0 B7R1.4 C=C1CCCC1=O Amb17593061 [0,0,0,0,0,0|3,0,1]=4 1 B7R1.4 C=C1CCNC1=O Amb26415156 [0,0,0,0,0,0|2,0,1]=3 2 B7R1.4 C=C1CCOC1=O Amb3941636 [0,0,0,0,0,0|3,0,1]=4 3 B7R1.4 C=C1CNCC1C Amb28197991 [0,0,0,0,0,0|4,0,0]=4 4 B7R1.4 C=C1COCC1=C Amb27838190 [0,0,0,0,0,0|3,0,1]=4 5 B7R1.4 C=C1COCC1N Amb31252146 [0,0,0,0,0,0|2,0,0]=2 6 B7R1.4 C=C1COCC1N Amb32795022 [0,0,0,0,0,0|2,0,0]=2 7 B7R1.4 C=C1COCC1O Amb24423437 [0,0,0,0,0,0|3,0,0]=3 8 B7R1.4 CC1=CCCC1C Amb24479857 [0,0,0,0,0,0|4,0,0]=4 9 B7R1.4 CC1=CCCC1O Amb25220686 [0,0,0,0,0,0|4,0,0]=4 10 B7R1.4 CC1=NONC1=N Amb22081472 [0,0,0,0,0,0|3,0,1]=4 11 B7R1.4 CC1C=COC1=O Amb27862334 [0,0,0,0,0,0|3,0,1]=4 12 B7R1.4 CC1C=NNC1=O Amb22232312 [0,0,0,0,0,0|2,0,1]=3 13 B7R1.4 CC1CCCC1=O Amb8514830 [0,0,0,0,0,0|3,0,0]=3 14 B7R1.4 CC1CCCC1=S Amb27483022 [0,0,0,0,0,0|3,1,0]=4 15 B7R1.4 CC1CCCC1N Amb33548666 [0,0,0,0,0,0|3,0,1]=4 16 B7R1.4 CC1CCCC1N Amb9776219 [0,0,0,0,0,0|3,0,1]=4 17 B7R1.4 CC1CCNC1=O Amb10603701 [0,0,0,0,0,0|2,0,0]=2 18 B7R1.4 CC1CCNC1C Amb18277375 [0,0,0,0,0,0|3,0,1]=4 19 B7R1.4 CC1CCNC1C Amb20623813 [0,0,0,0,0,0|3,0,1]=4 20 B7R1.4 CC1CCOC1=O Amb16185414 [0,0,0,0,0,0|3,0,0]=3 21 B7R1.4 CC1CNCC1N Amb24070522 [0,0,0,0,0,0|3,0,1]=4 22 B7R1.4 CC1CNCC1N Amb32682475 [0,0,0,0,0,0|3,0,1]=4 23 B7R1.4 CC1CNN=C1N Amb27257625 [0,0,0,0,0,0|3,0,1]=4 24 B7R1.4 CC1CNNC1=O Amb27228083 [0,0,0,0,0,0|2,0,0]=2 25 B7R1.4 CC1COCC1=O Amb24333426 [0,0,0,0,0,0|2,0,0]=2 26 B7R1.4 CC1COCC1Br Amb35736874 [0,0,0,0,0,0|3,0,1]=4 27 B7R1.4 CC1COCC1Cl Amb35631934 [0,0,0,0,0,0|3,0,1]=4 28 B7R1.4 CC1COCC1N Amb26929448 [0,0,0,0,0,0|2,0,1]=3 29 B7R1.4 CC1COCC1O Amb26864629 [0,0,0,0,0,0|2,0,2]=4 30 B7R1.4 CC1COCC1S Amb32788669 [0,0,0,0,0,0|2,1,1]=4 31 B7R1.4 CC1CON=C1N Amb27404510 [0,0,0,0,0,0|2,0,1]=3 32 B7R1.4 CC1CONC1=O Amb33714888 [0,0,0,0,0,0|1,0,0]=1 33 B7R1.4 CC1CSCC1=O Amb21964769 [0,0,0,0,0,0|2,1,0]=3 34 B7R1.4 CC1CSCC1N Amb18202602 [0,0,0,0,0,0|2,1,1]=4 35 B7R1.4 CC1NC=CC1=O Amb28201187 [0,0,0,0,0,0|4,0,0]=4 36 B7R1.4 CC1NCCC1=O Amb26950680 [0,0,0,0,0,0|4,0,0]=4 37 B7R1.4 CC1NCCC1=O Amb32410228 [0,0,0,0,0,0|4,0,0]=4 38 B7R1.4 CC1NCCC1O Amb27838277 [0,0,0,0,0,0|3,0,1]=4 39 B7R1.4 CC1NCCC1O Amb32882554 [0,0,0,0,0,0|3,0,1]=4 40 B7R1.4 CC1OC=CC1=O Amb28053998 [0,0,0,0,0,0|4,0,0]=4 41 B7R1.4 CC1OCCC1=O Amb2725497 [0,0,0,0,0,0|4,0,0]=4 42 B7R1.4 CC1OCCC1N Amb22058722 [0,0,0,0,0,0|3,0,1]=4 43 B7R1.4 CC1OCCC1N Amb32660981 [0,0,0,0,0,0|3,0,1]=4 44 B7R1.4 CC1OCNC1=O Amb28046854 [0,0,0,0,0,0|3,0,0]=3 45 B7R1.4 CC1SCCC1=O Amb8392845 [0,0,0,0,0,0|4,0,0]=4 46 B7R1.4 CC1SCCC1N Amb20623835 [0,0,0,0,0,0|3,0,1]=4 47 B7R1.4 CC1SCCC1N Amb28827634 [0,0,0,0,0,0|3,0,1]=4 48 B7R1.4 CC1SCNC1=O Amb27211661 [0,0,0,0,0,0|3,0,0]=3 49 B7R1.4 CN1C=CNC1=O Amb20622459 [0,0,0,0,0,0|3,0,1]=4 50 B7R1.4 CN1CC=CC1=O Amb22372248 [0,0,0,0,0,0|4,0,0]=4 51 B7R1.4 CN1CCCC1=O Amb22493780 [0,0,0,0,0,0|4,0,0]=4 52 B7R1.4 CN1CCCC1=O Amb6608842 [0,0,0,0,0,0|4,0,0]=4 53 B7R1.4 CN1CCCC1N Amb27631265 [0,0,0,0,0,0|4,0,0]=4 54 B7R1.4 CN1CCNC1=O Amb5718647 [0,0,0,0,0,0|3,0,0]=3 55 B7R1.4 CN1CCNC1=S Amb2720707 [0,0,0,0,0,0|3,1,0]=4 56 B7R1.4 CN1CCOC1=O Amb22347786 [0,0,0,0,0,0|4,0,0]=4 57 B7R1.4 CN1CNCC1=O Amb26582942 [0,0,0,0,0,0|4,0,0]=4 58 B7R1.4 CN1CNCC1=O Amb28827643 [0,0,0,0,0,0|4,0,0]=4 59 B7R1.4 CN1N=NNC1=O Amb22757905 [0,0,0,0,0,0|4,0,0]=4 60 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb22886234 [0,0,0,0,0,0|3,0,1]=4 61 B7R1.4 C[C@@H]1CCC[C@@H]1N Amb24540316 [0,0,0,0,0,0|3,0,1]=4 62 B7R1.4 C[C@@H]1CCC[C@H]1N Amb27858497 [0,0,0,0,0,0|3,0,1]=4 63 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [0,0,0,0,0,0|2,0,0]=2 64 B7R1.4 C[C@@H]1CCN[C@@H]1C Amb24117059 [0,0,0,0,0,0|3,0,1]=4 65 B7R1.4 C[C@@H]1CNC[C@@H]1N Amb25988639 [0,0,0,0,0,0|3,0,1]=4 66 B7R1.4 C[C@@H]1COC[C@@H]1O Amb22886816 [0,0,0,0,0,0|2,0,2]=4 67 B7R1.4 C[C@@H]1COC[C@H]1N Amb24353575 [0,0,0,0,0,0|2,0,1]=3 68 B7R1.4 C[C@@H]1COC[C@H]1N Amb30869718 [0,0,0,0,0,0|2,0,1]=3 69 B7R1.4 C[C@@H]1COC[C@H]1O Amb22886616 [0,0,0,0,0,0|2,0,2]=4 70 B7R1.4 C[C@@H]1NCCC1=O Amb18197575 [0,0,0,0,0,0|4,0,0]=4 71 B7R1.4 C[C@@H]1NCCC1N Amb18202992 [0,0,0,0,0,0|2,0,1]=3 72 B7R1.4 C[C@@H]1NCCC1O Amb18202778 [0,0,0,0,0,0|3,0,1]=4 73 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb24425021 [0,0,0,0,0,0|3,0,1]=4 74 B7R1.4 C[C@@H]1NCC[C@@H]1O Amb32412686 [0,0,0,0,0,0|3,0,1]=4 75 B7R1.4 C[C@@H]1NCC[C@H]1C Amb32412685 [0,0,0,0,0,0|3,0,1]=4 76 B7R1.4 C[C@@H]1NCC[C@H]1N Amb28250867 [0,0,0,0,0,0|2,0,1]=3 77 B7R1.4 C[C@@H]1NCC[C@H]1O Amb26412930 [0,0,0,0,0,0|3,0,1]=4 78 B7R1.4 C[C@@H]1NCC[C@H]1O Amb32412687 [0,0,0,0,0,0|3,0,1]=4 79 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [0,0,0,0,0,0|3,0,1]=4 80 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [0,0,0,0,0,0|3,0,1]=4 81 B7R1.4 C[C@@H]1OCC[C@H]1N Amb27435305 [0,0,0,0,0,0|3,0,1]=4 82 B7R1.4 C[C@@H]1OCC[C@H]1N Amb34915721 [0,0,0,0,0,0|3,0,1]=4 83 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [0,0,0,0,0,0|3,0,0]=3 84 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [0,0,0,0,0,0|2,0,0]=2 85 B7R1.4 C[C@H]1CCN[C@H]1C Amb27879886 [0,0,0,0,0,0|3,0,1]=4 86 B7R1.4 C[C@H]1CNC[C@H]1N Amb25174297 [0,0,0,0,0,0|3,0,1]=4 87 B7R1.4 C[C@H]1COC[C@@H]1N Amb33805302 [0,0,0,0,0,0|2,0,1]=3 88 B7R1.4 C[C@H]1COC[C@@H]1O Amb24609705 [0,0,0,0,0,0|2,0,2]=4 89 B7R1.4 C[C@H]1COC[C@H]1N Amb27202968 [0,0,0,0,0,0|2,0,1]=3 90 B7R1.4 C[C@H]1COC[C@H]1O Amb26400701 [0,0,0,0,0,0|2,0,2]=4 91 B7R1.4 C[C@H]1CSC[C@H]1N Amb27961505 [0,0,0,0,0,0|2,1,1]=4 92 B7R1.4 C[C@H]1NCC[C@@H]1O Amb28322208 [0,0,0,0,0,0|3,0,1]=4 93 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [0,0,0,0,0,0|3,0,1]=4 94 B7R1.4 Cc1conc1N Amb18278180 [0,0,0,0,0,0|3,0,1]=4 95 B7R1.4 Cc1nocc1N Amb22235025 [0,0,0,0,0,0|1,0,3]=4 96 B7R1.4 Cc1nocc1N Amb22494732 [0,0,0,0,0,0|1,0,3]=4 97 B7R1.4 Cc1nonc1N Amb1080847 [0,0,0,0,0,0|2,0,2]=4 98 B7R1.4 ClC1=CCCC1Cl Amb27262105 [0,0,0,0,0,0|4,0,0]=4 99 B7R1.4 N=C1OCCN1N Amb27803735 [0,0,0,0,0,0|4,0,0]=4 100 B7R1.4 NC1=CCOC1=O Amb22234102 [0,0,0,0,0,0|2,0,2]=4 101 B7R1.4 NC1=CNNC1=O Amb24120355 [0,0,0,0,0,0|1,0,2]=3 102 B7R1.4 NC1=CNNC1=O Amb28827627 [0,0,0,0,0,0|1,0,2]=3 103 B7R1.4 NC1=CONC1=O Amb18203033 [0,0,0,0,0,0|0,0,2]=2 104 B7R1.4 NC1=NCCN1N Amb24713156 [0,0,0,0,0,0|3,0,1]=4 105 B7R1.4 NC1C=NCC1N Amb27774521 [0,0,0,0,0,0|3,0,1]=4 106 B7R1.4 NC1C=NNC1=O Amb18202634 [0,0,0,0,0,0|1,0,1]=2 107 B7R1.4 NC1CCC=C1Br Amb33295394 [0,0,0,0,0,0|3,0,0]=3 108 B7R1.4 NC1CCC=C1Br Amb33484034 [0,0,0,0,0,0|3,0,0]=3 109 B7R1.4 NC1CCCC1=O Amb17939050 [0,0,0,0,0,0|2,0,0]=2 110 B7R1.4 NC1CCCC1=O Amb28994832 [0,0,0,0,0,0|2,0,0]=2 111 B7R1.4 NC1CCCC1Br Amb20667786 [0,0,0,0,0,0|3,0,1]=4 112 B7R1.4 NC1CCCC1Br Amb24691577 [0,0,0,0,0,0|3,0,1]=4 113 B7R1.4 NC1CCCC1Cl Amb3428719 [0,0,0,0,0,0|3,0,1]=4 114 B7R1.4 NC1CCCC1Cl Amb4451124 [0,0,0,0,0,0|3,0,1]=4 115 B7R1.4 NC1CCCC1F Amb23538754 [0,0,0,0,0,0|3,0,1]=4 116 B7R1.4 NC1CCCC1F Amb32658048 [0,0,0,0,0,0|3,0,1]=4 117 B7R1.4 NC1CCCC1N Amb18639642 [0,0,0,0,0,0|3,0,1]=4 118 B7R1.4 NC1CCCC1N Amb31291256 [0,0,0,0,0,0|3,0,1]=4 119 B7R1.4 NC1CCCC1O Amb13951342 [0,0,0,0,0,0|2,0,2]=4 120 B7R1.4 NC1CCCC1O Amb8385206 [0,0,0,0,0,0|2,0,2]=4 121 B7R1.4 NC1CCNC1=O Amb21955321 [0,0,0,0,0,0|1,0,0]=1 122 B7R1.4 NC1CCNC1=O Amb6739903 [0,0,0,0,0,0|1,0,0]=1 123 B7R1.4 NC1CCOC1=O Amb17614991 [0,0,0,0,0,0|2,0,0]=2 124 B7R1.4 NC1CCOC1=O Amb6609049 [0,0,0,0,0,0|2,0,0]=2 125 B7R1.4 NC1CCOC1=O Amb9761351 [0,0,0,0,0,0|2,0,0]=2 126 B7R1.4 NC1CCOC1O Amb27408022 [0,0,0,0,0,0|2,0,2]=4 127 B7R1.4 NC1CCSC1=O Amb1151877 [0,0,0,0,0,0|2,0,0]=2 128 B7R1.4 NC1CCSC1=O Amb2720274 [0,0,0,0,0,0|2,0,0]=2 129 B7R1.4 NC1CNCC1N Amb26003523 [0,0,0,0,0,0|3,0,1]=4 130 B7R1.4 NC1CNCC1N Amb33869965 [0,0,0,0,0,0|3,0,1]=4 131 B7R1.4 NC1CNCC1O Amb22235661 [0,0,0,0,0,0|2,0,2]=4 132 B7R1.4 NC1COCC1=O Amb18202885 [0,0,0,0,0,0|1,0,0]=1 133 B7R1.4 NC1COCC1=O Amb33328736 [0,0,0,0,0,0|1,0,0]=1 134 B7R1.4 NC1COCC1N Amb23590778 [0,0,0,0,0,0|2,0,1]=3 135 B7R1.4 NC1COCC1N Amb32665881 [0,0,0,0,0,0|2,0,1]=3 136 B7R1.4 NC1COCC1O Amb18277417 [0,0,0,0,0,0|1,0,2]=3 137 B7R1.4 NC1COCC1O Amb19515137 [0,0,0,0,0,0|1,0,2]=3 138 B7R1.4 NC1CONC1=O Amb1865548 [0,0,0,0,0,0|0,0,0]=0 139 B7R1.4 NC1CSCC1=O Amb18202693 [0,0,0,0,0,0|1,1,0]=2 140 B7R1.4 NC1CSCC1F Amb28280927 [0,0,0,0,0,0|2,1,1]=4 141 B7R1.4 NC1CSCC1O Amb2693597 [0,0,0,0,0,0|1,1,2]=4 142 B7R1.4 NC1CSCC1O Amb5634210 [0,0,0,0,0,0|1,1,2]=4 143 B7R1.4 NC1CSCC1O Amb8565080 [0,0,0,0,0,0|1,1,2]=4 144 B7R1.4 NC1CSNC1=O Amb27435893 [0,0,0,0,0,0|0,1,0]=1 145 B7R1.4 NN1C=NNC1=O Amb18548408 [0,0,0,0,0,0|2,0,1]=3 146 B7R1.4 NN1C=NNC1=S Amb18221777 [0,0,0,0,0,0|2,1,1]=4 147 B7R1.4 NN1CCCC1=O Amb8496496 [0,0,0,0,0,0|3,0,0]=3 148 B7R1.4 NN1CCCC1=O Amb9174227 [0,0,0,0,0,0|3,0,0]=3 149 B7R1.4 NN1CCNC1=O Amb5722000 [0,0,0,0,0,0|2,0,0]=2 150 B7R1.4 NN1CCOC1=O Amb10068971 [0,0,0,0,0,0|3,0,0]=3 151 B7R1.4 NN1CCOC1=O Amb33532698 [0,0,0,0,0,0|3,0,0]=3 152 B7R1.4 NN1N=CNC1=S Amb27422889 [0,0,0,0,0,0|3,1,0]=4 153 B7R1.4 N[C@@H]1CCC[C@@H]1Cl Amb32650234 [0,0,0,0,0,0|3,0,1]=4 154 B7R1.4 N[C@@H]1CCC[C@@H]1Cl Amb32650235 [0,0,0,0,0,0|3,0,1]=4 155 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb25174659 [0,0,0,0,0,0|3,0,1]=4 156 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb32661555 [0,0,0,0,0,0|3,0,1]=4 157 B7R1.4 N[C@@H]1CCC[C@@H]1F Amb32661660 [0,0,0,0,0,0|3,0,1]=4 158 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993810 [0,0,0,0,0,0|2,0,2]=4 159 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993921 [0,0,0,0,0,0|2,0,2]=4 160 B7R1.4 N[C@@H]1CCC[C@H]1Cl Amb27882439 [0,0,0,0,0,0|3,0,1]=4 161 B7R1.4 N[C@@H]1CCC[C@H]1F Amb28429786 [0,0,0,0,0,0|3,0,1]=4 162 B7R1.4 N[C@@H]1CCC[C@H]1F Amb31308557 [0,0,0,0,0,0|3,0,1]=4 163 B7R1.4 N[C@@H]1CCC[C@H]1N Amb16231433 [0,0,0,0,0,0|3,0,1]=4 164 B7R1.4 N[C@@H]1CCC[C@H]1N Amb22748826 [0,0,0,0,0,0|3,0,1]=4 165 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993811 [0,0,0,0,0,0|2,0,2]=4 166 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993922 [0,0,0,0,0,0|2,0,2]=4 167 B7R1.4 N[C@@H]1CCC[C@H]1O Amb30451169 [0,0,0,0,0,0|2,0,2]=4 168 B7R1.4 N[C@@H]1CCC[C@H]1O Amb33714404 [0,0,0,0,0,0|2,0,2]=4 169 B7R1.4 N[C@@H]1CCC[C@H]1S Amb28345579 [0,0,0,0,0,0|2,1,1]=4 170 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [0,0,0,0,0,0|1,0,0]=1 171 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [0,0,0,0,0,0|1,0,0]=1 172 B7R1.4 N[C@@H]1CCOC1=O Amb10601656 [0,0,0,0,0,0|2,0,0]=2 173 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [0,0,0,0,0,0|2,0,0]=2 174 B7R1.4 N[C@@H]1CCOC1=O Amb3941712 [0,0,0,0,0,0|2,0,0]=2 175 B7R1.4 N[C@@H]1CNC[C@@H]1F Amb35825100 [0,0,0,0,0,0|3,0,1]=4 176 B7R1.4 N[C@@H]1CNC[C@@H]1O Amb25911176 [0,0,0,0,0,0|2,0,2]=4 177 B7R1.4 N[C@@H]1CNC[C@H]1F Amb33851297 [0,0,0,0,0,0|3,0,1]=4 178 B7R1.4 N[C@@H]1CNC[C@H]1N Amb24620889 [0,0,0,0,0,0|3,0,1]=4 179 B7R1.4 N[C@@H]1COC[C@@H]1F Amb31188298 [0,0,0,0,0,0|2,0,1]=3 180 B7R1.4 N[C@@H]1COC[C@@H]1F Amb33456080 [0,0,0,0,0,0|2,0,1]=3 181 B7R1.4 N[C@@H]1COC[C@@H]1N Amb19515126 [0,0,0,0,0,0|2,0,1]=3 182 B7R1.4 N[C@@H]1COC[C@@H]1N Amb22802084 [0,0,0,0,0,0|2,0,1]=3 183 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22748842 [0,0,0,0,0,0|1,0,2]=3 184 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22754535 [0,0,0,0,0,0|1,0,2]=3 185 B7R1.4 N[C@@H]1COC[C@H]1F Amb33719125 [0,0,0,0,0,0|2,0,1]=3 186 B7R1.4 N[C@@H]1COC[C@H]1N Amb22231694 [0,0,0,0,0,0|2,0,1]=3 187 B7R1.4 N[C@@H]1COC[C@H]1N Amb22802083 [0,0,0,0,0,0|2,0,1]=3 188 B7R1.4 N[C@@H]1COC[C@H]1O Amb17933202 [0,0,0,0,0,0|1,0,2]=3 189 B7R1.4 N[C@@H]1COC[C@H]1O Amb22746728 [0,0,0,0,0,0|1,0,2]=3 190 B7R1.4 N[C@@H]1COC[C@H]1O Amb24107553 [0,0,0,0,0,0|1,0,2]=3 191 B7R1.4 N[C@@H]1COC[C@H]1O Amb33715897 [0,0,0,0,0,0|1,0,2]=3 192 B7R1.4 N[C@@H]1CONC1=O Amb533888 [0,0,0,0,0,0|0,0,0]=0 193 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb23482790 [0,0,0,0,0,0|1,1,2]=4 194 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb532933 [0,0,0,0,0,0|1,1,2]=4 195 B7R1.4 N[C@@H]1CSC[C@H]1O Amb1099355 [0,0,0,0,0,0|1,1,2]=4 196 B7R1.4 N[C@H]1CCC[C@@H]1Cl Amb27203393 [0,0,0,0,0,0|3,0,1]=4 197 B7R1.4 N[C@H]1CCC[C@@H]1F Amb34916180 [0,0,0,0,0,0|3,0,1]=4 198 B7R1.4 N[C@H]1CCC[C@@H]1N Amb16231434 [0,0,0,0,0,0|3,0,1]=4 199 B7R1.4 N[C@H]1CCC[C@@H]1O Amb10604100 [0,0,0,0,0,0|2,0,2]=4 200 B7R1.4 N[C@H]1CCC[C@@H]1O Amb3941725 [0,0,0,0,0,0|2,0,2]=4 201 B7R1.4 N[C@H]1CCC[C@H]1F Amb27476530 [0,0,0,0,0,0|3,0,1]=4 202 B7R1.4 N[C@H]1CCC[C@H]1F Amb34162936 [0,0,0,0,0,0|3,0,1]=4 203 B7R1.4 N[C@H]1CCC[C@H]1N Amb28346940 [0,0,0,0,0,0|3,0,1]=4 204 B7R1.4 N[C@H]1CCC[C@H]1N Amb30988009 [0,0,0,0,0,0|3,0,1]=4 205 B7R1.4 N[C@H]1CCC[C@H]1O Amb10603107 [0,0,0,0,0,0|2,0,2]=4 206 B7R1.4 N[C@H]1CCC[C@H]1O Amb28133706 [0,0,0,0,0,0|2,0,2]=4 207 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [0,0,0,0,0,0|1,0,0]=1 208 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [0,0,0,0,0,0|1,0,0]=1 209 B7R1.4 N[C@H]1CCOC1=O Amb10982617 [0,0,0,0,0,0|2,0,0]=2 210 B7R1.4 N[C@H]1CCOC1=O Amb541960 [0,0,0,0,0,0|2,0,0]=2 211 B7R1.4 N[C@H]1CCOC1=O Amb5718691 [0,0,0,0,0,0|2,0,0]=2 212 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [0,0,0,0,0,0|2,0,0]=2 213 B7R1.4 N[C@H]1CCSC1=O Amb33758042 [0,0,0,0,0,0|2,0,0]=2 214 B7R1.4 N[C@H]1CCSC1=O Amb8628572 [0,0,0,0,0,0|2,0,0]=2 215 B7R1.4 N[C@H]1CNC[C@@H]1F Amb26440346 [0,0,0,0,0,0|3,0,1]=4 216 B7R1.4 N[C@H]1CNC[C@H]1O Amb27621416 [0,0,0,0,0,0|2,0,2]=4 217 B7R1.4 N[C@H]1CNOC1=O Amb27778477 [0,0,0,0,0,0|2,0,0]=2 218 B7R1.4 N[C@H]1COC[C@@H]1N Amb26937236 [0,0,0,0,0,0|2,0,1]=3 219 B7R1.4 N[C@H]1COC[C@@H]1O Amb10608341 [0,0,0,0,0,0|1,0,2]=3 220 B7R1.4 N[C@H]1COC[C@@H]1O Amb22224915 [0,0,0,0,0,0|1,0,2]=3 221 B7R1.4 N[C@H]1COC[C@H]1F Amb35825425 [0,0,0,0,0,0|2,0,1]=3 222 B7R1.4 N[C@H]1COC[C@H]1O Amb25259808 [0,0,0,0,0,0|1,0,2]=3 223 B7R1.4 N[C@H]1COC[C@H]1O Amb33774994 [0,0,0,0,0,0|1,0,2]=3 224 B7R1.4 N[C@H]1CONC1=O Amb2719694 [0,0,0,0,0,0|0,0,0]=0 225 B7R1.4 Nc1cocc1N Amb20620155 [0,0,0,0,0,0|2,0,2]=4 226 B7R1.4 Nc1conc1N Amb18202560 [0,0,0,0,0,0|1,0,3]=4 227 B7R1.4 Nc1nocc1Br Amb23400901 [0,0,0,0,0,0|3,0,1]=4 228 B7R1.4 Nc1nocc1Cl Amb22899679 [0,0,0,0,0,0|3,0,1]=4 229 B7R1.4 Nc1nocc1I Amb23400914 [0,0,0,0,0,0|3,0,1]=4 230 B7R1.4 Nc1nonc1I Amb20623297 [0,0,0,0,0,0|2,0,2]=4 231 B7R1.4 Nc1nonc1N Amb6315487 [0,0,0,0,0,0|2,0,2]=4 232 B7R1.4 Nc1nonc1O Amb574750 [0,0,0,0,0,0|1,0,3]=4 233 B7R1.4 O=C1C=CCC1Cl Amb27482393 [0,0,0,0,0,0|3,0,0]=3 234 B7R1.4 O=C1C=CCN1O Amb28255915 [0,0,0,0,0,0|4,0,0]=4 235 B7R1.4 O=C1C=CNC1=O Amb26887753 [0,0,0,0,0,0|2,0,2]=4 236 B7R1.4 O=C1C=COC1O Amb27638452 [0,0,0,0,0,0|4,0,0]=4 237 B7R1.4 O=C1CCCC1=O Amb24053064 [0,0,0,0,0,0|3,0,1]=4 238 B7R1.4 O=C1CCCC1Br Amb16234114 [0,0,0,0,0,0|3,0,0]=3 239 B7R1.4 O=C1CCCC1Cl Amb3939970 [0,0,0,0,0,0|3,0,0]=3 240 B7R1.4 O=C1CCCC1F Amb28050533 [0,0,0,0,0,0|3,0,0]=3 241 B7R1.4 O=C1CCCC1I Amb25756212 [0,0,0,0,0,0|3,0,0]=3 242 B7R1.4 O=C1CCCC1O Amb17593081 [0,0,0,0,0,0|3,0,0]=3 243 B7R1.4 O=C1CCCC1S Amb27838260 [0,0,0,0,0,0|3,0,0]=3 244 B7R1.4 O=C1CCCN1O Amb33484242 [0,0,0,0,0,0|4,0,0]=4 245 B7R1.4 O=C1CCC[C@@H]1F Amb35788466 [0,0,0,0,0,0|3,0,0]=3 246 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [0,0,0,0,0,0|3,0,0]=3 247 B7R1.4 O=C1CCNC1=O Amb21858086 [0,0,0,0,0,0|2,0,1]=3 248 B7R1.4 O=C1CCOC1=O Amb27849805 [0,0,0,0,0,0|3,0,1]=4 249 B7R1.4 O=C1COC=C1O Amb27838226 [0,0,0,0,0,0|2,0,2]=4 250 B7R1.4 O=C1NC=CN1O Amb26589882 [0,0,0,0,0,0|3,0,1]=4 251 B7R1.4 O=C1NCCC1Br Amb20623055 [0,0,0,0,0,0|2,0,0]=2 252 B7R1.4 O=C1NCCC1Cl Amb28050511 [0,0,0,0,0,0|2,0,0]=2 253 B7R1.4 O=C1NCCC1F Amb25838145 [0,0,0,0,0,0|2,0,0]=2 254 B7R1.4 O=C1NCCC1O Amb10603089 [0,0,0,0,0,0|2,0,0]=2 255 B7R1.4 O=C1NCCC1S Amb18202686 [0,0,0,0,0,0|2,0,0]=2 256 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [0,0,0,0,0,0|2,0,0]=2 257 B7R1.4 O=C1NCC[C@H]1O Amb22225343 [0,0,0,0,0,0|2,0,0]=2 258 B7R1.4 O=C1NOC=C1Br Amb24641631 [0,0,0,0,0,0|1,0,2]=3 259 B7R1.4 O=C1OC=CC1Br Amb22015332 [0,0,0,0,0,0|3,0,1]=4 260 B7R1.4 O=C1OC=CC1S Amb27624883 [0,0,0,0,0,0|3,0,1]=4 261 B7R1.4 O=C1OC=C[C@@H]1O Amb27472742 [0,0,0,0,0,0|3,0,1]=4 262 B7R1.4 O=C1OCCC1Br Amb3940058 [0,0,0,0,0,0|3,0,0]=3 263 B7R1.4 O=C1OCCC1F Amb27642041 [0,0,0,0,0,0|3,0,0]=3 264 B7R1.4 O=C1OCCC1I Amb24418518 [0,0,0,0,0,0|3,0,0]=3 265 B7R1.4 O=C1OCCC1O Amb5718058 [0,0,0,0,0,0|3,0,0]=3 266 B7R1.4 O=C1OCCC1S Amb25146639 [0,0,0,0,0,0|3,0,0]=3 267 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [0,0,0,0,0,0|3,0,0]=3 268 B7R1.4 O=C1OCC[C@H]1Br Amb27407127 [0,0,0,0,0,0|3,0,0]=3 269 B7R1.4 O=C1OCC[C@H]1Cl Amb28207894 [0,0,0,0,0,0|3,0,0]=3 270 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [0,0,0,0,0,0|3,0,0]=3 271 B7R1.4 O=C1OCC[C@H]1S Amb27862288 [0,0,0,0,0,0|3,0,0]=3 272 B7R1.4 O=C1OCNC1Br Amb25299209 [0,0,0,0,0,0|4,0,0]=4 273 B7R1.4 O=C1SCC[C@@H]1Br Amb27482200 [0,0,0,0,0,0|3,0,0]=3 274 B7R1.4 O=S1CCCC1Br Amb28046103 [0,0,0,0,0,0|4,0,0]=4 275 B7R1.4 O=S1CCCC1Cl Amb27796334 [0,0,0,0,0,0|4,0,0]=4 276 B7R1.4 OC1CCC=C1Br Amb24429462 [0,0,0,0,0,0|4,0,0]=4 277 B7R1.4 OC1CCC=C1Cl Amb25202022 [0,0,0,0,0,0|4,0,0]=4 278 B7R1.4 OC1COCC1Br Amb25321008 [0,0,0,0,0,0|2,0,2]=4 279 B7R1.4 OC1COCC1F Amb26475960 [0,0,0,0,0,0|2,0,2]=4 280 B7R1.4 OC1COCC1I Amb24332672 [0,0,0,0,0,0|2,0,2]=4 281 B7R1.4 OC1COCC1O Amb532982 [0,0,0,0,0,0|2,0,2]=4 282 B7R1.4 OC1COCC1S Amb27970973 [0,0,0,0,0,0|2,0,2]=4 283 B7R1.4 O[C@@H]1CCC=C1Cl Amb28340922 [0,0,0,0,0,0|4,0,0]=4 284 B7R1.4 O[C@@H]1COC[C@@H]1F Amb24600177 [0,0,0,0,0,0|2,0,2]=4 285 B7R1.4 O[C@@H]1COC[C@H]1Br Amb24356806 [0,0,0,0,0,0|2,0,2]=4 286 B7R1.4 O[C@@H]1COC[C@H]1F Amb22886831 [0,0,0,0,0,0|2,0,2]=4 287 B7R1.4 O[C@@H]1COC[C@H]1O Amb22231695 [0,0,0,0,0,0|2,0,2]=4 288 B7R1.4 O[C@H]1COC[C@@H]1Br Amb24519174 [0,0,0,0,0,0|2,0,2]=4 289 B7R1.4 O[C@H]1COC[C@@H]1O Amb17938167 [0,0,0,0,0,0|2,0,2]=4 290 B7R1.4 O[C@H]1COC[C@H]1O Amb22406017 [0,0,0,0,0,0|2,0,2]=4 291 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [0,0,0,0,0,0|2,0,1]=3 292 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [0,0,0,0,0,0|2,0,1]=3 293 B7R1.4 [O-][N+]1=C(O)NCC1 Amb28367242 [0,0,0,0,0,0|3,0,1]=4 294 B6R1.2 BrC1=CCCC1 Amb10067271 [1,0,0,0,0,0|3,0,0]=4 295 B6R1.2 BrC1=COCC1 Amb24322594 [1,0,0,0,0,0|2,0,0]=3 296 B6R1.2 BrC1=NCCN1 Amb28382662 [1,0,0,0,0,0|3,0,0]=4 297 B6R1.2 BrC1CCNC1 Amb10608920 [1,0,0,0,0,0|2,0,1]=4 298 B6R1.2 BrC1CCNC1 Amb19958764 [1,0,0,0,0,0|2,0,1]=4 299 B6R1.2 BrC1CCNC1 Amb22229239 [1,0,0,0,0,0|2,0,1]=4 300 B6R1.2 BrC1CCOC1 Amb19957943 [1,0,0,0,0,0|2,0,1]=4 301 B6R1.2 Br[C@@H]1CCNC1 Amb22225312 [1,0,0,0,0,0|2,0,1]=4 302 B6R1.2 Br[C@@H]1CCNC1 Amb22225313 [1,0,0,0,0,0|2,0,1]=4 303 B6R1.2 Br[C@H]1CCNC1 Amb22226659 [1,0,0,0,0,0|2,0,1]=4 304 B6R1.2 Br[C@H]1CCNC1 Amb22226660 [1,0,0,0,0,0|2,0,1]=4 305 B6R1.2 C=C1CCCC1 Amb22337671 [1,0,0,0,0,0|3,0,0]=4 306 B6R1.2 C=C1CCCS1 Amb28137153 [1,0,0,0,0,0|3,0,0]=4 307 B6R1.2 C=C1CCNC1 Amb22490848 [1,0,0,0,0,0|3,0,0]=4 308 B6R1.2 C=C1CCNC1 Amb27782898 [1,0,0,0,0,0|3,0,0]=4 309 B6R1.2 C=C1CCSC1 Amb26477950 [1,0,0,0,0,0|2,1,0]=4 310 B6R1.2 C=C1CNOC1 Amb31156059 [1,0,0,0,0,0|1,0,2]=4 311 B6R1.2 C=C1CNOC1 Amb33309622 [1,0,0,0,0,0|1,0,2]=4 312 B6R1.2 CC1=CCCC1 Amb8513250 [1,0,0,0,0,0|3,0,0]=4 313 B6R1.2 CC1=CSCC1 Amb26495749 [1,0,0,0,0,0|2,1,0]=4 314 B6R1.2 CC1=NCCC1 Amb8513341 [1,0,0,0,0,0|2,0,1]=4 315 B6R1.2 CC1=NCCN1 Amb1294344 [1,0,0,0,0,0|3,0,0]=4 316 B6R1.2 CC1=NNCC1 Amb8492492 [1,0,0,0,0,0|2,0,1]=4 317 B6R1.2 CC1=NOCN1 Amb27262288 [1,0,0,0,0,0|2,0,1]=4 318 B6R1.2 CC1C=CCC1 Amb17674168 [1,0,0,0,0,0|3,0,0]=4 319 B6R1.2 CC1C=CNC1 Amb28040927 [1,0,0,0,0,0|3,0,0]=4 320 B6R1.2 CC1CCCN1 Amb8387002 [1,0,0,0,0,0|2,0,1]=4 321 B6R1.2 CC1CCCN1 Amb9713910 [1,0,0,0,0,0|2,0,1]=4 322 B6R1.2 CC1CCNC1 Amb15690616 [1,0,0,0,0,0|2,0,1]=4 323 B6R1.2 CC1CCNC1 Amb8630788 [1,0,0,0,0,0|2,0,1]=4 324 B6R1.2 CC1CCNO1 Amb27209819 [1,0,0,0,0,0|3,0,0]=4 325 B6R1.2 CC1CCOC1 Amb4418362 [1,0,0,0,0,0|2,0,1]=4 326 B6R1.2 CC1CCON1 Amb27793876 [1,0,0,0,0,0|1,0,1]=3 327 B6R1.2 CC1CNOC1 Amb30526860 [1,0,0,0,0,0|1,0,1]=3 328 B6R1.2 CC1COCN1 Amb17506155 [1,0,0,0,0,0|3,0,0]=4 329 B6R1.2 CN1CCCN1 Amb28058528 [1,0,0,0,0,0|3,0,0]=4 330 B6R1.2 CN1CCCN1 Amb35826246 [1,0,0,0,0,0|3,0,0]=4 331 B6R1.2 CN1CCOC1 Amb25146749 [1,0,0,0,0,0|3,0,0]=4 332 B6R1.2 C[C@@H]1CCCN1 Amb10071006 [1,0,0,0,0,0|2,0,1]=4 333 B6R1.2 C[C@@H]1CCCN1 Amb8628964 [1,0,0,0,0,0|2,0,1]=4 334 B6R1.2 C[C@@H]1CCNC1 Amb19888329 [1,0,0,0,0,0|2,0,1]=4 335 B6R1.2 C[C@@H]1CCNC1 Amb27593574 [1,0,0,0,0,0|2,0,1]=4 336 B6R1.2 C[C@H]1CCCN1 Amb10071007 [1,0,0,0,0,0|2,0,1]=4 337 B6R1.2 C[C@H]1CCCN1 Amb8387004 [1,0,0,0,0,0|2,0,1]=4 338 B6R1.2 C[C@H]1CCNC1 Amb19887708 [1,0,0,0,0,0|2,0,1]=4 339 B6R1.2 C[C@H]1COCN1 Amb28383154 [1,0,0,0,0,0|3,0,0]=4 340 B6R1.2 ClC1=NCCN1 Amb27624895 [1,0,0,0,0,0|3,0,0]=4 341 B6R1.2 ClC1C=CCC1 Amb17672585 [1,0,0,0,0,0|3,0,0]=4 342 B6R1.2 ClC1CCNC1 Amb18640558 [1,0,0,0,0,0|2,0,1]=4 343 B6R1.2 ClC1CCNC1 Amb22229273 [1,0,0,0,0,0|2,0,1]=4 344 B6R1.2 ClC1CCOC1 Amb20623054 [1,0,0,0,0,0|2,0,1]=4 345 B6R1.2 Cl[C@H]1CCNC1 Amb22226671 [1,0,0,0,0,0|2,0,1]=4 346 B6R1.2 FC1=COCC1 Amb24322813 [1,0,0,0,0,0|2,0,0]=3 347 B6R1.2 FC1CCCN1 Amb27590475 [1,0,0,0,0,0|2,0,1]=4 348 B6R1.2 FC1CCNC1 Amb19148522 [1,0,0,0,0,0|2,0,1]=4 349 B6R1.2 FC1CCNC1 Amb8010918 [1,0,0,0,0,0|2,0,1]=4 350 B6R1.2 F[C@@H]1CCNC1 Amb10603224 [1,0,0,0,0,0|2,0,1]=4 351 B6R1.2 F[C@@H]1CCNC1 Amb2688413 [1,0,0,0,0,0|2,0,1]=4 352 B6R1.2 F[C@H]1CCNC1 Amb10603273 [1,0,0,0,0,0|2,0,1]=4 353 B6R1.2 F[C@H]1CCNC1 Amb2688414 [1,0,0,0,0,0|2,0,1]=4 354 B6R1.2 IC1=CCCC1 Amb24332192 [1,0,0,0,0,0|3,0,0]=4 355 B6R1.2 IC1=COCC1 Amb24322814 [1,0,0,0,0,0|2,0,0]=3 356 B6R1.2 IC1CCNC1 Amb22229333 [1,0,0,0,0,0|2,0,1]=4 357 B6R1.2 IC1CCOC1 Amb9677596 [1,0,0,0,0,0|2,0,1]=4 358 B6R1.2 I[C@@H]1CCOC1 Amb25337461 [1,0,0,0,0,0|2,0,1]=4 359 B6R1.2 I[C@H]1CCOC1 Amb22405918 [1,0,0,0,0,0|2,0,1]=4 360 B6R1.2 N=C1CCC=N1 Amb28436317 [1,0,0,0,0,0|2,0,1]=4 361 B6R1.2 N=C1CCCN1 Amb2371632 [1,0,0,0,0,0|2,0,0]=3 362 B6R1.2 N=C1CCCN1 Amb501585 [1,0,0,0,0,0|2,0,0]=3 363 B6R1.2 N=C1CCCS1 Amb10072429 [1,0,0,0,0,0|3,0,0]=4 364 B6R1.2 N=C1CCCS1 Amb9825646 [1,0,0,0,0,0|3,0,0]=4 365 B6R1.2 N=C1NCCN1 Amb21859025 [1,0,0,0,0,0|3,0,0]=4 366 B6R1.2 N=C1NCCO1 Amb20623979 [1,0,0,0,0,0|3,0,0]=4 367 B6R1.2 N=C1NCCS1 Amb8470061 [1,0,0,0,0,0|3,0,0]=4 368 B6R1.2 NC1=CCNN1 Amb22346141 [1,0,0,0,0,0|2,0,1]=4 369 B6R1.2 NC1=CCNN1 Amb24053526 [1,0,0,0,0,0|2,0,1]=4 370 B6R1.2 NC1=CCNN1 Amb24080576 [1,0,0,0,0,0|2,0,1]=4 371 B6R1.2 NC1=CCNN1 Amb6889369 [1,0,0,0,0,0|2,0,1]=4 372 B6R1.2 NC1=NCCC1 Amb10976565 [1,0,0,0,0,0|2,0,1]=4 373 B6R1.2 NC1=NCCC1 Amb8342250 [1,0,0,0,0,0|2,0,1]=4 374 B6R1.2 NC1=NCCN1 Amb10810372 [1,0,0,0,0,0|3,0,0]=4 375 B6R1.2 NC1=NNCC1 Amb22330617 [1,0,0,0,0,0|2,0,1]=4 376 B6R1.2 NC1=NNCC1 Amb28555323 [1,0,0,0,0,0|2,0,1]=4 377 B6R1.2 NC1=NOCC1 Amb27975619 [1,0,0,0,0,0|1,0,1]=3 378 B6R1.2 NC1C=CCC1 Amb23385329 [1,0,0,0,0,0|2,0,0]=3 379 B6R1.2 NC1C=CCC1 Amb26367288 [1,0,0,0,0,0|2,0,0]=3 380 B6R1.2 NC1C=COC1 Amb28068172 [1,0,0,0,0,0|1,0,0]=2 381 B6R1.2 NC1CC=CC1 Amb18203201 [1,0,0,0,0,0|2,0,1]=4 382 B6R1.2 NC1CC=CC1 Amb2684387 [1,0,0,0,0,0|2,0,1]=4 383 B6R1.2 NC1CCCC1 Amb2792832 [1,0,0,0,0,0|2,0,1]=4 384 B6R1.2 NC1CCCO1 Amb16233703 [1,0,0,0,0,0|3,0,0]=4 385 B6R1.2 NC1CCNC1 Amb2720262 [1,0,0,0,0,0|1,0,1]=3 386 B6R1.2 NC1CCNC1 Amb2777850 [1,0,0,0,0,0|1,0,1]=3 387 B6R1.2 NC1CCOC1 Amb33536523 [1,0,0,0,0,0|1,0,1]=3 388 B6R1.2 NC1CCOC1 Amb3941188 [1,0,0,0,0,0|1,0,1]=3 389 B6R1.2 NC1CCSC1 Amb19149005 [1,0,0,0,0,0|1,1,1]=4 390 B6R1.2 NC1CCSC1 Amb9709380 [1,0,0,0,0,0|1,1,1]=4 391 B6R1.2 NC1CSSC1 Amb8480297 [1,0,0,0,0,0|1,1,1]=4 392 B6R1.2 NN1C=NNC1 Amb26369720 [1,0,0,0,0,0|2,0,1]=4 393 B6R1.2 N[C@@H]1CCNC1 Amb2696338 [1,0,0,0,0,0|1,0,1]=3 394 B6R1.2 N[C@@H]1CCNC1 Amb8396670 [1,0,0,0,0,0|1,0,1]=3 395 B6R1.2 N[C@@H]1CCOC1 Amb19515768 [1,0,0,0,0,0|1,0,1]=3 396 B6R1.2 N[C@@H]1CCOC1 Amb8628967 [1,0,0,0,0,0|1,0,1]=3 397 B6R1.2 N[C@@H]1CCSC1 Amb28067533 [1,0,0,0,0,0|1,1,1]=4 398 B6R1.2 N[C@H]1CCNC1 Amb2696339 [1,0,0,0,0,0|1,0,1]=3 399 B6R1.2 N[C@H]1CCOC1 Amb10603285 [1,0,0,0,0,0|1,0,1]=3 400 B6R1.2 N[C@H]1CCOC1 Amb8389308 [1,0,0,0,0,0|1,0,1]=3 401 B6R1.2 N[C@H]1CCSC1 Amb24611361 [1,0,0,0,0,0|1,1,1]=4 402 B6R1.2 Nc1ccoc1 Amb22230735 [1,0,0,0,0,0|1,0,2]=4 403 B6R1.2 Nc1ccon1 Amb613464 [1,0,0,0,0,0|2,0,1]=4 404 B6R1.2 Nc1cnoc1 Amb10602604 [1,0,0,0,0,0|0,0,3]=4 405 B6R1.2 Nc1cnoc1 Amb10602605 [1,0,0,0,0,0|0,0,3]=4 406 B6R1.2 Nc1cnon1 Amb18203173 [1,0,0,0,0,0|1,0,2]=4 407 B6R1.2 O=C1C=CCC1 Amb4019519 [1,0,0,0,0,0|2,0,0]=3 408 B6R1.2 O=C1C=CCN1 Amb20241082 [1,0,0,0,0,0|1,0,2]=4 409 B6R1.2 O=C1C=CCO1 Amb2792769 [1,0,0,0,0,0|3,0,0]=4 410 B6R1.2 O=C1C=CCS1 Amb22336458 [1,0,0,0,0,0|3,0,0]=4 411 B6R1.2 O=C1C=CNN1 Amb19958916 [1,0,0,0,0,0|1,0,2]=4 412 B6R1.2 O=C1C=COC1 Amb24107591 [1,0,0,0,0,0|1,0,2]=4 413 B6R1.2 O=C1C=CSN1 Amb19895016 [1,0,0,0,0,0|0,1,2]=4 414 B6R1.2 O=C1C=NCN1 Amb26572891 [1,0,0,0,0,0|2,0,1]=4 415 B6R1.2 O=C1C=NCO1 Amb25786221 [1,0,0,0,0,0|3,0,0]=4 416 B6R1.2 O=C1CC=CC1 Amb2686649 [1,0,0,0,0,0|2,0,1]=4 417 B6R1.2 O=C1CC=CN1 Amb22235167 [1,0,0,0,0,0|1,0,1]=3 418 B6R1.2 O=C1CC=NN1 Amb3428206 [1,0,0,0,0,0|1,0,1]=3 419 B6R1.2 O=C1CC=NO1 Amb27654112 [1,0,0,0,0,0|2,0,1]=4 420 B6R1.2 O=C1CCCC1 Amb2793024 [1,0,0,0,0,0|2,0,0]=3 421 B6R1.2 O=C1CCCN1 Amb22169686 [1,0,0,0,0,0|1,0,0]=2 422 B6R1.2 O=C1CCCN1 Amb6608645 [1,0,0,0,0,0|1,0,0]=2 423 B6R1.2 O=C1CCCO1 Amb3940401 [1,0,0,0,0,0|2,0,0]=3 424 B6R1.2 O=C1CCCS1 Amb22338102 [1,0,0,0,0,0|2,0,0]=3 425 B6R1.2 O=C1CCNC1 Amb2700623 [1,0,0,0,0,0|2,0,0]=3 426 B6R1.2 O=C1CCNC1 Amb8386645 [1,0,0,0,0,0|2,0,0]=3 427 B6R1.2 O=C1CCNN1 Amb33551041 [1,0,0,0,0,0|1,0,0]=2 428 B6R1.2 O=C1CCNN1 Amb3428540 [1,0,0,0,0,0|1,0,0]=2 429 B6R1.2 O=C1CCOC1 Amb7990143 [1,0,0,0,0,0|1,0,0]=2 430 B6R1.2 O=C1CCON1 Amb22235009 [1,0,0,0,0,0|0,0,0]=1 431 B6R1.2 O=C1CCSC1 Amb2720904 [1,0,0,0,0,0|1,1,0]=3 432 B6R1.2 O=C1CN=CS1 Amb27963219 [1,0,0,0,0,0|3,0,0]=4 433 B6R1.2 O=C1CNCN1 Amb19957368 [1,0,0,0,0,0|2,0,0]=3 434 B6R1.2 O=C1CNCS1 Amb27443758 [1,0,0,0,0,0|3,0,0]=4 435 B6R1.2 O=C1COCN1 Amb28132686 [1,0,0,0,0,0|2,0,0]=3 436 B6R1.2 O=C1CSCN1 Amb28187121 [1,0,0,0,0,0|2,0,0]=3 437 B6R1.2 O=C1CSSC1 Amb28351444 [1,0,0,0,0,0|2,1,0]=4 438 B6R1.2 O=C1NC=CN1 Amb19516737 [1,0,0,0,0,0|2,0,1]=4 439 B6R1.2 O=C1NC=CO1 Amb20671008 [1,0,0,0,0,0|2,0,1]=4 440 B6R1.2 O=C1NC=CS1 Amb19271596 [1,0,0,0,0,0|2,0,1]=4 441 B6R1.2 O=C1NC=NN1 Amb20243425 [1,0,0,0,0,0|2,0,1]=4 442 B6R1.2 O=C1NCCN1 Amb6357221 [1,0,0,0,0,0|2,0,0]=3 443 B6R1.2 O=C1NCCN1 Amb6608941 [1,0,0,0,0,0|2,0,0]=3 444 B6R1.2 O=C1NCCO1 Amb6608807 [1,0,0,0,0,0|2,0,0]=3 445 B6R1.2 O=C1NCCS1 Amb431322 [1,0,0,0,0,0|2,0,0]=3 446 B6R1.2 O=C1NN=CO1 Amb20667671 [1,0,0,0,0,0|2,0,1]=4 447 B6R1.2 O=C1NN=CS1 Amb22491285 [1,0,0,0,0,0|2,0,1]=4 448 B6R1.2 O=C1OCCO1 Amb4057710 [1,0,0,0,0,0|3,0,0]=4 449 B6R1.2 O=C1OCCS1 Amb27398683 [1,0,0,0,0,0|3,0,0]=4 450 B6R1.2 O=S1CCCC1 Amb2690579 [1,0,0,0,0,0|3,0,0]=4 451 B6R1.2 O=S1CCNC1 Amb28075495 [1,0,0,0,0,0|3,0,0]=4 452 B6R1.2 O=[PH]1CCCC1 Amb33804724 [1,0,0,0,0,0|3,0,0]=4 453 B6R1.2 OC1=NNCC1 Amb2111955 [1,0,0,0,0,0|1,0,2]=4 454 B6R1.2 OC1=NNCC1 Amb844737 [1,0,0,0,0,0|1,0,2]=4 455 B6R1.2 OC1C=CCC1 Amb33546881 [1,0,0,0,0,0|3,0,0]=4 456 B6R1.2 OC1CCCN1 Amb28120620 [1,0,0,0,0,0|1,0,2]=4 457 B6R1.2 OC1CCNC1 Amb22436788 [1,0,0,0,0,0|2,0,1]=4 458 B6R1.2 OC1CCNC1 Amb2688790 [1,0,0,0,0,0|2,0,1]=4 459 B6R1.2 OC1CCNC1 Amb2690449 [1,0,0,0,0,0|2,0,1]=4 460 B6R1.2 OC1CCOC1 Amb2688794 [1,0,0,0,0,0|1,0,2]=4 461 B6R1.2 OC1CNNC1 Amb17593035 [1,0,0,0,0,0|2,0,1]=4 462 B6R1.2 OC1CNNC1 Amb33456285 [1,0,0,0,0,0|2,0,1]=4 463 B6R1.2 OC1CNOC1 Amb19516646 [1,0,0,0,0,0|1,0,1]=3 464 B6R1.2 OC1CNOC1 Amb19889794 [1,0,0,0,0,0|1,0,1]=3 465 B6R1.2 O[C@@H]1CCNC1 Amb2688791 [1,0,0,0,0,0|2,0,1]=4 466 B6R1.2 O[C@@H]1CCNC1 Amb3939360 [1,0,0,0,0,0|2,0,1]=4 467 B6R1.2 O[C@@H]1CCOC1 Amb8628960 [1,0,0,0,0,0|1,0,2]=4 468 B6R1.2 O[C@@H]1CNOC1 Amb22748671 [1,0,0,0,0,0|1,0,1]=3 469 B6R1.2 O[C@H]1C=CCC1 Amb28133982 [1,0,0,0,0,0|3,0,0]=4 470 B6R1.2 O[C@H]1C=COC1 Amb27242778 [1,0,0,0,0,0|2,0,0]=3 471 B6R1.2 O[C@H]1CCNC1 Amb2688792 [1,0,0,0,0,0|2,0,1]=4 472 B6R1.2 O[C@H]1CCNC1 Amb33716680 [1,0,0,0,0,0|2,0,1]=4 473 B6R1.2 O[C@H]1CCNC1 Amb8384246 [1,0,0,0,0,0|2,0,1]=4 474 B6R1.2 O[C@H]1CCOC1 Amb32409449 [1,0,0,0,0,0|1,0,2]=4 475 B6R1.2 O[C@H]1CCOC1 Amb33718794 [1,0,0,0,0,0|1,0,2]=4 476 B6R1.2 O[C@H]1CCOC1 Amb3940165 [1,0,0,0,0,0|1,0,2]=4 477 B6R1.2 O[C@H]1CNOC1 Amb33801809 [1,0,0,0,0,0|1,0,1]=3 478 B6R1.2 S=C1CC=CN1 Amb27239207 [1,0,0,0,0,0|1,1,1]=4 479 B6R1.2 S=C1CCCC1 Amb28049287 [1,0,0,0,0,0|2,1,0]=4 480 B6R1.2 S=C1CCCN1 Amb2778514 [1,0,0,0,0,0|1,1,0]=3 481 B6R1.2 S=C1CCCO1 Amb27808589 [1,0,0,0,0,0|2,1,0]=4 482 B6R1.2 S=C1NCCN1 Amb2720352 [1,0,0,0,0,0|2,1,0]=4 483 B6R1.2 S=C1NCCO1 Amb2371644 [1,0,0,0,0,0|2,1,0]=4 484 B6R1.2 S=C1NCCS1 Amb4010551 [1,0,0,0,0,0|2,1,0]=4 485 B6R1.2 SC1=NCCN1 Amb3778841 [1,0,0,0,0,0|2,1,0]=4 486 B6R1.2 SC1C=CCC1 Amb32788808 [1,0,0,0,0,0|3,0,0]=4 487 B6R1.2 SC1CCNC1 Amb10608919 [1,0,0,0,0,0|2,0,1]=4 488 B6R1.2 SC1CCOC1 Amb22298444 [1,0,0,0,0,0|1,1,1]=4 489 B6R1.2 SC1CNOC1 Amb32788426 [1,0,0,0,0,0|1,0,1]=3 490 B8R1.11 C=C1CNCC1NC Amb27967218 [0,1,0,0,0,0|3,0,0]=4 491 B8R1.11 C=C1CNC[C@H]1NC Amb28067689 [0,1,0,0,0,0|3,0,0]=4 492 B8R1.11 C=C1COCC1CC Amb35646844 [0,1,0,0,0,0|3,0,0]=4 493 B8R1.11 C=CC1CCNC1=O Amb27459841 [0,1,0,0,0,0|2,0,0]=3 494 B8R1.11 C=CC1COCC1N Amb27596175 [0,1,0,0,0,0|2,0,1]=4 495 B8R1.11 CC1COCC1C=O Amb29882774 [0,1,0,0,0,0|2,0,1]=4 496 B8R1.11 CC1COCC1NN Amb35616344 [0,1,0,0,0,0|2,0,1]=4 497 B8R1.11 CC1COCC1NO Amb35635908 [0,1,0,0,0,0|2,0,1]=4 498 B8R1.11 CC1COC\C1=N/N Amb35647017 [0,1,0,0,0,0|3,0,0]=4 499 B8R1.11 CC1COC\C1=N/O Amb35646817 [0,1,0,0,0,0|2,0,1]=4 500 B8R1.11 CC1NCCC1CN Amb18203354 [0,1,0,0,0,0|2,0,1]=4 501 B8R1.11 CCC1C=CNC1=O Amb27882600 [0,1,0,0,0,0|2,0,1]=4 502 B8R1.11 CCC1CCCC1=O Amb16187019 [0,1,0,0,0,0|3,0,0]=4 503 B8R1.11 CCC1CCNC1=O Amb19516780 [0,1,0,0,0,0|2,0,0]=3 504 B8R1.11 CCC1CCOC1=O Amb23538353 [0,1,0,0,0,0|3,0,0]=4 505 B8R1.11 CCC1CCSC1=O Amb27420755 [0,1,0,0,0,0|3,0,0]=4 506 B8R1.11 CCC1COCC1=O Amb29866231 [0,1,0,0,0,0|2,0,0]=3 507 B8R1.11 CCC1COCC1N Amb29866237 [0,1,0,0,0,0|2,0,1]=4 508 B8R1.11 CCC1NCCC1N