0 B7R0.16 BrC(C(=O)O)C(=O)O Amb17594708 [0,0,0,0,0,0|1,0,0]=1 1 B7R0.16 C=C(Br)C(O)C(O)=O Amb24692957 [0,0,0,0,0,0|3,0,0]=3 2 B7R0.16 C=C(Br)[C@H](N)C(O)=O Amb24383876 [0,0,0,0,0,0|3,0,0]=3 3 B7R0.16 C=C(C(O)=O)C(O)=O Amb24481368 [0,0,0,0,0,0|0,0,2]=2 4 B7R0.16 C=C(Cl)C(N)C(O)=O Amb18643039 [0,0,0,0,0,0|3,0,0]=3 5 B7R0.16 C=C(F)C(N)C(O)=O Amb18641967 [0,0,0,0,0,0|3,0,0]=3 6 B7R0.16 CC(=C(C(=O)O)Br)C Amb17594579 [0,0,0,0,0,0|3,0,1]=4 7 B7R0.16 CC(=C(C(=O)O)C)C Amb17593186 [0,0,0,0,0,0|2,0,1]=3 8 B7R0.16 CC(=C(C)C)C(=O)C Amb17593162 [0,0,0,0,0,0|3,0,1]=4 9 B7R0.16 CC(=C(C)N)C(C)=O Amb25232464 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.16 CC(=C(N)N)C(C)=O Amb25168636 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.16 CC(=C(N)O)C(C)=O Amb24741192 [0,0,0,0,0,0|2,0,1]=3 12 B7R0.16 CC(=C)C(C)C(O)=O Amb18641781 [0,0,0,0,0,0|2,0,0]=2 13 B7R0.16 CC(=C)C(N)C(O)=O Amb18641831 [0,0,0,0,0,0|3,0,0]=3 14 B7R0.16 CC(=C)[C@@H](C)C(O)=O Amb25355239 [0,0,0,0,0,0|2,0,0]=2 15 B7R0.16 CC(=C)[C@@H](N)C(=C)O Amb25308010 [0,0,0,0,0,0|4,0,0]=4 16 B7R0.16 CC(=N)C(C)C(N)=S Amb25326603 [0,0,0,0,0,0|3,1,0]=4 17 B7R0.16 CC(=O)C(=O)C(O)=O Amb24101563 [0,0,0,0,0,0|2,0,1]=3 18 B7R0.16 CC(=O)C(=S)C(C)=O Amb24588939 [0,0,0,0,0,0|3,0,1]=4 19 B7R0.16 CC(=O)C(Br)C(C)=C Amb24533829 [0,0,0,0,0,0|4,0,0]=4 20 B7R0.16 CC(=O)C(Br)C(C)=O Amb22000680 [0,0,0,0,0,0|3,0,0]=3 21 B7R0.16 CC(=O)C(Br)C(N)=O Amb24483263 [0,0,0,0,0,0|3,0,0]=3 22 B7R0.16 CC(=O)C(C)C(=O)S Amb25094430 [0,0,0,0,0,0|1,1,0]=2 23 B7R0.16 CC(=O)C(C)C(=S)Cl Amb24432212 [0,0,0,0,0,0|2,1,0]=3 24 B7R0.16 CC(=O)C(C)C(N)=N Amb24629832 [0,0,0,0,0,0|3,0,0]=3 25 B7R0.16 CC(=O)C(Cl)C(N)=O Amb24056422 [0,0,0,0,0,0|3,0,0]=3 26 B7R0.16 CC(=O)C(F)C(C)=O Amb19889779 [0,0,0,0,0,0|3,0,0]=3 27 B7R0.16 CC(=O)C(N)C(O)=O Amb21962887 [0,0,0,0,0,0|2,0,0]=2 28 B7R0.16 CC(=O)C(O)C(C)=C Amb24614054 [0,0,0,0,0,0|4,0,0]=4 29 B7R0.16 CC(=O)C(S)=C(C)O Amb25327947 [0,0,0,0,0,0|3,0,1]=4 30 B7R0.16 CC(=O)N(C)C(N)=O Amb24621834 [0,0,0,0,0,0|3,0,0]=3 31 B7R0.16 CC(=O)N(C)C(N)=S Amb25337074 [0,0,0,0,0,0|3,1,0]=4 32 B7R0.16 CC(=O)N(Cl)C(N)=O Amb24481411 [0,0,0,0,0,0|4,0,0]=4 33 B7R0.16 CC(=O)N(O)C(C)=O Amb22750106 [0,0,0,0,0,0|4,0,0]=4 34 B7R0.16 CC(=O)\C(\F)=C(\C)/O Amb24571214 [0,0,0,0,0,0|3,0,1]=4 35 B7R0.16 CC(Br)C(N)C(O)=O Amb25775046 [0,0,0,0,0,0|3,0,1]=4 36 B7R0.16 CC(C(=C)Br)C(O)=O Amb24483212 [0,0,0,0,0,0|2,0,0]=2 37 B7R0.16 CC(C(=O)C)C(=O)C Amb1152249 [0,0,0,0,0,0|2,0,0]=2 38 B7R0.16 CC(C(=O)Cl)C(=O)Cl Amb22232260 [0,0,0,0,0,0|2,0,0]=2 39 B7R0.16 CC(C(=O)N)C(=O)C Amb10552518 [0,0,0,0,0,0|2,0,0]=2 40 B7R0.16 CC(C(=O)O)C(=O)C Amb10601660 [0,0,0,0,0,0|1,0,0]=1 41 B7R0.16 CC(C(=O)O)C(C)C Amb17087469 [0,0,0,0,0,0|2,0,1]=3 42 B7R0.16 CC(C(C(=O)C)C)O Amb17593202 [0,0,0,0,0,0|2,0,1]=3 43 B7R0.16 CC(C(C(=O)O)Br)O Amb17594710 [0,0,0,0,0,0|2,0,1]=3 44 B7R0.16 CC(C(C(=O)O)C)O Amb17615515 [0,0,0,0,0,0|1,0,1]=2 45 B7R0.16 CC(C(C(=O)O)Cl)O Amb17593522 [0,0,0,0,0,0|2,0,1]=3 46 B7R0.16 CC(C(C(=O)O)N)F Amb10838661 [0,0,0,0,0,0|3,0,1]=4 47 B7R0.16 CC(C(C(=O)O)N)S Amb17593434 [0,0,0,0,0,0|2,1,1]=4 48 B7R0.16 CC(C(C)=O)=C(C)Cl Amb25326830 [0,0,0,0,0,0|3,0,1]=4 49 B7R0.16 CC(C(C)=O)=C(C)F Amb25233562 [0,0,0,0,0,0|3,0,1]=4 50 B7R0.16 CC(C(C)=O)S(C)=O Amb24481498 [0,0,0,0,0,0|3,0,0]=3 51 B7R0.16 CC(C(C)=O)[N+]([O-])=O Amb24559893 [0,0,0,0,0,0|2,0,1]=3 52 B7R0.16 CC(C(C)Br)C(O)=O Amb25111271 [0,0,0,0,0,0|2,0,1]=3 53 B7R0.16 CC(C(C)Cl)C(N)=O Amb25785669 [0,0,0,0,0,0|3,0,1]=4 54 B7R0.16 CC(C(C)N)C(C)=O Amb24411022 [0,0,0,0,0,0|3,0,1]=4 55 B7R0.16 CC(C(C)N)C(O)=O Amb18124261 [0,0,0,0,0,0|2,0,1]=3 56 B7R0.16 CC(C(C)O)C(N)=O Amb24481579 [0,0,0,0,0,0|2,0,1]=3 57 B7R0.16 CC(C(C)O)C(N)=S Amb24583963 [0,0,0,0,0,0|2,1,1]=4 58 B7R0.16 CC(C(C)S)C(O)=O Amb25842057 [0,0,0,0,0,0|1,1,1]=3 59 B7R0.16 CC(C(N)=O)=C(C)Cl Amb24517373 [0,0,0,0,0,0|3,0,1]=4 60 B7R0.16 CC(C(N)=O)C(N)=S Amb22229181 [0,0,0,0,0,0|2,1,0]=3 61 B7R0.16 CC(C(N)=O)N(C)C Amb25679024 [0,0,0,0,0,0|4,0,0]=4 62 B7R0.16 CC(C(N)=S)C(O)=O Amb24745670 [0,0,0,0,0,0|1,1,0]=2 63 B7R0.16 CC(C(O)=O)=C(C)Br Amb24557990 [0,0,0,0,0,0|2,0,1]=3 64 B7R0.16 CC(C(O)=O)=C(C)Cl Amb24481381 [0,0,0,0,0,0|2,0,1]=3 65 B7R0.16 CC(C(O)=O)=C(C)N Amb24527948 [0,0,0,0,0,0|2,0,1]=3 66 B7R0.16 CC(C(O)=O)=C(Cl)Cl Amb24373832 [0,0,0,0,0,0|2,0,1]=3 67 B7R0.16 CC(C(O)=O)=C(F)F Amb24702881 [0,0,0,0,0,0|2,0,1]=3 68 B7R0.16 CC(C(O)=O)N(C)Br Amb24743147 [0,0,0,0,0,0|3,0,0]=3 69 B7R0.16 CC(C(O)=O)N(C)C Amb21955631 [0,0,0,0,0,0|3,0,0]=3 70 B7R0.16 CC(C(O)=O)N(C)N Amb22372039 [0,0,0,0,0,0|3,0,0]=3 71 B7R0.16 CC(C(O)=O)N(C)O Amb24714002 [0,0,0,0,0,0|2,0,0]=2 72 B7R0.16 CC(C(O)=O)S(C)=O Amb18950743 [0,0,0,0,0,0|2,0,0]=2 73 B7R0.16 CC(C(O)=O)S(O)=O Amb25680146 [0,0,0,0,0,0|1,0,0]=1 74 B7R0.16 CC(C(O)C)C(O)C Amb2583260 [0,0,0,0,0,0|2,0,2]=4 75 B7R0.16 CC(C)=C(Cl)C(O)=O Amb18642954 [0,0,0,0,0,0|3,0,1]=4 76 B7R0.16 CC(C)=C(F)C(O)=O Amb20669103 [0,0,0,0,0,0|3,0,1]=4 77 B7R0.16 CC(C)=C(S)C(O)=O Amb25360161 [0,0,0,0,0,0|3,0,1]=4 78 B7R0.16 CC(C)C(C)C(C)=O Amb17940267 [0,0,0,0,0,0|3,0,1]=4 79 B7R0.16 CC(C)C(C)C(N)=O Amb25810126 [0,0,0,0,0,0|3,0,1]=4 80 B7R0.16 CC(C)C(F)C(O)=O Amb19957386 [0,0,0,0,0,0|3,0,1]=4 81 B7R0.16 CC(C)C(N)[13C](O)=O Amb22338653 [0,0,0,0,0,0|3,0,1]=4 82 B7R0.16 CC(C)C(S)C(O)=O Amb18282761 [0,0,0,0,0,0|3,0,1]=4 83 B7R0.16 CC(C)C([15NH2])C(O)=O Amb22363191 [0,0,0,0,0,0|3,0,1]=4 84 B7R0.16 CC(C)[13CH](N)C(O)=O Amb22367349 [0,0,0,0,0,0|3,0,1]=4 85 B7R0.16 CC(C)[C@@H](C)C(C)=O Amb24753185 [0,0,0,0,0,0|3,0,1]=4 86 B7R0.16 CC(C)[C@@H](Cl)C(O)=O Amb22353101 [0,0,0,0,0,0|3,0,1]=4 87 B7R0.16 CC(C)[C@@H](F)C(O)=O Amb25083215 [0,0,0,0,0,0|3,0,1]=4 88 B7R0.16 CC(C)[C@@H](N)C(O)=O Amb22746777 [0,0,0,0,0,0|3,0,1]=4 89 B7R0.16 CC(C)[C@@H](S)C(O)=O Amb25320674 [0,0,0,0,0,0|3,0,1]=4 90 B7R0.16 CC(C)[C@H](N)C(O)=O Amb22351111 [0,0,0,0,0,0|3,0,1]=4 91 B7R0.16 CC(C)[C@H](N)[13C](O)=O Amb22354046 [0,0,0,0,0,0|3,0,1]=4 92 B7R0.16 CC(C)[C@H](S)C(O)=O Amb25662094 [0,0,0,0,0,0|3,0,1]=4 93 B7R0.16 CC(Cl)=C(Cl)C(O)=O Amb25272743 [0,0,0,0,0,0|3,0,1]=4 94 B7R0.16 CC(Cl)C(C)C(=O)Cl Amb25209986 [0,0,0,0,0,0|3,0,1]=4 95 B7R0.16 CC(Cl)C(N)C(O)=O Amb25269614 [0,0,0,0,0,0|3,0,1]=4 96 B7R0.16 CC(Cl)C(O)C(O)=O Amb25222028 [0,0,0,0,0,0|3,0,1]=4 97 B7R0.16 CC(F)C(Br)C(O)=O Amb25304346 [0,0,0,0,0,0|3,0,1]=4 98 B7R0.16 CC(F)C(F)C(O)=O Amb24687273 [0,0,0,0,0,0|3,0,1]=4 99 B7R0.16 CC(F)C(O)C(O)=O Amb24385715 [0,0,0,0,0,0|3,0,1]=4 100 B7R0.16 CC(N)=C(C)C(N)=O Amb24568296 [0,0,0,0,0,0|3,0,1]=4 101 B7R0.16 CC(N)C(N)C(O)=O Amb17678795 [0,0,0,0,0,0|3,0,1]=4 102 B7R0.16 CC(N)C(N)C(O)=O Amb22728051 [0,0,0,0,0,0|3,0,1]=4 103 B7R0.16 CC(N)C(O)C(O)=O Amb18641970 [0,0,0,0,0,0|3,0,1]=4 104 B7R0.16 CC(N)[C@H](N)C(O)=O Amb25083113 [0,0,0,0,0,0|3,0,1]=4 105 B7R0.16 CC(O)C(=O)C(O)=O Amb24481396 [0,0,0,0,0,0|2,0,2]=4 106 B7R0.16 CC(O)C(N)C(C)=O Amb25026434 [0,0,0,0,0,0|3,0,1]=4 107 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,0,0,0,0,0|3,0,1]=4 108 B7R0.16 CC(O)C(N)P(O)=O Amb24428649 [0,0,0,0,0,0|3,0,1]=4 109 B7R0.16 CC(O)C(O)C(O)=O Amb18124272 [0,0,0,0,0,0|2,0,1]=3 110 B7R0.16 CC(O)N(C)C(O)=O Amb22641864 [0,0,0,0,0,0|2,0,1]=3 111 B7R0.16 CC(O)[C@@H](C)C(O)=O Amb25857406 [0,0,0,0,0,0|1,0,1]=2 112 B7R0.16 CC(S)[C@@H](N)C(O)=O Amb24606864 [0,0,0,0,0,0|2,1,1]=4 113 B7R0.16 CC(S)[C@H](N)C(O)=O Amb25684204 [0,0,0,0,0,0|2,1,1]=4 114 B7R0.16 CC([C@@H](C)N)C(O)=O Amb24680995 [0,0,0,0,0,0|2,0,1]=3 115 B7R0.16 CN(C(N)=N)C(N)=O Amb25836892 [0,0,0,0,0,0|4,0,0]=4 116 B7R0.16 CN(C(N)=O)C(N)=S Amb24383546 [0,0,0,0,0,0|3,1,0]=4 117 B7R0.16 CN(C)C(N)C(O)=O Amb24746695 [0,0,0,0,0,0|4,0,0]=4 118 B7R0.16 C[C@@H](C(=O)O)C(C)C Amb10844600 [0,0,0,0,0,0|2,0,1]=3 119 B7R0.16 C[C@@H](C(N)=O)N(C)C Amb25031426 [0,0,0,0,0,0|4,0,0]=4 120 B7R0.16 C[C@@H](C(O)=O)N(C)C Amb22587534 [0,0,0,0,0,0|3,0,0]=3 121 B7R0.16 C[C@@H](C(O)=O)N(C)Cl Amb24640409 [0,0,0,0,0,0|3,0,0]=3 122 B7R0.16 C[C@@H](Cl)[C@@H](Br)C(O)=O Amb24526448 [0,0,0,0,0,0|3,0,1]=4 123 B7R0.16 C[C@@H](Cl)[C@@H](O)C(O)=O Amb24445574 [0,0,0,0,0,0|3,0,1]=4 124 B7R0.16 C[C@@H](F)[C@H](N)C(O)=O Amb25789807 [0,0,0,0,0,0|3,0,1]=4 125 B7R0.16 C[C@@H](N)[C@@H](N)C(O)=O Amb22745396 [0,0,0,0,0,0|3,0,1]=4 126 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb22745441 [0,0,0,0,0,0|3,0,1]=4 127 B7R0.16 C[C@@H](N)[C@H](N)C(O)=O Amb24481409 [0,0,0,0,0,0|3,0,1]=4 128 B7R0.16 C[C@@H](O)C(C)C(O)=O Amb24469914 [0,0,0,0,0,0|1,0,1]=2 129 B7R0.16 C[C@@H](O)[13C@H](N)[13C](O)=O Amb22336905 [0,0,0,0,0,0|2,0,1]=3 130 B7R0.16 C[C@@H](O)[C@@H](C)C(O)=O Amb24481394 [0,0,0,0,0,0|1,0,1]=2 131 B7R0.16 C[C@@H](O)[C@@H](N)C(C)=O Amb25238428 [0,0,0,0,0,0|3,0,1]=4 132 B7R0.16 C[C@@H](O)[C@@H](O)C(C)=O Amb24701454 [0,0,0,0,0,0|3,0,1]=4 133 B7R0.16 C[C@@H](O)[C@H](F)C(O)=O Amb24470562 [0,0,0,0,0,0|2,0,1]=3 134 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,0,0,0,0,0|3,0,1]=4 135 B7R0.16 C[C@@H](O)[C@H](N)C(O)=O Amb22351168 [0,0,0,0,0,0|2,0,1]=3 136 B7R0.16 C[C@@H](O)[C@H](O)C(C)=O Amb24481484 [0,0,0,0,0,0|3,0,1]=4 137 B7R0.16 C[C@@H](O)[C@H]([15NH2])C(O)=O Amb22353591 [0,0,0,0,0,0|2,0,1]=3 138 B7R0.16 C[C@@H](S)[C@@H](N)C(O)=O Amb24333717 [0,0,0,0,0,0|2,1,1]=4 139 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24117242 [0,0,0,0,0,0|2,1,1]=4 140 B7R0.16 C[C@@H](S)[C@H](N)C(O)=O Amb24726915 [0,0,0,0,0,0|2,1,1]=4 141 B7R0.16 C[C@@H]([C@@H](C)N)C(O)=O Amb24410324 [0,0,0,0,0,0|2,0,1]=3 142 B7R0.16 C[C@@H]([C@@H](C)O)C(=C)Br Amb25144623 [0,0,0,0,0,0|3,0,1]=4 143 B7R0.16 C[C@@H]([C@H](C(=O)O)C)O Amb10844569 [0,0,0,0,0,0|1,0,1]=2 144 B7R0.16 C[C@@H]([C@H](C)O)C(C)=C Amb25091688 [0,0,0,0,0,0|3,0,1]=4 145 B7R0.16 C[C@H](Br)[C@H](N)C(O)=O Amb24711401 [0,0,0,0,0,0|3,0,1]=4 146 B7R0.16 C[C@H](C(=O)O)C(C)C Amb10844601 [0,0,0,0,0,0|2,0,1]=3 147 B7R0.16 C[C@H](C(N)=O)N(C)C Amb24687546 [0,0,0,0,0,0|4,0,0]=4 148 B7R0.16 C[C@H](C(O)=O)N(C)C Amb22586633 [0,0,0,0,0,0|3,0,0]=3 149 B7R0.16 C[C@H](F)[C@H](N)C(O)=O Amb25805291 [0,0,0,0,0,0|3,0,1]=4 150 B7R0.16 C[C@H](N)C(O)C(O)=O Amb24649032 [0,0,0,0,0,0|3,0,1]=4 151 B7R0.16 C[C@H](N)[C@@H](F)C(O)=O Amb25293984 [0,0,0,0,0,0|3,0,1]=4 152 B7R0.16 C[C@H](N)[C@@H](N)C(O)=O Amb17678796 [0,0,0,0,0,0|3,0,1]=4 153 B7R0.16 C[C@H](N)[C@H](N)C(O)=O Amb17678797 [0,0,0,0,0,0|3,0,1]=4 154 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb19929490 [0,0,0,0,0,0|3,0,1]=4 155 B7R0.16 C[C@H](N)[C@H](O)C(O)=O Amb24407396 [0,0,0,0,0,0|3,0,1]=4 156 B7R0.16 C[C@H](O)C(N)C(O)=O Amb24377632 [0,0,0,0,0,0|2,0,1]=3 157 B7R0.16 C[C@H](O)[C@@H](O)C(O)=O Amb25844932 [0,0,0,0,0,0|2,0,1]=3 158 B7R0.16 C[C@H](O)[C@H](N)C(N)=O Amb25746274 [0,0,0,0,0,0|3,0,1]=4 159 B7R0.16 C[C@H](S)[C@H](N)C(O)=O Amb25131648 [0,0,0,0,0,0|2,1,1]=4 160 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O Amb16183845 [0,0,0,0,0,0|3,0,1]=4 161 B7R0.16 C[C@H]([C@@H](C(=O)O)C)O Amb10844572 [0,0,0,0,0,0|1,0,1]=2 162 B7R0.16 C[C@H]([C@@H](C)N)C(C)=O Amb25254240 [0,0,0,0,0,0|3,0,1]=4 163 B7R0.16 C[C@H]([C@@H](C)N)C(O)=O Amb25679842 [0,0,0,0,0,0|2,0,1]=3 164 B7R0.16 C[C@H]([C@@H](C)O)C(C)=O Amb25144117 [0,0,0,0,0,0|2,0,1]=3 165 B7R0.16 C[C@H]([C@@H]([13C](=O)O)N)O Amb17620634 [0,0,0,0,0,0|2,0,1]=3 166 B7R0.16 C[C@H]([C@H](C)O)S(C)=O Amb24332098 [0,0,0,0,0,0|3,0,1]=4 167 B7R0.16 C[C@H]([C@H](C)O)[C@@H](C)O Amb24445952 [0,0,0,0,0,0|2,0,2]=4 168 B7R0.16 C[C@H]([C@H](C)S)C(O)=O Amb24481380 [0,0,0,0,0,0|1,1,1]=3 169 B7R0.16 C\C(=C(\C)/N)\C(C)=O Amb24332752 [0,0,0,0,0,0|3,0,1]=4 170 B7R0.16 C\C(\C(C)=O)=C(/C)\Cl Amb24722797 [0,0,0,0,0,0|3,0,1]=4 171 B7R0.16 C\C(\C(C)=O)=C(\C)/Cl Amb25801180 [0,0,0,0,0,0|3,0,1]=4 172 B7R0.16 C\C(\C(O)=O)=C(\C)/Br Amb18124498 [0,0,0,0,0,0|2,0,1]=3 173 B7R0.16 C\C(\N)=C(\C)/C(N)=O Amb25293132 [0,0,0,0,0,0|3,0,1]=4 174 B7R0.16 C\C(\O)=C(\N)/C(O)=O Amb25320750 [0,0,0,0,0,0|2,0,1]=3 175 B7R0.16 Cl[C@H](C(=O)O)C(C)C Amb16232072 [0,0,0,0,0,0|3,0,1]=4 176 B7R0.16 N=C(C(O)=O)C(O)=O Amb24334530 [0,0,0,0,0,0|1,0,1]=2 177 B7R0.16 NC(=O)C(=O)C(O)=O Amb25344375 [0,0,0,0,0,0|2,0,1]=3 178 B7R0.16 NC(=O)C(Br)C(N)=O Amb23504430 [0,0,0,0,0,0|3,0,0]=3 179 B7R0.16 NC(=O)C(Cl)C(O)=O Amb25756168 [0,0,0,0,0,0|2,0,0]=2 180 B7R0.16 NC(=O)C(F)C(O)=O Amb25376646 [0,0,0,0,0,0|2,0,0]=2 181 B7R0.16 NC(=O)C(N)C(O)=O Amb24552728 [0,0,0,0,0,0|2,0,0]=2 182 B7R0.16 NC(=O)C(O)C(O)=O Amb24548669 [0,0,0,0,0,0|2,0,0]=2 183 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,0,0,0,0,0|1,0,0]=1 184 B7R0.16 NC(C(Cl)Cl)C(O)=O Amb24433439 [0,0,0,0,0,0|3,0,1]=4 185 B7R0.16 NC(C(F)F)C(O)=O Amb24713127 [0,0,0,0,0,0|3,0,1]=4 186 B7R0.16 NC(C(O)=O)S(O)=O Amb24464759 [0,0,0,0,0,0|2,0,0]=2 187 B7R0.16 NC(C(O)O)C(O)=O Amb25682498 [0,0,0,0,0,0|1,0,2]=3 188 B7R0.16 N[C@@H](C(Cl)Cl)C(O)=O Amb25101008 [0,0,0,0,0,0|3,0,1]=4 189 B7R0.16 N[C@@H](C(F)F)C(O)=O Amb24433723 [0,0,0,0,0,0|3,0,1]=4 190 B7R0.16 N[C@H](C(F)F)C(O)=O Amb24659125 [0,0,0,0,0,0|3,0,1]=4 191 B7R0.16 O=C(C(=O)C)C(=O)C Amb17593178 [0,0,0,0,0,0|3,0,1]=4 192 B7R0.16 O=C(Cl)C(Br)C(=O)Cl Amb24482983 [0,0,0,0,0,0|3,0,0]=3 193 B7R0.16 OC(=O)C(=O)C(O)=O Amb18641943 [0,0,0,0,0,0|1,0,1]=2 194 B7R0.16 OC(=O)C(=O)C(O)=O Amb22230802 [0,0,0,0,0,0|1,0,1]=2 195 B7R0.16 OC(=O)C(=S)C(O)=O Amb24544781 [0,0,0,0,0,0|1,0,1]=2 196 B7R0.16 OC(=O)C(=S)C(S)=S Amb24635391 [0,0,0,0,0,0|1,2,1]=4 197 B7R0.16 OC(=O)C(Cl)=C(Cl)Br Amb25365980 [0,0,0,0,0,0|3,0,1]=4 198 B7R0.16 OC(=O)C(Cl)=C(F)F Amb24758750 [0,0,0,0,0,0|3,0,1]=4 199 B7R0.16 OC(=O)C(Cl)C(Cl)Cl Amb24426145 [0,0,0,0,0,0|3,0,1]=4 200 B7R0.16 OC(=O)C(Cl)C(O)=O Amb18643353 [0,0,0,0,0,0|1,0,0]=1 201 B7R0.16 OC(=O)C(F)=C(Cl)Cl Amb25732891 [0,0,0,0,0,0|3,0,1]=4 202 B7R0.16 OC(=O)C(F)=C(F)Cl Amb24628494 [0,0,0,0,0,0|3,0,1]=4 203 B7R0.16 OC(=O)C(F)C(O)=O Amb24055884 [0,0,0,0,0,0|1,0,0]=1 204 B7R0.16 OC(=O)\C(\F)=C(/F)\Cl Amb25265638 [0,0,0,0,0,0|3,0,1]=4 205 B7R0.16 OC(C(=O)O)C(=O)O Amb1215315 [0,0,0,0,0,0|1,0,0]=1 206 B7R0.16 