb10608453 [0,2,0,0,0,0|1,0,1]=4 1964 B9R1.33 Cn1ccnc1CC#N Amb10609197 [0,2,0,0,0,0|1,0,1]=4 1965 B9R1.33 Cn1ccnc1CCBr Amb24477839 [0,2,0,0,0,0|1,0,1]=4 1966 B9R1.33 Cn1ccnc1CCBr Amb32652558 [0,2,0,0,0,0|1,0,1]=4 1967 B9R1.33 Cn1ccnc1CCCl Amb19516879 [0,2,0,0,0,0|1,0,1]=4 1968 B9R1.33 Cn1ccnc1CCCl Amb22587406 [0,2,0,0,0,0|1,0,1]=4 1969 B9R1.33 Cn1ccnc1CCN Amb21959921 [0,2,0,0,0,0|1,0,1]=4 1970 B9R1.33 Cn1ccnc1CCN Amb5638916 [0,2,0,0,0,0|1,0,1]=4 1971 B9R1.33 Cn1ccnc1CCO Amb17593312 [0,2,0,0,0,0|0,1,1]=4 1972 B9R1.33 Cn1ccnc1CCS Amb27804407 [0,2,0,0,0,0|0,0,2]=4 1973 B9R1.33 Cn1ccnc1CNN Amb22886985 [0,2,0,0,0,0|1,0,1]=4 1974 B9R1.33 Cn1ccnc1CNN Amb27435645 [0,2,0,0,0,0|1,0,1]=4 1975 B9R1.33 Cn1ccnc1CNO Amb24339748 [0,2,0,0,0,0|0,1,1]=4 1976 B9R1.33 Cn1ccnc1CON Amb25887266 [0,2,0,0,0,0|0,1,1]=4 1977 B9R1.33 Cn1ccnc1NC#N Amb27862016 [0,2,0,0,0,0|1,0,1]=4 1978 B9R1.33 Cn1ccnc1SC#N Amb27215619 [0,2,0,0,0,0|0,0,2]=4 1979 B9R1.33 Cn1ccnc1SCCl Amb27632299 [0,2,0,0,0,0|0,0,2]=4 1980 B9R1.33 Cn1ccnc1\C=C\Br Amb33135001 [0,2,0,0,0,0|1,0,1]=4 1981 B9R1.33 Cn1ccnc1\C=N\O Amb22641063 [0,2,0,0,0,0|0,1,1]=4 1982 B9R1.33 FCCn1ccnc1I Amb28135174 [0,2,0,0,0,0|1,0,1]=4 1983 B9R1.33 FCCn1ccnc1S Amb28047573 [0,2,0,0,0,0|0,0,2]=4 1984 B9R1.33 N#CCN1C=CSC1=N Amb25074411 [0,2,0,0,0,0|2,0,0]=4 1985 B9R1.33 N#CCN1C=CSC1=O Amb28133861 [0,2,0,0,0,0|1,1,0]=4 1986 B9R1.33 N#CCn1ccnc1N Amb33165735 [0,2,0,0,0,0|1,0,1]=4 1987 B9R1.33 N=C1NN=CN1CCN Amb25228537 [0,2,0,0,0,0|2,0,0]=4 1988 B9R1.33 NCCN1C=CNC1=O Amb22732577 [0,2,0,0,0,0|0,1,0]=3 1989 B9R1.33 NCCN1C=CNC1=O Amb32693456 [0,2,0,0,0,0|0,1,0]=3 1990 B9R1.33 NCCN1C=CSC1=O Amb18908384 [0,2,0,0,0,0|1,1,0]=4 1991 B9R1.33 NCCN1C=CSC1=O Amb32665352 [0,2,0,0,0,0|1,1,0]=4 1992 B9R1.33 NCCN1C=NNC1=O Amb25889403 [0,2,0,0,0,0|1,1,0]=4 1993 B9R1.33 NCCN1C=NNC1=O Amb33457498 [0,2,0,0,0,0|1,1,0]=4 1994 B9R1.33 NCCN1CCNC1=S Amb3376127 [0,2,0,0,0,0|0,0,2]=4 1995 B9R1.33 NCCn1ccnc1Cl Amb27633983 [0,2,0,0,0,0|1,0,1]=4 1996 B9R1.33 Nc1nccn1CCF Amb33165781 [0,2,0,0,0,0|1,0,1]=4 1997 B9R1.33 Nc1nccn1CCO Amb27186285 [0,2,0,0,0,0|1,0,1]=4 1998 B9R1.33 O=C1CC=CN1CCO Amb27186780 [0,2,0,0,0,0|1,1,0]=4 1999 B9R1.33 O=C1NC=CN1CCCl Amb19516683 [0,2,0,0,0,0|0,1,0]=3 2000 B9R1.33 O=C1SC=CN1CCBr Amb27194831 [0,2,0,0,0,0|1,1,0]=4 2001 B9R1.33 O=CCn1ccnc1O Amb27438556 [0,2,0,0,0,0|0,1,1]=4 2002 B9R1.33 OCCN1C=NNC1=S Amb27822899 [0,2,0,0,0,0|1,0,0]=3 2003 B9R1.33 OCCn1ccnc1Cl