0 B7R0.16 C=C(C(=O)Cl)C(F)F Amb27213226 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.16 C=C(C(=O)O)C(=O)Cl Amb28056536 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.16 C=C(C(=O)O)C(C)C Amb17593189 [0,0,0,0,0,0|1,0,0]=1 3 B7R0.16 C=C(C(=O)O)C(C)N Amb27794714 [0,0,0,0,0,0|2,0,0]=2 4 B7R0.16 C=C(C(=O)O)C(F)F Amb24117234 [0,0,0,0,0,0|3,0,0]=3 5 B7R0.16 C=C(C(=O)O)N(C)C Amb27162682 [0,0,0,0,0,0|2,0,0]=2 6 B7R0.16 C=C(C(=O)O)[C@@H](C)N Amb27440248 [0,0,0,0,0,0|2,0,0]=2 7 B7R0.16 C=C(C(=O)O)[C@H](C)O Amb27410183 [0,0,0,0,0,0|2,0,0]=2 8 B7R0.16 C=C(C(C)=O)C(C)=O Amb27424014 [0,0,0,0,0,0|3,0,1]=4 9 B7R0.16 C=C(C(C)=O)C(N)=O Amb27814821 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.16 C=C(C(C)=O)[C@@H](C)O Amb26964906 [0,0,0,0,0,0|3,0,0]=3 11 B7R0.16 C=C(C(C)=O)[C@H](C)O Amb27424236 [0,0,0,0,0,0|3,0,0]=3 12 B7R0.16 C=C(C(C)C)C(C)C Amb27424106 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.16 C=C(C(C)O)S(C)=O Amb27487029 [0,0,0,0,0,0|4,0,0]=4 14 B7R0.16 C=C(C)C(=C)C(=O)O Amb33199524 [0,0,0,0,0,0|1,0,2]=3 15 B7R0.16 C=C(C)C(=O)C(C)C Amb25353284 [0,0,0,0,0,0|2,0,0]=2 16 B7R0.16 C=C(C)C(=O)C(C)N Amb26370543 [0,0,0,0,0,0|3,0,0]=3 17 B7R0.16 C=C(C)C(=O)C(F)F Amb24534089 [0,0,0,0,0,0|4,0,0]=4 18 B7R0.16 C=C(C)C(=O)N(C)C Amb17934031 [0,0,0,0,0,0|3,0,0]=3 19 B7R0.16 C=C(C)C(=O)N(C)N Amb33191420 [0,0,0,0,0,0|4,0,0]=4 20 B7R0.16 C=C(C)C(=O)[C@@H](C)N Amb30024657 [0,0,0,0,0,0|3,0,0]=3 21 B7R0.16 C=C(C)C(=O)[C@H](C)N Amb35617899 [0,0,0,0,0,0|3,0,0]=3 22 B7R0.16 C=C(C)C(Br)=C(C)C Amb28284189 [0,0,0,0,0,0|3,0,1]=4 23 B7R0.16 C=C(C)C(C)C(=O)O Amb18641781 [0,0,0,0,0,0|1,0,3]=4 24 B7R0.16 C=C(C)C(N)C(=O)O Amb18641831 [0,0,0,0,0,0|1,0,3]=4 25 B7R0.16 C=C(C)C(N)C(C)C Amb18641748 [0,0,0,0,0,0|3,0,1]=4 26 B7R0.16 C=C(C)C(O)C(=O)O Amb27859701 [0,0,0,0,0,0|0,0,4]=4 27 B7R0.16 C=C(C)[C@@H](N)C(=O)O Amb26012631 [0,0,0,0,0,0|1,0,3]=4 28 B7R0.16 C=C(C)[C@@H](O)C(=O)O Amb28071409 [0,0,0,0,0,0|0,0,4]=4 29 B7R0.16 CC(=O)C(=O)C(=O)O Amb24101563 [0,0,0,0,0,0|1,0,1]=2 30 B7R0.16 CC(=O)C(=O)C(C)=O Amb17593178 [0,0,0,0,0,0|2,0,1]=3 31 B7R0.16 CC(=O)C(=O)C(C)Br Amb24055325 [0,0,0,0,0,0|2,0,0]=2 32 B7R0.16 CC(=O)C(=O)C(C)C Amb26614542 [0,0,0,0,0,0|1,0,0]=1 33 B7R0.16 CC(=O)C(=O)C(Cl)Cl Amb27767961 [0,0,0,0,0,0|3,0,0]=3 34 B7R0.16 CC(=O)C(=O)C(S)S Amb27460255 [0,0,0,0,0,0|3,0,0]=3 35 B7R0.16 CC(=O)C(=O)N(C)C Amb17399799 [0,0,0,0,0,0|2,0,0]=2 36 B7R0.16 CC(=O)C(=S)C(C)=O Amb24588939 [0,0,0,0,0,0|2,1,1]=4 37 B7R0.16 CC(=O)C(=S)N(C)C Amb27409555 [0,0,0,0,0,0|2,1,0]=3 38 B7R0.16 CC(=O)C(Br)C(C)C Amb2389580 [0,0,0,0,0,0|2,0,1]=3 39 B7R0.16 CC(=O)C(Br)C(C)Cl Amb27791473 [0,0,0,0,0,0|3,0,1]=4 40 B7R0.16 CC(=O)C(C)=C(C)C Amb17593162 [0,0,0,0,0,0|2,0,1]=3 41 B7R0.16 CC(=O)C(C)C(C)O Amb17593202 [0,0,0,0,0,0|3,0,1]=4 42 B7R0.16 CC(=O)C(C)[C@@H](C)O Amb28316228 [0,0,0,0,0,0|3,0,1]=4 43 B7R0.16 CC(=O)C(Cl)=C(C)C Amb28048939 [0,0,0,0,0,0|2,0,1]=3 44 B7R0.16 CC(=O)C(Cl)C(C)C Amb24483197 [0,0,0,0,0,0|2,0,1]=3 45 B7R0.16 CC(=O)C(F)C(C)O Amb28437134 [0,0,0,0,0,0|3,0,1]=4 46 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [0,0,0,0,0,0|2,0,2]=4 47 B7R0.16 CC(=O)C(N)C(C)C Amb23536905 [0,0,0,0,0,0|2,0,1]=3 48 B7R0.16 CC(=O)C(O)C(C)C Amb25087800 [0,0,0,0,0,0|1,0,2]=3 49 B7R0.16 CC(=O)C(O)C(C)O Amb26597030 [0,0,0,0,0,0|2,0,2]=4 50 B7R0.16 CC(=O)C(S)C(C)C Amb28254219 [0,0,0,0,0,0|1,1,1]=3 51 B7R0.16 CC(=O)N(C)C(C)C Amb28435200 [0,0,0,0,0,0|3,0,0]=3 52 B7R0.16 CC(=O)N(N)C(C)C Amb18641904 [0,0,0,0,0,0|3,0,0]=3 53 B7R0.16 CC(=O)[C@@H](C)[C@@H](C)Cl Amb28325873 [0,0,0,0,0,0|3,0,1]=4 54 B7R0.16 CC(=O)[C@@H](C)[C@H](C)O Amb26966954 [0,0,0,0,0,0|3,0,1]=4 55 B7R0.16 CC(=O)[C@@H](N)C(C)C Amb28410324 [0,0,0,0,0,0|2,0,1]=3 56 B7R0.16 CC(=O)[C@@H](O)[C@@H](C)O Amb24481484 [0,0,0,0,0,0|2,0,2]=4 57 B7R0.16 CC(=O)[C@@H](O)[C@H](C)O Amb28045145 [0,0,0,0,0,0|2,0,2]=4 58 B7R0.16 CC(=O)[C@H](C)C(C)C Amb24753185 [0,0,0,0,0,0|2,0,1]=3 59 B7R0.16 CC(=O)[C@H](C)[C@H](C)O Amb28249967 [0,0,0,0,0,0|3,0,1]=4 60 B7R0.16 CC(=O)[C@H](O)C(C)C Amb24379445 [0,0,0,0,0,0|1,0,2]=3 61 B7R0.16 CC(=O)[C@H](O)[C@@H](C)O Amb24701454 [0,0,0,0,0,0|2,0,2]=4 62 B7R0.16 CC(=O)\C(C)=C(/C)N Amb25232464 [0,0,0,0,0,0|3,0,1]=4 63 B7R0.16 CC(=O)\C(C)=C(\C)Br Amb27265798 [0,0,0,0,0,0|3,0,1]=4 64 B7R0.16 CC(=O)\C(C)=C(\C)N Amb28316241 [0,0,0,0,0,0|3,0,1]=4 65 B7R0.16 CC(=O)\C(F)=C(/C)F Amb27798095 [0,0,0,0,0,0|3,0,1]=4 66 B7R0.16 CC(=O)\C(F)=C(/C)O Amb28384212 [0,0,0,0,0,0|3,0,1]=4 67 B7R0.16 CC(=O)\C(F)=C(\C)F Amb24645401 [0,0,0,0,0,0|3,0,1]=4 68 B7R0.16 CC(=O)\C(N)=C(/C)O Amb26452525 [0,0,0,0,0,0|3,0,1]=4 69 B7R0.16 CC(=S)C(S)C(=O)O Amb27791825 [0,0,0,0,0,0|1,1,2]=4 70 B7R0.16 CC(Br)C(=O)C(=O)O Amb23400913 [0,0,0,0,0,0|1,0,0]=1 71 B7R0.16 CC(Br)C(=O)C(C)Br Amb16234174 [0,0,0,0,0,0|3,0,1]=4 72 B7R0.16 CC(Br)C(=O)N(C)C Amb15701256 [0,0,0,0,0,0|3,0,1]=4 73 B7R0.16 CC(Br)C(Br)C(=O)Cl Amb27482606 [0,0,0,0,0,0|3,0,1]=4 74 B7R0.16 CC(Br)C(Br)C(=O)O Amb4008645 [0,0,0,0,0,0|2,0,1]=3 75 B7R0.16 CC(C(=O)O)N(C)C Amb21955631 [0,0,0,0,0,0|2,0,1]=3 76 B7R0.16 CC(C(=O)O)N(C)C Amb6653762 [0,0,0,0,0,0|2,0,1]=3 77 B7R0.16 CC(C(=O)O)N(C)N Amb22372039 [0,0,0,0,0,0|3,0,1]=4 78 B7R0.16 CC(C(=O)[O-])[C@H](C)O Amb27835918 [0,0,0,0,0,0|2,0,2]=4 79 B7R0.16 CC(C)=C(Br)C(=O)O Amb17594579 [0,0,0,0,0,0|1,0,1]=2 80 B7R0.16 CC(C)=C(Br)N(C)C Amb10601604 [0,0,0,0,0,0|4,0,0]=4 81 B7R0.16 CC(C)=C(C)B(O)O Amb21963206 [0,0,0,0,0,0|2,0,2]=4 82 B7R0.16 CC(C)=C(C)C(=O)O Amb17593186 [0,0,0,0,0,0|1,0,1]=2 83 B7R0.16 CC(C)=C(C)C(C)Br Amb27400438 [0,0,0,0,0,0|4,0,0]=4 84 B7R0.16 CC(C)=C(C)C(C)C Amb22347879 [0,0,0,0,0,0|3,0,0]=3 85 B7R0.16 CC(C)=C(Cl)C(=O)O Amb18642954 [0,0,0,0,0,0|1,0,1]=2 86 B7R0.16 CC(C)=C(Cl)N(C)C Amb8515267 [0,0,0,0,0,0|4,0,0]=4 87 B7R0.16 CC(C)=C(F)C(=O)O Amb20669103 [0,0,0,0,0,0|1,0,1]=2 88 B7R0.16 CC(C)=C(F)N(C)C Amb26423288 [0,0,0,0,0,0|4,0,0]=4 89 B7R0.16 CC(C)C(=N)C(=O)O Amb28073845 [0,0,0,0,0,0|1,0,0]=1 90 B7R0.16 CC(C)C(=O)C(=O)Cl Amb27843357 [0,0,0,0,0,0|1,0,0]=1 91 B7R0.16 CC(C)C(=O)C(=O)O Amb6600000 [0,0,0,0,0,0|0,0,0]=0 92 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8393075 [0,0,0,0,0,0|0,0,1]=1 93 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8513875 [0,0,0,0,0,0|0,0,1]=1 94 B7R0.16 CC(C)C(=O)C(C)Br Amb25337696 [0,0,0,0,0,0|2,0,1]=3 95 B7R0.16 CC(C)C(=O)C(C)C Amb4606013 [0,0,0,0,0,0|2,0,1]=3 96 B7R0.16 CC(C)C(=O)C(C)Cl Amb17593425 [0,0,0,0,0,0|2,0,1]=3 97 B7R0.16 CC(C)C(=O)C(C)N Amb18124258 [0,0,0,0,0,0|2,0,1]=3 98 B7R0.16 CC(C)C(=O)C(C)O Amb26478614 [0,0,0,0,0,0|1,0,1]=2 99 B7R0.16 CC(C)C(=O)C(C)S Amb27226946 [0,0,0,0,0,0|1,1,1]=3 100 B7R0.16 CC(C)C(=O)C(Cl)Br Amb27791489 [0,0,0,0,0,0|2,0,1]=3 101 B7R0.16 CC(C)C(=O)C(Cl)Cl Amb27422900 [0,0,0,0,0,0|2,0,1]=3 102 B7R0.16 CC(C)C(=O)C(F)F Amb24694185 [0,0,0,0,0,0|2,0,1]=3 103 B7R0.16 CC(C)C(=O)C(N)=O Amb28119959 [0,0,0,0,0,0|1,0,0]=1 104 B7R0.16 CC(C)C(=O)N(C)C Amb2687536 [0,0,0,0,0,0|3,0,0]=3 105 B7R0.16 CC(C)C(=O)N(C)N Amb18641905 [0,0,0,0,0,0|3,0,0]=3 106 B7R0.16 CC(C)C(=O)N(C)O Amb27963828 [0,0,0,0,0,0|2,0,0]=2 107 B7R0.16 CC(C)C(=O)[C@@H](C)N Amb30023832 [0,0,0,0,0,0|2,0,1]=3 108 B7R0.16 CC(C)C(=O)[C@H](C)O Amb27985493 [0,0,0,0,0,0|1,0,1]=2 109 B7R0.16 CC(C)C(=O)[N+](=O)[O-] Amb28049032 [0,0,0,0,0,0|1,0,1]=2 110 B7R0.16 CC(C)C(=S)N(C)C Amb27421308 [0,0,0,0,0,0|3,1,0]=4 111 B7R0.16 CC(C)C(Br)C(=N)N Amb28285546 [0,0,0,0,0,0|3,0,1]=4 112 B7R0.16 CC(C)C(Br)C(=O)Cl Amb17569838 [0,0,0,0,0,0|2,0,1]=3 113 B7R0.16 CC(C)C(Br)C(=O)O Amb9703217 [0,0,0,0,0,0|1,0,1]=2 114 B7R0.16 CC(C)C(Br)C(N)=O Amb9725771 [0,0,0,0,0,0|2,0,1]=3 115 B7R0.16 CC(C)C(C)C(=O)Cl Amb27645335 [0,0,0,0,0,0|2,0,1]=3 116 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [0,0,0,0,0,0|1,0,1]=2 117 B7R0.16 CC(C)C(C)C(C)O Amb24640694 [0,0,0,0,0,0|2,0,2]=4 118 B7R0.16 CC(C)C(C)C(N)=S Amb28400471 [0,0,0,0,0,0|2,1,1]=4 119 B7R0.16 CC(C)C(C)S(=O)Cl Amb32720503 [0,0,0,0,0,0|3,0,1]=4 120 B7R0.16 CC(C)C(C)S(=O)[O-] Amb25685559 [0,0,0,0,0,0|2,0,2]=4 121 B7R0.16 CC(C)C(C)S(N)=O Amb32720504 [0,0,0,0,0,0|3,0,1]=4 122 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,0,0,0,0,0|2,0,1]=3 123 B7R0.16 CC(C)C(Cl)C(=O)O Amb6739911 [0,0,0,0,0,0|1,0,1]=2 124 B7R0.16 CC(C)C(F)C(=N)N Amb32456108 [0,0,0,0,0,0|3,0,1]=4 125 B7R0.16 CC(C)C(F)C(=O)O Amb19957386 [0,0,0,0,0,0|1,0,1]=2 126 B7R0.16 CC(C)C(N)B(O)O Amb24482349 [0,0,0,0,0,0|2,0,2]=4 127 B7R0.16 CC(C)C(N)C(=O)Cl Amb6740265 [0,0,0,0,0,0|2,0,1]=3 128 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [0,0,0,0,0,0|1,0,1]=2 129 B7R0.16 CC(C)C(N)C(C)O Amb18641932 [0,0,0,0,0,0|2,0,2]=4 130 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,0,0,0,0,0|2,0,1]=3 131 B7R0.16 CC(C)C(N)C(N)=O Amb32666402 [0,0,0,0,0,0|2,0,1]=3 132 B7R0.16 CC(C)C(N)C(N)=O Amb6271181 [0,0,0,0,0,0|2,0,1]=3 133 B7R0.16 CC(C)C(N)C(N)=S Amb19148044 [0,0,0,0,0,0|2,1,1]=4 134 B7R0.16 CC(C)C(O)C(=O)Cl Amb27213311 [0,0,0,0,0,0|1,0,2]=3 135 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [0,0,0,0,0,0|0,0,2]=2 136 B7R0.16 CC(C)C(O)C(C)O Amb27251557 [0,0,0,0,0,0|1,0,3]=4 137 B7R0.16 CC(C)C(O)[PH](=O)O Amb27430184 [0,0,0,0,0,0|1,0,2]=3 138 B7R0.16 CC(C)C(S)C(=O)O Amb18282761 [0,0,0,0,0,0|0,1,1]=2 139 B7R0.16 CC(C)N(C)C(=N)N Amb33551553 [0,0,0,0,0,0|4,0,0]=4 140 B7R0.16 CC(C)N(C)C(=O)Cl Amb25807313 [0,0,0,0,0,0|3,0,0]=3 141 B7R0.16 CC(C)N(N)C(N)=S Amb28249182 [0,0,0,0,0,0|3,1,0]=4 142 B7R0.16 CC(C)N(O)C(N)=O Amb18202545 [0,0,0,0,0,0|2,0,1]=3 143 B7R0.16 CC(C)[C@@H](Br)C(=O)O Amb8629113 [0,0,0,0,0,0|1,0,1]=2 144 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [0,0,0,0,0,0|1,0,1]=2 145 B7R0.16 CC(C)[C@@H](C)C(N)=O Amb27838382 [0,0,0,0,0,0|2,0,1]=3 146 B7R0.16 CC(C)[C@@H](C)[C@@H](C)O Amb27801928 [0,0,0,0,0,0|2,0,2]=4 147 B7R0.16 CC(C)[C@@H](Cl)C(=O)Cl Amb32658177 [0,0,0,0,0,0|2,0,1]=3 148 B7R0.16 CC(C)[C@@H](Cl)[C@@H](C)O Amb27433932 [0,0,0,0,0,0|2,0,2]=4 149 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [0,0,0,0,0,0|1,0,1]=2 150 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,0,0,0,0,0|2,0,1]=3 151 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,0,0,0,0,0|2,0,1]=3 152 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb4013551 [0,0,0,0,0,0|2,0,1]=3 153 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [0,0,0,0,0,0|0,0,2]=2 154 B7R0.16 CC(C)[C@@H](O)C(N)=O Amb27879443 [0,0,0,0,0,0|1,0,2]=3 155 B7R0.16 CC(C)[C@H](Br)C(=O)O Amb8629114 [0,0,0,0,0,0|1,0,1]=2 156 B7R0.16 CC(C)[C@H](C)B(O)O Amb27604530 [0,0,0,0,0,0|2,0,2]=4 157 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [0,0,0,0,0,0|1,0,1]=2 158 B7R0.16 CC(C)[C@H](C)C(N)=O Amb28345619 [0,0,0,0,0,0|2,0,1]=3 159 B7R0.16 CC(C)[C@H](Cl)C(=O)Cl Amb27407011 [0,0,0,0,0,0|2,0,1]=3 160 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [0,0,0,0,0,0|1,0,1]=2 161 B7R0.16 CC(C)[C@H](N)C(C)O Amb35623965 [0,0,0,0,0,0|2,0,2]=4 162 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16183986 [0,0,0,0,0,0|2,0,1]=3 163 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16231400 [0,0,0,0,0,0|2,0,1]=3 164 B7R0.16 CC(C)[C@H](N)C(N)=O Amb30595108 [0,0,0,0,0,0|2,0,1]=3 165 B7R0.16 CC(C)[C@H](N)[C@H](C)O Amb27167748 [0,0,0,0,0,0|2,0,2]=4 166 B7R0.16 CC(C)[C@H](N)[PH](=O)O Amb27814729 [0,0,0,0,0,0|2,0,1]=3 167 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [0,0,0,0,0,0|0,0,2]=2 168 B7R0.16 CC(C)[PH](=O)C(C)C Amb22009468 [0,0,0,0,0,0|3,0,1]=4 169 B7R0.16 CC(Cl)C(=O)C(Cl)Cl Amb27656891 [0,0,0,0,0,0|3,0,1]=4 170 B7R0.16 CC(Cl)C(=O)N(C)C Amb9722427 [0,0,0,0,0,0|3,0,1]=4 171 B7R0.16 CC(Cl)C(C)C(=O)O Amb28325096 [0,0,0,0,0,0|2,0,1]=3 172 B7R0.16 CC(Cl)C(Cl)C(=O)Cl Amb27634873 [0,0,0,0,0,0|3,0,1]=4 173 B7R0.16 CC(Cl)C(Cl)C(=O)O Amb28396619 [0,0,0,0,0,0|2,0,1]=3 174 B7R0.16 CC(Cl)N(C)C(=O)Cl Amb27656929 [0,0,0,0,0,0|4,0,0]=4 175 B7R0.16 CC(F)C(=O)C(=O)O Amb27246511 [0,0,0,0,0,0|1,0,0]=1 176 B7R0.16 CC(F)C(=O)C(C)Br Amb27433891 [0,0,0,0,0,0|3,0,1]=4 177 B7R0.16 CC(F)C(N)C(=O)O Amb10838661 [0,0,0,0,0,0|2,0,1]=3 178 B7R0.16 CC(F)C(N)C(=O)O Amb32752736 [0,0,0,0,0,0|2,0,1]=3 179 B7R0.16 CC(F)C(N)C(N)=O Amb28250824 [0,0,0,0,0,0|3,0,1]=4 180 B7R0.16 CC(F)[C@@H](N)C(=O)O Amb28316197 [0,0,0,0,0,0|2,0,1]=3 181 B7R0.16 CC(I)C(=O)N(C)C Amb27800345 [0,0,0,0,0,0|3,0,1]=4 182 B7R0.16 CC(N)C(=O)C(F)F Amb33337756 [0,0,0,0,0,0|3,0,1]=4 183 B7R0.16 CC(N)C(=O)N(C)C Amb21955713 [0,0,0,0,0,0|3,0,1]=4 184 B7R0.16 CC(N)C(=O)N(C)C Amb9728906 [0,0,0,0,0,0|3,0,1]=4 185 B7R0.16 CC(N)C(=O)N(C)N Amb28074021 [0,0,0,0,0,0|4,0,0]=4 186 B7R0.16 CC(N)C(=O)N(C)O Amb27640165 [0,0,0,0,0,0|3,0,0]=3 187 B7R0.16 CC(N)C(C)C(=O)O Amb18124261 [0,0,0,0,0,0|2,0,1]=3 188 B7R0.16 CC(N)C(C)C(=O)O Amb28934866 [0,0,0,0,0,0|2,0,1]=3 189 B7R0.16 CC(N)C(C)C(N)=O Amb27172764 [0,0,0,0,0,0|3,0,1]=4 190 B7R0.16 CC(N)C(F)C(=O)O Amb27411861 [0,0,0,0,0,0|2,0,1]=3 191 B7R0.16 CC(N)C(N)C(=O)O Amb22728051 [0,0,0,0,0,0|2,0,1]=3 192 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [0,0,0,0,0,0|1,0,2]=3 193 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [0,0,0,0,0,0|1,0,2]=3 194 B7R0.16 CC(N)C(O)C(N)=O Amb27483181 [0,0,0,0,0,0|2,0,2]=4 195 B7R0.16 CC(N)[C@H](N)C(=O)O Amb25083113 [0,0,0,0,0,0|2,0,1]=3 196 B7R0.16 CC(N)[C@H](N)C(=O)O Amb33740158 [0,0,0,0,0,0|2,0,1]=3 197 B7R0.16 CC(O)C(=O)C(=O)O Amb24481396 [0,0,0,0,0,0|1,0,0]=1 198 B7R0.16 CC(O)C(=O)C(C)Br Amb27806606 [0,0,0,0,0,0|2,0,1]=3 199 B7R0.16 CC(O)C(=O)N(C)C Amb2609090 [0,0,0,0,0,0|2,0,1]=3 200 B7R0.16 CC(O)C(=S)N(C)C Amb26411259 [0,0,0,0,0,0|2,1,1]=4 201 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,0,0,0,0,0|2,0,1]=3 202 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,0,0,0,0,0|2,0,1]=3 203 B7R0.16 CC(O)C(Cl)=C(Cl)Cl Amb27243012 [0,0,0,0,0,0|4,0,0]=4 204 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,0,0,0,0,0|2,0,1]=3 205 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,0,0,0,0,0|2,0,1]=3 206 B7R0.16 CC(O)C(N)C(=O)Cl Amb27830226 [0,0,0,0,0,0|3,0,1]=4 207 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,0,0,0,0,0|2,0,1]=3 208 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,0,0,0,0,0|2,0,1]=3 209 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,0,0,0,0,0|3,0,1]=4 210 B7R0.16 CC(O)C(N)C(N)=O Amb4006836 [0,0,0,0,0,0|3,0,1]=4 211 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,0,0,0,0,0|1,0,2]=3 212 B7R0.16 CC(O)[C@H](N)C(N)=O Amb27643319 [0,0,0,0,0,0|3,0,1]=4 213 B7R0.16 CC(S)C(=O)C(=O)O Amb28128312 [0,0,0,0,0,0|1,0,0]=1 214 B7R0.16 CC(S)C(N)C(=O)O Amb17593434 [0,0,0,0,0,0|2,0,1]=3 215 B7R0.16 CC(S)[C@@H](N)C(=O)O Amb24606864 [0,0,0,0,0,0|2,0,1]=3 216 B7R0.16 CN(C)C(=N)C(=O)O Amb18641880 [0,0,0,0,0,0|2,0,0]=2 217 B7R0.16 CN(C)C(=O)C(=O)O Amb2691325 [0,0,0,0,0,0|1,0,0]=1 218 B7R0.16 CN(C)C(=O)N(C)C Amb6297787 [0,0,0,0,0,0|4,0,0]=4 219 B7R0.16 CN(C)C(=O)N(C)N Amb26964847 [0,0,0,0,0,0|4,0,0]=4 220 B7R0.16 CN(C)C(=O)N(C)O Amb28060378 [0,0,0,0,0,0|3,0,0]=3 221 B7R0.16 CN(C)C(O)C(=O)O Amb28399618 [0,0,0,0,0,0|1,0,2]=3 222 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb22587534 [0,0,0,0,0,0|2,0,1]=3 223 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb28934882 [0,0,0,0,0,0|2,0,1]=3 224 B7R0.16 C[C@@H](Cl)[C@@H](Cl)C(=O)O Amb28343001 [0,0,0,0,0,0|2,0,1]=3 225 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(=O)O Amb28283911 [0,0,0,0,0,0|2,0,1]=3 226 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(N)=O Amb27607679 [0,0,0,0,0,0|3,0,1]=4 227 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb28286576 [0,0,0,0,0,0|2,0,1]=3 228 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb32668519 [0,0,0,0,0,0|2,0,1]=3 229 B7R0.16 C[C@@H](N)C(=O)N(C)C Amb18538472 [0,0,0,0,0,0|3,0,1]=4 230 B7R0.16 C[C@@H](N)C(=O)N(C)C Amb24271083 [0,0,0,0,0,0|3,0,1]=4 231 B7R0.16 C[C@@H](N)[C@@H](C)C(=O)O Amb25679842 [0,0,0,0,0,0|2,0,1]=3 232 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb22745441 [0,0,0,0,0,0|2,0,1]=3 233 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb24481409 [0,0,0,0,0,0|2,0,1]=3 234 B7R0.16 C[C@@H](O)C(=O)N(C)C Amb25358663 [0,0,0,0,0,0|2,0,1]=3 235 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,0,0,0,0,0|2,0,1]=3 236 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,0,0,0,0,0|2,0,1]=3 237 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,0,0,0,0,0|2,0,1]=3 238 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,0,0,0,0,0|1,0,2]=3 239 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,0,0,0,0,0|2,0,1]=3 240 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,0,0,0,0,0|2,0,1]=3 241 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,0,0,0,0,0|2,0,1]=3 242 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,0,0,0,0,0|2,0,1]=3 243 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,0,0,0,0,0|3,0,1]=4 244 B7R0.16 C[C@@H](S)[C@H](N)C(=O)O Amb24117242 [0,0,0,0,0,0|2,0,1]=3 245 B7R0.16 C[C@H](C(=O)O)N(C)C Amb22586633 [0,0,0,0,0,0|2,0,1]=3 246 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,0,0,0,0,0|2,0,1]=3 247 B7R0.16 C[C@H](Cl)C(=O)N(C)C Amb28382530 [0,0,0,0,0,0|3,0,1]=4 248 B7R0.16 C[C@H](Cl)C(=O)[C@@H](C)Cl Amb27446819 [0,0,0,0,0,0|3,0,1]=4 249 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)Cl Amb28384464 [0,0,0,0,0,0|3,0,1]=4 250 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)O Amb27955873 [0,0,0,0,0,0|2,0,1]=3 251 B7R0.16 C[C@H](N)C(=O)N(C)C Amb17231827 [0,0,0,0,0,0|3,0,1]=4 252 B7R0.16 C[C@H](N)C(=O)N(C)C Amb28934804 [0,0,0,0,0,0|3,0,1]=4 253 B7R0.16 C[C@H](N)[C@@H](C)C(=O)O Amb26887656 [0,0,0,0,0,0|2,0,1]=3 254 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [0,0,0,0,0,0|1,0,2]=3 255 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb17678797 [0,0,0,0,0,0|2,0,1]=3 256 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb26887696 [0,0,0,0,0,0|2,0,1]=3 257 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,0,0,0,0,0|2,0,1]=3 258 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,0,0,0,0,0|2,0,1]=3 259 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,0,0,0,0,0|2,0,1]=3 260 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,0,0,0,0,0|1,0,2]=3 261 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,0,0,0,0,0|2,0,1]=3 262 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,0,0,0,0,0|2,0,1]=3 263 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,0,0,0,0,0|2,0,1]=3 264 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,0,0,0,0,0|2,0,1]=3 265 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,0,0,0,0,0|2,0,1]=3 266 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,0,0,0,0,0|1,0,2]=3 267 B7R0.16 C[PH](=O)C(O)C(=O)O Amb34916646 [0,0,0,0,0,0|2,0,2]=4 268 B7R0.16 C\C(Br)=C(/C)C(=O)O Amb2611697 [0,0,0,0,0,0|2,0,1]=3 269 B7R0.16 C\C(N)=C(/Cl)C(N)=O Amb26578835 [0,0,0,0,0,0|3,0,1]=4 270 B7R0.16 C\C(O)=C(/N)C(N)=O Amb28429800 [0,0,0,0,0,0|3,0,1]=4 271 B7R0.16 C\C(O)=C(\N)C(=O)O Amb27191761 [0,0,0,0,0,0|2,0,1]=3 272 B7R0.16 C\C(O)=C(\O)C(=O)O Amb28282804 [0,0,0,0,0,0|1,0,2]=3 273 B7R0.16 C\C(O)=C(\O)C(C)O Amb25227909 [0,0,0,0,0,0|2,0,1]=3 274 B7R0.16 C\C(O)=C(\O)[C@@H](C)O Amb27862909 [0,0,0,0,0,0|2,0,1]=3 275 B7R0.16 NC(C(=O)O)C(F)F Amb24713127 [0,0,0,0,0,0|3,0,1]=4 276 B7R0.16 NC(C(=O)O)C(F)F Amb32644474 [0,0,0,0,0,0|3,0,1]=4 277 B7R0.16 N[C@H](C(=O)O)C(O)O Amb27867398 [0,0,0,0,0,0|3,0,1]=4 278 B7R0.16 O=C(Cl)C(=O)C(=O)Cl Amb26634429 [0,0,0,0,0,0|3,0,1]=4 279 B7R0.16 O=C(O)C(=O)C(=O)O Amb18641943 [0,0,0,0,0,0|2,0,1]=3 280 B7R0.16 O=C(O)C(=O)C(Br)Br Amb24179214 [0,0,0,0,0,0|2,0,0]=2 281 B7R0.16 O=C(O)C(=O)C(Cl)Br Amb27830042 [0,0,0,0,0,0|2,0,0]=2 282 B7R0.16 O=C(O)C(Br)=C(Cl)Cl Amb27827769 [0,0,0,0,0,0|3,0,1]=4 283 B7R0.16 O=C(O)C(Cl)=C(Cl)Cl Amb2724138 [0,0,0,0,0,0|3,0,1]=4 284 B7R0.16 O=C(O)C(F)=C(Cl)Cl Amb25732891 [0,0,0,0,0,0|3,0,1]=4 285 B7R0.16 O=C(O)C(F)=C(F)F Amb27409880 [0,0,0,0,0,0|3,0,1]=4 286 B7R0.16 O=C(O)C(F)C(Cl)Cl Amb4015382 [0,0,0,0,0,0|3,0,1]=4 287 B7R0.16 O=C(O)C(F)C(F)F Amb27481077 [0,0,0,0,0,0|3,0,1]=4 288 B7R0.16 O=C(O)C(O)C(Cl)Cl Amb27212773 [0,0,0,0,0,0|2,0,2]=4 289 B7R0.16 O=C(O)C(O)C(F)F Amb25074883 [0,0,0,0,0,0|2,0,2]=4 290 B6R0.2 C=C(Br)CC(C)C Amb22583739 [1,0,0,0,0,0|2,0,1]=4 291 B6R0.2 C=C(C)C=C(C)C Amb8513505 [1,0,0,0,0,0|2,0,1]=4 292 B6R0.2 C=C(C)CC(=O)O Amb6278832 [1,0,0,0,0,0|0,0,3]=4 293 B6R0.2 C=C(C)CC(C)C Amb4019530 [1,0,0,0,0,0|2,0,1]=4 294 B6R0.2 CC(=O)C=C(C)C Amb2793052 [1,0,0,0,0,0|1,0,1]=3 295 B6R0.2 CC(=O)CC(=O)O Amb377432 [1,0,0,0,0,0|1,0,2]=4 296 B6R0.2 CC(=O)CC(C)C Amb4605990 [1,0,0,0,0,0|1,0,1]=3 297 B6R0.2 CC(=O)CC(C)Cl Amb17593234 [1,0,0,0,0,0|2,0,1]=4 298 B6R0.2 CC(=O)CC(C)N Amb22587050 [1,0,0,0,0,0|2,0,1]=4 299 B6R0.2 CC(=O)CC(C)N Amb2583230 [1,0,0,0,0,0|2,0,1]=4 300 B6R0.2 CC(=O)CC(C)O Amb17593091 [1,0,0,0,0,0|2,0,1]=4 301 B6R0.2 CC(=O)CC(C)S Amb24600676 [1,0,0,0,0,0|2,0,1]=4 302 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [1,0,0,0,0,0|2,0,1]=4 303 B6R0.2 CC(=O)CN(C)C Amb9217324 [1,0,0,0,0,0|2,0,1]=4 304 B6R0.2 CC(=O)C[C@@H](C)N Amb27493422 [1,0,0,0,0,0|2,0,1]=4 305 B6R0.2 CC(=O)C[C@H](C)N Amb27222720 [1,0,0,0,0,0|2,0,1]=4 306 B6R0.2 CC(=O)NC(C)Br Amb27444682 [1,0,0,0,0,0|3,0,0]=4 307 B6R0.2 CC(=O)NC(C)C Amb3366263 [1,0,0,0,0,0|2,0,0]=3 308 B6R0.2 CC(=O)NC(C)N Amb27468729 [1,0,0,0,0,0|3,0,0]=4 309 B6R0.2 CC(=O)NN(C)C Amb25064806 [1,0,0,0,0,0|3,0,0]=4 310 B6R0.2 CC(=O)OC(C)Br Amb19958925 [1,0,0,0,0,0|3,0,0]=4 311 B6R0.2 CC(=O)OC(C)C Amb3940484 [1,0,0,0,0,0|2,0,0]=3 312 B6R0.2 CC(=O)OC(C)Cl Amb24058273 [1,0,0,0,0,0|3,0,0]=4 313 B6R0.2 CC(=O)OC(C)N Amb27184949 [1,0,0,0,0,0|3,0,0]=4 314 B6R0.2 CC(=O)OC(C)O Amb27457187 [1,0,0,0,0,0|3,0,0]=4 315 B6R0.2 CC(=O)O[SiH](C)C Amb2687439 [1,0,0,0,0,0|2,1,0]=4 316 B6R0.2 CC(=O)\C=C(/C)N Amb1149988 [1,0,0,0,0,0|2,0,1]=4 317 B6R0.2 CC(=O)\C=C(/C)S Amb27658727 [1,0,0,0,0,0|2,0,1]=4 318 B6R0.2 CC(=O)\C=C(\C)Br Amb27838200 [1,0,0,0,0,0|2,0,1]=4 319 B6R0.2 CC(=O)\C=C(\C)Cl Amb27196730 [1,0,0,0,0,0|2,0,1]=4 320 B6R0.2 CC(=O)\C=C(\C)N Amb2720902 [1,0,0,0,0,0|2,0,1]=4 321 B6R0.2 CC(=O)\C=C(\C)O Amb34915197 [1,0,0,0,0,0|2,0,1]=4 322 B6R0.2 CC(=O)\C=C(\C)S Amb26910658 [1,0,0,0,0,0|2,0,1]=4 323 B6R0.2 CC(=O)\C=C(\C)[O-] Amb19959976 [1,0,0,0,0,0|2,0,1]=4 324 B6R0.2 CC(=O)\C=C(\C)[O-] Amb20239443 [1,0,0,0,0,0|2,0,1]=4 325 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22045408 [1,0,0,0,0,0|2,0,1]=4 326 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053071 [1,0,0,0,0,0|2,0,1]=4 327 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053499 [1,0,0,0,0,0|2,0,1]=4 328 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053500 [1,0,0,0,0,0|2,0,1]=4 329 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053502 [1,0,0,0,0,0|2,0,1]=4 330 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053503 [1,0,0,0,0,0|2,0,1]=4 331 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053694 [1,0,0,0,0,0|2,0,1]=4 332 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053940 [1,0,0,0,0,0|2,0,1]=4 333 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22054020 [1,0,0,0,0,0|2,0,1]=4 334 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22466635 [1,0,0,0,0,0|2,0,1]=4 335 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22729908 [1,0,0,0,0,0|2,0,1]=4 336 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22730050 [1,0,0,0,0,0|2,0,1]=4 337 B6R0.2 CC(=O)\C=C(\C)[O-] Amb34915499 [1,0,0,0,0,0|2,0,1]=4 338 B6R0.2 CC(=S)CC(=O)O Amb28067768 [1,0,0,0,0,0|1,0,2]=4 339 B6R0.2 CC(=S)NC(C)C Amb27953313 [1,0,0,0,0,0|2,1,0]=4 340 B6R0.2 CC(=S)OC(C)C Amb24697607 [1,0,0,0,0,0|2,1,0]=4 341 B6R0.2 CC(Br)CC(=O)O Amb8517108 [1,0,0,0,0,0|1,0,1]=3 342 B6R0.2 CC(C)=CB(O)O Amb2455988 [1,0,0,0,0,0|1,0,2]=4 343 B6R0.2 CC(C)=CC(=O)Cl Amb2782315 [1,0,0,0,0,0|1,0,1]=3 344 B6R0.2 CC(C)=CC(=O)O Amb1485519 [1,0,0,0,0,0|0,0,1]=2 345 B6R0.2 CC(C)=CC(C)C Amb4016282 [1,0,0,0,0,0|2,0,0]=3 346 B6R0.2 CC(C)=CC(C)Cl Amb27841415 [1,0,0,0,0,0|3,0,0]=4 347 B6R0.2 CC(C)=CC(C)N Amb27258040 [1,0,0,0,0,0|3,0,0]=4 348 B6R0.2 CC(C)=CC(C)O Amb22229846 [1,0,0,0,0,0|1,0,2]=4 349 B6R0.2 CC(C)=CC(N)=O Amb10561758 [1,0,0,0,0,0|1,0,1]=3 350 B6R0.2 CC(C)=CC(N)=S Amb18108367 [1,0,0,0,0,0|1,1,1]=4 351 B6R0.2 CC(C)=CN(C)C Amb4017579 [1,0,0,0,0,0|3,0,0]=4 352 B6R0.2 CC(C)=C[C@@H](C)N Amb27405038 [1,0,0,0,0,0|3,0,0]=4 353 B6R0.2 CC(C)=C[N+](=O)[O-] Amb22167019 [1,0,0,0,0,0|1,0,2]=4 354 B6R0.2 CC(C)=NC(C)C Amb2689015 [1,0,0,0,0,0|3,0,0]=4 355 B6R0.2 CC(C)CB(O)O Amb2447316 [1,0,0,0,0,0|1,0,2]=4 356 B6R0.2 CC(C)CC(=N)N Amb10066934 [1,0,0,0,0,0|2,0,1]=4 357 B6R0.2 CC(C)CC(=N)N Amb2696279 [1,0,0,0,0,0|2,0,1]=4 358 B6R0.2 CC(C)CC(=O)Br Amb26486664 [1,0,0,0,0,0|1,0,1]=3 359 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [1,0,0,0,0,0|1,0,1]=3 360 B6R0.2 CC(C)CC(=O)F Amb32667643 [1,0,0,0,0,0|1,0,1]=3 361 B6R0.2 CC(C)CC(=O)O Amb3939848 [1,0,0,0,0,0|0,0,1]=2 362 B6R0.2 CC(C)CC(C)O Amb6608920 [1,0,0,0,0,0|1,0,2]=4 363 B6R0.2 CC(C)CC(N)=O Amb2722931 [1,0,0,0,0,0|1,0,1]=3 364 B6R0.2 CC(C)CC(N)=S Amb6246355 [1,0,0,0,0,0|1,1,1]=4 365 B6R0.2 CC(C)CC(N)O Amb28383510 [1,0,0,0,0,0|1,0,2]=4 366 B6R0.2 CC(C)CC(O)O Amb27207854 [1,0,0,0,0,0|0,0,3]=4 367 B6R0.2 CC(C)CN(C)O Amb33360311 [1,0,0,0,0,0|2,0,1]=4 368 B6R0.2 CC(C)CS(=O)Cl Amb26409520 [1,0,0,0,0,0|2,0,1]=4 369 B6R0.2 CC(C)CS(=O)[O-] Amb19930010 [1,0,0,0,0,0|1,0,2]=4 370 B6R0.2 CC(C)CS(C)=O Amb27972160 [1,0,0,0,0,0|2,0,1]=4 371 B6R0.2 CC(C)CS(N)=O Amb24527860 [1,0,0,0,0,0|2,0,1]=4 372 B6R0.2 CC(C)C[C@@H](C)O Amb8517525 [1,0,0,0,0,0|1,0,2]=4 373 B6R0.2 CC(C)C[C@H](C)O Amb8517526 [1,0,0,0,0,0|1,0,2]=4 374 B6R0.2 CC(C)C[N+](=O)[O-] Amb17672613 [1,0,0,0,0,0|1,0,2]=4 375 B6R0.2 CC(C)NC(=N)N Amb24271074 [1,0,0,0,0,0|3,0,0]=4 376 B6R0.2 CC(C)NC(=N)N Amb26339394 [1,0,0,0,0,0|3,0,0]=4 377 B6R0.2 CC(C)NC(=N)N Amb32410104 [1,0,0,0,0,0|3,0,0]=4 378 B6R0.2 CC(C)NC(=O)Cl Amb27780560 [1,0,0,0,0,0|2,0,0]=3 379 B6R0.2 CC(C)NC(=O)S Amb27817487 [1,0,0,0,0,0|1,1,0]=3 380 B6R0.2 CC(C)NC(N)=O Amb1104587 [1,0,0,0,0,0|2,0,0]=3 381 B6R0.2 CC(C)NC(N)=S Amb1152626 [1,0,0,0,0,0|2,1,0]=4 382 B6R0.2 CC(C)NS(C)=O Amb27777975 [1,0,0,0,0,0|3,0,0]=4 383 B6R0.2 CC(C)OB(O)O Amb28410460 [1,0,0,0,0,0|2,0,1]=4 384 B6R0.2 CC(C)OC(=O)Cl Amb3941687 [1,0,0,0,0,0|2,0,0]=3 385 B6R0.2 CC(C)OC(=S)S Amb24465791 [1,0,0,0,0,0|1,2,0]=4 386 B6R0.2 CC(C)OC(=S)[S-] Amb19748282 [1,0,0,0,0,0|1,2,0]=4 387 B6R0.2 CC(C)OC(=S)[S-] Amb534231 [1,0,0,0,0,0|1,2,0]=4 388 B6R0.2 CC(C)OC(N)=O Amb4017684 [1,0,0,0,0,0|2,0,0]=3 389 B6R0.2 CC(C)OC(N)=S Amb25732665 [1,0,0,0,0,0|2,1,0]=4 390 B6R0.2 CC(C)O[PH](=O)S Amb27447273 [1,0,0,0,0,0|2,1,0]=4 391 B6R0.2 CC(C)SC(=N)N Amb1093763 [1,0,0,0,0,0|3,0,0]=4 392 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [1,0,0,0,0,0|2,0,0]=3 393 B6R0.2 CC(Cl)CC(=O)Cl Amb28343061 [1,0,0,0,0,0|2,0,1]=4 394 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [1,0,0,0,0,0|1,0,1]=3 395 B6R0.2 CC(Cl)NC(N)=O Amb28130611 [1,0,0,0,0,0|3,0,0]=4 396 B6R0.2 CC(Cl)OC(=O)Cl Amb6608999 [1,0,0,0,0,0|3,0,0]=4 397 B6R0.2 CC(I)CC(=O)O Amb28398380 [1,0,0,0,0,0|1,0,1]=3 398 B6R0.2 CC(N)CC(=O)O Amb8379759 [1,0,0,0,0,0|1,0,1]=3 399 B6R0.2 CC(N)CC(=O)S Amb27413857 [1,0,0,0,0,0|1,1,1]=4 400 B6R0.2 CC(N)CC(N)=O Amb18281237 [1,0,0,0,0,0|2,0,1]=4 401 B6R0.2 CC(N)CC(N)=O Amb33532770 [1,0,0,0,0,0|2,0,1]=4 402 B6R0.2 CC(O)CC(=O)O Amb8513187 [1,0,0,0,0,0|1,0,1]=3 403 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [1,0,0,0,0,0|1,0,2]=4 404 B6R0.2 CC(O)CC(N)=O Amb26394320 [1,0,0,0,0,0|2,0,1]=4 405 B6R0.2 CC(S)CC(=O)O Amb33538201 [1,0,0,0,0,0|1,0,1]=3 406 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [1,0,0,0,0,0|2,0,1]=4 407 B6R0.2 CN(C)CC(=O)Cl Amb3939582 [1,0,0,0,0,0|2,0,1]=4 408 B6R0.2 CN(C)CC(=O)O Amb3319051 [1,0,0,0,0,0|1,0,1]=3 409 B6R0.2 CN(C)CC(=O)O Amb3940366 [1,0,0,0,0,0|1,0,1]=3 410 B6R0.2 CN(C)CC(N)=O Amb17231806 [1,0,0,0,0,0|2,0,1]=4 411 B6R0.2 CN(C)CC(N)=O Amb33321491 [1,0,0,0,0,0|2,0,1]=4 412 B6R0.2 CN(C)NC(=O)Cl Amb35637051 [1,0,0,0,0,0|3,0,0]=4 413 B6R0.2 CN(C)NC(N)=O Amb24325231 [1,0,0,0,0,0|3,0,0]=4 414 B6R0.2 CN(N)CC(=O)O Amb23592296 [1,0,0,0,0,0|2,0,1]=4 415 B6R0.2 CN(O)CC(=O)O Amb29838290 [1,0,0,0,0,0|2,0,1]=4 416 B6R0.2 CS(C)=NC(N)=O Amb27837994 [1,0,0,0,0,0|3,0,0]=4 417 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [1,0,0,0,0,0|1,0,1]=3 418 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [1,0,0,0,0,0|1,0,1]=3 419 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [1,0,0,0,0,0|1,0,1]=3 420 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [1,0,0,0,0,0|1,0,1]=3 421 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [1,0,0,0,0,0|1,0,1]=3 422 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [1,0,0,0,0,0|1,0,2]=4 423 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [1,0,0,0,0,0|1,0,1]=3 424 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [1,0,0,0,0,0|1,0,1]=3 425 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [1,0,0,0,0,0|1,0,1]=3 426 B6R0.2 C[C@H](N)CC(N)=O Amb27873963 [1,0,0,0,0,0|2,0,1]=4 427 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [1,0,0,0,0,0|1,0,1]=3 428 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [1,0,0,0,0,0|2,0,1]=4 429 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [1,0,0,0,0,0|1,0,1]=3 430 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [1,0,0,0,0,0|1,0,1]=3 431 B6R0.2 C[S+](C)CC(=O)[O-] Amb26065720 [1,0,0,0,0,0|1,0,2]=4 432 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [1,0,0,0,0,0|1,0,1]=3 433 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [1,0,0,0,0,0|1,0,1]=3 434 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [1,0,0,0,0,0|1,0,1]=3 435 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [1,0,0,0,0,0|1,0,1]=3 436 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [1,0,0,0,0,0|1,0,1]=3 437 B6R0.2 C\C(I)=C\C(N)=O Amb28058366 [1,0,0,0,0,0|2,0,1]=4 438 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [1,0,0,0,0,0|1,0,1]=3 439 B6R0.2 C\C(N)=C/C(N)=O Amb26600164 [1,0,0,0,0,0|2,0,1]=4 440 B6R0.2 C\C(S)=C\C(N)=O Amb27596108 [1,0,0,0,0,0|2,0,1]=4 441 B6R0.2 NC(N)=CC(=O)O Amb27618962 [1,0,0,0,0,0|2,0,1]=4 442 B6R0.2 NC(S)CC(=O)O Amb27391244 [1,0,0,0,0,0|2,0,1]=4 443 B6R0.2 O=C(O)C=C(Br)Br Amb24435008 [1,0,0,0,0,0|2,0,1]=4 444 B6R0.2 O=C(O)C=C(Cl)Cl Amb33544334 [1,0,0,0,0,0|2,0,1]=4 445 B6R0.2 O=C(O)C=C(F)F Amb24116995 [1,0,0,0,0,0|2,0,1]=4 446 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [1,0,0,0,0,0|2,0,1]=4 447 B6R0.2 O=C(O)CC(F)F Amb22001551 [1,0,0,0,0,0|2,0,1]=4 448 B6R0.2 O=C(O)\C=C(\Cl)Br Amb27955839 [1,0,0,0,0,0|2,0,1]=4 449 B6R0.3 C#CC(=O)C(C)N Amb28059314 [1,0,0,0,0,0|2,0,1]=4 450 B6R0.3 C#CC(=O)N(C)C Amb27868758 [1,0,0,0,0,0|2,0,1]=4 451 B6R0.3 C#CC(=O)[C@@H](C)N Amb30024725 [1,0,0,0,0,0|2,0,1]=4 452 B6R0.3 C#CC(=O)[C@H](C)N Amb29849487 [1,0,0,0,0,0|2,0,1]=4 453 B6R0.3 C=C(Br)C(=O)CC Amb24406631 [1,0,0,0,0,0|2,0,0]=3 454 B6R0.3 C=C(Br)C(=O)NC Amb28050278 [1,0,0,0,0,0|3,0,0]=4 455 B6R0.3 C=C(Br)C(=O)OC Amb20621565 [1,0,0,0,0,0|3,0,0]=4 456 B6R0.3 C=C(C#N)C(=O)O Amb18638894 [1,0,0,0,0,0|2,0,1]=4 457 B6R0.3 C=C(C#N)C(C)C Amb27627134 [1,0,0,0,0,0|2,0,1]=4 458 B6R0.3 C=C(C)C(=O)CC Amb27486383 [1,0,0,0,0,0|2,0,0]=3 459 B6R0.3 C=C(C)C(=O)CCl Amb33261651 [1,0,0,0,0,0|3,0,0]=4 460 B6R0.3 C=C(C)C(=O)CN Amb27150262 [1,0,0,0,0,0|3,0,0]=4 461 B6R0.3 C=C(C)C(=O)NC Amb17934099 [1,0,0,0,0,0|3,0,0]=4 462 B6R0.3 C=C(C)C(=O)OC Amb6608784 [1,0,0,0,0,0|3,0,0]=4 463 B6R0.3 C=C(C=O)C(C)C Amb18639179 [1,0,0,0,0,0|1,0,0]=2 464 B6R0.3 C=C(C=O)C(C)O Amb28050261 [1,0,0,0,0,0|2,0,0]=3 465 B6R0.3 C=C(C=O)N(C)C Amb27838248 [1,0,0,0,0,0|2,0,0]=3 466 B6R0.3 C=C(CBr)C(=O)O Amb6296612 [1,0,0,0,0,0|2,0,0]=3 467 B6R0.3 C=C(CBr)C(C)C Amb27650582 [1,0,0,0,0,0|2,0,1]=4 468 B6R0.3 C=C(CC)B(O)O Amb25888548 [1,0,0,0,0,0|2,0,1]=4 469 B6R0.3 C=C(CC)C(=O)Cl Amb22353554 [1,0,0,0,0,0|2,0,0]=3 470 B6R0.3 C=C(CC)C(=O)O Amb18639591 [1,0,0,0,0,0|1,0,0]=2 471 B6R0.3 C=C(CCl)C(=O)Cl Amb28340919 [1,0,0,0,0,0|3,0,0]=4 472 B6R0.3 C=C(CCl)C(=O)O Amb27851591 [1,0,0,0,0,0|2,0,0]=3 473 B6R0.3 C=C(CCl)C(C)C Amb26887803 [1,0,0,0,0,0|2,0,1]=4 474 B6R0.3 C=C(CN)C(C)C Amb25302981 [1,0,0,0,0,0|2,0,1]=4 475 B6R0.3 C=C(CO)C(=O)O Amb18121817 [1,0,0,0,0,0|2,0,0]=3 476 B6R0.3 C=C(CO)C(C)=O Amb24571845 [1,0,0,0,0,0|3,0,0]=4 477 B6R0.3 C=C(CS)C(=O)O Amb27263242 [1,0,0,0,0,0|2,0,0]=3 478 B6R0.3 C=C(Cl)C(=O)OC Amb8516698 [1,0,0,0,0,0|3,0,0]=4 479 B6R0.3 C=C(F)C(=O)CC Amb28317966 [1,0,0,0,0,0|2,0,0]=3 480 B6R0.3 C=C(F)C(=O)OC Amb10605555 [1,0,0,0,0,0|3,0,0]=4 481 B6R0.3 C=C(OC)C(=O)O Amb18639906 [1,0,0,0,0,0|2,0,0]=3 482 B6R0.3 C=C(OC)C(C)=O Amb28126662 [1,0,0,0,0,0|3,0,0]=4 483 B6R0.3 C=C(SC)C(=O)O Amb27882690 [1,0,0,0,0,0|2,0,0]=3 484 B6R0.3 C=C(SS)C(=O)O Amb27593809 [1,0,0,0,0,0|3,0,0]=4 485 B6R0.3 C=C=C(C)C(=O)O Amb17593066 [1,0,0,0,0,0|1,0,2]=4 486 B6R0.3 C=CC(=C)C(=O)O Amb24394371 [1,0,0,0,0,0|1,0,2]=4 487 B6R0.3 C=CC(=C)[C@@H](C)O Amb27196639 [1,0,0,0,0,0|3,0,0]=4 488 B6R0.3 C=CC(=O)C(=C)C Amb26842538 [1,0,0,0,0,0|1,0,2]=4 489 B6R0.3 C=CC(=O)C(C)C Amb24507596 [1,0,0,0,0,0|1,0,0]=2 490 B6R0.3 C=CC(=O)C(C)O Amb27660466 [1,0,0,0,0,0|2,0,0]=3 491 B6R0.3 C=CC(=O)C(F)F Amb25694492 [1,0,0,0,0,0|3,0,0]=4 492 B6R0.3 C=CC(=O)N(C)C Amb2721141 [1,0,0,0,0,0|2,0,0]=3 493 B6R0.3 C=CC(=O)[C@@H](C)N Amb30024726 [1,0,0,0,0,0|2,0,0]=3 494 B6R0.3 C=CC(=O)[C@@H](C)O Amb27838249 [1,0,0,0,0,0|2,0,0]=3 495 B6R0.3 C=CC(=O)[C@H](C)N Amb35617895 [1,0,0,0,0,0|2,0,0]=3 496 B6R0.3 C=CC(Br)C(C)C Amb27483981 [1,0,0,0,0,0|2,0,1]=4 497 B6R0.3 C=CC(C)=C(C)C Amb28457266 [1,0,0,0,0,0|2,0,1]=4 498 B6R0.3 C=CC(C)C(C)C Amb4019534 [1,0,0,0,0,0|2,0,1]=4 499 B6R0.3 C=CC(N)C(C)C Amb23536604 [1,0,0,0,0,0|2,0,1]=4 500 B6R0.3 C=CC(O)C(C)C Amb22346222 [1,0,0,0,0,0|1,0,2]=4 501 B6R0.3 C=C[C@@H](O)C(C)C Amb27780531 [1,0,0,0,0,0|1,0,2]=4 502 B6R0.3 CC(=O)C(=O)CBr Amb17506257 [1,0,0,0,0,0|2,0,0]=3 503 B6R0.3 CC(=O)C(=O)CCl Amb17506258 [1,0,0,0,0,0|2,0,0]=3 504 B6R0.3 CC(=O)C(=O)NO Amb26477907 [1,0,0,0,0,0|2,0,1]=4 505 B6R0.3 CC(=O)C(=O)O[Na] Amb18511533 [1,0,0,0,0,0|3,0,0]=4 506 B6R0.3 CC(=O)\C(Br)=C\O Amb17232510 [1,0,0,0,0,0|2,0,1]=4 507 B6R0.3 CC(=O)\C(Cl)=C\O Amb27854622 [1,0,0,0,0,0|2,0,1]=4 508 B6R0.3 CC(Br)C(=O)CBr Amb27796264 [1,0,0,0,0,0|2,0,1]=4 509 B6R0.3 CC(Br)C(Br)C=O Amb27594756 [1,0,0,0,0,0|2,0,1]=4 510 B6R0.3 CC(C)=C(Br)C=O Amb18645747 [1,0,0,0,0,0|1,0,1]=3 511 B6R0.3 CC(C)=C(Br)CO Amb24370439 [1,0,0,0,0,0|1,0,2]=4 512 B6R0.3 CC(C)=C(C)CO Amb25107300 [1,0,0,0,0,0|1,0,2]=4 513 B6R0.3 CC(C)=C(Cl)C=O Amb18640665 [1,0,0,0,0,0|1,0,1]=3 514 B6R0.3 CC(C)=C(F)C=O Amb27964539 [1,0,0,0,0,0|1,0,1]=3 515 B6R0.3 CC(C)=C(F)CO Amb22546803 [1,0,0,0,0,0|1,0,2]=4 516 B6R0.3 CC(C)C(=N)NN Amb22411381 [1,0,0,0,0,0|3,0,0]=4 517 B6R0.3 CC(C)C(=O)C#N Amb17231802 [1,0,0,0,0,0|1,0,1]=3 518 B6R0.3 CC(C)C(=O)C=O Amb28050041 [1,0,0,0,0,0|0,0,0]=1 519 B6R0.3 CC(C)C(=O)CBr Amb17594092 [1,0,0,0,0,0|1,0,1]=3 520 B6R0.3 CC(C)C(=O)CCl Amb33545057 [1,0,0,0,0,0|1,0,1]=3 521 B6R0.3 CC(C)C(=O)CI Amb27423490 [1,0,0,0,0,0|1,0,1]=3 522 B6R0.3 CC(C)C(=O)CN Amb18639716 [1,0,0,0,0,0|1,0,1]=3 523 B6R0.3 CC(C)C(=O)CN Amb19515068 [1,0,0,0,0,0|1,0,1]=3 524 B6R0.3 CC(C)C(=O)CO Amb18061654 [1,0,0,0,0,0|0,0,1]=2 525 B6R0.3 CC(C)C(=O)NN Amb6365574 [1,0,0,0,0,0|2,0,0]=3 526 B6R0.3 CC(C)C(=O)NO Amb6279610 [1,0,0,0,0,0|1,0,0]=2 527 B6R0.3 CC(C)C(=O)ON Amb28247467 [1,0,0,0,0,0|2,0,0]=3 528 B6R0.3 CC(C)C(Br)C=O Amb17594091 [1,0,0,0,0,0|1,0,1]=3 529 B6R0.3 CC(C)C(Br)CO Amb27776750 [1,0,0,0,0,0|1,0,2]=4 530 B6R0.3 CC(C)C(C)C=O Amb17593082 [1,0,0,0,0,0|1,0,1]=3 531 B6R0.3 CC(C)C(C)CO Amb26452810 [1,0,0,0,0,0|1,0,2]=4 532 B6R0.3 CC(C)C(Cl)C=O Amb18123761 [1,0,0,0,0,0|1,0,1]=3 533 B6R0.3 CC(C)C(F)C=O Amb27421552 [1,0,0,0,0,0|1,0,1]=3 534 B6R0.3 CC(C)C(N)CO Amb3939350 [1,0,0,0,0,0|1,0,2]=4 535 B6R0.3 CC(C)C(O)C=O Amb17593092 [1,0,0,0,0,0|0,0,2]=3 536 B6R0.3 CC(C)C(O)CO Amb27148682 [1,0,0,0,0,0|0,0,3]=4 537 B6R0.3 CC(C)C(S)CO Amb25809908 [1,0,0,0,0,0|0,1,2]=4 538 B6R0.3 CC(C)N(C)C=O Amb33547758 [1,0,0,0,0,0|2,0,0]=3 539 B6R0.3 CC(C)N(C)N=O Amb33035919 [1,0,0,0,0,0|3,0,0]=4 540 B6R0.3 CC(C)S(=O)NN Amb28195239 [1,0,0,0,0,0|3,0,0]=4 541 B6R0.3 CC(C)[C@@H](C)C=O Amb27224855 [1,0,0,0,0,0|1,0,1]=3 542 B6R0.3 CC(C)[C@@H](C)CO Amb17613247 [1,0,0,0,0,0|1,0,2]=4 543 B6R0.3 CC(C)[C@@H](C)NO Amb27641375 [1,0,0,0,0,0|2,0,1]=4 544 B6R0.3 CC(C)[C@@H](N)C=O Amb28292701 [1,0,0,0,0,0|1,0,1]=3 545 B6R0.3 CC(C)[C@@H](N)CO Amb3939342 [1,0,0,0,0,0|1,0,2]=4 546 B6R0.3 CC(C)[C@H](Br)CO Amb27760382 [1,0,0,0,0,0|1,0,2]=4 547 B6R0.3 CC(C)[C@H](C)C=O Amb27635299 [1,0,0,0,0,0|1,0,1]=3 548 B6R0.3 CC(C)[C@H](C)CO Amb24332267 [1,0,0,0,0,0|1,0,2]=4 549 B6R0.3 CC(C)[C@H](Cl)CO Amb27488685 [1,0,0,0,0,0|1,0,2]=4 550 B6R0.3 CC(C)[C@H](N)CO Amb2785298 [1,0,0,0,0,0|1,0,2]=4 551 B6R0.3 CC(C)\C(Cl)=C\Cl Amb27419919 [1,0,0,0,0,0|2,0,0]=3 552 B6R0.3 CC(C)\C(Cl)=N\O Amb25345474 [1,0,0,0,0,0|2,0,0]=3 553 B6R0.3 CC(C)\C(N)=N\N Amb17933174 [1,0,0,0,0,0|3,0,0]=4 554 B6R0.3 CC(C)\C(N)=N\O Amb2695033 [1,0,0,0,0,0|2,0,0]=3 555 B6R0.3 CC(CBr)C(=O)O Amb22002601 [1,0,0,0,0,0|2,0,1]=4 556 B6R0.3 CC(CCl)C(=O)O Amb18522181 [1,0,0,0,0,0|2,0,1]=4 557 B6R0.3 CC(CF)C(=O)O Amb24432331 [1,0,0,0,0,0|2,0,1]=4 558 B6R0.3 CC(CN)C(=O)O Amb2699128 [1,0,0,0,0,0|2,0,1]=4 559 B6R0.3 CC(CN)C(=O)O Amb6773978 [1,0,0,0,0,0|2,0,1]=4 560 B6R0.3 CC(CN)C(=O)O Amb8631418 [1,0,0,0,0,0|2,0,1]=4 561 B6R0.3 CC(CO)C(=O)O Amb8011522 [1,0,0,0,0,0|2,0,1]=4 562 B6R0.3 CC(Cl)C(=O)CCl Amb27146929 [1,0,0,0,0,0|2,0,1]=4 563 B6R0.3 CC(Cl)C(=O)CO Amb27409066 [1,0,0,0,0,0|1,0,1]=3 564 B6R0.3 CC(Cl)C(=O)NCl Amb28137961 [1,0,0,0,0,0|3,0,0]=4 565 B6R0.3 CC(Cl)C(=O)NN Amb25087323 [1,0,0,0,0,0|3,0,0]=4 566 B6R0.3 CC(Cl)C(=O)OF Amb27863393 [1,0,0,0,0,0|3,0,0]=4 567 B6R0.3 CC(Cl)C(O)C=O Amb27848371 [1,0,0,0,0,0|1,0,2]=4 568 B6R0.3 CC(Cl)\C(N)=N/O Amb2696029 [1,0,0,0,0,0|3,0,0]=4 569 B6R0.3 CC(N)C(=O)C#N Amb28075473 [1,0,0,0,0,0|2,0,1]=4 570 B6R0.3 CC(N)C(=O)CCl Amb25867299 [1,0,0,0,0,0|2,0,1]=4 571 B6R0.3 CC(N)C(=O)CCl Amb32662937 [1,0,0,0,0,0|2,0,1]=4 572 B6R0.3 CC(N)C(=O)CF Amb27493214 [1,0,0,0,0,0|2,0,1]=4 573 B6R0.3 CC(N)C(=O)N=S Amb27844643 [1,0,0,0,0,0|2,1,0]=4 574 B6R0.3 CC(N)C(=O)NN Amb18061963 [1,0,0,0,0,0|3,0,0]=4 575 B6R0.3 CC(N)C(=O)NO Amb33528158 [1,0,0,0,0,0|2,0,0]=3 576 B6R0.3 CC(N)C(O)C=O Amb28133361 [1,0,0,0,0,0|1,0,2]=4 577 B6R0.3 CC(N)\C(N)=N\O Amb25144101 [1,0,0,0,0,0|3,0,0]=4 578 B6R0.3 CC(O)C(=N)NO Amb19516866 [1,0,0,0,0,0|3,0,0]=4 579 B6R0.3 CC(O)C(=O)C=O Amb28287297 [1,0,0,0,0,0|1,0,0]=2 580 B6R0.3 CC(O)C(=O)CCl Amb27814891 [1,0,0,0,0,0|2,0,1]=4 581 B6R0.3 CC(O)C(=O)NN Amb2720766 [1,0,0,0,0,0|3,0,0]=4 582 B6R0.3 CC(O)C(=O)O[Na] Amb22051686 [1,0,0,0,0,0|3,0,0]=4 583 B6R0.3 CC(O)C(Cl)C=O Amb28121057 [1,0,0,0,0,0|2,0,1]=4 584 B6R0.3 CC(O)N(C)C=O Amb27191911 [1,0,0,0,0,0|3,0,0]=4 585 B6R0.3 CC(O)\C(F)=C\F Amb27844479 [1,0,0,0,0,0|3,0,0]=4 586 B6R0.3 CC(O)\C(N)=N\O Amb8384662 [1,0,0,0,0,0|3,0,0]=4 587 B6R0.3 CC(S)C(C)C=O Amb27838214 [1,0,0,0,0,0|2,0,1]=4 588 B6R0.3 CCC(=O)C(=O)Cl Amb27838251 [1,0,0,0,0,0|1,0,0]=2 589 B6R0.3 CCC(=O)C(=O)O Amb3940359 [1,0,0,0,0,0|0,0,0]=1 590 B6R0.3 CCC(=O)C(=O)[O-] Amb9825450 [1,0,0,0,0,0|0,0,1]=2 591 B6R0.3 CCC(=O)C(C)=O Amb8514604 [1,0,0,0,0,0|1,0,0]=2 592 B6R0.3 CCC(=O)C(C)Br Amb6673862 [1,0,0,0,0,0|2,0,1]=4 593 B6R0.3 CCC(=O)C(C)C Amb9024469 [1,0,0,0,0,0|1,0,1]=3 594 B6R0.3 CCC(=O)C(C)Cl Amb24093630 [1,0,0,0,0,0|2,0,1]=4 595 B6R0.3 CCC(=O)C(C)F Amb27838229 [1,0,0,0,0,0|2,0,1]=4 596 B6R0.3 CCC(=O)C(C)N Amb17938952 [1,0,0,0,0,0|2,0,1]=4 597 B6R0.3 CCC(=O)C(C)N Amb32410105 [1,0,0,0,0,0|2,0,1]=4 598 B6R0.3 CCC(=O)C(C)O Amb24479536 [1,0,0,0,0,0|1,0,1]=3 599 B6R0.3 CCC(=O)C(C)S Amb24323793 [1,0,0,0,0,0|1,1,1]=4 600 B6R0.3 CCC(=O)C(Cl)Cl Amb17593561 [1,0,0,0,0,0|2,0,1]=4 601 B6R0.3 CCC(=O)C(N)=O Amb22011827 [1,0,0,0,0,0|1,0,0]=2 602 B6R0.3 CCC(=O)N(C)C Amb3886532 [1,0,0,0,0,0|2,0,1]=4 603 B6R0.3 CCC(=O)N(C)N Amb25711736 [1,0,0,0,0,0|3,0,0]=4 604 B6R0.3 CCC(=O)[C@@H](C)N Amb30024727 [1,0,0,0,0,0|2,0,1]=4 605 B6R0.3 CCC(=O)[C@@H](C)O Amb27835613 [1,0,0,0,0,0|1,0,1]=3 606 B6R0.3 CCC(=O)[C@H](C)N Amb35617896 [1,0,0,0,0,0|2,0,1]=4 607 B6R0.3 CCC(=O)[C@H](C)O Amb28201619 [1,0,0,0,0,0|1,0,1]=3 608 B6R0.3 CCC(=S)C(=O)O Amb27872099 [1,0,0,0,0,0|0,1,0]=2 609 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [1,0,0,0,0,0|2,0,1]=4 610 B6R0.3 CCC(Br)C(=O)Cl Amb17666758 [1,0,0,0,0,0|2,0,1]=4 611 B6R0.3 CCC(Br)C(=O)O Amb5716858 [1,0,0,0,0,0|1,0,1]=3 612 B6R0.3 CCC(Br)C(C)=O Amb24615269 [1,0,0,0,0,0|2,0,1]=4 613 B6R0.3 CCC(Br)C(N)=O Amb13952819 [1,0,0,0,0,0|2,0,1]=4 614 B6R0.3 CCC(C)=C(C)C Amb4017694 [1,0,0,0,0,0|3,0,0]=4 615 B6R0.3 CCC(C)C(=O)Cl Amb3939259 [1,0,0,0,0,0|2,0,1]=4 616 B6R0.3 CCC(C)C(=O)O Amb9703224 [1,0,0,0,0,0|1,0,1]=3 617 B6R0.3 CCC(C)C(C)=O Amb4605996 [1,0,0,0,0,0|2,0,1]=4 618 B6R0.3 CCC(C)C(N)=O Amb33548100 [1,0,0,0,0,0|2,0,1]=4 619 B6R0.3 CCC(Cl)=C(Cl)Cl Amb27421317 [1,0,0,0,0,0|3,0,0]=4 620 B6R0.3 CCC(Cl)C(=O)Br Amb28384077 [1,0,0,0,0,0|2,0,1]=4 621 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [1,0,0,0,0,0|2,0,1]=4 622 B6R0.3 CCC(Cl)C(=O)O Amb4017887 [1,0,0,0,0,0|1,0,1]=3 623 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [1,0,0,0,0,0|2,0,1]=4 624 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [1,0,0,0,0,0|2,0,1]=4 625 B6R0.3 CCC(F)=C(F)F Amb10840895 [1,0,0,0,0,0|3,0,0]=4 626 B6R0.3 CCC(F)C(=O)O Amb25716167 [1,0,0,0,0,0|1,0,1]=3 627 B6R0.3 CCC(N)C(=O)Cl Amb17593240 [1,0,0,0,0,0|2,0,1]=4 628 B6R0.3 CCC(N)C(=O)O Amb9729506 [1,0,0,0,0,0|1,0,1]=3 629 B6R0.3 CCC(N)C(N)=O Amb1914080 [1,0,0,0,0,0|2,0,1]=4 630 B6R0.3 CCC(N)C(N)=O Amb33528521 [1,0,0,0,0,0|2,0,1]=4 631 B6R0.3 CCC(O)C(=O)O Amb6609018 [1,0,0,0,0,0|0,0,2]=3 632 B6R0.3 CCC(O)C(=O)[O-] Amb17943026 [1,0,0,0,0,0|0,0,3]=4 633 B6R0.3 CCC(O)C(C)=O Amb25336501 [1,0,0,0,0,0|1,0,2]=4 634 B6R0.3 CCC(O)C(N)=O Amb24116514 [1,0,0,0,0,0|1,0,2]=4 635 B6R0.3 CCC(S)C(=O)O Amb17501370 [1,0,0,0,0,0|0,1,1]=3 636 B6R0.3 CCC(S)C(C)=O Amb8393170 [1,0,0,0,0,0|1,1,1]=4 637 B6R0.3 CCN(C)C(=O)Cl Amb8390927 [1,0,0,0,0,0|3,0,0]=4 638 B6R0.3 CCN(C)C(C)=O Amb22753516 [1,0,0,0,0,0|3,0,0]=4 639 B6R0.3 CCN(N)C(C)=O Amb18639976 [1,0,0,0,0,0|3,0,0]=4 640 B6R0.3 CCN(N)C(N)=O Amb28184355 [1,0,0,0,0,0|3,0,0]=4 641 B6R0.3 CCN(O)C(C)=O Amb27652499 [1,0,0,0,0,0|2,0,1]=4 642 B6R0.3 CC[C@@H](Br)C(=O)O Amb9785161 [1,0,0,0,0,0|1,0,1]=3 643 B6R0.3 CC[C@@H](C)C(=O)O Amb8384578 [1,0,0,0,0,0|1,0,1]=3 644 B6R0.3 CC[C@@H](C)C(C)=O Amb28283799 [1,0,0,0,0,0|2,0,1]=4 645 B6R0.3 CC[C@@H](Cl)C(=O)Cl Amb27985877 [1,0,0,0,0,0|2,0,1]=4 646 B6R0.3 CC[C@@H](Cl)C(=O)O Amb22800493 [1,0,0,0,0,0|1,0,1]=3 647 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [1,0,0,0,0,0|2,0,1]=4 648 B6R0.3 CC[C@@H](N)C(=O)O Amb16233349 [1,0,0,0,0,0|1,0,1]=3 649 B6R0.3 CC[C@@H](N)C(=O)O Amb3940761 [1,0,0,0,0,0|1,0,1]=3 650 B6R0.3 CC[C@@H](N)C(C)=O Amb35594875 [1,0,0,0,0,0|2,0,1]=4 651 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [1,0,0,0,0,0|2,0,1]=4 652 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [1,0,0,0,0,0|2,0,1]=4 653 B6R0.3 CC[C@@H](O)C(=O)O Amb22369401 [1,0,0,0,0,0|0,0,2]=3 654 B6R0.3 CC[C@@H](O)C(N)=O Amb27792606 [1,0,0,0,0,0|1,0,2]=4 655 B6R0.3 CC[C@H](Br)C(=O)O Amb20242441 [1,0,0,0,0,0|1,0,1]=3 656 B6R0.3 CC[C@H](C)C(=O)Cl Amb26463969 [1,0,0,0,0,0|2,0,1]=4 657 B6R0.3 CC[C@H](C)C(=O)O Amb8514667 [1,0,0,0,0,0|1,0,1]=3 658 B6R0.3 CC[C@H](C)C(N)=O Amb27440802 [1,0,0,0,0,0|2,0,1]=4 659 B6R0.3 CC[C@H](Cl)C(=O)O Amb25190040 [1,0,0,0,0,0|1,0,1]=3 660 B6R0.3 CC[C@H](N)C(=O)O Amb2694208 [1,0,0,0,0,0|1,0,1]=3 661 B6R0.3 CC[C@H](N)C(=O)O Amb8631089 [1,0,0,0,0,0|1,0,1]=3 662 B6R0.3 CC[C@H](N)C(C)=O Amb29849605 [1,0,0,0,0,0|2,0,1]=4 663 B6R0.3 CC[C@H](N)C(N)=O Amb8387112 [1,0,0,0,0,0|2,0,1]=4 664 B6R0.3 CC[C@H](N)C(N)=O Amb8395789 [1,0,0,0,0,0|2,0,1]=4 665 B6R0.3 CC[C@H](O)C(=O)O Amb4166324 [1,0,0,0,0,0|0,0,2]=3 666 B6R0.3 CC[C@H](S)C(=O)O Amb9785162 [1,0,0,0,0,0|0,1,1]=3 667 B6R0.3 CN(C)C(=N)CO Amb23514996 [1,0,0,0,0,0|2,0,1]=4 668 B6R0.3 CN(C)C(=O)C#N Amb27391156 [1,0,0,0,0,0|2,0,1]=4 669 B6R0.3 CN(C)C(=O)CBr Amb19651563 [1,0,0,0,0,0|2,0,1]=4 670 B6R0.3 CN(C)C(=O)CCl Amb1153201 [1,0,0,0,0,0|2,0,1]=4 671 B6R0.3 CN(C)C(=O)CI Amb22235219 [1,0,0,0,0,0|2,0,1]=4 672 B6R0.3 CN(C)C(=O)CN Amb1106043 [1,0,0,0,0,0|2,0,1]=4 673 B6R0.3 CN(C)C(=O)CN Amb22757079 [1,0,0,0,0,0|2,0,1]=4 674 B6R0.3 CN(C)C(=O)CN Amb2786619 [1,0,0,0,0,0|2,0,1]=4 675 B6R0.3 CN(C)C(=O)CO Amb9421414 [1,0,0,0,0,0|1,0,1]=3 676 B6R0.3 CN(C)C(=O)CS Amb33548707 [1,0,0,0,0,0|1,1,1]=4 677 B6R0.3 CN(C)C(=O)NN Amb8854108 [1,0,0,0,0,0|3,0,0]=4 678 B6R0.3 CN(C)C(=O)NO Amb32667951 [1,0,0,0,0,0|2,0,0]=3 679 B6R0.3 CN(C)N(C)C=O Amb5719950 [1,0,0,0,0,0|3,0,0]=4 680 B6R0.3 CN(C)\C(N)=N/O Amb2694851 [1,0,0,0,0,0|3,0,0]=4 681 B6R0.3 CN(C)\C(N)=N\O Amb20669378 [1,0,0,0,0,0|3,0,0]=4 682 B6R0.3 CN(N)C(=O)NO Amb28239328 [1,0,0,0,0,0|3,0,0]=4 683 B6R0.3 CN(O)C(=O)CCl Amb27865720 [1,0,0,0,0,0|3,0,0]=4 684 