OC(C(=O)O)C(C)C Amb2582547 [0,0,0,0,0,0|3,0,1]=4 207 B7R0.16 OC(C(F)F)C(O)=O Amb25074883 [0,0,0,0,0,0|3,0,1]=4 208 B7R0.16 OC(C(O)=O)S(O)=O Amb24551214 [0,0,0,0,0,0|2,0,0]=2 209 B7R0.16 O[C@@H](C(=O)O)C(C)C Amb10071589 [0,0,0,0,0,0|3,0,1]=4 210 B7R0.16 [13CH3][13C@@H](O)[13C@H]([15NH2])[13C](O)=O Amb22353590 [0,0,0,0,0,0|2,0,1]=3 211 B7R0.16 [13CH3][13CH]([13CH3])[13C@H]([15NH2])[13C](O)=O Amb22338876 [0,0,0,0,0,0|3,0,1]=4 212 B7R0.16 [14CH3][14CH](O)[14CH](N)[14C](O)=O Amb22352529 [0,0,0,0,0,0|2,0,1]=3 213 B7R0.16 [O-]C(=O)C(=O)C([O-])=O Amb22234835 [0,0,0,0,0,0|1,0,3]=4 214 B6R0.2 C=C(Br)CC(N)=O Amb25174913 [1,0,0,0,0,0|3,0,0]=4 215 B6R0.2 C=C(Br)CC(O)=O Amb24479176 [1,0,0,0,0,0|2,0,0]=3 216 B6R0.2 C=C(Cl)CC(N)=O Amb24376175 [1,0,0,0,0,0|3,0,0]=4 217 B6R0.2 CC(=C)CC(=O)C Amb17593075 [1,0,0,0,0,0|3,0,0]=4 218 B6R0.2 CC(=CC(=O)O)C Amb1485519 [1,0,0,0,0,0|2,0,1]=4 219 B6R0.2 CC(=N)CC(N)=O Amb25259783 [1,0,0,0,0,0|3,0,0]=4 220 B6R0.2 CC(=O)CC(=C)Br Amb25662372 [1,0,0,0,0,0|3,0,0]=4 221 B6R0.2 CC(=O)CC(=O)Br Amb24422459 [1,0,0,0,0,0|2,0,0]=3 222 B6R0.2 CC(=O)CC(C)=N Amb22345922 [1,0,0,0,0,0|3,0,0]=4 223 B6R0.2 CC(=O)CC(C)=O Amb22727963 [1,0,0,0,0,0|2,0,0]=3 224 B6R0.2 CC(=O)CC(N)=S Amb24102403 [1,0,0,0,0,0|2,1,0]=4 225 B6R0.2 CC(=O)CC(O)=O Amb22348460 [1,0,0,0,0,0|1,0,0]=2 226 B6R0.2 CC(=O)CC(O)=S Amb24689856 [1,0,0,0,0,0|1,1,0]=3 227 B6R0.2 CC(=O)CC(O)O Amb25273111 [1,0,0,0,0,0|1,0,2]=4 228 B6R0.2 CC(=O)CC([O-])=O Amb22265051 [1,0,0,0,0,0|1,0,1]=3 229 B6R0.2 CC(=O)CS(C)=O Amb25025354 [1,0,0,0,0,0|3,0,0]=4 230 B6R0.2 CC(=O)C[N+]([O-])=O Amb18833135 [1,0,0,0,0,0|2,0,1]=4 231 B6R0.2 CC(=S)CC(N)=O Amb24479846 [1,0,0,0,0,0|2,1,0]=4 232 B6R0.2 CC(Br)=CC(O)=O Amb25347173 [1,0,0,0,0,0|2,0,1]=4 233 B6R0.2 CC(C)C[13C](O)=O Amb22336513 [1,0,0,0,0,0|2,0,1]=4 234 B6R0.2 CC(CC(=O)C)O Amb17593091 [1,0,0,0,0,0|2,0,1]=4 235 B6R0.2 CC(F)=CC(O)=O Amb24676595 [1,0,0,0,0,0|2,0,1]=4 236 B6R0.2 CC(F)CC(O)=O Amb24561809 [1,0,0,0,0,0|2,0,1]=4 237 B6R0.2 CC(I)=CC(O)=O Amb24668934 [1,0,0,0,0,0|2,0,1]=4 238 B6R0.2 CC(N)=CC(O)=O Amb25856437 [1,0,0,0,0,0|2,0,1]=4 239 B6R0.2 CC(N)CC(O)=O Amb19888354 [1,0,0,0,0,0|2,0,1]=4 240 B6R0.2 CC(O)CC(O)=O Amb22348403 [1,0,0,0,0,0|1,0,1]=3 241 B6R0.2 CC(O)CP(O)=O Amb24406357 [1,0,0,0,0,0|2,0,1]=4 242 B6R0.2 CC(S)CC(O)=O Amb18281031 [1,0,0,0,0,0|1,1,1]=4 243 B6R0.2 CN(Br)CC(O)=O Amb25745878 [1,0,0,0,0,0|3,0,0]=4 244 B6R0.2 CN(Cl)CC(O)=O Amb24455857 [1,0,0,0,0,0|3,0,0]=4 245 B6R0.2 CN(N)CC(O)=O Amb23592296 [1,0,0,0,0,0|3,0,0]=4 246 B6R0.2 CN(O)CC(O)=O Amb24732008 [1,0,0,0,0,0|2,0,0]=3 247 B6R0.2 CS(=O)CC(N)=O Amb24394100 [1,0,0,0,0,0|3,0,0]=4 248 B6R0.2 CS(=O)CC(O)=O Amb18957960 [1,0,0,0,0,0|2,0,0]=3 249 B6R0.2 C[13CH](O)C[13C]([O-])=O Amb22338641 [1,0,0,0,0,0|1,0,2]=4 250 B6R0.2 C[13C](=O)O[13C](C)=O Amb22353530 [1,0,0,0,0,0|3,0,0]=4 251 B6R0.2 C[C@@H](CC(=O)O)N Amb16184012 [1,0,0,0,0,0|2,0,1]=4 252 B6R0.2 C[C@@H](O)CC(N)=O Amb25746564 [1,0,0,0,0,0|2,0,1]=4 253 B6R0.2 C[C@@H](S)CC(O)=O Amb24480921 [1,0,0,0,0,0|1,1,1]=4 254 B6R0.2 C[C@H](Br)CC(O)=O Amb24432019 [1,0,0,0,0,0|2,0,1]=4 255 B6R0.2 C[C@H](CC(=O)O)N Amb16184009 [1,0,0,0,0,0|2,0,1]=4 256 B6R0.2 C[C@H](Cl)CC(O)=O Amb25259323 [1,0,0,0,0,0|2,0,1]=4 257 B6R0.2 C[C@H](F)CC(O)=O Amb24586490 [1,0,0,0,0,0|2,0,1]=4 258 B6R0.2 C[C@H](O)CC(C)=O Amb24334071 [1,0,0,0,0,0|2,0,1]=4 259 B6R0.2 C[C@H](O)CC(O)=O Amb22232025 [1,0,0,0,0,0|1,0,1]=3 260 B6R0.2 C[C@H](S)CC(O)=O Amb25190038 [1,0,0,0,0,0|1,1,1]=4 261 B6R0.2 C[NH+](C)CC(O)=O Amb24113881 [1,0,0,0,0,0|3,0,0]=4 262 B6R0.2 C\C(\Br)=C\C(O)=O Amb25662428 [1,0,0,0,0,0|2,0,1]=4 263 B6R0.2 C\C(\Cl)=C/C(O)=O Amb18123483 [1,0,0,0,0,0|2,0,1]=4 264 B6R0.2 C\C(\Cl)=C\C(O)=O Amb23556468 [1,0,0,0,0,0|2,0,1]=4 265 B6R0.2 C\C(\I)=C\C(O)=O Amb24741877 [1,0,0,0,0,0|2,0,1]=4 266 B6R0.2 C\C(\O)=C\C(C)=O Amb22034390 [1,0,0,0,0,0|2,0,1]=4 267 B6R0.2 N=C(Cl)CC(O)=O Amb25796071 [1,0,0,0,0,0|2,0,0]=3 268 B6R0.2 NC(=N)CC(=O)N Amb1981332 [1,0,0,0,0,0|3,0,0]=4 269 B6R0.2 NC(=O)CC(=N)[NH3+] Amb2439350 [1,0,0,0,0,0|3,0,0]=4 270 B6R0.2 NC(=O)CC(=O)N Amb1971463 [1,0,0,0,0,0|2,0,0]=3 271 B6R0.2 NC(=O)CC(=S)N Amb1155422 [1,0,0,0,0,0|2,1,0]=4 272 B6R0.2 NC(=O)CC(O)O Amb25810087 [1,0,0,0,0,0|1,0,2]=4 273 B6R0.2 NC(=O)CC([O-])=O Amb22263088 [1,0,0,0,0,0|1,0,1]=3 274 B6R0.2 NC(=O)[CH-]C(N)=O Amb24591184 [1,0,0,0,0,0|2,0,1]=4 275 B6R0.2 NC(F)CC(O)=O Amb24479804 [1,0,0,0,0,0|2,0,1]=4 276 B6R0.2 N[13C](=O)N[13C](N)=O Amb22367408 [1,0,0,0,0,0|3,0,0]=4 277 B6R0.2 N[13C](=O)[13CH2][13C](=O)N Amb17616663 [1,0,0,0,0,0|2,0,0]=3 278 B6R0.2 N[C@@H](CC(=O)O)O Amb16232006 [1,0,0,0,0,0|1,0,1]=3 279 B6R0.2 N[C@@H](F)CC(O)=O Amb25854307 [1,0,0,0,0,0|2,0,1]=4 280 B6R0.2 OB(O)CC(O)=O Amb24053058 [1,0,0,0,0,0|1,0,1]=3 281 B6R0.2 OC(=O)C=C(Br)Br Amb24435008 [1,0,0,0,0,0|2,0,1]=4 282 B6R0.2 OC(=O)C=C(F)F Amb24116995 [1,0,0,0,0,0|2,0,1]=4 283 B6R0.2 OC(=O)CC(=S)N Amb17465742 [1,0,0,0,0,0|1,1,0]=3 284 B6R0.2 OC(=O)CC(F)Br Amb25336987 [1,0,0,0,0,0|2,0,1]=4 285 B6R0.2 OC(=O)CC(F)F Amb22001551 [1,0,0,0,0,0|2,0,1]=4 286 B6R0.2 OC(=O)CC(O)=O Amb21935659 [1,0,0,0,0,0|0,0,0]=1 287 B6R0.2 OC(=O)CC(O)=O Amb22230690 [1,0,0,0,0,0|0,0,0]=1 288 B6R0.2 OC(=O)CC(O)=O Amb22230927 [1,0,0,0,0,0|0,0,0]=1 289 B6R0.2 OC(=O)CN(Cl)Cl Amb25133084 [1,0,0,0,0,0|3,0,0]=4 290 B6R0.2 OC(=O)[13CH2]C(O)=O Amb22337806 [1,0,0,0,0,0|0,0,0]=1 291 B6R0.2 O[13C](=O)C[13C](O)=O Amb22353218 [1,0,0,0,0,0|0,0,0]=1 292 B6R0.2 O[13C](=O)[13CH2][13C](O)=O Amb22363192 [1,0,0,0,0,0|0,0,0]=1 293 B6R0.2 O[14C](=O)O[14C](O)=O Amb22362831 [1,0,0,0,0,0|1,0,0]=2 294 B6R0.2 [13CH3]C(=O)OC([13CH3])=O Amb22336728 [1,0,0,0,0,0|3,0,0]=4 295 B6R0.2 [13CH3]C(O)[13CH2]C([O-])=O Amb22351144 [1,0,0,0,0,0|1,0,2]=4 296 B6R0.2 [13CH3][13C](=O)O[13C]([13CH3])=O Amb22338759 [1,0,0,0,0,0|3,0,0]=4 297 B6R0.2 [15NH2]C(=O)[15NH]C([15NH2])=O Amb22367466 [1,0,0,0,0,0|3,0,0]=4 298 B6R0.2 [BH3-][S+](C)CC(O)=O Amb24480870 [1,0,0,0,0,0|3,0,0]=4 299 B6R0.2 [O-]C(=O)CC(=O)[O-] Amb10070428 [1,0,0,0,0,0|0,0,2]=3 300 B6R0.2 [O-]C(=O)CC([O-])=O Amb22730396 [1,0,0,0,0,0|0,0,2]=3 301 B6R0.2 [O-]C(=O)C[C@@H](O)C Amb10844672 [1,0,0,0,0,0|1,0,2]=4 302 B6R0.2 [O-][N+](=O)CC(=O)N Amb10069145 [1,0,0,0,0,0|2,0,1]=4 303 B6R0.2 [O-][N+](=O)CC(=O)N Amb1101925 [1,0,0,0,0,0|2,0,1]=4 304 B6R0.3 C#CC(O)C(O)=O Amb22731622 [1,0,0,0,0,0|2,0,1]=4 305 B6R0.3 C#C[C@H](N)C(O)=O Amb22350666 [1,0,0,0,0,0|2,0,1]=4 306 B6R0.3 C=C(C=C)C(O)=O Amb24394371 [1,0,0,0,0,0|1,0,2]=4 307 B6R0.3 C=C(CO)C(O)=O Amb18121817 [1,0,0,0,0,0|0,0,3]=4 308 B6R0.3 C=CC(=O)C(O)=O Amb22011796 [1,0,0,0,0,0|2,0,1]=4 309 B6R0.3 C=CC(Br)C(O)=O Amb24453871 [1,0,0,0,0,0|2,0,0]=3 310 B6R0.3 C=CC(Cl)C(N)=O Amb24479818 [1,0,0,0,0,0|3,0,0]=4 311 B6R0.3 C=CC(N)C(N)=O Amb24689093 [1,0,0,0,0,0|3,0,0]=4 312 B6R0.3 C=CC(N)C(O)=O Amb20240543 [1,0,0,0,0,0|2,0,0]=3 313 B6R0.3 C=CC(O)C(O)=O Amb24061247 [1,0,0,0,0,0|2,0,0]=3 314 B6R0.3 C=C[C@@H](N)C(O)=O Amb20241335 [1,0,0,0,0,0|2,0,0]=3 315 B6R0.3 C=C[C@@H](N)C(O)=O Amb22756048 [1,0,0,0,0,0|2,0,0]=3 316 B6R0.3 C=C[C@@H](O)C(N)=O Amb25791152 [1,0,0,0,0,0|3,0,0]=4 317 B6R0.3 C=C[C@@H](O)C(O)=O Amb25146844 [1,0,0,0,0,0|2,0,0]=3 318 B6R0.3 C=C[C@H](O)C(O)=O Amb25118468 [1,0,0,0,0,0|2,0,0]=3 319 B6R0.3 CC(=C)C(O)C=O Amb24457056 [1,0,0,0,0,0|3,0,0]=4 320 B6R0.3 CC(=C=C)C(=O)O Amb17593066 [1,0,0,0,0,0|1,0,2]=4 321 B6R0.3 CC(=CCl)C(C)=O Amb25807396 [1,0,0,0,0,0|2,0,1]=4 322 B6R0.3 CC(=CCl)C(O)=O Amb25692582 [1,0,0,0,0,0|1,0,1]=3 323 B6R0.3 CC(=CN)C(C)=O Amb25804374 [1,0,0,0,0,0|2,0,1]=4 324 B6R0.3 CC(=CN)C(O)=O Amb25375168 [1,0,0,0,0,0|1,0,1]=3 325 B6R0.3 CC(=CO)C(C)=O Amb25377802 [1,0,0,0,0,0|1,0,1]=3 326 B6R0.3 CC(=CO)C(O)=O Amb25745269 [1,0,0,0,0,0|0,0,1]=2 327 B6R0.3 CC(=NBr)C(O)=O Amb24518467 [1,0,0,0,0,0|2,0,1]=4 328 B6R0.3 CC(=O)C(=O)C=O Amb25281133 [1,0,0,0,0,0|2,0,1]=4 329 B6R0.3 CC(=O)C(Br)=CO Amb25233141 [1,0,0,0,0,0|2,0,1]=4 330 B6R0.3 CC(=O)C(Br)CO Amb24649743 [1,0,0,0,0,0|2,0,1]=4 331 B6R0.3 CC(=O)C(Br)N=O Amb24332992 [1,0,0,0,0,0|3,0,0]=4 332 B6R0.3 CC(=O)C(C)=C=O Amb25735802 [1,0,0,0,0,0|1,0,2]=4 333 B6R0.3 CC(=O)C(Cl)CO Amb25321596 [1,0,0,0,0,0|2,0,1]=4 334 B6R0.3 CC(=O)C(F)CO Amb24725289 [1,0,0,0,0,0|2,0,1]=4 335 B6R0.3 CC(=O)C(N)=CO Amb25264865 [1,0,0,0,0,0|2,0,1]=4 336 B6R0.3 CC(=O)C(N)CO Amb18640011 [1,0,0,0,0,0|2,0,1]=4 337 B6R0.3 CC(=O)C(O)=CO Amb25302267 [1,0,0,0,0,0|2,0,1]=4 338 B6R0.3 CC(=O)C(O)C=O Amb24715304 [1,0,0,0,0,0|2,0,0]=3 339 B6R0.3 CC(=O)C([Na])C=O Amb25858759 [1,0,0,0,0,0|2,0,0]=3 340 B6R0.3 CC(=O)N(C)N=O Amb25259815 [1,0,0,0,0,0|3,0,0]=4 341 B6R0.3 CC(=O)[C@@H](N)CO Amb22745043 [1,0,0,0,0,0|2,0,1]=4 342 B6R0.3 CC(=O)[C@@H](O)C=C Amb25662172 [1,0,0,0,0,0|3,0,0]=4 343 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [1,0,0,0,0,0|2,0,1]=4 344 B6R0.3 CC(=O)[C@H](O)C=C Amb24480657 [1,0,0,0,0,0|3,0,0]=4 345 B6R0.3 CC(=O)[C@H](O)CO Amb25838797 [1,0,0,0,0,0|2,0,1]=4 346 B6R0.3 CC(=O)\C(=C\O)\Br Amb17232510 [1,0,0,0,0,0|2,0,1]=4 347 B6R0.3 CC(=O)\C(\O)=C\O Amb24621662 [1,0,0,0,0,0|2,0,1]=4 348 B6R0.3 CC(C#C)C(O)=O Amb25085390 [1,0,0,0,0,0|1,0,1]=3 349 B6R0.3 CC(C#N)C(N)=O Amb25336872 [1,0,0,0,0,0|2,0,1]=4 350 B6R0.3 CC(C#N)C([O-])=O Amb22057371 [1,0,0,0,0,0|1,0,2]=4 351 B6R0.3 CC(C#N)S(O)=O Amb25745526 [1,0,0,0,0,0|2,0,1]=4 352 B6R0.3 CC(C(=O)C)CO Amb10844844 [1,0,0,0,0,0|1,0,1]=3 353 B6R0.3 CC(C(=O)O)C#N Amb17210512 [1,0,0,0,0,0|1,0,1]=3 354 B6R0.3 CC(C)=C(C)C=O Amb18639155 [1,0,0,0,0,0|2,0,1]=4 355 B6R0.3 CC(C=C)C(C)=C Amb22228297 [1,0,0,0,0,0|3,0,0]=4 356 B6R0.3 CC(C=C)C(O)=O Amb21618706 [1,0,0,0,0,0|1,0,0]=2 357 B6R0.3 CC(C=O)=C(C)Br Amb25309571 [1,0,0,0,0,0|2,0,1]=4 358 B6R0.3 CC(C=O)=C(C)S Amb24513083 [1,0,0,0,0,0|1,1,1]=4 359 B6R0.3 CC(C=O)C(C)=C Amb18639176 [1,0,0,0,0,0|2,0,0]=3 360 B6R0.3 CC(C=O)C(C)=O Amb18639572 [1,0,0,0,0,0|1,0,0]=2 361 B6R0.3 CC(C=O)C(F)F Amb25746789 [1,0,0,0,0,0|2,0,1]=4 362 B6R0.3 CC(C=O)C(N)=O Amb24479831 [1,0,0,0,0,0|1,0,0]=2 363 B6R0.3 CC(C=O)N(C)C Amb25771612 [1,0,0,0,0,0|3,0,0]=4 364 B6R0.3 CC(CBr)C(C)=O Amb25296678 [1,0,0,0,0,0|2,0,1]=4 365 B6R0.3 CC(CBr)C(O)=O Amb22002601 [1,0,0,0,0,0|1,0,1]=3 366 B6R0.3 CC(CCl)C(=O)Cl Amb24479841 [1,0,0,0,0,0|2,0,1]=4 367 B6R0.3 CC(CCl)C(=O)S Amb24410197 [1,0,0,0,0,0|1,1,1]=4 368 B6R0.3 CC(CCl)C(N)=O Amb25061744 [1,0,0,0,0,0|2,0,1]=4 369 B6R0.3 CC(CCl)C(O)=O Amb18522181 [1,0,0,0,0,0|1,0,1]=3 370 B6R0.3 CC(CF)C(C)=O Amb25253758 [1,0,0,0,0,0|2,0,1]=4 371 B6R0.3 CC(CF)C(O)=O Amb24432331 [1,0,0,0,0,0|1,0,1]=3 372 B6R0.3 CC(CI)C(O)=O Amb25695307 [1,0,0,0,0,0|1,0,1]=3 373 B6R0.3 CC(CN)C(=O)Cl Amb24525988 [1,0,0,0,0,0|2,0,1]=4 374 B6R0.3 CC(CN)C(C)=O Amb18639690 [1,0,0,0,0,0|2,0,1]=4 375 B6R0.3 CC(CO)C(C)=C Amb24539367 [1,0,0,0,0,0|2,0,1]=4 376 B6R0.3 CC(CO)C([O-])=O Amb24123145 [1,0,0,0,0,0|0,0,2]=3 377 B6R0.3 CC(CO)S(C)=O Amb25173825 [1,0,0,0,0,0|2,0,1]=4 378 B6R0.3 CC(CS)C(C)=O Amb25830693 [1,0,0,0,0,0|1,1,1]=4 379 B6R0.3 CC(CS)C(N)=O Amb25759660 [1,0,0,0,0,0|1,1,1]=4 380 B6R0.3 CC(N=C)C(O)=O Amb24591339 [1,0,0,0,0,0|2,0,0]=3 381 B6R0.3 CC(NBr)C(O)=O Amb24677636 [1,0,0,0,0,0|2,0,0]=3 382 B6R0.3 CC(NCl)C(O)=O Amb25267473 [1,0,0,0,0,0|2,0,0]=3 383 B6R0.3 CC(NN)C(O)=O Amb18640367 [1,0,0,0,0,0|2,0,0]=3 384 B6R0.3 CC(O)=C(Br)C=O Amb25810089 [1,0,0,0,0,0|2,0,1]=4 385 B6R0.3 CC(O)=C(O)C=O Amb25747147 [1,0,0,0,0,0|2,0,1]=4 386 B6R0.3 CC(O)C(Br)C=O Amb25702152 [1,0,0,0,0,0|2,0,1]=4 387 B6R0.3 CC(O)C(N)C=O Amb24480424 [1,0,0,0,0,0|2,0,1]=4 388 B6R0.3 CC(O)C(O)C=O Amb18122303 [1,0,0,0,0,0|2,0,1]=4 389 B6R0.3 CC(ON)C(O)=O Amb24479235 [1,0,0,0,0,0|2,0,0]=3 390 B6R0.3 CCC(C(=O)O)S Amb17501370 [1,0,0,0,0,0|2,0,1]=4 391 B6R0.3 CCC(F)C(O)=O Amb25716167 [1,0,0,0,0,0|2,0,1]=4 392 B6R0.3 CCC(O)C(O)=O Amb22352315 [1,0,0,0,0,0|2,0,1]=4 393 B6R0.3 CCC(O)C(O)=O Amb22360643 [1,0,0,0,0,0|2,0,1]=4 394 B6R0.3 CC[C@@H](C)C(=O)Cl Amb24577241 [1,0,0,0,0,0|2,0,1]=4 395 B6R0.3 CC[C@@H](C)C(N)=O Amb22232008 [1,0,0,0,0,0|2,0,1]=4 396 B6R0.3 CC[C@@H](Cl)C(O)=O Amb22800493 [1,0,0,0,0,0|2,0,1]=4 397 B6R0.3 CC[C@@H](F)C(O)=O Amb24669143 [1,0,0,0,0,0|2,0,1]=4 398 B6R0.3 CC[C@@H](O)C(O)=O Amb22369401 [1,0,0,0,0,0|2,0,1]=4 399 B6R0.3 CC[C@H](Br)C(O)=O Amb20242441 [1,0,0,0,0,0|2,0,1]=4 400 B6R0.3 CC[C@H](C(=O)O)N Amb16233349 [1,0,0,0,0,0|2,0,1]=4 401 B6R0.3 CC[C@H](C)C(C)=O Amb24706969 [1,0,0,0,0,0|2,0,1]=4 402 B6R0.3 CC[C@H](Cl)C(O)=O Amb25190040 [1,0,0,0,0,0|2,0,1]=4 403 B6R0.3 CC[C@H](F)C(O)=O Amb24479776 [1,0,0,0,0,0|2,0,1]=4 404 B6R0.3 CN(N=O)C(N)=O Amb22727977 [1,0,0,0,0,0|3,0,0]=4 405 B6R0.3 CNC(C)C(C)=O Amb24369529 [1,0,0,0,0,0|3,0,0]=4 406 B6R0.3 CNC(C)C(O)=O Amb19373699 [1,0,0,0,0,0|2,0,0]=3 407 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [1,0,0,0,0,0|3,0,0]=4 408 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [1,0,0,0,0,0|3,0,0]=4 409 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [1,0,0,0,0,0|3,0,0]=4 410 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [1,0,0,0,0,0|3,0,0]=4 411 B6R0.3 COC(N)C(O)=O Amb24621851 [1,0,0,0,0,0|3,0,0]=4 412 B6R0.3 COC(O)C(O)=O Amb24479754 [1,0,0,0,0,0|3,0,0]=4 413 B6R0.3 CO[C@H](C)C(C)=O Amb24736032 [1,0,0,0,0,0|3,0,0]=4 414 B6R0.3 CSC(Br)C(O)=O Amb25169549 [1,0,0,0,0,0|3,0,0]=4 415 B6R0.3 CSC(C)C(=O)Cl Amb24742667 [1,0,0,0,0,0|3,0,0]=4 416 B6R0.3 CSC(F)C(O)=O Amb25043740 [1,0,0,0,0,0|3,0,0]=4 417 B6R0.3 CS[C@@H](C)C(O)=O Amb25173497 [1,0,0,0,0,0|2,0,0]=3 418 B6R0.3 C[C@@H](C(=O)O)CN Amb10844022 [1,0,0,0,0,0|1,0,1]=3 419 B6R0.3 C[C@@H](C(=O)O)NC Amb16233347 [1,0,0,0,0,0|2,0,0]=3 420 B6R0.3 C[C@@H](C(=O)O)NC Amb16233348 [1,0,0,0,0,0|2,0,0]=3 421 B6R0.3 C[C@@H](C=O)C(C)=O Amb24666681 [1,0,0,0,0,0|1,0,0]=2 422 B6R0.3 C[C@@H](C=O)[C@@H](C)O Amb25714216 [1,0,0,0,0,0|1,0,1]=3 423 B6R0.3 C[C@@H](CBr)C(O)=O Amb24334368 [1,0,0,0,0,0|1,0,1]=3 424 B6R0.3 C[C@@H](CN)C(O)=O Amb22756746 [1,0,0,0,0,0|1,0,1]=3 425 B6R0.3 C[C@@H](CO)C(C)=C Amb25025795 [1,0,0,0,0,0|2,0,1]=4 426 