Amb22741180 [0,2,0,0,0,0|1,0,1]=4 2004 B9R1.33 [C-]#[N+]Cc1nccn1C Amb27209687 [0,2,0,0,0,0|1,0,1]=4 2005 B9R1.33 [C-]#[N+]Cn1ccnc1C Amb27959127 [0,2,0,0,0,0|1,0,1]=4 2006 B9R1.41 CC(=O)N1CCNC1=S Amb1144472 [0,2,0,0,0,0|0,0,2]=4 2007 B9R1.41 CC(=O)c1cccn1C Amb3940343 [0,2,0,0,0,0|1,1,0]=4 2008 B9R1.41 CC(=O)c1nccn1C Amb16230260 [0,2,0,0,0,0|0,1,1]=4 2009 B9R1.41 CC(=O)n1cccc1Br Amb27488240 [0,2,0,0,0,0|2,0,0]=4 2010 B9R1.41 CC(=O)n1cccc1C Amb28285118 [0,2,0,0,0,0|2,0,0]=4 2011 B9R1.41 CC(=O)n1ccoc1=O Amb22229159 [0,2,0,0,0,0|1,1,0]=4 2012 B9R1.41 CC(Br)c1nccn1C Amb22270470 [0,2,0,0,0,0|1,0,1]=4 2013 B9R1.41 CC(C)N1C=CNC1=S Amb18039833 [0,2,0,0,0,0|0,0,0]=2 2014 B9R1.41 CC(C)N1C=CSC1=S Amb24117103 [0,2,0,0,0,0|1,0,0]=3 2015 B9R1.41 CC(C)N1CCNC1=S Amb27656685 [0,2,0,0,0,0|0,0,2]=4 2016 B9R1.41 CC(C)N1N=NNC1=S Amb19395856 [0,2,0,0,0,0|2,0,0]=4 2017 B9R1.41 CC(C)c1nccn1C Amb33545330 [0,2,0,0,0,0|1,0,1]=4 2018 B9R1.41 CC(C)n1ccnc1Br Amb17401246 [0,2,0,0,0,0|1,0,1]=4 2019 B9R1.41 CC(C)n1ccnc1Br Amb22587269 [0,2,0,0,0,0|1,0,1]=4 2020 B9R1.41 CC(C)n1ccnc1Cl Amb10067352 [0,2,0,0,0,0|1,0,1]=4 2021 B9R1.41 CC(C)n1ccnc1N Amb25862278 [0,2,0,0,0,0|1,0,1]=4 2022 B9R1.41 CC(C)n1ccnc1S Amb2371692 [0,2,0,0,0,0|0,0,2]=4 2023 B9R1.41 CC(Cl)c1nccn1C Amb22267315 [0,2,0,0,0,0|1,0,1]=4 2024 B9R1.41 CC(I)c1nccn1C Amb22267324 [0,2,0,0,0,0|1,0,1]=4 2025 B9R1.41 CC(N)c1cccn1C Amb5722734 [0,2,0,0,0,0|2,0,0]=4 2026 B9R1.41 CC(N)c1nccn1C Amb28934931 [0,2,0,0,0,0|1,0,1]=4 2027 B9R1.41 CC(N)c1nccn1C Amb5722661 [0,2,0,0,0,0|1,0,1]=4 2028 B9R1.41 CC(O)c1cccn1C Amb25348523 [0,2,0,0,0,0|1,1,0]=4 2029 B9R1.41 CC(O)c1nccn1C Amb22267722 [0,2,0,0,0,0|0,1,1]=4 2030 B9R1.41 CC(S)c1nccn1C Amb22267832 [0,2,0,0,0,0|0,0,2]=4 2031 B9R1.41 CN(C)c1cccn1C Amb26478469 [0,2,0,0,0,0|2,0,0]=4 2032 B9R1.41 CN(C)c1nccn1C Amb23437094 [0,2,0,0,0,0|1,0,1]=4 2033 B9R1.41 CN(C)n1ccnc1S Amb28382348 [0,2,0,0,0,0|0,0,2]=4 2034 B9R1.41 C[C@@H](N)c1cccn1C Amb22831455 [0,2,0,0,0,0|2,0,0]=4 2035 B9R1.41 C[C@@H](N)c1nccn1C Amb24117440 [0,2,0,0,0,0|1,0,1]=4 2036 B9R1.41 C[C@@H](O)c1cccn1C Amb27179780 [0,2,0,0,0,0|1,1,0]=4 2037 B9R1.41 C[C@@H](O)c1nccn1C Amb25923996 [0,2,0,0,0,0|0,1,1]=4 2038 B9R1.41 C[C@H](N)c1cccn1C Amb26327046 [0,2,0,0,0,0|2,0,0]=4 2039 B9R1.41 C[C@H](N)c1nccn1C Amb24436520 [0,2,0,0,0,0|1,0,1]=4 2040 B9R1.41 C[C@H](O)c1cccn1C Amb27805042 [0,2,0,0,0,0|1,1,0]=4 2041 B9R1.41 C[C@H](O)c1nccn1C Amb26340398 [0,2,0,0,0,0|0,1,1]=4 