Amb18203353 [0,1,0,0,0,0|2,0,1]=4 509 B8R1.11 CCC1SCNC1=O Amb27838311 [0,1,0,0,0,0|3,0,0]=4 510 B8R1.11 CCN1CCNC1=O Amb19333131 [0,1,0,0,0,0|3,0,0]=4 511 B8R1.11 CC[C@@H]1CCCC1=O Amb27164677 [0,1,0,0,0,0|3,0,0]=4 512 B8R1.11 CC[C@H]1CCCC1=O Amb27256510 [0,1,0,0,0,0|3,0,0]=4 513 B8R1.11 CNC1CCNC1=O Amb22059501 [0,1,0,0,0,0|1,0,0]=2 514 B8R1.11 CNC1CCNC1=O Amb28990981 [0,1,0,0,0,0|1,0,0]=2 515 B8R1.11 CNC1CCSC1=O Amb27234396 [0,1,0,0,0,0|2,0,0]=3 516 B8R1.11 CNC1COCC1C Amb35632266 [0,1,0,0,0,0|2,0,1]=4 517 B8R1.11 CNC1COCC1O Amb18944293 [0,1,0,0,0,0|1,0,2]=4 518 B8R1.11 CN[C@@H]1COC[C@@H]1O Amb24700231 [0,1,0,0,0,0|1,0,2]=4 519 B8R1.11 CN[C@@H]1COC[C@H]1O Amb22748628 [0,1,0,0,0,0|1,0,2]=4 520 B8R1.11 CN[C@@H]1COC[C@H]1O Amb22757852 [0,1,0,0,0,0|1,0,2]=4 521 B8R1.11 CN[C@H]1CCNC1=O Amb28042561 [0,1,0,0,0,0|1,0,0]=2 522 B8R1.11 CN[C@H]1CCOC1=O Amb28288608 [0,1,0,0,0,0|2,0,0]=3 523 B8R1.11 CN[C@H]1COC[C@@H]1O Amb10608328 [0,1,0,0,0,0|1,0,2]=4 524 B8R1.11 COC1C=CNC1=O Amb27850186 [0,1,0,0,0,0|2,0,1]=4 525 B8R1.11 COC1CCCC1=O Amb24573567 [0,1,0,0,0,0|3,0,0]=4 526 B8R1.11 COC1CCOC1=O Amb28127714 [0,1,0,0,0,0|3,0,0]=4 527 B8R1.11 COC1COCC1N Amb17606146 [0,1,0,0,0,0|1,0,2]=4 528 B8R1.11 COC1COCC1N Amb28994082 [0,1,0,0,0,0|1,0,2]=4 529 B8R1.11 CO[C@@H]1CC=CC1=O Amb27260476 [0,1,0,0,0,0|3,0,0]=4 530 B8R1.11 CO[C@@H]1COC[C@@H]1N Amb22757962 [0,1,0,0,0,0|1,0,2]=4 531 B8R1.11 CO[C@@H]1COC[C@@H]1N Amb24539352 [0,1,0,0,0,0|1,0,2]=4 532 B8R1.11 CO[C@@H]1COC[C@H]1N Amb22757840 [0,1,0,0,0,0|1,0,2]=4 533 B8R1.11 CO[C@@H]1COC[C@H]1N Amb23438206 [0,1,0,0,0,0|1,0,2]=4 534 B8R1.11 CO[C@H]1CC=CC1=O Amb27262725 [0,1,0,0,0,0|3,0,0]=4 535 B8R1.11 CO[C@H]1COC[C@@H]1N Amb10608202 [0,1,0,0,0,0|1,0,2]=4 536 B8R1.11 CO[C@H]1COC[C@H]1N Amb25683516 [0,1,0,0,0,0|1,0,2]=4 537 B8R1.11 CSC1COCC1N Amb22504265 [0,1,0,0,0,0|1,1,1]=4 538 B8R1.11 C[C@H]1CCC=C1C=O Amb28251104 [0,1,0,0,0,0|3,0,0]=4 539 B8R1.11 C\C=C1\CCNC1=O Amb28397116 [0,1,0,0,0,0|2,0,1]=4 540 B8R1.11 N#CC1CCCC1=O Amb9774970 [0,1,0,0,0,0|2,0,1]=4 541 B8R1.11 N#CC1CCNC1=O Amb24053097 [0,1,0,0,0,0|1,0,1]=3 542 B8R1.11 N#CC1CCOC1=O Amb6669560 [0,1,0,0,0,0|2,0,1]=4 543 B8R1.11 N#CC1CCSC1=O Amb28206797 [0,1,0,0,0,0|2,0,1]=4 544 B8R1.11 N#CC1CNCC1=O Amb22297522 [0,1,0,0,0,0|2,0,1]=4 545 B8R1.11 N#CC1COCC1=O Amb24183529 [0,1,0,0,0,0|1,0,1]=3 546 B8R1.11 N#CC1COCC1N Amb28048960 [0,1,0,0,0,0|2,0,1]=4 547 B8R1.11 N#CC1CSCC1=O Amb597776 [0,1,0,0,0,0|1,1,1]=4 548 B8R1.11 N#C[C@H]1CCCC1=O Amb25979444 [0,1,0,0,0,0|2,0,1]=4 549 B8R1.11 NC1COCC1CO Amb24581733 [0,1,0,0,0,0|1,0,2]=4 550 B8R1.11 NC1COCC1CO Amb30585130 [0,1,0,0,0,0|1,0,2]=4 551 B8R1.11 NCC1CCCC1=O Amb18833069 [0,1,0,0,0,0|2,0,0]=3 552 B8R1.11 NCC1CCCC1=O Amb28934823 [0,1,0,0,0,0|2,0,0]=3 553 B8R1.11 NCC1CCCS1=O Amb27872352 [0,1,0,0,0,0|3,0,0]=4 554 B8R1.11 NCC1CCNC1=O Amb18833033 [0,1,0,0,0,0|1,0,0]=2 555 B8R1.11 NCC1CCOC1=O Amb28398456 [0,1,0,0,0,0|2,0,0]=3 556 B8R1.11 NCC1CCOC1=O Amb32653583 [0,1,0,0,0,0|2,0,0]=3 557 B8R1.11 NCC1COCC1N Amb27459550 [0,1,0,0,0,0|2,0,1]=4 558 B8R1.11 NCC1COCC1O Amb25728184 [0,1,0,0,0,0|1,0,2]=4 559 B8R1.11 NCC1COCC1O Amb32753532 [0,1,0,0,0,0|1,0,2]=4 560 B8R1.11 NCC1CSCC1=O Amb24529601 [0,1,0,0,0,0|1,1,0]=3 561 B8R1.11 NC[C@@H]1COC[C@@H]1O Amb23439671 [0,1,0,0,0,0|1,0,2]=4 562 B8R1.11 NC[C@@H]1COC[C@@H]1O Amb32680795 [0,1,0,0,0,0|1,0,2]=4 563 B8R1.11 NC[C@@H]1COC[C@H]1O Amb23439670 [0,1,0,0,0,0|1,0,2]=4 564 B8R1.11 NC[C@@H]1COC[C@H]1O Amb25277795 [0,1,0,0,0,0|1,0,2]=4 565 B8R1.11 NC[C@H]1COC[C@@H]1O Amb26894025 [0,1,0,0,0,0|1,0,2]=4 566 B8R1.11 NC[C@H]1COC[C@@H]1O Amb34156215 [0,1,0,0,0,0|1,0,2]=4 567 B8R1.11 NC[C@H]1COC[C@H]1O Amb25351472 [0,1,0,0,0,0|1,0,2]=4 568 B8R1.11 NNC1CNNC1=O Amb28057143 [0,1,0,0,0,0|1,0,0]=2 569 B8R1.11 NNC1COCC1O Amb24706024 [0,1,0,0,0,0|1,0,2]=4 570 B8R1.11 NNC1COCC1O Amb32646040 [0,1,0,0,0,0|1,0,2]=4 571 B8R1.11 NN[C@@H]1COC[C@H]1O Amb33069638 [0,1,0,0,0,0|1,0,2]=4 572 B8R1.11 NOC1COCC1O Amb27479135 [0,1,0,0,0,0|1,0,2]=4 573 B8R1.11 N[C@@H]1COC[C@@H]1CO Amb31169044 [0,1,0,0,0,0|1,0,2]=4 574 B8R1.11 N[C@@H]1COC[C@@H]1CO Amb33456236 [0,1,0,0,0,0|1,0,2]=4 575 B8R1.11 N[C@H]1COC[C@H]1CO Amb27188192 [0,1,0,0,0,0|1,0,2]=4 576 B8R1.11 N\C=C1/CCCC1=O Amb28324124 [0,1,0,0,0,0|2,0,1]=4 577 B8R1.11 N\C=C1\CCOC1=O Amb24575038 [0,1,0,0,0,0|2,0,1]=4 578 B8R1.11 Nc1cocc1C=O Amb18203396 [0,1,0,0,0,0|1,0,2]=4 579 B8R1.11 Nc1nonc1N=O Amb9775162 [0,1,0,0,0,0|1,0,2]=4 580 B8R1.11 O=C1C=CCC1CO Amb27802494 [0,1,0,0,0,0|3,0,0]=4 581 B8R1.11 O=C1CCCC1CCl Amb25111572 [0,1,0,0,0,0|3,0,0]=4 582 B8R1.11 O=C1CCCC1CO Amb22491993 [0,1,0,0,0,0|3,0,0]=4 583 B8R1.11 O=C1CCC[C@@H]1CO Amb28049022 [0,1,0,0,0,0|3,0,0]=4 584 B8R1.11 O=C1NCCC1CO Amb33531235 [0,1,0,0,0,0|2,0,0]=3 585 B8R1.11 O=C1NCCN1CO Amb24761511 [0,1,0,0,0,0|3,0,0]=4 586 B8R1.11 O=C1NCC\C1=N/O Amb27838387 [0,1,0,0,0,0|1,0,2]=4 587 B8R1.11 O=C1OCCC1CO Amb26431337 [0,1,0,0,0,0|3,0,0]=4 588 B8R1.11 O=C1SCCC1CO Amb17593391 [0,1,0,0,0,0|3,0,0]=4 589 B8R1.11 O=CC1CCCC1=O Amb24480732 [0,1,0,0,0,0|3,0,0]=4 590 B8R1.11 O=CC1CCOC1=O Amb17593177 [0,1,0,0,0,0|3,0,0]=4 591 B8R1.11 O=CC1COCC1=O Amb27165171 [0,1,0,0,0,0|2,0,0]=3 592 B8R1.11 O=CN1CCNC1=O Amb27643561 [0,1,0,0,0,0|3,0,0]=4 593 B8R1.18 C=C1CC(=O)NC1=O Amb26369663 [0,1,0,0,0,0|2,0,1]=4 594 B8R1.18 C=C1CC(C)NC1=O Amb27201887 [0,1,0,0,0,0|2,0,1]=4 595 B8R1.18 CC1=CC(=O)C(Br)C1 Amb28284387 [0,1,0,0,0,0|3,0,0]=4 596 B8R1.18 CC1=CC(=O)C(C)C1 Amb24647798 [0,1,0,0,0,0|3,0,0]=4 597 B8R1.18 CC1=CC(=O)C(Cl)C1 Amb27750318 [0,1,0,0,0,0|3,0,0]=4 598 B8R1.18 CC1=CN(N)C(=O)N1 Amb28399196 [0,1,0,0,0,0|2,0,1]=4 599 B8R1.18 CC1CC(=O)C(C)C1 Amb26510571 [0,1,0,0,0,0|3,0,0]=4 600 B8R1.18 CC1CC(=O)NC1=O Amb10609734 [0,1,0,0,0,0|2,0,0]=3 601 B8R1.18 CC1CC(=O)OC1=O Amb3940407 [0,1,0,0,0,0|3,0,0]=4 602 B8R1.18 CC1CC(Br)C(=O)O1 Amb6608903 [0,1,0,0,0,0|3,0,0]=4 603 B8R1.18 CC1CC(C)C(=O)N1 Amb24698782 [0,1,0,0,0,0|2,0,0]=3 604 B8R1.18 CC1CC(C)C(=O)O1 Amb4017434 [0,1,0,0,0,0|3,0,0]=4 605 B8R1.18 CC1CC(N)C(=O)O1 Amb32653104 [0,1,0,0,0,0|2,0,0]=3 606 B8R1.18 CC1CC(N)C(=O)O1 Amb448594 [0,1,0,0,0,0|2,0,0]=3 607 B8R1.18 CC1CC(N)C(C)N1 Amb27808331 [0,1,0,0,0,0|2,0,1]=4 608 B8R1.18 CC1CC(O)C(=O)N1 Amb27784846 [0,1,0,0,0,0|2,0,0]=3 609 B8R1.18 CC1CC(O)C(=O)O1 Amb27451083 [0,1,0,0,0,0|3,0,0]=4 610 B8R1.18 CC1CN(C)CC1=O Amb20622328 [0,1,0,0,0,0|3,0,0]=4 611 B8R1.18 CC1C[C@@H](C)CC1=O Amb27424916 [0,1,0,0,0,0|3,0,0]=4 612 B8R1.18 CC1C[C@H](N)C(=O)O1 Amb27844768 [0,1,0,0,0,0|2,0,0]=3 613 B8R1.18 CC1NC(=O)C(C)N1 Amb24481399 [0,1,0,0,0,0|3,0,0]=4 614 B8R1.18 CC1NC(=O)C(C)S1 Amb27784375 [0,1,0,0,0,0|3,0,0]=4 615 B8R1.18 CC1NC(=O)NC1=O Amb1150065 [0,1,0,0,0,0|3,0,0]=4 616 B8R1.18 CC1NC(=O)[C@H](C)N1 Amb28284134 [0,1,0,0,0,0|3,0,0]=4 617 B8R1.18 CC1NC(=S)NC1=O Amb22263161 [0,1,0,0,0,0|3,0,0]=4 618 B8R1.18 CC1OC(=O)NC1=O Amb24357861 [0,1,0,0,0,0|3,0,0]=4 619 B8R1.18 CC1SC(=N)NC1=O Amb2792627 [0,1,0,0,0,0|3,0,0]=4 620 B8R1.18 CC1SC(=O)NC1=O Amb21857287 [0,1,0,0,0,0|3,0,0]=4 621 B8R1.18 CC1SC(=S)NC1=O Amb27794294 [0,1,0,0,0,0|3,0,0]=4 622 B8R1.18 CN1CC(=O)NC1=O Amb3940344 [0,1,0,0,0,0|3,0,0]=4 623 B8R1.18 CN1CC(N)C(=O)N1 Amb25872890 [0,1,0,0,0,0|1,0,0]=2 624 B8R1.18 C[C@@H]1CC(=O)OC1=O Amb25791861 [0,1,0,0,0,0|3,0,0]=4 625 B8R1.18 C[C@@H]1C[C@@H](Cl)C(=O)O1 Amb25288126 [0,1,0,0,0,0|3,0,0]=4 626 B8R1.18 C[C@@H]1C[C@@H](O)C(=S)N1 Amb28133564 [0,1,0,0,0,0|2,1,0]=4 627 B8R1.18 C[C@@H]1NC(=O)NC1=O Amb17617476 [0,1,0,0,0,0|3,0,0]=4 628 B8R1.18 C[C@@H]1NC(=S)NC1=O Amb27154771 [0,1,0,0,0,0|3,0,0]=4 629 B8R1.18 C[C@@H]1S[C@H](C)NC1=O Amb27857156 [0,1,0,0,0,0|3,0,0]=4 630 B8R1.18 C[C@H]1CC(=O)NC1=O Amb28119095 [0,1,0,0,0,0|2,0,0]=3 631 B8R1.18 C[C@H]1CC(=O)OC1=O Amb2609932 [0,1,0,0,0,0|3,0,0]=4 632 B8R1.18 C[C@H]1CC(=O)[C@H](C)C1 Amb28429622 [0,1,0,0,0,0|3,0,0]=4 633 B8R1.18 C[C@H]1C[C@@H](C)C(=O)O1 Amb28060142 [0,1,0,0,0,0|3,0,0]=4 634 B8R1.18 C[C@H]1C[C@@H](C)NC1=O Amb27619178 [0,1,0,0,0,0|2,0,0]=3 635 B8R1.18 C[C@H]1C[C@H](O)C(=O)O1 Amb27852763 [0,1,0,0,0,0|3,0,0]=4 636 B8R1.18 C[C@H]1NC(=O)NC1=O Amb17617475 [0,1,0,0,0,0|3,0,0]=4 637 B8R1.18 C[C@H]1NC(=S)NC1=O Amb27961227 [0,1,0,0,0,0|3,0,0]=4 638 B8R1.18 NC1=CC(=O)NC1=O Amb27627676 [0,1,0,0,0,0|1,0,2]=4 639 B8R1.18 NC1CC(=O)NC1=O Amb30585083 [0,1,0,0,0,0|1,0,0]=2 640 B8R1.18 NC1CC(=O)NC1=O Amb9502460 [0,1,0,0,0,0|1,0,0]=2 641 B8R1.18 NC1CC(=O)OC1=O Amb27216215 [0,1,0,0,0,0|2,0,0]=3 642 B8R1.18 NC1NC(=O)NC1=O Amb28118590 [0,1,0,0,0,0|2,0,0]=3 643 B8R1.18 NC1SC(=O)NC1=O Amb2794365 [0,1,0,0,0,0|2,0,0]=3 644 B8R1.18 NN1CC(=O)NC1=O Amb1106079 [0,1,0,0,0,0|2,0,0]=3 645 B8R1.18 NN1CC(=O)NC1=O Amb2720280 [0,1,0,0,0,0|2,0,0]=3 646 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb25992097 [0,1,0,0,0,0|2,0,0]=3 647 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb8631355 [0,1,0,0,0,0|2,0,0]=3 648 B8R1.18 N[C@H]1CC(=O)NC1=O Amb17134612 [0,1,0,0,0,0|1,0,0]=2 649 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,1,0,0,0,0|2,0,0]=3 650 B8R1.18 O=C1CC(=O)C(O)C1 Amb24330382 [0,1,0,0,0,0|3,0,0]=4 651 B8R1.18 O=C1CC(Cl)C(=O)O1 Amb24677749 [0,1,0,0,0,0|3,0,0]=4 652 B8R1.18 O=C1CC(O)C(=O)O1 Amb27399619 [0,1,0,0,0,0|3,0,0]=4 653 B8R1.18 O=C1CC(O)NC1=O Amb27596054 [0,1,0,0,0,0|2,0,1]=4 654 B8R1.18 O=C1CN([SiH3])C(=O)N1 Amb28071257 [0,1,0,0,0,0|3,0,0]=4 655 B8R1.18 O=C1C[C@@H](F)C(=O)O1 Amb28286140 [0,1,0,0,0,0|3,0,0]=4 656 B8R1.18 O=C1C[C@H](F)C(=O)O1 Amb27406936 [0,1,0,0,0,0|3,0,0]=4 657 B8R1.18 O=C1NC(=O)C(Br)N1 Amb8383660 [0,1,0,0,0,0|3,0,0]=4 658 B8R1.18 O=C1NC(=O)C(Br)S1 Amb2436078 [0,1,0,0,0,0|3,0,0]=4 659 B8R1.18 O=C1NC(=O)C(O)N1 Amb17615425 [0,1,0,0,0,0|3,0,0]=4 660 B8R1.18 O=C1OC(O)CC1O Amb27761542 [0,1,0,0,0,0|3,0,0]=4 661 B8R1.18 [NH3+]N1CC(=O)NC1=O Amb4296932 [0,1,0,0,0,0|2,0,1]=4 662 B8R1.19 CC1(Br)CCCC1=O Amb28316126 [0,1,0,0,0,0|3,0,0]=4 663 B8R1.19 CC1(Br)CCOC1=O Amb3940887 [0,1,0,0,0,0|3,0,0]=4 664 B8R1.19 CC1(C)CCCC1=O Amb4605933 [0,1,0,0,0,0|3,0,0]=4 665 B8R1.19 CC1(C)CCNC1=O Amb13882829 [0,1,0,0,0,0|2,0,0]=3 666 B8R1.19 CC1(C)CCNC1=O Amb22757339 [0,1,0,0,0,0|2,0,0]=3 667 B8R1.19 CC1(C)CCNC1=S Amb25265103 [0,1,0,0,0,0|2,1,0]=4 668 B8R1.19 CC1(C)CCOC1=O Amb10603955 [0,1,0,0,0,0|3,0,0]=4 669 B8R1.19 CC1(C)CNCC1=O Amb28398062 [0,1,0,0,0,0|3,0,0]=4 670 B8R1.19 CC1(C)COCC1=O Amb26970932 [0,1,0,0,0,0|2,0,0]=3 671 B8R1.19 CC1(C)COCC1N Amb25863650 [0,1,0,0,0,0|2,0,1]=4 672 B8R1.19 CC1(C)COCC1N Amb28555379 [0,1,0,0,0,0|2,0,1]=4 673 B8R1.19 CC1(C)CONC1=O Amb21927202 [0,1,0,0,0,0|1,0,0]=2 674 B8R1.19 CC1(C)NCCC1N Amb18833031 [0,1,0,0,0,0|2,0,1]=4 675 B8R1.19 CC1(Cl)CCCC1=O Amb28315776 [0,1,0,0,0,0|3,0,0]=4 676 B8R1.19 CC1(N)CCNC1=O Amb18124254 [0,1,0,0,0,0|1,0,0]=2 677 B8R1.19 CC1(N)CCOC1=O Amb28934923 [0,1,0,0,0,0|2,0,0]=3 678 B8R1.19 CC1(N)CCSC1=O Amb27838410 [0,1,0,0,0,0|2,0,0]=3 679 B8R1.19 CC1(O)CCCC1=O Amb27749790 [0,1,0,0,0,0|3,0,0]=4 680 B8R1.19 CC1CCNS1(=O)=O Amb33298956 [0,1,0,0,0,0|3,0,0]=4 681 B8R1.19 C[C@@]1(Cl)CC=CC1=O Amb28049021 [0,1,0,0,0,0|3,0,0]=4 682 B8R1.19 C[C@@]1(N)CONC1=O Amb25929798 [0,1,0,0,0,0|0,0,0]=1 683 B8R1.19 C[C@]1(N)CCOC1=O Amb27629673 [0,1,0,0,0,0|2,0,0]=3 684 B8R1.19 C[C@]1(N)CCSC1=O Amb27431520 [0,1,0,0,0,0|2,0,0]=3 685 B8R1.19 C[C@]1(N)CONC1=O Amb25947476 [0,1,0,0,0,0|0,0,0]=1 686 B8R1.19 NC1CCCS1(=O)=O Amb27421871 [0,1,0,0,0,0|3,0,0]=4 687 B8R1.19 NC1COCC1(F)F Amb33719126 [0,1,0,0,0,0|2,0,1]=4 688 B8R1.19 O=C1CCCC1(F)F Amb32795002 [0,1,0,0,0,0|3,0,0]=4 689 B8R1.19 O=C1CNCC1(F)F Amb32412689 [0,1,0,0,0,0|3,0,0]=4 690 B8R1.19 O=C1NCCC1(F)F Amb25063682 [0,1,0,0,0,0|2,0,0]=3 691 B8R1.19 O=C1OCCC1(Br)Br Amb25227692 [0,1,0,0,0,0|3,0,0]=4 692 B8R1.50 C=C1C(=O)OCC1N Amb18641720 [0,1,0,0,0,0|2,0,0]=3 693 B8R1.50 C=C1C(=O)OCC1O Amb27768713 [0,1,0,0,0,0|3,0,0]=4 694 B8R1.50 C=C1C(=O)OC[C@H]1O Amb27945232 [0,1,0,0,0,0|3,0,0]=4 695 B8R1.50 C=C1CCN(C)C1=O Amb24457267 [0,1,0,0,0,0|2,0,1]=4 696 B8R1.50 C=C1COC(C)C1C Amb29856199 [0,1,0,0,0,0|3,0,0]=4 697 B8R1.50 CC1=C(N)C(=N)ON1 Amb28249044 [0,1,0,0,0,0|1,0,2]=4 698 B8R1.50 CC1=C(N)C(=O)NN1 Amb28934850 [0,1,0,0,0,0|1,0,2]=4 699 B8R1.50 CC1=C(N)C(=O)NN1 Amb32661104 [0,1,0,0,0,0|1,0,2]=4 700 B8R1.50 CC1=CCC(C)C1=O Amb17778666 [0,1,0,0,0,0|3,0,0]=4 701 B8R1.50 CC1=NNC(=O)C1Br Amb22330367 [0,1,0,0,0,0|2,0,1]=4 702 B8R1.50 CC1=NNC(=O)C1C Amb3429410 [0,1,0,0,0,0|2,0,1]=4 703 B8R1.50 CC1=NNC(=O)C1F Amb27829533 [0,1,0,0,0,0|2,0,1]=4 704 B8R1.50 CC1=NNC(=O)C1N Amb32664286 [0,1,0,0,0,0|1,0,1]=3 705 B8R1.50 CC1=NNC(=O)N1N Amb18048389 [0,1,0,0,0,0|2,0,1]=4 706 B8R1.50 CC1C(=O)COC1=O Amb4035239 [0,1,0,0,0,0|2,0,1]=4 707 B8R1.50 CC1C(=O)NCN1C Amb28128324 [0,1,0,0,0,0|3,0,0]=4 708 B8R1.50 CC1C(=O)NCS1=O Amb27630693 [0,1,0,0,0,0|3,0,0]=4 709 B8R1.50 CC1C(=O)NN=C1N Amb17593175 [0,1,0,0,0,0|2,0,1]=4 710 B8R1.50 CC1C(=O)OC[C@@H]1O Amb27208229 [0,1,0,0,0,0|3,0,0]=4 711 B8R1.50 CC1C(=O)OC[C@H]1O Amb27484790 [0,1,0,0,0,0|3,0,0]=4 712 B8R1.50 CC1C(N)CCN1C Amb27838392 [0,1,0,0,0,0|2,0,1]=4 713 B8R1.50 CC1CCC(=O)C1=O Amb4477353 [0,1,0,0,0,0|3,0,0]=4 714 B8R1.50 CC1CCC(=O)C1C Amb27485174 [0,1,0,0,0,0|3,0,0]=4 715 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,1,0,0,0,0|2,0,0]=3 716 B8R1.50 CC1CCC(C)C1=O Amb27198252 [0,1,0,0,0,0|3,0,0]=4 717 B8R1.50 CC1CCC(F)C1=O Amb32656355 [0,1,0,0,0,0|3,0,0]=4 718 B8R1.50 CC1CCN(C)C1=O Amb10068267 [0,1,0,0,0,0|2,0,0]=3 719 B8R1.50 CC1CNC(=O)C1C Amb24334186 [0,1,0,0,0,0|2,0,0]=3 720 B8R1.50 CC1CNC(=O)N1Cl Amb27759555 [0,1,0,0,0,0|3,0,0]=4 721 B8R1.50 CC1COC(=O)C1=O Amb27262699 [0,1,0,0,0,0|2,0,0]=3 722 B8R1.50 CC1COC(=O)C1Br Amb27401963 [0,1,0,0,0,0|3,0,0]=4 723 B8R1.50 CC1NCN(C)C1=O Amb18641804 [0,1,0,0,0,0|3,0,0]=4 724 B8R1.50 CC1NCN(C)C1=O Amb32664413 [0,1,0,0,0,0|3,0,0]=4 725 B8R1.50 CC1NCN(O)C1=O Amb28251778 [0,1,0,0,0,0|3,0,0]=4 726 B8R1.50 CC1NNC(=O)C1C Amb35693716 [0,1,0,0,0,0|2,0,0]=3 727 B8R1.50 CC1OCC(=O)C1C Amb29866230 [0,1,0,0,0,0|2,0,0]=3 728 B8R1.50 CC1OCC(=O)C1O Amb28131956 [0,1,0,0,0,0|2,0,0]=3 729 B8R1.50 CC1OCC(N)C1C Amb35725145 [0,1,0,0,0,0|2,0,1]=4 730 B8R1.50 CC1OCC(N)C1N Amb27230142 [0,1,0,0,0,0|2,0,1]=4 731 B8R1.50 CC1OCC(O)C1=O Amb28048942 [0,1,0,0,0,0|2,0,0]=3 732 B8R1.50 CN1C=CC(O)C1=O Amb28207084 [0,1,0,0,0,0|2,0,1]=4 733 B8R1.50 CN1CC=C(N)C1=O Amb27971244 [0,1,0,0,0,0|1,0,2]=4 734 B8R1.50 CN1CCC(=O)C1=O Amb24183817 [0,1,0,0,0,0|2,0,1]=4 735 B8R1.50 CN1CCC(Br)C1=O Amb19514590 [0,1,0,0,0,0|2,0,0]=3 736 B8R1.50 CN1CCC(Cl)C1=O Amb26433662 [0,1,0,0,0,0|2,0,0]=3 737 B8R1.50 CN1CCC(N)C1=O Amb22491599 [0,1,0,0,0,0|1,0,0]=2 738 B8R1.50 CN1CCC(N)C1=O Amb33538759 [0,1,0,0,0,0|1,0,0]=2 739 B8R1.50 CN1CCC(O)C1=O Amb20622738 [0,1,0,0,0,0|2,0,0]=3 740 B8R1.50 CN1CCC(S)C1=N Amb28061196 [0,1,0,0,0,0|3,0,0]=4 741 B8R1.50 CN1CCN(C)C1=O Amb1195982 [0,1,0,0,0,0|3,0,0]=4 742 B8R1.50 CN1CCN(N)C1=O Amb24643625 [0,1,0,0,0,0|2,0,0]=3 743 B8R1.50 CN1CC[C@@H](N)C1=O Amb25303747 [0,1,0,0,0,0|1,0,0]=2 744 B8R1.50 CN1CC[C@H](N)C1=O Amb25889201 [0,1,0,0,0,0|1,0,0]=2 745 B8R1.50 CN1N=CN(N)C1=O Amb28315713 [0,1,0,0,0,0|2,0,1]=4 746 B8R1.50 CN1OCC(Br)C1=O Amb28396643 [0,1,0,0,0,0|1,0,0]=2 747 B8R1.50 CN1OCC(N)C1=O Amb25867269 [0,1,0,0,0,0|0,0,0]=1 748 B8R1.50 CN1OCC(N)C1=S Amb27620645 [0,1,0,0,0,0|0,1,0]=2 749 B8R1.50 CN1ON=C(N)C1=O Amb27656559 [0,1,0,0,0,0|1,0,1]=3 750 B8R1.50 C[C@@H]1C(=O)C=C[C@H]1O Amb27785473 [0,1,0,0,0,0|3,0,0]=4 751 B8R1.50 C[C@@H]1C(=O)CC[C@@H]1O Amb28253966 [0,1,0,0,0,0|3,0,0]=4 752 B8R1.50 C[C@@H]1C(=O)NC[C@H]1O Amb27881742 [0,1,0,0,0,0|2,0,0]=3 753 B8R1.50 C[C@@H]1C(=O)OC[C@@H]1N Amb28055949 [0,1,0,0,0,0|2,0,1]=4 754 B8R1.50 C[C@@H]1CNC(=O)[C@@H]1N Amb27488737 [0,1,0,0,0,0|1,0,0]=2 755 B8R1.50 C[C@@H]1CNC(=O)[C@H]1C Amb27437481 [0,1,0,0,0,0|2,0,0]=3 756 B8R1.50 C[C@@H]1CNC(=S)[C@H]1O Amb27494768 [0,1,0,0,0,0|2,1,0]=4 757 B8R1.50 C[C@@H]1COC(=O)[C@@H]1C Amb28411565 [0,1,0,0,0,0|3,0,0]=4 758 B8R1.50 C[C@@H]1NCN(C)C1=O Amb27882405 [0,1,0,0,0,0|3,0,0]=4 759 B8R1.50 C[C@H]1C(=O)OC[C@H]1N Amb27635064 [0,1,0,0,0,0|2,0,1]=4 760 B8R1.50 C[C@H]1C=CC(=O)[C@@H]1Cl Amb27881804 [0,1,0,0,0,0|3,0,0]=4 761 B8R1.50 C[C@H]1CC[C@H](C)C1=O Amb27434148 [0,1,0,0,0,0|3,0,0]=4 762 B8R1.50 C[C@H]1CNC(=O)[C@@H]1C Amb27783966 [0,1,0,0,0,0|2,0,0]=3 763 B8R1.50 N=C1COC(=O)C1N Amb27839054 [0,1,0,0,0,0|2,0,1]=4 764 B8R1.50 NC1=C([NH3+])NNC1=O Amb21933592 [0,1,0,0,0,0|1,0,2]=4 765 B8R1.50 NC1=NNC(N)C1N Amb27838293 [0,1,0,0,0,0|2,0,1]=4 766 B8R1.50 NC1C(=O)CCC1=O Amb27409660 [0,1,0,0,0,0|2,0,1]=4 767 B8R1.50 NC1C(=O)NNC1=O Amb26392782 [0,1,0,0,0,0|1,0,1]=3 768 B8R1.50 NC1CCN(O)C1=O Amb8631273 [0,1,0,0,0,0|1,0,0]=2 769 B8R1.50 NC1CNC(=O)C1N Amb18641832 [0,1,0,0,0,0|1,0,0]=2 770 B8R1.50 NN1C(=O)CNC1=O Amb2795837 [0,1,0,0,0,0|2,0,1]=4 771 B8R1.50 NN1C(=O)NNC1=O Amb18641860 [0,1,0,0,0,0|2,0,1]=4 772 B8R1.50 N[C@@H]1C(=O)NC[C@@H]1O Amb27420900 [0,1,0,0,0,0|1,0,0]=2 773 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O Amb28289413 [0,1,0,0,0,0|1,0,0]=2 774 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb24697759 [0,1,0,0,0,0|2,0,0]=3 775 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb32751750 [0,1,0,0,0,0|2,0,0]=3 776 B8R1.50 N[C@@H]1C(=O)OC[C@H]1O Amb27202409 [0,1,0,0,0,0|2,0,0]=3 777 B8R1.50 N[C@@H]1CCN(O)C1=O Amb22362895 [0,1,0,0,0,0|1,0,0]=2 778 B8R1.50 N[C@H]1C(=O)NC[C@H]1O Amb28346232 [0,1,0,0,0,0|1,0,0]=2 779 B8R1.50 N[C@H]1C(=O)OC[C@@H]1O Amb27620425 [0,1,0,0,0,0|2,0,0]=3 780 B8R1.50 N[C@H]1CCN(O)C1=O Amb25345964 [0,1,0,0,0,0|1,0,0]=2 781 B8R1.50 O=C1C(F)CCC1F Amb28316127 [0,1,0,0,0,0|3,0,0]=4 782 B8R1.50 O=C1C=CC(O)C1Cl Amb27863645 [0,1,0,0,0,0|3,0,0]=4 783 B8R1.50 O=C1C=C[C@@H](O)[C@@H]1Cl Amb28324060 [0,1,0,0,0,0|3,0,0]=4 784 B8R1.50 O=C1CCC(F)C1Br Amb27875964 [0,1,0,0,0,0|3,0,0]=4 785 B8R1.50 O=C1CC[C@H](O)[C@@H]1O Amb28253888 [0,1,0,0,0,0|3,0,0]=4 786 B8R1.50 O=C1COC(=O)C1Br Amb17594578 [0,1,0,0,0,0|2,0,1]=4 787 B8R1.50 O=C1COC(=O)C1Cl Amb534802 [0,1,0,0,0,0|2,0,1]=4 788 B8R1.50 O=C1NCC(O)C1O Amb27813982 [0,1,0,0,0,0|2,0,0]=3 789 B8R1.50 O=C1NNC(=O)C1F Amb27268595 [0,1,0,0,0,0|2,0,1]=4 790 B8R1.50 O=C1OCC(O)C1O Amb22730078 [0,1,0,0,0,0|3,0,0]=4 791 B8R1.50 O=C1OC[C@@H](O)[C@@H]1O Amb24609731 [0,1,0,0,0,0|3,0,0]=4 792 B8R1.50 O=C1OC[C@@H](O)[C@H]1Br Amb32414616 [0,1,0,0,0,0|3,0,0]=4 793 B8R1.50 O=C1OC[C@@H](O)[C@H]1O Amb8515014 [0,1,0,0,0,0|3,0,0]=4 794 B8R1.50 O=C1OC[C@H](O)[C@@H]1Br Amb10067848 [0,1,0,0,0,0|3,0,0]=4 795 B8R1.50 O=C1OC[C@H](O)[C@@H]1O Amb27440225 [0,1,0,0,0,0|3,0,0]=4 796 B8R1.50 O=C1OC[C@H](O)[C@H]1Br Amb27634828 [0,1,0,0,0,0|3,0,0]=4 797 B8R1.50 O=C1OC[C@H](O)[C@H]1F Amb27775907 [0,1,0,0,0,0|3,0,0]=4 798 B8R1.50 O=C1OC[C@H](O)[C@H]1O Amb15692412 [0,1,0,0,0,0|3,0,0]=4 799 B8R1.50 O=C1[C@@H](Cl)CC[C@H]1Cl Amb27858710 [0,1,0,0,0,0|3,0,0]=4 800 B8R1.50 O=C1[C@H](Cl)CC[C@H]1Cl Amb28195652 [0,1,0,0,0,0|3,0,0]=4 801 B6R0.1 C#CC(=O)COC Amb27794422 [0,0,1,0,0,0|2,0,1]=4 802 B6R0.1 C#CC(=O)NCC Amb24057137 [0,0,1,0,0,0|2,0,1]=4 803 B6R0.1 C#CC(N)COC Amb25691561 [0,0,1,0,0,0|2,0,1]=4 804 B6R0.1 C#CCC(=O)CN Amb27970357 [0,0,1,0,0,0|2,0,1]=4 805 B6R0.1 C#CCC(O)C=O Amb27838261 [0,0,1,0,0,0|3,0,0]=4 806 B6R0.1 C=C(C=O)COC Amb28066424 [0,0,1,0,0,0|2,0,1]=4 807 B6R0.1 C=C(CBr)COC Amb33451446 [0,0,1,0,0,0|3,0,0]=4 808 B6R0.1 C=C(CCl)COC Amb25924077 [0,0,1,0,0,0|3,0,0]=4 809 B6R0.1 C=C(CN)CCC Amb33204217 [0,0,1,0,0,0|3,0,0]=4 810 B6R0.1 C=C(CN)COC Amb25262850 [0,0,1,0,0,0|2,0,0]=3 811 B6R0.1 C=C(CN)CSC Amb25048378 [0,0,1,0,0,0|2,1,0]=4 812 B6R0.1 C=CC(=O)COC Amb22168158 [0,0,1,0,0,0|2,0,1]=4 813 B6R0.1 C=CC(=O)NCC Amb9480404 [0,0,1,0,0,0|2,0,1]=4 814 B6R0.1 C=CC(C)CCN Amb27950155 [0,0,1,0,0,0|3,0,0]=4 815 B6R0.1 C=CC(N)CCC Amb27814468 [0,0,1,0,0,0|3,0,0]=4 816 B6R0.1 C=CC(N)CCO Amb22496689 [0,0,1,0,0,0|3,0,0]=4 817 B6R0.1 C=CC(N)COC Amb25252949 [0,0,1,0,0,0|2,0,0]=3 818 B6R0.1 C=CC(O)COC Amb26347976 [0,0,1,0,0,0|3,0,0]=4 819 B6R0.1 C=CCC(=O)CN Amb32410102 [0,0,1,0,0,0|2,0,1]=4 820 B6R0.1 C=CCC(C)C=O Amb4358618 [0,0,1,0,0,0|3,0,0]=4 821 B6R0.1 C=CC[C@@H](N)C=C Amb27213303 [0,0,1,0,0,0|3,0,0]=4 822 B6R0.1 C=CC[C@H](C)C=O Amb28050198 [0,0,1,0,0,0|3,0,0]=4 823 B6R0.1 C=CC[C@H](I)C=O Amb28042873 [0,0,1,0,0,0|3,0,0]=4 824 B6R0.1 C=CC[C@H](N)C=C Amb28313731 [0,0,1,0,0,0|3,0,0]=4 825 B6R0.1 C=C[C@H](N)CC#N Amb27860467 [0,0,1,0,0,0|2,0,1]=4 826 B6R0.1 C=C[C@H](N)COC Amb28069182 [0,0,1,0,0,0|2,0,0]=3 827 B6R0.1 CC#CC(=O)CC Amb26041340 [0,0,1,0,0,0|3,0,0]=4 828 B6R0.1 CC#CC(=O)CCl Amb27257962 [0,0,1,0,0,0|3,0,0]=4 829 B6R0.1 CC#CC(=O)NN Amb27470250 [0,0,1,0,0,0|3,0,0]=4 830 B6R0.1 CC(C=O)CCBr Amb18126359 [0,0,1,0,0,0|3,0,0]=4 831 B6R0.1 CC(C=O)CCF Amb33196124 [0,0,1,0,0,0|3,0,0]=4 832 B6R0.1 CC(C=O)CCO Amb28208492 [0,0,1,0,0,0|3,0,0]=4 833 B6R0.1 CC(CF)CON Amb33376909 [0,0,1,0,0,0|2,0,1]=4 834 B6R0.1 CCC(=O)CNC Amb26408381 [0,0,1,0,0,0|3,0,0]=4 835 B6R0.1 CCC(=O)CNC Amb32410106 [0,0,1,0,0,0|3,0,0]=4 836 B6R0.1 CCC(=O)COC Amb19515551 [0,0,1,0,0,0|2,0,0]=3 837 B6R0.1 CCC(=O)CSC Amb8393183 [0,0,1,0,0,0|2,1,0]=4 838 B6R0.1 CCC(=O)NC=N Amb28341185 [0,0,1,0,0,0|3,0,0]=4 839 B6R0.1 CCC(=O)NCO Amb27235623 [0,0,1,0,0,0|3,0,0]=4 840 B6R0.1 CCC(C)CON Amb25316087 [0,0,1,0,0,0|2,0,1]=4 841 B6R0.1 CCC(C)NOC Amb20668189 [0,0,1,0,0,0|2,0,1]=4 842 B6R0.1 CCC(N)CCN Amb3941697 [0,0,1,0,0,0|2,0,1]=4 843 B6R0.1 CCC(N)COC Amb33544938 [0,0,1,0,0,0|2,0,1]=4 844 B6R0.1 CCC(N)COC Amb3940014 [0,0,1,0,0,0|2,0,1]=4 845 B6R0.1 CCCC(=O)CBr Amb24433274 [0,0,1,0,0,0|3,0,0]=4 846 B6R0.1 CCCC(=O)CC Amb8513390 [0,0,1,0,0,0|3,0,0]=4 847 B6R0.1 CCCC(=O)CCl Amb19372924 [0,0,1,0,0,0|3,0,0]=4 848 B6R0.1 CCCC(=O)CI Amb27876205 [0,0,1,0,0,0|3,0,0]=4 849 B6R0.1 CCCC(=O)CN Amb17593086 [0,0,1,0,0,0|2,0,0]=3 850 B6R0.1 CCCC(=O)CN Amb28827644 [0,0,1,0,0,0|2,0,0]=3 851 B6R0.1 CCCC(=O)CO Amb25125092 [0,0,1,0,0,0|3,0,0]=4 852 B6R0.1 CCCC(=O)NN Amb6366352 [0,0,1,0,0,0|3,0,0]=4 853 B6R0.1 CCCC(C)C=O Amb3939898 [0,0,1,0,0,0|3,0,0]=4 854 B6R0.1 CCCC(Cl)C=O Amb18124277 [0,0,1,0,0,0|3,0,0]=4 855 B6R0.1 CCCN(N)C=O Amb18121867 [0,0,1,0,0,0|3,0,0]=4 856 B6R0.1 CCC[C@H](C)C=O Amb28248332 [0,0,1,0,0,0|3,0,0]=4 857 B6R0.1 CCC[C@H](F)C=O Amb27644096 [0,0,1,0,0,0|3,0,0]=4 858 B6R0.1 CCC[C@H](N)C=O Amb27488589 [0,0,1,0,0,0|2,0,0]=3 859 B6R0.1 CCNC(=N)CCl Amb27188662 [0,0,1,0,0,0|3,0,0]=4 860 B6R0.1 CCNC(=O)CBr Amb2090261 [0,0,1,0,0,0|2,0,0]=3 861 B6R0.1 CCNC(=O)CC Amb3886529 [0,0,1,0,0,0|2,0,0]=3 862 B6R0.1 CCNC(=O)CCl Amb1643925 [0,0,1,0,0,0|2,0,0]=3 863 B6R0.1 CCNC(=O)CF Amb28316230 [0,0,1,0,0,0|2,0,0]=3 864 B6R0.1 CCNC(=O)CI Amb23512617 [0,0,1,0,0,0|2,0,0]=3 865 B6R0.1 CCNC(=O)CN Amb21956656 [0,0,1,0,0,0|1,0,0]=2 866 B6R0.1 CCNC(=O)CN Amb426696 [0,0,1,0,0,0|1,0,0]=2 867 B6R0.1 CCNC(=O)CO Amb9421415 [0,0,1,0,0,0|2,0,0]=3 868 B6R0.1 CCNC(=O)NC Amb24120627 [0,0,1,0,0,0|3,0,0]=4 869 B6R0.1 CCNC(=O)NN Amb8854035 [0,0,1,0,0,0|2,0,0]=3 870 B6R0.1 CCNC(=O)NO Amb28345704 [0,0,1,0,0,0|3,0,0]=4 871 B6R0.1 CCNC(=O)OC Amb22734099 [0,0,1,0,0,0|3,0,0]=4 872 B6R0.1 CCNC(=S)NN Amb6364699 [0,0,1,0,0,0|2,1,0]=4 873 B6R0.1 CCN[C@H](C)CN Amb27163445 [0,0,1,0,0,0|2,0,1]=4 874 B6R0.1 CCOC(=N)CN Amb28422301 [0,0,1,0,0,0|3,0,0]=4 875 B6R0.1 CCOC(=O)CBr Amb2687783 [0,0,1,0,0,0|3,0,0]=4 876 B6R0.1 CCOC(=O)CC Amb8513446 [0,0,1,0,0,0|3,0,0]=4 877 B6R0.1 CCOC(=O)CCl Amb3941486 [0,0,1,0,0,0|3,0,0]=4 878 B6R0.1 CCOC(=O)CF Amb2687849 [0,0,1,0,0,0|3,0,0]=4 879 B6R0.1 CCOC(=O)CI Amb8514613 [0,0,1,0,0,0|3,0,0]=4 880 B6R0.1 CCOC(=O)CN Amb2697340 [0,0,1,0,0,0|2,0,0]=3 881 B6R0.1 CCOC(=O)CN Amb8513174 [0,0,1,0,0,0|2,0,0]=3 882 B6R0.1 CCOC(=O)CO Amb3939196 [0,0,1,0,0,0|3,0,0]=4 883 B6R0.1 CCOC(=O)CS Amb6608734 [0,0,1,0,0,0|3,0,0]=4 884 B6R0.1 CCOC(=O)C[NH3+] Amb24113741 [0,0,1,0,0,0|2,0,1]=4 885 B6R0.1 CCOC(=O)NN Amb2780496 [0,0,1,0,0,0|3,0,0]=4 886 B6R0.1 CCSC(=O)CC Amb22043397 [0,0,1,0,0,0|3,0,0]=4 887 B6R0.1 CC[C@@H](N)COC Amb22755736 [0,0,1,0,0,0|2,0,1]=4 888 B6R0.1 CC[C@@H](N)COC Amb24479069 [0,0,1,0,0,0|2,0,1]=4 889 B6R0.1 CC[C@H](N)COC Amb27601302 [0,0,1,0,0,0|2,0,1]=4 890 B6R0.1 CC[C@H](N)COC Amb33339278 [0,0,1,0,0,0|2,0,1]=4 891 B6R0.1 CNC(=O)COC Amb22275885 [0,0,1,0,0,0|3,0,0]=4 892 B6R0.1 CNC(=S)NOC Amb28316081 [0,0,1,0,0,0|2,1,0]=4 893 B6R0.1 CNCC(=O)CF Amb33377251 [0,0,1,0,0,0|3,0,0]=4 894 B6R0.1 CNCC(=O)NN Amb16186920 [0,0,1,0,0,0|3,0,0]=4 895 B6R0.1 CNCC(=O)NN Amb32667538 [0,0,1,0,0,0|3,0,0]=4 896 B6R0.1 CNNC(=O)NC Amb27461318 [0,0,1,0,0,0|3,0,0]=4 897 B6R0.1 CNNC(=O)OC Amb22411352 [0,0,1,0,0,0|3,0,0]=4 898 B6R0.1 COC(C)CON Amb18640476 [0,0,1,0,0,0|3,0,0]=4 899 B6R0.1 COCC(=O)CCl Amb24523799 [0,0,1,0,0,0|2,0,0]=3 900 B6R0.1 COCC(=O)CI Amb27414026 [0,0,1,0,0,0|2,0,0]=3 901 B6R0.1 COCC(=O)CN Amb18833134 [0,0,1,0,0,0|1,0,0]=2 902 B6R0.1 COCC(=O)NN Amb6548366 [0,0,1,0,0,0|2,0,0]=3 903 B6R0.1 COCC(=O)OC Amb8513624 [0,0,1,0,0,0|3,0,0]=4 904 B6R0.1 COCC(Br)CN Amb27600803 [0,0,1,0,0,0|2,0,1]=4 905 B6R0.1 COCC(C)C=O Amb33545315 [0,0,1,0,0,0|2,0,0]=3 906 B6R0.1 COCC(C)CN Amb33109763 [0,0,1,0,0,0|2,0,1]=4 907 B6R0.1 COCC(C)CN Amb9029115 [0,0,1,0,0,0|2,0,1]=4 908 B6R0.1 COCC(Cl)CN Amb28060609 [0,0,1,0,0,0|2,0,1]=4 909 B6R0.1 COCC(F)CN Amb25888441 [0,0,1,0,0,0|2,0,1]=4 910 B6R0.1 COCC(F)CN Amb33532421 [0,0,1,0,0,0|2,0,1]=4 911 B6R0.1 COCC(N)C#N Amb18957614 [0,0,1,0,0,0|2,0,1]=4 912 B6R0.1 COCC(N)C#N Amb28555341 [0,0,1,0,0,0|2,0,1]=4 913 B6R0.1 COCC(N)CN Amb24655567 [0,0,1,0,0,0|2,0,1]=4 914 B6R0.1 COCC(N)CO Amb28827629 [0,0,1,0,0,0|1,0,2]=4 915 B6R0.1 COCC(N)CO Amb8630413 [0,0,1,0,0,0|1,0,2]=4 916 B6R0.1 COCC(O)CN Amb2693569 [0,0,1,0,0,0|1,0,2]=4 917 B6R0.1 COCC(O)CN Amb9708595 [0,0,1,0,0,0|1,0,2]=4 918 B6R0.1 COCC(S)CN Amb29854739 [0,0,1,0,0,0|1,1,1]=4 919 B6R0.1 COC[C@@H](N)CF Amb35788510 [0,0,1,0,0,0|2,0,1]=4 920 B6R0.1 COC[C@@H](N)CF Amb35789440 [0,0,1,0,0,0|2,0,1]=4 921 B6R0.1 COC[C@@H](N)CO Amb31291244 [0,0,1,0,0,0|1,0,2]=4 922 B6R0.1 COC[C@@H](N)CO Amb8385867 [0,0,1,0,0,0|1,0,2]=4 923 B6R0.1 COC[C@@H](O)C=O Amb28132745 [0,0,1,0,0,0|2,0,0]=3 924 B6R0.1 COC[C@@H](O)CN Amb17933201 [0,0,1,0,0,0|1,0,2]=4 925 B6R0.1 COC[C@@H](O)CN Amb32992071 [0,0,1,0,0,0|1,0,2]=4 926 B6R0.1 COC[C@H](F)CN Amb27635916 [0,0,1,0,0,0|2,0,1]=4 927 B6R0.1 COC[C@H](N)CF Amb35789441 [0,0,1,0,0,0|2,0,1]=4 928 B6R0.1 COC[C@H](N)CF Amb35789446 [0,0,1,0,0,0|2,0,1]=4 929 B6R0.1 COC[C@H](N)CN Amb27790030 [0,0,1,0,0,0|2,0,1]=4 930 B6R0.1 COC[C@H](N)CO Amb26597391 [0,0,1,0,0,0|1,0,2]=4 931 B6R0.1 COC[C@H](O)C=O Amb27838256 [0,0,1,0,0,0|2,0,0]=3 932 B6R0.1 COC[C@H](O)CN Amb8630371 [0,0,1,0,0,0|1,0,2]=4 933 B6R0.1 CONC(=O)CCl Amb7969376 [0,0,1,0,0,0|1,0,0]=2 934 B6R0.1 CONC(=O)CN Amb20669419 [0,0,1,0,0,0|0,0,0]=1 935 B6R0.1 CONC(=O)CN Amb27398660 [0,0,1,0,0,0|0,0,0]=1 936 B6R0.1 CONC(=O)CO Amb28344874 [0,0,1,0,0,0|1,0,0]=2 937 B6R0.1 CO\C=C(/F)CO Amb22546782 [0,0,1,0,0,0|3,0,0]=4 938 B6R0.1 CO\N=C(/C)CCl Amb28254362 [0,0,1,0,0,0|2,0,1]=4 939 B6R0.1 CO\N=C(\C)CN Amb27795871 [0,0,1,0,0,0|1,0,1]=3 940 B6R0.1 CSCC(=O)CCl Amb25965373 [0,0,1,0,0,0|2,1,0]=4 941 B6R0.1 CSCC(=O)CN Amb33225415 [0,0,1,0,0,0|1,1,0]=3 942 B6R0.1 CSCC(=O)NN Amb22058723 [0,0,1,0,0,0|2,1,0]=4 943 B6R0.1 CSCC(C)C=O Amb20621025 [0,0,1,0,0,0|2,1,0]=4 944 B6R0.1 CSCC(O)C=O Amb27438538 [0,0,1,0,0,0|2,1,0]=4 945 B6R0.1 C[C@@H](C=O)CCO Amb27394744 [0,0,1,0,0,0|3,0,0]=4 946 B6R0.1 C[C@H](C=O)CCCl Amb28252660 [0,0,1,0,0,0|3,0,0]=4 947 B6R0.1 C[C@H](C=O)CCO Amb27260814 [0,0,1,0,0,0|3,0,0]=4 948 B6R0.1 C\C(=C/Cl)CON Amb27978306 [0,0,1,0,0,0|2,0,1]=4 949 B6R0.1 C\C=C\C(=O)CC Amb8517594 [0,0,1,0,0,0|3,0,0]=4 950 B6R0.1 C\C=C\C(=O)CCl Amb26438240 [0,0,1,0,0,0|3,0,0]=4 951 B6R0.1 C\C=C\C(=O)NN Amb25796185 [0,0,1,0,0,0|3,0,0]=4 952 B6R0.1 N#CCC(O)C=O Amb28370523 [0,0,1,0,0,0|2,0,1]=4 953 B6R0.1 N#CNC(=O)CBr Amb27763707 [0,0,1,0,0,0|3,0,0]=4 954 B6R0.1 N#CNC(=O)CCl Amb25921846 [0,0,1,0,0,0|3,0,0]=4 955 B6R0.1 N#CNC(=O)CN Amb27844586 [0,0,1,0,0,0|2,0,0]=3 956 B6R0.1 NC(C=O)CC=O Amb27872844 [0,0,1,0,0,0|2,0,0]=3 957 B6R0.1 NCC(=O)CCF Amb26604148 [0,0,1,0,0,0|3,0,0]=4 958 B6R0.1 NCC(=O)OCCl Amb27204265 [0,0,1,0,0,0|3,0,0]=4 959 B6R0.1 NCC(Cl)CON Amb27425127 [0,0,1,0,0,0|2,0,1]=4 960 B6R0.1 NCC(F)CON Amb25338207 [0,0,1,0,0,0|2,0,1]=4 961 B6R0.1 NCCC(=O)CN Amb18121893 [0,0,1,0,0,0|3,0,0]=4 962 B6R0.1 NCCC(N)CN Amb27440801 [0,0,1,0,0,0|2,0,1]=4 963 B6R0.1 NCCC(O)C=O Amb25682881 [0,0,1,0,0,0|2,0,0]=3 964 B6R0.1 NCC[C@@H](N)CN Amb27482131 [0,0,1,0,0,0|2,0,1]=4 965 B6R0.1 NNC(=O)CON Amb27956110 [0,0,1,0,0,0|3,0,0]=4 966 B6R0.1 NNC(=O)CON Amb32671494 [0,0,1,0,0,0|3,0,0]=4 967 B6R0.1 NOCC(O)CF Amb25263885 [0,0,1,0,0,0|2,0,1]=4 968 B6R0.1 NOCC(O)CO Amb24397160 [0,0,1,0,0,0|1,0,2]=4 969 B6R0.1 O=C(CBr)NCO Amb25286051 [0,0,1,0,0,0|3,0,0]=4 970 B6R0.1 O=C(CCl)NC#P Amb27409179 [0,0,1,0,0,0|3,0,0]=4 971 B6R0.1 O=C(CCl)NCO Amb1153096 [0,0,1,0,0,0|3,0,0]=4 972 B6R0.1 O=C(CF)NCO Amb27625787 [0,0,1,0,0,0|3,0,0]=4 973 B6R0.1 O=C(CO)NCO Amb27593459 [0,0,1,0,0,0|3,0,0]=4 974 B6R0.1 O=CC(Br)CCO Amb28206552 [0,0,1,0,0,0|3,0,0]=4 975 B6R0.1 O=CC(O)CCBr Amb27838276 [0,0,1,0,0,0|3,0,0]=4 976 B6R0.1 O=CC(O)CCO Amb27955546 [0,0,1,0,0,0|3,0,0]=4 977 B6R0.1 O=CCC(O)C=O Amb28071061 [0,0,1,0,0,0|3,0,0]=4 978 B6R0.1 O=C[C@H](O)CCBr Amb28399793 [0,0,1,0,0,0|3,0,0]=4 979 B6R0.3 C#CC(=O)C(C)N Amb28059314 [0,0,1,0,0,0|2,0,0]=3 980 B6R0.3 C#CC(=O)[C@@H](C)N Amb30024725 [0,0,1,0,0,0|2,0,0]=3 981 B6R0.3 C#CC(=O)[C@H](C)N Amb29849487 [0,0,1,0,0,0|2,0,0]=3 982 B6R0.3 C#CC(N)C(=O)O Amb28282694 [0,0,1,0,0,0|2,0,1]=4 983 B6R0.3 C=C(Br)C(C)CO Amb27757394 [0,0,1,0,0,0|3,0,0]=4 984 B6R0.3 C=C(C)C(=O)NC Amb17934099 [0,0,1,0,0,0|2,0,1]=4 985 B6R0.3 C=C(C)C(=O)NN Amb24432473 [0,0,1,0,0,0|2,0,1]=4 986 B6R0.3 C=C(C)C(Br)CO Amb25707965 [0,0,1,0,0,0|3,0,0]=4 987 B6R0.3 C=C(C)C(C)CO Amb24539367 [0,0,1,0,0,0|3,0,0]=4 988 B6R0.3 C=C(C)C(Cl)CO Amb27858700 [0,0,1,0,0,0|3,0,0]=4 989 B6R0.3 C=C(C)C(F)CO Amb28043434 [0,0,1,0,0,0|3,0,0]=4 990 B6R0.3 C=C(C)C(N)CO Amb26544297 [0,0,1,0,0,0|2,0,0]=3 991 B6R0.3 C=C(C)C(O)CO Amb23570510 [0,0,1,0,0,0|3,0,0]=4 992 B6R0.3 C=C(C)[C@@H](N)CO Amb25693320 [0,0,1,0,0,0|2,0,0]=3 993 B6R0.3 C=C(C)[C@H](C)CO Amb28350373 [0,0,1,0,0,0|3,0,0]=4 994 B6R0.3 C=C(C)[C@H](F)CO Amb27763892 [0,0,1,0,0,0|3,0,0]=4 995 B6R0.3 C=C(C)[C@H](N)CO Amb27174504 [0,0,1,0,0,0|2,0,0]=3 996 B6R0.3 C=C(CC)C(C)N Amb23536388 [0,0,1,0,0,0|3,0,0]=4 997 B6R0.3 C=C(CO)C(=O)O Amb18121817 [0,0,1,0,0,0|2,0,1]=4 998 B6R0.3 C=C(CO)C(C)=O Amb24571845 [0,0,1,0,0,0|2,0,1]=4 999 B6R0.3 C=C(Cl)C(Br)CO Amb27656944 [0,0,1,0,0,0|3,0,0]=4 