B6R0.3 C[C@@H](CO)C(C)=O Amb25320503 [1,0,0,0,0,0|1,0,1]=3 427 B6R0.3 C[C@@H](CS)C(O)=O Amb24462697 [1,0,0,0,0,0|0,1,1]=3 428 B6R0.3 C[C@@H](NN)C(O)=O Amb24732969 [1,0,0,0,0,0|2,0,0]=3 429 B6R0.3 C[C@@H](NO)C(O)=O Amb24702625 [1,0,0,0,0,0|1,0,0]=2 430 B6R0.3 C[C@@H](O)[C@H](C)CO Amb25810619 [1,0,0,0,0,0|1,0,2]=4 431 B6R0.3 C[C@@H](O)[C@H](O)C=O Amb24398705 [1,0,0,0,0,0|2,0,1]=4 432 B6R0.3 C[C@H](C(=O)N)OC Amb17617080 [1,0,0,0,0,0|3,0,0]=4 433 B6R0.3 C[C@H](C(=O)O)CCl Amb10844008 [1,0,0,0,0,0|1,0,1]=3 434 B6R0.3 C[C@H](C(=O)O)NC Amb10844859 [1,0,0,0,0,0|2,0,0]=3 435 B6R0.3 C[C@H](C=C)[C@@H](C)O Amb25167394 [1,0,0,0,0,0|2,0,1]=4 436 B6R0.3 C[C@H](C=C)[C@H](C)O Amb25284228 [1,0,0,0,0,0|2,0,1]=4 437 B6R0.3 C[C@H](C=O)C(C)=O Amb25358934 [1,0,0,0,0,0|1,0,0]=2 438 B6R0.3 C[C@H](C=O)N(C)C Amb24333507 [1,0,0,0,0,0|3,0,0]=4 439 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [1,0,0,0,0,0|2,0,1]=4 440 B6R0.3 C[C@H](CCl)C(O)=O Amb25133056 [1,0,0,0,0,0|1,0,1]=3 441 B6R0.3 C[C@H](CN)C(O)=O Amb24117452 [1,0,0,0,0,0|1,0,1]=3 442 B6R0.3 C[C@H](CO)S(C)=O Amb24334035 [1,0,0,0,0,0|2,0,1]=4 443 B6R0.3 C[C@H](CS)C(O)=O Amb25228453 [1,0,0,0,0,0|0,1,1]=3 444 B6R0.3 C[C@H](N=C)C(O)=O Amb25720495 [1,0,0,0,0,0|2,0,0]=3 445 B6R0.3 C[C@H](NCl)C(O)=O Amb24460300 [1,0,0,0,0,0|2,0,0]=3 446 B6R0.3 C[C@H](O)[C@@H](C)CO Amb24480821 [1,0,0,0,0,0|1,0,2]=4 447 B6R0.3 C[C@H](O)[C@H](C)CO Amb25127201 [1,0,0,0,0,0|1,0,2]=4 448 B6R0.3 C[C@H](ON)C(O)=O Amb25853808 [1,0,0,0,0,0|2,0,0]=3 449 B6R0.3 C\C(=C/Br)\C(=O)Cl Amb25299886 [1,0,0,0,0,0|2,0,1]=4 450 B6R0.3 C\C(=C/Br)\C(C)=O Amb25061221 [1,0,0,0,0,0|2,0,1]=4 451 B6R0.3 C\C(=C/N)\C(C)=O Amb24551470 [1,0,0,0,0,0|2,0,1]=4 452 B6R0.3 C\C(=C/N)\C(O)=O Amb24507602 [1,0,0,0,0,0|1,0,1]=3 453 B6R0.3 C\C(=C/O)\C(O)=O Amb25140969 [1,0,0,0,0,0|0,0,1]=2 454 B6R0.3 C\C(=C\Br)\C(N)=O Amb25362058 [1,0,0,0,0,0|2,0,1]=4 455 B6R0.3 C\C(=C\C)\C(=O)Cl Amb25173910 [1,0,0,0,0,0|2,0,1]=4 456 B6R0.3 C\C(=C\C)\C(C)=O Amb25718935 [1,0,0,0,0,0|2,0,1]=4 457 B6R0.3 C\C(=C\Cl)\C(N)=O Amb25259193 [1,0,0,0,0,0|2,0,1]=4 458 B6R0.3 C\C(=C\O)\C(C)=O Amb24361303 [1,0,0,0,0,0|1,0,1]=3 459 B6R0.3 C\C(=C\O)\C(N)=O Amb24479832 [1,0,0,0,0,0|1,0,1]=3 460 B6R0.3 C\C(=N/O)\C(N)=O Amb24680733 [1,0,0,0,0,0|2,0,1]=4 461 B6R0.3 C\C(=N\Br)\C(O)=O Amb25745370 [1,0,0,0,0,0|2,0,1]=4 462 B6R0.3 C\C(=N\O)\C(O)=O Amb23523075 [1,0,0,0,0,0|1,0,1]=3 463 B6R0.3 C\C(\C=O)=C(/C)\Br Amb18645749 [1,0,0,0,0,0|2,0,1]=4 464 B6R0.3 C\C(\C=O)=C(/C)\Cl Amb18641884 [1,0,0,0,0,0|2,0,1]=4 465 B6R0.3 C\C(\C=O)=C(/C)\S Amb18641908 [1,0,0,0,0,0|1,1,1]=4 466 B6R0.3 C\C(\C=O)=C(\C)/Br Amb25257629 [1,0,0,0,0,0|2,0,1]=4 467 B6R0.3 C\C(\O)=C(\O)/C=O Amb25119300 [1,0,0,0,0,0|2,0,1]=4 468 B6R0.3 C\C=C(/Br)\C(O)=O Amb18646193 [1,0,0,0,0,0|2,0,1]=4 469 B6R0.3 C\C=C(/Cl)\C(O)=O Amb18123515 [1,0,0,0,0,0|2,0,1]=4 470 B6R0.3 C\C=C(/O)\C(O)=O Amb22727962 [1,0,0,0,0,0|2,0,1]=4 471 B6R0.3 NC(=O)C(Cl)CO Amb24392534 [1,0,0,0,0,0|2,0,1]=4 472 B6R0.3 NC(=O)C(F)CO Amb24507432 [1,0,0,0,0,0|2,0,1]=4 473 B6R0.3 NC(=O)N(O)C=O Amb24479864 [1,0,0,0,0,0|3,0,0]=4 474 B6R0.3 NC(=O)[C@H](O)CO Amb25732480 [1,0,0,0,0,0|2,0,1]=4 475 B6R0.3 NC(C#N)C(O)=O Amb25328320 [1,0,0,0,0,0|2,0,1]=4 476 B6R0.3 NC(C(=O)N)CO Amb17593097 [1,0,0,0,0,0|2,0,1]=4 477 B6R0.3 NC(C(=O)O)CF Amb10839589 [1,0,0,0,0,0|2,0,1]=4 478 B6R0.3 NC(C(=O)O)CS Amb13961966 [1,0,0,0,0,0|1,1,1]=4 479 B6R0.3 NC(C=O)C(O)=O Amb24349579 [1,0,0,0,0,0|1,0,0]=2 480 B6R0.3 NC(C=S)C(O)=O Amb25227802 [1,0,0,0,0,0|1,1,0]=3 481 B6R0.3 NC(CCl)C(O)=O Amb19651457 [1,0,0,0,0,0|2,0,1]=4 482 B6R0.3 NC(CCl)C(O)=O Amb21961077 [1,0,0,0,0,0|2,0,1]=4 483 B6R0.3 NC(CI)C(O)=O Amb25177412 [1,0,0,0,0,0|2,0,1]=4 484 B6R0.3 NC(CO)[13C](O)=O Amb22353217 [1,0,0,0,0,0|1,0,1]=3 485 B6R0.3 NC(CS)C(O)=O Amb22489523 [1,0,0,0,0,0|1,1,1]=4 486 B6R0.3 NC([13CH2]S)C(O)=O Amb22054824 [1,0,0,0,0,0|1,1,1]=4 487 B6R0.3 NCC(C(=O)O)Cl Amb17593263 [1,0,0,0,0,0|2,0,1]=4 488 B6R0.3 NCC(C(=O)O)S Amb17593238 [1,0,0,0,0,0|2,0,1]=4 489 B6R0.3 NCC(F)C(O)=O Amb22733051 [1,0,0,0,0,0|2,0,1]=4 490 B6R0.3 NCC(N)C(O)=O Amb22899095 [1,0,0,0,0,0|2,0,1]=4 491 B6R0.3 NC[C@@H](F)C(O)=O Amb25824168 [1,0,0,0,0,0|2,0,1]=4 492 B6R0.3 NC[C@@H](N)C(O)=O Amb22745957 [1,0,0,0,0,0|2,0,1]=4 493 B6R0.3 NC[C@@H](O)C(O)=O Amb22169412 [1,0,0,0,0,0|2,0,1]=4 494 B6R0.3 NOC(F)C(O)=O Amb24446310 [1,0,0,0,0,0|3,0,0]=4 495 B6R0.3 NOC(O)C(O)=O Amb24735537 [1,0,0,0,0,0|3,0,0]=4 496 B6R0.3 N[13CH2][13C@H]([13C](=O)O)F Amb17608076 [1,0,0,0,0,0|2,0,1]=4 497 B6R0.3 N[13CH2][13CH]([13C](=O)O)F Amb17614381 [1,0,0,0,0,0|2,0,1]=4 498 B6R0.3 N[14CH]([14CH2]O)[14C](O)=O Amb22362940 [1,0,0,0,0,0|1,0,1]=3 499 B6R0.3 N[C@@H](CCl)C(O)=O Amb22232860 [1,0,0,0,0,0|2,0,1]=4 500 B6R0.3 N[C@@H](CI)C(O)=O Amb25767583 [1,0,0,0,0,0|2,0,1]=4 501 B6R0.3 N[C@@H](CO)C(O)=O Amb22351170 [1,0,0,0,0,0|1,0,1]=3 502 B6R0.3 N[C@@H](CS)[13C](O)=O Amb22350380 [1,0,0,0,0,0|1,1,1]=4 503 B6R0.3 N[C@H](C(=O)O)CN Amb16183820 [1,0,0,0,0,0|2,0,1]=4 504 B6R0.3 N[C@H](CF)C(O)=O Amb24479910 [1,0,0,0,0,0|2,0,1]=4 505 B6R0.3 N[C@H](CO)C(N)=O Amb22886957 [1,0,0,0,0,0|2,0,1]=4 506 B6R0.3 N[C@H](CS)C(O)=O Amb17942912 [1,0,0,0,0,0|1,1,1]=4 507 B6R0.3 N\C(=N/O)\C(O)=O Amb24670890 [1,0,0,0,0,0|2,0,1]=4 508 B6R0.3 O=CC(C(=O)C)Br Amb17232509 [1,0,0,0,0,0|2,0,0]=3 509 B6R0.3 O=CC(C(C)C)C Amb17593082 [1,0,0,0,0,0|2,0,1]=4 510 B6R0.3 OC(=CBr)C(O)=O Amb24479759 [1,0,0,0,0,0|2,0,1]=4 511 B6R0.3 OC(=CS)C(O)=O Amb25340519 [1,0,0,0,0,0|1,1,1]=4 512 B6R0.3 OC(=O)C(=O)C=O Amb25836179 [1,0,0,0,0,0|1,0,1]=3 513 B6R0.3 OC(=O)C(Br)=CCl Amb24429120 [1,0,0,0,0,0|2,0,1]=4 514 B6R0.3 OC(=O)C(Br)CCl Amb24478864 [1,0,0,0,0,0|2,0,1]=4 515 B6R0.3 OC(=O)C(CF)Br Amb10605519 [1,0,0,0,0,0|2,0,1]=4 516 B6R0.3 OC(=O)C(Cl)=CBr Amb24478967 [1,0,0,0,0,0|2,0,1]=4 517 B6R0.3 OC(=O)C(Cl)=NO Amb25839923 [1,0,0,0,0,0|2,0,1]=4 518 B6R0.3 OC(=O)C(Cl)C=O Amb24480969 [1,0,0,0,0,0|1,0,0]=2 519 B6R0.3 OC(=O)C(Cl)CBr Amb25227429 [1,0,0,0,0,0|2,0,1]=4 520 B6R0.3 OC(=O)C(Cl)CCl Amb22228245 [1,0,0,0,0,0|2,0,1]=4 521 B6R0.3 OC(=O)C(Cl)CF Amb24669144 [1,0,0,0,0,0|2,0,1]=4 522 B6R0.3 OC(=O)C(Cl)CS Amb18643661 [1,0,0,0,0,0|1,1,1]=4 523 B6R0.3 OC(=O)C(F)=CBr Amb24651069 [1,0,0,0,0,0|2,0,1]=4 524 B6R0.3 OC(=O)C(F)=CCl Amb25805817 [1,0,0,0,0,0|2,0,1]=4 525 B6R0.3 OC(=O)C(F)C=O Amb22055301 [1,0,0,0,0,0|1,0,0]=2 526 B6R0.3 OC(=O)C(F)CF Amb24746801 [1,0,0,0,0,0|2,0,1]=4 527 B6R0.3 OC(=O)C(S)=CS Amb24480963 [1,0,0,0,0,0|1,1,1]=4 528 B6R0.3 OC(=O)C(S)=NO Amb24479775 [1,0,0,0,0,0|2,0,1]=4 529 B6R0.3 OC(=O)C(S)CS Amb18643295 [1,0,0,0,0,0|1,1,1]=4 530 B6R0.3 OC(=O)[C@H](Cl)CCl Amb25141566 [1,0,0,0,0,0|2,0,1]=4 531 B6R0.3 OC(=O)\C(=C/Cl)\Cl Amb17593560 [1,0,0,0,0,0|2,0,1]=4 532 B6R0.3 OC(=O)\C(\Br)=C/Br Amb22469643 [1,0,0,0,0,0|2,0,1]=4 533 B6R0.3 OC(=O)\C(\Cl)=C/O Amb24479774 [1,0,0,0,0,0|1,0,1]=3 534 B6R0.3 OC(=O)\C(\F)=C\F Amb24393011 [1,0,0,0,0,0|2,0,1]=4 535 B6R0.3 OC(C=O)C(O)=O Amb18640325 [1,0,0,0,0,0|1,0,0]=2 536 B6R0.3 OC(CBr)C(O)=O Amb24061932 [1,0,0,0,0,0|2,0,1]=4 537 B6R0.3 OC(CS)C(O)=O Amb18642053 [1,0,0,0,0,0|1,1,1]=4 538 B6R0.3 OCC(Br)C(O)=O Amb18126327 [1,0,0,0,0,0|1,0,1]=3 539 B6R0.3 OCC(C(=O)O)F Amb17593117 [1,0,0,0,0,0|1,0,1]=3 540 B6R0.3 OCC(C(=O)O)O Amb17593103 [1,0,0,0,0,0|1,0,1]=3 541 B6R0.3 OCC(Cl)C(O)=O Amb18124304 [1,0,0,0,0,0|1,0,1]=3 542 B6R0.3 OC[C@@H](C(=O)O)Br Amb10601700 [1,0,0,0,0,0|1,0,1]=3 543 B6R0.3 OC[C@@H](C(=O)O)C Amb10844567 [1,0,0,0,0,0|0,0,1]=2 544 B6R0.3 OC[C@H](C(=O)O)C Amb10844554 [1,0,0,0,0,0|0,0,1]=2 545 B6R0.3 OC[C@H](O)C(O)=O Amb22226732 [1,0,0,0,0,0|1,0,1]=3 546 B6R0.3 ONC(O)C(O)=O Amb25832155 [1,0,0,0,0,0|2,0,0]=3 547 B6R0.3 O[C@@H](CCl)C(O)=O Amb22225325 [1,0,0,0,0,0|2,0,1]=4 548 B6R0.3 O[C@@H](CF)C(O)=O Amb24117272 [1,0,0,0,0,0|2,0,1]=4 549 B6R0.3 O[C@@H](CS)C(O)=O Amb24428282 [1,0,0,0,0,0|1,1,1]=4 550 B6R0.3 O[C@H](CCl)C(O)=O Amb22388611 [1,0,0,0,0,0|2,0,1]=4 551 B6R0.3 O\C(=N\O)\C(O)=O Amb24462565 [1,0,0,0,0,0|2,0,1]=4 552 B6R0.3 [13CH3][13CH2][13CH](O)[13C](O)=O Amb22350316 [1,0,0,0,0,0|2,0,1]=4 553 B6R0.3 [15NH2][13C@@H]([13CH2]S)[13C](O)=O Amb22354011 [1,0,0,0,0,0|1,1,1]=4 554 B6R0.3 [15NH2][C@@H](CO)C(O)=O Amb22353589 [1,0,0,0,0,0|1,0,1]=3 555 B6R0.3 [O-]C(=O)C(O)CO Amb22045196 [1,0,0,0,0,0|1,0,2]=4 556 B6R0.3 [O-]C(=O)[C@@H](O)CO Amb22799769 [1,0,0,0,0,0|1,0,2]=4 557 B6R0.3 [O-][N+](=O)C(CO)C Amb17600148 [1,0,0,0,0,0|1,0,2]=4 558 B6R0.3 [O-]\C=C(/C(=O)C)\C Amb17617704 [1,0,0,0,0,0|1,0,2]=4 559 B6R0.3 [O-]\C=C(\C(=O)C)/C Amb10552504 [1,0,0,0,0,0|1,0,2]=4 560 B8R0.2 C=C(C(=O)NO)C(O)=O Amb24340135 [0,1,0,0,0,0|0,0,2]=3 561 B8R0.2 C=C(C(N)=O)C(=O)NO Amb24674027 [0,1,0,0,0,0|1,0,2]=4 562 B8R0.2 C=C(C=C)[C@H](N)C(O)=O Amb24580353 [0,1,0,0,0,0|3,0,0]=4 563 B8R0.2 C=CC(O)C(N)C(O)=O Amb18642830 [0,1,0,0,0,0|2,0,1]=4 564 B8R0.2 C=C[C@@H](O)[C@H](N)C(O)=O Amb25111565 [0,1,0,0,0,0|2,0,1]=4 565 B8R0.2 C=C[C@H](O)[C@H](N)C(O)=O Amb25328036 [0,1,0,0,0,0|2,0,1]=4 566 B8R0.2 CC(=C(O)CC)C(C)=O Amb25264815 [0,1,0,0,0,0|2,0,1]=4 567 B8R0.2 CC(=C)C(C)C(=O)C#N Amb24454401 [0,1,0,0,0,0|3,0,0]=4 568 B8R0.2 CC(=C)C(C)C(=O)CO Amb25262676 [0,1,0,0,0,0|2,0,0]=3 569 B8R0.2 CC(=C)C(C)C(=O)NC Amb24477751 [0,1,0,0,0,0|3,0,0]=4 570 B8R0.2 CC(=C)[C@@H](N)C(=O)OC Amb24744947 [0,1,0,0,0,0|3,0,0]=4 571 B8R0.2 CC(=NO)C(C)C(C)=O Amb24572272 [0,1,0,0,0,0|2,0,0]=3 572 B8R0.2 CC(=NO)C(C)C(N)=O Amb24476690 [0,1,0,0,0,0|2,0,0]=3 573 B8R0.2 CC(=O)C(=C)C(=O)OC Amb22734869 [0,1,0,0,0,0|1,0,2]=4 574 B8R0.2 CC(=O)C(Br)C(=O)OC Amb22499701 [0,1,0,0,0,0|2,0,0]=3 575 B8R0.2 CC(=O)C(C)=C(C)C=O Amb25275053 [0,1,0,0,0,0|2,0,1]=4 576 B8R0.2 CC(=O)C(C)C(=O)NC Amb25303120 [0,1,0,0,0,0|2,0,0]=3 577 B8R0.2 CC(=O)C(C)C(=O)NO Amb24096632 [0,1,0,0,0,0|1,0,0]=2 578 B8R0.2 CC(=O)C(C)C(=O)SC Amb25334908 [0,1,0,0,0,0|1,1,0]=3 579 B8R0.2 CC(=O)C(C)C(=S)SC Amb25842196 [0,1,0,0,0,0|1,2,0]=4 580 B8R0.2 CC(=O)C(Cl)C(=C)OC Amb24480172 [0,1,0,0,0,0|3,0,0]=4 581 B8R0.2 CC(=O)C(Cl)C(=O)CC Amb24373790 [0,1,0,0,0,0|3,0,0]=4 582 B8R0.2 CC(=O)C(N)C(=O)CC Amb24744767 [0,1,0,0,0,0|3,0,0]=4 583 B8R0.2 CC(=O)C(N)C(=O)NC Amb25146054 [0,1,0,0,0,0|3,0,0]=4 584 B8R0.2 CC(=O)C(N)C(=O)OC Amb21520335 [0,1,0,0,0,0|2,0,0]=3 585 B8R0.2 CC(=O)C(N)C(=O)OC Amb22491080 [0,1,0,0,0,0|2,0,0]=3 586 B8R0.2 CC(=O)C(O)C(=O)CO Amb25082771 [0,1,0,0,0,0|2,0,0]=3 587 B8R0.2 CC(=O)C(O)C(O)C=O Amb24633454 [0,1,0,0,0,0|2,0,1]=4 588 B8R0.2 CC(=O)N(C)C(=O)CCl Amb25743997 [0,1,0,0,0,0|3,0,0]=4 589 B8R0.2 CC(=O)N(C)C(=O)CN Amb24073565 [0,1,0,0,0,0|3,0,0]=4 590 B8R0.2 CC(=O)[C-](C)C(=O)OC Amb24422496 [0,1,0,0,0,0|1,0,1]=3 591 B8R0.2 CC(=O)[C@@H](O)[C@@H](O)C=O Amb25032290 [0,1,0,0,0,0|2,0,1]=4 592 B8R0.2 CC(=O)[C@H](C)C(=O)OC Amb24378331 [0,1,0,0,0,0|1,0,0]=2 593 B8R0.2 CC(=O)[C@H](O)C(=O)CO Amb25756996 [0,1,0,0,0,0|2,0,0]=3 594 B8R0.2 CC(C(=O)CC)=C(C)O Amb25234472 [0,1,0,0,0,0|2,0,1]=4 595 B8R0.2 CC(C(C)Br)C(=O)OC Amb25046683 [0,1,0,0,0,0|2,0,1]=4 596 B8R0.2 CC(C(C)C#C)C(O)=O Amb25848905 [0,1,0,0,0,0|2,0,1]=4 597 B8R0.2 CC(C(C)C#N)C(O)=O Amb25062368 [0,1,0,0,0,0|2,0,1]=4 598 B8R0.2 CC(C(C)C=C)C(O)=O Amb18642611 [0,1,0,0,0,0|2,0,1]=4 599 B8R0.2 CC(C(C)C=O)C(O)=O Amb24468282 [0,1,0,0,0,0|1,0,1]=3 600 B8R0.2 CC(C(C)CO)C(C)=O Amb25127275 [0,1,0,0,0,0|2,0,1]=4 601 B8R0.2 CC(C(C)Cl)C(=O)OC Amb24635801 [0,1,0,0,0,0|2,0,1]=4 602 B8R0.2 CC(C(C)N)C(=O)NO Amb24355745 [0,1,0,0,0,0|2,0,1]=4 603 B8R0.2 CC(C(C)N)C(=O)OC Amb18642841 [0,1,0,0,0,0|2,0,1]=4 604 B8R0.2 CC(C(C)O)C(=O)OC Amb22059109 [0,1,0,0,0,0|1,0,1]=3 605 B8R0.2 CC(C(C)S)C(=O)OC Amb25682049 [0,1,0,0,0,0|1,1,1]=4 606 B8R0.2 CC(C(F)CC)C(O)=O Amb25836213 [0,1,0,0,0,0|2,0,1]=4 607 B8R0.2 CC(C(N)=O)N(C)CO Amb24744516 [0,1,0,0,0,0|3,0,0]=4 608 B8R0.2 CC(C(N)CC)C(O)=O Amb18832531 [0,1,0,0,0,0|2,0,1]=4 609 B8R0.2 CC(C(N)CN)C(O)=O Amb24532823 [0,1,0,0,0,0|2,0,1]=4 610 B8R0.2 CC(C(O)=O)=C(Br)C=O Amb24571694 [0,1,0,0,0,0|1,0,1]=3 611 B8R0.2 CC(C(O)=O)=C(Cl)CC Amb24719968 [0,1,0,0,0,0|2,0,1]=4 612 B8R0.2 CC(C(O)=O)N(C)C=O Amb18284942 [0,1,0,0,0,0|2,0,0]=3 613 B8R0.2 CC(C(O)=O)N(C)N=O Amb25041960 [0,1,0,0,0,0|2,0,0]=3 614 B8R0.2 CC(C(O)C#C)C(O)=O Amb25123215 [0,1,0,0,0,0|1,0,1]=3 615 B8R0.2 CC(C(O)C=C)C(O)=O Amb18642774 [0,1,0,0,0,0|1,0,1]=3 616 B8R0.2 CC(C([O-])=O)C(=O)NN Amb25274275 [0,1,0,0,0,0|1,0,1]=3 617 B8R0.2 CC(C)=C(C)C(=O)OC Amb25706600 [0,1,0,0,0,0|2,0,1]=4 618 B8R0.2 CC(C=O)C(N)C(O)=O Amb24374650 [0,1,0,0,0,0|2,0,1]=4 619 B8R0.2 CC(CO)=C(N)C(O)=O Amb25031515 [0,1,0,0,0,0|2,0,1]=4 620 B8R0.2 CC(CO)=C(O)C(O)=O Amb25757908 [0,1,0,0,0,0|2,0,1]=4 621 B8R0.2 CC(O)C(Br)C(=O)OC Amb24415051 [0,1,0,0,0,0|2,0,1]=4 622 B8R0.2 CC(O)C(Cl)C(=O)OC Amb25269533 [0,1,0,0,0,0|2,0,1]=4 623 B8R0.2 CC(O)C(F)C(=O)OC Amb24481911 [0,1,0,0,0,0|2,0,1]=4 624 B8R0.2 CC(O)[C@H](N)C(=O)OC Amb25213074 [0,1,0,0,0,0|2,0,1]=4 625 B8R0.2 CC(OC)[C@@H](N)C(O)=O Amb25733335 [0,1,0,0,0,0|2,0,1]=4 626 B8R0.2 CC([C@@H](C)O)C(=O)OC Amb25077967 [0,1,0,0,0,0|1,0,1]=3 627 B8R0.2 CC([C@H](C)O)C(=O)OC Amb25788911 [0,1,0,0,0,0|1,0,1]=3 628 B8R0.2 CCC(=C)C(C)C(O)=O Amb25228831 [0,1,0,0,0,0|2,0,0]=3 629 B8R0.2 CCC(=C)C(N)C(O)=O Amb18642707 [0,1,0,0,0,0|3,0,0]=4 630 B8R0.2 CCC(=C)[C@H](N)C(O)=O Amb25828765 [0,1,0,0,0,0|3,0,0]=4 631 B8R0.2 CCC(=O)C(C)C(=O)Cl Amb24340219 [0,1,0,0,0,0|2,0,0]=3 632 B8R0.2 CCC(=O)C(C)C(C)=O Amb17666954 [0,1,0,0,0,0|2,0,0]=3 633 B8R0.2 CCC(=O)C(C)C(N)=O Amb24524504 [0,1,0,0,0,0|2,0,0]=3 634 B8R0.2 CCC(=O)C(C)S(C)=O Amb24394596 [0,1,0,0,0,0|3,0,0]=4 635 B8R0.2 CCC(=S)[C@H](N)C(O)=O Amb25111086 [0,1,0,0,0,0|2,1,0]=4 636 B8R0.2 CCC(C(C(=O)O)C)O Amb10844267 [0,1,0,0,0,0|1,0,1]=3 637 B8R0.2 CCC(C)C(C)C(O)=O Amb18290719 [0,1,0,0,0,0|2,0,1]=4 638 B8R0.2 CCC(O)C(N)C(O)=O Amb18203168 [0,1,0,0,0,0|2,0,1]=4 639 B8R0.2 CCC(O)C(O)C(O)=O Amb24441607 [0,1,0,0,0,0|2,0,1]=4 640 B8R0.2 CCC(O)[C@@H](N)C(O)=O Amb22750712 [0,1,0,0,0,0|2,0,1]=4 641 B8R0.2 CCC(O)[C@H](N)C(O)=O Amb24364655 [0,1,0,0,0,0|2,0,1]=4 