2042 B9R1.41 Cc1ccoc1C(N)=S Amb25775196 [0,2,0,0,0,0|2,0,0]=4 2043 B9R1.41 Cc1ccsc1C(N)=S Amb1116860 [0,2,0,0,0,0|2,0,0]=4 2044 B9R1.41 Cc1nccn1C(C)C Amb25267403 [0,2,0,0,0,0|1,0,1]=4 2045 B9R1.41 Cn1cccc1B(O)O Amb16185674 [0,2,0,0,0,0|1,1,0]=4 2046 B9R1.41 Cn1cccc1C(=N)N Amb31097722 [0,2,0,0,0,0|2,0,0]=4 2047 B9R1.41 Cn1cccc1C(=O)O Amb1151288 [0,2,0,0,0,0|1,1,0]=4 2048 B9R1.41 Cn1cccc1C(N)=O Amb2604322 [0,2,0,0,0,0|1,1,0]=4 2049 B9R1.41 Cn1cccc1C(N)=S Amb25032223 [0,2,0,0,0,0|1,0,0]=3 2050 B9R1.41 Cn1cccc1C(N)O Amb25349340 [0,2,0,0,0,0|1,1,0]=4 2051 B9R1.41 Cn1cccc1S(=O)[O-] Amb32754674 [0,2,0,0,0,0|1,0,1]=4 2052 B9R1.41 Cn1cccc1[N+](=O)[O-] Amb27870456 [0,2,0,0,0,0|1,1,0]=4 2053 B9R1.41 Cn1ccnc1C(=N)N Amb21960774 [0,2,0,0,0,0|1,0,1]=4 2054 B9R1.41 Cn1ccnc1C(=N)N Amb24477878 [0,2,0,0,0,0|1,0,1]=4 2055 B9R1.41 Cn1ccnc1C(=O)Cl Amb10844843 [0,2,0,0,0,0|0,1,1]=4 2056 B9R1.41 Cn1ccnc1C(=O)Cl Amb33496155 [0,2,0,0,0,0|0,1,1]=4 2057 B9R1.41 Cn1ccnc1C(=O)O Amb1107172 [0,2,0,0,0,0|0,1,1]=4 2058 B9R1.41 Cn1ccnc1C(=O)[O-] Amb13951582 [0,2,0,0,0,0|0,1,1]=4 2059 B9R1.41 Cn1ccnc1C(=O)[O-] Amb33512890 [0,2,0,0,0,0|0,1,1]=4 2060 B9R1.41 Cn1ccnc1C(=O)[O-] Amb33542621 [0,2,0,0,0,0|0,1,1]=4 2061 B9R1.41 Cn1ccnc1C(N)=O Amb2415054 [0,2,0,0,0,0|0,1,1]=4 2062 B9R1.41 Cn1ccnc1C(N)=S Amb22059424 [0,2,0,0,0,0|0,0,1]=3 2063 B9R1.41 Cn1ccnc1S(=O)[O-] Amb32754077 [0,2,0,0,0,0|0,0,2]=4 2064 B9R1.41 Cn1ccnc1S(C)=O Amb26031872 [0,2,0,0,0,0|0,0,2]=4 2065 B9R1.41 Cn1ccnc1[N+](=O)[O-] Amb10573953 [0,2,0,0,0,0|0,1,1]=4 2066 B9R1.41 Cn1cncc1C(N)=S Amb25978233 [0,2,0,0,0,0|2,0,0]=4 2067 B9R1.41 Cn1nccc1C(N)=S Amb24462613 [0,2,0,0,0,0|2,0,0]=4 2068 B9R1.41 Cn1ncnc1C(N)=S Amb35789515 [0,2,0,0,0,0|1,0,1]=4 2069 B9R1.41 NC(=O)N1C=CNC1=O Amb27882714 [0,2,0,0,0,0|0,1,1]=4 2070 B9R1.41 NC(=O)N1C=CNC1=S Amb27224334 [0,2,0,0,0,0|0,0,1]=3 2071 B9R1.41 Nc1nccn1C(F)F Amb33165782 [0,2,0,0,0,0|1,0,1]=4 2072 B9R1.41 O=C1SC=CN1C(F)F Amb27859621 [0,2,0,0,0,0|1,1,0]=4 2073 B9R1.132 C#Cc1cnc(C)n1C Amb24526463 [0,2,0,0,0,0|1,0,1]=4 2074 B9R1.132 C#Cc1cnc(Cl)n1C Amb35580964 [0,2,0,0,0,0|1,0,1]=4 2075 B9R1.132 C#Cc1ncc(Cl)n1C Amb27956589 [0,2,0,0,0,0|1,0,1]=4 2076 B9R1.132 C=Cc1cnc(C)n1C Amb35652784 [0,2,0,0,0,0|1,0,1]=4 2077 B9R1.132 C=Cc1ncc(Cl)n1C Amb27813699 [0,2,0,0,0,0|1,0,1]=4 2078 B9R1.132 CCC1=CNC(=O)C1C Amb28285251 [0,2,0,0,0,0|1,1,0]=4 2079 B9R1.132 CCC1=CNC(=O)N1C Amb27946349 [0,2,0,0,0,0|0,1,0]=3 2080 B9R1.132 