1000 B6R0.3 C=CC(=O)C(C)C Amb24507596 [0,0,1,0,0,0|3,0,0]=4 1001 B6R0.3 C=CC(=O)C(C)O Amb27660466 [0,0,1,0,0,0|3,0,0]=4 1002 B6R0.3 C=CC(=O)[C@@H](C)N Amb30024726 [0,0,1,0,0,0|2,0,0]=3 1003 B6R0.3 C=CC(=O)[C@@H](C)O Amb27838249 [0,0,1,0,0,0|3,0,0]=4 1004 B6R0.3 C=CC(=O)[C@H](C)N Amb35617895 [0,0,1,0,0,0|2,0,0]=3 1005 B6R0.3 C=CC(C)C(N)=O Amb27167730 [0,0,1,0,0,0|2,0,1]=4 1006 B6R0.3 C=CC(N)C(=O)O Amb20240543 [0,0,1,0,0,0|2,0,1]=4 1007 B6R0.3 C=CC(O)C(N)=O Amb27391902 [0,0,1,0,0,0|2,0,1]=4 1008 B6R0.3 C=C[C@@H](N)C(=O)O Amb22756048 [0,0,1,0,0,0|2,0,1]=4 1009 B6R0.3 C=C[C@H](N)C(=O)O Amb2699113 [0,0,1,0,0,0|2,0,1]=4 1010 B6R0.3 C=C[C@H](O)C(N)=O Amb28282656 [0,0,1,0,0,0|2,0,1]=4 1011 B6R0.3 CC(=O)C(=N)NO Amb27433735 [0,0,1,0,0,0|2,0,1]=4 1012 B6R0.3 CC(=O)C(=O)NO Amb26477907 [0,0,1,0,0,0|1,0,1]=3 1013 B6R0.3 CC(=O)C(Br)CBr Amb27597612 [0,0,1,0,0,0|3,0,0]=4 1014 B6R0.3 CC(=O)C(C)CCl Amb26477594 [0,0,1,0,0,0|3,0,0]=4 1015 B6R0.3 CC(=O)C(C)CO Amb10844844 [0,0,1,0,0,0|2,0,0]=3 1016 B6R0.3 CC(=O)C(Cl)CCl Amb27257955 [0,0,1,0,0,0|3,0,0]=4 1017 B6R0.3 CC(=O)C(O)CO Amb26463044 [0,0,1,0,0,0|2,0,0]=3 1018 B6R0.3 CC(=O)C([Na])CN Amb28423432 [0,0,1,0,0,0|3,0,0]=4 1019 B6R0.3 CC(=O)N(C)CO Amb28191296 [0,0,1,0,0,0|3,0,0]=4 1020 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [0,0,1,0,0,0|2,0,0]=3 1021 B6R0.3 CC(=O)[C@H](N)CO Amb27451047 [0,0,1,0,0,0|1,0,0]=2 1022 B6R0.3 CC(Br)C(=O)CBr Amb27796264 [0,0,1,0,0,0|3,0,0]=4 1023 B6R0.3 CC(C)C(=N)NN Amb22411381 [0,0,1,0,0,0|3,0,0]=4 1024 B6R0.3 CC(C)C(=O)C#N Amb17231802 [0,0,1,0,0,0|3,0,0]=4 1025 B6R0.3 CC(C)C(=O)C=O Amb28050041 [0,0,1,0,0,0|2,0,1]=4 1026 B6R0.3 CC(C)C(=O)CBr Amb17594092 [0,0,1,0,0,0|3,0,0]=4 1027 B6R0.3 CC(C)C(=O)CCl Amb33545057 [0,0,1,0,0,0|3,0,0]=4 1028 B6R0.3 CC(C)C(=O)CI Amb27423490 [0,0,1,0,0,0|3,0,0]=4 1029 B6R0.3 CC(C)C(=O)CN Amb18639716 [0,0,1,0,0,0|3,0,0]=4 1030 B6R0.3 CC(C)C(=O)CN Amb19515068 [0,0,1,0,0,0|3,0,0]=4 1031 B6R0.3 CC(C)C(=O)CO Amb18061654 [0,0,1,0,0,0|2,0,0]=3 1032 B6R0.3 CC(C)C(=O)NN Amb6365574 [0,0,1,0,0,0|2,0,0]=3 1033 B6R0.3 CC(C)C(=O)NO Amb6279610 [0,0,1,0,0,0|1,0,0]=2 1034 B6R0.3 CC(C)C(=O)ON Amb28247467 [0,0,1,0,0,0|3,0,0]=4 1035 B6R0.3 CC(C)C(N)CO Amb3939350 [0,0,1,0,0,0|2,0,1]=4 1036 B6R0.3 CC(C)S(=O)NN Amb28195239 [0,0,1,0,0,0|3,0,0]=4 1037 B6R0.3 CC(C)[C@@H](C)NO Amb27641375 [0,0,1,0,0,0|2,0,1]=4 1038 B6R0.3 CC(C)[C@@H](N)CO Amb3939342 [0,0,1,0,0,0|2,0,1]=4 1039 B6R0.3 CC(C)[C@H](N)CO Amb2785298 [0,0,1,0,0,0|2,0,1]=4 1040 B6R0.3 CC(C)\C(Cl)=N\O Amb25345474 [0,0,1,0,0,0|2,0,1]=4 1041 B6R0.3 CC(C)\C(N)=N\O Amb2695033 [0,0,1,0,0,0|2,0,1]=4 1042 B6R0.3 CC(CBr)C(=O)O Amb22002601 [0,0,1,0,0,0|3,0,0]=4 1043 B6R0.3 CC(CCl)C(=O)O Amb18522181 [0,0,1,0,0,0|3,0,0]=4 1044 B6R0.3 CC(CF)C(=O)O Amb24432331 [0,0,1,0,0,0|3,0,0]=4 1045 B6R0.3 CC(CN)C(=N)N Amb28282121 [0,0,1,0,0,0|3,0,0]=4 1046 B6R0.3 CC(CN)C(=O)O Amb2699128 [0,0,1,0,0,0|3,0,0]=4 1047 B6R0.3 CC(CN)C(=O)O Amb6773978 [0,0,1,0,0,0|3,0,0]=4 1048 B6R0.3 CC(CN)C(=O)O Amb8631418 [0,0,1,0,0,0|3,0,0]=4 1049 B6R0.3 CC(CO)C(=O)O Amb8011522 [0,0,1,0,0,0|2,0,0]=3 1050 B6R0.3 CC(CO)C(N)=S Amb8869143 [0,0,1,0,0,0|1,1,0]=3 1051 B6R0.3 CC(CO)N(C)N Amb27883234 [0,0,1,0,0,0|3,0,0]=4 1052 B6R0.3 CC(CO)[N+](=O)[O-] Amb17600148 [0,0,1,0,0,0|3,0,0]=4 1053 B6R0.3 CC(Cl)C(=O)CCl Amb27146929 [0,0,1,0,0,0|3,0,0]=4 1054 B6R0.3 CC(Cl)C(=O)CO Amb27409066 [0,0,1,0,0,0|2,0,0]=3 1055 B6R0.3 CC(Cl)C(=O)NCl Amb28137961 [0,0,1,0,0,0|2,0,0]=3 1056 B6R0.3 CC(Cl)C(=O)NN Amb25087323 [0,0,1,0,0,0|2,0,0]=3 1057 B6R0.3 CC(Cl)C(=O)OF Amb27863393 [0,0,1,0,0,0|3,0,0]=4 1058 B6R0.3 CC(Cl)\C(N)=N/O Amb2696029 [0,0,1,0,0,0|2,0,1]=4 1059 B6R0.3 CC(N)C(=O)C#N Amb28075473 [0,0,1,0,0,0|2,0,0]=3 1060 B6R0.3 CC(N)C(=O)CCl Amb25867299 [0,0,1,0,0,0|2,0,0]=3 1061 B6R0.3 CC(N)C(=O)CCl Amb32662937 [0,0,1,0,0,0|2,0,0]=3 1062 B6R0.3 CC(N)C(=O)CF Amb27493214 [0,0,1,0,0,0|2,0,0]=3 1063 B6R0.3 CC(N)C(=O)N=S Amb27844643 [0,0,1,0,0,0|0,1,1]=3 1064 B6R0.3 CC(N)C(=O)NN Amb18061963 [0,0,1,0,0,0|1,0,0]=2 1065 B6R0.3 CC(N)C(=O)NO Amb33528158 [0,0,1,0,0,0|0,0,0]=1 1066 B6R0.3 CC(N)C(C)CO Amb18122199 [0,0,1,0,0,0|2,0,1]=4 1067 B6R0.3 CC(N)C(N)CO Amb27196655 [0,0,1,0,0,0|1,0,1]=3 1068 B6R0.3 CC(N)C(O)CO Amb24583121 [0,0,1,0,0,0|1,0,2]=4 1069 B6R0.3 CC(N)\C(N)=N\O Amb25144101 [0,0,1,0,0,0|1,0,1]=3 1070 B6R0.3 CC(N=O)C(N)=O Amb26600137 [0,0,1,0,0,0|2,0,1]=4 1071 B6R0.3 CC(O)C(=N)NO Amb19516866 [0,0,1,0,0,0|2,0,0]=3 1072 B6R0.3 CC(O)C(=O)C=O Amb28287297 [0,0,1,0,0,0|2,0,1]=4 1073 B6R0.3 CC(O)C(=O)CCl Amb27814891 [0,0,1,0,0,0|3,0,0]=4 1074 B6R0.3 CC(O)C(=O)NN Amb2720766 [0,0,1,0,0,0|2,0,0]=3 1075 B6R0.3 CC(O)C(=O)O[Na] Amb22051686 [0,0,1,0,0,0|3,0,0]=4 1076 B6R0.3 CC(O)C(C)NO Amb27772254 [0,0,1,0,0,0|2,0,1]=4 1077 B6R0.3 CC(O)C(N)CO Amb17593100 [0,0,1,0,0,0|1,0,2]=4 1078 B6R0.3 CC(O)C(N)CO Amb32666361 [0,0,1,0,0,0|1,0,2]=4 1079 B6R0.3 CC(O)[C@H](N)CO Amb28050579 [0,0,1,0,0,0|1,0,2]=4 1080 B6R0.3 CC(O)\C(N)=N\O Amb8384662 [0,0,1,0,0,0|2,0,1]=4 1081 B6R0.3 CC(ON)C(N)=O Amb28318742 [0,0,1,0,0,0|3,0,0]=4 1082 B6R0.3 CCC(=O)C(C)Br Amb6673862 [0,0,1,0,0,0|3,0,0]=4 1083 B6R0.3 CCC(=O)C(C)C Amb9024469 [0,0,1,0,0,0|3,0,0]=4 1084 B6R0.3 CCC(=O)C(C)Cl Amb24093630 [0,0,1,0,0,0|3,0,0]=4 1085 B6R0.3 CCC(=O)C(C)F Amb27838229 [0,0,1,0,0,0|3,0,0]=4 1086 B6R0.3 CCC(=O)C(C)N Amb17938952 [0,0,1,0,0,0|2,0,0]=3 1087 B6R0.3 CCC(=O)C(C)N Amb32410105 [0,0,1,0,0,0|2,0,0]=3 1088 B6R0.3 CCC(=O)C(C)O Amb24479536 [0,0,1,0,0,0|3,0,0]=4 1089 B6R0.3 CCC(=O)C(C)S Amb24323793 [0,0,1,0,0,0|3,0,0]=4 1090 B6R0.3 CCC(=O)C(N)=O Amb22011827 [0,0,1,0,0,0|2,0,1]=4 1091 B6R0.3 CCC(=O)N(C)N Amb25711736 [0,0,1,0,0,0|3,0,0]=4 1092 B6R0.3 CCC(=O)[C@@H](C)N Amb30024727 [0,0,1,0,0,0|2,0,0]=3 1093 B6R0.3 CCC(=O)[C@@H](C)O Amb27835613 [0,0,1,0,0,0|3,0,0]=4 1094 B6R0.3 CCC(=O)[C@H](C)N Amb35617896 [0,0,1,0,0,0|2,0,0]=3 1095 B6R0.3 CCC(=O)[C@H](C)O Amb28201619 [0,0,1,0,0,0|3,0,0]=4 1096 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [0,0,1,0,0,0|3,0,0]=4 1097 B6R0.3 CCC(Br)C(=O)Cl Amb17666758 [0,0,1,0,0,0|3,0,0]=4 1098 B6R0.3 CCC(Br)C(=O)O Amb5716858 [0,0,1,0,0,0|3,0,0]=4 1099 B6R0.3 CCC(Br)C(C)=O Amb24615269 [0,0,1,0,0,0|3,0,0]=4 1100 B6R0.3 CCC(Br)C(N)=O Amb13952819 [0,0,1,0,0,0|2,0,0]=3 1101 B6R0.3 CCC(C)C(=N)N Amb6740564 [0,0,1,0,0,0|3,0,0]=4 1102 B6R0.3 CCC(C)C(=N)N Amb8630181 [0,0,1,0,0,0|3,0,0]=4 1103 B6R0.3 CCC(C)C(=O)Cl Amb3939259 [0,0,1,0,0,0|3,0,0]=4 1104 B6R0.3 CCC(C)C(=O)O Amb9703224 [0,0,1,0,0,0|3,0,0]=4 1105 B6R0.3 CCC(C)C(C)=O Amb4605996 [0,0,1,0,0,0|3,0,0]=4 1106 B6R0.3 CCC(C)C(N)=O Amb33548100 [0,0,1,0,0,0|2,0,0]=3 1107 B6R0.3 CCC(C)C(N)=S Amb6740516 [0,0,1,0,0,0|2,1,0]=4 1108 B6R0.3 CCC(C)S(N)=O Amb32756501 [0,0,1,0,0,0|3,0,0]=4 1109 B6R0.3 CCC(Cl)C(=O)Br Amb28384077 [0,0,1,0,0,0|3,0,0]=4 1110 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [0,0,1,0,0,0|3,0,0]=4 1111 B6R0.3 CCC(Cl)C(=O)O Amb4017887 [0,0,1,0,0,0|3,0,0]=4 1112 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [0,0,1,0,0,0|3,0,0]=4 1113 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [0,0,1,0,0,0|2,0,0]=3 1114 B6R0.3 CCC(F)C(=N)N Amb32456109 [0,0,1,0,0,0|3,0,0]=4 1115 B6R0.3 CCC(F)C(=O)O Amb25716167 [0,0,1,0,0,0|3,0,0]=4 1116 B6R0.3 CCC(N)C(=O)Cl Amb17593240 [0,0,1,0,0,0|2,0,0]=3 1117 B6R0.3 CCC(N)C(=O)O Amb9729506 [0,0,1,0,0,0|2,0,0]=3 1118 B6R0.3 CCC(N)C(N)=O Amb1914080 [0,0,1,0,0,0|1,0,0]=2 1119 B6R0.3 CCC(N)C(N)=O Amb33528521 [0,0,1,0,0,0|1,0,0]=2 1120 B6R0.3 CCC(N)C(N)O Amb28348585 [0,0,1,0,0,0|1,0,2]=4 1121 B6R0.3 CCC(N)P(=O)=O Amb27786328 [0,0,1,0,0,0|3,0,0]=4 1122 B6R0.3 CCC(O)C(=N)N Amb33321504 [0,0,1,0,0,0|3,0,0]=4 1123 B6R0.3 CCC(O)C(=O)O Amb6609018 [0,0,1,0,0,0|3,0,0]=4 1124 B6R0.3 CCC(O)C(=O)[O-] Amb17943026 [0,0,1,0,0,0|3,0,0]=4 1125 B6R0.3 CCC(O)C(C)=O Amb25336501 [0,0,1,0,0,0|3,0,0]=4 1126 B6R0.3 CCC(O)C(N)=O Amb24116514 [0,0,1,0,0,0|2,0,0]=3 1127 B6R0.3 CCC(O)C(N)=S Amb23449332 [0,0,1,0,0,0|2,1,0]=4 1128 B6R0.3 CCC(S)C(=O)O Amb17501370 [0,0,1,0,0,0|3,0,0]=4 1129 B6R0.3 CCC(S)C(C)=O Amb8393170 [0,0,1,0,0,0|3,0,0]=4 1130 B6R0.3 CCN(N)C(=N)N Amb28207703 [0,0,1,0,0,0|3,0,0]=4 1131 B6R0.3 CCN(N)C(C)=O Amb18639976 [0,0,1,0,0,0|3,0,0]=4 1132 B6R0.3 CCN(N)C(N)=O Amb28184355 [0,0,1,0,0,0|2,0,0]=3 1133 B6R0.3 CC[C@@H](Br)C(=O)O Amb9785161 [0,0,1,0,0,0|3,0,0]=4 1134 B6R0.3 CC[C@@H](C)C(=O)O Amb8384578 [0,0,1,0,0,0|3,0,0]=4 1135 B6R0.3 CC[C@@H](C)C(C)=O Amb28283799 [0,0,1,0,0,0|3,0,0]=4 1136 B6R0.3 CC[C@@H](Cl)C(=O)Cl Amb27985877 [0,0,1,0,0,0|3,0,0]=4 1137 B6R0.3 CC[C@@H](Cl)C(=O)O Amb22800493 [0,0,1,0,0,0|3,0,0]=4 1138 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [0,0,1,0,0,0|2,0,0]=3 1139 B6R0.3 CC[C@@H](N)C(=O)O Amb16233349 [0,0,1,0,0,0|2,0,0]=3 1140 B6R0.3 CC[C@@H](N)C(=O)O Amb3940761 [0,0,1,0,0,0|2,0,0]=3 1141 B6R0.3 CC[C@@H](N)C(C)=O Amb35594875 [0,0,1,0,0,0|2,0,0]=3 1142 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [0,0,1,0,0,0|1,0,0]=2 1143 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [0,0,1,0,0,0|1,0,0]=2 1144 B6R0.3 CC[C@@H](O)C(=O)O Amb22369401 [0,0,1,0,0,0|3,0,0]=4 1145 B6R0.3 CC[C@@H](O)C(N)=O Amb27792606 [0,0,1,0,0,0|2,0,0]=3 1146 B6R0.3 CC[C@H](Br)C(=O)O Amb20242441 [0,0,1,0,0,0|3,0,0]=4 1147 B6R0.3 CC[C@H](C)C(=O)Cl Amb26463969 [0,0,1,0,0,0|3,0,0]=4 1148 B6R0.3 CC[C@H](C)C(=O)O Amb8514667 [0,0,1,0,0,0|3,0,0]=4 1149 B6R0.3 CC[C@H](C)C(N)=O Amb27440802 [0,0,1,0,0,0|2,0,0]=3 1150 B6R0.3 CC[C@H](Cl)C(=O)O Amb25190040 [0,0,1,0,0,0|3,0,0]=4 1151 B6R0.3 CC[C@H](N)C(=O)O Amb2694208 [0,0,1,0,0,0|2,0,0]=3 1152 B6R0.3 CC[C@H](N)C(=O)O Amb8631089 [0,0,1,0,0,0|2,0,0]=3 1153 B6R0.3 CC[C@H](N)C(C)=O Amb29849605 [0,0,1,0,0,0|2,0,0]=3 1154 B6R0.3 CC[C@H](N)C(N)=O Amb8387112 [0,0,1,0,0,0|1,0,0]=2 1155 B6R0.3 CC[C@H](N)C(N)=O Amb8395789 [0,0,1,0,0,0|1,0,0]=2 1156 B6R0.3 CC[C@H](O)C(=O)O Amb4166324 [0,0,1,0,0,0|3,0,0]=4 1157 B6R0.3 CC[C@H](S)C(=O)O Amb9785162 [0,0,1,0,0,0|3,0,0]=4 1158 B6R0.3 CN(C)C(=O)CO Amb9421414 [0,0,1,0,0,0|3,0,0]=4 1159 B6R0.3 CN(C)C(=O)NN Amb8854108 [0,0,1,0,0,0|3,0,0]=4 1160 B6R0.3 CN(C)C(=O)NO Amb32667951 [0,0,1,0,0,0|2,0,0]=3 1161 B6R0.3 CN(C)C(N)CO Amb28399614 [0,0,1,0,0,0|3,0,0]=4 1162 B6R0.3 CN(N)C(=O)NO Amb28239328 [0,0,1,0,0,0|1,0,0]=2 1163 B6R0.3 CN(O)C(=O)NN Amb27831015 [0,0,1,0,0,0|3,0,0]=4 1164 B6R0.3 CNC(=N)C(C)C Amb27254368 [0,0,1,0,0,0|3,0,0]=4 1165 B6R0.3 CNC(=O)C(C)=O Amb17399787 [0,0,1,0,0,0|2,0,1]=4 1166 B6R0.3 CNC(=O)C(C)Br Amb33544599 [0,0,1,0,0,0|2,0,0]=3 1167 B6R0.3 CNC(=O)C(C)C Amb3886530 [0,0,1,0,0,0|2,0,0]=3 1168 B6R0.3 CNC(=O)C(C)Cl Amb9745747 [0,0,1,0,0,0|2,0,0]=3 1169 B6R0.3 CNC(=O)C(C)N Amb21958662 [0,0,1,0,0,0|1,0,0]=2 1170 B6R0.3 CNC(=O)C(C)N Amb9718190 [0,0,1,0,0,0|1,0,0]=2 1171 B6R0.3 CNC(=O)C(C)O Amb9421389 [0,0,1,0,0,0|2,0,0]=3 1172 B6R0.3 CNC(=O)C(Cl)Cl Amb3886571 [0,0,1,0,0,0|3,0,0]=4 1173 B6R0.3 CNC(=O)C(F)Br Amb10840460 [0,0,1,0,0,0|3,0,0]=4 1174 B6R0.3 CNC(=O)C(F)Cl Amb10840462 [0,0,1,0,0,0|3,0,0]=4 1175 B6R0.3 CNC(=O)C(F)I Amb10840465 [0,0,1,0,0,0|3,0,0]=4 1176 B6R0.3 CNC(=O)C(N)=S Amb27866513 [0,0,1,0,0,0|2,0,1]=4 1177 B6R0.3 CNC(=O)N(C)C Amb4020935 [0,0,1,0,0,0|3,0,0]=4 1178 B6R0.3 CNC(=O)N(C)Cl Amb27655891 [0,0,1,0,0,0|3,0,0]=4 1179 B6R0.3 CNC(=O)N(C)O Amb27169733 [0,0,1,0,0,0|3,0,0]=4 1180 B6R0.3 CNC(=O)[C@@H](C)N Amb18538471 [0,0,1,0,0,0|1,0,0]=2 1181 B6R0.3 CNC(=O)[C@@H](C)N Amb22744991 [0,0,1,0,0,0|1,0,0]=2 1182 B6R0.3 CNC(=O)[C@@H](C)O Amb27206795 [0,0,1,0,0,0|2,0,0]=3 1183 B6R0.3 CNC(=O)[C@H](C)N Amb10606813 [0,0,1,0,0,0|1,0,0]=2 1184 B6R0.3 CNC(=O)[C@H](C)N Amb10876424 [0,0,1,0,0,0|1,0,0]=2 1185 B6R0.3 CNC(=O)[C@H](C)O Amb27458528 [0,0,1,0,0,0|2,0,0]=3 1186 B6R0.3 CNC(=S)N(C)N Amb22497916 [0,0,1,0,0,0|2,1,0]=4 1187 B6R0.3 CNC(=S)N(C)N Amb32663561 [0,0,1,0,0,0|2,1,0]=4 1188 B6R0.3 CNC(C)C(C)N Amb27214909 [0,0,1,0,0,0|2,0,1]=4 1189 B6R0.3 CNC(C)C(N)=O Amb33527202 [0,0,1,0,0,0|3,0,0]=4 1190 B6R0.3 CNC(C)C(N)=O Amb7758120 [0,0,1,0,0,0|3,0,0]=4 1191 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [0,0,1,0,0,0|3,0,0]=4 1192 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [0,0,1,0,0,0|3,0,0]=4 1193 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [0,0,1,0,0,0|3,0,0]=4 1194 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [0,0,1,0,0,0|3,0,0]=4 1195 B6R0.3 COC(=O)C(C)Br Amb3939969 [0,0,1,0,0,0|3,0,0]=4 1196 B6R0.3 COC(=O)C(C)C Amb8513617 [0,0,1,0,0,0|3,0,0]=4 1197 B6R0.3 COC(=O)C(C)Cl Amb9702790 [0,0,1,0,0,0|3,0,0]=4 1198 B6R0.3 COC(=O)C(C)F Amb20671153 [0,0,1,0,0,0|3,0,0]=4 1199 B6R0.3 COC(=O)C(C)N Amb22492644 [0,0,1,0,0,0|2,0,0]=3 1200 B6R0.3 COC(=O)C(C)N Amb2684294 [0,0,1,0,0,0|2,0,0]=3 1201 B6R0.3 COC(=O)C(C)N Amb399617 [0,0,1,0,0,0|2,0,0]=3 1202 B6R0.3 COC(=O)C(C)O Amb8516704 [0,0,1,0,0,0|3,0,0]=4 1203 B6R0.3 COC(=O)C(C)S Amb19372611 [0,0,1,0,0,0|3,0,0]=4 1204 B6R0.3 COC(=O)N(C)N Amb16186697 [0,0,1,0,0,0|3,0,0]=4 1205 B6R0.3 COC(=O)[C@@H](C)Br Amb24711299 [0,0,1,0,0,0|3,0,0]=4 1206 B6R0.3 COC(=O)[C@@H](C)Cl Amb3941680 [0,0,1,0,0,0|3,0,0]=4 1207 B6R0.3 COC(=O)[C@@H](C)N Amb2778753 [0,0,1,0,0,0|2,0,0]=3 1208 B6R0.3 COC(=O)[C@@H](C)N Amb3940039 [0,0,1,0,0,0|2,0,0]=3 1209 B6R0.3 COC(=O)[C@@H](C)O Amb3939701 [0,0,1,0,0,0|3,0,0]=4 1210 B6R0.3 COC(=O)[C@H](C)Br Amb27836311 [0,0,1,0,0,0|3,0,0]=4 1211 B6R0.3 COC(=O)[C@H](C)Cl Amb3940748 [0,0,1,0,0,0|3,0,0]=4 1212 B6R0.3 COC(=O)[C@H](C)N Amb533664 [0,0,1,0,0,0|2,0,0]=3 1213 B6R0.3 COC(=O)[C@H](C)N Amb9825569 [0,0,1,0,0,0|2,0,0]=3 1214 B6R0.3 COC(=O)[C@H](C)O Amb3939672 [0,0,1,0,0,0|3,0,0]=4 1215 B6R0.3 COC(C)C(N)=O Amb6541307 [0,0,1,0,0,0|3,0,0]=4 1216 B6R0.3 CO[C@@H](C)C(N)=O Amb8515768 [0,0,1,0,0,0|3,0,0]=4 1217 B6R0.3 CO[C@H](C)C(N)=O Amb17617080 [0,0,1,0,0,0|3,0,0]=4 1218 B6R0.3 CSC(=O)C(C)C Amb25290392 [0,0,1,0,0,0|3,0,0]=4 1219 B6R0.3 CSC(C)C(N)=O Amb28047863 [0,0,1,0,0,0|3,0,0]=4 1220 B6R0.3 CSC(N)C(=O)O Amb28383509 [0,0,1,0,0,0|3,0,0]=4 1221 B6R0.3 C[C@@H](CF)C(=O)O Amb33743265 [0,0,1,0,0,0|3,0,0]=4 1222 B6R0.3 C[C@@H](CI)C(=O)O Amb28322539 [0,0,1,0,0,0|3,0,0]=4 1223 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [0,0,1,0,0,0|3,0,0]=4 1224 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [0,0,1,0,0,0|3,0,0]=4 1225 B6R0.3 C[C@@H](CO)C(=O)O Amb10844567 [0,0,1,0,0,0|2,0,0]=3 1226 B6R0.3 C[C@@H](CO)C(N)=O Amb27254152 [0,0,1,0,0,0|1,0,0]=2 1227 B6R0.3 C[C@@H](N)C(=O)CCl Amb30868150 [0,0,1,0,0,0|2,0,0]=3 1228 B6R0.3 C[C@@H](N)C(=O)CO Amb27751438 [0,0,1,0,0,0|1,0,0]=2 1229 B6R0.3 C[C@@H](N)C(=O)NO Amb26878662 [0,0,1,0,0,0|0,0,0]=1 1230 B6R0.3 C[C@@H](O)C(=N)NO Amb22587591 [0,0,1,0,0,0|2,0,0]=3 1231 B6R0.3 C[C@@H](O)[C@@H](N)CO Amb4493367 [0,0,1,0,0,0|1,0,2]=4 1232 B6R0.3 C[C@@H](O)[C@H](N)CO Amb32661654 [0,0,1,0,0,0|1,0,2]=4 1233 B6R0.3 C[C@@H](O)[C@H](N)CO Amb4489737 [0,0,1,0,0,0|1,0,2]=4 1234 B6R0.3 C[C@H](CBr)C(=O)O Amb27975404 [0,0,1,0,0,0|3,0,0]=4 1235 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [0,0,1,0,0,0|3,0,0]=4 1236 B6R0.3 C[C@H](CF)C(=O)O Amb33727262 [0,0,1,0,0,0|3,0,0]=4 1237 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [0,0,1,0,0,0|3,0,0]=4 1238 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [0,0,1,0,0,0|3,0,0]=4 1239 B6R0.3 C[C@H](CO)C(=O)O Amb10844554 [0,0,1,0,0,0|2,0,0]=3 1240 B6R0.3 C[C@H](N)C(=O)N=S Amb27786327 [0,0,1,0,0,0|0,1,1]=3 1241 B6R0.3 C[C@H](N)C(=O)NO Amb27978100 [0,0,1,0,0,0|0,0,0]=1 1242 B6R0.3 C[C@H](O)C(=N)NO Amb22587550 [0,0,1,0,0,0|2,0,0]=3 1243 B6R0.3 C[C@H](O)C(=O)CO Amb27838238 [0,0,1,0,0,0|2,0,0]=3 1244 B6R0.3 C[C@H](O)[C@@H](N)CO Amb8516107 [0,0,1,0,0,0|1,0,2]=4 1245 B6R0.3 C[C@H](O)[C@H](N)CO Amb24479858 [0,0,1,0,0,0|1,0,2]=4 1246 B6R0.3 C\C(=N/O)C(C)C Amb24529673 [0,0,1,0,0,0|2,0,1]=4 1247 B6R0.3 C\C(=N\O)C(C)C Amb7969593 [0,0,1,0,0,0|2,0,1]=4 1248 B6R0.3 N#CC(Br)C(N)=O Amb9201659 [0,0,1,0,0,0|2,0,1]=4 1249 B6R0.3 N#CC(I)C(N)=O Amb27838205 [0,0,1,0,0,0|2,0,1]=4 1250 B6R0.3 N#CC(N)C(=O)O Amb25328320 [0,0,1,0,0,0|2,0,1]=4 1251 B6R0.3 N#CC(N)C(N)=O Amb33544806 [0,0,1,0,0,0|1,0,1]=3 1252 B6R0.3 N#CC([Na])C(N)=O Amb27596629 [0,0,1,0,0,0|2,0,1]=4 1253 B6R0.3 NC(=O)C(Br)CBr Amb8390579 [0,0,1,0,0,0|2,0,0]=3 1254 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [0,0,1,0,0,0|2,0,0]=3 1255 B6R0.3 NC(=O)C(N)=S=O Amb28314240 [0,0,1,0,0,0|1,0,2]=4 1256 B6R0.3 NC(=O)C(N)CO Amb17593097 [0,0,1,0,0,0|0,0,0]=1 1257 B6R0.3 NC(=O)C(N)CO Amb2720301 [0,0,1,0,0,0|0,0,0]=1 1258 B6R0.3 NC(=O)C(N)CS Amb18641990 [0,0,1,0,0,0|0,1,0]=2 1259 B6R0.3 NC(=O)C(N)CS Amb33330875 [0,0,1,0,0,0|0,1,0]=2 1260 B6R0.3 NC(=O)C(O)CO Amb27169520 [0,0,1,0,0,0|1,0,0]=2 1261 B6R0.3 NC(=O)N(S)CO Amb27249862 [0,0,1,0,0,0|2,0,0]=3 1262 B6R0.3 NC(=O)[C@@H](N)CO Amb6336612 [0,0,1,0,0,0|0,0,0]=1 1263 B6R0.3 NC(=O)[C@@H](N)CO Amb8387630 [0,0,1,0,0,0|0,0,0]=1 1264 B6R0.3 NC(=O)[C@@H](N)CS Amb23437751 [0,0,1,0,0,0|0,1,0]=2 1265 B6R0.3 NC(=O)[C@@H](O)CO Amb27816733 [0,0,1,0,0,0|1,0,0]=2 1266 B6R0.3 NC(=O)[C@H](N)CO Amb22886957 [0,0,1,0,0,0|0,0,0]=1 1267 B6R0.3 NC(=O)[C@H](N)CO Amb26505098 [0,0,1,0,0,0|0,0,0]=1 1268 B6R0.3 NC(=O)\C(N)=N\O Amb16186552 [0,0,1,0,0,0|1,0,1]=3 1269 B6R0.3 NC(=S)\C(N)=N\O Amb9682648 [0,0,1,0,0,0|1,1,1]=4 1270 B6R0.3 NC(CCl)C(=O)O Amb19651457 [0,0,1,0,0,0|2,0,0]=3 1271 B6R0.3 NC(CCl)C(=O)O Amb21961077 [0,0,1,0,0,0|2,0,0]=3 1272 B6R0.3 NC(CF)C(=O)O Amb10839589 [0,0,1,0,0,0|2,0,0]=3 1273 B6R0.3 NC(CO)C(=O)O Amb9702805 [0,0,1,0,0,0|1,0,0]=2 1274 B6R0.3 NC(CO)C(F)F Amb27250856 [0,0,1,0,0,0|2,0,1]=4 1275 B6R0.3 NC(CO)P(O)O Amb27953933 [0,0,1,0,0,0|2,0,1]=4 1276 B6R0.3 NC(CP)C(=O)O Amb27234251 [0,0,1,0,0,0|2,0,0]=3 1277 B6R0.3 NC(CS)C(=O)Cl Amb28050358 [0,0,1,0,0,0|1,1,0]=3 1278 B6R0.3 NC(CS)C(=O)O Amb13961966 [0,0,1,0,0,0|1,1,0]=3 1279 B6R0.3 NC(CS)C(=O)O Amb22489523 [0,0,1,0,0,0|1,1,0]=3 1280 B6R0.3 NC(CS)C(=O)O Amb6537913 [0,0,1,0,0,0|1,1,0]=3 1281 B6R0.3 NC(CS)C(=O)O Amb6537914 [0,0,1,0,0,0|1,1,0]=3 1282 B6R0.3 NC(CS)C(=O)S Amb27838279 [0,0,1,0,0,0|1,1,0]=3 1283 B6R0.3 NC(CS)S(=O)O Amb27238568 [0,0,1,0,0,0|2,1,0]=4 1284 B6R0.3 NC(C[NH3+])C(=O)O Amb4004471 [0,0,1,0,0,0|2,0,0]=3 1285 B6R0.3 NCC(Br)C(=O)O Amb28385732 [0,0,1,0,0,0|3,0,0]=4 1286 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [0,0,1,0,0,0|3,0,0]=4 1287 B6R0.3 NCC(F)C(=O)O Amb22733051 [0,0,1,0,0,0|3,0,0]=4 1288 B6R0.3 NCC(F)C(=O)O Amb2688010 [0,0,1,0,0,0|3,0,0]=4 1289 B6R0.3 NCC(F)C(N)=O Amb26984913 [0,0,1,0,0,0|2,0,0]=3 1290 B6R0.3 NCC(F)C(N)=O Amb32667436 [0,0,1,0,0,0|2,0,0]=3 1291 B6R0.3 NCC(N)C(=O)O Amb22899095 [0,0,1,0,0,0|2,0,0]=3 1292 B6R0.3 NCC(N)C(=O)O Amb2697095 [0,0,1,0,0,0|2,0,0]=3 1293 B6R0.3 NCC(N)C(=O)O Amb8514284 [0,0,1,0,0,0|2,0,0]=3 1294 B6R0.3 NCC(O)C(=O)O Amb8517492 [0,0,1,0,0,0|3,0,0]=4 1295 B6R0.3 NCC(O)C(N)=O Amb27164291 [0,0,1,0,0,0|2,0,0]=3 1296 B6R0.3 NCC(O)C(N)=O Amb28827639 [0,0,1,0,0,0|2,0,0]=3 1297 B6R0.3 NCC(S)C(=O)O Amb17593238 [0,0,1,0,0,0|3,0,0]=4 1298 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [0,0,1,0,0,0|3,0,0]=4 1299 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [0,0,1,0,0,0|3,0,0]=4 1300 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [0,0,1,0,0,0|2,0,0]=3 1301 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [0,0,1,0,0,0|2,0,0]=3 1302 B6R0.3 NC[C@@H](N)C(N)=O Amb27981260 [0,0,1,0,0,0|1,0,0]=2 1303 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [0,0,1,0,0,0|3,0,0]=4 1304 B6R0.3 NC[C@@H](O)C(N)=O Amb28282144 [0,0,1,0,0,0|2,0,0]=3 1305 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [0,0,1,0,0,0|3,0,0]=4 1306 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [0,0,1,0,0,0|3,0,0]=4 1307 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [0,0,1,0,0,0|2,0,0]=3 1308 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [0,0,1,0,0,0|2,0,0]=3 1309 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [0,0,1,0,0,0|2,0,0]=3 1310 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [0,0,1,0,0,0|3,0,0]=4 1311 B6R0.3 NC[C@H](O)C(N)=O Amb32645211 [0,0,1,0,0,0|2,0,0]=3 1312 B6R0.3 NNC(=O)C(Cl)Cl Amb25227528 [0,0,1,0,0,0|3,0,0]=4 1313 B6R0.3 NNC(=O)C(F)F Amb27164833 [0,0,1,0,0,0|3,0,0]=4 1314 B6R0.3 NNC(=O)C(N)=O Amb6608760 [0,0,1,0,0,0|2,0,1]=4 1315 B6R0.3 NNC(=O)C(N)=S Amb27468151 [0,0,1,0,0,0|2,0,1]=4 1316 B6R0.3 NOC(=O)C(N)O Amb27447198 [0,0,1,0,0,0|3,0,0]=4 1317 B6R0.3 NS(=O)C(Cl)CCl Amb32720412 [0,0,1,0,0,0|3,0,0]=4 1318 B6R0.3 N[C@@H](C=S)C(=O)O Amb27838199 [0,0,1,0,0,0|1,1,1]=4 1319 B6R0.3 N[C@@H](CBr)C(=O)O Amb27188433 [0,0,1,0,0,0|2,0,0]=3 1320 B6R0.3 N[C@@H](CCl)C(=O)O Amb22232860 [0,0,1,0,0,0|2,0,0]=3 1321 B6R0.3 N[C@@H](CCl)C(=O)O Amb8515277 [0,0,1,0,0,0|2,0,0]=3 1322 B6R0.3 N[C@@H](CO)C(=O)O Amb22351170 [0,0,1,0,0,0|1,0,0]=2 1323 B6R0.3 N[C@@H](CO)C(=O)O Amb8387621 [0,0,1,0,0,0|1,0,0]=2 1324 B6R0.3 N[C@@H](CO)C(F)F Amb27202123 [0,0,1,0,0,0|2,0,1]=4 1325 B6R0.3 N[C@@H](CS)C(=O)O Amb3940755 [0,0,1,0,0,0|1,1,0]=3 1326 B6R0.3 N[C@@H](CS)C(=O)O Amb8385453 [0,0,1,0,0,0|1,1,0]=3 1327 B6R0.3 N[C@@H](CS)C(=O)O Amb9826090 [0,0,1,0,0,0|1,1,0]=3 1328 B6R0.3 N[C@@H](CS)S(=O)O Amb27391675 [0,0,1,0,0,0|2,1,0]=4 1329 B6R0.3 N[C@@H](C[SeH])C(=O)O Amb31031035 [0,0,1,0,0,0|1,1,0]=3 1330 B6R0.3 N[C@H](CCl)C(=O)Cl Amb28143184 [0,0,1,0,0,0|2,0,0]=3 1331 B6R0.3 N[C@H](CCl)C(=O)O Amb2699111 [0,0,1,0,0,0|2,0,0]=3 1332 B6R0.3 N[C@H](CCl)C(=O)O Amb9813688 [0,0,1,0,0,0|2,0,0]=3 1333 B6R0.3 N[C@H](CO)C(=O)Cl Amb28058341 [0,0,1,0,0,0|1,0,0]=2 1334 B6R0.3 N[C@H](CO)C(=O)O Amb2690463 [0,0,1,0,0,0|1,0,0]=2 1335 B6R0.3 N[C@H](CO)C(F)F Amb33337773 [0,0,1,0,0,0|2,0,1]=4 1336 B6R0.3 N[C@H](CS)C(=O)Cl Amb27166396 [0,0,1,0,0,0|1,1,0]=3 1337 B6R0.3 N[C@H](CS)C(=O)O Amb17942912 [0,0,1,0,0,0|1,1,0]=3 1338 B6R0.3 N[C@H](CS)C(=O)O Amb8394603 [0,0,1,0,0,0|1,1,0]=3 1339 B6R0.3 N[C@H](CS)C(=O)O Amb8628479 [0,0,1,0,0,0|1,1,0]=3 1340 B6R0.3 N\C(=N/O)C(=O)O Amb24670890 [0,0,1,0,0,0|2,0,1]=4 1341 B6R0.3 O=C(CO)C(F)F Amb32677822 [0,0,1,0,0,0|3,0,0]=4 1342 B6R0.3 O=C(Cl)C(Br)CBr Amb3940235 [0,0,1,0,0,0|3,0,0]=4 1343 B6R0.3 O=C(Cl)C(Br)CCl Amb28198806 [0,0,1,0,0,0|3,0,0]=4 1344 B6R0.3 O=C(Cl)C(Br)CF Amb28129447 [0,0,1,0,0,0|3,0,0]=4 1345 B6R0.3 O=C(Cl)C(Cl)CCl Amb3940236 [0,0,1,0,0,0|3,0,0]=4 1346 B6R0.3 O=C(NCl)C(Cl)Cl Amb27865479 [0,0,1,0,0,0|3,0,0]=4 1347 B6R0.3 O=C(NO)C(F)F Amb27219370 [0,0,1,0,0,0|2,0,0]=3 1348 B6R0.3 O=C(O)C(=O)CO Amb6600025 [0,0,1,0,0,0|2,0,1]=4 1349 B6R0.3 O=C(O)C(Br)CBr Amb8513574 [0,0,1,0,0,0|3,0,0]=4 1350 B6R0.3 O=C(O)C(Br)CF Amb10605519 [0,0,1,0,0,0|3,0,0]=4 1351 B6R0.3 O=C(O)C(Br)CO Amb18126327 [0,0,1,0,0,0|2,0,0]=3 1352 B6R0.3 O=C(O)C(Cl)CCl Amb22228245 [0,0,1,0,0,0|3,0,0]=4 1353 B6R0.3 O=C(O)C(Cl)CO Amb18124304 [0,0,1,0,0,0|2,0,0]=3 1354 B6R0.3 O=C(O)C(Cl)CS Amb18643661 [0,0,1,0,0,0|2,1,0]=4 1355 B6R0.3 O=C(O)C(F)CO Amb17593117 [0,0,1,0,0,0|2,0,0]=3 1356 B6R0.3 O=C(O)C(O)CBr Amb24061932 [0,0,1,0,0,0|3,0,0]=4 1357 B6R0.3 O=C(O)C(O)CCl Amb6371692 [0,0,1,0,0,0|3,0,0]=4 1358 B6R0.3 O=C(O)C(O)CF Amb27476477 [0,0,1,0,0,0|3,0,0]=4 1359 B6R0.3 O=C(O)C(O)CO Amb17593103 [0,0,1,0,0,0|2,0,0]=3 1360 B6R0.3 O=C(O)C(O)CS Amb18642053 [0,0,1,0,0,0|2,1,0]=4 1361 B6R0.3 O=C(O)C(S)CS Amb18643295 [0,0,1,0,0,0|2,1,0]=4 1362 B6R0.3 O=C(O)[C@@H](Br)CO Amb10601700 [0,0,1,0,0,0|2,0,0]=3 1363 B6R0.3 O=C(O)[C@@H](Cl)CO Amb27968485 [0,0,1,0,0,0|2,0,0]=3 1364 B6R0.3 O=C(O)[C@@H](O)CBr Amb27858794 [0,0,1,0,0,0|3,0,0]=4 1365 B6R0.3 O=C(O)[C@@H](O)CCl Amb22225325 [0,0,1,0,0,0|3,0,0]=4 1366 B6R0.3 O=C(O)[C@@H](O)CF Amb24117272 [0,0,1,0,0,0|3,0,0]=4 1367 B6R0.3 O=C(O)[C@@H](O)CO Amb22226732 [0,0,1,0,0,0|2,0,0]=3 1368 B6R0.3 O=C(O)[C@H](Cl)CO Amb27759746 [0,0,1,0,0,0|2,0,0]=3 1369 B6R0.3 O=C(O)[C@H](O)CBr Amb28137021 [0,0,1,0,0,0|3,0,0]=4 1370 B6R0.3 O=C(O)[C@H](O)CF Amb27467272 [0,0,1,0,0,0|3,0,0]=4 1371 B6R0.3 O=C(O)[C@H](O)CO Amb4166319 [0,0,1,0,0,0|2,0,0]=3 1372 B6R0.3 O=[N+]([O-])C(Br)CO Amb24479795 [0,0,1,0,0,0|3,0,0]=4 1373 B6R0.6 C#CCCNC=O Amb27447032 [0,0,1,0,0,0|2,0,1]=4 1374 B6R0.6 C#CCOCCN Amb18976416 [0,0,1,0,0,0|2,0,1]=4 1375 B6R0.6 C#CCOCCN Amb32718823 [0,0,1,0,0,0|2,0,1]=4 1376 B6R0.6 C=CCCCCN Amb18639514 [0,0,1,0,0,0|3,0,0]=4 1377 B6R0.6 C=CCNCCN Amb17091015 [0,0,1,0,0,0|3,0,0]=4 1378 B6R0.6 C=CCOCC=O Amb27402231 [0,0,1,0,0,0|2,0,1]=4 1379 B6R0.6 C=CCOCCBr Amb33531510 [0,0,1,0,0,0|3,0,0]=4 1380 B6R0.6 C=CCOCCC Amb3940491 [0,0,1,0,0,0|3,0,0]=4 1381 B6R0.6 C=CCOCCCl Amb2696085 [0,0,1,0,0,0|3,0,0]=4 1382 B6R0.6 C=CCOCCI Amb24739964 [0,0,1,0,0,0|3,0,0]=4 1383 B6R0.6 C=CCOCCN Amb32667523 [0,0,1,0,0,0|2,0,0]=3 1384 B6R0.6 C=CCOCCN Amb33530047 [0,0,1,0,0,0|2,0,0]=3 1385 B6R0.6 C=CCOCCO Amb3940609 [0,0,1,0,0,0|3,0,0]=4 1386 B6R0.6 C=CCSCCN Amb13951462 [0,0,1,0,0,0|2,1,0]=4 1387 B6R0.6 C=CCSCCN Amb6273787 [0,0,1,0,0,0|2,1,0]=4 1388 B6R0.6 C=COCCCN Amb3997182 [0,0,1,0,0,0|3,0,0]=4 1389 B6R0.6 C=CSCCCN Amb27800121 [0,0,1,0,0,0|3,0,0]=4 1390 B6R0.6 C=C\C=C\CCN Amb18639048 [0,0,1,0,0,0|3,0,0]=4 1391 B6R0.6 C=C\C=C\CCN Amb32679368 [0,0,1,0,0,0|3,0,0]=4 1392 B6R0.6 CCCC#CC=O Amb27244852 [0,0,1,0,0,0|3,0,0]=4 1393 B6R0.6 CCCCCC=O Amb3939522 [0,0,1,0,0,0|3,0,0]=4 1394 B6R0.6 CCCCNC=O Amb4017838 [0,0,1,0,0,0|2,0,0]=3 1395 B6R0.6 CCCCOC=O Amb6608882 [0,0,1,0,0,0|3,0,0]=4 1396 B6R0.6 CCCOCCN Amb3939563 [0,0,1,0,0,0|2,0,1]=4 1397 B6R0.6 CCC\C=C/C=O Amb25885814 [0,0,1,0,0,0|3,0,0]=4 1398 B6R0.6 CCC\C=C\C=O Amb3940431 [0,0,1,0,0,0|3,0,0]=4 1399 B6R0.6 CCNCCCN Amb17315269 [0,0,1,0,0,0|2,0,1]=4 1400 B6R0.6 CCNCNC=O Amb27252409 [0,0,1,0,0,0|3,0,0]=4 1401 B6R0.6 CCNOCCO Amb28281707 [0,0,1,0,0,0|2,0,1]=4 1402 B6R0.6 CCOCNC=O Amb28252363 [0,0,1,0,0,0|3,0,0]=4 1403 B6R0.6 CCSCNC=O Amb28315587 [0,0,1,0,0,0|3,0,0]=4 1404 B6R0.6 COCCNC=O Amb24334241 [0,0,1,0,0,0|3,0,0]=4 1405 B6R0.6 COCOCC=O Amb27409311 [0,0,1,0,0,0|3,0,0]=4 1406 B6R0.6 COCOCCN Amb25314793 [0,0,1,0,0,0|3,0,0]=4 1407 B6R0.6 CONCCCN Amb26953498 [0,0,1,0,0,0|3,0,0]=4 1408 B6R0.6 CONCCCN Amb30584683 [0,0,1,0,0,0|3,0,0]=4 1409 B6R0.6 CONCCCN Amb32666616 [0,0,1,0,0,0|3,0,0]=4 1410 B6R0.6 CSCCNC=O Amb28437305 [0,0,1,0,0,0|3,0,0]=4 1411 B6R0.6 C\C=C/CCCN Amb27658374 [0,0,1,0,0,0|3,0,0]=4 1412 B6R0.6 Cl\C=C/OCCCl Amb27843981 [0,0,1,0,0,0|3,0,0]=4 1413 B6R0.6 NCCCCC=O Amb26627836 [0,0,1,0,0,0|2,0,0]=3 1414 B6R0.6 NCCCNC=O Amb5723517 [0,0,1,0,0,0|1,0,0]=2 1415 B6R0.6 NCCC\C=C/I Amb28050291 [0,0,1,0,0,0|3,0,0]=4 1416 B6R0.6 NCCOCCBr Amb25888513 [0,0,1,0,0,0|2,0,1]=4 1417 B6R0.6 NCCOCCBr Amb35747990 [0,0,1,0,0,0|2,0,1]=4 1418 B6R0.6 NCCOCCCl Amb22036609 [0,0,1,0,0,0|2,0,1]=4 1419 B6R0.6 NCCOCCF Amb28320518 [0,0,1,0,0,0|2,0,1]=4 1420 B6R0.6 NCCOCCF Amb33536623 [0,0,1,0,0,0|2,0,1]=4 1421 B6R0.6 NCCOCCN Amb2583212 [0,0,1,0,0,0|2,0,1]=4 1422 B6R0.6 NCCOCCN Amb8504888 [0,0,1,0,0,0|2,0,1]=4 1423 B6R0.6 NCCOCCO Amb3939011 [0,0,1,0,0,0|1,0,2]=4 1424 B6R0.6 NCCOCCS Amb17502015 [0,0,1,0,0,0|1,1,1]=4 1425 B6R0.6 NCCOCCS Amb35789823 [0,0,1,0,0,0|1,1,1]=4 1426 B6R0.6 O=CCCCCBr Amb18126353 [0,0,1,0,0,0|3,0,0]=4 1427 B6R0.6 O=CCCCCCl Amb18123550 [0,0,1,0,0,0|3,0,0]=4 1428 B6R0.6 O=CCCCCO Amb10603837 [0,0,1,0,0,0|3,0,0]=4 1429 B6R0.6 O=CNCCCO Amb27248821 [0,0,1,0,0,0|2,0,0]=3 1430 B6R0.6 O=C\C=C/CCO Amb27235316 [0,0,1,0,0,0|3,0,0]=4 1431 B6R0.6 O=C\C=C\CCF Amb33429802 [0,0,1,0,0,0|3,0,0]=4 1432 B8R2.2 NC12COCC1C2 Amb32674927 [0,0,0,1,0,0|2,0,1]=4 1433 B8R2.2 NC12COCC1C2 Amb32674928 [0,0,0,1,0,0|2,0,1]=4 1434 B8R2.2 N[C@@]12COC[C@@H]1C2 Amb32675187 [0,0,0,1,0,0|2,0,1]=4 1435 B8R2.2 N[C@@]12COC[C@@H]1C2 Amb32675188 [0,0,0,1,0,0|2,0,1]=4 1436 B8R2.4 O=C1CC2CC1C2 Amb24426322 [0,0,0,1,0,0|3,0,0]=4 1437 B8R2.4 O=C1NC2CC1C2 Amb27848619 [0,0,0,1,0,0|2,0,0]=3 1438 B8R2.22 C1NC2COCC12 Amb26047819 [0,0,0,1,0,0|2,0,1]=4 1439 B8R2.27 NC1C2CNC1C2 Amb28367414 [0,0,0,1,0,0|2,0,1]=4 1440 B8R2.27 O=C1C2CCC1C2 Amb27794426 [0,0,0,1,0,0|3,0,0]=4 1441 B8R2.38 O=C1C=CC2OC12 Amb27775734 [0,0,0,1,0,0|3,0,0]=4 1442 B8R2.38 O=C1C=C[C@@H]2C[C@H]12 Amb28052364 [0,0,0,1,0,0|3,0,0]=4 1443 B8R2.38 O=C1CCC2CC12 Amb22736104 [0,0,0,1,0,0|3,0,0]=4 1444 B8R2.38 O=C1CCC2OC12 Amb28141441 [0,0,0,1,0,0|3,0,0]=4 1445 B8R2.38 O=C1CC[C@@H]2C[C@H]12 Amb24623125 [0,0,0,1,0,0|3,0,0]=4 1446 B8R2.38 O=C1CC[C@H]2C[C@@H]12 Amb27845572 [0,0,0,1,0,0|3,0,0]=4 1447 B8R2.38 O=C1CNC2CC12 Amb34142462 [0,0,0,1,0,0|3,0,0]=4 1448 B8R2.38 O=C1CN[C@@H]2C[C@H]12 Amb27630008 [0,0,0,1,0,0|3,0,0]=4 1449 B8R2.38 O=C1NCC2CC12 Amb22546330 [0,0,0,1,0,0|2,0,0]=3 1450 B8R2.38 O=C1NCC2OC12 Amb28143671 [0,0,0,1,0,0|2,0,0]=3 1451 B8R2.38 O=C1NC[C@@H]2C[C@H]12 Amb27961231 [0,0,0,1,0,0|2,0,0]=3 1452 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,1,0,0|3,0,0]=4 1453 B8R2.38 O=C1OC[C@H]2C[C@@H]12 Amb27421949 [0,0,0,1,0,0|3,0,0]=4 1454 B6R1.4 C=C1CCC1C Amb27424508 [0,0,0,0,1,0|3,0,0]=4 1455 B6R1.4 C=C1CCC1Cl Amb27637701 [0,0,0,0,1,0|3,0,0]=4 1456 B6R1.4 CC1CCC1=O Amb17593022 [0,0,0,0,1,0|2,0,0]=3 1457 B6R1.4 CC1CCC1N Amb26081246 [0,0,0,0,1,0|2,0,1]=4 1458 B6R1.4 CC1CCC1N Amb33550388 [0,0,0,0,1,0|2,0,1]=4 1459 B6R1.4 CC1CNC1=O Amb24444140 [0,0,0,0,1,0|1,0,0]=2 1460 B6R1.4 CC1CNC1C Amb25760265 [0,0,0,0,1,0|2,0,1]=4 1461 B6R1.4 CC1CNC1C Amb32661303 [0,0,0,0,1,0|2,0,1]=4 1462 B6R1.4 CC1COC1=O Amb25794274 [0,0,0,0,1,0|1,0,0]=2 1463 B6R1.4 CC1NCC1F Amb27640535 [0,0,0,0,1,0|2,0,1]=4 1464 B6R1.4 CC1NCC1F Amb34159500 [0,0,0,0,1,0|2,0,1]=4 1465 B6R1.4 CC1NCC1O Amb22754478 [0,0,0,0,1,0|2,0,1]=4 1466 B6R1.4 CC1NCC1O Amb26381929 [0,0,0,0,1,0|2,0,1]=4 1467 B6R1.4 CC1NNC1=O Amb35751853 [0,0,0,0,1,0|2,0,0]=3 1468 B6R1.4 CC1OCC1=O Amb23456088 [0,0,0,0,1,0|2,0,0]=3 1469 B6R1.4 CC1OCC1O Amb25917442 [0,0,0,0,1,0|2,0,1]=4 1470 B6R1.4 C[C@@H]1CC[C@H]1N Amb27461478 [0,0,0,0,1,0|2,0,1]=4 1471 B6R1.4 C[C@@H]1CC[C@H]1N Amb31030976 [0,0,0,0,1,0|2,0,1]=4 1472 B6R1.4 C[C@@H]1NCC1F Amb34162588 [0,0,0,0,1,0|2,0,1]=4 1473 B6R1.4 C[C@@H]1NCC1O Amb24120609 [0,0,0,0,1,0|2,0,1]=4 1474 B6R1.4 C[C@@H]1NC[C@@H]1F Amb34159360 [0,0,0,0,1,0|2,0,1]=4 1475 B6R1.4 C[C@@H]1NC[C@@H]1O Amb25252257 [0,0,0,0,1,0|2,0,1]=4 1476 B6R1.4 C[C@@H]1NC[C@@H]1O Amb33719043 [0,0,0,0,1,0|2,0,1]=4 1477 B6R1.4 C[C@@H]1NC[C@H]1F Amb34151957 [0,0,0,0,1,0|2,0,1]=4 1478 B6R1.4 C[C@@H]1NC[C@H]1N Amb28072129 [0,0,0,0,1,0|1,0,1]=3 1479 B6R1.4 C[C@@H]1NC[C@H]1O Amb26448868 [0,0,0,0,1,0|2,0,1]=4 1480 B6R1.4 C[C@@H]1NC[C@H]1O Amb33719042 [0,0,0,0,1,0|2,0,1]=4 1481 B6R1.4 C[C@@H]1OC[C@@H]1O Amb25988882 [0,0,0,0,1,0|2,0,1]=4 1482 B6R1.4 C[C@@H]1OC[C@H]1O Amb25913383 [0,0,0,0,1,0|2,0,1]=4 1483 B6R1.4 C[C@H]1CNC1=O Amb27620602 [0,0,0,0,1,0|1,0,0]=2 1484 B6R1.4 C[C@H]1NCC1F Amb34137586 [0,0,0,0,1,0|2,0,1]=4 