642 B8R0.2 CCC([C@@H](C(=O)O)C)C Amb10844495 [0,1,0,0,0,0|2,0,1]=4 643 B8R0.2 CCN(C)[C@H](C)C(O)=O Amb25073540 [0,1,0,0,0,0|3,0,0]=4 644 B8R0.2 CCS(=O)C(C)C(C)=O Amb25772477 [0,1,0,0,0,0|3,0,0]=4 645 B8R0.2 CCS(=O)C(C)C(O)=O Amb18984976 [0,1,0,0,0,0|2,0,0]=3 646 B8R0.2 CC[C@@H](O)[C@@H](N)C(O)=O Amb24087716 [0,1,0,0,0,0|2,0,1]=4 647 B8R0.2 CC[C@@H](O)[C@H](N)C(O)=O Amb24105353 [0,1,0,0,0,0|2,0,1]=4 648 B8R0.2 CC[C@@H](O)[C@H](O)C(O)=O Amb24431211 [0,1,0,0,0,0|2,0,1]=4 649 B8R0.2 CC[C@@H]([C@@H](C(=O)O)C)C Amb10844498 [0,1,0,0,0,0|2,0,1]=4 650 B8R0.2 CC[C@H](C)[C@@H](C)C(O)=O Amb25056174 [0,1,0,0,0,0|2,0,1]=4 651 B8R0.2 CN(C(=O)F)C(=O)CCl Amb24406678 [0,1,0,0,0,0|3,0,0]=4 652 B8R0.2 CN(C=O)C(O)C(O)=O Amb24069122 [0,1,0,0,0,0|3,0,0]=4 653 B8R0.2 CNC(=O)C(=O)C(O)=O Amb25075425 [0,1,0,0,0,0|2,0,1]=4 654 B8R0.2 CNC(=O)C(N)C(N)=O Amb18124333 [0,1,0,0,0,0|3,0,0]=4 655 B8R0.2 CNC(C)C(C)C(O)=O Amb25342967 [0,1,0,0,0,0|2,0,1]=4 656 B8R0.2 CN[C@@H](C)[C@H](C)C(O)=O Amb25676912 [0,1,0,0,0,0|2,0,1]=4 657 B8R0.2 COC(=O)C(=O)C(=O)C Amb17569865 [0,1,0,0,0,0|2,0,1]=4 658 B8R0.2 COC(=O)C(=O)C(O)=O Amb18124343 [0,1,0,0,0,0|1,0,1]=3 659 B8R0.2 COC(=O)C(C)C(C)=O Amb17939472 [0,1,0,0,0,0|1,0,0]=2 660 B8R0.2 COC(=O)C(C)C(O)=O Amb18642868 [0,1,0,0,0,0|0,0,0]=1 661 B8R0.2 COC(=O)C(C)S(=O)Cl Amb24725099 [0,1,0,0,0,0|2,0,0]=3 662 B8R0.2 COC(=O)C(C)S(C)=O Amb18181669 [0,1,0,0,0,0|2,0,0]=3 663 B8R0.2 COC(=O)C(C)S([O-])=O Amb24626145 [0,1,0,0,0,0|1,0,1]=3 664 B8R0.2 COC(=O)C(C)[N+]([O-])=O Amb25322922 [0,1,0,0,0,0|1,0,1]=3 665 B8R0.2 COC(=O)C(Cl)C(=O)Cl Amb24373872 [0,1,0,0,0,0|2,0,0]=3 666 B8R0.2 COC(=O)C(Cl)C(N)=O Amb24589473 [0,1,0,0,0,0|2,0,0]=3 667 B8R0.2 COC(=O)C(F)C(N)=O Amb24587657 [0,1,0,0,0,0|2,0,0]=3 668 B8R0.2 COC(=O)C(N)C(=C)N Amb24542847 [0,1,0,0,0,0|3,0,0]=4 669 B8R0.2 COC(=O)C(N)C(N)=O Amb24478682 [0,1,0,0,0,0|2,0,0]=3 670 B8R0.2 COC(=O)C(N)C(O)=O Amb22491276 [0,1,0,0,0,0|1,0,0]=2 671 B8R0.2 COC(=O)C(O)C(O)=O Amb25255680 [0,1,0,0,0,0|1,0,0]=2 672 B8R0.2 COC(=O)N(Cl)C(N)=O Amb24480054 [0,1,0,0,0,0|3,0,0]=4 673 B8R0.2 COC(=O)[C@H](N)C(O)=O Amb24695000 [0,1,0,0,0,0|1,0,0]=2 674 B8R0.2 COC(=O)[C@H]([C@H](O)C)N Amb10844890 [0,1,0,0,0,0|2,0,1]=4 675 B8R0.2 COC(C(C(=O)O)Br)C Amb16233352 [0,1,0,0,0,0|2,0,1]=4 676 B8R0.2 COC(C(C(=O)O)C)C Amb10844268 [0,1,0,0,0,0|1,0,1]=3 677 B8R0.2 COC(C)=C(C)C(C)=O Amb24678123 [0,1,0,0,0,0|2,0,1]=4 678 B8R0.2 COC(C)C(N)C(O)=O Amb17938689 [0,1,0,0,0,0|2,0,1]=4 679 B8R0.2 COC(C)[C@H](C)C(O)=O Amb25722336 [0,1,0,0,0,0|1,0,1]=3 680 B8R0.2 CO[C@@H](C)[C@@H](C)C(O)=O Amb25263126 [0,1,0,0,0,0|1,0,1]=3 681 B8R0.2 CO[C@@H]([C@@H](C(=O)O)N)C Amb16183892 [0,1,0,0,0,0|2,0,1]=4 682 B8R0.2 CO[C@@H]([C@H](C(=O)O)N)C Amb10603094 [0,1,0,0,0,0|2,0,1]=4 683 B8R0.2 CO[C@H](C)[C@H](C)C(O)=O Amb24358364 [0,1,0,0,0,0|1,0,1]=3 684 B8R0.2 CO[C@H]([C@@H](C(=O)O)C)C Amb10844258 [0,1,0,0,0,0|1,0,1]=3 685 B8R0.2 CO\C(\C)=C(/C)\C(C)=O Amb25683972 [0,1,0,0,0,0|2,0,1]=4 686 B8R0.2 CO\C(\C)=C(/C)\C(N)=O Amb24518090 [0,1,0,0,0,0|2,0,1]=4 687 B8R0.2 CSC(C)C(C)C(O)=O Amb18644375 [0,1,0,0,0,0|1,1,1]=4 688 B8R0.2 CS[C@@H](C)[C@H](C)C(O)=O Amb24552609 [0,1,0,0,0,0|1,1,1]=4 689 B8R0.2 C[C@@H](C(O)=O)N(C)C=O Amb24558225 [0,1,0,0,0,0|2,0,0]=3 690 B8R0.2 C[C@@H](C=O)[C@H](N)C(O)=O Amb25142449 [0,1,0,0,0,0|2,0,1]=4 691 B8R0.2 C[C@@H](CO)[C@@H](N)C(O)=O Amb24117487 [0,1,0,0,0,0|2,0,1]=4 692 B8R0.2 C[C@@H](CO)[C@H](N)C(O)=O Amb24117488 [0,1,0,0,0,0|2,0,1]=4 693 B8R0.2 C[C@@H](O)[C@@H](Cl)C(=O)OC Amb24479996 [0,1,0,0,0,0|2,0,1]=4 694 B8R0.2 C[C@@H](O)[C@@H](N)C(=O)OC Amb22744992 [0,1,0,0,0,0|2,0,1]=4 695 B8R0.2 C[C@@H](O)[C@@H](O)C(=O)OC Amb25320663 [0,1,0,0,0,0|2,0,1]=4 696 B8R0.2 C[C@@H](O)[C@H](Br)C(=O)OC Amb25109342 [0,1,0,0,0,0|2,0,1]=4 697 B8R0.2 C[C@@H](O)[C@H](N)C(=O)NO Amb22800603 [0,1,0,0,0,0|2,0,1]=4 698 B8R0.2 C[C@@H](O)[C@H](O)C(=O)CO Amb24625788 [0,1,0,0,0,0|2,0,1]=4 699 B8R0.2 C[C@@H](OC)[C@@H](N)C(O)=O Amb23438804 [0,1,0,0,0,0|2,0,1]=4 700 B8R0.2 C[C@@H](OC)[C@H](Cl)C(O)=O Amb25701678 [0,1,0,0,0,0|2,0,1]=4 701 B8R0.2 C[C@@H](OC)[C@H](N)C(O)=O Amb23438882 [0,1,0,0,0,0|2,0,1]=4 702 B8R0.2 C[C@@H](OC)[C@H](O)C(O)=O Amb25316180 [0,1,0,0,0,0|2,0,1]=4 703 B8R0.2 C[C@@H]([C@@H](C)C=C)C(O)=O Amb24721924 [0,1,0,0,0,0|2,0,1]=4 704 B8R0.2 C[C@@H]([C@@H](C)C=O)C(O)=O Amb24470204 [0,1,0,0,0,0|1,0,1]=3 705 B8R0.2 C[C@@H]([C@@H](C)CO)C(O)=O Amb24696822 [0,1,0,0,0,0|1,0,1]=3 706 B8R0.2 C[C@@H]([C@@H](C)N)C(=O)OC Amb24698063 [0,1,0,0,0,0|2,0,1]=4 707 B8R0.2 C[C@@H]([C@@H](C)O)C(=O)OC Amb24363609 [0,1,0,0,0,0|1,0,1]=3 708 B8R0.2 C[C@@H]([C@@H](O)CC)C(O)=O Amb24427100 [0,1,0,0,0,0|1,0,1]=3 709 B8R0.2 C[C@@H]([C@H](N)CC)C(O)=O Amb24496209 [0,1,0,0,0,0|2,0,1]=4 710 B8R0.2 C[C@@H]([C@H](O)C=C)C(O)=O Amb24622455 [0,1,0,0,0,0|1,0,1]=3 711 B8R0.2 C[C@@H]([C@H](O)CC)C(O)=O Amb24472165 [0,1,0,0,0,0|1,0,1]=3 712 B8R0.2 C[C@H](C(C)Br)C(=O)OC Amb25061347 [0,1,0,0,0,0|2,0,1]=4 713 B8R0.2 C[C@H](O)C(N)C(=O)OC Amb25302264 [0,1,0,0,0,0|2,0,1]=4 714 B8R0.2 C[C@H](O)[C@@H](N)C(=O)NO Amb25063917 [0,1,0,0,0,0|2,0,1]=4 715 B8R0.2 C[C@H](O)[C@@H](O)C(=O)OC Amb25763009 [0,1,0,0,0,0|2,0,1]=4 716 B8R0.2 C[C@H](O)[C@H](O)C(=O)OC Amb25327481 [0,1,0,0,0,0|2,0,1]=4 717 B8R0.2 C[C@H](OC)[C@@H](Br)C(O)=O Amb24480242 [0,1,0,0,0,0|2,0,1]=4 718 B8R0.2 C[C@H](OC)[C@@H](O)C(O)=O Amb25140960 [0,1,0,0,0,0|2,0,1]=4 719 B8R0.2 C[C@H]([C@@H](O)CC)C(C)=O Amb25096669 [0,1,0,0,0,0|2,0,1]=4 720 B8R0.2 C[C@H]([C@H](C)C=C)C(O)=O Amb24528497 [0,1,0,0,0,0|2,0,1]=4 721 B8R0.2 C[C@H]([C@H](C)O)C(=O)CC Amb25086603 [0,1,0,0,0,0|2,0,1]=4 722 B8R0.2 C[C@H]([C@H](C)O)C(=O)OC Amb25762229 [0,1,0,0,0,0|1,0,1]=3 723 B8R0.2 C[C@H]([C@H](N)CC)C(O)=O Amb25737884 [0,1,0,0,0,0|2,0,1]=4 724 B8R0.2 C\C(=C(\O)/CC)\C(C)=O Amb25318800 [0,1,0,0,0,0|2,0,1]=4 725 B8R0.2 C\C(=C/C)\C(C)C(C)=O Amb24689489 [0,1,0,0,0,0|3,0,0]=4 726 B8R0.2 C\C(=C/C)\C(C)C(N)=O Amb24477780 [0,1,0,0,0,0|3,0,0]=4 727 B8R0.2 C\C(=C/C)\C(N)C(O)=O Amb18642706 [0,1,0,0,0,0|3,0,0]=4 728 B8R0.2 C\C(=C/C)\[C@@H](N)C(O)=O Amb24695637 [0,1,0,0,0,0|3,0,0]=4 729 B8R0.2 C\C(=C\C)\C(O)C(O)=O Amb24495368 [0,1,0,0,0,0|3,0,0]=4 730 B8R0.2 C\C(\C(=O)CC)=C(/C)\O Amb25373297 [0,1,0,0,0,0|2,0,1]=4 731 B8R0.2 C\C(\C(=O)OC)=C(\C)/N Amb24340241 [0,1,0,0,0,0|2,0,1]=4 732 B8R0.2 C\C(\C(O)=O)=C(\Br)/C=C Amb25361017 [0,1,0,0,0,0|2,0,1]=4 733 B8R0.2 C\C(\C(O)=O)=C(\Br)/C=O Amb25200989 [0,1,0,0,0,0|1,0,1]=3 734 B8R0.2 ClCC(C(C(=O)O)O)O Amb17593871 [0,1,0,0,0,0|2,0,1]=4 735 B8R0.2 FC[C@H]([C@@H](C(=O)O)N)O Amb13883676 [0,1,0,0,0,0|2,0,1]=4 736 B8R0.2 NC(C(O)CO)C(O)=O Amb18642974 [0,1,0,0,0,0|1,0,2]=4 737 B8R0.2 NC(CO)C(O)C(O)=O Amb25270055 [0,1,0,0,0,0|2,0,1]=4 738 B8R0.2 NC[C@H](O)[C@@H](O)C(O)=O Amb25323660 [0,1,0,0,0,0|2,0,1]=4 739 B8R0.2 NC[C@H](O)[C@H](O)C(O)=O Amb25242625 [0,1,0,0,0,0|2,0,1]=4 740 B8R0.2 N[C@@H](C(O)CBr)C(O)=O Amb24391545 [0,1,0,0,0,0|2,0,1]=4 741 B8R0.2 N[C@@H](C(O)CF)C(O)=O Amb24426022 [0,1,0,0,0,0|2,0,1]=4 742 B8R0.2 N[C@@H](CO)[C@H](O)C(O)=O Amb25738857 [0,1,0,0,0,0|2,0,1]=4 743 B8R0.2 N[C@@H]([C@@H](O)CBr)C(O)=O Amb24480277 [0,1,0,0,0,0|2,0,1]=4 744 B8R0.2 N[C@@H]([C@@H](O)CO)C(O)=O Amb25678241 [0,1,0,0,0,0|1,0,2]=4 745 B8R0.2 N[C@@H]([C@H](N)CO)C(O)=O Amb24761920 [0,1,0,0,0,0|2,0,1]=4 746 B8R0.2 N[C@@H]([C@H](O)CCl)C(O)=O Amb25324441 [0,1,0,0,0,0|2,0,1]=4 747 B8R0.2 N[C@@H]([C@H](O)CO)C(O)=O Amb24674136 [0,1,0,0,0,0|1,0,2]=4 748 B8R0.2 N[C@H](C(=O)NO)C(O)=O Amb24476649 [0,1,0,0,0,0|1,0,0]=2 749 B8R0.2 N[C@H](CO)[C@H](O)C(O)=O Amb25090400 [0,1,0,0,0,0|2,0,1]=4 750 B8R0.2 N[C@H]([C@@H](O)CO)C(O)=O Amb25836554 [0,1,0,0,0,0|1,0,2]=4 751 B8R0.2 N[C@H]([C@H](O)CO)C(O)=O Amb24671346 [0,1,0,0,0,0|1,0,2]=4 752 B8R0.2 O=C(Cl)C(Cl)C(=O)CCl Amb24433455 [0,1,0,0,0,0|3,0,0]=4 753 B8R0.2 O=C\C(=C(\C(=O)O)/Br)\Br Amb1981387 [0,1,0,0,0,0|2,0,1]=4 754 B8R0.2 OC(=O)C(=O)C(Cl)=NO Amb25258692 [0,1,0,0,0,0|2,0,1]=4 755 B8R0.2 OC(=O)C(Cl)=C(Br)C=O Amb24591769 [0,1,0,0,0,0|2,0,1]=4 756 B8R0.2 OC(=O)C(O)=C(Cl)C=O Amb24518465 [0,1,0,0,0,0|2,0,1]=4 757 B8R0.2 OC(=O)\C(\Cl)=C(/Cl)\C=O Amb18602727 [0,1,0,0,0,0|2,0,1]=4 758 B8R0.2 OC(=O)\C(\Cl)=C(\Br)/C=O Amb18657499 [0,1,0,0,0,0|2,0,1]=4 759 B8R0.2 OC(=O)\C(\O)=C(\Cl)/C=O Amb25361999 [0,1,0,0,0,0|2,0,1]=4 760 B8R0.2 OC(C(O)C=O)C(O)=O Amb18124399 [0,1,0,0,0,0|1,0,1]=3 761 B8R0.2 OC(C(O)CBr)C(O)=O Amb24358122 [0,1,0,0,0,0|2,0,1]=4 762 B8R0.2 OC(CF)C(Br)C(O)=O Amb25733261 [0,1,0,0,0,0|2,0,1]=4 763 B8R0.2 OCC(O)C(O)C(O)=O Amb22495524 [0,1,0,0,0,0|1,0,2]=4 764 B8R0.2 OC[C@@H](O)[C@H](O)C(O)=O Amb22801448 [0,1,0,0,0,0|1,0,2]=4 765 B8R0.2 OC[C@H](O)[C@H](O)C(O)=O Amb25223742 [0,1,0,0,0,0|1,0,2]=4 766 B8R0.2 O[C@@H]([C@H](O)CBr)C(O)=O Amb24426113 [0,1,0,0,0,0|2,0,1]=4 767 B8R0.2 O[C@@H]([C@H](O)CCl)C(O)=O Amb25836734 [0,1,0,0,0,0|2,0,1]=4 768 B8R0.2 SCC(C(C(=O)O)C)C Amb17593702 [0,1,0,0,0,0|1,1,1]=4 769 B8R0.2 [O-][N+](=O)C(C(=O)CC)C Amb17618436 [0,1,0,0,0,0|2,0,1]=4 770 B8R0.18 CC(=C)C(CC)C(N)=O Amb24673757 [0,1,0,0,0,0|3,0,0]=4 771 B8R0.18 CC(=C)C(CC)C(O)=O Amb18642606 [0,1,0,0,0,0|2,0,0]=3 772 B8R0.18 CC(=C)\C(=C\C)\C(O)=O Amb25341613 [0,1,0,0,0,0|2,0,1]=4 773 B8R0.18 CC(=O)C(C#N)C(N)=O Amb25265556 [0,1,0,0,0,0|2,0,1]=4 774 B8R0.18 CC(=O)C(C=N)C(C)=O Amb25128218 [0,1,0,0,0,0|2,0,1]=4 775 B8R0.18 CC(=O)C(CC)C(C)=C Amb25244374 [0,1,0,0,0,0|3,0,0]=4 776 B8R0.18 CC(=O)C(CC)C(N)=O Amb25082383 [0,1,0,0,0,0|2,0,0]=3 777 B8R0.18 CC(=O)C(CC)C([O-])=O Amb22167697 [0,1,0,0,0,0|1,0,1]=3 778 B8R0.18 CC(=O)C(CC)C([O-])=O Amb22730810 [0,1,0,0,0,0|1,0,1]=3 779 B8R0.18 CC(=O)C(CC)C([O-])=O Amb22734577 [0,1,0,0,0,0|1,0,1]=3 780 B8R0.18 CC(=O)C(CO)C(C)=O Amb25288499 [0,1,0,0,0,0|2,0,0]=3 781 B8R0.18 CC(=O)\C(=N/O)\C(O)=O Amb24100395 [0,1,0,0,0,0|2,0,1]=4 782 B8R0.18 CC(=O)\C(\OC)=C(\C)/O Amb24577822 [0,1,0,0,0,0|2,0,1]=4 783 B8R0.18 CC(Br)C(CC)C(O)=O Amb25351353 [0,1,0,0,0,0|2,0,1]=4 784 B8R0.18 CC(C)=C(CC)C(O)=O Amb18642607 [0,1,0,0,0,0|2,0,1]=4 785 B8R0.18 CC(C)=C(OC)C(O)=O Amb18642778 [0,1,0,0,0,0|2,0,1]=4 786 B8R0.18 CC(C)=C(SC)C(O)=O Amb24656294 [0,1,0,0,0,0|2,0,1]=4 787 B8R0.18 CC(C)C(CBr)C(O)=O Amb24429178 [0,1,0,0,0,0|2,0,1]=4 788 B8R0.18 CC(C)C(CC)C(O)=O Amb18972345 [0,1,0,0,0,0|2,0,1]=4 789 B8R0.18 CC(C)C(CN)C(O)=O Amb18987935 [0,1,0,0,0,0|2,0,1]=4 790 B8R0.18 CC(C)C(CN)C(O)=O Amb19375052 [0,1,0,0,0,0|2,0,1]=4 791 B8R0.18 CC(C)C(CO)C(O)=O Amb24116921 [0,1,0,0,0,0|2,0,1]=4 792 B8R0.18 CC(C)C(NC)C(O)=O Amb21961623 [0,1,0,0,0,0|2,0,1]=4 793 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756745 [0,1,0,0,0,0|2,0,1]=4 794 B8R0.18 CC(C)[C@@H](CN)C(O)=O Amb22756747 [0,1,0,0,0,0|2,0,1]=4 795 B8R0.18 CC(C)[C@@H](CO)C(O)=O Amb24588987 [0,1,0,0,0,0|2,0,1]=4 796 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22231334 [0,1,0,0,0,0|2,0,1]=4 797 B8R0.18 CC(C)[C@@H](NC)C(O)=O Amb22749002 [0,1,0,0,0,0|2,0,1]=4 798 B8R0.18 CC(C)[C@H](CN)C(O)=O Amb25283442 [0,1,0,0,0,0|2,0,1]=4 799 B8R0.18 CC(Cl)C(SC)C(O)=O Amb18126488 [0,1,0,0,0,0|2,0,1]=4 800 B8R0.18 CC(O)=C(N=O)C(O)=O Amb25727301 [0,1,0,0,0,0|2,0,1]=4 801 B8R0.18 CC(O)C(C=C)C(O)=O Amb18642779 [0,1,0,0,0,0|1,0,2]=4 802 B8R0.18 CC(O)C(CC)C(N)=O Amb24539570 [0,1,0,0,0,0|2,0,1]=4 803 B8R0.18 CC(O)C(CC)C(O)=O Amb18990651 [0,1,0,0,0,0|1,0,1]=3 804 B8R0.18 CC(O)C(CO)C(O)=O Amb24759475 [0,1,0,0,0,0|1,0,1]=3 805 B8R0.18 CC(O)C(NC)C(O)=O Amb24680323 [0,1,0,0,0,0|1,0,1]=3 806 B8R0.18 CC(O)C(NCl)C(O)=O Amb24408588 [0,1,0,0,0,0|2,0,1]=4 807 B8R0.18 CC(O)C(NN)C(O)=O Amb18642940 [0,1,0,0,0,0|2,0,1]=4 808 B8R0.18 CC(O)[C@@H](NC)C(O)=O Amb22800385 [0,1,0,0,0,0|1,0,1]=3 809 B8R0.18 CC(O)[C@H](NCl)C(O)=O Amb25684733 [0,1,0,0,0,0|2,0,1]=4 810 B8R0.18 CCC(C(=O)C)C(=O)C Amb2371444 [0,1,0,0,0,0|2,0,0]=3 811 B8R0.18 CCC(C(C)=O)[N+]([O-])=O Amb24738348 [0,1,0,0,0,0|2,0,1]=4 812 B8R0.18 CCC(C(Cl)=O)C(Cl)=O Amb17942975 [0,1,0,0,0,0|2,0,0]=3 813 B8R0.18 CCC(C(N)=O)C(N)=O Amb25848912 [0,1,0,0,0,0|2,0,0]=3 814 B8R0.18 CCC(C(O)=O)=C(Cl)Cl Amb25123840 [0,1,0,0,0,0|2,0,1]=4 815 B8R0.18 CCC(C(O)=O)N(C)C Amb20627822 [0,1,0,0,0,0|3,0,0]=4 816 B8R0.18 CCC(C(O)=O)N(C)N Amb25145584 [0,1,0,0,0,0|3,0,0]=4 817 B8R0.18 CCC(C(O)=O)N(C)O Amb24609518 [0,1,0,0,0,0|2,0,0]=3 818 B8R0.18 CCC(C(O)=O)P(O)=O Amb25205534 [0,1,0,0,0,0|1,0,0]=2 819 B8R0.18 CCC(C(O)=O)S(C)=O Amb18290930 [0,1,0,0,0,0|2,0,0]=3 820 B8R0.18 CCN(C(C)=O)C(C)=O Amb25857493 [0,1,0,0,0,0|3,0,0]=4 821 B8R0.18 CCN(C(N)=O)C(N)=O Amb25804589 [0,1,0,0,0,0|3,0,0]=4 822 B8R0.18 CC[C@@H](C(=O)O)N(O)O Amb16233002 [0,1,0,0,0,0|1,0,1]=3 823 B8R0.18 CC[C@@H](C(C)=O)[N+]([O-])=O Amb25185100 [0,1,0,0,0,0|2,0,1]=4 824 B8R0.18 CC[C@@H](C(O)=O)N(C)C Amb25823446 [0,1,0,0,0,0|3,0,0]=4 825 B8R0.18 CN(C)C(CF)C(O)=O Amb25216064 [0,1,0,0,0,0|3,0,0]=4 826 B8R0.18 CN(C)C(CO)C(O)=O Amb24407402 [0,1,0,0,0,0|3,0,0]=4 827 B8R0.18 CN(C)[C@@H](CF)C(O)=O Amb24407184 [0,1,0,0,0,0|3,0,0]=4 828 B8R0.18 CN(C)[C@@H](CS)C(O)=O Amb24120376 [0,1,0,0,0,0|3,0,0]=4 829 B8R0.18 CN(C)[C@H](CS)C(O)=O Amb24405547 [0,1,0,0,0,0|3,0,0]=4 830 B8R0.18 CN(O)C(C=C)C(O)=O Amb25302099 [0,1,0,0,0,0|2,0,1]=4 831 B8R0.18 CNC(C(N)=O)C(N)=O Amb18642836 [0,1,0,0,0,0|2,0,0]=3 832 B8R0.18 CNC(C(O)=O)C(O)=O Amb24477701 [0,1,0,0,0,0|0,0,0]=1 833 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,1,0,0,0,0|2,0,1]=4 834 B8R0.18 CON(C(C)=O)C(C)=O Amb22231327 [0,1,0,0,0,0|3,0,0]=4 835 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,1,0,0,0,0|2,0,1]=4 836 B8R0.18 CSC(C(C)=O)C(C)=O Amb25834292 [0,1,0,0,0,0|2,0,0]=3 837 B8R0.18 C[C@@H](N)[C@@H](CC)C(O)=O Amb24709757 [0,1,0,0,0,0|2,0,1]=4 838 B8R0.18 C[C@@H](O)[C@@H](NC)C(O)=O Amb24375967 [0,1,0,0,0,0|1,0,1]=3 839 B8R0.18 C[C@@H](O)[C@H](CN)C(O)=O Amb24715545 [0,1,0,0,0,0|1,0,1]=3 840 B8R0.18 C[C@@H](O)[C@H](NCl)C(O)=O Amb25124152 [0,1,0,0,0,0|2,0,1]=4 841 B8R0.18 C[C@H](O)[C@H](NC)C(O)=O Amb24529115 [0,1,0,0,0,0|1,0,1]=3 842 B8R0.18 C[C@H](O)[C@H](NN)C(O)=O Amb25032229 [0,1,0,0,0,0|2,0,1]=4 