CCC1=NNC(=S)N1N Amb21846722 [0,2,0,0,0,0|2,0,0]=4 2081 B9R1.132 CCN1N=CN(N)C1=O Amb24381344 [0,2,0,0,0,0|1,1,0]=4 2082 B9R1.132 CCc1ccc(F)n1C Amb24373276 [0,2,0,0,0,0|2,0,0]=4 2083 B9R1.132 CCc1cnc(N)n1C Amb27760133 [0,2,0,0,0,0|1,0,1]=4 2084 B9R1.132 CCn1cc[n+](C)c1C Amb22353654 [0,2,0,0,0,0|1,0,1]=4 2085 B9R1.132 CCn1ccc(O)c1C Amb26866203 [0,2,0,0,0,0|2,0,0]=4 2086 B9R1.132 CN1C(=O)NN=C1CCl Amb22728869 [0,2,0,0,0,0|1,1,0]=4 2087 B9R1.132 CN1C(=O)NN=C1CN Amb24429197 [0,2,0,0,0,0|1,1,0]=4 2088 B9R1.132 CN1C(=O)NN=C1CN Amb28555380 [0,2,0,0,0,0|1,1,0]=4 2089 B9R1.132 CN1C(=O)NN=C1CO Amb25737080 [0,2,0,0,0,0|1,1,0]=4 2090 B9R1.132 CN1C(=S)NC=C1CO Amb20637276 [0,2,0,0,0,0|0,0,0]=2 2091 B9R1.132 CN1C(=S)NN=C1CBr Amb27876859 [0,2,0,0,0,0|1,0,0]=3 2092 B9R1.132 CN1C(CO)=CNC1S Amb25917874 [0,2,0,0,0,0|0,0,2]=4 2093 B9R1.132 CN1C=CN(CO)C1=S Amb27850841 [0,2,0,0,0,0|0,0,0]=2 2094 B9R1.132 CN1C=NN(CO)C1=S Amb28065716 [0,2,0,0,0,0|1,0,0]=3 2095 B9R1.132 CN1CCN(CO)C1=S Amb26477830 [0,2,0,0,0,0|0,0,2]=4 2096 B9R1.132 CN1N=NN(CO)C1=S Amb28315559 [0,2,0,0,0,0|2,0,0]=4 2097 B9R1.132 COC1=NNC(=O)N1C Amb19958971 [0,2,0,0,0,0|1,1,0]=4 2098 B9R1.132 COn1ccc(N)c1O Amb27180067 [0,2,0,0,0,0|1,1,0]=4 2099 B9R1.132 COn1ccc(O)c1N Amb28040897 [0,2,0,0,0,0|2,0,0]=4 2100 B9R1.132 CSc1ccc(N)n1C Amb18202553 [0,2,0,0,0,0|1,0,1]=4 2101 B9R1.132 C\N=c1/ssc(=S)n1C Amb1987626 [0,2,0,0,0,0|2,0,0]=4 2102 B9R1.132 Cc1c(C=O)ccn1C Amb23100946 [0,2,0,0,0,0|2,0,0]=4 2103 B9R1.132 Cc1c(CN)ccn1C Amb18832869 [0,2,0,0,0,0|2,0,0]=4 2104 B9R1.132 Cc1ccc(C#N)n1C Amb2720708 [0,2,0,0,0,0|2,0,0]=4 2105 B9R1.132 Cc1ccc(C=O)n1C Amb857675 [0,2,0,0,0,0|1,1,0]=4 2106 B9R1.132 Cc1ccc(CN)n1C Amb10531650 [0,2,0,0,0,0|2,0,0]=4 2107 B9R1.132 Cc1ccc(CN)n1C Amb1090454 [0,2,0,0,0,0|2,0,0]=4 2108 B9R1.132 Cc1ccc(C[NH3+])n1C Amb34916611 [0,2,0,0,0,0|2,0,0]=4 2109 B9R1.132 Cc1ccn(C=O)c1C Amb24648826 [0,2,0,0,0,0|2,0,0]=4 2110 B9R1.132 Cc1cnc(C=O)n1C Amb8010960 [0,2,0,0,0,0|0,1,1]=4 2111 B9R1.132 Cc1cnc(CCl)n1C Amb27490491 [0,2,0,0,0,0|1,0,1]=4 2112 B9R1.132 Cc1cnc(CO)n1C Amb24192760 [0,2,0,0,0,0|0,1,1]=4 2113 B9R1.132 Cc1cnc(CS)n1C Amb32788504 [0,2,0,0,0,0|0,0,2]=4 2114 B9R1.132 Cc1cnc(NN)n1C Amb24270958 [0,2,0,0,0,0|1,0,1]=4 2115 B9R1.132 Cc1cnc(NN)n1C Amb30594748 [0,2,0,0,0,0|1,0,1]=4 2116 B9R1.132 Cc1ncc(C#N)n1C Amb18642002 [0,2,0,0,0,0|1,0,1]=4 2117 B9R1.132 Cc1ncc(C=O)n1C Amb2723384 [0,2,0,0,0,0|1,0,1]=4 2118 B9R1.132 Cc1ncc(CCl)n1C