1485 B6R1.4 C[C@H]1NCC1O Amb34145767 [0,0,0,0,1,0|2,0,1]=4 1486 B6R1.4 C[C@H]1NC[C@@H]1F Amb34141626 [0,0,0,0,1,0|2,0,1]=4 1487 B6R1.4 C[C@H]1NC[C@@H]1O Amb34137561 [0,0,0,0,1,0|2,0,1]=4 1488 B6R1.4 C[C@H]1NC[C@H]1F Amb34156696 [0,0,0,0,1,0|2,0,1]=4 1489 B6R1.4 C[C@H]1NC[C@H]1O Amb34139677 [0,0,0,0,1,0|2,0,1]=4 1490 B6R1.4 C[C@H]1NC[C@H]1O Amb34145135 [0,0,0,0,1,0|2,0,1]=4 1491 B6R1.4 N=C1CNC1=O Amb27255646 [0,0,0,0,1,0|0,0,2]=3 1492 B6R1.4 NC1CCC1=O Amb22896568 [0,0,0,0,1,0|1,0,0]=2 1493 B6R1.4 NC1CCC1=O Amb25887804 [0,0,0,0,1,0|1,0,0]=2 1494 B6R1.4 NC1CCC1F Amb33715804 [0,0,0,0,1,0|2,0,1]=4 1495 B6R1.4 NC1CCC1N Amb27872038 [0,0,0,0,1,0|2,0,1]=4 1496 B6R1.4 NC1CCC1O Amb19148610 [0,0,0,0,1,0|1,0,2]=4 1497 B6R1.4 NC1CCC1O Amb31291441 [0,0,0,0,1,0|1,0,2]=4 1498 B6R1.4 NC1CNC1=O Amb18832512 [0,0,0,0,1,0|0,0,0]=1 1499 B6R1.4 NC1CNC1=O Amb32671465 [0,0,0,0,1,0|0,0,0]=1 1500 B6R1.4 NN1CCC1=O Amb27860475 [0,0,0,0,1,0|2,0,0]=3 1501 B6R1.4 NN1CCC1=O Amb30625658 [0,0,0,0,1,0|2,0,0]=3 1502 B6R1.4 N[C@@H]1CC[C@@H]1F Amb33620889 [0,0,0,0,1,0|2,0,1]=4 1503 B6R1.4 N[C@@H]1CC[C@@H]1F Amb33747380 [0,0,0,0,1,0|2,0,1]=4 1504 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22757952 [0,0,0,0,1,0|1,0,2]=4 1505 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22823228 [0,0,0,0,1,0|1,0,2]=4 1506 B6R1.4 N[C@@H]1CC[C@H]1O Amb22757953 [0,0,0,0,1,0|1,0,2]=4 1507 B6R1.4 N[C@@H]1CC[C@H]1O Amb22823232 [0,0,0,0,1,0|1,0,2]=4 1508 B6R1.4 N[C@@H]1CC[C@H]1O Amb33719048 [0,0,0,0,1,0|1,0,2]=4 1509 B6R1.4 N[C@@H]1CNC1=O Amb22751418 [0,0,0,0,1,0|0,0,0]=1 1510 B6R1.4 N[C@@H]1CNC1=O Amb30982058 [0,0,0,0,1,0|0,0,0]=1 1511 B6R1.4 N[C@@H]1COC1=O Amb22748014 [0,0,0,0,1,0|0,0,0]=1 1512 B6R1.4 N[C@H]1CC[C@@H]1O Amb24579886 [0,0,0,0,1,0|1,0,2]=4 1513 B6R1.4 N[C@H]1CC[C@H]1N Amb25067470 [0,0,0,0,1,0|2,0,1]=4 1514 B6R1.4 N[C@H]1CC[C@H]1O Amb24580190 [0,0,0,0,1,0|1,0,2]=4 1515 B6R1.4 N[C@H]1CNC1=O Amb25811302 [0,0,0,0,1,0|0,0,0]=1 1516 B6R1.4 N[C@H]1CNC1=O Amb31291144 [0,0,0,0,1,0|0,0,0]=1 1517 B6R1.4 N[C@H]1COC1=O Amb28315731 [0,0,0,0,1,0|0,0,0]=1 1518 B6R1.4 N[C@H]1CSC1=O Amb27391192 [0,0,0,0,1,0|0,1,0]=2 1519 B6R1.4 O=C1CCC1=O Amb4036402 [0,0,0,0,1,0|2,0,1]=4 1520 B6R1.4 O=C1CCC1Br Amb21964157 [0,0,0,0,1,0|2,0,0]=3 1521 B6R1.4 O=C1CCC1Cl Amb33544158 [0,0,0,0,1,0|2,0,0]=3 1522 B6R1.4 O=C1CCC1O Amb17593027 [0,0,0,0,1,0|2,0,0]=3 1523 B6R1.4 O=C1CNC1=O Amb27973276 [0,0,0,0,1,0|1,0,1]=3 1524 B6R1.4 O=C1NCC1O Amb24689689 [0,0,0,0,1,0|1,0,0]=2 1525 B6R1.4 O=C1NNC1=O Amb25328306 [0,0,0,0,1,0|2,0,1]=4 1526 B8R1.4 C=C1COCC(O)C1 Amb27484750 [0,0,0,0,0,1|3,0,0]=4 1527 B8R1.4 CC1=CC(=O)NCC1 Amb27170325 [0,0,0,0,0,1|2,0,1]=4 1528 B8R1.4 CC1=CC(=O)NON1 Amb4004619 [0,0,0,0,0,1|2,0,1]=4 1529 B8R1.4 CC1=CC(N)CNC1 Amb32989560 [0,0,0,0,0,1|3,0,0]=4 1530 B8R1.4 CC1CC(N)CCN1 Amb23440606 [0,0,0,0,0,1|2,0,1]=4 1531 B8R1.4 CC1CC=CC(=O)C1 Amb4034490 [0,0,0,0,0,1|3,0,0]=4 1532 B8R1.4 CC1CC=CC(=O)N1 Amb27788159 [0,0,0,0,0,1|3,0,0]=4 1533 B8R1.4 CC1CC=CC(=O)O1 Amb22173905 [0,0,0,0,0,1|3,0,0]=4 1534 B8R1.4 CC1CCCC(=O)C1 Amb1151295 [0,0,0,0,0,1|3,0,0]=4 1535 B8R1.4 CC1CCCC(=O)N1 Amb22372271 [0,0,0,0,0,1|3,0,0]=4 1536 B8R1.4 CC1CCCC(=O)O1 Amb19405726 [0,0,0,0,0,1|3,0,0]=4 1537 B8R1.4 CC1CCNC(=O)C1 Amb20668125 [0,0,0,0,0,1|2,0,0]=3 1538 B8R1.4 CC1CCNC(=O)N1 Amb27193730 [0,0,0,0,0,1|2,0,0]=3 1539 B8R1.4 CC1CCNC(=S)N1 Amb27838373 [0,0,0,0,0,1|2,1,0]=4 1540 B8R1.4 CC1CCNC(N)=N1 Amb25879219 [0,0,0,0,0,1|3,0,0]=4 1541 B8R1.4 CC1CCNC(N)=N1 Amb35747071 [0,0,0,0,0,1|3,0,0]=4 1542 B8R1.4 CC1CCOC(=O)N1 Amb27655650 [0,0,0,0,0,1|3,0,0]=4 1543 B8R1.4 CC1CCOC(=O)O1 Amb33714707 [0,0,0,0,0,1|3,0,0]=4 1544 B8R1.4 CC1CNCC(=O)C1 Amb26048394 [0,0,0,0,0,1|3,0,0]=4 1545 B8R1.4 CC1CNCC(=O)C1 Amb33494302 [0,0,0,0,0,1|3,0,0]=4 1546 B8R1.4 CC1CNCC(=O)N1 Amb22587525 [0,0,0,0,0,1|3,0,0]=4 1547 B8R1.4 CC1CNCC(=O)N1 Amb32410668 [0,0,0,0,0,1|3,0,0]=4 1548 B8R1.4 CC1CNNC(=O)C1 Amb27800916 [0,0,0,0,0,1|2,0,0]=3 1549 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,0,0,0,0,1|2,0,0]=3 1550 B8R1.4 CN1CCNC(=O)C1 Amb19958159 [0,0,0,0,0,1|3,0,0]=4 1551 B8R1.4 C[C@@H]1CC=CC(=O)C1 Amb27762503 [0,0,0,0,0,1|3,0,0]=4 1552 B8R1.4 C[C@@H]1CCCC(=O)C1 Amb21618704 [0,0,0,0,0,1|3,0,0]=4 1553 B8R1.4 C[C@@H]1CCCC(=O)N1 Amb25772093 [0,0,0,0,0,1|3,0,0]=4 1554 B8R1.4 C[C@@H]1CCCC(=O)O1 Amb4166295 [0,0,0,0,0,1|3,0,0]=4 1555 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22504491 [0,0,0,0,0,1|3,0,0]=4 1556 B8R1.4 C[C@@H]1CNCC(=O)N1 Amb22748720 [0,0,0,0,0,1|3,0,0]=4 1557 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,0,0,0,0,1|2,0,0]=3 1558 B8R1.4 C[C@H]1CC=CC(=O)O1 Amb24584842 [0,0,0,0,0,1|3,0,0]=4 1559 B8R1.4 C[C@H]1CCCC(=O)C1 Amb22799724 [0,0,0,0,0,1|3,0,0]=4 1560 B8R1.4 C[C@H]1CCCC(=O)O1 Amb26865751 [0,0,0,0,0,1|3,0,0]=4 1561 B8R1.4 C[C@H]1CCNC(=O)C1 Amb25739591 [0,0,0,0,0,1|2,0,0]=3 1562 B8R1.4 C[C@H]1CNCC(=O)N1 Amb22304821 [0,0,0,0,0,1|3,0,0]=4 1563 B8R1.4 C[C@H]1CNCC(=O)N1 Amb23385344 [0,0,0,0,0,1|3,0,0]=4 1564 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,0,0,0,0,1|2,0,0]=3 1565 B8R1.4 NC1=CC(=O)CCC1 Amb1151335 [0,0,0,0,0,1|2,0,1]=4 1566 B8R1.4 NC1=CC(=O)COC1 Amb25785409 [0,0,0,0,0,1|1,0,1]=3 1567 B8R1.4 NC1=CC(=O)CSC1 Amb28066865 [0,0,0,0,0,1|1,1,1]=4 1568 B8R1.4 NC1=CC(=O)NC=C1 Amb18641608 [0,0,0,0,0,1|1,0,2]=4 1569 B8R1.4 NC1=CC(=O)NC=C1 Amb33716235 [0,0,0,0,0,1|1,0,2]=4 1570 B8R1.4 NC1=CC(=O)NCC1 Amb22229455 [0,0,0,0,0,1|1,0,1]=3 1571 B8R1.4 NC1=CC(=O)NN=C1 Amb18641633 [0,0,0,0,0,1|1,0,2]=4 1572 B8R1.4 NC1=CCNC(=O)N1 Amb25799600 [0,0,0,0,0,1|1,0,2]=4 1573 B8R1.4 NC1=NC(=O)NC=C1 Amb18511886 [0,0,0,0,0,1|1,0,2]=4 1574 B8R1.4 NC1=NC(=O)NC=N1 Amb18641678 [0,0,0,0,0,1|2,0,1]=4 1575 B8R1.4 NC1=NC(=O)NN=C1 Amb18369126 [0,0,0,0,0,1|1,0,2]=4 1576 B8R1.4 NC1=NOCC(=O)N1 Amb27786326 [0,0,0,0,0,1|2,0,1]=4 1577 B8R1.4 NC1C=CNC(=O)N1 Amb28397982 [0,0,0,0,0,1|1,0,1]=3 1578 B8R1.4 NC1CCCC(=O)C1 Amb23440459 [0,0,0,0,0,1|2,0,0]=3 1579 B8R1.4 NC1CCCC(=O)C1 Amb8387391 [0,0,0,0,0,1|2,0,0]=3 1580 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,0,0,0,0,1|1,0,0]=2 1581 B8R1.4 NC1CCNC(=O)C1 Amb19957631 [0,0,0,0,0,1|1,0,0]=2 1582 B8R1.4 NC1CCNC(=O)C1 Amb21960626 [0,0,0,0,0,1|1,0,0]=2 1583 B8R1.4 NC1COCC(=O)C1 Amb33623050 [0,0,0,0,0,1|1,0,0]=2 1584 B8R1.4 NC1COCC(=O)C1 Amb33716160 [0,0,0,0,0,1|1,0,0]=2 1585 B8R1.4 NC1COCC(F)C1 Amb33716161 [0,0,0,0,0,1|2,0,1]=4 1586 B8R1.4 NC1COCC(O)C1 Amb24526934 [0,0,0,0,0,1|1,0,2]=4 1587 B8R1.4 NC1COCC(O)C1 Amb31291238 [0,0,0,0,0,1|1,0,2]=4 1588 B8R1.4 N[C@@H]1CCCS(=O)C1 Amb25168909 [0,0,0,0,0,1|3,0,0]=4 1589 B8R1.4 N[C@@H]1CCNC(=O)C1 Amb27489147 [0,0,0,0,0,1|1,0,0]=2 1590 B8R1.4 N[C@H]1CCCS(=O)C1 Amb27838286 [0,0,0,0,0,1|3,0,0]=4 1591 B8R1.4 N[C@H]1CCNC(=O)C1 Amb25168718 [0,0,0,0,0,1|1,0,0]=2 1592 B8R1.4 N[C@H]1COC[C@H](O)C1 Amb26008196 [0,0,0,0,0,1|1,0,2]=4 1593 B8R1.4 O=C1C=C(Br)CCN1 Amb23402186 [0,0,0,0,0,1|2,0,1]=4 1594 B8R1.4 O=C1C=C(O)COC1 Amb28048998 [0,0,0,0,0,1|2,0,1]=4 1595 B8R1.4 O=C1C=CCC(O)C1 Amb27227199 [0,0,0,0,0,1|3,0,0]=4 1596 B8R1.4 O=C1CC(F)CCN1 Amb27459538 [0,0,0,0,0,1|2,0,0]=3 1597 B8R1.4 O=C1CC(O)CCN1 Amb10602744 [0,0,0,0,0,1|2,0,0]=3 1598 B8R1.4 O=C1CC(S)NCN1 Amb28245543 [0,0,0,0,0,1|3,0,0]=4 1599 B8R1.4 O=C1CCCC(Br)C1 Amb27850962 [0,0,0,0,0,1|3,0,0]=4 1600 B8R1.4 O=C1CCCC(Cl)C1 Amb26946112 [0,0,0,0,0,1|3,0,0]=4 1601 B8R1.4 O=C1CCCC(Cl)N1 Amb28423467 [0,0,0,0,0,1|3,0,0]=4 1602 B8R1.4 O=C1CCCC(F)C1 Amb24578309 [0,0,0,0,0,1|3,0,0]=4 1603 B8R1.4 O=C1CCCC(I)C1 Amb24436778 [0,0,0,0,0,1|3,0,0]=4 1604 B8R1.4 O=C1CCCC(O)C1 Amb22754759 [0,0,0,0,0,1|3,0,0]=4 1605 B8R1.4 O=C1CCCC(O)N1 Amb26394230 [0,0,0,0,0,1|3,0,0]=4 1606 B8R1.4 O=C1CCC[C@@H](O)C1 Amb25320136 [0,0,0,0,0,1|3,0,0]=4 1607 B8R1.4 O=C1CCC[C@H](O)C1 Amb27432456 [0,0,0,0,0,1|3,0,0]=4 1608 B8R1.4 O=C1CCNC(=O)C1 Amb10602544 [0,0,0,0,0,1|2,0,1]=4 1609 B8R1.4 O=C1CCNC(=O)N1 Amb1042477 [0,0,0,0,0,1|2,0,1]=4 1610 B8R1.4 O=C1CCNC(=O)O1 Amb22011553 [0,0,0,0,0,1|2,0,1]=4 1611 B8R1.4 O=C1CCNC(=O)S1 Amb27786235 [0,0,0,0,0,1|2,0,1]=4 1612 B8R1.4 O=C1COCC(=O)C1 Amb8392404 [0,0,0,0,0,1|2,0,1]=4 1613 B8R1.4 O=C1COCC(=O)N1 Amb10808497 [0,0,0,0,0,1|2,0,1]=4 1614 B8R1.4 O=C1COCC(=O)O1 Amb1214326 [0,0,0,0,0,1|2,0,1]=4 1615 B8R1.4 O=C1CS(=O)CCN1 Amb27184590 [0,0,0,0,0,1|3,0,0]=4 1616 B8R1.4 O=C1C[C@@H](O)CCN1 Amb22744924 [0,0,0,0,0,1|2,0,0]=3 1617 B8R1.4 O=C1C[C@H](O)CCN1 Amb17845212 [0,0,0,0,0,1|2,0,0]=3 1618 B8R1.5 C=C1CCCC[C@@H]1N Amb27252272 [0,0,0,0,0,1|3,0,0]=4 1619 B8R1.5 C=C1COCCC1=O Amb18063600 [0,0,0,0,0,1|2,0,1]=4 1620 B8R1.5 C=C1NCCCC1F Amb28384341 [0,0,0,0,0,1|3,0,0]=4 1621 B8R1.5 CC1=C(C)CONC1 Amb19651312 [0,0,0,0,0,1|2,0,1]=4 1622 B8R1.5 CC1=C(C)CONC1 Amb21961473 [0,0,0,0,0,1|2,0,1]=4 1623 B8R1.5 CC1=CCOCC1O Amb28411303 [0,0,0,0,0,1|3,0,0]=4 1624 B8R1.5 CC1CC=CCC1=O Amb17593140 [0,0,0,0,0,1|3,0,0]=4 1625 B8R1.5 CC1CC=NNC1=O Amb22752103 [0,0,0,0,0,1|2,0,0]=3 1626 B8R1.5 CC1CCC=CC1=O Amb17593138 [0,0,0,0,0,1|3,0,0]=4 1627 B8R1.5 CC1CCCCC1=O Amb6608749 [0,0,0,0,0,1|3,0,0]=4 1628 B8R1.5 CC1CCCNC1=O Amb2778949 [0,0,0,0,0,1|2,0,0]=3 1629 B8R1.5 CC1CCCOC1=O Amb26933974 [0,0,0,0,0,1|3,0,0]=4 1630 B8R1.5 CC1CCNCC1=O Amb28990014 [0,0,0,0,0,1|2,0,0]=3 1631 B8R1.5 CC1CCNCC1=O Amb8388554 [0,0,0,0,0,1|2,0,0]=3 1632 B8R1.5 CC1CCOCC1=O Amb25718285 [0,0,0,0,0,1|2,0,0]=3 1633 B8R1.5 CC1CNCCC1=O Amb19888361 [0,0,0,0,0,1|3,0,0]=4 1634 B8R1.5 CC1CNCCC1=O Amb8393082 [0,0,0,0,0,1|3,0,0]=4 1635 B8R1.5 CC1CNCCC1N Amb23440690 [0,0,0,0,0,1|2,0,1]=4 1636 B8R1.5 CC1COC=CC1=O Amb28124249 [0,0,0,0,0,1|2,0,0]=3 1637 B8R1.5 CC1COCCC1=O Amb21856147 [0,0,0,0,0,1|2,0,0]=3 1638 B8R1.5 CC1COCCC1N Amb18833016 [0,0,0,0,0,1|2,0,1]=4 1639 B8R1.5 CC1COCCC1N Amb28934837 [0,0,0,0,0,1|2,0,1]=4 1640 B8R1.5 CC1CSCCC1=O Amb26404796 [0,0,0,0,0,1|2,1,0]=4 1641 B8R1.5 CC1NCCCC1=O Amb26633057 [0,0,0,0,0,1|3,0,0]=4 1642 B8R1.5 CC1NCCCC1=O Amb32695440 [0,0,0,0,0,1|3,0,0]=4 1643 B8R1.5 CC1NCCCC1N Amb24715672 [0,0,0,0,0,1|2,0,1]=4 1644 B8R1.5 CC1NCCNC1=O Amb5846691 [0,0,0,0,0,1|2,0,0]=3 1645 B8R1.5 CC1NCCNC1=O Amb9778910 [0,0,0,0,0,1|2,0,0]=3 1646 B8R1.5 CC1NCCSC1=O Amb27489291 [0,0,0,0,0,1|3,0,0]=4 1647 B8R1.5 CC1OCC=CC1=O Amb28316168 [0,0,0,0,0,1|3,0,0]=4 1648 B8R1.5 CC1OCCCC1=O Amb28048940 [0,0,0,0,0,1|3,0,0]=4 1649 B8R1.5 CC1OCCNC1=O Amb19517095 [0,0,0,0,0,1|2,0,0]=3 1650 B8R1.5 CC1SCCCC1=O Amb25989585 [0,0,0,0,0,1|3,0,0]=4 1651 B8R1.5 CC1SCCNC1=O Amb4009235 [0,0,0,0,0,1|2,0,0]=3 1652 B8R1.5 CN1CCCNC1=O Amb10608416 [0,0,0,0,0,1|3,0,0]=4 1653 B8R1.5 CN1CCCNC1=O Amb32665804 [0,0,0,0,0,1|3,0,0]=4 1654 B8R1.5 CN1CCNCC1=O Amb1834069 [0,0,0,0,0,1|3,0,0]=4 1655 B8R1.5 CN1CCNCC1=O Amb6540859 [0,0,0,0,0,1|3,0,0]=4 1656 B8R1.5 CN1CCOCC1=O Amb22301593 [0,0,0,0,0,1|3,0,0]=4 1657 B8R1.5 C[C@@H]1CCC=CC1=O Amb28316223 [0,0,0,0,0,1|3,0,0]=4 1658 B8R1.5 C[C@@H]1COCC[C@@H]1N Amb22745852 [0,0,0,0,0,1|2,0,1]=4 1659 B8R1.5 C[C@@H]1COCC[C@H]1N Amb23440138 [0,0,0,0,0,1|2,0,1]=4 1660 B8R1.5 C[C@@H]1COCC[C@H]1N Amb25929881 [0,0,0,0,0,1|2,0,1]=4 1661 B8R1.5 C[C@@H]1COCN[C@H]1C Amb27469346 [0,0,0,0,0,1|2,0,1]=4 1662 B8R1.5 C[C@@H]1NC=NNC1=O Amb28341242 [0,0,0,0,0,1|2,0,1]=4 1663 B8R1.5 C[C@@H]1NCCNC1=O Amb18203363 [0,0,0,0,0,1|2,0,0]=3 1664 B8R1.5 C[C@@H]1OCCCC1=O Amb28202118 [0,0,0,0,0,1|3,0,0]=4 1665 B8R1.5 C[C@@H]1SCCNC1=O Amb34915743 [0,0,0,0,0,1|2,0,0]=3 1666 B8R1.5 C[C@H]1CCC=CC1=O Amb28316171 [0,0,0,0,0,1|3,0,0]=4 1667 B8R1.5 C[C@H]1CCCNC1=O Amb27648584 [0,0,0,0,0,1|2,0,0]=3 1668 B8R1.5 C[C@H]1COCC[C@@H]1N Amb27440842 [0,0,0,0,0,1|2,0,1]=4 1669 B8R1.5 C[C@H]1COCC[C@@H]1N Amb33726124 [0,0,0,0,0,1|2,0,1]=4 1670 B8R1.5 C[C@H]1COCC[C@H]1N Amb22736636 [0,0,0,0,0,1|2,0,1]=4 1671 B8R1.5 C[C@H]1COCC[C@H]1N Amb32409393 [0,0,0,0,0,1|2,0,1]=4 1672 B8R1.5 C[C@H]1NCCNC1=O Amb22336965 [0,0,0,0,0,1|2,0,0]=3 1673 B8R1.5 C[C@H]1SCCNC1=O Amb27810802 [0,0,0,0,0,1|2,0,0]=3 1674 B8R1.5 NC1=C(N)NCCN1 Amb27221355 [0,0,0,0,0,1|2,0,1]=4 1675 B8R1.5 NC1=C(N)NCNC1 Amb33512905 [0,0,0,0,0,1|2,0,1]=4 1676 B8R1.5 NC1=CC=CNC1=O Amb18641609 [0,0,0,0,0,1|1,0,2]=4 1677 B8R1.5 NC1=CC=NNC1=O Amb18641632 [0,0,0,0,0,1|1,0,2]=4 1678 B8R1.5 NC1=CN=CNC1=O Amb33544216 [0,0,0,0,0,1|1,0,2]=4 1679 B8R1.5 NC1=NC=CNC1=O Amb22388516 [0,0,0,0,0,1|1,0,2]=4 1680 B8R1.5 NC1=NCCCC1=O Amb28399329 [0,0,0,0,0,1|2,0,1]=4 1681 B8R1.5 NC1C=NC=NC1=O Amb22015333 [0,0,0,0,0,1|1,0,2]=4 1682 B8R1.5 NC1C=NN=CC1=O Amb27630032 [0,0,0,0,0,1|1,0,2]=4 1683 B8R1.5 NC1CCCC=C1Br Amb27974263 [0,0,0,0,0,1|3,0,0]=4 1684 B8R1.5 NC1CCCC=C1Br Amb33338965 [0,0,0,0,0,1|3,0,0]=4 1685 B8R1.5 NC1CCCC=C1Cl Amb18124341 [0,0,0,0,0,1|3,0,0]=4 1686 B8R1.5 NC1CCCCC1=O Amb17939051 [0,0,0,0,0,1|2,0,0]=3 1687 B8R1.5 NC1CCCCC1=O Amb22001819 [0,0,0,0,0,1|2,0,0]=3 1688 B8R1.5 NC1CCCNC1=O Amb1088746 [0,0,0,0,0,1|1,0,0]=2 1689 B8R1.5 NC1CCCNC1=O Amb8428208 [0,0,0,0,0,1|1,0,0]=2 1690 B8R1.5 NC1CCNCC1F Amb27473229 [0,0,0,0,0,1|2,0,1]=4 1691 B8R1.5 NC1CCNCC1O Amb22388661 [0,0,0,0,0,1|1,0,2]=4 1692 B8R1.5 NC1CCOCC1Br Amb32657381 [0,0,0,0,0,1|2,0,1]=4 1693 B8R1.5 NC1CCOCC1F Amb22436824 [0,0,0,0,0,1|2,0,1]=4 1694 B8R1.5 NC1CCOCC1O Amb18198453 [0,0,0,0,0,1|1,0,2]=4 1695 B8R1.5 NC1CCOCC1O Amb28934888 [0,0,0,0,0,1|1,0,2]=4 1696 B8R1.5 NC1CCONC1=O Amb22295935 [0,0,0,0,0,1|0,0,0]=1 1697 B8R1.5 NC1CNCCC1=O Amb27635311 [0,0,0,0,0,1|2,0,0]=3 1698 B8R1.5 NC1COCCC1=O Amb18833021 [0,0,0,0,0,1|1,0,0]=2 1699 B8R1.5 NC1COCCC1=O Amb32670691 [0,0,0,0,0,1|1,0,0]=2 1700 B8R1.5 NC1COCCC1O Amb18198755 [0,0,0,0,0,1|1,0,2]=4 1701 B8R1.5 NC1COCCC1O Amb32753157 [0,0,0,0,0,1|1,0,2]=4 1702 B8R1.5 NC1CSCCC1=O Amb4296938 [0,0,0,0,0,1|1,1,0]=3 1703 B8R1.5 NC1N=CC=NC1=O Amb32411851 [0,0,0,0,0,1|1,0,2]=4 1704 B8R1.5 NN1CCCCC1=O Amb13952152 [0,0,0,0,0,1|3,0,0]=4 1705 B8R1.5 NN1CCCCC1=O Amb22275946 [0,0,0,0,0,1|3,0,0]=4 1706 B8R1.5 NN1CCCNC1=O Amb25343173 [0,0,0,0,0,1|2,0,0]=3 1707 B8R1.5 NN1CCCOC1=O Amb17608306 [0,0,0,0,0,1|3,0,0]=4 1708 B8R1.5 NN1CCOCC1=O Amb27238452 [0,0,0,0,0,1|2,0,0]=3 1709 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,0,0,0,0,1|1,0,0]=2 1710 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,0,0,0,0,1|1,0,0]=2 1711 B8R1.5 N[C@@H]1CCNC[C@H]1O Amb27421907 [0,0,0,0,0,1|1,0,2]=4 1712 B8R1.5 N[C@@H]1CCOC[C@@H]1F Amb23439434 [0,0,0,0,0,1|2,0,1]=4 1713 B8R1.5 N[C@@H]1CCOC[C@@H]1F Amb25780287 [0,0,0,0,0,1|2,0,1]=4 1714 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb22406155 [0,0,0,0,0,1|1,0,2]=4 1715 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb23385312 [0,0,0,0,0,1|1,0,2]=4 1716 B8R1.5 N[C@@H]1CCOC[C@H]1F Amb23439433 [0,0,0,0,0,1|2,0,1]=4 1717 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb22406158 [0,0,0,0,0,1|1,0,2]=4 1718 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb23385253 [0,0,0,0,0,1|1,0,2]=4 1719 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb23385320 [0,0,0,0,0,1|1,0,2]=4 1720 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb26888092 [0,0,0,0,0,1|1,0,2]=4 1721 B8R1.5 N[C@@H]1COCC[C@H]1F Amb27435652 [0,0,0,0,0,1|2,0,1]=4 1722 B8R1.5 N[C@@H]1COCC[C@H]1N Amb24120364 [0,0,0,0,0,1|2,0,1]=4 1723 B8R1.5 N[C@@H]1COCC[C@H]1O Amb22748653 [0,0,0,0,0,1|1,0,2]=4 1724 B8R1.5 N[C@@H]1COCC[C@H]1O Amb23385302 [0,0,0,0,0,1|1,0,2]=4 1725 B8R1.5 N[C@H]1CCCNC1=O Amb10603272 [0,0,0,0,0,1|1,0,0]=2 1726 B8R1.5 N[C@H]1CCCNC1=O Amb8631316 [0,0,0,0,0,1|1,0,0]=2 1727 B8R1.5 N[C@H]1CCNC[C@@H]1O Amb28052491 [0,0,0,0,0,1|1,0,2]=4 1728 B8R1.5 N[C@H]1CCNC[C@H]1O Amb27815748 [0,0,0,0,0,1|1,0,2]=4 1729 B8R1.5 N[C@H]1CCOC[C@@H]1F Amb33726121 [0,0,0,0,0,1|2,0,1]=4 1730 B8R1.5 N[C@H]1CCOC[C@@H]1O Amb25970035 [0,0,0,0,0,1|1,0,2]=4 1731 B8R1.5 N[C@H]1CCOC[C@@H]1O Amb33725444 [0,0,0,0,0,1|1,0,2]=4 1732 B8R1.5 N[C@H]1CCOC[C@H]1F Amb26532518 [0,0,0,0,0,1|2,0,1]=4 1733 B8R1.5 N[C@H]1CCOC[C@H]1F Amb31291469 [0,0,0,0,0,1|2,0,1]=4 1734 B8R1.5 N[C@H]1CCOC[C@H]1O Amb26407654 [0,0,0,0,0,1|1,0,2]=4 1735 B8R1.5 N[C@H]1CCOC[C@H]1O Amb33801116 [0,0,0,0,0,1|1,0,2]=4 1736 B8R1.5 N[C@H]1COCC[C@@H]1O Amb25231772 [0,0,0,0,0,1|1,0,2]=4 1737 B8R1.5 N[C@H]1COCC[C@H]1O Amb24617518 [0,0,0,0,0,1|1,0,2]=4 1738 B8R1.5 N[C@H]1COCC[C@H]1O Amb33872533 [0,0,0,0,0,1|1,0,2]=4 1739 B8R1.5 O=C1C=CCCC1Br Amb27477843 [0,0,0,0,0,1|3,0,0]=4 1740 B8R1.5 O=C1C=CCCC1O Amb27165534 [0,0,0,0,0,1|3,0,0]=4 1741 B8R1.5 O=C1CC=CCC1Cl Amb27471139 [0,0,0,0,0,1|3,0,0]=4 1742 B8R1.5 O=C1CCCCC1Br Amb8394127 [0,0,0,0,0,1|3,0,0]=4 1743 B8R1.5 O=C1CCCCC1Cl Amb1154371 [0,0,0,0,0,1|3,0,0]=4 1744 B8R1.5 O=C1CCCCC1F Amb10605769 [0,0,0,0,0,1|3,0,0]=4 1745 B8R1.5 O=C1CCCCC1I Amb28239314 [0,0,0,0,0,1|3,0,0]=4 1746 B8R1.5 O=C1CCCCC1O Amb8390042 [0,0,0,0,0,1|3,0,0]=4 1747 B8R1.5 O=C1CCCCC1S Amb25839265 [0,0,0,0,0,1|3,0,0]=4 1748 B8R1.5 O=C1CCCC[C@@H]1F Amb24379012 [0,0,0,0,0,1|3,0,0]=4 1749 B8R1.5 O=C1CCCC[C@@H]1O Amb28316212 [0,0,0,0,0,1|3,0,0]=4 1750 B8R1.5 O=C1CCCC[C@H]1Cl Amb28119800 [0,0,0,0,0,1|3,0,0]=4 1751 B8R1.5 O=C1CCCNC1=O Amb2445649 [0,0,0,0,0,1|2,0,1]=4 1752 B8R1.5 O=C1CCCSC1Cl Amb26534671 [0,0,0,0,0,1|3,0,0]=4 1753 B8R1.5 O=C1CCNCC1Br Amb21520330 [0,0,0,0,0,1|3,0,0]=4 1754 B8R1.5 O=C1CCNCC1F Amb13885958 [0,0,0,0,0,1|3,0,0]=4 1755 B8R1.5 O=C1CCNCC1F Amb22002662 [0,0,0,0,0,1|3,0,0]=4 1756 B8R1.5 O=C1CCNCC1O Amb24075970 [0,0,0,0,0,1|3,0,0]=4 1757 B8R1.5 O=C1CCNCC1O Amb27230548 [0,0,0,0,0,1|3,0,0]=4 1758 B8R1.5 O=C1CCNC[C@H]1F Amb27467922 [0,0,0,0,0,1|3,0,0]=4 1759 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,0,0,0,0,1|2,0,0]=3 1760 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,0,0,0,0,1|2,0,0]=3 1761 B8R1.5 O=C1CCOCC1F Amb19958536 [0,0,0,0,0,1|2,0,0]=3 1762 B8R1.5 O=C1CCOCC1O Amb26966688 [0,0,0,0,0,1|2,0,0]=3 1763 B8R1.5 O=C1CCOC[C@@H]1Br Amb26936362 [0,0,0,0,0,1|2,0,0]=3 1764 B8R1.5 O=C1CCOC[C@@H]1F Amb27813369 [0,0,0,0,0,1|2,0,0]=3 1765 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,0,0,0,0,1|2,0,0]=3 1766 B8R1.5 O=C1CCSCC1Br Amb22493812 [0,0,0,0,0,1|2,1,0]=4 1767 B8R1.5 O=C1CCSCC1O Amb27762936 [0,0,0,0,0,1|2,1,0]=4 1768 B8R1.5 O=C1CCSC[C@@H]1O Amb28316128 [0,0,0,0,0,1|2,1,0]=4 1769 B8R1.5 O=C1COC=C[C@H]1F Amb28292426 [0,0,0,0,0,1|2,0,1]=4 1770 B8R1.5 O=C1COCCC1Br Amb24416092 [0,0,0,0,0,1|2,0,0]=3 1771 B8R1.5 O=C1COCCC1F Amb28048950 [0,0,0,0,0,1|2,0,0]=3 1772 B8R1.5 O=C1COCC[C@H]1F Amb27207103 [0,0,0,0,0,1|2,0,0]=3 1773 B8R1.5 O=C1CON=NC1=O Amb28316169 [0,0,0,0,0,1|1,0,2]=4 1774 B8R1.5 O=C1NC=CSC1O Amb27882387 [0,0,0,0,0,1|2,0,1]=4 1775 B8R1.5 O=C1NCCC=C1Cl Amb26349713 [0,0,0,0,0,1|2,0,1]=4 1776 B8R1.5 O=C1NCCCC1Br Amb33543864 [0,0,0,0,0,1|2,0,0]=3 1777 B8R1.5 O=C1NCCCC1F Amb13888988 [0,0,0,0,0,1|2,0,0]=3 1778 B8R1.5 O=C1NCCCC1O Amb10602315 [0,0,0,0,0,1|2,0,0]=3 1779 B8R1.5 O=C1NCCC[C@@H]1O Amb22226682 [0,0,0,0,0,1|2,0,0]=3 1780 B8R1.5 O=C1NCCC[C@H]1O Amb22225342 [0,0,0,0,0,1|2,0,0]=3 1781 B8R1.5 O=C1NCCNC1=O Amb4005151 [0,0,0,0,0,1|2,0,1]=4 1782 B8R1.5 O=C1NCCOC1=O Amb24120265 [0,0,0,0,0,1|2,0,1]=4 1783 B8R1.5 O=C1NCNCC1Br Amb28060398 [0,0,0,0,0,1|2,0,0]=3 1784 B8R1.5 O=C1NNCCC1Cl Amb26453975 [0,0,0,0,0,1|2,0,0]=3 1785 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,0,0,0,0,1|3,0,0]=4 1786 B8R1.5 O=C1OCCCC1Cl Amb28195106 [0,0,0,0,0,1|3,0,0]=4 1787 B8R1.5 O=C1OCCCC1O Amb19959000 [0,0,0,0,0,1|3,0,0]=4 1788 B8R1.5 O=C1OCCSC1Br Amb27776793 [0,0,0,0,0,1|3,0,0]=4 1789 B8R1.5 O=C1SCCSC1Cl Amb25026142 [0,0,0,0,0,1|3,0,0]=4 1790 B8R1.5 O[C@H]1CONC[C@H]1O Amb31258099 [0,0,0,0,0,1|1,0,2]=4 1791 B8R1.5 O[C@H]1CONC[C@H]1O Amb32679452 [0,0,0,0,0,1|1,0,2]=4 1792 B5R0.1 BC(=O)NCC Amb27430059 [1,0,1,0,0,0|2,0,0]=4 1793 B5R0.1 C#CNC(N)=O Amb28049383 [1,0,1,0,0,0|1,0,1]=4 1794 B5R0.1 C=C(Br)CCO Amb4014497 [1,0,1,0,0,0|2,0,0]=4 1795 B5R0.1 C=C(C)CCO Amb34916534 [1,0,1,0,0,0|2,0,0]=4 1796 B5R0.1 C=C(C)CCO Amb8513522 [1,0,1,0,0,0|2,0,0]=4 1797 B5R0.1 C=C(C)COC Amb26589016 [1,0,1,0,0,0|2,0,0]=4 1798 B5R0.1 C=C(C)CON Amb18560218 [1,0,1,0,0,0|1,0,1]=4 1799 B5R0.1 C=C(C)CON Amb30634348 [1,0,1,0,0,0|1,0,1]=4 1800 B5R0.1 C=CCC(N)=O Amb17610156 [1,0,1,0,0,0|1,0,1]=4 1801 B5R0.1 C=CNC(C)=O Amb24323579 [1,0,1,0,0,0|1,0,1]=4 1802 B5R0.1 C=CNC(N)=O Amb25082241 [1,0,1,0,0,0|1,0,1]=4 1803 B5R0.1 C=NCC(N)=O Amb26548445 [1,0,1,0,0,0|2,0,0]=4 1804 B5R0.1 C=NNC(C)=O Amb29626225 [1,0,1,0,0,0|1,0,1]=4 1805 B5R0.1 CC#CC(C)=O Amb17593016 [1,0,1,0,0,0|2,0,0]=4 1806 B5R0.1 CC#CC(N)=O Amb10552409 [1,0,1,0,0,0|2,0,0]=4 1807 B5R0.1 CC(=O)CCBr Amb24078246 [1,0,1,0,0,0|2,0,0]=4 1808 B5R0.1 CC(=O)CCCl Amb2720823 [1,0,1,0,0,0|2,0,0]=4 1809 B5R0.1 CC(=O)CCF Amb26427773 [1,0,1,0,0,0|2,0,0]=4 1810 B5R0.1 CC(=O)CCN Amb18632933 [1,0,1,0,0,0|2,0,0]=4 1811 B5R0.1 CC(=O)CCN Amb33544540 [1,0,1,0,0,0|2,0,0]=4 1812 B5R0.1 CC(=O)CCO Amb836357 [1,0,1,0,0,0|1,0,0]=3 1813 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [1,0,1,0,0,0|2,0,0]=4 1814 B5R0.1 CC(=O)CNO Amb28049954 [1,0,1,0,0,0|2,0,0]=4 1815 B5R0.1 CC(=O)NC=O Amb27850191 [1,0,1,0,0,0|2,0,0]=4 1816 B5R0.1 CC(=O)NCO Amb8516057 [1,0,1,0,0,0|2,0,0]=4 1817 B5R0.1 CC(=O)SCO Amb27255261 [1,0,1,0,0,0|2,0,0]=4 1818 B5R0.1 CC(Br)\C=N\O Amb28137926 [1,0,1,0,0,0|1,0,1]=4 1819 B5R0.1 CC(C)CNO Amb25887512 [1,0,1,0,0,0|1,0,1]=4 1820 B5R0.1 CC(C)CON Amb19889788 [1,0,1,0,0,0|1,0,1]=4 1821 B5R0.1 CC(C)CON Amb2819061 [1,0,1,0,0,0|1,0,1]=4 1822 B5R0.1 CC(C)\C=N\O Amb2455920 [1,0,1,0,0,0|1,0,1]=4 1823 B5R0.1 CC(N)CCN Amb18951361 [1,0,1,0,0,0|1,0,1]=4 1824 B5R0.1 CC(N)CCN Amb19338152 [1,0,1,0,0,0|1,0,1]=4 1825 B5R0.1 CC(N)CCO Amb2697504 [1,0,1,0,0,0|1,0,1]=4 1826 B5R0.1 CC(N)CCO Amb32666060 [1,0,1,0,0,0|1,0,1]=4 1827 B5R0.1 CC(N)CNN Amb24680308 [1,0,1,0,0,0|1,0,1]=4 1828 B5R0.1 CC(N)CNN Amb32651879 [1,0,1,0,0,0|1,0,1]=4 1829 B5R0.1 CC(N)CON Amb28315722 [1,0,1,0,0,0|0,0,1]=3 1830 B5R0.1 CC(N)\C=N\O Amb28073035 [1,0,1,0,0,0|0,0,1]=3 1831 B5R0.1 CC(O)CON Amb21962618 [1,0,1,0,0,0|1,0,1]=4 1832 B5R0.1 CCCC(=N)N Amb10610381 [1,0,1,0,0,0|2,0,0]=4 1833 B5R0.1 CCCC(=N)N Amb2695914 [1,0,1,0,0,0|2,0,0]=4 1834 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,1,0,0,0|2,0,0]=4 1835 B5R0.1 CCCC(=O)Cl Amb2792903 [1,0,1,0,0,0|2,0,0]=4 1836 B5R0.1 CCCC(=O)O Amb3939012 [1,0,1,0,0,0|2,0,0]=4 1837 B5R0.1 CCCC(=O)[O-] Amb8514901 [1,0,1,0,0,0|2,0,0]=4 1838 B5R0.1 CCCC(C)=O Amb6608910 [1,0,1,0,0,0|2,0,0]=4 1839 B5R0.1 CCCC(N)=O Amb3886524 [1,0,1,0,0,0|1,0,0]=3 1840 B5R0.1 CCCC(N)=S Amb6245403 [1,0,1,0,0,0|1,1,0]=4 1841 B5R0.1 CCCC(N)=[NH2+] Amb8384484 [1,0,1,0,0,0|2,0,0]=4 1842 B5R0.1 CCCS(N)=O Amb24733579 [1,0,1,0,0,0|2,0,0]=4 1843 B5R0.1 CCNC(=N)N Amb21964689 [1,0,1,0,0,0|2,0,0]=4 1844 B5R0.1 CCNC(=N)N Amb22053912 [1,0,1,0,0,0|2,0,0]=4 1845 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,1,0,0,0|2,0,0]=4 1846 B5R0.1 CCNC(C)=O Amb2780415 [1,0,1,0,0,0|1,0,0]=3 1847 B5R0.1 CCNC(N)=O Amb6608844 [1,0,1,0,0,0|1,0,0]=3 1848 B5R0.1 CCNC(N)=S Amb6608838 [1,0,1,0,0,0|1,1,0]=4 1849 B5R0.1 CCNC(N)=[NH2+] Amb22734753 [1,0,1,0,0,0|2,0,0]=4 1850 B5R0.1 CCOC(C)=O Amb3940488 [1,0,1,0,0,0|2,0,0]=4 1851 B5R0.1 CCOC(N)=O Amb6608672 [1,0,1,0,0,0|2,0,0]=4 1852 B5R0.1 CN(N)CCO Amb28400197 [1,0,1,0,0,0|2,0,0]=4 1853 B5R0.1 CNCC(C)=O Amb17621974 [1,0,1,0,0,0|2,0,0]=4 1854 B5R0.1 CNCC(C)=O Amb21959975 [1,0,1,0,0,0|2,0,0]=4 1855 B5R0.1 CNCC(C)N Amb18281800 [1,0,1,0,0,0|1,0,1]=4 1856 B5R0.1 CNCC(C)N Amb20629142 [1,0,1,0,0,0|1,0,1]=4 1857 B5R0.1 CNCC(N)=O Amb19134307 [1,0,1,0,0,0|2,0,0]=4 1858 B5R0.1 CNCC(N)=O Amb3940074 [1,0,1,0,0,0|2,0,0]=4 1859 B5R0.1 CNCC(N)=O Amb9151172 [1,0,1,0,0,0|2,0,0]=4 1860 B5R0.1 CNC[C@H](C)N Amb27452084 [1,0,1,0,0,0|1,0,1]=4 1861 B5R0.1 CNNC(=N)N Amb28049454 [1,0,1,0,0,0|2,0,0]=4 1862 B5R0.1 CNNC(N)=S Amb19514512 [1,0,1,0,0,0|1,1,0]=4 1863 B5R0.1 CNOC(N)=O Amb28341734 [1,0,1,0,0,0|2,0,0]=4 1864 B5R0.1 COC=C(C)C Amb25063853 [1,0,1,0,0,0|2,0,0]=4 1865 B5R0.1 COCC(=N)N Amb2696281 [1,0,1,0,0,0|2,0,0]=4 1866 B5R0.1 COCC(=N)N Amb33551686 [1,0,1,0,0,0|2,0,0]=4 1867 B5R0.1 COCC(=O)Cl Amb3939326 [1,0,1,0,0,0|2,0,0]=4 1868 B5R0.1 COCC(=O)O Amb3939876 [1,0,1,0,0,0|2,0,0]=4 1869 B5R0.1 COCC(C)=O Amb8513767 [1,0,1,0,0,0|1,0,0]=3 1870 B5R0.1 COCC(C)N Amb22233778 [1,0,1,0,0,0|1,0,1]=4 1871 B5R0.1 COCC(C)N Amb3939301 [1,0,1,0,0,0|1,0,1]=4 1872 B5R0.1 COCC(N)=O Amb1153776 [1,0,1,0,0,0|1,0,0]=3 1873 B5R0.1 COCC(N)=S Amb6268129 [1,0,1,0,0,0|1,1,0]=4 1874 B5R0.1 COC[C@@H](C)N Amb18529651 [1,0,1,0,0,0|1,0,1]=4 1875 B5R0.1 COC[C@@H](C)N Amb19149178 [1,0,1,0,0,0|1,0,1]=4 1876 B5R0.1 COC[C@H](C)N Amb17061637 [1,0,1,0,0,0|1,0,1]=4 1877 B5R0.1 COC[C@H](C)N Amb24052963 [1,0,1,0,0,0|1,0,1]=4 1878 B5R0.1 CON=C(C)C Amb24118020 [1,0,1,0,0,0|1,0,1]=4 1879 B5R0.1 CONC(=N)N Amb27411569 [1,0,1,0,0,0|1,0,0]=3 1880 B5R0.1 CONC(C)=O Amb25046114 [1,0,1,0,0,0|0,0,0]=2 1881 B5R0.1 CONC(C)=S Amb27759908 [1,0,1,0,0,0|0,1,0]=3 1882 B5R0.1 CONC(C)C Amb20668193 [1,0,1,0,0,0|1,0,1]=4 1883 B5R0.1 CONC(C)C Amb24333864 [1,0,1,0,0,0|1,0,1]=4 1884 B5R0.1 CONC(N)=O Amb2417193 [1,0,1,0,0,0|0,0,0]=2 1885 B5R0.1 CS(=O)CCO Amb28075364 [1,0,1,0,0,0|2,0,0]=4 1886 B5R0.1 CSCC(C)=O Amb20621731 [1,0,1,0,0,0|1,1,0]=4 1887 B5R0.1 CSCC(N)=O Amb19515874 [1,0,1,0,0,0|1,1,0]=4 1888 B5R0.1 CSNC(C)=O Amb22500292 [1,0,1,0,0,0|0,1,0]=3 1889 B5R0.1 C[C@@H](N)CCO Amb19515999 [1,0,1,0,0,0|1,0,1]=4 1890 B5R0.1 C[C@@H](N)CCO Amb22746127 [1,0,1,0,0,0|1,0,1]=4 1891 B5R0.1 C[C@@H](N)CON Amb28204295 [1,0,1,0,0,0|0,0,1]=3 1892 B5R0.1 C[C@@H](O)CON Amb26019757 [1,0,1,0,0,0|1,0,1]=4 1893 B5R0.1 C[C@H](N)CCO Amb19515998 [1,0,1,0,0,0|1,0,1]=4 1894 B5R0.1 C[C@H](N)CCO Amb24055217 [1,0,1,0,0,0|1,0,1]=4 1895 B5R0.1 C[C@H](O)CON Amb24557560 [1,0,1,0,0,0|1,0,1]=4 1896 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [1,0,1,0,0,0|2,0,0]=4 1897 B5R0.1 C\C=C/C(C)=O Amb28351405 [1,0,1,0,0,0|2,0,0]=4 1898 B5R0.1 C\C=C\C(C)=O Amb33941980 [1,0,1,0,0,0|2,0,0]=4 1899 B5R0.1 C\C=C\C(C)N Amb19514513 [1,0,1,0,0,0|2,0,0]=4 1900 B5R0.1 C\C=C\C(C)N Amb33295164 [1,0,1,0,0,0|2,0,0]=4 1901 B5R0.1 C\C=C\C(N)=O Amb4025906 [1,0,1,0,0,0|2,0,0]=4 1902 B5R0.1 N#CCC(N)=O Amb6336473 [1,0,1,0,0,0|1,0,1]=4 1903 B5R0.1 N=C(N)CCBr Amb4297021 [1,0,1,0,0,0|2,0,0]=4 1904 B5R0.1 N=C(N)CCCl Amb25839424 [1,0,1,0,0,0|2,0,0]=4 1905 B5R0.1 N=C(N)CCF Amb26024692 [1,0,1,0,0,0|2,0,0]=4 1906 B5R0.1 N=C(N)CCN Amb27265608 [1,0,1,0,0,0|2,0,0]=4 1907 B5R0.1 N=C(N)CCN Amb32687503 [1,0,1,0,0,0|2,0,0]=4 1908 B5R0.1 N=C(N)CCN Amb33164129 [1,0,1,0,0,0|2,0,0]=4 1909 B5R0.1 N=C(N)CCO Amb2696134 [1,0,1,0,0,0|1,0,0]=3 1910 B5R0.1 N=C(N)CCO Amb8630168 [1,0,1,0,0,0|1,0,0]=3 1911 B5R0.1 NC(=O)CC=O Amb25777522 [1,0,1,0,0,0|0,0,2]=4 1912 B5R0.1 NC(=O)CCBr Amb21618712 [1,0,1,0,0,0|1,0,0]=3 1913 B5R0.1 NC(=O)CCCl Amb1127569 [1,0,1,0,0,0|1,0,0]=3 1914 B5R0.1 NC(=O)CCF Amb28289353 [1,0,1,0,0,0|1,0,0]=3 1915 B5R0.1 NC(=O)CCI Amb27966778 [1,0,1,0,0,0|1,0,0]=3 1916 B5R0.1 NC(=O)CCO Amb9421407 [1,0,1,0,0,0|0,0,0]=2 1917 B5R0.1 NC(=O)CCS Amb27154802 [1,0,1,0,0,0|0,1,0]=3 1918 B5R0.1 NC(=O)CNCl Amb28315673 [1,0,1,0,0,0|2,0,0]=4 1919 B5R0.1 NC(=O)NC=O Amb8514974 [1,0,1,0,0,0|2,0,0]=4 1920 B5R0.1 NC(=O)NCO Amb17674341 [1,0,1,0,0,0|1,0,0]=3 1921 B5R0.1 NC(=O)SCCl Amb26419693 [1,0,1,0,0,0|2,0,0]=4 1922 B5R0.1 NC(=S)CCCl Amb33328368 [1,0,1,0,0,0|1,1,0]=4 1923 B5R0.1 NC(=S)CCF Amb27950563 [1,0,1,0,0,0|1,1,0]=4 1924 B5R0.1 NC(=S)CCO Amb8855295 [1,0,1,0,0,0|0,1,0]=3 1925 B5R0.1 NC(=S)CCS Amb17503271 [1,0,1,0,0,0|0,2,0]=4 1926 B5R0.1 NC(=S)NCO Amb27461395 [1,0,1,0,0,0|1,1,0]=4 1927 B5R0.1 NC(O)CCO Amb28252327 [1,0,1,0,0,0|0,0,2]=4 1928 B5R0.1 NCCC(=O)Cl Amb24117140 [1,0,1,0,0,0|2,0,0]=4 1929 B5R0.1 NCCC(=O)O Amb1935127 [1,0,1,0,0,0|2,0,0]=4 1930 B5R0.1 NCCC(=O)[O-] Amb28991330 [1,0,1,0,0,0|2,0,0]=4 1931 B5R0.1 NCCC(N)=O Amb1137251 [1,0,1,0,0,0|1,0,0]=3 1932 B5R0.1 NCCC(N)=O Amb9147573 [1,0,1,0,0,0|1,0,0]=3 1933 B5R0.1 NCCC(N)=S Amb18523221 [1,0,1,0,0,0|1,1,0]=4 1934 B5R0.1 NCCC(N)=S Amb33456385 [1,0,1,0,0,0|1,1,0]=4 1935 B5R0.1 NCCS(N)=O Amb33512527 [1,0,1,0,0,0|2,0,0]=4 1936 B5R0.1 NNCC(N)=O Amb32990162 [1,0,1,0,0,0|1,0,1]=4 1937 B5R0.1 NOCC(=O)O Amb1154237 [1,0,1,0,0,0|1,0,1]=4 1938 B5R0.1 NOCC(=O)O Amb4324355 [1,0,1,0,0,0|1,0,1]=4 1939 B5R0.1 NOCC(=O)O Amb8513076 [1,0,1,0,0,0|1,0,1]=4 1940 B5R0.1 NOCC(F)F Amb22008452 [1,0,1,0,0,0|2,0,0]=4 1941 B5R0.1 NOCC(N)=O Amb33528973 [1,0,1,0,0,0|0,0,1]=3 1942 B5R0.1 NS(=O)CCCl Amb24407159 [1,0,1,0,0,0|2,0,0]=4 1943 B5R0.1 NS(=O)CCF Amb32720391 [1,0,1,0,0,0|2,0,0]=4 1944 B5R0.1 NS(=O)CCO Amb32720357 [1,0,1,0,0,0|1,0,0]=3 1945 B5R0.1 O=C(Br)CCBr Amb24624022 [1,0,1,0,0,0|2,0,0]=4 1946 B5R0.1 O=C(Cl)CCBr Amb3941484 [1,0,1,0,0,0|2,0,0]=4 1947 B5R0.1 O=C(Cl)CCCl Amb3939313 [1,0,1,0,0,0|2,0,0]=4 1948 B5R0.1 O=C(Cl)CCF Amb27148631 [1,0,1,0,0,0|2,0,0]=4 1949 B5R0.1 O=C(Cl)CCI Amb28454579 [1,0,1,0,0,0|2,0,0]=4 1950 B5R0.1 O=C(Cl)CCO Amb27270014 [1,0,1,0,0,0|1,0,0]=3 1951 B5R0.1 O=C(F)CCCl Amb27257545 [1,0,1,0,0,0|2,0,0]=4 1952 B5R0.1 O=C(O)CCBr Amb2685479 [1,0,1,0,0,0|2,0,0]=4 1953 B5R0.1 O=C(O)CCCl Amb5395408 [1,0,1,0,0,0|2,0,0]=4 1954 B5R0.1 O=C(O)CCF Amb10603694 [1,0,1,0,0,0|2,0,0]=4 1955 B5R0.1 O=C(O)CCI Amb2688882 [1,0,1,0,0,0|2,0,0]=4 1956 B5R0.1 O=C(O)CCO Amb2688785 [1,0,1,0,0,0|1,0,0]=3 1957 B5R0.1 O=C(O)CCS Amb6608916 [1,0,1,0,0,0|1,1,0]=4 1958 B5R0.1 O=C(O)CNO Amb24120360 [1,0,1,0,0,0|2,0,0]=4 1959 B5R0.1 O=C(S)CCCl Amb27461454 [1,0,1,0,0,0|2,0,0]=4 1960 B5R0.1 O=C([O-])CCO Amb22055495 [1,0,1,0,0,0|1,0,0]=3 1961 B5R0.1 O=S(Cl)CCO Amb32720404 [1,0,1,0,0,0|2,0,0]=4 1962 B5R0.1 O=S(O)CCO Amb25937057 [1,0,1,0,0,0|2,0,0]=4 1963 B5R0.1 O=S([O-])CCO Amb32754124 [1,0,1,0,0,0|2,0,0]=4 1964 B5R0.1 O=[N+]([O-])CCO Amb3940447 [1,0,1,0,0,0|2,0,0]=4 1965 B5R0.2 C#CCCC=O Amb28049678 [1,0,1,0,0,0|2,0,0]=4 1966 B5R0.2 C#CCCON Amb28200358 [1,0,1,0,0,0|1,0,1]=4 1967 B5R0.2 C=C=CCCN Amb27252647 [1,0,1,0,0,0|2,0,0]=4 1968 B5R0.2 C=CCCC=O Amb4358616 [1,0,1,0,0,0|2,0,0]=4 1969 B5R0.2 C=CCCCN Amb18299670 [1,0,1,0,0,0|2,0,0]=4 1970 B5R0.2 C=CCCCN Amb22001451 [1,0,1,0,0,0|2,0,0]=4 1971 B5R0.2 C=CCCOC Amb28065418 [1,0,1,0,0,0|2,0,0]=4 1972 B5R0.2 C=CCCON Amb22233632 [1,0,1,0,0,0|1,0,0]=3 1973 B5R0.2 C=CCCON Amb22896384 [1,0,1,0,0,0|1,0,0]=3 1974 B5R0.2 C=CCNC=O Amb2781857 [1,0,1,0,0,0|1,0,1]=4 1975 B5R0.2 C=CCOCC Amb2684299 [1,0,1,0,0,0|2,0,0]=4 1976 B5R0.2 C=CNCCC Amb27461242 [1,0,1,0,0,0|2,0,0]=4 1977 B5R0.2 C=COCCC Amb17940706 [1,0,1,0,0,0|2,0,0]=4 1978 B5R0.2 C=COCCI Amb28245341 [1,0,1,0,0,0|2,0,0]=4 1979 B5R0.2 C=COCCN Amb17593030 [1,0,1,0,0,0|1,0,0]=3 1980 B5R0.2 C=COCCN Amb32409664 [1,0,1,0,0,0|1,0,0]=3 1981 B5R0.2 C=COCCO Amb17674184 [1,0,1,0,0,0|2,0,0]=4 1982 B5R0.2 CCC#CC=O Amb25663194 [1,0,1,0,0,0|2,0,0]=4 1983 B5R0.2 CCCCC=O Amb3939655 [1,0,1,0,0,0|2,0,0]=4 1984 B5R0.2 CCCCON Amb17101066 [1,0,1,0,0,0|1,0,1]=4 1985 B5R0.2 CCCCON Amb6308542 [1,0,1,0,0,0|1,0,1]=4 1986 B5R0.2 CCCNC=S Amb27754027 [1,0,1,0,0,0|1,1,0]=4 1987 B5R0.2 CCNCCN Amb6297789 [1,0,1,0,0,0|1,0,1]=4 1988 B5R0.2 CCNOCC Amb26852166 [1,0,1,0,0,0|1,0,1]=4 1989 B5R0.2 CCNOCC Amb32655926 [1,0,1,0,0,0|1,0,1]=4 1990 B5R0.2 CCOCCN Amb1130918 [1,0,1,0,0,0|1,0,1]=4 1991 B5R0.2 CCOCCN Amb29844456 [1,0,1,0,0,0|1,0,1]=4 1992 B5R0.2 CCO\C=C/Br Amb2455970 [1,0,1,0,0,0|2,0,0]=4 1993 B5R0.2 CCO\C=C/Cl Amb28315611 [1,0,1,0,0,0|2,0,0]=4 1994 B5R0.2 CCO\C=C\Br Amb10068669 [1,0,1,0,0,0|2,0,0]=4 1995 B5R0.2 CCSCC=O Amb17940620 [1,0,1,0,0,0|1,1,0]=4 1996 B5R0.2 CC\C=C\C=O Amb33986391 [1,0,1,0,0,0|2,0,0]=4 1997 B5R0.2 CC\C=C\CN Amb27447017 [1,0,1,0,0,0|2,0,0]=4 1998 B5R0.2 CC\C=C\CN Amb33526952 [1,0,1,0,0,0|2,0,0]=4 1999 B5R0.2 CNCCCN Amb2698065 [1,0,1,0,0,0|1,0,1]=4 2000 B5R0.2 CNOCCN Amb22411501 [1,0,1,0,0,0|0,0,1]=3 2001 B5R0.2 CNOCCN Amb22490915 [1,0,1,0,0,0|0,0,1]=3 2002 B5R0.2 CNOCCO Amb27637954 [1,0,1,0,0,0|1,0,1]=4 2003 B5R0.2 COCCC=O Amb10602324 [1,0,1,0,0,0|1,0,0]=3 2004 B5R0.2 COCCCN Amb3939346 [1,0,1,0,0,0|1,0,1]=4 2005 B5R0.2 COCCON Amb17194148 [1,0,1,0,0,0|2,0,0]=4 2006 B5R0.2 COCCON Amb20623946 [1,0,1,0,0,0|2,0,0]=4 2007 B5R0.2 COCNC=O Amb28049834 [1,0,1,0,0,0|2,0,0]=4 2008 B5R0.2 CONCCN Amb25733738 [1,0,1,0,0,0|0,0,1]=3 2009 B5R0.2 CONCCN Amb32645968 [1,0,1,0,0,0|0,0,1]=3 2010 B5R0.2 CONCCO Amb27658816 [1,0,1,0,0,0|1,0,1]=4 2011 B5R0.2 CO\N=C\CCl Amb27431885 [1,0,1,0,0,0|1,0,1]=4 2012 B5R0.2 CSCCC=O Amb3939952 [1,0,1,0,0,0|1,1,0]=4 2013 B5R0.2 CSCCON Amb25806571 [1,0,1,0,0,0|2,0,0]=4 2014 B5R0.2 C\C=C\CCN Amb19374038 [1,0,1,0,0,0|2,0,0]=4 2015 B5R0.2 C\C=C\CCN Amb33038294 [1,0,1,0,0,0|2,0,0]=4 2016 B5R0.2 C\C=C\CON Amb18560216 [1,0,1,0,0,0|1,0,1]=4 2017 B5R0.2 C\C=C\OCC Amb8516635 [1,0,1,0,0,0|2,0,0]=4 2018 B5R0.2 C\C=N\CCN Amb27837883 [1,0,1,0,0,0|1,0,1]=4 2019 B5R0.2 N#CCCC=O Amb3941009 [1,0,1,0,0,0|1,0,1]=4 2020 B5R0.2 N#CCOC=O Amb22347946 [1,0,1,0,0,0|0,0,2]=4 2021 B5R0.2 N#CNCCN Amb28049617 [1,0,1,0,0,0|1,0,1]=4 2022 B5R0.2 NCCCC=O Amb26851044 [1,0,1,0,0,0|1,0,0]=3 2023 B5R0.2 NCCCN=O Amb28049442 [1,0,1,0,0,0|1,0,1]=4 2024 B5R0.2 NCCCNN Amb27392601 [1,0,1,0,0,0|2,0,0]=4 2025 B5R0.2 NCCCNO Amb27882495 [1,0,1,0,0,0|1,0,1]=4 2026 B5R0.2 NCCCNO Amb32729324 [1,0,1,0,0,0|1,0,1]=4 2027 B5R0.2 NCCOC=O Amb24612320 [1,0,1,0,0,0|0,0,0]=2 2028 B5R0.2 NCCOCF Amb33378706 [1,0,1,0,0,0|1,0,1]=4 2029 B5R0.2 NCCSN=O Amb27950442 [1,0,1,0,0,0|0,1,1]=4 2030 B5R0.2 NCC\C=C\Cl Amb27391191 [1,0,1,0,0,0|2,0,0]=4 2031 B5R0.2 NOCCCF Amb24632017 [1,0,1,0,0,0|1,0,1]=4 2032 B5R0.2 NOCCCO Amb18061671 [1,0,1,0,0,0|0,0,2]=4 2033 B5R0.2 NOCCCS Amb17608230 [1,0,1,0,0,0|0,1,1]=4 2034 B5R0.2 NOCCCS Amb27489799 [1,0,1,0,0,0|0,1,1]=4 2035 B5R0.2 NOCCON Amb31308386 [1,0,1,0,0,0|2,0,0]=4 2036 B5R0.2 NOC\C=C\Cl Amb32653337 [1,0,1,0,0,0|1,0,1]=4 2037 B5R0.2 NOC\C=C\Cl Amb32701613 [1,0,1,0,0,0|1,0,1]=4 2038 B5R0.2 N\C=N\OC=O Amb28118665 [1,0,1,0,0,0|1,0,1]=4 2039 B5R0.2 O=BOCCBr Amb27954923 [1,0,1,0,0,0|2,0,0]=4 2040 B5R0.2 O=CCCC=O Amb8395090 [1,0,1,0,0,0|2,0,0]=4 2041 B5R0.2 O=CCCCBr Amb18644189 [1,0,1,0,0,0|2,0,0]=4 2042 B5R0.2 O=CCCCCl Amb8395190 [1,0,1,0,0,0|2,0,0]=4 2043 B5R0.2 O=CCCCF Amb24056028 [1,0,1,0,0,0|2,0,0]=4 2044 B5R0.2 O=CCCCI Amb27249641 [1,0,1,0,0,0|2,0,0]=4 2045 B5R0.2 O=CCCCO Amb24589235 [1,0,1,0,0,0|2,0,0]=4 2046 B5R0.2 O=CCCSS Amb22524519 [1,0,1,0,0,0|1,1,0]=4 2047 B5R0.2 O=CCNC=O Amb26370295 [1,0,1,0,0,0|1,0,1]=4 2048 B5R0.2 O=CNCCF Amb28205988 [1,0,1,0,0,0|1,0,0]=3 2049 B5R0.2 O=COCCBr Amb27816149 [1,0,1,0,0,0|1,0,0]=3 2050 B5R0.2 O=COCCO Amb26625741 [1,0,1,0,0,0|1,0,0]=3 2051 B5R0.2 O=NOCCCl Amb27205298 [1,0,1,0,0,0|1,0,1]=4 2052 B5R0.2 O=NOCCI Amb28188003 [1,0,1,0,0,0|1,0,1]=4 2053 B5R0.2 O=NOCCO Amb22363071 [1,0,1,0,0,0|1,0,1]=4 2054 B5R0.3 C#CC(=O)CC Amb25989183 [1,0,1,0,0,0|2,0,0]=4 2055 B5R0.3 C#CC(=O)CN Amb27424437 [1,0,1,0,0,0|1,0,1]=4 2056 B5R0.3 C#CC(=O)NC Amb25147319 [1,0,1,0,0,0|1,0,1]=4 2057 B5R0.3 C#CC(=O)OC Amb2725608 [1,0,1,0,0,0|1,0,1]=4 2058 B5R0.3 C#CC(N)CO Amb26985041 [1,0,1,0,0,0|1,0,1]=4 2059 B5R0.3 C#CC(N)CO Amb33551336 [1,0,1,0,0,0|1,0,1]=4 2060 B5R0.3 C#C[C@H](N)CO Amb28345581 [1,0,1,0,0,0|1,0,1]=4 2061 B5R0.3 C=C(CBr)OC Amb25177183 [1,0,1,0,0,0|2,0,0]=4 2062 B5R0.3 C=C(CC)CN Amb27195088 [1,0,1,0,0,0|2,0,0]=4 2063 B5R0.3 C=C(CC)CN Amb28555329 [1,0,1,0,0,0|2,0,0]=4 2064 B5R0.3 C=C(CC)CO Amb33549724 [1,0,1,0,0,0|2,0,0]=4 2065 B5R0.3 C=C(CN)CO Amb26960439 [1,0,1,0,0,0|2,0,0]=4 2066 B5R0.3 C=CC(=O)CC Amb3940490 [1,0,1,0,0,0|2,0,0]=4 2067 B5R0.3 C=CC(=O)NC Amb9480402 [1,0,1,0,0,0|1,0,1]=4 2068 B5R0.3 C=CC(=O)NO Amb28049735 [1,0,1,0,0,0|0,0,2]=4 2069 B5R0.3 C=CC(=O)OC Amb22351400 [1,0,1,0,0,0|1,0,1]=4 2070 B5R0.3 C=CC(=O)OC Amb2793072 [1,0,1,0,0,0|1,0,1]=4 2071 B5R0.3 C=CC(Br)CO Amb25888060 [1,0,1,0,0,0|2,0,0]=4 2072 B5R0.3 C=CC(C)CO Amb22347861 [1,0,1,0,0,0|2,0,0]=4 2073 B5R0.3 C=CC(C)ON Amb22896392 [1,0,1,0,0,0|2,0,0]=4 2074 B5R0.3 C=CC(C)ON Amb25146282 [1,0,1,0,0,0|2,0,0]=4 2075 B5R0.3 C=CC(Cl)CO Amb26946125 [1,0,1,0,0,0|2,0,0]=4 2076 B5R0.3 C=CC(F)CN Amb26476565 [1,0,1,0,0,0|2,0,0]=4 2077 B5R0.3 C=CC(I)CO Amb28291610 [1,0,1,0,0,0|2,0,0]=4 2078 B5R0.3 C=CC(N)CC Amb26349978 [1,0,1,0,0,0|2,0,0]=4 2079 B5R0.3 C=CC(N)CC Amb31291608 [1,0,1,0,0,0|2,0,0]=4 2080 B5R0.3 C=CC(N)CF Amb27593895 [1,0,1,0,0,0|2,0,0]=4 2081 B5R0.3 C=CC(N)CO Amb19374935 [1,0,1,0,0,0|1,0,0]=3 2082 B5R0.3 C=CC(N)CO Amb28555332 [1,0,1,0,0,0|1,0,0]=3 2083 B5R0.3 C=CC(N)CS Amb18120558 [1,0,1,0,0,0|1,1,0]=4 2084 B5R0.3 C=CC(O)CN Amb8630112 [1,0,1,0,0,0|2,0,0]=4 2085 B5R0.3 C=CC(O)CO Amb17610151 [1,0,1,0,0,0|2,0,0]=4 2086 B5R0.3 C=CC(S)CO Amb27960052 [1,0,1,0,0,0|2,0,0]=4 2087 B5R0.3 C=C[C@@H](N)CO Amb19886656 [1,0,1,0,0,0|1,0,0]=3 2088 B5R0.3 C=C[C@@H](N)CO Amb27247092 [1,0,1,0,0,0|1,0,0]=3 2089 B5R0.3 C=C[C@@H](O)CN Amb27837717 [1,0,1,0,0,0|2,0,0]=4 2090 B5R0.3 C=C[C@H](C)CO Amb27470174 [1,0,1,0,0,0|2,0,0]=4 2091 B5R0.3 C=C[C@H](N)CO Amb25147462 [1,0,1,0,0,0|1,0,0]=3 2092 B5R0.3 C=C[C@H](N)CO Amb8631419 [1,0,1,0,0,0|1,0,0]=3 2093 B5R0.3 C=C[C@H](O)CO Amb19888350 [1,0,1,0,0,0|2,0,0]=4 2094 B5R0.3 CC(C=O)CF Amb24638421 [1,0,1,0,0,0|2,0,0]=4 2095 B5R0.3 CC(C=O)O[SiH3] Amb28284225 [1,0,1,0,0,0|2,0,0]=4 2096 B5R0.3 CC(CN)CO Amb2699160 [1,0,1,0,0,0|1,0,1]=4 2097 B5R0.3 CC(CN)CO Amb8869013 [1,0,1,0,0,0|1,0,1]=4 2098 B5R0.3 CC(CO)N=O Amb28365917 [1,0,1,0,0,0|2,0,0]=4 2099 B5R0.3 CC(CO)NN Amb20622512 [1,0,1,0,0,0|2,0,0]=4 2100 B5R0.3 CC(CO)NN Amb22231763 [1,0,1,0,0,0|2,0,0]=4 2101 B5R0.3 CCC(=N)NO Amb19515903 [1,0,1,0,0,0|1,0,0]=3 2102 B5R0.3 CCC(=O)C#N Amb17231799 [1,0,1,0,0,0|2,0,0]=4 2103 B5R0.3 CCC(=O)C=O Amb22228532 [1,0,1,0,0,0|1,0,1]=4 2104 B5R0.3 CCC(=O)CBr Amb2684976 [1,0,1,0,0,0|2,0,0]=4 2105 B5R0.3 CCC(=O)CC Amb4605995 [1,0,1,0,0,0|2,0,0]=4 2106 B5R0.3 CCC(=O)CCl Amb19338105 [1,0,1,0,0,0|2,0,0]=4 2107 B5R0.3 CCC(=O)CF Amb23454809 [1,0,1,0,0,0|2,0,0]=4 2108 B5R0.3 CCC(=O)CN Amb18203134 [1,0,1,0,0,0|1,0,0]=3 2109 B5R0.3 CCC(=O)CN Amb19959206 [1,0,1,0,0,0|1,0,0]=3 2110 B5R0.3 CCC(=O)CO Amb22227965 [1,0,1,0,0,0|1,0,0]=3 2111 B5R0.3 CCC(=O)CO Amb33529428 [1,0,1,0,0,0|1,0,0]=3 2112 B5R0.3 CCC(=O)CS Amb27843254 [1,0,1,0,0,0|1,1,0]=4 2113 B5R0.3 CCC(=O)NN Amb1104708 [1,0,1,0,0,0|1,0,0]=3 2114 B5R0.3 CCC(=O)NO Amb6273963 [1,0,1,0,0,0|0,0,0]=2 2115 B5R0.3 CCC(=O)OC Amb8513418 [1,0,1,0,0,0|1,0,0]=3 2116 B5R0.3 CCC(=S)NN Amb26505324 [1,0,1,0,0,0|1,1,0]=4 2117 B5R0.3 CCC(=S)OC Amb22168046 [1,0,1,0,0,0|1,1,0]=4 2118 B5R0.3 CCC(Br)C=O Amb18124003 [1,0,1,0,0,0|2,0,0]=4 2119 B5R0.3 CCC(C)C=O Amb3939899 [1,0,1,0,0,0|2,0,0]=4 2120 B5R0.3 CCC(Cl)C=O Amb18122610 [1,0,1,0,0,0|2,0,0]=4 2121 B5R0.3 CCC(N)CN Amb33534078 [1,0,1,0,0,0|1,0,1]=4 2122 B5R0.3 CCC(N)CN Amb9380664 [1,0,1,0,0,0|1,0,1]=4 2123 B5R0.3 CCC(N)CO Amb9703106 [1,0,1,0,0,0|1,0,1]=4 2124 B5R0.3 CCC(N)[SH]=O Amb28241197 [1,0,1,0,0,0|2,0,0]=4 2125 B5R0.3 CCN(N)C=O Amb24428031 [1,0,1,0,0,0|2,0,0]=4 2126 B5R0.3 CC[C@@H](C)C=O Amb27759282 [1,0,1,0,0,0|2,0,0]=4 2127 B5R0.3 CC[C@@H](N)CO Amb3940043 [1,0,1,0,0,0|1,0,1]=4 2128 B5R0.3 CC[C@H](C)C=O Amb27837733 [1,0,1,0,0,0|2,0,0]=4 2129 B5R0.3 CC[C@H](N)C=O Amb27460588 [1,0,1,0,0,0|1,0,0]=3 2130 B5R0.3 CC[C@H](N)CO Amb3939341 [1,0,1,0,0,0|1,0,1]=4 2131 B5R0.3 CC\C(C)=N\O Amb8516521 [1,0,1,0,0,0|1,0,1]=4 2132 B5R0.3 CC\C(N)=N/O Amb10609125 [1,0,1,0,0,0|1,0,1]=4 2133 B5R0.3 CC\C(N)=N\O Amb1125701 [1,0,1,0,0,0|1,0,1]=4 2134 B5R0.3 CC\C(N)=N\O Amb19883708 [1,0,1,0,0,0|1,0,1]=4 2135 B5R0.3 CN(C=O)CO Amb27253133 [1,0,1,0,0,0|2,0,0]=4 2136 B5R0.3 CNC(=N)CO Amb23514994 [1,0,1,0,0,0|2,0,0]=4 2137 B5R0.3 CNC(=N)NN Amb3429276 [1,0,1,0,0,0|2,0,0]=4 2138 B5R0.3 CNC(=O)C#N Amb28423537 [1,0,1,0,0,0|0,0,2]=4 2139 B5R0.3 CNC(=O)CBr Amb33541701 [1,0,1,0,0,0|1,0,0]=3 2140 B5R0.3 CNC(=O)CCl Amb6365480 [1,0,1,0,0,0|1,0,0]=3 2141 B5R0.3 CNC(=O)CI Amb23512488 [1,0,1,0,0,0|1,0,0]=3 2142 B5R0.3 CNC(=O)CN Amb2371053 [1,0,1,0,0,0|0,0,0]=2 2143 B5R0.3 CNC(=O)CN Amb436613 [1,0,1,0,0,0|0,0,0]=2 2144 B5R0.3 CNC(=O)CO Amb3375431 [1,0,1,0,0,0|1,0,0]=3 2145 B5R0.3 CNC(=O)CS Amb22348209 [1,0,1,0,0,0|1,0,0]=3 2146 B5R0.3 CNC(=O)NC Amb4037273 [1,0,1,0,0,0|2,0,0]=4 2147 B5R0.3 CNC(=O)NN Amb8854034 [1,0,1,0,0,0|1,0,0]=3 2148 B5R0.3 CNC(=O)NO Amb25185417 [1,0,1,0,0,0|1,0,0]=3 2149 B5R0.3 CNC(=O)OC Amb16185431 [1,0,1,0,0,0|2,0,0]=4 2150 B5R0.3 CNC(=S)CCl Amb28411477 [1,0,1,0,0,0|1,1,0]=4 2151 B5R0.3 CNC(=S)CN Amb26326922 [1,0,1,0,0,0|0,1,0]=3 2152 B5R0.3 CNC(=S)NN Amb2689743 [1,0,1,0,0,0|1,1,0]=4 2153 B5R0.3 CNC(C)CN Amb33266033 [1,0,1,0,0,0|1,0,1]=4 2154 B5R0.3 CNC(C)CN Amb33529517 [1,0,1,0,0,0|1,0,1]=4 2155 B5R0.3 CN[C@@H](C)CN Amb28316231 [1,0,1,0,0,0|1,0,1]=4 2156 B5R0.3 CN\C(C)=N/N Amb24738841 [1,0,1,0,0,0|2,0,0]=4 2157 B5R0.3 CN\C(N)=N\N Amb22058750 [1,0,1,0,0,0|2,0,0]=4 2158 B5R0.3 COC(=N)CBr Amb27206918 [1,0,1,0,0,0|2,0,0]=4 2159 B5R0.3 COC(=N)CCl Amb26458698 [1,0,1,0,0,0|2,0,0]=4 2160 B5R0.3 COC(=N)CCl Amb28991311 [1,0,1,0,0,0|2,0,0]=4 2161 B5R0.3 COC(=O)BF Amb27639427 [1,0,1,0,0,0|2,0,0]=4 2162 B5R0.3 COC(=O)C#N Amb22350567 [1,0,1,0,0,0|0,0,2]=4 2163 B5R0.3 COC(=O)C=O Amb29083438 [1,0,1,0,0,0|1,0,1]=4 2164 B5R0.3 COC(=O)C=O Amb8384463 [1,0,1,0,0,0|1,0,1]=4 2165 B5R0.3 COC(=O)CBr Amb3939968 [1,0,1,0,0,0|1,0,0]=3 2166 B5R0.3 COC(=O)CCl Amb2792917 [1,0,1,0,0,0|1,0,0]=3 2167 B5R0.3 COC(=O)CF Amb2689433 [1,0,1,0,0,0|1,0,0]=3 2168 B5R0.3 COC(=O)CI Amb22036593 [1,0,1,0,0,0|1,0,0]=3 2169 B5R0.3 COC(=O)CN Amb1153098 [1,0,1,0,0,0|0,0,0]=2 2170 B5R0.3 COC(=O)CN Amb534106 [1,0,1,0,0,0|0,0,0]=2 2171 B5R0.3 COC(=O)CO Amb2778433 [1,0,1,0,0,0|1,0,0]=3 2172 B5R0.3 COC(=O)CS Amb6608893 [1,0,1,0,0,0|1,0,0]=3 2173 B5R0.3 COC(=O)NN Amb1800924 [1,0,1,0,0,0|1,0,0]=3 2174 B5R0.3 COC(=O)OC Amb6609028 [1,0,1,0,0,0|2,0,0]=4 2175 B5R0.3 COC(=O)SCl Amb2689119 [1,0,1,0,0,0|2,0,0]=4 2176 B5R0.3 COC(=S)NN Amb22504666 [1,0,1,0,0,0|1,1,0]=4 2177 B5R0.3 COC(C)C=O Amb27875195 [1,0,1,0,0,0|2,0,0]=4 2178 B5R0.3 COC(C)CN Amb2140564 [1,0,1,0,0,0|1,0,1]=4 2179 B5R0.3 COC(C)CN Amb927898 [1,0,1,0,0,0|1,0,1]=4 2180 B5R0.3 COS(=O)CCl Amb27468688 [1,0,1,0,0,0|2,0,0]=4 2181 B5R0.3 CO[C@@H](C)C=O Amb28121215 [1,0,1,0,0,0|2,0,0]=4 2182 B5R0.3 CO[C@@H](C)CN Amb22746816 [1,0,1,0,0,0|1,0,1]=4 2183 B5R0.3 CO[C@@H](C)CN Amb27613930 [1,0,1,0,0,0|1,0,1]=4 2184 B5R0.3 CO[C@H](C)C=O Amb28284155 [1,0,1,0,0,0|2,0,0]=4 2185 B5R0.3 CO[C@H](C)CN Amb26959026 [1,0,1,0,0,0|1,0,1]=4 2186 B5R0.3 CO[C@H](C)CN Amb33801901 [1,0,1,0,0,0|1,0,1]=4 2187 B5R0.3 CSC(=O)CN Amb27482013 [1,0,1,0,0,0|0,1,0]=3 2188 B5R0.3 C[C@@H](C=O)CBr Amb28200669 [1,0,1,0,0,0|2,0,0]=4 2189 B5R0.3 C[C@@H](C=O)CO Amb27455063 [1,0,1,0,0,0|1,0,0]=3 2190 B5R0.3 C[C@H](CN)CO Amb26065118 [1,0,1,0,0,0|1,0,1]=4 2191 B5R0.3 C\C=C(/I)CN Amb27392321 [1,0,1,0,0,0|2,0,0]=4 2192 B5R0.3 C\C=C(\Br)CN Amb27650590 [1,0,1,0,0,0|2,0,0]=4 2193 B5R0.3 N#CC(=O)CN Amb27811242 [1,0,1,0,0,0|2,0,0]=4 2194 B5R0.3 N#CC(N)CN Amb25250533 [1,0,1,0,0,0|1,0,1]=4 2195 B5R0.3 N#CC(N)CN Amb33291351 [1,0,1,0,0,0|1,0,1]=4 2196 B5R0.3 N#CC(N)CO Amb19372799 [1,0,1,0,0,0|0,0,2]=4 2197 B5R0.3 N#CC(N)CO Amb28555331 [1,0,1,0,0,0|0,0,2]=4 2198 B5R0.3 N#C[C@H](N)CO Amb28399707 [1,0,1,0,0,0|0,0,2]=4 2199 B5R0.3 N=C(CO)NO Amb21520323 [1,0,1,0,0,0|2,0,0]=4 2200 B5R0.3 NC(C=O)C=O Amb22751007 [1,0,1,0,0,0|0,0,2]=4 2201 B5R0.3 NC(C=O)CS Amb27626007 [1,0,1,0,0,0|0,1,0]=3 2202 B5R0.3 NC(CO)CF Amb20622637 [1,0,1,0,0,0|1,0,1]=4 2203 B5R0.3 NC(CO)CF Amb25734803 [1,0,1,0,0,0|1,0,1]=4 2204 B5R0.3 NC(CO)CO Amb3939868 [1,0,1,0,0,0|0,0,2]=4 2205 B5R0.3 NC(CO)CO Amb8396812 [1,0,1,0,0,0|0,0,2]=4 2206 B5R0.3 NCC(=O)CCl Amb27225872 [1,0,1,0,0,0|2,0,0]=4 2207 B5R0.3 NCC(=O)CF Amb33377281 [1,0,1,0,0,0|2,0,0]=4 2208 B5R0.3 NCC(=O)CN Amb17593034 [1,0,1,0,0,0|2,0,0]=4 2209 B5R0.3 NCC(=O)CN Amb22227724 [1,0,1,0,0,0|2,0,0]=4 2210 B5R0.3 NCC(=O)NN Amb18559478 [1,0,1,0,0,0|1,0,0]=3 2211 B5R0.3 NCC(=O)NN Amb33804098 [1,0,1,0,0,0|1,0,0]=3 2212 B5R0.3 NCC(=O)NO Amb2433859 [1,0,1,0,0,0|0,0,0]=2 2213 B5R0.3 NCC(=O)OBr Amb27983785 [1,0,1,0,0,0|1,0,0]=3 2214 B5R0.3 NCC(=O)OCl Amb27628854 [1,0,1,0,0,0|1,0,0]=3 2215 B5R0.3 NCC(=O)ON Amb27473245 [1,0,1,0,0,0|1,0,0]=3 2216 B5R0.3 NCC(Cl)CO Amb27856087 [1,0,1,0,0,0|1,0,1]=4 2217 B5R0.3 NCC(F)CO Amb25968755 [1,0,1,0,0,0|1,0,1]=4 2218 B5R0.3 NCC(N)CBr Amb25888055 [1,0,1,0,0,0|1,0,1]=4 2219 B5R0.3 NCC(N)CCl Amb24117148 [1,0,1,0,0,0|1,0,1]=4 2220 B5R0.3 NCC(N)CN Amb19149260 [1,0,1,0,0,0|1,0,1]=4 2221 B5R0.3 NCC(N)CO Amb24117147 [1,0,1,0,0,0|0,0,1]=3 2222 B5R0.3 NCC(N)CO Amb33292549 [1,0,1,0,0,0|0,0,1]=3 2223 B5R0.3 NCC(N)CS Amb27167387 [1,0,1,0,0,0|0,1,1]=4 2224 B5R0.3 NCC(O)CO Amb3940459 [1,0,1,0,0,0|1,0,1]=4 2225 B5R0.3 NCC(S)CO Amb27811256 [1,0,1,0,0,0|1,0,1]=4 2226 B5R0.3 NC[C@@H](F)CO Amb27199563 [1,0,1,0,0,0|1,0,1]=4 2227 B5R0.3 NC[C@@H](N)CO Amb19374894 [1,0,1,0,0,0|0,0,1]=3 2228 B5R0.3 NC[C@@H](N)CO Amb32990166 [1,0,1,0,0,0|0,0,1]=3 2229 B5R0.3 NC[C@@H](O)CO Amb32992847 [1,0,1,0,0,0|1,0,1]=4 2230 B5R0.3 NC[C@@H](O)CO Amb4037015 [1,0,1,0,0,0|1,0,1]=4 2231 B5R0.3 NC[C@H](F)C=O Amb27204919 [1,0,1,0,0,0|1,0,0]=3 2232 B5R0.3 NC[C@H](F)CO Amb27605560 [1,0,1,0,0,0|1,0,1]=4 2233 B5R0.3 NC[C@H](F)CO Amb35751724 [1,0,1,0,0,0|1,0,1]=4 2234 B5R0.3 NC[C@H](N)CO Amb26390006 [1,0,1,0,0,0|0,0,1]=3 2235 B5R0.3 NC[C@H](N)CO Amb32789590 [1,0,1,0,0,0|0,0,1]=3 2236 B5R0.3 NC[C@H](O)CO Amb20670545 [1,0,1,0,0,0|1,0,1]=4 2237 B5R0.3 NC[C@H](O)CO Amb8386084 [1,0,1,0,0,0|1,0,1]=4 2238 B5R0.3 NC\C(N)=N\O Amb28241447 [1,0,1,0,0,0|1,0,1]=4 2239 B5R0.3 NNC(=O)CCl Amb10570260 [1,0,1,0,0,0|2,0,0]=4 2240 B5R0.3 NNC(=O)CCl Amb4037964 [1,0,1,0,0,0|2,0,0]=4 2241 B5R0.3 NNC(=O)CO Amb17615031 [1,0,1,0,0,0|2,0,0]=4 2242 B5R0.3 NNC(=O)CS Amb33537685 [1,0,1,0,0,0|2,0,0]=4 2243 B5R0.3 NNC(=O)NN Amb2780494 [1,0,1,0,0,0|2,0,0]=4 2244 B5R0.3 NNC(=O)NO Amb3427804 [1,0,1,0,0,0|1,0,0]=3 2245 B5R0.3 N[C@@H](CO)CF Amb33376913 [1,0,1,0,0,0|1,0,1]=4 2246 B5R0.3 N[C@H](C=O)CO Amb27170308 [1,0,1,0,0,0|0,0,0]=2 2247 B5R0.3 N[C@H](CO)CF Amb33376914 [1,0,1,0,0,0|1,0,1]=4 2248 B5R0.3 N[C@H](CO)CF Amb33620306 [1,0,1,0,0,0|1,0,1]=4 2249 B5R0.3 N\C(C=O)=C/O Amb28315747 [1,0,1,0,0,0|0,0,2]=4 2250 B5R0.3 O=C(CBr)NBr Amb27432082 [1,0,1,0,0,0|2,0,0]=4 2251 B5R0.3 O=C(CBr)NCl Amb28284405 [1,0,1,0,0,0|2,0,0]=4 2252 B5R0.3 O=C(CBr)OBr Amb28454578 [1,0,1,0,0,0|2,0,0]=4 2253 B5R0.3 O=C(CCl)NO Amb25324352 [1,0,1,0,0,0|1,0,0]=3 2254 B5R0.3 O=C(CI)NO Amb27635227 [1,0,1,0,0,0|1,0,0]=3 2255 B5R0.3 O=C(CO)CBr Amb25945111 [1,0,1,0,0,0|2,0,0]=4 2256 B5R0.3 O=C(CO)CCl Amb28322779 [1,0,1,0,0,0|2,0,0]=4 2257 B5R0.3 O=C(CO)CI Amb28121276 [1,0,1,0,0,0|2,0,0]=4 2258 B5R0.3 O=C(CO)CO Amb6600007 [1,0,1,0,0,0|2,0,0]=4 2259 B5R0.3 O=C(CO)NO Amb27596845 [1,0,1,0,0,0|1,0,0]=3 2260 B5R0.3 O=CC(=O)CO Amb17593031 [1,0,1,0,0,0|1,0,1]=4 2261 B5R0.3 O=CC(Br)CBr Amb17670591 [1,0,1,0,0,0|2,0,0]=4 2262 B5R0.3 O=CC(Br)CCl Amb18647566 [1,0,1,0,0,0|2,0,0]=4 2263 B5R0.3 O=CC(Cl)CO Amb17593122 [1,0,1,0,0,0|1,0,0]=3 2264 B5R0.3 O=CC(F)CF Amb28051572 [1,0,1,0,0,0|2,0,0]=4 2265 B5R0.3 O=CC(F)CO Amb28043006 [1,0,1,0,0,0|1,0,0]=3 2266 B5R0.3 O=CC(O)CO Amb3940759 [1,0,1,0,0,0|1,0,0]=3 2267 B5R0.3 O=CC(S)CO Amb4020723 [1,0,1,0,0,0|1,0,0]=3 2268 B5R0.3 O=C[C@@H](O)CF Amb28247090 [1,0,1,0,0,0|2,0,0]=4 2269 B5R0.3 O=C[C@@H](O)CO Amb16232009 [1,0,1,0,0,0|1,0,0]=3 2270 B5R0.3 O=C[C@H](O)CO Amb20242417 [1,0,1,0,0,0|1,0,0]=3 2271 B5R0.3 O=NC(Cl)CO Amb27232983 [1,0,1,0,0,0|2,0,0]=4 2272 B5R0.5 C=C(C)C(=O)O Amb6608998 [1,0,1,0,0,0|1,0,1]=4 2273 B5R0.5 C=C(C)C(N)=O Amb6609019 [1,0,1,0,0,0|1,0,1]=4 2274 B5R0.5 C=C(C)[C@@H](C)N Amb33199904 [1,0,1,0,0,0|2,0,0]=4 2275 B5R0.5 C=C(C)[C@H](C)N Amb33199903 [1,0,1,0,0,0|2,0,0]=4 2276 B5R0.5 CC(=O)C(=O)O Amb932807 [1,0,1,0,0,0|1,0,1]=4 2277 B5R0.5 CC(=O)C(C)Br Amb8384405 [1,0,1,0,0,0|2,0,0]=4 2278 B5R0.5 CC(=O)C(C)C Amb4605987 [1,0,1,0,0,0|2,0,0]=4 2279 B5R0.5 CC(=O)C(C)Cl Amb9702838 [1,0,1,0,0,0|2,0,0]=4 2280 B5R0.5 CC(=O)C(C)F Amb10841897 [1,0,1,0,0,0|2,0,0]=4 2281 B5R0.5 CC(=O)C(C)I Amb28315734 [1,0,1,0,0,0|2,0,0]=4 2282 B5R0.5 CC(=O)C(C)N Amb17593029 [1,0,1,0,0,0|1,0,0]=3 2283 B5R0.5 CC(=O)C(C)N Amb19148817 [1,0,1,0,0,0|1,0,0]=3 2284 B5R0.5 CC(=O)C(C)O Amb6608962 [1,0,1,0,0,0|2,0,0]=4 2285 B5R0.5 CC(=O)C(C)S Amb8393169 [1,0,1,0,0,0|2,0,0]=4 2286 B5R0.5 CC(=O)C(N)=O Amb17593028 [1,0,1,0,0,0|1,0,1]=4 2287 B5R0.5 CC(=O)C(O)O Amb22436762 [1,0,1,0,0,0|2,0,0]=4 2288 B5R0.5 CC(=O)N(C)N Amb17593037 [1,0,1,0,0,0|2,0,0]=4 2289 B5R0.5 CC(=O)[C@@H](C)N Amb22748924 [1,0,1,0,0,0|1,0,0]=3 2290 B5R0.5 CC(=O)[C@H](C)N Amb26418661 [1,0,1,0,0,0|1,0,0]=3 2291 B5R0.5 CC(=S)C(=O)O Amb27424126 [1,0,1,0,0,0|1,0,1]=4 2292 B5R0.5 CC(Br)C(=O)Br Amb7969424 [1,0,1,0,0,0|2,0,0]=4 2293 B5R0.5 CC(Br)C(=O)Cl Amb6296592 [1,0,1,0,0,0|2,0,0]=4 2294 B5R0.5 CC(Br)C(=O)O Amb2795764 [1,0,1,0,0,0|1,0,0]=3 2295 B5R0.5 CC(Br)C(N)=O Amb2779903 [1,0,1,0,0,0|1,0,0]=3 2296 B5R0.5 CC(Br)C(N)=S Amb27971550 [1,0,1,0,0,0|1,1,0]=4 2297 B5R0.5 CC(C)C(=N)N Amb2695035 [1,0,1,0,0,0|2,0,0]=4 2298 B5R0.5 CC(C)C(=N)N Amb2725173 [1,0,1,0,0,0|2,0,0]=4 2299 B5R0.5 CC(C)C(=O)Br Amb22731066 [1,0,1,0,0,0|2,0,0]=4 2300 B5R0.5 CC(C)C(=O)Cl Amb3939052 [1,0,1,0,0,0|2,0,0]=4 2301 B5R0.5 CC(C)C(=O)F Amb25848493 [1,0,1,0,0,0|2,0,0]=4 2302 B5R0.5 CC(C)C(=O)I Amb26992316 [1,0,1,0,0,0|2,0,0]=4 2303 B5R0.5 CC(C)C(=O)O Amb3939822 [1,0,1,0,0,0|1,0,0]=3 2304 B5R0.5 CC(C)C(=O)S Amb33482574 [1,0,1,0,0,0|1,1,0]=4 2305 B5R0.5 CC(C)C(N)=O Amb1153145 [1,0,1,0,0,0|1,0,0]=3 2306 B5R0.5 CC(C)C(N)=S Amb6242688 [1,0,1,0,0,0|1,1,0]=4 2307 B5R0.5 CC(C)N(=O)O Amb33789630 [1,0,1,0,0,0|2,0,0]=4 2308 B5R0.5 CC(C)S(=O)O Amb27245066 [1,0,1,0,0,0|2,0,0]=4 2309 B5R0.5 CC(C)S(N)=O Amb25675545 [1,0,1,0,0,0|2,0,0]=4 2310 B5R0.5 CC(Cl)C(=N)N Amb20622290 [1,0,1,0,0,0|2,0,0]=4 2311 B5R0.5 CC(Cl)C(=N)N Amb4297060 [1,0,1,0,0,0|2,0,0]=4 2312 B5R0.5 CC(Cl)C(=O)Cl Amb9703139 [1,0,1,0,0,0|2,0,0]=4 2313 B5R0.5 CC(Cl)C(=O)F Amb27863699 [1,0,1,0,0,0|2,0,0]=4 2314 B5R0.5 CC(Cl)C(=O)O Amb3940363 [1,0,1,0,0,0|1,0,0]=3 2315 B5R0.5 CC(Cl)C(N)=O Amb9745753 [1,0,1,0,0,0|1,0,0]=3 2316 B5R0.5 CC(Cl)C(N)=S Amb33328367 [1,0,1,0,0,0|1,1,0]=4 2317 B5R0.5 CC(Cl)S(=O)O Amb27983761 [1,0,1,0,0,0|2,0,0]=4 2318 B5R0.5 CC(Cl)S(N)=O Amb32720330 [1,0,1,0,0,0|2,0,0]=4 2319 B5R0.5 CC(F)C(=N)N Amb32455979 [1,0,1,0,0,0|2,0,0]=4 2320 B5R0.5 CC(F)C(=O)O Amb10605770 [1,0,1,0,0,0|1,0,0]=3 2321 B5R0.5 CC(F)C(N)=O Amb28248497 [1,0,1,0,0,0|1,0,0]=3 2322 B5R0.5 CC(I)C(=O)O Amb26450528 [1,0,1,0,0,0|1,0,0]=3 2323 B5R0.5 CC(I)C(N)=O Amb25684673 [1,0,1,0,0,0|1,0,0]=3 2324 B5R0.5 CC(N)B(O)O Amb25844423 [1,0,1,0,0,0|1,0,1]=4 2325 B5R0.5 CC(N)C(=O)O Amb32724352 [1,0,1,0,0,0|0,0,0]=2 2326 B5R0.5 CC(N)C(=O)O Amb5716847 [1,0,1,0,0,0|0,0,0]=2 2327 B5R0.5 CC(N)C(=O)S Amb27175379 [1,0,1,0,0,0|0,1,0]=3 2328 B5R0.5 CC(N)C(C)N Amb22330596 [1,0,1,0,0,0|1,0,1]=4 2329 B5R0.5 CC(N)C(C)N Amb33473133 [1,0,1,0,0,0|1,0,1]=4 2330 B5R0.5 CC(N)C(C)O Amb33801453 [1,0,1,0,0,0|1,0,1]=4 2331 B5R0.5 CC(N)C(C)O Amb8630303 [1,0,1,0,0,0|1,0,1]=4 2332 B5R0.5 CC(N)C(N)=O Amb21958673 [1,0,1,0,0,0|0,0,0]=2 2333 B5R0.5 CC(N)C(N)=O Amb33532935 [1,0,1,0,0,0|0,0,0]=2 2334 B5R0.5 CC(N)C(N)=S Amb19374914 [1,0,1,0,0,0|0,1,0]=3 2335 B5R0.5 CC(N)C(N)=S Amb33527239 [1,0,1,0,0,0|0,1,0]=3 2336 B5R0.5 CC(O)C(=N)N Amb22587521 [1,0,1,0,0,0|2,0,0]=4 2337 B5R0.5 CC(O)C(=N)N Amb2696133 [1,0,1,0,0,0|2,0,0]=4 2338 B5R0.5 CC(O)C(=O)O Amb9703100 [1,0,1,0,0,0|1,0,0]=3 2339 B5R0.5 CC(O)C(=O)[O-] Amb3499440 [1,0,1,0,0,0|1,0,1]=4 2340 B5R0.5 CC(O)C(=O)[O-] Amb9787591 [1,0,1,0,0,0|1,0,1]=4 2341 B5R0.5 CC(O)C(N)=O Amb6394657 [1,0,1,0,0,0|1,0,0]=3 2342 B5R0.5 CC(O)[C@@H](C)N Amb30010753 [1,0,1,0,0,0|1,0,1]=4 2343 B5R0.5 CC(O)[C@H](C)N Amb35713820 [1,0,1,0,0,0|1,0,1]=4 2344 B5R0.5 CC(S)C(=O)O Amb6608753 [1,0,1,0,0,0|1,0,0]=3 2345 B5R0.5 CN(C)C(=O)O Amb22348477 [1,0,1,0,0,0|2,0,0]=4 2346 B5R0.5 CN(C)C(N)=O Amb2604398 [1,0,1,0,0,0|2,0,0]=4 2347 B5R0.5 CN(N)C(=N)N Amb10552372 [1,0,1,0,0,0|2,0,0]=4 2348 B5R0.5 CN(N)C(=N)N Amb27595677 [1,0,1,0,0,0|2,0,0]=4 2349 B5R0.5 CN(N)C(N)=O Amb27167382 [1,0,1,0,0,0|1,0,0]=3 2350 B5R0.5 CN(N)C(N)=S Amb6298790 [1,0,1,0,0,0|1,1,0]=4 2351 B5R0.5 C[C@@H](Br)C(=O)Br Amb27455066 [1,0,1,0,0,0|2,0,0]=4 2352 B5R0.5 C[C@@H](Br)C(=O)Cl Amb26395930 [1,0,1,0,0,0|2,0,0]=4 2353 B5R0.5 C[C@@H](Br)C(=O)O Amb8515030 [1,0,1,0,0,0|1,0,0]=3 2354 B5R0.5 C[C@@H](Cl)C(=O)Cl Amb28140701 [1,0,1,0,0,0|2,0,0]=4 2355 B5R0.5 C[C@@H](Cl)C(=O)O Amb2725594 [1,0,1,0,0,0|1,0,0]=3 2356 B5R0.5 C[C@@H](I)C(=O)O Amb27878762 [1,0,1,0,0,0|1,0,0]=3 2357 B5R0.5 C[C@@H](I)C(N)=O Amb27863419 [1,0,1,0,0,0|1,0,0]=3 2358 B5R0.5 C[C@@H](N)B(O)O Amb27662188 [1,0,1,0,0,0|1,0,1]=4 2359 B5R0.5 C[C@@H](N)C(=O)O Amb3940457 [1,0,1,0,0,0|0,0,0]=2 2360 B5R0.5 C[C@@H](N)C(N)=O Amb2371905 [1,0,1,0,0,0|0,0,0]=2 2361 B5R0.5 C[C@@H](N)C(N)=O Amb2778751 [1,0,1,0,0,0|0,0,0]=2 2362 B5R0.5 C[C@@H](N)[C@@H](C)N Amb22800310 [1,0,1,0,0,0|1,0,1]=4 2363 B5R0.5 C[C@@H](N)[C@@H](C)O Amb26068187 [1,0,1,0,0,0|1,0,1]=4 2364 B5R0.5 C[C@@H](O)C(=N)N Amb22587056 [1,0,1,0,0,0|2,0,0]=4 2365 B5R0.5 C[C@@H](O)C(=N)N Amb8630521 [1,0,1,0,0,0|2,0,0]=4 2366 B5R0.5 C[C@@H](O)C(=O)Cl Amb28350419 [1,0,1,0,0,0|2,0,0]=4 2367 B5R0.5 C[C@@H](O)C(=O)O Amb6600026 [1,0,1,0,0,0|1,0,0]=3 2368 B5R0.5 C[C@@H](O)C(=O)[O-] Amb22350432 [1,0,1,0,0,0|1,0,1]=4 2369 B5R0.5 C[C@@H](O)C(=O)[O-] Amb8514494 [1,0,1,0,0,0|1,0,1]=4 2370 B5R0.5 C[C@@H](O)C(N)=O Amb3939680 [1,0,1,0,0,0|1,0,0]=3 2371 B5R0.5 C[C@H](Br)C(=O)O Amb8515029 [1,0,1,0,0,0|1,0,0]=3 2372 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [1,0,1,0,0,0|2,0,0]=4 2373 B5R0.5 C[C@H](Cl)C(=O)F Amb28138044 [1,0,1,0,0,0|2,0,0]=4 2374 B5R0.5 C[C@H](Cl)C(=O)O Amb17776586 [1,0,1,0,0,0|1,0,0]=3 2375 B5R0.5 C[C@H](F)C(=O)O Amb27216697 [1,0,1,0,0,0|1,0,0]=3 2376 B5R0.5 C[C@H](N)C(=O)O Amb33780861 [1,0,1,0,0,0|0,0,0]=2 2377 B5R0.5 C[C@H](N)C(=O)O Amb6298336 [1,0,1,0,0,0|0,0,0]=2 2378 B5R0.5 C[C@H](N)C(=O)S Amb28315892 [1,0,1,0,0,0|0,1,0]=3 2379 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [1,0,1,0,0,0|0,0,0]=2 2380 B5R0.5 C[C@H](N)C(N)=O Amb2371522 [1,0,1,0,0,0|0,0,0]=2 2381 B5R0.5 C[C@H](N)C(N)=O Amb2778752 [1,0,1,0,0,0|0,0,0]=2 2382 B5R0.5 C[C@H](N)C(N)=O Amb33822632 [1,0,1,0,0,0|0,0,0]=2 2383 B5R0.5 C[C@H](N)[C@H](C)O Amb28126703 [1,0,1,0,0,0|1,0,1]=4 2384 B5R0.5 C[C@H](N)[C@H](C)O Amb35789596 [1,0,1,0,0,0|1,0,1]=4 2385 B5R0.5 C[C@H](O)C(=N)N Amb22587541 [1,0,1,0,0,0|2,0,0]=4 2386 B5R0.5 C[C@H](O)C(=N)N Amb34912477 [1,0,1,0,0,0|2,0,0]=4 2387 B5R0.5 C[C@H](O)C(=O)O Amb8386374 [1,0,1,0,0,0|1,0,0]=3 2388 B5R0.5 C[C@H](O)C(=O)[O-] Amb17772234 [1,0,1,0,0,0|1,0,1]=4 2389 B5R0.5 C[C@H](O)C(=O)[O-] Amb8515200 [1,0,1,0,0,0|1,0,1]=4 2390 B5R0.5 C[C@H](O)C(N)=O Amb3939676 [1,0,1,0,0,0|1,0,0]=3 2391 B5R0.5 C[C@H](S)C(=O)O Amb25147510 [1,0,1,0,0,0|1,0,0]=3 2392 B5R0.5 C[N+](N)=C(N)N Amb33421923 [1,0,1,0,0,0|2,0,0]=4 2393 B5R0.5 NC(=O)C(=O)O Amb32666615 [1,0,1,0,0,0|1,0,1]=4 2394 B5R0.5 NC(=O)C(=O)O Amb3940455 [1,0,1,0,0,0|1,0,1]=4 2395 B5R0.5 NC(=O)C(Br)Br Amb3986938 [1,0,1,0,0,0|2,0,0]=4 2396 B5R0.5 NC(=O)C(Cl)Br Amb25288934 [1,0,1,0,0,0|2,0,0]=4 2397 B5R0.5 NC(=O)C(Cl)Cl Amb3886544 [1,0,1,0,0,0|2,0,0]=4 2398 B5R0.5 NC(=O)C(F)Br Amb10841902 [1,0,1,0,0,0|2,0,0]=4 2399 B5R0.5 NC(=O)C(F)Cl Amb10839936 [1,0,1,0,0,0|2,0,0]=4 2400 B5R0.5 NC(=O)C(F)F Amb2222272 [1,0,1,0,0,0|2,0,0]=4 2401 B5R0.5 NC(=O)C(F)I Amb10840454 [1,0,1,0,0,0|2,0,0]=4 2402 B5R0.5 NC(=O)C(N)=O Amb3886526 [1,0,1,0,0,0|0,0,2]=4 2403 B5R0.5 NC(Br)C(=O)O Amb25724348 [1,0,1,0,0,0|1,0,0]=3 2404 B5R0.5 NC(O)C(=O)O Amb24663706 [1,0,1,0,0,0|1,0,0]=3 2405 B5R0.5 NC(S)C(=O)O Amb27253385 [1,0,1,0,0,0|1,0,0]=3 2406 B5R0.5 N[C@@H](S)C(=O)O Amb27788398 [1,0,1,0,0,0|1,0,0]=3 2407 B5R0.5 O=C(O)C(Br)I Amb17610018 [1,0,1,0,0,0|2,0,0]=4 2408 B5R0.5 O=C(O)C(Cl)Cl Amb6891960 [1,0,1,0,0,0|2,0,0]=4 2409 B5R0.5 O=C(O)C(Cl)I Amb17610937 [1,0,1,0,0,0|2,0,0]=4 2410 B5R0.5 O=C(O)C(F)Br Amb10841090 [1,0,1,0,0,0|2,0,0]=4 2411 B5R0.5 O=C(O)C(F)Cl Amb10838714 [1,0,1,0,0,0|2,0,0]=4 2412 B5R0.5 O=C(O)C(F)F Amb1953492 [1,0,1,0,0,0|2,0,0]=4 2413 B5R0.5 O=C(O)C(F)I Amb10838458 [1,0,1,0,0,0|2,0,0]=4 2414 B5R0.5 O=C(O)C(I)I Amb17612865 [1,0,1,0,0,0|2,0,0]=4 2415 B5R0.5 O=C(O)C(O)O Amb6608986 [1,0,1,0,0,0|2,0,0]=4 2416 B5R0.5 O=C(O)[C@@H](F)Cl Amb26559563 [1,0,1,0,0,0|2,0,0]=4 2417 B5R0.5 O=C(O)[C@@H](F)I Amb27827825 [1,0,1,0,0,0|2,0,0]=4 2418 B5R0.5 O=C(O)[C@H](F)Br Amb28200717 [1,0,1,0,0,0|2,0,0]=4 2419 B5R0.5 O=C([O-])C(O)O Amb33512886 [1,0,1,0,0,0|2,0,0]=4 2420 B5R1.1 C1=CCCC1 Amb6608970 [2,0,0,0,0,0|2,0,0]=4 2421 B5R1.1 C1=CCOC1 Amb7809243 [2,0,0,0,0,0|1,0,1]=4 2422 B5R1.1 C1=CNCC1 Amb24476832 [2,0,0,0,0,0|1,0,1]=4 2423 B5R1.1 C1=COCC1 Amb6609005 [2,0,0,0,0,0|1,0,0]=3 2424 B5R1.1 C1=COCN1 Amb20242493 [2,0,0,0,0,0|2,0,0]=4 2425 B5R1.1 C1=CSCC1 Amb24065325 [2,0,0,0,0,0|1,1,0]=4 2426 B5R1.1 C1=NCCC1 Amb28282781 [2,0,0,0,0,0|1,0,1]=4 2427 B5R1.1 C1=NCCN1 Amb25083166 [2,0,0,0,0,0|2,0,0]=4 2428 B5R1.1 C1=NCCO1 Amb16234259 [2,0,0,0,0,0|2,0,0]=4 2429 B5R1.1 C1=NNCC1 Amb21618957 [2,0,0,0,0,0|1,0,1]=4 2430 B5R1.1 C1=NOCN1 Amb24117046 [2,0,0,0,0,0|1,0,1]=4 2431 B5R1.1 C1CCNC1 Amb2792830 [2,0,0,0,0,0|1,0,1]=4 2432 B5R1.1 C1CCOC1 Amb2792997 [2,0,0,0,0,0|1,0,1]=4 2433 B5R1.1 C1CNNC1 Amb18061973 [2,0,0,0,0,0|1,0,1]=4 2434 B5R1.1 C1CNNC1 Amb21964916 [2,0,0,0,0,0|1,0,1]=4 2435 B5R1.1 C1CNOC1 Amb6365588 [2,0,0,0,0,0|0,0,1]=3 2436 B5R1.1 C1CNOC1 Amb8503363 [2,0,0,0,0,0|0,0,1]=3 2437 B5R1.1 C1COCN1 Amb17506153 [2,0,0,0,0,0|2,0,0]=4 2438 B7R0.2 CC(=O)NC(=O)CBr Amb33541733 [0,1,1,0,0,0|2,0,0]=4 2439 B7R0.2 CC(=O)NC(=O)CCl Amb1105796 [0,1,1,0,0,0|2,0,0]=4 2440 B7R0.2 CC(=O)NC(=O)CN Amb24117061 [0,1,1,0,0,0|1,0,0]=3 2441 B7R0.2 CC(=O)OC(=O)CN Amb28240797 [0,1,1,0,0,0|2,0,0]=4 2442 B7R0.2 CC(C)CC(=O)CN Amb18641847 [0,1,1,0,0,0|2,0,0]=4 2443 B7R0.2 CC(C)CC(=O)CN Amb30982570 [0,1,1,0,0,0|2,0,0]=4 2444 B7R0.2 CC(C)C[C@H](N)C=O Amb26851754 [0,1,1,0,0,0|2,0,0]=4 2445 B7R0.2 CC(C)NC(=O)CBr Amb2090260 [0,1,1,0,0,0|2,0,0]=4 2446 B7R0.2 CC(C)NC(=O)CCl Amb1151852 [0,1,1,0,0,0|2,0,0]=4 2447 B7R0.2 CC(C)NC(=O)CI Amb10608892 [0,1,1,0,0,0|2,0,0]=4 2448 B7R0.2 CC(C)NC(=O)CN Amb435868 [0,1,1,0,0,0|1,0,0]=3 2449 B7R0.2 CC(C)NC(=O)CN Amb6892385 [0,1,1,0,0,0|1,0,0]=3 2450 B7R0.2 CC(C)NC(=O)CO Amb5798170 [0,1,1,0,0,0|2,0,0]=4 2451 B7R0.2 CC(C)NC(=O)NN Amb8854026 [0,1,1,0,0,0|2,0,0]=4 2452 B7R0.2 CC(C)OC(=O)CN Amb10807427 [0,1,1,0,0,0|2,0,0]=4 2453 B7R0.2 CC(C)OC(=O)CN Amb9289819 [0,1,1,0,0,0|2,0,0]=4 2454 B7R0.2 CC(Cl)CC(=O)CN Amb28048961 [0,1,1,0,0,0|2,0,0]=4 2455 B7R0.2 CC(Cl)CC(=O)CN Amb33473605 [0,1,1,0,0,0|2,0,0]=4 2456 B7R0.2 CC(O)NC(=O)CS Amb27838336 [0,1,1,0,0,0|2,0,0]=4 2457 B7R0.2 CCC(=O)NC(C)=O Amb27800787 [0,1,1,0,0,0|2,0,0]=4 2458 B7R0.2 CCC(=O)NC(C)=S Amb28287319 [0,1,1,0,0,0|2,0,0]=4 2459 B7R0.2 CCC(=O)NC(C)C Amb5797517 [0,1,1,0,0,0|2,0,0]=4 2460 B7R0.2 CCC(=O)NN(C)C Amb28316116 [0,1,1,0,0,0|2,0,0]=4 2461 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [0,1,1,0,0,0|2,0,0]=4 2462 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [0,1,1,0,0,0|2,0,0]=4 2463 B7R0.3 C#CCNC(=O)CN Amb13951829 [0,1,1,0,0,0|1,0,1]=4 2464 B7R0.3 C#CCNC(=O)CN Amb6269640 [0,1,1,0,0,0|1,0,1]=4 2465 B7R0.3 C=C(CN)CCOC Amb33377483 [0,1,1,0,0,0|2,0,0]=4 2466 B7R0.3 C=CC(=O)NCOC Amb27467338 [0,1,1,0,0,0|1,0,1]=4 2467 B7R0.3 C=CC(=O)NOCC Amb27234385 [0,1,1,0,0,0|1,0,1]=4 2468 B7R0.3 C=CC(N)COCC Amb27248147 [0,1,1,0,0,0|2,0,0]=4 2469 B7R0.3 C=CCNC(=O)CN Amb21958702 [0,1,1,0,0,0|1,0,1]=4 2470 B7R0.3 C=CCNC(=O)CN Amb5783027 [0,1,1,0,0,0|1,0,1]=4 2471 B7R0.3 CCC(=O)NCCCl Amb17103188 [0,1,1,0,0,0|2,0,0]=4 2472 B7R0.3 CCC(=O)NCCF Amb27972779 [0,1,1,0,0,0|2,0,0]=4 2473 B7R0.3 CCC(=O)NCCN Amb1137732 [0,1,1,0,0,0|2,0,0]=4 2474 B7R0.3 CCC(=O)NCCN Amb32434788 [0,1,1,0,0,0|2,0,0]=4 2475 B7R0.3 CCC(=O)NCCN Amb33741516 [0,1,1,0,0,0|2,0,0]=4 2476 B7R0.3 CCC(=O)NCCO Amb5797470 [0,1,1,0,0,0|2,0,0]=4 2477 B7R0.3 CCC(=O)NCCS Amb24505089 [0,1,1,0,0,0|2,0,0]=4 2478 B7R0.3 CCCCC(=O)CN Amb24473062 [0,1,1,0,0,0|2,0,0]=4 2479 B7R0.3 CCCCC(N)C=O Amb28422291 [0,1,1,0,0,0|2,0,0]=4 2480 B7R0.3 CCCNC(=O)CBr Amb17330843 [0,1,1,0,0,0|2,0,0]=4 2481 B7R0.3 CCCNC(=O)CC Amb5797516 [0,1,1,0,0,0|2,0,0]=4 2482 B7R0.3 CCCNC(=O)CCl Amb1207068 [0,1,1,0,0,0|2,0,0]=4 2483 B7R0.3 CCCNC(=O)CI Amb23512283 [0,1,1,0,0,0|2,0,0]=4 2484 B7R0.3 CCCNC(=O)CN Amb10781813 [0,1,1,0,0,0|1,0,0]=3 2485 B7R0.3 CCCNC(=O)CN Amb426858 [0,1,1,0,0,0|1,0,0]=3 2486 B7R0.3 CCCNC(=O)CO Amb5798169 [0,1,1,0,0,0|2,0,0]=4 2487 B7R0.3 CCCNC(=O)NN Amb8854021 [0,1,1,0,0,0|2,0,0]=4 2488 B7R0.3 CCCOC(=O)CN Amb9826861 [0,1,1,0,0,0|2,0,0]=4 2489 B7R0.3 CCOCC(=O)CC Amb27406475 [0,1,1,0,0,0|2,0,0]=4 2490 B7R0.3 CCOCC(=O)CCl Amb25087764 [0,1,1,0,0,0|2,0,0]=4 2491 B7R0.3 CCOCC(=O)CF Amb28316133 [0,1,1,0,0,0|2,0,0]=4 2492 B7R0.3 CCOCC(=O)CN Amb27453616 [0,1,1,0,0,0|1,0,0]=3 2493 B7R0.3 CCOCC(=O)CO Amb28066809 [0,1,1,0,0,0|2,0,0]=4 2494 B7R0.3 CCOCC(=O)NN Amb2111918 [0,1,1,0,0,0|2,0,0]=4 2495 B7R0.3 CCOCC(=O)NN Amb6744505 [0,1,1,0,0,0|2,0,0]=4 2496 B7R0.3 CCOCC(O)C=O Amb27883256 [0,1,1,0,0,0|2,0,0]=4 2497 B7R0.3 CCONC(=O)CN Amb24445788 [0,1,1,0,0,0|0,0,0]=2 2498 B7R0.3 