B6R0.3 CN(O)C(=O)CN Amb27593581 [1,0,0,0,0,0|3,0,0]=4 685 B6R0.3 CN(O)C(=O)CN Amb33250369 [1,0,0,0,0,0|3,0,0]=4 686 B6R0.3 CNC(=N)C(C)C Amb27254368 [1,0,0,0,0,0|3,0,0]=4 687 B6R0.3 CNC(=O)C(=O)O Amb2691295 [1,0,0,0,0,0|1,0,0]=2 688 B6R0.3 CNC(=O)C(C)=O Amb17399787 [1,0,0,0,0,0|2,0,0]=3 689 B6R0.3 CNC(=O)C(C)Br Amb33544599 [1,0,0,0,0,0|3,0,0]=4 690 B6R0.3 CNC(=O)C(C)C Amb3886530 [1,0,0,0,0,0|2,0,0]=3 691 B6R0.3 CNC(=O)C(C)Cl Amb9745747 [1,0,0,0,0,0|3,0,0]=4 692 B6R0.3 CNC(=O)C(C)N Amb21958662 [1,0,0,0,0,0|3,0,0]=4 693 B6R0.3 CNC(=O)C(C)N Amb9718190 [1,0,0,0,0,0|3,0,0]=4 694 B6R0.3 CNC(=O)C(C)O Amb9421389 [1,0,0,0,0,0|2,0,1]=4 695 B6R0.3 CNC(=O)C(N)=S Amb27866513 [1,0,0,0,0,0|2,1,0]=4 696 B6R0.3 CNC(=O)N(C)C Amb4020935 [1,0,0,0,0,0|3,0,0]=4 697 B6R0.3 CNC(=O)N(C)O Amb27169733 [1,0,0,0,0,0|3,0,0]=4 698 B6R0.3 CNC(=O)[C@@H](C)N Amb18538471 [1,0,0,0,0,0|3,0,0]=4 699 B6R0.3 CNC(=O)[C@@H](C)N Amb22744991 [1,0,0,0,0,0|3,0,0]=4 700 B6R0.3 CNC(=O)[C@@H](C)O Amb27206795 [1,0,0,0,0,0|2,0,1]=4 701 B6R0.3 CNC(=O)[C@H](C)N Amb10606813 [1,0,0,0,0,0|3,0,0]=4 702 B6R0.3 CNC(=O)[C@H](C)N Amb10876424 [1,0,0,0,0,0|3,0,0]=4 703 B6R0.3 CNC(=O)[C@H](C)O Amb27458528 [1,0,0,0,0,0|2,0,1]=4 704 B6R0.3 CNC(C)C(=O)O Amb19373699 [1,0,0,0,0,0|2,0,1]=4 705 B6R0.3 CNC(C)C(=O)O Amb9271766 [1,0,0,0,0,0|2,0,1]=4 706 B6R0.3 CNC(O)C(=O)O Amb27229907 [1,0,0,0,0,0|1,0,2]=4 707 B6R0.3 CN[C@@H](C)C(=O)O Amb16233347 [1,0,0,0,0,0|2,0,1]=4 708 B6R0.3 CN[C@@H](C)C(=O)O Amb16233348 [1,0,0,0,0,0|2,0,1]=4 709 B6R0.3 CN[C@H](C)C(=O)O Amb10844859 [1,0,0,0,0,0|2,0,1]=4 710 B6R0.3 COC(=N)C(C)C Amb17673177 [1,0,0,0,0,0|3,0,0]=4 711 B6R0.3 COC(=N)C(C)C Amb6295825 [1,0,0,0,0,0|3,0,0]=4 712 B6R0.3 COC(=O)C(=N)N Amb24708486 [1,0,0,0,0,0|3,0,0]=4 713 B6R0.3 COC(=O)C(=N)N Amb8630730 [1,0,0,0,0,0|3,0,0]=4 714 B6R0.3 COC(=O)C(=O)Cl Amb3940234 [1,0,0,0,0,0|2,0,0]=3 715 B6R0.3 COC(=O)C(=O)O Amb33545007 [1,0,0,0,0,0|1,0,0]=2 716 B6R0.3 COC(=O)C(=O)[O-] Amb22058088 [1,0,0,0,0,0|1,0,1]=3 717 B6R0.3 COC(=O)C(=O)[O-] Amb22411428 [1,0,0,0,0,0|1,0,1]=3 718 B6R0.3 COC(=O)C(C)=O Amb8513262 [1,0,0,0,0,0|2,0,0]=3 719 B6R0.3 COC(=O)C(C)Br Amb3939969 [1,0,0,0,0,0|3,0,0]=4 720 B6R0.3 COC(=O)C(C)C Amb8513617 [1,0,0,0,0,0|2,0,0]=3 721 B6R0.3 COC(=O)C(C)Cl Amb9702790 [1,0,0,0,0,0|3,0,0]=4 722 B6R0.3 COC(=O)C(C)F Amb20671153 [1,0,0,0,0,0|3,0,0]=4 723 B6R0.3 COC(=O)C(C)N Amb22492644 [1,0,0,0,0,0|3,0,0]=4 724 B6R0.3 COC(=O)C(C)N Amb2684294 [1,0,0,0,0,0|3,0,0]=4 725 B6R0.3 COC(=O)C(C)N Amb399617 [1,0,0,0,0,0|3,0,0]=4 726 B6R0.3 COC(=O)C(C)O Amb8516704 [1,0,0,0,0,0|2,0,1]=4 727 B6R0.3 COC(=O)C(C)S Amb19372611 [1,0,0,0,0,0|3,0,0]=4 728 B6R0.3 COC(=O)C(N)=O Amb22167666 [1,0,0,0,0,0|2,0,0]=3 729 B6R0.3 COC(=O)C(N)=S Amb19514933 [1,0,0,0,0,0|2,1,0]=4 730 B6R0.3 COC(=O)N(C)C Amb27967797 [1,0,0,0,0,0|3,0,0]=4 731 B6R0.3 COC(=O)N(C)O Amb25823260 [1,0,0,0,0,0|3,0,0]=4 732 B6R0.3 COC(=O)[C@@H](C)Br Amb24711299 [1,0,0,0,0,0|3,0,0]=4 733 B6R0.3 COC(=O)[C@@H](C)Cl Amb3941680 [1,0,0,0,0,0|3,0,0]=4 734 B6R0.3 COC(=O)[C@@H](C)N Amb2778753 [1,0,0,0,0,0|3,0,0]=4 735 B6R0.3 COC(=O)[C@@H](C)N Amb3940039 [1,0,0,0,0,0|3,0,0]=4 736 B6R0.3 COC(=O)[C@@H](C)O Amb3939701 [1,0,0,0,0,0|2,0,1]=4 737 B6R0.3 COC(=O)[C@H](C)Br Amb27836311 [1,0,0,0,0,0|3,0,0]=4 738 B6R0.3 COC(=O)[C@H](C)Cl Amb3940748 [1,0,0,0,0,0|3,0,0]=4 739 B6R0.3 COC(=O)[C@H](C)N Amb533664 [1,0,0,0,0,0|3,0,0]=4 740 B6R0.3 COC(=O)[C@H](C)N Amb9825569 [1,0,0,0,0,0|3,0,0]=4 741 B6R0.3 COC(=O)[C@H](C)O Amb3939672 [1,0,0,0,0,0|2,0,1]=4 742 B6R0.3 COC(Br)C(=O)O Amb27439128 [1,0,0,0,0,0|2,0,1]=4 743 B6R0.3 COC(C)C(=O)O Amb9729215 [1,0,0,0,0,0|2,0,1]=4 744 B6R0.3 COC(Cl)C(=O)O Amb28280799 [1,0,0,0,0,0|2,0,1]=4 745 B6R0.3 COC(F)C(=O)O Amb27764863 [1,0,0,0,0,0|2,0,1]=4 746 B6R0.3 CO[C@@H](C)C(=O)O Amb8515766 [1,0,0,0,0,0|2,0,1]=4 747 B6R0.3 CO[C@H](C)C(=O)O Amb8515771 [1,0,0,0,0,0|2,0,1]=4 748 B6R0.3 CSC(=O)C(C)=O Amb27861244 [1,0,0,0,0,0|2,0,0]=3 749 B6R0.3 CSC(=O)C(C)C Amb25290392 [1,0,0,0,0,0|2,0,0]=3 750 B6R0.3 CSC(=S)C(N)=O Amb28128369 [1,0,0,0,0,0|2,1,0]=4 751 B6R0.3 CSC(C)C(=O)O Amb6274567 [1,0,0,0,0,0|2,0,1]=4 752 B6R0.3 CSC(N)C(=O)O Amb28383509 [1,0,0,0,0,0|2,0,1]=4 753 B6R0.3 CS[C@H](C)C(=O)O Amb26611205 [1,0,0,0,0,0|2,0,1]=4 754 B6R0.3 C[C@@H](C=O)N(C)C Amb27268446 [1,0,0,0,0,0|2,0,1]=4 755 B6R0.3 C[C@@H](CF)C(=O)O Amb33743265 [1,0,0,0,0,0|2,0,1]=4 756 B6R0.3 C[C@@H](CI)C(=O)O Amb28322539 [1,0,0,0,0,0|2,0,1]=4 757 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [1,0,0,0,0,0|2,0,1]=4 758 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [1,0,0,0,0,0|2,0,1]=4 759 B6R0.3 C[C@@H](CO)C(=O)O Amb10844567 [1,0,0,0,0,0|2,0,1]=4 760 B6R0.3 C[C@@H](Cl)[C@H](Br)C=O Amb27858842 [1,0,0,0,0,0|2,0,1]=4 761 B6R0.3 C[C@@H](N)C(=O)CCl Amb30868150 [1,0,0,0,0,0|2,0,1]=4 762 B6R0.3 C[C@@H](N)C(=O)CO Amb27751438 [1,0,0,0,0,0|1,0,1]=3 763 B6R0.3 C[C@@H](N)C(=O)NO Amb26878662 [1,0,0,0,0,0|2,0,0]=3 764 B6R0.3 C[C@@H](O)C(=N)NO Amb22587591 [1,0,0,0,0,0|3,0,0]=4 765 B6R0.3 C[C@@H](O)[C@H](N)C=O Amb27657440 [1,0,0,0,0,0|2,0,1]=4 766 B6R0.3 C[C@H](CBr)C(=O)O Amb27975404 [1,0,0,0,0,0|2,0,1]=4 767 B6R0.3 C[C@H](CF)C(=O)O Amb33727262 [1,0,0,0,0,0|2,0,1]=4 768 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [1,0,0,0,0,0|2,0,1]=4 769 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [1,0,0,0,0,0|2,0,1]=4 770 B6R0.3 C[C@H](CO)C(=O)O Amb10844554 [1,0,0,0,0,0|2,0,1]=4 771 B6R0.3 C[C@H](N)C(=O)N=S Amb27786327 [1,0,0,0,0,0|2,1,0]=4 772 B6R0.3 C[C@H](N)C(=O)NO Amb27978100 [1,0,0,0,0,0|2,0,0]=3 773 B6R0.3 C[C@H](O)C(=N)NO Amb22587550 [1,0,0,0,0,0|3,0,0]=4 774 B6R0.3 C[C@H](O)C(=O)CO Amb27838238 [1,0,0,0,0,0|1,0,1]=3 775 B6R0.3 C[C@H](O)[C@H](O)C=O Amb28434698 [1,0,0,0,0,0|1,0,2]=4 776 B6R0.3 C\C(=C/Br)C(=O)O Amb4014496 [1,0,0,0,0,0|2,0,1]=4 777 B6R0.3 C\C(=C/Br)C(C)O Amb27848009 [1,0,0,0,0,0|3,0,0]=4 778 B6R0.3 C\C(=C/Cl)C(C)O Amb27233447 [1,0,0,0,0,0|3,0,0]=4 779 B6R0.3 C\C(=C/F)C(=O)O Amb27469080 [1,0,0,0,0,0|2,0,1]=4 780 B6R0.3 C\C(=C/I)C(=O)O Amb27838211 [1,0,0,0,0,0|2,0,1]=4 781 B6R0.3 C\C(=N/O)C(=O)O Amb28187271 [1,0,0,0,0,0|3,0,0]=4 782 B6R0.3 C\C(=N/O)C(C)C Amb24529673 [1,0,0,0,0,0|2,0,0]=3 783 B6R0.3 C\C(=N\O)C(C)C Amb7969593 [1,0,0,0,0,0|2,0,0]=3 784 B6R0.3 C\C(Br)=C(/C)C=O Amb18645749 [1,0,0,0,0,0|2,0,1]=4 785 B6R0.3 C\C(Cl)=C(\C)C=O Amb27403540 [1,0,0,0,0,0|2,0,1]=4 786 B6R0.3 C\C(O)=C(/C)C=O Amb27238606 [1,0,0,0,0,0|2,0,1]=4 787 B6R0.3 C\C(O)=C(\Br)C=O Amb27643424 [1,0,0,0,0,0|2,0,1]=4 788 B6R0.3 C\C(O)=C(\C)C=O Amb27210577 [1,0,0,0,0,0|2,0,1]=4 789 B6R0.3 C\C(S)=C(/C)C=O Amb18641908 [1,0,0,0,0,0|2,0,1]=4 790 B6R0.3 C\C=C(/Br)C(=O)O Amb18646193 [1,0,0,0,0,0|1,0,1]=3 791 B6R0.3 C\C=C(/Br)[C@H](C)Cl Amb28342257 [1,0,0,0,0,0|3,0,0]=4 792 B6R0.3 C\C=C(/C)C(=O)Cl Amb8395514 [1,0,0,0,0,0|2,0,1]=4 793 B6R0.3 C\C=C(/C)C(=O)O Amb33723768 [1,0,0,0,0,0|1,0,1]=3 794 B6R0.3 C\C=C(/C)C(C)=O Amb2725616 [1,0,0,0,0,0|2,0,1]=4 795 B6R0.3 C\C=C(/C)C(C)C Amb4019536 [1,0,0,0,0,0|2,0,0]=3 796 B6R0.3 C\C=C(/C)C(C)Cl Amb28050209 [1,0,0,0,0,0|3,0,0]=4 797 B6R0.3 C\C=C(/F)C(=O)O Amb32663762 [1,0,0,0,0,0|1,0,1]=3 798 B6R0.3 C\C=C(/O)C(=O)O Amb22727962 [1,0,0,0,0,0|0,0,2]=3 799 B6R0.3 C\C=C(/O)C(N)=O Amb27837997 [1,0,0,0,0,0|1,0,2]=4 800 B6R0.3 C\C=C(\Br)C(=O)O Amb4014486 [1,0,0,0,0,0|1,0,1]=3 801 B6R0.3 C\C=C(\Br)C(N)=O Amb25919697 [1,0,0,0,0,0|2,0,1]=4 802 B6R0.3 C\C=C(\Br)[C@@H](C)O Amb28064198 [1,0,0,0,0,0|3,0,0]=4 803 B6R0.3 C\C=C(\C)C(=O)O Amb3445181 [1,0,0,0,0,0|1,0,1]=3 804 B6R0.3 C\C=C(\C)C(N)=O Amb28318688 [1,0,0,0,0,0|2,0,1]=4 805 B6R0.3 C\C=C(\Cl)C(=O)O Amb28073985 [1,0,0,0,0,0|1,0,1]=3 806 B6R0.3 C\C=C(\Cl)C(C)O Amb28350374 [1,0,0,0,0,0|3,0,0]=4 807 B6R0.3 C\C=C(\I)C(=O)O Amb27841305 [1,0,0,0,0,0|1,0,1]=3 808 B6R0.3 C\N=C(/C)C(C)=O Amb27838250 [1,0,0,0,0,0|3,0,0]=4 809 B6R0.3 NC(CCl)C(=O)O Amb19651457 [1,0,0,0,0,0|2,0,1]=4 810 B6R0.3 NC(CCl)C(=O)O Amb21961077 [1,0,0,0,0,0|2,0,1]=4 811 B6R0.3 NC(CF)C(=O)O Amb10839589 [1,0,0,0,0,0|2,0,1]=4 812 B6R0.3 NC(CO)C(=O)O Amb9702805 [1,0,0,0,0,0|2,0,1]=4 813 B6R0.3 NC(CP)C(=O)O Amb27234251 [1,0,0,0,0,0|2,0,1]=4 814 B6R0.3 NC(CS)C(=O)O Amb13961966 [1,0,0,0,0,0|2,0,1]=4 815 B6R0.3 NC(CS)C(=O)O Amb22489523 [1,0,0,0,0,0|2,0,1]=4 816 B6R0.3 NC(CS)C(=O)O Amb6537913 [1,0,0,0,0,0|2,0,1]=4 817 B6R0.3 NC(CS)C(=O)O Amb6537914 [1,0,0,0,0,0|2,0,1]=4 818 B6R0.3 NC(C[NH3+])C(=O)O Amb4004471 [1,0,0,0,0,0|2,0,1]=4 819 B6R0.3 NCC(Br)C(=O)O Amb28385732 [1,0,0,0,0,0|2,0,1]=4 820 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [1,0,0,0,0,0|2,0,1]=4 821 B6R0.3 NCC(F)C(=O)O Amb22733051 [1,0,0,0,0,0|2,0,1]=4 822 B6R0.3 NCC(F)C(=O)O Amb2688010 [1,0,0,0,0,0|2,0,1]=4 823 B6R0.3 NCC(N)C(=O)O Amb22899095 [1,0,0,0,0,0|2,0,1]=4 824 B6R0.3 NCC(N)C(=O)O Amb2697095 [1,0,0,0,0,0|2,0,1]=4 825 B6R0.3 NCC(N)C(=O)O Amb8514284 [1,0,0,0,0,0|2,0,1]=4 826 B6R0.3 NCC(O)C(=O)O Amb8517492 [1,0,0,0,0,0|1,0,2]=4 827 B6R0.3 NCC(S)C(=O)O Amb17593238 [1,0,0,0,0,0|1,1,1]=4 828 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [1,0,0,0,0,0|2,0,1]=4 829 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [1,0,0,0,0,0|2,0,1]=4 830 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [1,0,0,0,0,0|2,0,1]=4 831 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [1,0,0,0,0,0|2,0,1]=4 832 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [1,0,0,0,0,0|1,0,2]=4 833 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [1,0,0,0,0,0|2,0,1]=4 834 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [1,0,0,0,0,0|2,0,1]=4 835 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [1,0,0,0,0,0|2,0,1]=4 836 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [1,0,0,0,0,0|2,0,1]=4 837 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [1,0,0,0,0,0|2,0,1]=4 838 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [1,0,0,0,0,0|1,0,2]=4 839 B6R0.3 NNC(=O)C(N)=O Amb6608760 [1,0,0,0,0,0|3,0,0]=4 840 B6R0.3 N[C@@H](CBr)C(=O)O Amb27188433 [1,0,0,0,0,0|2,0,1]=4 841 B6R0.3 N[C@@H](CCl)C(=O)O Amb22232860 [1,0,0,0,0,0|2,0,1]=4 842 B6R0.3 N[C@@H](CCl)C(=O)O Amb8515277 [1,0,0,0,0,0|2,0,1]=4 843 B6R0.3 N[C@@H](CO)C(=O)O Amb22351170 [1,0,0,0,0,0|2,0,1]=4 844 B6R0.3 N[C@@H](CO)C(=O)O Amb8387621 [1,0,0,0,0,0|2,0,1]=4 845 B6R0.3 N[C@@H](CS)C(=O)O Amb3940755 [1,0,0,0,0,0|2,0,1]=4 846 B6R0.3 N[C@@H](CS)C(=O)O Amb8385453 [1,0,0,0,0,0|2,0,1]=4 847 B6R0.3 N[C@@H](CS)C(=O)O Amb9826090 [1,0,0,0,0,0|2,0,1]=4 848 B6R0.3 N[C@@H](C[SeH])C(=O)O Amb31031035 [1,0,0,0,0,0|2,0,1]=4 849 B6R0.3 N[C@H](CCl)C(=O)O Amb2699111 [1,0,0,0,0,0|2,0,1]=4 850 B6R0.3 N[C@H](CCl)C(=O)O Amb9813688 [1,0,0,0,0,0|2,0,1]=4 851 B6R0.3 N[C@H](CO)C(=O)O Amb2690463 [1,0,0,0,0,0|2,0,1]=4 852 B6R0.3 N[C@H](CS)C(=O)O Amb17942912 [1,0,0,0,0,0|2,0,1]=4 853 B6R0.3 N[C@H](CS)C(=O)O Amb8394603 [1,0,0,0,0,0|2,0,1]=4 854 B6R0.3 N[C@H](CS)C(=O)O Amb8628479 [1,0,0,0,0,0|2,0,1]=4 855 B6R0.3 N\C(=N/O)C(=O)O Amb24670890 [1,0,0,0,0,0|3,0,0]=4 856 B6R0.3 O=C(CO)C(F)F Amb32677822 [1,0,0,0,0,0|2,0,1]=4 857 B6R0.3 O=C(NO)C(F)F Amb27219370 [1,0,0,0,0,0|3,0,0]=4 858 B6R0.3 O=C(O)C(=O)CBr Amb10068671 [1,0,0,0,0,0|1,0,0]=2 859 B6R0.3 O=C(O)C(=O)CBr Amb8389349 [1,0,0,0,0,0|1,0,0]=2 860 B6R0.3 O=C(O)C(=O)CCl Amb16233358 [1,0,0,0,0,0|1,0,0]=2 861 B6R0.3 O=C(O)C(=O)CI Amb27659477 [1,0,0,0,0,0|1,0,0]=2 862 B6R0.3 O=C(O)C(=O)CO Amb6600025 [1,0,0,0,0,0|1,0,0]=2 863 B6R0.3 O=C(O)C(=O)CS Amb6600041 [1,0,0,0,0,0|1,0,0]=2 864 B6R0.3 O=C(O)C(=O)NI Amb27643666 [1,0,0,0,0,0|2,0,0]=3 865 B6R0.3 O=C(O)C(=S)NS Amb27469030 [1,0,0,0,0,0|2,1,0]=4 866 B6R0.3 O=C(O)C(Br)CBr Amb8513574 [1,0,0,0,0,0|2,0,1]=4 867 B6R0.3 O=C(O)C(Br)CF Amb10605519 [1,0,0,0,0,0|2,0,1]=4 868 B6R0.3 O=C(O)C(Br)CO Amb18126327 [1,0,0,0,0,0|2,0,1]=4 869 B6R0.3 O=C(O)C(Cl)CCl Amb22228245 [1,0,0,0,0,0|2,0,1]=4 870 B6R0.3 O=C(O)C(Cl)CO Amb18124304 [1,0,0,0,0,0|2,0,1]=4 871 B6R0.3 O=C(O)C(Cl)CS Amb18643661 [1,0,0,0,0,0|2,0,1]=4 872 B6R0.3 O=C(O)C(F)CO Amb17593117 [1,0,0,0,0,0|2,0,1]=4 873 B6R0.3 O=C(O)C(O)CBr Amb24061932 [1,0,0,0,0,0|1,0,2]=4 874 B6R0.3 O=C(O)C(O)CCl Amb6371692 [1,0,0,0,0,0|1,0,2]=4 875 B6R0.3 O=C(O)C(O)CF Amb27476477 [1,0,0,0,0,0|1,0,2]=4 876 B6R0.3 O=C(O)C(O)CO Amb17593103 [1,0,0,0,0,0|1,0,2]=4 877 B6R0.3 O=C(O)C(O)CS Amb18642053 [1,0,0,0,0,0|1,0,2]=4 878 B6R0.3 O=C(O)C(S)CS Amb18643295 [1,0,0,0,0,0|1,1,1]=4 879 B6R0.3 O=C(O)[C@@H](Br)CO Amb10601700 [1,0,0,0,0,0|2,0,1]=4 880 B6R0.3 O=C(O)[C@@H](Cl)CO Amb27968485 [1,0,0,0,0,0|2,0,1]=4 881 B6R0.3 O=C(O)[C@@H](O)CBr Amb27858794 [1,0,0,0,0,0|1,0,2]=4 882 B6R0.3 O=C(O)[C@@H](O)CCl Amb22225325 [1,0,0,0,0,0|1,0,2]=4 883 B6R0.3 O=C(O)[C@@H](O)CF Amb24117272 [1,0,0,0,0,0|1,0,2]=4 884 B6R0.3 O=C(O)[C@@H](O)CO Amb22226732 [1,0,0,0,0,0|1,0,2]=4 885 B6R0.3 O=C(O)[C@H](Cl)CO Amb27759746 [1,0,0,0,0,0|2,0,1]=4 886 B6R0.3 O=C(O)[C@H](O)CBr Amb28137021 [1,0,0,0,0,0|1,0,2]=4 887 B6R0.3 O=C(O)[C@H](O)CF Amb27467272 [1,0,0,0,0,0|1,0,2]=4 888 B6R0.3 O=C(O)[C@H](O)CO Amb4166319 [1,0,0,0,0,0|1,0,2]=4 889 B6R0.3 O=C(O)\C(Br)=N\O Amb26949828 [1,0,0,0,0,0|3,0,0]=4 890 B6R0.3 O=C(O)\C(Cl)=C/Cl Amb17593560 [1,0,0,0,0,0|2,0,1]=4 891 B6R0.3 O=C(O)\C(Cl)=C/O Amb24479774 [1,0,0,0,0,0|2,0,1]=4 892 B6R0.3 O=C(O)\C(Cl)=C\Cl Amb32409784 [1,0,0,0,0,0|2,0,1]=4 893 B6R0.3 O=C(O)\C(Cl)=N\O Amb25839923 [1,0,0,0,0,0|3,0,0]=4 894 B6R0.3 O=C(O)\C(O)=C/O Amb27220871 [1,0,0,0,0,0|1,0,2]=4 895 B6R0.3 O=C([O-])C(=O)CF Amb10839900 [1,0,0,0,0,0|1,0,1]=3 896 B6R0.3 O=C([O-])C(=O)CS Amb22547761 [1,0,0,0,0,0|1,0,1]=3 897 B6R0.3 O=C([O-])C(=O)CS Amb9825929 [1,0,0,0,0,0|1,0,1]=3 898 B6R0.3 O\C=C(\Cl)C(Cl)Cl Amb24676590 [1,0,0,0,0,0|3,0,0]=4 899 B8R0.2 C#CC(=O)C(C)=C(C)C Amb27972918 [0,1,0,0,0,0|2,0,1]=4 900 B8R0.2 C#CC(=O)[C@@H](N)C(C)C Amb35617525 [0,1,0,0,0,0|2,0,1]=4 901 B8R0.2 C#CC(=O)[C@H](N)C(C)C Amb35617735 [0,1,0,0,0,0|2,0,1]=4 902 B8R0.2 C#CC(O)C(=C)C(C)C Amb27197153 [0,1,0,0,0,0|2,0,1]=4 903 B8R0.2 C#C[C@@H](C)[C@H](C)C(=O)O Amb27257738 [0,1,0,0,0,0|1,0,2]=4 904 B8R0.2 C#C[C@H](C)[C@@H](O)C(=O)O Amb27777980 [0,1,0,0,0,0|0,0,3]=4 905 B8R0.2 C=C(C(=O)CC)C(C)O Amb27984022 [0,1,0,0,0,0|3,0,0]=4 906 B8R0.2 C=C(C(=O)O)C(C)CC Amb18642655 [0,1,0,0,0,0|1,0,0]=2 907 B8R0.2 C=C(C(=O)O)[C@@H](O)CC Amb28253249 [0,1,0,0,0,0|2,0,0]=3 908 B8R0.2 C=C(C(=O)OC)C(C)Br Amb27878767 [0,1,0,0,0,0|2,0,0]=3 909 B8R0.2 C=C(C(=O)OC)[C@@H](C)O Amb27956621 [0,1,0,0,0,0|2,0,0]=3 910 B8R0.2 C=C(C(C)=O)C(C)C=O Amb18642419 [0,1,0,0,0,0|2,0,1]=4 911 B8R0.2 C=C(C(C)=O)[C@@H](O)CC Amb27165607 [0,1,0,0,0,0|3,0,0]=4 912 B8R0.2 C=C(C(C)=O)[C@H](C)CO Amb28202165 [0,1,0,0,0,0|2,0,0]=3 913 B8R0.2 C=C(C(C)=O)[C@H](O)CC Amb27634796 [0,1,0,0,0,0|3,0,0]=4 914 B8R0.2 C=C(C(C)C)[C@@H](O)CC Amb28292215 [0,1,0,0,0,0|2,0,1]=4 915 B8R0.2 C=C(C(C)C)[C@H](O)CC Amb28315507 [0,1,0,0,0,0|2,0,1]=4 916 B8R0.2 C=C(C)C(=O)C(C)CO Amb27973088 [0,1,0,0,0,0|2,0,0]=3 917 B8R0.2 C=C(C)C(=O)C(C)OC Amb27838472 [0,1,0,0,0,0|2,0,0]=3 918 B8R0.2 C=C(C)C(=O)N(C)OC Amb17616971 [0,1,0,0,0,0|3,0,0]=4 919 B8R0.2 C=C(C)C(=O)[C@@H](N)CC Amb35601238 [0,1,0,0,0,0|3,0,0]=4 920 B8R0.2 C=C(C)C(=O)[C@@H](O)CO Amb28365064 [0,1,0,0,0,0|3,0,0]=4 921 B8R0.2 C=C(C)C(=O)[C@H](C)CO Amb27185479 [0,1,0,0,0,0|2,0,0]=3 922 B8R0.2 C=C(C)C(=O)[C@H](C)NC Amb30040573 [0,1,0,0,0,0|2,0,0]=3 923 B8R0.2 C=C(C)C(=O)[C@H](N)CC Amb35595867 [0,1,0,0,0,0|3,0,0]=4 924 B8R0.2 C=C(CBr)C(=O)N(C)C Amb27477892 [0,1,0,0,0,0|3,0,0]=4 925 B8R0.2 C=C(CC)C(=O)C(C)C Amb28122205 [0,1,0,0,0,0|2,0,0]=3 926 B8R0.2 C=C(CC)C(=O)N(C)C Amb24591163 [0,1,0,0,0,0|3,0,0]=4 927 B8R0.2 C=C(Cl)C(=O)N(C)CC Amb27959785 [0,1,0,0,0,0|3,0,0]=4 928 B8R0.2 C=C(OC)C(=O)C(C)=O Amb27465203 [0,1,0,0,0,0|1,0,2]=4 929 B8R0.2 C=CC(=O)C(=C)C(C)C Amb28122459 [0,1,0,0,0,0|2,0,0]=3 930 B8R0.2 C=CC(=O)C(=O)C(=C)C Amb27838761 [0,1,0,0,0,0|1,0,2]=4 931 B8R0.2 C=CC(=O)[C@@H](N)C(C)C Amb35617526 [0,1,0,0,0,0|2,0,1]=4 932 B8R0.2 C=CC(=O)[C@H](N)C(C)C Amb35617737 [0,1,0,0,0,0|2,0,1]=4 933 B8R0.2 C=CC(C)C(C)C(=O)O Amb18642611 [0,1,0,0,0,0|1,0,2]=4 934 B8R0.2 C=CC(C)C(N)C(=O)O Amb18989861 [0,1,0,0,0,0|1,0,2]=4 935 B8R0.2 C=CC(C)C(O)C(=O)O Amb18642750 [0,1,0,0,0,0|0,0,3]=4 936 B8R0.2 C=CC(C)[C@@H](N)C(=O)O Amb25889532 [0,1,0,0,0,0|1,0,2]=4 937 B8R0.2 C=CC(C)[C@H](N)C(=O)O Amb27761345 [0,1,0,0,0,0|1,0,2]=4 938 B8R0.2 C=C[C@@H](C)[C@H](N)C(=O)O Amb28129785 [0,1,0,0,0,0|1,0,2]=4 939 B8R0.2 C=C[C@@H](C)[C@H](O)C(=O)O Amb27788648 [0,1,0,0,0,0|0,0,3]=4 940 B8R0.2 C=C[C@H](C)[C@@H](N)C(=O)O Amb28067623 [0,1,0,0,0,0|1,0,2]=4 941 B8R0.2 C=C[C@H](C)[C@H](Cl)C(=O)O Amb27601824 [0,1,0,0,0,0|1,0,2]=4 942 B8R0.2 C=C[C@H](C)[C@H](F)C(=O)O Amb28285951 [0,1,0,0,0,0|1,0,2]=4 943 B8R0.2 C=C\C(C)=C(/C)C(=O)O Amb28060126 [0,1,0,0,0,0|1,0,2]=4 944 B8R0.2 C=C\C(C)=C(\C)C(=O)O Amb27947979 [0,1,0,0,0,0|1,0,2]=4 945 B8R0.2 CC(=O)C(=O)C(=O)C=O Amb27211203 [0,1,0,0,0,0|1,0,2]=4 946 B8R0.2 CC(=O)C(=O)C(O)CO Amb25830733 [0,1,0,0,0,0|2,0,0]=3 947 B8R0.2 CC(=O)C(=O)[C@@H](O)CO Amb25697046 [0,1,0,0,0,0|2,0,0]=3 948 B8R0.2 CC(=O)C(=O)[C@H](O)CO Amb27490779 [0,1,0,0,0,0|2,0,0]=3 949 B8R0.2 CC(=O)N(C)C(C)CO Amb27628421 [0,1,0,0,0,0|3,0,0]=4 950 B8R0.2 CC(=O)\C(Cl)=C(/C)CCl Amb27629744 [0,1,0,0,0,0|2,0,1]=4 951 B8R0.2 CC(=O)\C(Cl)=C(\C)CCl Amb28340937 [0,1,0,0,0,0|2,0,1]=4 952 B8R0.2 CC(C#N)C(N)C(=O)O Amb33065998 [0,1,0,0,0,0|1,0,2]=4 953 B8R0.2 CC(C#N)[C@@H](N)C(=O)O Amb33308709 [0,1,0,0,0,0|1,0,2]=4 954 B8R0.2 CC(C#N)[C@H](N)C(=O)O Amb33308645 [0,1,0,0,0,0|1,0,2]=4 955 B8R0.2 CC(C(=O)O)C(N)CN Amb24532823 [0,1,0,0,0,0|2,0,1]=4 956 B8R0.2 CC(C)=C(F)C(=O)NO Amb28071893 [0,1,0,0,0,0|1,0,1]=3 957 B8R0.2 CC(C)C(=O)C([Na])C=O Amb27237311 [0,1,0,0,0,0|1,0,1]=3 958 B8R0.2 CC(C)C(=O)N(C)CCl Amb26359873 [0,1,0,0,0,0|3,0,0]=4 959 B8R0.2 CC(C)C(=O)\C(Cl)=N\O Amb28142301 [0,1,0,0,0,0|1,0,0]=2 960 B8R0.2 CC(C)C(Br)C(=O)CBr Amb26007156 [0,1,0,0,0,0|2,0,1]=4 961 B8R0.2 CC(C)C(Br)C(=O)NO Amb28137656 [0,1,0,0,0,0|1,0,1]=3 962 B8R0.2 CC(C)C(C)C(=O)CBr Amb28388772 [0,1,0,0,0,0|2,0,1]=4 963 B8R0.2 CC(C)C(C)C(O)C=O Amb27758170 [0,1,0,0,0,0|1,0,2]=4 964 B8R0.2 CC(C)C(F)C(=O)CN Amb27642925 [0,1,0,0,0,0|2,0,1]=4 965 B8R0.2 CC(C)C(N)C(=O)CO Amb27202150 [0,1,0,0,0,0|1,0,1]=3 966 B8R0.2 CC(C)C(N)C(=O)NN Amb18061950 [0,1,0,0,0,0|2,0,1]=4 967 B8R0.2 CC(C)C(N)C(=O)NO Amb2439843 [0,1,0,0,0,0|1,0,1]=3 968 B8R0.2 CC(C)C(N)C(=O)OBr Amb28137372 [0,1,0,0,0,0|1,0,1]=3 969 B8R0.2 CC(C)C(N)\C(N)=N\O Amb25967017 [0,1,0,0,0,0|2,0,1]=4 970 B8R0.2 CC(C)C(O)\C(N)=N/O Amb19737368 [0,1,0,0,0,0|1,0,2]=4 971 B8R0.2 CC(C)N(C)C(=O)CBr Amb27834117 [0,1,0,0,0,0|3,0,0]=4 972 B8R0.2 CC(C)N(C)C(=O)CCl Amb453173 [0,1,0,0,0,0|3,0,0]=4 973 B8R0.2 CC(C)N(C)C(=O)CN Amb6275815 [0,1,0,0,0,0|3,0,0]=4 974 B8R0.2 CC(C)N(C)\C(N)=N\O Amb25945077 [0,1,0,0,0,0|3,0,0]=4 975 B8R0.2 CC(C)N(O)C(=O)CN Amb25324350 [0,1,0,0,0,0|2,0,1]=4 976 B8R0.2 CC(C)N(O)C(=O)CN Amb33189094 [0,1,0,0,0,0|2,0,1]=4 977 B8R0.2 CC(C)S(=O)C(C)C=O Amb35647338 [0,1,0,0,0,0|2,0,1]=4 978 B8R0.2 CC(C)[C@H](N)C(=O)CCl Amb28423857 [0,1,0,0,0,0|2,0,1]=4 979 B8R0.2 CC(C)[C@H](N)C(=O)NN Amb27628835 [0,1,0,0,0,0|2,0,1]=4 980 B8R0.2 CC(C)[C@H](O)C(=O)NN Amb27956618 [0,1,0,0,0,0|1,0,2]=4 981 B8R0.2 CC(CCl)C(=O)N(C)C Amb27837524 [0,1,0,0,0,0|3,0,0]=4 982 B8R0.2 CC(CCl)C(N)C(=O)O Amb27470876 [0,1,0,0,0,0|1,0,1]=3 983 B8R0.2 CC(CN)C(C)C(=O)O Amb27217450 [0,1,0,0,0,0|1,0,1]=3 984 B8R0.2 CC(CN)C(F)C(=O)O Amb35750952 [0,1,0,0,0,0|1,0,1]=3 985 B8R0.2 CC(CN)C(F)C(=O)O Amb35751592 [0,1,0,0,0,0|1,0,1]=3 986 B8R0.2 CC(CN)C(O)C(=O)O Amb18642919 [0,1,0,0,0,0|0,0,2]=3 987 B8R0.2 CC(CN)N(C)C(N)=O Amb18251133 [0,1,0,0,0,0|3,0,0]=4 988 B8R0.2 CC(CO)C(C)C(=O)O Amb27255789 [0,1,0,0,0,0|1,0,1]=3 989 B8R0.2 CC(CO)C(N)C(=O)O Amb27629815 [0,1,0,0,0,0|1,0,1]=3 990 B8R0.2 CC(CO)C(N)C(N)=O Amb33308985 [0,1,0,0,0,0|2,0,1]=4 991 B8R0.2 CC(CO)[C@@H](N)C(=O)O Amb33308939 [0,1,0,0,0,0|1,0,1]=3 992 B8R0.2 CC(CO)[C@H](N)C(=O)O Amb25918803 [0,1,0,0,0,0|1,0,1]=3 993 B8R0.2 CC(CS)C(C)C(=O)O Amb17593702 [0,1,0,0,0,0|1,0,1]=3 994 B8R0.2 CC(NO)C(C)C(=O)O Amb27185439 [0,1,0,0,0,0|2,0,1]=4 995 B8R0.2 CC(O)C(C)C(=O)CO Amb27948718 [0,1,0,0,0,0|2,0,1]=4 996 B8R0.2 CC(O)C(O)C(=O)CO Amb27785801 [0,1,0,0,0,0|1,0,2]=4 997 B8R0.2 CC(O)[C@H](O)C(=O)CO Amb27227013 [0,1,0,0,0,0|1,0,2]=4 998 B8R0.2 CCC(=O)C(=O)C(=O)O Amb31097725 [0,1,0,0,0,0|1,0,1]=3 999 B8R0.2 CCC(=O)C(=O)C(C)=O Amb17593337 [0,1,0,0,0,0|2,0,1]=4 1000 B8R0.2 CCC(=O)C(=O)C(C)C Amb25965254 [0,1,0,0,0,0|1,0,0]=2 1001 B8R0.2 CCC(=O)C(=O)N(C)C Amb27838777 [0,1,0,0,0,0|2,0,0]=3 1002 B8R0.2 CCC(=O)C(C)=C(C)C Amb24424875 [0,1,0,0,0,0|2,0,1]=4 1003 B8R0.2 CCC(=O)C(N)C(C)C Amb23536939 [0,1,0,0,0,0|2,0,1]=4 1004 B8R0.2 CCC(=O)N(C)C(C)C Amb26513508 [0,1,0,0,0,0|3,0,0]=4 1005 B8R0.2 CCC(=O)N(N)C(C)C Amb33191468 [0,1,0,0,0,0|3,0,0]=4 1006 B8R0.2 CCC(=O)[C@H](N)C(C)C Amb30022955 [0,1,0,0,0,0|2,0,1]=4 1007 B8R0.2 CCC(Br)C(=O)C(=O)O Amb27232743 [0,1,0,0,0,0|1,0,0]=2 1008 B8R0.2 CCC(Br)C(=O)C(C)C Amb24552845 [0,1,0,0,0,0|2,0,1]=4 1009 B8R0.2 CCC(C)C(=O)C(=O)Cl Amb28285750 [0,1,0,0,0,0|1,0,0]=2 1010 B8R0.2 CCC(C)C(=O)C(=O)O Amb2695339 [0,1,0,0,0,0|0,0,0]=1 1011 B8R0.2 CCC(C)C(=O)C(C)C Amb3940676 [0,1,0,0,0,0|2,0,1]=4 1012 B8R0.2 CCC(C)C(=O)C(C)N Amb26920348 [0,1,0,0,0,0|2,0,1]=4 1013 B8R0.2 CCC(C)C(=O)C(C)O Amb27774877 [0,1,0,0,0,0|1,0,1]=3 1014 B8R0.2 CCC(C)C(=O)C(Cl)Cl Amb27472159 [0,1,0,0,0,0|2,0,1]=4 1015 B8R0.2 CCC(C)C(=O)C(F)F Amb25739859 [0,1,0,0,0,0|2,0,1]=4 1016 B8R0.2 CCC(C)C(=O)[C@@H](C)N Amb35582958 [0,1,0,0,0,0|2,0,1]=4 1017 B8R0.2 CCC(C)C(=O)[C@H](C)N Amb35624367 [0,1,0,0,0,0|2,0,1]=4 1018 B8R0.2 CCC(C)C(Br)C(=O)O Amb4015586 [0,1,0,0,0,0|1,0,1]=3 1019 B8R0.2 CCC(C)C(Br)C(N)=O Amb27472685 [0,1,0,0,0,0|2,0,1]=4 1020 B8R0.2 CCC(C)C(C)C(=O)O Amb18290719 [0,1,0,0,0,0|1,0,1]=3 1021 B8R0.2 CCC(C)C(C)C(C)=O Amb4035878 [0,1,0,0,0,0|2,0,1]=4 1022 B8R0.2 CCC(C)C(Cl)C(=O)O Amb17593752 [0,1,0,0,0,0|1,0,1]=3 1023 B8R0.2 CCC(C)C(Cl)C(N)=O Amb27771780 [0,1,0,0,0,0|2,0,1]=4 1024 B8R0.2 CCC(C)C(N)C(=O)O Amb9702778 [0,1,0,0,0,0|1,0,1]=3 1025 B8R0.2 CCC(C)C(N)C(N)=O Amb1105283 [0,1,0,0,0,0|2,0,1]=4 1026 B8R0.2 CCC(C)C(N)C(N)=O Amb1152621 [0,1,0,0,0,0|2,0,1]=4 1027 B8R0.2 CCC(C)C(N)C(N)=O Amb33551930 [0,1,0,0,0,0|2,0,1]=4 1028 B8R0.2 CCC(C)C(O)C(=O)O Amb18288809 [0,1,0,0,0,0|0,0,2]=3 1029 B8R0.2 CCC(C)C(O)C(N)=O Amb24112761 [0,1,0,0,0,0|1,0,2]=4 1030 B8R0.2 CCC(C)C(S)C(=O)O Amb27667077 [0,1,0,0,0,0|0,1,1]=3 1031 B8R0.2 CCC(C)[C@@H](C)C(=O)O Amb10844494 [0,1,0,0,0,0|1,0,1]=3 1032 B8R0.2 CCC(C)[C@@H](N)C(=O)O Amb10844500 [0,1,0,0,0,0|1,0,1]=3 1033 B8R0.2 CCC(C)[C@H](Br)C(=O)Cl Amb27166137 [0,1,0,0,0,0|2,0,1]=4 1034 B8R0.2 CCC(C)[C@H](Br)C(=O)O Amb28183049 [0,1,0,0,0,0|1,0,1]=3 1035 B8R0.2 CCC(C)[C@H](C)C(=O)O Amb10844495 [0,1,0,0,0,0|1,0,1]=3 1036 B8R0.2 CCC(C)[C@H](Cl)C(=O)O Amb28314442 [0,1,0,0,0,0|1,0,1]=3 1037 B8R0.2 CCC(C)[C@H](N)C(=O)O Amb10844501 [0,1,0,0,0,0|1,0,1]=3 1038 B8R0.2 CCC(C)[C@H](N)C(C)=O Amb35617474 [0,1,0,0,0,0|2,0,1]=4 1039 B8R0.2 CCC(Cl)C(=O)C(C)C Amb28076550 [0,1,0,0,0,0|2,0,1]=4 1040 B8R0.2 CCC(F)C(=O)C(=O)O Amb27489910 [0,1,0,0,0,0|1,0,0]=2 1041 B8R0.2 CCC(F)C(Br)C(=O)O Amb27858717 [0,1,0,0,0,0|2,0,1]=4 1042 B8R0.2 CCC(N)C(=O)N(C)O Amb27440324 [0,1,0,0,0,0|3,0,0]=4 1043 B8R0.2 CCC(N)C(F)C(=O)O Amb33036406 [0,1,0,0,0,0|2,0,1]=4 1044 B8R0.2 CCC(O)C(=O)N(C)C Amb26563237 [0,1,0,0,0,0|2,0,1]=4 1045 B8R0.2 CCC(O)C(C)C(=O)O Amb10844267 [0,1,0,0,0,0|2,0,1]=4 1046 B8R0.2 CCC(O)C(F)C(=O)O Amb33136388 [0,1,0,0,0,0|2,0,1]=4 1047 B8R0.2 CCC(O)C(N)C(=O)O Amb18203168 [0,1,0,0,0,0|2,0,1]=4 1048 B8R0.2 CCC(O)[C@H](N)C(=O)O Amb24364655 [0,1,0,0,0,0|2,0,1]=4 1049 B8R0.2 CCN(C)C(=O)C(=O)O Amb9304051 [0,1,0,0,0,0|1,0,0]=2 1050 B8R0.2 CCN(C)C(=O)C(C)=O Amb27857476 [0,1,0,0,0,0|2,0,0]=3 1051 B8R0.2 CCN(C)C(=O)[C@@H](C)O Amb27196996 [0,1,0,0,0,0|2,0,1]=4 1052 B8R0.2 CCN(C)C(=O)[C@H](C)O Amb27837644 [0,1,0,0,0,0|2,0,1]=4 1053 B8R0.2 CCN(C)C(C)C(=O)O Amb8890967 [0,1,0,0,0,0|2,0,1]=4 1054 B8R0.2 CCN(C)[C@@H](C)C(=O)O Amb27228167 [0,1,0,0,0,0|2,0,1]=4 1055 B8R0.2 CCN(N)C(=O)C(C)C Amb33191312 [0,1,0,0,0,0|3,0,0]=4 1056 B8R0.2 CCN(O)C(=O)C(C)C Amb27435663 [0,1,0,0,0,0|2,0,0]=3 1057 B8R0.2 CC[C@@H](C)C(Cl)C(=O)O Amb27472040 [0,1,0,0,0,0|1,0,1]=3 1058 B8R0.2 CC[C@@H](C)[C@@H](Br)C(=O)Cl Amb27194351 [0,1,0,0,0,0|2,0,1]=4 1059 B8R0.2 CC[C@@H](C)[C@@H](C)C(C)=O Amb27949165 [0,1,0,0,0,0|2,0,1]=4 1060 B8R0.2 CC[C@@H](C)[C@@H](C)C(N)=O Amb28049888 [0,1,0,0,0,0|2,0,1]=4 1061 B8R0.2 CC[C@@H](C)[C@@H](Cl)C(=O)O Amb28130604 [0,1,0,0,0,0|1,0,1]=3 1062 B8R0.2 CC[C@@H](C)[C@@H](F)C(=O)O Amb28347222 [0,1,0,0,0,0|1,0,1]=3 1063 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O Amb8513329 [0,1,0,0,0,0|1,0,1]=3 1064 B8R0.2 CC[C@@H](C)[C@@H](O)C(=O)O Amb26063750 [0,1,0,0,0,0|0,0,2]=3 1065 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O Amb26866576 [0,1,0,0,0,0|1,0,1]=3 1066 B8R0.2 CC[C@@H](C)[C@H](C)C(C)=O Amb25024740 [0,1,0,0,0,0|2,0,1]=4 1067 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O Amb10068321 [0,1,0,0,0,0|1,0,1]=3 1068 B8R0.2 CC[C@@H](N)C(=O)C(C)C Amb35595868 [0,1,0,0,0,0|2,0,1]=4 1069 B8R0.2 CC[C@@H](O)[C@@H](C)C(=O)O Amb27879857 [0,1,0,0,0,0|2,0,1]=4 1070 B8R0.2 CC[C@H](Br)[C@H](Br)C(=O)O Amb16233350 [0,1,0,0,0,0|2,0,1]=4 1071 B8R0.2 CC[C@H](C)C(=O)C(=O)O Amb28075584 [0,1,0,0,0,0|0,0,0]=1 1072 B8R0.2 CC[C@H](C)C(C)C(=O)O Amb27950556 [0,1,0,0,0,0|1,0,1]=3 1073 B8R0.2 CC[C@H](C)C(C)C(N)=O Amb28049537 [0,1,0,0,0,0|2,0,1]=4 1074 B8R0.2 CC[C@H](C)C(N)C(=O)O Amb27209489 [0,1,0,0,0,0|1,0,1]=3 1075 B8R0.2 CC[C@H](C)[C@@H](Br)C(=O)O Amb23401386 [0,1,0,0,0,0|1,0,1]=3 1076 B8R0.2 CC[C@H](C)[C@@H](C)C(C)=O Amb27250604 [0,1,0,0,0,0|2,0,1]=4 1077 B8R0.2 CC[C@H](C)[C@@H](F)C(=O)O Amb27954743 [0,1,0,0,0,0|1,0,1]=3 1078 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O Amb8516280 [0,1,0,0,0,0|1,0,1]=3 1079 B8R0.2 CC[C@H](C)[C@H](Br)C(N)=O Amb27235575 [0,1,0,0,0,0|2,0,1]=4 1080 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)Cl Amb27768651 [0,1,0,0,0,0|2,0,1]=4 1081 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O Amb22388560 [0,1,0,0,0,0|1,0,1]=3 1082 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O Amb3940753 [0,1,0,0,0,0|1,0,1]=3 1083 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O Amb10878815 [0,1,0,0,0,0|2,0,1]=4 1084 B8R0.2 CC[C@H](C)[C@H](N)C(N)=O Amb9813724 [0,1,0,0,0,0|2,0,1]=4 1085 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O Amb2694797 [0,1,0,0,0,0|0,0,2]=3 1086 B8R0.2 CC[C@H](N)C(=O)C(C)C Amb35601239 [0,1,0,0,0,0|2,0,1]=4 1087 B8R0.2 CC[C@H](N)C(=O)N(C)O Amb27640455 [0,1,0,0,0,0|3,0,0]=4 1088 B8R0.2 CC[C@H](N)[C@H](C)C(=O)O Amb27779460 [0,1,0,0,0,0|2,0,1]=4 1089 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O Amb26981388 [0,1,0,0,0,0|2,0,1]=4 1090 B8R0.2 CC[C@H](O)[C@H](Br)C(=O)O Amb28285137 [0,1,0,0,0,0|2,0,1]=4 1091 B8R0.2 CC[C@H](O)[C@H](N)C(=O)O Amb26024594 [0,1,0,0,0,0|2,0,1]=4 1092 B8R0.2 CC\C(C)=C(/C)C(=O)O Amb27424733 [0,1,0,0,0,0|1,0,1]=3 1093 B8R0.2 CC\C(C)=C(/C)C(C)=O Amb28421971 [0,1,0,0,0,0|2,0,1]=4 1094 B8R0.2 CC\C(C)=C(/C)C(N)=O Amb27791930 [0,1,0,0,0,0|2,0,1]=4 1095 B8R0.2 CC\C(O)=C(\C)C(=O)O Amb27253362 [0,1,0,0,0,0|2,0,1]=4 1096 B8R0.2 CN(C)C(=O)C(N)CO Amb28318583 [0,1,0,0,0,0|2,0,1]=4 1097 B8R0.2 CN(C)C(=O)C(O)CN Amb28401546 [0,1,0,0,0,0|2,0,1]=4 1098 B8R0.2 CN(C)C(=O)C(O)CO Amb25043693 [0,1,0,0,0,0|1,0,2]=4 1099 B8R0.2 CN(C)C(=O)[C@H](O)CN Amb28285257 [0,1,0,0,0,0|2,0,1]=4 1100 B8R0.2 CN(C)C(=O)[C@H](O)CO Amb28455651 [0,1,0,0,0,0|1,0,2]=4 1101 B8R0.2 CN(C)C(=O)\C(Cl)=N\O Amb24740165 [0,1,0,0,0,0|2,0,0]=3 1102 B8R0.2 CN(C)C(=O)\C(N)=N/O Amb19517099 [0,1,0,0,0,0|2,0,0]=3 1103 B8R0.2 CN(C)C(=O)\C(N)=N\O Amb19737363 [0,1,0,0,0,0|2,0,0]=3 1104 B8R0.2 CNC(=O)C(=O)N(C)C Amb24113906 [0,1,0,0,0,0|2,0,0]=3 1105 B8R0.2 CNC(=O)C(N)C(C)C Amb33549803 [0,1,0,0,0,0|2,0,1]=4 1106 B8R0.2 CNC(=O)C(N)C(C)C Amb9727630 [0,1,0,0,0,0|2,0,1]=4 1107 B8R0.2 CNC(=O)C(O)C(C)C Amb24743373 [0,1,0,0,0,0|1,0,2]=4 1108 B8R0.2 CNC(=O)[C@@H](N)C(C)C Amb17231869 [0,1,0,0,0,0|2,0,1]=4 1109 B8R0.2 CNC(=O)[C@@H](N)C(C)C Amb30585154 [0,1,0,0,0,0|2,0,1]=4 1110 B8R0.2 CNC(=O)[C@H](N)C(C)C Amb32414606 [0,1,0,0,0,0|2,0,1]=4 1111 B8R0.2 CNC(C)C(=O)C(C)C Amb24411109 [0,1,0,0,0,0|2,0,1]=4 1112 B8R0.2 CNC(C)C(=O)N(C)C Amb7758121 [0,1,0,0,0,0|3,0,0]=4 1113 B8R0.2 CNC(C)C(C)C(C)=O Amb27202218 [0,1,0,0,0,0|2,0,1]=4 1114 B8R0.2 CNC(C)C(N)C(=O)O Amb18642890 [0,1,0,0,0,0|1,0,1]=3 1115 B8R0.2 CNC(C)C(O)C(N)=O Amb28366769 [0,1,0,0,0,0|1,0,2]=4 1116 B8R0.2 CN[C@@H](C)C(=O)C(C)C Amb30040578 [0,1,0,0,0,0|2,0,1]=4 1117 B8R0.2 CN[C@@H](C)C(=O)N(C)C Amb22587546 [0,1,0,0,0,0|3,0,0]=4 1118 B8R0.2 CN[C@@H](C)C(=O)N(C)C Amb33457359 [0,1,0,0,0,0|3,0,0]=4 1119 B8R0.2 CN[C@H](C)C(=O)N(C)C Amb22587584 [0,1,0,0,0,0|3,0,0]=4 1120 B8R0.2 CN\C(C)=C(/C)C(C)=O Amb27264901 [0,1,0,0,0,0|2,0,1]=4 1121 B8R0.2 CN\C(C)=C(\Cl)C(C)=O Amb27828096 [0,1,0,0,0,0|2,0,1]=4 1122 B8R0.2 COC(=N)C(C)C(C)C Amb27261046 [0,1,0,0,0,0|2,0,1]=4 1123 B8R0.2 COC(=O)C(=O)C(C)=O Amb17569865 [0,1,0,0,0,0|1,0,1]=3 1124 B8R0.2 COC(=O)C(=O)C(C)Br Amb17621489 [0,1,0,0,0,0|1,0,0]=2 1125 B8R0.2 COC(=O)C(=O)C(C)C Amb17935756 [0,1,0,0,0,0|0,0,0]=1 1126 B8R0.2 COC(=O)C(=O)C(C)Cl Amb27239406 [0,1,0,0,0,0|1,0,0]=2 1127 B8R0.2 COC(=O)C(=O)C(F)F Amb27802655 [0,1,0,0,0,0|2,0,0]=3 1128 B8R0.2 COC(=O)C(=O)C(N)=O Amb27983893 [0,1,0,0,0,0|2,0,1]=4 1129 B8R0.2 COC(=O)C(=O)N(C)C Amb25085299 [0,1,0,0,0,0|1,0,0]=2 1130 B8R0.2 COC(=O)C(=S)C(C)=O Amb27838708 [0,1,0,0,0,0|1,1,1]=4 1131 B8R0.2 COC(=O)C(Br)=C(C)C Amb17610027 [0,1,0,0,0,0|1,0,1]=3 1132 B8R0.2 COC(=O)C(Br)C(C)Br Amb495553 [0,1,0,0,0,0|2,0,1]=4 1133 B8R0.2 COC(=O)C(Br)C(C)C Amb6892152 [0,1,0,0,0,0|1,0,1]=3 1134 B8R0.2 COC(=O)C(C)C(C)C Amb4044380 [0,1,0,0,0,0|1,0,1]=3 1135 B8R0.2 COC(=O)C(C)C(C)N Amb18642841 [0,1,0,0,0,0|2,0,1]=4 1136 B8R0.2 COC(=O)C(C)C(C)O Amb22059109 [0,1,0,0,0,0|2,0,1]=4 1137 B8R0.2 COC(=O)C(C)C(C)S Amb25682049 [0,1,0,0,0,0|2,0,1]=4 1138 B8R0.2 COC(=O)C(C)N(C)C Amb8455327 [0,1,0,0,0,0|2,0,1]=4 1139 B8R0.2 COC(=O)C(Cl)C(C)Cl Amb5720898 [0,1,0,0,0,0|2,0,1]=4 1140 B8R0.2 COC(=O)C(Cl)C(C)O Amb25269533 [0,1,0,0,0,0|2,0,1]=4 1141 B8R0.2 COC(=O)C(F)=C(C)C Amb27396094 [0,1,0,0,0,0|1,0,1]=3 1142 B8R0.2 COC(=O)C(F)C(C)Cl Amb27955227 [0,1,0,0,0,0|2,0,1]=4 1143 B8R0.2 COC(=O)C(F)C(C)N Amb27625216 [0,1,0,0,0,0|2,0,1]=4 1144 B8R0.2 COC(=O)C(N)=C(C)C Amb28057573 [0,1,0,0,0,0|1,0,1]=3 1145 B8R0.2 COC(=O)C(N)C(C)C Amb16233843 [0,1,0,0,0,0|1,0,1]=3 1146 B8R0.2 COC(=O)C(N)C(C)C Amb2720229 [0,1,0,0,0,0|1,0,1]=3 1147 B8R0.2 COC(=O)C(N)C(C)C Amb9702768 [0,1,0,0,0,0|1,0,1]=3 1148 B8R0.2 COC(=O)C(N)C(C)F Amb27390643 [0,1,0,0,0,0|2,0,1]=4 1149 B8R0.2 COC(=O)C(N)C(C)O Amb4005044 [0,1,0,0,0,0|2,0,1]=4 1150 B8R0.2 COC(=O)C(N)C(C)O Amb9204482 [0,1,0,0,0,0|2,0,1]=4 1151 B8R0.2 COC(=O)C(O)C(C)Br Amb27232794 [0,1,0,0,0,0|1,0,2]=4 1152 B8R0.2 COC(=O)C(O)C(C)C Amb24093829 [0,1,0,0,0,0|0,0,2]=3 1153 B8R0.2 COC(=O)C(O)C(C)N Amb27596094 [0,1,0,0,0,0|1,0,2]=4 1154 B8R0.2 COC(=O)C(O)C(C)O Amb27410609 [0,1,0,0,0,0|1,0,2]=4 1155 B8R0.2 COC(=O)C(S)C(C)C Amb28350746 [0,1,0,0,0,0|0,1,1]=3 1156 B8R0.2 COC(=O)C([NH3+])C(C)O Amb33513068 [0,1,0,0,0,0|2,0,1]=4 1157 B8R0.2 COC(=O)N(C)C(C)C Amb28324612 [0,1,0,0,0,0|2,0,0]=3 1158 B8R0.2 COC(=O)N(N)C(C)C Amb33191565 [0,1,0,0,0,0|2,0,0]=3 1159 B8R0.2 COC(=O)[C@@H](Br)C(C)C Amb27955279 [0,1,0,0,0,0|1,0,1]=3 1160 B8R0.2 COC(=O)[C@@H](Br)[C@@H](C)Cl Amb28436749 [0,1,0,0,0,0|2,0,1]=4 1161 B8R0.2 COC(=O)[C@@H](Cl)[C@@H](C)O Amb27831417 [0,1,0,0,0,0|2,0,1]=4 1162 B8R0.2 COC(=O)[C@@H](Cl)[C@H](C)O Amb33741900 [0,1,0,0,0,0|2,0,1]=4 1163 B8R0.2 COC(=O)[C@@H](N)C(C)C Amb2719737 [0,1,0,0,0,0|1,0,1]=3 1164 B8R0.2 COC(=O)[C@@H](N)C(C)C Amb533666 [0,1,0,0,0,0|1,0,1]=3 1165 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O Amb10844890 [0,1,0,0,0,0|2,0,1]=4 1166 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O Amb6296132 [0,1,0,0,0,0|2,0,1]=4 1167 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O Amb27636193 [0,1,0,0,0,0|2,0,1]=4 1168 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O Amb33483414 [0,1,0,0,0,0|2,0,1]=4 1169 B8R0.2 COC(=O)[C@@H](O)C(C)C Amb22228179 [0,1,0,0,0,0|0,0,2]=3 1170 B8R0.2 COC(=O)[C@@H](O)[C@@H](C)N Amb28075209 [0,1,0,0,0,0|1,0,2]=4 1171 B8R0.2 COC(=O)[C@H](Br)C(C)C Amb27244045 [0,1,0,0,0,0|1,0,1]=3 1172 B8R0.2 COC(=O)[C@H](Br)[C@@H](C)O Amb28121043 [0,1,0,0,0,0|2,0,1]=4 1173 B8R0.2 COC(=O)[C@H](Br)[C@H](C)O Amb27974271 [0,1,0,0,0,0|2,0,1]=4 1174 B8R0.2 COC(=O)[C@H](C)C(C)C Amb27226106 [0,1,0,0,0,0|1,0,1]=3 1175 B8R0.2 COC(=O)[C@H](C)[C@@H](C)Br Amb27607692 [0,1,0,0,0,0|2,0,1]=4 1176 B8R0.2 COC(=O)[C@H](C)[C@@H](C)N Amb28124532 [0,1,0,0,0,0|2,0,1]=4 1177 B8R0.2 COC(=O)[C@H](C)[C@@H](C)O Amb27783741 [0,1,0,0,0,0|2,0,1]=4 1178 B8R0.2 COC(=O)[C@H](C)[C@H](C)N Amb27969940 [0,1,0,0,0,0|2,0,1]=4 1179 B8R0.2 COC(=O)[C@H](Cl)[C@@H](C)Cl Amb28366837 [0,1,0,0,0,0|2,0,1]=4 1180 B8R0.2 COC(=O)[C@H](Cl)[C@@H](C)F Amb27401974 [0,1,0,0,0,0|2,0,1]=4 1181 B8R0.2 COC(=O)[C@H](Cl)[C@H](C)F Amb27607693 [0,1,0,0,0,0|2,0,1]=4 1182 B8R0.2 COC(=O)[C@H](N)C(C)C Amb10604149 [0,1,0,0,0,0|1,0,1]=3 1183 B8R0.2 COC(=O)[C@H](N)C(C)C Amb16183873 [0,1,0,0,0,0|1,0,1]=3 1184 B8R0.2 COC(=O)[C@H](N)[C@@H](C)F Amb26452555 [0,1,0,0,0,0|2,0,1]=4 1185 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O Amb22744992 [0,1,0,0,0,0|2,0,1]=4 1186 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O Amb25955119 [0,1,0,0,0,0|2,0,1]=4 1187 B8R0.2 COC(=O)[C@H](N)[C@H](C)F Amb27429857 [0,1,0,0,0,0|2,0,1]=4 1188 B8R0.2 COC(=O)[C@H](N)[C@H](C)O Amb27800278 [0,1,0,0,0,0|2,0,1]=4 1189 B8R0.2 COC(=O)[C@H](N)[C@H](C)O Amb8390421 [0,1,0,0,0,0|2,0,1]=4 1190 B8R0.2 COC(=O)[C@H](O)C(C)C Amb22388621 [0,1,0,0,0,0|0,0,2]=3 1191 B8R0.2 COC(=O)[C@H](O)[C@@H](C)Cl Amb27233486 [0,1,0,0,0,0|1,0,2]=4 1192 B8R0.2 COC(=O)[C@H](O)[C@@H](C)F Amb27210162 [0,1,0,0,0,0|1,0,2]=4 1193 B8R0.2 COC(=O)[C@H](O)[C@H](C)Cl Amb28325667 [0,1,0,0,0,0|1,0,2]=4 1194 B8R0.2 COC(C)C(=O)C(C)F Amb28285822 [0,1,0,0,0,0|2,0,1]=4 1195 B8R0.2 COC(C)C(=O)C(C)O Amb28193503 [0,1,0,0,0,0|1,0,1]=3 1196 B8R0.2 COC(C)C(=O)N(C)C Amb27812073 [0,1,0,0,0,0|2,0,1]=4 1197 B8R0.2 COC(C)C(=O)N(C)O Amb28349195 [0,1,0,0,0,0|2,0,0]=3 1198 B8R0.2 COC(C)C(Br)C(=O)Cl Amb27215381 [0,1,0,0,0,0|2,0,1]=4 1199 B8R0.2 COC(C)C(Br)C(=O)O Amb16233352 [0,1,0,0,0,0|1,0,1]=3 1200 B8R0.2 COC(C)C(Br)C(C)=O Amb27477738 [0,1,0,0,0,0|2,0,1]=4 1201 B8R0.2 COC(C)C(C)C(=O)O Amb10844268 [0,1,0,0,0,0|1,0,1]=3 1202 B8R0.2 COC(C)C(Cl)C(N)=O Amb27614474 [0,1,0,0,0,0|2,0,1]=4 1203 B8R0.2 COC(C)C(N)C(=O)O Amb17938689 [0,1,0,0,0,0|1,0,1]=3 1204 B8R0.2 COC(C)C(N)C(N)=O Amb27195568 [0,1,0,0,0,0|2,0,1]=4 1205 B8R0.2 COC(C)C(O)C(=O)O Amb27816478 [0,1,0,0,0,0|0,0,2]=3 1206 B8R0.2 COC(C)[C@@H](C)C(=O)O Amb33729616 [0,1,0,0,0,0|1,0,1]=3 1207 B8R0.2 COC(C)[C@@H](N)C(=O)O Amb25733335 [0,1,0,0,0,0|1,0,1]=3 1208 B8R0.2 COC(C)[C@H](C)C(=O)O Amb25722336 [0,1,0,0,0,0|1,0,1]=3 1209 B8R0.2 COC(C)[C@H](N)C(=O)O Amb25881538 [0,1,0,0,0,0|1,0,1]=3 1210 B8R0.2 CON(C)C(=O)C(=O)O Amb28200907 [0,1,0,0,0,0|1,0,0]=2 1211 B8R0.2 CON(C)C(=O)C(C)=O Amb8388005 [0,1,0,0,0,0|2,0,0]=3 1212 B8R0.2 CON(C)C(=O)C(C)C Amb20673733 [0,1,0,0,0,0|2,0,0]=3 1213 B8R0.2 CON(C)C(=O)C(C)N Amb33539101 [0,1,0,0,0,0|3,0,0]=4 1214 B8R0.2 CON(C)C(=O)N(C)C Amb6366851 [0,1,0,0,0,0|3,0,0]=4 1215 B8R0.2 CON(C)C(=O)[C@@H](C)N Amb24671558 [0,1,0,0,0,0|3,0,0]=4 1216 B8R0.2 CON(C)C(=O)[C@@H](C)O Amb27654927 [0,1,0,0,0,0|2,0,1]=4 1217 B8R0.2 CON(C)C(=O)[C@H](C)N Amb25110344 [0,1,0,0,0,0|3,0,0]=4 1218 B8R0.2 CON(C)C(=O)[C@H](C)O Amb27838570 [0,1,0,0,0,0|2,0,1]=4 1219 B8R0.2 CON(C)C(C)C(=O)O Amb27665034 [0,1,0,0,0,0|2,0,1]=4 1220 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O Amb26036938 [0,1,0,0,0,0|1,0,1]=3 1221 B8R0.2 CO[C@@H](C)[C@H](Br)C(N)=O Amb27863450 [0,1,0,0,0,0|2,0,1]=4 1222 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O Amb8390422 [0,1,0,0,0,0|1,0,1]=3 1223 B8R0.2 CO[C@H](C)[C@@H](Br)C(=O)O Amb27392325 [0,1,0,0,0,0|1,0,1]=3 1224 B8R0.2 CO[C@H](C)[C@@H](Cl)C(=O)O Amb27424722 [0,1,0,0,0,0|1,0,1]=3 1225 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O Amb16183892 [0,1,0,0,0,0|1,0,1]=3 1226 B8R0.2 CO[C@H](C)[C@H](N)C(N)=O Amb32723110 [0,1,0,0,0,0|2,0,1]=4 1227 B8R0.2 CO[C@H](C)[C@H](O)C(=O)O Amb25316180 [0,1,0,0,0,0|0,0,2]=3 1228 B8R0.2 CO\C(C)=C(/C)C(C)=O Amb25683972 [0,1,0,0,0,0|2,0,1]=4 1229 B8R0.2 CSC(=O)C(=O)C(C)C Amb27256416 [0,1,0,0,0,0|0,1,0]=2 1230 B8R0.2 CSC(=O)C(Br)C(C)C Amb27614276 [0,1,0,0,0,0|1,1,1]=4 1231 B8R0.2 CSC(C)C(Cl)C(=O)Cl Amb28352236 [0,1,0,0,0,0|2,0,1]=4 1232 B8R0.2 CSC(C)C(N)C(N)=O Amb30035540 [0,1,0,0,0,0|2,0,1]=4 1233 B8R0.2 CS[C@H](C)[C@H](N)C(=O)O Amb27771288 [0,1,0,0,0,0|1,0,1]=3 1234 B8R0.2 C[C@@H](CN)N(C)C(N)=O Amb27974325 [0,1,0,0,0,0|3,0,0]=4 1235 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb24117487 [0,1,0,0,0,0|1,0,1]=3 1236 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb27828649 [0,1,0,0,0,0|1,0,1]=3 1237 B8R0.2 C[C@@H](CO)[C@H](N)C(=O)O Amb24117488 [0,1,0,0,0,0|1,0,1]=3 1238 B8R0.2 C[C@@H](O)[C@@H](N)C(=O)NO Amb28049201 [0,1,0,0,0,0|2,0,1]=4 1239 B8R0.2 C[C@@H](O)[C@H](N)C(=O)NO Amb22800603 [0,1,0,0,0,0|2,0,1]=4 1240 B8R0.2 C[C@H](C(=O)O)[C@@H](O)CN Amb28056248 [0,1,0,0,0,0|2,0,1]=4 1241 B8R0.2 C[C@H](CN)[C@@H](O)C(=O)O Amb27455474 [0,1,0,0,0,0|0,0,2]=3 1242 B8R0.2 C[C@H](Cl)[C@@H](N)C(=O)NO Amb27657831 [0,1,0,0,0,0|2,0,1]=4 1243 B8R0.2 C[C@H](O)[C@@H](C)C(=O)CO Amb28346866 [0,1,0,0,0,0|2,0,1]=4 1244 B8R0.2 C\C(=C(\F)CO)C(C)C Amb27808712 [0,1,0,0,0,0|2,0,0]=3 1245 B8R0.2 C\C(=C/Br)C(=O)N(C)C Amb27252241 [0,1,0,0,0,0|3,0,0]=4 1246 B8R0.2 C\C(=N/O)C(=O)N(C)C Amb26574363 [0,1,0,0,0,0|2,0,0]=3 1247 B8R0.2 C\C(=N/O)C(O)C(C)C Amb27763029 [0,1,0,0,0,0|1,0,2]=4 1248 B8R0.2 C\C(C=O)=C(/Cl)C(=O)O Amb27199263 [0,1,0,0,0,0|1,0,2]=4 1249 B8R0.2 C\C(C=O)=C(\C)C(C)C Amb27217523 [0,1,0,0,0,0|2,0,0]=3 1250 B8R0.2 C\C(C=O)=C(\Cl)C(=O)O Amb28130176 [0,1,0,0,0,0|1,0,2]=4 1251 B8R0.2 C\C=C(/Br)C(=O)C(=O)O Amb28145171 [0,1,0,0,0,0|1,0,1]=3 1252 B8R0.2 C\C=C(/C)C(C)C(=O)O Amb27810548 [0,1,0,0,0,0|1,0,2]=4 1253 B8R0.2 C\C=C(/C)C(N)C(=O)O Amb18642706 [0,1,0,0,0,0|1,0,2]=4 1254 B8R0.2 C\C=C(\C)C(=O)N(C)C Amb27837605 [0,1,0,0,0,0|3,0,0]=4 1255 B8R0.2 C\C=C(\C)C(C)C(=O)O Amb27626047 [0,1,0,0,0,0|1,0,2]=4 1256 B8R0.2 C\C=C(\C)C(N)C(=O)O Amb27634383 [0,1,0,0,0,0|1,0,2]=4 1257 B8R0.2 C\C=C(\C)[C@H](N)C(=O)O Amb28424373 [0,1,0,0,0,0|1,0,2]=4 1258 B8R0.2 C\N=C(/Cl)C(=O)C(C)C Amb28386633 [0,1,0,0,0,0|2,0,0]=3 1259 B8R0.2 NC(C(=O)O)C(F)CO Amb27950986 [0,1,0,0,0,0|2,0,1]=4 1260 B8R0.2 NC(C(=O)O)C(O)CCl Amb27846402 [0,1,0,0,0,0|2,0,1]=4 1261 B8R0.2 NC(C(=O)O)C(O)CF Amb27592597 [0,1,0,0,0,0|2,0,1]=4 1262 B8R0.2 NC(C(=O)O)C(S)CO Amb27199680 [0,1,0,0,0,0|2,0,1]=4 1263 B8R0.2 NC(CO)C(N)C(=O)O Amb28208230 [0,1,0,0,0,0|2,0,1]=4 1264 B8R0.2 NCC(O)C(N)C(=O)O Amb27876292 [0,1,0,0,0,0|2,0,1]=4 1265 B8R0.2 NCC(O)C(O)C(=O)O Amb27830532 [0,1,0,0,0,0|1,0,2]=4 1266 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb27945588 [0,1,0,0,0,0|1,0,2]=4 1267 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb33209939 [0,1,0,0,0,0|1,0,2]=4 1268 B8R0.2 NC[C@@H](O)[C@H](N)C(=O)O Amb30884414 [0,1,0,0,0,0|2,0,1]=4 1269 B8R0.2 NC[C@H](F)[C@H](F)C(=O)O Amb27224824 [0,1,0,0,0,0|2,0,1]=4 1270 B8R0.2 N[C@@H](C(=O)O)C(O)CBr Amb28245344 [0,1,0,0,0,0|2,0,1]=4 1271 B8R0.2 N[C@@H](C(=O)O)C(S)CO Amb27233478 [0,1,0,0,0,0|2,0,1]=4 1272 B8R0.2 N[C@@H](C(=O)O)[C@H](O)CO Amb24671346 [0,1,0,0,0,0|2,0,1]=4 1273 B8R0.2 N[C@H](C(=O)O)C(O)CCl Amb27212707 [0,1,0,0,0,0|2,0,1]=4 1274 B8R0.2 N[C@H](C(=O)O)C(O)CO Amb28255690 [0,1,0,0,0,0|2,0,1]=4 1275 B8R0.2 N[C@H](C(=O)O)[C@@H](O)CO Amb25678241 [0,1,0,0,0,0|2,0,1]=4 1276 B8R0.2 O=C(O)C(=O)C(O)CO Amb27408895 [0,1,0,0,0,0|1,0,0]=2 1277 B8R0.2 O=C(O)C(Br)C(Br)CBr Amb22347644 [0,1,0,0,0,0|2,0,1]=4 1278 B8R0.2 O=C(O)C(O)C(O)CO Amb22495524 [0,1,0,0,0,0|1,0,2]=4 1279 B8R0.2 O=C(O)[C@@H](F)[C@H](O)CO Amb27195151 [0,1,0,0,0,0|2,0,1]=4 1280 B8R0.2 O=C(O)[C@H](O)C(O)CO Amb27229496 [0,1,0,0,0,0|1,0,2]=4 1281 B8R0.2 O=C(O)[C@H](O)[C@@H](O)CO Amb27849401 [0,1,0,0,0,0|1,0,2]=4 1282 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO Amb32644462 [0,1,0,0,0,0|1,0,2]=4 1283 B8R0.18 C=C(C)C(C=O)C(C)C Amb28326197 [0,1,0,0,0,0|2,0,1]=4 1284 B8R0.18 C=CC(C(=O)O)=C(C)C Amb27170334 [0,1,0,0,0,0|1,0,1]=3 1285 B8R0.18 C=CC(C(=O)O)N(C)C Amb27757609 [0,1,0,0,0,0|2,0,1]=4 1286 B8R0.18 C=NC(C(=O)O)C(C)C Amb27409212 [0,1,0,0,0,0|1,0,1]=3 1287 B8R0.18 CC(=O)C(C#N)=S(C)C Amb27589051 [0,1,0,0,0,0|3,0,0]=4 1288 B8R0.18 CC(=O)C(C#N)C(C)C Amb25810486 [0,1,0,0,0,0|2,0,1]=4 1289 B8R0.18 CC(=O)N(N=O)C(C)C Amb27481508 [0,1,0,0,0,0|2,0,0]=3 1290 B8R0.18 CC(=O)\C(=N/O)C(C)C Amb25919078 [0,1,0,0,0,0|1,0,1]=3 1291 B8R0.18 CC(=O)\C(=N\O)C(C)C Amb28134070 [0,1,0,0,0,0|1,0,1]=3 1292 B8R0.18 CC(=O)\C(=N\O)C(C)Cl Amb27875111 [0,1,0,0,0,0|2,0,1]=4 1293 B8R0.18 CC(C)=C(C#N)C(=O)O Amb3986874 [0,1,0,0,0,0|1,0,1]=3 1294 B8R0.18 CC(C)=C(CN)C(=O)O Amb28368080 [0,1,0,0,0,0|1,0,1]=3 1295 B8R0.18 CC(C)C(C#N)C(=O)Cl Amb27466440 [0,1,0,0,0,0|2,0,1]=4 1296 B8R0.18 CC(C)C(C#N)C(=O)O Amb10066977 [0,1,0,0,0,0|1,0,1]=3 1297 B8R0.18 CC(C)C(CF)C(=O)O Amb26965957 [0,1,0,0,0,0|1,0,1]=3 1298 B8R0.18 CC(C)C(CN)C(=O)O Amb18987935 [0,1,0,0,0,0|1,0,1]=3 1299 B8R0.18 CC(C)C(CN)C(=O)O Amb19375052 [0,1,0,0,0,0|1,0,1]=3 1300 B8R0.18 CC(C)C(CO)C(=O)O Amb24116921 [0,1,0,0,0,0|0,0,2]=3 1301 B8R0.18 CC(C)C(CO)C(=O)[O-] Amb32655908 [0,1,0,0,0,0|0,0,3]=4 1302 B8R0.18 CC(C)C(CS)C(=O)O Amb17593703 [0,1,0,0,0,0|0,1,1]=3 1303 B8R0.18 CC(C)C(NN)C(=O)O Amb18642886 [0,1,0,0,0,0|1,0,1]=3 1304 B8R0.18 CC(C)C(NO)C(=O)O Amb28429830 [0,1,0,0,0,0|0,0,2]=3 1305 B8R0.18 CC(C)C(ON)C(=O)O Amb24477865 [0,1,0,0,0,0|0,0,2]=3 1306 B8R0.18 CC(C)C(ON)C(=O)O Amb32652494 [0,1,0,0,0,0|0,0,2]=3 1307 B8R0.18 CC(C)N(N=O)C(N)=O Amb26954616 [0,1,0,0,0,0|2,0,0]=3 1308 B8R0.18 CC(C)[C@@H](CN)C(=O)O Amb22756745 [0,1,0,0,0,0|1,0,1]=3 1309 B8R0.18 CC(C)[C@@H](CN)C(=O)O Amb22756747 [0,1,0,0,0,0|1,0,1]=3 1310 B8R0.18 CC(C)[C@@H](NN)C(=O)O Amb27468667 [0,1,0,0,0,0|1,0,1]=3 1311 B8R0.18 CC(C)[C@@H](NO)C(N)=O Amb27469128 [0,1,0,0,0,0|1,0,2]=4 1312 B8R0.18 CC(C)[C@@H](ON)C(=O)O Amb24117143 [0,1,0,0,0,0|0,0,2]=3 1313 B8R0.18 CC(C)[C@H](CN)C(=O)O Amb25283442 [0,1,0,0,0,0|1,0,1]=3 1314 B8R0.18 CC(C)[C@H](CN)C(=O)O Amb32620230 [0,1,0,0,0,0|1,0,1]=3 1315 B8R0.18 CC(C)[C@H](CO)C(=O)O Amb27249807 [0,1,0,0,0,0|0,0,2]=3 1316 B8R0.18 CC(C)[C@H](NN)C(=O)O Amb27946435 [0,1,0,0,0,0|1,0,1]=3 1317 B8R0.18 CC(C)[C@H](NO)C(=O)O Amb27859675 [0,1,0,0,0,0|0,0,2]=3 1318 B8R0.18 CC(C)\C(=N/O)C(C)O Amb27470655 [0,1,0,0,0,0|1,0,2]=4 1319 B8R0.18 CC(C)\C(=N\O)C(N)=O Amb27769192 [0,1,0,0,0,0|1,0,1]=3 1320 B8R0.18 CC(O)C(NN)C(=O)O Amb18642940 [0,1,0,0,0,0|2,0,1]=4 1321 B8R0.18 CCC(C(=O)O)C(C)C Amb18972345 [0,1,0,0,0,0|1,0,1]=3 1322 B8R0.18 CCC(C(=O)O)C(C)O Amb18990651 [0,1,0,0,0,0|2,0,1]=4 1323 B8R0.18 CCC(C(=O)O)N(C)C Amb33551144 [0,1,0,0,0,0|2,0,1]=4 1324 B8R0.18 CCC(C(=O)O)N(C)C Amb8455277 [0,1,0,0,0,0|2,0,1]=4 1325 B8R0.18 CCC(C(C)=O)=C(C)C Amb27802654 [0,1,0,0,0,0|2,0,1]=4 1326 B8R0.18 CCC(C(C)=O)C(C)C Amb3940735 [0,1,0,0,0,0|2,0,1]=4 1327 B8R0.18 CCN(C(=O)Cl)C(C)C Amb20622995 [0,1,0,0,0,0|3,0,0]=4 1328 B8R0.18 CC[C@@H](C(=O)O)N(C)C Amb25823446 [0,1,0,0,0,0|2,0,1]=4 1329 B8R0.18 CC[C@@H](C(=O)O)[C@@H](C)O Amb28410568 [0,1,0,0,0,0|2,0,1]=4 1330 B8R0.18 CC[C@@H](C(C)=O)C(C)C Amb28195024 [0,1,0,0,0,0|2,0,1]=4 1331 B8R0.18 CC[C@H](C(=O)O)N(C)C Amb32668789 [0,1,0,0,0,0|2,0,1]=4 1332 B8R0.18 CC[C@H](C(=O)O)[C@H](C)O Amb27655638 [0,1,0,0,0,0|2,0,1]=4 1333 B8R0.18 CN(C)C(CN)C(=O)O Amb26350112 [0,1,0,0,0,0|2,0,1]=4 1334 B8R0.18 CN(C)C(CO)C(=O)O Amb24407402 [0,1,0,0,0,0|1,0,2]=4 1335 B8R0.18 CN(C)[C@@H](CO)C(=O)O Amb27397686 [0,1,0,0,0,0|1,0,2]=4 1336 B8R0.18 CNC(C(=O)O)C(C)C Amb21961623 [0,1,0,0,0,0|1,0,1]=3 1337 B8R0.18 CNC(C(=O)O)C(C)C Amb4035989 [0,1,0,0,0,0|1,0,1]=3 1338 B8R0.18 CNC(C(=O)O)C(C)F Amb27596009 [0,1,0,0,0,0|2,0,1]=4 1339 B8R0.18 CNC(C(C)=O)C(C)C Amb2369975 [0,1,0,0,0,0|2,0,1]=4 1340 B8R0.18 CN[C@@H](C(=O)O)C(C)C Amb22231334 [0,1,0,0,0,0|1,0,1]=3 1341 B8R0.18 CN[C@@H](C(=O)O)C(C)C Amb22749002 [0,1,0,0,0,0|1,0,1]=3 1342 B8R0.18 CN[C@@H](C(=O)O)C(C)O Amb22800385 [0,1,0,0,0,0|2,0,1]=4 1343 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,1,0,0,0,0|1,0,1]=3 1344 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb33812559 [0,1,0,0,0,0|1,0,1]=3 1345 B8R0.18 CN[C@H](C(=O)O)C(C)O Amb27446656 [0,1,0,0,0,0|2,0,1]=4 1346 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O Amb25887203 [0,1,0,0,0,0|2,0,1]=4 1347 B8R0.18 COC(C(=O)O)C(C)C Amb33532796 [0,1,0,0,0,0|0,0,2]=3 1348 B8R0.18 COC(C(=O)O)C(C)O Amb26003623 [0,1,0,0,0,0|1,0,2]=4 1349 B8R0.18 CO[C@H](C(=O)O)C(C)C Amb27966715 [0,1,0,0,0,0|0,0,2]=3 1350 B8R0.18 CO[C@H](C(C)=O)C(C)C Amb27453538 [0,1,0,0,0,0|1,0,2]=4 1351 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,1,0,0,0,0|0,1,1]=3 1352 B8R0.18 C\C(N)=C(\C#N)C(=O)O