Amb27195299 [0,2,0,0,0,0|1,0,1]=4 2119 B9R1.132 Cc1ncc(CN)n1C Amb16187183 [0,2,0,0,0,0|1,0,1]=4 2120 B9R1.132 Cc1ncc(CO)n1C Amb22009457 [0,2,0,0,0,0|1,0,1]=4 2121 B9R1.132 Cc1ncc(CS)n1C Amb32788544 [0,2,0,0,0,0|1,0,1]=4 2122 B9R1.132 Cn1c(Br)cnc1C=O Amb6751940 [0,2,0,0,0,0|0,1,1]=4 2123 B9R1.132 Cn1c(Br)cnc1CO Amb6751935 [0,2,0,0,0,0|0,1,1]=4 2124 B9R1.132 Cn1c(C#N)cnc1Cl Amb32668330 [0,2,0,0,0,0|1,0,1]=4 2125 B9R1.132 Cn1c(C#N)cnc1N Amb28046864 [0,2,0,0,0,0|1,0,1]=4 2126 B9R1.132 Cn1c(C=O)cnc1Br Amb18129389 [0,2,0,0,0,0|1,0,1]=4 2127 B9R1.132 Cn1c(C=O)cnc1Cl Amb25835855 [0,2,0,0,0,0|1,0,1]=4 2128 B9R1.132 Cn1c(C=O)cnc1O Amb18832772 [0,2,0,0,0,0|0,1,1]=4 2129 B9R1.132 Cn1c(CBr)cnc1Br Amb28196537 [0,2,0,0,0,0|1,0,1]=4 2130 B9R1.132 Cn1c(CCl)cnc1Br Amb27864488 [0,2,0,0,0,0|1,0,1]=4 2131 B9R1.132 Cn1c(CCl)cnc1Cl Amb27207084 [0,2,0,0,0,0|1,0,1]=4 2132 B9R1.132 Cn1c(CN)cnc1Br Amb27168186 [0,2,0,0,0,0|1,0,1]=4 2133 B9R1.132 Cn1c(CN)cnc1Cl Amb28046838 [0,2,0,0,0,0|1,0,1]=4 2134 B9R1.132 Cn1c(CN)csc1=S Amb13881638 [0,2,0,0,0,0|1,0,0]=3 2135 B9R1.132 Cn1c(CO)cnc1Br Amb22495979 [0,2,0,0,0,0|1,0,1]=4 2136 B9R1.132 Cn1c(CO)cnc1Cl Amb25809022 [0,2,0,0,0,0|1,0,1]=4 2137 B9R1.132 Cn1c(CO)cnc1N Amb2699144 [0,2,0,0,0,0|1,0,1]=4 2138 B9R1.132 Cn1c(CO)cnc1S Amb2424532 [0,2,0,0,0,0|0,0,2]=4 2139 B9R1.132 Cn1c(Cl)ccc1CO Amb26549135 [0,2,0,0,0,0|1,1,0]=4 2140 B9R1.132 Cn1c(Cl)cnc1C=O Amb18644174 [0,2,0,0,0,0|0,1,1]=4 2141 B9R1.132 Cn1c(Cl)cnc1CCl Amb2326745 [0,2,0,0,0,0|1,0,1]=4 2142 B9R1.132 Cn1c(Cl)cnc1CCl Amb2371150 [0,2,0,0,0,0|1,0,1]=4 2143 B9R1.132 Cn1c(Cl)cnc1CN Amb33532406 [0,2,0,0,0,0|1,0,1]=4 2144 B9R1.132 Cn1c(Cl)cnc1CN Amb9204142 [0,2,0,0,0,0|1,0,1]=4 2145 B9R1.132 Cn1c(Cl)cnc1CO Amb13951698 [0,2,0,0,0,0|0,1,1]=4 2146 B9R1.132 Cn1c(Cl)cnc1CO Amb9287817 [0,2,0,0,0,0|0,1,1]=4 2147 B9R1.132 Cn1c(Cl)cnc1CS Amb32788850 [0,2,0,0,0,0|0,0,2]=4 2148 B9R1.132 Cn1c(F)ccc1C#N Amb26353896 [0,2,0,0,0,0|2,0,0]=4 2149 B9R1.132 Cn1c(F)ccc1C=O Amb26448169 [0,2,0,0,0,0|1,1,0]=4 2150 B9R1.132 Cn1c(N)cnc1C=O Amb18832828 [0,2,0,0,0,0|0,1,1]=4 2151 B9R1.132 Cn1c(NN)cnc1Cl Amb35676147 [0,2,0,0,0,0|1,0,1]=4 2152 B9R1.132 Cn1ccc(C=O)c1Cl Amb18831521 [0,2,0,0,0,0|2,0,0]=4 2153 B9R1.132 NNC1=NNC(=S)N1N Amb22540444 [0,2,0,0,0,0|2,0,0]=4 2154 B9R1.23 CCc1cn(C)c(N)n1 Amb25722131 [0,2,0,0,0,0|1,0,1]=4 2155 B9R1.23 CN1C=C(C=O)SC1=O Amb19649786 [0,2,0,0,0,0|1,1,0]=4 2156 B9R1.23 CN1C=C(CO)SC1=O Amb24312656 [0,2,0,0,0,0|1,1,0]=4 2157 B9R1.23 CN1N=C(CCl)NC1=O Amb25116098 [0,2,0,0,0,0|1,1,0]=4 2158 B9R1.23 CN1N=C(CN)NC1=O Amb26066840 [0,2,0,0,0,0|1,1,0]=4 2159 B9R1.23 Cc1cc(C=O)cn1C Amb18832958 [0,2,0,0,0,0|2,0,0]=4 2160 B9R1.23 Cc1nc(C=O)cn1C Amb18832918 [0,2,0,0,0,0|1,0,1]=4 2161 B9R1.23 Cc1nc(CCl)cn1C Amb27838587 [0,2,0,0,0,0|1,0,1]=4 2162 B9R1.23 Cc1nc(CN)cn1C Amb8009959 [0,2,0,0,0,0|1,0,1]=4 2163 B9R1.23 Cc1nc(CO)cn1C Amb27841607 [0,2,0,0,0,0|1,0,1]=4 2164 B9R1.23 Cn1cc(C#N)cc1N Amb21926664 [0,2,0,0,0,0|2,0,0]=4 2165 B9R1.23 Cn1cc(C#N)nc1Br Amb29872484 [0,2,0,0,0,0|1,0,1]=4 2166 B9R1.23 Cn1cc(C#N)nc1N Amb25113393 [0,2,0,0,0,0|1,0,1]=4 2167 B9R1.23 Cn1cc(C=O)nc1Br Amb35605381 [0,2,0,0,0,0|1,0,1]=4 2168 B9R1.23 Cn1cc(C=O)nc1N Amb24751976 [0,2,0,0,0,0|1,0,1]=4 2169 B9R1.23 Cn1cc(CBr)nc1Br Amb35736325 [0,2,0,0,0,0|1,0,1]=4 2170 B9R1.23 Cn1cc(CCl)nc1Br Amb35736323 [0,2,0,0,0,0|1,0,1]=4 2171 B9R1.23 Cn1cc(CN)nc1Br Amb35596702 [0,2,0,0,0,0|1,0,1]=4 2172 B9R1.23 Cn1cc(CO)nc1Br Amb35596865 [0,2,0,0,0,0|1,0,1]=4 2173 B9R1.23 Cn1cc(CO)nc1S Amb21927944 [0,2,0,0,0,0|0,0,2]=4 2174 B9R1.36 CN1CC(C)(C)NC1=S Amb27974500 [0,2,0,0,0,0|0,0,2]=4 2175 B9R1.37 C=C1NC(=O)C(O)=C1C Amb27614159 [0,2,0,0,0,0|2,0,0]=4 2176 B9R1.37 C=C1NC(=O)N(C)C1=O Amb26951053 [0,2,0,0,0,0|0,1,0]=3 2177 B9R1.37 CC1=C(Br)C(=O)NC1=O Amb17594928 [0,2,0,0,0,0|1,1,0]=4 2178 B9R1.37 CC1=C(C)C(=O)NC1=O Amb17672553 [0,2,0,0,0,0|1,1,0]=4 2179 B9R1.37 CC1=C(C)N(C)C(=O)N1 Amb19517085 [0,2,0,0,0,0|0,1,0]=3 2180 B9R1.37 CC1=C(C)N(C)C(=O)N1 Amb22587506 [0,2,0,0,0,0|0,1,0]=3 2181 B9R1.37 CC1=CC(=O)N(C)C1=O Amb33552424 [0,2,0,0,0,0|1,1,0]=4 2182 B9R1.37 CC1=CC(=O)N(N)C1=O Amb27250713 [0,2,0,0,0,0|1,1,0]=4 2183 B9R1.37 CC1=CC(=O)N(N)C1=O Amb33611604 [0,2,0,0,0,0|1,1,0]=4 2184 B9R1.37 CC1=CN(C)C(=O)C1C Amb27609692 [0,2,0,0,0,0|1,1,0]=4 2185 B9R1.37 CC1=CN(N)C(=O)N1C Amb26946321 [0,2,0,0,0,0|0,1,0]=3 2186 B9R1.37 CC1=NN(C)C(=O)N1C Amb29860115 [0,2,0,0,0,0|1,1,0]=4 2187 B9R1.37 CC1NC(=O)N(C)C1=O Amb19517104 [0,2,0,0,0,0|0,1,1]=4 2188 B9R1.37 CC1NC(=S)N(C)C1=O Amb22732725 [0,2,0,0,0,0|0,0,1]=3 2189 B9R1.37 CN1C(=O)C(=O)N=C1N Amb28895938 [0,2,0,0,0,0|1,0,1]=4 2190 B9R1.37 CN1C(=O)C=C(Br)C1=O Amb19148927 [0,2,0,0,0,0|1,1,0]=4 2191 B9R1.37 CN1C(=O)C=C(Cl)C1=O Amb27624713 [0,2,0,0,0,0|1,1,0]=4 2192 B9R1.37 CN1C(=O)C=C(N)C1=O Amb7090674 [0,2,0,0,0,0|1,1,0]=4 2193 B9R1.37 CN1C(=O)CN(N)C1=O Amb27436200 [0,2,0,0,0,0|0,1,1]=4 2194 B9R1.37 