CCONC(=O)CN Amb32664914 [0,1,1,0,0,0|0,0,0]=2 2499 B7R0.3 CCONC(=O)CO Amb27762105 [0,1,1,0,0,0|1,0,0]=3 2500 B7R0.3 CCONC(=O)NC Amb27805073 [0,1,1,0,0,0|2,0,0]=4 2501 B7R0.3 CCONC(C)CN Amb27947132 [0,1,1,0,0,0|1,0,1]=4 2502 B7R0.3 CCSCC(=O)CN Amb33324079 [0,1,1,0,0,0|1,1,0]=4 2503 B7R0.3 CC\C=C\C(=O)CN Amb33268678 [0,1,1,0,0,0|2,0,0]=4 2504 B7R0.3 COCCC(=O)CCl Amb20622320 [0,1,1,0,0,0|2,0,0]=4 2505 B7R0.3 COCCC(=O)CN Amb26515688 [0,1,1,0,0,0|1,0,0]=3 2506 B7R0.3 COCCC(=O)NN Amb2689273 [0,1,1,0,0,0|2,0,0]=4 2507 B7R0.3 COCCC(C)C=O Amb26896518 [0,1,1,0,0,0|2,0,0]=4 2508 B7R0.3 COCCC(N)C=O Amb28397866 [0,1,1,0,0,0|1,0,0]=3 2509 B7R0.3 COCC[C@@H](C)C=O Amb28351588 [0,1,1,0,0,0|2,0,0]=4 2510 B7R0.3 COCNC(=O)CF Amb28045827 [0,1,1,0,0,0|1,0,0]=3 2511 B7R0.3 COCNC(=O)OC Amb27253203 [0,1,1,0,0,0|2,0,0]=4 2512 B7R0.3 COCOC(=O)CCl Amb27952135 [0,1,1,0,0,0|2,0,0]=4 2513 B7R0.3 COCOC(=O)NN Amb28386033 [0,1,1,0,0,0|2,0,0]=4 2514 B7R0.3 COCO[C@@H](C)C=O Amb28422010 [0,1,1,0,0,0|2,0,0]=4 2515 B7R0.3 CONCC(C)CN Amb28127725 [0,1,1,0,0,0|1,0,1]=4 2516 B7R0.3 CO\C=C\C(=O)CBr Amb26323620 [0,1,1,0,0,0|2,0,0]=4 2517 B7R0.3 CSCCC(=O)CN Amb33199125 [0,1,1,0,0,0|1,1,0]=4 2518 B7R0.3 C\C=N\NC(=O)CCl Amb28345569 [0,1,1,0,0,0|2,0,0]=4 2519 B7R0.3 C\C=N\NC(=O)NN Amb28313374 [0,1,1,0,0,0|2,0,0]=4 2520 B7R0.3 N#CCNC(=O)CN Amb32652935 [0,1,1,0,0,0|1,0,1]=4 2521 B7R0.3 N#CCNC(=O)CN Amb6274014 [0,1,1,0,0,0|1,0,1]=4 2522 B7R0.3 NCC(=O)NCCF Amb27659897 [0,1,1,0,0,0|1,0,0]=3 2523 B7R0.3 NCC(=O)NCCF Amb33473629 [0,1,1,0,0,0|1,0,0]=3 2524 B7R0.3 NCC(=O)NCCO Amb9023087 [0,1,1,0,0,0|1,0,0]=3 2525 B7R0.3 NCC(=O)OCCCl Amb4244115 [0,1,1,0,0,0|2,0,0]=4 2526 B7R0.3 NCC(=O)OCCF Amb27964557 [0,1,1,0,0,0|2,0,0]=4 2527 B7R0.3 NCCC[C@H](N)C=O Amb27838296 [0,1,1,0,0,0|1,0,0]=3 2528 B7R0.3 NCCNC(=O)CS Amb27413124 [0,1,1,0,0,0|2,0,0]=4 2529 B7R0.3 NCCNC(=O)NN Amb19514735 [0,1,1,0,0,0|2,0,0]=4 2530 B7R0.3 NCCNC(=O)NN Amb26370529 [0,1,1,0,0,0|2,0,0]=4 2531 B7R0.3 NOCC[C@H](N)CO Amb27430113 [0,1,1,0,0,0|0,0,2]=4 2532 B7R0.3 O=C(CBr)NCCBr Amb24104073 [0,1,1,0,0,0|2,0,0]=4 2533 B7R0.3 O=C(CBr)NCCCl Amb29848056 [0,1,1,0,0,0|2,0,0]=4 2534 B7R0.3 O=C(CCl)NCCBr Amb26055016 [0,1,1,0,0,0|2,0,0]=4 2535 B7R0.3 O=C(CCl)NCCCl Amb22261518 [0,1,1,0,0,0|2,0,0]=4 2536 B7R0.3 O=C(CCl)NCCF Amb28048272 [0,1,1,0,0,0|2,0,0]=4 2537 B7R0.3 O=C(CCl)NCCO Amb5716292 [0,1,1,0,0,0|2,0,0]=4 2538 B7R0.3 O=C(CCl)NCCS Amb25350349 [0,1,1,0,0,0|2,0,0]=4 2539 B7R0.3 O=C(CO)NCCO Amb5798091 [0,1,1,0,0,0|2,0,0]=4 2540 B7R0.3 O=C(CS)NCCF Amb28204076 [0,1,1,0,0,0|2,0,0]=4 2541 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [0,1,1,0,0,0|2,0,0]=4 2542 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [0,1,1,0,0,0|2,0,0]=4 2543 B7R0.5 C#CCC(N)C(C)=O Amb27228190 [0,1,1,0,0,0|2,0,0]=4 2544 B7R0.5 C#CCC(N)C(N)=O Amb22059485 [0,1,1,0,0,0|2,0,0]=4 2545 B7R0.5 C#CCC(N)C(N)=O Amb33543329 [0,1,1,0,0,0|2,0,0]=4 2546 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [0,1,1,0,0,0|2,0,0]=4 2547 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [0,1,1,0,0,0|2,0,0]=4 2548 B7R0.5 C#CC[C@@H](N)C(N)=O Amb27473309 [0,1,1,0,0,0|2,0,0]=4 2549 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [0,1,1,0,0,0|2,0,0]=4 2550 B7R0.5 C#CC[C@H](N)C(N)=O Amb28345609 [0,1,1,0,0,0|2,0,0]=4 2551 B7R0.5 C=C(C)C(C)CON Amb33199600 [0,1,1,0,0,0|2,0,0]=4 2552 B7R0.5 C=CCC(N)C(=O)Cl Amb27413912 [0,1,1,0,0,0|2,0,0]=4 2553 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [0,1,1,0,0,0|2,0,0]=4 2554 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [0,1,1,0,0,0|2,0,0]=4 2555 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [0,1,1,0,0,0|2,0,0]=4 2556 B7R0.5 C=CCC(N)C(N)=O Amb26585896 [0,1,1,0,0,0|2,0,0]=4 2557 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [0,1,1,0,0,0|2,0,0]=4 2558 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [0,1,1,0,0,0|2,0,0]=4 2559 B7R0.5 C=CC[C@@H](N)C(N)=O Amb27838370 [0,1,1,0,0,0|2,0,0]=4 2560 B7R0.5 C=CC[C@H](N)C(=O)Cl Amb28120452 [0,1,1,0,0,0|2,0,0]=4 2561 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [0,1,1,0,0,0|2,0,0]=4 2562 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [0,1,1,0,0,0|2,0,0]=4 2563 B7R0.5 CC(=O)C(N)CCO Amb25087112 [0,1,1,0,0,0|2,0,0]=4 2564 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [0,1,1,0,0,0|2,0,0]=4 2565 B7R0.5 CC(CCN)C(=O)O Amb20667970 [0,1,1,0,0,0|2,0,0]=4 2566 B7R0.5 CC(CCN)C(=O)O Amb538221 [0,1,1,0,0,0|2,0,0]=4 2567 B7R0.5 CC(N)C(=O)NC#N Amb27167072 [0,1,1,0,0,0|2,0,0]=4 2568 B7R0.5 CCCC(=O)C(C)N Amb18641850 [0,1,1,0,0,0|2,0,0]=4 2569 B7R0.5 CCCC(=O)[C@@H](C)N Amb30023710 [0,1,1,0,0,0|2,0,0]=4 2570 B7R0.5 CCCC(=O)[C@H](C)N Amb35617900 [0,1,1,0,0,0|2,0,0]=4 2571 B7R0.5 CCCC(N)C(=O)O Amb6262055 [0,1,1,0,0,0|2,0,0]=4 2572 B7R0.5 CCCC(N)C(C)=O Amb27838289 [0,1,1,0,0,0|2,0,0]=4 2573 B7R0.5 CCCC(N)C(N)=O Amb22284825 [0,1,1,0,0,0|2,0,0]=4 2574 B7R0.5 CCCC(N)C(N)=O Amb9514970 [0,1,1,0,0,0|2,0,0]=4 2575 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [0,1,1,0,0,0|2,0,0]=4 2576 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [0,1,1,0,0,0|2,0,0]=4 2577 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [0,1,1,0,0,0|2,0,0]=4 2578 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [0,1,1,0,0,0|2,0,0]=4 2579 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [0,1,1,0,0,0|2,0,0]=4 2580 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [0,1,1,0,0,0|2,0,0]=4 2581 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [0,1,1,0,0,0|2,0,0]=4 2582 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [0,1,1,0,0,0|2,0,0]=4 2583 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [0,1,1,0,0,0|2,0,0]=4 2584 B7R0.5 CCNC(=O)C(C)Br Amb17326728 [0,1,1,0,0,0|2,0,0]=4 2585 B7R0.5 CCNC(=O)C(C)Cl Amb9745748 [0,1,1,0,0,0|2,0,0]=4 2586 B7R0.5 CCNC(=O)C(C)N Amb6892333 [0,1,1,0,0,0|1,0,0]=3 2587 B7R0.5 CCNC(=O)C(C)N Amb9719931 [0,1,1,0,0,0|1,0,0]=3 2588 B7R0.5 CCNC(=O)C(C)O Amb9421391 [0,1,1,0,0,0|2,0,0]=4 2589 B7R0.5 CCNC(=O)C(Cl)Cl Amb3358004 [0,1,1,0,0,0|2,0,0]=4 2590 B7R0.5 CCNC(=O)C(N)=O Amb27969146 [0,1,1,0,0,0|1,0,1]=4 2591 B7R0.5 CCNC(=O)C(N)=S Amb19514543 [0,1,1,0,0,0|1,0,1]=4 2592 B7R0.5 CCNC(=O)N(C)N Amb18641925 [0,1,1,0,0,0|2,0,0]=4 2593 B7R0.5 CCNC(=O)[C@@H](C)O Amb27402988 [0,1,1,0,0,0|2,0,0]=4 2594 B7R0.5 CCNC(=O)[C@H](C)N Amb17231828 [0,1,1,0,0,0|1,0,0]=3 2595 B7R0.5 CCNC(=O)[C@H](C)O Amb28250860 [0,1,1,0,0,0|2,0,0]=4 2596 B7R0.5 CCOC(=O)C(C)N Amb2684292 [0,1,1,0,0,0|2,0,0]=4 2597 B7R0.5 CCOC(=O)C(C)N Amb4019258 [0,1,1,0,0,0|2,0,0]=4 2598 B7R0.5 CCOC(=O)C(N)F Amb28397880 [0,1,1,0,0,0|2,0,0]=4 2599 B7R0.5 CCOC(=O)[C@@H](C)N Amb27807204 [0,1,1,0,0,0|2,0,0]=4 2600 B7R0.5 CCOC(=O)[C@@H](C)N Amb8395170 [0,1,1,0,0,0|2,0,0]=4 2601 B7R0.5 CCOC(=O)[C@@H](N)O Amb27430554 [0,1,1,0,0,0|2,0,0]=4 2602 B7R0.5 CCOC(=O)[C@H](C)N Amb2725105 [0,1,1,0,0,0|2,0,0]=4 2603 B7R0.5 CCOC(=O)[C@H](C)N Amb3940042 [0,1,1,0,0,0|2,0,0]=4 2604 B7R0.5 CNCC(N)C(=O)O Amb10845350 [0,1,1,0,0,0|2,0,0]=4 2605 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [0,1,1,0,0,0|2,0,0]=4 2606 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [0,1,1,0,0,0|2,0,0]=4 2607 B7R0.5 COCC(=O)C(C)C Amb19375017 [0,1,1,0,0,0|2,0,0]=4 2608 B7R0.5 COCC(=O)C(C)N Amb18825587 [0,1,1,0,0,0|1,0,0]=3 2609 B7R0.5 COCC(=O)C(F)F Amb25287315 [0,1,1,0,0,0|2,0,0]=4 2610 B7R0.5 COCC(=O)N(C)N Amb33191423 [0,1,1,0,0,0|2,0,0]=4 2611 B7R0.5 COCC(=O)[C@@H](C)N Amb30024709 [0,1,1,0,0,0|1,0,0]=3 2612 B7R0.5 COCC(=O)[C@H](C)N Amb35617901 [0,1,1,0,0,0|1,0,0]=3 2613 B7R0.5 COCC(Br)C(=O)Cl Amb27797270 [0,1,1,0,0,0|2,0,0]=4 2614 B7R0.5 COCC(Br)C(=O)O Amb17594709 [0,1,1,0,0,0|2,0,0]=4 2615 B7R0.5 COCC(C)C(=O)O Amb33545090 [0,1,1,0,0,0|2,0,0]=4 2616 B7R0.5 COCC(C)C(C)=O Amb24683449 [0,1,1,0,0,0|2,0,0]=4 2617 B7R0.5 COCC(C)C(N)=O Amb27401584 [0,1,1,0,0,0|2,0,0]=4 2618 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [0,1,1,0,0,0|2,0,0]=4 2619 B7R0.5 COCC(N)C(=O)O Amb33551350 [0,1,1,0,0,0|1,0,0]=3 2620 B7R0.5 COCC(N)C(=O)O Amb6752055 [0,1,1,0,0,0|1,0,0]=3 2621 B7R0.5 COCC(N)C(C)=O Amb27468401 [0,1,1,0,0,0|1,0,0]=3 2622 B7R0.5 COCC(N)C(N)=O Amb18984372 [0,1,1,0,0,0|1,0,0]=3 2623 B7R0.5 COCC(N)C(N)=O Amb32693410 [0,1,1,0,0,0|1,0,0]=3 2624 B7R0.5 COCC(O)C(=O)O Amb18124273 [0,1,1,0,0,0|2,0,0]=4 2625 B7R0.5 COCC(O)C(N)=O Amb28069186 [0,1,1,0,0,0|2,0,0]=4 2626 B7R0.5 COCC(S)C(=O)O Amb27763656 [0,1,1,0,0,0|2,0,0]=4 2627 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [0,1,1,0,0,0|2,0,0]=4 2628 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [0,1,1,0,0,0|1,0,0]=3 2629 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [0,1,1,0,0,0|1,0,0]=3 2630 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [0,1,1,0,0,0|2,0,0]=4 2631 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [0,1,1,0,0,0|1,0,0]=3 2632 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [0,1,1,0,0,0|1,0,0]=3 2633 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [0,1,1,0,0,0|2,0,0]=4 2634 B7R0.5 CONC(=O)C(C)Br Amb27659000 [0,1,1,0,0,0|1,0,0]=3 2635 B7R0.5 CONC(=O)C(C)Cl Amb27777111 [0,1,1,0,0,0|1,0,0]=3 2636 B7R0.5 CONC(=O)C(C)N Amb27461391 [0,1,1,0,0,0|0,0,0]=2 2637 B7R0.5 CONC(=O)[C@@H](C)N Amb27955810 [0,1,1,0,0,0|0,0,0]=2 2638 B7R0.5 CONC(=O)[C@H](C)N Amb27838965 [0,1,1,0,0,0|0,0,0]=2 2639 B7R0.5 CSCC(=O)C(C)N Amb33225478 [0,1,1,0,0,0|1,1,0]=4 2640 B7R0.5 CSCC(N)C(=O)O Amb33804791 [0,1,1,0,0,0|1,1,0]=4 2641 B7R0.5 CSCC(N)C(=O)O Amb6280829 [0,1,1,0,0,0|1,1,0]=4 2642 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [0,1,1,0,0,0|1,1,0]=4 2643 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [0,1,1,0,0,0|1,1,0]=4 2644 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [0,1,1,0,0,0|1,1,0]=4 2645 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [0,1,1,0,0,0|2,0,0]=4 2646 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [0,1,1,0,0,0|1,1,0]=4 2647 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [0,1,1,0,0,0|1,1,0]=4 2648 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [0,1,1,0,0,0|1,0,1]=4 2649 B7R0.5 N#CCC(N)C(N)=O Amb33308724 [0,1,1,0,0,0|1,0,1]=4 2650 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [0,1,1,0,0,0|1,0,1]=4 2651 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [0,1,1,0,0,0|1,0,1]=4 2652 B7R0.5 NC(=O)C(N)CCF Amb24391278 [0,1,1,0,0,0|2,0,0]=4 2653 B7R0.5 NC(=O)C(N)CCO Amb24481392 [0,1,1,0,0,0|2,0,0]=4 2654 B7R0.5 NC(=O)C(N)CNO Amb27396201 [0,1,1,0,0,0|2,0,0]=4 2655 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [0,1,1,0,0,0|2,0,0]=4 2656 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [0,1,1,0,0,0|2,0,0]=4 2657 B7R0.5 NC(CCF)C(=O)O Amb25889337 [0,1,1,0,0,0|2,0,0]=4 2658 B7R0.5 NC(CCF)C(=O)O Amb28934889 [0,1,1,0,0,0|2,0,0]=4 2659 B7R0.5 NC(CCO)C(=O)O Amb8514287 [0,1,1,0,0,0|2,0,0]=4 2660 B7R0.5 NC(CCS)C(=O)O Amb19267093 [0,1,1,0,0,0|2,0,0]=4 2661 B7R0.5 NC(CCS)C(=O)O Amb3499433 [0,1,1,0,0,0|2,0,0]=4 2662 B7R0.5 NC(CNO)C(=O)O Amb4092732 [0,1,1,0,0,0|2,0,0]=4 2663 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [0,1,1,0,0,0|1,0,0]=3 2664 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [0,1,1,0,0,0|2,0,0]=4 2665 B7R0.5 NCCC(F)C(=O)O Amb10838221 [0,1,1,0,0,0|2,0,0]=4 2666 B7R0.5 NCCC(F)C(=O)O Amb22229524 [0,1,1,0,0,0|2,0,0]=4 2667 B7R0.5 NCCC(N)C(=O)O Amb2697841 [0,1,1,0,0,0|1,0,0]=3 2668 B7R0.5 NCCC(N)C(=O)O Amb8514694 [0,1,1,0,0,0|1,0,0]=3 2669 B7R0.5 NCCC(O)C(=O)O Amb16232090 [0,1,1,0,0,0|2,0,0]=4 2670 B7R0.5 NCCC(O)C(N)=O Amb28121985 [0,1,1,0,0,0|2,0,0]=4 2671 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [0,1,1,0,0,0|2,0,0]=4 2672 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [0,1,1,0,0,0|1,0,0]=3 2673 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [0,1,1,0,0,0|1,0,0]=3 2674 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [0,1,1,0,0,0|1,0,0]=3 2675 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [0,1,1,0,0,0|1,0,0]=3 2676 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [0,1,1,0,0,0|2,0,0]=4 2677 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [0,1,1,0,0,0|2,0,0]=4 2678 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [0,1,1,0,0,0|1,0,0]=3 2679 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [0,1,1,0,0,0|1,0,0]=3 2680 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [0,1,1,0,0,0|1,0,0]=3 2681 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [0,1,1,0,0,0|1,0,0]=3 2682 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [0,1,1,0,0,0|2,0,0]=4 2683 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [0,1,1,0,0,0|2,0,0]=4 2684 B7R0.5 NNCC(O)C(=O)[O-] Amb27956514 [0,1,1,0,0,0|2,0,0]=4 2685 B7R0.5 NOCC(N)C(=O)O Amb24184086 [0,1,1,0,0,0|0,0,0]=2 2686 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [0,1,1,0,0,0|2,0,0]=4 2687 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [0,1,1,0,0,0|2,0,0]=4 2688 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [0,1,1,0,0,0|2,0,0]=4 2689 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [0,1,1,0,0,0|2,0,0]=4 2690 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [0,1,1,0,0,0|2,0,0]=4 2691 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [0,1,1,0,0,0|2,0,0]=4 2692 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [0,1,1,0,0,0|2,0,0]=4 2693 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [0,1,1,0,0,0|2,0,0]=4 2694 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [0,1,1,0,0,0|2,0,0]=4 2695 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [0,1,1,0,0,0|1,1,0]=4 2696 B7R0.7 C#CCC(=O)NCC Amb27878438 [0,1,1,0,0,0|2,0,0]=4 2697 B7R0.7 C=C(CCN)COC Amb33428659 [0,1,1,0,0,0|2,0,0]=4 2698 B7R0.7 C=C(CNC)COC Amb27604409 [0,1,1,0,0,0|2,0,0]=4 2699 B7R0.7 C=CCC(=O)COC Amb27168366 [0,1,1,0,0,0|2,0,0]=4 2700 B7R0.7 C=CCC(N)COC Amb19018008 [0,1,1,0,0,0|2,0,0]=4 2701 B7R0.7 C=CC[C@@H](N)COC Amb28128126 [0,1,1,0,0,0|2,0,0]=4 2702 B7R0.7 C=CC[C@H](N)COC Amb27851131 [0,1,1,0,0,0|2,0,0]=4 2703 B7R0.7 CCCC(=O)CCN Amb25104618 [0,1,1,0,0,0|2,0,0]=4 2704 B7R0.7 CCCC(=O)CNC Amb27251893 [0,1,1,0,0,0|2,0,0]=4 2705 B7R0.7 CCNC(=N)NOC Amb28350554 [0,1,1,0,0,0|2,0,0]=4 2706 B7R0.7 CCNC(=O)CC#N Amb6334810 [0,1,1,0,0,0|1,0,1]=4 2707 B7R0.7 CCNC(=O)CCBr Amb17324658 [0,1,1,0,0,0|2,0,0]=4 2708 B7R0.7 CCNC(=O)CCCl Amb1138928 [0,1,1,0,0,0|2,0,0]=4 2709 B7R0.7 CCNC(=O)CCN Amb1131291 [0,1,1,0,0,0|1,0,0]=3 2710 B7R0.7 CCNC(=O)CCN Amb21956669 [0,1,1,0,0,0|1,0,0]=3 2711 B7R0.7 CCNC(=O)CCO Amb17334068 [0,1,1,0,0,0|2,0,0]=4 2712 B7R0.7 CCNC(=O)CNC Amb1971537 [0,1,1,0,0,0|1,0,0]=3 2713 B7R0.7 CCNC(=O)CNC Amb33548995 [0,1,1,0,0,0|1,0,0]=3 2714 B7R0.7 CCNC(=O)CNN Amb24578064 [0,1,1,0,0,0|1,0,0]=3 2715 B7R0.7 CCNC(=O)CSC Amb27873687 [0,1,1,0,0,0|2,0,0]=4 2716 B7R0.7 CCNC(=O)NCC Amb8484443 [0,1,1,0,0,0|2,0,0]=4 2717 B7R0.7 CCNC(=O)NOC Amb27838398 [0,1,1,0,0,0|1,0,0]=3 2718 B7R0.7 CCNC(=O)OCC Amb8517332 [0,1,1,0,0,0|2,0,0]=4 2719 B7R0.7 CCNC(=O)OCCl Amb29884720 [0,1,1,0,0,0|2,0,0]=4 2720 B7R0.7 CCNC(=O)SCC Amb24271089 [0,1,1,0,0,0|2,0,0]=4 2721 B7R0.7 CCNC(=S)NOC Amb27596114 [0,1,1,0,0,0|1,1,0]=4 2722 B7R0.7 CCOC(=O)CCN Amb2684293 [0,1,1,0,0,0|2,0,0]=4 2723 B7R0.7 CCOC(=O)CCN Amb2697378 [0,1,1,0,0,0|2,0,0]=4 2724 B7R0.7 CCOC(=O)CNC Amb33531143 [0,1,1,0,0,0|2,0,0]=4 2725 B7R0.7 CCOC(=O)CNC Amb3941374 [0,1,1,0,0,0|2,0,0]=4 2726 B7R0.7 CCOC(=O)CNN Amb2182883 [0,1,1,0,0,0|2,0,0]=4 2727 B7R0.7 CCOC(=O)CNN Amb22489529 [0,1,1,0,0,0|2,0,0]=4 2728 B7R0.7 CCOC(=O)CNN Amb32667340 [0,1,1,0,0,0|2,0,0]=4 2729 B7R0.7 CCOC(=O)CNN Amb534885 [0,1,1,0,0,0|2,0,0]=4 2730 B7R0.7 CCOC(=O)CNO Amb27947131 [0,1,1,0,0,0|2,0,0]=4 2731 B7R0.7 CCOC(=O)COC Amb2726240 [0,1,1,0,0,0|2,0,0]=4 2732 B7R0.7 CCOC(=O)CON Amb18641971 [0,1,1,0,0,0|2,0,0]=4 2733 B7R0.7 CCOC(=O)NNC Amb25322288 [0,1,1,0,0,0|2,0,0]=4 2734 B7R0.7 CCOC(=O)NOC Amb6384032 [0,1,1,0,0,0|1,0,0]=3 2735 B7R0.7 CCSC(=O)CCN Amb28043103 [0,1,1,0,0,0|2,0,0]=4 2736 B7R0.7 CNCC(=O)COC Amb28313964 [0,1,1,0,0,0|1,0,0]=3 2737 B7R0.7 CNCC(=O)CSC Amb33272051 [0,1,1,0,0,0|1,1,0]=4 2738 B7R0.7 CNC\C(C)=N\OC Amb28284215 [0,1,1,0,0,0|1,0,1]=4 2739 B7R0.7 COCC(=O)CC#N Amb22752805 [0,1,1,0,0,0|1,0,1]=4 2740 B7R0.7 COCC(=O)CCN Amb26326903 [0,1,1,0,0,0|1,0,0]=3 2741 B7R0.7 COCC(=O)COC Amb2694754 [0,1,1,0,0,0|2,0,0]=4 2742 B7R0.7 COCC(=O)OCCl Amb26452518 [0,1,1,0,0,0|2,0,0]=4 2743 B7R0.7 COCC(C)NC=O Amb27838341 [0,1,1,0,0,0|2,0,0]=4 2744 B7R0.7 CONC(=O)CCBr Amb28048928 [0,1,1,0,0,0|1,0,0]=3 2745 B7R0.7 CONC(=O)CCCl Amb27792516 [0,1,1,0,0,0|1,0,0]=3 2746 B7R0.7 CONC(=O)NOC Amb28364508 [0,1,1,0,0,0|2,0,0]=4 2747 B7R0.7 CONC(=O)OCCl Amb35637649 [0,1,1,0,0,0|1,0,0]=3 2748 B7R0.7 CONS(=O)CCCl Amb27807629 [0,1,1,0,0,0|2,0,0]=4 2749 B7R0.7 CSCC(=O)CCN Amb33272060 [0,1,1,0,0,0|1,1,0]=4 2750 B7R0.7 C\C=C\C(=O)NOC Amb28423185 [0,1,1,0,0,0|1,0,1]=4 2751 B7R0.7 [C-]#[N+]CC(=O)NCC Amb32993667 [0,1,1,0,0,0|1,0,1]=4 2752 B7R0.10 C#CC(=O)N(C)OC Amb28075088 [0,1,1,0,0,0|1,0,1]=4 2753 B7R0.10 C=C(CN)C(=O)OC Amb27599562 [0,1,1,0,0,0|2,0,0]=4 2754 B7R0.10 C=CC(=O)N(C)OC Amb9492353 [0,1,1,0,0,0|1,0,1]=4 2755 B7R0.10 CC(CN)C(O)C=O Amb26370126 [0,1,1,0,0,0|2,0,0]=4 2756 B7R0.10 CCC(=O)C(=O)OC Amb17935757 [0,1,1,0,0,0|2,0,0]=4 2757 B7R0.10 CCC(=O)N(C)OC Amb8394947 [0,1,1,0,0,0|1,0,0]=3 2758 B7R0.10 CCC(=O)N(N)CC Amb33191316 [0,1,1,0,0,0|2,0,0]=4 2759 B7R0.10 CCC(C)C(=O)CN Amb26871505 [0,1,1,0,0,0|2,0,0]=4 2760 B7R0.10 CCC(C)C(N)C=O Amb27257596 [0,1,1,0,0,0|2,0,0]=4 2761 B7R0.10 CCN(C)C(=O)CBr Amb33541718 [0,1,1,0,0,0|2,0,0]=4 2762 B7R0.10 CCN(C)C(=O)CCl Amb8428074 [0,1,1,0,0,0|2,0,0]=4 2763 B7R0.10 CCN(C)C(=O)CI Amb27594155 [0,1,1,0,0,0|2,0,0]=4 2764 B7R0.10 CCN(C)C(=O)CN Amb34912728 [0,1,1,0,0,0|1,0,0]=3 2765 B7R0.10 CCN(C)C(=O)CN Amb8890853 [0,1,1,0,0,0|1,0,0]=3 2766 B7R0.10 CCN(C)C(=O)CO Amb9421550 [0,1,1,0,0,0|2,0,0]=4 2767 B7R0.10 CCN(C)C(=O)NN Amb8891099 [0,1,1,0,0,0|2,0,0]=4 2768 B7R0.10 CCN(O)C(=O)CBr Amb27203032 [0,1,1,0,0,0|2,0,0]=4 2769 B7R0.10 CC[C@H](C)[C@H](N)C=O Amb28247667 [0,1,1,0,0,0|2,0,0]=4 2770 B7R0.10 CNN(C)C(=O)CCl Amb27592475 [0,1,1,0,0,0|2,0,0]=4 2771 B7R0.10 COC(=O)C(=O)CBr Amb2455971 [0,1,1,0,0,0|2,0,0]=4 2772 B7R0.10 COC(=O)C(=O)CCl Amb25929741 [0,1,1,0,0,0|2,0,0]=4 2773 B7R0.10 COC(=O)C(=O)CF Amb27464331 [0,1,1,0,0,0|2,0,0]=4 2774 B7R0.10 COC(=O)C(=O)C[S-] Amb27397384 [0,1,1,0,0,0|2,0,0]=4 2775 B7R0.10 COC(=O)C(=O)NN Amb9753505 [0,1,1,0,0,0|2,0,0]=4 2776 B7R0.10 COC(=O)N(C)OC Amb26498638 [0,1,1,0,0,0|2,0,0]=4 2777 B7R0.10 COC(C)C(=O)NN Amb2081552 [0,1,1,0,0,0|2,0,0]=4 2778 B7R0.10 COC(C)C(Br)C=O Amb28119865 [0,1,1,0,0,0|2,0,0]=4 2779 B7R0.10 CON(C)C(=O)C=O Amb28325250 [0,1,1,0,0,0|1,0,1]=4 2780 B7R0.10 CON(C)C(=O)CBr Amb20673706 [0,1,1,0,0,0|1,0,0]=3 2781 B7R0.10 CON(C)C(=O)CCl Amb3940847 [0,1,1,0,0,0|1,0,0]=3 2782 B7R0.10 CON(C)C(=O)CF Amb27392034 [0,1,1,0,0,0|1,0,0]=3 2783 B7R0.10 CON(C)C(=O)CN Amb18282074 [0,1,1,0,0,0|0,0,0]=2 2784 B7R0.10 CON(C)C(=O)CN Amb32644535 [0,1,1,0,0,0|0,0,0]=2 2785 B7R0.10 CON(C)C(=O)NN Amb28045836 [0,1,1,0,0,0|1,0,0]=3 2786 B7R0.11 CC(O)(C=O)CCN Amb25770524 [0,1,1,0,0,0|2,0,0]=4 2787 B7R0.11 CCS(=N)(=O)NOC Amb30013570 [0,1,1,0,0,0|2,0,0]=4 2788 B7R0.11 COCC(C)(C)C=O Amb18641883 [0,1,1,0,0,0|2,0,0]=4 2789 B7R0.11 COCC(C)(Cl)C=O Amb27794027 [0,1,1,0,0,0|2,0,0]=4 2790 B7R0.11 CONS(=O)(=O)CBr Amb27235644 [0,1,1,0,0,0|2,0,0]=4 2791 B7R0.12 CC\C(C=O)=C\OC Amb27261656 [0,1,1,0,0,0|2,0,0]=4 2792 B7R0.13 C=C(C)C(C)(N)CO Amb33199514 [0,1,1,0,0,0|2,0,0]=4 2793 B7R0.13 CC(=O)C(C)(C)CO Amb24691506 [0,1,1,0,0,0|2,0,0]=4 2794 B7R0.13 CC(=O)C(C)(O)CO Amb27471773 [0,1,1,0,0,0|2,0,0]=4 2795 B7R0.13 CC(=O)C(Cl)(Cl)CO Amb24601361 [0,1,1,0,0,0|2,0,0]=4 2796 B7R0.13 CC(=O)C(F)(F)CO Amb25724409 [0,1,1,0,0,0|2,0,0]=4 2797 B7R0.13 CC(=O)[C@](C)(O)CO Amb28195327 [0,1,1,0,0,0|2,0,0]=4 2798 B7R0.13 CC(Br)(CO)C(N)=O Amb27657597 [0,1,1,0,0,0|1,0,0]=3 2799 B7R0.13 CC(C)(CBr)C(N)=O Amb24635645 [0,1,1,0,0,0|2,0,0]=4 2800 B7R0.13 CC(C)(CCl)C(N)=O Amb27206927 [0,1,1,0,0,0|2,0,0]=4 2801 B7R0.13 CC(C)(CF)C(N)=O Amb28342317 [0,1,1,0,0,0|2,0,0]=4 2802 B7R0.13 CC(C)(CN)C(N)=O Amb8396021 [0,1,1,0,0,0|2,0,0]=4 2803 B7R0.13 CC(C)(CO)C(=N)N Amb25337772 [0,1,1,0,0,0|2,0,0]=4 2804 B7R0.13 CC(C)(CO)C(=O)O Amb2613656 [0,1,1,0,0,0|2,0,0]=4 2805 B7R0.13 CC(C)(CO)C(N)=S Amb26641111 [0,1,1,0,0,0|1,1,0]=4 2806 B7R0.13 CC(C)(NO)C(N)=O Amb27637542 [0,1,1,0,0,0|2,0,0]=4 2807 B7R0.13 CC(C)S(=N)(=O)NO Amb35711043 [0,1,1,0,0,0|2,0,0]=4 2808 B7R0.13 CC(C)S(=O)(=O)NO Amb26647421 [0,1,1,0,0,0|2,0,0]=4 2809 B7R0.13 CC(N)(CF)C(=O)O Amb27435532 [0,1,1,0,0,0|2,0,0]=4 2810 B7R0.13 CC(N)(CN)C(=O)O Amb25310586 [0,1,1,0,0,0|2,0,0]=4 2811 B7R0.13 CC(N)(CN)C(=O)O Amb33550422 [0,1,1,0,0,0|2,0,0]=4 2812 B7R0.13 CC(N)(CO)C(=O)O Amb2780027 [0,1,1,0,0,0|1,0,0]=3 2813 B7R0.13 CC(N)(CO)C(=O)O Amb28934875 [0,1,1,0,0,0|1,0,0]=3 2814 B7R0.13 CC(N)(CO)C(N)=O Amb28381837 [0,1,1,0,0,0|0,0,0]=2 2815 B7R0.13 CC(N)(CS)C(=O)O Amb18124446 [0,1,1,0,0,0|1,1,0]=4 2816 B7R0.13 CC(N)(CS)C(=O)O Amb24480151 [0,1,1,0,0,0|1,1,0]=4 2817 B7R0.13 CC(O)(CO)C(=O)O Amb33544570 [0,1,1,0,0,0|2,0,0]=4 2818 B7R0.13 CCC(C)(C)C(N)=O Amb3886539 [0,1,1,0,0,0|2,0,0]=4 2819 B7R0.13 CCC(C)(Cl)C(N)=O Amb28075797 [0,1,1,0,0,0|2,0,0]=4 2820 B7R0.13 CCC(C)(N)C(=O)O Amb28934789 [0,1,1,0,0,0|2,0,0]=4 2821 B7R0.13 CCC(C)(N)C(=O)O Amb9728371 [0,1,1,0,0,0|2,0,0]=4 2822 B7R0.13 CCC(C)(N)C(N)=O Amb13952193 [0,1,1,0,0,0|1,0,0]=3 2823 B7R0.13 CCC(C)(N)C(N)=O Amb18949646 [0,1,1,0,0,0|1,0,0]=3 2824 B7R0.13 CCC(C)(O)C(N)=O Amb24116738 [0,1,1,0,0,0|2,0,0]=4 2825 B7R0.13 CCC(F)(F)C(N)=O Amb24054261 [0,1,1,0,0,0|2,0,0]=4 2826 B7R0.13 CCC(N)(S)C(=O)O Amb27229859 [0,1,1,0,0,0|2,0,0]=4 2827 B7R0.13 CC[C@@](C)(N)C(=O)O Amb8515205 [0,1,1,0,0,0|2,0,0]=4 2828 B7R0.13 CC[C@](C)(N)C(=O)O Amb16183896 [0,1,1,0,0,0|2,0,0]=4 2829 B7R0.13 CC[C@](C)(N)C(=O)O Amb33871585 [0,1,1,0,0,0|2,0,0]=4 2830 B7R0.13 CC[C@](C)(N)C(N)=O Amb27838327 [0,1,1,0,0,0|1,0,0]=3 2831 B7R0.13 CC[C@](C)(O)C(N)=O Amb27258058 [0,1,1,0,0,0|2,0,0]=4 2832 B7R0.13 CC[C@](N)(O)C(=O)O Amb28398612 [0,1,1,0,0,0|2,0,0]=4 2833 B7R0.13 C[C@@](N)(CO)C(=O)O Amb8515082 [0,1,1,0,0,0|1,0,0]=3 2834 B7R0.13 C[C@@](N)(CS)C(=O)O Amb16183893 [0,1,1,0,0,0|1,1,0]=4 2835 B7R0.13 C[C@@](N)(CS)C(=O)O Amb22757501 [0,1,1,0,0,0|1,1,0]=4 2836 B7R0.13 C[C@@](N)(CS)C(N)=O Amb27843429 [0,1,1,0,0,0|0,1,0]=3 2837 B7R0.13 C[C@](N)(CN)C(=O)O Amb25690446 [0,1,1,0,0,0|2,0,0]=4 2838 B7R0.13 C[C@](N)(CO)C(=O)O Amb8515081 [0,1,1,0,0,0|1,0,0]=3 2839 B7R0.13 NC(=O)C(Cl)(Cl)CCl Amb10844816 [0,1,1,0,0,0|2,0,0]=4 2840 B7R0.13 NC(=O)C(F)(Cl)CCl Amb27961474 [0,1,1,0,0,0|2,0,0]=4 2841 B7R0.13 NC(N)(CS)C(=O)O Amb24746383 [0,1,1,0,0,0|1,1,0]=4 2842 B7R0.13 NCC(F)(F)C(N)=O Amb28049309 [0,1,1,0,0,0|2,0,0]=4 2843 B7R0.13 NCC(F)(F)C(N)=O Amb30585144 [0,1,1,0,0,0|2,0,0]=4 2844 B7R0.13 O=C(O)C(Cl)(Cl)CO Amb27409099 [0,1,1,0,0,0|2,0,0]=4 2845 B7R0.13 O=C(O)C(F)(F)CO Amb17593305 [0,1,1,0,0,0|2,0,0]=4 2846 B7R0.14 C#CC(=O)C(C)(C)N Amb28316034 [0,1,1,0,0,0|2,0,0]=4 2847 B7R0.14 C=CC(=O)C(C)(C)N Amb28313965 [0,1,1,0,0,0|2,0,0]=4 2848 B7R0.14 CC(C)(C)C(=N)NO Amb22731673 [0,1,1,0,0,0|2,0,0]=4 2849 B7R0.14 CC(C)(C)C(=N)NO Amb33715895 [0,1,1,0,0,0|2,0,0]=4 2850 B7R0.14 CC(C)(C)C(=O)CO Amb10574779 [0,1,1,0,0,0|2,0,0]=4 2851 B7R0.14 CC(C)(C)C(=O)NN Amb1141426 [0,1,1,0,0,0|2,0,0]=4 2852 B7R0.14 CC(C)(C)C(=O)NO Amb2411633 [0,1,1,0,0,0|1,0,0]=3 2853 B7R0.14 CC(C)(F)C(=O)NN Amb27837593 [0,1,1,0,0,0|2,0,0]=4 2854 B7R0.14 CC(C)(N)C(=O)CBr Amb27198364 [0,1,1,0,0,0|2,0,0]=4 2855 B7R0.14 CC(C)(N)C(=O)NO Amb22059374 [0,1,1,0,0,0|0,0,0]=2 2856 B7R0.14 CC(C)(N)C(=O)NO Amb32708496 [0,1,1,0,0,0|0,0,0]=2 2857 B7R0.14 CC(C)(N)\C(N)=N\O Amb25057112 [0,1,1,0,0,0|1,0,1]=4 2858 B7R0.14 CC(C)(O)C(=N)NO Amb22735886 [0,1,1,0,0,0|2,0,0]=4 2859 B7R0.14 CC(C)(O)C(=O)NN Amb2154720 [0,1,1,0,0,0|2,0,0]=4 2860 B7R0.14 CC(CO)S(N)(=O)=O Amb24367553 [0,1,1,0,0,0|2,0,0]=4 2861 B7R0.14 CC(Cl)(Cl)C(=O)NO Amb27829599 [0,1,1,0,0,0|1,0,0]=3 2862 B7R0.14 CC(F)(F)C(=O)NN Amb24674729 [0,1,1,0,0,0|2,0,0]=4 2863 B7R0.14 CCC(=O)C(C)(C)N Amb18833010 [0,1,1,0,0,0|2,0,0]=4 2864 B7R0.14 CNC(=N)C(C)(C)N Amb27817696 [0,1,1,0,0,0|2,0,0]=4 2865 B7R0.14 CNC(=O)C(C)(C)Br Amb10071168 [0,1,1,0,0,0|2,0,0]=4 2866 B7R0.14 CNC(=O)C(C)(C)F Amb28049313 [0,1,1,0,0,0|2,0,0]=4 2867 B7R0.14 CNC(=O)C(C)(C)N Amb10608298 [0,1,1,0,0,0|1,0,0]=3 2868 B7R0.14 CNC(=O)C(C)(C)N Amb21956111 [0,1,1,0,0,0|1,0,0]=3 2869 B7R0.14 CNC(=O)C(C)(C)O Amb28127514 [0,1,1,0,0,0|2,0,0]=4 2870 B7R0.14 COC(=O)C(C)(C)N Amb16183987 [0,1,1,0,0,0|2,0,0]=4 2871 B7R0.14 COC(=O)C(C)(C)N Amb6892728 [0,1,1,0,0,0|2,0,0]=4 2872 B7R0.14 COC(=O)C(C)(N)O Amb27477505 [0,1,1,0,0,0|2,0,0]=4 2873 B7R0.14 CP(=O)(O)C(N)CO Amb25809584 [0,1,1,0,0,0|2,0,0]=4 2874 B7R0.15 C=C(C)C(CN)CO Amb33199604 [0,1,1,0,0,0|2,0,0]=4 2875 B7R0.15 CC(=O)C(CN)CN Amb28206451 [0,1,1,0,0,0|2,0,0]=4 2876 B7R0.15 CC(=O)C(CO)CO Amb22904340 [0,1,1,0,0,0|2,0,0]=4 2877 B7R0.15 CC(Cl)\C(C=O)=N\O Amb27875998 [0,1,1,0,0,0|1,0,1]=4 2878 B7R0.15 CCC(C#N)C(N)=O Amb27797961 [0,1,1,0,0,0|1,0,1]=4 2879 B7R0.15 CCC(CC)C(N)=O Amb33550498 [0,1,1,0,0,0|2,0,0]=4 2880 B7R0.15 CCC(CN)C(=O)O Amb18987934 [0,1,1,0,0,0|2,0,0]=4 2881 B7R0.15 CCC(CN)C(=O)O Amb19514932 [0,1,1,0,0,0|2,0,0]=4 2882 B7R0.15 CCC(CN)C(N)=O Amb18294192 [0,1,1,0,0,0|1,0,0]=3 2883 B7R0.15 CCC(CO)C(=O)O Amb18641947 [0,1,1,0,0,0|2,0,0]=4 2884 B7R0.15 CCC(CO)C(=O)[O-] Amb28934895 [0,1,1,0,0,0|2,0,0]=4 2885 B7R0.15 CCC(CO)C(N)=O Amb28314312 [0,1,1,0,0,0|1,0,0]=3 2886 B7R0.15 CCC(NC)C(=O)O Amb10610245 [0,1,1,0,0,0|2,0,0]=4 2887 B7R0.15 CCC(NC)C(=O)O Amb9619833 [0,1,1,0,0,0|2,0,0]=4 2888 B7R0.15 CCC(NC)C(C)=O Amb28049011 [0,1,1,0,0,0|2,0,0]=4 2889 B7R0.15 CCC(NC)C(N)=O Amb15701261 [0,1,1,0,0,0|1,0,0]=3 2890 B7R0.15 CCC(NCl)C(=O)O Amb28387574 [0,1,1,0,0,0|2,0,0]=4 2891 B7R0.15 CCC(NN)C(=O)O Amb18641955 [0,1,1,0,0,0|2,0,0]=4 2892 B7R0.15 CCC(NO)C(=O)O Amb4019788 [0,1,1,0,0,0|2,0,0]=4 2893 B7R0.15 CCC(OC)C(N)=O Amb2027289 [0,1,1,0,0,0|2,0,0]=4 2894 B7R0.15 CC[C@@H](CN)C(=O)O Amb27838297 [0,1,1,0,0,0|2,0,0]=4 2895 B7R0.15 CC[C@@H](CO)C(=O)O Amb22745321 [0,1,1,0,0,0|2,0,0]=4 2896 B7R0.15 CC[C@@H](NC)C(=O)O Amb28315876 [0,1,1,0,0,0|2,0,0]=4 2897 B7R0.15 CC[C@H](CN)C(=O)O Amb25790771 [0,1,1,0,0,0|2,0,0]=4 2898 B7R0.15 CC[C@H](CO)C(=O)O Amb16232065 [0,1,1,0,0,0|2,0,0]=4 2899 B7R0.15 CC[C@H](NC)C(=O)O Amb24505225 [0,1,1,0,0,0|2,0,0]=4 2900 B7R0.15 CC[C@H](NCl)C(=O)O Amb28193501 [0,1,1,0,0,0|2,0,0]=4 2901 B7R0.15 CC[C@H](NN)C(=O)O Amb28289412 [0,1,1,0,0,0|2,0,0]=4 2902 B7R0.15 CNC(CN)C(=O)O Amb23515020 [0,1,1,0,0,0|2,0,0]=4 2903 B7R0.15 CNC(CN)C(=O)O Amb28934876 [0,1,1,0,0,0|2,0,0]=4 2904 B7R0.15 CNC(CO)C(=O)O Amb26068513 [0,1,1,0,0,0|1,0,0]=3 2905 B7R0.15 CNC(CO)C(N)=O Amb18641957 [0,1,1,0,0,0|0,0,0]=2 2906 B7R0.15 CNC(CS)C(=O)O Amb2781760 [0,1,1,0,0,0|1,1,0]=4 2907 B7R0.15 CN[C@@H](CO)C(=O)O Amb16183860 [0,1,1,0,0,0|1,0,0]=3 2908 B7R0.15 CN[C@@H](CO)C(C)=O Amb26476298 [0,1,1,0,0,0|1,0,0]=3 2909 B7R0.15 CN[C@@H](CS)C(=O)O Amb27630049 [0,1,1,0,0,0|1,1,0]=4 2910 B7R0.15 CN[C@@H](CS)C(=O)O Amb33875997 [0,1,1,0,0,0|1,1,0]=4 2911 B7R0.15 CN[C@H](CO)C(=O)O Amb26948665 [0,1,1,0,0,0|1,0,0]=3 2912 B7R0.15 CO[C@@H](CO)C(=O)O Amb27409917 [0,1,1,0,0,0|2,0,0]=4 2913 B7R0.15 N#CC(CO)C(=O)O Amb27246245 [0,1,1,0,0,0|1,0,1]=4 2914 B7R0.15 NC(=O)N(CO)CO Amb22167903 [0,1,1,0,0,0|2,0,0]=4 2915 B7R0.15 NCC(CF)C(=O)O Amb26995116 [0,1,1,0,0,0|2,0,0]=4 2916 B7R0.15 NC[C@H](CO)C(=O)O Amb26873333 [0,1,1,0,0,0|1,0,0]=3 2917 B7R0.15 NNC(CO)C(=O)O Amb27595622 [0,1,1,0,0,0|1,0,0]=3 2918 B7R0.15 NNC(CS)C(=O)O Amb24117863 [0,1,1,0,0,0|1,1,0]=4 2919 B7R0.15 NNC(CS)C(=O)O Amb27834344 [0,1,1,0,0,0|1,1,0]=4 2920 B7R0.15 NOC(CO)C(=O)O Amb27173883 [0,1,1,0,0,0|1,0,0]=3 2921 B7R0.15 O=C(O)C(CO)NCl Amb28120918 [0,1,1,0,0,0|1,0,0]=3 2922 B7R0.15 O=C(O)[C@H](CS)NS Amb27750416 [0,1,1,0,0,0|1,1,0]=4 2923 B7R0.16 C=C(C(=O)O)C(C)N Amb27794714 [0,1,1,0,0,0|2,0,0]=4 2924 B7R0.16 C=C(C(=O)O)[C@@H](C)N Amb27440248 [0,1,1,0,0,0|2,0,0]=4 2925 B7R0.16 C=C(C)C(=O)C(C)N Amb26370543 [0,1,1,0,0,0|2,0,0]=4 2926 B7R0.16 C=C(C)C(=O)[C@@H](C)N Amb30024657 [0,1,1,0,0,0|2,0,0]=4 2927 B7R0.16 C=C(C)C(=O)[C@H](C)N Amb35617899 [0,1,1,0,0,0|2,0,0]=4 2928 B7R0.16 CC(=O)C(C)C(C)O Amb17593202 [0,1,1,0,0,0|2,0,0]=4 2929 B7R0.16 CC(=O)C(C)[C@@H](C)O Amb28316228 [0,1,1,0,0,0|2,0,0]=4 2930 B7R0.16 CC(=O)C(F)C(C)O Amb28437134 [0,1,1,0,0,0|2,0,0]=4 2931 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [0,1,1,0,0,0|1,0,1]=4 2932 B7R0.16 CC(=O)C(N)C(C)C Amb23536905 [0,1,1,0,0,0|2,0,0]=4 2933 B7R0.16 CC(=O)C(O)C(C)O Amb26597030 [0,1,1,0,0,0|2,0,0]=4 2934 B7R0.16 CC(=O)[C@@H](C)[C@H](C)O Amb26966954 [0,1,1,0,0,0|2,0,0]=4 2935 B7R0.16 CC(=O)[C@@H](N)C(C)C Amb28410324 [0,1,1,0,0,0|2,0,0]=4 2936 B7R0.16 CC(=O)[C@@H](O)[C@@H](C)O Amb24481484 [0,1,1,0,0,0|2,0,0]=4 2937 B7R0.16 CC(=O)[C@@H](O)[C@H](C)O Amb28045145 [0,1,1,0,0,0|2,0,0]=4 2938 B7R0.16 CC(=O)[C@H](C)[C@H](C)O Amb28249967 [0,1,1,0,0,0|2,0,0]=4 2939 B7R0.16 CC(=O)[C@H](O)[C@@H](C)O Amb24701454 [0,1,1,0,0,0|2,0,0]=4 2940 B7R0.16 CC(Br)C(=O)C(=O)O Amb23400913 [0,1,1,0,0,0|2,0,0]=4 2941 B7R0.16 CC(Br)C(=O)N(C)C Amb15701256 [0,1,1,0,0,0|2,0,0]=4 2942 B7R0.16 CC(C(=O)[O-])[C@H](C)O Amb27835918 [0,1,1,0,0,0|2,0,0]=4 2943 B7R0.16 CC(C(N)=O)C(=O)O Amb27401562 [0,1,1,0,0,0|1,0,1]=4 2944 B7R0.16 CC(C)C(=O)C(=O)O Amb6600000 [0,1,1,0,0,0|2,0,0]=4 2945 B7R0.16 CC(C)C(=O)C(C)N Amb18124258 [0,1,1,0,0,0|2,0,0]=4 2946 B7R0.16 CC(C)C(=O)C(C)O Amb26478614 [0,1,1,0,0,0|2,0,0]=4 2947 B7R0.16 CC(C)C(=O)N(C)C Amb2687536 [0,1,1,0,0,0|2,0,0]=4 2948 B7R0.16 CC(C)C(=O)N(C)N Amb18641905 [0,1,1,0,0,0|2,0,0]=4 2949 B7R0.16 CC(C)C(=O)N(C)O Amb27963828 [0,1,1,0,0,0|1,0,0]=3 2950 B7R0.16 CC(C)C(=O)[C@@H](C)N Amb30023832 [0,1,1,0,0,0|2,0,0]=4 2951 B7R0.16 CC(C)C(=O)[C@H](C)O Amb27985493 [0,1,1,0,0,0|2,0,0]=4 2952 B7R0.16 CC(C)C(Br)C(N)=O Amb9725771 [0,1,1,0,0,0|2,0,0]=4 2953 B7R0.16 CC(C)C(N)C(=O)Cl Amb6740265 [0,1,1,0,0,0|2,0,0]=4 2954 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [0,1,1,0,0,0|2,0,0]=4 2955 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,1,1,0,0,0|1,0,0]=3 2956 B7R0.16 CC(C)C(N)C(N)=O Amb32666402 [0,1,1,0,0,0|1,0,0]=3 2957 B7R0.16 CC(C)C(N)C(N)=O Amb6271181 [0,1,1,0,0,0|1,0,0]=3 2958 B7R0.16 CC(C)C(N)C(N)=S Amb19148044 [0,1,1,0,0,0|1,1,0]=4 2959 B7R0.16 CC(C)[C@@H](C)C(N)=O Amb27838382 [0,1,1,0,0,0|2,0,0]=4 2960 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [0,1,1,0,0,0|2,0,0]=4 2961 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,1,1,0,0,0|1,0,0]=3 2962 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,1,1,0,0,0|1,0,0]=3 2963 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb4013551 [0,1,1,0,0,0|1,0,0]=3 2964 B7R0.16 CC(C)[C@@H](O)C(N)=O Amb27879443 [0,1,1,0,0,0|2,0,0]=4 2965 B7R0.16 CC(C)[C@H](C)C(N)=O Amb28345619 [0,1,1,0,0,0|2,0,0]=4 2966 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [0,1,1,0,0,0|2,0,0]=4 2967 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16183986 [0,1,1,0,0,0|1,0,0]=3 2968 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16231400 [0,1,1,0,0,0|1,0,0]=3 2969 B7R0.16 CC(C)[C@H](N)C(N)=O Amb30595108 [0,1,1,0,0,0|1,0,0]=3 2970 B7R0.16 CC(Cl)C(=O)N(C)C Amb9722427 [0,1,1,0,0,0|2,0,0]=4 2971 B7R0.16 CC(F)C(=O)C(=O)O Amb27246511 [0,1,1,0,0,0|2,0,0]=4 2972 B7R0.16 CC(F)C(N)C(=O)O Amb10838661 [0,1,1,0,0,0|2,0,0]=4 2973 B7R0.16 CC(F)C(N)C(=O)O Amb32752736 [0,1,1,0,0,0|2,0,0]=4 2974 B7R0.16 CC(F)C(N)C(N)=O Amb28250824 [0,1,1,0,0,0|1,0,0]=3 2975 B7R0.16 CC(F)[C@@H](N)C(=O)O Amb28316197 [0,1,1,0,0,0|2,0,0]=4 2976 B7R0.16 CC(I)C(=O)N(C)C Amb27800345 [0,1,1,0,0,0|2,0,0]=4 2977 B7R0.16 CC(N)C(=O)C(F)F Amb33337756 [0,1,1,0,0,0|2,0,0]=4 2978 B7R0.16 CC(N)C(=O)N(C)C Amb21955713 [0,1,1,0,0,0|1,0,0]=3 2979 B7R0.16 CC(N)C(=O)N(C)C Amb9728906 [0,1,1,0,0,0|1,0,0]=3 2980 B7R0.16 CC(N)C(=O)N(C)N Amb28074021 [0,1,1,0,0,0|1,0,0]=3 2981 B7R0.16 CC(N)C(=O)N(C)O Amb27640165 [0,1,1,0,0,0|0,0,0]=2 2982 B7R0.16 CC(N)C(C)C(N)=O Amb27172764 [0,1,1,0,0,0|2,0,0]=4 2983 B7R0.16 CC(N)C(N)C(=O)O Amb22728051 [0,1,1,0,0,0|2,0,0]=4 2984 B7R0.16 CC(N)C(O)C(N)=O Amb27483181 [0,1,1,0,0,0|2,0,0]=4 2985 B7R0.16 CC(N)[C@H](N)C(=O)O Amb25083113 [0,1,1,0,0,0|2,0,0]=4 2986 B7R0.16 CC(N)[C@H](N)C(=O)O Amb33740158 [0,1,1,0,0,0|2,0,0]=4 2987 B7R0.16 CC(O)C(=O)C(=O)O Amb24481396 [0,1,1,0,0,0|2,0,0]=4 2988 B7R0.16 CC(O)C(=O)C(C)Br Amb27806606 [0,1,1,0,0,0|2,0,0]=4 2989 B7R0.16 CC(O)C(=O)N(C)C Amb2609090 [0,1,1,0,0,0|2,0,0]=4 2990 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,1,1,0,0,0|2,0,0]=4 2991 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,1,1,0,0,0|2,0,0]=4 2992 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,1,1,0,0,0|2,0,0]=4 2993 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,1,1,0,0,0|2,0,0]=4 2994 B7R0.16 CC(O)C(N)C(=O)Cl Amb27830226 [0,1,1,0,0,0|1,0,0]=3 2995 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,1,1,0,0,0|1,0,0]=3 2996 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,1,1,0,0,0|1,0,0]=3 2997 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,1,1,0,0,0|0,0,0]=2 2998 B7R0.16 CC(O)C(N)C(N)=O Amb4006836 [0,1,1,0,0,0|0,0,0]=2 2999 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,1,1,0,0,0|2,0,0]=4 3000 B7R0.16 CC(O)[C@H](N)C(N)=O Amb27643319 [0,1,1,0,0,0|0,0,0]=2 3001 B7R0.16 CC(S)C(=O)C(=O)O Amb28128312 [0,1,1,0,0,0|2,0,0]=4 3002 B7R0.16 CC(S)C(N)C(=O)O Amb17593434 [0,1,1,0,0,0|1,1,0]=4 3003 B7R0.16 CC(S)[C@@H](N)C(=O)O Amb24606864 [0,1,1,0,0,0|1,1,0]=4 3004 B7R0.16 CN(C)C(=O)N(C)N Amb26964847 [0,1,1,0,0,0|2,0,0]=4 3005 B7R0.16 CN(C)C(=O)N(C)O Amb28060378 [0,1,1,0,0,0|2,0,0]=4 3006 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(N)=O Amb27607679 [0,1,1,0,0,0|2,0,0]=4 3007 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb28286576 [0,1,1,0,0,0|2,0,0]=4 3008 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb32668519 [0,1,1,0,0,0|2,0,0]=4 3009 B7R0.16 C[C@@H](N)C(=O)N(C)C Amb18538472 [0,1,1,0,0,0|1,0,0]=3 3010 B7R0.16 C[C@@H](N)C(=O)N(C)C Amb24271083 [0,1,1,0,0,0|1,0,0]=3 3011 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb22745441 [0,1,1,0,0,0|2,0,0]=4 3012 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb24481409 [0,1,1,0,0,0|2,0,0]=4 3013 B7R0.16 C[C@@H](O)C(=O)N(C)C Amb25358663 [0,1,1,0,0,0|2,0,0]=4 3014 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,1,1,0,0,0|1,0,0]=3 3015 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,1,1,0,0,0|2,0,0]=4 3016 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,1,1,0,0,0|1,0,0]=3 3017 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,1,1,0,0,0|2,0,0]=4 3018 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,1,1,0,0,0|2,0,0]=4 3019 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,1,1,0,0,0|1,0,0]=3 3020 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,1,1,0,0,0|1,0,0]=3 3021 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,1,1,0,0,0|1,0,0]=3 3022 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,1,1,0,0,0|0,0,0]=2 3023 B7R0.16 C[C@@H](S)[C@H](N)C(=O)O Amb24117242 [0,1,1,0,0,0|1,1,0]=4 3024 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,1,1,0,0,0|2,0,0]=4 3025 B7R0.16 C[C@H](Cl)C(=O)N(C)C Amb28382530 [0,1,1,0,0,0|2,0,0]=4 3026 B7R0.16 C[C@H](N)C(=O)N(C)C Amb17231827 [0,1,1,0,0,0|1,0,0]=3 3027 B7R0.16 C[C@H](N)C(=O)N(C)C Amb28934804 [0,1,1,0,0,0|1,0,0]=3 3028 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb17678797 [0,1,1,0,0,0|2,0,0]=4 3029 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb26887696 [0,1,1,0,0,0|2,0,0]=4 3030 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,1,1,0,0,0|2,0,0]=4 3031 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,1,1,0,0,0|2,0,0]=4 3032 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,1,1,0,0,0|1,0,0]=3 3033 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,1,1,0,0,0|2,0,0]=4 3034 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,1,1,0,0,0|2,0,0]=4 3035 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,1,1,0,0,0|2,0,0]=4 3036 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,1,1,0,0,0|2,0,0]=4 3037 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,1,1,0,0,0|1,0,0]=3 3038 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,1,1,0,0,0|1,0,0]=3 3039 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,1,1,0,0,0|2,0,0]=4 3040 B7R0.16 C\C(O)=C(/N)C(N)=O Amb28429800 [0,1,1,0,0,0|0,0,2]=4 3041 B7R0.16 N=C(N)C(N)C(N)=O Amb27601378 [0,1,1,0,0,0|1,0,1]=4 3042 B7R0.16 NC(=O)C(N)C(N)=O Amb518675 [0,1,1,0,0,0|0,0,2]=4 3043 B7R0.16 NC(=O)[C@H](N)C(=O)O Amb28397054 [0,1,1,0,0,0|0,0,1]=3 3044 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,1,1,0,0,0|1,0,1]=4 3045 B7R0.16 NC(C(=O)O)C(F)F Amb24713127 [0,1,1,0,0,0|2,0,0]=4 3046 B7R0.16 NC(C(=O)O)C(F)F Amb32644474 [0,1,1,0,0,0|2,0,0]=4 3047 B7R0.16 N[C@@H](C(=O)O)S(=O)O Amb28125643 [0,1,1,0,0,0|2,0,0]=4 3048 B7R0.16 N[C@H](C(=O)O)C(O)O Amb27867398 [0,1,1,0,0,0|1,0,0]=3 3049 B7R0.1 C#CCCCNC=O Amb27838352 [0,1,1,0,0,0|2,0,0]=4 3050 B7R0.1 C=CCCOCCN Amb22059113 [0,1,1,0,0,0|2,0,0]=4 3051 B7R0.1 C=CCNCCCN Amb17315274 [0,1,1,0,0,0|2,0,0]=4 3052 B7R0.1 C=CCNOCCC Amb28077176 [0,1,1,0,0,0|2,0,0]=4 3053 B7R0.1 C=CCOCCCN Amb25190295 [0,1,1,0,0,0|2,0,0]=4 3054 B7R0.1 CCCCOCC=O Amb26515709 [0,1,1,0,0,0|2,0,0]=4 3055 B7R0.1 CCSCCNC=O Amb27752341 [0,1,1,0,0,0|2,0,0]=4 3056 B7R0.1 COCCOCC=O Amb26051823 [0,1,1,0,0,0|2,0,0]=4 3057 B7R0.1 COCCONC=O Amb28049001 [0,1,1,0,0,0|1,0,0]=3 3058 B7R0.1 N#CCCOCC=O Amb27613546 [0,1,1,0,0,0|1,0,1]=4 3059 B7R0.1 NCCCCNC=O Amb18641902 [0,1,1,0,0,0|1,0,0]=3 3060 B7R0.1 O=CCCOCCO Amb18641946 [0,1,1,0,0,0|2,0,0]=4 3061 B7R0.1 O=CNCCCCF Amb27168251 [0,1,1,0,0,0|2,0,0]=4 3062 B7R0.1 O=CNCCCCO Amb28187191 [0,1,1,0,0,0|2,0,0]=4 3063 B7R0.1 O=COCOCCCl Amb28326081 [0,1,1,0,0,0|2,0,0]=4 3064 B7R0.4 C=C(Br)COCCN Amb19020783 [0,1,1,0,0,0|2,0,0]=4 3065 B7R0.4 C=C(C)COCCN Amb19020764 [0,1,1,0,0,0|2,0,0]=4 3066 B7R0.4 C=C(C)COCCN Amb20631068 [0,1,1,0,0,0|2,0,0]=4 3067 B7R0.4 C=C(C)CONC=O Amb27620967 [0,1,1,0,0,0|1,0,1]=4 3068 B7R0.4 C=C(Cl)COCCN Amb19020765 [0,1,1,0,0,0|2,0,0]=4 3069 B7R0.4 C=CCONC(N)=O Amb2899787 [0,1,1,0,0,0|1,0,1]=4 3070 B7R0.4 CC(=O)CCCCN Amb27401218 [0,1,1,0,0,0|2,0,0]=4 3071 B7R0.4 CC(=O)COCCCl Amb25346574 [0,1,1,0,0,0|2,0,0]=4 3072 B7R0.4 CC(=O)COCCF Amb27463527 [0,1,1,0,0,0|2,0,0]=4 3073 B7R0.4 CC(=O)COCCO Amb28122841 [0,1,1,0,0,0|2,0,0]=4 3074 B7R0.4 CC(=O)CSCCN Amb17500454 [0,1,1,0,0,0|1,1,0]=4 3075 B7R0.4 CC(=O)NCCCBr Amb8826231 [0,1,1,0,0,0|2,0,0]=4 3076 B7R0.4 CC(=O)NCCCCl Amb3886559 [0,1,1,0,0,0|2,0,0]=4 3077 B7R0.4 CC(=O)NCCCN Amb10610286 [0,1,1,0,0,0|1,0,0]=3 3078 B7R0.4 CC(=O)NCCCN Amb6664982 [0,1,1,0,0,0|1,0,0]=3 3079 B7R0.4 CC(=O)NCCCO Amb3429354 [0,1,1,0,0,0|2,0,0]=4 3080 B7R0.4 CC(=O)NCCNN Amb24117179 [0,1,1,0,0,0|2,0,0]=4 3081 B7R0.4 CC(=O)NCCON Amb17138368 [0,1,1,0,0,0|2,0,0]=4 3082 B7R0.4 CC(=O)NOCCO Amb27484242 [0,1,1,0,0,0|1,0,0]=3 3083 B7R0.4 CC(C)CCNC=O Amb27460935 [0,1,1,0,0,0|2,0,0]=4 3084 B7R0.4 CCCCNC(=O)Cl Amb24574309 [0,1,1,0,0,0|2,0,0]=4 3085 B7R0.4 CCCCNC(C)=O Amb5835711 [0,1,1,0,0,0|2,0,0]=4 3086 B7R0.4 CCCCNC(N)=O Amb6663202 [0,1,1,0,0,0|2,0,0]=4 3087 B7R0.4 CCCNNC(N)=O Amb27405031 [0,1,1,0,0,0|2,0,0]=4 3088 B7R0.4 CCCOCC(=O)Cl Amb27260778 [0,1,1,0,0,0|2,0,0]=4 3089 B7R0.4 CCCOCC(=O)O Amb8874504 [0,1,1,0,0,0|2,0,0]=4 3090 B7R0.4 CCCOCC(N)=O Amb27844884 [0,1,1,0,0,0|2,0,0]=4 3091 B7R0.4 CCCONC(C)=O Amb27764366 [0,1,1,0,0,0|1,0,0]=3 3092 B7R0.4 CCCONC(N)=O Amb2899788 [0,1,1,0,0,0|1,0,0]=3 3093 B7R0.4 N=C(N)NOCCO Amb27217173 [0,1,1,0,0,0|2,0,0]=4 3094 B7R0.4 NC(=O)COCCBr Amb25133475 [0,1,1,0,0,0|2,0,0]=4 3095 B7R0.4 NC(=O)COCCCl Amb5722397 [0,1,1,0,0,0|2,0,0]=4 3096 B7R0.4 NC(=O)NCCCF Amb27396406 [0,1,1,0,0,0|2,0,0]=4 3097 B7R0.4 NC(=O)NCCCO Amb9248133 [0,1,1,0,0,0|2,0,0]=4 3098 B7R0.4 NC(=S)CCNC=O Amb27395809 [0,1,1,0,0,0|1,0,1]=4 3099 B7R0.4 NCCC#CC(=O)O Amb32656225 [0,1,1,0,0,0|2,0,0]=4 3100 B7R0.4 NCCCCC(=O)Cl Amb26599615 [0,1,1,0,0,0|2,0,0]=4 3101 B7R0.4 NCCCCC(=O)O Amb2780021 [0,1,1,0,0,0|2,0,0]=4 3102 B7R0.4 NCCCCC(=O)O Amb3941646 [0,1,1,0,0,0|2,0,0]=4 3103 B7R0.4 NCCCCC(=O)O Amb9825855 [0,1,1,0,0,0|2,0,0]=4 3104 B7R0.4 NCCCCC(N)=O Amb18641897 [0,1,1,0,0,0|2,0,0]=4 3105 B7R0.4 NCCCCC(N)=O Amb33552086 [0,1,1,0,0,0|2,0,0]=4 3106 B7R0.4 NCCCNC(=O)O Amb24093884 [0,1,1,0,0,0|1,0,0]=3 3107 B7R0.4 NCCCNC(=O)S Amb27839485 [0,1,1,0,0,0|1,0,0]=3 3108 B7R0.4 NCCCNC(=S)S Amb27772303 [0,1,1,0,0,0|1,1,0]=4 3109 B7R0.4 NCCCNC(N)=O Amb18296186 [0,1,1,0,0,0|1,0,0]=3 3110 B7R0.4 NCCCNC(N)=O Amb20622408 [0,1,1,0,0,0|1,0,0]=3 3111 B7R0.4 NCCCOC(N)=O Amb26334419 [0,1,1,0,0,0|2,0,0]=4 3112 B7R0.4 NCCCOC(N)=O Amb33299259 [0,1,1,0,0,0|2,0,0]=4 3113 B7R0.4 NCCNCC(=O)O Amb17608063 [0,1,1,0,0,0|2,0,0]=4 3114 B7R0.4 NCCNCC(=O)O Amb33339058 [0,1,1,0,0,0|2,0,0]=4 3115 B7R0.4 NCCNCC(N)=O Amb28388338 [0,1,1,0,0,0|2,0,0]=4 3116 B7R0.4 NCCOCC(=O)O Amb18630146 [0,1,1,0,0,0|1,0,0]=3 3117 B7R0.4 NCCOCC(=O)O Amb33550947 [0,1,1,0,0,0|1,0,0]=3 3118 B7R0.4 NCCOCC(N)=O Amb18523830 [0,1,1,0,0,0|1,0,0]=3 3119 B7R0.4 NCCOCC(N)=O Amb33549549 [0,1,1,0,0,0|1,0,0]=3 3120 B7R0.4 NCCSCC(=O)O Amb17500446 [0,1,1,0,0,0|1,1,0]=4 3121 B7R0.4 NCCSCC(=O)O Amb20622325 [0,1,1,0,0,0|1,1,0]=4 3122 B7R0.4 NCCSCC(N)=O Amb6266329 [0,1,1,0,0,0|1,1,0]=4 3123 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [0,1,1,0,0,0|2,0,0]=4 3124 B7R0.4 O=C(Cl)COCCCl Amb17610887 [0,1,1,0,0,0|2,0,0]=4 3125 B7R0.4 O=C(Cl)NCCCCl Amb27856097 [0,1,1,0,0,0|2,0,0]=4 3126 B7R0.4 O=C(Cl)NCCCF Amb35633310 [0,1,1,0,0,0|2,0,0]=4 3127 B7R0.4 O=C(O)COCCCl Amb21857870 [0,1,1,0,0,0|2,0,0]=4 3128 B7R0.4 O=C(O)COCCF Amb27866609 [0,1,1,0,0,0|2,0,0]=4 3129 B7R0.4 O=C(O)COCCO Amb6680914 [0,1,1,0,0,0|2,0,0]=4 3130 B7R0.4 O=C([O-])COCCO Amb33553026 [0,1,1,0,0,0|2,0,0]=4 3131 B7R0.4 O=CNOCC(=O)O Amb27477273 [0,1,1,0,0,0|1,0,1]=4 3132 B7R1.1 CNC1CCNC1 Amb22491402 [1,1,0,0,0,0|1,0,1]=4 3133 B7R1.1 CNC1CCNC1 Amb8396671 [1,1,0,0,0,0|1,0,1]=4 3134 B7R1.1 CNC1CCNC1 Amb8397135 [1,1,0,0,0,0|1,0,1]=4 3135 B7R1.1 CNC1CCOC1 Amb20241377 [1,1,0,0,0,0|1,0,1]=4 3136 B7R1.1 CNC1CCOC1 Amb8009837 [1,1,0,0,0,0|1,0,1]=4 3137 B7R1.1 CN[C@@H]1CCNC1 Amb8396672 [1,1,0,0,0,0|1,0,1]=4 3138 B7R1.1 CN[C@@H]1CCNC1 Amb8397134 [1,1,0,0,0,0|1,0,1]=4 3139 B7R1.1 CN[C@@H]1CCOC1 Amb20241026 [1,1,0,0,0,0|1,0,1]=4 3140 B7R1.1 CN[C@@H]1CCOC1 Amb33330851 [1,1,0,0,0,0|1,0,1]=4 3141 B7R1.1 CN[C@H]1CCNC1 Amb8396673 [1,1,0,0,0,0|1,0,1]=4 3142 B7R1.1 CN[C@H]1CCNC1 Amb8397133 [1,1,0,0,0,0|1,0,1]=4 3143 B7R1.1 CN[C@H]1CCOC1 Amb20240861 [1,1,0,0,0,0|1,0,1]=4 3144 B7R1.1 CN[C@H]1CCOC1 Amb20241500 [1,1,0,0,0,0|1,0,1]=4 3145 B7R1.1 ClCC1=NOCC1 Amb32660442 [1,1,0,0,0,0|1,0,1]=4 3146 B7R1.1 N#CC1=NOCC1 Amb24624782 [1,1,0,0,0,0|1,0,1]=4 3147 B7R1.1 NCC1=NOCC1 Amb19148524 [1,1,0,0,0,0|1,0,1]=4 3148 B7R1.1 NCC1=NOCC1 Amb33330960 [1,1,0,0,0,0|1,0,1]=4 3149 B7R1.1 NCC1C=CCC1 Amb18119742 [1,1,0,0,0,0|2,0,0]=4 3150 B7R1.1 NCC1C=CCC1 Amb30584689 [1,1,0,0,0,0|2,0,0]=4 3151 B7R1.1 NCC1CCOC1 Amb33536658 [1,1,0,0,0,0|1,0,1]=4 3152 B7R1.1 NCC1CCOC1 Amb7969615 [1,1,0,0,0,0|1,0,1]=4 3153 B7R1.1 NCC1COCO1 Amb25261501 [1,1,0,0,0,0|2,0,0]=4 3154 B7R1.1 NCC1COCO1 Amb28827653 [1,1,0,0,0,0|2,0,0]=4 3155 B7R1.1 NC[C@@H]1CCOC1 Amb26870648 [1,1,0,0,0,0|1,0,1]=4 3156 B7R1.1 NC[C@@H]1CCOC1 Amb31204704 [1,1,0,0,0,0|1,0,1]=4 3157 B7R1.1 NC[C@H]1CCNC1 Amb25079280 [1,1,0,0,0,0|1,0,1]=4 3158 B7R1.1 NC[C@H]1CCOC1 Amb23439065 [1,1,0,0,0,0|1,0,1]=4 3159 B7R1.1 NC[C@H]1CCOC1 Amb23439174 [1,1,0,0,0,0|1,0,1]=4 3160 B7R1.1 NNC1CCNC1 Amb28984221 [1,1,0,0,0,0|1,0,1]=4 3161 B7R1.1 NNC1CCOC1 Amb20668064 [1,1,0,0,0,0|1,0,1]=4 3162 B7R1.1 NNC1CCOC1 Amb22059240 [1,1,0,0,0,0|1,0,1]=4 3163 B7R1.1 NNC1CCOC1 Amb22491679 [1,1,0,0,0,0|1,0,1]=4 3164 B7R1.1 NN[C@@H]1CCOC1 Amb31291316 [1,1,0,0,0,0|1,0,1]=4 3165 B7R1.1 NOC1CCOC1 Amb22295766 [1,1,0,0,0,0|1,0,1]=4 3166 B7R1.1 NO[C@H]1CCNC1 Amb28245423 [1,1,0,0,0,0|1,0,1]=4 3167 B7R1.1 O=C=C1CC=CN1 Amb27851531 [1,1,0,0,0,0|1,0,1]=4 3168 B7R1.1 O=C=C1CCCC1 Amb17673796 [1,1,0,0,0,0|2,0,0]=4 3169 B7R1.1 O=CC1=CCCC1 Amb17138358 [1,1,0,0,0,0|2,0,0]=4 3170 B7R1.1 O=CC1=COCC1 Amb18120774 [1,1,0,0,0,0|1,0,0]=3 3171 B7R1.1 O=CC1=NOCC1 Amb35788708 [1,1,0,0,0,0|0,0,1]=3 3172 B7R1.1 O=CC1CCOC1 Amb6608994 [1,1,0,0,0,0|1,0,1]=4 3173 B7R1.1 O=C[C@@H]1CCCN1 Amb27261498 [1,1,0,0,0,0|1,0,1]=4 3174 B7R1.1 O=C[C@@H]1CCOC1 Amb27801459 [1,1,0,0,0,0|1,0,1]=4 3175 B7R1.1 O=NC1CCCN1 Amb27488681 [1,1,0,0,0,0|1,0,1]=4 3176 B7R1.1 O=S=C1NCCO1 Amb28350550 [1,1,0,0,0,0|2,0,0]=4 3177 B7R1.1 OCC1=COCC1 Amb27827039 [1,1,0,0,0,0|1,0,1]=4 3178 B7R1.1 OCC1=NOCC1 Amb35746891 [1,1,0,0,0,0|0,0,2]=4 3179 B7R1.1 OCC1CCON1 Amb25888553 [1,1,0,0,0,0|0,0,2]=4 3180 B7R1.1 OCC1CCON1 Amb33483283 [1,1,0,0,0,0|0,0,2]=4 3181 B7R1.1 OCC1CNOC1 Amb27867600 [1,1,0,0,0,0|1,0,1]=4 3182 B7R1.1 ONC1CCOC1 Amb25888397 [1,1,0,0,0,0|1,0,1]=4 3183 B7R1.1 ONC1CCOC1 Amb32653528 [1,1,0,0,0,0|1,0,1]=4 3184 B7R1.1 O\N=C1/CCCN1 Amb19769769 [1,1,0,0,0,0|1,0,1]=4 3185 B7R1.1 O\N=C1/CCCN1 Amb33309985 [1,1,0,0,0,0|1,0,1]=4 3186 B7R1.2 C=C1COC(C)C1 Amb35695393 [1,1,0,0,0,0|2,0,0]=4 3187 B7R1.2 C=C1NC(=O)CO1 Amb27847146 [1,1,0,0,0,0|2,0,0]=4 3188 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [1,1,0,0,0,0|2,0,0]=4 3189 B7R1.2 CC1=CC(=O)NO1 Amb19338707 [1,1,0,0,0,0|0,0,2]=4 3190 B7R1.2 CC1=CC(N)CC1 Amb28186103 [1,1,0,0,0,0|2,0,0]=4 3191 B7R1.2 CC1=NCC(=O)N1 Amb27827848 [1,1,0,0,0,0|2,0,0]=4 3192 B7R1.2 CC1=NNC(=O)C1 Amb932788 [1,1,0,0,0,0|1,0,1]=4 3193 B7R1.2 CC1C=CC(=O)C1 Amb27260718 [1,1,0,0,0,0|2,0,0]=4 3194 B7R1.2 CC1CC(=O)CN1 Amb28349308 [1,1,0,0,0,0|2,0,0]=4 3195 B7R1.2 CC1CC(=O)CO1 Amb25888380 [1,1,0,0,0,0|1,0,0]=3 3196 B7R1.2 CC1CC(=O)CS1 Amb23598370 [1,1,0,0,0,0|1,1,0]=4 3197 B7R1.2 CC1CC(=O)NN1 Amb493880 [1,1,0,0,0,0|1,0,0]=3 3198 B7R1.2 CC1CC(N)=NO1 Amb26627705 [1,1,0,0,0,0|1,0,1]=4 3199 B7R1.2 CC1CC(N)CN1 Amb27168248 [1,1,0,0,0,0|1,0,1]=4 3200 B7R1.2 CC1CC(N)CO1 Amb28283957 [1,1,0,0,0,0|1,0,1]=4 3201 B7R1.2 CC1CC(N)CO1 Amb28827641 [1,1,0,0,0,0|1,0,1]=4 3202 B7R1.2 CC1CCC(=O)C1 Amb8513672 [1,1,0,0,0,0|2,0,0]=4 3203 B7R1.2 CC1CCC(=O)N1 Amb19267101 [1,1,0,0,0,0|1,0,0]=3 3204 B7R1.2 CC1CCC(=O)O1 Amb6298321 [1,1,0,0,0,0|2,0,0]=4 3205 B7R1.2 CC1CCC(=O)S1 Amb27252897 [1,1,0,0,0,0|2,0,0]=4 3206 B7R1.2 CC1CCC(=S)N1 Amb27849283 [1,1,0,0,0,0|1,1,0]=4 3207 B7R1.2 CC1CNC(=O)C1 Amb10608004 [1,1,0,0,0,0|1,0,0]=3 3208 B7R1.2 CC1CNC(=O)N1 Amb17506853 [1,1,0,0,0,0|2,0,0]=4 3209 B7R1.2 CC1CNC(=O)O1 Amb19651732 [1,1,0,0,0,0|2,0,0]=4 3210 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,1,0,0,0,0|2,0,0]=4 3211 B7R1.2 CC1COC(=O)N1 Amb19517037 [1,1,0,0,0,0|2,0,0]=4 3212 B7R1.2 CC1CSC(=O)N1 Amb28320497 [1,1,0,0,0,0|2,0,0]=4 3213 B7R1.2 CC1NC(=O)CS1 Amb27806202 [1,1,0,0,0,0|2,0,0]=4 3214 B7R1.2 CC1NCC(=O)N1 Amb28456791 [1,1,0,0,0,0|2,0,0]=4 3215 B7R1.2 CN1CC(O)CO1 Amb27980980 [1,1,0,0,0,0|1,0,1]=4 3216 B7R1.2 CN1CC(O)ON1 Amb27465997 [1,1,0,0,0,0|2,0,0]=4 3217 B7R1.2 CN1CCC(=O)C1 Amb22236123 [1,1,0,0,0,0|2,0,0]=4 3218 B7R1.2 CN1CCC(=O)C1 Amb8947873 [1,1,0,0,0,0|2,0,0]=4 3219 B7R1.2 CN1CCC(=O)N1 Amb24064860 [1,1,0,0,0,0|1,0,0]=3 3220 B7R1.2 CN1CCC(N)C1 Amb10610163 [1,1,0,0,0,0|1,0,1]=4 3221 B7R1.2 CN1CCC(N)C1 Amb8948079 [1,1,0,0,0,0|1,0,1]=4 3222 B7R1.2 CN1CC[C@@H](N)C1 Amb19891803 [1,1,0,0,0,0|1,0,1]=4 3223 B7R1.2 CN1CC[C@@H](N)C1 Amb8386824 [1,1,0,0,0,0|1,0,1]=4 3224 B7R1.2 CN1CC[C@H](N)C1 Amb19929627 [1,1,0,0,0,0|1,0,1]=4 3225 B7R1.2 CN1CC[C@H](N)C1 Amb20671398 [1,1,0,0,0,0|1,0,1]=4 3226 B7R1.2 CN1C[C@H](O)CO1 Amb27761726 [1,1,0,0,0,0|1,0,1]=4 3227 B7R1.2 C[C@@H]1C=CC(=O)C1 Amb28199837 [1,1,0,0,0,0|2,0,0]=4 3228 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,1,0,0,0,0|2,0,0]=4 3229 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [1,1,0,0,0,0|1,0,0]=3 3230 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [1,1,0,0,0,0|2,0,0]=4 3231 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,1,0,0,0,0|1,0,0]=3 3232 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [1,1,0,0,0,0|2,0,0]=4 3233 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,1,0,0,0,0|2,0,0]=4 3234 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [1,1,0,0,0,0|2,0,0]=4 3235 B7R1.2 C[C@@H]1C[C@@H](N)CN1 Amb27214176 [1,1,0,0,0,0|1,0,1]=4 3236 B7R1.2 C[C@@H]1C[C@H](N)CN1 Amb27421394 [1,1,0,0,0,0|1,0,1]=4 3237 B7R1.2 C[C@H]1C=CC(=O)C1 Amb27262978 [1,1,0,0,0,0|2,0,0]=4 3238 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [1,1,0,0,0,0|2,0,0]=4 3239 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [1,1,0,0,0,0|1,0,0]=3 3240 B7R1.2 C[C@H]1CNC(=O)N1 Amb27413051 [1,1,0,0,0,0|2,0,0]=4 3241 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,1,0,0,0,0|2,0,0]=4 3242 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [1,1,0,0,0,0|2,0,0]=4 3243 B7R1.2 C[C@H]1C[C@@H](N)CN1 Amb26406117 [1,1,0,0,0,0|1,0,1]=4 3244 B7R1.2 N=C1C=C(N)CO1 Amb27631497 [1,1,0,0,0,0|1,0,1]=4 3245 B7R1.2 N=C1CSC(=O)N1 Amb2537154 [1,1,0,0,0,0|2,0,0]=4 3246 B7R1.2 N=C1NC(=O)CS1 Amb8468365 [1,1,0,0,0,0|2,0,0]=4 3247 B7R1.2 NC1=CC(=O)CC1 Amb9753541 [1,1,0,0,0,0|2,0,0]=4 3248 B7R1.2 NC1=CC(=O)NO1 Amb20103209 [1,1,0,0,0,0|0,0,2]=4 3249 B7R1.2 NC1=CCC(=O)N1 Amb25757914 [1,1,0,0,0,0|1,0,1]=4 3250 B7R1.2 NC1=NCC(=O)N1 Amb21964674 [1,1,0,0,0,0|2,0,0]=4 3251 B7R1.2 NC1=NCC(=O)N1 Amb475286 [1,1,0,0,0,0|2,0,0]=4 3252 B7R1.2 NC1=NNC(=O)C1 Amb6409420 [1,1,0,0,0,0|1,0,1]=4 3253 B7R1.2 NC1C=CC(=O)C1 Amb27445487 [1,1,0,0,0,0|2,0,0]=4 3254 B7R1.2 NC1C=CC(O)C1 Amb27948080 [1,1,0,0,0,0|2,0,0]=4 3255 B7R1.2 NC1CCC(=O)C1 Amb22494268 [1,1,0,0,0,0|2,0,0]=4 3256 B7R1.2 NC1CCC(=O)N1 Amb24480433 [1,1,0,0,0,0|1,0,0]=3 3257 B7R1.2 NC1CCC(=O)O1 Amb17593085 [1,1,0,0,0,0|2,0,0]=4 3258 B7R1.2 NC1CNC(=O)C1 Amb17760661 [1,1,0,0,0,0|1,0,0]=3 3259 B7R1.2 NC1CNC(=O)C1 Amb33544169 [1,1,0,0,0,0|1,0,0]=3 3260 B7R1.2 NC1COC(=O)C1 Amb30594428 [1,1,0,0,0,0|1,0,1]=4 3261 B7R1.2 NC1COC(=O)C1 Amb9782136 [1,1,0,0,0,0|1,0,1]=4 3262 B7R1.2 NC1CSC(=O)N1 Amb27596093 [1,1,0,0,0,0|2,0,0]=4 3263 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22226165 [1,1,0,0,0,0|1,0,0]=3 3264 B7R1.2 N[C@@H]1CNC(=O)C1 Amb22756464 [1,1,0,0,0,0|1,0,0]=3 3265 B7R1.2 N[C@@H]1CNC(=O)C1 Amb33714529 [1,1,0,0,0,0|1,0,0]=3 3266 B7R1.2 N[C@@H]1COC(=O)C1 Amb16233747 [1,1,0,0,0,0|1,0,1]=4 3267 B7R1.2 N[C@@H]1COC(=O)C1 Amb26477774 [1,1,0,0,0,0|1,0,1]=4 3268 B7R1.2 N[C@H]1CCC(=O)N1 Amb27482175 [1,1,0,0,0,0|1,0,0]=3 3269 B7R1.2 N[C@H]1CNC(=O)C1 Amb22225365 [1,1,0,0,0,0|1,0,0]=3 3270 B7R1.2 N[C@H]1CNC(=O)C1 Amb33801336 [1,1,0,0,0,0|1,0,0]=3 3271 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [1,1,0,0,0,0|1,0,1]=4 3272 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [1,1,0,0,0,0|1,0,1]=4 3273 B7R1.2 O=C1C=C(Br)CC1 Amb23399816 [1,1,0,0,0,0|2,0,0]=4 3274 B7R1.2 O=C1C=C(Cl)CC1 Amb9753542 [1,1,0,0,0,0|2,0,0]=4 3275 B7R1.2 O=C1C=C(O)CC1 Amb9901808 [1,1,0,0,0,0|2,0,0]=4 3276 B7R1.2 O=C1C=CC(Br)C1 Amb27809803 [1,1,0,0,0,0|2,0,0]=4 3277 B7R1.2 O=C1C=CC(O)C1 Amb9782767 [1,1,0,0,0,0|2,0,0]=4 3278 B7R1.2 O=C1C=C[C@@H](O)C1 Amb27256512 [1,1,0,0,0,0|2,0,0]=4 3279 B7R1.2 O=C1C=C[C@H](Cl)C1 Amb27984687 [1,1,0,0,0,0|2,0,0]=4 3280 B7R1.2 O=C1C=C[C@H](O)C1 Amb2694980 [1,1,0,0,0,0|2,0,0]=4 3281 B7R1.2 O=C1CC(=O)NN1 Amb9809314 [1,1,0,0,0,0|1,0,1]=4 3282 B7R1.2 O=C1CC(=O)ON1 Amb33714889 [1,1,0,0,0,0|0,0,1]=3 3283 B7R1.2 O=C1CC(F)CO1 Amb24431109 [1,1,0,0,0,0|2,0,0]=4 3284 B7R1.2 O=C1CC(I)CO1 Amb27401189 [1,1,0,0,0,0|2,0,0]=4 3285 B7R1.2 O=C1CC(O)CN1 Amb19958404 [1,1,0,0,0,0|1,0,0]=3 3286 B7R1.2 O=C1CC(O)CO1 Amb4006296 [1,1,0,0,0,0|2,0,0]=4 3287 B7R1.2 O=C1CC(S)CN1 Amb25685875 [1,1,0,0,0,0|1,0,0]=3 3288 B7R1.2 O=C1CCC(=O)C1 Amb2696524 [1,1,0,0,0,0|2,0,0]=4 3289 B7R1.2 O=C1CCC(=O)N1 Amb2793049 [1,1,0,0,0,0|1,0,0]=3 3290 B7R1.2 O=C1CCC(=O)O1 Amb2793017 [1,1,0,0,0,0|2,0,0]=4 3291 B7R1.2 O=C1CCC(=O)S1 Amb2691584 [1,1,0,0,0,0|2,0,0]=4 3292 B7R1.2 O=C1CCC(=S)N1 Amb28122939 [1,1,0,0,0,0|1,0,0]=3 3293 B7R1.2 O=C1CCC(Br)C1 Amb24334292 [1,1,0,0,0,0|2,0,0]=4 3294 B7R1.2 O=C1CCC(Br)N1 Amb27592181 [1,1,0,0,0,0|1,0,0]=3 3295 B7R1.2 O=C1CCC(Br)O1 Amb24556526 [1,1,0,0,0,0|2,0,0]=4 3296 B7R1.2 O=C1CCC(Cl)C1 Amb26585347 [1,1,0,0,0,0|2,0,0]=4 3297 B7R1.2 O=C1CCC(Cl)O1 Amb27477474 [1,1,0,0,0,0|2,0,0]=4 3298 B7R1.2 O=C1CCC(F)C1 Amb21963553 [1,1,0,0,0,0|2,0,0]=4 3299 B7R1.2 O=C1CCC(O)C1 Amb22057378 [1,1,0,0,0,0|2,0,0]=4 3300 B7R1.2 O=C1CCC(O)O1 Amb22740957 [1,1,0,0,0,0|2,0,0]=4 3301 B7R1.2 O=C1CCS(=O)C1 Amb27199097 [1,1,0,0,0,0|1,1,0]=4 3302 B7R1.2 O=C1CC[C@@H](O)C1 Amb27432638 [1,1,0,0,0,0|2,0,0]=4 3303 B7R1.2 O=C1CC[C@@H](O)N1 Amb27458284 [1,1,0,0,0,0|1,0,0]=3 3304 B7R1.2 O=C1CC[C@H](O)C1 Amb27804552 [1,1,0,0,0,0|2,0,0]=4 3305 B7R1.2 O=C1CC[C@H](O)N1 Amb27881572 [1,1,0,0,0,0|1,0,0]=3 3306 B7R1.2 O=C1CN(Cl)CN1 Amb27795741 [1,1,0,0,0,0|2,0,0]=4 3307 B7R1.2 O=C1CN=C(S)N1 Amb22058713 [1,1,0,0,0,0|2,0,0]=4 3308 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [1,1,0,0,0,0|1,0,1]=4 3309 B7R1.2 O=C1CNC(=O)N1 Amb3598086 [1,1,0,0,0,0|2,0,0]=4 3310 B7R1.2 O=C1CNC(=S)N1 Amb1151361 [1,1,0,0,0,0|2,0,0]=4 3311 B7R1.2 O=C1COC(=O)C1 Amb2721303 [1,1,0,0,0,0|1,0,1]=4 3312 B7R1.2 O=C1COC(=O)N1 Amb1625991 [1,1,0,0,0,0|2,0,0]=4 3313 B7R1.2 O=C1CSC(=O)N1 Amb1853667 [1,1,0,0,0,0|2,0,0]=4 3314 B7R1.2 O=C1CSC(=S)N1 Amb1008361 [1,1,0,0,0,0|2,0,0]=4 3315 B7R1.2 O=C1C[C@@H](O)CN1 Amb15691722 [1,1,0,0,0,0|1,0,0]=3 3316 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [1,1,0,0,0,0|2,0,0]=4 3317 B7R1.2 O=C1C[C@@H](S)CN1 Amb22225368 [1,1,0,0,0,0|1,0,0]=3 3318 B7R1.2 O=C1C[C@H](O)CN1 Amb8386060 [1,1,0,0,0,0|1,0,0]=3 3319 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [1,1,0,0,0,0|2,0,0]=4 3320 B7R1.2 O=C1C[C@H](S)CN1 Amb22226251 [1,1,0,0,0,0|1,0,0]=3 3321 B7R1.2 O=C1NC(=S)CO1 Amb28384997 [1,1,0,0,0,0|2,0,0]=4 3322 B7R1.2 O=C1NC(=S)CS1 Amb2469502 [1,1,0,0,0,0|2,0,0]=4 3323 B7R1.2 O=C1NCC(=S)N1 Amb2794498 [1,1,0,0,0,0|2,0,0]=4 3324 B7R1.2 O=C1NOC(=O)N1 Amb22002584 [1,1,0,0,0,0|1,0,1]=4 3325 B7R1.2 S=C1CCC(=S)N1 Amb24479225 [1,1,0,0,0,0|1,1,0]=4 3326 B7R1.2 [NH3+]C1CNC(=O)C1 Amb24112953 [1,1,0,0,0,0|1,0,0]=3 3327 B7R1.14 CC1(N)CCNC1 Amb18121423 [1,1,0,0,0,0|1,0,1]=4 3328 B7R1.14 CC1(N)CCNC1 Amb31307900 [1,1,0,0,0,0|1,0,1]=4 3329 B7R1.14 CC1(N)CCOC1 Amb22058785 [1,1,0,0,0,0|1,0,1]=4 3330 B7R1.14 CC1(N)CCOC1 Amb28955919 [1,1,0,0,0,0|1,0,1]=4 3331 B7R1.14 CC1(O)CNOC1 Amb26046889 [1,1,0,0,0,0|1,0,1]=4 3332 B7R1.14 CC1(O)CNOC1 Amb31156316 [1,1,0,0,0,0|1,0,1]=4 3333 B7R1.14 O=S1(=O)CCCN1 Amb6893202 [1,1,0,0,0,0|2,0,0]=4 3334 B7R1.8 CCC1CCC1=O Amb28137082 [0,1,0,0,1,0|2,0,0]=4 3335 B7R1.8 CCC1OCC1=O Amb23456089 [0,1,0,0,1,0|2,0,0]=4 3336 B7R1.8 CC[C@@H]1NC[C@@H]1N Amb25102070 [0,1,0,0,1,0|1,0,1]=4 3337 B7R1.8 CNC1CNC1C Amb27838267 [0,1,0,0,1,0|1,0,1]=4 3338 B7R1.8 COC1CCC1=O Amb22896543 [0,1,0,0,1,0|2,0,0]=4 3339 B7R1.8 CSC1CCC1=O Amb26054103 [0,1,0,0,1,0|2,0,0]=4 3340 B7R1.8 NCC1CNC1=O Amb25888547 [0,1,0,0,1,0|0,0,0]=2 3341 B7R1.8 O=C1CCC1CBr Amb24633095 [0,1,0,0,1,0|2,0,0]=4 3342 B7R1.8 O=C1CCC1CCl Amb28197139 [0,1,0,0,1,0|2,0,0]=4 3343 B7R1.8 O=C1CCC1CO Amb24722181 [0,1,0,0,1,0|2,0,0]=4 3344 B7R1.8 O=C1NCC1CO Amb28196532 [0,1,0,0,1,0|1,0,0]=3 3345 B7R1.15 C=C1C(=O)NC1C Amb28350835 [0,1,0,0,1,0|1,0,1]=4 3346 B7R1.15 CC1C(=O)CC1O Amb28423178 [0,1,0,0,1,0|2,0,0]=4 3347 B7R1.15 CC1CC(=O)C1C Amb33551302 [0,1,0,0,1,0|2,0,0]=4 3348 B7R1.15 CC1CN(N)C1=O Amb24479155 [0,1,0,0,1,0|1,0,0]=3 3349 B7R1.15 CC1NC(=O)C1C Amb22364651 [0,1,0,0,1,0|1,0,0]=3 3350 B7R1.15 CC1NC(=O)C1N Amb26077932 [0,1,0,0,1,0|0,0,0]=2 3351 B7R1.15 CN1CC(N)C1=O Amb25314708 [0,1,0,0,1,0|0,0,0]=2 3352 B7R1.15 CN1C[C@@H](N)C1=O Amb34137166 [0,1,0,0,1,0|0,0,0]=2 3353 B7R1.15 CN1C[C@H](N)C1=O Amb24746774 [0,1,0,0,1,0|0,0,0]=2 3354 B7R1.15 C[C@@H]1C(=O)C[C@H]1C Amb27865634 [0,1,0,0,1,0|2,0,0]=4 3355 B7R1.15 C[C@@H]1NC(=O)[C@H]1Br Amb28051851 [0,1,0,0,1,0|1,0,0]=3 3356 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22388492 [0,1,0,0,1,0|0,0,0]=2 3357 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22757240 [0,1,0,0,1,0|0,0,0]=2 3358 B7R1.15 C[C@H]1CC(=O)[C@@H]1C Amb27433516 [0,1,0,0,1,0|2,0,0]=4 3359 B7R1.15 C[C@H]1CC(=O)[C@H]1C Amb27788507 [0,1,0,0,1,0|2,0,0]=4 3360 B7R1.15 C[C@H]1OC(=O)[C@H]1N Amb27629736 [0,1,0,0,1,0|0,0,0]=2 3361 B7R1.17 CC1(C)CCC1=O Amb28050382 [0,1,0,0,1,0|2,0,0]=4 3362 B7R1.17 CC1(C)CNC1=O Amb26954140 [0,1,0,0,1,0|1,0,0]=3 3363 B7R1.17 CC1(C)COC1=O Amb17619458 [0,1,0,0,1,0|1,0,0]=3 3364 B7R1.17 CC1(C)NCC1N Amb24507424 [0,1,0,0,1,0|1,0,1]=4 3365 B7R1.17 CC1(C)NCC1N Amb33714649 [0,1,0,0,1,0|1,0,1]=4 3366 B7R1.17 CC1(C)OCC1=O Amb27666218 [0,1,0,0,1,0|2,0,0]=4 3367 B7R1.17 CC1(C)OCC1N Amb26946725 [0,1,0,0,1,0|1,0,1]=4 3368 B7R1.17 CC1(N)COC1=O Amb24626106 [0,1,0,0,1,0|0,0,0]=2 3369 B7R1.17 CC1CNS1(=O)=O Amb35788456 [0,1,0,0,1,0|2,0,0]=4 3370 B7R1.17 CC1NCC1(C)N Amb25095806 [0,1,0,0,1,0|1,0,1]=4 3371 B7R1.17 C[C@]1(N)COC1=O Amb27232689 [0,1,0,0,1,0|0,0,0]=2 3372 B9R1.2 C=C[C@H]1COCC(=O)N1 Amb27237122 [0,1,0,0,0,1|2,0,0]=4 3373 B9R1.2 CCC1CCNC(=O)C1 Amb25791122 [0,1,0,0,0,1|2,0,0]=4 3374 B9R1.2 CCC1COCC(=O)N1 Amb10608051 [0,1,0,0,0,1|2,0,0]=4 3375 B9R1.2 CC[C@@H]1COCC(=O)N1 Amb25146204 [0,1,0,0,0,1|2,0,0]=4 3376 B9R1.2 COC1COCC(=O)N1 Amb28043309 [0,1,0,0,0,1|2,0,0]=4 3377 B9R1.2 N#CC1CCNC(=O)C1 Amb26984825 [0,1,0,0,0,1|1,0,1]=4 3378 B9R1.2 NCC1CCCC(=O)N1 Amb18832610 [0,1,0,0,0,1|2,0,0]=4 3379 B9R1.2 NCC1CCCC(=O)N1 Amb22754591 [0,1,0,0,0,1|2,0,0]=4 3380 B9R1.2 NCC1CCCC(=O)N1 Amb33313533 [0,1,0,0,0,1|2,0,0]=4 3381 B9R1.2 NCC1CCNC(=O)C1 Amb18832611 [0,1,0,0,0,1|1,0,0]=3 3382 B9R1.2 NCC1CCNC(=O)C1 Amb22405878 [0,1,0,0,0,1|1,0,0]=3 3383 B9R1.2 NCC1CCNC(=O)C1 Amb35747931 [0,1,0,0,0,1|1,0,0]=3 3384 B9R1.2 NCC1CNCC(=O)N1 Amb27793712 [0,1,0,0,0,1|2,0,0]=4 3385 B9R1.2 NCC1CSCC(=O)N1 Amb18251299 [0,1,0,0,0,1|1,1,0]=4 3386 B9R1.2 NC[C@H]1CCCC(=O)N1 Amb32687113 [0,1,0,0,0,1|2,0,0]=4 3387 B9R1.2 NC[C@H]1CCCC(=O)N1 Amb32687289 [0,1,0,0,0,1|2,0,0]=4 3388 B9R1.2 O=C1CC(CBr)CCN1 Amb27980511 [0,1,0,0,0,1|2,0,0]=4 3389 B9R1.2 O=C1CC(CO)CCN1 Amb21960758 [0,1,0,0,0,1|2,0,0]=4 3390 B9R1.2 O=C1COCC(CO)N1 Amb22236095 [0,1,0,0,0,1|2,0,0]=4 3391 B9R1.2 O=C1N=C(NO)CCN1 Amb27960301 [0,1,0,0,0,1|1,0,1]=4 3392 B9R1.3 CC1C(=O)NCCC1O Amb27836723 [0,1,0,0,0,1|2,0,0]=4 3393 B9R1.3 CC1CCNC(=O)C1Br Amb27658951 [0,1,0,0,0,1|2,0,0]=4 3394 B9R1.3 CC1CCNC(=O)C1N Amb22229171 [0,1,0,0,0,1|2,0,0]=4 3395 B9R1.3 CN1C(=O)CCCC1N Amb28285249 [0,1,0,0,0,1|2,0,0]=4 3396 B9R1.3 CN1C(=O)NC=CC1N Amb27413099 [0,1,0,0,0,1|1,0,1]=4 3397 B9R1.3 C[C@@H]1C(=O)CCC[C@@H]1N Amb27818101 [0,1,0,0,0,1|2,0,0]=4 3398 B9R1.3 NC1CCCC(=O)C1=O Amb28042602 [0,1,0,0,0,1|2,0,0]=4 3399 B9R1.3 NC1CNNC(=O)C1Cl Amb27437980 [0,1,0,0,0,1|1,0,0]=3 3400 B9R1.3 O=C1NCC[C@@H](O)[C@@H]1O Amb28057700 [0,1,0,0,0,1|2,0,0]=4 3401 B9R1.3 O=C1NCC[C@H](O)[C@@H]1O Amb27202725 [0,1,0,0,0,1|2,0,0]=4 3402 B9R1.3 O=C1NNCC(Br)C1Br Amb26065676 [0,1,0,0,0,1|2,0,0]=4 3403 B9R1.3 O=C1NNCC(Cl)C1Cl Amb27612893 [0,1,0,0,0,1|2,0,0]=4 3404 B9R1.34 CC1CC(=O)NC(=O)C1 Amb17940391 [0,1,0,0,0,1|2,0,0]=4 3405 B9R1.34 CC1CC(=O)NC(=O)N1 Amb2196506 [0,1,0,0,0,1|2,0,0]=4 3406 B9R1.34 CC1CC(=O)NC(=O)S1 Amb27636402 [0,1,0,0,0,1|2,0,0]=4 3407 B9R1.34 CC1CC(=O)NC(C)C1 Amb27760003 [0,1,0,0,0,1|2,0,0]=4 3408 B9R1.34 CC1CC(C)NC(=O)N1 Amb27974674 [0,1,0,0,0,1|2,0,0]=4 3409 B9R1.34 CC1CC(O)CC(=O)N1 Amb27257554 [0,1,0,0,0,1|2,0,0]=4 3410 B9R1.34 CC1CC(O)NC(=O)N1 Amb27768639 [0,1,0,0,0,1|2,0,0]=4 3411 B9R1.34 C[C@@H]1C[C@H](N)CC(=O)N1 Amb28134031 [0,1,0,0,0,1|1,0,0]=3 3412 B9R1.34 C[C@H]1C[C@@H](C)CC(=O)N1 Amb33484017 [0,1,0,0,0,1|2,0,0]=4 3413 B9R1.34 NC1=CC(=O)NC(=O)C1 Amb24560228 [0,1,0,0,0,1|1,0,1]=4 3414 B9R1.34 NC1CC(=O)NC(=O)C1 Amb30869723 [0,1,0,0,0,1|1,0,0]=3 3415 B9R1.34 NC1CC(=O)NC(=O)C1 Amb6261880 [0,1,0,0,0,1|1,0,0]=3 3416 B9R1.34 NC1CC(N)NC(=O)N1 Amb27485934 [0,1,0,0,0,1|1,0,0]=3 3417 B9R1.34 N[C@@H]1CC(=O)C[C@H](N)C1 Amb28326235 [0,1,0,0,0,1|2,0,0]=4 3418 B9R1.34 O=C1CC(I)CC(O)N1 Amb27451041 [0,1,0,0,0,1|2,0,0]=4 3419 B9R1.66 CC1(C)CCNC(=O)C1 Amb24451332 [0,1,0,0,0,1|2,0,0]=4 3420 B9R1.66 CC1(C)COCC(=O)C1 Amb26515851 [0,1,0,0,0,1|2,0,0]=4 3421 B9R1.66 CC1(C)COCC(=O)N1 Amb5787087 [0,1,0,0,0,1|2,0,0]=4 3422 B9R1.66 O=C1CC(F)(F)CCN1 Amb24567328 [0,1,0,0,0,1|2,0,0]=4 3423 B9R1.69 CC1=C[C@@H](N)[C@@H](C)OC1 Amb27188228 [0,1,0,0,0,1|2,0,0]=4 3424 B9R1.69 CC1CC(=O)NCC1O Amb27257393 [0,1,0,0,0,1|2,0,0]=4 3425 B9R1.69 CC1CC(=O)NNC1Cl Amb27796166 [0,1,0,0,0,1|2,0,0]=4 3426 B9R1.69 CC1CCC(=O)CC1N Amb32866958 [0,1,0,0,0,1|2,0,0]=4 3427 B9R1.69 CC1CCN(N)C(=O)N1 Amb25917643 [0,1,0,0,0,1|2,0,0]=4 3428 B9R1.69 CC1CNC(=O)CC1O Amb27816242 [0,1,0,0,0,1|2,0,0]=4 3429 