843 B8R0.18 C\C(\O)=C(\C#N)/C(O)=O Amb25793575 [0,1,0,0,0,0|1,0,2]=4 844 B8R0.18 C\C=C(/[C@@H](C)O)\C(O)=O Amb25843942 [0,1,0,0,0,0|1,0,2]=4 845 B8R0.18 N=C=C(C(O)=O)C(O)=O Amb25312535 [0,1,0,0,0,0|0,0,2]=3 846 B8R0.18 NC(=O)C(=NO)C(O)=O Amb25118376 [0,1,0,0,0,0|2,0,1]=4 847 B8R0.18 NC(=O)C(N=O)C(N)=O Amb24476651 [0,1,0,0,0,0|3,0,0]=4 848 B8R0.18 OC(=O)C(=CCl)C(O)=O Amb24634285 [0,1,0,0,0,0|0,0,2]=3 849 B8R0.18 OC(=O)C(C=O)C(O)=O Amb25188908 [0,1,0,0,0,0|0,0,1]=2 850 B8R0.18 OC(=O)C(CF)=C(F)F Amb25081967 [0,1,0,0,0,0|2,0,1]=4 851 B8R0.18 OC(=O)C(CF)C(F)F Amb24743896 [0,1,0,0,0,0|2,0,1]=4 852 B8R0.18 OC(=O)C(CO)C(F)F Amb24559548 [0,1,0,0,0,0|2,0,1]=4 853 B8R0.18 SCC(C(=O)O)C(C)C Amb17593703 [0,1,0,0,0,0|2,0,1]=4 854 B8R0.18 [NH-][NH+]=C(C(O)=O)C(O)=O Amb24557340 [0,1,0,0,0,0|1,0,1]=3 855 B8R0.27 CC(=O)C(F)S(O)(=O)=O Amb25282863 [0,1,0,0,0,0|3,0,0]=4 856 B8R0.27 CC(=O)C(O)S(O)(=O)=O Amb25769834 [0,1,0,0,0,0|3,0,0]=4 857 B8R0.27 CC(C(C)=O)S(C)(=O)=O Amb18181047 [0,1,0,0,0,0|2,0,1]=4 858 B8R0.27 CC(C(F)(C)C)C(=O)O Amb10843986 [0,1,0,0,0,0|2,0,1]=4 859 B8R0.27 CC(C(N)=O)S(C)(=O)=O Amb24643116 [0,1,0,0,0,0|2,0,1]=4 860 B8R0.27 CC(C(N)=O)S(N)(=O)=O Amb25060642 [0,1,0,0,0,0|2,0,1]=4 861 B8R0.27 CC(C(O)=O)C(C)(C)N Amb24459511 [0,1,0,0,0,0|2,0,1]=4 862 B8R0.27 CC(C(O)=O)C(F)(F)F Amb19148979 [0,1,0,0,0,0|2,0,1]=4 863 B8R0.27 CC(C(O)=O)S(=O)(=O)Cl Amb18957684 [0,1,0,0,0,0|1,0,1]=3 864 B8R0.27 CC(C(O)=O)S(N)(=O)=O Amb18281052 [0,1,0,0,0,0|1,0,1]=3 865 B8R0.27 CC(C(O)=O)S(O)(=O)=O Amb25765487 [0,1,0,0,0,0|1,0,0]=2 866 B8R0.27 CC(C(O)=O)[N+](C)(C)C Amb24759071 [0,1,0,0,0,0|3,0,0]=4 867 B8R0.27 CC(C(O)=O)[N+](C)(C)N Amb25306005 [0,1,0,0,0,0|3,0,0]=4 868 B8R0.27 CC(C(O)=O)[Si](O)(O)O Amb24429015 [0,1,0,0,0,0|0,1,1]=3 869 B8R0.27 CC(C)(O)C(Cl)C(O)=O Amb25101058 [0,1,0,0,0,0|2,0,1]=4 870 B8R0.27 CC(C)(O)C(N)C(O)=O Amb18642914 [0,1,0,0,0,0|2,0,1]=4 871 B8R0.27 CC(C)(O)C(O)C(O)=O Amb25118477 [0,1,0,0,0,0|2,0,1]=4 872 B8R0.27 CP(C)(=O)C(O)C(O)=O Amb22231894 [0,1,0,0,0,0|3,0,0]=4 873 B8R0.27 CS(=O)(=O)C(F)C(O)=O Amb25242777 [0,1,0,0,0,0|2,0,1]=4 874 B8R0.27 C[C@@H](C(C)(C)C)C(=O)O Amb10844034 [0,1,0,0,0,0|2,0,1]=4 875 B8R0.27 C[C@@H](C(O)=O)C(F)(F)F Amb24120617 [0,1,0,0,0,0|2,0,1]=4 876 B8R0.27 C[C@H](C(C)(C)C)C(=O)O Amb10844023 [0,1,0,0,0,0|2,0,1]=4 877 B8R0.27 C[C@H](C(O)=O)C(C)(C)Cl Amb24522973 [0,1,0,0,0,0|2,0,1]=4 878 B8R0.27 C[C@H](C(O)=O)S(C)(=O)=O Amb24480187 [0,1,0,0,0,0|1,0,1]=3 879 B8R0.27 OC(=O)C(Br)S(O)(=O)=O Amb24375783 [0,1,0,0,0,0|2,0,0]=3 880 B8R0.27 OC(=O)C(C(O)(C)C)Br Amb17595209 [0,1,0,0,0,0|2,0,1]=4 881 B8R0.27 OC(=O)C(C(O)(C)C)C Amb10844263 [0,1,0,0,0,0|1,0,1]=3 882 B8R0.27 OC(=O)C(Cl)S(O)(=O)=O Amb25724885 [0,1,0,0,0,0|2,0,0]=3 883 B8R0.27 OC(=O)C(F)P(O)(O)=O Amb24520819 [0,1,0,0,0,0|2,0,0]=3 884 B8R0.27 OC(=O)[C@@H](Br)S(O)(=O)=O Amb25218846 [0,1,0,0,0,0|2,0,0]=3 885 B8R0.27 OC(=O)[C@@H](C(O)(C)C)C Amb10844262 [0,1,0,0,0,0|1,0,1]=3 886 B8R0.27 OC(=O)[C@H](C(O)(C)C)C Amb10844272 [0,1,0,0,0,0|1,0,1]=3 887 B8R0.27 OC(C(O)=O)P(O)(O)=O Amb24117287 [0,1,0,0,0,0|2,0,0]=3 888 B8R0.27 OC(C(O)=O)S(O)(=O)=O Amb24739659 [0,1,0,0,0,0|2,0,0]=3 889 B8R0.37 BrC(=C)C(C(=O)O)(C)C Amb17595054 [0,1,0,0,0,0|2,0,0]=3 890 B8R0.37 CC(=C)C(C(=O)O)(C)C Amb15701602 [0,1,0,0,0,0|2,0,0]=3 891 B8R0.37 CC(=C)C(C)(C)C(N)=O Amb25032100 [0,1,0,0,0,0|3,0,0]=4 892 B8R0.37 CC(=C)C(C)(O)C(O)=O Amb18642760 [0,1,0,0,0,0|2,0,0]=3 893 B8R0.37 CC(=O)C(C(=O)C)(C)C Amb17593343 [0,1,0,0,0,0|2,0,0]=3 894 B8R0.37 CC(=O)C(C)(C)C(N)=S Amb25257011 [0,1,0,0,0,0|2,1,0]=4 895 B8R0.37 CC(=O)C(C)(C)C(O)=O Amb18642784 [0,1,0,0,0,0|1,0,0]=2 896 B8R0.37 CC(=O)C(C)(C)C(O)=S Amb24061048 [0,1,0,0,0,0|1,1,0]=3 897 B8R0.37 CC(=O)C(C)(C)[N+]([O-])=O Amb25060217 [0,1,0,0,0,0|2,0,1]=4 898 B8R0.37 CC(=O)C(C)(Cl)C(C)=C Amb24621439 [0,1,0,0,0,0|3,0,0]=4 899 B8R0.37 CC(=O)C(C)(O)C(N)=O Amb24084329 [0,1,0,0,0,0|2,0,0]=3 900 B8R0.37 CC(=O)C(C)(O)C(O)=O Amb18642870 [0,1,0,0,0,0|1,0,0]=2 901 B8R0.37 CC(=O)C(C)(O)C(O)O Amb25833528 [0,1,0,0,0,0|1,0,2]=4 902 B8R0.37 CC(=O)C(Cl)(Cl)C(=O)Cl Amb24563515 [0,1,0,0,0,0|3,0,0]=4 903 B8R0.37 CC(=O)C(Cl)(Cl)C(C)=O Amb25857557 [0,1,0,0,0,0|3,0,0]=4 904 B8R0.37 CC(=O)C(O)(O)C(C)=O Amb24513654 [0,1,0,0,0,0|3,0,0]=4 905 B8R0.37 CC(=O)C(O)(O)C(O)=O Amb24101440 [0,1,0,0,0,0|2,0,0]=3 906 B8R0.37 CC(=S)C(C)(C)C(C)=O Amb24677277 [0,1,0,0,0,0|2,1,0]=4 907 B8R0.37 CC(Br)(C(N)=O)C(N)=O Amb25702506 [0,1,0,0,0,0|2,0,0]=3 908 B8R0.37 CC(Br)(C(O)=O)C(O)=O Amb24429036 [0,1,0,0,0,0|0,0,0]=1 909 B8R0.37 CC(Br)C(C)(C)C(O)=O Amb25088460 [0,1,0,0,0,0|2,0,1]=4 910 B8R0.37 CC(C(C(=O)O)(C)C)C Amb17593377 [0,1,0,0,0,0|2,0,1]=4 911 B8R0.37 CC(C)(C(=O)Cl)C(=O)Cl Amb22347922 [0,1,0,0,0,0|2,0,0]=3 912 B8R0.37 CC(C)(C(N)=O)C(N)=O Amb24659379 [0,1,0,0,0,0|2,0,0]=3 913 B8R0.37 CC(C)C(C)(Br)C(O)=O Amb24652574 [0,1,0,0,0,0|2,0,1]=4 914 B8R0.37 CC(C)C(C)(F)C(O)=O Amb24518491 [0,1,0,0,0,0|2,0,1]=4 915 B8R0.37 CC(C)C(C)(O)C(O)=O Amb18286212 [0,1,0,0,0,0|2,0,1]=4 916 B8R0.37 CC(C)C(C)(S)C(O)=O Amb25064233 [0,1,0,0,0,0|2,0,1]=4 917 B8R0.37 CC(Cl)(C(N)=O)C(N)=O Amb25363306 [0,1,0,0,0,0|2,0,0]=3 918 B8R0.37 CC(F)C(C)(C)C(O)=O Amb24695887 [0,1,0,0,0,0|2,0,1]=4 919 B8R0.37 CC(F)C(C)(N)C(O)=O Amb25844045 [0,1,0,0,0,0|2,0,1]=4 920 B8R0.37 CC(N)C(C)(C)C(O)=O Amb24681858 [0,1,0,0,0,0|2,0,1]=4 921 B8R0.37 CC(O)(C(F)F)C(O)=O Amb25842016 [0,1,0,0,0,0|2,0,1]=4 922 B8R0.37 CC(O)(C(O)=O)C(O)=O Amb18124398 [0,1,0,0,0,0|0,0,0]=1 923 B8R0.37 CC(O)C(C)(C)C(C)=O Amb25282830 [0,1,0,0,0,0|2,0,1]=4 924 B8R0.37 CC(O)C(C)(C)C(O)=O Amb18961474 [0,1,0,0,0,0|1,0,1]=3 925 B8R0.37 CC(O)C(C)(O)C(O)=O Amb18124401 [0,1,0,0,0,0|1,0,1]=3 926 B8R0.37 CC([C@@](C(=O)O)(N)C)C Amb10603127 [0,1,0,0,0,0|2,0,1]=4 927 B8R0.37 CC([C@@](C(=O)O)(O)C)C Amb16231522 [0,1,0,0,0,0|2,0,1]=4 928 B8R0.37 CC([C@](C(=O)O)(N)C)C Amb16183901 [0,1,0,0,0,0|2,0,1]=4 929 B8R0.37 CN(C)C(C)(C)C(O)=O Amb20627821 [0,1,0,0,0,0|3,0,0]=4 930 B8R0.37 CS(=O)C(C)(C)C(N)=O Amb25145472 [0,1,0,0,0,0|3,0,0]=4 931 B8R0.37 CS(=O)C(C)(C)C(O)=O Amb18644428 [0,1,0,0,0,0|2,0,0]=3 932 B8R0.37 CS(=O)C(F)(F)C(O)=O Amb23586464 [0,1,0,0,0,0|3,0,0]=4 933 B8R0.37 C[C@@H](Cl)[C@](C)(O)C(O)=O Amb25360920 [0,1,0,0,0,0|2,0,1]=4 934 B8R0.37 C[C@@H](O)C(C)(C)C(O)=O Amb24465184 [0,1,0,0,0,0|1,0,1]=3 935 B8R0.37 C[C@@H](O)[C@@](C)(O)C(C)=O Amb25662408 [0,1,0,0,0,0|2,0,1]=4 936 B8R0.37 C[C@@H](O)[C@@](C)(O)C(O)=O Amb25842427 [0,1,0,0,0,0|1,0,1]=3 937 B8R0.37 C[C@@H](O)[C@](C)(O)C(C)=O Amb25767044 [0,1,0,0,0,0|2,0,1]=4 938 B8R0.37 C[C@@](N)(C(F)F)C(O)=O Amb25329065 [0,1,0,0,0,0|2,0,1]=4 939 B8R0.37 C[C@@](N)(C(O)=O)C(N)=O Amb25077574 [0,1,0,0,0,0|1,0,0]=2 940 B8R0.37 C[C@H](O)C(C)(C)C(C)=O Amb24725317 [0,1,0,0,0,0|2,0,1]=4 941 B8R0.37 C[C@H](O)C(C)(C)C(O)=O Amb25114676 [0,1,0,0,0,0|1,0,1]=3 942 B8R0.37 C[C@H](O)[C@@](C)(N)C(O)=O Amb22232016 [0,1,0,0,0,0|1,0,1]=3 943 B8R0.37 C[C@H](O)[C@](C)(Cl)C(O)=O Amb25772784 [0,1,0,0,0,0|1,0,1]=3 944 B8R0.37 C[C@](N)(C(F)F)C(O)=O Amb25107781 [0,1,0,0,0,0|2,0,1]=4 945 B8R0.37 ClC(=C)C(C(=O)O)(C)C Amb17613253 [0,1,0,0,0,0|2,0,0]=3 946 B8R0.37 FC(=O)C(C(=O)F)(F)F Amb10838771 [0,1,0,0,0,0|3,0,0]=4 947 B8R0.37 NC(=O)C(Br)(Br)C(O)=O Amb25840519 [0,1,0,0,0,0|2,0,0]=3 948 B8R0.37 NC(=O)C(C(=O)N)(F)F Amb10839344 [0,1,0,0,0,0|3,0,0]=4 949 B8R0.37 NC(=O)C(Cl)(Cl)C(N)=O Amb24524184 [0,1,0,0,0,0|3,0,0]=4 950 B8R0.37 NC(=O)C(F)(Cl)C(N)=O Amb24739739 [0,1,0,0,0,0|3,0,0]=4 951 B8R0.37 NC(=O)C(F)(F)C(O)=O Amb24385040 [0,1,0,0,0,0|2,0,0]=3 952 B8R0.37 NC(=O)C(O)(O)C(N)=O Amb25339245 [0,1,0,0,0,0|3,0,0]=4 953 B8R0.37 NC(N)(C(N)=O)C(N)=O Amb24548237 [0,1,0,0,0,0|3,0,0]=4 954 B8R0.37 N[13C](=O)[13C]([13C](=O)N)(Br)Br Amb17612557 [0,1,0,0,0,0|3,0,0]=4 955 B8R0.37 OC(=O)C(Br)(Br)C(O)=O Amb24707409 [0,1,0,0,0,0|1,0,0]=2 956 B8R0.37 OC(=O)C(C(=O)Cl)(C)C Amb17593749 [0,1,0,0,0,0|1,0,0]=2 957 B8R0.37 OC(=O)C(C(=O)O)(Cl)Cl Amb17594338 [0,1,0,0,0,0|1,0,0]=2 958 B8R0.37 OC(=O)C(C(=S)N)(C)C Amb17465757 [0,1,0,0,0,0|1,1,0]=3 959 B8R0.37 OC(=O)C(Cl)(Br)C(O)=O Amb25827170 [0,1,0,0,0,0|1,0,0]=2 960 B8R0.37 OC(=O)C(F)(F)C(O)=O Amb24088375 [0,1,0,0,0,0|1,0,0]=2 961 B8R0.37 OC(O)(C(O)=O)C(O)=O Amb22002022 [0,1,0,0,0,0|1,0,0]=2 962 B8R0.37 [O-]C(=O)C(O)(O)C([O-])=O Amb24325371 [0,1,0,0,0,0|1,0,2]=4 963 B8R1.30 C=C1CC1(N)C(O)=O Amb22274582 [0,0,0,1,0,0|3,0,0]=4 964 B8R1.30 CC1(CC1F)C(O)=O Amb24445672 [0,0,0,1,0,0|2,0,1]=4 965 B8R1.30 CC1(OC1C)C(=O)O Amb17593199 [0,0,0,1,0,0|1,0,1]=3 966 B8R1.30 CC1=NC1(C)C(N)=O Amb25230606 [0,0,0,1,0,0|3,0,0]=4 967 B8R1.30 CC1OC1(C)C(C)=O Amb25745803 [0,0,0,1,0,0|2,0,1]=4 968 B8R1.30 CC1OC1(C)C(N)=O Amb24482460 [0,0,0,1,0,0|2,0,1]=4 969 B8R1.30 CC1OC1(Cl)C(O)=O Amb24604328 [0,0,0,1,0,0|2,0,1]=4 970 B8R1.30 C[C@@H]1C[C@@]1(C)C(O)=O Amb24680945 [0,0,0,1,0,0|2,0,1]=4 971 B8R1.30 C[C@@H]1O[C@@]1(C)C(N)=O Amb24760855 [0,0,0,1,0,0|2,0,1]=4 972 B8R1.30 C[C@@H]1O[C@@]1(C)C(O)=O Amb25174091 [0,0,0,1,0,0|1,0,1]=3 973 B8R1.30 C[C@@]1(C[C@H]1Cl)C(O)=O Amb25025974 [0,0,0,1,0,0|2,0,1]=4 974 B8R1.30 C[C@H]1O[C@@]1(C)C(C)=O Amb25207221 [0,0,0,1,0,0|2,0,1]=4 975 B8R1.30 C[C@]1(C[C@@H]1F)C(O)=O Amb24053139 [0,0,0,1,0,0|2,0,1]=4 976 B8R1.31 CC(=O)C1CNC1=O Amb24526367 [0,0,0,1,0,0|2,0,0]=3 977 B8R1.31 CC(=O)C1COC1=O Amb24601316 [0,0,0,1,0,0|1,0,0]=2 978 B8R1.31 CC(O)C1CCC1=O Amb24363437 [0,0,0,1,0,0|2,0,1]=4 979 B8R1.31 CC1CCC1C(O)=O Amb21857447 [0,0,0,1,0,0|2,0,1]=4 980 B8R1.31 CN1CCC1C(O)=O Amb22011586 [0,0,0,1,0,0|3,0,0]=4 981 B8R1.31 CN1CC[C@@H]1C(O)=O Amb24183372 [0,0,0,1,0,0|3,0,0]=4 982 B8R1.31 CN1CC[C@H]1C(O)=O Amb24699921 [0,0,0,1,0,0|3,0,0]=4 983 B8R1.31 C[C@@H]1CC[C@H]1C(O)=O Amb25174793 [0,0,0,1,0,0|2,0,1]=4 984 B8R1.31 C[C@H](O)[C@@H]1CNC1=O Amb25224413 [0,0,0,1,0,0|2,0,1]=4 985 B8R1.31 C[C@H]1CC[C@@H]1C(O)=O Amb24561899 [0,0,0,1,0,0|2,0,1]=4 986 B8R1.31 C[C@H]1CC[C@H]1C(O)=O Amb25259513 [0,0,0,1,0,0|2,0,1]=4 987 B8R1.31 NN1CCC1C(O)=O Amb25189887 [0,0,0,1,0,0|3,0,0]=4 988 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24117048 [0,0,0,1,0,0|2,0,1]=4 989 B8R1.31 N[C@@H]1CC[C@@H]1C(O)=O Amb24183584 [0,0,0,1,0,0|2,0,1]=4 990 B8R1.31 OC(=O)C1CCC1S Amb25830696 [0,0,0,1,0,0|1,1,1]=4 991 B8R1.31 OC(=O)C1CNC1=O Amb24524290 [0,0,0,1,0,0|1,0,0]=2 992 B8R1.31 OC(=O)[C@@H]1CC[C@@H]1Cl Amb24514834 [0,0,0,1,0,0|2,0,1]=4 993 B8R1.31 OC(=O)[C@@H]1CC[C@H]1Cl Amb24580965 [0,0,0,1,0,0|2,0,1]=4 994 B8R1.31 OC1CCC1C(O)=O Amb24481384 [0,0,0,1,0,0|1,0,1]=3 995 B8R1.31 OC=1CCC1C(O)=O Amb25119748 [0,0,0,1,0,0|1,0,1]=3 996 B8R1.31 [C@H]1(CNC1=O)[C@@H](C)O Amb17843592 [0,0,0,1,0,0|2,0,1]=4 997 B8R1.50 BrC1C(=O)CCC1=O Amb10975590 [0,0,0,1,0,0|3,0,0]=4 998 B8R1.50 BrC1C(=O)COC1=O Amb17594578 [0,0,0,1,0,0|2,0,0]=3 999 B8R1.50 CC1=CNC(=O)C1C Amb25367339 [0,0,0,1,0,0|3,0,0]=4 1000 B8R1.50 CC1=NOC(=O)C1C Amb19958218 [0,0,0,1,0,0|2,0,0]=3 1001 B8R1.50 CC1=NOC(=O)N1C Amb25031408 [0,0,0,1,0,0|3,0,0]=4 1002 B8R1.50 CC1C(=O)C=CC1=O Amb25675832 [0,0,0,1,0,0|2,0,0]=3 1003 B8R1.50 CC1C(N)COC1=O Amb18641824 [0,0,0,1,0,0|2,0,1]=4 1004 B8R1.50 CC1C(O)CNC1=O Amb24441657 [0,0,0,1,0,0|2,0,1]=4 1005 B8R1.50 CC1C(O)COC1=O Amb25357313 [0,0,0,1,0,0|1,0,1]=3 1006 B8R1.50 CC=1C(=O)OCC1C Amb25859061 [0,0,0,1,0,0|2,0,1]=4 1007 B8R1.50 CC=1C(=O)ONC1C Amb22490660 [0,0,0,1,0,0|2,0,1]=4 1008 B8R1.50 CN1C(=O)C=CC1=O Amb1158022 [0,0,0,1,0,0|3,0,0]=4 1009 B8R1.50 CN1C(=O)CNC1=O Amb22002559 [0,0,0,1,0,0|3,0,0]=4 1010 B8R1.50 CN1C(=O)COC1=O Amb21927685 [0,0,0,1,0,0|2,0,0]=3 1011 B8R1.50 CN1C(=O)CSC1=O Amb1883006 [0,0,0,1,0,0|2,1,0]=4 1012 B8R1.50 CN1C(=O)NNC1=O Amb22347867 [0,0,0,1,0,0|3,0,0]=4 1013 B8R1.50 CN1C(=O)SSC1=O Amb24332991 [0,0,0,1,0,0|1,2,0]=4 1014 B8R1.50 CN1C(N)=NOC1=O Amb25709943 [0,0,0,1,0,0|3,0,0]=4 1015 B8R1.50 C[C-]1C(=O)CCC1=O Amb24458437 [0,0,0,1,0,0|2,0,1]=4 1016 B8R1.50 C[C@@H]1[C@@H](O)COC1=O Amb25176469 [0,0,0,1,0,0|1,0,1]=3 1017 B8R1.50 C[C@H]1[C@H](N)COC1=O Amb24514746 [0,0,0,1,0,0|2,0,1]=4 1018 B8R1.50 C[C@H]1[C@H](O)CCC1=O Amb24631662 [0,0,0,1,0,0|2,0,1]=4 1019 B8R1.50 Cc1c(N)o[n]c1O Amb23504024 [0,0,0,1,0,0|2,0,1]=4 1020 B8R1.50 NC1C(O)COC1=O Amb25746355 [0,0,0,1,0,0|2,0,1]=4 1021 B8R1.50 N[C@@H]1[C@H](O)COC1=O Amb25260781 [0,0,0,1,0,0|2,0,1]=4 1022 B8R1.50 N[C@H]1[C@@H](O)COC1=O Amb24697759 [0,0,0,1,0,0|2,0,1]=4 1023 B8R1.50 O=C1C(=O)COC1=O Amb24364125 [0,0,0,1,0,0|2,0,1]=4 1024 B8R1.50 O=C1CCC(=O)C1F Amb24466994 [0,0,0,1,0,0|3,0,0]=4 1025 B8R1.50 O=C1CCC(=O)C1[Na] Amb25162789 [0,0,0,1,0,0|3,0,0]=4 1026 B8R1.50 O=C1NN=C(C1C)N Amb17593175 [0,0,0,1,0,0|3,0,0]=4 1027 B8R1.50 OC1C(=O)C=CC1=O Amb25272521 [0,0,0,1,0,0|3,0,0]=4 1028 B8R1.50 OC1C(=O)CCC1=O Amb24443990 [0,0,0,1,0,0|3,0,0]=4 1029 B8R1.50 OC1C(=O)COC1=O Amb25143349 [0,0,0,1,0,0|2,0,0]=3 1030 B8R1.50 OC1C(O)COC1=O Amb22730078 [0,0,0,1,0,0|2,0,1]=4 1031 B8R1.50 OC1COC(=O)C1Br Amb24482051 [0,0,0,1,0,0|2,0,1]=4 1032 B8R1.50 OC1COC(=O)C1F Amb24529261 [0,0,0,1,0,0|2,0,1]=4 1033 B8R1.50 OC=1C(=O)OCC1O Amb23505710 [0,0,0,1,0,0|2,0,1]=4 1034 B8R1.50 OC=1COC(=O)C1Cl Amb22360617 [0,0,0,1,0,0|2,0,1]=4 1035 B8R1.50 O[C@@H]1[C@@H](O)COC1=O Amb15692412 [0,0,0,1,0,0|2,0,1]=4 1036 B8R1.50 O[C@H]1COC(=O)[C@H]1Br Amb10067848 [0,0,0,1,0,0|2,0,1]=4 1037 B8R1.50 O[C@H]1[C@H](O)COC1=O Amb24609731 [0,0,0,1,0,0|2,0,1]=4 1038 B8R1.50 Oc1noc(c1C)C Amb10552497 [0,0,0,1,0,0|2,0,1]=4 1039 B8R1.54 CC(C(=O)O)C1CC1 Amb17087493 [0,0,0,1,0,0|2,0,1]=4 1040 B8R1.54 CC(C(O)=O)=C1CC1 Amb24450586 [0,0,0,1,0,0|2,0,1]=4 1041 B8R1.77 CC1(Cl)CC1C(O)=O Amb24629731 [0,0,0,1,0,0|2,0,1]=4 1042 B8R1.77 OC(=O)C1CC1(Br)Br Amb24651946 [0,0,0,1,0,0|2,0,1]=4 1043 B8R1.77 OC(=O)C1CC1(Cl)Cl Amb1106460 [0,0,0,1,0,0|2,0,1]=4 1044 B8R1.77 OC(=O)C1CC1(F)Cl Amb10841879 [0,0,0,1,0,0|2,0,1]=4 1045 B8R0.23 C=C(Br)C(O)CC(O)=O Amb24648348 [0,0,0,0,0,1|3,0,0]=4 1046 B8R0.23 C=C(Br)CC(N)C(O)=O Amb24557771 [0,0,0,0,0,1|3,0,0]=4 1047 B8R0.23 C=C(Br)C[C@@H](N)C(O)=O Amb22746251 [0,0,0,0,0,1|3,0,0]=4 