Amb13951423 [0,1,0,0,0,0|2,0,1]=4 1353 B8R0.18 C\C(N)=C(\C#N)C(C)C Amb28197948 [0,1,0,0,0,0|3,0,0]=4 1354 B8R0.18 C\C(O)=C(\C#N)C(=O)O Amb27444896 [0,1,0,0,0,0|2,0,1]=4 1355 B8R0.18 C\C=C(\C(N)=O)C(C)C Amb27647773 [0,1,0,0,0,0|2,0,0]=3 1356 B8R0.18 [C-]#[N+]C(C(=O)O)C(C)C Amb27945578 [0,1,0,0,0,0|1,0,1]=3 1357 B8R0.18 [C-]#[N+]C(C(N)=O)C(C)C Amb27866988 [0,1,0,0,0,0|2,0,1]=4 1358 B8R0.27 C=C(C(=O)O)C(C)(C)C Amb18642653 [0,1,0,0,0,0|1,0,0]=2 1359 B8R0.27 C=C(C(=O)O)C(C)(C)F Amb33271858 [0,1,0,0,0,0|1,0,0]=2 1360 B8R0.27 C=C(C(=O)O)C(C)(F)F Amb32810180 [0,1,0,0,0,0|2,0,0]=3 1361 B8R0.27 C=C(C(=O)O)C(F)(F)F Amb2691011 [0,1,0,0,0,0|3,0,0]=4 1362 B8R0.27 C=C(C(C)=O)[Si](C)(C)C Amb27195607 [0,1,0,0,0,0|2,1,0]=4 1363 B8R0.27 C=C(C(C)O)C(C)(C)C Amb27207354 [0,1,0,0,0,0|2,0,1]=4 1364 B8R0.27 C=C(C(N)=O)[Si](C)(C)C Amb28383232 [0,1,0,0,0,0|2,1,0]=4 1365 B8R0.27 C=C(C)C(=O)C(C)(C)C Amb24478672 [0,1,0,0,0,0|2,0,0]=3 1366 B8R0.27 CC(=O)C(=O)C(C)(C)C Amb24350511 [0,1,0,0,0,0|1,0,0]=2 1367 B8R0.27 CC(=O)C(=O)C(C)(C)F Amb27603006 [0,1,0,0,0,0|1,0,0]=2 1368 B8R0.27 CC(=O)C(=O)C(F)(F)F Amb26408284 [0,1,0,0,0,0|3,0,0]=4 1369 B8R0.27 CC(=O)C(Br)C(C)(C)C Amb25761464 [0,1,0,0,0,0|2,0,1]=4 1370 B8R0.27 CC(=O)C(Br)C(C)(C)Cl Amb27390172 [0,1,0,0,0,0|2,0,1]=4 1371 B8R0.27 CC(=O)C(C)C(C)(C)N Amb27256781 [0,1,0,0,0,0|2,0,1]=4 1372 B8R0.27 CC(=O)C(Cl)C(C)(C)Cl Amb28137878 [0,1,0,0,0,0|2,0,1]=4 1373 B8R0.27 CC(=O)C(Cl)C(C)(C)F Amb27482514 [0,1,0,0,0,0|2,0,1]=4 1374 B8R0.27 CC(=O)C(Cl)C(C)(C)O Amb25933618 [0,1,0,0,0,0|2,0,1]=4 1375 B8R0.27 CC(=O)C(O)C(C)(C)C Amb27805300 [0,1,0,0,0,0|1,0,2]=4 1376 B8R0.27 CC(=O)C(O)C(C)(C)N Amb28144996 [0,1,0,0,0,0|1,0,2]=4 1377 B8R0.27 CC(=O)C(O)C(C)(C)O Amb17593385 [0,1,0,0,0,0|1,0,2]=4 1378 B8R0.27 CC(=O)N(N)C(C)(C)C Amb33191324 [0,1,0,0,0,0|3,0,0]=4 1379 B8R0.27 CC(=O)[C@@H](C)C(C)(C)C Amb25060195 [0,1,0,0,0,0|2,0,1]=4 1380 B8R0.27 CC(=O)[C@@H](O)C(C)(C)C Amb27256659 [0,1,0,0,0,0|1,0,2]=4 1381 B8R0.27 CC(Br)C(=O)C(C)(C)C Amb25121252 [0,1,0,0,0,0|2,0,1]=4 1382 B8R0.27 CC(C(=O)Cl)C(C)(C)C Amb27450126 [0,1,0,0,0,0|2,0,1]=4 1383 B8R0.27 CC(C(=O)O)C(C)(C)C Amb4477144 [0,1,0,0,0,0|1,0,1]=3 1384 B8R0.27 CC(C(=O)O)C(C)(C)F Amb10843986 [0,1,0,0,0,0|1,0,1]=3 1385 B8R0.27 CC(C(=O)O)C(C)(C)N Amb24459511 [0,1,0,0,0,0|1,0,1]=3 1386 B8R0.27 CC(C(=O)O)C(C)(C)O Amb10844263 [0,1,0,0,0,0|1,0,1]=3 1387 B8R0.27 CC(C(=O)O)C(C)(F)F Amb27626900 [0,1,0,0,0,0|2,0,1]=4 1388 B8R0.27 CC(C(=O)O)[Si](C)(C)C Amb27945584 [0,1,0,0,0,0|1,1,1]=4 1389 B8R0.27 CC(C)(Br)C(Br)C(=O)O Amb16192461 [0,1,0,0,0,0|1,0,1]=3 1390 B8R0.27 CC(C)(C)C(=O)C(=O)O Amb8384135 [0,1,0,0,0,0|0,0,0]=1 1391 B8R0.27 CC(C)(C)C(=O)C(=S)Cl Amb17594088 [0,1,0,0,0,0|1,1,0]=3 1392 B8R0.27 CC(C)(C)C(=O)C(Br)Br Amb2779284 [0,1,0,0,0,0|2,0,1]=4 1393 B8R0.27 CC(C)(C)C(=O)C(Cl)Cl Amb10071694 [0,1,0,0,0,0|2,0,1]=4 1394 B8R0.27 CC(C)(C)C(=O)C(F)Br Amb27165811 [0,1,0,0,0,0|2,0,1]=4 1395 B8R0.27 CC(C)(C)C(=O)C(F)Cl Amb27860173 [0,1,0,0,0,0|2,0,1]=4 1396 B8R0.27 CC(C)(C)C(=O)C(F)F Amb27768664 [0,1,0,0,0,0|2,0,1]=4 1397 B8R0.27 CC(C)(C)C(Br)C(=O)Cl Amb27222881 [0,1,0,0,0,0|2,0,1]=4 1398 B8R0.27 CC(C)(C)C(Br)C(=O)O Amb18127181 [0,1,0,0,0,0|1,0,1]=3 1399 B8R0.27 CC(C)(C)C(Br)C(N)=O Amb27857005 [0,1,0,0,0,0|2,0,1]=4 1400 B8R0.27 CC(C)(C)C(F)C(=O)O Amb28285305 [0,1,0,0,0,0|1,0,1]=3 1401 B8R0.27 CC(C)(C)C(N)C(=O)O Amb493874 [0,1,0,0,0,0|1,0,1]=3 1402 B8R0.27 CC(C)(C)C(N)C(=O)O Amb9747344 [0,1,0,0,0,0|1,0,1]=3 1403 B8R0.27 CC(C)(C)C(N)C(N)=O Amb18281879 [0,1,0,0,0,0|2,0,1]=4 1404 B8R0.27 CC(C)(C)C(N)C(N)=O Amb19373321 [0,1,0,0,0,0|2,0,1]=4 1405 B8R0.27 CC(C)(C)C(O)C(=O)O Amb19299856 [0,1,0,0,0,0|0,0,2]=3 1406 B8R0.27 CC(C)(C)C(O)C(N)=O Amb27963620 [0,1,0,0,0,0|1,0,2]=4 1407 B8R0.27 CC(C)(C)C(S)C(=O)O Amb27880919 [0,1,0,0,0,0|0,1,1]=3 1408 B8R0.27 CC(C)(C)[C@@H](Br)C(=O)O Amb22746895 [0,1,0,0,0,0|1,0,1]=3 1409 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O Amb22744938 [0,1,0,0,0,0|1,0,1]=3 1410 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O Amb8513330 [0,1,0,0,0,0|1,0,1]=3 1411 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22754654 [0,1,0,0,0,0|2,0,1]=4 1412 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22899171 [0,1,0,0,0,0|2,0,1]=4 1413 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O Amb22225174 [0,1,0,0,0,0|0,0,2]=3 1414 B8R0.27 CC(C)(C)[C@H](Br)C(=O)O Amb22226488 [0,1,0,0,0,0|1,0,1]=3 1415 B8R0.27 CC(C)(C)[C@H](Cl)C(=O)O Amb3429554 [0,1,0,0,0,0|1,0,1]=3 1416 B8R0.27 CC(C)(C)[C@H](N)C(=O)O Amb2720519 [0,1,0,0,0,0|1,0,1]=3 1417 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb24271101 [0,1,0,0,0,0|2,0,1]=4 1418 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb25215486 [0,1,0,0,0,0|2,0,1]=4 1419 B8R0.27 CC(C)(C)[C@H](O)C(=O)O Amb10603129 [0,1,0,0,0,0|0,0,2]=3 1420 B8R0.27 CC(C)(Cl)C(Cl)C(=O)O Amb18126746 [0,1,0,0,0,0|1,0,1]=3 1421 B8R0.27 CC(C)(Cl)C(N)C(N)=O Amb28069484 [0,1,0,0,0,0|2,0,1]=4 1422 B8R0.27 CC(C)(Cl)C(O)C(=O)O Amb27232684 [0,1,0,0,0,0|0,0,2]=3 1423 B8R0.27 CC(C)(F)C(=O)C(=O)O Amb25079631 [0,1,0,0,0,0|0,0,0]=1 1424 B8R0.27 CC(C)(F)C(=O)C(F)F Amb33410466 [0,1,0,0,0,0|2,0,1]=4 1425 B8R0.27 CC(C)(F)C(Br)C(=O)O Amb10605635 [0,1,0,0,0,0|1,0,1]=3 1426 B8R0.27 CC(C)(F)C(N)C(=O)O Amb2695553 [0,1,0,0,0,0|1,0,1]=3 1427 B8R0.27 CC(C)(F)C(O)C(=O)O Amb25868881 [0,1,0,0,0,0|0,0,2]=3 1428 B8R0.27 CC(C)(F)[C@@H](N)C(=O)O Amb27599060 [0,1,0,0,0,0|1,0,1]=3 1429 B8R0.27 CC(C)(F)[C@@H](N)C(=O)O Amb30666687 [0,1,0,0,0,0|1,0,1]=3 1430 B8R0.27 CC(C)(F)[C@@H](O)C(=O)O Amb27660747 [0,1,0,0,0,0|0,0,2]=3 1431 B8R0.27 CC(C)(F)[C@H](N)C(=O)O Amb24369670 [0,1,0,0,0,0|1,0,1]=3 1432 B8R0.27 CC(C)(N)C(F)C(=O)O Amb33036292 [0,1,0,0,0,0|1,0,1]=3 1433 B8R0.27 CC(C)(N)C(O)C(=O)O Amb25075483 [0,1,0,0,0,0|0,0,2]=3 1434 B8R0.27 CC(C)(O)C(=O)C(Br)Br Amb8394357 [0,1,0,0,0,0|2,0,1]=4 1435 B8R0.27 CC(C)(O)C(=O)C(Cl)Cl Amb27180139 [0,1,0,0,0,0|2,0,1]=4 1436 B8R0.27 CC(C)(O)C(Br)C(=O)O Amb17595209 [0,1,0,0,0,0|1,0,1]=3 1437 B8R0.27 CC(C)(O)C(F)C(=O)O Amb32664861 [0,1,0,0,0,0|1,0,1]=3 1438 B8R0.27 CC(C)(O)C(N)C(=O)O Amb18642914 [0,1,0,0,0,0|1,0,1]=3 1439 B8R0.27 CC(C)(O)C(O)C(=O)O Amb25118477 [0,1,0,0,0,0|0,0,2]=3 1440 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O Amb8389457 [0,1,0,0,0,0|1,0,1]=3 1441 B8R0.27 CC(C)(O)[C@@H](O)C(=O)O Amb27974877 [0,1,0,0,0,0|0,0,2]=3 1442 B8R0.27 CC(C)(O)[C@H](N)C(=O)O Amb33872154 [0,1,0,0,0,0|1,0,1]=3 1443 B8R0.27 CC(C)(O)[C@H](N)C(=O)O Amb8397144 [0,1,0,0,0,0|1,0,1]=3 1444 B8R0.27 CC(C)(O)[C@H](O)C(=O)O Amb27469612 [0,1,0,0,0,0|0,0,2]=3 1445 B8R0.27 CC(C)(S)C(N)C(=O)O Amb4006839 [0,1,0,0,0,0|1,0,1]=3 1446 B8R0.27 CC(C)(S)C(N)C(=O)O Amb9703216 [0,1,0,0,0,0|1,0,1]=3 1447 B8R0.27 CC(C)(S)C([NH3+])C(=O)[O-] Amb4260371 [0,1,0,0,0,0|1,0,2]=4 1448 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O Amb28524814 [0,1,0,0,0,0|1,0,1]=3 1449 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O Amb533607 [0,1,0,0,0,0|1,0,1]=3 1450 B8R0.27 CC(C)(S)[C@H](N)C(=O)O Amb2709386 [0,1,0,0,0,0|1,0,1]=3 1451 B8R0.27 CC(C)=C(F)P(=O)(O)O Amb28132465 [0,1,0,0,0,0|2,0,1]=4 1452 B8R0.27 CC(C)C(=O)C(C)(C)C Amb33533379 [0,1,0,0,0,0|2,0,1]=4 1453 B8R0.27 CC(C)C(=O)C(C)(C)Cl Amb28194551 [0,1,0,0,0,0|2,0,1]=4 1454 B8R0.27 CC(C)C(=O)C(C)(C)O Amb27838710 [0,1,0,0,0,0|1,0,1]=3 1455 B8R0.27 CC(C)C(=O)C(C)(Cl)Cl Amb27470605 [0,1,0,0,0,0|2,0,1]=4 1456 B8R0.27 CC(C)C(=O)C(C)(F)F Amb27948423 [0,1,0,0,0,0|2,0,1]=4 1457 B8R0.27 CC(C)C(=O)C(F)(F)F Amb2694420 [0,1,0,0,0,0|2,0,1]=4 1458 B8R0.27 CC(C)C(N)P(=O)(O)O Amb2719706 [0,1,0,0,0,0|2,0,1]=4 1459 B8R0.27 CC(C)C(N)S(=O)(=O)O Amb25918816 [0,1,0,0,0,0|2,0,1]=4 1460 B8R0.27 CC(C)C(O)P(=O)(O)O Amb26927015 [0,1,0,0,0,0|1,0,2]=4 1461 B8R0.27 CC(C)C(O)S(=O)(=O)O Amb35753169 [0,1,0,0,0,0|1,0,2]=4 1462 B8R0.27 CC(C)[C@@H](N)P(=O)(O)O Amb8517217 [0,1,0,0,0,0|2,0,1]=4 1463 B8R0.27 CC(C)[C@H](N)P(=O)(O)O Amb8517216 [0,1,0,0,0,0|2,0,1]=4 1464 B8R0.27 CC(F)(F)C(=O)C(=O)O Amb25997735 [0,1,0,0,0,0|1,0,0]=2 1465 B8R0.27 CC(F)(F)C(F)C(=O)O Amb32675224 [0,1,0,0,0,0|2,0,1]=4 1466 B8R0.27 CC(F)(F)C(N)C(=O)O Amb26413853 [0,1,0,0,0,0|2,0,1]=4 1467 B8R0.27 CC(F)(F)C(O)C(=O)O Amb32809793 [0,1,0,0,0,0|1,0,2]=4 1468 B8R0.27 CC(N)C(=O)C(C)(C)C Amb18203221 [0,1,0,0,0,0|2,0,1]=4 1469 B8R0.27 CC(N)C(=O)C(C)(C)F Amb33273021 [0,1,0,0,0,0|2,0,1]=4 1470 B8R0.27 CC(O)C(=O)C(C)(C)C Amb26033521 [0,1,0,0,0,0|1,0,1]=3 1471 B8R0.27 CN(C(=O)Cl)C(C)(C)C Amb24625528 [0,1,0,0,0,0|3,0,0]=4 1472 B8R0.27 CN(C(N)=O)C(C)(C)C Amb28285107 [0,1,0,0,0,0|3,0,0]=4 1473 B8R0.27 CN(C)C(=O)C(C)(C)Br Amb18066313 [0,1,0,0,0,0|3,0,0]=4 1474 B8R0.27 CN(C)C(=O)C(C)(C)C Amb2720818 [0,1,0,0,0,0|3,0,0]=4 1475 B8R0.27 CN(C)C(=O)C(C)(C)N Amb18944787 [0,1,0,0,0,0|3,0,0]=4 1476 B8R0.27 CN(C)C(=O)C(C)(C)N Amb21958410 [0,1,0,0,0,0|3,0,0]=4 1477 B8R0.27 CN(N)C(=O)C(C)(C)C Amb33191327 [0,1,0,0,0,0|3,0,0]=4 1478 B8R0.27 CN(O)C(=O)C(C)(C)Br Amb27216371 [0,1,0,0,0,0|2,0,0]=3 1479 B8R0.27 CN(O)C(=O)C(C)(C)N Amb27195682 [0,1,0,0,0,0|2,0,0]=3 1480 B8R0.27 CP(C)(=O)C(O)C(=O)O Amb22231894 [0,1,0,0,0,0|1,0,2]=4 1481 B8R0.27 C[C@@H](C(=O)O)C(C)(C)C Amb10844023 [0,1,0,0,0,0|1,0,1]=3 1482 B8R0.27 C[C@@H](C(=O)O)C(C)(C)Cl Amb28399702 [0,1,0,0,0,0|1,0,1]=3 1483 B8R0.27 C[C@@H](C(=O)O)C(C)(C)O Amb10844262 [0,1,0,0,0,0|1,0,1]=3 1484 B8R0.27 C[C@@H](C(=O)O)C(C)(F)F Amb33728209 [0,1,0,0,0,0|2,0,1]=4 1485 B8R0.27 C[C@@H](N)C(=O)C(C)(C)C Amb35582957 [0,1,0,0,0,0|2,0,1]=4 1486 B8R0.27 C[C@@H](O)C(=O)C(C)(C)C Amb26451465 [0,1,0,0,0,0|1,0,1]=3 1487 B8R0.27 C[C@H](C(=O)O)C(C)(C)C Amb10844034 [0,1,0,0,0,0|1,0,1]=3 1488 B8R0.27 C[C@H](C(=O)O)C(C)(F)F Amb33749542 [0,1,0,0,0,0|2,0,1]=4 1489 B8R0.27 C[C@H](N)C(=O)C(C)(C)C Amb35624366 [0,1,0,0,0,0|2,0,1]=4 1490 B8R0.27 NC(=O)C(=O)C(F)(F)F Amb10840001 [0,1,0,0,0,0|3,0,0]=4 1491 B8R0.27 NC(=O)C(=O)C(F)(F)F Amb10841031 [0,1,0,0,0,0|3,0,0]=4 1492 B8R0.27 O=C(F)C(=O)C(F)(F)F Amb10840003 [0,1,0,0,0,0|3,0,0]=4 1493 B8R0.27 O=C(O)C(=O)C(Cl)(Cl)Cl Amb27433907 [0,1,0,0,0,0|2,0,0]=3 1494 B8R0.27 O=C(O)C(=O)C(F)(F)F Amb19887759 [0,1,0,0,0,0|2,0,0]=3 1495 B8R0.27 O=C(O)C(=O)C(F)(F)F Amb21953823 [0,1,0,0,0,0|2,0,0]=3 1496 B8R0.37 CC(=O)C(C)(C)C(C)C Amb17593353 [0,1,0,0,0,0|2,0,1]=4 1497 B8R0.37 CC(=O)C(C)(Cl)C(C)C Amb27260456 [0,1,0,0,0,0|2,0,1]=4 1498 B8R0.37 CC(=O)C(F)(Cl)C(C)C Amb27478248 [0,1,0,0,0,0|2,0,1]=4 1499 B8R0.37 CC(Br)C(C)(Br)C(=O)O Amb2612513 [0,1,0,0,0,0|2,0,1]=4 1500 B8R0.37 CC(C)C(C)(C)C(=O)Cl Amb27174630 [0,1,0,0,0,0|2,0,1]=4 1501 B8R0.37 CC(C)C(C)(C)C(=O)O Amb17593377 [0,1,0,0,0,0|1,0,1]=3 1502 B8R0.37 CC(C)C(C)(N)C(=O)O Amb4134845 [0,1,0,0,0,0|1,0,1]=3 1503 B8R0.37 CC(C)C(C)(N)C(N)=O Amb8384332 [0,1,0,0,0,0|2,0,1]=4 1504 B8R0.37 CC(C)C(C)(O)C(=O)O Amb18286212 [0,1,0,0,0,0|0,0,2]=3 1505 B8R0.37 CC(C)C(C)(O)C(N)=O Amb27948725 [0,1,0,0,0,0|1,0,2]=4 1506 B8R0.37 CC(C)C(F)(F)C(=O)O Amb26019477 [0,1,0,0,0,0|1,0,1]=3 1507 B8R0.37 CC(C)S(=N)(=O)N(C)O Amb35715332 [0,1,0,0,0,0|3,0,0]=4 1508 B8R0.37 CC(C)S(=O)(=O)N(C)O Amb27627152 [0,1,0,0,0,0|3,0,0]=4 1509 B8R0.37 CC(C)[C@@](C)(N)C(=O)O Amb16183901 [0,1,0,0,0,0|1,0,1]=3 1510 B8R0.37 CC(C)[C@@](C)(N)C(N)=O Amb25886638 [0,1,0,0,0,0|2,0,1]=4 1511 B8R0.37 CC(C)[C@](C)(N)C(=O)O Amb10603127 [0,1,0,0,0,0|1,0,1]=3 1512 B8R0.37 CC(C)[C@](C)(N)C(N)=O Amb25132092 [0,1,0,0,0,0|2,0,1]=4 1513 B8R0.37 CC(C)[C@](C)(O)C(=O)O Amb16231522 [0,1,0,0,0,0|0,0,2]=3 1514 B8R0.37 CC(Cl)C(C)(O)C(=O)O Amb27243989 [0,1,0,0,0,0|1,0,2]=4 1515 B8R0.37 CC(Cl)C(Cl)(Cl)C(=O)O Amb22168920 [0,1,0,0,0,0|2,0,1]=4 1516 B8R0.37 CC(F)C(F)(F)C(=O)O Amb26315929 [0,1,0,0,0,0|2,0,1]=4 1517 B8R0.37 CC(N)C(C)(C)C(=O)O Amb24681858 [0,1,0,0,0,0|2,0,1]=4 1518 B8R0.37 CC(N)C(F)(F)C(=O)O Amb25188946 [0,1,0,0,0,0|2,0,1]=4 1519 B8R0.37 CC(O)C(C)(C)C(=O)O Amb18961474 [0,1,0,0,0,0|2,0,1]=4 1520 B8R0.37 CC(O)C(C)(N)C(=O)O Amb2780038 [0,1,0,0,0,0|2,0,1]=4 1521 B8R0.37 CC(O)C(C)(N)C(=O)O Amb30585196 [0,1,0,0,0,0|2,0,1]=4 1522 B8R0.37 CC(O)C(C)(O)C(=O)O Amb18124401 [0,1,0,0,0,0|1,0,2]=4 1523 B8R0.37 CC(O)C(F)(F)C(=O)O Amb30623506 [0,1,0,0,0,0|2,0,1]=4 1524 B8R0.37 CN(C)C(C)(C)C(=O)O Amb33550826 [0,1,0,0,0,0|2,0,1]=4 1525 B8R0.37 CN(C)C(C)(C)C(=O)O Amb3976483 [0,1,0,0,0,0|2,0,1]=4 1526 B8R0.37 C[C@@H](F)[C@@](C)(N)C(=O)O Amb26917123 [0,1,0,0,0,0|2,0,1]=4 1527 B8R0.37 C[C@@H](O)[C@@](C)(N)C(=O)O Amb26458741 [0,1,0,0,0,0|2,0,1]=4 1528 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O Amb27776914 [0,1,0,0,0,0|2,0,1]=4 1529 B8R0.37 C[C@H](N)C(F)(F)C(=O)O Amb28457233 [0,1,0,0,0,0|2,0,1]=4 1530 B8R0.37 C[C@H](O)[C@@](C)(N)C(=O)O Amb22232016 [0,1,0,0,0,0|2,0,1]=4 1531 B8R0.37 C[C@H](O)[C@](C)(N)C(=O)O Amb26390846 [0,1,0,0,0,0|2,0,1]=4 1532 B8R0.37 C[C@H](O)[C@](C)(O)C(=O)O Amb27974163 [0,1,0,0,0,0|1,0,2]=4 1533 B8R1.29 CC1(C)CC(=O)C1Br Amb28458511 [0,0,0,1,0,0|2,0,1]=4 1534 B8R1.29 CC1(C)NC(=O)[C@H]1N Amb28066066 [0,0,0,1,0,0|2,0,1]=4 1535 B8R1.29 CC1(C)OC(=O)C1Cl Amb27232959 [0,0,0,1,0,0|1,0,1]=3 1536 B8R1.29 CC1(C)SC(=O)C1N Amb25836418 [0,0,0,1,0,0|1,1,1]=4 1537 B8R1.29 CC1(C)SC(=O)C1N Amb33330064 [0,0,0,1,0,0|1,1,1]=4 1538 B8R1.29 CC1(C)SC(=O)[C@@H]1N Amb26580763 [0,0,0,1,0,0|1,1,1]=4 1539 B8R1.29 CC1(C)SC(=O)[C@@H]1N Amb33465336 [0,0,0,1,0,0|1,1,1]=4 1540 B8R1.29 CC1(C)SC(=O)[C@H]1N Amb27169489 [0,0,0,1,0,0|1,1,1]=4 1541 B8R1.29 CC1C(=O)CC1(C)C Amb28122376 [0,0,0,1,0,0|2,0,1]=4 1542 B8R1.29 CC1CC(C)(O)C1=O Amb27762931 [0,0,0,1,0,0|1,0,1]=3 1543 B8R1.30 CC(=O)[C@@]1(C)C[C@H]1C Amb28131473 [0,0,0,1,0,0|2,0,1]=4 1544 B8R1.30 CC(=O)[C@]1(C)C[C@H]1C Amb28054445 [0,0,0,1,0,0|2,0,1]=4 1545 B8R1.30 CC1(C(=O)O)CC1Br Amb25889224 [0,0,0,1,0,0|2,0,1]=4 1546 B8R1.30 CC1(C(=O)O)CC1Cl Amb28325885 [0,0,0,1,0,0|2,0,1]=4 1547 B8R1.30 CC1(C(=O)O)CC1F Amb24445672 [0,0,0,1,0,0|2,0,1]=4 1548 B8R1.30 CC1CC1(C)C(=O)O Amb28456906 [0,0,0,1,0,0|1,0,1]=3 1549 B8R1.30 CC1CC1(F)C(=O)O Amb32679974 [0,0,0,1,0,0|1,0,1]=3 1550 B8R1.30 CC1CC1(N)C(=O)O Amb26066646 [0,0,0,1,0,0|1,0,1]=3 1551 B8R1.30 CC1CC1(N)C(N)=O Amb28434643 [0,0,0,1,0,0|2,0,1]=4 1552 B8R1.30 C[C@@H]1C[C@@]1(C)C(=O)O Amb24680945 [0,0,0,1,0,0|1,0,1]=3 1553 B8R1.30 C[C@@H]1C[C@@]1(N)C(N)=O Amb27969162 [0,0,0,1,0,0|2,0,1]=4 1554 B8R1.30 C[C@@H]1C[C@@]1(O)C(=O)O Amb28133921 [0,0,0,1,0,0|0,0,2]=3 1555 B8R1.30 C[C@@H]1O[C@]1(C)C(=O)O Amb28057500 [0,0,0,1,0,0|2,0,1]=4 1556 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1Cl Amb28134278 [0,0,0,1,0,0|2,0,1]=4 1557 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1F Amb24053139 [0,0,0,1,0,0|2,0,1]=4 1558 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Br Amb27222642 [0,0,0,1,0,0|2,0,1]=4 1559 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Cl Amb28196682 [0,0,0,1,0,0|2,0,1]=4 1560 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1F Amb26656665 [0,0,0,1,0,0|2,0,1]=4 1561 B8R1.30 C[C@H]1C[C@@]1(C)C(=O)O Amb27789627 [0,0,0,1,0,0|1,0,1]=3 1562 B8R1.30 C[C@H]1C[C@@]1(Cl)C(=O)O Amb28286348 [0,0,0,1,0,0|1,0,1]=3 1563 B8R1.30 C[C@H]1C[C@]1(N)C(=O)O Amb27873946 [0,0,0,1,0,0|1,0,1]=3 1564 B8R1.30 C[C@H]1C[C@]1(N)C(N)=O Amb27419998 [0,0,0,1,0,0|2,0,1]=4 1565 B8R1.30 C[C@H]1C[C@]1(O)C(=O)O Amb27881113 [0,0,0,1,0,0|0,0,2]=3 1566 B8R1.30 C[C@]1(C(=O)O)C[C@@H]1F Amb26987734 [0,0,0,1,0,0|2,0,1]=4 1567 B8R1.30 C[C@]1(C(=O)O)C[C@H]1F Amb26870422 [0,0,0,1,0,0|2,0,1]=4 1568 B8R1.30 NC1(C(=O)O)CC1Br Amb27430541 [0,0,0,1,0,0|2,0,1]=4 1569 B8R1.30 NC1(C(=O)O)CC1Cl Amb27596928 [0,0,0,1,0,0|2,0,1]=4 1570 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Br Amb28411230 [0,0,0,1,0,0|2,0,1]=4 1571 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Cl Amb25245700 [0,0,0,1,0,0|2,0,1]=4 1572 B8R1.30 N[C@@]1(C(=O)O)C[C@H]1Cl Amb28436769 [0,0,0,1,0,0|2,0,1]=4 1573 B8R1.30 N[C@]1(C(=O)O)C[C@@H]1Cl Amb26587370 [0,0,0,1,0,0|2,0,1]=4 1574 B8R1.30 N[C@]1(C(=O)O)C[C@H]1Cl Amb22748908 [0,0,0,1,0,0|2,0,1]=4 1575 B8R1.31 CC(=O)C1=C(C)CC1 Amb28316170 [0,0,0,1,0,0|2,0,1]=4 1576 B8R1.31 CC(=O)N1CCC1C Amb27603227 [0,0,0,1,0,0|3,0,0]=4 1577 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C Amb26866992 [0,0,0,1,0,0|2,0,1]=4 1578 B8R1.31 CC(=O)[C@H]1CC[C@H]1C Amb26361346 [0,0,0,1,0,0|2,0,1]=4 1579 B8R1.31 CC(C)=C1CNC1=O Amb28123439 [0,0,0,1,0,0|2,0,1]=4 1580 B8R1.31 CC(C)=C1SCC1=O Amb27485319 [0,0,0,1,0,0|1,1,1]=4 1581 B8R1.31 CC(C)C1CCC1=O Amb26599211 [0,0,0,1,0,0|2,0,1]=4 1582 B8R1.31 CC(C)C1CNC1=O Amb28252476 [0,0,0,1,0,0|2,0,1]=4 1583 B8R1.31 CC(C)C1OCC1=O Amb23456090 [0,0,0,1,0,0|1,0,2]=4 1584 B8R1.31 CC1CCC1C(=O)O Amb21857447 [0,0,0,1,0,0|1,0,1]=3 1585 B8R1.31 CC1NCC1C(=O)O Amb26984410 [0,0,0,1,0,0|2,0,1]=4 1586 B8R1.31 CN1CCC1C(=O)O Amb22011586 [0,0,0,1,0,0|2,0,1]=4 1587 B8R1.31 CN1CC[C@@H]1C(=O)O Amb24183372 [0,0,0,1,0,0|2,0,1]=4 1588 B8R1.31 CN1CC[C@H]1C(=O)O Amb24699921 [0,0,0,1,0,0|2,0,1]=4 1589 B8R1.31 C[C@@H]1CC[C@@H]1C(=O)O Amb28203929 [0,0,0,1,0,0|1,0,1]=3 1590 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb24597629 [0,0,0,1,0,0|1,0,1]=3 1591 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb33620541 [0,0,0,1,0,0|1,0,1]=3 1592 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O Amb34913092 [0,0,0,1,0,0|2,0,1]=4 1593 B8R1.31 C[C@H]1CC[C@H]1C(N)=O Amb27237000 [0,0,0,1,0,0|2,0,1]=4 1594 B8R1.31 NC1CCC1C(=O)O Amb26979562 [0,0,0,1,0,0|2,0,1]=4 1595 B8R1.31 NC1COC1C(=O)O Amb28428430 [0,0,0,1,0,0|1,0,2]=4 1596 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24117048 [0,0,0,1,0,0|2,0,1]=4 1597 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24183584 [0,0,0,1,0,0|2,0,1]=4 1598 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb25976891 [0,0,0,1,0,0|2,0,1]=4 1599 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb31291972 [0,0,0,1,0,0|2,0,1]=4 1600 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Amb24681491 [0,0,0,1,0,0|1,0,2]=4 1601 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb27187220 [0,0,0,1,0,0|2,0,1]=4 1602 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb33805288 [0,0,0,1,0,0|2,0,1]=4 1603 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb25911896 [0,0,0,1,0,0|2,0,1]=4 1604 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb33801366 [0,0,0,1,0,0|2,0,1]=4 1605 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Amb25324265 [0,0,0,1,0,0|1,0,2]=4 1606 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Amb25929776 [0,0,0,1,0,0|1,0,2]=4 1607 B8R1.31 O=C(O)C1=C(Br)CC1 Amb28454412 [0,0,0,1,0,0|2,0,1]=4 1608 B8R1.31 O=C(O)C1=C(Cl)CC1 Amb33609521 [0,0,0,1,0,0|2,0,1]=4 1609 B8R1.31 O=C(O)C1CCC1Cl Amb27490061 [0,0,0,1,0,0|2,0,1]=4 1610 B8R1.31 O=C(O)C1CCC1F Amb27835547 [0,0,0,1,0,0|2,0,1]=4 1611 B8R1.31 O=C(O)C1CCC1O Amb24481384 [0,0,0,1,0,0|2,0,1]=4 1612 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O Amb27619188 [0,0,0,1,0,0|2,0,1]=4 1613 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O Amb34913090 [0,0,0,1,0,0|2,0,1]=4 1614 B8R1.50 C=C1C(=O)CCC1C Amb27199153 [0,0,0,1,0,0|2,0,0]=3 1615 B8R1.50 C=C1C(=O)OCC1N Amb18641720 [0,0,0,1,0,0|2,0,0]=3 1616 B8R1.50 C=C1C(=O)OCC1O Amb27768713 [0,0,0,1,0,0|2,0,0]=3 1617 B8R1.50 C=C1C(=O)OC[C@H]1O Amb27945232 [0,0,0,1,0,0|2,0,0]=3 1618 B8R1.50 C=C1CCN(C)C1=O Amb24457267 [0,0,0,1,0,0|3,0,0]=4 1619 B8R1.50 CC1=C(Br)C(=O)CC1 Amb10067495 [0,0,0,1,0,0|2,0,1]=4 1620 B8R1.50 CC1=C(Br)COC1=O Amb27854509 [0,0,0,1,0,0|2,0,1]=4 1621 B8R1.50 CC1=C(C)C(=O)CC1 Amb22351730 [0,0,0,1,0,0|2,0,1]=4 1622 B8R1.50 CC1=C(C)C(=O)NC1 Amb2778404 [0,0,0,1,0,0|2,0,1]=4 1623 B8R1.50 CC1=C(C)C(C)CC1 Amb25725570 [0,0,0,1,0,0|3,0,0]=4 1624 B8R1.50 CC1=C(Cl)C(=O)OC1 Amb26020563 [0,0,0,1,0,0|1,0,1]=3 1625 B8R1.50 CC1=C(Cl)C(=O)ON1 Amb27431251 [0,0,0,1,0,0|2,0,1]=4 1626 B8R1.50 CC1=C(O)C(=O)CC1 Amb4004294 [0,0,0,1,0,0|1,0,2]=4 1627 B8R1.50 CC1=C(O)C(=O)OC1 Amb23571854 [0,0,0,1,0,0|0,0,2]=3 1628 B8R1.50 CC1=C(O)C(=O)SC1 Amb24638526 [0,0,0,1,0,0|0,1,2]=4 1629 B8R1.50 CC1=C(O)COC1=O Amb2611869 [0,0,0,1,0,0|2,0,1]=4 1630 B8R1.50 CC1=CCC(C)C1=O Amb17778666 [0,0,0,1,0,0|2,0,0]=3 1631 B8R1.50 CC1=CSC(C)C1=O Amb28124245 [0,0,0,1,0,0|3,0,0]=4 1632 B8R1.50 CC1C(=O)OC[C@@H]1O Amb27208229 [0,0,0,1,0,0|2,0,1]=4 1633 B8R1.50 CC1C(=O)OC[C@H]1O Amb27484790 [0,0,0,1,0,0|2,0,1]=4 1634 B8R1.50 CC1CCC(=O)C1=O Amb4477353 [0,0,0,1,0,0|1,0,0]=2 1635 B8R1.50 CC1CCC(=O)C1C Amb27485174 [0,0,0,1,0,0|2,0,1]=4 1636 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,0,0,1,0,0|2,0,1]=4 1637 B8R1.50 CC1CCC(=O)N1C Amb15693449 [0,0,0,1,0,0|3,0,0]=4 1638 B8R1.50 CC1CCC(C)C1=O Amb27198252 [0,0,0,1,0,0|2,0,1]=4 1639 B8R1.50 CC1CCC(F)C1=O Amb32656355 [0,0,0,1,0,0|2,0,1]=4 1640 B8R1.50 CC1CCN(C)C1=O Amb10068267 [0,0,0,1,0,0|3,0,0]=4 1641 B8R1.50 CC1CN=C(O)N1C Amb27853518 [0,0,0,1,0,0|3,0,0]=4 1642 B8R1.50 CC1CNC(=O)C1C Amb24334186 [0,0,0,1,0,0|2,0,1]=4 1643 B8R1.50 CC1CNC(=O)N1Cl Amb27759555 [0,0,0,1,0,0|3,0,0]=4 1644 B8R1.50 CC1COC(=O)C1=O Amb27262699 [0,0,0,1,0,0|0,0,0]=1 1645 B8R1.50 CC1COC(=O)C1Br Amb27401963 [0,0,0,1,0,0|1,0,1]=3 1646 B8R1.50 CC1COC(=S)N1C Amb24524261 [0,0,0,1,0,0|2,1,0]=4 1647 B8R1.50 CC1NCN(O)C1=O Amb28251778 [0,0,0,1,0,0|3,0,0]=4 1648 B8R1.50 CC1OCC(O)C1=O Amb28048942 [0,0,0,1,0,0|2,0,1]=4 1649 B8R1.50 CN1CC=C(Cl)C1=O Amb28255503 [0,0,0,1,0,0|3,0,0]=4 1650 B8R1.50 CN1CC=C(N)C1=O Amb27971244 [0,0,0,1,0,0|3,0,0]=4 1651 B8R1.50 CN1CCC(=O)C1=O Amb24183817 [0,0,0,1,0,0|2,0,0]=3 1652 B8R1.50 CN1CCC(O)C1=O Amb20622738 [0,0,0,1,0,0|2,0,1]=4 1653 B8R1.50 CN1OCC(Br)C1=O Amb28396643 [0,0,0,1,0,0|3,0,0]=4 1654 B8R1.50 CN1OCC(N)C1=O Amb25867269 [0,0,0,1,0,0|3,0,0]=4 1655 B8R1.50 C[C@@H]1C(=O)OC[C@@H]1N Amb28055949 [0,0,0,1,0,0|2,0,1]=4 1656 B8R1.50 C[C@@H]1CNC(=O)[C@@H]1N Amb27488737 [0,0,0,1,0,0|2,0,1]=4 1657 B8R1.50 C[C@@H]1CNC(=O)[C@H]1C Amb27437481 [0,0,0,1,0,0|2,0,1]=4 1658 B8R1.50 C[C@@H]1COC(=O)[C@@H]1C Amb28411565 [0,0,0,1,0,0|1,0,1]=3 1659 B8R1.50 C[C@H]1C(=O)OC[C@H]1N Amb27635064 [0,0,0,1,0,0|2,0,1]=4 1660 B8R1.50 C[C@H]1CC[C@H](C)C1=O Amb27434148 [0,0,0,1,0,0|2,0,1]=4 1661 B8R1.50 C[C@H]1CNC(=O)[C@@H]1C Amb27783966 [0,0,0,1,0,0|2,0,1]=4 1662 B8R1.50 NC1=C(O)COC1=O Amb27830449 [0,0,0,1,0,0|2,0,1]=4 1663 B8R1.50 NC1CCN(O)C1=O Amb8631273 [0,0,0,1,0,0|3,0,0]=4 1664 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb24697759 [0,0,0,1,0,0|2,0,1]=4 1665 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb32751750 [0,0,0,1,0,0|2,0,1]=4 1666 B8R1.50 N[C@@H]1C(=O)OC[C@H]1O Amb27202409 [0,0,0,1,0,0|2,0,1]=4 1667 B8R1.50 N[C@@H]1CCN(O)C1=O Amb22362895 [0,0,0,1,0,0|3,0,0]=4 1668 B8R1.50 N[C@H]1C(=O)OC[C@@H]1O Amb27620425 [0,0,0,1,0,0|2,0,1]=4 1669 B8R1.50 N[C@H]1CCN(O)C1=O Amb25345964 [0,0,0,1,0,0|3,0,0]=4 1670 B8R1.50 O=C1OCC(Br)=C1Br Amb10067289 [0,0,0,1,0,0|2,0,1]=4 1671 B8R1.50 O=C1OCC(Cl)=C1Cl Amb24551013 [0,0,0,1,0,0|2,0,1]=4 1672 B8R1.50 O=C1OCC(O)=C1Br Amb5751200 [0,0,0,1,0,0|2,0,1]=4 1673 B8R1.50 O=C1OCC(O)=C1F Amb27812981 [0,0,0,1,0,0|2,0,1]=4 1674 B8R1.50 O=C1OCC(O)=C1O Amb23505710 [0,0,0,1,0,0|1,0,2]=4 1675 B8R1.50 O=C1OCC(O)C1O Amb22730078 [0,0,0,1,0,0|1,0,2]=4 1676 B8R1.50 O=C1OC[C@@H](O)[C@@H]1O Amb24609731 [0,0,0,1,0,0|1,0,2]=4 1677 B8R1.50 O=C1OC[C@@H](O)[C@H]1Br Amb32414616 [0,0,0,1,0,0|2,0,1]=4 1678 B8R1.50 O=C1OC[C@@H](O)[C@H]1O Amb8515014 [0,0,0,1,0,0|1,0,2]=4 1679 B8R1.50 O=C1OC[C@H](O)[C@@H]1Br Amb10067848 [0,0,0,1,0,0|2,0,1]=4 1680 B8R1.50 O=C1OC[C@H](O)[C@@H]1O Amb27440225 [0,0,0,1,0,0|1,0,2]=4 1681 B8R1.50 O=C1OC[C@H](O)[C@H]1Br Amb27634828 [0,0,0,1,0,0|2,0,1]=4 1682 B8R1.50 O=C1OC[C@H](O)[C@H]1F Amb27775907 [0,0,0,1,0,0|2,0,1]=4 1683 B8R1.50 O=C1OC[C@H](O)[C@H]1O Amb15692412 [0,0,0,1,0,0|1,0,2]=4 1684 B8R1.54 C=C(C(=O)O)C1CC1 Amb24481397 [0,0,0,1,0,0|1,0,0]=2 1685 B8R1.54 CC(=O)C(=O)C1CC1 Amb20241141 [0,0,0,1,0,0|1,0,0]=2 1686 B8R1.54 CC(=O)C(C)=C1CC1 Amb28320841 [0,0,0,1,0,0|2,0,1]=4 1687 B8R1.54 CC(=O)C(C)C1CC1 Amb25798488 [0,0,0,1,0,0|2,0,1]=4 1688 B8R1.54 CC(=O)C(N)C1CC1 Amb27668423 [0,0,0,1,0,0|2,0,1]=4 1689 B8R1.54 CC(=O)N(C)C1CC1 Amb27259327 [0,0,0,1,0,0|3,0,0]=4 1690 B8R1.54 CC(=O)N(N)C1CC1 Amb33191631 [0,0,0,1,0,0|3,0,0]=4 1691 B8R1.54 CC(Br)C(=O)C1CC1 Amb22498754 [0,0,0,1,0,0|2,0,1]=4 1692 B8R1.54 CC(C(=O)O)=C1CC1 Amb24450586 [0,0,0,1,0,0|1,0,1]=3 1693 B8R1.54 CC(C(=O)O)C1CC1 Amb33537630 [0,0,0,1,0,0|1,0,1]=3 1694 B8R1.54 CC(C)C(=O)C1CC1 Amb13952508 [0,0,0,1,0,0|2,0,1]=4 1695 B8R1.54 CC(Cl)C(=O)C1CC1 Amb27436051 [0,0,0,1,0,0|2,0,1]=4 1696 B8R1.54 CC(N)C(=O)C1CC1 Amb18833068 [0,0,0,1,0,0|2,0,1]=4 1697 B8R1.54 CC(O)C(=O)C1CC1 Amb25094291 [0,0,0,1,0,0|1,0,1]=3 1698 B8R1.54 CN(C(=O)Cl)C1CC1 Amb32671378 [0,0,0,1,0,0|3,0,0]=4 1699 B8R1.54 CN(C)C(=O)C1CC1 Amb2721152 [0,0,0,1,0,0|3,0,0]=4 1700 B8R1.54 CN(O)C(=O)C1CC1 Amb27195681 [0,0,0,1,0,0|2,0,0]=3 1701 B8R1.54 C[C@@H](C(=O)O)C1CC1 Amb33732043 [0,0,0,1,0,0|1,0,1]=3 1702 B8R1.54 C[C@@H](N)C(=O)C1CC1 Amb30024581 [0,0,0,1,0,0|2,0,1]=4 1703 B8R1.54 C[C@H](C(=O)O)C1CC1 Amb33744363 [0,0,0,1,0,0|1,0,1]=3 1704 B8R1.54 C[C@H](N)C(=O)C1CC1 Amb33131766 [0,0,0,1,0,0|2,0,1]=4 1705 B8R1.54 NC(=O)C(Cl)C1CC1 Amb26875098 [0,0,0,1,0,0|2,0,1]=4 1706 B8R1.54 NC(=O)C(N)C1CC1 Amb18282442 [0,0,0,1,0,0|2,0,1]=4 1707 B8R1.54 NC(=O)C(N)C1CC1 Amb28991331 [0,0,0,1,0,0|2,0,1]=4 1708 B8R1.54 NC(=O)C(O)C1CC1 Amb20630809 [0,0,0,1,0,0|1,0,2]=4 1709 B8R1.54 NC(=O)[C@H](N)C1CC1 Amb27436476 [0,0,0,1,0,0|2,0,1]=4 1710 B8R1.54 NC(C(=O)O)C1CC1 Amb19515010 [0,0,0,1,0,0|1,0,1]=3 1711 B8R1.54 NC(C(=O)O)C1CC1 Amb2696737 [0,0,0,1,0,0|1,0,1]=3 1712 B8R1.54 N[C@@H](C(=O)O)C1CC1 Amb2699141 [0,0,0,1,0,0|1,0,1]=3 1713 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb19929447 [0,0,0,1,0,0|1,0,1]=3 1714 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb2694840 [0,0,0,1,0,0|1,0,1]=3 1715 B8R1.54 O=C(Cl)C(=O)C1CC1 Amb26514373 [0,0,0,1,0,0|1,0,0]=2 1716 B8R1.54 O=C(O)C(=O)C1CC1 Amb16233327 [0,0,0,1,0,0|0,0,0]=1 1717 B8R1.54 O=C(O)C(F)C1CC1 Amb25936979 [0,0,0,1,0,0|1,0,1]=3 1718 B8R1.54 O=C(O)C(O)C1CC1 Amb18282441 [0,0,0,1,0,0|0,0,2]=3 1719 B8R1.54 O=C([O-])C(=O)C1CC1 Amb22641890 [0,0,0,1,0,0|0,0,1]=2 1720 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,0,0,1,0,0|2,0,1]=4 1721 B8R1.77 CC(=O)C1OC1(C)C Amb4605897 [0,0,0,1,0,0|1,0,2]=4 1722 B8R1.77 CC(O)C1=CC1(C)C Amb28191917 [0,0,0,1,0,0|2,0,1]=4 1723 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [0,0,0,1,0,0|2,0,1]=4 1724 B8R1.77 CC1(C)CC1C(=O)Cl Amb16230811 [0,0,0,1,0,0|2,0,1]=4 1725 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [0,0,0,1,0,0|1,0,1]=3 1726 B8R1.77 CC1(C)CC1C(N)=O Amb2778846 [0,0,0,1,0,0|2,0,1]=4 1727 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [0,0,0,1,0,0|1,0,1]=3 1728 B8R1.77 CC1(C)C[C@@H]1C(N)=O Amb4166316 [0,0,0,1,0,0|2,0,1]=4 1729 B8R1.77 CC1(C)C[C@H]1C(N)=O Amb10072071 [0,0,0,1,0,0|2,0,1]=4 1730 B8R1.77 CC1(C)OC1C(=O)O Amb24481352 [0,0,0,1,0,0|0,0,2]=3 1731 B8R1.77 CC1(C)SC1C(N)=O Amb27838390 [0,0,0,1,0,0|1,1,1]=4 1732 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [0,0,0,1,0,0|2,0,1]=4 1733 B8R1.87 CC1(C)C(=O)C1(C)C Amb28253565 [0,0,0,1,0,0|2,0,1]=4 1734 B8R0.23 C=C(C)C(=O)CC(C)C Amb25222433 [0,0,0,0,0,1|2,0,0]=3 1735 B8R0.23 C=C(C)C(=O)CC(C)N Amb27173379 [0,0,0,0,0,1|3,0,0]=4 1736 B8R0.23 C=C(C)C(=O)CN(C)C Amb28423222 [0,0,0,0,0,1|3,0,0]=4 1737 B8R0.23 C=C(C)C(=O)NC(C)C Amb20621998 [0,0,0,0,0,1|2,0,0]=3 1738 B8R0.23 C=C(C)C(=O)NC(C)O Amb28250875 [0,0,0,0,0,1|3,0,0]=4 1739 B8R0.23 C=C(C)C(=O)NC(N)=O Amb27232527 [0,0,0,0,0,1|1,0,2]=4 1740 B8R0.23 C=C(C)C(=O)OC(C)C Amb17934142 [0,0,0,0,0,1|2,0,0]=3 1741 B8R0.23 C=C(C)CC(=O)C(=O)O Amb28073130 [0,0,0,0,0,1|0,0,2]=3 1742 B8R0.23 C=C(C)CC(=O)C(C)N Amb27949490 [0,0,0,0,0,1|3,0,0]=4 1743 B8R0.23 C=C(C)CC(=O)N(C)C Amb28184722 [0,0,0,0,0,1|3,0,0]=4 1744 B8R0.23 C=C(C)CC(=O)[C@@H](C)N Amb30024552 [0,0,0,0,0,1|3,0,0]=4 1745 B8R0.23 C=C(C)CC(=O)[C@H](C)N Amb35624364 [0,0,0,0,0,1|3,0,0]=4 1746 B8R0.23 C=C(C)OC(=O)C(C)N Amb28125484 [0,0,0,0,0,1|3,0,0]=4 1747 B8R0.23 C=C(C)\C(C)=C\C(=O)O Amb17593311 [0,0,0,0,0,1|1,0,2]=4 1748 B8R0.23 C=C(CC(=O)O)C(C)=O Amb27831643 [0,0,0,0,0,1|2,0,1]=4 1749 B8R0.23 C=C(CC(C)C)C(=O)Cl Amb28256819 [0,0,0,0,0,1|2,0,0]=3 1750 B8R0.23 C=C(CC(C)C)C(=O)O Amb33542856 [0,0,0,0,0,1|1,0,0]=2 1751 B8R0.23 C=C(CC(C)C)C(C)=O Amb22277685 [0,0,0,0,0,1|2,0,0]=3 1752 B8R0.23 C=C(CN(C)C)C(=O)O Amb33544507 [0,0,0,0,0,1|2,0,0]=3 1753 B8R0.23 C=C(CN(C)C)C(C)=O Amb8397272 [0,0,0,0,0,1|3,0,0]=4 1754 B8R0.23 C=C(CN(C)O)C(=O)O Amb27640409 [0,0,0,0,0,1|3,0,0]=4 1755 B8R0.23 C=C(Cl)C(=O)NN(C)C Amb27856408 [0,0,0,0,0,1|3,0,0]=4 1756 B8R0.23 C=C(Cl)CC(=O)C(C)C Amb28144043 [0,0,0,0,0,1|2,0,0]=3 1757 B8R0.23 C=C(NC(C)=O)C(=O)O Amb8513049 [0,0,0,0,0,1|2,0,1]=4 1758 B8R0.23 C=C(O)CC(=C)N(C)C Amb27767982 [0,0,0,0,0,1|3,0,0]=4 1759 B8R0.23 C=C(OC(C)C)C(C)=O Amb27263012 [0,0,0,0,0,1|2,0,0]=3 1760 B8R0.23 CC(=O)C(=O)C=C(C)C Amb27843950 [0,0,0,0,0,1|1,0,1]=3 1761 B8R0.23 CC(=O)C(=O)CC(=O)O Amb17593364 [0,0,0,0,0,1|1,0,1]=3 1762 B8R0.23 CC(=O)C(=O)CC(C)C Amb22489717 [0,0,0,0,0,1|1,0,0]=2 1763 B8R0.23 CC(=O)C(=O)NC(C)C Amb17399820 [0,0,0,0,0,1|1,0,0]=2 1764 B8R0.23 CC(=O)C(=O)OC(C)C Amb22232277 [0,0,0,0,0,1|1,0,0]=2 1765 B8R0.23 CC(=O)C(C)CC(C)C Amb24640121 [0,0,0,0,0,1|2,0,1]=4 1766 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [0,0,0,0,0,1|1,0,2]=4 1767 B8R0.23 CC(=O)CC(=O)C(=O)O Amb18642736 [0,0,0,0,0,1|1,0,1]=3 1768 B8R0.23 CC(=O)CC(=O)C(C)=O Amb25806867 [0,0,0,0,0,1|2,0,1]=4 1769 B8R0.23 CC(=O)CC(=O)C(C)C Amb17778966 [0,0,0,0,0,1|1,0,0]=2 1770 B8R0.23 CC(=O)CC(=O)C(F)F Amb2687035 [0,0,0,0,0,1|3,0,0]=4 1771 B8R0.23 CC(=O)CC(=O)N(C)C Amb1152296 [0,0,0,0,0,1|2,0,0]=3 1772 B8R0.23 CC(=O)CC(=S)N(C)C Amb27836775 [0,0,0,0,0,1|2,1,0]=4 1773 B8R0.23 CC(=O)CC(Br)C(C)C Amb28436887 [0,0,0,0,0,1|2,0,1]=4 1774 B8R0.23 CC(=O)CC(Cl)=C(C)C Amb28351823 [0,0,0,0,0,1|2,0,1]=4 1775 B8R0.23 CC(=O)CC(N)C(C)C Amb27409984 [0,0,0,0,0,1|2,0,1]=4 1776 B8R0.23 CC(=O)CN(C)C(C)C Amb22587141 [0,0,0,0,0,1|3,0,0]=4 1777 B8R0.23 CC(=O)CS(=O)C(C)C Amb27804515 [0,0,0,0,0,1|2,0,0]=3 1778 B8R0.23 CC(=O)C[C@@H](O)C(C)C Amb25135567 [0,0,0,0,0,1|1,0,2]=4 1779 B8R0.23 CC(=O)C[C@H](C)C(C)C Amb28285288 [0,0,0,0,0,1|2,0,1]=4 1780 B8R0.23 CC(=O)NC(=O)C(C)=O Amb28245557 [0,0,0,0,0,1|2,0,1]=4 1781 B8R0.23 CC(=O)NC(=O)C(C)C Amb28428628 [0,0,0,0,0,1|1,0,0]=2 1782 B8R0.23 CC(=O)NC(=O)C(C)Cl Amb9534235 [0,0,0,0,0,1|2,0,0]=3 1783 B8R0.23 CC(=O)NC(=S)N(C)C Amb24741222 [0,0,0,0,0,1|2,1,0]=4 1784 B8R0.23 CC(=O)OC(=O)C(C)=O Amb26528827 [0,0,0,0,0,1|2,0,1]=4 1785 B8R0.23 CC(=O)OC(=O)C(C)O Amb28049127 [0,0,0,0,0,1|2,0,0]=3 1786 B8R0.23 CC(=O)[C@@H](N)CC(C)C Amb28344512 [0,0,0,0,0,1|2,0,1]=4 1787 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [0,0,0,0,0,1|1,0,2]=4 1788 B8R0.23 CC(=O)[C@H](N)CC(C)C Amb27490707 [0,0,0,0,0,1|2,0,1]=4 1789 B8R0.23 CC(=O)\C(Br)=C\C(=O)O Amb27983634 [0,0,0,0,0,1|2,0,1]=4 1790 B8R0.23 CC(=O)\C(C)=C/C(C)O Amb27838725 [0,0,0,0,0,1|3,0,0]=4 1791 B8R0.23 CC(=O)\C(C)=C/N(C)C Amb27191797 [0,0,0,0,0,1|3,0,0]=4 1792 B8R0.23 CC(=O)\C(C)=C\C(=O)O Amb27838567 [0,0,0,0,0,1|2,0,1]=4 1793 B8R0.23 CC(=O)\C(C)=C\N(C)C Amb28199737 [0,0,0,0,0,1|3,0,0]=4 1794 B8R0.23 CC(=O)\C(C)=N/C(C)C Amb27165098 [0,0,0,0,0,1|2,0,0]=3 1795 B8R0.23 CC(=O)\C(C)=N\C(C)C Amb27826830 [0,0,0,0,0,1|2,0,0]=3 1796 B8R0.23 CC(=O)\C(C)=N\N(C)C Amb26984737 [0,0,0,0,0,1|3,0,0]=4 1797 B8R0.23 CC(=O)\C=C(/C)C(=O)O Amb18642577 [0,0,0,0,0,1|2,0,1]=4 1798 B8R0.23 CC(=O)\C=C(/C)C(C)C Amb27649040 [0,0,0,0,0,1|2,0,0]=3 1799 B8R0.23 CC(=O)\C=C(/C)N(C)C Amb28429281 [0,0,0,0,0,1|3,0,0]=4 1800 B8R0.23 CC(=O)\C=C(/Cl)N(C)C Amb27844137 [0,0,0,0,0,1|3,0,0]=4 1801 B8R0.23 CC(=O)\C=C(/N)C(=O)O Amb28206217 [0,0,0,0,0,1|2,0,1]=4 1802 B8R0.23 CC(=O)\C=C(/N)C(C)C Amb27477023 [0,0,0,0,0,1|2,0,0]=3 1803 B8R0.23 CC(=O)\C=C(/O)C(=O)O Amb28122229 [0,0,0,0,0,1|1,0,2]=4 1804 B8R0.23 CC(=O)\C=C(\Br)C(=O)O Amb27419942 [0,0,0,0,0,1|2,0,1]=4 1805 B8R0.23 CC(=O)\C=C(\Cl)N(C)C Amb27424743 [0,0,0,0,0,1|3,0,0]=4 1806 B8R0.23 CC(=O)\C=C(\O)C(=O)O Amb25856143 [0,0,0,0,0,1|1,0,2]=4 1807 B8R0.23 CC(=S)CC(=O)C(C)C Amb27838816 [0,0,0,0,0,1|1,1,0]=3 1808 B8R0.23 CC(Br)CC(=O)C(=O)O Amb28146183 [0,0,0,0,0,1|1,0,0]=2 1809 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [0,0,0,0,0,1|2,0,1]=4 1810 B8R0.23 CC(C)=C(C)CC(=O)O Amb18642613 [0,0,0,0,0,1|1,0,1]=3 1811 B8R0.23 CC(C)=CC(=O)C(C)C Amb27389734 [0,0,0,0,0,1|2,0,0]=3 1812 B8R0.23 CC(C)=CC(=O)C(C)N Amb28071144 [0,0,0,0,0,1|3,0,0]=4 1813 B8R0.23 CC(C)=CC(=O)N(C)C Amb25311833 [0,0,0,0,0,1|3,0,0]=4 1814 B8R0.23 CC(C)=CC(=O)[C@@H](C)N Amb30024530 [0,0,0,0,0,1|3,0,0]=4 1815 B8R0.23 CC(C)=CC(O)C(=O)O Amb28346343 [0,0,0,0,0,1|0,0,3]=4 1816 B8R0.23 CC(C)=C[C@@H](O)C(=O)O Amb27228179 [0,0,0,0,0,1|0,0,3]=4 1817 B8R0.23 CC(C)=C[C@H](O)C(=O)O Amb27473652 [0,0,0,0,0,1|0,0,3]=4 1818 B8R0.23 CC(C)=NS(=O)C(C)C Amb35685241 [0,0,0,0,0,1|3,0,0]=4 1819 B8R0.23 CC(C)C(=O)CS(C)=O Amb28041249 [0,0,0,0,0,1|2,0,0]=3 1820 B8R0.23 CC(C)C(=O)C[C@H](C)O Amb28285164 [0,0,0,0,0,1|1,0,1]=3 1821 B8R0.23 CC(C)C(=O)C[N+](=O)[O-] Amb27802158 [0,0,0,0,0,1|1,0,1]=3 1822 B8R0.23 CC(C)C(=O)NC(N)=O Amb25716051 [0,0,0,0,0,1|1,0,0]=2 1823 B8R0.23 CC(C)C(=S)NC(N)=O Amb27168629 [0,0,0,0,0,1|1,1,0]=3 1824 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,0,0,0,0,1|1,0,1]=3 1825 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,0,0,0,0,1|2,0,1]=4 1826 B8R0.23 CC(C)C(C)NC(=O)Cl Amb35637133 [0,0,0,0,0,1|2,0,1]=4 1827 B8R0.23 CC(C)C(C)NC(N)=O Amb7761978 [0,0,0,0,0,1|2,0,1]=4 1828 B8R0.23 CC(C)C(C)OC(=O)Cl Amb27835399 [0,0,0,0,0,1|2,0,1]=4 1829 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [0,0,0,0,0,1|1,0,1]=3 1830 B8R0.23 CC(C)C(Cl)OC(=O)Cl Amb8515447 [0,0,0,0,0,1|2,0,1]=4 1831 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [0,0,0,0,0,1|1,0,1]=3 1832 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [0,0,0,0,0,1|1,0,1]=3 1833 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,0,0,0,0,1|2,0,1]=4 1834 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [0,0,0,0,0,1|0,0,2]=3 1835 B8R0.23 CC(C)CC(=N)C(=O)O Amb27268516 [0,0,0,0,0,1|1,0,0]=2 1836 B8R0.23 CC(C)CC(=O)C(=O)Cl Amb28350424 [0,0,0,0,0,1|1,0,0]=2 1837 B8R0.23 CC(C)CC(=O)C(=O)O Amb8387123 [0,0,0,0,0,1|0,0,0]=1 1838 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb21962530 [0,0,0,0,0,1|0,0,1]=2 1839 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb22360647 [0,0,0,0,0,1|0,0,1]=2 1840 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb8393074 [0,0,0,0,0,1|0,0,1]=2 1841 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb8513874 [0,0,0,0,0,1|0,0,1]=2 1842 B8R0.23 CC(C)CC(=O)C(C)C Amb17138370 [0,0,0,0,0,1|2,0,1]=4 1843 B8R0.23 CC(C)CC(=O)C(C)N Amb18832558 [0,0,0,0,0,1|2,0,1]=4 1844 B8R0.23 CC(C)CC(=O)C(C)O Amb25808608 [0,0,0,0,0,1|1,0,1]=3 1845 B8R0.23 CC(C)CC(=O)C(F)F Amb27838473 [0,0,0,0,0,1|2,0,1]=4 1846 B8R0.23 CC(C)CC(=O)C(N)=S Amb28046427 [0,0,0,0,0,1|1,1,0]=3 1847 B8R0.23 CC(C)CC(=O)N(C)C Amb3886553 [0,0,0,0,0,1|3,0,0]=4 1848 B8R0.23 CC(C)CC(=O)N(C)N Amb33191428 [0,0,0,0,0,1|3,0,0]=4 1849 B8R0.23 CC(C)CC(=O)[C@@H](C)N Amb30024801 [0,0,0,0,0,1|2,0,1]=4 1850 B8R0.23 CC(C)CC(=O)[C@H](C)N Amb35624365 [0,0,0,0,0,1|2,0,1]=4 1851 B8R0.23 CC(C)CC(=O)[C@H](C)O Amb27598746 [0,0,0,0,0,1|1,0,1]=3 1852 B8R0.23 CC(C)CC(Br)C(=O)Cl Amb26515942 [0,0,0,0,0,1|2,0,1]=4 1853 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [0,0,0,0,0,1|1,0,1]=3 1854 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [0,0,0,0,0,1|1,0,1]=3 1855 B8R0.23 CC(C)CC(Cl)C(=O)Cl Amb27400431 [0,0,0,0,0,1|2,0,1]=4 1856 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [0,0,0,0,0,1|1,0,1]=3 1857 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [0,0,0,0,0,1|1,0,1]=3 1858 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [0,0,0,0,0,1|1,0,1]=3 1859 B8R0.23 CC(C)CC(N)C(N)=O Amb6334827 [0,0,0,0,0,1|2,0,1]=4 1860 B8R0.23 CC(C)CC(N)C(N)=O Amb9729639 [0,0,0,0,0,1|2,0,1]=4 1861 B8R0.23 CC(C)CC(N)[PH](=O)O Amb27831348 [0,0,0,0,0,1|2,0,1]=4 1862 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [0,0,0,0,0,1|0,0,2]=3 1863 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [0,0,0,0,0,1|0,0,3]=4 1864 B8R0.23 CC(C)CC(O)[PH](=O)O Amb27255267 [0,0,0,0,0,1|1,0,2]=4 1865 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [0,0,0,0,0,1|0,1,1]=3 1866 B8R0.23 CC(C)CN(C)C(=O)Cl Amb26589878 [0,0,0,0,0,1|3,0,0]=4 1867 B8R0.23 CC(C)CN(N)C(N)=O Amb27624191 [0,0,0,0,0,1|3,0,0]=4 1868 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [0,0,0,0,0,1|1,0,1]=3 1869 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [0,0,0,0,0,1|1,0,1]=3 1870 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [0,0,0,0,0,1|1,0,1]=3 1871 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [0,0,0,0,0,1|1,0,1]=3 1872 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb16183944 [0,0,0,0,0,1|2,0,1]=4 1873 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,0,0,0,0,1|2,0,1]=4 1874 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [0,0,0,0,0,1|0,0,2]=3 1875 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [0,0,0,0,0,1|0,1,1]=3 1876 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [0,0,0,0,0,1|1,0,1]=3 1877 B8R0.23 CC(C)C[C@H](Br)C(N)=O Amb28197754 [0,0,0,0,0,1|2,0,1]=4 1878 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [0,0,0,0,0,1|1,0,1]=3 1879 B8R0.23 CC(C)C[C@H](Cl)C(=O)Cl Amb27657532 [0,0,0,0,0,1|2,0,1]=4 1880 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [0,0,0,0,0,1|1,0,1]=3 1881 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [0,0,0,0,0,1|1,0,1]=3 1882 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [0,0,0,0,0,1|1,0,1]=3 1883 B8R0.23 CC(C)C[C@H](N)C(=O)S Amb27810129 [0,0,0,0,0,1|1,1,1]=4 1884 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb10670112 [0,0,0,0,0,1|2,0,1]=4 1885 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb8515324 [0,0,0,0,0,1|2,0,1]=4 1886 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [0,0,0,0,0,1|0,0,2]=3 1887 B8R0.23 CC(C)N(C)CC(=O)O Amb10609863 [0,0,0,0,0,1|2,0,0]=3 1888 B8R0.23 CC(C)N(C)CC(=O)O Amb6639901 [0,0,0,0,0,1|2,0,0]=3 1889 B8R0.23 CC(C)NC(=O)C(=O)O Amb2693957 [0,0,0,0,0,1|0,0,0]=1 1890 B8R0.23 CC(C)NC(=O)C(C)Br Amb17331366 [0,0,0,0,0,1|2,0,1]=4 1891 B8R0.23 CC(C)NC(=O)C(C)C Amb2779926 [0,0,0,0,0,1|2,0,1]=4 1892 B8R0.23 CC(C)NC(=O)C(C)Cl Amb9745741 [0,0,0,0,0,1|2,0,1]=4 1893 B8R0.23 CC(C)NC(=O)C(C)N Amb21958713 [0,0,0,0,0,1|2,0,1]=4 1894 B8R0.23 CC(C)NC(=O)C(C)N Amb9730026 [0,0,0,0,0,1|2,0,1]=4 1895 B8R0.23 CC(C)NC(=O)C(C)O Amb9421392 [0,0,0,0,0,1|1,0,1]=3 1896 B8R0.23 CC(C)NC(=O)C(C)S Amb27196675 [0,0,0,0,0,1|1,1,1]=4 1897 B8R0.23 CC(C)NC(=O)C(Cl)Cl Amb3366917 [0,0,0,0,0,1|2,0,1]=4 1898 B8R0.23 CC(C)NC(=O)C(F)F Amb28286578 [0,0,0,0,0,1|2,0,1]=4 1899 B8R0.23 CC(C)NC(=O)C(N)=S Amb19514732 [0,0,0,0,0,1|1,1,0]=3 1900 B8R0.23 CC(C)NC(=O)N(C)O Amb27174320 [0,0,0,0,0,1|2,0,0]=3 1901 B8R0.23 CC(C)NC(=O)[C@@H](C)N Amb17987730 [0,0,0,0,0,1|2,0,1]=4 1902 B8R0.23 CC(C)NC(=O)[C@@H](C)O Amb25724418 [0,0,0,0,0,1|1,0,1]=3 1903 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [0,0,0,0,0,1|1,0,1]=3 1904 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [0,0,0,0,0,1|1,0,1]=3 1905 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [0,0,0,0,0,1|1,0,1]=3 1906 B8R0.23 CC(C)OC(=O)C(C)Br Amb18090825 [0,0,0,0,0,1|2,0,1]=4 1907 B8R0.23 CC(C)OC(=O)C(C)C Amb22230769 [0,0,0,0,0,1|2,0,1]=4 1908 B8R0.23 CC(C)OC(=O)C(C)N Amb31292800 [0,0,0,0,0,1|2,0,1]=4 1909 B8R0.23 CC(C)OC(=O)C(C)N Amb9493142 [0,0,0,0,0,1|2,0,1]=4 1910 B8R0.23 CC(C)OC(=O)C(Cl)Cl Amb26019475 [0,0,0,0,0,1|2,0,1]=4 1911 B8R0.23 CC(C)OC(=O)N(C)C Amb19515936 [0,0,0,0,0,1|3,0,0]=4 1912 B8R0.23 CC(C)OC(=O)N(C)N Amb33191432 [0,0,0,0,0,1|3,0,0]=4 1913 B8R0.23 CC(C)OC(=O)N(C)O Amb25961035 [0,0,0,0,0,1|2,0,0]=3 1914 B8R0.23 CC(C)OC(=O)[C@@H](C)N Amb16233848 [0,0,0,0,0,1|2,0,1]=4 1915 B8R0.23 CC(C)OC(=O)[C@@H](C)N Amb22748656 [0,0,0,0,0,1|2,0,1]=4 1916 B8R0.23 CC(C)OC(=O)[C@@H](C)O Amb24117117 [0,0,0,0,0,1|1,0,1]=3 1917 B8R0.23 CC(C)OC(=O)[C@H](C)Br Amb28399574 [0,0,0,0,0,1|2,0,1]=4 1918 B8R0.23 CC(C)OC(=O)[C@H](C)N Amb19930723 [0,0,0,0,0,1|2,0,1]=4 1919 B8R0.23 CC(C)OC(=O)[C@H](C)N Amb25879103 [0,0,0,0,0,1|2,0,1]=4 1920 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [0,0,0,0,0,1|1,0,1]=3 1921 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb6541556 [0,0,0,0,0,1|1,0,2]=4 1922 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb9172207 [0,0,0,0,0,1|1,0,2]=4 1923 B8R0.23 CC(C)OC(F)C(=O)O Amb28045324 [0,0,0,0,0,1|1,0,1]=3 1924 B8R0.23 CC(C)SC(=O)C(C)Br Amb27751317 [0,0,0,0,0,1|2,0,1]=4 1925 B8R0.23 CC(C)SC(=S)C(=O)O Amb27196601 [0,0,0,0,0,1|0,1,0]=2 1926 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [0,0,0,0,0,1|1,0,1]=3 1927 B8R0.23 CC(C)SC(C)C(N)=O Amb28071700 [0,0,0,0,0,1|2,0,1]=4 1928 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [0,0,0,0,0,1|1,0,1]=3 1929 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,0,0,0,0,1|1,0,1]=3 1930 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [0,0,0,0,0,1|1,0,1]=3 1931 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [0,0,0,0,0,1|1,0,1]=3 1932 B8R0.23 CC(C)[C@@H](N)CC(N)=O Amb28340737 [0,0,0,0,0,1|2,0,1]=4 1933 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [0,0,0,0,0,1|0,0,2]=3 1934 B8R0.23 CC(C)[C@@H](O)CC(N)=O Amb27443470 [0,0,0,0,0,1|1,0,2]=4 1935 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [0,0,0,0,0,1|1,0,1]=3 1936 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [0,0,0,0,0,1|1,0,1]=3 1937 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,0,0,0,0,1|2,0,1]=4 1938 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [0,0,0,0,0,1|0,0,2]=3 1939 B8R0.23 CC(C)\C(N)=C\C(N)=O Amb27413103 [0,0,0,0,0,1|2,0,0]=3 1940 B8R0.23 CC(C)\C(N)=C\C(N)=S Amb28241427 [0,0,0,0,0,1|2,1,0]=4 1941 B8R0.23 CC(C)\C=C(/F)C(=O)O Amb34913203 [0,0,0,0,0,1|1,0,0]=2 1942 B8R0.23 CC(C)\C=C(\Br)C(=O)O Amb27789870 [0,0,0,0,0,1|1,0,0]=2 1943 B8R0.23 CC(C)\C=C(\F)C(=O)O Amb27838509 [0,0,0,0,0,1|1,0,0]=2 1944 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [0,0,0,0,0,1|2,0,1]=4 1945 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [0,0,0,0,0,1|2,0,1]=4 1946 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [0,0,0,0,0,1|2,0,1]=4 1947 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [0,0,0,0,0,1|2,0,1]=4 1948 B8R0.23 CC(Cl)C(=O)NC(N)=O Amb380836 [0,0,0,0,0,1|2,0,0]=3 1949 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [0,0,0,0,0,1|2,0,1]=4 1950 B8R0.23 CC(Cl)OC(=O)C(C)C Amb26981122 [0,0,0,0,0,1|2,0,1]=4 1951 B8R0.23 CC(Cl)\C=C(\O)C(=O)O Amb27658885 [0,0,0,0,0,1|1,0,1]=3 1952 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [0,0,0,0,0,1|1,0,2]=4 1953 B8R0.23 CC(N)CC(=O)N(C)O Amb27237285 [0,0,0,0,0,1|3,0,0]=4 1954 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [0,0,0,0,0,1|2,0,1]=4 1955 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [0,0,0,0,0,1|1,0,2]=4 1956 B8R0.23 CC(O)C(=O)NC(N)=O Amb9421397 [0,0,0,0,0,1|2,0,0]=3 1957 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [0,0,0,0,0,1|2,0,1]=4 1958 B8R0.23 CC(O)CC(=O)C(=O)O Amb25789747 [0,0,0,0,0,1|1,0,0]=2 1959 B8R0.23 CC(O)CC(=O)N(C)C Amb27187024 [0,0,0,0,0,1|2,0,1]=4 1960 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [0,0,0,0,0,1|2,0,1]=4 1961 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [0,0,0,0,0,1|2,0,1]=4 1962 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [0,0,0,0,0,1|2,0,1]=4 1963 B8R0.23 CC(O)OC(=O)C(C)C Amb28049225 [0,0,0,0,0,1|1,0,1]=3 1964 B8R0.23 CC(O)OC(=O)C(C)S Amb28453494 [0,0,0,0,0,1|2,0,1]=4 1965 B8R0.23 CN(C)C(=O)CC(=O)O Amb17399822 [0,0,0,0,0,1|1,0,0]=2 1966 B8R0.23 CN(C)C(=O)CC(N)=O Amb17760295 [0,0,0,0,0,1|2,0,0]=3 1967 B8R0.23 CN(C)C(=O)CC(N)=S Amb1980814 [0,0,0,0,0,1|2,1,0]=4 1968 B8R0.23 CN(C)C(=O)NC(=N)N Amb10068397 [0,0,0,0,0,1|3,0,0]=4 1969 B8R0.23 CN(C)C(=O)NC(N)=O Amb27254207 [0,0,0,0,0,1|2,0,0]=3 1970 B8R0.23 CN(C)C(=O)NC(N)=S Amb27640332 [0,0,0,0,0,1|2,1,0]=4 1971 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [0,0,0,0,0,1|2,0,1]=4 1972 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [0,0,0,0,0,1|2,0,1]=4 1973 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [0,0,0,0,0,1|2,0,1]=4 1974 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [0,0,0,0,0,1|1,0,2]=4 1975 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [0,0,0,0,0,1|2,0,1]=4 1976 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [0,0,0,0,0,1|2,0,1]=4 1977 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [0,0,0,0,0,1|2,0,1]=4 1978 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [0,0,0,0,0,1|1,0,2]=4 1979 B8R0.23 CN(C)\C(N)=N\C(N)=O Amb24481785 [0,0,0,0,0,1|3,0,0]=4 1980 B8R0.23 CN(N)C(=O)CC(=O)O Amb25326354 [0,0,0,0,0,1|2,0,0]=3 1981 B8R0.23 CS(=O)CC(=O)C(=O)Cl Amb27861442 [0,0,0,0,0,1|3,0,0]=4 1982 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [0,0,0,0,0,1|2,0,1]=4 1983 B8R0.23 C[C@@H](N)C(=O)CC(N)=O Amb28188661 [0,0,0,0,0,1|2,0,0]=3 1984 B8R0.23 C[C@@H](O)CC(=O)N(C)C