B9R1.69 CC1CNC(=O)NC1N Amb27229171 [0,1,0,0,0,1|1,0,0]=3 3430 B9R1.69 CC1NC(=O)COC1C Amb27440075 [0,1,0,0,0,1|2,0,0]=4 3431 B9R1.69 CC1OCC(=O)C=C1N Amb27799172 [0,1,0,0,0,1|1,0,1]=4 3432 B9R1.69 CN1C=CC(N)NC1=O Amb27639893 [0,1,0,0,0,1|1,0,1]=4 3433 B9R1.69 CN1CCC(N)=NC1=O Amb5501940 [0,1,0,0,0,1|1,0,1]=4 3434 B9R1.69 CN1CCC(N)CC1=O Amb21857737 [0,1,0,0,0,1|1,0,0]=3 3435 B9R1.69 CN1CCC(N)CC1=O Amb28895935 [0,1,0,0,0,1|1,0,0]=3 3436 B9R1.69 CN1CCC(N)CC1=O Amb8010833 [0,1,0,0,0,1|1,0,0]=3 3437 B9R1.69 CN1OCC(=S)NC1=O Amb27194249 [0,1,0,0,0,1|1,0,1]=4 3438 B9R1.69 C[C@@H]1OCC(=O)N[C@@H]1C Amb26870419 [0,1,0,0,0,1|2,0,0]=4 3439 B9R1.69 C[C@@H]1OC[C@@H](C)NC1=O Amb27216673 [0,1,0,0,0,1|2,0,0]=4 3440 B9R1.69 C[C@H]1CC(=O)NC[C@H]1O Amb28365998 [0,1,0,0,0,1|2,0,0]=4 3441 B9R1.69 C[C@H]1CNC(=O)O[C@H]1C Amb27492970 [0,1,0,0,0,1|2,0,0]=4 3442 B9R1.69 C[C@H]1CO[C@@H](C)C(=O)N1 Amb26975581 [0,1,0,0,0,1|2,0,0]=4 3443 B9R1.69 NC1=NC(=O)NCC1Cl Amb27166738 [0,1,0,0,0,1|1,0,1]=4 3444 B9R1.69 NC1NC(=O)NC=C1F Amb9801787 [0,1,0,0,0,1|1,0,1]=4 3445 B9R1.69 O=C1C[C@H](O)[C@H](O)CN1 Amb24517387 [0,1,0,0,0,1|2,0,0]=4 3446 B9R1.15 CCC1CCCNC1=O Amb22276357 [0,1,0,0,0,1|2,0,0]=4 3447 B9R1.15 CCC1CCOCC1=O Amb33295409 [0,1,0,0,0,1|2,0,0]=4 3448 B9R1.15 CCC1COCCC1=O Amb25687037 [0,1,0,0,0,1|2,0,0]=4 3449 B9R1.15 CCC1NCCNC1=O Amb8503280 [0,1,0,0,0,1|2,0,0]=4 3450 B9R1.15 CCC1NCCNC1=O Amb9778903 [0,1,0,0,0,1|2,0,0]=4 3451 B9R1.15 CCC1SCCNC1=O Amb2796294 [0,1,0,0,0,1|2,0,0]=4 3452 B9R1.15 CC[C@@H]1CCCNC1=O Amb28436118 [0,1,0,0,0,1|2,0,0]=4 3453 B9R1.15 CNC1CCCCC1=O Amb28984230 [0,1,0,0,0,1|2,0,0]=4 3454 B9R1.15 CNC1CCCCC1=O Amb3644506 [0,1,0,0,0,1|2,0,0]=4 3455 B9R1.15 CNC1CCCNC1=O Amb28934961 [0,1,0,0,0,1|1,0,0]=3 3456 B9R1.15 COC1CCCNC1=O Amb16231349 [0,1,0,0,0,1|2,0,0]=4 3457 B9R1.15 COC1COCCC1=O Amb20241319 [0,1,0,0,0,1|2,0,0]=4 3458 B9R1.15 CO[C@@H]1COCCC1=O Amb22232585 [0,1,0,0,0,1|2,0,0]=4 3459 B9R1.15 CO[C@H]1COCCC1=O Amb27777522 [0,1,0,0,0,1|2,0,0]=4 3460 B9R1.15 N#CC1CCNCC1=O Amb27966755 [0,1,0,0,0,1|1,0,1]=4 3461 B9R1.15 N#CC1CCOCC1=O Amb18832849 [0,1,0,0,0,1|1,0,1]=4 3462 B9R1.15 N#CC1COCCC1=O Amb18832847 [0,1,0,0,0,1|1,0,1]=4 3463 B9R1.15 NCC1CCCCC1=O Amb18203259 [0,1,0,0,0,1|2,0,0]=4 3464 B9R1.15 NCC1CCCNC1=O Amb19514595 [0,1,0,0,0,1|1,0,0]=3 3465 B9R1.15 NCC1CCCNC1=O Amb23586199 [0,1,0,0,0,1|1,0,0]=3 3466 B9R1.15 NCC1OCCNC1=O Amb32684680 [0,1,0,0,0,1|1,0,0]=3 3467 B9R1.15 N[C@@H]1COCN[C@@H]1CO Amb27231412 [0,1,0,0,0,1|0,0,2]=4 3468 B9R1.15 O=C1CCOCC1CF Amb27623327 [0,1,0,0,0,1|2,0,0]=4 3469 B9R1.15 O=C1NCCCC1CO Amb27814971 [0,1,0,0,0,1|2,0,0]=4 3470 B9R1.15 O=C1NCCCC1CS Amb27473272 [0,1,0,0,0,1|2,0,0]=4 3471 B9R1.15 O=C1NCCNC1CO Amb8010659 [0,1,0,0,0,1|2,0,0]=4 3472 B9R1.15 O=C1NCCN[C@H]1CO Amb27391825 [0,1,0,0,0,1|2,0,0]=4 3473 B9R1.15 O=C1NCCOC1CBr Amb32992407 [0,1,0,0,0,1|2,0,0]=4 3474 B9R1.15 O=C1NCCOC1CCl Amb33329105 [0,1,0,0,0,1|2,0,0]=4 3475 B9R1.15 O=C1NCCOC1CO Amb25235028 [0,1,0,0,0,1|2,0,0]=4 3476 B9R1.40 CC1(C)CCCNC1=O Amb15701290 [0,1,0,0,0,1|2,0,0]=4 3477 B9R1.40 CC1(C)CCOCC1=O Amb28386611 [0,1,0,0,0,1|2,0,0]=4 3478 B9R1.40 CC1(C)COC=CC1=O Amb24360651 [0,1,0,0,0,1|2,0,0]=4 3479 B9R1.40 CC1(C)COCCC1=O Amb18832625 [0,1,0,0,0,1|2,0,0]=4 3480 B9R1.40 CC1(C)NCCNC1=O Amb2721804 [0,1,0,0,0,1|2,0,0]=4 3481 B9R1.40 CC1(C)OCCNC1=O Amb28348411 [0,1,0,0,0,1|2,0,0]=4 3482 B9R1.40 CC1(C)SCCNC1=O Amb22261440 [0,1,0,0,0,1|2,0,0]=4 3483 B9R1.40 CC1(N)CCCNC1=O Amb32410904 [0,1,0,0,0,1|1,0,0]=3 3484 B9R1.40 CC1(O)COC=CC1=O Amb27267146 [0,1,0,0,0,1|2,0,0]=4 3485 B9R1.40 CC1(O)COCCC1=O Amb24737493 [0,1,0,0,0,1|2,0,0]=4 3486 B9R1.40 C[C@@]1(N)CCONC1=O Amb27449489 [0,1,0,0,0,1|0,0,0]=2 3487 B9R1.40 C[C@]1(N)CCCNC1=O Amb28285706 [0,1,0,0,0,1|1,0,0]=3 3488 B9R1.40 O=C1NCCCC1(Br)Br Amb22434360 [0,1,0,0,0,1|2,0,0]=4 3489 B9R1.40 O=C1NCCCC1(F)F Amb22899413 [0,1,0,0,0,1|2,0,0]=4 3490 B9R1.22 CCC1CC(=O)NC1=O Amb24117084 [0,2,0,0,0,0|2,0,0]=4 3491 B9R1.22 COC1CC(=O)NC1=O Amb27491448 [0,2,0,0,0,0|2,0,0]=4 3492 B9R1.22 N#CC1CC(=O)NC1=O Amb27639236 [0,2,0,0,0,0|1,0,1]=4 3493 B9R1.22 NCC1CC(=O)NC1=O Amb22899269 [0,2,0,0,0,0|1,0,0]=3 3494 B9R1.22 NCC1CC(=O)NC1=O Amb6718275 [0,2,0,0,0,0|1,0,0]=3 3495 B9R1.22 NCC1NC(=O)NC1=O Amb18832575 [0,2,0,0,0,0|2,0,0]=4 3496 B9R1.22 NC[C@@H]1NC(=O)NC1=O Amb27180356 [0,2,0,0,0,0|2,0,0]=4 3497 B9R1.22 NC[C@H]1NC(=O)NC1=O Amb28252348 [0,2,0,0,0,0|2,0,0]=4 3498 B9R1.27 CC1=NNC(=O)C1CN Amb10607325 [0,2,0,0,0,0|1,0,1]=4 3499 B9R1.27 CC1=NNC(=O)C1CN Amb22586694 [0,2,0,0,0,0|1,0,1]=4 3500 B9R1.27 CCC1C(=O)COC1C Amb30013811 [0,2,0,0,0,0|2,0,0]=4 3501 B9R1.33 C#CCC1COCC1=O Amb35635975 [0,2,0,0,0,0|2,0,0]=4 3502 B9R1.33 C=CCC1CCNC1=O Amb24384112 [0,2,0,0,0,0|2,0,0]=4 3503 B9R1.33 C=CCC1COCC1=O Amb27235559 [0,2,0,0,0,0|2,0,0]=4 3504 B9R1.33 CCCC1COCC1=O Amb35639022 [0,2,0,0,0,0|2,0,0]=4 3505 B9R1.33 CCC[C@H]1CCNC1=O Amb27624920 [0,2,0,0,0,0|2,0,0]=4 3506 B9R1.33 CCNC1CCNC1=O Amb28249830 [0,2,0,0,0,0|1,0,0]=3 3507 B9R1.33 CCNC1CCNC1=O Amb28960288 [0,2,0,0,0,0|1,0,0]=3 3508 B9R1.33 CCNC1CCSC1=O Amb25706233 [0,2,0,0,0,0|2,0,0]=4 3509 B9R1.33 CCN[C@H]1CCOC1=O Amb28249000 [0,2,0,0,0,0|2,0,0]=4 3510 B9R1.33 CCSC1CCNC1=O Amb27837709 [0,2,0,0,0,0|2,0,0]=4 3511 B9R1.33 CNCC1CCCC1=O Amb27202013 [0,2,0,0,0,0|2,0,0]=4 3512 B9R1.33 COCC1COCC1=O Amb35639023 [0,2,0,0,0,0|2,0,0]=4 3513 B9R1.33 CONC1CCOC1=O Amb28128618 [0,2,0,0,0,0|2,0,0]=4 3514 B9R1.33 N#CNC1CCNC1=O Amb30010442 [0,2,0,0,0,0|1,0,0]=3 3515 B9R1.33 N#CN[C@H]1CCNC1=O Amb29891767 [0,2,0,0,0,0|1,0,0]=3 3516 B9R1.33 NCCC1CCCC1=O Amb18832679 [0,2,0,0,0,0|2,0,0]=4 3517 B9R1.33 NCCC1CCNC1=O Amb18832608 [0,2,0,0,0,0|1,0,0]=3 3518 B9R1.33 NCCN1CCNC1=O Amb2691301 [0,2,0,0,0,0|2,0,0]=4 3519 B9R1.33 O=C1NCCC1CCBr Amb27956490 [0,2,0,0,0,0|2,0,0]=4 3520 B9R1.33 O=C1NCCC1CCCl Amb25946315 [0,2,0,0,0,0|2,0,0]=4 3521 B9R1.33 O=C1NCCC1CCO Amb33531266 [0,2,0,0,0,0|2,0,0]=4 3522 B9R1.33 O=C1NCCC1N=C=S Amb35700804 [0,2,0,0,0,0|1,0,1]=4 3523 B9R1.33 O=C1NCC[C@@H]1CCO Amb27593854 [0,2,0,0,0,0|2,0,0]=4 3524 B9R1.33 O=CNC1CCOC1=O Amb27391272 [0,2,0,0,0,0|2,0,0]=4 3525 B9R1.33 O=CN[C@@H]1CONC1=O Amb27784848 [0,2,0,0,0,0|0,0,0]=2 3526 B9R1.33 O=CN[C@H]1CCNC1=O Amb27236896 [0,2,0,0,0,0|1,0,0]=3 3527 B9R1.33 O=CN[C@H]1CCOC1=O Amb35688702 [0,2,0,0,0,0|2,0,0]=4 3528 B9R1.33 [N-]=[N+]=NC1CCNC1=O Amb27793016 [0,2,0,0,0,0|1,0,1]=4 3529 B9R1.41 CC(=O)C1CCNC1=O Amb9782651 [0,2,0,0,0,0|2,0,0]=4 3530 B9R1.41 CC(=O)C1COCC1N Amb25918760 [0,2,0,0,0,0|1,0,1]=4 3531 B9R1.41 CC(C)C1CCNC1=O Amb27179731 [0,2,0,0,0,0|2,0,0]=4 3532 B9R1.41 CC(C)C1COCC1=O Amb23590155 [0,2,0,0,0,0|2,0,0]=4 3533 B9R1.41 CC(N)C1CCOC1=O Amb28240358 [0,2,0,0,0,0|2,0,0]=4 3534 B9R1.41 CN(C)C1CCCC1=O Amb33527404 [0,2,0,0,0,0|2,0,0]=4 3535 B9R1.41 CN(C)C1CCCC1=O Amb9661087 [0,2,0,0,0,0|2,0,0]=4 3536 B9R1.41 CN(C)C1CCNC1=O Amb33456306 [0,2,0,0,0,0|1,0,0]=3 3537 B9R1.41 CN(C)C1CCOC1=O Amb27837705 [0,2,0,0,0,0|2,0,0]=4 3538 B9R1.41 N=C(N)C1=NONC1=O Amb27166723 [0,2,0,0,0,0|1,0,1]=4 3539 B9R1.41 NC(=O)C1CCCC1=O Amb16233729 [0,2,0,0,0,0|2,0,0]=4 3540 B9R1.41 NC(=S)N1CCNC1=O Amb24394363 [0,2,0,0,0,0|2,0,0]=4 3541 B9R1.41 NC1CCNC1C(=O)O Amb27153692 [0,2,0,0,0,0|1,0,1]=4 3542 B9R1.41 NC1COCC1C(=O)O Amb24709230 [0,2,0,0,0,0|1,0,1]=4 3543 B9R1.41 NS(=O)C1CCOC1=O Amb32720450 [0,2,0,0,0,0|2,0,0]=4 3544 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb19929517 [0,2,0,0,0,0|1,0,1]=4 3545 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O Amb31028940 [0,2,0,0,0,0|1,0,1]=4 3546 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb24078777 [0,2,0,0,0,0|1,0,1]=4 3547 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O Amb33330248 [0,2,0,0,0,0|1,0,1]=4 3548 B9R1.41 N[C@H]1CCN[C@@H]1C(=O)O Amb27460833 [0,2,0,0,0,0|1,0,1]=4 3549 B9R1.41 N[C@H]1CCN[C@H]1C(=O)O Amb26904835 [0,2,0,0,0,0|1,0,1]=4 3550 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O Amb24605467 [0,2,0,0,0,0|1,0,1]=4 3551 B9R1.41 O=C(O)C1CCNC1=O Amb18642691 [0,2,0,0,0,0|2,0,0]=4 3552 B9R1.132 CC1C(=O)NNC1CO Amb35692243 [0,2,0,0,0,0|2,0,0]=4 3553 B9R1.132 CCC1COC(=O)C1N Amb28285145 [0,2,0,0,0,0|2,0,0]=4 3554 B9R1.132 CCC1NNC(=O)C1C Amb35686093 [0,2,0,0,0,0|2,0,0]=4 3555 B9R1.132 CCN1CCC(Br)C1=O Amb22749189 [0,2,0,0,0,0|2,0,0]=4 3556 B9R1.132 CCN1CCC(N)C1=O Amb18945418 [0,2,0,0,0,0|1,0,0]=3 3557 B9R1.132 CCN1CCC(N)C1=O Amb32655994 [0,2,0,0,0,0|1,0,0]=3 3558 B9R1.132 CCN1CCN(N)C1=O Amb27237090 [0,2,0,0,0,0|2,0,0]=4 3559 B9R1.132 CCN1OCC(Br)C1=O Amb25032274 [0,2,0,0,0,0|1,0,0]=3 3560 B9R1.132 CCN1OCC(N)C1=O Amb25887354 [0,2,0,0,0,0|0,0,0]=2 3561 B9R1.132 CCN1OCC(N)C1=O Amb33309535 [0,2,0,0,0,0|0,0,0]=2 3562 B9R1.132 CCN1OCC(O)C1=O Amb35789273 [0,2,0,0,0,0|1,0,0]=3 3563 B9R1.132 CCN1OC[C@@H](N)C1=O Amb33719167 [0,2,0,0,0,0|0,0,0]=2 3564 B9R1.132 CC[C@@H]1COC(=O)[C@H]1N Amb28345688 [0,2,0,0,0,0|2,0,0]=4 3565 B9R1.132 CN1CCC(CBr)C1=O Amb28318638 [0,2,0,0,0,0|2,0,0]=4 3566 B9R1.132 CN1CCC(CI)C1=O Amb35723927 [0,2,0,0,0,0|2,0,0]=4 3567 B9R1.132 CN1CCC(CN)C1=O Amb30982588 [0,2,0,0,0,0|1,0,0]=3 3568 B9R1.132 CN1CCC(CN)C1=O Amb33550142 [0,2,0,0,0,0|1,0,0]=3 3569 B9R1.132 CN1CCC(CO)C1=O Amb22236004 [0,2,0,0,0,0|2,0,0]=4 3570 B9R1.132 CN1CCC(CS)C1=O Amb35686181 [0,2,0,0,0,0|2,0,0]=4 3571 B9R1.132 CN1CC\C(=N/N)C1=O Amb27835244 [0,2,0,0,0,0|1,0,1]=4 3572 B9R1.132 CNC1CCN(C)C1=O Amb18945539 [0,2,0,0,0,0|1,0,0]=3 3573 B9R1.132 CNC1CCN(C)C1=O Amb33550373 [0,2,0,0,0,0|1,0,0]=3 3574 B9R1.132 CON1CCC(Br)C1=O Amb22749188 [0,2,0,0,0,0|2,0,0]=4 3575 B9R1.132 CON1CCN(N)C1=O Amb32668183 [0,2,0,0,0,0|2,0,0]=4 3576 B9R1.132 CON1CCN(N)C1=O Amb32668506 [0,2,0,0,0,0|2,0,0]=4 3577 B9R1.132 C[C@H]1C(=O)NC[C@@H]1CO Amb27805447 [0,2,0,0,0,0|2,0,0]=4 3578 B9R1.132 N#CC1COC(=O)C1=O Amb27838693 [0,2,0,0,0,0|1,0,1]=4 3579 B9R1.132 NC1C(=O)NCC1CF Amb27663222 [0,2,0,0,0,0|1,0,0]=3 3580 B9R1.132 NC1C(=O)NCC1CO Amb28125787 [0,2,0,0,0,0|1,0,0]=3 3581 B9R1.132 NC1C(=O)OCC1CO Amb27804109 [0,2,0,0,0,0|2,0,0]=4 3582 B9R1.132 NC1C(=O)OCC1CS Amb27637863 [0,2,0,0,0,0|2,0,0]=4 3583 B9R1.202 C#CC1(O)CCNC1=O Amb28071648 [0,2,0,0,0,0|2,0,0]=4 3584 B9R1.202 CC1(CBr)CCNC1=O Amb35601686 [0,2,0,0,0,0|2,0,0]=4 3585 B9R1.202 CC1(CI)CCNC1=O Amb35601688 [0,2,0,0,0,0|2,0,0]=4 3586 B9R1.202 CC1(CN)CCNC1=O Amb24105417 [0,2,0,0,0,0|1,0,0]=3 3587 B9R1.202 CC1(CO)CCNC1=O Amb27242492 [0,2,0,0,0,0|2,0,0]=4 3588 B9R1.202 CCC1(C)CCNC1=O Amb24118004 [0,2,0,0,0,0|2,0,0]=4 3589 B9R1.202 CCC1(N)CCCC1=O Amb27866573 [0,2,0,0,0,0|2,0,0]=4 3590 B9R1.202 NC1(CO)CCNC1=O Amb27658842 [0,2,0,0,0,0|1,0,0]=3 3591 B9R1.23 CC1CC(CO)NC1=O Amb2695752 [0,2,0,0,0,0|2,0,0]=4 3592 B9R1.23 CCC1CC(C)C(=O)N1 Amb20623299 [0,2,0,0,0,0|2,0,0]=4 3593 B9R1.23 CCC1CC(N)C(=O)O1 Amb27647519 [0,2,0,0,0,0|2,0,0]=4 3594 B9R1.23 C[C@H]1C[C@H](CO)NC1=O Amb27422040 [0,2,0,0,0,0|2,0,0]=4 3595 B9R1.23 NC1CC(CO)OC1=O Amb18642829 [0,2,0,0,0,0|2,0,0]=4 3596 B9R1.23 NC[C@@H]1C[C@H](N)C(=O)O1 Amb27851651 [0,2,0,0,0,0|2,0,0]=4 3597 B9R1.23 N[C@H]1C[C@@H](CO)OC1=O Amb28059280 [0,2,0,0,0,0|2,0,0]=4 3598 B9R1.23 N[C@H]1C[C@H](CBr)OC1=O Amb27233512 [0,2,0,0,0,0|2,0,0]=4 3599 B9R1.23 O=C1NC(CO)CC1F Amb27394226 [0,2,0,0,0,0|2,0,0]=4 3600 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb18124322 [0,2,0,0,0,0|2,0,0]=4 3601 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb32674857 [0,2,0,0,0,0|2,0,0]=4 3602 B9R1.36 CC1(C)C[C@@H](N)C(=O)O1 Amb28196700 [0,2,0,0,0,0|2,0,0]=4 3603 B9R1.36 CC1(C)C[C@H](N)C(=O)O1 Amb24476611 [0,2,0,0,0,0|2,0,0]=4 3604 B9R1.36 CC1CC(C)(C)NC1=O Amb19149267 [0,2,0,0,0,0|2,0,0]=4 3605 B9R1.36 CC1CS(=O)(=O)NC1=O Amb32686578 [0,2,0,0,0,0|1,1,0]=4 3606 B9R1.36 C[C@H]1CC(C)(C)NC1=O Amb35825454 [0,2,0,0,0,0|2,0,0]=4 3607 B9R1.36 NC1CS(=O)(=O)NC1=O Amb25223128 [0,2,0,0,0,0|0,1,0]=3 3608 B9R1.36 NC1CS(=O)(=O)NC1=O Amb32667177 [0,2,0,0,0,0|0,1,0]=3 3609 B9R1.37 C=C1NC(=O)C(C)C1C Amb27236263 [0,2,0,0,0,0|2,0,0]=4 3610 B9R1.37 C=C1NC(=O)[C@@H](C)[C@@H]1C Amb27217263 [0,2,0,0,0,0|2,0,0]=4 3611 B9R1.37 C=C1NC(=O)[C@@H](C)[C@H]1C Amb27758891 [0,2,0,0,0,0|2,0,0]=4 3612 B9R1.37 C=C1NC(=O)[C@H](C)[C@@H]1C Amb24608855 [0,2,0,0,0,0|2,0,0]=4 3613 B9R1.37 C=C1NC(=O)[C@H](C)[C@H]1C Amb25064615 [0,2,0,0,0,0|2,0,0]=4 3614 B9R1.37 CC1C(=O)NC(=O)C1C Amb19148076 [0,2,0,0,0,0|2,0,0]=4 3615 B9R1.37 CC1C(=O)OC(=O)[C@H]1N Amb27664717 [0,2,0,0,0,0|2,0,0]=4 3616 B9R1.37 CC1CN(C)C(=O)C1Cl Amb27872230 [0,2,0,0,0,0|2,0,0]=4 3617 B9R1.37 CC1CN(N)C(=O)N1C Amb28255433 [0,2,0,0,0,0|2,0,0]=4 3618 B9R1.37 CC1CN(O)C(=O)C1N Amb25888759 [0,2,0,0,0,0|1,0,0]=3 3619 B9R1.37 CC1NC(=O)C(C)C1C Amb25888744 [0,2,0,0,0,0|2,0,0]=4 3620 B9R1.37 CC1OC(=O)C(=O)C1C Amb24360322 [0,2,0,0,0,0|2,0,0]=4 3621 B9R1.37 CC1OC(=O)C(N)C1C Amb27424680 [0,2,0,0,0,0|2,0,0]=4 3622 B9R1.37 CN1C(=O)CC(N)C1=O Amb33550083 [0,2,0,0,0,0|1,0,0]=3 3623 B9R1.37 CN1C(=O)CC(N)C1=O Amb9500648 [0,2,0,0,0,0|1,0,0]=3 3624 B9R1.37 CN1C(=O)CC(O)C1=O Amb22388645 [0,2,0,0,0,0|2,0,0]=4 3625 B9R1.37 CN1C(=O)CN(N)C1=O Amb27436200 [0,2,0,0,0,0|2,0,0]=4 3626 B9R1.37 CN1C(=O)CN(N)C1=O Amb32708527 [0,2,0,0,0,0|2,0,0]=4 3627 B9R1.37 CN1C(=O)C[C@@H](N)C1=O Amb18033836 [0,2,0,0,0,0|1,0,0]=3 3628 B9R1.37 CN1C(=O)C[C@@H](O)C1=O Amb4451252 [0,2,0,0,0,0|2,0,0]=4 3629 B9R1.37 CN1C(=O)C[C@H](N)C1=O Amb17134613 [0,2,0,0,0,0|1,0,0]=3 3630 B9R1.37 CN1C(=O)C[C@H](O)C1=O Amb3939670 [0,2,0,0,0,0|2,0,0]=4 3631 B9R1.37 CN1NC(=O)C(N)C1=O Amb28139683 [0,2,0,0,0,0|1,0,1]=4 3632 B9R1.37 C[C@@H]1C(=O)NC(=O)[C@@H]1C Amb27876548 [0,2,0,0,0,0|2,0,0]=4 3633 B9R1.37 C[C@@H]1CN(O)C(=O)[C@@H]1N Amb30588539 [0,2,0,0,0,0|1,0,0]=3 3634 B9R1.37 C[C@@H]1CN(O)C(=O)[C@@H]1N Amb30640026 [0,2,0,0,0,0|1,0,0]=3 3635 B9R1.37 C[C@@H]1C[C@@H](C)N(C)C1=O Amb25174058 [0,2,0,0,0,0|2,0,0]=4 3636 B9R1.37 C[C@@H]1NC(=O)[C@H](C)[C@H]1C Amb28429823 [0,2,0,0,0,0|2,0,0]=4 3637 B9R1.37 C[C@@H]1OC(=O)[C@@H](N)[C@@H]1C Amb27203003 [0,2,0,0,0,0|2,0,0]=4 3638 B9R1.37 C[C@@H]1OC(=O)[C@@H](N)[C@H]1C Amb25946352 [0,2,0,0,0,0|2,0,0]=4 3639 B9R1.37 C[C@@H]1OC(=O)[C@H](N)[C@@H]1C Amb27961355 [0,2,0,0,0,0|2,0,0]=4 3640 B9R1.37 C[C@H]1CC(=O)N(C)C1=O Amb25933614 [0,2,0,0,0,0|2,0,0]=4 3641 B9R1.37 C[C@H]1CN(C)C(=O)[C@@H]1Cl Amb28051787 [0,2,0,0,0,0|2,0,0]=4 3642 B9R1.37 C[C@H]1CN(O)C(=O)[C@@H]1N Amb24587752 [0,2,0,0,0,0|1,0,0]=3 3643 B9R1.37 C[C@H]1CN(O)C(=O)[C@H]1N Amb27215974 [0,2,0,0,0,0|1,0,0]=3 3644 B9R1.37 C[C@H]1C[C@@H](C)C(=O)N1C Amb25347216 [0,2,0,0,0,0|2,0,0]=4 3645 B9R1.37 C[C@H]1C[C@@H](C)N(C)C1=O Amb27767999 [0,2,0,0,0,0|2,0,0]=4 3646 B9R1.37 C[C@H]1NC(=O)[C@H](C)[C@H]1C Amb28058295 [0,2,0,0,0,0|2,0,0]=4 3647 B9R1.37 C[C@H]1OC(=O)[C@H](N)[C@H]1C Amb27421606 [0,2,0,0,0,0|2,0,0]=4 3648 B9R1.37 C[C@H]1[C@H](N)C(=O)O[C@@H]1C Amb26415247 [0,2,0,0,0,0|2,0,0]=4 3649 B9R1.37 NC1C(=O)N(O)CC1O Amb27956515 [0,2,0,0,0,0|1,0,0]=3 3650 B9R1.37 NC1CC(=O)N(N)C1=O Amb28119967 [0,2,0,0,0,0|1,0,0]=3 3651 B9R1.37 N[C@H]1C(=O)N(O)C[C@@H]1O Amb27480613 [0,2,0,0,0,0|1,0,0]=3 3652 B9R1.37 N[C@H]1C(=O)N(O)C[C@H]1O Amb27218653 [0,2,0,0,0,0|1,0,0]=3 3653 B9R1.37 N[C@H]1CC(=O)N(O)C1=O Amb28249834 [0,2,0,0,0,0|1,0,0]=3 3654 B9R1.37 O=C1NC(=O)C(O)C1O Amb27845569 [0,2,0,0,0,0|2,0,0]=4 3655 B9R1.38 CC1(Br)CC(=O)NC1=O Amb25095370 [0,2,0,0,0,0|2,0,0]=4 3656 B9R1.38 CC1(C)CC(=O)NC1=O Amb8845622 [0,2,0,0,0,0|2,0,0]=4 3657 B9R1.38 CC1(C)CC(=S)NC1=O Amb27209597 [0,2,0,0,0,0|2,0,0]=4 3658 B9R1.38 CC1(N)CC(=O)NC1=O Amb28314090 [0,2,0,0,0,0|1,0,0]=3 3659 B9R1.38 CC1CC(C)(C)C(=O)N1 Amb4034923 [0,2,0,0,0,0|2,0,0]=4 3660 B9R1.38 CN1CC(C)(C)C(=O)N1 Amb25887410 [0,2,0,0,0,0|2,0,0]=4 3661 B9R1.38 C[C@@H]1C[C@](C)(N)C(=O)O1 Amb28057766 [0,2,0,0,0,0|2,0,0]=4 3662 B9R1.38 C[C@H]1C[C@](C)(N)C(=O)O1 Amb27639486 [0,2,0,0,0,0|2,0,0]=4 3663 B9R1.106 CC1(C)C(=O)NCC1N Amb23439606 [0,2,0,0,0,0|2,0,0]=4 3664 B9R1.106 CC1(C)C(=O)NC[C@@H]1N Amb23439617 [0,2,0,0,0,0|2,0,0]=4 3665 B9R1.106 CC1(C)C(=O)NC[C@H]1N Amb26891098 [0,2,0,0,0,0|2,0,0]=4 3666 B9R1.106 CC1(O)C(=O)NCC1O Amb27247145 [0,2,0,0,0,0|2,0,0]=4 3667 B9R1.106 CC1CNC(=O)C1(C)N Amb32655252 [0,2,0,0,0,0|1,0,0]=3 3668 B9R1.106 C[C@@H]1CNC(=O)[C@]1(C)O Amb27202702 [0,2,0,0,0,0|2,0,0]=4 3669 B9R1.106 C[C@H]1CNC(=O)[C@@]1(C)O Amb28411281 [0,2,0,0,0,0|2,0,0]=4 3670 B9R1.138 CC1(Br)COC(=O)C1=O Amb17595052 [0,2,0,0,0,0|2,0,0]=4 3671 B9R1.138 CC1(C)CNC(=O)C1N Amb25224596 [0,2,0,0,0,0|1,0,0]=3 3672 B9R1.138 CC1(C)CNC(=O)C1O Amb16203297 [0,2,0,0,0,0|2,0,0]=4 3673 B9R1.138 CC1(C)COC(=O)C1=O Amb3941520 [0,2,0,0,0,0|2,0,0]=4 3674 B9R1.138 CC1(C)COC(=O)C1N Amb18642696 [0,2,0,0,0,0|2,0,0]=4 3675 B9R1.138 CC1(C)COC(=O)C1N Amb28935018 [0,2,0,0,0,0|2,0,0]=4 3676 B9R1.138 CC1(C)COC(=O)[C@@H]1N Amb25083661 [0,2,0,0,0,0|2,0,0]=4 3677 B9R1.138 CC1(C)COC(=O)[C@@H]1N Amb33338971 [0,2,0,0,0,0|2,0,0]=4 3678 B9R1.138 CC1(C)COC(=O)[C@H]1N Amb24589212 [0,2,0,0,0,0|2,0,0]=4 3679 B9R1.138 CC1(C)COC(=O)[C@H]1N Amb33330894 [0,2,0,0,0,0|2,0,0]=4 3680 B9R1.138 CC1(C)COC(Br)C1=O Amb27483939 [0,2,0,0,0,0|2,0,0]=4 3681 B9R1.138 CC1(C)CSC(=O)C1N Amb28250198 [0,2,0,0,0,0|2,0,0]=4 3682 B9R1.138 CC1(C)CSC(=O)C1N Amb34930436 [0,2,0,0,0,0|2,0,0]=4 3683 B9R1.138 CC1(C)NNC(=O)C1[K] Amb5719769 [0,2,0,0,0,0|2,0,0]=4 3684 B9R1.138 CC1(C)NOC(=O)[C@H]1N Amb25032224 [0,2,0,0,0,0|2,0,0]=4 3685 B9R1.138 CC1(C)OCC(O)C1=O Amb27468092 [0,2,0,0,0,0|2,0,0]=4 3686 B9R1.138 CC1(O)OC[C@H](O)C1=O Amb27180421 [0,2,0,0,0,0|2,0,0]=4 3687 B9R1.138 CC1C(=O)NNC1(C)C Amb35693845 [0,2,0,0,0,0|2,0,0]=4 3688 B9R1.138 CN1SCC(C)(C)C1=O Amb27237663 [0,2,0,0,0,0|1,1,0]=4 3689 B9R1.138 C[C@@]1(O)OC[C@H](O)C1=O Amb28202135 [0,2,0,0,0,0|2,0,0]=4 3690 B9R1.138 C[C@]1(O)OC[C@H](O)C1=O Amb27262924 [0,2,0,0,0,0|2,0,0]=4 3691 B7R1.3 O=C1CCCCN1 Amb6892006 [0,0,1,1,0,0|2,0,0]=4 3692 B7R1.3 O=C1CCCNC1 Amb10070944 [0,0,1,1,0,0|2,0,0]=4 3693 B7R1.3 O=C1CCCNC1 Amb10602349 [0,0,1,1,0,0|2,0,0]=4 3694 B7R1.3 O=C1CCCNC1 Amb19958010 [0,0,1,1,0,0|2,0,0]=4 3695 B7R1.3 O=C1CCCNN1 Amb18061622 [0,0,1,1,0,0|2,0,0]=4 3696 B7R1.3 O=C1CCCOC1 Amb19373430 [0,0,1,1,0,0|2,0,0]=4 3697 B7R1.3 O=C1CCCON1 Amb26560803 [0,0,1,1,0,0|1,0,0]=3 3698 B7R1.3 O=C1CNC=NN1 Amb27817820 [0,0,1,1,0,0|1,0,1]=4 3699 B7R1.3 O=C1CNCCN1 Amb4138465 [0,0,1,1,0,0|1,0,0]=3 3700 B7R1.3 O=C1CNCCN1 Amb6334808 [0,0,1,1,0,0|1,0,0]=3 3701 B7R1.3 O=C1CNCCO1 Amb19958702 [0,0,1,1,0,0|2,0,0]=4 3702 B7R1.3 O=C1CNCCO1 Amb32410210 [0,0,1,1,0,0|2,0,0]=4 3703 B7R1.3 O=C1COCCN1 Amb15691115 [0,0,1,1,0,0|2,0,0]=4 3704 B7R1.3 O=C1CSCCN1 Amb674722 [0,0,1,1,0,0|2,0,0]=4 3705 B7R1.3 O=C1NCCNN1 Amb28341733 [0,0,1,1,0,0|2,0,0]=4 3706 B7R1.6 CON=C1CNC1 Amb27883046 [0,0,1,1,0,0|1,0,1]=4 3707 B7R1.6 CON=C1CNC1 Amb35747824 [0,0,1,1,0,0|1,0,1]=4 3708 B7R1.9 COC1CC1C=O Amb35720824 [0,0,1,1,0,0|2,0,0]=4 3709 B7R1.22 NCC(=O)C1CC1 Amb18197870 [0,0,1,1,0,0|2,0,0]=4 3710 B7R1.22 NCC(=O)C1CC1 Amb33528322 [0,0,1,1,0,0|2,0,0]=4 3711 B7R1.22 O=C(CCl)N1CC1 Amb19651585 [0,0,1,1,0,0|2,0,0]=4 3712 B7R1.25 CC1(C=O)COC1 Amb17933843 [0,0,1,1,0,0|2,0,0]=4 3713 B7R1.12 CC1CC1C(N)=O Amb8858378 [0,0,1,1,0,0|2,0,0]=4 3714 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [0,0,1,1,0,0|2,0,0]=4 3715 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [0,0,1,1,0,0|2,0,0]=4 3716 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [0,0,1,1,0,0|2,0,0]=4 3717 B7R1.12 NC(=O)C1CC1Br Amb27838278 [0,0,1,1,0,0|2,0,0]=4 3718 B7R1.12 NC(=O)C1CC1F Amb26026786 [0,0,1,1,0,0|2,0,0]=4 3719 B7R1.12 NC(=O)C1CC1N Amb18279694 [0,0,1,1,0,0|2,0,0]=4 3720 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F Amb27758752 [0,0,1,1,0,0|2,0,0]=4 3721 B7R1.12 NC(=O)[C@@H]1C[C@H]1F Amb27403700 [0,0,1,1,0,0|2,0,0]=4 3722 B7R1.18 CC(=O)C1CCN1 Amb28142364 [0,0,1,1,0,0|2,0,0]=4 3723 B7R1.18 CC(=O)C1COC1 Amb27397483 [0,0,1,1,0,0|2,0,0]=4 3724 B7R1.18 N=C(N)C1CCN1 Amb28410949 [0,0,1,1,0,0|2,0,0]=4 3725 B7R1.18 N=C(N)[C@@H]1CCN1 Amb27790002 [0,0,1,1,0,0|2,0,0]=4 3726 B7R1.18 NC(=O)C1CCC1 Amb33552668 [0,0,1,1,0,0|2,0,0]=4 3727 B7R1.18 NC(=O)C1CCN1 Amb22230240 [0,0,1,1,0,0|1,0,0]=3 3728 B7R1.18 NC(=O)C1CCN1 Amb22491865 [0,0,1,1,0,0|1,0,0]=3 3729 B7R1.18 NC(=O)C1CNC1 Amb10976072 [0,0,1,1,0,0|2,0,0]=4 3730 B7R1.18 NC(=O)C1CNC1 Amb20061301 [0,0,1,1,0,0|2,0,0]=4 3731 B7R1.18 NC(=O)C1CNC1 Amb21960249 [0,0,1,1,0,0|2,0,0]=4 3732 B7R1.18 NC(=O)C1CSC1 Amb27209831 [0,0,1,1,0,0|1,1,0]=4 3733 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [0,0,1,1,0,0|1,0,0]=3 3734 B7R1.18 NS(=O)C1COC1 Amb32720384 [0,0,1,1,0,0|2,0,0]=4 3735 B7R1.18 O=C(O)C1CCN1 Amb2371568 [0,0,1,1,0,0|2,0,0]=4 3736 B7R1.18 O=C(O)C1CCN1 Amb8391098 [0,0,1,1,0,0|2,0,0]=4 3737 B7R1.18 O=C(O)C1COC1 Amb33542663 [0,0,1,1,0,0|2,0,0]=4 3738 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [0,0,1,1,0,0|2,0,0]=4 3739 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [0,0,1,1,0,0|2,0,0]=4 3740 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [0,0,1,1,0,0|2,0,0]=4 3741 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [0,0,1,1,0,0|2,0,0]=4 3742 B7R1.19 CC(=O)C1(C)CO1 Amb9677568 [0,0,1,1,0,0|2,0,0]=4 3743 B7R1.19 CC(=O)C1(N)CC1 Amb25279285 [0,0,1,1,0,0|2,0,0]=4 3744 B7R1.19 CC(=O)C1(N)CC1 Amb28827658 [0,0,1,1,0,0|2,0,0]=4 3745 B7R1.19 CC(=O)[C@@]1(C)CO1 Amb28050546 [0,0,1,1,0,0|2,0,0]=4 3746 B7R1.19 CC1(C(=O)O)CO1 Amb33542864 [0,0,1,1,0,0|2,0,0]=4 3747 B7R1.19 CC1(C(N)=O)CC1 Amb19958822 [0,0,1,1,0,0|2,0,0]=4 3748 B7R1.19 N=C(N)C1(N)CC1 Amb35595082 [0,0,1,1,0,0|2,0,0]=4 3749 B7R1.19 NC(=O)C1(Br)CC1 Amb22234538 [0,0,1,1,0,0|2,0,0]=4 3750 B7R1.19 NC(=O)C1(Cl)CC1 Amb28187965 [0,0,1,1,0,0|2,0,0]=4 3751 B7R1.19 NC(=O)C1(F)CC1 Amb27851813 [0,0,1,1,0,0|2,0,0]=4 3752 B7R1.19 NC(=O)C1(N)CC1 Amb22001522 [0,0,1,1,0,0|1,0,0]=3 3753 B7R1.19 NC(=O)C1(N)CC1 Amb33544868 [0,0,1,1,0,0|1,0,0]=3 3754 B7R1.19 NC(=O)C1(O)CC1 Amb25745829 [0,0,1,1,0,0|2,0,0]=4 3755 B7R1.19 NC1(C(=O)O)CC1 Amb4296883 [0,0,1,1,0,0|2,0,0]=4 3756 B7R1.19 NC1(C(=O)O)CC1 Amb6223185 [0,0,1,1,0,0|2,0,0]=4 3757 B7R1.7 O=CNCC1CC1 Amb28322746 [0,0,1,1,0,0|2,0,0]=4 3758 B7R2.13 C1OCC2NC12 Amb22500569 [1,0,0,1,0,0|1,0,1]=4 3759 B7R2.13 C1OC[C@@H]2N[C@H]12 Amb32663628 [1,0,0,1,0,0|1,0,1]=4 3760 B9R2.21 O=C1CC2CC2CN1 Amb33716335 [0,0,0,1,0,1|2,0,0]=4 3761 B9R2.25 NC1=NC(=O)N2CC12 Amb22352757 [0,0,0,1,0,1|1,0,1]=4 3762 B9R2.39 O=C1CC2CCC1N2 Amb26502233 [0,0,0,1,0,1|2,0,0]=4 3763 B9R2.39 O=C1CC2COC1C2 Amb24734169 [0,0,0,1,0,1|2,0,0]=4 3764 B9R2.39 O=C1C[C@H]2CC[C@@H]1N2 Amb27421729 [0,0,0,1,0,1|2,0,0]=4 3765 B9R2.109 O=C1NCC[C@@H]2O[C@H]12 Amb27446837 [0,0,0,1,0,1|2,0,0]=4 3766 B9R2.109 O=C1NNCC2CC12 Amb27797433 [0,0,0,1,0,1|2,0,0]=4 3767 B9R2.17 N[C@]12C[C@H]1COC2=O Amb27420696 [0,0,0,1,0,1|2,0,0]=4 3768 B9R2.19 O=C1NCC2CC1C2 Amb25221783 [0,0,0,1,0,1|2,0,0]=4 3769 B9R2.19 O=C1NCC2CC1N2 Amb27801865 [0,0,0,1,0,1|1,0,0]=3 3770 B9R2.19 O=C1NC[C@H]2C[C@@H]1O2 Amb27841075 [0,0,0,1,0,1|2,0,0]=4 3771 B9R2.37 CC1C(=O)CC2OC21 Amb28316166 [0,0,0,1,0,1|2,0,0]=4 3772 B9R2.3 C1NCC2NOCC12 Amb27639669 [0,1,0,1,0,0|1,0,1]=4 3773 B9R2.5 O=C1NCCC12CC2 Amb24053126 [0,1,0,1,0,0|2,0,0]=4 3774 B9R2.7 O=C1N[C@@H]2CCN[C@H]12 Amb27796913 [0,1,0,1,0,0|1,0,1]=4 3775 B9R2.20 O=C1NCC2CCC12 Amb24121240 [0,1,0,1,0,0|2,0,0]=4 3776 B9R2.20 O=C1NC[C@@H]2CC[C@H]12 Amb28131123 [0,1,0,1,0,0|2,0,0]=4 3777 B9R2.31 NC1C2CC1C(=O)N2 Amb27481752 [0,1,0,1,0,0|1,0,0]=3 3778 B9R2.31 NC1[C@@H]2C[C@H]1NC2=O Amb28131384 [0,1,0,1,0,0|1,0,0]=3 3779 B9R2.40 C[C@@]12CNC(=O)[C@@H]1C2 Amb27975818 [0,1,0,1,0,0|2,0,0]=4 3780 B5R1.2 BrC1CNC1 Amb22229230 [1,0,0,0,1,0|1,0,1]=4 3781 B5R1.2 BrC1CNC1 Amb22235472 [1,0,0,0,1,0|1,0,1]=4 3782 B5R1.2 BrC1CNC1 Amb22304219 [1,0,0,0,1,0|1,0,1]=4 3783 B5R1.2 BrC1COC1 Amb2383522 [1,0,0,0,1,0|1,0,1]=4 3784 B5R1.2 C=C1CCC1 Amb19374657 [1,0,0,0,1,0|2,0,0]=4 3785 B5R1.2 C=C1CCO1 Amb22736695 [1,0,0,0,1,0|1,0,0]=3 3786 B5R1.2 C=C1COC1 Amb27432949 [1,0,0,0,1,0|2,0,0]=4 3787 B5R1.2 CC1CCN1 Amb33544381 [1,0,0,0,1,0|1,0,1]=4 3788 B5R1.2 CC1CCN1 Amb7094895 [1,0,0,0,1,0|1,0,1]=4 3789 B5R1.2 CC1CCO1 Amb22284855 [1,0,0,0,1,0|1,0,1]=4 3790 B5R1.2 CC1CNC1 Amb19957931 [1,0,0,0,1,0|1,0,1]=4 3791 B5R1.2 CC1CNC1 Amb26579404 [1,0,0,0,1,0|1,0,1]=4 3792 B5R1.2 CC1COC1 Amb20621708 [1,0,0,0,1,0|1,0,1]=4 3793 B5R1.2 C[C@@H]1CCN1 Amb34148051 [1,0,0,0,1,0|1,0,1]=4 3794 B5R1.2 C[C@@H]1CCO1 Amb28292927 [1,0,0,0,1,0|1,0,1]=4 3795 B5R1.2 C[C@H]1CCN1 Amb33805340 [1,0,0,0,1,0|1,0,1]=4 3796 B5R1.2 C[C@H]1CCO1 Amb26503922 [1,0,0,0,1,0|1,0,1]=4 3797 B5R1.2 ClC1CNC1 Amb21960859 [1,0,0,0,1,0|1,0,1]=4 3798 B5R1.2 ClC1CNC1 Amb22232545 [1,0,0,0,1,0|1,0,1]=4 3799 B5R1.2 ClC1COC1 Amb22737242 [1,0,0,0,1,0|1,0,1]=4 3800 B5R1.2 FC1CNC1 Amb19148506 [1,0,0,0,1,0|1,0,1]=4 3801 B5R1.2 FC1CNC1 Amb8629955 [1,0,0,0,1,0|1,0,1]=4 3802 B5R1.2 FC1COC1 Amb21960819 [1,0,0,0,1,0|1,0,1]=4 3803 B5R1.2 IC1CNC1 Amb22229328 [1,0,0,0,1,0|1,0,1]=4 3804 B5R1.2 IC1CNC1 Amb28247468 [1,0,0,0,1,0|1,0,1]=4 3805 B5R1.2 IC1COC1 Amb2383523 [1,0,0,0,1,0|1,0,1]=4 3806 B5R1.2 NC1C=CC1 Amb32658179 [1,0,0,0,1,0|1,0,0]=3 3807 B5R1.2 NC1CCC1 Amb3938963 [1,0,0,0,1,0|1,0,1]=4 3808 B5R1.2 NC1CCC1 Amb8631327 [1,0,0,0,1,0|1,0,1]=4 3809 B5R1.2 NC1CNC1 Amb2696234 [1,0,0,0,1,0|0,0,1]=3 3810 B5R1.2 NC1CNC1 Amb8630172 [1,0,0,0,1,0|0,0,1]=3 3811 B5R1.2 NC1COC1 Amb21928045 [1,0,0,0,1,0|0,0,1]=3 3812 B5R1.2 NC1COC1 Amb6259281 [1,0,0,0,1,0|0,0,1]=3 3813 B5R1.2 NC1CSC1 Amb17597694 [1,0,0,0,1,0|0,1,1]=4 3814 B5R1.2 NC1CSC1 Amb19373792 [1,0,0,0,1,0|0,1,1]=4 3815 B5R1.2 NC1CSC1 Amb22295804 [1,0,0,0,1,0|0,1,1]=4 3816 B5R1.2 O=C1BCN1 Amb27403064 [1,0,0,0,1,0|1,0,0]=3 3817 B5R1.2 O=C1C=CC1 Amb24477666 [1,0,0,0,1,0|1,0,1]=4 3818 B5R1.2 O=C1CCC1 Amb4605970 [1,0,0,0,1,0|1,0,0]=3 3819 B5R1.2 O=C1CCN1 Amb2779956 [1,0,0,0,1,0|0,0,0]=2 3820 B5R1.2 O=C1CCO1 Amb8514945 [1,0,0,0,1,0|0,0,0]=2 3821 B5R1.2 O=C1CCS1 Amb28430252 [1,0,0,0,1,0|0,1,0]=3 3822 B5R1.2 O=C1CNC1 Amb10975976 [1,0,0,0,1,0|2,0,0]=4 3823 B5R1.2 O=C1COC1 Amb10067645 [1,0,0,0,1,0|1,0,0]=3 3824 B5R1.2 O=C1CSC1 Amb19516222 [1,0,0,0,1,0|1,1,0]=4 3825 B5R1.2 O=C1O[Ba]O1 Amb22052524 [1,0,0,0,1,0|2,0,0]=4 3826 B5R1.2 O=C1O[Mg]O1 Amb22052493 [1,0,0,0,1,0|2,0,0]=4 3827 B5R1.2 O=C1O[PbH2]O1 Amb22052516 [1,0,0,0,1,0|2,0,0]=4 3828 B5R1.2 O=S1CCC1 Amb27653739 [1,0,0,0,1,0|2,0,0]=4 3829 B5R1.2 OC1CCO1 Amb27424422 [1,0,0,0,1,0|0,0,2]=4 3830 B5R1.2 OC1CNC1 Amb22489446 [1,0,0,0,1,0|1,0,1]=4 3831 B5R1.2 OC1CNC1 Amb2688729 [1,0,0,0,1,0|1,0,1]=4 3832 B5R1.2 OC1CNC1 Amb2785246 [1,0,0,0,1,0|1,0,1]=4 3833 B5R1.2 OC1COC1 Amb10602318 [1,0,0,0,1,0|1,0,1]=4 3834 B5R1.2 SC1CNC1 Amb24477050 [1,0,0,0,1,0|1,0,1]=4 3835 B5R1.2 SC1CNC1 Amb33715987 [1,0,0,0,1,0|1,0,1]=4 3836 B5R1.2 SC1COC1 Amb22737528 [1,0,0,0,1,0|1,0,1]=4 3837 B5R1.4 C=C1CC1N Amb28286745 [0,0,0,0,2,0|1,0,0]=3 3838 B5R1.4 CC1CC1N Amb10609752 [0,0,0,0,2,0|1,0,1]=4 3839 B5R1.4 CC1CC1N Amb22886429 [0,0,0,0,2,0|1,0,1]=4 3840 B5R1.4 CC1CC1N Amb9024793 [0,0,0,0,2,0|1,0,1]=4 3841 B5R1.4 C[C@@H]1C[C@H]1N Amb13952528 [0,0,0,0,2,0|1,0,1]=4 3842 B5R1.4 C[C@@H]1C[C@H]1N Amb22886313 [0,0,0,0,2,0|1,0,1]=4 3843 B5R1.4 C[C@H]1C[C@@H]1N Amb32655995 [0,0,0,0,2,0|1,0,1]=4 3844 B5R1.4 C[C@H]1C[C@@H]1N Amb32655996 [0,0,0,0,2,0|1,0,1]=4 3845 B5R1.4 C[C@H]1C[C@H]1N Amb28134094 [0,0,0,0,2,0|1,0,1]=4 3846 B5R1.4 NC1CC1F Amb27848487 [0,0,0,0,2,0|1,0,1]=4 3847 B5R1.4 NC1CC1F Amb33986627 [0,0,0,0,2,0|1,0,1]=4 3848 B5R1.4 NC1CC1N Amb19514509 [0,0,0,0,2,0|1,0,1]=4 3849 B5R1.4 NC1CC1N Amb20667825 [0,0,0,0,2,0|1,0,1]=4 3850 B5R1.4 N[C@@H]1C[C@@H]1F Amb26546441 [0,0,0,0,2,0|1,0,1]=4 3851 B5R1.4 N[C@@H]1C[C@H]1N Amb22745875 [0,0,0,0,2,0|1,0,1]=4 3852 B5R1.4 N[C@@H]1C[C@H]1N Amb27195408 [0,0,0,0,2,0|1,0,1]=4 3853 B5R1.4 N[C@H]1C[C@H]1N Amb25883439 [0,0,0,0,2,0|1,0,1]=4 3854 B5R1.4 N[C@H]1C[C@H]1N Amb32683299 [0,0,0,0,2,0|1,0,1]=4 3855 B9R1.48 CC1CC(=O)NCCN1 Amb18832620 [0,0,0,0,0,2|2,0,0]=4 3856 B9R1.48 CC1CC(=O)NCCO1 Amb27244386 [0,0,0,0,0,2|2,0,0]=4 3857 B9R1.48 CC1CC(=O)NCCS1 Amb22642277 [0,0,0,0,0,2|2,0,0]=4 3858 B9R1.48 CC1CCCNC(=O)C1 Amb28364919 [0,0,0,0,0,2|2,0,0]=4 3859 B9R1.48 CC1COCCC(=O)N1 Amb28123242 [0,0,0,0,0,2|2,0,0]=4 3860 B9R1.48 C[C@@H]1CC(=O)NCCN1 Amb26457829 [0,0,0,0,0,2|2,0,0]=4 3861 B9R1.48 C[C@@H]1CCCNC(=O)C1 Amb28241573 [0,0,0,0,0,2|2,0,0]=4 3862 B9R1.48 C[C@H]1CCCNC(=O)C1 Amb27174761 [0,0,0,0,0,2|2,0,0]=4 3863 B9R1.49 CC1CCNC(=O)CC1 Amb9316850 [0,0,0,0,0,2|2,0,0]=4 3864 B9R1.49 NC1CCCC(=O)NC1 Amb22230053 [0,0,0,0,0,2|2,0,0]=4 3865 B9R1.49 NC1CCCC(=O)NC1 Amb27867752 [0,0,0,0,0,2|2,0,0]=4 3866 B9R1.49 NC1CCNC(=O)CC1 Amb24689800 [0,0,0,0,0,2|1,0,0]=3 3867 B9R1.49 NC1CCNC(=O)CC1 Amb32663578 [0,0,0,0,0,2|1,0,0]=3 3868 B9R1.49 NC1CCNC(=O)CC1 Amb32663872 [0,0,0,0,0,2|1,0,0]=3 3869 B9R1.49 O=C1CCC(Cl)CCN1 Amb27768772 [0,0,0,0,0,2|2,0,0]=4 3870 B9R1.49 O=C1CCC(O)CCN1 Amb26443713 [0,0,0,0,0,2|2,0,0]=4 3871 B9R1.5 CC1CCNCCC1=O Amb22886271 [0,0,0,0,0,2|2,0,0]=4 3872 B9R1.5 CC1CNCCNC1=O Amb27228560 [0,0,0,0,0,2|2,0,0]=4 3873 B9R1.5 CC1CSC=CNC1=O Amb28183043 [0,0,0,0,0,2|1,1,0]=4 3874 B9R1.5 CC1NCCCNC1=O Amb33545017 [0,0,0,0,0,2|2,0,0]=4 3875 B9R1.5 C[C@@H]1CCCCNC1=O Amb28072473 [0,0,0,0,0,2|2,0,0]=4 3876 B9R1.5 C[C@@H]1NCCCNC1=O Amb25733316 [0,0,0,0,0,2|2,0,0]=4 3877 B9R1.5 C[C@H]1NCCCNC1=O Amb25146171 [0,0,0,0,0,2|2,0,0]=4 3878 B9R1.5 NC1CCCCCC1=O Amb18276126 [0,0,0,0,0,2|2,0,0]=4 3879 B9R1.5 NC1CCCCCC1=O Amb28934932 [0,0,0,0,0,2|2,0,0]=4 3880 B9R1.5 NC1CCCCNC1=O Amb19958477 [0,0,0,0,0,2|1,0,0]=3 3881 B9R1.5 NC1CCCCNC1=O Amb9721937 [0,0,0,0,0,2|1,0,0]=3 3882 B9R1.5 NC1CSCCNC1=O Amb25336468 [0,0,0,0,0,2|0,1,0]=3 3883 B9R1.5 NC1CSCCNC1=O Amb32412582 [0,0,0,0,0,2|0,1,0]=3 3884 B9R1.5 N[C@@H]1CCCCNC1=O Amb10608775 [0,0,0,0,0,2|1,0,0]=3 3885 B9R1.5 N[C@@H]1CCCCNC1=O Amb20670688 [0,0,0,0,0,2|1,0,0]=3 3886 B9R1.5 N[C@@H]1CSCCNC1=O Amb19374458 [0,0,0,0,0,2|0,1,0]=3 3887 B9R1.5 N[C@@H]1CSCCNC1=O Amb32414615 [0,0,0,0,0,2|0,1,0]=3 3888 B9R1.5 N[C@H]1CCCCNC1=O Amb19929579 [0,0,0,0,0,2|1,0,0]=3 3889 B9R1.5 N[C@H]1CCCCNC1=O Amb532926 [0,0,0,0,0,2|1,0,0]=3 3890 B9R1.5 N[C@H]1COCCNC1=O Amb27234381 [0,0,0,0,0,2|0,0,0]=2 3891 B9R1.5 N[C@H]1CSCCNC1=O Amb10067826 [0,0,0,0,0,2|0,1,0]=3 3892 B9R1.5 O=C1CCNCCC1Br Amb27201712 [0,0,0,0,0,2|2,0,0]=4 3893 B9R1.5 O=C1CCNCCC1Br Amb33621267 [0,0,0,0,0,2|2,0,0]=4 3894 B9R1.5 O=C1CCNCCC1F Amb22886247 [0,0,0,0,0,2|2,0,0]=4 3895 B9R1.5 O=C1CNCCCC1F Amb22886238 [0,0,0,0,0,2|2,0,0]=4 3896 B9R1.5 O=C1NCCCCC1Br Amb9781677 [0,0,0,0,0,2|2,0,0]=4 3897 B9R1.5 O=C1NCCCCC1Cl Amb27815034 [0,0,0,0,0,2|2,0,0]=4 3898 B9R1.5 O=C1NCCCCC1I Amb35751097 [0,0,0,0,0,2|2,0,0]=4