1048 B8R0.23 C=C(CC(=O)Cl)C(O)=O Amb25227983 [0,0,0,0,0,1|1,0,2]=4 1049 B8R0.23 C=C(CC(N)=O)C(O)=O Amb24333452 [0,0,0,0,0,1|1,0,2]=4 1050 B8R0.23 C=C(CC(O)=O)C(N)=O Amb22011744 [0,0,0,0,0,1|1,0,2]=4 1051 B8R0.23 C=C(Cl)CC(N)C(O)=O Amb24411473 [0,0,0,0,0,1|3,0,0]=4 1052 B8R0.23 C=C(F)CC(N)C(O)=O Amb24580886 [0,0,0,0,0,1|3,0,0]=4 1053 B8R0.23 C=C(I)CC(N)C(O)=O Amb25842052 [0,0,0,0,0,1|3,0,0]=4 1054 B8R0.23 CC(=C)C(C)CC(O)=O Amb18642614 [0,0,0,0,0,1|2,0,0]=3 1055 B8R0.23 CC(=C)C(O)CC(O)=O Amb18642756 [0,0,0,0,0,1|3,0,0]=4 1056 B8R0.23 CC(=C)CC(C)C(N)=O Amb24475657 [0,0,0,0,0,1|3,0,0]=4 1057 B8R0.23 CC(=C)CC(C)C(O)=O Amb24471924 [0,0,0,0,0,1|2,0,0]=3 1058 B8R0.23 CC(=C)CC(O)C(O)=O Amb24534477 [0,0,0,0,0,1|3,0,0]=4 1059 B8R0.23 CC(=C)C[C@@H](C(=O)O)C Amb10843988 [0,0,0,0,0,1|2,0,0]=3 1060 B8R0.23 CC(=C)C[C@@H](C)C(O)=O Amb24340253 [0,0,0,0,0,1|2,0,0]=3 1061 B8R0.23 CC(=C)C[C@@H](N)C(O)=O Amb22801689 [0,0,0,0,0,1|3,0,0]=4 1062 B8R0.23 CC(=C)C[C@H](N)C(O)=O Amb25757900 [0,0,0,0,0,1|3,0,0]=4 1063 B8R0.23 CC(=C)[C@@H](O)CC(O)=O Amb25789715 [0,0,0,0,0,1|3,0,0]=4 1064 B8R0.23 CC(=CC(=O)Cl)C(=O)Cl Amb24464565 [0,0,0,0,0,1|2,0,1]=4 1065 B8R0.23 CC(=CC(N)=O)C(O)=O Amb24744881 [0,0,0,0,0,1|1,0,1]=3 1066 B8R0.23 CC(=CC(O)=O)[N+]([O-])=O Amb24685014 [0,0,0,0,0,1|1,0,2]=4 1067 B8R0.23 CC(=O)C(C)=NC(C)=O Amb25349449 [0,0,0,0,0,1|2,0,1]=4 1068 B8R0.23 CC(=O)C(C)CC(O)=O Amb18292788 [0,0,0,0,0,1|1,0,0]=2 1069 B8R0.23 CC(=O)C(C)OC(=O)Cl Amb24721759 [0,0,0,0,0,1|2,0,0]=3 1070 B8R0.23 CC(=O)C(C)SC(C)=O Amb25833387 [0,0,0,0,0,1|2,0,0]=3 1071 B8R0.23 CC(=O)C(Cl)CC(O)=O Amb24426109 [0,0,0,0,0,1|2,0,0]=3 1072 B8R0.23 CC(=O)C(N)CC(N)=O Amb24409504 [0,0,0,0,0,1|3,0,0]=4 1073 B8R0.23 CC(=O)C(O)=CC(O)=O Amb25261166 [0,0,0,0,0,1|2,0,1]=4 1074 B8R0.23 CC(=O)C(O)CC(O)=O Amb25341886 [0,0,0,0,0,1|2,0,0]=3 1075 B8R0.23 CC(=O)CC(=O)C(O)=O Amb18642736 [0,0,0,0,0,1|2,0,1]=4 1076 B8R0.23 CC(=O)CC(Br)C(O)=O Amb24710683 [0,0,0,0,0,1|2,0,0]=3 1077 B8R0.23 CC(=O)CC(C)C(O)=S Amb24061827 [0,0,0,0,0,1|1,1,0]=3 1078 B8R0.23 CC(=O)CC(N)C(O)=O Amb18832532 [0,0,0,0,0,1|2,0,0]=3 1079 B8R0.23 CC(=O)CC(N)C(O)=O Amb22546289 [0,0,0,0,0,1|2,0,0]=3 1080 B8R0.23 CC(=O)CC(O)C(O)=O Amb22500917 [0,0,0,0,0,1|2,0,0]=3 1081 B8R0.23 CC(=O)C[C@@H](C)C(C)=C Amb25347412 [0,0,0,0,0,1|3,0,0]=4 1082 B8R0.23 CC(=O)C[C@@H](C)C(O)=O Amb24369598 [0,0,0,0,0,1|1,0,0]=2 1083 B8R0.23 CC(=O)C[C@@H](N)C(O)=O Amb22745939 [0,0,0,0,0,1|2,0,0]=3 1084 B8R0.23 CC(=O)C[C@H](O)C(O)=O Amb24358758 [0,0,0,0,0,1|2,0,0]=3 1085 B8R0.23 CC(=O)NC(C(=O)N)N Amb10558230 [0,0,0,0,0,1|3,0,0]=4 1086 B8R0.23 CC(=O)NC(C(=S)N)C Amb17399904 [0,0,0,0,0,1|2,1,0]=4 1087 B8R0.23 CC(=O)NC(O)C(O)=O Amb25146184 [0,0,0,0,0,1|2,0,0]=3 1088 B8R0.23 CC(=O)NN(C)C(N)=O Amb24449373 [0,0,0,0,0,1|3,0,0]=4 1089 B8R0.23 CC(=O)N[C@@H](C)C(=O)Cl Amb25032144 [0,0,0,0,0,1|2,0,0]=3 1090 B8R0.23 CC(=O)N[C@@H](C)C(N)=O Amb22168264 [0,0,0,0,0,1|2,0,0]=3 1091 B8R0.23 CC(=O)N[C@H](C)C(N)=O Amb24478101 [0,0,0,0,0,1|2,0,0]=3 1092 B8R0.23 CC(=O)N[C@H](C)C(O)=O Amb19944277 [0,0,0,0,0,1|1,0,0]=2 1093 B8R0.23 CC(=O)OC(C)C(O)=O Amb22360672 [0,0,0,0,0,1|1,0,0]=2 1094 B8R0.23 CC(=O)O[C@@H](C)C(N)=O Amb25733380 [0,0,0,0,0,1|2,0,0]=3 1095 B8R0.23 CC(=O)SC(C)C(O)=O Amb25719066 [0,0,0,0,0,1|1,0,0]=2 1096 B8R0.23 CC(=O)[C@@H](C)CC(O)=O Amb25145964 [0,0,0,0,0,1|1,0,0]=2 1097 B8R0.23 CC(=O)[C@@H](C)OC(C)=O Amb25205804 [0,0,0,0,0,1|2,0,0]=3 1098 B8R0.23 CC(=O)[C@@H](N)CC(O)=O Amb25064775 [0,0,0,0,0,1|2,0,0]=3 1099 B8R0.23 CC(=O)[C@H](C)CC(O)=O Amb25360184 [0,0,0,0,0,1|1,0,0]=2 1100 B8R0.23 CC(=O)[C@H](C)NC(C)=O Amb24072918 [0,0,0,0,0,1|2,0,0]=3 1101 B8R0.23 CC(=O)\C(\C)=C/C(C)=O Amb24447751 [0,0,0,0,0,1|2,0,1]=4 1102 B8R0.23 CC(=O)\C(\C)=C\C(C)=O Amb25773462 [0,0,0,0,0,1|2,0,1]=4 1103 B8R0.23 CC(=O)\C(\C)=C\C(O)=O Amb22359749 [0,0,0,0,0,1|1,0,1]=3 1104 B8R0.23 CC(=O)\C(\C)=N/C(C)=O Amb24072927 [0,0,0,0,0,1|2,0,1]=4 1105 B8R0.23 CC(=O)\C=C(/Br)\C(O)=O Amb24739508 [0,0,0,0,0,1|2,0,1]=4 1106 B8R0.23 CC(=O)\C=C(/C)\C(O)=O Amb18642577 [0,0,0,0,0,1|1,0,1]=3 1107 B8R0.23 CC(=O)\C=C(\C)/C(O)=O Amb24582978 [0,0,0,0,0,1|1,0,1]=3 1108 B8R0.23 CC(=O)\C=C(\O)/C(O)=O Amb25856143 [0,0,0,0,0,1|2,0,1]=4 1109 B8R0.23 CC(=S)CC(C)C(O)=O Amb24588975 [0,0,0,0,0,1|1,1,0]=3 1110 B8R0.23 CC(=S)N[C@@H](C)C(O)=O Amb24529119 [0,0,0,0,0,1|1,1,0]=3 1111 B8R0.23 CC(C(=O)O)NC(C)C Amb10199874 [0,0,0,0,0,1|2,0,1]=4 1112 B8R0.23 CC(C(=O)O)NC(C)C Amb1110769 [0,0,0,0,0,1|2,0,1]=4 1113 B8R0.23 CC(C(=O)O)OC(C)C Amb10607866 [0,0,0,0,0,1|2,0,1]=4 1114 B8R0.23 CC(C(C)C)CC(=O)O Amb10844380 [0,0,0,0,0,1|2,0,1]=4 1115 B8R0.23 CC(C)=C(C)CC(O)=O Amb18642613 [0,0,0,0,0,1|2,0,1]=4 1116 B8R0.23 CC(C)=CC(C)C(C)=O Amb25749549 [0,0,0,0,0,1|3,0,0]=4 1117 B8R0.23 CC(C)=C[C@@H](C)C(O)=O Amb25794277 [0,0,0,0,0,1|2,0,0]=3 1118 B8R0.23 CC(C)=C[C@H](N)C(O)=O Amb24629144 [0,0,0,0,0,1|3,0,0]=4 1119 B8R0.23 CC(C)CC(C)C(O)=O Amb18975244 [0,0,0,0,0,1|2,0,1]=4 1120 B8R0.23 CC(C)S[C@@H](C)C(O)=O Amb25108429 [0,0,0,0,0,1|2,0,1]=4 1121 B8R0.23 CC(CC(=O)Cl)C(=O)Cl Amb22167294 [0,0,0,0,0,1|2,0,0]=3 1122 B8R0.23 CC(CC(C)=O)C(C)O Amb24339979 [0,0,0,0,0,1|2,0,1]=4 1123 B8R0.23 CC(CC(C)=O)S(C)=O Amb25712236 [0,0,0,0,0,1|3,0,0]=4 1124 B8R0.23 CC(CC(C)N)C(O)=O Amb20620336 [0,0,0,0,0,1|2,0,1]=4 1125 B8R0.23 CC(CC(C)O)C(C)=O Amb25682085 [0,0,0,0,0,1|2,0,1]=4 1126 B8R0.23 CC(CC(F)F)C(O)=O Amb22896466 [0,0,0,0,0,1|2,0,1]=4 1127 B8R0.23 CC(CC(N)=O)C(N)=N Amb25325023 [0,0,0,0,0,1|3,0,0]=4 1128 B8R0.23 CC(CC(O)=O)=P(O)=O Amb25264110 [0,0,0,0,0,1|1,0,1]=3 1129 B8R0.23 CC(CC(O)=O)C(C)N Amb23536744 [0,0,0,0,0,1|2,0,1]=4 1130 B8R0.23 CC(CC(O)=O)C(N)=O Amb25737942 [0,0,0,0,0,1|1,0,0]=2 1131 B8R0.23 CC(CC(O)=O)N(C)N Amb25699365 [0,0,0,0,0,1|3,0,0]=4 1132 B8R0.23 CC(CC(O)=O)S(C)=O Amb18974545 [0,0,0,0,0,1|2,0,0]=3 1133 B8R0.23 CC(CC([O-])=O)S([O-])=O Amb22470749 [0,0,0,0,0,1|1,0,2]=4 1134 B8R0.23 CC(CN(C)O)C(O)=O Amb24540617 [0,0,0,0,0,1|2,0,0]=3 1135 B8R0.23 CC(CS(C)=O)C(O)=O Amb18974546 [0,0,0,0,0,1|2,0,0]=3 1136 B8R0.23 CC(CS([O-])=O)C([O-])=O Amb22470748 [0,0,0,0,0,1|1,0,2]=4 1137 B8R0.23 CC(N=C(N)S)C(O)=O Amb22229340 [0,0,0,0,0,1|1,1,0]=3 1138 B8R0.23 CC(NC(=O)Cl)C(=O)Cl Amb25049171 [0,0,0,0,0,1|2,0,0]=3 1139 B8R0.23 CC(NC(C)=O)B(O)O Amb25125858 [0,0,0,0,0,1|2,0,1]=4 1140 B8R0.23 CC(NC(C)=O)C(C)O Amb25188915 [0,0,0,0,0,1|2,0,1]=4 1141 B8R0.23 CC(NC(N)=N)C(N)=O Amb24425222 [0,0,0,0,0,1|3,0,0]=4 1142 B8R0.23 CC(NC(N)=N)C(O)=O Amb22522920 [0,0,0,0,0,1|2,0,0]=3 1143 B8R0.23 CC(NC(N)=O)C(N)=N Amb25733715 [0,0,0,0,0,1|3,0,0]=4 1144 B8R0.23 CC(NC(S)=S)C(O)=O Amb25336384 [0,0,0,0,0,1|0,2,0]=3 1145 B8R0.23 CC(NN(C)C)C(O)=O Amb24523085 [0,0,0,0,0,1|3,0,0]=4 1146 B8R0.23 CC(NS(C)=O)C(C)=O Amb25263940 [0,0,0,0,0,1|3,0,0]=4 1147 B8R0.23 CC(NS(C)=O)C(O)=O Amb25241916 [0,0,0,0,0,1|2,0,0]=3 1148 B8R0.23 CC(O)=CC(=O)C(O)=O Amb25047399 [0,0,0,0,0,1|2,0,1]=4 1149 B8R0.23 CC(O)C(C)CC(O)=O Amb18293276 [0,0,0,0,0,1|1,0,1]=3 1150 B8R0.23 CC(O)CC(C)C(O)=O Amb18293277 [0,0,0,0,0,1|1,0,1]=3 1151 B8R0.23 CC(O)CC(N)C(O)=O Amb18642918 [0,0,0,0,0,1|2,0,1]=4 1152 B8R0.23 CC(OC(F)F)C(O)=O Amb24358717 [0,0,0,0,0,1|2,0,1]=4 1153 B8R0.23 CC(OC(N)=S)C(O)=O Amb25732591 [0,0,0,0,0,1|1,1,0]=3 1154 B8R0.23 CN(CC(O)=O)C(N)=N Amb22002328 [0,0,0,0,0,1|3,0,0]=4 1155 B8R0.23 CN(CC(O)=O)C(N)=N Amb22167307 [0,0,0,0,0,1|3,0,0]=4 1156 B8R0.23 CN(CC(O)=O)C(N)=S Amb25115737 [0,0,0,0,0,1|2,1,0]=4 1157 B8R0.23 CN(CC(O)=O)[13C](N)=N Amb22367285 [0,0,0,0,0,1|3,0,0]=4 1158 B8R0.23 CN(NC(N)=O)C(N)=O Amb24743493 [0,0,0,0,0,1|3,0,0]=4 1159 B8R0.23 CS(=O)CC(N)C(O)=O Amb18125279 [0,0,0,0,0,1|3,0,0]=4 1160 B8R0.23 CS(=O)CC(O)C(O)=O Amb24692848 [0,0,0,0,0,1|3,0,0]=4 1161 B8R0.23 CS(=O)C[C@@H](C(=O)O)N Amb16232229 [0,0,0,0,0,1|3,0,0]=4 1162 B8R0.23 CS(=O)C[C@@H](N)C(O)=O Amb22745418 [0,0,0,0,0,1|3,0,0]=4 1163 B8R0.23 C[C@@H](C(=O)O)CC(C)C Amb10844070 [0,0,0,0,0,1|2,0,1]=4 1164 B8R0.23 C[C@@H](C(C)C)CC(=O)O Amb10844387 [0,0,0,0,0,1|2,0,1]=4 1165 B8R0.23 C[C@@H](CC(O)=O)C(Cl)Cl Amb24480304 [0,0,0,0,0,1|2,0,1]=4 1166 B8R0.23 C[C@@H](CC(O)=O)C(O)=O Amb22226742 [0,0,0,0,0,1|0,0,0]=1 1167 B8R0.23 C[C@@H](NC(C)=O)B(O)O Amb24741011 [0,0,0,0,0,1|2,0,1]=4 1168 B8R0.23 C[C@@H](NC(S)=S)C(O)=O Amb25073818 [0,0,0,0,0,1|0,2,0]=3 1169 B8R0.23 C[C@@H](O)C[C@H](N)C(O)=O Amb25162814 [0,0,0,0,0,1|2,0,1]=4 1170 B8R0.23 C[C@@H](O)[C@@H](O)CC(O)=O Amb25267600 [0,0,0,0,0,1|2,0,1]=4 1171 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22168848 [0,0,0,0,0,1|2,0,1]=4 1172 B8R0.23 C[C@@H](O)[C@H](N)CC(O)=O Amb22756696 [0,0,0,0,0,1|2,0,1]=4 1173 B8R0.23 C[C@@H](OC(C)=O)[C@@H](C)O Amb25333442 [0,0,0,0,0,1|2,0,1]=4 1174 B8R0.23 C[C@@H](OC(F)F)C(O)=O Amb24389309 [0,0,0,0,0,1|2,0,1]=4 1175 B8R0.23 C[C@H](C(=O)O)CC(C)C Amb10844071 [0,0,0,0,0,1|2,0,1]=4 1176 B8R0.23 C[C@H](C(=O)O)CN(C)C Amb10844031 [0,0,0,0,0,1|3,0,0]=4 1177 B8R0.23 C[C@H](CC(N)=O)C(N)=O Amb25126983 [0,0,0,0,0,1|2,0,0]=3 1178 B8R0.23 C[C@H](CC(N)=O)C(O)=O Amb25077589 [0,0,0,0,0,1|1,0,0]=2 1179 B8R0.23 C[C@H](CC(O)=O)C(O)=O Amb22225399 [0,0,0,0,0,1|0,0,0]=1 1180 B8R0.23 C[C@H](NC(C)=O)[C@@H](C)O Amb25132762 [0,0,0,0,0,1|2,0,1]=4 1181 B8R0.23 C[C@H](NC(N)=N)C(O)=O Amb24388432 [0,0,0,0,0,1|2,0,0]=3 1182 B8R0.23 C[C@H](NC(N)=O)[C@@H](C)O Amb24562842 [0,0,0,0,0,1|2,0,1]=4 1183 B8R0.23 C[C@H](O)C[C@@H](C)C(O)=O Amb25114249 [0,0,0,0,0,1|1,0,1]=3 1184 B8R0.23 C[C@H](O)C[C@H](N)C(O)=O Amb24461394 [0,0,0,0,0,1|2,0,1]=4 1185 B8R0.23 C[C@H](OC(C)=O)[C@@H](C)O Amb24642757 [0,0,0,0,0,1|2,0,1]=4 1186 B8R0.23 C[C@H](OC(N)=O)C(O)=O Amb24427686 [0,0,0,0,0,1|1,0,0]=2 1187 B8R0.23 C\C(=C/C(C)=C)\C(O)=O Amb24523653 [0,0,0,0,0,1|2,0,1]=4 1188 B8R0.23 C\C(=C/C(C)O)\C(O)=O Amb18642769 [0,0,0,0,0,1|1,0,2]=4 1189 B8R0.23 C\C(=C/C(O)=O)\[C@H](C)O Amb24340136 [0,0,0,0,0,1|1,0,2]=4 1190 B8R0.23 C\C(=C\C(C)O)\C(O)=O Amb24548753 [0,0,0,0,0,1|1,0,2]=4 1191 B8R0.23 C\C(=C\C(N)=O)\C(N)=O Amb25146105 [0,0,0,0,0,1|2,0,1]=4 1192 B8R0.23 C\C(=C\C(N)=O)\C(O)=O Amb25199871 [0,0,0,0,0,1|1,0,1]=3 1193 B8R0.23 C\C(=C\C(O)=O)\C(=N)O Amb24387420 [0,0,0,0,0,1|1,0,1]=3 1194 B8R0.23 C\C(\Cl)=C\C(Cl)C(O)=O Amb24710290 [0,0,0,0,0,1|3,0,0]=4 1195 B8R0.23 NC(=O)C(Br)CC(N)=O Amb24373945 [0,0,0,0,0,1|3,0,0]=4 1196 B8R0.23 NC(=O)C(N)CC(N)=O Amb18289248 [0,0,0,0,0,1|3,0,0]=4 1197 B8R0.23 NC(=O)C(N)CC(O)=O Amb18124347 [0,0,0,0,0,1|2,0,0]=3 1198 B8R0.23 NC(=O)C(O)CC(O)=O Amb25378786 [0,0,0,0,0,1|2,0,0]=3 1199 B8R0.23 NC(=O)CC(=O)C(O)=O Amb25146116 [0,0,0,0,0,1|2,0,1]=4 1200 B8R0.23 NC(=O)C[C@@H](C(=O)N)N Amb16183882 [0,0,0,0,0,1|3,0,0]=4 1201 B8R0.23 NC(=O)C[C@@H](C(=O)O)C Amb10843937 [0,0,0,0,0,1|1,0,0]=2 1202 B8R0.23 NC(=O)C[C@@H](O)C(O)=O Amb24681022 [0,0,0,0,0,1|2,0,0]=3 1203 B8R0.23 NC(=O)C[C@H](Br)C(O)=O Amb25137878 [0,0,0,0,0,1|2,0,0]=3 1204 B8R0.23 NC(=O)C[C@H](C(=O)O)N Amb10071271 [0,0,0,0,0,1|2,0,0]=3 1205 B8R0.23 NC(=O)C[C@H](Cl)C(O)=O Amb24479999 [0,0,0,0,0,1|2,0,0]=3 1206 B8R0.23 NC(=O)C[C@H]([15NH2])C(O)=O Amb22338491 [0,0,0,0,0,1|2,0,0]=3 1207 B8R0.23 NC(=O)NC(=O)C(O)=O Amb18124345 [0,0,0,0,0,1|2,0,1]=4 1208 B8R0.23 NC(=O)NC(N)C(O)=O Amb24418886 [0,0,0,0,0,1|2,0,0]=3 1209 B8R0.23 NC(=O)NC(O)C(O)=O Amb22350130 [0,0,0,0,0,1|2,0,0]=3 1210 B8R0.23 NC(=O)NC(O)C(O)=O Amb24592607 [0,0,0,0,0,1|2,0,0]=3 1211 B8R0.23 NC(=O)[C@@H](N)CC(N)=O Amb22801077 [0,0,0,0,0,1|3,0,0]=4 1212 B8R0.23 NC(=O)[C@@H](N)CC(O)=O Amb19334954 [0,0,0,0,0,1|2,0,0]=3 1213 B8R0.23 NC(=O)[C@@H](O)CC(N)=O Amb24435465 [0,0,0,0,0,1|3,0,0]=4 1214 B8R0.23 NC(=O)[C@H](Br)CC(N)=O Amb24480049 [0,0,0,0,0,1|3,0,0]=4 1215 B8R0.23 NC(=O)\C=C(\Cl)/C(O)=O Amb24540540 [0,0,0,0,0,1|2,0,1]=4 1216 B8R0.23 NC(=S)CC(N)C(O)=O Amb24728838 [0,0,0,0,0,1|2,1,0]=4 1217 B8R0.23 NC(C=C(Cl)Cl)C(O)=O Amb22350718 [0,0,0,0,0,1|3,0,0]=4 1218 B8R0.23 NC(CC(O)=O)C(O)=O Amb22730002 [0,0,0,0,0,1|1,0,0]=2 1219 B8R0.23 NC(CC(O)=O)C([O-])=O Amb20241398 [0,0,0,0,0,1|1,0,1]=3 1220 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22167994 [0,0,0,0,0,1|1,0,1]=3 1221 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22330537 [0,0,0,0,0,1|1,0,1]=3 1222 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22337568 [0,0,0,0,0,1|1,0,1]=3 1223 B8R0.23 NC(CC(O)=O)C([O-])=O Amb22349433 [0,0,0,0,0,1|1,0,1]=3 1224 B8R0.23 NC(CC(O)=O)[13C](O)=O Amb22351321 [0,0,0,0,0,1|1,0,0]=2 1225 B8R0.23 NC(CC([O-])=O)C(O)=O Amb22731484 [0,0,0,0,0,1|1,0,1]=3 1226 B8R0.23 NC(CC([O-])=O)C([O-])=O Amb22168247 [0,0,0,0,0,1|1,0,2]=4 1227 B8R0.23 NC(CS(=O)=O)C(O)=O Amb24480078 [0,0,0,0,0,1|2,0,1]=4 1228 B8R0.23 NC(CS(N)=O)C(O)=O Amb25139436 [0,0,0,0,0,1|3,0,0]=4 1229 B8R0.23 NC(CS(O)=O)C(O)=O Amb21913242 [0,0,0,0,0,1|2,0,0]=3 1230 B8R0.23 NC(C[13C](O)=O)C(O)=O Amb22362630 [0,0,0,0,0,1|1,0,0]=2 1231 B8R0.23 NC(C[13C](O)=O)[13C](O)=O Amb22353605 [0,0,0,0,0,1|1,0,0]=2 1232 B8R0.23 NC(C[N+]([O-])=O)C(O)=O Amb24642660 [0,0,0,0,0,1|2,0,1]=4 1233 B8R0.23 NC([13CH2]C(O)=O)C(O)=O Amb22336729 [0,0,0,0,0,1|1,0,0]=2 1234 B8R0.23 N[13C@@H](CC(O)=O)[13C](O)=O Amb22353606 [0,0,0,0,0,1|1,0,0]=2 1235 B8R0.23 N[13C](=O)[13CH2][13C@H](N)[13C](O)=O Amb22367522 [0,0,0,0,0,1|2,0,0]=3 1236 B8R0.23 N[C@@H](CB(O)O)C(O)=O Amb25844412 [0,0,0,0,0,1|2,0,1]=4 1237 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb20241378 [0,0,0,0,0,1|1,0,1]=3 1238 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22337725 [0,0,0,0,0,1|1,0,1]=3 1239 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22352336 [0,0,0,0,0,1|1,0,1]=3 1240 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22748705 [0,0,0,0,0,1|1,0,1]=3 1241 B8R0.23 N[C@@H](CC(O)=O)C([O-])=O Amb22801032 [0,0,0,0,0,1|1,0,1]=3 1242 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb20240565 [0,0,0,0,0,1|1,0,1]=3 1243 B8R0.23 N[C@@H](CC([O-])=O)C(O)=O Amb22748769 [0,0,0,0,0,1|1,0,1]=3 1244 B8R0.23 N[C@@H](CC([O-])=O)C([O-])=O Amb17772217 [0,0,0,0,0,1|1,0,2]=4 1245 B8R0.23 N[C@@H](CC([O-])=O)C([O-])=O