Amb27406239 [0,0,0,0,0,1|2,0,1]=4 1985 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [0,0,0,0,0,1|2,0,1]=4 1986 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [0,0,0,0,0,1|2,0,1]=4 1987 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [0,0,0,0,0,1|1,0,2]=4 1988 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [0,0,0,0,0,1|1,0,2]=4 1989 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [0,0,0,0,0,1|2,0,1]=4 1990 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [0,0,0,0,0,1|1,0,2]=4 1991 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [0,0,0,0,0,1|1,0,2]=4 1992 B8R0.23 C[C@H](O)CC(=O)N(C)C Amb28045652 [0,0,0,0,0,1|2,0,1]=4 1993 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [0,0,0,0,0,1|2,0,1]=4 1994 B8R0.23 C\C(=C/B(O)O)C(C)C Amb27241046 [0,0,0,0,0,1|2,0,1]=4 1995 B8R0.23 C\C(=C/C(=O)O)C(C)C Amb17506861 [0,0,0,0,0,1|1,0,0]=2 1996 B8R0.23 C\C(=C/C(=O)O)C(F)F Amb33620436 [0,0,0,0,0,1|3,0,0]=4 1997 B8R0.23 C\C(=C/C(C)C)C(=O)O Amb18642616 [0,0,0,0,0,1|1,0,0]=2 1998 B8R0.23 C\C(=C/C(C)C)C(N)=O Amb27807446 [0,0,0,0,0,1|2,0,0]=3 1999 B8R0.23 C\C(=C/C(C)C)[N+](=O)[O-] Amb28364859 [0,0,0,0,0,1|2,0,1]=4 2000 B8R0.23 C\C(=C/C(N)=O)C(C)C Amb27468615 [0,0,0,0,0,1|2,0,0]=3 2001 B8R0.23 C\C(=C\C(C)C)C(C)O Amb27488746 [0,0,0,0,0,1|2,0,1]=4 2002 B8R0.23 C\C(=C\C(C)C)C(N)=O Amb28350432 [0,0,0,0,0,1|2,0,0]=3 2003 B8R0.23 C\C(=C\C(C)N)C(=O)O Amb25731207 [0,0,0,0,0,1|2,0,0]=3 2004 B8R0.23 C\C(=N/S(C)=O)C(C)C Amb29858795 [0,0,0,0,0,1|3,0,0]=4 2005 B8R0.23 C\C(Cl)=C/C(=O)C(C)C Amb28144120 [0,0,0,0,0,1|2,0,0]=3 2006 B8R0.23 NC(=O)NC(=O)C(=O)O Amb18124345 [0,0,0,0,0,1|2,0,1]=4 2007 B8R0.23 N\C(=C/C(=O)O)C(F)F Amb27607399 [0,0,0,0,0,1|3,0,0]=4 2008 B8R0.23 O=C(O)C(=O)CC(F)F Amb33337766 [0,0,0,0,0,1|2,0,0]=3 2009 B8R0.23 O=C(O)C(=O)C[PH](=O)O Amb27218009 [0,0,0,0,0,1|3,0,0]=4 2010 B8R0.23 O=C(O)CC(=O)C(=O)O Amb3909986 [0,0,0,0,0,1|2,0,1]=4 2011 B8R0.23 O=C(O)CS(=O)C(F)F Amb18979309 [0,0,0,0,0,1|3,0,0]=4 2012 B5R0.1 BC(=O)NCC Amb27430059 [2,0,0,0,0,0|2,0,0]=4 2013 B5R0.1 C=CC=C(C)C Amb22229813 [2,0,0,0,0,0|1,0,1]=4 2014 B5R0.1 C=CCC(C)C Amb8513260 [2,0,0,0,0,0|1,0,1]=4 2015 B5R0.1 C=CNC(C)C Amb28075363 [2,0,0,0,0,0|2,0,0]=4 2016 B5R0.1 C=COC(C)C Amb22230777 [2,0,0,0,0,0|2,0,0]=4 2017 B5R0.1 CC#CC(=O)O Amb2685714 [2,0,0,0,0,0|0,0,2]=4 2018 B5R0.1 CC(Br)\C=C\Cl Amb25196204 [2,0,0,0,0,0|2,0,0]=4 2019 B5R0.1 CC(Br)\C=N\O Amb28137926 [2,0,0,0,0,0|2,0,0]=4 2020 B5R0.1 CC(C)=CC=O Amb8385061 [2,0,0,0,0,0|0,0,1]=3 2021 B5R0.1 CC(C)=CCO Amb4605830 [2,0,0,0,0,0|0,0,2]=4 2022 B5R0.1 CC(C)C=C=O Amb27858445 [2,0,0,0,0,0|0,0,1]=3 2023 B5R0.1 CC(C)CC=O Amb3939851 [2,0,0,0,0,0|0,0,1]=3 2024 B5R0.1 CC(C)CCO Amb4605831 [2,0,0,0,0,0|0,0,2]=4 2025 B5R0.1 CC(C)CNO Amb25887512 [2,0,0,0,0,0|1,0,1]=4 2026 B5R0.1 CC(C)N=C=O Amb3939055 [2,0,0,0,0,0|1,0,1]=4 2027 B5R0.1 CC(C)NC=O Amb4017634 [2,0,0,0,0,0|1,0,0]=3 2028 B5R0.1 CC(C)NC=S Amb28049627 [2,0,0,0,0,0|1,1,0]=4 2029 B5R0.1 CC(C)OC=N Amb22337834 [2,0,0,0,0,0|2,0,0]=4 2030 B5R0.1 CC(C)OC=O Amb9787311 [2,0,0,0,0,0|1,0,0]=3 2031 B5R0.1 CC(C)ON=O Amb17938692 [2,0,0,0,0,0|2,0,0]=4 2032 B5R0.1 CC(C)\C=N\O Amb2455920 [2,0,0,0,0,0|1,0,0]=3 2033 B5R0.1 CC(Cl)\C=C\Cl Amb25256868 [2,0,0,0,0,0|2,0,0]=4 2034 B5R0.1 CC(F)CC=O Amb28051612 [2,0,0,0,0,0|1,0,1]=4 2035 B5R0.1 CC(N)\C=N\O Amb28073035 [2,0,0,0,0,0|2,0,0]=4 2036 B5R0.1 CC(O)CC=O Amb4036424 [2,0,0,0,0,0|1,0,1]=4 2037 B5R0.1 CC(O)NC=O Amb28049622 [2,0,0,0,0,0|2,0,0]=4 2038 B5R0.1 CCC=C(Br)Br Amb25887651 [2,0,0,0,0,0|2,0,0]=4 2039 B5R0.1 CCC=C(C)C Amb22336412 [2,0,0,0,0,0|2,0,0]=4 2040 B5R0.1 CCC=C(F)F Amb10839842 [2,0,0,0,0,0|2,0,0]=4 2041 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,1]=4 2042 B5R0.1 CCCC(=O)Cl Amb2792903 [2,0,0,0,0,0|1,0,1]=4 2043 B5R0.1 CCCC(=O)O Amb3939012 [2,0,0,0,0,0|0,0,1]=3 2044 B5R0.1 CCCC(=O)[O-] Amb8514901 [2,0,0,0,0,0|0,0,2]=4 2045 B5R0.1 CCCC(C)=O Amb6608910 [2,0,0,0,0,0|1,0,1]=4 2046 B5R0.1 CCCC(N)=O Amb3886524 [2,0,0,0,0,0|1,0,1]=4 2047 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|0,1,1]=4 2048 B5R0.1 CCNC(=O)Cl Amb25791793 [2,0,0,0,0,0|2,0,0]=4 2049 B5R0.1 CCNC(C)=O Amb2780415 [2,0,0,0,0,0|2,0,0]=4 2050 B5R0.1 CCNC(N)=O Amb6608844 [2,0,0,0,0,0|2,0,0]=4 2051 B5R0.1 CCOC(=O)Cl Amb2793045 [2,0,0,0,0,0|2,0,0]=4 2052 B5R0.1 CCOC(=O)O Amb8393208 [2,0,0,0,0,0|1,0,0]=3 2053 B5R0.1 CCOC(C)=O Amb3940488 [2,0,0,0,0,0|2,0,0]=4 2054 B5R0.1 CCOC(N)=O Amb6608672 [2,0,0,0,0,0|2,0,0]=4 2055 B5R0.1 CCO[PH](=O)O Amb22360741 [2,0,0,0,0,0|2,0,0]=4 2056 B5R0.1 CCO[Si](=O)O Amb26569259 [2,0,0,0,0,0|1,1,0]=4 2057 B5R0.1 CCSC(=O)Cl Amb8516064 [2,0,0,0,0,0|2,0,0]=4 2058 B5R0.1 CN(C)CC=O Amb22002191 [2,0,0,0,0,0|1,0,1]=4 2059 B5R0.1 CN(C)CC=O Amb22491245 [2,0,0,0,0,0|1,0,1]=4 2060 B5R0.1 CN(C)NC=O Amb1930732 [2,0,0,0,0,0|2,0,0]=4 2061 B5R0.1 CN(C)\C=C\N Amb26443108 [2,0,0,0,0,0|2,0,0]=4 2062 B5R0.1 CNCC(=O)O Amb6298808 [2,0,0,0,0,0|1,0,1]=4 2063 B5R0.1 CNCC(=O)O Amb6599996 [2,0,0,0,0,0|1,0,1]=4 2064 B5R0.1 COCC(=O)O Amb3939876 [2,0,0,0,0,0|1,0,1]=4 2065 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|1,0,1]=4 2066 B5R0.1 C[C@H](O)CC=O Amb27595676 [2,0,0,0,0,0|1,0,1]=4 2067 B5R0.1 C\C(Br)=C/C=O Amb27202112 [2,0,0,0,0,0|1,0,1]=4 2068 B5R0.1 C\C(Br)=C\C=O Amb27201671 [2,0,0,0,0,0|1,0,1]=4 2069 B5R0.1 C\C(N)=C/C=O Amb2612039 [2,0,0,0,0,0|1,0,1]=4 2070 B5R0.1 C\C(O)=C\CN Amb33294274 [2,0,0,0,0,0|2,0,0]=4 2071 B5R0.1 C\C=C/C(=O)O Amb27779315 [2,0,0,0,0,0|0,0,1]=3 2072 B5R0.1 C\C=C/C(C)=O Amb28351405 [2,0,0,0,0,0|1,0,1]=4 2073 B5R0.1 C\C=C/C(C)C Amb20618870 [2,0,0,0,0,0|1,0,0]=3 2074 B5R0.1 C\C=C\C(=O)Br Amb25026006 [2,0,0,0,0,0|1,0,1]=4 2075 B5R0.1 C\C=C\C(=O)Cl Amb8517577 [2,0,0,0,0,0|1,0,1]=4 2076 B5R0.1 C\C=C\C(=O)O Amb8385856 [2,0,0,0,0,0|0,0,1]=3 2077 B5R0.1 C\C=C\C(C)=O Amb33941980 [2,0,0,0,0,0|1,0,1]=4 2078 B5R0.1 C\C=C\C(C)Br Amb24725263 [2,0,0,0,0,0|2,0,0]=4 2079 B5R0.1 C\C=C\C(C)C Amb4019538 [2,0,0,0,0,0|1,0,0]=3 2080 B5R0.1 C\C=C\C(C)Cl Amb24377224 [2,0,0,0,0,0|2,0,0]=4 2081 B5R0.1 C\C=C\C(C)N Amb19514513 [2,0,0,0,0,0|2,0,0]=4 2082 B5R0.1 C\C=C\C(C)N Amb33295164 [2,0,0,0,0,0|2,0,0]=4 2083 B5R0.1 C\C=C\C(C)O Amb2721243 [2,0,0,0,0,0|2,0,0]=4 2084 B5R0.1 C\C=C\C(N)=O Amb4025906 [2,0,0,0,0,0|1,0,1]=4 2085 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|1,0,1]=4 2086 B5R0.1 N\C=C\C(=O)O Amb27217920 [2,0,0,0,0,0|1,0,1]=4 2087 B5R0.1 O=C(O)CCBr Amb2685479 [2,0,0,0,0,0|1,0,1]=4 2088 B5R0.1 O=C(O)CCCl Amb5395408 [2,0,0,0,0,0|1,0,1]=4 2089 B5R0.1 O=C(O)CCF Amb10603694 [2,0,0,0,0,0|1,0,1]=4 2090 B5R0.1 O=C(O)CCI Amb2688882 [2,0,0,0,0,0|1,0,1]=4 2091 B5R0.1 O=C(O)CCO Amb2688785 [2,0,0,0,0,0|1,0,1]=4 2092 B5R0.1 O=C(O)CCS Amb6608916 [2,0,0,0,0,0|1,0,1]=4 2093 B5R0.1 O=C(O)\C=C/Br Amb18644453 [2,0,0,0,0,0|1,0,1]=4 2094 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [2,0,0,0,0,0|1,0,1]=4 2095 B5R0.1 O=C(O)\C=C/I Amb28315824 [2,0,0,0,0,0|1,0,1]=4 2096 B5R0.1 O=C(O)\C=C\Br Amb27423608 [2,0,0,0,0,0|1,0,1]=4 2097 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [2,0,0,0,0,0|1,0,1]=4 2098 B5R0.1 O=C(O)\C=C\I Amb30584673 [2,0,0,0,0,0|1,0,1]=4 2099 B5R0.1 O=C(O)\C=C\O Amb26055842 [2,0,0,0,0,0|1,0,1]=4 2100 B5R0.1 O=C(O)\C=C\S Amb28401590 [2,0,0,0,0,0|1,0,1]=4 2101 B5R0.1 O=C(O)\C=N\O Amb20671938 [2,0,0,0,0,0|2,0,0]=4 2102 B5R0.3 C#CC(=O)CC Amb25989183 [2,0,0,0,0,0|1,0,1]=4 2103 B5R0.3 C=C(C=O)CC Amb17940102 [2,0,0,0,0,0|1,0,0]=3 2104 B5R0.3 C=C(C=O)OC Amb27863725 [2,0,0,0,0,0|2,0,0]=4 2105 B5R0.3 C=C(CC)CO Amb33549724 [2,0,0,0,0,0|1,0,1]=4 2106 B5R0.3 C=CC(=C)CC Amb28141349 [2,0,0,0,0,0|2,0,0]=4 2107 B5R0.3 C=CC(=O)CBr Amb10602446 [2,0,0,0,0,0|2,0,0]=4 2108 B5R0.3 C=CC(=O)CC Amb3940490 [2,0,0,0,0,0|1,0,0]=3 2109 B5R0.3 C=CC(=O)CCl Amb27211112 [2,0,0,0,0,0|2,0,0]=4 2110 B5R0.3 C=CC(=O)CO Amb28074769 [2,0,0,0,0,0|2,0,0]=4 2111 B5R0.3 C=CC(=O)NC Amb9480402 [2,0,0,0,0,0|2,0,0]=4 2112 B5R0.3 C=CC(=O)OC Amb22351400 [2,0,0,0,0,0|2,0,0]=4 2113 B5R0.3 C=CC(=O)OC Amb2793072 [2,0,0,0,0,0|2,0,0]=4 2114 B5R0.3 CCC(=N)NO Amb19515903 [2,0,0,0,0,0|2,0,0]=4 2115 B5R0.3 CCC(=O)C#N Amb17231799 [2,0,0,0,0,0|1,0,1]=4 2116 B5R0.3 CCC(=O)C=O Amb22228532 [2,0,0,0,0,0|0,0,0]=2 2117 B5R0.3 CCC(=O)CBr Amb2684976 [2,0,0,0,0,0|1,0,1]=4 2118 B5R0.3 CCC(=O)CC Amb4605995 [2,0,0,0,0,0|1,0,1]=4 2119 B5R0.3 CCC(=O)CCl Amb19338105 [2,0,0,0,0,0|1,0,1]=4 2120 B5R0.3 CCC(=O)CF Amb23454809 [2,0,0,0,0,0|1,0,1]=4 2121 B5R0.3 CCC(=O)CN Amb18203134 [2,0,0,0,0,0|1,0,1]=4 2122 B5R0.3 CCC(=O)CN Amb19959206 [2,0,0,0,0,0|1,0,1]=4 2123 B5R0.3 CCC(=O)CO Amb22227965 [2,0,0,0,0,0|0,0,1]=3 2124 B5R0.3 CCC(=O)CO Amb33529428 [2,0,0,0,0,0|0,0,1]=3 2125 B5R0.3 CCC(=O)CS Amb27843254 [2,0,0,0,0,0|0,1,1]=4 2126 B5R0.3 CCC(=O)NN Amb1104708 [2,0,0,0,0,0|2,0,0]=4 2127 B5R0.3 CCC(=O)NO Amb6273963 [2,0,0,0,0,0|1,0,0]=3 2128 B5R0.3 CCC(=O)OC Amb8513418 [2,0,0,0,0,0|2,0,0]=4 2129 B5R0.3 CCC(Br)C=O Amb18124003 [2,0,0,0,0,0|1,0,1]=4 2130 B5R0.3 CCC(C)C=O Amb3939899 [2,0,0,0,0,0|1,0,1]=4 2131 B5R0.3 CCC(Cl)C=O Amb18122610 [2,0,0,0,0,0|1,0,1]=4 2132 B5R0.3 CCN(C)C=O Amb20627285 [2,0,0,0,0,0|2,0,0]=4 2133 B5R0.3 CCN(N)C=O Amb24428031 [2,0,0,0,0,0|2,0,0]=4 2134 B5R0.3 CC[C@@H](C)C=O Amb27759282 [2,0,0,0,0,0|1,0,1]=4 2135 B5R0.3 CC[C@H](C)C=O Amb27837733 [2,0,0,0,0,0|1,0,1]=4 2136 B5R0.3 CC[C@H](N)C=O Amb27460588 [2,0,0,0,0,0|1,0,1]=4 2137 B5R0.3 CC\C(C)=C\Cl Amb27848092 [2,0,0,0,0,0|2,0,0]=4 2138 B5R0.3 CC\C(C)=N\O Amb8516521 [2,0,0,0,0,0|2,0,0]=4 2139 B5R0.3 CC\C(N)=N/O Amb10609125 [2,0,0,0,0,0|2,0,0]=4 2140 B5R0.3 CC\C(N)=N\O Amb1125701 [2,0,0,0,0,0|2,0,0]=4 2141 B5R0.3 CC\C(N)=N\O Amb19883708 [2,0,0,0,0,0|2,0,0]=4 2142 B5R0.3 CNC(=O)CO Amb3375431 [2,0,0,0,0,0|1,0,1]=4 2143 B5R0.3 CNC(=O)NO Amb25185417 [2,0,0,0,0,0|2,0,0]=4 2144 B5R0.3 COC(=O)C=O Amb29083438 [2,0,0,0,0,0|1,0,0]=3 2145 B5R0.3 COC(=O)C=O Amb8384463 [2,0,0,0,0,0|1,0,0]=3 2146 B5R0.3 COC(=O)CO Amb2778433 [2,0,0,0,0,0|1,0,1]=4 2147 B5R0.3 CSC(=O)C=O Amb28284177 [2,0,0,0,0,0|1,0,0]=3 2148 B5R0.3 C\C=C(/Br)C=O Amb24478125 [2,0,0,0,0,0|1,0,1]=4 2149 B5R0.3 C\C=C(/C)C=O Amb30526844 [2,0,0,0,0,0|1,0,1]=4 2150 B5R0.3 C\C=C(/C)CC Amb26540266 [2,0,0,0,0,0|2,0,0]=4 2151 B5R0.3 C\C=C(/Cl)C=O Amb18122386 [2,0,0,0,0,0|1,0,1]=4 2152 B5R0.3 C\C=C(/I)C=O Amb28049947 [2,0,0,0,0,0|1,0,1]=4 2153 B5R0.3 C\C=C(\Br)C=O Amb18124612 [2,0,0,0,0,0|1,0,1]=4 2154 B5R0.3 C\C=C(\C)C=O Amb24333046 [2,0,0,0,0,0|1,0,1]=4 2155 B5R0.3 C\C=C(\C)CC Amb25332651 [2,0,0,0,0,0|2,0,0]=4 2156 B5R0.3 NCC(=O)NO Amb2433859 [2,0,0,0,0,0|2,0,0]=4 2157 B5R0.3 O=C(CCl)NO Amb25324352 [2,0,0,0,0,0|2,0,0]=4 2158 B5R0.3 O=C(CI)NO Amb27635227 [2,0,0,0,0,0|2,0,0]=4 2159 B5R0.3 O=C(CO)CBr Amb25945111 [2,0,0,0,0,0|1,0,1]=4 2160 B5R0.3 O=C(CO)CCl Amb28322779 [2,0,0,0,0,0|1,0,1]=4 2161 B5R0.3 O=C(CO)CI Amb28121276 [2,0,0,0,0,0|1,0,1]=4 2162 B5R0.3 O=C(CO)CO Amb6600007 [2,0,0,0,0,0|1,0,1]=4 2163 B5R0.3 O=C(CO)NO Amb27596845 [2,0,0,0,0,0|2,0,0]=4 2164 B5R0.3 O=CC(=O)C=O Amb17593025 [2,0,0,0,0,0|1,0,1]=4 2165 B5R0.3 O=CC(=O)CO Amb17593031 [2,0,0,0,0,0|1,0,0]=3 2166 B5R0.5 C=C(Br)C(=O)O Amb20620403 [2,0,0,0,0,0|1,0,1]=4 2167 B5R0.5 C=C(Br)C(C)=O Amb17593709 [2,0,0,0,0,0|2,0,0]=4 2168 B5R0.5 C=C(Br)C(C)C Amb22583736 [2,0,0,0,0,0|1,0,0]=3 2169 B5R0.5 C=C(C)C(=O)Cl Amb534203 [2,0,0,0,0,0|2,0,0]=4 2170 B5R0.5 C=C(C)C(=O)O Amb6608998 [2,0,0,0,0,0|1,0,0]=3 2171 B5R0.5 C=C(C)C(C)=O Amb17593021 [2,0,0,0,0,0|2,0,0]=4 2172 B5R0.5 C=C(C)C(C)C Amb8513830 [2,0,0,0,0,0|1,0,0]=3 2173 B5R0.5 C=C(C)C(C)Cl Amb24407204 [2,0,0,0,0,0|2,0,0]=4 2174 B5R0.5 C=C(C)C(C)O Amb28282626 [2,0,0,0,0,0|2,0,0]=4 2175 B5R0.5 C=C(C)C(N)=O Amb6609019 [2,0,0,0,0,0|2,0,0]=4 2176 B5R0.5 C=C(C)[C@@H](C)N Amb33199904 [2,0,0,0,0,0|2,0,0]=4 2177 B5R0.5 C=C(C)[C@@H](C)O Amb25834912 [2,0,0,0,0,0|2,0,0]=4 2178 B5R0.5 C=C(C)[C@H](C)N Amb33199903 [2,0,0,0,0,0|2,0,0]=4 2179 B5R0.5 C=C(C)[C@H](C)O Amb25294556 [2,0,0,0,0,0|2,0,0]=4 2180 B5R0.5 C=C(Cl)C(=O)O Amb17933971 [2,0,0,0,0,0|1,0,1]=4 2181 B5R0.5 C=C(Cl)C(C)=O Amb28284771 [2,0,0,0,0,0|2,0,0]=4 2182 B5R0.5 C=C(Cl)C(C)Cl Amb27400335 [2,0,0,0,0,0|2,0,0]=4 2183 B5R0.5 C=C(F)C(=O)O Amb2688008 [2,0,0,0,0,0|1,0,1]=4 2184 B5R0.5 C=C(F)C(C)=O Amb17593032 [2,0,0,0,0,0|2,0,0]=4 2185 B5R0.5 C=C(F)C(C)Br Amb27212987 [2,0,0,0,0,0|2,0,0]=4 2186 B5R0.5 CC(=O)C(=N)N Amb24409561 [2,0,0,0,0,0|2,0,0]=4 2187 B5R0.5 CC(=O)C(=O)Cl Amb17593107 [2,0,0,0,0,0|1,0,0]=3 2188 B5R0.5 CC(=O)C(=O)O Amb932807 [2,0,0,0,0,0|0,0,0]=2 2189 B5R0.5 CC(=O)C(=O)[O-] Amb22043412 [2,0,0,0,0,0|0,0,1]=3 2190 B5R0.5 CC(=O)C(C)=O Amb6608675 [2,0,0,0,0,0|1,0,0]=3 2191 B5R0.5 CC(=O)C(C)=S Amb27632834 [2,0,0,0,0,0|1,1,0]=4 2192 B5R0.5 CC(=O)C(C)Br Amb8384405 [2,0,0,0,0,0|1,0,1]=4 2193 B5R0.5 CC(=O)C(C)C Amb4605987 [2,0,0,0,0,0|0,0,1]=3 2194 B5R0.5 CC(=O)C(C)Cl Amb9702838 [2,0,0,0,0,0|1,0,1]=4 2195 B5R0.5 CC(=O)C(C)F Amb10841897 [2,0,0,0,0,0|1,0,1]=4 2196 B5R0.5 CC(=O)C(C)I Amb28315734 [2,0,0,0,0,0|1,0,1]=4 2197 B5R0.5 CC(=O)C(C)N Amb17593029 [2,0,0,0,0,0|1,0,1]=4 2198 B5R0.5 CC(=O)C(C)N Amb19148817 [2,0,0,0,0,0|1,0,1]=4 2199 B5R0.5 CC(=O)C(C)O Amb6608962 [2,0,0,0,0,0|1,0,1]=4 2200 B5R0.5 CC(=O)C(C)S Amb8393169 [2,0,0,0,0,0|1,0,1]=4 2201 B5R0.5 CC(=O)C(N)=O Amb17593028 [2,0,0,0,0,0|1,0,0]=3 2202 B5R0.5 CC(=O)C(N)=S Amb33528965 [2,0,0,0,0,0|1,1,0]=4 2203 B5R0.5 CC(=O)C(O)O Amb22436762 [2,0,0,0,0,0|0,0,2]=4 2204 B5R0.5 CC(=O)N(C)C Amb24323347 [2,0,0,0,0,0|1,0,1]=4 2205 B5R0.5 CC(=O)N(C)C Amb2793066 [2,0,0,0,0,0|1,0,1]=4 2206 B5R0.5 CC(=O)N(C)O Amb24066817 [2,0,0,0,0,0|2,0,0]=4 2207 B5R0.5 CC(=O)[C@@H](C)N Amb22748924 [2,0,0,0,0,0|1,0,1]=4 2208 B5R0.5 CC(=O)[C@H](C)N Amb26418661 [2,0,0,0,0,0|1,0,1]=4 2209 B5R0.5 CC(=S)C(=O)O Amb27424126 [2,0,0,0,0,0|0,1,0]=3 2210 B5R0.5 CC(Br)C(=O)Br Amb7969424 [2,0,0,0,0,0|2,0,0]=4 2211 B5R0.5 CC(Br)C(=O)Cl Amb6296592 [2,0,0,0,0,0|2,0,0]=4 2212 B5R0.5 CC(Br)C(=O)O Amb2795764 [2,0,0,0,0,0|1,0,0]=3 2213 B5R0.5 CC(Br)C(N)=O Amb2779903 [2,0,0,0,0,0|2,0,0]=4 2214 B5R0.5 CC(C)B(O)O Amb2447044 [2,0,0,0,0,0|1,0,1]=4 2215 B5R0.5 CC(C)C(=N)N Amb2695035 [2,0,0,0,0,0|2,0,0]=4 2216 B5R0.5 CC(C)C(=N)N Amb2725173 [2,0,0,0,0,0|2,0,0]=4 2217 B5R0.5 CC(C)C(=O)Br Amb22731066 [2,0,0,0,0,0|1,0,0]=3 2218 B5R0.5 CC(C)C(=O)Cl Amb3939052 [2,0,0,0,0,0|1,0,0]=3 2219 B5R0.5 CC(C)C(=O)F Amb25848493 [2,0,0,0,0,0|1,0,0]=3 2220 B5R0.5 CC(C)C(=O)I Amb26992316 [2,0,0,0,0,0|1,0,0]=3 2221 B5R0.5 CC(C)C(=O)O Amb3939822 [2,0,0,0,0,0|0,0,0]=2 2222 B5R0.5 CC(C)C(=O)S Amb33482574 [2,0,0,0,0,0|0,1,0]=3 2223 B5R0.5 CC(C)C(C)O Amb9748261 [2,0,0,0,0,0|1,0,1]=4 2224 B5R0.5 CC(C)C(N)=O Amb1153145 [2,0,0,0,0,0|1,0,0]=3 2225 B5R0.5 CC(C)C(N)=S Amb6242688 [2,0,0,0,0,0|1,1,0]=4 2226 B5R0.5 CC(C)N(=O)=O Amb8395293 [2,0,0,0,0,0|1,0,0]=3 2227 B5R0.5 CC(C)N(=O)O Amb33789630 [2,0,0,0,0,0|1,0,0]=3 2228 B5R0.5 CC(C)S(=O)Cl Amb27859539 [2,0,0,0,0,0|2,0,0]=4 2229 B5R0.5 CC(C)S(=O)O Amb27245066 [2,0,0,0,0,0|1,0,0]=3 2230 B5R0.5 CC(C)S(=O)[O-] Amb19929129 [2,0,0,0,0,0|1,0,1]=4 2231 B5R0.5 CC(C)S(N)=O Amb25675545 [2,0,0,0,0,0|2,0,0]=4 2232 B5R0.5 CC(C)[C@@H](C)O Amb13952942 [2,0,0,0,0,0|1,0,1]=4 2233 B5R0.5 CC(C)[C@H](C)O Amb6366846 [2,0,0,0,0,0|1,0,1]=4 2234 B5R0.5 CC(C)[N+](=O)[O-] Amb6608812 [2,0,0,0,0,0|1,0,1]=4 2235 B5R0.5 CC(Cl)C(=O)Cl Amb9703139 [2,0,0,0,0,0|2,0,0]=4 2236 B5R0.5 CC(Cl)C(=O)F Amb27863699 [2,0,0,0,0,0|2,0,0]=4 2237 B5R0.5 CC(Cl)C(=O)O Amb3940363 [2,0,0,0,0,0|1,0,0]=3 2238 B5R0.5 CC(Cl)C(N)=O Amb9745753 [2,0,0,0,0,0|2,0,0]=4 2239 B5R0.5 CC(Cl)S(=O)O Amb27983761 [2,0,0,0,0,0|2,0,0]=4 2240 B5R0.5 CC(Cl)[SH](=O)=O Amb27425039 [2,0,0,0,0,0|2,0,0]=4 2241 B5R0.5 CC(F)C(=O)O Amb10605770 [2,0,0,0,0,0|1,0,0]=3 2242 B5R0.5 CC(F)C(N)=O Amb28248497 [2,0,0,0,0,0|2,0,0]=4 2243 B5R0.5 CC(I)C(=O)O Amb26450528 [2,0,0,0,0,0|1,0,0]=3 2244 B5R0.5 CC(I)C(N)=O Amb25684673 [2,0,0,0,0,0|2,0,0]=4 2245 B5R0.5 CC(N)C(=O)O Amb32724352 [2,0,0,0,0,0|1,0,0]=3 2246 B5R0.5 CC(N)C(=O)O Amb5716847 [2,0,0,0,0,0|1,0,0]=3 2247 B5R0.5 CC(N)C(=O)S Amb27175379 [2,0,0,0,0,0|1,1,0]=4 2248 B5R0.5 CC(N)C(N)=O Amb21958673 [2,0,0,0,0,0|2,0,0]=4 2249 B5R0.5 CC(N)C(N)=O Amb33532935 [2,0,0,0,0,0|2,0,0]=4 2250 B5R0.5 CC(O)C(=O)O Amb9703100 [2,0,0,0,0,0|1,0,0]=3 2251 B5R0.5 CC(O)C(=O)[O-] Amb3499440 [2,0,0,0,0,0|1,0,1]=4 2252 B5R0.5 CC(O)C(=O)[O-] Amb9787591 [2,0,0,0,0,0|1,0,1]=4 2253 B5R0.5 CC(O)C(N)=O Amb6394657 [2,0,0,0,0,0|2,0,0]=4 2254 B5R0.5 CC(S)C(=O)O Amb6608753 [2,0,0,0,0,0|1,0,0]=3 2255 B5R0.5 CN(C)C(=O)Cl Amb2793056 [2,0,0,0,0,0|2,0,0]=4 2256 B5R0.5 CN(C)C(=O)O Amb22348477 [2,0,0,0,0,0|1,0,0]=3 2257 B5R0.5 CN(C)C(N)=O Amb2604398 [2,0,0,0,0,0|2,0,0]=4 2258 B5R0.5 C[C@@H](Br)C(=O)Br Amb27455066 [2,0,0,0,0,0|2,0,0]=4 2259 B5R0.5 C[C@@H](Br)C(=O)Cl Amb26395930 [2,0,0,0,0,0|2,0,0]=4 2260 B5R0.5 C[C@@H](Br)C(=O)O Amb8515030 [2,0,0,0,0,0|1,0,0]=3 2261 B5R0.5 C[C@@H](Cl)C(=O)Cl Amb28140701 [2,0,0,0,0,0|2,0,0]=4 2262 B5R0.5 C[C@@H](Cl)C(=O)O Amb2725594 [2,0,0,0,0,0|1,0,0]=3 2263 B5R0.5 C[C@@H](I)C(=O)O Amb27878762 [2,0,0,0,0,0|1,0,0]=3 2264 B5R0.5 C[C@@H](I)C(N)=O Amb27863419 [2,0,0,0,0,0|2,0,0]=4 2265 B5R0.5 C[C@@H](N)C(=O)O Amb3940457 [2,0,0,0,0,0|1,0,0]=3 2266 B5R0.5 C[C@@H](N)C(N)=O Amb2371905 [2,0,0,0,0,0|2,0,0]=4 2267 B5R0.5 C[C@@H](N)C(N)=O Amb2778751 [2,0,0,0,0,0|2,0,0]=4 2268 B5R0.5 C[C@@H](O)C(=O)Cl Amb28350419 [2,0,0,0,0,0|2,0,0]=4 2269 B5R0.5 C[C@@H](O)C(=O)O Amb6600026 [2,0,0,0,0,0|1,0,0]=3 2270 B5R0.5 C[C@@H](O)C(=O)[O-] Amb22350432 [2,0,0,0,0,0|1,0,1]=4 2271 B5R0.5 C[C@@H](O)C(=O)[O-] Amb8514494 [2,0,0,0,0,0|1,0,1]=4 2272 B5R0.5 C[C@@H](O)C(N)=O Amb3939680 [2,0,0,0,0,0|2,0,0]=4 2273 B5R0.5 C[C@H](Br)C(=O)O Amb8515029 [2,0,0,0,0,0|1,0,0]=3 2274 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [2,0,0,0,0,0|2,0,0]=4 2275 B5R0.5 C[C@H](Cl)C(=O)F Amb28138044 [2,0,0,0,0,0|2,0,0]=4 2276 B5R0.5 C[C@H](Cl)C(=O)O Amb17776586 [2,0,0,0,0,0|1,0,0]=3 2277 B5R0.5 C[C@H](F)C(=O)O Amb27216697 [2,0,0,0,0,0|1,0,0]=3 2278 B5R0.5 C[C@H](N)C(=O)O Amb33780861 [2,0,0,0,0,0|1,0,0]=3 2279 B5R0.5 C[C@H](N)C(=O)O Amb6298336 [2,0,0,0,0,0|1,0,0]=3 2280 B5R0.5 C[C@H](N)C(=O)S Amb28315892 [2,0,0,0,0,0|1,1,0]=4 2281 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [2,0,0,0,0,0|2,0,0]=4 2282 B5R0.5 C[C@H](N)C(N)=O Amb2371522 [2,0,0,0,0,0|2,0,0]=4 2283 B5R0.5 C[C@H](N)C(N)=O Amb2778752 [2,0,0,0,0,0|2,0,0]=4 2284 B5R0.5 C[C@H](N)C(N)=O Amb33822632 [2,0,0,0,0,0|2,0,0]=4 2285 B5R0.5 C[C@H](O)C(=O)O Amb8386374 [2,0,0,0,0,0|1,0,0]=3 2286 B5R0.5 C[C@H](O)C(=O)[O-] Amb17772234 [2,0,0,0,0,0|1,0,1]=4 2287 B5R0.5 C[C@H](O)C(=O)[O-] Amb8515200 [2,0,0,0,0,0|1,0,1]=4 2288 B5R0.5 C[C@H](O)C(N)=O Amb3939676 [2,0,0,0,0,0|2,0,0]=4 2289 B5R0.5 C[C@H](S)C(=O)O Amb25147510 [2,0,0,0,0,0|1,0,0]=3 2290 B5R0.5 N=C(S)C(=O)O Amb18640468 [2,0,0,0,0,0|1,1,0]=4 2291 B5R0.5 NC(=O)C(=O)O Amb32666615 [2,0,0,0,0,0|1,0,0]=3 2292 B5R0.5 NC(=O)C(=O)O Amb3940455 [2,0,0,0,0,0|1,0,0]=3 2293 B5R0.5 NC(=O)C(=O)[O-] Amb22053860 [2,0,0,0,0,0|1,0,1]=4 2294 B5R0.5 NC(=O)C(=O)[O-] Amb22730546 [2,0,0,0,0,0|1,0,1]=4 2295 B5R0.5 NC(=O)C(N)=O Amb3886526 [2,0,0,0,0,0|2,0,0]=4 2296 B5R0.5 NC(Br)C(=O)O Amb25724348 [2,0,0,0,0,0|2,0,0]=4 2297 B5R0.5 NC(O)C(=O)O Amb24663706 [2,0,0,0,0,0|2,0,0]=4 2298 B5R0.5 NC(S)C(=O)O Amb27253385 [2,0,0,0,0,0|2,0,0]=4 2299 B5R0.5 N[C@@H](S)C(=O)O Amb27788398 [2,0,0,0,0,0|2,0,0]=4 2300 B5R0.5 O=C(Br)C(=O)Br Amb8513454 [2,0,0,0,0,0|2,0,0]=4 2301 B5R0.5 O=C(Cl)C(=O)Cl Amb2793009 [2,0,0,0,0,0|2,0,0]=4 2302 B5R0.5 O=C(F)C(=O)F Amb10840380 [2,0,0,0,0,0|2,0,0]=4 2303 B5R0.5 O=C(O)C(=O)Br Amb27863598 [2,0,0,0,0,0|1,0,0]=3 2304 B5R0.5 O=C(O)C(=O)O Amb10608980 [2,0,0,0,0,0|1,0,0]=3 2305 B5R0.5 O=C(O)C(=O)O Amb19374136 [2,0,0,0,0,0|1,0,0]=3 2306 B5R0.5 O=C(O)C(=O)O Amb22231343 [2,0,0,0,0,0|1,0,0]=3 2307 B5R0.5 O=C(O)C(=O)O Amb22394874 [2,0,0,0,0,0|1,0,0]=3 2308 B5R0.5 O=C(O)C(=O)O Amb22436461 [2,0,0,0,0,0|1,0,0]=3 2309 B5R0.5 O=C(O)C(=O)O Amb7755827 [2,0,0,0,0,0|1,0,0]=3 2310 B5R0.5 O=C(O)C(=O)O Amb8513282 [2,0,0,0,0,0|1,0,0]=3 2311 B5R0.5 O=C(O)C(Br)I Amb17610018 [2,0,0,0,0,0|2,0,0]=4 2312 B5R0.5 O=C(O)C(Cl)Cl Amb6891960 [2,0,0,0,0,0|2,0,0]=4 2313 B5R0.5 O=C(O)C(Cl)I Amb17610937 [2,0,0,0,0,0|2,0,0]=4 2314 B5R0.5 O=C(O)C(F)Br Amb10841090 [2,0,0,0,0,0|2,0,0]=4 2315 B5R0.5 O=C(O)C(F)Cl Amb10838714 [2,0,0,0,0,0|2,0,0]=4 2316 B5R0.5 O=C(O)C(F)F Amb1953492 [2,0,0,0,0,0|2,0,0]=4 2317 B5R0.5 O=C(O)C(F)I Amb10838458 [2,0,0,0,0,0|2,0,0]=4 2318 B5R0.5 O=C(O)C(I)I Amb17612865 [2,0,0,0,0,0|2,0,0]=4 2319 B5R0.5 O=C(O)C(O)O Amb6608986 [2,0,0,0,0,0|2,0,0]=4 2320 B5R0.5 O=C(O)[C@@H](F)Cl Amb26559563 [2,0,0,0,0,0|2,0,0]=4 2321 B5R0.5 O=C(O)[C@@H](F)I Amb27827825 [2,0,0,0,0,0|2,0,0]=4 2322 B5R0.5 O=C(O)[C@H](F)Br Amb28200717 [2,0,0,0,0,0|2,0,0]=4 2323 B5R0.5 O=C([O-])C(=O)[O-] Amb17943075 [2,0,0,0,0,0|1,0,1]=4 2324 B5R0.5 O=C([O-])C(=O)[O-] Amb21963194 [2,0,0,0,0,0|1,0,1]=4 2325 B5R0.5 O=C([O-])C(=O)[O-] Amb22002099 [2,0,0,0,0,0|1,0,1]=4 2326 B5R0.5 O=C([O-])C(=O)[O-] Amb22045394 [2,0,0,0,0,0|1,0,1]=4 2327 B5R0.5 O=C([O-])C(=O)[O-] Amb22053543 [2,0,0,0,0,0|1,0,1]=4 2328 B5R0.5 O=C([O-])C(=O)[O-] Amb22053547 [2,0,0,0,0,0|1,0,1]=4 2329 B5R0.5 O=C([O-])C(=O)[O-] Amb8514326 [2,0,0,0,0,0|1,0,1]=4 2330 B5R0.5 O=C([O-])C(=O)[O-] Amb8514363 [2,0,0,0,0,0|1,0,1]=4 2331 B5R0.5 O=C([O-])C(=O)[O-] Amb8514364 [2,0,0,0,0,0|1,0,1]=4 2332 B5R0.5 O=C([S-])C(=O)[S-] Amb22730472 [2,0,0,0,0,0|1,1,0]=4 2333 B7R0.2 C#CC(=O)CC(C)C Amb28345618 [1,1,0,0,0,0|1,0,1]=4 2334 B7R0.2 C#CC(=O)OC(C)C Amb25345845 [1,1,0,0,0,0|2,0,0]=4 2335 B7R0.2 C#CC(C)CC(=O)O Amb27246384 [1,1,0,0,0,0|0,0,2]=4 2336 B7R0.2 C#C\C(C)=C\C(=O)O Amb27950241 [1,1,0,0,0,0|0,0,2]=4 2337 B7R0.2 C=C(CO)CC(C)C Amb25889172 [1,1,0,0,0,0|1,0,1]=4 2338 B7R0.2 C=C(O)\C=C(/C)OC Amb27635019 [1,1,0,0,0,0|1,0,1]=4 2339 B7R0.2 C=CC(=O)CC(C)C Amb27412805 [1,1,0,0,0,0|1,0,1]=4 2340 B7R0.2 C=CC(=O)NC(C)C Amb3940719 [1,1,0,0,0,0|2,0,0]=4 2341 B7R0.2 C=CC(=O)OC(C)C Amb22734220 [1,1,0,0,0,0|2,0,0]=4 2342 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [1,1,0,0,0,0|0,0,2]=4 2343 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [1,1,0,0,0,0|0,0,2]=4 2344 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [1,1,0,0,0,0|0,0,2]=4 2345 B7R0.2 C=C\C(C)=C/C(=O)O Amb18641686 [1,1,0,0,0,0|0,0,2]=4 2346 B7R0.2 CC(=O)CC(C)CCl Amb28313530 [1,1,0,0,0,0|1,0,1]=4 2347 B7R0.2 CC(=O)CC(C)CN Amb18251072 [1,1,0,0,0,0|1,0,1]=4 2348 B7R0.2 CC(=O)NC(C)CCl Amb33542146 [1,1,0,0,0,0|2,0,0]=4 2349 B7R0.2 CC(=O)NC(C)CO Amb9276356 [1,1,0,0,0,0|2,0,0]=4 2350 B7R0.2 CC(=O)N[C@@H](C)CN Amb27768700 [1,1,0,0,0,0|2,0,0]=4 2351 B7R0.2 CC(=O)N[C@@H](C)CO Amb26515722 [1,1,0,0,0,0|2,0,0]=4 2352 B7R0.2 CC(=O)N[C@H](C)CO Amb24426644 [1,1,0,0,0,0|2,0,0]=4 2353 B7R0.2 CC(=O)OC(C)CBr Amb26477506 [1,1,0,0,0,0|2,0,0]=4 2354 B7R0.2 CC(=O)OC(C)CN Amb27838841 [1,1,0,0,0,0|2,0,0]=4 2355 B7R0.2 CC(=O)SC(C)CBr Amb27983834 [1,1,0,0,0,0|2,0,0]=4 2356 B7R0.2 CC(=O)SC(C)CCl Amb27253145 [1,1,0,0,0,0|2,0,0]=4 2357 B7R0.2 CC(=O)\C=C(/C)CO Amb25240045 [1,1,0,0,0,0|1,0,1]=4 2358 B7R0.2 CC(=O)\C=C(\C)CO Amb24518297 [1,1,0,0,0,0|1,0,1]=4 2359 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [1,1,0,0,0,0|0,0,2]=4 2360 B7R0.2 CC(C)=CC(=N)NO Amb27623180 [1,1,0,0,0,0|1,0,1]=4 2361 B7R0.2 CC(C)=CC(=O)CBr Amb17594501 [1,1,0,0,0,0|1,0,1]=4 2362 B7R0.2 CC(C)=CC(=O)CCl Amb28313535 [1,1,0,0,0,0|1,0,1]=4 2363 B7R0.2 CC(C)=CC(=O)CO Amb28048944 [1,1,0,0,0,0|0,0,1]=3 2364 B7R0.2 CC(C)=CC(=O)NN Amb27830541 [1,1,0,0,0,0|1,0,1]=4 2365 B7R0.2 CC(C)=CC(=O)NO Amb27835078 [1,1,0,0,0,0|0,0,1]=3 2366 B7R0.2 CC(C)=CC(C)CO Amb28318182 [1,1,0,0,0,0|2,0,0]=4 2367 B7R0.2 CC(C)CC(=O)C#N Amb4019436 [1,1,0,0,0,0|1,0,1]=4 2368 B7R0.2 CC(C)CC(=O)C=O Amb25189904 [1,1,0,0,0,0|0,0,2]=4 2369 B7R0.2 CC(C)CC(=O)CBr Amb22396854 [1,1,0,0,0,0|1,0,1]=4 2370 B7R0.2 CC(C)CC(=O)CCl Amb20622841 [1,1,0,0,0,0|1,0,1]=4 2371 B7R0.2 CC(C)CC(=O)CF Amb23454719 [1,1,0,0,0,0|1,0,1]=4 2372 B7R0.2 CC(C)CC(=O)CN Amb18641847 [1,1,0,0,0,0|1,0,1]=4 2373 B7R0.2 CC(C)CC(=O)CN Amb30982570 [1,1,0,0,0,0|1,0,1]=4 2374 B7R0.2 CC(C)CC(=O)CO Amb18559774 [1,1,0,0,0,0|0,0,1]=3 2375 B7R0.2 CC(C)CC(=O)CS Amb28316226 [1,1,0,0,0,0|0,1,1]=4 2376 B7R0.2 CC(C)CC(=O)NN Amb1154207 [1,1,0,0,0,0|1,0,1]=4 2377 B7R0.2 CC(C)CC(=O)NO Amb6280209 [1,1,0,0,0,0|0,0,1]=3 2378 B7R0.2 CC(C)CC(O)C=O Amb27250174 [1,1,0,0,0,0|0,0,2]=4 2379 B7R0.2 CC(C)C\C(N)=N/O Amb2696576 [1,1,0,0,0,0|1,0,1]=4 2380 B7R0.2 CC(C)C\C(N)=N\O Amb8384557 [1,1,0,0,0,0|1,0,1]=4 2381 B7R0.2 CC(C)NC(=O)C#N Amb27839607 [1,1,0,0,0,0|2,0,0]=4 2382 B7R0.2 CC(C)NC(=O)C=O Amb27881630 [1,1,0,0,0,0|1,0,1]=4 2383 B7R0.2 CC(C)NC(=O)CBr Amb2090260 [1,1,0,0,0,0|2,0,0]=4 2384 B7R0.2 CC(C)NC(=O)CCl Amb1151852 [1,1,0,0,0,0|2,0,0]=4 2385 B7R0.2 CC(C)NC(=O)CI Amb10608892 [1,1,0,0,0,0|2,0,0]=4 2386 B7R0.2 CC(C)NC(=O)CN Amb435868 [1,1,0,0,0,0|2,0,0]=4 2387 B7R0.2 CC(C)NC(=O)CN Amb6892385 [1,1,0,0,0,0|2,0,0]=4 2388 B7R0.2 CC(C)NC(=O)CO Amb5798170 [1,1,0,0,0,0|1,0,0]=3 2389 B7R0.2 CC(C)NC(=O)NN Amb8854026 [1,1,0,0,0,0|2,0,0]=4 2390 B7R0.2 CC(C)NC(=O)NO Amb27838415 [1,1,0,0,0,0|1,0,0]=3 2391 B7R0.2 CC(C)NN(O)N=O Amb27423687 [1,1,0,0,0,0|2,0,0]=4 2392 B7R0.2 CC(C)N\C(N)=N\O Amb2697162 [1,1,0,0,0,0|2,0,0]=4 2393 B7R0.2 CC(C)OC(=O)C#N Amb27263089 [1,1,0,0,0,0|2,0,0]=4 2394 B7R0.2 CC(C)OC(=O)CBr Amb3939972 [1,1,0,0,0,0|2,0,0]=4 2395 B7R0.2 CC(C)OC(=O)CCl Amb1153072 [1,1,0,0,0,0|2,0,0]=4 2396 B7R0.2 CC(C)OC(=O)CN Amb10807427 [1,1,0,0,0,0|2,0,0]=4 2397 B7R0.2 CC(C)OC(=O)CN Amb9289819 [1,1,0,0,0,0|2,0,0]=4 2398 B7R0.2 CC(C)OC(=O)CO Amb3941003 [1,1,0,0,0,0|1,0,0]=3 2399 B7R0.2 CC(C)OC(=O)CS Amb2698248 [1,1,0,0,0,0|1,1,0]=4 2400 B7R0.2 CC(C)OC(=O)NF Amb27165196 [1,1,0,0,0,0|2,0,0]=4 2401 B7R0.2 CC(C)OC(=O)NN Amb19516135 [1,1,0,0,0,0|2,0,0]=4 2402 B7R0.2 CC(C)OC(N)=S=O Amb27814664 [1,1,0,0,0,0|2,0,0]=4 2403 B7R0.2 CC(C)SC(=O)CBr Amb28458507 [1,1,0,0,0,0|2,0,0]=4 2404 B7R0.2 CC(C)SC(=O)NN Amb27830889 [1,1,0,0,0,0|2,0,0]=4 2405 B7R0.2 CC(C)S\C(N)=N\O Amb24505936 [1,1,0,0,0,0|2,0,0]=4 2406 B7R0.2 CC(C)\C=C(\F)CO Amb27662199 [1,1,0,0,0,0|1,0,0]=3 2407 B7R0.2 CC(CC(=O)O)NN Amb28346224 [1,1,0,0,0,0|1,0,1]=4 2408 B7R0.2 CC(CC(=O)O)NN Amb33141007 [1,1,0,0,0,0|1,0,1]=4 2409 B7R0.2 CC(CCl)CC(=O)Cl Amb27949867 [1,1,0,0,0,0|1,0,1]=4 2410 B7R0.2 CC(CCl)OC(=O)Cl Amb27482960 [1,1,0,0,0,0|2,0,0]=4 2411 B7R0.2 CC(CCl)OC(=O)F Amb27424209 [1,1,0,0,0,0|2,0,0]=4 2412 B7R0.2 CC(CF)CC(=O)O Amb25990964 [1,1,0,0,0,0|0,0,1]=3 2413 B7R0.2 CC(CN)CC(=O)O Amb18124263 [1,1,0,0,0,0|0,0,1]=3 2414 B7R0.2 CC(CN)CC(=O)O Amb20669501 [1,1,0,0,0,0|0,0,1]=3 2415 B7R0.2 CC(CN)CC(=O)O Amb32752805 [1,1,0,0,0,0|0,0,1]=3 2416 B7R0.2 CC(CN)CC(N)=O Amb18641899 [1,1,0,0,0,0|1,0,1]=4 2417 B7R0.2 CC(CN)NC(N)=O Amb18202682 [1,1,0,0,0,0|2,0,0]=4 2418 B7R0.2 CC(CN)O[PH](=O)O Amb28388782 [1,1,0,0,0,0|2,0,0]=4 2419 B7R0.2 CC(CO)CC(=O)O Amb18198168 [1,1,0,0,0,0|0,0,1]=3 2420 B7R0.2 CC(CO)CC(=O)[O-] Amb33329956 [1,1,0,0,0,0|0,0,2]=4 2421 B7R0.2 CC(CO)OC(N)=O Amb26402233 [1,1,0,0,0,0|2,0,0]=4 2422 B7R0.2 CCC(=O)C=C(C)C Amb25715052 [1,1,0,0,0,0|1,0,1]=4 2423 B7R0.2 CCC(=O)CC(C)C Amb17138363 [1,1,0,0,0,0|1,0,1]=4 2424 B7R0.2 CCC(=O)NC(C)C Amb5797517 [1,1,0,0,0,0|2,0,0]=4 2425 B7R0.2 CCC(=O)SC(C)C Amb25993951 [1,1,0,0,0,0|2,0,0]=4 2426 B7R0.2 CCC(C)CC(=O)Cl Amb10844649 [1,1,0,0,0,0|1,0,1]=4 2427 B7R0.2 CCC(C)CC(=O)O Amb2689581 [1,1,0,0,0,0|0,0,1]=3 2428 B7R0.2 CCC(C)CC(C)=O Amb10608208 [1,1,0,0,0,0|1,0,1]=4 2429 B7R0.2 CCC(C)CC(N)=O Amb25230669 [1,1,0,0,0,0|1,0,1]=4 2430 B7R0.2 CCC(C)NC(=O)Cl Amb27838339 [1,1,0,0,0,0|2,0,0]=4 2431 B7R0.2 CCC(C)NC(C)=O Amb3358085 [1,1,0,0,0,0|2,0,0]=4 2432 B7R0.2 CCC(C)NC(N)=O Amb9702507 [1,1,0,0,0,0|2,0,0]=4 2433 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [1,1,0,0,0,0|2,0,0]=4 2434 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [1,1,0,0,0,0|2,0,0]=4 2435 B7R0.2 CCC(N)CC(=O)O Amb1993862 [1,1,0,0,0,0|1,0,1]=4 2436 B7R0.2 CCC(N)CC(=O)O Amb8631361 [1,1,0,0,0,0|1,0,1]=4 2437 B7R0.2 CCC(O)CC(=O)O Amb10844270 [1,1,0,0,0,0|1,0,1]=4 2438 B7R0.2 CCN(C)CC(=O)O Amb33620688 [1,1,0,0,0,0|1,0,1]=4 2439 B7R0.2 CCN(C)CC(=O)O Amb8428140 [1,1,0,0,0,0|1,0,1]=4 2440 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [1,1,0,0,0,0|0,0,1]=3 2441 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [1,1,0,0,0,0|1,0,1]=4 2442 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [1,1,0,0,0,0|1,0,1]=4 2443 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [1,1,0,0,0,0|1,0,1]=4 2444 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [1,1,0,0,0,0|0,0,1]=3 2445 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [1,1,0,0,0,0|1,0,1]=4 2446 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [1,1,0,0,0,0|1,0,1]=4 2447 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [1,1,0,0,0,0|1,0,1]=4 2448 B7R0.2 CC\C(Br)=C\C(=O)O Amb27409320 [1,1,0,0,0,0|1,0,1]=4 2449 B7R0.2 CC\C(C)=C/C(=O)O Amb18281014 [1,1,0,0,0,0|0,0,1]=3 2450 B7R0.2 CC\C(C)=C/C(C)=O Amb27424977 [1,1,0,0,0,0|1,0,1]=4 2451 B7R0.2 CC\C(C)=C\C(=O)O Amb33528462 [1,1,0,0,0,0|0,0,1]=3 2452 B7R0.2 CC\C(C)=C\C(C)=O Amb27985733 [1,1,0,0,0,0|1,0,1]=4 2453 B7R0.2 CC\C(F)=C/C(=O)O Amb27780201 [1,1,0,0,0,0|1,0,1]=4 2454 B7R0.2 CC\C(N)=C\C(=O)O Amb28145108 [1,1,0,0,0,0|1,0,1]=4 2455 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [1,1,0,0,0,0|1,0,1]=4 2456 B7R0.2 CN(C)\C=C(/Br)C=O Amb20622479 [1,1,0,0,0,0|2,0,0]=4 2457 B7R0.2 CN(C)\C=C(/Cl)C=O Amb27392189 [1,1,0,0,0,0|2,0,0]=4 2458 B7R0.2 CN(C)\C=C(/I)C=O Amb28077233 [1,1,0,0,0,0|2,0,0]=4 2459 B7R0.2 CN(CO)CC(=O)O Amb27663224 [1,1,0,0,0,0|1,0,1]=4 2460 B7R0.2 CNC(=O)C=C(C)C Amb27838918 [1,1,0,0,0,0|1,0,1]=4 2461 B7R0.2 CNC(=O)OC(C)C Amb27838350 [1,1,0,0,0,0|2,0,0]=4 2462 B7R0.2 CNC(C)CC(=O)O Amb21959674 [1,1,0,0,0,0|0,0,1]=3 2463 B7R0.2 CNC(C)CC(=O)O Amb9398363 [1,1,0,0,0,0|0,0,1]=3 2464 B7R0.2 CNC(C)CC(N)=O Amb17231826 [1,1,0,0,0,0|1,0,1]=4 2465 B7R0.2 CNC(C)CC(N)=O Amb19960012 [1,1,0,0,0,0|1,0,1]=4 2466 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [1,1,0,0,0,0|0,0,1]=3 2467 B7R0.2 CN\C(C)=C/C(C)=O Amb15691784 [1,1,0,0,0,0|1,0,1]=4 2468 B7R0.2 CN\C(C)=C\C(C)=O Amb27486166 [1,1,0,0,0,0|1,0,1]=4 2469 B7R0.2 COC(=N)CC(C)C Amb26515773 [1,1,0,0,0,0|1,0,1]=4 2470 B7R0.2 COC(=N)CC(C)C Amb32658736 [1,1,0,0,0,0|1,0,1]=4 2471 B7R0.2 COC(=O)C=C(C)C Amb8384897 [1,1,0,0,0,0|0,0,1]=3 2472 B7R0.2 COC(=O)CC(C)Br Amb10603675 [1,1,0,0,0,0|1,0,1]=4 2473 B7R0.2 COC(=O)CC(C)C Amb9241810 [1,1,0,0,0,0|0,0,1]=3 2474 B7R0.2 COC(=O)CC(C)Cl Amb4017877 [1,1,0,0,0,0|1,0,1]=4 2475 B7R0.2 COC(=O)CC(C)N Amb2371489 [1,1,0,0,0,0|1,0,1]=4 2476 B7R0.2 COC(=O)CC(C)N Amb461639 [1,1,0,0,0,0|1,0,1]=4 2477 B7R0.2 COC(=O)CC(C)O Amb9277785 [1,1,0,0,0,0|1,0,1]=4 2478 B7R0.2 COC(=O)CC(C)S Amb19515267 [1,1,0,0,0,0|1,0,1]=4 2479 B7R0.2 COC(=O)CN(C)C Amb7755999 [1,1,0,0,0,0|1,0,1]=4 2480 B7R0.2 COC(=O)C[C@@H](C)N Amb22898912 [1,1,0,0,0,0|1,0,1]=4 2481 B7R0.2 COC(=O)C[C@@H](C)N Amb8395866 [1,1,0,0,0,0|1,0,1]=4 2482 B7R0.2 COC(=O)C[C@@H](C)O Amb2725551 [1,1,0,0,0,0|1,0,1]=4 2483 B7R0.2 COC(=O)C[C@H](C)N Amb25789928 [1,1,0,0,0,0|1,0,1]=4 2484 B7R0.2 COC(=O)C[C@H](C)N Amb33847401 [1,1,0,0,0,0|1,0,1]=4 2485 B7R0.2 COC(=O)C[C@H](C)O Amb8397299 [1,1,0,0,0,0|1,0,1]=4 2486 B7R0.2 COC(=O)NC(C)C Amb17861698 [1,1,0,0,0,0|1,0,0]=3 2487 B7R0.2 COC(=O)OC(C)C Amb22049510 [1,1,0,0,0,0|1,0,0]=3 2488 B7R0.2 COC(=O)OC(C)Cl Amb28320721 [1,1,0,0,0,0|2,0,0]=4 2489 B7R0.2 COC(=O)OC(C)F Amb28251346 [1,1,0,0,0,0|2,0,0]=4 2490 B7R0.2 COC(=O)OC(C)O Amb28207359 [1,1,0,0,0,0|2,0,0]=4 2491 B7R0.2 COC(=O)\C=C(/C)N Amb1157857 [1,1,0,0,0,0|1,0,1]=4 2492 B7R0.2 COC(=O)\C=C(\C)N Amb4018177 [1,1,0,0,0,0|1,0,1]=4 2493 B7R0.2 COC(C)C=C(Br)Br Amb27226095 [1,1,0,0,0,0|2,0,0]=4 2494 B7R0.2 COC(C)CC(=O)O Amb4001695 [1,1,0,0,0,0|0,0,1]=3 2495 B7R0.2 COC(C)CC(C)=O Amb26512071 [1,1,0,0,0,0|1,0,1]=4 2496 B7R0.2 COC(C)CC(N)=O Amb27838372 [1,1,0,0,0,0|1,0,1]=4 2497 B7R0.2 COC(C)NC(C)=O Amb27839138 [1,1,0,0,0,0|2,0,0]=4 2498 B7R0.2 CON(C)CC(=O)O Amb8010467 [1,1,0,0,0,0|1,0,1]=4 2499 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [1,1,0,0,0,0|0,0,1]=3 2500 B7R0.2 CO[C@H](C)CC(C)=O Amb26494510 [1,1,0,0,0,0|1,0,1]=4 2501 B7R0.2 CO\C(C)=C/C(=O)O Amb2611888 [1,1,0,0,0,0|0,0,1]=3 2502 B7R0.2 CO\C(C)=C/C(C)=O Amb28145644 [1,1,0,0,0,0|1,0,1]=4 2503 B7R0.2 CO\C(C)=C\C(=O)O Amb27631657 [1,1,0,0,0,0|0,0,1]=3 2504 B7R0.2 CO\C([O-])=C\[S+](C)C Amb27862552 [1,1,0,0,0,0|1,0,1]=4 2505 B7R0.2 CSC(C)CC(=O)O Amb18967824 [1,1,0,0,0,0|0,0,1]=3 2506 B7R0.2 CSC(C)CC(C)=O Amb25714199 [1,1,0,0,0,0|1,0,1]=4 2507 B7R0.2 CSC(C)CC(N)=O Amb27838848 [1,1,0,0,0,0|1,0,1]=4 2508 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [1,1,0,0,0,0|0,0,1]=3 2509 B7R0.2 CS\C(C)=C\C(C)=O Amb28315811 [1,1,0,0,0,0|1,0,1]=4 2510 B7R0.2 C[C@@H](CCl)CC(=O)Cl Amb27855839 [1,1,0,0,0,0|1,0,1]=4 2511 B7R0.2 C[C@@H](CF)NC(N)=O Amb27660553 [1,1,0,0,0,0|2,0,0]=4 2512 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [1,1,0,0,0,0|0,0,1]=3 2513 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [1,1,0,0,0,0|0,0,1]=3 2514 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [1,1,0,0,0,0|0,0,1]=3 2515 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [1,1,0,0,0,0|0,0,1]=3 2516 B7R0.2 C[C@H](CN)NC(N)=O Amb28049036 [1,1,0,0,0,0|2,0,0]=4 2517 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [1,1,0,0,0,0|0,0,1]=3 2518 B7R0.2 C\C(=C/C(=O)Cl)CBr Amb27477400 [1,1,0,0,0,0|1,0,1]=4 2519 B7R0.2 C\C(=C/C(=O)Cl)CCl Amb28134682 [1,1,0,0,0,0|1,0,1]=4 2520 B7R0.2 C\C(=C/C(=O)O)CO Amb18641871 [1,1,0,0,0,0|0,0,1]=3 2521 B7R0.2 C\C(=C/C(N)=O)CN Amb28288035 [1,1,0,0,0,0|1,0,1]=4 2522 B7R0.2 C\C(=C/[C@H](C)N)CO Amb27838303 [1,1,0,0,0,0|2,0,0]=4 2523 B7R0.2 C\C(=C\C(C)C)CCl Amb27875838 [1,1,0,0,0,0|2,0,0]=4 2524 B7R0.2 C\C(=C\C(C)N)CO Amb28240215 [1,1,0,0,0,0|2,0,0]=4 2525 B7R0.2 C\C(=C\[C@@H](C)N)CO Amb27635084 [1,1,0,0,0,0|2,0,0]=4 2526 B7R0.2 C\C(Br)=C\[C@@H](C)CO Amb28206195 [1,1,0,0,0,0|2,0,0]=4 2527 B7R0.2 C\C(C#N)=C/C(=O)O Amb27830669 [1,1,0,0,0,0|0,0,2]=4 2528 B7R0.2 C\C(C=O)=C/N(C)C Amb2779776 [1,1,0,0,0,0|2,0,0]=4 2529 B7R0.2 C\C(C=O)=C\C(C)O Amb27802195 [1,1,0,0,0,0|2,0,0]=4 2530 B7R0.2 C\C(C=O)=C\N(C)C Amb19651322 [1,1,0,0,0,0|2,0,0]=4 2531 B7R0.2 C\C(CC(C)C)=N/O Amb26630838 [1,1,0,0,0,0|1,0,1]=4 2532 B7R0.2 C\C(CC(C)C)=N\O Amb27624178 [1,1,0,0,0,0|1,0,1]=4 2533 B7R0.2 C\N=C(C)/C=C(\C)O Amb27637850 [1,1,0,0,0,0|1,0,1]=4 2534 B7R0.2 NC(CF)CC(=O)O Amb24428065 [1,1,0,0,0,0|1,0,1]=4 2535 B7R0.2 NC(CS)CC(=O)O Amb25090412 [1,1,0,0,0,0|1,0,1]=4 2536 B7R0.2 NCC(N)CC(=O)O Amb19515145 [1,1,0,0,0,0|1,0,1]=4 2537 B7R0.2 NCC(N)CC(=O)O Amb21858324 [1,1,0,0,0,0|1,0,1]=4 2538 B7R0.2 NCC(O)CC(=O)O Amb32663899 [1,1,0,0,0,0|1,0,1]=4 2539 B7R0.2 NCC(O)CC(=O)O Amb33544754 [1,1,0,0,0,0|1,0,1]=4 2540 B7R0.2 NC[C@@H](F)CC(=O)O Amb27481078 [1,1,0,0,0,0|1,0,1]=4 2541 B7R0.2 NC[C@@H](N)CC(=O)O Amb10603267 [1,1,0,0,0,0|1,0,1]=4 2542 B7R0.2 NC[C@@H](O)CC(=O)O Amb32665211 [1,1,0,0,0,0|1,0,1]=4 2543 B7R0.2 NC[C@@H](O)CC(=O)O Amb8386098 [1,1,0,0,0,0|1,0,1]=4 2544 B7R0.2 NC[C@H](O)CC(=O)O Amb8628962 [1,1,0,0,0,0|1,0,1]=4 2545 B7R0.2 NC\C(I)=C\C(=O)O Amb28386476 [1,1,0,0,0,0|1,0,1]=4 2546 B7R0.2 N[C@@H](CO)CC(=O)O Amb16184020 [1,1,0,0,0,0|1,0,1]=4 2547 B7R0.2 N[C@@H](CO)CC(=O)O Amb22388520 [1,1,0,0,0,0|1,0,1]=4 2548 B7R0.2 N[C@H](CO)CC(=O)O Amb2694944 [1,1,0,0,0,0|1,0,1]=4 2549 B7R0.2 N[C@H](CS)CC(=O)O Amb28326106 [1,1,0,0,0,0|1,0,1]=4 2550 B7R0.2 O=C(O)CC(O)CBr Amb27592126 [1,1,0,0,0,0|1,0,1]=4 2551 B7R0.2 O=C(O)CC(O)CF Amb26557587 [1,1,0,0,0,0|1,0,1]=4 2552 B7R0.2 O=C(O)CC(O)CO Amb28120003 [1,1,0,0,0,0|1,0,1]=4 2553 B7R0.2 O=C(O)CC(O)CS Amb27244674 [1,1,0,0,0,0|1,0,1]=4 2554 B7R0.2 O=C(O)C[C@@H](O)CF Amb33377449 [1,1,0,0,0,0|1,0,1]=4 2555 B7R0.2 O=C(O)C[C@H](O)CBr Amb28325607 [1,1,0,0,0,0|1,0,1]=4 2556 B7R0.2 O=C(O)C[C@H](O)CCl Amb27830780 [1,1,0,0,0,0|1,0,1]=4 2557 B7R0.2 O=C(O)C[C@H](O)CF Amb33377451 [1,1,0,0,0,0|1,0,1]=4 2558 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [1,1,0,0,0,0|1,0,1]=4 2559 B7R0.2 O=C(O)\C=C(/Br)CO Amb27424808 [1,1,0,0,0,0|1,0,1]=4 2560 B7R0.2 O=C(O)\C=C(\O)CBr Amb28458506 [1,1,0,0,0,0|1,0,1]=4 2561 B7R0.9 CC(=O)CC(C)(C)C Amb4605984 [1,1,0,0,0,0|1,0,1]=4 2562 B7R0.9 CC(=O)CC(C)(C)Cl Amb27861037 [1,1,0,0,0,0|1,0,1]=4 2563 B7R0.9 CC(=O)CC(C)(C)N Amb3940544 [1,1,0,0,0,0|1,0,1]=4 2564 B7R0.9 CC(=O)CC(C)(C)N Amb4136360 [1,1,0,0,0,0|1,0,1]=4 2565 B7R0.9 CC(=O)CC(C)(C)O Amb2721701 [1,1,0,0,0,0|1,0,1]=4 2566 B7R0.9 CC(=O)CC(C)(C)S Amb17593394 [1,1,0,0,0,0|1,0,1]=4 2567 B7R0.9 CC(=O)NC(C)(C)C Amb2721059 [1,1,0,0,0,0|2,0,0]=4 2568 B7R0.9 CC(=O)OC(C)(C)C Amb8386362 [1,1,0,0,0,0|2,0,0]=4 2569 B7R0.9 CC(=O)OC(C)(C)Cl Amb28456284 [1,1,0,0,0,0|2,0,0]=4 2570 B7R0.9 CC(=O)SC(C)(C)C Amb22231459 [1,1,0,0,0,0|2,0,0]=4 2571 B7R0.9 CC(C)(Br)CC(=O)Cl Amb32665504 [1,1,0,0,0,0|1,0,1]=4 2572 B7R0.9 CC(C)(Br)CC(=O)O Amb27400399 [1,1,0,0,0,0|0,0,1]=3 2573 B7R0.9 CC(C)(C)CC(=O)Cl Amb3939309 [1,1,0,0,0,0|1,0,1]=4 2574 B7R0.9 CC(C)(C)CC(=O)O Amb3939865 [1,1,0,0,0,0|0,0,1]=3 2575 B7R0.9 CC(C)(C)CC(N)=O Amb3886534 [1,1,0,0,0,0|1,0,1]=4 2576 B7R0.9 CC(C)(C)NC(N)=O Amb2721329 [1,1,0,0,0,0|2,0,0]=4 2577 B7R0.9 CC(C)(C)OC(=O)Cl Amb6743390 [1,1,0,0,0,0|2,0,0]=4 2578 B7R0.9 CC(C)(C)OC(N)=O Amb2236390 [1,1,0,0,0,0|2,0,0]=4 2579 B7R0.9 CC(C)(C)SC(=O)Cl Amb22353785 [1,1,0,0,0,0|2,0,0]=4 2580 B7R0.9 CC(C)(Cl)CC(=O)O Amb28047719 [1,1,0,0,0,0|0,0,1]=3 2581 B7R0.9 CC(C)(F)CC(=O)O Amb26360155 [1,1,0,0,0,0|0,0,1]=3 2582 B7R0.9 CC(C)(N)C=C(Cl)Cl Amb27878721 [1,1,0,0,0,0|2,0,0]=4 2583 B7R0.9 CC(C)(N)CC(=O)Cl Amb27173472 [1,1,0,0,0,0|1,0,1]=4 2584 B7R0.9 CC(C)(N)CC(=O)O Amb19267108 [1,1,0,0,0,0|0,0,1]=3 2585 B7R0.9 CC(C)(N)CC(=O)O Amb2691269 [1,1,0,0,0,0|0,0,1]=3 2586 B7R0.9 CC(C)(N)CC(=O)O Amb33109875 [1,1,0,0,0,0|0,0,1]=3 2587 B7R0.9 CC(C)(N)CC(N)=O Amb23402094 [1,1,0,0,0,0|1,0,1]=4 2588 B7R0.9 CC(C)(N)CC(N)=O Amb24271090 [1,1,0,0,0,0|1,0,1]=4 2589 B7R0.9 CC(C)(O)CC(=O)O Amb10605560 [1,1,0,0,0,0|0,0,1]=3 2590 B7R0.9 CC(C)(O)CC(=O)[O-] Amb17678748 [1,1,0,0,0,0|0,0,2]=4 2591 B7R0.9 CC(C)(O)CC(=O)[O-] Amb22729769 [1,1,0,0,0,0|0,0,2]=4 2592 B7R0.9 CC(C)(O)CC(N)=O Amb25889946 [1,1,0,0,0,0|1,0,1]=4 2593 B7R0.9 CC(C)(S)CC(=O)O Amb28314250 [1,1,0,0,0,0|0,0,1]=3 2594 B7R0.9 CC(C)=CC(C)(C)Cl Amb26533525 [1,1,0,0,0,0|2,0,0]=4 2595 B7R0.9 CC(C)CS(=O)(=O)O Amb28349282 [1,1,0,0,0,0|1,0,1]=4 2596 B7R0.9 CC(C)NS(=O)(=O)O Amb28385158 [1,1,0,0,0,0|2,0,0]=4 2597 B7R0.9 CC(C)OP(=O)(O)O Amb22493772 [1,1,0,0,0,0|2,0,0]=4 2598 B7R0.9 CC(C)OP(C)(=O)O Amb10842159 [1,1,0,0,0,0|2,0,0]=4 2599 B7R0.9 CC(F)(F)CC(=O)O Amb26018420 [1,1,0,0,0,0|1,0,1]=4 2600 B7R0.9 CC(O)(F)CC(=O)O Amb28072926 [1,1,0,0,0,0|1,0,1]=4 2601 B7R0.9 CC(O)(O)CC(=O)O Amb27405076 [1,1,0,0,0,0|1,0,1]=4 2602 B7R0.9 CP(C)(=O)CC(=O)O Amb25197683 [1,1,0,0,0,0|1,0,1]=4 2603 B7R0.9 CS(C)(=O)=CC(N)=O Amb28397881 [1,1,0,0,0,0|2,0,0]=4 2604 B7R0.9 CS(C)(Cl)CC(=O)O Amb27633859 [1,1,0,0,0,0|1,0,1]=4 2605 B7R0.9 C[N+](C)(C)CC(=O)O Amb3428940 [1,1,0,0,0,0|1,0,1]=4 2606 B7R0.9 C[N+](C)(N)CC(=O)O Amb27242840 [1,1,0,0,0,0|1,0,1]=4 2607 B7R0.9 C[Si](C)(C)CC(=O)O Amb19894126 [1,1,0,0,0,0|0,1,1]=4 2608 B7R0.5 C#CCC(=O)C(=O)O Amb27601316 [1,1,0,0,0,0|0,0,1]=3 2609 B7R0.5 C#CCC(=O)C(C)C Amb27214113 [1,1,0,0,0,0|1,0,1]=4 2610 B7R0.5 C=C(Br)C(=O)OCC Amb19516136 [1,1,0,0,0,0|2,0,0]=4 2611 B7R0.5 C=C(C)C(=O)CCC Amb25862437 [1,1,0,0,0,0|2,0,0]=4 2612 B7R0.5 C=C(C)C(=O)CCN Amb25694471 [1,1,0,0,0,0|2,0,0]=4 2613 B7R0.5 C=C(C)C(=O)CNC Amb26901887 [1,1,0,0,0,0|2,0,0]=4 2614 B7R0.5 C=C(C)C(=O)NCC Amb17934052 [1,1,0,0,0,0|2,0,0]=4 2615 B7R0.5 C=C(C)C(=O)OCC Amb8395008 [1,1,0,0,0,0|2,0,0]=4 2616 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [1,1,0,0,0,0|1,0,0]=3 2617 B7R0.5 C=C(CCF)C(=O)O Amb33480692 [1,1,0,0,0,0|1,0,0]=3 2618 B7R0.5 C=C(CCN)C(=O)O Amb27267272 [1,1,0,0,0,0|1,0,0]=3 2619 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [1,1,0,0,0,0|1,0,0]=3 2620 B7R0.5 C=C(COC)C(=O)O Amb26978134 [1,1,0,0,0,0|1,0,0]=3 2621 B7R0.5 C=C(COC)C(C)C Amb28072395 [1,1,0,0,0,0|1,0,1]=4 2622 B7R0.5 C=C(CSC)C(=O)O Amb26953041 [1,1,0,0,0,0|1,0,0]=3 2623 B7R0.5 C=C(Cl)C(=O)OCC Amb22734210 [1,1,0,0,0,0|2,0,0]=4 2624 B7R0.5 C=C(N=C=O)C(C)C Amb27828008 [1,1,0,0,0,0|1,0,1]=4 2625 B7R0.5 C=CCC(=C)C(=O)O Amb18641687 [1,1,0,0,0,0|1,0,1]=4 2626 B7R0.5 C=CCC(=O)C(=O)O Amb25890017 [1,1,0,0,0,0|0,0,1]=3 2627 B7R0.5 C=CCC(=O)[C@@H](C)N Amb30024575 [1,1,0,0,0,0|2,0,0]=4 2628 B7R0.5 C=CCC(=O)[C@H](C)N Amb35617898 [1,1,0,0,0,0|2,0,0]=4 2629 B7R0.5 C=CNC(=O)C(C)C Amb28252471 [1,1,0,0,0,0|1,0,0]=3 2630 B7R0.5 C=CNC(=O)C(C)O Amb27872694 [1,1,0,0,0,0|2,0,0]=4 2631 B7R0.5 C=COC(=O)C(C)C Amb26422505 [1,1,0,0,0,0|1,0,0]=3 2632 B7R0.5 C=COC(=O)C(C)O Amb17593197 [1,1,0,0,0,0|2,0,0]=4 2633 B7R0.5 C=COC(=O)N(C)C Amb27811374 [1,1,0,0,0,0|2,0,0]=4 2634 B7R0.5 CC(=O)C(=O)CC=O Amb24524264 [1,1,0,0,0,0|1,0,1]=4 2635 B7R0.5 CC(=O)C(=O)CCCl Amb28077243 [1,1,0,0,0,0|1,0,0]=3 2636 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [1,1,0,0,0,0|1,0,0]=3 2637 B7R0.5 CC(C)=C(C)CC=O Amb27625010 [1,1,0,0,0,0|1,0,1]=4 2638 B7R0.5 CC(C)C(=O)C=[N+]=[N-] Amb24557187 [1,1,0,0,0,0|1,0,0]=3 2639 B7R0.5 CC(C)C(=O)CC#N Amb7172624 [1,1,0,0,0,0|1,0,1]=4 2640 B7R0.5 CC(C)C(=O)CC=O Amb25771325 [1,1,0,0,0,0|0,0,0]=2 2641 B7R0.5 CC(C)C(=O)CCN Amb18202694 [1,1,0,0,0,0|1,0,1]=4 2642 B7R0.5 CC(C)C(=O)CCO Amb20669209 [1,1,0,0,0,0|0,0,1]=3 2643 B7R0.5 CC(C)C(=O)N=C=O Amb33547669 [1,1,0,0,0,0|0,0,1]=3 2644 B7R0.5 CC(C)C(=O)N=C=S Amb1118608 [1,1,0,0,0,0|0,1,1]=4 2645 B7R0.5 CC(C)C(=O)N=[N+]=[N-] Amb26064270 [1,1,0,0,0,0|2,0,0]=4 2646 B7R0.5 CC(C)C(=O)NCO Amb27838418 [1,1,0,0,0,0|0,0,1]=3 2647 B7R0.5 CC(C)C(=O)OCCl Amb22728948 [1,1,0,0,0,0|1,0,1]=4 2648 B7R0.5 CC(C)C(=O)OCI Amb27147082 [1,1,0,0,0,0|1,0,1]=4 2649 B7R0.5 CC(C)C(=O)\C=C\Cl Amb34915330 [1,1,0,0,0,0|1,0,0]=3 2650 B7R0.5 CC(C)C(=O)\C=C\N Amb25083174 [1,1,0,0,0,0|1,0,0]=3 2651 B7R0.5 CC(C)C(=O)\C=C\[O-] Amb27837535 [1,1,0,0,0,0|0,0,1]=3 2652 B7R0.5 CC(C)C(=O)\C=N\O Amb28382384 [1,1,0,0,0,0|0,0,0]=2 2653 B7R0.5 CC(C)C(=O)\N=C\S Amb27949045 [1,1,0,0,0,0|0,1,0]=3 2654 B7R0.5 CC(C)C(C)CC=O Amb18641816 [1,1,0,0,0,0|1,0,1]=4 2655 B7R0.5 CC(C)C(C)\C=N\O Amb27184671 [1,1,0,0,0,0|1,0,1]=4 2656 B7R0.5 CC(C)C(Cl)\C=N\O Amb27424666 [1,1,0,0,0,0|1,0,1]=4 2657 B7R0.5 CC(C)C(N)CC=O Amb27628058 [1,1,0,0,0,0|1,0,1]=4 2658 B7R0.5 CC(C)[C@@H](C)CC=O Amb28388606 [1,1,0,0,0,0|1,0,1]=4 2659 B7R0.5 CC(C)[C@H](N)NC=O Amb28187220 [1,1,0,0,0,0|1,0,1]=4 2660 B7R0.5 CC(C)\C(N)=C/C#N Amb35744437 [1,1,0,0,0,0|2,0,0]=4 2661 B7R0.5 CC(C)\C(N)=C\C#N Amb28423511 [1,1,0,0,0,0|2,0,0]=4 2662 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [1,1,0,0,0,0|1,0,1]=4 2663 B7R0.5 CC(CCF)C(=O)O Amb24678386 [1,1,0,0,0,0|1,0,1]=4 2664 B7R0.5 CC(CCN)C(=O)O Amb20667970 [1,1,0,0,0,0|1,0,1]=4 2665 B7R0.5 CC(CCN)C(=O)O Amb538221 [1,1,0,0,0,0|1,0,1]=4 2666 B7R0.5 CC(CCO)C(=O)O Amb18641949 [1,1,0,0,0,0|1,0,1]=4 2667 B7R0.5 CC(Cl)C(=O)N=C=O Amb18061679 [1,1,0,0,0,0|1,0,1]=4 2668 B7R0.5 CC(Cl)C(=O)\C=C\Cl Amb17593817 [1,1,0,0,0,0|2,0,0]=4 2669 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [1,1,0,0,0,0|0,0,0]=2 2670 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [1,1,0,0,0,0|1,0,0]=3 2671 B7R0.5 CCCC(=O)C(C)C Amb8394855 [1,1,0,0,0,0|1,0,1]=4 2672 B7R0.5 CCCC(=O)C(C)O Amb24481443 [1,1,0,0,0,0|1,0,1]=4 2673 B7R0.5 CCCC(=O)N(C)O Amb27229047 [1,1,0,0,0,0|2,0,0]=4 2674 B7R0.5 CCCC(=O)[C@H](C)O Amb24546365 [1,1,0,0,0,0|1,0,1]=4 2675 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [1,1,0,0,0,0|1,0,1]=4 2676 B7R0.5 CCCC(C)C(=O)O Amb3938958 [1,1,0,0,0,0|1,0,1]=4 2677 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [1,1,0,0,0,0|1,0,1]=4 2678 B7R0.5 CCCC(F)C(=O)O Amb25842008 [1,1,0,0,0,0|1,0,1]=4 2679 B7R0.5 CCCC(N)C(=O)O Amb6262055 [1,1,0,0,0,0|1,0,1]=4 2680 B7R0.5 CCCC(O)C(=O)O Amb2818222 [1,1,0,0,0,0|0,0,2]=4 2681 B7R0.5 CCCC(S)C(=O)O Amb18124440 [1,1,0,0,0,0|0,1,1]=4 2682 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [1,1,0,0,0,0|1,0,1]=4 2683 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [1,1,0,0,0,0|1,0,1]=4 2684 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [1,1,0,0,0,0|1,0,1]=4 2685 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [1,1,0,0,0,0|0,0,2]=4 2686 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [1,1,0,0,0,0|1,0,1]=4 2687 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [1,1,0,0,0,0|1,0,1]=4 2688 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [1,1,0,0,0,0|1,0,1]=4 2689 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [1,1,0,0,0,0|1,0,1]=4 2690 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [1,1,0,0,0,0|1,0,1]=4 2691 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [1,1,0,0,0,0|0,0,2]=4 2692 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [1,1,0,0,0,0|0,1,1]=4 2693 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [1,1,0,0,0,0|0,0,0]=2 2694 B7R0.5 CCNC(=O)C(C)=O Amb17399798 [1,1,0,0,0,0|1,0,0]=3 2695 B7R0.5 CCNC(=O)C(C)O Amb9421391 [1,1,0,0,0,0|1,0,1]=4 2696 B7R0.5 CCNC(=O)C(N)=O Amb27969146 [1,1,0,0,0,0|1,0,0]=3 2697 B7R0.5 CCNC(=O)C(N)=S Amb19514543 [1,1,0,0,0,0|1,1,0]=4 2698 B7R0.5 CCNC(=O)N(C)O Amb27168229 [1,1,0,0,0,0|2,0,0]=4 2699 B7R0.5 CCNC(=O)[C@@H](C)O Amb27402988 [1,1,0,0,0,0|1,0,1]=4 2700 B7R0.5 CCNC(=O)[C@H](C)O Amb28250860 [1,1,0,0,0,0|1,0,1]=4 2701 B7R0.5 CCNC(C)C(=O)O Amb33527634 [1,1,0,0,0,0|1,0,1]=4 2702 B7R0.5 CCNC(C)C(=O)O Amb9326962 [1,1,0,0,0,0|1,0,1]=4 2703 B7R0.5 CCNC(O)C(=O)O Amb27259098 [1,1,0,0,0,0|0,0,2]=4 2704 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [1,1,0,0,0,0|1,0,1]=4 2705 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [1,1,0,0,0,0|1,0,1]=4 2706 B7R0.5 CCOC(=O)C(=O)Cl Amb932808 [1,1,0,0,0,0|1,0,0]=3 2707 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [1,1,0,0,0,0|0,0,0]=2 2708 B7R0.5 CCOC(=O)C(=O)[O-] Amb16192061 [1,1,0,0,0,0|0,0,1]=3 2709 B7R0.5 CCOC(=O)C(C)=O Amb2793051 [1,1,0,0,0,0|1,0,0]=3 2710 B7R0.5 CCOC(=O)C(C)C Amb3940129 [1,1,0,0,0,0|1,0,1]=4 2711 B7R0.5 CCOC(=O)C(C)O Amb8517047 [1,1,0,0,0,0|1,0,1]=4 2712 B7R0.5 CCOC(=O)C(N)=O Amb3886540 [1,1,0,0,0,0|1,0,0]=3 2713 B7R0.5 CCOC(=O)C(N)=S Amb17776596 [1,1,0,0,0,0|1,1,0]=4 2714 B7R0.5 CCOC(=O)C(O)O Amb25356252 [1,1,0,0,0,0|0,0,2]=4 2715 B7R0.5 CCOC(=O)[C@@H](C)O Amb17614096 [1,1,0,0,0,0|1,0,1]=4 2716 B7R0.5 CCOC(=O)[C@@H](N)O Amb27430554 [1,1,0,0,0,0|1,0,1]=4 2717 B7R0.5 CCOC(=O)[C@H](C)O Amb3939669 [1,1,0,0,0,0|1,0,1]=4 2718 B7R0.5 CCOC(=S)C(N)=O Amb10604171 [1,1,0,0,0,0|1,1,0]=4 2719 B7R0.5 CCOC(C)C(=O)O Amb9725271 [1,1,0,0,0,0|1,0,1]=4 2720 B7R0.5 CCOC(F)C(=O)O Amb27210743 [1,1,0,0,0,0|1,0,1]=4 2721 B7R0.5 CCSC(=O)C(=O)O Amb28410577 [1,1,0,0,0,0|0,0,0]=2 2722 B7R0.5 CCSC(=O)C(C)=O Amb27972957 [1,1,0,0,0,0|1,0,0]=3 2723 B7R0.5 CCSC(C)C(=O)O Amb9721554 [1,1,0,0,0,0|1,0,1]=4 2724 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [1,1,0,0,0,0|1,0,0]=3 2725 B7R0.5 CC\C=C(/C)C(C)C Amb4016284 [1,1,0,0,0,0|2,0,0]=4 2726 B7R0.5 CC\C=C(/C)C(N)=O Amb27985331 [1,1,0,0,0,0|2,0,0]=4 2727 B7R0.5 CC\C=C(/Cl)C(C)=O Amb27199134 [1,1,0,0,0,0|2,0,0]=4 2728 B7R0.5 CC\C=C(/F)C(=O)O Amb27968785 [1,1,0,0,0,0|1,0,0]=3 2729 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [1,1,0,0,0,0|1,0,0]=3 2730 B7R0.5 CC\C=C(\Cl)C(C)=O Amb27486079 [1,1,0,0,0,0|2,0,0]=4 2731 B7R0.5 CN(C)C(=O)CCO Amb10576258 [1,1,0,0,0,0|1,0,1]=4 2732 B7R0.5 CN(C)C(=O)CON Amb26515730 [1,1,0,0,0,0|1,0,1]=4 2733 B7R0.5 CN(C)C(=O)CON Amb29848024 [1,1,0,0,0,0|1,0,1]=4 2734 B7R0.5 CN(C)C(=O)N=C=O Amb28397191 [1,1,0,0,0,0|1,0,1]=4 2735 B7R0.5 CN(C)C(=O)NC=O Amb27391650 [1,1,0,0,0,0|1,0,0]=3 2736 B7R0.5 CN(C)C(=S)CC=O Amb27974853 [1,1,0,0,0,0|1,1,0]=4 2737 B7R0.5 CN(C)\C(O)=C\C=O Amb27830087 [1,1,0,0,0,0|1,0,1]=4 2738 B7R0.5 CNCC(=O)C(C)C Amb27838338 [1,1,0,0,0,0|1,0,1]=4 2739 B7R0.5 CNCC(C)C(=O)O Amb13952364 [1,1,0,0,0,0|1,0,1]=4 2740 B7R0.5 CNCC(C)C(=O)O Amb9400281 [1,1,0,0,0,0|1,0,1]=4 2741 B7R0.5 CNCC(N)C(=O)O Amb10845350 [1,1,0,0,0,0|1,0,1]=4 2742 B7R0.5 CNCC(O)C(=O)O Amb26894610 [1,1,0,0,0,0|0,0,2]=4 2743 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [1,1,0,0,0,0|1,0,1]=4 2744 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [1,1,0,0,0,0|1,0,1]=4 2745 B7R0.5 CN\N=C(/C)C(=O)O Amb27489531 [1,1,0,0,0,0|2,0,0]=4 2746 B7R0.5 COCC(=O)C(C)=O Amb24694271 [1,1,0,0,0,0|1,0,0]=3 2747 B7R0.5 COCC(=O)C(C)C Amb19375017 [1,1,0,0,0,0|0,0,1]=3 2748 B7R0.5 COCC(=O)C(C)N Amb18825587 [1,1,0,0,0,0|1,0,1]=4 2749 B7R0.5 COCC(=O)N(C)C Amb20621750 [1,1,0,0,0,0|1,0,1]=4 2750 B7R0.5 COCC(=O)[C@@H](C)N Amb30024709 [1,1,0,0,0,0|1,0,1]=4 2751 B7R0.5 COCC(=O)[C@H](C)N Amb35617901 [1,1,0,0,0,0|1,0,1]=4 2752 B7R0.5 COCC(Br)C(=O)O Amb17594709 [1,1,0,0,0,0|1,0,1]=4 2753 B7R0.5 COCC(C)C(=O)O Amb33545090 [1,1,0,0,0,0|1,0,1]=4 2754 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [1,1,0,0,0,0|1,0,1]=4 2755 B7R0.5 COCC(N)C(=O)O Amb33551350 [1,1,0,0,0,0|1,0,1]=4 2756 B7R0.5 COCC(N)C(=O)O Amb6752055 [1,1,0,0,0,0|1,0,1]=4 2757 B7R0.5 COCC(O)C(=O)O Amb18124273 [1,1,0,0,0,0|0,0,2]=4 2758 B7R0.5 COCC(S)C(=O)O Amb27763656 [1,1,0,0,0,0|0,1,1]=4 2759 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [1,1,0,0,0,0|1,0,1]=4 2760 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [1,1,0,0,0,0|1,0,1]=4 2761 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [1,1,0,0,0,0|1,0,1]=4 2762 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [1,1,0,0,0,0|1,0,1]=4 2763 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [1,1,0,0,0,0|1,0,1]=4 2764 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [1,1,0,0,0,0|1,0,1]=4 2765 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [1,1,0,0,0,0|0,0,2]=4 2766 B7R0.5 CONC(=O)C(C)Br Amb27659000 [1,1,0,0,0,0|2,0,0]=4 2767 B7R0.5 CONC(=O)C(C)Cl Amb27777111 [1,1,0,0,0,0|2,0,0]=4 2768 B7R0.5 CONC(=O)C(C)N Amb27461391 [1,1,0,0,0,0|2,0,0]=4 2769 B7R0.5 CONC(=O)[C@@H](C)N Amb27955810 [1,1,0,0,0,0|2,0,0]=4 2770 B7R0.5 CONC(=O)[C@H](C)N Amb27838965 [1,1,0,0,0,0|2,0,0]=4 2771 B7R0.5 CO\C=C(/C)C(=O)O Amb18641867 [1,1,0,0,0,0|1,0,1]=4 2772 B7R0.5 CO\C=C(/F)C(=O)O Amb28369284 [1,1,0,0,0,0|1,0,1]=4 2773 B7R0.5 CO\C=C(\F)C(=O)O Amb22641708 [1,1,0,0,0,0|1,0,1]=4 2774 B7R0.5 CO\C=C(\I)C(=O)O Amb27228187 [1,1,0,0,0,0|1,0,1]=4 2775 B7R0.5 CO\C=C(\N)C(=O)O Amb27390812 [1,1,0,0,0,0|1,0,1]=4 2776 B7R0.5 CO\N=C(/C)C(=O)O Amb28203933 [1,1,0,0,0,0|2,0,0]=4 2777 B7R0.5 CO\N=C(/N)C(C)C Amb27969367 [1,1,0,0,0,0|2,0,0]=4 2778 B7R0.5 CSCC(C)C(=O)O Amb18967825 [1,1,0,0,0,0|1,0,1]=4 2779 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [1,1,0,0,0,0|1,0,1]=4 2780 B7R0.5 CSCC(N)C(=O)O Amb33804791 [1,1,0,0,0,0|1,0,1]=4 2781 B7R0.5 CSCC(N)C(=O)O Amb6280829 [1,1,0,0,0,0|1,0,1]=4 2782 B7R0.5 CSCC(O)C(=O)O Amb25131873 [1,1,0,0,0,0|0,0,2]=4 2783 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [1,1,0,0,0,0|1,0,1]=4 2784 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [1,1,0,0,0,0|1,0,1]=4 2785 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [1,1,0,0,0,0|1,0,1]=4 2786 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [1,1,0,0,0,0|1,0,1]=4 2787 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [1,1,0,0,0,0|1,0,1]=4 2788 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [1,1,0,0,0,0|1,0,1]=4 2789 B7R0.5 C[N+](C)=C(Cl)\C=C\O Amb28065177 [1,1,0,0,0,0|2,0,0]=4 2790 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [1,1,0,0,0,0|1,0,1]=4 2791 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [1,1,0,0,0,0|1,0,1]=4 2792 B7R0.5 C\C(=C/C=O)C(C)C Amb18641697 [1,1,0,0,0,0|1,0,0]=3 2793 B7R0.5 C\C(=C/CCl)C(=O)O Amb25844891 [1,1,0,0,0,0|1,0,1]=4 2794 B7R0.5 C\C(=C/CCl)C(C)C Amb27408079 [1,1,0,0,0,0|2,0,0]=4 2795 B7R0.5 C\C(=C/CN)C(=O)O Amb25845292 [1,1,0,0,0,0|1,0,1]=4 2796 B7R0.5 C\C(=C/CN)C(C)C Amb28045473 [1,1,0,0,0,0|2,0,0]=4 2797 B7R0.5 C\C(=C/CO)C(C)C Amb25662075 [1,1,0,0,0,0|1,0,0]=3 2798 B7R0.5 C\C(=C/CO)[C@@H](C)O Amb27255232 [1,1,0,0,0,0|2,0,0]=4 2799 B7R0.5 C\C(=C/CS)C(=O)O Amb28041309 [1,1,0,0,0,0|1,0,1]=4 2800 B7R0.5 C\C(=C\C=O)C(C)C Amb27872238 [1,1,0,0,0,0|1,0,0]=3 2801 B7R0.5 C\C(=N/O[SiH3])C(C)C Amb33872464 [1,1,0,0,0,0|2,0,0]=4 2802 B7R0.5 C\C=C\C(=O)C(C)C Amb25718415 [1,1,0,0,0,0|1,0,0]=3 2803 B7R0.5 C\C=C\C(=O)N(C)C Amb28058173 [1,1,0,0,0,0|2,0,0]=4 2804 B7R0.5 C\C=N\S(=O)C(C)C Amb29861453 [1,1,0,0,0,0|2,0,0]=4 2805 B7R0.5 C\N=C\C(=O)C(C)C Amb28048921 [1,1,0,0,0,0|1,0,0]=3 2806 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [1,1,0,0,0,0|1,0,1]=4 2807 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [1,1,0,0,0,0|1,0,1]=4 2808 B7R0.5 NC(CCF)C(=O)O Amb25889337 [1,1,0,0,0,0|1,0,1]=4 2809 B7R0.5 NC(CCF)C(=O)O Amb28934889 [1,1,0,0,0,0|1,0,1]=4 2810 B7R0.5 NC(CCO)C(=O)O Amb8514287 [1,1,0,0,0,0|1,0,1]=4 2811 B7R0.5 NC(CCS)C(=O)O Amb19267093 [1,1,0,0,0,0|1,0,1]=4 2812 B7R0.5 NC(CCS)C(=O)O Amb3499433 [1,1,0,0,0,0|1,0,1]=4 2813 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [1,1,0,0,0,0|1,0,1]=4 2814 B7R0.5 NCCC(F)C(=O)O Amb10838221 [1,1,0,0,0,0|1,0,1]=4 2815 B7R0.5 NCCC(F)C(=O)O Amb22229524 [1,1,0,0,0,0|1,0,1]=4 2816 B7R0.5 NCCC(N)C(=O)O Amb2697841 [1,1,0,0,0,0|1,0,1]=4 2817 B7R0.5 NCCC(N)C(=O)O Amb8514694 [1,1,0,0,0,0|1,0,1]=4 2818 B7R0.5 NCCC(O)C(=O)O Amb16232090 [1,1,0,0,0,0|0,0,2]=4 2819 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [1,1,0,0,0,0|1,0,1]=4 2820 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [1,1,0,0,0,0|1,0,1]=4 2821 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [1,1,0,0,0,0|1,0,1]=4 2822 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [1,1,0,0,0,0|1,0,1]=4 2823 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [1,1,0,0,0,0|0,0,2]=4 2824 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [1,1,0,0,0,0|1,0,1]=4 2825 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [1,1,0,0,0,0|1,0,1]=4 2826 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [1,1,0,0,0,0|1,0,1]=4 2827 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [1,1,0,0,0,0|1,0,1]=4 2828 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [1,1,0,0,0,0|1,0,1]=4 2829 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [1,1,0,0,0,0|0,0,2]=4 2830 B7R0.5 NC\C=C(/F)C(=O)O Amb33802627 [1,1,0,0,0,0|1,0,1]=4 2831 B7R0.5 NC\C=C(\F)C(=O)O Amb28340962 [1,1,0,0,0,0|1,0,1]=4 2832 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [1,1,0,0,0,0|1,0,1]=4 2833 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [1,1,0,0,0,0|1,0,1]=4 2834 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [1,1,0,0,0,0|1,0,1]=4 2835 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [1,1,0,0,0,0|1,0,1]=4 2836 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [1,1,0,0,0,0|1,0,1]=4 2837 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [1,1,0,0,0,0|1,0,1]=4 2838 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [1,1,0,0,0,0|1,0,1]=4 2839 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [1,1,0,0,0,0|1,0,1]=4 2840 B7R0.5 O=C(O)C(=O)CCF Amb33377241 [1,1,0,0,0,0|0,0,0]=2 2841 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [1,1,0,0,0,0|0,0,0]=2 2842 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [1,1,0,0,0,0|1,0,1]=4 2843 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [1,1,0,0,0,0|1,0,1]=4 2844 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [1,1,0,0,0,0|1,0,1]=4 2845 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [1,1,0,0,0,0|0,0,2]=4 2846 B7R0.5 O=C(O)C(O)CCF Amb28071189 [1,1,0,0,0,0|0,0,2]=4 2847 B7R0.5 O=C(O)C(O)CCO Amb24689942 [1,1,0,0,0,0|0,0,2]=4 2848 B7R0.5 O=C(O)C(S)CCS Amb27634893 [1,1,0,0,0,0|0,1,1]=4 2849 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [1,1,0,0,0,0|0,0,2]=4 2850 B7R0.5 O=C(O)\C(Br)=C\CO Amb28291530 [1,1,0,0,0,0|1,0,1]=4 2851 B7R0.5 O=C(O)\C(Cl)=C\CBr Amb27875077 [1,1,0,0,0,0|1,0,1]=4 2852 B7R0.5 O=CCC(=O)C(=O)O Amb26326260 [1,1,0,0,0,0|0,0,1]=3 2853 B7R0.5 OCC\C(Br)=C(/O)Br Amb27967773 [1,1,0,0,0,0|2,0,0]=4 2854 B7R0.10 C#CC(=O)C(C)CN Amb27976940 [1,1,0,0,0,0|1,0,1]=4 2855 B7R0.10 C#CC(=O)C(C)NC Amb28342098 [1,1,0,0,0,0|1,0,1]=4 2856 B7R0.10 C#CC(=O)[C@H](C)NC Amb30039170 [1,1,0,0,0,0|1,0,1]=4 2857 B7R0.10 C=C(C=O)[C@@H](C)CC Amb27390187 [1,1,0,0,0,0|1,0,0]=3 2858 B7R0.10 C=C(CBr)C(=O)OC Amb8516917 [1,1,0,0,0,0|2,0,0]=4 2859 B7R0.10 C=C(CC)C(=O)CC Amb17593165 [1,1,0,0,0,0|2,0,0]=4 2860 B7R0.10 C=C(CC)C(=O)CO Amb27486129 [1,1,0,0,0,0|1,0,0]=3 2861 B7R0.10 C=C(CC)C(=O)NN Amb27654970 [1,1,0,0,0,0|2,0,0]=4 2862 B7R0.10 C=C(CC)C(=O)OC Amb24469857 [1,1,0,0,0,0|1,0,0]=3 2863 B7R0.10 C=C(CCl)C(=O)OC Amb19958340 [1,1,0,0,0,0|2,0,0]=4 2864 B7R0.10 C=C(CF)C(=O)OC Amb27864265 [1,1,0,0,0,0|2,0,0]=4 2865 B7R0.10 C=C(CN)C(=O)OC Amb27599562 [1,1,0,0,0,0|2,0,0]=4 2866 B7R0.10 C=C(CO)C(=O)OC Amb17933844 [1,1,0,0,0,0|2,0,0]=4 2867 B7R0.10 C=C(OC)C(=O)OC Amb28399073 [1,1,0,0,0,0|2,0,0]=4 2868 B7R0.10 C=C(SC)C(=O)OC Amb27656814 [1,1,0,0,0,0|2,0,0]=4 2869 B7R0.10 C=CC(=O)C(C)CC Amb26350444 [1,1,0,0,0,0|1,0,0]=3 2870 B7R0.10 C=CC(=O)C(C)CN Amb27251892 [1,1,0,0,0,0|1,0,0]=3 2871 B7R0.10 C=CC(=O)C(N)CC Amb27593564 [1,1,0,0,0,0|2,0,0]=4 2872 B7R0.10 C=CC(=O)N(C)CC Amb9480867 [1,1,0,0,0,0|2,0,0]=4 2873 B7R0.10 C=CC(=O)N(C)OC Amb9492353 [1,1,0,0,0,0|2,0,0]=4 2874 B7R0.10 C=CC(=O)[C@@H](N)CC Amb35601235 [1,1,0,0,0,0|2,0,0]=4 2875 B7R0.10 C=CC(=O)[C@H](C)NC Amb30039175 [1,1,0,0,0,0|1,0,0]=3 2876 B7R0.10 C=CC(=O)[C@H](N)CC Amb35594877 [1,1,0,0,0,0|2,0,0]=4 2877 B7R0.10 C=CC(=O)\C(C)=C/C Amb27434163 [1,1,0,0,0,0|1,0,1]=4 2878 B7R0.10 CC(C=O)C(C)CO Amb28048946 [1,1,0,0,0,0|1,0,1]=4 2879 B7R0.10 CC(CN)C(=O)NN Amb28422261 [1,1,0,0,0,0|2,0,0]=4 2880 B7R0.10 CC(CN)C(=O)NO Amb27756001 [1,1,0,0,0,0|1,0,0]=3 2881 B7R0.10 CC(CN)C(O)C=O Amb26370126 [1,1,0,0,0,0|0,0,2]=4 2882 B7R0.10 CC(CN)\C(N)=N\O Amb26367204 [1,1,0,0,0,0|2,0,0]=4 2883 B7R0.10 CC(CO)C(=O)NN Amb28048504 [1,1,0,0,0,0|2,0,0]=4 2884 B7R0.10 CCC(=O)C(=O)CC Amb6608779 [1,1,0,0,0,0|1,0,0]=3 2885 B7R0.10 CCC(=O)C(=O)CO Amb28316184 [1,1,0,0,0,0|0,0,0]=2 2886 B7R0.10 CCC(=O)C(=O)OC Amb17935757 [1,1,0,0,0,0|0,0,0]=2 2887 B7R0.10 CCC(=O)C(Br)C=O Amb27407783 [1,1,0,0,0,0|1,0,1]=4 2888 B7R0.10 CCC(=O)C(C)CC Amb22229845 [1,1,0,0,0,0|1,0,1]=4 2889 B7R0.10 CCC(=O)C(C)NC Amb25738187 [1,1,0,0,0,0|1,0,1]=4 2890 B7R0.10 CCC(=O)C(O)CC Amb2721046 [1,1,0,0,0,0|1,0,1]=4 2891 B7R0.10 CCC(=O)C(O)CO Amb28074689 [1,1,0,0,0,0|0,0,2]=4 2892 B7R0.10 CCC(=O)N(C)OC Amb8394947 [1,1,0,0,0,0|2,0,0]=4 2893 B7R0.10 CCC(=O)[C@H](C)CC Amb27835595 [1,1,0,0,0,0|1,0,1]=4 2894 B7R0.10 CCC(=O)[C@H](C)NC Amb30039186 [1,1,0,0,0,0|1,0,1]=4 2895 B7R0.10 CCC(=O)[C@H](C)NO Amb27880702 [1,1,0,0,0,0|1,0,1]=4 2896 B7R0.10 CCC(=O)\C(Br)=C\O Amb28316206 [1,1,0,0,0,0|1,0,0]=3 2897 B7R0.10 CCC(=O)\C(C)=C/N Amb17778143 [1,1,0,0,0,0|2,0,0]=4 2898 B7R0.10 CCC(=O)\C(C)=C\Br Amb26477160 [1,1,0,0,0,0|2,0,0]=4 2899 B7R0.10 CCC(=O)\C(C)=C\Cl Amb28291599 [1,1,0,0,0,0|2,0,0]=4 2900 B7R0.10 CCC(=O)\C(C)=C\N Amb27798686 [1,1,0,0,0,0|2,0,0]=4 2901 B7R0.10 CCC(=O)\C(C)=N/N Amb28126724 [1,1,0,0,0,0|2,0,0]=4 2902 B7R0.10 CCC(=O)\C(C)=N/O Amb10552519 [1,1,0,0,0,0|1,0,0]=3 2903 B7R0.10 CCC(=O)\C(C)=N\C Amb27260482 [1,1,0,0,0,0|2,0,0]=4 2904 B7R0.10 CCC(=O)\C(C)=N\O Amb27460236 [1,1,0,0,0,0|1,0,0]=3 2905 B7R0.10 CCC(Br)C(=O)OC Amb1157544 [1,1,0,0,0,0|1,0,1]=4 2906 B7R0.10 CCC(C)C(=O)CBr Amb24483169 [1,1,0,0,0,0|1,0,1]=4 2907 B7R0.10 CCC(C)C(=O)CCl Amb20667851 [1,1,0,0,0,0|1,0,1]=4 2908 B7R0.10 CCC(C)C(=O)CN Amb26871505 [1,1,0,0,0,0|1,0,1]=4 2909 B7R0.10 CCC(C)C(=O)CO Amb24680373 [1,1,0,0,0,0|0,0,1]=3 2910 B7R0.10 CCC(C)C(=O)NN Amb9706124 [1,1,0,0,0,0|2,0,0]=4 2911 B7R0.10 CCC(C)C(=O)NO Amb6275767 [1,1,0,0,0,0|1,0,0]=3 2912 B7R0.10 CCC(C)C(C)C=O Amb18641810 [1,1,0,0,0,0|1,0,1]=4 2913 B7R0.10 CCC(C)C(N)C=O Amb27257596 [1,1,0,0,0,0|1,0,1]=4 2914 B7R0.10 CCC(C)C(O)C=O Amb28454245 [1,1,0,0,0,0|0,0,2]=4 2915 B7R0.10 CCC(C)\C(C)=N\O Amb28124153 [1,1,0,0,0,0|2,0,0]=4 2916 B7R0.10 CCC(C)\C(Cl)=C\Cl Amb27865557 [1,1,0,0,0,0|2,0,0]=4 2917 B7R0.10 CCC(C)\C(Cl)=N\O Amb27654809 [1,1,0,0,0,0|2,0,0]=4 2918 B7R0.10 CCC(C)\C(N)=N\O Amb19516921 [1,1,0,0,0,0|2,0,0]=4 2919 B7R0.10 CCC(C)\C(N)=N\O Amb22586630 [1,1,0,0,0,0|2,0,0]=4 2920 B7R0.10 CCC(Cl)C(=O)OC Amb21618748 [1,1,0,0,0,0|1,0,1]=4 2921 B7R0.10 CCC(N)C(=O)NO Amb21922881 [1,1,0,0,0,0|1,0,1]=4 2922 B7R0.10 CCC(N)C(=O)OC Amb17601372 [1,1,0,0,0,0|1,0,1]=4 2923 B7R0.10 CCC(N)C(=O)OC Amb9271765 [1,1,0,0,0,0|1,0,1]=4 2924 B7R0.10 CCC(O)C(=O)C=O Amb24722957 [1,1,0,0,0,0|1,0,0]=3 2925 B7R0.10 CCC(O)C(=O)CO Amb28316154 [1,1,0,0,0,0|0,0,2]=4 2926 B7R0.10 CCC(O)C(=O)OC Amb4019849 [1,1,0,0,0,0|0,0,2]=4 2927 B7R0.10 CCC(S)C(=O)OC Amb26860434 [1,1,0,0,0,0|0,1,1]=4 2928 B7R0.10 CCN(C)C(=O)CO Amb9421550 [1,1,0,0,0,0|1,0,1]=4 2929 B7R0.10 CCN(C)C(=O)NO Amb32657190 [1,1,0,0,0,0|2,0,0]=4 2930 B7R0.10 CCN(N)C(=O)OC Amb33191318 [1,1,0,0,0,0|2,0,0]=4 2931 B7R0.10 CC[C@@H](Br)C(=O)OC Amb27607617 [1,1,0,0,0,0|1,0,1]=4 2932 B7R0.10 CC[C@@H](C)[C@@H](C)C=O Amb28184530 [1,1,0,0,0,0|1,0,1]=4 2933 B7R0.10 CC[C@@H](N)C(=O)NO Amb27602079 [1,1,0,0,0,0|1,0,1]=4 2934 B7R0.10 CC[C@@H](N)C(=O)OC Amb19944650 [1,1,0,0,0,0|1,0,1]=4 2935 B7R0.10 CC[C@@H](N)C(=O)OC Amb22057548 [1,1,0,0,0,0|1,0,1]=4 2936 B7R0.10 CC[C@H](C)C(=O)NC Amb27403795 [1,1,0,0,0,0|2,0,0]=4 2937 B7R0.10 CC[C@H](C)C(=O)OC Amb28145887 [1,1,0,0,0,0|1,0,1]=4 2938 B7R0.10 CC[C@H](C)[C@H](N)C=O Amb28247667 [1,1,0,0,0,0|1,0,1]=4 2939 B7R0.10 CC[C@H](N)C(=O)NO Amb27869261 [1,1,0,0,0,0|1,0,1]=4 2940 B7R0.10 CC[C@H](N)C(=O)OC Amb22167154 [1,1,0,0,0,0|1,0,1]=4 2941 B7R0.10 CC[C@H](N)C(=O)OC Amb27391053 [1,1,0,0,0,0|1,0,1]=4 2942 B7R0.10 CC[C@H](O)C(=O)CO Amb27433137 [1,1,0,0,0,0|0,0,2]=4 2943 B7R0.10 CC[C@H](O)C(=O)OC Amb26318042 [1,1,0,0,0,0|0,0,2]=4 2944 B7R0.10 CC\C(C)=C(/Br)CO Amb28188291 [1,1,0,0,0,0|2,0,0]=4 2945 B7R0.10 CC\C(C)=C(/C)C=O Amb27622928 [1,1,0,0,0,0|1,0,1]=4 2946 B7R0.10 CC\C(C)=C(/C)CO Amb25052170 [1,1,0,0,0,0|2,0,0]=4 2947 B7R0.10 CC\C(C)=C(/F)C=O Amb27948535 [1,1,0,0,0,0|1,0,1]=4 2948 B7R0.10 CC\C(Cl)=C(/C)C=O Amb27761558 [1,1,0,0,0,0|2,0,0]=4 2949 B7R0.10 CC\C(O)=C(/Br)C=O Amb28133175 [1,1,0,0,0,0|1,0,1]=4 2950 B7R0.10 CNC(=O)C(=O)NC Amb534268 [1,1,0,0,0,0|2,0,0]=4 2951 B7R0.10 CNC(=O)C(=O)OC Amb26858133 [1,1,0,0,0,0|1,0,0]=3 2952 B7R0.10 CNC(=O)C(C)CN Amb15701296 [1,1,0,0,0,0|2,0,0]=4 2953 B7R0.10 CNC(=O)C(C)CN Amb19929904 [1,1,0,0,0,0|2,0,0]=4 2954 B7R0.10 CNC(=O)C(C)NC Amb9764386 [1,1,0,0,0,0|2,0,0]=4 2955 B7R0.10 CNC(=O)C(C)SC Amb25742663 [1,1,0,0,0,0|2,0,0]=4 2956 B7R0.10 CNC(=O)C(N)=S=O Amb27253887 [1,1,0,0,0,0|2,0,0]=4 2957 B7R0.10 CNC(=O)[C@@H](C)NC Amb23385262 [1,1,0,0,0,0|2,0,0]=4 2958 B7R0.10 CNC(=O)[C@H](C)CN Amb28245424 [1,1,0,0,0,0|2,0,0]=4 2959 B7R0.10 CNC(=O)[C@H](C)NC Amb22587529 [1,1,0,0,0,0|2,0,0]=4 2960 B7R0.10 CNC(=O)[C@H](C)NC Amb23385248 [1,1,0,0,0,0|2,0,0]=4 2961 B7R0.10 CNC(=O)\C(C)=N\O Amb27839126 [1,1,0,0,0,0|2,0,0]=4 2962 B7R0.10 CNC(=O)\C(N)=N/O Amb19517087 [1,1,0,0,0,0|2,0,0]=4 2963 B7R0.10 CNC(=O)\C(N)=N\O Amb19651443 [1,1,0,0,0,0|2,0,0]=4 2964 B7R0.10 CNC(C)C(=O)CBr Amb27845352 [1,1,0,0,0,0|1,0,1]=4 2965 B7R0.10 CNC(C)C(=O)NO Amb27207236 [1,1,0,0,0,0|1,0,0]=3 2966 B7R0.10 CNC(C)C(=O)OC Amb18299580 [1,1,0,0,0,0|2,0,0]=4 2967 B7R0.10 CNC(C)C(=O)OC Amb21961535 [1,1,0,0,0,0|2,0,0]=4 2968 B7R0.10 CNC(C)\C(N)=N\O Amb27436763 [1,1,0,0,0,0|2,0,0]=4 2969 B7R0.10 CN[C@@H](C)C(=O)OC Amb22587553 [1,1,0,0,0,0|2,0,0]=4 2970 B7R0.10 CN[C@@H](C)C(=O)OC Amb22745401 [1,1,0,0,0,0|2,0,0]=4 2971 B7R0.10 CN[C@H](C)C(=O)OC Amb22587562 [1,1,0,0,0,0|2,0,0]=4 2972 B7R0.10 CN[C@H](C)C(=O)OC Amb34153346 [1,1,0,0,0,0|2,0,0]=4 2973 B7R0.10 COC(=O)C(=O)CBr Amb2455971 [1,1,0,0,0,0|1,0,0]=3 2974 B7R0.10 COC(=O)C(=O)CCl Amb25929741 [1,1,0,0,0,0|1,0,0]=3 2975 B7R0.10 COC(=O)C(=O)CF Amb27464331 [1,1,0,0,0,0|1,0,0]=3 2976 B7R0.10 COC(=O)C(=O)C[S-] Amb27397384 [1,1,0,0,0,0|1,0,0]=3 2977 B7R0.10 COC(=O)C(=O)NN Amb9753505 [1,1,0,0,0,0|2,0,0]=4 2978 B7R0.10 COC(=O)C(=O)OC Amb2793071 [1,1,0,0,0,0|1,0,0]=3 2979 B7R0.10 COC(=O)C(C)CBr Amb23440928 [1,1,0,0,0,0|2,0,0]=4 2980 B7R0.10 COC(=O)C(C)CCl Amb25890022 [1,1,0,0,0,0|2,0,0]=4 2981 B7R0.10 COC(=O)C(C)CF Amb27205725 [1,1,0,0,0,0|2,0,0]=4 2982 B7R0.10 COC(=O)C(C)CN Amb13952562 [1,1,0,0,0,0|2,0,0]=4 2983 B7R0.10 COC(=O)C(C)CN Amb9400287 [1,1,0,0,0,0|2,0,0]=4 2984 B7R0.10 COC(=O)C(C)CO Amb9277786 [1,1,0,0,0,0|2,0,0]=4 2985 B7R0.10 COC(=O)C(C)CS Amb17673607 [1,1,0,0,0,0|2,0,0]=4 2986 B7R0.10 COC(=O)C(C)SC Amb22043309 [1,1,0,0,0,0|2,0,0]=4 2987 B7R0.10 COC(=O)C(O)C=O Amb27468135 [1,1,0,0,0,0|1,0,1]=4 2988 B7R0.10 COC(=O)[C@@H](C)CBr Amb22225306 [1,1,0,0,0,0|2,0,0]=4 2989 B7R0.10 COC(=O)[C@@H](C)CI Amb23437667 [1,1,0,0,0,0|2,0,0]=4 2990 B7R0.10 COC(=O)[C@@H](C)CN Amb27391189 [1,1,0,0,0,0|2,0,0]=4 2991 B7R0.10 COC(=O)[C@@H](C)CN Amb35788514 [1,1,0,0,0,0|2,0,0]=4 2992 B7R0.10 COC(=O)[C@@H](C)CO Amb17615445 [1,1,0,0,0,0|2,0,0]=4 2993 B7R0.10 COC(=O)[C@@H](C)OC Amb27218042 [1,1,0,0,0,0|2,0,0]=4 2994 B7R0.10 COC(=O)[C@H](C)CBr Amb10844721 [1,1,0,0,0,0|2,0,0]=4 2995 B7R0.10 COC(=O)[C@H](C)CO Amb17615446 [1,1,0,0,0,0|2,0,0]=4 2996 B7R0.10 COC(=O)[C@H](C)OC Amb28316057 [1,1,0,0,0,0|2,0,0]=4 2997 B7R0.10 COC(=O)\C(C)=N/O Amb25889365 [1,1,0,0,0,0|2,0,0]=4 2998 B7R0.10 COC(=O)\C(C)=N\O Amb28053741 [1,1,0,0,0,0|2,0,0]=4 2999 B7R0.10 COC(=O)\C(Cl)=N/O Amb24665681 [1,1,0,0,0,0|2,0,0]=4 3000 B7R0.10 COC(=O)\C(Cl)=N\O Amb22741121 [1,1,0,0,0,0|2,0,0]=4 3001 B7R0.10 COC(=O)\C(N)=N\O Amb22741276 [1,1,0,0,0,0|2,0,0]=4 3002 B7R0.10 COC(C)C(=O)C=O Amb27622168 [1,1,0,0,0,0|0,0,0]=2 3003 B7R0.10 COC(C)C(=O)NN Amb2081552 [1,1,0,0,0,0|2,0,0]=4 3004 B7R0.10 COC(C)C(Br)C=O Amb28119865 [1,1,0,0,0,0|1,0,1]=4 3005 B7R0.10 COC(C)\C(Cl)=N\O Amb28436190 [1,1,0,0,0,0|2,0,0]=4 3006 B7R0.10 COC(C)\C(N)=N\O Amb19650787 [1,1,0,0,0,0|2,0,0]=4 3007 B7R0.10 CON(C)C(=O)C=O Amb28325250 [1,1,0,0,0,0|1,0,0]=3 3008 B7R0.10 CSC(=O)C(=O)CF Amb27861416 [1,1,0,0,0,0|1,1,0]=4 3009 B7R0.10 CSC(C)C(=O)NN Amb28204526 [1,1,0,0,0,0|2,0,0]=4 3010 B7R0.10 CSC(C)\C(C)=N\O Amb2781500 [1,1,0,0,0,0|2,0,0]=4 3011 B7R0.10 C\C(=C/O)C(O)CO Amb27441465 [1,1,0,0,0,0|2,0,0]=4 3012 B7R0.10 C\C(=N\O)C(=O)CCl Amb27256425 [1,1,0,0,0,0|2,0,0]=4 3013 B7R0.10 C\C(=N\O)C(=O)CO Amb28249683 [1,1,0,0,0,0|2,0,0]=4 3014 B7R0.10 C\C=C(/Br)C(=O)OC Amb24618775 [1,1,0,0,0,0|1,0,1]=4 3015 B7R0.10 C\C=C(/C)C(=O)CC Amb28066002 [1,1,0,0,0,0|2,0,0]=4 3016 B7R0.10 C\C=C(/C)C(=O)OC Amb6296120 [1,1,0,0,0,0|1,0,1]=4 3017 B7R0.10 C\C=C(/C)C(C)CC Amb25989296 [1,1,0,0,0,0|2,0,0]=4 3018 B7R0.10 C\C=C(/N)C(=O)OC Amb27438851 [1,1,0,0,0,0|1,0,1]=4 3019 B7R0.10 C\C=C(\C)C(=O)OC Amb19930194 [1,1,0,0,0,0|1,0,1]=4 3020 B7R0.10 NC(CCl)C(=O)NO Amb6740291 [1,1,0,0,0,0|2,0,0]=4 3021 B7R0.10 NC(CO)C(=O)NO Amb22352399 [1,1,0,0,0,0|2,0,0]=4 3022 B7R0.10 NNC(=O)C(=O)NO Amb27769052 [1,1,0,0,0,0|2,0,0]=4 3023 B7R0.10 N[C@@H](CCl)C(=O)NO Amb22747830 [1,1,0,0,0,0|2,0,0]=4 3024 B7R0.10 N[C@@H](CO)C(=O)NO Amb28203960 [1,1,0,0,0,0|2,0,0]=4 3025 B7R0.10 N[C@H](CCl)C(=O)NO Amb28040834 [1,1,0,0,0,0|2,0,0]=4 3026 B7R0.10 O=C(CBr)C(=O)CBr Amb4057539 [1,1,0,0,0,0|2,0,0]=4 3027 B7R0.10 O=C(CBr)\C(Cl)=N\O Amb28247995 [1,1,0,0,0,0|2,0,0]=4 3028 B7R0.10 O=C(CCl)C(=O)CBr Amb17506259 [1,1,0,0,0,0|2,0,0]=4 3029 B7R0.10 O=C(CO)C(=O)CO Amb28049023 [1,1,0,0,0,0|1,0,0]=3 3030 B7R0.10 O=C(CO)C(O)CO Amb27955920 [1,1,0,0,0,0|1,0,1]=4 3031 B7R0.10 O=C(CO)[C@H](O)CO Amb24628483 [1,1,0,0,0,0|1,0,1]=4 3032 B7R0.10 O=CC(=O)C(Br)C=O Amb28285097 [1,1,0,0,0,0|1,0,1]=4 3033 B7R0.10 O=CC(=O)[C@@H](O)CO Amb28247115 [1,1,0,0,0,0|1,0,0]=3 3034 B7R0.10 O=CC(=O)[C@H](O)CO Amb27210862 [1,1,0,0,0,0|1,0,0]=3 3035 B7R0.13 C=CS(=O)(=O)C(C)C Amb27236160 [1,1,0,0,0,0|2,0,0]=4 3036 B7R0.13 CC(C)C(C)(C)C=O Amb18641812 [1,1,0,0,0,0|1,0,1]=4 3037 B7R0.13 CC(C)S(=N)(=O)NO Amb35711043 [1,1,0,0,0,0|2,0,0]=4 3038 B7R0.13 CC(C)S(=O)(=O)NO Amb26647421 [1,1,0,0,0,0|2,0,0]=4 3039 B7R0.13 CCC(C)(Br)C(=O)O Amb22228657 [1,1,0,0,0,0|1,0,1]=4 3040 B7R0.13 CCC(C)(C)C(=O)O Amb4605833 [1,1,0,0,0,0|1,0,1]=4 3041 B7R0.13 CCC(C)(Cl)C(=O)O Amb25730682 [1,1,0,0,0,0|1,0,1]=4 3042 B7R0.13 CCC(C)(N)C(=O)O Amb28934789 [1,1,0,0,0,0|1,0,1]=4 3043 B7R0.13 CCC(C)(N)C(=O)O Amb9728371 [1,1,0,0,0,0|1,0,1]=4 3044 B7R0.13 CCC(C)(O)C(=O)O Amb2609046 [1,1,0,0,0,0|0,0,2]=4 3045 B7R0.13 CCC(Cl)(Cl)C(=O)O Amb25274946 [1,1,0,0,0,0|1,0,1]=4 3046 B7R0.13 CCC(F)(F)C(=O)O Amb10982488 [1,1,0,0,0,0|1,0,1]=4 3047 B7R0.13 CCC(N)(S)C(=O)O Amb27229859 [1,1,0,0,0,0|0,1,1]=4 3048 B7R0.13 CCC(O)(O)C(=O)O Amb28428544 [1,1,0,0,0,0|0,0,2]=4 3049 B7R0.13 CC[C@@](C)(Cl)C(=O)O Amb27391076 [1,1,0,0,0,0|1,0,1]=4 3050 B7R0.13 CC[C@@](C)(N)C(=O)O Amb8515205 [1,1,0,0,0,0|1,0,1]=4 3051 B7R0.13 CC[C@](C)(N)C(=O)O Amb16183896 [1,1,0,0,0,0|1,0,1]=4 3052 B7R0.13 CC[C@](C)(N)C(=O)O Amb33871585 [1,1,0,0,0,0|1,0,1]=4 3053 B7R0.13 CC[C@](N)(O)C(=O)O Amb28398612 [1,1,0,0,0,0|0,0,2]=4 3054 B7R0.14 C#CC(=O)C(C)(C)C Amb26369689 [1,1,0,0,0,0|1,0,1]=4 3055 B7R0.14 C#CC(=O)C(C)(C)N Amb28316034 [1,1,0,0,0,0|1,0,1]=4 3056 B7R0.14 C#CC(=O)C(C)(C)O Amb28315571 [1,1,0,0,0,0|1,0,1]=4 3057 B7R0.14 C=C(C=O)C(C)(C)C Amb8392632 [1,1,0,0,0,0|1,0,0]=3 3058 B7R0.14 C=C(CO)C(C)(C)C Amb27436466 [1,1,0,0,0,0|1,0,1]=4 3059 B7R0.14 C=C(CO)C(C)(C)O Amb28280874 [1,1,0,0,0,0|1,0,1]=4 3060 B7R0.14 C=CC(=O)C(C)(C)C Amb19305627 [1,1,0,0,0,0|1,0,0]=3 3061 B7R0.14 C=CC(=O)C(C)(C)F Amb26341215 [1,1,0,0,0,0|1,0,0]=3 3062 B7R0.14 C=CC(=O)C(C)(C)N Amb28313965 [1,1,0,0,0,0|1,0,0]=3 3063 B7R0.14 C=CC(=O)C(C)(F)F Amb25790807 [1,1,0,0,0,0|2,0,0]=4 3064 B7R0.14 CC(C)(Br)C(=O)CBr Amb20623384 [1,1,0,0,0,0|1,0,1]=4 3065 B7R0.14 CC(C)(C)C(=N)NO Amb22731673 [1,1,0,0,0,0|2,0,0]=4 3066 B7R0.14 CC(C)(C)C(=N)NO Amb33715895 [1,1,0,0,0,0|2,0,0]=4 3067 B7R0.14 CC(C)(C)C(=O)C#N Amb17231811 [1,1,0,0,0,0|1,0,1]=4 3068 B7R0.14 CC(C)(C)C(=O)C=O Amb17778336 [1,1,0,0,0,0|0,0,0]=2 3069 B7R0.14 CC(C)(C)C(=O)CBr Amb2720507 [1,1,0,0,0,0|1,0,1]=4 3070 B7R0.14 CC(C)(C)C(=O)CCl Amb2720558 [1,1,0,0,0,0|1,0,1]=4 3071 B7R0.14 CC(C)(C)C(=O)CN Amb2684398 [1,1,0,0,0,0|1,0,1]=4 3072 B7R0.14 CC(C)(C)C(=O)CN Amb2786558 [1,1,0,0,0,0|1,0,1]=4 3073 B7R0.14 CC(C)(C)C(=O)CO Amb10574779 [1,1,0,0,0,0|0,0,1]=3 3074 B7R0.14 CC(C)(C)C(=O)CS Amb20623549 [1,1,0,0,0,0|0,1,1]=4 3075 B7R0.14 CC(C)(C)C(=O)NN Amb1141426 [1,1,0,0,0,0|2,0,0]=4 3076 B7R0.14 CC(C)(C)C(=O)NO Amb2411633 [1,1,0,0,0,0|1,0,0]=3 3077 B7R0.14 CC(C)(C)C(=O)O[K] Amb3150187 [1,1,0,0,0,0|2,0,0]=4 3078 B7R0.14 CC(C)(C)C(Br)C=O Amb18127551 [1,1,0,0,0,0|1,0,1]=4 3079 B7R0.14 CC(C)(C)C(Cl)C=O Amb17593424 [1,1,0,0,0,0|1,0,1]=4 3080 B7R0.14 CC(C)(C)C(N)=S=O Amb27838844 [1,1,0,0,0,0|2,0,0]=4 3081 B7R0.14 CC(C)(C)[C@@H](Cl)C=O Amb27398016 [1,1,0,0,0,0|1,0,1]=4 3082 B7R0.14 CC(C)(C)[C@@H](F)C=O Amb28054345 [1,1,0,0,0,0|1,0,1]=4 3083 B7R0.14 CC(C)(C)[C@@H](O)C=O Amb28351621 [1,1,0,0,0,0|0,0,2]=4 3084 B7R0.14 CC(C)(C)[C@H](Cl)C=O Amb28046166 [1,1,0,0,0,0|1,0,1]=4 3085 B7R0.14 CC(C)(C)\C(Br)=C/Br Amb26533053 [1,1,0,0,0,0|2,0,0]=4 3086 B7R0.14 CC(C)(C)\C(Br)=C\Br Amb25890042 [1,1,0,0,0,0|2,0,0]=4 3087 B7R0.14 CC(C)(C)\C(Cl)=C\Cl Amb27847861 [1,1,0,0,0,0|2,0,0]=4 3088 B7R0.14 CC(C)(C)\C(Cl)=N\O Amb27809855 [1,1,0,0,0,0|2,0,0]=4 3089 B7R0.14 CC(C)(C)\C(N)=N\O Amb1124539 [1,1,0,0,0,0|2,0,0]=4 3090 B7R0.14 CC(C)(C)\C(N)=N\O Amb33718587 [1,1,0,0,0,0|2,0,0]=4 3091 B7R0.14 CC(C)(Cl)C(=O)CCl Amb21962601 [1,1,0,0,0,0|1,0,1]=4 3092 B7R0.14 CC(C)(F)C(=O)CCl Amb26624939 [1,1,0,0,0,0|1,0,1]=4 3093 B7R0.14 CC(C)(F)C(=O)CN Amb33273022 [1,1,0,0,0,0|1,0,1]=4 3094 B7R0.14 CC(C)(F)C(=O)NN Amb27837593 [1,1,0,0,0,0|2,0,0]=4 3095 B7R0.14 CC(C)(F)\C(N)=N\O Amb26439748 [1,1,0,0,0,0|2,0,0]=4 3096 B7R0.14 CC(C)(N)C(=O)CBr Amb27198364 [1,1,0,0,0,0|1,0,1]=4 3097 B7R0.14 CC(C)(N)C(=O)NO Amb22059374 [1,1,0,0,0,0|1,0,0]=3 3098 B7R0.14 CC(C)(N)C(=O)NO Amb32708496 [1,1,0,0,0,0|1,0,0]=3 3099 B7R0.14 CC(C)(N)\C(N)=N\O Amb25057112 [1,1,0,0,0,0|2,0,0]=4 3100 B7R0.14 CC(C)(O)C(=N)NO Amb22735886 [1,1,0,0,0,0|2,0,0]=4 3101 B7R0.14 CC(C)(O)C(=O)CBr Amb26548372 [1,1,0,0,0,0|1,0,1]=4 3102 B7R0.14 CC(C)(O)C(=O)CN Amb26413840 [1,1,0,0,0,0|1,0,1]=4 3103 B7R0.14 CC(C)(O)C(=O)CN Amb32676677 [1,1,0,0,0,0|1,0,1]=4 3104 B7R0.14 CC(C)(O)C(=O)NN Amb2154720 [1,1,0,0,0,0|2,0,0]=4 3105 B7R0.14 CC(C)(O)\C(Cl)=C/Cl Amb27863547 [1,1,0,0,0,0|2,0,0]=4 3106 B7R0.14 CC(C=O)C(C)(C)C Amb10558535 [1,1,0,0,0,0|1,0,1]=4 3107 B7R0.14 CC(C=O)C(C)(C)F Amb24694360 [1,1,0,0,0,0|1,0,1]=4 3108 B7R0.14 CC(C=O)C(C)(C)O Amb28255749 [1,1,0,0,0,0|1,0,1]=4 3109 B7R0.14 CC(Cl)(Cl)C(=O)NO Amb27829599 [1,1,0,0,0,0|2,0,0]=4 3110 B7R0.14 CCC(=O)C(C)(C)C Amb33539697 [1,1,0,0,0,0|1,0,1]=4 3111 B7R0.14 CCC(=O)C(C)(C)N Amb18833010 [1,1,0,0,0,0|1,0,1]=4 3112 B7R0.14 CCC(=O)C(C)(O)O Amb28324138 [1,1,0,0,0,0|0,0,2]=4 3113 B7R0.14 CNC(=O)C(C)(C)Br Amb10071168 [1,1,0,0,0,0|2,0,0]=4 3114 B7R0.14 CNC(=O)C(C)(C)F Amb28049313 [1,1,0,0,0,0|2,0,0]=4 3115 B7R0.14 CNC(=O)C(C)(C)N Amb10608298 [1,1,0,0,0,0|2,0,0]=4 3116 B7R0.14 CNC(=O)C(C)(C)N Amb21956111 [1,1,0,0,0,0|2,0,0]=4 3117 B7R0.14 CNC(=O)C(C)(C)O Amb28127514 [1,1,0,0,0,0|2,0,0]=4 3118 B7R0.14 COC(=O)C(C)(C)Br Amb4013015 [1,1,0,0,0,0|2,0,0]=4 3119 B7R0.14 COC(=O)C(C)(C)C Amb2689798 [1,1,0,0,0,0|2,0,0]=4 3120 B7R0.14 COC(=O)C(C)(C)Cl Amb25110685 [1,1,0,0,0,0|2,0,0]=4 3121 B7R0.14 COC(=O)C(C)(C)F Amb10839378 [1,1,0,0,0,0|2,0,0]=4 3122 B7R0.14 COC(=O)C(C)(C)I Amb28049010 [1,1,0,0,0,0|2,0,0]=4 3123 B7R0.14 COC(=O)C(C)(C)N Amb16183987 [1,1,0,0,0,0|2,0,0]=4 3124 B7R0.14 COC(=O)C(C)(C)N Amb6892728 [1,1,0,0,0,0|2,0,0]=4 3125 B7R0.14 COC(=O)C(C)(C)O Amb8388083 [1,1,0,0,0,0|2,0,0]=4 3126 B7R0.14 COC(=O)C(C)(C)S Amb17617596 [1,1,0,0,0,0|2,0,0]=4 3127 B7R0.14 COC(=O)P(=O)(O)O Amb22388745 [1,1,0,0,0,0|2,0,0]=4 3128 B7R0.14 C\C(=C/I)C(C)(C)N Amb27762409 [1,1,0,0,0,0|2,0,0]=4 3129 B7R0.14 C\C(=C\Cl)C(C)(C)C Amb30621743 [1,1,0,0,0,0|2,0,0]=4 3130 B7R0.14 C\C(=N/O)C(C)(C)C Amb6335783 [1,1,0,0,0,0|2,0,0]=4 3131 B7R0.14 C\C(=N/O)C(C)(C)O Amb28423961 [1,1,0,0,0,0|2,0,0]=4 3132 B7R0.14 C\C(=N\O)C(C)(C)O Amb28127607 [1,1,0,0,0,0|2,0,0]=4 3133 B7R0.14 C\C=C(/C)C(C)(C)C Amb4019537 [1,1,0,0,0,0|2,0,0]=4 3134 B7R0.14 C\C=C(\C)C(C)(C)C Amb22734766 [1,1,0,0,0,0|2,0,0]=4 3135 B7R0.14 O=C(CCl)P(=O)(O)O Amb27196109 [1,1,0,0,0,0|2,0,0]=4 3136 B7R0.14 O=CC(=O)C(F)(F)F Amb33546821 [1,1,0,0,0,0|2,0,0]=4 3137 B7R0.15 C=CC(CC)C(=O)O Amb28119400 [1,1,0,0,0,0|1,0,1]=4 3138 B7R0.15 CC(C)=C(C=O)C=O Amb27255684 [1,1,0,0,0,0|0,0,1]=3 3139 B7R0.15 CC(C)C(C#N)C=O Amb26316466 [1,1,0,0,0,0|1,0,1]=4 3140 B7R0.15 CC(C)N(C=O)CO Amb27589720 [1,1,0,0,0,0|1,0,1]=4 3141 B7R0.15 CC(C)\C(C#N)=C/Br Amb33482584 [1,1,0,0,0,0|2,0,0]=4 3142 B7R0.15 CC(C)\C(C=N)=C\O Amb27826311 [1,1,0,0,0,0|1,0,0]=3 3143 B7R0.15 CC(C)\C(C=O)=C/Cl Amb27864128 [1,1,0,0,0,0|1,0,0]=3 3144 B7R0.15 CC(C)\C(C=O)=C\N Amb25338102 [1,1,0,0,0,0|1,0,0]=3 3145 B7R0.15 CC(Cl)\C(C=O)=N\O Amb27875998 [1,1,0,0,0,0|1,0,1]=4 3146 B7R0.15 CCC(=C=O)C(=O)Cl Amb27668810 [1,1,0,0,0,0|1,0,0]=3 3147 B7R0.15 CCC(C#N)C(=O)O Amb17210513 [1,1,0,0,0,0|1,0,1]=4 3148 B7R0.15 CCC(C=O)=S(C)C Amb28239512 [1,1,0,0,0,0|2,0,0]=4 3149 B7R0.15 CCC(C=O)C(=O)O Amb28410235 [1,1,0,0,0,0|0,0,1]=3 3150 B7R0.15 CCC(CC)C(=O)O Amb4605826 [1,1,0,0,0,0|1,0,1]=4 3151 B7R0.15 CCC(CCl)C(=O)O Amb27424156 [1,1,0,0,0,0|1,0,1]=4 3152 B7R0.15 CCC(CF)C(=O)O Amb27625346 [1,1,0,0,0,0|1,0,1]=4 3153 B7R0.15 CCC(CN)C(=O)O Amb18987934 [1,1,0,0,0,0|1,0,1]=4 3154 B7R0.15 CCC(CN)C(=O)O Amb19514932 [1,1,0,0,0,0|1,0,1]=4 3155 B7R0.15 CCC(CO)C(=O)O Amb18641947 [1,1,0,0,0,0|0,0,2]=4 3156 B7R0.15 CCC(NC)C(=O)O Amb10610245 [1,1,0,0,0,0|1,0,1]=4 3157 B7R0.15 CCC(NC)C(=O)O Amb9619833 [1,1,0,0,0,0|1,0,1]=4 3158 B7R0.15 CCC(NCl)C(=O)O Amb28387574 [1,1,0,0,0,0|1,0,1]=4 3159 B7R0.15 CCC(NN)C(=O)O Amb18641955 [1,1,0,0,0,0|1,0,1]=4 3160 B7R0.15 CCC(NO)C(=O)O Amb4019788 [1,1,0,0,0,0|0,0,2]=4 3161 B7R0.15 CCC(OC)C(=O)O Amb8472685 [1,1,0,0,0,0|0,0,2]=4 3162 B7R0.15 CCC(SC)C(=O)O Amb17501348 [1,1,0,0,0,0|0,1,1]=4 3163 B7R0.15 CCN(N=O)C(N)=O Amb17618582 [1,1,0,0,0,0|2,0,0]=4 3164 B7R0.15 CC[C@@H](CN)C(=O)O Amb27838297 [1,1,0,0,0,0|1,0,1]=4 3165 B7R0.15 CC[C@@H](CO)C(=O)O Amb22745321 [1,1,0,0,0,0|0,0,2]=4 3166 B7R0.15 CC[C@@H](NC)C(=O)O Amb28315876 [1,1,0,0,0,0|1,0,1]=4 3167 B7R0.15 CC[C@H](CN)C(=O)O Amb25790771 [1,1,0,0,0,0|1,0,1]=4 3168 B7R0.15 CC[C@H](CO)C(=O)O Amb16232065 [1,1,0,0,0,0|0,0,2]=4 3169 B7R0.15 CC[C@H](NC)C(=O)O Amb24505225 [1,1,0,0,0,0|1,0,1]=4 3170 B7R0.15 CC[C@H](NCl)C(=O)O Amb28193501 [1,1,0,0,0,0|1,0,1]=4 3171 B7R0.15 CC[C@H](NN)C(=O)O Amb28289412 [1,1,0,0,0,0|1,0,1]=4 3172 B7R0.15 CC\C(=N/O)C(N)=O Amb27814540 [1,1,0,0,0,0|1,0,1]=4 3173 B7R0.15 CC\C(=N\O)C(C)=O Amb28198610 [1,1,0,0,0,0|1,0,1]=4 3174 B7R0.15 CC\C(C=O)=C(/C)Cl Amb27598544 [1,1,0,0,0,0|2,0,0]=4 3175 B7R0.15 CN(C)\C(C=O)=C/O Amb27441097 [1,1,0,0,0,0|1,0,0]=3 3176 B7R0.15 CN(C)\C(C=O)=C\O Amb27782411 [1,1,0,0,0,0|1,0,0]=3 3177 B7R0.15 CNC(C=O)C(C)C Amb18641852 [1,1,0,0,0,0|1,0,1]=4 3178 B7R0.15 COC(C=O)C(C)C Amb18641891 [1,1,0,0,0,0|0,0,2]=4 3179 B7R0.15 CS(C)=C(C=O)C=O Amb27789601 [1,1,0,0,0,0|1,0,0]=3 3180 B7R0.15 CSC(C=O)C(=O)O Amb27399075 [1,1,0,0,0,0|1,0,1]=4 3181 B7R0.15 CSC(C=O)C(C)C Amb18641605 [1,1,0,0,0,0|0,1,1]=4 3182 B7R0.15 C\C(O)=C(/C=O)CBr Amb27215400 [1,1,0,0,0,0|2,0,0]=4 3183 B7R0.15 C\C=C(/C#N)C(=O)O Amb27204254 [1,1,0,0,0,0|1,0,1]=4 3184 B7R0.15 C\C=C(/CBr)C(=O)O Amb18128301 [1,1,0,0,0,0|1,0,1]=4 3185 B7R0.15 C\C=C(/CC)C(=O)O Amb18641780 [1,1,0,0,0,0|1,0,0]=3 3186 B7R0.15 C\C=C(/CC)C(C)=O Amb27243013 [1,1,0,0,0,0|2,0,0]=4 3187 B7R0.15 C\C=C(/CC)C(C)C Amb24581918 [1,1,0,0,0,0|2,0,0]=4 3188 B7R0.15 C\C=C(\CO)C(=O)O Amb25306747 [1,1,0,0,0,0|0,0,2]=4 3189 B7R0.15 C\N=C(/NC)C(=O)O Amb28349086 [1,1,0,0,0,0|2,0,0]=4 3190 B9R0.10 C=C(C)CC(=O)C(C)(C)C Amb27879616 [0,1,0,0,0,1|2,0,0]=4 3191 B9R0.10 C=C(C)CC(=O)C(C)(C)F Amb27777688 [0,1,0,0,0,1|2,0,0]=4 3192 B9R0.10 CC(=O)CC(=O)C(C)(C)C Amb7764664 [0,1,0,0,0,1|1,0,0]=3 3193 B9R0.10 CC(=O)CC(=O)C(C)(F)F Amb24481121 [0,1,0,0,0,1|2,0,0]=4 3194 B9R0.10 CC(=O)CS(=O)C(C)(C)C Amb4166041 [0,1,0,0,0,1|2,0,0]=4 3195 B9R0.10 CC(=O)NC(=O)C(C)(C)Br Amb28041264 [0,1,0,0,0,1|1,0,0]=3 3196 B9R0.10 CC(=O)NC(=O)C(C)(C)C Amb27194404 [0,1,0,0,0,1|1,0,0]=3 3197 B9R0.10 CC(=O)\C=C(/C)C(C)(C)C Amb21948345 [0,1,0,0,0,1|2,0,0]=4 3198 B9R0.10 CC(=O)\C=C(\N)C(C)(C)O Amb27788212 [0,1,0,0,0,1|2,0,0]=4 3199 B9R0.10 CC(C)(Br)C(=O)NC(N)=O Amb27268423 [0,1,0,0,0,1|1,0,0]=3 3200 B9R0.10 CC(C)(C)C(=O)CC(=O)[Na] Amb27762570 [0,1,0,0,0,1|1,0,0]=3 3201 B9R0.10 CC(C)(C)C(=O)CC(N)=O Amb28240438 [0,1,0,0,0,1|1,0,0]=3 3202 B9R0.10 CC(C)(C)C(=O)C[N+](=O)[O-] Amb27956382 [0,1,0,0,0,1|1,0,1]=4 3203 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb31307616 [0,1,0,0,0,1|1,0,1]=4 3204 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb8515866 [0,1,0,0,0,1|1,0,1]=4 3205 B9R0.10 CC(C)(C)C(O)CC(=O)O Amb17232006 [0,1,0,0,0,1|0,0,2]=4 3206 B9R0.10 CC(C)(C)S(=O)CC(=O)O Amb18974534 [0,1,0,0,0,1|1,0,0]=3 3207 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb19888358 [0,1,0,0,0,1|1,0,1]=4 3208 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb33456414 [0,1,0,0,0,1|1,0,1]=4 3209 B9R0.10 CC(C)(C)[C@@H](O)CC(=O)O Amb24505172 [0,1,0,0,0,1|0,0,2]=4 3210 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O Amb33456294 [0,1,0,0,0,1|1,0,1]=4 3211 B9R0.10 CC(C)(C)[C@H](O)CC(=O)O Amb25889023 [0,1,0,0,0,1|0,0,2]=4 3212 B9R0.10 CC(C)(C)\C(N)=C\C(=O)O Amb28313951 [0,1,0,0,0,1|1,0,0]=3 3213 B9R0.10 CC(C)(C)\C(O)=C\C(N)=O Amb28456576 [0,1,0,0,0,1|1,0,1]=4 3214 B9R0.10 CC(C)(F)C(N)CC(=O)O Amb33273018 [0,1,0,0,0,1|1,0,1]=4 3215 B9R0.10 CC(C)(F)C(O)CC(=O)O Amb33272209 [0,1,0,0,0,1|0,0,2]=4 3216 B9R0.10 CC(C)(F)[C@@H](O)CC(=O)O Amb33272208 [0,1,0,0,0,1|0,0,2]=4 3217 B9R0.10 CC(C)(F)[C@H](O)CC(=O)O Amb33225482 [0,1,0,0,0,1|0,0,2]=4 3218 B9R0.10 CC(C)(N)C(=O)NC(N)=O Amb27945636 [0,1,0,0,0,1|1,0,0]=3 3219 B9R0.10 CC(C)(S)C(N)CC(=O)O Amb28182470 [0,1,0,0,0,1|1,0,1]=4 3220 B9R0.10 CC(C)=CC(=O)C(C)(C)N Amb27391414 [0,1,0,0,0,1|2,0,0]=4 3221 B9R0.10 CC(C)NC(=O)C(C)(C)O Amb27436596 [0,1,0,0,0,1|1,0,1]=4 3222 B9R0.10 CC(C)OC(=O)C(C)(C)O Amb24482982 [0,1,0,0,0,1|1,0,1]=4 3223 B9R0.10 CC(CC(=O)O)C(C)(C)C Amb6749223 [0,1,0,0,0,1|1,0,1]=4 3224 B9R0.10 CC(CC(=O)O)C(C)(C)F Amb27633286 [0,1,0,0,0,1|1,0,1]=4 3225 B9R0.10 CC(CC(=O)O)C(C)(C)N Amb19651352 [0,1,0,0,0,1|1,0,1]=4 3226 B9R0.10 CC(CC(=O)O)C(C)(C)O Amb27815005 [0,1,0,0,0,1|1,0,1]=4 3227 B9R0.10 CN(CC(=O)O)C(C)(C)C Amb17334246 [0,1,0,0,0,1|2,0,0]=4 3228 B9R0.10 CS(=O)CC(=O)C(C)(C)C Amb25972077 [0,1,0,0,0,1|2,0,0]=4 3229 B9R0.10 C[C@@H](CC(=O)O)C(C)(C)C Amb28050110 [0,1,0,0,0,1|1,0,1]=4 3230 B9R0.10 C[C@H](O)CC(=O)C(C)(C)C Amb27222638 [0,1,0,0,0,1|1,0,1]=4 3231 B9R0.10 C[Si](C)(C)\C(Cl)=C\C(=O)O Amb27657462 [0,1,0,0,0,1|1,1,0]=4 3232 B9R0.10 C\C(=C/C(=O)O)C(C)(C)C Amb6749108 [0,1,0,0,0,1|1,0,0]=3 3233 B9R0.10 C\C(=C/C(N)=O)C(C)(C)C Amb28429721 [0,1,0,0,0,1|2,0,0]=4 3234 B9R0.10 C\C(=C\C(=O)O)C(C)(C)C Amb28314071 [0,1,0,0,0,1|1,0,0]=3 3235 B9R0.10 C\C(N)=C/C(=O)C(C)(C)C Amb28131576 [0,1,0,0,0,1|2,0,0]=4 3236 B9R0.10 O=C(O)CC(=O)C(F)(F)F Amb8394977 [0,1,0,0,0,1|2,0,0]=4 3237 B9R0.11 CC(=O)NS(=O)(=O)C(C)C Amb27956395 [0,1,0,0,0,1|2,0,0]=4 3238 B9R0.11 CC(C)C(C)(C)CC(=O)O Amb18124695 [0,1,0,0,0,1|1,0,1]=4 3239 B9R0.11 CC(C)C(C)(N)CC(=O)O Amb25934755 [0,1,0,0,0,1|1,0,1]=4 3240 B9R0.11 CC(C)C(C)(O)CC(=O)O Amb18991699 [0,1,0,0,0,1|0,0,2]=4 3241 B9R0.11 CC(C)C(F)(F)CC(=O)O Amb26991653 [0,1,0,0,0,1|1,0,1]=4 3242 B9R0.11 CC(C)CC(C)(C)C(=O)O Amb10843993 [0,1,0,0,0,1|1,0,1]=4 3243 B9R0.11 CC(C)CC(C)(F)C(=O)O Amb25997944 [0,1,0,0,0,1|1,0,1]=4 3244 B9R0.11 CC(C)CC(C)(N)C(=O)O Amb4134832 [0,1,0,0,0,1|1,0,1]=4 3245 B9R0.11 CC(C)CC(C)(O)C(=O)O Amb18523766 [0,1,0,0,0,1|0,0,2]=4 3246 B9R0.11 CC(C)CC(F)(F)C(=O)O Amb25773701 [0,1,0,0,0,1|1,0,1]=4 3247 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O Amb8630501 [0,1,0,0,0,1|1,0,1]=4 3248 B9R0.11 CC(C)C[C@](C)(N)C(=O)O Amb10066904 [0,1,0,0,0,1|1,0,1]=4 3249 B9R0.11 CC(C)NC(C)(C)C(=O)O Amb3978636 [0,1,0,0,0,1|1,0,1]=4 3250 B9R0.11 CC(C)OC(C)(C)C(=O)O Amb18976739 [0,1,0,0,0,1|1,0,1]=4 3251 B9R0.11 CC(C)OP(=O)(O)C(N)=O Amb28325677 [0,1,0,0,0,1|2,0,0]=4 3252 B9R0.11 CC(C)S(=N)(=O)NC(N)=O Amb35711045 [0,1,0,0,0,1|2,0,0]=4 3253 B9R0.11 CC(C)S(=O)(=O)CC(=O)O Amb6281038 [0,1,0,0,0,1|1,0,0]=3 3254 B9R0.11 CC(C)SC(C)(C)C(=O)O Amb17501486 [0,1,0,0,0,1|1,0,1]=4 3255 B9R0.11 CC(C)[C@@](C)(N)CC(=O)O Amb27185746 [0,1,0,0,0,1|1,0,1]=4 3256 B9R0.11 CC(C)[C@](C)(N)CC(=O)O Amb28346262 [0,1,0,0,0,1|1,0,1]=4 3257 B9R0.11 CC(C)[C@](C)(O)CC(=O)O Amb27810826 [0,1,0,0,0,1|0,0,2]=4 3258 B9R0.11 CN(C)S(=O)(=O)CC(=O)O Amb6742030 [0,1,0,0,0,1|2,0,0]=4 3259 B9R0.23 C=C(C#N)C(=O)OC(C)C Amb2698247 [0,1,0,0,0,1|2,0,0]=4 3260 B9R0.23 C=C(C)CC(=O)C(C)CC Amb27875938 [0,1,0,0,0,1|2,0,0]=4 3261 B9R0.23 C=C(C)CC(=O)C(C)CO Amb27801591 [0,1,0,0,0,1|2,0,0]=4 3262 B9R0.23 C=C(C)CC(=O)C(C)NC Amb28050439 [0,1,0,0,0,1|2,0,0]=4 3263 B9R0.23 C=C(C)CC(=O)C(C)OC Amb28461000 [0,1,0,0,0,1|2,0,0]=4 3264 B9R0.23 C=C(CBr)C(=O)OC(C)C Amb27951363 [0,1,0,0,0,1|2,0,0]=4 3265 B9R0.23 C=C(CC(C)C)C(=O)OC Amb27827319 [0,1,0,0,0,1|1,0,0]=3 3266 B9R0.23 C=C(CCl)C(=O)CC(C)C Amb27618163 [0,1,0,0,0,1|2,0,0]=4 3267 B9R0.23 C=C(CO)C(=O)OC(C)C Amb27839197 [0,1,0,0,0,1|1,0,0]=3 3268 B9R0.23 CC(=O)NC(=O)C(C)CCl Amb18798253 [0,1,0,0,0,1|1,0,0]=3 3269 B9R0.23 CC(=O)OC(=O)C(O)CO Amb27805333 [0,1,0,0,0,1|2,0,0]=4 3270 B9R0.23 CC(=O)OC(=O)[C@@H](N)CS Amb27837858 [0,1,0,0,0,1|2,0,0]=4 3271 B9R0.23 CC(C)=C=C(C)C(=O)CO Amb28049895 [0,1,0,0,0,1|1,0,1]=4 3272 B9R0.23 CC(C)=CC(=O)C(=O)CBr Amb27777252 [0,1,0,0,0,1|1,0,1]=4 3273 B9R0.23 CC(C)=CC(=O)C(C)CN Amb28050470 [0,1,0,0,0,1|2,0,0]=4 3274 B9R0.23 CC(C)CC(=O)C(=O)CBr Amb28346721 [0,1,0,0,0,1|1,0,0]=3 3275 B9R0.23 CC(C)CC(=O)C(C)C=O Amb28049939 [0,1,0,0,0,1|1,0,1]=4 3276 B9R0.23 CC(C)CC(=O)\C(Cl)=N/O Amb27470975 [0,1,0,0,0,1|1,0,0]=3 3277 B9R0.23 CC(C)CC(=O)\C(N)=N\N Amb2696490 [0,1,0,0,0,1|2,0,0]=4 3278 B9R0.23 CC(C)CC(N)C(=O)NO Amb27264492 [0,1,0,0,0,1|1,0,1]=4 3279 B9R0.23 CC(C)C[C@H](N)C(=O)NO Amb24440728 [0,1,0,0,0,1|1,0,1]=4 3280 B9R0.23 CC(C)NC(=O)C(=O)NN Amb436365 [0,1,0,0,0,1|1,0,0]=3 3281 B9R0.23 CC(C)NC(=O)[C@@H](O)CN Amb32645253 [0,1,0,0,0,1|1,0,1]=4 3282 B9R0.23 CC(C)NC(=O)\C(Cl)=C\Cl Amb28050897 [0,1,0,0,0,1|2,0,0]=4 3283 B9R0.23 CC(C)OC(=O)C(=O)CBr Amb22231989 [0,1,0,0,0,1|1,0,0]=3 3284 B9R0.23 CC(C)OC(=O)C(=O)CCl Amb27479239 [0,1,0,0,0,1|1,0,0]=3 3285 B9R0.23 CC(C)OC(=O)C(N)CO Amb9493141 [0,1,0,0,0,1|1,0,1]=4 3286 B9R0.23 CC(C)OC(=O)C(O)CN Amb27401958 [0,1,0,0,0,1|1,0,1]=4 3287 B9R0.23 CC(C)OC(=O)[C@@H](N)CO Amb32405899 [0,1,0,0,0,1|1,0,1]=4 3288 B9R0.23 CC(CN)N(C)CC(=O)O Amb27453888 [0,1,0,0,0,1|2,0,0]=4 3289 B9R0.23 CCC(C)C(=N)CC(C)=O Amb27629398 [0,1,0,0,0,1|2,0,0]=4 3290 B9R0.23 CCC(C)C(=O)CC(C)=O Amb24544654 [0,1,0,0,0,1|1,0,0]=3 3291 B9R0.23 CCC(C)C(=O)CC(C)O Amb28141520 [0,1,0,0,0,1|1,0,1]=4 3292 B9R0.23 CCC(C)C(=O)CS(C)=O Amb27837870 [0,1,0,0,0,1|2,0,0]=4 3293 B9R0.23 CCC(C)C(=O)C[N+](=O)[O-] Amb28349860 [0,1,0,0,0,1|1,0,1]=4 3294 B9R0.23 CCC(C)C(=O)NC(N)=O Amb28050080 [0,1,0,0,0,1|1,0,0]=3 3295 B9R0.23 CCC(C)C(C)CC(=O)O Amb18304200 [0,1,0,0,0,1|1,0,1]=4 3296 B9R0.23 CCC(C)C(N)CC(=O)O Amb2438880 [0,1,0,0,0,1|1,0,1]=4 3297 B9R0.23 CCC(C)C(O)CC(=O)O Amb18310690 [0,1,0,0,0,1|0,0,2]=4 3298 B9R0.23 CCC(C)N(C)CC(=O)O Amb8900884 [0,1,0,0,0,1|2,0,0]=4 3299 B9R0.23 CCC(C)S(=O)CC(=O)O Amb18523822 [0,1,0,0,0,1|1,0,0]=3 3300 B9R0.23 CCC(C)[C@@H](N)CC(=O)O Amb28455466 [0,1,0,0,0,1|1,0,1]=4 3301 B9R0.23 CCC(C)[C@@H](O)CC(=O)O Amb33318493 [0,1,0,0,0,1|0,0,2]=4 3302 B9R0.23 CCC(C)[C@H](N)CC(=O)O Amb25117039 [0,1,0,0,0,1|1,0,1]=4 3303 B9R0.23 CCC(C)[C@H](O)CC(=O)O Amb33318492 [0,1,0,0,0,1|0,0,2]=4 3304 B9R0.23 CCC(C)\C(C)=C\C(=O)O Amb27837581 [0,1,0,0,0,1|1,0,0]=3 3305 B9R0.23 CCC(C)\C(C)=C\C(C)=O Amb27196911 [0,1,0,0,0,1|2,0,0]=4 3306 B9R0.23 CCC(C)\C(Cl)=C\C(=O)O Amb28254394 [0,1,0,0,0,1|1,0,0]=3 3307 B9R0.23 CCC(Cl)C(=O)NC(C)=O Amb27407290 [0,1,0,0,0,1|2,0,0]=4 3308 B9R0.23 CCC(N)C(=O)NC(N)=O Amb27869473 [0,1,0,0,0,1|2,0,0]=4 3309 B9R0.23 CCN(C)C(=O)CC(=O)O Amb18987423 [0,1,0,0,0,1|1,0,0]=3 3310 B9R0.23 CCN(C)C(=O)CC(N)=O Amb16233768 [0,1,0,0,0,1|2,0,0]=4 3311 B9R0.23 CCN(O)C(=O)OC(C)C Amb27789775 [0,1,0,0,0,1|2,0,0]=4 3312 B9R0.23 CC[C@@H](C)C(N)CC(=O)O Amb32687892 [0,1,0,0,0,1|1,0,1]=4 3313 B9R0.23 CC[C@@H](C)[C@@H](N)CC(=O)O Amb25689818 [0,1,0,0,0,1|1,0,1]=4 3314 B9R0.23 CC[C@H](C)C(N)CC(=O)O Amb32687890 [0,1,0,0,0,1|1,0,1]=4 3315 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O Amb16184016 [0,1,0,0,0,1|1,0,1]=4 3316 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb19944304 [0,1,0,0,0,1|1,0,1]=4 3317 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb25068405 [0,1,0,0,0,1|1,0,1]=4 3318 B9R0.23 CC\C(C)=C(/C)CC(=O)O Amb28050046 [0,1,0,0,0,1|1,0,1]=4 3319 B9R0.23 CN[C@@H](C)C(=O)C=C(C)C Amb29890640 [0,1,0,0,0,1|2,0,0]=4 3320 B9R0.23 COC(=O)C(=O)CC(C)=O Amb1155424 [0,1,0,0,0,1|1,0,1]=4 3321 B9R0.23 COC(=O)C(=O)CC(C)C Amb17740021 [0,1,0,0,0,1|0,0,0]=2 3322 B9R0.23 COC(=O)C(Br)CC(C)C Amb22490955 [0,1,0,0,0,1|1,0,1]=4 3323 B9R0.23 COC(=O)C(C)=C=C(C)C Amb32423563 [0,1,0,0,0,1|1,0,1]=4 3324 B9R0.23 COC(=O)C(C)NC(C)C Amb19003119 [0,1,0,0,0,1|1,0,1]=4 3325 B9R0.23 COC(=O)C(Cl)CC(C)C Amb18800856 [0,1,0,0,0,1|1,0,1]=4 3326 B9R0.23 COC(=O)C(N)CC(C)C Amb1152419 [0,1,0,0,0,1|1,0,1]=4 3327 B9R0.23 COC(=O)C(N)CC(C)C Amb22489476 [0,1,0,0,0,1|1,0,1]=4 3328 B9R0.23 COC(=O)C(N)CC(C)C Amb932819 [0,1,0,0,0,1|1,0,1]=4 3329 B9R0.23 COC(=O)C(O)CC(C)C Amb19306745 [0,1,0,0,0,1|0,0,2]=4 3330 B9R0.23 COC(=O)[C@@H](Br)CC(C)C Amb27400688 [0,1,0,0,0,1|1,0,1]=4 3331 B9R0.23 COC(=O)[C@@H](N)CC(C)C Amb533935 [0,1,0,0,0,1|1,0,1]=4 3332 B9R0.23 COC(=O)[C@@H](N)CC(C)C Amb8513236 [0,1,0,0,0,1|1,0,1]=4 3333 B9R0.23 COC(=O)[C@H](Br)CC(C)C Amb27796257 [0,1,0,0,0,1|1,0,1]=4 3334 B9R0.23 COC(=O)[C@H](C)NC(C)C Amb9228611 [0,1,0,0,0,1|1,0,1]=4 3335 B9R0.23 COC(=O)[C@H](N)CC(C)C Amb2719741 [0,1,0,0,0,1|1,0,1]=4 3336 B9R0.23 COC(=O)[C@H](N)CC(C)C Amb3941143 [0,1,0,0,0,1|1,0,1]=4 3337 B9R0.23 COC(=O)[C@H](O)CC(C)C Amb26022448 [0,1,0,0,0,1|0,0,2]=4 3338 B9R0.23 COC(=O)\C(I)=C\C(C)C Amb27230893 [0,1,0,0,0,1|1,0,0]=3 3339 B9R0.23 COC(=O)\C(N)=C\C(C)C Amb28050074 [0,1,0,0,0,1|1,0,0]=3 3340 B9R0.23 COC(C)C(=O)CC(C)=O Amb26479508 [0,1,0,0,0,1|1,0,0]=3 3341 B9R0.23 COC(C)C(=O)C[N+](=O)[O-] Amb28292013 [0,1,0,0,0,1|1,0,1]=4 3342 B9R0.23 COC(C)C(=O)NC(C)C Amb27849551 [0,1,0,0,0,1|1,0,1]=4 3343 B9R0.23 COC(C)C(C)CC(=O)O Amb18202340 [0,1,0,0,0,1|1,0,1]=4 3344 B9R0.23 COC(C)C(N)CC(=O)O Amb26567214 [0,1,0,0,0,1|1,0,1]=4 3345 B9R0.23 COC(C)\C(C)=C\C(C)=O Amb27780973 [0,1,0,0,0,1|2,0,0]=4 3346 B9R0.23 CON(C)C(=O)CC(C)=O Amb26436045 [0,1,0,0,0,1|2,0,0]=4 3347 B9R0.23 CON(C)C(=O)CC(C)C Amb20673732 [0,1,0,0,0,1|2,0,0]=4 3348 B9R0.23 CON(C)C(=O)NC(C)C Amb28122150 [0,1,0,0,0,1|2,0,0]=4 3349 B9R0.23 CON(C)C(=O)OC(C)C Amb27853985 [0,1,0,0,0,1|2,0,0]=4 3350 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35788177 [0,1,0,0,0,1|1,0,1]=4 3351 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35789671 [0,1,0,0,0,1|1,0,1]=4 3352 B9R0.23 CSC(=S)C(=O)NC(C)C Amb27752054 [0,1,0,0,0,1|0,2,0]=4 3353 B9R0.23 CSC(O)C(=O)CC(C)C Amb27854282 [0,1,0,0,0,1|0,1,1]=4 3354 B9R0.23 C[C@H](CO)N(C)CC(=O)O Amb28254590 [0,1,0,0,0,1|2,0,0]=4 3355 B9R0.23 C\C(=C/O)C(=O)CC(C)C Amb28056098 [0,1,0,0,0,1|1,0,0]=3 3356 B9R0.23 C\C(=N/O)C(=O)CC(C)C Amb28381111 [0,1,0,0,0,1|1,0,0]=3 3357 B9R0.23 C\C(C=O)=C(\O)CC(C)C Amb27439095 [0,1,0,0,0,1|1,0,1]=4 3358 B9R0.23 C\C=C(/C)C(=O)OC(C)C Amb22230776 [0,1,0,0,0,1|2,0,0]=4 3359 B9R0.23 C\C=C(\C)C(=O)NC(C)=O Amb27810928 [0,1,0,0,0,1|1,0,1]=4 3360 B9R0.23 C\C=C(\C)C(=O)NC(C)C Amb27833332 [0,1,0,0,0,1|2,0,0]=4 3361 B9R0.23 C\C=C(\C)C(=O)OC(C)C Amb24482854 [0,1,0,0,0,1|2,0,0]=4 3362 B9R0.23 