CN1C(=O)CN(N)C1=O Amb32708527 [0,2,0,0,0,0|0,1,1]=4 2195 B9R1.37 CN1C(=O)NC(=O)C1=O Amb397808 [0,2,0,0,0,0|0,1,0]=3 2196 B9R1.37 CN1C(=O)NC(=O)C1Br Amb28138023 [0,2,0,0,0,0|0,1,1]=4 2197 B9R1.37 CN1C(=O)NC(=O)C1O Amb8395584 [0,2,0,0,0,0|0,1,1]=4 2198 B9R1.37 CN1C(=O)NC(=O)[C@@H]1O Amb26409658 [0,2,0,0,0,0|0,1,1]=4 2199 B9R1.37 CN1C(=S)N=C(N)N1C Amb27489669 [0,2,0,0,0,0|1,0,1]=4 2200 B9R1.37 CN1C(=S)NC(=S)N1C Amb27643566 [0,2,0,0,0,0|1,0,0]=3 2201 B9R1.37 CN1C(=S)NC(O)C1O Amb3427940 [0,2,0,0,0,0|0,0,2]=4 2202 B9R1.37 CN1C(=S)SC(=S)N1C Amb22359114 [0,2,0,0,0,0|2,0,0]=4 2203 B9R1.37 CN1C=C(N)N(C)C1=S Amb24055303 [0,2,0,0,0,0|0,0,0]=2 2204 B9R1.37 CN1CC(=O)N(C)C1=N Amb25681741 [0,2,0,0,0,0|1,0,1]=4 2205 B9R1.37 CN1CC(=O)N(C)C1=N Amb28555364 [0,2,0,0,0,0|1,0,1]=4 2206 B9R1.37 CN1CC(=O)N(C)C1=O Amb27838767 [0,2,0,0,0,0|0,1,1]=4 2207 B9R1.37 CN1CC(=O)N(C)C1=S Amb3616441 [0,2,0,0,0,0|0,0,1]=3 2208 B9R1.37 CN1CC(=S)N(C)C1=S Amb24478615 [0,2,0,0,0,0|0,0,1]=3 2209 B9R1.37 CN1N=C(Br)N(C)C1=O Amb32666879 [0,2,0,0,0,0|1,1,0]=4 2210 B9R1.37 CN1N=C(Cl)N(C)C1=O Amb27218755 [0,2,0,0,0,0|1,1,0]=4 2211 B9R1.37 CN1NC(=O)N(C)C1=O Amb35788733 [0,2,0,0,0,0|1,1,0]=4 2212 B9R1.37 C[C@@H]1NC(=O)N(C)C1=O Amb27768581 [0,2,0,0,0,0|0,1,1]=4 2213 B9R1.37 C[C@@H]1NC(=S)N(N)C1=O Amb28322846 [0,2,0,0,0,0|1,0,1]=4 2214 B9R1.37 C[C@H]1NC(=O)N(C)C1=O Amb26061869 [0,2,0,0,0,0|0,1,1]=4 2215 B9R1.37 Cc1c(Br)nc(Br)n1C Amb10067922 [0,2,0,0,0,0|1,0,1]=4 2216 B9R1.37 Cc1c(I)nc(I)n1C Amb31208642 [0,2,0,0,0,0|1,0,1]=4 2217 B9R1.37 Cc1cc(Br)c(C)n1C Amb18893776 [0,2,0,0,0,0|2,0,0]=4 2218 B9R1.37 Cc1cc(N)n(C)c1C Amb18832868 [0,2,0,0,0,0|2,0,0]=4 2219 B9R1.37 Cc1cc(S)c(C)n1C Amb27164094 [0,2,0,0,0,0|2,0,0]=4 2220 B9R1.37 Cc1cn(C)c(C)c1N Amb18832867 [0,2,0,0,0,0|2,0,0]=4 2221 B9R1.37 Cc1cn(C)c(O)c1C Amb27834272 [0,2,0,0,0,0|1,1,0]=4 2222 B9R1.37 Cc1nc(Br)c(Br)n1C Amb10068575 [0,2,0,0,0,0|1,0,1]=4 2223 B9R1.37 Cc1nc(Br)c(C)n1C Amb7093847 [0,2,0,0,0,0|1,0,1]=4 2224 B9R1.37 Cc1nc(Br)c(N)n1C Amb18673603 [0,2,0,0,0,0|1,0,1]=4 2225 B9R1.37 Cc1nc(C)n(C)c1C Amb22489903 [0,2,0,0,0,0|1,0,1]=4 2226 B9R1.37 Cc1nc(C)n(C)c1N Amb18277372 [0,2,0,0,0,0|1,0,1]=4 2227 B9R1.37 Cc1nc(Cl)c(Cl)n1C Amb4477160 [0,2,0,0,0,0|1,0,1]=4 2228 B9R1.37 Cc1nc(Cl)c(N)n1C Amb18831462 [0,2,0,0,0,0|1,0,1]=4 2229 B9R1.37 Cc1nc(I)c(I)n1C Amb6396373 [0,2,0,0,0,0|1,0,1]=4 2230 B9R1.37 Cc1nc(I)n(C)c1C Amb28288997 [0,2,0,0,0,0|1,0,1]=4 2231 B9R1.37 Cc1nc(N)c(Br)n1C