Amb17912733 [0,0,0,0,0,1|1,0,2]=4 1246 B8R0.23 N[C@@H](CC([O-])=O)C([O-])=O Amb22750690 [0,0,0,0,0,1|1,0,2]=4 1247 B8R0.23 N[C@@H](CC([O-])=O)C([O-])=O Amb22757383 [0,0,0,0,0,1|1,0,2]=4 1248 B8R0.23 N[C@@H](C[13C](N)=O)C(O)=O Amb22353613 [0,0,0,0,0,1|2,0,0]=3 1249 B8R0.23 N[C@@H](C[N+]([O-])=O)C(O)=O Amb25710255 [0,0,0,0,0,1|2,0,1]=4 1250 B8R0.23 N[C@@H]([13CH2][13C](O)=O)C(O)=O Amb22367550 [0,0,0,0,0,1|1,0,0]=2 1251 B8R0.23 N[C@H](CC(N)=O)C(O)=O Amb17749060 [0,0,0,0,0,1|2,0,0]=3 1252 B8R0.23 N[C@H](CC(O)=O)P(O)=O Amb25838846 [0,0,0,0,0,1|2,0,0]=3 1253 B8R0.23 N[C@H](CS(O)=O)C(O)=O Amb24366002 [0,0,0,0,0,1|2,0,0]=3 1254 B8R0.23 O=C(Cl)[C@H](Cl)CC(=O)Cl Amb24710716 [0,0,0,0,0,1|3,0,0]=4 1255 B8R0.23 OC(=O)C(=S)CC(O)=O Amb25304511 [0,0,0,0,0,1|1,0,1]=3 1256 B8R0.23 OC(=O)C(Cl)C=C(Cl)Cl Amb24635775 [0,0,0,0,0,1|3,0,0]=4 1257 B8R0.23 OC(=O)C(Cl)CS(O)=O Amb25708099 [0,0,0,0,0,1|2,0,0]=3 1258 B8R0.23 OC(=O)C(F)CC(O)=O Amb25077170 [0,0,0,0,0,1|1,0,0]=2 1259 B8R0.23 OC(=O)C(O)C=C(Cl)Cl Amb24355502 [0,0,0,0,0,1|3,0,0]=4 1260 B8R0.23 OC(=O)C(O)CC(=O)S Amb25690206 [0,0,0,0,0,1|1,1,0]=3 1261 B8R0.23 OC(=O)C(O)CC(O)=O Amb21935660 [0,0,0,0,0,1|1,0,0]=2 1262 B8R0.23 OC(=O)C(S)CC(O)=O Amb22729564 [0,0,0,0,0,1|1,0,0]=2 1263 B8R0.23 OC(=O)CC(=O)C(=O)C Amb17593364 [0,0,0,0,0,1|2,0,1]=4 1264 B8R0.23 OC(=O)CC(C(=O)O)C Amb1935053 [0,0,0,0,0,1|0,0,0]=1 1265 B8R0.23 OC(=O)CC(O)C(=O)Cl Amb25700438 [0,0,0,0,0,1|2,0,0]=3 1266 B8R0.23 OC(=O)CC(O)C(O)=O Amb22734584 [0,0,0,0,0,1|1,0,0]=2 1267 B8R0.23 OC(=O)CC([N+](=O)[O-])O Amb2222216 [0,0,0,0,0,1|2,0,1]=4 1268 B8R0.23 OC(=O)CN(C(=O)C)C Amb1111693 [0,0,0,0,0,1|2,0,0]=3 1269 B8R0.23 OC(=O)CN(C(=O)N)C Amb2371395 [0,0,0,0,0,1|2,0,0]=3 1270 B8R0.23 OC(=O)CN(C(=S)S)C Amb1042470 [0,0,0,0,0,1|1,2,0]=4 1271 B8R0.23 OC(=O)C[C@@H](C(=O)O)N Amb16232085 [0,0,0,0,0,1|1,0,0]=2 1272 B8R0.23 OC(=O)C[C@@H]([C@@H](O)C)N Amb16184021 [0,0,0,0,0,1|2,0,1]=4 1273 B8R0.23 OC(=O)[13CH](O)CC(O)=O Amb22367337 [0,0,0,0,0,1|1,0,0]=2 1274 B8R0.23 OC(=O)[C@@H](Cl)CC(O)=O Amb20242425 [0,0,0,0,0,1|1,0,0]=2 1275 B8R0.23 OC(=O)[C@@H](S)CC(O)=O Amb22504526 [0,0,0,0,0,1|1,0,0]=2 1276 B8R0.23 OC(=O)[C@H](Br)CC(O)=O Amb22504149 [0,0,0,0,0,1|1,0,0]=2 1277 B8R0.23 OC(=O)[C@H](Cl)CC(O)=O Amb20242424 [0,0,0,0,0,1|1,0,0]=2 1278 B8R0.23 OC(=O)[C@H](S)CC(O)=O Amb25124090 [0,0,0,0,0,1|1,0,0]=2 1279 B8R0.23 OC(=O)\C(\Br)=C/C(O)=O Amb25746120 [0,0,0,0,0,1|1,0,1]=3 1280 B8R0.23 OC(=O)\C(\Cl)=C/C(O)=O Amb24481892 [0,0,0,0,0,1|1,0,1]=3 1281 B8R0.23 OC(=O)\C(\F)=C/C(O)=O Amb18124397 [0,0,0,0,0,1|1,0,1]=3 1282 B8R0.23 OC(=O)\C(\I)=C/C(O)=O Amb25736420 [0,0,0,0,0,1|1,0,1]=3 1283 B8R0.23 OC(=O)\C=C(\C(=C)C)/C Amb17593311 [0,0,0,0,0,1|2,0,1]=4 1284 B8R0.23 OC(CC(=O)Cl)C(=O)Cl Amb25680528 [0,0,0,0,0,1|3,0,0]=4 1285 B8R0.23 OC(O)C[C@@H](O)C(O)=O Amb24524214 [0,0,0,0,0,1|1,0,2]=4 1286 B8R0.23 O[13C](=O)[13CH2][13CH]([13C](=O)O)O Amb17616665 [0,0,0,0,0,1|1,0,0]=2 1287 B8R0.23 O[C@@H](CC(=O)Cl)C(=O)Cl Amb25832731 [0,0,0,0,0,1|3,0,0]=4 1288 B8R0.23 [13CH3]N(CC(O)=O)C(N)=N Amb22367286 [0,0,0,0,0,1|3,0,0]=4 1289 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22337484 [0,0,0,0,0,1|2,0,0]=3 1290 B8R0.23 [15NH2]C(=O)C[C@H]([15NH2])C(O)=O Amb22351412 [0,0,0,0,0,1|2,0,0]=3 1291 B8R0.23 [15NH2]C(CC(O)=O)C(O)=O Amb22731529 [0,0,0,0,0,1|1,0,0]=2 1292 B8R0.23 [15NH2][13C@@H]([13CH2][13C](O)=O)[13C](O)=O Amb22353584 [0,0,0,0,0,1|1,0,0]=2 1293 B8R0.23 [15NH2][13CH](CC(O)=O)C(O)=O Amb22351286 [0,0,0,0,0,1|1,0,0]=2 1294 B8R0.23 [15NH2][13C](=O)[13CH2][13C@H]([15NH2])[13C](O)=O Amb22337495 [0,0,0,0,0,1|2,0,0]=3 1295 B8R0.23 [15NH2][C@@H](CC(O)=O)[13C](O)=O Amb22367524 [0,0,0,0,0,1|1,0,0]=2 1296 B8R0.23 [O-]C(=O)C(O)CC([O-])=O Amb22230371 [0,0,0,0,0,1|1,0,2]=4 1297 B8R0.23 [O-]C(=O)C([S-])CC([O-])=O Amb22337769 [0,0,0,0,0,1|1,0,2]=4 1298 B8R0.23 [O-]C(=O)CC(O)C(O)=O Amb22734911 [0,0,0,0,0,1|1,0,1]=3 1299 B8R0.23 [O-]C(=O)[C@@H](O)CC([O-])=O Amb22351833 [0,0,0,0,0,1|1,0,2]=4 1300 B8R0.23 [O-]C(=O)[C@@H](O)CC([O-])=O Amb22801345 [0,0,0,0,0,1|1,0,2]=4 1301 B5R0.1 CC(=O)CC=O Amb17666764 [2,0,0,0,0,0|1,0,0]=3 1302 B5R0.1 CC(=O)CN=O Amb24645582 [2,0,0,0,0,0|2,0,0]=4 1303 B5R0.1 CC(=O)OC=O Amb25283525 [2,0,0,0,0,0|2,0,0]=4 1304 B5R0.1 CCC[13C](O)=O Amb22337992 [2,0,0,0,0,0|1,0,1]=4 1305 B5R0.1 CCC[13C](O)=O Amb22338339 [2,0,0,0,0,0|1,0,1]=4 1306 B5R0.1 CC[13CH2]C(O)=O Amb22367520 [2,0,0,0,0,0|1,0,1]=4 1307 B5R0.1 CC[13CH2][13C](O)=O Amb22351790 [2,0,0,0,0,0|1,0,1]=4 1308 B5R0.1 CS(=O)CC=O Amb25173706 [2,0,0,0,0,0|2,0,0]=4 1309 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|2,0,0]=4 1310 B5R0.1 C[C@@H](O)CC=O Amb24356009 [2,0,0,0,0,0|1,0,1]=4 1311 B5R0.1 N#CCC(O)=O Amb20247050 [2,0,0,0,0,0|1,0,1]=4 1312 B5R0.1 NC(=O)CC=C Amb17610156 [2,0,0,0,0,0|2,0,0]=4 1313 B5R0.1 NC(=O)CC=O Amb25777522 [2,0,0,0,0,0|1,0,0]=3 1314 B5R0.1 NC(=O)CNO Amb25199017 [2,0,0,0,0,0|2,0,0]=4 1315 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|1,0,1]=4 1316 B5R0.1 NOCC(=O)O Amb1154237 [2,0,0,0,0,0|2,0,0]=4 1317 B5R0.1 OC(=O)C=C=O Amb24671304 [2,0,0,0,0,0|0,0,2]=4 1318 B5R0.1 OC(=O)CC=O Amb22169407 [2,0,0,0,0,0|0,0,0]=2 1319 B5R0.1 OC(=O)CCF Amb10603694 [2,0,0,0,0,0|1,0,1]=4 1320 B5R0.1 OC(=O)CI=O Amb25146428 [2,0,0,0,0,0|1,0,0]=3 1321 B5R0.1 OC(=O)CNBr Amb25053433 [2,0,0,0,0,0|2,0,0]=4 1322 B5R0.1 OC(=O)CNCl Amb24653229 [2,0,0,0,0,0|2,0,0]=4 1323 B5R0.1 OC(=O)CNI Amb25216175 [2,0,0,0,0,0|2,0,0]=4 1324 B5R0.1 OC(=O)CSCl Amb24597301 [2,0,0,0,0,0|2,0,0]=4 1325 B5R0.1 OC(=O)C[Hg]Cl Amb22347659 [2,0,0,0,0,0|2,0,0]=4 1326 B5R0.1 OC(=O)\C=C/Br Amb18644453 [2,0,0,0,0,0|1,0,1]=4 1327 B5R0.1 OC(=O)\C=C\F Amb24417763 [2,0,0,0,0,0|1,0,1]=4 1328 B5R0.1 OC(=O)\C=C\I Amb20242758 [2,0,0,0,0,0|1,0,1]=4 1329 B5R0.1 ON=CC(O)=O Amb25046587 [2,0,0,0,0,0|1,0,1]=4 1330 B5R0.1 ONCC(O)=O Amb24120360 [2,0,0,0,0,0|1,0,0]=3 1331 B5R0.1 OP(=O)CC=O Amb25706451 [2,0,0,0,0,0|1,0,0]=3 1332 B5R0.1 O\N=C/C(=O)O Amb10601571 [2,0,0,0,0,0|1,0,1]=4 1333 B5R0.1 O\N=C\C(O)=O Amb20671938 [2,0,0,0,0,0|1,0,1]=4 1334 B5R0.1 [15NH2]C[13CH2][13C](O)=O Amb22353834 [2,0,0,0,0,0|1,0,1]=4 1335 B5R0.1 [15NH2][13CH2][13CH2][13C](O)=O Amb22353457 [2,0,0,0,0,0|1,0,1]=4 1336 B5R0.1 [O-]C(=O)CCO Amb22055495 [2,0,0,0,0,0|0,0,2]=4 1337 B5R0.3 C=CC(F)C=O Amb24552239 [2,0,0,0,0,0|2,0,0]=4 1338 B5R0.3 C=CC(O)C=O Amb25066575 [2,0,0,0,0,0|2,0,0]=4 1339 B5R0.3 C=C[C@H](O)C=O Amb24677118 [2,0,0,0,0,0|2,0,0]=4 1340 B5R0.3 CC(C=C)C=C Amb22337672 [2,0,0,0,0,0|2,0,0]=4 1341 B5R0.3 CC(C=C)C=O Amb25737956 [2,0,0,0,0,0|1,0,0]=3 1342 B5R0.3 CC(C=O)=C=O Amb24478468 [2,0,0,0,0,0|0,0,2]=4 1343 B5R0.3 CC(C=O)=CBr Amb25262258 [2,0,0,0,0,0|1,0,1]=4 1344 B5R0.3 CC(C=O)=CCl Amb24333882 [2,0,0,0,0,0|1,0,1]=4 1345 B5R0.3 CC(C=O)=NO Amb25746939 [2,0,0,0,0,0|1,0,1]=4 1346 B5R0.3 CC(C=O)C#C Amb24557170 [2,0,0,0,0,0|1,0,1]=4 1347 B5R0.3 CC(CBr)C=O Amb24478503 [2,0,0,0,0,0|1,0,1]=4 1348 B5R0.3 CC(CCl)C=O Amb24691518 [2,0,0,0,0,0|1,0,1]=4 1349 B5R0.3 CC(CF)C=O Amb24638421 [2,0,0,0,0,0|1,0,1]=4 1350 B5R0.3 CC(CO)C=C Amb22347861 [2,0,0,0,0,0|1,0,1]=4 1351 B5R0.3 CC(CO)C=O Amb25745800 [2,0,0,0,0,0|0,0,1]=3 1352 B5R0.3 CC(CS)C=O Amb25758635 [2,0,0,0,0,0|0,1,1]=4 1353 B5R0.3 CN(C=O)C=O Amb24098492 [2,0,0,0,0,0|1,0,0]=3 1354 B5R0.3 C[C@@H](CBr)C=O Amb25024867 [2,0,0,0,0,0|1,0,1]=4 1355 B5R0.3 C[C@@H](CO)C=C Amb25145603 [2,0,0,0,0,0|1,0,1]=4 1356 B5R0.3 C[C@@H](CO)C=O Amb24750144 [2,0,0,0,0,0|0,0,1]=3 1357 B5R0.3 C\C(=C/O)\C=O Amb25276378 [2,0,0,0,0,0|0,0,1]=3 1358 B5R0.3 C\C(=C\N)\C=O Amb24090370 [2,0,0,0,0,0|1,0,1]=4 1359 B5R0.3 C\C(\C=C)=C\O Amb25808114 [2,0,0,0,0,0|1,0,1]=4 1360 B5R0.3 C\C(\C=O)=C/Cl Amb25275130 [2,0,0,0,0,0|1,0,1]=4 1361 B5R0.3 C\C(\C=O)=C/I Amb25326015 [2,0,0,0,0,0|1,0,1]=4 1362 B5R0.3 C\C(\C=O)=C\Cl Amb18640380 [2,0,0,0,0,0|1,0,1]=4 1363 B5R0.3 C\C(\C=O)=N/O Amb24478401 [2,0,0,0,0,0|1,0,1]=4 1364 B5R0.3 C\C=C(\C)/C=O Amb24333046 [2,0,0,0,0,0|1,0,1]=4 1365 B5R0.3 NC(C=O)C=O Amb22751007 [2,0,0,0,0,0|1,0,0]=3 1366 B5R0.3 O=CC(=O)C=O Amb17593025 [2,0,0,0,0,0|1,0,1]=4 1367 B5R0.3 O=CC(C=O)Br Amb2455922 [2,0,0,0,0,0|1,0,0]=3 1368 B5R0.3 O=CC(C=O)C Amb17593026 [2,0,0,0,0,0|0,0,0]=2 1369 B5R0.3 O=CC(C=O)O Amb17615780 [2,0,0,0,0,0|1,0,0]=3 1370 B5R0.3 O=CC(F)C=O Amb22230729 [2,0,0,0,0,0|1,0,0]=3 1371 B5R0.3 O=CC(I)C=O Amb24548139 [2,0,0,0,0,0|1,0,0]=3 1372 B5R0.3 O=CN([Na])C=O Amb19884111 [2,0,0,0,0,0|2,0,0]=4 1373 B5R0.3 O=C[C-](F)C=O Amb22008001 [2,0,0,0,0,0|1,0,1]=4 1374 B5R0.3 OC(CO)C=O Amb21618959 [2,0,0,0,0,0|1,0,1]=4 1375 B5R0.3 OCC(Br)C=O Amb18644196 [2,0,0,0,0,0|1,0,1]=4 1376 B5R0.3 OCC(C=O)Cl Amb17593122 [2,0,0,0,0,0|1,0,1]=4 1377 B5R0.3 OC[C@@H](O)C=O Amb20242417 [2,0,0,0,0,0|1,0,1]=4 1378 B5R0.3 O[C@H](C=O)CO Amb16232009 [2,0,0,0,0,0|1,0,1]=4 1379 B5R0.3 O\C=C(/Br)\C=O Amb24478132 [2,0,0,0,0,0|1,0,1]=4 1380 B5R0.3 O\C=C(/I)\C=O Amb25226806 [2,0,0,0,0,0|1,0,1]=4 1381 B5R0.3 O\C=C(\Br)/C=O Amb24333812 [2,0,0,0,0,0|1,0,1]=4 1382 B5R0.3 O\C=C(\O)/C=O Amb22731841 [2,0,0,0,0,0|1,0,1]=4 1383 B5R0.3 O\C=C(\S)/C=O Amb24573083 [2,0,0,0,0,0|1,0,1]=4 1384 B5R0.5 C=C(Br)C(O)=O Amb20620403 [2,0,0,0,0,0|1,0,1]=4 1385 B5R0.5 C=C(Cl)C(O)=O Amb17933971 [2,0,0,0,0,0|1,0,1]=4 1386 B5R0.5 CC(=C)C(=O)F Amb22230833 [2,0,0,0,0,0|1,0,1]=4 1387 B5R0.5 CC(=C)C(O)=O Amb22230681 [2,0,0,0,0,0|0,0,1]=3 1388 B5R0.5 CC(=C)C(O)=O Amb22337777 [2,0,0,0,0,0|0,0,1]=3 1389 B5R0.5 CC(=C)C(O)=O Amb22351305 [2,0,0,0,0,0|0,0,1]=3 1390 B5R0.5 CC(=C)C(O)=O Amb22351871 [2,0,0,0,0,0|0,0,1]=3 1391 B5R0.5 CC(=C)C(O)=O Amb22351927 [2,0,0,0,0,0|0,0,1]=3 1392 B5R0.5 CC(=C)C([O-])=O Amb17943044 [2,0,0,0,0,0|0,0,2]=4 1393 B5R0.5 CC(=C)C([O-])=O Amb20240542 [2,0,0,0,0,0|0,0,2]=4 1394 B5R0.5 CC(=C)C([O-])=O Amb20240585 [2,0,0,0,0,0|0,0,2]=4 1395 B5R0.5 CC(=C)C([O-])=O Amb22045782 [2,0,0,0,0,0|0,0,2]=4 1396 B5R0.5 CC(=C)C([O-])=O Amb22045789 [2,0,0,0,0,0|0,0,2]=4 1397 B5R0.5 CC(=C)C([O-])=O Amb22229881 [2,0,0,0,0,0|0,0,2]=4 1398 B5R0.5 CC(=C)C([O-])=O Amb22230829 [2,0,0,0,0,0|0,0,2]=4 1399 B5R0.5 CC(=C)C([O-])=O Amb22231309 [2,0,0,0,0,0|0,0,2]=4 1400 B5R0.5 CC(=C)C([O-])=O Amb22730162 [2,0,0,0,0,0|0,0,2]=4 1401 B5R0.5 CC(=C)C([O-])=O Amb22730173 [2,0,0,0,0,0|0,0,2]=4 1402 B5R0.5 CC(=C)C([O-])=O Amb22730220 [2,0,0,0,0,0|0,0,2]=4 1403 B5R0.5 CC(=C)C([O-])=O Amb22730616 [2,0,0,0,0,0|0,0,2]=4 1404 B5R0.5 CC(=C)C([O-])=O Amb22732008 [2,0,0,0,0,0|0,0,2]=4 1405 B5R0.5 CC(=C)C([O-])=O Amb22732130 [2,0,0,0,0,0|0,0,2]=4 1406 B5R0.5 CC(=C)C([O-])=O Amb22732965 [2,0,0,0,0,0|0,0,2]=4 1407 B5R0.5 CC(=C)C([O-])=O Amb22733010 [2,0,0,0,0,0|0,0,2]=4 1408 B5R0.5 CC(=C)C([O-])=O Amb22733228 [2,0,0,0,0,0|0,0,2]=4 1409 B5R0.5 CC(=C)C([O-])=O Amb22733283 [2,0,0,0,0,0|0,0,2]=4 1410 B5R0.5 CC(=C)C([O-])=O Amb22733711 [2,0,0,0,0,0|0,0,2]=4 1411 B5R0.5 CC(=C)C([O-])=O Amb22734514 [2,0,0,0,0,0|0,0,2]=4 1412 B5R0.5 CC(=O)C(=C)C Amb17593021 [2,0,0,0,0,0|1,0,1]=4 1413 B5R0.5 CC(=O)C(=O)[13CH3] Amb10072163 [2,0,0,0,0,0|1,0,1]=4 1414 B5R0.5 CC(=O)C(F)C Amb10841897 [2,0,0,0,0,0|2,0,0]=4 1415 B5R0.5 CC(=O)C(N)C Amb17593029 [2,0,0,0,0,0|2,0,0]=4 1416 B5R0.5 CC(=O)C(O)O Amb22436762 [2,0,0,0,0,0|2,0,0]=4 1417 B5R0.5 CC(=O)C([O-])=O Amb22043412 [2,0,0,0,0,0|0,0,2]=4 1418 B5R0.5 CC(=O)C([O-])=O Amb22053857 [2,0,0,0,0,0|0,0,2]=4 1419 B5R0.5 CC(=O)C([O-])=O Amb22167358 [2,0,0,0,0,0|0,0,2]=4 1420 B5R0.5 CC(=O)C([O-])=O Amb22733838 [2,0,0,0,0,0|0,0,2]=4 1421 B5R0.5 CC(=O)N(C)O Amb24066817 [2,0,0,0,0,0|2,0,0]=4 1422 B5R0.5 CC(=O)P(O)=O Amb25368211 [2,0,0,0,0,0|1,0,1]=4 1423 B5R0.5 CC(=O)[13C]([O-])=O Amb22351546 [2,0,0,0,0,0|0,0,2]=4 1424 B5R0.5 CC(Br)C(N)=O Amb22491874 [2,0,0,0,0,0|2,0,0]=4 1425 B5R0.5 CC(Br)[13C](O)=O Amb22351913 [2,0,0,0,0,0|1,0,0]=3 1426 B5R0.5 CC(C(=O)N)C Amb1153145 [2,0,0,0,0,0|1,0,1]=4 1427 B5R0.5 CC(C(=O)N)Cl Amb1151918 [2,0,0,0,0,0|2,0,0]=4 1428 B5R0.5 CC(C(=O)O)F Amb10605770 [2,0,0,0,0,0|1,0,0]=3 1429 B5R0.5 CC(C)C(=O)Br Amb22731066 [2,0,0,0,0,0|1,0,1]=4 1430 B5R0.5 CC(C)C(=O)F Amb25848493 [2,0,0,0,0,0|1,0,1]=4 1431 B5R0.5 CC(C)C([O-])=O Amb22045473 [2,0,0,0,0,0|0,0,2]=4 1432 B5R0.5 CC(C)C([O-])=O Amb22730398 [2,0,0,0,0,0|0,0,2]=4 1433 B5R0.5 CC(C)C([O-])=O Amb22734686 [2,0,0,0,0,0|0,0,2]=4 1434 B5R0.5 CC(Cl)C(=O)Br Amb24602442 [2,0,0,0,0,0|2,0,0]=4 1435 B5R0.5 CC(F)C(=O)Cl Amb24472500 [2,0,0,0,0,0|2,0,0]=4 1436 B5R0.5 CC(I)C(=O)Cl Amb24559615 [2,0,0,0,0,0|2,0,0]=4 1437 B5R0.5 CC(I)C(N)=O Amb25684673 [2,0,0,0,0,0|2,0,0]=4 1438 B5R0.5 CC(N)C(=O)Br Amb25184851 [2,0,0,0,0,0|2,0,0]=4 1439 B5R0.5 CC(N)C(C)=O Amb19148817 [2,0,0,0,0,0|2,0,0]=4 1440 B5R0.5 CC(N)C(N)=O Amb21958673 [2,0,0,0,0,0|2,0,0]=4 1441 B5R0.5 CC(N)P(O)=O Amb25147710 [2,0,0,0,0,0|2,0,0]=4 1442 B5R0.5 CC(N)[13C](O)=O Amb22336671 [2,0,0,0,0,0|1,0,0]=3 1443 B5R0.5 CC(O)C(=C)F Amb25695653 [2,0,0,0,0,0|2,0,0]=4 1444 B5R0.5 CC(O)C(=C)I Amb24736518 [2,0,0,0,0,0|2,0,0]=4 1445 B5R0.5 CC(O)C(=O)Cl Amb25045690 [2,0,0,0,0,0|1,0,0]=3 1446 B5R0.5 CC(O)C(N)=N Amb22587521 [2,0,0,0,0,0|2,0,0]=4 1447 B5R0.5 CC(O)C(N)=S Amb23449309 [2,0,0,0,0,0|1,1,0]=4 1448 B5R0.5 CC(O)C(O)=O Amb22350027 [2,0,0,0,0,0|0,0,0]=2 1449 B5R0.5 CC(O)C(O)Br Amb25274110 [2,0,0,0,0,0|1,0,1]=4 1450 B5R0.5 CC(O)C(O)Cl Amb25147284 [2,0,0,0,0,0|1,0,1]=4 1451 B5R0.5 CC(O)C(O)O Amb24531370 [2,0,0,0,0,0|0,0,2]=4 1452 B5R0.5 CC(O)C([O-])=O Amb17942960 [2,0,0,0,0,0|0,0,1]=3 1453 B5R0.5 CC(O)C([O-])=O Amb17943079 [2,0,0,0,0,0|0,0,1]=3 1454 B5R0.5 CC(O)C([O-])=O Amb20246816 [2,0,0,0,0,0|0,0,1]=3 1455 B5R0.5 CC(O)C([O-])=O Amb21936112 [2,0,0,0,0,0|0,0,1]=3 1456 B5R0.5 CC(O)C([O-])=O Amb22002445 [2,0,0,0,0,0|0,0,1]=3 1457 B5R0.5 CC(O)C([O-])=O Amb22054134 [2,0,0,0,0,0|0,0,1]=3 1458 B5R0.5 CC(O)C([O-])=O Amb22055552 [2,0,0,0,0,0|0,0,1]=3 1459 B5R0.5 CC(O)C([O-])=O Amb22167842 [2,0,0,0,0,0|0,0,1]=3 1460 B5R0.5 CC(O)C([O-])=O Amb22350448 [2,0,0,0,0,0|0,0,1]=3 1461 B5R0.5 CC(O)C([O-])=O Amb22730128 [2,0,0,0,0,0|0,0,1]=3 1462 B5R0.5 