C\C=C(\N)C(=O)OC(C)C Amb27968618 [0,1,0,0,0,1|2,0,0]=4 3363 B9R0.39 C#CC(CC(=O)O)C(C)C Amb27408324 [0,1,0,0,0,1|1,0,1]=4 3364 B9R0.39 C#C[C@@H](CC(=O)O)C(C)C Amb27977044 [0,1,0,0,0,1|1,0,1]=4 3365 B9R0.39 C#C[C@H](CC(=O)O)C(C)C Amb27253902 [0,1,0,0,0,1|1,0,1]=4 3366 B9R0.39 C=CC(CC(=O)O)C(C)C Amb18643903 [0,1,0,0,0,1|1,0,1]=4 3367 B9R0.39 C=CC(SC(C)C)C(=O)O Amb28123807 [0,1,0,0,0,1|1,0,1]=4 3368 B9R0.39 C=C[C@@H](CC(=O)O)C(C)C Amb27881786 [0,1,0,0,0,1|1,0,1]=4 3369 B9R0.39 C=C[C@H](CC(=O)O)C(C)C Amb27962891 [0,1,0,0,0,1|1,0,1]=4 3370 B9R0.39 CC(=O)CC(C=O)C(C)C Amb27838017 [0,1,0,0,0,1|1,0,1]=4 3371 B9R0.39 CC(=O)SC(C=O)=C(C)C Amb28050015 [0,1,0,0,0,1|1,0,1]=4 3372 B9R0.39 CC(=O)\C(=C/C(C)C)CBr Amb27630403 [0,1,0,0,0,1|2,0,0]=4 3373 B9R0.39 CC(=O)\C(=C/Cl)CC(C)C Amb27614904 [0,1,0,0,0,1|2,0,0]=4 3374 B9R0.39 CC(=O)\C(=C/O)CC(C)C Amb27752064 [0,1,0,0,0,1|1,0,1]=4 3375 B9R0.39 CC(=O)\C(C#N)=C\C(C)C Amb27669051 [0,1,0,0,0,1|2,0,0]=4 3376 B9R0.39 CC(C)C(C#N)CC(=O)O Amb25818234 [0,1,0,0,0,1|1,0,1]=4 3377 B9R0.39 CC(C)C(CN)CC(=O)O Amb26910759 [0,1,0,0,0,1|1,0,1]=4 3378 B9R0.39 CC(C)CC(C#N)C(=O)O Amb23558965 [0,1,0,0,0,1|1,0,1]=4 3379 B9R0.39 CC(C)CC(CN)C(=O)O Amb19021764 [0,1,0,0,0,1|1,0,1]=4 3380 B9R0.39 CC(C)CC(CN)C(=O)O Amb28555451 [0,1,0,0,0,1|1,0,1]=4 3381 B9R0.39 CC(C)CC(CO)C(=O)O Amb18124780 [0,1,0,0,0,1|0,0,2]=4 3382 B9R0.39 CC(C)CC(N=O)C(=O)O Amb27461396 [0,1,0,0,0,1|0,0,1]=3 3383 B9R0.39 CC(C)CC(NCl)C(=O)O Amb27401848 [0,1,0,0,0,1|1,0,1]=4 3384 B9R0.39 CC(C)CC(ON)C(=O)O Amb18644321 [0,1,0,0,0,1|0,0,2]=4 3385 B9R0.39 CC(C)CC(ON)C(=O)O Amb33484371 [0,1,0,0,0,1|0,0,2]=4 3386 B9R0.39 CC(C)CN(N=O)C(N)=O Amb25809440 [0,1,0,0,0,1|2,0,0]=4 3387 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756732 [0,1,0,0,0,1|1,0,1]=4 3388 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756740 [0,1,0,0,0,1|1,0,1]=4 3389 B9R0.39 CC(C)C[C@@H](NN)C(=O)O Amb27424998 [0,1,0,0,0,1|1,0,1]=4 3390 B9R0.39 CC(C)C[C@@H](ON)C(=O)O Amb27975779 [0,1,0,0,0,1|0,0,2]=4 3391 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb26390781 [0,1,0,0,0,1|1,0,1]=4 3392 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb32620226 [0,1,0,0,0,1|1,0,1]=4 3393 B9R0.39 CC(C)C[C@H](NN)C(=O)O Amb27488207 [0,1,0,0,0,1|1,0,1]=4 3394 B9R0.39 CC(C)C\C(=N\O)C(N)=O Amb27450654 [0,1,0,0,0,1|1,0,1]=4 3395 B9R0.39 CC(C)N(C#N)CC(=O)O Amb35634517 [0,1,0,0,0,1|2,0,0]=4 3396 B9R0.39 CC(C)N(N=O)NC(N)=O Amb27780575 [0,1,0,0,0,1|2,0,0]=4 3397 B9R0.39 CC(C)NC(CN)C(=O)O Amb28291039 [0,1,0,0,0,1|1,0,1]=4 3398 B9R0.39 CC(C)NC(CO)C(=O)O Amb26046487 [0,1,0,0,0,1|0,0,2]=4 3399 B9R0.39 CC(C)NC(CS)C(=O)O Amb27233014 [0,1,0,0,0,1|0,1,1]=4 3400 B9R0.39 CC(C)N[C@@H](CS)C(=O)O Amb25299344 [0,1,0,0,0,1|0,1,1]=4 3401 B9R0.39 CC(C)S[C@@H](CN)C(=O)O Amb27444140 [0,1,0,0,0,1|1,0,1]=4 3402 B9R0.39 CC(C)S\C(=N\O)C(N)=O Amb28458278 [0,1,0,0,0,1|1,0,1]=4 3403 B9R0.39 CC(C)[C@@H](C#N)CC(=O)O Amb27473398 [0,1,0,0,0,1|1,0,1]=4 3404 B9R0.39 CC(C)[C@H](C#N)CC(=O)O Amb28184580 [0,1,0,0,0,1|1,0,1]=4 3405 B9R0.39 CC(C)[C@H](C=O)CC(=O)[O-] Amb27948625 [0,1,0,0,0,1|0,0,2]=4 3406 B9R0.39 CC(C)\C=C(/C#N)C(=O)O Amb25864734 [0,1,0,0,0,1|1,0,0]=3 3407 B9R0.39 CCC(CC(=O)O)C(C)C Amb33534084 [0,1,0,0,0,1|1,0,1]=4 3408 B9R0.39 CCC(CC(C)C)C(=O)O Amb19014184 [0,1,0,0,0,1|1,0,1]=4 3409 B9R0.39 CCC(NC(C)C)C(=O)O Amb28555426 [0,1,0,0,0,1|1,0,1]=4 3410 B9R0.39 CCC(NC(C)C)C(=O)O Amb9620437 [0,1,0,0,0,1|1,0,1]=4 3411 B9R0.39 CCC(SC(C)C)C(=O)O Amb17501347 [0,1,0,0,0,1|1,0,1]=4 3412 B9R0.39 CC[C@@H](CC(C)C)C(=O)O Amb28397993 [0,1,0,0,0,1|1,0,1]=4 3413 B9R0.39 CC[C@H](CC(=O)O)C(C)C Amb25989910 [0,1,0,0,0,1|1,0,1]=4 3414 B9R0.39 CC\C(=C/C(=O)O)C(C)C Amb18967765 [0,1,0,0,0,1|1,0,0]=3 3415 B9R0.39 CC\C(=C/C(C)=O)C(C)C Amb28189821 [0,1,0,0,0,1|2,0,0]=4 3416 B9R0.39 CC\C(=C/C(C)C)C(=O)O Amb18643946 [0,1,0,0,0,1|1,0,0]=3 3417 B9R0.39 CC\C(=N/N(C)C)C(=O)O Amb28423305 [0,1,0,0,0,1|2,0,0]=4 3418 B9R0.39 CNC(CC(=O)O)C(C)C Amb27209417 [0,1,0,0,0,1|1,0,1]=4 3419 B9R0.39 CNC(CC(C)C)C(=O)O Amb22274694 [0,1,0,0,0,1|1,0,1]=4 3420 B9R0.39 CNC(CC(C)C)C(=O)O Amb9283589 [0,1,0,0,0,1|1,0,1]=4 3421 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb16183858 [0,1,0,0,0,1|1,0,1]=4 3422 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb2779901 [0,1,0,0,0,1|1,0,1]=4 3423 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb10842218 [0,1,0,0,0,1|1,0,1]=4 3424 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb22745995 [0,1,0,0,0,1|1,0,1]=4 3425 B9R0.39 COC(CC(C)C)C(=O)O Amb26656466 [0,1,0,0,0,1|0,0,2]=4 3426 B9R0.39 CO[C@@H](CC(C)C)C(=O)O Amb28126876 [0,1,0,0,0,1|0,0,2]=4 3427 B9R0.39 CSC(CC(C)C)C(=O)O Amb27658945 [0,1,0,0,0,1|0,1,1]=4 3428 B9R0.39 C\C(Cl)=C(\C=O)CC(C)C Amb27663713 [0,1,0,0,0,1|2,0,0]=4 3429 B9R0.39 C\C=C(\CC(C)=O)C(C)C Amb25265231 [0,1,0,0,0,1|2,0,0]=4 3430 B9R0.39 O=C\C(=C/C(=O)O)C(Cl)Cl Amb27392225 [0,1,0,0,0,1|2,0,0]=4 3431 B9R0.39 O=C\C(=C\C(=O)O)C(Cl)Cl Amb27630396 [0,1,0,0,0,1|2,0,0]=4 3432 B9R0.42 C=C(C)C(=O)CC(=O)OC Amb26925268 [0,1,0,0,0,1|0,0,2]=4 3433 B9R0.42 C=C(C)C(=O)CC(C)OC Amb17593596 [0,1,0,0,0,1|2,0,0]=4 3434 B9R0.42 C=C(C)C(=O)OC(C)CC Amb22231432 [0,1,0,0,0,1|2,0,0]=4 3435 B9R0.42 C=C(C)C(=O)OC(C)CO Amb24714712 [0,1,0,0,0,1|2,0,0]=4 3436 B9R0.42 C=C(C=O)CC(=O)C(C)C Amb28436744 [0,1,0,0,0,1|1,0,0]=3 3437 B9R0.42 C=C(CC(C)CC)C(=O)O Amb27794839 [0,1,0,0,0,1|1,0,0]=3 3438 B9R0.42 C=C(CC(O)CC)C(=O)O Amb27427164 [0,1,0,0,0,1|2,0,0]=4 3439 B9R0.42 C=C(CC(O)CO)C(=O)O Amb28050042 [0,1,0,0,0,1|2,0,0]=4 3440 B9R0.42 C=C(C[C@@H](C)CC)C(C)=O Amb26853718 [0,1,0,0,0,1|2,0,0]=4 3441 B9R0.42 C=C(Cl)C(=O)NC(C)CC Amb27461359 [0,1,0,0,0,1|2,0,0]=4 3442 B9R0.42 C=C(Cl)C(=O)NC(C)CO Amb27845881 [0,1,0,0,0,1|2,0,0]=4 3443 B9R0.42 C=CC(=O)\C=C(/C)C(C)C Amb26910599 [0,1,0,0,0,1|2,0,0]=4 3444 B9R0.42 C=CC(C)OC(=O)C(C)=O Amb27262902 [0,1,0,0,0,1|1,0,1]=4 3445 B9R0.42 C=C\C(Cl)=C/C(=O)C(C)C Amb24508943 [0,1,0,0,0,1|2,0,0]=4 3446 B9R0.42 CC(=O)C(=O)CC(O)CO Amb28253841 [0,1,0,0,0,1|2,0,0]=4 3447 B9R0.42 CC(=O)C(=O)OC(C)CCl Amb27848531 [0,1,0,0,0,1|1,0,0]=3 3448 B9R0.42 CC(C#N)NC(=O)C(=O)O Amb18563433 [0,1,0,0,0,1|0,0,1]=3 3449 B9R0.42 CC(C)C(=O)NC(=O)CCl Amb1107207 [0,1,0,0,0,1|1,0,0]=3 3450 B9R0.42 CC(C)C(=O)N[C@@H](C)CO Amb25708718 [0,1,0,0,0,1|1,0,1]=4 3451 B9R0.42 CC(C)C(=O)\C=C(\Cl)CCl Amb28244787 [0,1,0,0,0,1|2,0,0]=4 3452 B9R0.42 CC(CF)CC(N)C(=O)O Amb27838056 [0,1,0,0,0,1|1,0,1]=4 3453 B9R0.42 CC(CF)NC(=O)[C@@H](C)O Amb27260089 [0,1,0,0,0,1|1,0,1]=4 3454 B9R0.42 CC(CN)NC(=O)C(=O)O Amb28340502 [0,1,0,0,0,1|0,0,0]=2 3455 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [0,1,0,0,0,1|1,0,1]=4 3456 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [0,1,0,0,0,1|1,0,1]=4 3457 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [0,1,0,0,0,1|1,0,1]=4 3458 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [0,1,0,0,0,1|1,0,1]=4 3459 B9R0.42 CC(CO)NC(=O)C(C)C Amb9275938 [0,1,0,0,0,1|1,0,1]=4 3460 B9R0.42 CC(CO)NC(=O)[C@@H](C)O Amb28315975 [0,1,0,0,0,1|1,0,1]=4 3461 B9R0.42 CC(CO)OC(C)C(=O)O Amb27664032 [0,1,0,0,0,1|1,0,1]=4 3462 B9R0.42 CC(CO)O[C@@H](C)C(=O)O Amb28255959 [0,1,0,0,0,1|1,0,1]=4 3463 B9R0.42 CC(CO)O[C@H](C)C(=O)O Amb27450794 [0,1,0,0,0,1|1,0,1]=4 3464 B9R0.42 CC(CO)SC(F)C(=O)O Amb28205607 [0,1,0,0,0,1|1,0,1]=4 3465 B9R0.42 CC(N)C(=O)NC(=O)CN Amb30666650 [0,1,0,0,0,1|2,0,0]=4 3466 B9R0.42 CC(O)C(=O)OC(=O)CO Amb27197247 [0,1,0,0,0,1|1,0,0]=3 3467 B9R0.42 CCC(=O)CC(=O)C(C)C Amb9775083 [0,1,0,0,0,1|1,0,0]=3 3468 B9R0.42 CCC(=O)CS(=O)C(C)C Amb27838993 [0,1,0,0,0,1|2,0,0]=4 3469 B9R0.42 CCC(=O)NC(=O)C(C)C Amb27797221 [0,1,0,0,0,1|1,0,0]=3 3470 B9R0.42 CCC(=O)OC(=O)C(C)C Amb15692551 [0,1,0,0,0,1|1,0,0]=3 3471 B9R0.42 CCC(C)CC(=O)C(=O)O Amb27600368 [0,1,0,0,0,1|0,0,0]=2 3472 B9R0.42 CCC(C)CC(=O)C(C)O Amb27174638 [0,1,0,0,0,1|1,0,1]=4 3473 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [0,1,0,0,0,1|1,0,1]=4 3474 B9R0.42 CCC(C)CC(Cl)C(=O)O Amb28050903 [0,1,0,0,0,1|1,0,1]=4 3475 B9R0.42 CCC(C)CC(N)C(=O)O Amb18313985 [0,1,0,0,0,1|1,0,1]=4 3476 B9R0.42 CCC(C)CC(N)C(=O)O Amb20667726 [0,1,0,0,0,1|1,0,1]=4 3477 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [0,1,0,0,0,1|0,0,2]=4 3478 B9R0.42 CCC(C)CC(S)C(=O)O Amb18798152 [0,1,0,0,0,1|0,1,1]=4 3479 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [0,1,0,0,0,1|1,0,1]=4 3480 B9R0.42 CCC(C)C[C@@H](N)C(=O)O Amb25127143 [0,1,0,0,0,1|1,0,1]=4 3481 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [0,1,0,0,0,1|1,0,1]=4 3482 B9R0.42 CCC(C)C[C@H](N)C(=O)O Amb27471067 [0,1,0,0,0,1|1,0,1]=4 3483 B9R0.42 CCC(C)NC(=O)C(=O)O Amb9303796 [0,1,0,0,0,1|0,0,0]=2 3484 B9R0.42 CCC(C)NC(=O)C(C)=O Amb17399880 [0,1,0,0,0,1|1,0,0]=3 3485 B9R0.42 CCC(C)NC(=O)C(N)=O Amb28050528 [0,1,0,0,0,1|1,0,0]=3 3486 B9R0.42 CCC(C)NC(=O)[C@@H](C)O Amb27946418 [0,1,0,0,0,1|1,0,1]=4 3487 B9R0.42 CCC(C)NC(=O)[C@H](C)O Amb27247185 [0,1,0,0,0,1|1,0,1]=4 3488 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [0,1,0,0,0,1|1,0,1]=4 3489 B9R0.42 CCC(C)OC(=O)C(C)=O Amb28198630 [0,1,0,0,0,1|1,0,0]=3 3490 B9R0.42 CCC(C)OC(=O)C(C)O Amb24672514 [0,1,0,0,0,1|1,0,1]=4 3491 B9R0.42 CCC(C)OC(=O)C(N)=O Amb27216908 [0,1,0,0,0,1|1,0,0]=3 3492 B9R0.42 CCC(C)OC(=O)[C@H](C)O Amb27833305 [0,1,0,0,0,1|1,0,1]=4 3493 B9R0.42 CCC(C)O[C@@H](C)C(=O)O Amb27395318 [0,1,0,0,0,1|1,0,1]=4 3494 B9R0.42 CCC(C)O[C@H](C)C(=O)O Amb27495202 [0,1,0,0,0,1|1,0,1]=4 3495 B9R0.42 CCC(C)SC(F)C(=O)O Amb27272834 [0,1,0,0,0,1|1,0,1]=4 3496 B9R0.42 CCC(C)\C=C(/C)C(=O)O Amb18643945 [0,1,0,0,0,1|1,0,0]=3 3497 B9R0.42 CCC(C)\C=C(\C)C(=O)O Amb27837721 [0,1,0,0,0,1|1,0,0]=3 3498 B9R0.42 CCC(O)OC(=O)C(C)C Amb28206089 [0,1,0,0,0,1|1,0,1]=4 3499 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [0,1,0,0,0,1|1,0,1]=4 3500 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [0,1,0,0,0,1|0,0,2]=4 3501 B9R0.42 CC[C@H](C)CC(=O)C(=O)O Amb27473360 [0,1,0,0,0,1|0,0,0]=2 3502 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [0,1,0,0,0,1|1,0,1]=4 3503 B9R0.42 CC[C@H](C)CC(N)C(=O)O Amb28364291 [0,1,0,0,0,1|1,0,1]=4 3504 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [0,1,0,0,0,1|1,0,1]=4 3505 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb25662528 [0,1,0,0,0,1|1,0,1]=4 3506 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb33620552 [0,1,0,0,0,1|1,0,1]=4 3507 B9R0.42 CC[C@H](C)\C=C(/C)C(=O)O Amb27831923 [0,1,0,0,0,1|1,0,0]=3 3508 B9R0.42 CC[C@H](C)\C=C(/C)C(C)=O Amb24586848 [0,1,0,0,0,1|2,0,0]=4 3509 B9R0.42 CC\C(S)=C\C(=O)C(C)C Amb27433805 [0,1,0,0,0,1|1,1,0]=4 3510 B9R0.42 CN(C)C(=O)CC(=O)CBr Amb27231438 [0,1,0,0,0,1|2,0,0]=4 3511 B9R0.42 CN(C)C(=O)CC(=O)CCl Amb24707806 [0,1,0,0,0,1|2,0,0]=4 3512 B9R0.42 CN(C)C(=O)C\C(N)=N\O Amb8846345 [0,1,0,0,0,1|2,0,0]=4 3513 B9R0.42 CNC(=O)NC(=O)C(C)Cl Amb379544 [0,1,0,0,0,1|2,0,0]=4 3514 B9R0.42 CNC(=O)NC(=O)C(C)I Amb27761929 [0,1,0,0,0,1|2,0,0]=4 3515 B9R0.42 CNC(=O)NC(=O)C(C)O Amb9421399 [0,1,0,0,0,1|2,0,0]=4 3516 B9R0.42 CNC(=S)NC(=O)C(C)C Amb26316260 [0,1,0,0,0,1|1,1,0]=4 3517 B9R0.42 COC(=O)CC(=O)C(=O)O Amb22728219 [0,1,0,0,0,1|1,0,1]=4 3518 B9R0.42 COC(=O)CC(=O)C(C)=O Amb25146895 [0,1,0,0,0,1|1,0,1]=4 3519 B9R0.42 COC(=O)CC(=O)C(C)Br Amb19888842 [0,1,0,0,0,1|1,0,0]=3 3520 B9R0.42 COC(=O)CC(=O)C(C)C Amb2689576 [0,1,0,0,0,1|0,0,0]=2 3521 B9R0.42 COC(=O)CC(=O)C(C)Cl Amb27592185 [0,1,0,0,0,1|1,0,0]=3 3522 B9R0.42 COC(=O)CC(=O)C(C)F Amb24589068 [0,1,0,0,0,1|1,0,0]=3 3523 B9R0.42 COC(=O)CC(=O)C(C)O Amb27827292 [0,1,0,0,0,1|1,0,0]=3 3524 B9R0.42 COC(=O)CC(=O)C(F)F Amb22011637 [0,1,0,0,0,1|2,0,0]=4 3525 B9R0.42 COC(=O)CC(=O)N(C)C Amb17399891 [0,1,0,0,0,1|1,0,0]=3 3526 B9R0.42 COC(=O)CC(N)C(C)C Amb22168224 [0,1,0,0,0,1|1,0,1]=4 3527 B9R0.42 COC(=O)CC(N)C(C)C Amb26870018 [0,1,0,0,0,1|1,0,1]=4 3528 B9R0.42 COC(=O)CC(O)C(C)C Amb24423234 [0,1,0,0,0,1|0,0,2]=4 3529 B9R0.42 COC(=O)CN(C)C(C)C Amb7757820 [0,1,0,0,0,1|2,0,0]=4 3530 B9R0.42 COC(=O)C[C@@H](N)C(C)C Amb26391960 [0,1,0,0,0,1|1,0,1]=4 3531 B9R0.42 COC(=O)C[C@@H](N)C(C)C Amb30640927 [0,1,0,0,0,1|1,0,1]=4 3532 B9R0.42 COC(=O)C[C@@H](O)C(C)C Amb25847717 [0,1,0,0,0,1|0,0,2]=4 3533 B9R0.42 COC(=O)C[C@H](N)C(C)C Amb23401522 [0,1,0,0,0,1|1,0,1]=4 3534 B9R0.42 COC(=O)C[C@H](N)C(C)C Amb25865860 [0,1,0,0,0,1|1,0,1]=4 3535 B9R0.42 COC(=O)C[C@H](O)C(C)C Amb26322416 [0,1,0,0,0,1|0,0,2]=4 3536 B9R0.42 COC(=O)NC(=O)C(C)Cl Amb444963 [0,1,0,0,0,1|1,0,0]=3 3537 B9R0.42 COC(=O)\C=C(/C)C(C)C Amb33472138 [0,1,0,0,0,1|1,0,0]=3 3538 B9R0.42 COC(=O)\C=C(/N)C(C)C Amb32701567 [0,1,0,0,0,1|1,0,0]=3 3539 B9R0.42 COC(=O)\C=C(/N)N(C)C Amb27216562 [0,1,0,0,0,1|2,0,0]=4 3540 B9R0.42 COC(=O)\C=C(\C)N(C)C Amb2386647 [0,1,0,0,0,1|2,0,0]=4 3541 B9R0.42 COC(=O)\N=C(/N)C(C)C Amb25147336 [0,1,0,0,0,1|1,0,0]=3 3542 B9R0.42 COC(C)CC(=O)C(=O)O Amb27614317 [0,1,0,0,0,1|0,0,0]=2 3543 B9R0.42 COC(C)CC(=O)C(C)O Amb26317373 [0,1,0,0,0,1|1,0,1]=4 3544 B9R0.42 COC(C)CC(N)C(=O)O Amb25147752 [0,1,0,0,0,1|1,0,1]=4 3545 B9R0.42 COC(C)CC(O)C(=O)O Amb33353368 [0,1,0,0,0,1|0,0,2]=4 3546 B9R0.42 COC(C)C[C@@H](N)C(=O)O Amb24412403 [0,1,0,0,0,1|1,0,1]=4 3547 B9R0.42 COC(C)C[C@H](N)C(=O)O Amb27801695 [0,1,0,0,0,1|1,0,1]=4 3548 B9R0.42 COC(C)\C=C(\C)C(=O)O Amb27432877 [0,1,0,0,0,1|1,0,0]=3 3549 B9R0.42 CO\C(C)=C\C(=O)C(C)C Amb28428756 [0,1,0,0,0,1|1,0,0]=3 3550 B9R0.42 CSC(C)C[C@H](N)C(=O)O Amb28208334 [0,1,0,0,0,1|1,0,1]=4 3551 B9R0.42 CS[C@@H](C)C[C@@H](N)C(=O)O Amb27755570 [0,1,0,0,0,1|1,0,1]=4 3552 B9R0.42 C[C@@H](CN)NC(=O)C(=O)O Amb28316025 [0,1,0,0,0,1|0,0,0]=2 3553 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [0,1,0,0,0,1|1,0,1]=4 3554 B9R0.42 C[C@@H](CO)NC(=O)C(=O)O Amb28049727 [0,1,0,0,0,1|0,0,0]=2 3555 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [0,1,0,0,0,1|1,0,1]=4 3556 B9R0.42 C\C(=C/C(=O)C(C)C)CCl Amb27469639 [0,1,0,0,0,1|2,0,0]=4 3557 B9R0.42 C\C(CC(=O)C(C)Br)=N/O Amb28049975 [0,1,0,0,0,1|2,0,0]=4 3558 B9R0.42 O=C(CO)CC(=O)C(F)F Amb32677820 [0,1,0,0,0,1|2,0,0]=4 3559 B9R0.42 O=C(O)C(=O)C[C@H](O)CO Amb26605764 [0,1,0,0,0,1|1,0,0]=3 3560 B9R0.57 C=C(Br)C(=O)OC(C)(C)C Amb22360695 [0,1,0,0,0,1|2,0,0]=4 3561 B9R0.57 C=C(C)C(=O)CC(C)(C)N Amb27426849 [0,1,0,0,0,1|2,0,0]=4 3562 B9R0.57 C=C(C)C(=O)NC(C)(C)C Amb2720814 [0,1,0,0,0,1|2,0,0]=4 3563 B9R0.57 C=C(C)C(=O)OC(C)(C)C Amb17943081 [0,1,0,0,0,1|2,0,0]=4 3564 B9R0.57 C=C(CC(C)(C)C)C(=O)O Amb27815006 [0,1,0,0,0,1|1,0,0]=3 3565 B9R0.57 C=C(Cl)C(=O)OC(C)(C)C Amb28281755 [0,1,0,0,0,1|2,0,0]=4 3566 B9R0.57 C=C(F)C(=O)OC(C)(C)C Amb2685643 [0,1,0,0,0,1|2,0,0]=4 3567 B9R0.57 C=C(OC(C)(C)C)C(=O)O Amb18644144 [0,1,0,0,0,1|1,0,0]=3 3568 B9R0.57 CC(=O)C(=O)NC(C)(C)C Amb17399882 [0,1,0,0,0,1|1,0,0]=3 3569 B9R0.57 CC(=O)C(=O)OC(C)(C)C Amb27973047 [0,1,0,0,0,1|1,0,0]=3 3570 B9R0.57 CC(=O)\C(C)=C\C(C)(C)C Amb27616506 [0,1,0,0,0,1|2,0,0]=4 3571 B9R0.57 CC(=O)\C(Cl)=N\C(C)(C)C Amb28052217 [0,1,0,0,0,1|2,0,0]=4 3572 B9R0.57 CC(C)(C)CC(=O)C(=O)O Amb6295779 [0,1,0,0,0,1|0,0,0]=2 3573 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb7172575 [0,1,0,0,0,1|1,0,1]=4 3574 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb8385710 [0,1,0,0,0,1|1,0,1]=4 3575 B9R0.57 CC(C)(C)CC(O)C(=O)O Amb18302187 [0,1,0,0,0,1|0,0,2]=4 3576 B9R0.57 CC(C)(C)C[C@@H](Br)C(=O)O Amb28049945 [0,1,0,0,0,1|1,0,1]=4 3577 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O Amb16184025 [0,1,0,0,0,1|1,0,1]=4 3578 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O Amb6295897 [0,1,0,0,0,1|1,0,1]=4 3579 B9R0.57 CC(C)(C)NC(=O)C(=O)Cl Amb28049997 [0,1,0,0,0,1|1,0,0]=3 3580 B9R0.57 CC(C)(C)NC(=O)C(=O)O Amb2693955 [0,1,0,0,0,1|0,0,0]=2 3581 B9R0.57 CC(C)(C)NC(=O)C(N)=O Amb3613981 [0,1,0,0,0,1|1,0,0]=3 3582 B9R0.57 CC(C)(C)OC(=O)C(=N)N Amb27170077 [0,1,0,0,0,1|2,0,0]=4 3583 B9R0.57 CC(C)(C)OC(=O)C(=O)Cl Amb22736009 [0,1,0,0,0,1|1,0,0]=3 3584 B9R0.57 CC(C)(C)OC(=O)C(=O)[O-] Amb22436495 [0,1,0,0,0,1|0,0,1]=3 3585 B9R0.57 CC(C)(C)OC(=O)C(N)=O Amb22546413 [0,1,0,0,0,1|1,0,0]=3 3586 B9R0.57 CC(C)(C)OC(=O)C(N)=S Amb25146256 [0,1,0,0,0,1|1,1,0]=4 3587 B9R0.57 CC(C)(C)OC(F)C(=O)O Amb27399823 [0,1,0,0,0,1|1,0,1]=4 3588 B9R0.57 CC(C)(C)\C=C(/F)C(=O)O Amb27194420 [0,1,0,0,0,1|1,0,0]=3 3589 B9R0.57 CC(C)(C)\C=C(\Br)C(=O)O Amb27230191 [0,1,0,0,0,1|1,0,0]=3 3590 B9R0.57 CC(C)(Cl)CC(N)C(=O)O Amb28555620 [0,1,0,0,0,1|1,0,1]=4 3591 B9R0.57 CC(C)(F)CC(=O)C(=O)O Amb33273007 [0,1,0,0,0,1|0,0,0]=2 3592 B9R0.57 CC(C)(F)CC(N)C(=O)O Amb26496047 [0,1,0,0,0,1|1,0,1]=4 3593 B9R0.57 CC(C)(F)CC(O)C(=O)O Amb33272231 [0,1,0,0,0,1|0,0,2]=4 3594 B9R0.57 CC(C)(F)C[C@@H](N)C(=O)O Amb24055873 [0,1,0,0,0,1|1,0,1]=4 3595 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O Amb26959500 [0,1,0,0,0,1|1,0,1]=4 3596 B9R0.57 CC(C)(O)CC(N)C(=O)O Amb18644326 [0,1,0,0,0,1|1,0,1]=4 3597 B9R0.57 CC(C)(O)CC(O)C(=O)O Amb27953570 [0,1,0,0,0,1|0,0,2]=4 3598 B9R0.57 CC(C)(O)C[C@@H](N)C(=O)O Amb24479570 [0,1,0,0,0,1|1,0,1]=4 3599 B9R0.57 CC(C)(O)C[C@@H](O)C(=O)O Amb27254266 [0,1,0,0,0,1|0,0,2]=4 3600 B9R0.57 CC(C)(O)C[C@H](N)C(=O)O Amb25992355 [0,1,0,0,0,1|1,0,1]=4 3601 B9R0.57 CC(C)(S)CC(N)C(=O)O Amb27984144 [0,1,0,0,0,1|1,0,1]=4 3602 B9R0.57 CC(C)C(=O)CC(C)(C)O Amb24721641 [0,1,0,0,0,1|1,0,1]=4 3603 B9R0.57 CC(C)C(=O)CS(=O)(=O)F Amb32794894 [0,1,0,0,0,1|1,0,1]=4 3604 B9R0.57 CC(CC(C)(C)C)C(=O)O Amb18124693 [0,1,0,0,0,1|1,0,1]=4 3605 B9R0.57 CC(CC(C)(C)F)C(=O)O Amb25971880 [0,1,0,0,0,1|1,0,1]=4 3606 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb22364426 [0,1,0,0,0,1|1,0,1]=4 3607 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb28555536 [0,1,0,0,0,1|1,0,1]=4 3608 B9R0.57 CC(F)(F)CC(=O)C(=O)O Amb32809797 [0,1,0,0,0,1|1,0,0]=3 3609 B9R0.57 CC(N)C(=O)OP(=O)(O)O Amb27843307 [0,1,0,0,0,1|2,0,0]=4 3610 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb17399895 [0,1,0,0,0,1|1,0,1]=4 3611 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb28991327 [0,1,0,0,0,1|1,0,1]=4 3612 B9R0.57 CC(O)C(=O)NC(C)(C)C Amb9421405 [0,1,0,0,0,1|1,0,1]=4 3613 B9R0.57 CC(O)C(=O)OC(C)(C)C Amb27391509 [0,1,0,0,0,1|1,0,1]=4 3614 B9R0.57 CC(OC(C)(C)C)C(=O)O Amb9208483 [0,1,0,0,0,1|1,0,1]=4 3615 B9R0.57 CN(O)C(=O)CC(C)(C)N Amb27440325 [0,1,0,0,0,1|2,0,0]=4 3616 B9R0.57 CN(O)C(=O)OC(C)(C)C Amb26478745 [0,1,0,0,0,1|2,0,0]=4 3617 B9R0.57 CS(=N)(=O)CC(=O)C(=O)O Amb33070021 [0,1,0,0,0,1|2,0,0]=4 3618 B9R0.57 CS(C)(=O)=NC(=O)C(=O)O Amb25027853 [0,1,0,0,0,1|1,0,0]=3 3619 B9R0.57 C[C@@H](CC(C)(C)C)C(=O)O Amb10844016 [0,1,0,0,0,1|1,0,1]=4 3620 B9R0.57 C[C@@H](N)C(=O)CP(=O)(O)O Amb25689821 [0,1,0,0,0,1|2,0,0]=4 3621 B9R0.57 C[C@@H](O)C(=O)NC(C)(C)C Amb28049744 [0,1,0,0,0,1|1,0,1]=4 3622 B9R0.57 C[C@@H](O)C(=O)OC(C)(C)C Amb22232948 [0,1,0,0,0,1|1,0,1]=4 3623 B9R0.57 C[C@H](CC(C)(C)C)C(=O)O Amb10844015 [0,1,0,0,0,1|1,0,1]=4 3624 B9R0.57 C[C@H](N)C(=O)CP(=O)(O)O Amb27862501 [0,1,0,0,0,1|2,0,0]=4 3625 B9R0.57 C[C@H](O)C(=O)NC(C)(C)C Amb27425093 [0,1,0,0,0,1|1,0,1]=4 3626 B9R0.57 C[C@H](O)C(=O)OC(C)(C)C Amb22232945 [0,1,0,0,0,1|1,0,1]=4 3627 B9R0.57 C\C(=C/C(C)(C)C)C(=O)O Amb28050296 [0,1,0,0,0,1|1,0,0]=3 3628 B9R0.57 O=C(O)C(=O)CC(F)(F)F Amb25232625 [0,1,0,0,0,1|2,0,0]=4 3629 B9R0.57 O=C(O)C(=O)NC(F)(F)F Amb27841806 [0,1,0,0,0,1|2,0,0]=4 3630 B9R0.79 C=C(C(=O)O)C(O)C(C)C Amb27468733 [0,1,0,0,0,1|1,0,0]=3 3631 B9R0.79 C=C(C(N)=O)[C@@H](O)C(C)C Amb27246122 [0,1,0,0,0,1|2,0,0]=4 3632 B9R0.79 C=C(C)C(=O)N(N)C(C)C Amb33191552 [0,1,0,0,0,1|2,0,0]=4 3633 B9R0.79 C=C(C)C(=O)[C@@H](N)C(C)C Amb35617530 [0,1,0,0,0,1|2,0,0]=4 3634 B9R0.79 C=C(C)C(=O)[C@H](N)C(C)C Amb35617739 [0,1,0,0,0,1|2,0,0]=4 3635 B9R0.79 C=C(Cl)C(=O)N(C)C(C)C Amb28288553 [0,1,0,0,0,1|2,0,0]=4 3636 B9R0.79 CC(=O)C(=O)C(O)C(C)O Amb28202342 [0,1,0,0,0,1|2,0,0]=4 3637 B9R0.79 CC(=O)C(=O)[C@@H](O)[C@H](C)O Amb27594785 [0,1,0,0,0,1|2,0,0]=4 3638 B9R0.79 CC(=O)C(Br)C(=O)N(C)C Amb28128408 [0,1,0,0,0,1|2,0,0]=4 3639 B9R0.79 CC(=O)C(C)C(=O)C(C)C Amb17778960 [0,1,0,0,0,1|1,0,0]=3 3640 B9R0.79 CC(=O)C(C)S(=O)C(C)C Amb28061580 [0,1,0,0,0,1|2,0,0]=4 3641 B9R0.79 CC(=O)C(Cl)C(=O)C(=O)O Amb27600115 [0,1,0,0,0,1|1,0,1]=4 3642 B9R0.79 CC(=O)C(Cl)C(=O)N(C)C Amb6608840 [0,1,0,0,0,1|2,0,0]=4 3643 B9R0.79 CC(=O)C(F)C(=O)N(C)C Amb25853211 [0,1,0,0,0,1|2,0,0]=4 3644 B9R0.79 CC(=O)C(O)C(=O)C(C)C Amb27480227 [0,1,0,0,0,1|1,0,0]=3 3645 B9R0.79 CC(=O)\C(C)=C(/C)C(C)C Amb27973084 [0,1,0,0,0,1|2,0,0]=4 3646 B9R0.79 CC(C(=O)O)C(=O)N(C)C Amb24454556 [0,1,0,0,0,1|1,0,0]=3 3647 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33330058 [0,1,0,0,0,1|1,0,1]=4 3648 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33484307 [0,1,0,0,0,1|1,0,1]=4 3649 B9R0.79 CC(C)C(=O)C(=O)C(=O)O Amb31099538 [0,1,0,0,0,1|0,0,0]=2 3650 B9R0.79 CC(C)C(=S)[C@H](N)C(=O)O Amb26586364 [0,1,0,0,0,1|0,1,0]=3 3651 B9R0.79 CC(C)C(Br)C(=O)N(C)O Amb27640383 [0,1,0,0,0,1|2,0,0]=4 3652 B9R0.79 CC(C)C(C)C(=O)C(=O)O Amb27473341 [0,1,0,0,0,1|0,0,0]=2 3653 B9R0.79 CC(C)C(C)C(=O)C(N)=O Amb27413554 [0,1,0,0,0,1|1,0,0]=3 3654 B9R0.79 CC(C)C(C)C(N)C(=O)O Amb26965499 [0,1,0,0,0,1|1,0,1]=4 3655 B9R0.79 CC(C)C(C)[C@@H](N)C(=O)O Amb28119442 [0,1,0,0,0,1|1,0,1]=4 3656 B9R0.79 CC(C)C(C)[C@H](N)C(=O)O Amb27951299 [0,1,0,0,0,1|1,0,1]=4 3657 B9R0.79 CC(C)C(Cl)C(=O)C(=O)O Amb18646182 [0,1,0,0,0,1|0,0,0]=2 3658 B9R0.79 CC(C)C(F)C(N)C(=O)O Amb28071157 [0,1,0,0,0,1|1,0,1]=4 3659 B9R0.79 CC(C)C(F)[C@@H](N)C(=O)O Amb27248487 [0,1,0,0,0,1|1,0,1]=4 3660 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb25863595 [0,1,0,0,0,1|1,0,1]=4 3661 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb33328671 [0,1,0,0,0,1|1,0,1]=4 3662 B9R0.79 CC(C)C(N)C(C)C(=O)O Amb28121227 [0,1,0,0,0,1|1,0,1]=4 3663 B9R0.79 CC(C)C(N)C(F)C(=O)O Amb28385013 [0,1,0,0,0,1|1,0,1]=4 3664 B9R0.79 CC(C)C(N)C(O)C(=O)O Amb27615047 [0,1,0,0,0,1|0,0,2]=4 3665 B9R0.79 CC(C)C(O)C(C)C(=O)O Amb18990636 [0,1,0,0,0,1|0,0,2]=4 3666 B9R0.79 CC(C)C(O)C(F)C(=O)O Amb33136392 [0,1,0,0,0,1|0,0,2]=4 3667 B9R0.79 CC(C)C(O)C(N)C(=O)O Amb23399656 [0,1,0,0,0,1|0,0,2]=4 3668 B9R0.79 CC(C)C(O)C(O)C(=O)O Amb27655491 [0,1,0,0,0,1|0,0,2]=4 3669 B9R0.79 CC(C)C(O)[C@@H](C)C(=O)O Amb27494047 [0,1,0,0,0,1|0,0,2]=4 3670 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O Amb24509492 [0,1,0,0,0,1|0,0,2]=4 3671 B9R0.79 CC(C)C(S)C(N)C(=O)O Amb28076641 [0,1,0,0,0,1|0,1,1]=4 3672 B9R0.79 CC(C)N(C)C(=O)C(=O)O Amb9303810 [0,1,0,0,0,1|0,0,0]=2 3673 B9R0.79 CC(C)N(C)C(=O)[C@@H](C)O Amb27807368 [0,1,0,0,0,1|1,0,1]=4 3674 B9R0.79 CC(C)N(N)C(C)C(=O)O Amb27850417 [0,1,0,0,0,1|1,0,1]=4 3675 B9R0.79 CC(C)N(O)C(=O)C(=O)O Amb24671329 [0,1,0,0,0,1|0,0,0]=2 3676 B9R0.79 CC(C)[C@@H](Cl)[C@@H](N)C(=O)O Amb27409092 [0,1,0,0,0,1|1,0,1]=4 3677 B9R0.79 CC(C)[C@@H](O)[C@@H](Br)C(=O)O Amb27394249 [0,1,0,0,0,1|0,0,2]=4 3678 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O Amb27874042 [0,1,0,0,0,1|0,0,2]=4 3679 B9R0.79 CC(C)[C@@H](O)[C@H](C)C(=O)O Amb28347218 [0,1,0,0,0,1|0,0,2]=4 3680 B9R0.79 CC(C)[C@H](Cl)[C@@H](N)C(=O)O Amb27796326 [0,1,0,0,0,1|1,0,1]=4 3681 B9R0.79 CC(C)[C@H](N)[C@H](C)C(=O)O Amb27216704 [0,1,0,0,0,1|1,0,1]=4 3682 B9R0.79 CC(C)[C@H](N)[C@H](O)C(=O)O Amb25147282 [0,1,0,0,0,1|0,0,2]=4 3683 B9R0.79 CC(C)[C@H](O)[C@@H](C)C(=O)O Amb10844253 [0,1,0,0,0,1|0,0,2]=4 3684 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O Amb10807407 [0,1,0,0,0,1|0,0,2]=4 3685 B9R0.79 CC(C)[C@H](O)[C@H](C)C(=O)O Amb28346279 [0,1,0,0,0,1|0,0,2]=4 3686 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O Amb26333625 [0,1,0,0,0,1|0,0,2]=4 3687 B9R0.79 CC(C)[C@H](O)[C@H](O)C(=O)O Amb28050049 [0,1,0,0,0,1|0,0,2]=4 3688 B9R0.79 CN(C)C(=O)C(=O)C(=O)O Amb28316062 [0,1,0,0,0,1|1,0,0]=3 3689 B9R0.79 CN(C)C(=O)C(F)C(=O)O Amb28050091 [0,1,0,0,0,1|1,0,0]=3 3690 B9R0.79 CN(C)C(=O)C(N)C(N)=O Amb28132673 [0,1,0,0,0,1|2,0,0]=4 3691 B9R0.79 CN(C)C(=O)N(C)C(=O)Cl Amb28199041 [0,1,0,0,0,1|2,0,0]=4 3692 B9R0.79 C\C(=C(\F)C(=O)O)C(C)C Amb27615103 [0,1,0,0,0,1|1,0,0]=3 3693 B9R0.79 C\C(O)=C(\C)C(=O)C(C)C Amb27859396 [0,1,0,0,0,1|1,0,0]=3 3694 B9R0.6 C#CCC(C)C(C)C(=O)O Amb28049486 [0,2,0,0,0,0|1,0,1]=4 3695 B9R0.6 C#CCN(C)C(=O)C(=O)O Amb28398282 [0,2,0,0,0,0|1,0,0]=3 3696 B9R0.6 C#CCN(C)C(=O)C(C)=O Amb26475476 [0,2,0,0,0,0|2,0,0]=4 3697 B9R0.6 C=C(C(=O)O)C(C)CCC Amb33321132 [0,2,0,0,0,0|1,0,0]=3 3698 B9R0.6 C=C(C(=O)O)C(C)OCC Amb33425050 [0,2,0,0,0,0|1,0,0]=3 3699 B9R0.6 C=C(C(=O)OCC)C(C)C Amb24183730 [0,2,0,0,0,0|1,0,0]=3 3700 B9R0.6 C=C(C(=O)OCC)C(C)Cl Amb27657404 [0,2,0,0,0,0|2,0,0]=4 3701 B9R0.6 C=C(C(=O)OCC)C(C)O Amb28138407 [0,2,0,0,0,0|2,0,0]=4 3702 B9R0.6 C=C(C(=O)OCC)[C@@H](C)O Amb27823217 [0,2,0,0,0,0|2,0,0]=4 3703 B9R0.6 C=C(C(C)=O)C(C)\C=C\C Amb25146572 [0,2,0,0,0,0|2,0,0]=4 3704 B9R0.6 C=C(C)C(=O)C(=O)OCC Amb22754344 [0,2,0,0,0,0|0,0,2]=4 3705 B9R0.6 C=CCC(C)C(C)C(=O)O Amb18643938 [0,2,0,0,0,0|1,0,1]=4 3706 B9R0.6 C=CCC(C)C(N)C(=O)O Amb26381874 [0,2,0,0,0,0|1,0,1]=4 3707 B9R0.6 C=CCC(C)[C@@H](N)C(=O)O Amb33037030 [0,2,0,0,0,0|1,0,1]=4 3708 B9R0.6 C=CCC(C)[C@H](N)C(=O)O Amb32865926 [0,2,0,0,0,0|1,0,1]=4 3709 B9R0.6 C=CCC(O)C(=O)C(C)C Amb27822633 [0,2,0,0,0,0|1,0,1]=4 3710 B9R0.6 C=CCN(C)C(=O)C(=O)O Amb26035155 [0,2,0,0,0,0|1,0,0]=3 3711 B9R0.6 CC(=O)C(=O)C(C)OC=O Amb28321869 [0,2,0,0,0,0|1,0,1]=4 3712 B9R0.6 CC(C)C(=O)N(C)CC=O Amb17080671 [0,2,0,0,0,0|2,0,0]=4 3713 B9R0.6 CC(C)C(=O)N(C)CCO Amb5797669 [0,2,0,0,0,0|2,0,0]=4 3714 B9R0.6 CC(C)C(N)C(=O)OCCl Amb27601971 [0,2,0,0,0,0|1,0,1]=4 3715 B9R0.6 CC(C)[C@@H](N)C(=O)OCCl Amb27221960 [0,2,0,0,0,0|1,0,1]=4 3716 B9R0.6 CC(CC#N)C(C)C(=O)O Amb35719228 [0,2,0,0,0,0|1,0,1]=4 3717 B9R0.6 CC(CC#N)C(N)C(=O)O Amb33066130 [0,2,0,0,0,0|1,0,1]=4 3718 B9R0.6 CC(CC#N)[C@@H](N)C(=O)O Amb33308829 [0,2,0,0,0,0|1,0,1]=4 3719 B9R0.6 CC(CC#N)[C@H](N)C(=O)O Amb32865927 [0,2,0,0,0,0|1,0,1]=4 3720 B9R0.6 CC(CC=O)C(C)C(=O)O Amb18644133 [0,2,0,0,0,0|1,0,1]=4 3721 B9R0.6 CC(CCN)C(=O)N(C)O Amb28252205 [0,2,0,0,0,0|2,0,0]=4 3722 B9R0.6 CCCC(C)C(=O)C(=O)O Amb24747027 [0,2,0,0,0,0|0,0,0]=2 3723 B9R0.6 CCCC(C)C(=O)C(C)=O Amb28144170 [0,2,0,0,0,0|1,0,0]=3 3724 B9R0.6 CCCC(C)C(C)C(=O)O Amb28050123 [0,2,0,0,0,0|1,0,1]=4 3725 B9R0.6 CCCC(C)C(N)C(=O)O Amb20622789 [0,2,0,0,0,0|1,0,1]=4 3726 B9R0.6 CCCC(C)C(O)C(=O)O Amb27809670 [0,2,0,0,0,0|0,0,2]=4 3727 B9R0.6 CCCC(C)[C@@H](C)C(=O)O Amb33727115 [0,2,0,0,0,0|1,0,1]=4 3728 B9R0.6 CCCC(C)[C@@H](N)C(=O)O Amb26624121 [0,2,0,0,0,0|1,0,1]=4 3729 B9R0.6 CCCC(C)[C@H](C)C(=O)O Amb33749068 [0,2,0,0,0,0|1,0,1]=4 3730 B9R0.6 CCCC(C)[C@H](N)C(=O)O Amb26512364 [0,2,0,0,0,0|1,0,1]=4 3731 B9R0.6 CCC[C@@H](C)[C@@H](C)C(=O)O Amb27961440 [0,2,0,0,0,0|1,0,1]=4 3732 B9R0.6 CCC[C@H](C)[C@@H](N)C(=O)O Amb27801051 [0,2,0,0,0,0|1,0,1]=4 3733 B9R0.6 CCC[C@H](C)[C@@H](O)C(=O)O Amb28050149 [0,2,0,0,0,0|0,0,2]=4 3734 B9R0.6 CCC[C@H](C)[C@H](N)C(=O)O Amb29838293 [0,2,0,0,0,0|1,0,1]=4 3735 B9R0.6 CCC\C(C)=C(/C)C(=O)O Amb28072401 [0,2,0,0,0,0|1,0,1]=4 3736 B9R0.6 CCC\C(C)=C(/F)C(=O)O Amb27655820 [0,2,0,0,0,0|1,0,1]=4 3737 B9R0.6 CCOC(=O)C(=O)C(=O)O Amb27392066 [0,2,0,0,0,0|1,0,1]=4 3738 B9R0.6 CCOC(=O)C(=O)C(Br)Br Amb24471536 [0,2,0,0,0,0|2,0,0]=4 3739 B9R0.6 CCOC(=O)C(=O)C(C)=O Amb17593616 [0,2,0,0,0,0|1,0,1]=4 3740 B9R0.6 CCOC(=O)C(=O)C(C)Br Amb19737361 [0,2,0,0,0,0|1,0,0]=3 3741 B9R0.6 CCOC(=O)C(=O)C(C)C Amb6608868 [0,2,0,0,0,0|0,0,0]=2 3742 B9R0.6 CCOC(=O)C(=O)C(C)Cl Amb26431388 [0,2,0,0,0,0|1,0,0]=3 3743 B9R0.6 CCOC(=O)C(=O)C(C)O Amb25146496 [0,2,0,0,0,0|1,0,0]=3 3744 B9R0.6 CCOC(=O)C(=O)C(O)O Amb25707495 [0,2,0,0,0,0|2,0,0]=4 3745 B9R0.6 CCOC(=O)C(=O)N(C)C Amb2721176 [0,2,0,0,0,0|1,0,0]=3 3746 B9R0.6 CCOC(=O)C(Br)C(C)C Amb2720442 [0,2,0,0,0,0|1,0,1]=4 3747 B9R0.6 CCOC(=O)C(C)C(C)C Amb2780711 [0,2,0,0,0,0|1,0,1]=4 3748 B9R0.6 CCOC(=O)C(Cl)C(C)C Amb18800861 [0,2,0,0,0,0|1,0,1]=4 3749 B9R0.6 CCOC(=O)C(F)=C(C)C Amb25801998 [0,2,0,0,0,0|1,0,1]=4 3750 B9R0.6 CCOC(=O)C(F)C(C)C Amb24554825 [0,2,0,0,0,0|1,0,1]=4 3751 B9R0.6 CCOC(=O)C(N)C(C)C Amb17621190 [0,2,0,0,0,0|1,0,1]=4 3752 B9R0.6 CCOC(=O)C(N)C(C)C Amb9204488 [0,2,0,0,0,0|1,0,1]=4 3753 B9R0.6 CCOC(=O)C(O)C(C)C Amb25787483 [0,2,0,0,0,0|0,0,2]=4 3754 B9R0.6 CCOC(=O)C(S)C(C)C Amb27977759 [0,2,0,0,0,0|0,1,1]=4 3755 B9R0.6 CCOC(=O)N(C)C(C)C Amb28350576 [0,2,0,0,0,0|2,0,0]=4 3756 B9R0.6 CCOC(=O)[C@@H](Br)C(C)C Amb27401118 [0,2,0,0,0,0|1,0,1]=4 3757 B9R0.6 CCOC(=O)[C@@H](N)C(C)C Amb2725108 [0,2,0,0,0,0|1,0,1]=4 3758 B9R0.6 CCOC(=O)[C@@H](N)C(C)C Amb3941376 [0,2,0,0,0,0|1,0,1]=4 3759 B9R0.6 CCOC(=O)[C@@H](O)C(C)C Amb25079854 [0,2,0,0,0,0|0,0,2]=4 3760 B9R0.6 CCOC(=O)[C@H](Br)C(C)C Amb28130440 [0,2,0,0,0,0|1,0,1]=4 3761 B9R0.6 CCOC(=O)[C@H](N)C(C)C Amb10069732 [0,2,0,0,0,0|1,0,1]=4 3762 B9R0.6 CCOC(=O)[C@H](N)C(C)C Amb22801934 [0,2,0,0,0,0|1,0,1]=4 3763 B9R0.6 CCOC(C)C(=O)C(=O)O Amb33425710 [0,2,0,0,0,0|0,0,0]=2 3764 B9R0.6 CCOC(C)C(=O)C(O)O Amb25870960 [0,2,0,0,0,0|0,0,2]=4 3765 B9R0.6 CCOC(C)C(C)C(=O)O Amb33427356 [0,2,0,0,0,0|1,0,1]=4 3766 B9R0.6 CCOC(C)C(N)C(=O)O Amb25887694 [0,2,0,0,0,0|1,0,1]=4 3767 B9R0.6 CCOC(C)C(O)C(=O)O Amb33425709 [0,2,0,0,0,0|0,0,2]=4 3768 B9R0.6 CCOC(C)[C@@H](N)C(=O)O Amb33065865 [0,2,0,0,0,0|1,0,1]=4 3769 B9R0.6 CCOC(C)[C@H](N)C(=O)O Amb33065957 [0,2,0,0,0,0|1,0,1]=4 3770 B9R0.6 CCON(C)C(=O)C(C)C Amb27603220 [0,2,0,0,0,0|2,0,0]=4 3771 B9R0.6 CCO[C@H](C)[C@@H](N)C(=O)O Amb22747686 [0,2,0,0,0,0|1,0,1]=4 3772 B9R0.6 CCSC(C)C(C)C(=O)O Amb27753248 [0,2,0,0,0,0|1,0,1]=4 3773 B9R0.6 CCSC(C)C(N)C(=O)O Amb26359481 [0,2,0,0,0,0|1,0,1]=4 3774 B9R0.6 CCS\C(C)=C(/C)C(=O)O Amb28436848 [0,2,0,0,0,0|1,0,1]=4 3775 B9R0.6 CN(C)C(=O)\C(F)=C\CO Amb27981025 [0,2,0,0,0,0|2,0,0]=4 3776 B9R0.6 CN(CCF)C(=O)C(=O)O Amb28314056 [0,2,0,0,0,0|1,0,0]=3 3777 B9R0.6 COCC(=O)C(N)C(C)C Amb27656120 [0,2,0,0,0,0|1,0,1]=4 3778 B9R0.6 COCC(=O)N(N)C(C)C Amb33191480 [0,2,0,0,0,0|2,0,0]=4 3779 B9R0.6 COCC(C)C(C)C(=O)O Amb26369700 [0,2,0,0,0,0|1,0,1]=4 3780 B9R0.6 COCC(C)C(N)C(=O)O Amb24116980 [0,2,0,0,0,0|1,0,1]=4 3781 B9R0.6 COCC(C)C(O)C(=O)O Amb27596283 [0,2,0,0,0,0|0,0,2]=4 3782 B9R0.6 COCC(C)[C@@H](N)C(=O)O Amb26467489 [0,2,0,0,0,0|1,0,1]=4 3783 B9R0.6 COCC(C)[C@H](N)C(=O)O Amb25729786 [0,2,0,0,0,0|1,0,1]=4 3784 B9R0.6 COCC(N)C(=O)C(C)C Amb27413188 [0,2,0,0,0,0|1,0,1]=4 3785 B9R0.6 COC\C(C)=C(/F)C(=O)O Amb27868085 [0,2,0,0,0,0|1,0,1]=4 3786 B9R0.6 CONC(=O)C(=O)C(=O)O Amb27594170 [0,2,0,0,0,0|1,0,1]=4 3787 B9R0.6 CONC(=O)C(Br)C(C)C Amb28239997 [0,2,0,0,0,0|1,0,1]=4 3788 B9R0.6 CONC(=O)C(F)=C(C)C Amb28045613 [0,2,0,0,0,0|1,0,1]=4 3789 B9R0.6 CONC(=O)C(N)C(C)C Amb28245106 [0,2,0,0,0,0|1,0,1]=4 3790 B9R0.6 CONC(=O)[C@H](O)C(C)C Amb27833456 [0,2,0,0,0,0|0,0,2]=4 3791 B9R0.6 CSCC(=O)C(=O)N(C)C Amb28381224 [0,2,0,0,0,0|1,1,0]=4 3792 B9R0.6 CSCC(C)C(N)C(=O)O Amb27161222 [0,2,0,0,0,0|1,0,1]=4 3793 B9R0.6 CSCC(C)[C@H](N)C(=O)O Amb28137881 [0,2,0,0,0,0|1,0,1]=4 3794 B9R0.6 CSC[C@@H](C)C(N)C(=O)O Amb27629392 [0,2,0,0,0,0|1,0,1]=4 3795 B9R0.6 C[C@@H](CCCl)[C@H](N)C(=O)O Amb28203940 [0,2,0,0,0,0|1,0,1]=4 3796 B9R0.6 C\C=C\C(C)C(C)C(=O)O Amb28346501 [0,2,0,0,0,0|1,0,1]=4 3797 B9R0.6 C\C=C\[C@@H](C)[C@H](Br)C(=O)O Amb27849000 [0,2,0,0,0,0|1,0,1]=4 3798 B9R0.6 C\C=C\[C@H](C)[C@H](C)C(=O)O Amb27630536 [0,2,0,0,0,0|1,0,1]=4 3799 B9R0.25 C=C(C(=O)OC)[Si](C)(C)C Amb22733754 [0,2,0,0,0,0|1,1,0]=4 3800 B9R0.25 CC(C(=O)NO)C(C)(C)C Amb27753555 [0,2,0,0,0,0|1,0,1]=4 3801 B9R0.25 CC(C)(C)C(=O)C(=O)N=O Amb27598821 [0,2,0,0,0,0|0,0,1]=3 3802 B9R0.25 CC(C)(C)C(=O)C(N)=S=O Amb27490352 [0,2,0,0,0,0|1,0,0]=3 3803 B9R0.25 CC(C)(C)C(=O)C(O)CO Amb27226904 [0,2,0,0,0,0|0,0,2]=4 3804 B9R0.25 CC(C)(C)C(=O)[C@H](N)CO Amb27447470 [0,2,0,0,0,0|1,0,1]=4 3805 B9R0.25 CC(C)(C)C(=O)\C(Cl)=N\N Amb27776898 [0,2,0,0,0,0|2,0,0]=4 3806 B9R0.25 CC(C)(C)C(=O)\C(Cl)=N\O Amb27640637 [0,2,0,0,0,0|1,0,0]=3 3807 B9R0.25 CC(C)(C)C(=O)\C(F)=C\F Amb27972937 [0,2,0,0,0,0|2,0,0]=4 3808 B9R0.25 CC(C)(C)C(N)C(=O)NO Amb24760873 [0,2,0,0,0,0|1,0,1]=4 3809 B9R0.25 CC(C=O)C(=O)C(C)(C)C Amb26900206 [0,2,0,0,0,0|1,0,1]=4 3810 B9R0.25 CCC(=O)C(=O)C(C)(C)C Amb27433533 [0,2,0,0,0,0|1,0,0]=3 3811 B9R0.25 COC(=O)C(=O)C(C)(C)C Amb24178896 [0,2,0,0,0,0|0,0,0]=2 3812 B9R0.25 COC(=O)C(=O)C(C)(C)Cl Amb26638278 [0,2,0,0,0,0|0,0,0]=2 3813 B9R0.25 COC(=O)C(=O)C(C)(C)F Amb27424849 [0,2,0,0,0,0|0,0,0]=2 3814 B9R0.25 COC(=O)C(=O)C(F)(F)F Amb2689795 [0,2,0,0,0,0|2,0,0]=4 3815 B9R0.25 COC(=O)C(Br)C(C)(C)C Amb26856421 [0,2,0,0,0,0|1,0,1]=4 3816 B9R0.25 COC(=O)C(C)C(C)(C)C Amb10558498 [0,2,0,0,0,0|1,0,1]=4 3817 B9R0.25 COC(=O)C(N)C(C)(C)C Amb2425516 [0,2,0,0,0,0|1,0,1]=4 3818 B9R0.25 COC(=O)C(N)C(C)(C)C Amb33473692 [0,2,0,0,0,0|1,0,1]=4 3819 B9R0.25 COC(=O)C(N)C(C)(C)F Amb25662650 [0,2,0,0,0,0|1,0,1]=4 3820 B9R0.25 COC(=O)C(N)C(C)(C)O Amb23399555 [0,2,0,0,0,0|1,0,1]=4 3821 B9R0.25 COC(=O)C(O)C(C)(C)C Amb27784083 [0,2,0,0,0,0|0,0,2]=4 3822 B9R0.25 COC(=O)C(O)C(C)(C)F Amb28280903 [0,2,0,0,0,0|0,0,2]=4 3823 B9R0.25 COC(=O)C(O)C(C)(C)N Amb25683764 [0,2,0,0,0,0|0,0,2]=4 3824 B9R0.25 COC(=O)C(O)C(C)(C)N Amb28555594 [0,2,0,0,0,0|0,0,2]=4 3825 B9R0.25 COC(=O)C(O)C(C)(C)S Amb28207123 [0,2,0,0,0,0|0,0,2]=4 3826 B9R0.25 COC(=O)N(N)C(C)(C)C Amb33191366 [0,2,0,0,0,0|2,0,0]=4 3827 B9R0.25 COC(=O)[C@@H](N)C(C)(C)C Amb19374784 [0,2,0,0,0,0|1,0,1]=4 3828 B9R0.25 COC(=O)[C@@H](N)C(C)(C)C Amb9824752 [0,2,0,0,0,0|1,0,1]=4 3829 B9R0.25 COC(=O)[C@@H](N)C(C)(C)F Amb28364468 [0,2,0,0,0,0|1,0,1]=4 3830 B9R0.25 COC(=O)[C@@H](N)C(C)(C)O Amb28132587 [0,2,0,0,0,0|1,0,1]=4 3831 B9R0.25 COC(=O)[C@@H](N)C(C)(C)S Amb24482143 [0,2,0,0,0,0|1,0,1]=4 3832 B9R0.25 COC(=O)[C@H](N)C(C)(C)C Amb26612833 [0,2,0,0,0,0|1,0,1]=4 3833 B9R0.25 COC(=O)[C@H](N)C(C)(C)C Amb33801635 [0,2,0,0,0,0|1,0,1]=4 3834 B9R0.25 COC(=O)[C@H](N)C(C)(C)S Amb28076574 [0,2,0,0,0,0|1,0,1]=4 3835 B9R0.25 CON(C)C(=O)C(C)(C)C Amb20673498 [0,2,0,0,0,0|2,0,0]=4 3836 B9R0.25 CSC(=O)C(=O)C(C)(C)C Amb27262732 [0,2,0,0,0,0|0,1,0]=3 3837 B9R0.25 C\C(=C(\F)C=O)C(C)(C)C Amb27164522 [0,2,0,0,0,0|2,0,0]=4 3838 B9R0.25 C\C(=C(\F)CO)C(C)(C)C Amb28050585 [0,2,0,0,0,0|2,0,0]=4 3839 B9R0.25 C\C(=C/[O-])C(=O)C(C)(C)C Amb28386119 [0,2,0,0,0,0|1,0,1]=4 3840 B9R0.25 C\C(=N/O)C(=O)C(C)(C)N Amb28130281 [0,2,0,0,0,0|1,0,0]=3 3841 B9R0.25 C\C(=N\O)C(=O)C(C)(C)C Amb27432560 [0,2,0,0,0,0|1,0,0]=3 3842 B9R0.25 O=C(CO)C(=O)C(O)(Cl)Cl Amb27839554 [0,2,0,0,0,0|2,0,0]=4 3843 B9R0.27 C=C(C(=O)OC)C(C)CO Amb25335437 [0,2,0,0,0,0|1,0,0]=3 3844 B9R0.27 C=C(C(=O)OC)C(O)CC Amb27755500 [0,2,0,0,0,0|2,0,0]=4 3845 B9R0.27 C=C(C(=O)OC)C(O)CO Amb27853545 [0,2,0,0,0,0|2,0,0]=4 3846 B9R0.27 C=C(C(=O)OC)[C@H](O)CO Amb27451995 [0,2,0,0,0,0|2,0,0]=4 3847 B9R0.27 C=C(CO)C(=O)N(C)CC Amb28138260 [0,2,0,0,0,0|2,0,0]=4 3848 B9R0.27 C=CC(=O)C(=O)C(O)CO Amb27480845 [0,2,0,0,0,0|2,0,0]=4 3849 B9R0.27 CCC(=O)C(=O)C(O)CO Amb27192499 [0,2,0,0,0,0|2,0,0]=4 3850 B9R0.27 CCC(=O)C(=O)N(C)OC Amb27433283 [0,2,0,0,0,0|2,0,0]=4 3851 B9R0.27 CCC(C)C(=O)C(=O)OC Amb25145521 [0,2,0,0,0,0|0,0,0]=2 3852 B9R0.27 CCC(C)C(=O)N(C)OC Amb20673484 [0,2,0,0,0,0|2,0,0]=4 3853 B9R0.27 CCC(C)C(Br)C(=O)OC Amb27797258 [0,2,0,0,0,0|1,0,1]=4 3854 B9R0.27 CCC(C)C(C)C(=O)OC Amb27605074 [0,2,0,0,0,0|1,0,1]=4 3855 B9R0.27 CCC(C)C(Cl)C(=O)OC Amb18800857 [0,2,0,0,0,0|1,0,1]=4 3856 B9R0.27 CCC(C)C(N)C(=O)OC Amb1154182 [0,2,0,0,0,0|1,0,1]=4 3857 B9R0.27 CCC(C)C(N)C(=O)OC Amb9703020 [0,2,0,0,0,0|1,0,1]=4 3858 B9R0.27 CCC(C)C(O)C(=O)OC Amb23596600 [0,2,0,0,0,0|0,0,2]=4 3859 B9R0.27 CCC(Cl)C(=O)C(=O)OC Amb27865418 [0,2,0,0,0,0|1,0,0]=3 3860 B9R0.27 CCN(O)C(=O)C(C)CN Amb27220768 [0,2,0,0,0,0|2,0,0]=4 3861 B9R0.27 CCN(O)C(=O)[C@H](C)NC Amb27214788 [0,2,0,0,0,0|2,0,0]=4 3862 B9R0.27 CC[C@@H](C)[C@@H](N)C(=O)OC Amb28341323 [0,2,0,0,0,0|1,0,1]=4 3863 B9R0.27 CC[C@@H](C)[C@@H](O)C(=O)OC Amb28138586 [0,2,0,0,0,0|0,0,2]=4 3864 B9R0.27 CC[C@@H](C)[C@H](O)C(=O)OC Amb27484517 [0,2,0,0,0,0|0,0,2]=4 3865 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC Amb22747221 [0,2,0,0,0,0|1,0,1]=4 3866 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC Amb28350478 [0,2,0,0,0,0|1,0,1]=4 3867 B9R0.27 CC[C@H](C)[C@H](N)C(=O)NO Amb25146430 [0,2,0,0,0,0|1,0,1]=4 3868 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC Amb533936 [0,2,0,0,0,0|1,0,1]=4 3869 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC Amb8390409 [0,2,0,0,0,0|1,0,1]=4 3870 B9R0.27 CC\C(C)=C(/N)C(=O)OC Amb27637584 [0,2,0,0,0,0|1,0,1]=4 3871 B9R0.27 COC(=O)C(=O)C(=O)OC Amb27403003 [0,2,0,0,0,0|1,0,1]=4 3872 B9R0.27 COC(=O)C(=O)C(C)C=O Amb25049149 [0,2,0,0,0,0|0,0,1]=3 3873 B9R0.27 COC(=O)C(=O)C(C)OC Amb28381261 [0,2,0,0,0,0|0,0,0]=2 3874 B9R0.27 COC(=O)C(=O)N(C)OC Amb25862751 [0,2,0,0,0,0|1,0,0]=3 3875 B9R0.27 COC(=O)C(=O)\C(C)=C\[O-] Amb27839946 [0,2,0,0,0,0|0,0,2]=4 3876 B9R0.27 COC(=O)C(C)C(C)CO Amb27945381 [0,2,0,0,0,0|1,0,1]=4 3877 B9R0.27 COC(=O)C(Cl)C(C)OC Amb24373136 [0,2,0,0,0,0|1,0,1]=4 3878 B9R0.27 COC(=O)C(Cl)C(C)SC Amb27185586 [0,2,0,0,0,0|1,0,1]=4 3879 B9R0.27 COC(=O)C(N)C(C)CO Amb33066102 [0,2,0,0,0,0|1,0,1]=4 3880 B9R0.27 COC(=O)C(N)C(C)OC Amb25111509 [0,2,0,0,0,0|1,0,1]=4 3881 B9R0.27 COC(=O)C(O)C(C)CN Amb27465415 [0,2,0,0,0,0|0,0,2]=4 3882 B9R0.27 COC(=O)N(C)C(C)CN Amb18908397 [0,2,0,0,0,0|2,0,0]=4 3883 B9R0.27 COC(=O)N(C)[C@@H](C)CN Amb27402037 [0,2,0,0,0,0|2,0,0]=4 3884 B9R0.27 COC(=O)N(C)[C@H](C)CN Amb28386328 [0,2,0,0,0,0|2,0,0]=4 3885 B9R0.27 COC(=O)[C@@H](Cl)[C@@H](C)OC Amb27233550 [0,2,0,0,0,0|1,0,1]=4 3886 B9R0.27 COC(=O)[C@@H](N)C(C)OC Amb27879002 [0,2,0,0,0,0|1,0,1]=4 3887 B9R0.27 COC(=O)[C@@H](N)[C@@H](C)OC Amb27817562 [0,2,0,0,0,0|1,0,1]=4 3888 B9R0.27 COC(=O)[C@@H](N)[C@@H](C)OC Amb33483415 [0,2,0,0,0,0|1,0,1]=4 3889 B9R0.27 COC(=O)[C@@H](N)[C@H](C)OC Amb28251917 [0,2,0,0,0,0|1,0,1]=4 3890 B9R0.27 COC(=O)[C@@H](O)[C@@H](C)OC Amb27456964 [0,2,0,0,0,0|0,0,2]=4 3891 B9R0.27 COC(=O)[C@H](Br)[C@@H](C)OC Amb28323609 [0,2,0,0,0,0|1,0,1]=4 3892 B9R0.27 COC(=O)[C@H](Cl)[C@@H](C)OC Amb27798305 [0,2,0,0,0,0|1,0,1]=4 3893 B9R0.27 COC(=O)[C@H](N)[C@@H](C)OC Amb27453476 [0,2,0,0,0,0|1,0,1]=4 3894 B9R0.27 COC(=O)[C@H](O)[C@H](C)OC Amb27752349 [0,2,0,0,0,0|0,0,2]=4 3895 B9R0.27 COC(C)C(=O)N(C)OC Amb28203910 [0,2,0,0,0,0|2,0,0]=4 3896 B9R0.27 CON(C)C(=O)C(C)SC Amb28126917 [0,2,0,0,0,0|2,0,0]=4 3897 B9R0.27 CON(C)C(=O)[C@@H](C)CO Amb27839465 [0,2,0,0,0,0|2,0,0]=4 3898 B9R0.27 C\C(CO)=C(\C)C(C)CO Amb27206070 [0,2,0,0,0,0|2,0,0]=4 3899 B9R0.27 O=C(CO)C(=O)C(O)CO Amb27458696 [0,2,0,0,0,0|1,0,0]=3 3900 B9R0.27 O=C(CO)C(=O)[C@H](O)CO Amb28126619 [0,2,0,0,0,0|1,0,0]=3 3901 B9R0.27 O=CC(O)C(=O)C(O)CO Amb27954199 [0,2,0,0,0,0|1,0,1]=4 3902 B9R0.27 O=C[C@H](O)C(=O)[C@H](O)CO Amb28428603 [0,2,0,0,0,0|1,0,1]=4 3903 B9R0.28 CC(CO)C(C)(C)C(=O)O Amb27857073 [0,2,0,0,0,0|1,0,1]=4 3904 B9R0.28 CCC(C)C(C)(C)C(=O)O Amb26861529 [0,2,0,0,0,0|1,0,1]=4 3905 B9R0.28 CCC(C)C(C)(N)C(=O)O Amb28428774 [0,2,0,0,0,0|1,0,1]=4 3906 B9R0.28 CCC(C)C(C)(N)C(=O)O Amb33733696 [0,2,0,0,0,0|1,0,1]=4 3907 B9R0.28 CCC(C)C(F)(F)C(=O)O Amb32811211 [0,2,0,0,0,0|1,0,1]=4 3908 B9R0.28 CCC(C)C(N)(N)C(=O)O Amb27759305 [0,2,0,0,0,0|1,0,1]=4 3909 B9R0.28 CCC(C)C(O)(O)C(=O)O Amb28314146 [0,2,0,0,0,0|0,0,2]=4 3910 B9R0.28 CC[C@@H](C)[C@](C)(N)C(=O)O Amb25946335 [0,2,0,0,0,0|1,0,1]=4 3911 B9R0.28 CC[C@H](C)[C@@](C)(N)C(=O)O Amb27153391 [0,2,0,0,0,0|1,0,1]=4 3912 B9R0.28 CC[C@H](C)[C@](C)(N)C(=O)O Amb24538030 [0,2,0,0,0,0|1,0,1]=4 3913 B9R0.28 COC(=O)C(C)(Br)C(C)C Amb27810643 [0,2,0,0,0,0|1,0,1]=4 3914 B9R0.28 COC(=O)C(C)(C)C(C)C Amb23589746 [0,2,0,0,0,0|1,0,1]=4 3915 B9R0.28 COC(=O)C(C)(N)C(C)C Amb18989923 [0,2,0,0,0,0|1,0,1]=4 3916 B9R0.28 COC(=O)C(C)(O)C(C)C Amb26446314 [0,2,0,0,0,0|0,0,2]=4 3917 B9R0.28 COC(=O)[C@@](C)(N)C(C)C Amb24456742 [0,2,0,0,0,0|1,0,1]=4 3918 B9R0.29 C=C(OC)C(=C=O)C(=O)O Amb28368757 [0,2,0,0,0,0|0,0,2]=4 3919 B9R0.29 CC(CN)C(CN)C(=O)O Amb27953003 [0,2,0,0,0,0|1,0,1]=4 3920 B9R0.29 CC(CO)C(C#N)C(=O)O Amb35741474 [0,2,0,0,0,0|1,0,1]=4 3921 B9R0.29 CCC(C(=O)O)C(C)CCl Amb27969167 [0,2,0,0,0,0|1,0,1]=4 3922 B9R0.29 CCC(C(=O)O)[C@@H](C)CC Amb28050112 [0,2,0,0,0,0|1,0,1]=4 3923 B9R0.29 CCC(C)C(C#N)C(=O)O Amb28072843 [0,2,0,0,0,0|1,0,1]=4 3924 B9R0.29 CCC(C)C(CN)C(=O)O Amb25978406 [0,2,0,0,0,0|1,0,1]=4 3925 B9R0.29 CCC(C)C(N=O)C(=O)O Amb28119173 [0,2,0,0,0,0|0,0,1]=3 3926 B9R0.29 CCC(C)C(NC)C(=O)O Amb33551329 [0,2,0,0,0,0|1,0,1]=4 3927 B9R0.29 CCC(C)C(NC)C(=O)O Amb4018745 [0,2,0,0,0,0|1,0,1]=4 3928 B9R0.29 CCC(C)C(NS)C(=O)O Amb27876164 [0,2,0,0,0,0|0,1,1]=4 3929 B9R0.29 CCC(C)C(OC)C(=O)O Amb24563898 [0,2,0,0,0,0|0,0,2]=4 3930 B9R0.29 CCC(C)C(ON)C(=O)O Amb27494007 [0,2,0,0,0,0|0,0,2]=4 3931 B9R0.29 CCC(C)[C@H](NC)C(=O)O Amb27390153 [0,2,0,0,0,0|1,0,1]=4 3932 B9R0.29 CCC(C)\C(=N\O)C(=O)O Amb27881720 [0,2,0,0,0,0|0,0,1]=3 3933 B9R0.29 CCC(C)\C(=N\O)C(C)=O Amb28052556 [0,2,0,0,0,0|1,0,1]=4 3934 B9R0.29 CC[C@H](C)[C@@H](OC)C(=O)O Amb28239702 [0,2,0,0,0,0|0,0,2]=4 3935 B9R0.29 CC[C@H](C)[C@H](CC)C(=O)O Amb28340911 [0,2,0,0,0,0|1,0,1]=4 3936 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O Amb16183967 [0,2,0,0,0,0|1,0,1]=4 3937 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O Amb22747123 [0,2,0,0,0,0|1,0,1]=4 3938 B9R0.29 CC\C(C(=O)O)=C(\C)CCl Amb27167671 [0,2,0,0,0,0|1,0,1]=4 3939 B9R0.29 CC\C(O)=C(/N=O)C(=O)O Amb27823209 [0,2,0,0,0,0|1,0,1]=4 3940 B9R0.29 CNC(C(=O)O)C(C)OC Amb24117895 [0,2,0,0,0,0|1,0,1]=4 3941 B9R0.29 CNC(C(=O)OC)C(C)C Amb9239395 [0,2,0,0,0,0|1,0,1]=4 3942 B9R0.29 CN[C@@H](C(=O)O)[C@@H](C)OC Amb33347469 [0,2,0,0,0,0|1,0,1]=4 3943 B9R0.29 CN[C@@H](C(=O)OC)C(C)C Amb22745354 [0,2,0,0,0,0|1,0,1]=4 3944 B9R0.29 CN[C@H](C(=O)OC)C(C)C Amb16183826 [0,2,0,0,0,0|1,0,1]=4 3945 B9R0.29 CN[C@H](C(=O)OC)C(C)C Amb33813302 [0,2,0,0,0,0|1,0,1]=4 3946 B9R0.29 COC(=O)C(C#N)=C(C)C Amb4016375 [0,2,0,0,0,0|1,0,1]=4 3947 B9R0.29 COC(=O)C(C#N)C(C)C Amb18643719 [0,2,0,0,0,0|1,0,1]=4 3948 B9R0.29 COC(=O)C(C=O)C(C)C Amb18644091 [0,2,0,0,0,0|0,0,1]=3 3949 B9R0.29 COC(=O)C(CCl)=C(C)C Amb27479089 [0,2,0,0,0,0|1,0,1]=4 3950 B9R0.29 COC(=O)C(CCl)C(C)C Amb27969166 [0,2,0,0,0,0|1,0,1]=4 3951 B9R0.29 COC(=O)C(CN)C(C)C Amb25744585 [0,2,0,0,0,0|1,0,1]=4 3952 B9R0.29 COC(=O)C(CO)C(C)C Amb27161897 [0,2,0,0,0,0|0,0,2]=4 3953 B9R0.29 COC(=O)C(NN)C(C)C Amb27867029 [0,2,0,0,0,0|1,0,1]=4 3954 B9R0.29 COC(=O)C(ON)C(C)C Amb32660228 [0,2,0,0,0,0|0,0,2]=4 3955 B9R0.29 COC(=O)[C@@H](CO)C(C)C Amb27617037 [0,2,0,0,0,0|0,0,2]=4 3956 B9R0.29 COC(=O)[C@H](CN)C(C)C Amb27468636 [0,2,0,0,0,0|1,0,1]=4 3957 B9R0.29 COC(=O)\C(=C\O)C(C)C Amb27399789 [0,2,0,0,0,0|0,0,1]=3 3958 B9R0.29 COC(=O)\C(=N\O)C(C)O Amb27457855 [0,2,0,0,0,0|1,0,1]=4 3959 B9R0.29 COC(C(=O)NO)C(C)C Amb27752732 [0,2,0,0,0,0|0,0,2]=4 3960 B9R0.29 CO\C(C)=C(/C#N)C(=O)O Amb28050427 [0,2,0,0,0,0|1,0,1]=4 3961 B9R0.29 C\C=C(\C(=O)OC)[C@@H](C)O Amb28292206 [0,2,0,0,0,0|2,0,0]=4 3962 B9R0.29 C\C=C(\C)C(=C=N)C(=O)O Amb27402759 [0,2,0,0,0,0|1,0,1]=4 3963 B9R0.29 [C-]#[N+]C(C(=O)OC)C(C)C Amb2689490 [0,2,0,0,0,0|1,0,1]=4 3964 B9R0.29 [C-]#[N+][C@@H](C(=O)OC)C(C)C Amb33747507 [0,2,0,0,0,0|1,0,1]=4 3965 B9R0.29 [C-]#[N+][C@H](C(=O)OC)C(C)C Amb33747506 [0,2,0,0,0,0|1,0,1]=4 3966 B9R0.32 C#CC(C)(C)C(N)C(=O)O Amb27967135 [0,2,0,0,0,0|1,0,1]=4 3967 B9R0.32 C=C(C(=O)O)C(C)(C)CC Amb33266326 [0,2,0,0,0,0|1,0,0]=3 3968 B9R0.32 C=C(C(=O)O)C(C)(C)CO Amb33197717 [0,2,0,0,0,0|1,0,0]=3 3969 B9R0.32 C=C(C)C(=O)C(C)(C)CN Amb27617205 [0,2,0,0,0,0|2,0,0]=4 3970 B9R0.32 C=CC(C)(C)C(=C)C(C)=O Amb27945515 [0,2,0,0,0,0|2,0,0]=4 3971 B9R0.32 C=CC(C)(C)[C@H](N)C(=O)O Amb26904663 [0,2,0,0,0,0|1,0,1]=4 3972 B9R0.32 C=CC(F)(F)C(=O)C(=O)O Amb28139407 [0,2,0,0,0,0|1,0,1]=4 3973 B9R0.32 CC(C(=O)O)C(C)(C)CO Amb33200362 [0,2,0,0,0,0|1,0,1]=4 3974 B9R0.32 CC(C)(CCl)[C@H](N)C(=O)O Amb27879456 [0,2,0,0,0,0|1,0,1]=4 3975 B9R0.32 CC(C)(CF)C(=O)C(=O)O Amb27220438 [0,2,0,0,0,0|0,0,0]=2 3976 B9R0.32 CC(C)(CF)C(N)C(=O)O Amb33376924 [0,2,0,0,0,0|1,0,1]=4 3977 B9R0.32 CC(C)(CF)C(O)C(=O)O Amb33376921 [0,2,0,0,0,0|0,0,2]=4 3978 B9R0.32 CC(C)(CN)C(O)C(=O)O Amb533284 [0,2,0,0,0,0|0,0,2]=4 3979 B9R0.32 CC(C)(CN)[C@H](O)C(=O)O Amb27174464 [0,2,0,0,0,0|0,0,2]=4 3980 B9R0.32 CC(C)(CO)C(=O)C(=O)O Amb27465183 [0,2,0,0,0,0|0,0,0]=2 3981 B9R0.32 CC(C)(CO)C(N)C(=O)O Amb17593671 [0,2,0,0,0,0|1,0,1]=4 3982 B9R0.32 CC(C)(CO)C(O)C(=O)O Amb18644357 [0,2,0,0,0,0|0,0,2]=4 3983 B9R0.32 CC(C)(CO)[C@@H](O)C(=O)O Amb27815004 [0,2,0,0,0,0|0,0,2]=4 3984 B9R0.32 CC(C)(CO)[C@H](O)C(=O)O Amb27397678 [0,2,0,0,0,0|0,0,2]=4 3985 B9R0.32 CC(C)(CS)C(N)C(=O)O Amb25889914 [0,2,0,0,0,0|1,0,1]=4 3986 B9R0.32 CC(C)C(=O)C(C)(C)CO Amb25096499 [0,2,0,0,0,0|1,0,1]=4 3987 B9R0.32 CCC(C)(C)C(=O)C(=O)O Amb10569501 [0,2,0,0,0,0|0,0,0]=2 3988 B9R0.32 CCC(C)(C)C(C)C(=O)O Amb26991539 [0,2,0,0,0,0|1,0,1]=4 3989 B9R0.32 CCC(C)(C)C(N)C(=O)O Amb27750376 [0,2,0,0,0,0|1,0,1]=4 3990 B9R0.32 CCC(C)(C)C(N)C(=O)O Amb28555548 [0,2,0,0,0,0|1,0,1]=4 3991 B9R0.32 CCC(C)(C)C(O)C(=O)O Amb26603809 [0,2,0,0,0,0|0,0,2]=4 3992 B9R0.32 CCC(C)(C)[C@@H](C)C(=O)O Amb33727263 [0,2,0,0,0,0|1,0,1]=4 3993 B9R0.32 CCC(C)(C)[C@H](C)C(=O)O Amb33744638 [0,2,0,0,0,0|1,0,1]=4 3994 B9R0.32 CCC(C)(C)[C@H](N)C(=O)O Amb34916559 [0,2,0,0,0,0|1,0,1]=4 