Amb18190876 [0,2,0,0,0,0|1,0,1]=4 2232 B9R1.37 Cc1nc(N)c(Cl)n1C Amb18831463 [0,2,0,0,0,0|1,0,1]=4 2233 B9R1.37 Cc1nc(N)c(S)n1C Amb18831557 [0,2,0,0,0,0|1,0,1]=4 2234 B9R1.37 Cc1nc(N)n(C)c1C Amb25779613 [0,2,0,0,0,0|1,0,1]=4 2235 B9R1.37 Cc1nc(N)n(C)c1C Amb35753059 [0,2,0,0,0,0|1,0,1]=4 2236 B9R1.37 Cc1nc(N)n(C)c1O Amb4044372 [0,2,0,0,0,0|1,0,1]=4 2237 B9R1.37 Cc1nc(S)n(C)c1C Amb22524697 [0,2,0,0,0,0|0,0,2]=4 2238 B9R1.37 Cn1c(Br)nc(Br)c1Br Amb8393424 [0,2,0,0,0,0|1,0,1]=4 2239 B9R1.37 Cn1c(Br)nc(Br)c1Cl Amb24528267 [0,2,0,0,0,0|1,0,1]=4 2240 B9R1.37 Cn1c(Br)nc(Cl)c1Cl Amb8496696 [0,2,0,0,0,0|1,0,1]=4 2241 B9R1.37 Cn1c(O)nc(O)c1O Amb27171072 [0,2,0,0,0,0|0,1,1]=4 2242 B9R1.37 NN1C(=O)NC(=O)C1=O Amb23590661 [0,2,0,0,0,0|1,1,0]=4 2243 B9R1.38 CC1(C)CC(=O)NC1=S Amb27827420 [0,2,0,0,0,0|1,0,1]=4 2244 B9R1.38 CC1(C)NC(=O)NC1=S Amb27644002 [0,2,0,0,0,0|2,0,0]=4 2245 B7R1.3 NC1=CC=CCN1 Amb27391599 [0,0,1,1,0,0|2,0,0]=4 2246 B7R1.3 O=C1CCC=CN1 Amb26365285 [0,0,1,1,0,0|1,1,0]=4 2247 B7R1.3 S=C1C=CC=CN1 Amb20246884 [0,0,1,1,0,0|1,0,1]=4 2248 B7R1.3 S=C1C=NC=CN1 Amb18545446 [0,0,1,1,0,0|2,0,0]=4 2249 B7R1.3 S=C1N=CC=CN1 Amb18545462 [0,0,1,1,0,0|0,0,2]=4 2250 B7R1.3 S=C1NCC=NN1 Amb27596557 [0,0,1,1,0,0|1,0,0]=3 2251 B7R1.3 S=C1NCCCN1 Amb2690553 [0,0,1,1,0,0|0,0,2]=4 2252 B7R1.3 S=C1NCNCN1 Amb1289820 [0,0,1,1,0,0|1,0,1]=4 2253 B7R1.3 S=C1NCSCN1 Amb27838255 [0,0,1,1,0,0|1,0,1]=4 2254 B7R1.3 S=C1NN=CNN1 Amb21967556 [0,0,1,1,0,0|2,0,0]=4 2255 B7R1.12 C=C1CC1C(N)=O Amb28191145 [0,0,1,1,0,0|1,1,0]=4 2256 B7R1.18 CC(=O)N1C=CC1 Amb22001815 [0,0,1,1,0,0|1,1,0]=4 2257 B7R1.18 NC(=S)N1CCC1 Amb23443673 [0,0,1,1,0,0|0,0,2]=4 2258 B9R2.9 CC12C=CC1NC2=O Amb27602137 [0,0,0,1,0,1|1,1,0]=4 2259 B9R2.3 C1=NNC2=NCCN12 Amb28280963 [0,1,0,1,0,0|2,0,0]=4 2260 B9R2.3 c1cc2n(c1)CCC2 Amb17689384 [0,1,0,1,0,0|2,0,0]=4 2261 B9R2.3 c1cn2c(n1)CCC2 Amb19892428 [0,1,0,1,0,0|1,0,1]=4 2262 B9R2.3 c1cn2c(n1)NCC2 Amb7173203 [0,1,0,1,0,0|1,0,1]=4 2263 B9R2.3 c1cn2c(n1)SCC2 Amb27229245 [0,1,0,1,0,0|0,0,2]=4 2264 B5R1.2 O=C1C=CC1 Amb24477666 [1,0,0,0,1,0|1,1,0]=4 2265 B5R1.4 CC1=C(C)N1 Amb28060181 [0,0,0,0,2,0|2,0,0]=4 2266 B9R1.48 CC1=CC=CNC(=O)N1 Amb28285240 [0,0,0,0,0,2|1,1,0]=4 2267 B9R1.49 CC1=CNC(=O)NC=C1 Amb27643010 [0,0,0,0,0,2|1,1,0]=4 2268 B9R1.49 CN1CCNC(=S)CC1 Amb27860906 [0,0,0,0,0,2|0,0,2]=4 2269 B9R1.5 CC1CSC=CNC1=O Amb28183043 [0,0,0,0,0,2|1,1,0]=4 2270 B9R1.5 CN1CCCCNC1=S Amb28346274 [0,0,0,0,0,2|0,0,2]=4