3995 B9R0.32 CCC(C)(F)C(N)C(=O)O Amb28399318 [0,2,0,0,0,0|1,0,1]=4 3996 B9R0.32 CCC(C)(N)C(C)C(=O)O Amb33036321 [0,2,0,0,0,0|1,0,1]=4 3997 B9R0.32 CCC(C)(N)C(O)C(=O)O Amb27389918 [0,2,0,0,0,0|0,0,2]=4 3998 B9R0.32 CCC(C)(O)C(=O)C(=O)O Amb22731859 [0,2,0,0,0,0|0,0,0]=2 3999 B9R0.32 CCC(C)(O)C(C)C(=O)O Amb18990593 [0,2,0,0,0,0|1,0,1]=4 4000 B9R0.32 CCC(C)(O)C(Cl)C(=O)O Amb27184930 [0,2,0,0,0,0|1,0,1]=4 4001 B9R0.32 CCC(C)(O)C(O)C(=O)O Amb27810824 [0,2,0,0,0,0|0,0,2]=4 4002 B9R0.32 CC[C@@](C)(O)C(=O)C(=O)O Amb27952470 [0,2,0,0,0,0|0,0,0]=2 4003 B9R0.32 CC[C@@](C)(S)[C@H](N)C(=O)O Amb28067632 [0,2,0,0,0,0|1,0,1]=4 4004 B9R0.32 CC[C@](C)(O)[C@H](O)C(=O)O Amb27615052 [0,2,0,0,0,0|0,0,2]=4 4005 B9R0.32 CN(O)C(=O)C(C)(C)CN Amb27620122 [0,2,0,0,0,0|2,0,0]=4 4006 B9R0.32 CNC(C)(C)C(=O)N(C)O Amb28134995 [0,2,0,0,0,0|2,0,0]=4 4007 B9R0.32 CNC(C)(C)C(O)C(=O)O Amb27411390 [0,2,0,0,0,0|0,0,2]=4 4008 B9R0.32 COC(C)(C)C(Br)C(=O)O Amb10070092 [0,2,0,0,0,0|1,0,1]=4 4009 B9R0.32 COC(C)(C)C(C)C(=O)O Amb27247404 [0,2,0,0,0,0|1,0,1]=4 4010 B9R0.32 COC(C)(C)C(N)C(=O)O Amb10070091 [0,2,0,0,0,0|1,0,1]=4 4011 B9R0.32 COC(C)(C)C(O)C(=O)O Amb27830980 [0,2,0,0,0,0|0,0,2]=4 4012 B9R0.32 COC(C)(C)C(S)C(=O)O Amb28436888 [0,2,0,0,0,0|0,1,1]=4 4013 B9R0.32 COC(C)(C)[C@@H](N)C(=O)O Amb28250822 [0,2,0,0,0,0|1,0,1]=4 4014 B9R0.32 CSC(C)(C)C(Cl)C(=O)O Amb27863425 [0,2,0,0,0,0|1,0,1]=4 4015 B9R0.32 CSC(C)(C)[C@@H](N)C(=O)O Amb24482204 [0,2,0,0,0,0|1,0,1]=4 4016 B9R0.32 C[C@@](O)(CF)[C@@H](N)C(=O)O Amb24627279 [0,2,0,0,0,0|1,0,1]=4 4017 B9R0.32 C[C@@](O)(CF)[C@H](N)C(=O)O Amb27810949 [0,2,0,0,0,0|1,0,1]=4 4018 B9R0.32 C[C@](O)(CN)[C@H](O)C(=O)O Amb25701236 [0,2,0,0,0,0|0,0,2]=4 4019 B9R0.41 C=C(C(=O)O)C(CC)CC Amb33313766 [0,2,0,0,0,0|1,0,0]=3 4020 B9R0.41 C=C(C(=O)O)C(CC)OC Amb25757932 [0,2,0,0,0,0|1,0,0]=3 4021 B9R0.41 C=C(C(=O)O)C(OC)OC Amb33281755 [0,2,0,0,0,0|1,0,0]=3 4022 B9R0.41 C=C(C(N)=O)C(CC)OC Amb27759793 [0,2,0,0,0,0|2,0,0]=4 4023 B9R0.41 C=C(C)C(=O)C(CC)CC Amb27455170 [0,2,0,0,0,0|2,0,0]=4 4024 B9R0.41 C=C\C(=C\C)C(=O)C(=O)O Amb27631431 [0,2,0,0,0,0|0,0,2]=4 4025 B9R0.41 CCC(CC)=C(F)C(=O)O Amb27493847 [0,2,0,0,0,0|1,0,1]=4 4026 B9R0.41 CCC(CC)C(=O)C(=O)O Amb25085109 [0,2,0,0,0,0|0,0,0]=2 4027 B9R0.41 CCC(CC)C(=O)C(C)O Amb27490808 [0,2,0,0,0,0|1,0,1]=4 4028 B9R0.41 CCC(CC)C(C)C(=O)O Amb18831490 [0,2,0,0,0,0|1,0,1]=4 4029 B9R0.41 CCC(CC)C(N)C(=O)O Amb19375421 [0,2,0,0,0,0|1,0,1]=4 4030 B9R0.41 CCC(CC)C(N)C(=O)O Amb4134815 [0,2,0,0,0,0|1,0,1]=4 4031 B9R0.41 CCC(CC)C(O)C(=O)O Amb19013419 [0,2,0,0,0,0|0,0,2]=4 4032 B9R0.41 CCC(CC)[C@@H](C)C(=O)O Amb33730913 [0,2,0,0,0,0|1,0,1]=4 4033 B9R0.41 CCC(CC)[C@@H](N)C(=O)O Amb17612760 [0,2,0,0,0,0|1,0,1]=4 4034 B9R0.41 CCC(CC)[C@H](C)C(=O)O Amb25255941 [0,2,0,0,0,0|1,0,1]=4 4035 B9R0.41 CCC(CC)[C@H](N)C(=O)O Amb17612761 [0,2,0,0,0,0|1,0,1]=4 4036 B9R0.41 CCC(CF)C(N)C(=O)O Amb28290093 [0,2,0,0,0,0|1,0,1]=4 4037 B9R0.41 CCC(CN)C(O)C(=O)O Amb24700895 [0,2,0,0,0,0|0,0,2]=4 4038 B9R0.41 CCC(OC)C(=O)C(=O)O Amb33320140 [0,2,0,0,0,0|0,0,0]=2 4039 B9R0.41 CCC(OC)C(=O)C(C)C Amb28461235 [0,2,0,0,0,0|1,0,1]=4 4040 B9R0.41 CCC(OC)C(C)C(=O)O Amb27413515 [0,2,0,0,0,0|1,0,1]=4 4041 B9R0.41 CCC(OC)C(N)C(=O)O Amb24381341 [0,2,0,0,0,0|1,0,1]=4 4042 B9R0.41 CCC(OC)C(O)C(=O)O Amb25695288 [0,2,0,0,0,0|0,0,2]=4 4043 B9R0.41 CCN(CC)C(=O)C(=O)O Amb9238091 [0,2,0,0,0,0|1,0,0]=3 4044 B9R0.41 CCN(CC)C(=O)C(C)=O Amb17399881 [0,2,0,0,0,0|2,0,0]=4 4045 B9R0.41 CCN(CC)C(=O)C(O)=S Amb27470752 [0,2,0,0,0,0|1,1,0]=4 4046 B9R0.41 CC[C@H](CF)[C@H](N)C(=O)O Amb28077201 [0,2,0,0,0,0|1,0,1]=4 4047 B9R0.41 CC[C@H](OC)[C@H](N)C(=O)O Amb27779324 [0,2,0,0,0,0|1,0,1]=4 4048 B9R0.41 CN(C)C(=O)\C(C#N)=N\O Amb27843431 [0,2,0,0,0,0|2,0,0]=4 4049 B9R0.41 COC(CO)C(O)C(=O)O Amb27790653 [0,2,0,0,0,0|0,0,2]=4 4050 B9R0.41 COC(OC)C(=O)C(C)C Amb27750392 [0,2,0,0,0,0|0,0,2]=4 4051 B9R0.41 COC(OC)C(C)C(=O)O Amb24401121 [0,2,0,0,0,0|1,0,1]=4 4052 B9R0.41 COC(OC)C(N)C(=O)O Amb27443034 [0,2,0,0,0,0|1,0,1]=4 4053 B9R0.41 COC(OC)C(O)C(=O)O Amb33342039 [0,2,0,0,0,0|0,0,2]=4 4054 B9R0.41 CO[C@H](CO)[C@@H](O)C(=O)O Amb28137968 [0,2,0,0,0,0|0,0,2]=4 4055 B9R0.41 CS\C(=N/O)C(=O)N(C)C Amb17618934 [0,2,0,0,0,0|1,1,0]=4 4056 B9R0.41 CS\C(=N\O)C(=O)N(C)C Amb24702513 [0,2,0,0,0,0|1,1,0]=4 4057 B9R0.41 N[C@H](C(=O)O)C(CO)CO Amb27655595 [0,2,0,0,0,0|1,0,1]=4 4058 B9R0.33 C=CCC(C(=O)O)C(C)C Amb18643926 [0,2,0,0,0,0|1,0,1]=4 4059 B9R0.33 C=C\C=C(\C(=O)O)C(C)C Amb28050067 [0,2,0,0,0,0|1,0,0]=3 4060 B9R0.33 CC(=O)[C@@H](N=C=O)C(C)C Amb27455074 [0,2,0,0,0,0|1,0,1]=4 4061 B9R0.33 CC(C)C(CC#N)C(=O)O Amb35711779 [0,2,0,0,0,0|1,0,1]=4 4062 B9R0.33 CC(C)C(CCF)C(=O)O Amb27837856 [0,2,0,0,0,0|1,0,1]=4 4063 B9R0.33 CC(C)C(CCN)C(=O)O Amb22371125 [0,2,0,0,0,0|1,0,1]=4 4064 B9R0.33 CC(C)C(CCN)C(=O)O Amb24426418 [0,2,0,0,0,0|1,0,1]=4 4065 B9R0.33 CC(C)C(N=C=O)C(=O)O Amb25952521 [0,2,0,0,0,0|0,0,1]=3 4066 B9R0.33 CC(C)C(N=C=S)C(=O)O Amb33471521 [0,2,0,0,0,0|0,1,1]=4 4067 B9R0.33 CC(C)C(NC#N)C(=O)O Amb30030789 [0,2,0,0,0,0|1,0,1]=4 4068 B9R0.33 CC(C)C(NC=O)C(=O)O Amb4018743 [0,2,0,0,0,0|0,0,1]=3 4069 B9R0.33 CC(C)C(NN=O)C(=O)O Amb28198835 [0,2,0,0,0,0|0,0,1]=3 4070 B9R0.33 CC(C)[C@@H](N=C=O)C(=O)O Amb33471340 [0,2,0,0,0,0|0,0,1]=3 4071 B9R0.33 CC(C)[C@@H](N=C=S)C(=O)O Amb33471569 [0,2,0,0,0,0|0,1,1]=4 4072 B9R0.33 CC(C)[C@@H](N=[N+]=[N-])C(=O)O Amb32620196 [0,2,0,0,0,0|1,0,1]=4 4073 B9R0.33 CC(C)[C@@H](NC#N)C(=O)O Amb30030642 [0,2,0,0,0,0|1,0,1]=4 4074 B9R0.33 CC(C)[C@@H](NC=O)C(=O)O Amb22745192 [0,2,0,0,0,0|0,0,1]=3 4075 B9R0.33 CC(C)[C@H](N=C=O)C(=O)O Amb33471334 [0,2,0,0,0,0|0,0,1]=3 4076 B9R0.33 CC(C)[C@H](N=C=S)C(=O)O Amb33471564 [0,2,0,0,0,0|0,1,1]=4 4077 B9R0.33 CC(C)[C@H](N=[N+]=[N-])C(=O)O Amb32620170 [0,2,0,0,0,0|1,0,1]=4 4078 B9R0.33 CC(C)[C@H](NC#N)C(=O)O Amb30030779 [0,2,0,0,0,0|1,0,1]=4 4079 B9R0.33 CC(C)[C@H](NC=O)C(=O)O Amb4018781 [0,2,0,0,0,0|0,0,1]=3 4080 B9R0.33 CC(C)[C@H](NN=O)C(=O)O Amb27810805 [0,2,0,0,0,0|0,0,1]=3 4081 B9R0.33 CC(C)\C(=N\C=O)C(=O)O Amb28429778 [0,2,0,0,0,0|0,0,0]=2 4082 B9R0.33 CCCC(C(=O)O)C(C)C Amb17616275 [0,2,0,0,0,0|1,0,1]=4 4083 B9R0.33 CCNC(C(=O)O)C(C)C Amb19514760 [0,2,0,0,0,0|1,0,1]=4 4084 B9R0.33 CCNC(C(=O)O)C(C)C Amb9327924 [0,2,0,0,0,0|1,0,1]=4 4085 B9R0.33 CCN[C@@H](C(=O)O)C(C)C Amb33347482 [0,2,0,0,0,0|1,0,1]=4 4086 B9R0.33 CCN[C@H](C(=O)O)C(C)C Amb25230589 [0,2,0,0,0,0|1,0,1]=4 4087 B9R0.33 CCOC(C(=O)O)C(C)C Amb6267583 [0,2,0,0,0,0|0,0,2]=4 4088 B9R0.33 CCSC(C(=O)O)C(C)C Amb6680206 [0,2,0,0,0,0|0,1,1]=4 4089 B9R0.33 COCC(C(=O)O)C(C)C Amb26443509 [0,2,0,0,0,0|0,0,2]=4 4090 B9R0.33 CO\C=C(\C(=O)O)C(C)C Amb27837143 [0,2,0,0,0,0|0,0,1]=3 4091 B9R0.33 CSCC(C(=O)O)C(C)C Amb27639484 [0,2,0,0,0,0|0,1,1]=4 4092 B9R0.33 C\C=C\C(C(=O)O)C(C)C Amb18643944 [0,2,0,0,0,0|1,0,1]=4 4093 B9R0.33 C\C=N\[C@H](C(=O)O)C(C)C Amb27831817 [0,2,0,0,0,0|1,0,1]=4 4094 B9R0.54 C=C(C)C(C(=O)O)C(C)C Amb18643917 [0,2,0,0,0,0|1,0,1]=4 4095 B9R0.54 C=C(C)[C@H](C(=O)O)C(C)C Amb27222321 [0,2,0,0,0,0|1,0,1]=4 4096 B9R0.54 CC(=O)C(C(C)=O)=S(C)C Amb28381112 [0,2,0,0,0,0|2,0,0]=4 4097 B9R0.54 CC(=O)C(C(C)=O)C(C)C Amb17689200 [0,2,0,0,0,0|1,0,1]=4 4098 B9R0.54 CC(=O)C(C(N)=O)C(C)C Amb27618094 [0,2,0,0,0,0|1,0,1]=4 4099 B9R0.54 CC(=O)\C(=C(/C)O)C(C)C Amb27833903 [0,2,0,0,0,0|1,0,0]=3 4100 B9R0.54 CC(C)=C(C(=O)O)C(=O)O Amb18644067 [0,2,0,0,0,0|0,0,1]=3 4101 B9R0.54 CC(C)=C(C(N)=O)C(=O)O Amb28240353 [0,2,0,0,0,0|0,0,1]=3 4102 B9R0.54 CC(C)C(C(=O)O)C(=O)O Amb2689019 [0,2,0,0,0,0|0,0,1]=3 4103 B9R0.54 CC(C)C(C(=O)O)C(C)C Amb17593626 [0,2,0,0,0,0|1,0,1]=4 4104 B9R0.54 CC(C)C(C(=O)O)C(C)N Amb24420001 [0,2,0,0,0,0|1,0,1]=4 4105 B9R0.54 CC(C)C(C(=O)O)C(C)N Amb28555623 [0,2,0,0,0,0|1,0,1]=4 4106 B9R0.54 CC(C)C(C(=O)O)C(C)O Amb18990640 [0,2,0,0,0,0|0,0,2]=4 4107 B9R0.54 CC(C)C(C(=O)O)C(F)F Amb33006059 [0,2,0,0,0,0|1,0,1]=4 4108 B9R0.54 CC(C)C(C(=O)O)N(C)C Amb19343274 [0,2,0,0,0,0|1,0,1]=4 4109 B9R0.54 CC(C)C(C(=O)O)N(C)C Amb6619070 [0,2,0,0,0,0|1,0,1]=4 4110 B9R0.54 CC(C)C(C(=O)O)N(C)Cl Amb28251094 [0,2,0,0,0,0|1,0,1]=4 4111 B9R0.54 CC(C)C(C(N)=O)C(=O)O Amb28050146 [0,2,0,0,0,0|0,0,1]=3 4112 B9R0.54 CC(C)C(C(N)=O)C(N)=O Amb27230644 [0,2,0,0,0,0|1,0,1]=4 4113 B9R0.54 CC(C)[C@@H](C(=O)O)N(C)C Amb8630219 [0,2,0,0,0,0|1,0,1]=4 4114 B9R0.54 CC(C)[C@H](C(=O)O)N(C)C Amb24053107 [0,2,0,0,0,0|1,0,1]=4 4115 B9R0.54 CC(C)[C@H](C(=O)O)N(C)C Amb34913643 [0,2,0,0,0,0|1,0,1]=4 4116 B9R0.54 C\C(Cl)=C(/C(=O)O)C(C)C Amb27239684 [0,2,0,0,0,0|1,0,0]=3 4117 B9R0.54 C\C(Cl)=C(\C(=O)O)C(C)C Amb28208572 [0,2,0,0,0,0|1,0,0]=3 4118 B9R0.72 C=CC(C(=O)O)C(C)(C)C Amb27839076 [0,2,0,0,0,0|1,0,1]=4 4119 B9R0.72 CC(=O)\C(=N/O)C(C)(C)N Amb27619212 [0,2,0,0,0,0|1,0,1]=4 4120 B9R0.72 CC(C)(C)C(CF)C(=O)O Amb28140824 [0,2,0,0,0,0|1,0,1]=4 4121 B9R0.72 CC(C)(C)C(CN)C(=O)O Amb22745168 [0,2,0,0,0,0|1,0,1]=4 4122 B9R0.72 CC(C)(C)C(CN)C(=O)O Amb34140533 [0,2,0,0,0,0|1,0,1]=4 4123 B9R0.72 CC(C)(C)C(CO)C(=O)O Amb28050066 [0,2,0,0,0,0|0,0,2]=4 4124 B9R0.72 CC(C)(C)C(NN)C(=O)O Amb27413490 [0,2,0,0,0,0|1,0,1]=4 4125 B9R0.72 CC(C)(C)C(ON)C(=O)O Amb28121246 [0,2,0,0,0,0|0,0,2]=4 4126 B9R0.72 CC(C)(C)[C@@H](NN)C(=O)O Amb27790437 [0,2,0,0,0,0|1,0,1]=4 4127 B9R0.72 CC(C)(C)[C@H](CN)C(=O)O Amb26629662 [0,2,0,0,0,0|1,0,1]=4 4128 B9R0.72 CC(C)(C)[C@H](CO)C(=O)O Amb27787642 [0,2,0,0,0,0|0,0,2]=4 4129 B9R0.72 CC(C)(C)\C(=C\Br)C(=O)O Amb28079199 [0,2,0,0,0,0|1,0,0]=3 4130 B9R0.72 CC(C)(F)C(CN)C(=O)O Amb33273751 [0,2,0,0,0,0|1,0,1]=4 4131 B9R0.72 CCC(C(=O)O)C(C)(C)C Amb18124683 [0,2,0,0,0,0|1,0,1]=4 4132 B9R0.72 CCC(C(=O)O)C(C)(C)F Amb24756885 [0,2,0,0,0,0|1,0,1]=4 4133 B9R0.72 CCC(C(=O)O)C(C)(C)N Amb26857945 [0,2,0,0,0,0|1,0,1]=4 4134 B9R0.72 CCC(C(=O)O)C(C)(C)O Amb18990620 [0,2,0,0,0,0|1,0,1]=4 4135 B9R0.72 CNC(C(=O)O)C(C)(C)C Amb18975753 [0,2,0,0,0,0|1,0,1]=4 4136 B9R0.72 CNC(C(=O)O)C(C)(C)O Amb18644319 [0,2,0,0,0,0|1,0,1]=4 4137 B9R0.72 CNC(C(=O)O)C(C)(C)S Amb27772393 [0,2,0,0,0,0|1,0,1]=4 4138 B9R0.72 CN[C@@H](C(=O)O)C(C)(C)C Amb24117092 [0,2,0,0,0,0|1,0,1]=4 4139 B9R0.72 CN[C@@H](C(=O)O)C(C)(C)S Amb28291638 [0,2,0,0,0,0|1,0,1]=4 4140 B9R0.72 CN[C@H](C(=O)O)C(C)(C)C Amb27615056 [0,2,0,0,0,0|1,0,1]=4 4141 B9R0.72 CN[C@H](C(=O)O)C(C)(C)O Amb27252117 [0,2,0,0,0,0|1,0,1]=4 4142 B9R0.72 COC(C(=O)O)C(C)(C)C Amb24382480 [0,2,0,0,0,0|0,0,2]=4 4143 B9R0.72 CO[C@H](C(=O)O)C(C)(C)C Amb25864953 [0,2,0,0,0,0|0,0,2]=4 4144 B9R0.72 CSC(C(=O)O)C(C)(C)C Amb28145113 [0,2,0,0,0,0|0,1,1]=4 4145 B9R0.72 [C-]#[N+]C(C(=O)O)C(C)(C)C Amb27786900 [0,2,0,0,0,0|1,0,1]=4 4146 B9R0.76 CC(C)C(C)(CO)C(=O)O Amb27849972 [0,2,0,0,0,0|0,0,2]=4 4147 B9R0.76 CC(C)C(F)(CN)C(=O)O Amb25135307 [0,2,0,0,0,0|1,0,1]=4 4148 B9R0.76 CC(C)C(N)(CN)C(=O)O Amb27667118 [0,2,0,0,0,0|1,0,1]=4 4149 B9R0.76 CC(C)C(N)(CO)C(=O)O Amb8515984 [0,2,0,0,0,0|0,0,2]=4 4150 B9R0.76 CC(C)C(O)(CO)C(=O)O Amb27461352 [0,2,0,0,0,0|0,0,2]=4 4151 B9R0.76 CC(C)[C@@](N)(CN)C(=O)O Amb27468639 [0,2,0,0,0,0|1,0,1]=4 4152 B9R0.76 CC(C)[C@](C)(C#N)C(=O)O Amb27241345 [0,2,0,0,0,0|1,0,1]=4 4153 B9R0.76 CC(C)[C@](N)(CO)C(=O)O Amb25103828 [0,2,0,0,0,0|0,0,2]=4 4154 B9R0.76 CCC(N)(C(=O)O)C(C)C Amb24460296 [0,2,0,0,0,0|1,0,1]=4 4155 B9R0.76 CCC(O)(C(=O)O)C(C)C Amb24459544 [0,2,0,0,0,0|0,0,2]=4 4156 B9R0.80 CC(C)(C)C(C)(C)C(=O)O Amb18124686 [0,2,0,0,0,0|1,0,1]=4 4157 B9R0.80 CC(C)(C)C(C)(F)C(=O)O Amb27847029 [0,2,0,0,0,0|1,0,1]=4 4158 B9R0.80 CC(C)(C)C(C)(N)C(=O)O Amb33856589 [0,2,0,0,0,0|1,0,1]=4 4159 B9R0.80 CC(C)(C)C(C)(O)C(=O)O Amb18644262 [0,2,0,0,0,0|0,0,2]=4 4160 B9R0.80 CC(C)(C)[C@@](C)(N)C(=O)O Amb28143043 [0,2,0,0,0,0|1,0,1]=4 4161 B9R0.80 CC(C)(C)[C@@](C)(O)C(=O)O Amb28182896 [0,2,0,0,0,0|0,0,2]=4 4162 B9R0.80 CC(C)(C)[C@](C)(O)C(=O)O Amb27759796 [0,2,0,0,0,0|0,0,2]=4 4163 B9R0.80 CC(C)(F)C(C)(C)C(=O)O Amb26013877 [0,2,0,0,0,0|1,0,1]=4 4164 B9R0.80 CC(C)(F)C(C)(F)C(=O)O Amb33743294 [0,2,0,0,0,0|1,0,1]=4 4165 B9R0.80 CC(C)(F)C(F)(F)C(=O)O Amb33410095 [0,2,0,0,0,0|1,0,1]=4 4166 B9R0.80 CC(C)(N)C(C)(C)C(=O)O Amb19283404 [0,2,0,0,0,0|1,0,1]=4 4167 B9R0.80 CC(C)(N)C(C)(C)C(=O)O Amb9782738 [0,2,0,0,0,0|1,0,1]=4 4168 B9R0.80 CC(C)(O)C(C)(C)C(=O)O Amb18281599 [0,2,0,0,0,0|1,0,1]=4 4169 B9R0.80 CC(C)(O)C(C)(O)C(=O)O Amb27975752 [0,2,0,0,0,0|0,0,2]=4 4170 B9R0.80 CC(C)(O)C(F)(F)C(=O)O Amb18796751 [0,2,0,0,0,0|1,0,1]=4 4171 B9R0.80 CC(C)(O)[C@@](C)(N)C(=O)O Amb25117586 [0,2,0,0,0,0|1,0,1]=4 4172 B9R0.80 CC(C)(O)[C@](C)(N)C(=O)O Amb28135986 [0,2,0,0,0,0|1,0,1]=4 4173 B9R0.80 CC(C)(S)C(C)(O)C(=O)O Amb27592186 [0,2,0,0,0,0|0,0,2]=4 4174 B9R0.80 CC(C)(S)[C@@](C)(N)C(=O)O Amb9786787 [0,2,0,0,0,0|1,0,1]=4 4175 B7R1.2 CC1=CC(=O)CC1 Amb6608696 [1,0,0,1,0,0|1,0,1]=4 4176 B7R1.2 CC1=CC(=O)NC1 Amb24479892 [1,0,0,1,0,0|1,0,1]=4 4177 B7R1.2 CC1=CC(=O)OC1 Amb22002703 [1,0,0,1,0,0|0,0,1]=3 4178 B7R1.2 CC1=CC(C)CC1 Amb24479860 [1,0,0,1,0,0|2,0,0]=4 4179 B7R1.2 CC1=NC(C)CO1 Amb9805507 [1,0,0,1,0,0|2,0,0]=4 4180 B7R1.2 CC1CCC(=O)C1 Amb8513672 [1,0,0,1,0,0|1,0,1]=4 4181 B7R1.2 CC1CCC(=O)N1 Amb19267101 [1,0,0,1,0,0|2,0,0]=4 4182 B7R1.2 CC1CCC(=O)O1 Amb6298321 [1,0,0,1,0,0|2,0,0]=4 4183 B7R1.2 CC1CCC(=O)S1 Amb27252897 [1,0,0,1,0,0|2,0,0]=4 4184 B7R1.2 CC1CNC(=O)C1 Amb10608004 [1,0,0,1,0,0|1,0,1]=4 4185 B7R1.2 CC1CNC(=O)N1 Amb17506853 [1,0,0,1,0,0|2,0,0]=4 4186 B7R1.2 CC1CNC(=O)O1 Amb19651732 [1,0,0,1,0,0|2,0,0]=4 4187 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,0,0,1,0,0|0,0,1]=3 4188 B7R1.2 CC1COC(=O)N1 Amb19517037 [1,0,0,1,0,0|1,0,0]=3 4189 B7R1.2 CC1COC(=O)O1 Amb8513300 [1,0,0,1,0,0|1,0,0]=3 4190 B7R1.2 CC1COC(N)=N1 Amb23449369 [1,0,0,1,0,0|2,0,0]=4 4191 B7R1.2 CC1COS(=O)O1 Amb22346070 [1,0,0,1,0,0|2,0,0]=4 4192 B7R1.2 CC1CSC(=O)N1 Amb28320497 [1,0,0,1,0,0|1,1,0]=4 4193 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,0,0,1,0,0|1,0,1]=4 4194 B7R1.2 C[C@@H]1CCC(=O)N1 Amb24116991 [1,0,0,1,0,0|2,0,0]=4 4195 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [1,0,0,1,0,0|2,0,0]=4 4196 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,0,0,1,0,0|1,0,1]=4 4197 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [1,0,0,1,0,0|2,0,0]=4 4198 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,0,0,1,0,0|0,0,1]=3 4199 B7R1.2 C[C@@H]1COC(=O)N1 Amb22745849 [1,0,0,1,0,0|1,0,0]=3 4200 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [1,0,0,1,0,0|1,0,0]=3 4201 B7R1.2 C[C@@H]1COS(=O)O1 Amb27979548 [1,0,0,1,0,0|2,0,0]=4 4202 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [1,0,0,1,0,0|2,0,0]=4 4203 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [1,0,0,1,0,0|1,0,1]=4 4204 B7R1.2 C[C@H]1CNC(=O)N1 Amb27413051 [1,0,0,1,0,0|2,0,0]=4 4205 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,0,0,1,0,0|0,0,1]=3 4206 B7R1.2 C[C@H]1COC(=O)N1 Amb8391158 [1,0,0,1,0,0|1,0,0]=3 4207 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [1,0,0,1,0,0|1,0,0]=3 4208 B7R1.2 NC1COC(=O)C1 Amb30594428 [1,0,0,1,0,0|1,0,1]=4 4209 B7R1.2 NC1COC(=O)C1 Amb9782136 [1,0,0,1,0,0|1,0,1]=4 4210 B7R1.2 N[C@@H]1COC(=O)C1 Amb16233747 [1,0,0,1,0,0|1,0,1]=4 4211 B7R1.2 N[C@@H]1COC(=O)C1 Amb26477774 [1,0,0,1,0,0|1,0,1]=4 4212 B7R1.2 N[C@H]1COC(=O)C1 Amb19516097 [1,0,0,1,0,0|1,0,1]=4 4213 B7R1.2 N[C@H]1COC(=O)C1 Amb25264112 [1,0,0,1,0,0|1,0,1]=4 4214 B7R1.2 O=C1C=C(Br)CO1 Amb10067500 [1,0,0,1,0,0|1,0,1]=4 4215 B7R1.2 O=C1C=C(I)CO1 Amb2455617 [1,0,0,1,0,0|1,0,1]=4 4216 B7R1.2 O=C1C=C(O)CO1 Amb628324 [1,0,0,1,0,0|1,0,1]=4 4217 B7R1.2 O=C1C=C(S)CO1 Amb28323506 [1,0,0,1,0,0|1,0,1]=4 4218 B7R1.2 O=C1CC(F)CO1 Amb24431109 [1,0,0,1,0,0|1,0,1]=4 4219 B7R1.2 O=C1CC(I)CO1 Amb27401189 [1,0,0,1,0,0|1,0,1]=4 4220 B7R1.2 O=C1CC(O)CO1 Amb4006296 [1,0,0,1,0,0|1,0,1]=4 4221 B7R1.2 O=C1C[C@@H](O)CO1 Amb2695144 [1,0,0,1,0,0|1,0,1]=4 4222 B7R1.2 O=C1C[C@H](O)CO1 Amb8627913 [1,0,0,1,0,0|1,0,1]=4 4223 B7R1.2 O=C1OCC(Cl)O1 Amb10842117 [1,0,0,1,0,0|2,0,0]=4 4224 B7R1.2 O=C1OCC(F)O1 Amb10841016 [1,0,0,1,0,0|2,0,0]=4 4225 B7R1.12 CC(=O)C1CC1C Amb25720437 [1,0,0,1,0,0|1,0,1]=4 4226 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [1,0,0,1,0,0|1,0,1]=4 4227 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [1,0,0,1,0,0|1,0,1]=4 4228 B7R1.12 CC(C)C1=C(Br)C1 Amb25972622 [1,0,0,1,0,0|2,0,0]=4 4229 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [1,0,0,1,0,0|1,0,1]=4 4230 B7R1.12 CC1CC1C(=O)O Amb9703126 [1,0,0,1,0,0|0,0,1]=3 4231 B7R1.12 CC1CC1C(N)=O Amb8858378 [1,0,0,1,0,0|1,0,1]=4 4232 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|1,0,1]=4 4233 B7R1.12 CC1SC1C(=O)O Amb27195238 [1,0,0,1,0,0|1,0,1]=4 4234 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [1,0,0,1,0,0|1,0,1]=4 4235 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [1,0,0,1,0,0|0,0,1]=3 4236 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [1,0,0,1,0,0|1,0,1]=4 4237 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [1,0,0,1,0,0|0,0,1]=3 4238 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [1,0,0,1,0,0|1,0,1]=4 4239 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [1,0,0,1,0,0|1,0,1]=4 4240 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [1,0,0,1,0,0|1,0,1]=4 4241 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [1,0,0,1,0,0|1,0,1]=4 4242 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [1,0,0,1,0,0|0,0,1]=3 4243 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [1,0,0,1,0,0|1,0,1]=4 4244 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|0,0,1]=3 4245 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [1,0,0,1,0,0|1,0,1]=4 4246 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [1,0,0,1,0,0|1,0,1]=4 4247 B7R1.12 NC1CC1C(=O)O Amb7762823 [1,0,0,1,0,0|1,0,1]=4 4248 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [1,0,0,1,0,0|1,0,1]=4 4249 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [1,0,0,1,0,0|1,0,1]=4 4250 B7R1.12 O=C(O)C1CC1Br Amb27760446 [1,0,0,1,0,0|1,0,1]=4 4251 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [1,0,0,1,0,0|1,0,1]=4 4252 B7R1.12 O=C(O)C1CC1F Amb22490547 [1,0,0,1,0,0|1,0,1]=4 4253 B7R1.12 O=C(O)C1CC1I Amb26047069 [1,0,0,1,0,0|1,0,1]=4 4254 B7R1.12 O=C(O)C1CC1S Amb20246988 [1,0,0,1,0,0|1,0,1]=4 4255 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [1,0,0,1,0,0|1,0,1]=4 4256 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [1,0,0,1,0,0|1,0,1]=4 4257 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [1,0,0,1,0,0|1,0,1]=4 4258 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [1,0,0,1,0,0|1,0,1]=4 4259 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [1,0,0,1,0,0|1,0,1]=4 4260 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [1,0,0,1,0,0|1,0,1]=4 4261 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [1,0,0,1,0,0|1,0,1]=4 4262 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [1,0,0,1,0,0|1,0,1]=4 4263 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [1,0,0,1,0,0|1,0,1]=4 4264 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [1,0,0,1,0,0|1,0,1]=4 4265 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [1,0,0,1,0,0|1,0,1]=4 4266 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [1,0,0,1,0,0|1,0,1]=4 4267 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [1,0,0,1,0,0|1,0,1]=4 4268 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [1,0,0,1,0,0|1,0,1]=4 4269 B7R1.16 CC1(C)CC(=O)C1 Amb24117921 [1,0,0,1,0,0|1,0,1]=4 4270 B7R1.16 CC1(C)CC(=O)N1 Amb19515692 [1,0,0,1,0,0|1,0,1]=4 4271 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [1,0,0,1,0,0|0,0,1]=3 4272 B7R1.20 BrC(Br)=CC1CC1 Amb17612546 [1,0,0,1,0,0|2,0,0]=4 4273 B7R1.20 CC(=O)C=C1CC1 Amb28201596 [1,0,0,1,0,0|1,0,1]=4 4274 B7R1.20 CC(=O)CC1CC1 Amb10603417 [1,0,0,1,0,0|1,0,1]=4 4275 B7R1.20 CC(=O)NC1CC1 Amb3366973 [1,0,0,1,0,0|2,0,0]=4 4276 B7R1.20 NC(=O)CC1CC1 Amb33552967 [1,0,0,1,0,0|1,0,1]=4 4277 B7R1.20 NC(=O)NC1CC1 Amb1152776 [1,0,0,1,0,0|2,0,0]=4 4278 B7R1.20 NC(=O)OC1CC1 Amb27265645 [1,0,0,1,0,0|2,0,0]=4 4279 B7R1.20 O=C(Cl)CC1CC1 Amb18283320 [1,0,0,1,0,0|1,0,1]=4 4280 B7R1.20 O=C(Cl)NC1CC1 Amb27848787 [1,0,0,1,0,0|2,0,0]=4 4281 B7R1.20 O=C(Cl)OC1CC1 Amb25251789 [1,0,0,1,0,0|2,0,0]=4 4282 B7R1.20 O=C(O)C=C1CC1 Amb8392543 [1,0,0,1,0,0|0,0,1]=3 4283 B7R1.20 O=C(O)CC1CC1 Amb2686657 [1,0,0,1,0,0|0,0,1]=3 4284 B7R1.20 O=C(O)CC1CO1 Amb25244347 [1,0,0,1,0,0|1,0,1]=4 4285 B7R1.20 O=C(O)C[C@@H]1CO1 Amb27253415 [1,0,0,1,0,0|1,0,1]=4 4286 B7R1.20 O=C(O)C[C@H]1CO1 Amb26068484 [1,0,0,1,0,0|1,0,1]=4 4287 B7R1.4 C=C1CCCC1=O Amb17593061 [1,0,0,1,0,0|2,0,0]=4 4288 B7R1.4 C=C1CCNC1=O Amb26415156 [1,0,0,1,0,0|2,0,0]=4 4289 B7R1.4 C=C1CCOC1=O Amb3941636 [1,0,0,1,0,0|1,0,0]=3 4290 B7R1.4 CC1=C(S)CCO1 Amb16232456 [1,0,0,1,0,0|1,1,0]=4 4291 B7R1.4 CC1=CCCC1=O Amb8514958 [1,0,0,1,0,0|2,0,0]=4 4292 B7R1.4 CC1=CCCC1C Amb24479857 [1,0,0,1,0,0|2,0,0]=4 4293 B7R1.4 CC1=CCOC1=O Amb16231256 [1,0,0,1,0,0|1,0,1]=4 4294 B7R1.4 CC1CCCC1=O Amb8514830 [1,0,0,1,0,0|1,0,1]=4 4295 B7R1.4 CC1CCNC1=O Amb10603701 [1,0,0,1,0,0|2,0,0]=4 4296 B7R1.4 CC1CCOC1=O Amb16185414 [1,0,0,1,0,0|1,0,1]=4 4297 B7R1.4 CC1CNNC1=O Amb27228083 [1,0,0,1,0,0|2,0,0]=4 4298 B7R1.4 CC1COCC1=O Amb24333426 [1,0,0,1,0,0|0,0,1]=3 4299 B7R1.4 CC1CON=C1N Amb27404510 [1,0,0,1,0,0|2,0,0]=4 4300 B7R1.4 CC1CONC1=O Amb33714888 [1,0,0,1,0,0|1,0,0]=3 4301 B7R1.4 CC1CSCC1=O Amb21964769 [1,0,0,1,0,0|0,1,1]=4 4302 B7R1.4 CC1NC=CC1=O Amb28201187 [1,0,0,1,0,0|2,0,0]=4 4303 B7R1.4 CC1OC=CC1=O Amb28053998 [1,0,0,1,0,0|2,0,0]=4 4304 B7R1.4 CC1OCCC1=O Amb2725497 [1,0,0,1,0,0|1,0,1]=4 4305 B7R1.4 CN1CC=CC1=O Amb22372248 [1,0,0,1,0,0|2,0,0]=4 4306 B7R1.4 CN1CCOC1=O Amb22347786 [1,0,0,1,0,0|2,0,0]=4 4307 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [1,0,0,1,0,0|2,0,0]=4 4308 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [1,0,0,1,0,0|1,0,1]=4 4309 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [1,0,0,1,0,0|2,0,0]=4 4310 B7R1.4 NC1=CCOC1=O Amb22234102 [1,0,0,1,0,0|1,0,1]=4 4311 B7R1.4 NC1CCOC1=O Amb17614991 [1,0,0,1,0,0|1,0,1]=4 4312 B7R1.4 NC1CCOC1=O Amb6609049 [1,0,0,1,0,0|1,0,1]=4 4313 B7R1.4 NC1CCOC1=O Amb9761351 [1,0,0,1,0,0|1,0,1]=4 4314 B7R1.4 NC1COCC1=O Amb18202885 [1,0,0,1,0,0|1,0,1]=4 4315 B7R1.4 NC1COCC1=O Amb33328736 [1,0,0,1,0,0|1,0,1]=4 4316 B7R1.4 NC1CONC1=O Amb1865548 [1,0,0,1,0,0|2,0,0]=4 4317 B7R1.4 NN1CCOC1=O Amb10068971 [1,0,0,1,0,0|2,0,0]=4 4318 B7R1.4 NN1CCOC1=O Amb33532698 [1,0,0,1,0,0|2,0,0]=4 4319 B7R1.4 N[C@@H]1CCOC1=O Amb10601656 [1,0,0,1,0,0|1,0,1]=4 4320 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [1,0,0,1,0,0|1,0,1]=4 4321 B7R1.4 N[C@@H]1CCOC1=O Amb3941712 [1,0,0,1,0,0|1,0,1]=4 4322 B7R1.4 N[C@@H]1CONC1=O Amb533888 [1,0,0,1,0,0|2,0,0]=4 4323 B7R1.4 N[C@H]1CCOC1=O Amb10982617 [1,0,0,1,0,0|1,0,1]=4 4324 B7R1.4 N[C@H]1CCOC1=O Amb541960 [1,0,0,1,0,0|1,0,1]=4 4325 B7R1.4 N[C@H]1CCOC1=O Amb5718691 [1,0,0,1,0,0|1,0,1]=4 4326 B7R1.4 N[C@H]1CONC1=O Amb2719694 [1,0,0,1,0,0|2,0,0]=4 4327 B7R1.4 O=C1C=CCC1Cl Amb27482393 [1,0,0,1,0,0|2,0,0]=4 4328 B7R1.4 O=C1CCC=C1Br Amb10067494 [1,0,0,1,0,0|2,0,0]=4 4329 B7R1.4 O=C1CCC=C1I Amb26585706 [1,0,0,1,0,0|2,0,0]=4 4330 B7R1.4 O=C1CCC=C1O Amb17593067 [1,0,0,1,0,0|1,0,0]=3 4331 B7R1.4 O=C1CCCC1=O Amb24053064 [1,0,0,1,0,0|1,0,0]=3 4332 B7R1.4 O=C1CCCC1O Amb17593081 [1,0,0,1,0,0|1,0,1]=4 4333 B7R1.4 O=C1CCCN1O Amb33484242 [1,0,0,1,0,0|2,0,0]=4 4334 B7R1.4 O=C1CCNC1=O Amb21858086 [1,0,0,1,0,0|1,0,0]=3 4335 B7R1.4 O=C1CCOC1=O Amb27849805 [1,0,0,1,0,0|0,0,0]=2 4336 B7R1.4 O=C1CNC=C1O Amb27962752 [1,0,0,1,0,0|2,0,0]=4 4337 B7R1.4 O=C1COC=C1O Amb27838226 [1,0,0,1,0,0|2,0,0]=4 4338 B7R1.4 O=C1OCC=C1Br Amb10067498 [1,0,0,1,0,0|1,0,1]=4 4339 B7R1.4 O=C1OCC=C1Cl Amb23571857 [1,0,0,1,0,0|1,0,1]=4 4340 B7R1.4 O=C1OCC=C1F Amb28144969 [1,0,0,1,0,0|1,0,1]=4 4341 B7R1.4 O=C1OCCC1Br Amb3940058 [1,0,0,1,0,0|1,0,1]=4 4342 B7R1.4 O=C1OCCC1F Amb27642041 [1,0,0,1,0,0|1,0,1]=4 4343 B7R1.4 O=C1OCCC1I Amb24418518 [1,0,0,1,0,0|1,0,1]=4 4344 B7R1.4 O=C1OCCC1O Amb5718058 [1,0,0,1,0,0|0,0,2]=4 4345 B7R1.4 O=C1OCCC1S Amb25146639 [1,0,0,1,0,0|0,1,1]=4 4346 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [1,0,0,1,0,0|0,0,2]=4 4347 B7R1.4 O=C1OCC[C@H]1Br Amb27407127 [1,0,0,1,0,0|1,0,1]=4 4348 B7R1.4 O=C1OCC[C@H]1Cl Amb28207894 [1,0,0,1,0,0|1,0,1]=4 4349 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [1,0,0,1,0,0|0,0,2]=4 4350 B7R1.4 O=C1OCC[C@H]1S Amb27862288 [1,0,0,1,0,0|0,1,1]=4 4351 B7R1.4 O=C1O[Sr]OC1=O Amb22338392 [1,0,0,1,0,0|2,0,0]=4 4352 B7R1.8 C[C@@H]1CC[C@H]1C=O Amb27841156 [1,0,0,1,0,0|1,0,1]=4 4353 B7R1.15 C=C1C(=O)NC1C Amb28350835 [1,0,0,1,0,0|2,0,0]=4 4354 B7R1.15 CC1=C(C)C(=O)C1 Amb27226738 [1,0,0,1,0,0|1,0,1]=4 4355 B7R1.15 CC1CC(=O)C1C Amb33551302 [1,0,0,1,0,0|1,0,1]=4 4356 B7R1.15 CC1CN(N)C1=O Amb24479155 [1,0,0,1,0,0|2,0,0]=4 4357 B7R1.15 C[C@@H]1C(=O)C[C@H]1C Amb27865634 [1,0,0,1,0,0|1,0,1]=4 4358 B7R1.15 C[C@H]1CC(=O)[C@@H]1C Amb27433516 [1,0,0,1,0,0|1,0,1]=4 4359 B7R1.15 C[C@H]1CC(=O)[C@H]1C Amb27788507 [1,0,0,1,0,0|1,0,1]=4 4360 B7R1.15 C[C@H]1OC(=O)[C@H]1N Amb27629736 [1,0,0,1,0,0|1,0,1]=4 4361 B7R1.17 CC1(C)C=CC1=O Amb27486040 [1,0,0,1,0,0|1,0,0]=3 4362 B7R1.17 CC1(C)CCC1=O Amb28050382 [1,0,0,1,0,0|1,0,1]=4 4363 B7R1.17 CC1(C)CNC1=O Amb26954140 [1,0,0,1,0,0|2,0,0]=4 4364 B7R1.17 CC1(C)COC1=O Amb17619458 [1,0,0,1,0,0|2,0,0]=4 4365 B7R1.17 CC1(C)OCC1=O Amb27666218 [1,0,0,1,0,0|0,0,1]=3 4366 B7R1.18 CC(=O)C1=CCC1 Amb23453500 [1,0,0,1,0,0|2,0,0]=4 4367 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [1,0,0,1,0,0|1,0,0]=3 4368 B7R1.18 O=C(O)C1CCC1 Amb2686619 [1,0,0,1,0,0|1,0,1]=4 4369 B7R1.18 O=C(O)C1CCN1 Amb2371568 [1,0,0,1,0,0|1,0,1]=4 4370 B7R1.18 O=C(O)C1CCN1 Amb8391098 [1,0,0,1,0,0|1,0,1]=4 4371 B7R1.18 O=C(O)C1CCO1 Amb2383526 [1,0,0,1,0,0|0,0,2]=4 4372 B7R1.18 O=C(O)C1CCS1 Amb27209836 [1,0,0,1,0,0|0,1,1]=4 4373 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [1,0,0,1,0,0|1,0,1]=4 4374 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [1,0,0,1,0,0|1,0,1]=4 4375 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [1,0,0,1,0,0|0,0,2]=4 4376 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [1,0,0,1,0,0|1,0,1]=4 4377 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [1,0,0,1,0,0|1,0,1]=4 4378 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [1,0,0,1,0,0|0,0,2]=4 4379 B7R1.18 O=C([O-])C1=CCC1 Amb34165365 [1,0,0,1,0,0|1,0,1]=4 4380 B7R1.19 CC1(C(=O)O)CC1 Amb2779924 [1,0,0,1,0,0|1,0,1]=4 4381 B7R1.19 NC1(C(=O)O)CC1 Amb4296883 [1,0,0,1,0,0|1,0,1]=4 4382 B7R1.19 NC1(C(=O)O)CC1 Amb6223185 [1,0,0,1,0,0|1,0,1]=4 4383 B7R1.19 O=C(O)C1(Br)CC1 Amb33544592 [1,0,0,1,0,0|1,0,1]=4 4384 B7R1.19 O=C(O)C1(Cl)CC1 Amb25841916 [1,0,0,1,0,0|1,0,1]=4 4385 B7R1.19 O=C(O)C1(F)CC1 Amb22001836 [1,0,0,1,0,0|1,0,1]=4 4386 B7R1.19 O=C(O)C1(O)CC1 Amb6609000 [1,0,0,1,0,0|0,0,2]=4 4387 B7R1.22 C=C(C=O)C1CC1 Amb28050249 [1,0,0,1,0,0|1,0,0]=3 4388 B7R1.22 C=C(CO)C1CC1 Amb27245002 [1,0,0,1,0,0|1,0,1]=4 4389 B7R1.22 C=CC(=O)C1CC1 Amb22059056 [1,0,0,1,0,0|1,0,0]=3 4390 B7R1.22 C=CC(=O)[C@@H]1CO1 Amb27859349 [1,0,0,1,0,0|2,0,0]=4 4391 B7R1.22 CC(C=O)=C1CC1 Amb28251246 [1,0,0,1,0,0|1,0,1]=4 4392 B7R1.22 CC(C=O)C1CC1 Amb25376838 [1,0,0,1,0,0|1,0,1]=4 4393 B7R1.22 CCC(=O)C1CC1 Amb17138359 [1,0,0,1,0,0|1,0,1]=4 4394 B7R1.22 CN(C=O)C1CC1 Amb24117128 [1,0,0,1,0,0|2,0,0]=4 4395 B7R1.22 CNC(=O)C1CC1 Amb33530537 [1,0,0,1,0,0|2,0,0]=4 4396 B7R1.22 COC(=O)C1CC1 Amb2689409 [1,0,0,1,0,0|2,0,0]=4 4397 B7R1.22 C\C(=C/Br)C1CC1 Amb27591985 [1,0,0,1,0,0|2,0,0]=4 4398 B7R1.22 C\C(=N/O)C1CC1 Amb534257 [1,0,0,1,0,0|2,0,0]=4 4399 B7R1.22 C\C(=N\O)C1CC1 Amb22731956 [1,0,0,1,0,0|2,0,0]=4 4400 B7R1.22 N#CC(=O)C1CC1 Amb17231801 [1,0,0,1,0,0|1,0,1]=4 4401 B7R1.22 N=C(NO)C1CC1 Amb18049065 [1,0,0,1,0,0|2,0,0]=4 4402 B7R1.22 N=NC(=O)C1CC1 Amb28241431 [1,0,0,1,0,0|2,0,0]=4 4403 B7R1.22 NCC(=O)C1CC1 Amb18197870 [1,0,0,1,0,0|1,0,1]=4 4404 B7R1.22 NCC(=O)C1CC1 Amb33528322 [1,0,0,1,0,0|1,0,1]=4 4405 B7R1.22 NNC(=O)C1CC1 Amb6373977 [1,0,0,1,0,0|2,0,0]=4 4406 B7R1.22 N\C(=N/O)C1CC1 Amb2695051 [1,0,0,1,0,0|2,0,0]=4 4407 B7R1.22 N\C(=N/O)C1CC1 Amb6892640 [1,0,0,1,0,0|2,0,0]=4 4408 B7R1.22 O=C(CBr)C1CC1 Amb10879887 [1,0,0,1,0,0|1,0,1]=4 4409 B7R1.22 O=C(CCl)C1CC1 Amb24120625 [1,0,0,1,0,0|1,0,1]=4 4410 B7R1.22 O=C(CF)C1CC1 Amb23454824 [1,0,0,1,0,0|1,0,1]=4 4411 B7R1.22 O=C(CO)C1CC1 Amb18061832 [1,0,0,1,0,0|0,0,1]=3 4412 B7R1.22 O=C(NO)C1CC1 Amb6266675 [1,0,0,1,0,0|1,0,0]=3 4413 B7R1.22 O=CC(=O)C1CC1 Amb22900251 [1,0,0,1,0,0|0,0,0]=2 4414 B7R1.22 O=CC(F)C1CC1 Amb27777027 [1,0,0,1,0,0|1,0,1]=4 4415 B7R1.22 O=CC(O)C1CC1 Amb27593028 [1,0,0,1,0,0|0,0,2]=4 4416 B7R1.23 CC1(C)CC1C=O Amb28071200 [1,0,0,1,0,0|1,0,1]=4 4417 B7R1.23 CC1(C)C[C@@H]1C=O Amb26416941 [1,0,0,1,0,0|1,0,1]=4 4418 B7R1.23 CC1(C)C\C1=C/Cl Amb27407556 [1,0,0,1,0,0|2,0,0]=4 4419 B7R1.23 CC1(C)OC1C=O Amb24724709 [1,0,0,1,0,0|0,0,2]=4 4420 B7R1.23 CC1(C)O[C@@H]1C=O Amb28050526 [1,0,0,1,0,0|0,0,2]=4 4421 B7R1.27 CC1CC1(C)C=O Amb25076193 [1,0,0,1,0,0|1,0,1]=4 4422 B7R1.27 C[C@@H]1C[C@]1(C)C=O Amb27493432 [1,0,0,1,0,0|1,0,1]=4 4423 B7R1.30 CC1=C(Br)C1(C)C Amb25662183 [1,0,0,1,0,0|2,0,0]=4 4424 B7R1.30 CC1C(=O)C1(C)C Amb28321957 [1,0,0,1,0,0|1,0,1]=4 4425 B9R1.35 CC(C)C1=CC(=O)CC1 Amb26866593 [0,0,0,1,0,1|2,0,0]=4 4426 B9R1.35 CC(C)C1=CC(=O)NO1 Amb25956301 [0,0,0,1,0,1|1,0,1]=4 4427 B9R1.35 CC(C)C1=CCC(=O)O1 Amb27462536 [0,0,0,1,0,1|2,0,0]=4 4428 B9R1.35 CC(C)C1=CNC(=O)N1 Amb25068480 [0,0,0,1,0,1|2,0,0]=4 4429 B9R1.35 CC(C)C1=NC(=O)NO1 Amb20246896 [0,0,0,1,0,1|1,0,1]=4 4430 B9R1.35 CC(C)C1=NCC(=O)N1 Amb27446386 [0,0,0,1,0,1|2,0,0]=4 4431 B9R1.35 CC(C)C1=NNC(=O)C1 Amb9202907 [0,0,0,1,0,1|2,0,0]=4 4432 B9R1.35 CC(C)C1=NNC(=O)O1 Amb20246867 [0,0,0,1,0,1|2,0,0]=4 4433 B9R1.35 CC(C)C1=NOC(=O)C1 Amb26851580 [0,0,0,1,0,1|1,0,0]=3 4434 B9R1.35 CC(C)C1=NOC(=O)N1 Amb22059086 [0,0,0,1,0,1|1,0,0]=3 4435 B9R1.35 CC(C)C1=NSC(=O)O1 Amb27762657 [0,0,0,1,0,1|1,1,0]=4 4436 B9R1.35 CC(C)C1COC(=O)N1 Amb10071773 [0,0,0,1,0,1|1,0,1]=4 4437 B9R1.35 CC(C)[C@@H]1COC(=O)N1 Amb8515206 [0,0,0,1,0,1|1,0,1]=4 4438 B9R1.35 CC(C)[C@H]1COC(=O)C1 Amb27242562 [0,0,0,1,0,1|1,0,1]=4 4439 B9R1.35 CC(C)[C@H]1COC(=O)N1 Amb8385596 [0,0,0,1,0,1|1,0,1]=4 4440 B9R1.35 CC(C)c1cc(Br)on1 Amb28144792 [0,0,0,1,0,1|2,0,0]=4 4441 B9R1.35 CC(C)c1cc(N)on1 Amb404782 [0,0,0,1,0,1|2,0,0]=4 4442 B9R1.35 CC(C)c1ccc(O)s1 Amb20617566 [0,0,0,1,0,1|2,0,0]=4 4443 B9R1.35 CC(C)c1cnc(O)s1 Amb13884343 [0,0,0,1,0,1|2,0,0]=4 4444 B9R1.35 CC(C)c1coc(Br)c1 Amb10600626 [0,0,0,1,0,1|2,0,0]=4 4445 B9R1.35 CC(C)c1coc(Br)n1 Amb28144974 [0,0,0,1,0,1|2,0,0]=4 4446 B9R1.35 CC(C)c1coc(I)n1 Amb27768796 [0,0,0,1,0,1|2,0,0]=4 4447 B9R1.35 CC(C)c1coc(N)c1 Amb10600627 [0,0,0,1,0,1|2,0,0]=4 4448 B9R1.35 CC(C)c1coc(N)n1 Amb18946537 [0,0,0,1,0,1|2,0,0]=4 4449 B9R1.35 CC(C)c1csc(O)c1 Amb20617592 [0,0,0,1,0,1|1,1,0]=4 4450 B9R1.35 CC(C)c1nc(O)cs1 Amb10599936 [0,0,0,1,0,1|1,1,0]=4 4451 B9R1.35 CC(C)c1ncc(O)s1 Amb10600221 [0,0,0,1,0,1|2,0,0]=4 4452 B9R1.35 CC(C)c1nnc(O)s1 Amb19516959 [0,0,0,1,0,1|2,0,0]=4 4453 B9R1.35 CC(C)c1noc(Br)n1 Amb26022167 [0,0,0,1,0,1|2,0,0]=4 4454 B9R1.35 CC(C)c1noc(Cl)n1 Amb19307934 [0,0,0,1,0,1|2,0,0]=4 4455 B9R1.35 CC(C)c1noc(N)n1 Amb10608475 [0,0,0,1,0,1|2,0,0]=4 4456 B9R1.35 CC(C)c1noc(O)n1 Amb15701656 [0,0,0,1,0,1|1,0,1]=4 4457 B9R1.35 CC(C)c1noc(S)n1 Amb25344230 [0,0,0,1,0,1|1,1,0]=4 4458 B9R1.35 CC(N)C1=CC(=O)ON1 Amb27971191 [0,0,0,1,0,1|2,0,0]=4 4459 B9R1.35 CC(N)C1=NOC(=O)N1 Amb24116664 [0,0,0,1,0,1|2,0,0]=4 4460 B9R1.35 CC1C=C(C(=O)O)CC1 Amb18642397 [0,0,0,1,0,1|1,0,0]=3 4461 B9R1.35 CC1CC(C(=O)O)=NO1 Amb25694020 [0,0,0,1,0,1|2,0,0]=4 4462 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [0,0,0,1,0,1|1,0,1]=4 4463 B9R1.35 CC1CCC(C(=O)O)N1 Amb18832572 [0,0,0,1,0,1|1,0,1]=4 4464 B9R1.35 CC1CCC(C(=O)O)N1 Amb32652343 [0,0,0,1,0,1|1,0,1]=4 4465 B9R1.35 CC1CCC(C(=O)O)O1 Amb17593370 [0,0,0,1,0,1|1,0,1]=4 4466 B9R1.35 CC1CCC(C(=O)O)S1 Amb25719281 [0,0,0,1,0,1|1,0,1]=4 4467 B9R1.35 CC1CC[C@H](C(=O)O)N1 Amb22748252 [0,0,0,1,0,1|1,0,1]=4 4468 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [0,0,0,1,0,1|1,0,1]=4 4469 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [0,0,0,1,0,1|1,0,1]=4 4470 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [0,0,0,1,0,1|0,0,2]=4 4471 B9R1.35 C[C@@H]1CCC(C(=O)O)O1 Amb33423875 [0,0,0,1,0,1|1,0,1]=4 4472 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [0,0,0,1,0,1|1,0,1]=4 4473 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)N1 Amb31308105 [0,0,0,1,0,1|1,0,1]=4 4474 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [0,0,0,1,0,1|1,0,1]=4 4475 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb24399449 [0,0,0,1,0,1|1,0,1]=4 4476 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)N1 Amb32652487 [0,0,0,1,0,1|1,0,1]=4 4477 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)O1 Amb22886534 [0,0,0,1,0,1|1,0,1]=4 4478 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [0,0,0,1,0,1|1,0,1]=4 4479 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [0,0,0,1,0,1|1,0,1]=4 4480 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb24598417 [0,0,0,1,0,1|1,0,1]=4 4481 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)N1 Amb35745779 [0,0,0,1,0,1|1,0,1]=4 4482 B9R1.35 C[C@H]1CC[C@@H](C(=O)O)O1 Amb24651587 [0,0,0,1,0,1|1,0,1]=4 4483 B9R1.35 C[C@H]1CC[C@H](C(=O)O)N1 Amb33871500 [0,0,0,1,0,1|1,0,1]=4 4484 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [0,0,0,1,0,1|1,0,1]=4 4485 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [0,0,0,1,0,1|1,0,1]=4 4486 B9R1.35 NC1C=C(C(=O)O)CC1 Amb18642496 [0,0,0,1,0,1|2,0,0]=4 4487 B9R1.35 NC1CC=C(C(=O)O)C1 Amb18642495 [0,0,0,1,0,1|2,0,0]=4 4488 B9R1.35 NC1CC=C(C(=O)O)C1 Amb32667606 [0,0,0,1,0,1|2,0,0]=4 4489 B9R1.35 N[C@@H]1CC=C(C(=O)O)C1 Amb25824589 [0,0,0,1,0,1|2,0,0]=4 4490 B9R1.35 N[C@H]1CC=C(C(=O)O)C1 Amb25143919 [0,0,0,1,0,1|2,0,0]=4 4491 B9R1.35 O=C(O)C1=CC(Br)CC1 Amb27776760 [0,0,0,1,0,1|2,0,0]=4 4492 B9R1.35 O=C(O)C1=CC(O)CC1 Amb27619747 [0,0,0,1,0,1|2,0,0]=4 4493 B9R1.35 O=C(O)C1=C[C@@H](O)CC1 Amb27412374 [0,0,0,1,0,1|2,0,0]=4 4494 B9R1.35 O=C(O)C1=NC[C@@H](O)C1 Amb28198348 [0,0,0,1,0,1|2,0,0]=4 4495 B9R1.36 C=C1CC(C)(C)NC1=O Amb27224823 [0,0,0,1,0,1|2,0,0]=4 4496 B9R1.36 C=C1CC(C)(C)OC1=O Amb27879663 [0,0,0,1,0,1|1,0,0]=3 4497 B9R1.36 CC1(C)C=C(Br)C(=O)C1 Amb26512356 [0,0,0,1,0,1|2,0,0]=4 4498 B9R1.36 CC1(C)CC(=O)C(=O)C1 Amb25888889 [0,0,0,1,0,1|1,0,0]=3 4499 B9R1.36 CC1(C)CC(=O)C(O)C1 Amb26892864 [0,0,0,1,0,1|1,0,1]=4 4500 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb18124322 [0,0,0,1,0,1|1,0,1]=4 4501 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb32674857 [0,0,0,1,0,1|1,0,1]=4 4502 B9R1.36 CC1(C)C[C@@H](N)C(=O)O1 Amb28196700 [0,0,0,1,0,1|1,0,1]=4 4503 B9R1.36 CC1(C)C[C@@H](O)C(=O)O1 Amb27472564 [0,0,0,1,0,1|0,0,2]=4 4504 B9R1.36 CC1(C)C[C@H](N)C(=O)O1 Amb24476611 [0,0,0,1,0,1|1,0,1]=4 4505 B9R1.36 CC1(C)C[C@H](O)C(=O)O1 Amb28205922 [0,0,0,1,0,1|0,0,2]=4 4506 B9R1.36 CC1(C)NC(=O)C(=O)N1 Amb25137176 [0,0,0,1,0,1|1,0,0]=3 4507 B9R1.36 CC1(C)NC(=S)C(=O)S1 Amb28056026 [0,0,0,1,0,1|0,2,0]=4 4508 B9R1.36 CC1=CC(C)(C)NC1=O Amb26654163 [0,0,0,1,0,1|2,0,0]=4 4509 B9R1.36 CC1=NC(C)(C)NC1=O Amb27873384 [0,0,0,1,0,1|2,0,0]=4 4510 B9R1.36 CC1CC(C)(C)OC1=O Amb24444118 [0,0,0,1,0,1|1,0,1]=4 4511 B9R1.36 CC1CS(=O)(=O)NC1=O Amb32686578 [0,0,0,1,0,1|1,0,1]=4 4512 B9R1.38 C=C1OC(=O)OC1(C)C Amb1033029 [0,0,0,1,0,1|1,0,0]=3 4513 B9R1.38 C=C1OC(=O)OC1(C)Cl Amb26064671 [0,0,0,1,0,1|2,0,0]=4 4514 B9R1.38 CC1(Br)CC(=O)NC1=O Amb25095370 [0,0,0,1,0,1|2,0,0]=4 4515 B9R1.38 CC1(C)CC(=O)CC1=O Amb25993979 [0,0,0,1,0,1|1,0,0]=3 4516 B9R1.38 CC1(C)CC(=O)N=C1N Amb24412394 [0,0,0,1,0,1|2,0,0]=4 4517 B9R1.38 CC1(C)CC(=O)NC1=O Amb8845622 [0,0,0,1,0,1|1,0,0]=3 4518 B9R1.38 CC1(C)CC(=O)NC1=S Amb27827420 [0,0,0,1,0,1|1,1,0]=4 4519 B9R1.38 CC1(C)CC(=O)OC1=O Amb2687615 [0,0,0,1,0,1|1,0,0]=3 4520 B9R1.38 CC1(C)CC(=S)NC1=O Amb27209597 [0,0,0,1,0,1|1,1,0]=4 4521 B9R1.38 CC1(C)CC(O)OC1=O Amb17593371 [0,0,0,1,0,1|1,0,1]=4 4522 B9R1.38 CC1(C)NC(=O)CC1=O Amb18832699 [0,0,0,1,0,1|1,0,0]=3 4523 B9R1.38 CC1(C)NC(=O)N=C1N Amb20667594 [0,0,0,1,0,1|2,0,0]=4 4524 B9R1.38 CC1(C)NC(=O)NC1=O Amb1145663 [0,0,0,1,0,1|1,0,0]=3 4525 B9R1.38 CC1(C)NC(=O)NC1=S Amb27644002 [0,0,0,1,0,1|1,1,0]=4 4526 B9R1.38 CC1(C)NC(=O)OC1=O Amb26615190 [0,0,0,1,0,1|1,0,0]=3 4527 B9R1.38 CC1(C)NC(=S)NC1=O Amb23515160 [0,0,0,1,0,1|1,1,0]=4 4528 B9R1.38 CC1(C)NC(=S)OC1=O Amb27816436 [0,0,0,1,0,1|1,1,0]=4 4529 B9R1.38 CC1(C)NC(=S)SC1=O Amb27619256 [0,0,0,1,0,1|1,1,0]=4 4530 B9R1.38 CC1(C)NC(N)=NC1=O Amb26045577 [0,0,0,1,0,1|2,0,0]=4 4531 B9R1.38 CC1(C)NC(O)NC1=O Amb28120891 [0,0,0,1,0,1|1,0,1]=4 4532 B9R1.38 CC1(C)OC(=N)C=C1N Amb17593313 [0,0,0,1,0,1|2,0,0]=4 4533 B9R1.38 CC1(C)OC(=O)C=C1N Amb28193555 [0,0,0,1,0,1|1,0,0]=3 4534 B9R1.38 CC1(C)OC(=O)C=C1O Amb28060059 [0,0,0,1,0,1|0,0,1]=3 4535 B9R1.38 CC1(C)OC(=O)CC1=O Amb27838818 [0,0,0,1,0,1|0,0,0]=2 4536 B9R1.38 CC1(C)OC(=O)C[C@H]1O Amb27208228 [0,0,0,1,0,1|0,0,2]=4 4537 B9R1.38 CC1(C)OC(=O)N=C1N Amb23515141 [0,0,0,1,0,1|1,0,0]=3 4538 B9R1.38 CC1(C)OC(=O)NC1=O Amb6296615 [0,0,0,1,0,1|0,0,0]=2 4539 B9R1.38 CC1(C)OC(=S)NC1=O Amb16226161 [0,0,0,1,0,1|0,1,0]=3 4540 B9R1.38 CC1(C)SC(=O)NC1=O Amb20622849 [0,0,0,1,0,1|0,1,0]=3 4541 B9R1.38 CC1(C)SC(N)=NC1=O Amb26505020 [0,0,0,1,0,1|1,1,0]=4 4542 B9R1.38 CC1(N)CC(=O)NC1=O Amb28314090 [0,0,0,1,0,1|2,0,0]=4 4543 B9R1.38 CC1(O)NC(=O)NC1=O Amb4012222 [0,0,0,1,0,1|2,0,0]=4 4544 B9R1.38 CC1=CC(=O)C(C)(C)O1 Amb25319517 [0,0,0,1,0,1|1,0,0]=3 4545 B9R1.38 CC1=CC(=O)CC1(C)C Amb16191973 [0,0,0,1,0,1|2,0,0]=4 4546 B9R1.38 CC1=CC(=O)OC1(C)C Amb32664388 [0,0,0,1,0,1|1,0,0]=3 4547 B9R1.38 CC1=NC(C)(C)C(=O)N1 Amb27166126 [0,0,0,1,0,1|2,0,0]=4 4548 B9R1.38 CC1CC(=O)OC1(C)C Amb28206444 [0,0,0,1,0,1|1,0,1]=4 4549 B9R1.38 CC1NC(=O)OC1(C)C Amb28457652 [0,0,0,1,0,1|1,0,1]=4 4550 B9R1.44 CC1CC1(N)CC(=O)O Amb27816522 [0,0,0,1,0,1|1,0,1]=4 4551 B9R1.45 C=C(C(=O)O)C1CC1C Amb33144231 [0,0,0,1,0,1|1,0,0]=3 4552 B9R1.45 C=C(C)C(=O)C1CC1C Amb27655307 [0,0,0,1,0,1|2,0,0]=4 4553 B9R1.45 CC1CC1C(=O)C(=O)O Amb24760671 [0,0,0,1,0,1|0,0,0]=2 4554 B9R1.45 CC1CC1C(C)C(=O)O Amb25708709 [0,0,0,1,0,1|1,0,1]=4 4555 B9R1.45 CC1CC1C(N)C(=O)O Amb33359576 [0,0,0,1,0,1|1,0,1]=4 4556 B9R1.45 CC1CC1C(O)C(=O)O Amb33474336 [0,0,0,1,0,1|0,0,2]=4 4557 B9R1.55 CC(=O)C1=C(C)C(C)C1 Amb28122458 [0,0,0,1,0,1|2,0,0]=4 4558 B9R1.55 CC(C)=C1CC(C)C1=O Amb27838814 [0,0,0,1,0,1|2,0,0]=4 4559 B9R1.55 CC(C)[C@@H]1OC(=O)[C@H]1O Amb27196798 [0,0,0,1,0,1|0,0,2]=4 4560 B9R1.55 CC1CC(C(=O)O)N1C Amb28285280 [0,0,0,1,0,1|2,0,0]=4 4561 B9R1.55 CN1CC(C(=O)O)C1=O Amb17593354 [0,0,0,1,0,1|1,0,0]=3 4562 B9R1.55 C[C@H]1CC(C(=O)O)[C@@H]1C Amb28132441 [0,0,0,1,0,1|1,0,1]=4 4563 B9R1.67 CC(=O)\C=C1/CCC1C Amb28251863 [0,0,0,1,0,1|2,0,0]=4 4564 B9R1.67 CC(C)\C=C1\CCC1=O Amb35752264 [0,0,0,1,0,1|2,0,0]=4 4565 B9R1.67 CC1CCN1CC(=O)O Amb27838508 [0,0,0,1,0,1|2,0,0]=4 4566 B9R1.67 CC1CCN1CC(=O)O Amb33552557 [0,0,0,1,0,1|2,0,0]=4 4567 B9R1.69 C=C1CC(C)CNC1=O Amb27640032 [0,0,0,1,0,1|2,0,0]=4 4568 B9R1.69 CC1=CC(=O)C(C)CC1 Amb28323862 [0,0,0,1,0,1|2,0,0]=4 4569 B9R1.69 CC1=CC(=O)CC[C@H]1C Amb27838729 [0,0,0,1,0,1|2,0,0]=4 4570 B9R1.69 CC1=CC(=O)OCC1O Amb28457807 [0,0,0,1,0,1|2,0,0]=4 4571 B9R1.69 CC1=CC(=O)[C@H](C)CC1 Amb27598775 [0,0,0,1,0,1|2,0,0]=4 4572 B9R1.69 CC1=CC(C)CNC1=O Amb27435183 [0,0,0,1,0,1|2,0,0]=4 4573 B9R1.69 CC1=CCC(C)C(=O)O1 Amb6600560 [0,0,0,1,0,1|2,0,0]=4 4574 B9R1.69 CC1C=C(I)C(=O)CC1 Amb32867829 [0,0,0,1,0,1|2,0,0]=4 4575 B9R1.69 CC1CC(=O)C(O)=CO1 Amb28351460 [0,0,0,1,0,1|2,0,0]=4 4576 B9R1.69 CC1CC=C(Br)C(=O)N1 Amb27494118 [0,0,0,1,0,1|2,0,0]=4 4577 B9R1.69 CC1CC=C(Cl)C(=O)C1 Amb27199164 [0,0,0,1,0,1|2,0,0]=4 4578 B9R1.69 CC1CCC(=O)C=C1O Amb26053264 [0,0,0,1,0,1|1,0,1]=4 4579 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [0,0,0,1,0,1|1,0,0]=3 4580 B9R1.69 CC1CCC(=O)NC1=O Amb21963732 [0,0,0,1,0,1|1,0,0]=3 4581 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [0,0,0,1,0,1|1,0,0]=3 4582 B9R1.69 CC1CCC(O)=CC1=O Amb24532888 [0,0,0,1,0,1|1,0,0]=3 4583 B9R1.69 CC1CCC(O)C(=O)O1 Amb28285159 [0,0,0,1,0,1|1,0,1]=4 4584 B9R1.69 CC1CNC(=O)C(=O)O1 Amb27961492 [0,0,0,1,0,1|1,0,0]=3 4585 B9R1.69 CC1CNC(=O)CC1=O Amb19958593 [0,0,0,1,0,1|1,0,0]=3 4586 B9R1.69 CC1CNC(=O)NC1=O Amb1152691 [0,0,0,1,0,1|1,0,0]=3 4587 B9R1.69 CC1CNC(O)=NC1=O Amb4256704 [0,0,0,1,0,1|1,0,0]=3 4588 B9R1.69 CC1NCC(=O)NC1=O Amb26514613 [0,0,0,1,0,1|2,0,0]=4 4589 B9R1.69 CC1OCC(=O)CC1=O Amb27838792 [0,0,0,1,0,1|2,0,0]=4 4590 B9R1.69 CC1OCC(=O)NC1=O Amb27866285 [0,0,0,1,0,1|2,0,0]=4 4591 B9R1.69 CC1SCC(=O)CC1=O Amb27838733 [0,0,0,1,0,1|2,0,0]=4 4592 B9R1.69 CC1SCC(=O)NC1=O Amb32670772 [0,0,0,1,0,1|2,0,0]=4 4593 B9R1.69 CC1SCC(=O)OC1=O Amb2431035 [0,0,0,1,0,1|2,0,0]=4 4594 B9R1.69 CN1CCC(=O)CC1=O Amb27154977 [0,0,0,1,0,1|2,0,0]=4 4595 B9R1.69 CN1CCC(=O)NC1=O Amb2389875 [0,0,0,1,0,1|2,0,0]=4 4596 B9R1.69 CN1CNC(=O)CC1=O Amb27267762 [0,0,0,1,0,1|2,0,0]=4 4597 B9R1.69 C[C@@H]1CC(=O)C(O)=CO1 Amb28350976 [0,0,0,1,0,1|2,0,0]=4 4598 B9R1.69 C[C@@H]1COC(=O)N[C@H]1C Amb27203324 [0,0,0,1,0,1|1,0,1]=4 4599 B9R1.69 C[C@@H]1OC[C@@H](C)NC1=O Amb27216673 [0,0,0,1,0,1|1,0,1]=4 4600 B9R1.69 C[C@H]1CC[C@@H](O)CC1=O Amb27427823 [0,0,0,1,0,1|1,0,1]=4 4601 B9R1.69 C[C@H]1CNC(=O)NC1=O Amb27655087 [0,0,0,1,0,1|1,0,0]=3 4602 B9R1.69 C[C@H]1COC(=O)C[C@@H]1O Amb27853905 [0,0,0,1,0,1|0,0,2]=4 4603 B9R1.69 C[C@H]1CO[C@@H](C)C(=O)N1 Amb26975581 [0,0,0,1,0,1|1,0,1]=4 4604 B9R1.69 C[C@H]1C[C@@H](C)COC1=O Amb27251551 [0,0,0,1,0,1|1,0,1]=4 4605 B9R1.69 NC1CCC(=O)NC1=O Amb16233835 [0,0,0,1,0,1|2,0,0]=4 4606 B9R1.69 NC1CCC(=O)NC1=O Amb20620338 [0,0,0,1,0,1|2,0,0]=4 4607 B9R1.69 NC1CCC(=O)NC1=O Amb22640986 [0,0,0,1,0,1|2,0,0]=4 4608 B9R1.69 NC1CCC(=O)NC1=O Amb30982658 [0,0,0,1,0,1|2,0,0]=4 4609 B9R1.69 NC1CCC(=O)OC1=O Amb27838431 [0,0,0,1,0,1|2,0,0]=4 4610 B9R1.69 NC1CNC(=O)NC1=O Amb28429840 [0,0,0,1,0,1|2,0,0]=4 4611 B9R1.69 N[C@@H]1CCC(=O)NC1=O Amb18536900 [0,0,0,1,0,1|2,0,0]=4 4612 B9R1.69 N[C@@H]1CCC(=O)NC1=O Amb31291118 [0,0,0,1,0,1|2,0,0]=4 4613 B9R1.69 O=C1CCC(Br)C(=O)N1 Amb22735973 [0,0,0,1,0,1|2,0,0]=4 4614 B9R1.69 O=C1CCC(Br)C(=O)O1 Amb25680134 [0,0,0,1,0,1|2,0,0]=4 4615 B9R1.69 O=C1CCC(O)C(=O)C1 Amb27409551 [0,0,0,1,0,1|2,0,0]=4 4616 B9R1.69 O=C1CC[C@H](O)C(=O)N1 Amb27954578 [0,0,0,1,0,1|2,0,0]=4 4617 B9R1.69 O=C1NCC(Br)C(=O)N1 Amb1156185 [0,0,0,1,0,1|2,0,0]=4 4618 B9R1.69 O=C1NCC(Cl)C(=O)N1 Amb2099523 [0,0,0,1,0,1|2,0,0]=4 4619 B9R1.69 O=C1NCC(F)C(=O)N1 Amb17614408 [0,0,0,1,0,1|2,0,0]=4 4620 B9R1.69 O=C1NC[C@@H](F)C(=O)N1 Amb26889424 [0,0,0,1,0,1|2,0,0]=4 4621 B9R1.69 O=C1OCC(Br)C=C1Br Amb25727424 [0,0,0,1,0,1|2,0,0]=4 4622 B9R1.112 C=C(Cl)C(=O)NC1CC1 Amb28293286 [0,0,0,1,0,1|2,0,0]=4 4623 B9R1.112 CC(=O)C(=O)NC1CC1 Amb17399817 [0,0,0,1,0,1|1,0,0]=3 4624 B9R1.112 CC(CC1CC1)C(=O)O Amb28075498 [0,0,0,1,0,1|1,0,1]=4 4625 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [0,0,0,1,0,1|1,0,1]=4 4626 B9R1.112 CC(O)C(=O)NC1CC1 Amb9421390 [0,0,0,1,0,1|1,0,1]=4 4627 B9R1.112 CC(O)C(=O)OC1CC1 Amb27766995 [0,0,0,1,0,1|1,0,1]=4 4628 B9R1.112 CC(OC1CC1)C(=O)O Amb27667232 [0,0,0,1,0,1|1,0,1]=4 4629 B9R1.112 CN(O)C(=O)NC1CC1 Amb27856393 [0,0,0,1,0,1|2,0,0]=4 4630 B9R1.112 C[C@@H](CC1CC1)C(=O)O Amb10844014 [0,0,0,1,0,1|1,0,1]=4 4631 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [0,0,0,1,0,1|1,0,1]=4 4632 B9R1.112 C[C@@H](O)C(=O)OC1CC1 Amb27837624 [0,0,0,1,0,1|1,0,1]=4 4633 B9R1.112 C[C@H](CC1CC1)C(=O)O Amb33749387 [0,0,0,1,0,1|1,0,1]=4 4634 B9R1.112 C[C@H](O)C(=O)NC1CC1 Amb27173655 [0,0,0,1,0,1|1,0,1]=4 4635 B9R1.112 C[C@H](O)C(=O)OC1CC1 Amb28054075 [0,0,0,1,0,1|1,0,1]=4 4636 B9R1.112 C\C(=C/C1CC1)C(=O)O Amb25996000 [0,0,0,1,0,1|1,0,0]=3 4637 B9R1.112 NC(=O)C(=O)NC1CC1 Amb28255966 [0,0,0,1,0,1|1,0,0]=3 4638 B9R1.112 NC(=S)C(=O)NC1CC1 Amb19515263 [0,0,0,1,0,1|1,1,0]=4 4639 B9R1.112 NC(CC1CC1)C(=O)O Amb23399727 [0,0,0,1,0,1|1,0,1]=4 4640 B9R1.112 NC(CC1CC1)C(=O)O Amb4019455 [0,0,0,1,0,1|1,0,1]=4 4641 B9R1.112 N[C@@H](CC1CC1)C(=O)O Amb24329024 [0,0,0,1,0,1|1,0,1]=4 4642 B9R1.112 N[C@H](CC1CC1)C(=O)O Amb2699114 [0,0,0,1,0,1|1,0,1]=4 4643 B9R1.112 O=C(O)C(=O)CC1CC1 Amb18988329 [0,0,0,1,0,1|0,0,0]=2 4644 B9R1.112 O=C(O)C(=O)NC1CC1 Amb9303797 [0,0,0,1,0,1|0,0,0]=2 4645 B9R1.112 O=C(O)C(F)CC1CC1 Amb27838541 [0,0,0,1,0,1|1,0,1]=4 4646 B9R1.112 O=C(O)C(O)CC1CC1 Amb25082516 [0,0,0,1,0,1|0,0,2]=4 4647 B9R1.112 O=C(O)C(S)CC1CC1 Amb18296302 [0,0,0,1,0,1|0,1,1]=4 4648 B9R1.112 O=C(O)[C@@H](O)CC1CC1 Amb23401512 [0,0,0,1,0,1|0,0,2]=4 4649 B9R1.112 O=C(O)[C@H](O)CC1CC1 Amb26014645 [0,0,0,1,0,1|0,0,2]=4 4650 B9R1.112 O=C(O)\C(F)=C\C1CC1 Amb25102827 [0,0,0,1,0,1|1,0,0]=3 4651 B9R1.137 C=C(C)CC(=O)C1CC1 Amb27977021 [0,0,0,1,0,1|2,0,0]=4 4652 B9R1.137 CC(=O)CC(=O)C1CC1 Amb9206108 [0,0,0,1,0,1|1,0,0]=3 4653 B9R1.137 CC(=O)\C=C(/C)C1CC1 Amb28351677 [0,0,0,1,0,1|2,0,0]=4 4654 B9R1.137 CC(=O)\C=C(\C)C1CC1 Amb25889814 [0,0,0,1,0,1|2,0,0]=4 4655 B9R1.137 CC(C)=CC(=O)C1CC1 Amb28367871 [0,0,0,1,0,1|2,0,0]=4 4656 B9R1.137 CC(C)CC(=O)C1CO1 Amb27844027 [0,0,0,1,0,1|1,0,1]=4 4657 B9R1.137 CC(C)CC(=O)[C@H]1CO1 Amb28124540 [0,0,0,1,0,1|1,0,1]=4 4658 B9R1.137 CC(CC(=O)O)C1CC1 Amb6749210 [0,0,0,1,0,1|1,0,1]=4 4659 B9R1.137 CN(CC(=O)O)C1CC1 Amb8892577 [0,0,0,1,0,1|2,0,0]=4 4660 B9R1.137 CS(=O)CC(=O)C1CC1 Amb27984475 [0,0,0,1,0,1|2,0,0]=4 4661 B9R1.137 C\C(=C/C(=O)O)C1CC1 Amb10609547 [0,0,0,1,0,1|1,0,0]=3 4662 B9R1.137 C\C(=C\C(=O)O)C1CC1 Amb10718081 [0,0,0,1,0,1|1,0,0]=3 4663 B9R1.137 C\C(N)=C/C(=O)C1CC1 Amb27648094 [0,0,0,1,0,1|2,0,0]=4 4664 B9R1.137 NC(=O)NC(=O)C1CC1 Amb25104753 [0,0,0,1,0,1|1,0,0]=3 4665 B9R1.137 NC(CC(=O)O)C1CC1 Amb2683273 [0,0,0,1,0,1|1,0,1]=4 4666 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb26989123 [0,0,0,1,0,1|1,0,1]=4 4667 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb33329309 [0,0,0,1,0,1|1,0,1]=4 4668 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb24349802 [0,0,0,1,0,1|1,0,1]=4 4669 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb33329112 [0,0,0,1,0,1|1,0,1]=4 4670 B9R1.137 O=C(O)CC(=O)C1CC1 Amb10576272 [0,0,0,1,0,1|0,0,0]=2 4671 B9R1.137 O=C(O)CC(O)C1CC1 Amb17231863 [0,0,0,1,0,1|0,0,2]=4 4672 B9R1.137 O=C(O)C[C@@H](O)C1CC1 Amb25367343 [0,0,0,1,0,1|0,0,2]=4 4673 B9R1.137 O=C(O)C[C@H](O)C1CC1 Amb27468740 [0,0,0,1,0,1|0,0,2]=4 4674 B9R1.137 O=C(O)\C=C(\Cl)C1CC1 Amb25272142 [0,0,0,1,0,1|1,0,0]=3 4675 B9R1.139 C=C1C(C(C)=O)C1(C)C Amb27762509 [0,0,0,1,0,1|2,0,0]=4 4676 B9R1.139 CC1(C)C(Br)C1C(=O)O Amb28078793 [0,0,0,1,0,1|1,0,1]=4 4677 B9R1.139 CC1(C)C(C(=O)O)[C@H]1Cl Amb28043135 [0,0,0,1,0,1|1,0,1]=4 4678 B9R1.139 CC1(C)C(O)C1C(=O)O Amb27642274 [0,0,0,1,0,1|0,0,2]=4 4679 B9R1.139 C[C@@H]1[C@@H](C(=O)O)C1(C)C Amb27247272 [0,0,0,1,0,1|1,0,1]=4 4680 B9R1.139 C[C@H]1[C@@H](C(=O)O)C1(C)C Amb28429827 [0,0,0,1,0,1|1,0,1]=4 4681 B9R1.152 CC1CC(C)(C(=O)O)C1 Amb23448860 [0,0,0,1,0,1|1,0,1]=4 4682 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb25821754 [0,0,0,1,0,1|1,0,1]=4 4683 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb30585229 [0,0,0,1,0,1|1,0,1]=4 4684 B9R1.153 CC1(C)C(=O)CS1(=O)=O Amb27838739 [0,0,0,1,0,1|1,0,1]=4 4685 B9R1.153 CC1(C)C(=O)NS1(=O)=O Amb20623854 [0,0,0,1,0,1|1,0,1]=4 4686 B9R1.153 CC1(C)CC(=O)C1(C)O Amb27838627 [0,0,0,1,0,1|1,0,1]=4 4687 B9R1.153 CC1(C)SC(=O)C1(C)O Amb27480738 [0,0,0,1,0,1|1,0,1]=4 4688 B9R1.161 CC(C)C1CC1C(=O)O Amb18285139 [0,0,0,1,0,1|1,0,1]=4 4689 B9R1.161 CC(C)[C@@H]1C[C@H]1C(=O)O Amb33360310 [0,0,0,1,0,1|1,0,1]=4 4690 B9R1.161 CC(C)[C@@H]1O[C@H]1C(=O)O Amb28252782 [0,0,0,1,0,1|0,0,2]=4 4691 B9R1.164 CC1(C)C=C(C(=O)O)C1 Amb22405981 [0,0,0,1,0,1|1,0,0]=3 4692 B9R1.164 CC1(C)CC(C(=O)O)C1 Amb33542624 [0,0,0,1,0,1|1,0,1]=4 4693 B9R1.164 CC1(C)CC(C(=O)O)N1 Amb24117447 [0,0,0,1,0,1|1,0,1]=4 4694 B9R1.169 CC1(C)CC1(N)C(=O)O Amb35788491 [0,0,0,1,0,1|1,0,1]=4 4695 B9R1.169 CC1(C)CC1(N)C(=O)O Amb4296872 [0,0,0,1,0,1|1,0,1]=4 4696 B9R1.169 CC1(C)C[C@@]1(N)C(=O)O Amb4296946 [0,0,0,1,0,1|1,0,1]=4 4697 B9R1.170 CC1(C)CC1CC(=O)O Amb25145962 [0,0,0,1,0,1|1,0,1]=4 4698 B9R1.170 CC1(C)C\C1=C/C(=O)O Amb25056977 [0,0,0,1,0,1|1,0,0]=3 4699 B9R1.3 C=C1C(=O)CCC[C@@H]1C Amb27838735 [0,1,0,1,0,0|2,0,0]=4 4700 B9R1.3 CC1=CCCC(C)C1=O Amb17593286 [0,1,0,1,0,0|2,0,0]=4 4701 B9R1.3 CC1=COCC(C)C1=O Amb24545605 [0,1,0,1,0,0|1,0,0]=3 4702 B9R1.3 CC1COCC(C)C1=O Amb22299425 [0,1,0,1,0,0|1,0,1]=4 4703 B9R1.3 CC1OC=CC(=O)C1=O Amb26429858 [0,1,0,1,0,0|1,0,1]=4 4704 B9R1.3 CN1CCCC(=O)C1=O Amb33547367 [0,1,0,1,0,0|2,0,0]=4 4705 B9R1.3 CN1CCNC(=O)C1=O Amb16544042 [0,1,0,1,0,0|2,0,0]=4 4706 B9R1.3 C[C@@H]1CCOC(=O)[C@H]1O Amb27197166 [0,1,0,1,0,0|0,0,2]=4 4707 B9R1.3 C[C@H]1CCOC(=O)[C@@H]1O Amb27196773 [0,1,0,1,0,0|0,0,2]=4 4708 B9R1.3 NC1CCCC(=O)C1=O Amb28042602 [0,1,0,1,0,0|2,0,0]=4 4709 B9R1.3 O=C1C(O)=CCOC1O Amb27164545 [0,1,0,1,0,0|2,0,0]=4 4710 B9R1.3 O=C1CCCC(Br)C1=O Amb27866033 [0,1,0,1,0,0|2,0,0]=4 4711 B9R1.37 C=C1C(=O)CC(C)C1=O Amb28192131 [0,1,0,1,0,0|1,0,0]=3 4712 B9R1.37 C=C1C(=O)OC(C)C1O Amb28315459 [0,1,0,1,0,0|2,0,0]=4 4713 B9R1.37 CC1=C(C)C(C)OC1=O Amb21926616 [0,1,0,1,0,0|1,0,1]=4 4714 B9R1.37 CC1=C(C)C(O)OC1=O Amb17778789 [0,1,0,1,0,0|1,0,1]=4 4715 B9R1.37 CC1=C(Cl)C(=O)OC1O Amb24401510 [0,1,0,1,0,0|1,0,1]=4 4716 B9R1.37 CC1=C(O)C(=O)C(Br)C1 Amb27768656 [0,1,0,1,0,0|2,0,0]=4 4717 B9R1.37 CC1=C(O)C(=O)C(C)O1 Amb8386150 [0,1,0,1,0,0|2,0,0]=4 4718 B9R1.37 CC1=C(O)C(=O)CC1C Amb26593809 [0,1,0,1,0,0|1,0,0]=3 4719 B9R1.37 CC1=C(O)C(=O)CC1O Amb28315501 [0,1,0,1,0,0|2,0,0]=4 4720 B9R1.37 CC1=C(O)C(=O)OC1C Amb8393149 [0,1,0,1,0,0|0,0,2]=4 4721 B9R1.37 CC1=C(O)C(=O)[C@@H](C)O1 Amb27222092 [0,1,0,1,0,0|2,0,0]=4 4722 B9R1.37 CC1=C(O)CC(O)C1=O Amb27948592 [0,1,0,1,0,0|2,0,0]=4 4723 B9R1.37 CC1=C[C@@H](O)[C@@H](C)C1=O Amb27187016 [0,1,0,1,0,0|2,0,0]=4 4724 B9R1.37 CC1=C[C@H](O)[C@@H](C)C1=O Amb28283154 [0,1,0,1,0,0|2,0,0]=4 4725 B9R1.37 CC1CC(=O)C(=O)C1C Amb8514920 [0,1,0,1,0,0|1,0,0]=3 4726 B9R1.37 CC1CC(=O)C(C)C1=O Amb27838774 [0,1,0,1,0,0|1,0,1]=4 4727 B9R1.37 CC1CC(=O)C(O)=C1O Amb27153105 [0,1,0,1,0,0|0,0,1]=3 4728 B9R1.37 CC1CC(C)C(=O)C1=O Amb22334650 [0,1,0,1,0,0|1,0,0]=3 4729 B9R1.37 CC1CC(C)C(O)C1=O Amb27844251 [0,1,0,1,0,0|1,0,1]=4 4730 B9R1.37 CC1CN(O)C(=O)C1N Amb25888759 [0,1,0,1,0,0|1,0,1]=4 4731 B9R1.37 CC1OC(=O)C(=O)C1C Amb24360322 [0,1,0,1,0,0|0,0,0]=2 4732 B9R1.37 CC1OC(=O)C(N)C1C Amb27424680 [0,1,0,1,0,0|1,0,1]=4 4733 B9R1.37 CC1OC(=O)C(O)C1=O Amb27222152 [0,1,0,1,0,0|1,0,1]=4 4734 B9R1.37 CC1OC(C)C(=O)C1=O Amb28381239 [0,1,0,1,0,0|2,0,0]=4 4735 B9R1.37 CN1CC(O)=C(O)C1=O Amb25145483 [0,1,0,1,0,0|1,0,1]=4 4736 B9R1.37 C[C@@H]1CN(O)C(=O)[C@@H]1N Amb30588539 [0,1,0,1,0,0|1,0,1]=4 4737 B9R1.37 C[C@@H]1CN(O)C(=O)[C@@H]1N Amb30640026 [0,1,0,1,0,0|1,0,1]=4 4738 B9R1.37 C[C@@H]1OC(=O)C(O)=C1O Amb25332813 [0,1,0,1,0,0|1,0,1]=4 4739 B9R1.37 C[C@@H]1OC(=O)[C@@H](N)[C@@H]1C Amb27203003 [0,1,0,1,0,0|1,0,1]=4 4740 B9R1.37 C[C@@H]1OC(=O)[C@@H](N)[C@H]1C Amb25946352 [0,1,0,1,0,0|1,0,1]=4 4741 B9R1.37 C[C@@H]1OC(=O)[C@H](N)[C@@H]1C Amb27961355 [0,1,0,1,0,0|1,0,1]=4 4742 B9R1.37 C[C@H]1CC(=O)N(C)C1=O Amb25933614 [0,1,0,1,0,0|2,0,0]=4 4743 B9R1.37 C[C@H]1CN(O)C(=O)[C@@H]1N Amb24587752 [0,1,0,1,0,0|1,0,1]=4 4744 B9R1.37 C[C@H]1CN(O)C(=O)[C@H]1N Amb27215974 [0,1,0,1,0,0|1,0,1]=4 4745 B9R1.37 C[C@H]1OC(=O)[C@H](N)[C@H]1C Amb27421606 [0,1,0,1,0,0|1,0,1]=4 4746 B9R1.37 C[C@H]1[C@H](N)C(=O)O[C@@H]1C Amb26415247 [0,1,0,1,0,0|1,0,1]=4 4747 B9R1.37 N[C@H]1CC(=O)N(O)C1=O Amb28249834 [0,1,0,1,0,0|2,0,0]=4 4748 B9R1.37 O=C1C(=O)C(Cl)CC1Cl Amb27749695 [0,1,0,1,0,0|2,0,0]=4 4749 B9R1.37 O=C1C(O)=C(Cl)CC1O Amb27838813 [0,1,0,1,0,0|2,0,0]=4 4750 B9R1.41 CC(=O)C1=CCC[C@@H]1C Amb27668819 [0,1,0,1,0,0|2,0,0]=4 4751 B9R1.41 CC(C)=C1N=COC1=O Amb28135727 [0,1,0,1,0,0|1,0,1]=4 4752 B9R1.41 CC(C)C1=NSNC1=O Amb24605164 [0,1,0,1,0,0|1,1,0]=4 4753 B9R1.41 CC(C)C1C=COC1=O Amb27427630 [0,1,0,1,0,0|1,0,1]=4 4754 B9R1.41 CC(C)C1COCC1=O Amb23590155 [0,1,0,1,0,0|1,0,1]=4 4755 B9R1.41 CC(C)c1ccoc1Br Amb13884534 [0,1,0,1,0,0|2,0,0]=4 4756 B9R1.41 CC(C)c1cnoc1Cl Amb27665880 [0,1,0,1,0,0|2,0,0]=4 4757 B9R1.41 CC(C)c1cnoc1N Amb24558033 [0,1,0,1,0,0|2,0,0]=4 4758 B9R1.41 CC(C)c1cocc1F Amb27462639 [0,1,0,1,0,0|2,0,0]=4 4759 B9R1.41 CC(C)c1conc1N Amb24481750 [0,1,0,1,0,0|2,0,0]=4 4760 B9R1.41 CC(C)c1nonc1N Amb33528946 [0,1,0,1,0,0|2,0,0]=4 4761 B9R1.41 CC1=C(C(=O)O)CCC1 Amb4021851 [0,1,0,1,0,0|1,0,1]=4 4762 B9R1.41 CC1=C(C(=O)O)CCN1 Amb32672006 [0,1,0,1,0,0|1,0,1]=4 4763 B9R1.41 CC1=C(C(=O)O)CCO1 Amb26326654 [0,1,0,1,0,0|1,0,1]=4 4764 B9R1.41 CC1=C(C(=O)O)CCS1 Amb24750254 [0,1,0,1,0,0|1,0,1]=4 4765 B9R1.41 CC1=C(C(=O)O)CNC1 Amb28188857 [0,1,0,1,0,0|1,0,1]=4 4766 B9R1.41 CC1CCCC1C(=O)O Amb8496598 [0,1,0,1,0,0|1,0,1]=4 4767 B9R1.41 CC1CCNC1C(=O)O Amb22496299 [0,1,0,1,0,0|1,0,1]=4 4768 B9R1.41 CC1CCNC1C(=O)O Amb28895929 [0,1,0,1,0,0|1,0,1]=4 4769 B9R1.41 CC1CCN[C@@H]1C(=O)O Amb25786199 [0,1,0,1,0,0|1,0,1]=4 4770 B9R1.41 CC1CCOC1C(=O)O Amb20668280 [0,1,0,1,0,0|0,0,2]=4 4771 B9R1.41 CC1CCSC1C(=O)O Amb33038449 [0,1,0,1,0,0|0,1,1]=4 4772 B9R1.41 CC1CNCC1C(=O)O Amb2695368 [0,1,0,1,0,0|1,0,1]=4 4773 B9R1.41 CC1CNCC1C(=O)O Amb32665482 [0,1,0,1,0,0|1,0,1]=4 4774 B9R1.41 CC1NCC=C1C(=O)O Amb27603549 [0,1,0,1,0,0|1,0,0]=3 4775 B9R1.41 CC1NCCC1C(=O)O Amb18118138 [0,1,0,1,0,0|1,0,1]=4 4776 B9R1.41 CC1NCCC1C(=O)O Amb28555367 [0,1,0,1,0,0|1,0,1]=4 4777 B9R1.41 CC1OCCC1C(=O)O Amb33548509 [0,1,0,1,0,0|1,0,1]=4 4778 B9R1.41 CC1OCOC1C(=O)O Amb27828880 [0,1,0,1,0,0|0,0,2]=4 4779 B9R1.41 CC1SCNC1C(=O)O Amb27591597 [0,1,0,1,0,0|1,0,1]=4 4780 B9R1.41 C[C@@H]1CCCC1C(=O)O Amb27167847 [0,1,0,1,0,0|1,0,1]=4 4781 B9R1.41 C[C@@H]1CCC[C@@H]1C(=O)O Amb10843957 [0,1,0,1,0,0|1,0,1]=4 4782 B9R1.41 C[C@@H]1CCC[C@H]1C(=O)O Amb10843949 [0,1,0,1,0,0|1,0,1]=4 4783 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O Amb22747259 [0,1,0,1,0,0|1,0,1]=4 4784 B9R1.41 C[C@@H]1CCO[C@@H]1C(=O)O Amb25251332 [0,1,0,1,0,0|0,0,2]=4 4785 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O Amb34916171 [0,1,0,1,0,0|0,0,2]=4 4786 B9R1.41 C[C@@H]1CNC[C@@H]1C(=O)O Amb27440055 [0,1,0,1,0,0|1,0,1]=4 4787 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb26442159 [0,1,0,1,0,0|1,0,1]=4 4788 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O Amb32664837 [0,1,0,1,0,0|1,0,1]=4 4789 B9R1.41 C[C@@H]1COC[C@H]1C(=O)O Amb28286229 [0,1,0,1,0,0|0,0,2]=4 4790 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O Amb27969130 [0,1,0,1,0,0|1,0,1]=4 4791 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O Amb18832568 [0,1,0,1,0,0|1,0,1]=4 4792 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O Amb22886528 [0,1,0,1,0,0|1,0,1]=4 4793 B9R1.41 C[C@@H]1OCC[C@H]1C(=O)O Amb25992190 [0,1,0,1,0,0|1,0,1]=4 4794 B9R1.41 C[C@H]1CCC[C@@H]1C(=O)O Amb10843959 [0,1,0,1,0,0|1,0,1]=4 4795 B9R1.41 C[C@H]1CCC[C@H]1C(=O)O Amb10843950 [0,1,0,1,0,0|1,0,1]=4 4796 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O Amb8387164 [0,1,0,1,0,0|1,0,1]=4 4797 B9R1.41 C[C@H]1CNC[C@@H]1C(=O)O Amb27217270 [0,1,0,1,0,0|1,0,1]=4 4798 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O Amb27655604 [0,1,0,1,0,0|1,0,1]=4 4799 B9R1.41 C[C@H]1OCC[C@H]1C(=O)O Amb25253338 [0,1,0,1,0,0|1,0,1]=4 4800 B9R1.41 C[C@H]1OCNC1C(=O)O Amb28057581 [0,1,0,1,0,0|1,0,1]=4 4801 B9R1.41 C[C@H]1OCN[C@@H]1C(=O)O Amb27782646 [0,1,0,1,0,0|1,0,1]=4 4802 B9R1.41 C[C@H]1OCO[C@@H]1C(=O)O Amb27782406 [0,1,0,1,0,0|0,0,2]=4 4803 B9R1.41 O=C(O)C1=CCCC1O Amb27251744 [0,1,0,1,0,0|2,0,0]=4 4804 B9R1.41 O=C(O)C1=NCCC1O Amb28137087 [0,1,0,1,0,0|2,0,0]=4 4805 B9R1.81 COC(=O)C1CCC1C Amb25110041 [0,1,0,1,0,0|1,0,1]=4 4806 B9R1.81 COC(=O)C1NCC1C Amb28070582 [0,1,0,1,0,0|1,0,1]=4 4807 B9R1.81 COC(=O)[C@H]1CC[C@H]1C Amb25919237 [0,1,0,1,0,0|1,0,1]=4 4808 B9R1.91 CC1(C)OC(CO)C1=O Amb27970150 [0,1,0,1,0,0|0,0,2]=4 4809 B9R1.93 CC1(C(=O)O)CC1CO Amb24559345 [0,1,0,1,0,0|1,0,1]=4 4810 B9R1.93 CCC1CC1(N)C(=O)O Amb24655862 [0,1,0,1,0,0|1,0,1]=4 4811 B9R1.93 CCC1CC1(O)C(=O)O Amb27607715 [0,1,0,1,0,0|0,0,2]=4 4812 B9R1.93 CC[C@@H]1CC1(N)C(=O)O Amb25104706 [0,1,0,1,0,0|1,0,1]=4 4813 B9R1.93 CC[C@@H]1C[C@@]1(C)C(=O)O Amb33098402 [0,1,0,1,0,0|1,0,1]=4 4814 B9R1.93 CC[C@@H]1C[C@@]1(N)C(=O)O Amb23452849 [0,1,0,1,0,0|1,0,1]=4 4815 B9R1.93 CC[C@H]1CC1(N)C(=O)O Amb26556180 [0,1,0,1,0,0|1,0,1]=4 4816 B9R1.93 CC[C@H]1C[C@@]1(C)C(=O)O Amb33098405 [0,1,0,1,0,0|1,0,1]=4 4817 B9R1.93 CC[C@H]1C[C@]1(N)C(=O)O Amb27961471 [0,1,0,1,0,0|1,0,1]=4 4818 B9R1.93 C[C@@]1(C(=O)O)C[C@@H]1CO Amb33098403 [0,1,0,1,0,0|1,0,1]=4 4819 B9R1.93 C[C@@]1(C(=O)O)C[C@H]1CO Amb33098404 [0,1,0,1,0,0|1,0,1]=4 4820 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CF Amb33098429 [0,1,0,1,0,0|1,0,1]=4 4821 B9R1.93 C[C@]1(C(=O)O)C[C@@H]1CO Amb33098423 [0,1,0,1,0,0|1,0,1]=4 4822 B9R1.93 NC1(C(=O)O)CC1CO Amb25828351 [0,1,0,1,0,0|1,0,1]=4 4823 B9R1.93 NCC1CC1(N)C(=O)O Amb27873291 [0,1,0,1,0,0|1,0,1]=4 4824 B9R1.93 NC[C@@H]1C[C@@]1(N)C(=O)O Amb24763621 [0,1,0,1,0,0|1,0,1]=4 4825 B9R1.93 N[C@@]1(C(=O)O)C[C@H]1CO Amb26405303 [0,1,0,1,0,0|1,0,1]=4 4826 B9R1.93 N[C@]1(C(=O)O)C[C@@H]1CO Amb2694928 [0,1,0,1,0,0|1,0,1]=4 4827 B9R1.93 N[C@]1(C(=O)O)C[C@H]1CO Amb25101898 [0,1,0,1,0,0|1,0,1]=4 4828 B9R1.93 O=C(O)C1(Cl)CC1CCl Amb24404084 [0,1,0,1,0,0|1,0,1]=4 4829 B9R1.96 CCC1CCC1C(=O)O Amb25727014 [0,1,0,1,0,0|1,0,1]=4 4830 B9R1.96 CCC1CN[C@@H]1C(=O)O Amb30633665 [0,1,0,1,0,0|1,0,1]=4 4831 B9R1.96 COC1CCC1C(=O)O Amb26516125 [0,1,0,1,0,0|1,0,1]=4 4832 B9R1.96 CO[C@@H]1CC[C@@H]1C(=O)O Amb34912847 [0,1,0,1,0,0|1,0,1]=4 4833 B9R1.96 CO[C@@H]1CC[C@H]1C(=O)O Amb26636288 [0,1,0,1,0,0|1,0,1]=4 4834 B9R1.96 NC[C@@H]1CC[C@H]1C(=O)O Amb27259838 [0,1,0,1,0,0|1,0,1]=4 4835 B9R1.96 O=C(O)C1CCC1CF Amb20667674 [0,1,0,1,0,0|1,0,1]=4 4836 B9R1.96 O=C(O)C1CCC1CO Amb24340315 [0,1,0,1,0,0|1,0,1]=4 4837 B9R1.96 O=C(O)N1CCC1CO Amb22756926 [0,1,0,1,0,0|2,0,0]=4 4838 B9R1.101 C=CC(=O)C(=C)C1CC1 Amb27838800 [0,1,0,1,0,0|2,0,0]=4 4839 B9R1.101 CC(C=O)C(=O)C1CC1 Amb26031968 [0,1,0,1,0,0|1,0,1]=4 4840 B9R1.101 CN(C(=O)CO)C1CC1 Amb24404537 [0,1,0,1,0,0|2,0,0]=4 4841 B9R1.101 CN(N=O)C(=O)C1CC1 Amb27633678 [0,1,0,1,0,0|2,0,0]=4 4842 B9R1.101 COC(=O)C(=O)C1CC1 Amb25880883 [0,1,0,1,0,0|0,0,0]=2 4843 B9R1.101 COC(=O)C(Br)C1CC1 Amb26638854 [0,1,0,1,0,0|1,0,1]=4 4844 B9R1.101 COC(=O)C(Cl)=C1CC1 Amb22002422 [0,1,0,1,0,0|1,0,1]=4 4845 B9R1.101 COC(=O)C(Cl)C1CC1 Amb20623820 [0,1,0,1,0,0|1,0,1]=4 4846 B9R1.101 COC(=O)C(N)C1CC1 Amb13883561 [0,1,0,1,0,0|1,0,1]=4 4847 B9R1.101 COC(=O)C(N)C1CC1 Amb19149335 [0,1,0,1,0,0|1,0,1]=4 4848 B9R1.101 COC(=O)C(O)C1CC1 Amb22059072 [0,1,0,1,0,0|0,0,2]=4 4849 B9R1.101 COC(=O)C(S)C1CC1 Amb24384464 [0,1,0,1,0,0|0,1,1]=4 4850 B9R1.101 COC(=O)N(N)C1CC1 Amb33191645 [0,1,0,1,0,0|2,0,0]=4 4851 B9R1.101 COC(=O)[C@@H](N)C1CC1 Amb2699131 [0,1,0,1,0,0|1,0,1]=4 4852 B9R1.101 COC(=O)[C@@H](N)C1CC1 Amb8630385 [0,1,0,1,0,0|1,0,1]=4 4853 B9R1.101 COC(=O)[C@H](N)C1CC1 Amb2699130 [0,1,0,1,0,0|1,0,1]=4 4854 B9R1.101 COC(=O)[C@H](N)C1CC1 Amb33836774 [0,1,0,1,0,0|1,0,1]=4 4855 B9R1.101 CON(C)C(=O)C1CC1 Amb22233737 [0,1,0,1,0,0|2,0,0]=4 4856 B9R1.101 C\C(C=O)=C(\Cl)C1CC1 Amb27838565 [0,1,0,1,0,0|2,0,0]=4 4857 B9R1.101 C\N=C(/Cl)C(=O)C1CC1 Amb25297011 [0,1,0,1,0,0|2,0,0]=4 4858 B9R1.101 O=C(\C(O)=C\O)C1CC1 Amb27838719 [0,1,0,1,0,0|0,0,1]=3 4859 B9R1.110 C=C(C(=O)O)C1CCC1 Amb26589067 [0,1,0,1,0,0|1,0,0]=3 4860 B9R1.110 C=C(C)C(=O)C1CNC1 Amb27250954 [0,1,0,1,0,0|2,0,0]=4 4861 B9R1.110 C=C(C)C(=O)C1CSC1 Amb35715947 [0,1,0,1,0,0|2,0,0]=4 4862 B9R1.110 CC(C(=O)O)=C1CCC1 Amb25921041 [0,1,0,1,0,0|1,0,1]=4 4863 B9R1.110 CC(C(=O)O)=C1COC1 Amb35585359 [0,1,0,1,0,0|1,0,1]=4 4864 B9R1.110 CC(C(=O)O)C1CCC1 Amb33543919 [0,1,0,1,0,0|1,0,1]=4 4865 B9R1.110 CC(C(=O)O)C1CCO1 Amb26595674 [0,1,0,1,0,0|1,0,1]=4 4866 B9R1.110 CC(C(=O)O)C1CNC1 Amb26649377 [0,1,0,1,0,0|1,0,1]=4 4867 B9R1.110 CC(C(=O)O)C1CNC1 Amb28555391 [0,1,0,1,0,0|1,0,1]=4 4868 B9R1.110 CC(C(=O)O)C1COC1 Amb33313543 [0,1,0,1,0,0|1,0,1]=4 4869 B9R1.110 CC(C)C(=O)C1COC1 Amb27636696 [0,1,0,1,0,0|1,0,1]=4 4870 B9R1.110 C[C@@H](C(=O)O)C1COC1 Amb33727764 [0,1,0,1,0,0|1,0,1]=4 4871 B9R1.110 C[C@H](C(=O)O)C1COC1 Amb33749535 [0,1,0,1,0,0|1,0,1]=4 4872 B9R1.110 NC(C(=O)O)C1CCC1 Amb19149365 [0,1,0,1,0,0|1,0,1]=4 4873 B9R1.110 NC(C(=O)O)C1CNC1 Amb30040080 [0,1,0,1,0,0|1,0,1]=4 4874 B9R1.110 NC(C(=O)O)C1COC1 Amb22405987 [0,1,0,1,0,0|1,0,1]=4 4875 B9R1.110 NC(C(=O)O)C1CSC1 Amb27844776 [0,1,0,1,0,0|1,0,1]=4 4876 B9R1.110 N[C@@H](C(=O)O)C1CCC1 Amb8395977 [0,1,0,1,0,0|1,0,1]=4 4877 B9R1.110 N[C@@H](C(=O)O)C1COC1 Amb22737550 [0,1,0,1,0,0|1,0,1]=4 4878 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb30633821 [0,1,0,1,0,0|1,0,1]=4 4879 B9R1.110 N[C@H](C(=O)O)C1CCC1 Amb8395976 [0,1,0,1,0,0|1,0,1]=4 4880 B9R1.110 N[C@H](C(=O)O)C1COC1 Amb22737551 [0,1,0,1,0,0|1,0,1]=4 4881 B9R1.110 O=C(O)C(F)=C1CCC1 Amb24432885 [0,1,0,1,0,0|1,0,1]=4 4882 B9R1.110 O=C(O)C(F)=C1COC1 Amb35585360 [0,1,0,1,0,0|1,0,1]=4 4883 B9R1.110 O=C(O)C(F)C1CCC1 Amb27760713 [0,1,0,1,0,0|1,0,1]=4 4884 B9R1.110 O=C(O)C(F)C1COC1 Amb33165607 [0,1,0,1,0,0|1,0,1]=4 4885 B9R1.110 O=C(O)C(O)C1CCC1 Amb24426901 [0,1,0,1,0,0|0,0,2]=4 4886 B9R1.110 O=C(O)C(O)C1COC1 Amb26860151 [0,1,0,1,0,0|0,0,2]=4 4887 B9R1.110 O=C(O)[C@@H](O)C1CCC1 Amb34164748 [0,1,0,1,0,0|0,0,2]=4 4888 B9R1.110 O=C(O)[C@H](O)C1CCC1 Amb34165382 [0,1,0,1,0,0|0,0,2]=4 4889 B9R1.111 C=C(C(=O)O)C1(C)CC1 Amb27453004 [0,1,0,1,0,0|1,0,0]=3 4890 B9R1.111 C=C(C)C(=O)C1(N)CC1 Amb27253829 [0,1,0,1,0,0|2,0,0]=4 4891 B9R1.111 CC(C(=O)O)C1(C)CC1 Amb18832624 [0,1,0,1,0,0|1,0,1]=4 4892 B9R1.111 CC(C(=O)O)C1(F)CC1 Amb27491857 [0,1,0,1,0,0|1,0,1]=4 4893 B9R1.111 CC(C(=O)O)C1(N)CC1 Amb18832571 [0,1,0,1,0,0|1,0,1]=4 4894 B9R1.111 CC(C(=O)O)C1(O)CC1 Amb27875945 [0,1,0,1,0,0|1,0,1]=4 4895 B9R1.111 CC1(C(=O)C(=O)O)CC1 Amb33313344 [0,1,0,1,0,0|0,0,0]=2 4896 B9R1.111 CC1(C(N)C(=O)O)CC1 Amb25146159 [0,1,0,1,0,0|1,0,1]=4 4897 B9R1.111 CC1(C(N)C(=O)O)CC1 Amb30869387 [0,1,0,1,0,0|1,0,1]=4 4898 B9R1.111 CC1(C(O)C(=O)O)CC1 Amb33361276 [0,1,0,1,0,0|0,0,2]=4 4899 B9R1.111 CC1([C@@H](N)C(=O)O)CC1 Amb27630930 [0,1,0,1,0,0|1,0,1]=4 4900 B9R1.111 CC1([C@H](N)C(=O)O)CC1 Amb27965965 [0,1,0,1,0,0|1,0,1]=4 4901 B9R1.111 CC1([C@H](N)C(=O)O)CC1 Amb28989798 [0,1,0,1,0,0|1,0,1]=4 4902 B9R1.111 C[C@@H](C(=O)O)C1(C)CC1 Amb33738113 [0,1,0,1,0,0|1,0,1]=4 4903 B9R1.111 C[C@H](C(=O)O)C1(C)CC1 Amb33744643 [0,1,0,1,0,0|1,0,1]=4 4904 B9R1.111 NC(C(=O)O)C1(N)CC1 Amb26850724 [0,1,0,1,0,0|1,0,1]=4 4905 B9R1.111 NC(C(=O)O)C1(S)CC1 Amb27785321 [0,1,0,1,0,0|1,0,1]=4 4906 B9R1.111 NC1(C(O)C(=O)O)CC1 Amb27235816 [0,1,0,1,0,0|0,0,2]=4 4907 B9R1.111 N[C@@H](C(=O)O)C1(O)CC1 Amb22751391 [0,1,0,1,0,0|1,0,1]=4 4908 B9R1.111 N[C@H](C(=O)O)C1(O)CC1 Amb24117270 [0,1,0,1,0,0|1,0,1]=4 4909 B9R1.111 N[C@H](C(=O)O)C1(O)CC1 Amb27216712 [0,1,0,1,0,0|1,0,1]=4 4910 B9R1.127 CC1(CN)CC1C(=O)O Amb27481579 [0,1,0,1,0,0|1,0,1]=4 4911 B9R1.127 CCC1(C)CC1C(=O)O Amb18285802 [0,1,0,1,0,0|1,0,1]=4 4912 B9R1.132 CC1C(=O)OCC1CO Amb27853141 [0,1,0,1,0,0|1,0,1]=4 4913 B9R1.132 CC1CCC(CO)C1=O Amb27486136 [0,1,0,1,0,0|1,0,1]=4 4914 B9R1.132 CCC1COC(=O)C1N Amb28285145 [0,1,0,1,0,0|1,0,1]=4 4915 B9R1.132 CC[C@@H]1COC(=O)N1C Amb25736752 [0,1,0,1,0,0|2,0,0]=4 4916 B9R1.132 CC[C@@H]1COC(=O)[C@H]1N Amb28345688 [0,1,0,1,0,0|1,0,1]=4 4917 B9R1.132 CN1C(=O)OCC1CN Amb26030449 [0,1,0,1,0,0|2,0,0]=4 4918 B9R1.132 CN1C(=O)OCC1CO Amb22504497 [0,1,0,1,0,0|2,0,0]=4 4919 B9R1.132 CN1CC\C(=N\O)C1=O Amb28077077 [0,1,0,1,0,0|2,0,0]=4 4920 B9R1.132 COC1=C(C)C(=O)OC1 Amb28255435 [0,1,0,1,0,0|1,0,1]=4 4921 B9R1.132 COC1=C(Cl)C(=O)OC1 Amb28130118 [0,1,0,1,0,0|1,0,1]=4 4922 B9R1.132 COC1=CCC(C)C1=O Amb27267059 [0,1,0,1,0,0|1,0,0]=3 4923 B9R1.132 CO[C@H]1COC(=O)[C@@H]1O Amb27432154 [0,1,0,1,0,0|0,0,2]=4 4924 B9R1.132 C[C@@H]1C(=O)OC[C@H]1CO Amb28065887 [0,1,0,1,0,0|1,0,1]=4 4925 B9R1.132 N#CC1COC(=O)C1=O Amb27838693 [0,1,0,1,0,0|0,0,1]=3 4926 B9R1.132 NC1C(=O)OCC1CO Amb27804109 [0,1,0,1,0,0|1,0,1]=4 4927 B9R1.132 NC1C(=O)OCC1CS Amb27637863 [0,1,0,1,0,0|1,0,1]=4 4928 B9R1.132 O=C1OCC(CO)=C1F Amb27775542 [0,1,0,1,0,0|1,0,1]=4 4929 B9R1.132 O=C1OCC(CO)C1O Amb27197070 [0,1,0,1,0,0|0,0,2]=4 4930 B9R1.138 C=C1C(=O)C=CC1(C)C Amb28060554 [0,1,0,1,0,0|2,0,0]=4 4931 B9R1.138 C=C1CCC(C)(C)C1=O Amb27785076 [0,1,0,1,0,0|2,0,0]=4 4932 B9R1.138 CC1(Br)COC(=O)C1=O Amb17595052 [0,1,0,1,0,0|0,0,0]=2 4933 B9R1.138 CC1(C)C=CC(=O)C1=O Amb28054370 [0,1,0,1,0,0|1,0,0]=3 4934 B9R1.138 CC1(C)CCC(=O)C1=O Amb27838751 [0,1,0,1,0,0|1,0,0]=3 4935 B9R1.138 CC1(C)CNC(=O)C1=O Amb22295904 [0,1,0,1,0,0|1,0,0]=3 4936 B9R1.138 CC1(C)COC(=O)C1=O Amb3941520 [0,1,0,1,0,0|0,0,0]=2 4937 B9R1.138 CC1(C)COC(=O)C1Cl Amb27477382 [0,1,0,1,0,0|1,0,1]=4 4938 B9R1.138 CC1(C)COC(=O)C1N Amb18642696 [0,1,0,1,0,0|1,0,1]=4 4939 B9R1.138 CC1(C)COC(=O)C1N Amb28935018 [0,1,0,1,0,0|1,0,1]=4 4940 B9R1.138 CC1(C)COC(=O)C1O Amb532977 [0,1,0,1,0,0|0,0,2]=4 4941 B9R1.138 CC1(C)COC(=O)N1Br Amb26616806 [0,1,0,1,0,0|2,0,0]=4 4942 B9R1.138 CC1(C)COC(=O)[C@@H]1Br Amb22747532 [0,1,0,1,0,0|1,0,1]=4 4943 B9R1.138 CC1(C)COC(=O)[C@@H]1N Amb25083661 [0,1,0,1,0,0|1,0,1]=4 4944 B9R1.138 CC1(C)COC(=O)[C@@H]1N Amb33338971 [0,1,0,1,0,0|1,0,1]=4 4945 B9R1.138 CC1(C)COC(=O)[C@@H]1O Amb2719697 [0,1,0,1,0,0|0,0,2]=4 4946 B9R1.138 CC1(C)COC(=O)[C@H]1Br Amb27479666 [0,1,0,1,0,0|1,0,1]=4 4947 B9R1.138 CC1(C)COC(=O)[C@H]1N Amb24589212 [0,1,0,1,0,0|1,0,1]=4 4948 B9R1.138 CC1(C)COC(=O)[C@H]1N Amb33330894 [0,1,0,1,0,0|1,0,1]=4 4949 B9R1.138 CC1(C)COC(=O)[C@H]1O Amb3939674 [0,1,0,1,0,0|0,0,2]=4 4950 B9R1.138 CC1(C)COC(Br)C1=O Amb27483939 [0,1,0,1,0,0|1,0,1]=4 4951 B9R1.138 CC1(C)NOC(=O)[C@H]1N Amb25032224 [0,1,0,1,0,0|1,0,1]=4 4952 B9R1.138 CC1(C)OCC(O)C1=O Amb27468092 [0,1,0,1,0,0|0,0,2]=4 4953 B9R1.138 CC1(Cl)CCC(=O)C1=O Amb27486096 [0,1,0,1,0,0|1,0,0]=3 4954 B9R1.138 CC1(O)CCC(=O)C1=O Amb28122175 [0,1,0,1,0,0|1,0,0]=3 4955 B9R1.138 CC1(O)CCC(O)C1=O Amb27861206 [0,1,0,1,0,0|1,0,1]=4 4956 B9R1.138 CC1=CCC(C)(Cl)C1=O Amb27409590 [0,1,0,1,0,0|2,0,0]=4 4957 B9R1.138 CC1=NOC(C)(C)C1=O Amb27838788 [0,1,0,1,0,0|1,0,0]=3 4958 B9R1.138 CN1C(=O)OCC1(C)C Amb27970325 [0,1,0,1,0,0|2,0,0]=4 4959 B9R1.138 C[C@@]1(O)CC=C(O)C1=O Amb28351523 [0,1,0,1,0,0|1,0,0]=3 4960 B9R1.138 C[C@@]1(O)CCC(=O)C1=O Amb27838709 [0,1,0,1,0,0|1,0,0]=3 4961 B9R1.138 C[C@@]1(O)CC[C@H](O)C1=O Amb27818075 [0,1,0,1,0,0|1,0,1]=4 4962 B9R1.140 CC1=C(C)C(C)(C)C1O Amb27806583 [0,1,0,1,0,0|2,0,0]=4 4963 B9R1.141 C[C@H]1[C@@H](C)[C@]1(C)C(=O)O Amb28248727 [0,1,0,1,0,0|1,0,1]=4 4964 B9R1.159 CC1CCC1(C)C(=O)O Amb28397417 [0,1,0,1,0,0|1,0,1]=4 4965 B9R1.159 CC1CCC1(N)C(=O)O Amb23456072 [0,1,0,1,0,0|1,0,1]=4 4966 B9R1.159 C[C@@H]1CC[C@@]1(C)C(=O)O Amb27655982 [0,1,0,1,0,0|1,0,1]=4 4967 B9R1.159 C[C@@H]1CC[C@@]1(N)C(=O)O Amb26027352 [0,1,0,1,0,0|1,0,1]=4 4968 B9R1.159 C[C@@H]1CC[C@]1(N)C(=O)O Amb24586126 [0,1,0,1,0,0|1,0,1]=4 4969 B9R1.159 C[C@H]1CC[C@@]1(N)C(=O)O Amb28056437 [0,1,0,1,0,0|1,0,1]=4 4970 B9R1.185 COC(=O)C1CC1(C)C Amb25762943 [0,1,0,1,0,0|1,0,1]=4 4971 B9R1.185 COC(=O)C1OC1(C)C Amb4418353 [0,1,0,1,0,0|0,0,2]=4 4972 B9R1.188 COC(=O)C1(C)CC1C Amb26415550 [0,1,0,1,0,0|1,0,1]=4 4973 B9R1.188 COC(=O)[C@]1(C)C[C@H]1C Amb27636165 [0,1,0,1,0,0|1,0,1]=4 4974 B9R1.188 COC(=O)[C@]1(N)C[C@@H]1C Amb27419940 [0,1,0,1,0,0|1,0,1]=4 4975 B9R1.188 COC(=O)[C@]1(N)C[C@H]1C Amb27619292 [0,1,0,1,0,0|1,0,1]=4 4976 B9R1.199 CCC1(C)CC(=O)C1=O Amb27844343 [0,1,0,1,0,0|1,0,0]=3 4977 B9R1.27 CC1=C(CO)C(=O)OC1 Amb27430811 [0,1,0,1,0,0|0,0,2]=4 4978 B9R1.27 CC1=C(CO)C(C)CO1 Amb27396212 [0,1,0,1,0,0|1,0,1]=4 4979 B9R1.27 CC1COC(=O)\C1=N/N Amb27452261 [0,1,0,1,0,0|1,0,0]=3 4980 B9R1.27 O=CC1=C(O)COC1=O Amb27751398 [0,1,0,1,0,0|1,0,1]=4 4981 B9R1.32 C\C=C1/C(=O)CC1(C)C Amb32649030 [0,1,0,1,0,0|2,0,0]=4 4982 B9R1.52 CC(=O)C1=C(C)CC1C Amb25879399 [0,1,0,1,0,0|2,0,0]=4 4983 B9R1.52 CC(C)=C1C(=O)CC1=O Amb28399473 [0,1,0,1,0,0|1,0,1]=4 4984 B9R1.52 CC1CC(O)C1C(=O)O Amb28076807 [0,1,0,1,0,0|0,0,2]=4 4985 B9R1.52 CC1CN(C)[C@@H]1C(=O)O Amb30869400 [0,1,0,1,0,0|1,0,1]=4 4986 B9R1.52 CC1CN(C)[C@H]1C(=O)O Amb34915559 [0,1,0,1,0,0|1,0,1]=4 4987 B9R1.52 C[C@H]1C[C@@H](O)[C@H]1C(=O)O Amb28057126 [0,1,0,1,0,0|0,0,2]=4 4988 B9R1.116 CCC(C(=O)O)C1CC1 Amb18832627 [0,1,0,1,0,0|1,0,1]=4 4989 B9R1.116 CNC(C(=O)O)C1CC1 Amb18975569 [0,1,0,1,0,0|1,0,1]=4 4990 B9R1.116 COC(C(=O)O)C1CC1 Amb24524177 [0,1,0,1,0,0|0,0,2]=4 4991 B9R1.116 NC(=O)N(N=O)C1CC1 Amb27877844 [0,1,0,1,0,0|2,0,0]=4 4992 B9R1.116 NCC(C(=O)O)C1CC1 Amb26482230 [0,1,0,1,0,0|1,0,1]=4 4993 B9R1.116 NOC(C(=O)O)C1CC1 Amb26560827 [0,1,0,1,0,0|0,0,2]=4 4994 B9R1.116 NOC(C(=O)O)C1CC1 Amb32655968 [0,1,0,1,0,0|0,0,2]=4 4995 B9R1.116 O=C(O)C(CF)C1CC1 Amb27816769 [0,1,0,1,0,0|1,0,1]=4 4996 B9R1.116 O=C(O)C(NO)C1CC1 Amb27410795 [0,1,0,1,0,0|0,0,2]=4 4997 B9R1.116 O=C(O)\C(=N\O)C1CC1 Amb26442048 [0,1,0,1,0,0|0,0,1]=3 4998 B9R1.130 CC1CC1(C#N)C(=O)O Amb28457724 [0,1,0,1,0,0|1,0,1]=4 4999 B9R1.130 CC1CC1(CN)C(=O)O Amb24502348 [0,1,0,1,0,0|1,0,1]=4 5000 B9R1.130 CC1CC1(CN)C(=O)O Amb33747377 [0,1,0,1,0,0|1,0,1]=4 5001 B9R1.130 CC1CC1(CO)C(=O)O Amb27876946 [0,1,0,1,0,0|0,0,2]=4 5002 B9R1.130 CN[C@]1(C(=O)O)C[C@H]1C Amb28347002 [0,1,0,1,0,0|1,0,1]=4 5003 B9R1.130 CSC1(C(=O)O)CC1C Amb24540432 [0,1,0,1,0,0|0,1,1]=4 5004 B9R1.130 C[C@@H]1C[C@@]1(CN)C(=O)O Amb33734028 [0,1,0,1,0,0|1,0,1]=4 5005 B9R1.130 C[C@@H]1C[C@@]1(CN)C(=O)O Amb33742278 [0,1,0,1,0,0|1,0,1]=4 5006 B9R1.166 CC1(C)CCC1C(=O)O Amb25032090 [0,1,0,1,0,0|1,0,1]=4 5007 B9R1.166 CC1(C)CNC1C(=O)O Amb24117326 [0,1,0,1,0,0|1,0,1]=4 5008 B9R1.166 CC1(C)CNC1C(=O)O Amb27253737 [0,1,0,1,0,0|1,0,1]=4 5009 B9R1.166 CC1(C)CN[C@@H]1C(=O)O Amb30869393 [0,1,0,1,0,0|1,0,1]=4 5010 B9R1.166 CC1(C)CN[C@H]1C(=O)O Amb34161295 [0,1,0,1,0,0|1,0,1]=4 5011 B9R1.166 CC1(C)COC1C(=O)O Amb8010835 [0,1,0,1,0,0|0,0,2]=4 5012 B9R1.168 CC(C)C1(C(=O)O)CC1 Amb18061747 [0,1,0,1,0,0|1,0,1]=4 5013 B9R1.102 CC(C)(C)C(=O)C1CO1 Amb27838644 [0,1,0,1,0,0|1,0,1]=4 5014 B9R1.223 CC1(C)CC(C)(O)C1=O Amb28122378 [0,1,0,1,0,0|1,0,1]=4 5015 B9R1.223 CC1(C)OC(C)(C)C1=O Amb25745784 [0,1,0,1,0,0|1,0,1]=4 5016 B9R1.165 CC(C)(C(=O)O)C1CC1 Amb33544781 [0,1,0,1,0,0|1,0,1]=4 5017 B9R1.165 CC(Cl)(C(=O)O)C1CC1 Amb27448215 [0,1,0,1,0,0|1,0,1]=4 5018 B9R1.165 CC(F)(C(=O)O)C1CC1 Amb27782191 [0,1,0,1,0,0|1,0,1]=4 5019 B9R1.165 CC(N)(C(=O)O)C1CC1 Amb22492372 [0,1,0,1,0,0|1,0,1]=4 5020 B9R1.165 CC(N)(C(=O)O)C1CC1 Amb33551932 [0,1,0,1,0,0|1,0,1]=4 5021 B9R1.165 CC(N)(C(=O)O)C1CC1 Amb9725301 [0,1,0,1,0,0|1,0,1]=4 5022 B9R1.165 CC(O)(C(=O)O)C1CC1 Amb18952003 [0,1,0,1,0,0|0,0,2]=4 5023 B9R1.165 C[C@@](N)(C(=O)O)C1CC1 Amb27975393 [0,1,0,1,0,0|1,0,1]=4 5024 B9R1.165 C[C@](N)(C(=O)O)C1CC1 Amb25975990 [0,1,0,1,0,0|1,0,1]=4 5025 B9R1.165 O=C(O)C(F)(F)C1CC1 Amb26390617 [0,1,0,1,0,0|1,0,1]=4 5026 B9R2.17 N[C@]12C[C@H]1COC2=O Amb27420696 [0,0,0,2,0,0|1,0,1]=4 5027 B9R2.144 O=C(O)C12CCC1C2 Amb28252733 [0,0,0,2,0,0|1,0,1]=4 5028 B9R2.147 O=C(O)C1C2CC1C2 Amb27634394 [0,0,0,2,0,0|1,0,1]=4 5029 B9R2.150 O=C(O)C1CC2CC21 Amb25049722 [0,0,0,2,0,0|1,0,1]=4 5030 B9R2.15 O=C1C(=O)C2CC1C2 Amb28316210 [0,0,0,2,0,0|1,0,0]=3 5031 B9R2.143 O=C(O)C1CC12CC2 Amb8010165 [0,0,0,2,0,0|1,0,1]=4 5032 B9R2.143 O=C(O)[C@@H]1CC12CC2 Amb28071386 [0,0,0,2,0,0|1,0,1]=4 5033 B7R0.6 C=C(C)\C=C\C(=O)O Amb17593153 [1,0,0,0,0,1|0,0,2]=4 5034 B7R0.6 C=C(O)\C=N\N(C)C Amb27209036 [1,0,0,0,0,1|2,0,0]=4 5035 B7R0.6 CC(=O)CC=C(C)C Amb17593170 [1,0,0,0,0,1|1,0,1]=4 5036 B7R0.6 CC(=O)CCC(C)C Amb4605991 [1,0,0,0,0,1|1,0,1]=4 5037 B7R0.6 CC(=O)CNC(C)C Amb28126943 [1,0,0,0,0,1|1,0,1]=4 5038 B7R0.6 CC(=O)CNC(C)C Amb32661638 [1,0,0,0,0,1|1,0,1]=4 5039 B7R0.6 CC(=O)COC(C)C Amb9665256 [1,0,0,0,0,1|1,0,1]=4 5040 B7R0.6 CC(=O)CSC(C)C Amb22549127 [1,0,0,0,0,1|1,0,1]=4 5041 B7R0.6 CC(=O)NCC(C)C Amb3364211 [1,0,0,0,0,1|1,0,1]=4 5042 B7R0.6 CC(=O)NNC(C)C Amb22233621 [1,0,0,0,0,1|2,0,0]=4 5043 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [1,0,0,0,0,1|1,0,1]=4 5044 B7R0.6 CC(=O)\C=C\C(C)C Amb28524833 [1,0,0,0,0,1|1,0,0]=3 5045 B7R0.6 CC(=O)\C=C\C(C)Cl Amb25782801 [1,0,0,0,0,1|2,0,0]=4 5046 B7R0.6 CC(=O)\C=C\N(C)C Amb4019563 [1,0,0,0,0,1|2,0,0]=4 5047 B7R0.6 CC(=O)\C=N\N(C)C Amb28316186 [1,0,0,0,0,1|2,0,0]=4 5048 B7R0.6 CC(=O)\N=C\C(=O)O Amb27262053 [1,0,0,0,0,1|1,0,1]=4 5049 B7R0.6 CC(=O)\N=C\C(C)O Amb27457691 [1,0,0,0,0,1|2,0,0]=4 5050 B7R0.6 CC(=O)\N=C\N(C)C Amb27950201 [1,0,0,0,0,1|2,0,0]=4 5051 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [1,0,0,0,0,1|1,0,1]=4 5052 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [1,0,0,0,0,1|0,0,1]=3 5053 B7R0.6 CC(C)=CCC(=O)[O-] Amb22491058 [1,0,0,0,0,1|0,0,2]=4 5054 B7R0.6 CC(C)=CCC(C)C Amb22731329 [1,0,0,0,0,1|2,0,0]=4 5055 B7R0.6 CC(C)C#CC(=O)O Amb33544341 [1,0,0,0,0,1|0,0,1]=3 5056 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [1,0,0,0,0,1|1,0,1]=4 5057 B7R0.6 CC(C)CCC(=O)O Amb1153016 [1,0,0,0,0,1|0,0,1]=3 5058 B7R0.6 CC(C)CCC(N)=O Amb8997711 [1,0,0,0,0,1|1,0,1]=4 5059 B7R0.6 CC(C)CNC(=O)Cl Amb35637064 [1,0,0,0,0,1|1,0,1]=4 5060 B7R0.6 CC(C)CNC(N)=O Amb1151241 [1,0,0,0,0,1|1,0,1]=4 5061 B7R0.6 CC(C)CNC(O)=S Amb27597328 [1,0,0,0,0,1|0,1,1]=4 5062 B7R0.6 CC(C)COC(=O)Cl Amb3940231 [1,0,0,0,0,1|1,0,1]=4 5063 B7R0.6 CC(C)COC(N)=O Amb4020010 [1,0,0,0,0,1|1,0,1]=4 5064 B7R0.6 CC(C)CON(=O)O Amb33780821 [1,0,0,0,0,1|1,0,1]=4 5065 B7R0.6 CC(C)CO[PH](=O)O Amb27252350 [1,0,0,0,0,1|1,0,1]=4 5066 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [1,0,0,0,0,1|1,0,1]=4 5067 B7R0.6 CC(C)NCC(=O)Cl Amb27441169 [1,0,0,0,0,1|1,0,1]=4 5068 B7R0.6 CC(C)NCC(=O)O Amb2372347 [1,0,0,0,0,1|0,0,1]=3 5069 B7R0.6 CC(C)NCC(=O)O Amb6892753 [1,0,0,0,0,1|0,0,1]=3 5070 B7R0.6 CC(C)NCC(N)=O Amb2370772 [1,0,0,0,0,1|1,0,1]=4 5071 B7R0.6 CC(C)NCC(N)=O Amb399843 [1,0,0,0,0,1|1,0,1]=4 5072 B7R0.6 CC(C)NNC(N)=O Amb27409411 [1,0,0,0,0,1|2,0,0]=4 5073 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [1,0,0,0,0,1|1,0,1]=4 5074 B7R0.6 CC(C)OCC(=O)O Amb6275796 [1,0,0,0,0,1|0,0,1]=3 5075 B7R0.6 CC(C)OCC(N)=O Amb26515707 [1,0,0,0,0,1|1,0,1]=4 5076 B7R0.6 CC(C)ONC(N)=O Amb2899784 [1,0,0,0,0,1|2,0,0]=4 5077 B7R0.6 CC(C)SCC(=O)O Amb1128460 [1,0,0,0,0,1|0,0,1]=3 5078 B7R0.6 CC(C)\C=C\B(O)O Amb27149192 [1,0,0,0,0,1|1,0,1]=4 5079 B7R0.6 CC(C)\C=C\C(=O)Cl Amb24481563 [1,0,0,0,0,1|1,0,0]=3 5080 B7R0.6 CC(C)\C=C\C(=O)O Amb8517064 [1,0,0,0,0,1|0,0,0]=2 5081 B7R0.6 CC(C)\C=C\C(C)O Amb25746608 [1,0,0,0,0,1|1,0,1]=4 5082 B7R0.6 CC(C)\C=C\[C@H](C)O Amb28189174 [1,0,0,0,0,1|1,0,1]=4 5083 B7R0.6 CC(C)\C=C\[N+](=O)[O-] Amb32644472 [1,0,0,0,0,1|1,0,1]=4 5084 B7R0.6 CC(C)\C=N\S(C)=O Amb35681708 [1,0,0,0,0,1|2,0,0]=4 5085 B7R0.6 CC(C)\N=C\C(N)=O Amb28388359 [1,0,0,0,0,1|1,0,0]=3 5086 B7R0.6 CC(Cl)C#CC(=O)O Amb28410751 [1,0,0,0,0,1|1,0,1]=4 5087 B7R0.6 CC(Cl)\C=C\C(=O)Cl Amb24579654 [1,0,0,0,0,1|2,0,0]=4 5088 B7R0.6 CC(I)CCC(=O)O Amb25938596 [1,0,0,0,0,1|1,0,1]=4 5089 B7R0.6 CC(N)C#CC(=O)O Amb27876109 [1,0,0,0,0,1|1,0,1]=4 5090 B7R0.6 CC(N)CCC(=O)O Amb17593212 [1,0,0,0,0,1|1,0,1]=4 5091 B7R0.6 CC(N)CCC(=O)O Amb19515603 [1,0,0,0,0,1|1,0,1]=4 5092 B7R0.6 CC(N)SCC(=O)O Amb27401691 [1,0,0,0,0,1|1,0,1]=4 5093 B7R0.6 CC(N)\C=C\C(=O)O Amb33804531 [1,0,0,0,0,1|1,0,0]=3 5094 B7R0.6 CC(O)C#CC(=O)O Amb27803065 [1,0,0,0,0,1|1,0,1]=4 5095 B7R0.6 CC(O)CCC(=O)O Amb18294804 [1,0,0,0,0,1|1,0,1]=4 5096 B7R0.6 CC(S)CCC(=O)O Amb8471198 [1,0,0,0,0,1|1,0,1]=4 5097 B7R0.6 CN(C)CCC(=O)O Amb19888182 [1,0,0,0,0,1|1,0,1]=4 5098 B7R0.6 CN(C)CCC(=O)O Amb6633385 [1,0,0,0,0,1|1,0,1]=4 5099 B7R0.6 CN(C)OCC(=O)O Amb28120004 [1,0,0,0,0,1|1,0,1]=4 5100 B7R0.6 CN(C)\C=C\C(=O)O Amb25273624 [1,0,0,0,0,1|1,0,0]=3 5101 B7R0.6 CN(O)\C=C\C(=O)O Amb27788003 [1,0,0,0,0,1|2,0,0]=4 5102 B7R0.6 CS(=O)\C=C\C(=O)O Amb18642965 [1,0,0,0,0,1|2,0,0]=4 5103 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [1,0,0,0,0,1|1,0,1]=4 5104 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [1,0,0,0,0,1|1,0,1]=4 5105 B7R0.6 C[C@H](N)C#CC(=O)O Amb27644755 [1,0,0,0,0,1|1,0,1]=4 5106 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [1,0,0,0,0,1|1,0,1]=4 5107 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [1,0,0,0,0,1|1,0,1]=4 5108 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [1,0,0,0,0,1|1,0,1]=4 5109 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [1,0,0,0,0,1|1,0,1]=4 5110 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [1,0,0,0,0,1|1,0,1]=4 5111 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [1,0,0,0,0,1|1,0,1]=4 5112 B7R0.6 O=C(O)\C=C\C(Cl)Cl Amb26464246 [1,0,0,0,0,1|2,0,0]=4 5113 B7R0.6 O=C(O)\C=C\C(F)F Amb24340205 [1,0,0,0,0,1|2,0,0]=4 5114 B9R0.7 C=C(C)C#CC(=O)C(C)C Amb27433972 [0,0,0,0,0,2|2,0,0]=4 5115 B9R0.7 C=C(C)C(=O)CNC(C)C Amb28050499 [0,0,0,0,0,2|2,0,0]=4 5116 B9R0.7 C=C(C)C(=O)NCC(=O)O Amb16232088 [0,0,0,0,0,2|0,0,2]=4 5117 B9R0.7 C=C(C)C(=O)OCC(=O)O Amb18644056 [0,0,0,0,0,2|0,0,2]=4 5118 B9R0.7 C=C(C)C(=O)OCC(C)C Amb533494 [0,0,0,0,0,2|2,0,0]=4 5119 B9R0.7 C=C(C)CCC(=O)C(C)C Amb9031731 [0,0,0,0,0,2|2,0,0]=4 5120 B9R0.7 C=C(C)CNC(=O)C(C)C Amb27793754 [0,0,0,0,0,2|2,0,0]=4 5121 B9R0.7 C=C(C)COC(=O)C(C)C Amb28454043 [0,0,0,0,0,2|2,0,0]=4 5122 B9R0.7 C=C(CCC(=O)O)C(C)C Amb28050060 [0,0,0,0,0,2|1,0,0]=3 5123 B9R0.7 C=C(CCN(C)C)C(=O)O Amb28903893 [0,0,0,0,0,2|2,0,0]=4 5124 B9R0.7 C=C(CCN(C)C)C(=O)O Amb32667385 [0,0,0,0,0,2|2,0,0]=4 5125 B9R0.7 C=C(COC(C)C)C(=O)O Amb25958768 [0,0,0,0,0,2|1,0,0]=3 5126 B9R0.7 C=C(Cl)C(=O)NCC(C)C Amb27867917 [0,0,0,0,0,2|2,0,0]=4 5127 B9R0.7 C=C(Cl)CNC(=O)C(C)C Amb27229779 [0,0,0,0,0,2|2,0,0]=4 5128 B9R0.7 C=C(OCC(C)C)C(=O)Cl Amb27233166 [0,0,0,0,0,2|2,0,0]=4 5129 B9R0.7 CC(=O)C(=O)NCC(=O)O Amb17593639 [0,0,0,0,0,2|1,0,1]=4 5130 B9R0.7 CC(=O)C(=O)NCC(C)C Amb17399879 [0,0,0,0,0,2|1,0,0]=3 5131 B9R0.7 CC(=O)C(=O)NCC(C)O Amb27197014 [0,0,0,0,0,2|2,0,0]=4 5132 B9R0.7 CC(=O)C(=O)OCC(=O)O Amb28126708 [0,0,0,0,0,2|1,0,1]=4 5133 B9R0.7 CC(=O)C(=O)OCC(C)C Amb28254557 [0,0,0,0,0,2|1,0,0]=3 5134 B9R0.7 CC(=O)C(=O)\C=C\C(=O)O Amb27803733 [0,0,0,0,0,2|1,0,1]=4 5135 B9R0.7 CC(=O)C(=O)\C=C\N(C)C Amb33291070 [0,0,0,0,0,2|2,0,0]=4 5136 B9R0.7 CC(=O)CCC(=O)C(C)C Amb19515553 [0,0,0,0,0,2|1,0,0]=3 5137 B9R0.7 CC(=O)CCC(=O)N(C)C Amb17334213 [0,0,0,0,0,2|2,0,0]=4 5138 B9R0.7 CC(=O)CNC(=O)C(=O)O Amb24480846 [0,0,0,0,0,2|1,0,1]=4 5139 B9R0.7 CC(=O)CNC(=O)C(C)Cl Amb26363906 [0,0,0,0,0,2|2,0,0]=4 5140 B9R0.7 CC(=O)CNC(=O)N(C)C Amb27232544 [0,0,0,0,0,2|2,0,0]=4 5141 B9R0.7 CC(=O)CNS(=O)C(C)C Amb28194716 [0,0,0,0,0,2|2,0,0]=4 5142 B9R0.7 CC(=O)COC(=O)C(C)C Amb27198382 [0,0,0,0,0,2|1,0,0]=3 5143 B9R0.7 CC(=O)C\C=C(/C)C(C)C Amb24725292 [0,0,0,0,0,2|2,0,0]=4 5144 B9R0.7 CC(=O)C\C=C(\C)C(C)C Amb24408897 [0,0,0,0,0,2|2,0,0]=4 5145 B9R0.7 CC(=O)NCC(=O)N(C)C Amb20624202 [0,0,0,0,0,2|2,0,0]=4 5146 B9R0.7 CC(=O)NNC(=O)C(C)Cl Amb9489670 [0,0,0,0,0,2|2,0,0]=4 5147 B9R0.7 CC(=O)NNC(=O)C(C)N Amb17334234 [0,0,0,0,0,2|2,0,0]=4 5148 B9R0.7 CC(=O)NNC(=O)[C@H](C)O Amb28316001 [0,0,0,0,0,2|2,0,0]=4 5149 B9R0.7 CC(=O)OCC(=O)C(C)C Amb24456861 [0,0,0,0,0,2|1,0,0]=3 5150 B9R0.7 CC(=O)SCC(=O)C(C)C Amb27858864 [0,0,0,0,0,2|1,0,0]=3 5151 B9R0.7 CC(=O)\C=C\C(=O)N(C)C Amb24415333 [0,0,0,0,0,2|2,0,0]=4 5152 B9R0.7 CC(Br)C(=O)NCC(=O)O Amb4015128 [0,0,0,0,0,2|1,0,0]=3 5153 B9R0.7 CC(C)=C(C)\C=C\C(=O)O Amb18643593 [0,0,0,0,0,2|1,0,1]=4 5154 B9R0.7 CC(C)=C\C=C(/C)C(=O)O Amb27210759 [0,0,0,0,0,2|1,0,1]=4 5155 B9R0.7 CC(C)=C\C=C(/F)C(=O)O Amb28050050 [0,0,0,0,0,2|1,0,1]=4 5156 B9R0.7 CC(C)=NNC(=O)C(C)C Amb4035698 [0,0,0,0,0,2|2,0,0]=4 5157 B9R0.7 CC(C)=NNC(=O)C(N)=O Amb17790213 [0,0,0,0,0,2|1,0,1]=4 5158 B9R0.7 CC(C)C#CC(C)C(=O)O Amb27646536 [0,0,0,0,0,2|1,0,1]=4 5159 B9R0.7 CC(C)C(=N)NCC(=O)O Amb27162604 [0,0,0,0,0,2|1,0,0]=3 5160 B9R0.7 CC(C)C(=O)CNC(N)=O Amb27262218 [0,0,0,0,0,2|1,0,0]=3 5161 B9R0.7 CC(C)C(=O)NCC(=O)O Amb1112853 [0,0,0,0,0,2|0,0,0]=2 5162 B9R0.7 CC(C)C(=O)NCC(N)=O Amb17231981 [0,0,0,0,0,2|1,0,0]=3 5163 B9R0.7 CC(C)C(=O)NNC(N)=O Amb26876073 [0,0,0,0,0,2|1,0,0]=3 5164 B9R0.7 CC(C)C(=O)NNC(N)=S Amb27633137 [0,0,0,0,0,2|1,1,0]=4 5165 B9R0.7 CC(C)C(=O)\C=C\C(=O)O Amb25117573 [0,0,0,0,0,2|0,0,0]=2 5166 B9R0.7 CC(C)C(=S)SCC(=O)O Amb27878469 [0,0,0,0,0,2|0,1,0]=3 5167 B9R0.7 CC(C)C(N)C#CC(=O)O Amb27408416 [0,0,0,0,0,2|1,0,1]=4 5168 B9R0.7 CC(C)C(N)CCC(=O)O Amb18124745 [0,0,0,0,0,2|1,0,1]=4 5169 B9R0.7 CC(C)C(O)CCC(=O)O Amb25252592 [0,0,0,0,0,2|0,0,2]=4 5170 B9R0.7 CC(C)CCC(=O)C(=O)O Amb26508699 [0,0,0,0,0,2|0,0,0]=2 5171 B9R0.7 CC(C)CCC(Br)C(=O)O Amb18131059 [0,0,0,0,0,2|1,0,1]=4 5172 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [0,0,0,0,0,2|1,0,1]=4 5173 B9R0.7 CC(C)CCC(F)C(=O)O Amb26612835 [0,0,0,0,0,2|1,0,1]=4 5174 B9R0.7 CC(C)CCC(N)C(=O)O Amb19269152 [0,0,0,0,0,2|1,0,1]=4 5175 B9R0.7 CC(C)CCC(N)C(=O)O Amb6269218 [0,0,0,0,0,2|1,0,1]=4 5176 B9R0.7 CC(C)CCC(O)C(=O)O Amb27788603 [0,0,0,0,0,2|0,0,2]=4 5177 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [0,0,0,0,0,2|1,0,1]=4 5178 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb19133196 [0,0,0,0,0,2|1,0,1]=4 5179 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb22899130 [0,0,0,0,0,2|1,0,1]=4 5180 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [0,0,0,0,0,2|1,0,1]=4 5181 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb16183866 [0,0,0,0,0,2|1,0,1]=4 5182 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb33339290 [0,0,0,0,0,2|1,0,1]=4 5183 B9R0.7 CC(C)CNC(=O)C(=O)O Amb2693956 [0,0,0,0,0,2|0,0,0]=2 5184 B9R0.7 CC(C)CNC(=O)C(C)O Amb9421403 [0,0,0,0,0,2|1,0,1]=4 5185 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [0,0,0,0,0,2|1,0,1]=4 5186 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [0,0,0,0,0,2|1,0,1]=4 5187 B9R0.7 CC(C)COC(=O)C(C)O Amb9787541 [0,0,0,0,0,2|1,0,1]=4 5188 B9R0.7 CC(C)COC(=O)[C@@H](C)O Amb3939702 [0,0,0,0,0,2|1,0,1]=4 5189 B9R0.7 CC(C)COC(C)C(=O)O Amb6258223 [0,0,0,0,0,2|1,0,1]=4 5190 B9R0.7 CC(C)COC(F)C(=O)O Amb27825878 [0,0,0,0,0,2|1,0,1]=4 5191 B9R0.7 CC(C)CSC(C)C(=O)O Amb6270237 [0,0,0,0,0,2|1,0,1]=4 5192 B9R0.7 CC(C)C\C=C(/F)C(=O)O Amb18124770 [0,0,0,0,0,2|1,0,0]=3 5193 B9R0.7 CC(C)N(C)CCC(=O)O Amb6611753 [0,0,0,0,0,2|2,0,0]=4 5194 B9R0.7 CC(C)N(C)CCC(=O)O Amb8428206 [0,0,0,0,0,2|2,0,0]=4 5195 B9R0.7 CC(C)N(C)\C=C\C(=O)O Amb27768790 [0,0,0,0,0,2|2,0,0]=4 5196 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [0,0,0,0,0,2|1,0,1]=4 5197 B9R0.7 CC(C)NNC(=O)C(C)O Amb28050637 [0,0,0,0,0,2|1,0,1]=4 5198 B9R0.7 CC(C)OCC(=O)C(=O)O Amb27620494 [0,0,0,0,0,2|0,0,0]=2 5199 B9R0.7 CC(C)OCC(=O)C(C)O Amb27399155 [0,0,0,0,0,2|1,0,1]=4 5200 B9R0.7 CC(C)OCC(C)C(=O)O Amb26037515 [0,0,0,0,0,2|1,0,1]=4 5201 B9R0.7 CC(C)OCC(Cl)C(=O)O Amb27770474 [0,0,0,0,0,2|1,0,1]=4 5202 B9R0.7 CC(C)OCC(N)C(=O)O Amb25956723 [0,0,0,0,0,2|1,0,1]=4 5203 B9R0.7 CC(C)OCC(N)C(=O)O Amb32665467 [0,0,0,0,0,2|1,0,1]=4 5204 B9R0.7 CC(C)OCC(O)C(=O)O Amb24583914 [0,0,0,0,0,2|0,0,2]=4 5205 B9R0.7 CC(C)OC[C@@H](N)C(=O)O Amb24479342 [0,0,0,0,0,2|1,0,1]=4 5206 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb26960408 [0,0,0,0,0,2|1,0,1]=4 5207 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb32664966 [0,0,0,0,0,2|1,0,1]=4 5208 B9R0.7 CC(C)S(=O)\C=C\C(=O)O Amb27166984 [0,0,0,0,0,2|1,0,0]=3 5209 B9R0.7 CC(C)SCC(N)C(=O)O Amb6273927 [0,0,0,0,0,2|1,0,1]=4 5210 B9R0.7 CC(C)[C@@H](O)CCC(=O)O Amb28314215 [0,0,0,0,0,2|0,0,2]=4 5211 B9R0.7 CC(Cl)C(=O)CCC(=O)O Amb25362323 [0,0,0,0,0,2|1,0,0]=3 5212 B9R0.7 CC(Cl)C(=O)NCC(=O)O Amb8393827 [0,0,0,0,0,2|1,0,0]=3 5213 B9R0.7 CC(N)C(=O)NCC(=O)O Amb2778754 [0,0,0,0,0,2|1,0,0]=3 5214 B9R0.7 CC(N)C(=O)NCC(N)=O Amb6263248 [0,0,0,0,0,2|2,0,0]=4 5215 B9R0.7 CC(N)C(=O)OCC(N)=O Amb27955239 [0,0,0,0,0,2|2,0,0]=4 5216 B9R0.7 CC(O)C(=O)NCC(N)=O Amb27188914 [0,0,0,0,0,2|2,0,0]=4 5217 B9R0.7 CC(O)C(=O)OCC(=O)O Amb27392962 [0,0,0,0,0,2|1,0,0]=3 5218 B9R0.7 CC(O)CCC(=O)C(=O)O Amb27799217 [0,0,0,0,0,2|1,0,0]=3 5219 B9R0.7 CC(O)CNC(=O)C(C)C Amb9275174 [0,0,0,0,0,2|1,0,1]=4 5220 B9R0.7 CC(S)C(=O)NCC(=O)O Amb2777540 [0,0,0,0,0,2|1,0,0]=3 5221 B9R0.7 CN(C)C(=O)C#CC(=O)O Amb26940350 [0,0,0,0,0,2|1,0,0]=3 5222 B9R0.7 CN(C)C(=O)CCC(=O)Cl Amb27273505 [0,0,0,0,0,2|2,0,0]=4 5223 B9R0.7 CN(C)C(=O)CCC(=O)O Amb1135807 [0,0,0,0,0,2|1,0,0]=3 5224 B9R0.7 CN(C)C(=O)CCC(N)=O Amb17334218 [0,0,0,0,0,2|2,0,0]=4 5225 B9R0.7 CN(C)C(=O)NCC(=O)O Amb9304726 [0,0,0,0,0,2|1,0,0]=3 5226 B9R0.7 CN(C)C(=O)SCC(=O)O Amb28199270 [0,0,0,0,0,2|1,0,0]=3 5227 B9R0.7 CN(C)C(=O)\C=C/C(=O)O Amb2967257 [0,0,0,0,0,2|1,0,0]=3 5228 B9R0.7 CN(C)C(=O)\C=C\C(=O)O Amb34913235 [0,0,0,0,0,2|1,0,0]=3 5229 B9R0.7 CN(C)C(=O)\C=C\C(N)=O Amb28132660 [0,0,0,0,0,2|2,0,0]=4 5230 B9R0.7 CN(C)C(=S)NCC(=O)O Amb25708504 [0,0,0,0,0,2|1,1,0]=4 5231 B9R0.7 CN(C)C(=S)SCC(=O)O Amb3986957 [0,0,0,0,0,2|1,1,0]=4 5232 B9R0.7 CN(C)CCC(=O)C(=O)O Amb33272647 [0,0,0,0,0,2|1,0,0]=3 5233 B9R0.7 CN(C)\C=C\C(=O)C(=O)O Amb27615648 [0,0,0,0,0,2|1,0,0]=3 5234 B9R0.7 CN(O)C(=O)CCC(=O)O Amb27460547 [0,0,0,0,0,2|2,0,0]=4 5235 B9R0.7 C[C@@H](Br)C(=O)NCC(=O)O Amb27169385 [0,0,0,0,0,2|1,0,0]=3 5236 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb22756673 [0,0,0,0,0,2|1,0,0]=3 5237 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb30867950 [0,0,0,0,0,2|1,0,0]=3 5238 B9R0.7 C[C@@H](N)C(=O)NCC(N)=O Amb25242887 [0,0,0,0,0,2|2,0,0]=4 5239 B9R0.7 C[C@@H](O)C(=O)NCC(N)=O Amb28316066 [0,0,0,0,0,2|2,0,0]=4 5240 B9R0.7 C[C@H](Cl)C(=O)NCC(=O)O Amb27776749 [0,0,0,0,0,2|1,0,0]=3 5241 B9R0.7 C[C@H](N)C(=O)NCC(=O)O Amb4035944 [0,0,0,0,0,2|1,0,0]=3 5242 B9R0.7 C[C@H](N)C(=O)NCC(N)=O Amb28399884 [0,0,0,0,0,2|2,0,0]=4 5243 B9R0.7 C[C@H](N)C(=O)OCC(N)=O Amb28126942 [0,0,0,0,0,2|2,0,0]=4 5244 B9R0.7 C\C(=C/CC(=O)O)C(C)C Amb25866328 [0,0,0,0,0,2|1,0,0]=3 5245 B9R0.7 C\C(=C/CC(C)C)C(=O)O Amb27815070 [0,0,0,0,0,2|1,0,0]=3 5246 B9R0.7 C\C(=C/C[C@@H](C)O)C(=O)O Amb27254118 [0,0,0,0,0,2|2,0,0]=4 5247 B9R0.7 C\C(=C\CC(C)C)C(=O)O Amb27203321 [0,0,0,0,0,2|1,0,0]=3 5248 B9R0.7 C\C(=N/CC(C)C)C(=O)O Amb27426682 [0,0,0,0,0,2|1,0,0]=3 5249 B9R0.7 C\C(=N/NC(C)C)C(=O)O Amb27881746 [0,0,0,0,0,2|1,0,0]=3 5250 B9R0.7 C\C(=N/NC(N)=O)C(C)C Amb27260870 [0,0,0,0,0,2|2,0,0]=4 5251 B9R0.7 O=C(O)C(=O)NCC(F)F Amb24383665 [0,0,0,0,0,2|2,0,0]=4 5252 B9R0.7 O=C(O)CCC(=O)C(Cl)Cl Amb28343114 [0,0,0,0,0,2|2,0,0]=4 5253 B9R0.7 O=C(O)CCC(=O)C(O)O Amb28429041 [0,0,0,0,0,2|2,0,0]=4 5254 B9R0.7 O=C(O)CNC(=O)C(Cl)Cl Amb24596966 [0,0,0,0,0,2|2,0,0]=4 5255 B9R0.7 O=C(O)CNC(=O)C(F)F Amb26494307 [0,0,0,0,0,2|2,0,0]=4 5256 B9R0.53 C=C(C)NC(=O)OC(C)C Amb28185838 [0,0,0,0,0,2|2,0,0]=4 5257 B9R0.53 C=C(CC(=O)O)CC(C)C Amb18643897 [0,0,0,0,0,2|1,0,0]=3 5258 B9R0.53 CC(=O)CC(=O)CC(C)C Amb8516702 [0,0,0,0,0,2|1,0,0]=3 5259 B9R0.53 CC(=O)CC(=O)NN(C)C Amb28121577 [0,0,0,0,0,2|2,0,0]=4 5260 B9R0.53 CC(=O)CC(=O)OC(C)C Amb6608870 [0,0,0,0,0,2|1,0,0]=3 5261 B9R0.53 CC(=O)NC(=O)C=C(C)C Amb27876464 [0,0,0,0,0,2|1,0,1]=4 5262 B9R0.53 CC(=O)NC(=O)CC(=O)O Amb24671240 [0,0,0,0,0,2|1,0,1]=4 5263 B9R0.53 CC(=O)NC(=S)OC(C)C Amb28071008 [0,0,0,0,0,2|1,1,0]=4 5264 B9R0.53 CC(=O)\C=C(/C)CC(C)C Amb28063284 [0,0,0,0,0,2|2,0,0]=4 5265 B9R0.53 CC(=O)\C=C(/O)CC(C)C Amb28288330 [0,0,0,0,0,2|1,0,1]=4 5266 B9R0.53 CC(C)=CC(=O)NC(N)=O Amb27814879 [0,0,0,0,0,2|1,0,1]=4 5267 B9R0.53 CC(C)=CC(=O)SC(C)C Amb22231438 [0,0,0,0,0,2|2,0,0]=4 5268 B9R0.53 CC(C)=C\C(C)=C\C(=O)O Amb27422044 [0,0,0,0,0,2|1,0,1]=4 5269 B9R0.53 CC(C)CC(=N)CC(N)=O Amb27827487 [0,0,0,0,0,2|2,0,0]=4 5270 B9R0.53 CC(C)CC(C)CC(=O)O Amb6749218 [0,0,0,0,0,2|1,0,1]=4 5271 B9R0.53 CC(C)CC(N)CC(=O)O Amb2438867 [0,0,0,0,0,2|1,0,1]=4 5272 B9R0.53 CC(C)CC(O)CC(=O)O Amb17232005 [0,0,0,0,0,2|0,0,2]=4 5273 B9R0.53 CC(C)CN(C)CC(=O)O Amb8900040 [0,0,0,0,0,2|2,0,0]=4 5274 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631385 [0,0,0,0,0,2|1,0,1]=4 5275 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631386 [0,0,0,0,0,2|1,0,1]=4 5276 B9R0.53 CC(C)C[C@@H](O)CC(=O)O Amb28050162 [0,0,0,0,0,2|0,0,2]=4 5277 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb16184017 [0,0,0,0,0,2|1,0,1]=4 5278 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb19944305 [0,0,0,0,0,2|1,0,1]=4 5279 B9R0.53 CC(C)C[C@H](O)CC(=O)O Amb24505145 [0,0,0,0,0,2|0,0,2]=4 5280 B9R0.53 CC(C)NC(=O)CC(=O)O Amb17399889 [0,0,0,0,0,2|0,0,0]=2 5281 B9R0.53 CC(C)NC(=O)CC(N)=O Amb28050038 [0,0,0,0,0,2|1,0,0]=3 5282 B9R0.53 CC(C)NC(=O)CC(N)=S Amb5638562 [0,0,0,0,0,2|1,1,0]=4 5283 B9R0.53 CC(C)NC(=O)NC(=N)N Amb27489688 [0,0,0,0,0,2|2,0,0]=4 5284 B9R0.53 CC(C)NC(C)CC(=O)O Amb9398367 [0,0,0,0,0,2|1,0,1]=4 5285 B9R0.53 CC(C)OC(=O)C=C(Cl)Cl Amb28061013 [0,0,0,0,0,2|2,0,0]=4 5286 B9R0.53 CC(C)OC(=O)CC(=N)N Amb27615033 [0,0,0,0,0,2|2,0,0]=4 5287 B9R0.53 CC(C)OC(=O)CC(=O)O Amb25887628 [0,0,0,0,0,2|0,0,0]=2 5288 B9R0.53 CC(C)OC(=O)CC(N)=O Amb27765049 [0,0,0,0,0,2|1,0,0]=3 5289 B9R0.53 CC(C)OC(=O)CC(N)=S Amb1116492 [0,0,0,0,0,2|1,1,0]=4 5290 B9R0.53 CC(C)OC(=O)CS(=O)Cl Amb32720546 [0,0,0,0,0,2|2,0,0]=4 5291 B9R0.53 CC(C)OC(=O)CS(=O)[O-] Amb32754483 [0,0,0,0,0,2|1,0,1]=4 5292 B9R0.53 CC(C)OC(=O)CS(N)=O Amb32720547 [0,0,0,0,0,2|2,0,0]=4 5293 B9R0.53 CC(C)OC(=O)C[C@@H](C)O Amb28050747 [0,0,0,0,0,2|1,0,1]=4 5294 B9R0.53 CC(C)SC(=N)NC(N)=O Amb27487342 [0,0,0,0,0,2|2,0,0]=4 5295 B9R0.53 CC(N)CC(=O)NC(N)=O Amb27397813 [0,0,0,0,0,2|2,0,0]=4 5296 B9R0.53 CC(O)CC(=O)OC(C)C Amb28189370 [0,0,0,0,0,2|1,0,1]=4 5297 B9R0.53 CN(C)CC(=O)NC(N)=O Amb25684200 [0,0,0,0,0,2|2,0,0]=4 5298 B9R0.53 CN(C)NC(=O)CC(=O)O Amb20246800 [0,0,0,0,0,2|1,0,0]=3 5299 B9R0.53 C\C(=C\C(=O)O)CC(C)C Amb26947874 [0,0,0,0,0,2|1,0,0]=3 5300 B9R0.53 C\C(=C\C(C)C)CC(=O)O Amb27784871 [0,0,0,0,0,2|1,0,0]=3 5301 B9R0.53 C\C(Cl)=C\C(=O)NC(C)C Amb25063189 [0,0,0,0,0,2|2,0,0]=4 5302 B9R0.53 C\C(N)=C/C(=O)OC(C)C Amb33512913 [0,0,0,0,0,2|2,0,0]=4 5303 B9R0.53 C\C(N)=C\C(=O)OC(C)C Amb4016229 [0,0,0,0,0,2|2,0,0]=4 5304 B9R0.53 C\C(N)=C\C(=O)SC(C)C Amb27780159 [0,0,0,0,0,2|2,0,0]=4