CC(O)C([O-])=O Amb22730326 [2,0,0,0,0,0|0,0,1]=3 1463 B5R0.5 CC(O)C([O-])=O Amb22731947 [2,0,0,0,0,0|0,0,1]=3 1464 B5R0.5 CC(O)C([O-])=O Amb22732237 [2,0,0,0,0,0|0,0,1]=3 1465 B5R0.5 CC(O)C([O-])=O Amb22732420 [2,0,0,0,0,0|0,0,1]=3 1466 B5R0.5 CC(O)C([O-])=O Amb22732487 [2,0,0,0,0,0|0,0,1]=3 1467 B5R0.5 CC(O)C([O-])=O Amb22732889 [2,0,0,0,0,0|0,0,1]=3 1468 B5R0.5 CC(O)C([O-])=O Amb22733874 [2,0,0,0,0,0|0,0,1]=3 1469 B5R0.5 CC(O)C([O-])=O Amb22733995 [2,0,0,0,0,0|0,0,1]=3 1470 B5R0.5 CC(O)P(O)=O Amb24333635 [2,0,0,0,0,0|1,0,0]=3 1471 B5R0.5 CC(O)[14C]([O-])=O Amb22362798 [2,0,0,0,0,0|0,0,1]=3 1472 B5R0.5 CC(P)C(N)=O Amb24715877 [2,0,0,0,0,0|2,0,0]=4 1473 B5R0.5 CC([15NH2])C(O)=O Amb22353286 [2,0,0,0,0,0|1,0,0]=3 1474 B5R0.5 CC([C@@H](O)C)O Amb10068424 [2,0,0,0,0,0|1,0,1]=4 1475 B5R0.5 CC([C@H](O)C)O Amb10068423 [2,0,0,0,0,0|1,0,1]=4 1476 B5R0.5 CC([O-])C([O-])=O Amb22045882 [2,0,0,0,0,0|0,0,2]=4 1477 B5R0.5 CN(C)C(O)=O Amb22348477 [2,0,0,0,0,0|1,0,1]=4 1478 B5R0.5 CN(O)C(N)=O Amb22055740 [2,0,0,0,0,0|2,0,0]=4 1479 B5R0.5 C[13C@@H]([15NH2])C(O)=O Amb22363357 [2,0,0,0,0,0|1,0,0]=3 1480 B5R0.5 C[13CH](N)C(O)=O Amb22367246 [2,0,0,0,0,0|1,0,0]=3 1481 B5R0.5 C[13C](=O)C([O-])=O Amb22056112 [2,0,0,0,0,0|0,0,2]=4 1482 B5R0.5 C[13C](=O)[13C](=O)C Amb17610135 [2,0,0,0,0,0|1,0,1]=4 1483 B5R0.5 C[C@@H](Cl)C(=O)F Amb25811184 [2,0,0,0,0,0|2,0,0]=4 1484 B5R0.5 C[C@@H](F)C(O)=O Amb24376099 [2,0,0,0,0,0|1,0,0]=3 1485 B5R0.5 C[C@@H](N)C(C)=O Amb22748924 [2,0,0,0,0,0|2,0,0]=4 1486 B5R0.5 C[C@@H](N)C(C)=O Amb22748925 [2,0,0,0,0,0|2,0,0]=4 1487 B5R0.5 C[C@@H](N)C(N)=O Amb22746786 [2,0,0,0,0,0|2,0,0]=4 1488 B5R0.5 C[C@@H](N)P(O)=O Amb24640370 [2,0,0,0,0,0|2,0,0]=4 1489 B5R0.5 C[C@@H](O)C(C)=C Amb25834912 [2,0,0,0,0,0|2,0,0]=4 1490 B5R0.5 C[C@@H](O)C(C)=O Amb25120774 [2,0,0,0,0,0|1,0,0]=3 1491 B5R0.5 C[C@@H](O)C(N)=N Amb22587056 [2,0,0,0,0,0|2,0,0]=4 1492 B5R0.5 C[C@@H](O)C(O)=O Amb22799466 [2,0,0,0,0,0|0,0,0]=2 1493 B5R0.5 C[C@@H](O)C([O-])=O Amb22350432 [2,0,0,0,0,0|0,0,1]=3 1494 B5R0.5 C[C@@H](O)C([O-])=O Amb22801669 [2,0,0,0,0,0|0,0,1]=3 1495 B5R0.5 C[C@@H](O)P(O)=O Amb25129822 [2,0,0,0,0,0|1,0,0]=3 1496 B5R0.5 C[C@@H](S)C(N)=O Amb25065854 [2,0,0,0,0,0|1,1,0]=4 1497 B5R0.5 C[C@@H]([15NH2])C(O)=O Amb22800337 [2,0,0,0,0,0|1,0,0]=3 1498 B5R0.5 C[C@H](Br)C(=O)Br Amb25780155 [2,0,0,0,0,0|2,0,0]=4 1499 B5R0.5 C[C@H](Br)C(=O)Cl Amb24449131 [2,0,0,0,0,0|2,0,0]=4 1500 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [2,0,0,0,0,0|2,0,0]=4 1501 B5R0.5 C[C@H](Cl)C(O)=O Amb17776586 [2,0,0,0,0,0|1,0,0]=3 1502 B5R0.5 C[C@H](I)C(O)=O Amb25724908 [2,0,0,0,0,0|1,0,0]=3 1503 B5R0.5 C[C@H](N)C(=O)Cl Amb24333765 [2,0,0,0,0,0|2,0,0]=4 1504 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [2,0,0,0,0,0|2,0,0]=4 1505 B5R0.5 C[C@H](N)P(O)=O Amb25101926 [2,0,0,0,0,0|2,0,0]=4 1506 B5R0.5 C[C@H](O)C(C)=C Amb25294556 [2,0,0,0,0,0|2,0,0]=4 1507 B5R0.5 C[C@H](O)C(C)=O Amb24625154 [2,0,0,0,0,0|1,0,0]=3 1508 B5R0.5 C[C@H](O)C(N)=N Amb22587541 [2,0,0,0,0,0|2,0,0]=4 1509 B5R0.5 C[C@H](O)C([O-])=O Amb17772234 [2,0,0,0,0,0|0,0,1]=3 1510 B5R0.5 C[C@H](O)C([O-])=O Amb22338062 [2,0,0,0,0,0|0,0,1]=3 1511 B5R0.5 C[C@H](O)C([O-])=O Amb22369005 [2,0,0,0,0,0|0,0,1]=3 1512 B5R0.5 C[C@H](O)[13C]([O-])=O Amb22353664 [2,0,0,0,0,0|0,0,1]=3 1513 B5R0.5 C[C@H](S)C(O)=O Amb25147510 [2,0,0,0,0,0|0,1,0]=3 1514 B5R0.5 C[C@H]([15NH2])C(O)=O Amb22351686 [2,0,0,0,0,0|1,0,0]=3 1515 B5R0.5 ClC(=O)C(=O)C Amb17593107 [2,0,0,0,0,0|1,0,1]=4 1516 B5R0.5 FC(C(=O)O)F Amb1953492 [2,0,0,0,0,0|2,0,0]=4 1517 B5R0.5 IC(C(=O)O)I Amb17612865 [2,0,0,0,0,0|2,0,0]=4 1518 B5R0.5 NC(=O)C(=O)C Amb17593028 [2,0,0,0,0,0|1,0,1]=4 1519 B5R0.5 NC(=O)C(N)C Amb1156937 [2,0,0,0,0,0|2,0,0]=4 1520 B5R0.5 NC(=O)C(O)O Amb24680574 [2,0,0,0,0,0|2,0,0]=4 1521 B5R0.5 NC(=O)[C@@H](N)C Amb2371522 [2,0,0,0,0,0|2,0,0]=4 1522 B5R0.5 NC(=O)[C@H](N)C Amb2371905 [2,0,0,0,0,0|2,0,0]=4 1523 B5R0.5 NC(Br)C(O)=O Amb25724348 [2,0,0,0,0,0|2,0,0]=4 1524 B5R0.5 NC(O)C(N)=O Amb24478450 [2,0,0,0,0,0|2,0,0]=4 1525 B5R0.5 NC(O)C(O)=O Amb24663706 [2,0,0,0,0,0|1,0,0]=3 1526 B5R0.5 N[C@@H](O)C(N)=O Amb25338621 [2,0,0,0,0,0|2,0,0]=4 1527 B5R0.5 N[C@H](S)C(O)=O Amb25289119 [2,0,0,0,0,0|1,1,0]=4 1528 B5R0.5 OC(=O)C(=O)O Amb10608980 [2,0,0,0,0,0|1,0,1]=4 1529 B5R0.5 OC(=O)C(=O)O Amb19134307 [2,0,0,0,0,0|1,0,1]=4 1530 B5R0.5 OC(=O)C(=O)S Amb25375340 [2,0,0,0,0,0|1,0,1]=4 1531 B5R0.5 OC(=O)C(Br)F Amb10841090 [2,0,0,0,0,0|2,0,0]=4 1532 B5R0.5 OC(=O)C(Cl)Br Amb22002468 [2,0,0,0,0,0|2,0,0]=4 1533 B5R0.5 OC(=O)C(Cl)Cl Amb22338543 [2,0,0,0,0,0|2,0,0]=4 1534 B5R0.5 OC(=O)C(Cl)F Amb10838714 [2,0,0,0,0,0|2,0,0]=4 1535 B5R0.5 OC(=O)C(F)S Amb25272480 [2,0,0,0,0,0|1,1,0]=4 1536 B5R0.5 OC(=O)C(I)Br Amb17610018 [2,0,0,0,0,0|2,0,0]=4 1537 B5R0.5 OC(=O)C(I)Cl Amb17610937 [2,0,0,0,0,0|2,0,0]=4 1538 B5R0.5 OC(=O)C(I)F Amb10838458 [2,0,0,0,0,0|2,0,0]=4 1539 B5R0.5 OC(=O)C(O)=O Amb19374136 [2,0,0,0,0,0|1,0,1]=4 1540 B5R0.5 OC(=O)C(O)=O Amb22002537 [2,0,0,0,0,0|1,0,1]=4 1541 B5R0.5 OC(=O)C(O)=O Amb22231343 [2,0,0,0,0,0|1,0,1]=4 1542 B5R0.5 OC(=O)C(O)=O Amb22352057 [2,0,0,0,0,0|1,0,1]=4 1543 B5R0.5 OC(=O)C(O)=O Amb22353291 [2,0,0,0,0,0|1,0,1]=4 1544 B5R0.5 OC(=O)C(O)=O Amb22360650 [2,0,0,0,0,0|1,0,1]=4 1545 B5R0.5 OC(=O)C(O)=O Amb22360667 [2,0,0,0,0,0|1,0,1]=4 1546 B5R0.5 OC(=O)C(O)=O Amb22363275 [2,0,0,0,0,0|1,0,1]=4 1547 B5R0.5 OC(=O)C(O)=O Amb22363302 [2,0,0,0,0,0|1,0,1]=4 1548 B5R0.5 OC(=O)C(O)=O Amb22394874 [2,0,0,0,0,0|1,0,1]=4 1549 B5R0.5 OC(=O)C(O)=O Amb22436461 [2,0,0,0,0,0|1,0,1]=4 1550 B5R0.5 OC(=O)C(O)=O Amb22731645 [2,0,0,0,0,0|1,0,1]=4 1551 B5R0.5 OC(=O)C(O)=O Amb22731888 [2,0,0,0,0,0|1,0,1]=4 1552 B5R0.5 OC(=O)C(O)=O Amb22897045 [2,0,0,0,0,0|1,0,1]=4 1553 B5R0.5 OC(=O)C(O)=O Amb23412252 [2,0,0,0,0,0|1,0,1]=4 1554 B5R0.5 OC(=O)[13CH](Cl)Cl Amb22336527 [2,0,0,0,0,0|2,0,0]=4 1555 B5R0.5 OC(=O)[C@@H](F)Br Amb25147695 [2,0,0,0,0,0|2,0,0]=4 1556 B5R0.5 OC(=O)[C@H](Cl)Br Amb25857711 [2,0,0,0,0,0|2,0,0]=4 1557 B5R0.5 OC(=O)[C@H](F)I Amb24561039 [2,0,0,0,0,0|2,0,0]=4 1558 B5R0.5 OC(Cl)C(=O)Cl Amb24470096 [2,0,0,0,0,0|2,0,0]=4 1559 B5R0.5 O[13C](=O)C(Br)Br Amb22367565 [2,0,0,0,0,0|2,0,0]=4 1560 B5R0.5 O[13C](=O)C(Cl)Br Amb22367326 [2,0,0,0,0,0|2,0,0]=4 1561 B5R0.5 O[13C](=O)[13C](O)=O Amb22369747 [2,0,0,0,0,0|1,0,1]=4 1562 B5R0.5 O[14C](=O)[14C](O)=O Amb22349945 [2,0,0,0,0,0|1,0,1]=4 1563 B5R0.5 [12CH3][12C@H](N)[12C](O)=O Amb22367004 [2,0,0,0,0,0|1,0,0]=3 1564 B5R0.5 [13CH3]C(=O)C([O-])=O Amb22353396 [2,0,0,0,0,0|0,0,2]=4 1565 B5R0.5 [13CH3]C(N)C(O)=O Amb22351250 [2,0,0,0,0,0|1,0,0]=3 1566 B5R0.5 [13CH3][13CH](N)C(O)=O Amb22338584 [2,0,0,0,0,0|1,0,0]=3 1567 B5R0.5 [13CH3][13CH](N)[13C](O)=O Amb22353501 [2,0,0,0,0,0|1,0,0]=3 1568 B5R0.5 [13CH3][C@@H](O)C([O-])=O Amb22350379 [2,0,0,0,0,0|0,0,1]=3 1569 B5R0.5 [O-]C(=O)C(O)=O Amb20246604 [2,0,0,0,0,0|1,0,1]=4 1570 B5R0.5 [O-]C(=O)C(O)=O Amb22055985 [2,0,0,0,0,0|1,0,1]=4 1571 B5R0.5 [O-]C(=O)C(O)=O Amb22167952 [2,0,0,0,0,0|1,0,1]=4 1572 B5R0.5 [O-]C(=O)C(O)=O Amb22231328 [2,0,0,0,0,0|1,0,1]=4 1573 B7R0.2 C#CC(O)CC(O)=O Amb25737576 [1,1,0,0,0,0|1,0,1]=4 1574 B7R0.2 C=C(CC(O)=O)C#C Amb24568901 [1,1,0,0,0,0|2,0,0]=4 1575 B7R0.2 C=C(CC(O)=O)C=C Amb24561923 [1,1,0,0,0,0|2,0,0]=4 1576 B7R0.2 C=CC(O)CC(O)=O Amb18641866 [1,1,0,0,0,0|1,0,1]=4 1577 B7R0.2 C=C[C@@H](O)CC(O)=O Amb25314661 [1,1,0,0,0,0|1,0,1]=4 1578 B7R0.2 C=C[C@H](O)CC(O)=O Amb25844309 [1,1,0,0,0,0|1,0,1]=4 1579 B7R0.2 CC(=CC(O)=O)C=O Amb25378040 [1,1,0,0,0,0|1,0,1]=4 1580 B7R0.2 CC(=CC(O)=O)OC Amb24699194 [1,1,0,0,0,0|1,0,1]=4 1581 B7R0.2 CC(=O)CC(=O)C#N Amb25328629 [1,1,0,0,0,0|2,0,0]=4 1582 B7R0.2 CC(=O)CC(=O)CBr Amb24442011 [1,1,0,0,0,0|2,0,0]=4 1583 B7R0.2 CC(=O)CC(=O)NN Amb24677298 [1,1,0,0,0,0|2,0,0]=4 1584 B7R0.2 CC(=O)CC(=O)NO Amb24096625 [1,1,0,0,0,0|1,0,0]=3 1585 B7R0.2 CC(=O)CC(=O)SC Amb24097115 [1,1,0,0,0,0|1,1,0]=4 1586 B7R0.2 CC(=O)CC(=S)C=O Amb25142738 [1,1,0,0,0,0|1,1,0]=4 1587 B7R0.2 CC(=O)CC(=S)OC Amb24096829 [1,1,0,0,0,0|1,1,0]=4 1588 B7R0.2 CC(=O)CC(O)C=O Amb24481554 [1,1,0,0,0,0|1,0,1]=4 1589 B7R0.2 CC(=O)NC(=O)OC Amb24657097 [1,1,0,0,0,0|2,0,0]=4 1590 B7R0.2 CC(CC(O)=O)=C=C Amb25265849 [1,1,0,0,0,0|2,0,0]=4 1591 B7R0.2 CC(CC(O)=O)=CCl Amb25802122 [1,1,0,0,0,0|2,0,0]=4 1592 B7R0.2 CC(CC(O)=O)C=O Amb25836603 [1,1,0,0,0,0|1,0,1]=4 1593 B7R0.2 CC(CC(O)=O)CO Amb18198168 [1,1,0,0,0,0|1,0,1]=4 1594 B7R0.2 CC(CO)=CC(O)=O Amb24689918 [1,1,0,0,0,0|1,0,1]=4 1595 B7R0.2 CC(O)CC(=O)CO Amb25116562 [1,1,0,0,0,0|1,0,1]=4 1596 B7R0.2 CCC(=C)CC(O)=O Amb18641782 [1,1,0,0,0,0|2,0,0]=4 1597 B7R0.2 CCC(=O)CC(O)=O Amb18641869 [1,1,0,0,0,0|1,0,0]=3 1598 B7R0.2 CCC(CC(=O)O)O Amb10844270 [1,1,0,0,0,0|1,0,1]=4 1599 B7R0.2 CCC(O)CC(O)=O Amb22363067 [1,1,0,0,0,0|1,0,1]=4 1600 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [1,1,0,0,0,0|2,0,0]=4 1601 B7R0.2 CN(CC(O)=O)C=O Amb18951578 [1,1,0,0,0,0|2,0,0]=4 1602 B7R0.2 CNC(=O)CC(N)=O Amb24400836 [1,1,0,0,0,0|2,0,0]=4 1603 B7R0.2 COC(=O)CC(=O)O Amb16232032 [1,1,0,0,0,0|0,0,0]=2 1604 B7R0.2 COC(=O)CC(N)=N Amb18831173 [1,1,0,0,0,0|2,0,0]=4 1605 B7R0.2 COC(=O)CC(N)=N Amb19516886 [1,1,0,0,0,0|2,0,0]=4 1606 B7R0.2 COC(=O)CC(N)=O Amb22043417 [1,1,0,0,0,0|1,0,0]=3 1607 B7R0.2 COC(=O)CN(=O)=O Amb20621013 [1,1,0,0,0,0|1,0,1]=4 1608 B7R0.2 COC(=O)CS(C)=O Amb20626166 [1,1,0,0,0,0|2,0,0]=4 1609 B7R0.2 COC(=O)NC(=O)Cl Amb24483069 [1,1,0,0,0,0|2,0,0]=4 1610 B7R0.2 CO[C@@H](C)CC(O)=O Amb24481367 [1,1,0,0,0,0|1,0,1]=4 1611 B7R0.2 C[C@@H](CC(O)=O)ON Amb25189045 [1,1,0,0,0,0|1,0,1]=4 1612 B7R0.2 C\C(=C/C(O)=O)\C=O Amb25138216 [1,1,0,0,0,0|1,0,1]=4 1613 B7R0.2 C\C(=C\C(O)=O)\C=O Amb24579433 [1,1,0,0,0,0|1,0,1]=4 1614 B7R0.2 C\C(\CC(C)=O)=N\O Amb24457353 [1,1,0,0,0,0|2,0,0]=4 1615 B7R0.2 C\C(\CC(O)=O)=C\C Amb24481339 [1,1,0,0,0,0|2,0,0]=4 1616 B7R0.2 C\C(\CC(O)=O)=N/O Amb25064289 [1,1,0,0,0,0|1,0,0]=3 1617 B7R0.2 C\C(\CO)=C/C(O)=O Amb18641871 [1,1,0,0,0,0|1,0,1]=4 1618 B7R0.2 C\C=C(\Cl)/CC(O)=O Amb25174797 [1,1,0,0,0,0|2,0,0]=4 1619 B7R0.2 ClCC(=O)CC(=O)Cl Amb17593874 [1,1,0,0,0,0|2,0,0]=4 1620 B7R0.2 NC(CO)=CC(O)=O Amb24628694 [1,1,0,0,0,0|1,0,1]=4 1621 B7R0.2 NNC(=O)CC(=O)N Amb1980864 [1,1,0,0,0,0|2,0,0]=4 1622 B7R0.2 NNC(=O)CC(O)=O Amb25073925 [1,1,0,0,0,0|1,0,0]=3 1623 B7R0.2 N[C@H](CC(O)=O)C=O Amb24643781 [1,1,0,0,0,0|1,0,1]=4 1624 B7R0.2 N[C@H](CC(O)=O)CO Amb22388520 [1,1,0,0,0,0|1,0,1]=4 1625 B7R0.2 N\C(\CC(O)=O)=N/N Amb25281098 [1,1,0,0,0,0|2,0,0]=4 1626 B7R0.2 O=NN(CC(=O)O)C Amb17618622 [1,1,0,0,0,0|2,0,0]=4 1627 B7R0.2 OC(=O)CC(=O)CCl Amb18124484 [1,1,0,0,0,0|1,0,0]=3 1628 B7R0.2 OC(=O)CC(=O)NO Amb24444078 [1,1,0,0,0,0|0,0,0]=2 1629 B7R0.2 OC(=O)CC(F)C=O Amb25114270 [1,1,0,0,0,0|1,0,1]=4 1630 B7R0.2 OC(=O)CN(O)C=O Amb25367291 [1,1,0,0,0,0|1,0,0]=3 1631 B7R0.2 OC(=O)CN(O)N=O Amb25041862 [1,1,0,0,0,0|1,0,0]=3 1632 B7R0.2 OC(=O)\C=C(/Cl)\C=O Amb24452824 [1,1,0,0,0,0|1,0,1]=4 1633 B7R0.2 OC(CCl)CC(O)=O Amb18643354 [1,1,0,0,0,0|1,0,1]=4 1634 B7R0.2 OC[C@@H](CC(=O)O)N Amb16184020 [1,1,0,0,0,0|1,0,1]=4 1635 B7R0.2 OC[C@H](O)CC(O)=O Amb25326979 [1,1,0,0,0,0|0,0,2]=4 1636 B7R0.2 O[C@H](CBr)CC(O)=O Amb22265826 [1,1,0,0,0,0|1,0,1]=4 1637 B7R0.2 [O-]C(=O)CC(O)C=O Amb22733997 [1,1,0,0,0,0|0,0,2]=4 1638 B7R0.2 [O-][N+](=O)CC(=O)OC Amb1101938 [1,1,0,0,0,0|1,0,1]=4 1639 B7R0.9 CC(=O)CP(O)(O)=O Amb24706713 [1,1,0,0,0,0|2,0,0]=4 1640 B7R0.9 CC(=O)CS(O)(=O)=O Amb24751070 [1,1,0,0,0,0|2,0,0]=4 1641 B7R0.9 CP(C)(=O)CC(O)=O Amb25197683 [1,1,0,0,0,0|2,0,0]=4 1642 B7R0.9 NC(=O)CP(O)(O)=O Amb24481466 [1,1,0,0,0,0|2,0,0]=4 1643 B7R0.9 OC(=O)CC(O)(C)C Amb10605560 [1,1,0,0,0,0|1,0,1]=4 1644 B7R0.9 OC(=O)CS(=O)(=O)O Amb16232248 [1,1,0,0,0,0|1,0,0]=3 1645 B7R0.9 [O-]C(=O)C[As]([O-])(O)=O Amb21618903 [1,1,0,0,0,0|1,0,1]=4 1646 B7R0.5 C=CCC(Br)C(O)=O Amb18648213 [1,1,0,0,0,0|2,0,0]=4 1647 B7R0.5 C=CCC(Cl)C(O)=O Amb25056173 [1,1,0,0,0,0|2,0,0]=4 1648 B7R0.5 C=CCC(N)C(O)=O Amb21856826 [1,1,0,0,0,0|2,0,0]=4 1649 B7R0.5 C=CC[C@@H](F)C(O)=O Amb24481338 [1,1,0,0,0,0|2,0,0]=4 1650 B7R0.5 C=CC[C@@H](N)C(O)=O Amb22745310 [1,1,0,0,0,0|2,0,0]=4 1651 B7R0.5 C=CC[C@@H](O)C(O)=O Amb24548731 [1,1,0,0,0,0|2,0,0]=4 1652 B7R0.5 CC#CC(C)C(O)=O Amb22748425 [1,1,0,0,0,0|1,0,1]=4 1653 B7R0.5 CC(=C=CC)C(O)=O Amb24481354 [1,1,0,0,0,0|1,0,1]=4 1654 B7R0.5 CC(=CC#N)C(O)=O Amb24475374 [1,1,0,0,0,0|1,0,1]=4 1655 B7R0.5 CC(=CC=O)C(N)=O Amb24548847 [1,1,0,0,0,0|1,0,1]=4 1656 B7R0.5 CC(=CCBr)C(O)=O Amb24551921 [1,1,0,0,0,0|1,0,1]=4 1657 B7R0.5 CC(=CCCl)C(O)=O Amb25114258 [1,1,0,0,0,0|1,0,1]=4 1658 B7R0.5 CC(=CCN)C(O)=O Amb25845292 [1,1,0,0,0,0|1,0,1]=4 1659 B7R0.5 CC(=CCO)C(O)=O Amb24730294 [1,1,0,0,0,0|0,0,1]=3 1660 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [1,1,0,0,0,0|2,0,0]=4 1661 B7R0.5 CC(=O)[C@@H](O)CC=O Amb25839860 [1,1,0,0,0,0|2,0,0]=4 1662 B7R0.5 CC(=O)\C(\C)=C/C=O Amb18641685 [1,1,0,0,0,0|1,0,1]=4 1663 B7R0.5 CC(C(=O)C)CCO Amb13881368 [1,1,0,0,0,0|1,0,1]=4 1664 B7R0.5 CC(C(=O)O)CC#N Amb17334056 [1,1,0,0,0,0|1,0,1]=4 1665 B7R0.5 CC(C(=O)O)CNC Amb13952364 [1,1,0,0,0,0|1,0,1]=4 1666 B7R0.5 CC(C=NO)C(O)=O Amb24616398 [1,1,0,0,0,0|0,0,0]=2 1667 B7R0.5 CC(CC#C)C(O)=O Amb18633959 [1,1,0,0,0,0|1,0,1]=4 1668 B7R0.5 CC(CC=C)C(=O)Cl Amb25702960 [1,1,0,0,0,0|2,0,0]=4 1669 B7R0.5 CC(CC=C)C(C)=O Amb19373098 [1,1,0,0,0,0|2,0,0]=4 1670 B7R0.5 CC(CC=O)C(C)=O Amb18641772 [1,1,0,0,0,0|1,0,0]=3 1671 B7R0.5 CC(CCF)C(O)=O Amb24678386 [1,1,0,0,0,0|1,0,1]=4 1672 B7R0.5 CC(CCN)C(O)=O Amb20667970 [1,1,0,0,0,0|1,0,1]=4 1673 B7R0.5 CC(CCO)C(O)=O Amb18641949 [1,1,0,0,0,0|0,0,1]=3 1674 B7R0.5 CC(CCS)C(O)=O Amb25133689 [1,1,0,0,0,0|0,1,1]=4 1675 B7R0.5 CC(NC=O)C(C)=O Amb23442778 [1,1,0,0,0,0|1,0,0]=3 1676 B7R0.5 CC(NC=O)C(C)O Amb25347778 [1,1,0,0,0,0|1,0,1]=4 1677 B7R0.5 CC(NC=O)C(N)=O Amb24533730 [1,1,0,0,0,0|1,0,0]=3 1678 B7R0.5 CC(NC=O)C(N)=S Amb25299165 [1,1,0,0,0,0|1,1,0]=4 1679 B7R0.5 CC(SC#N)C(O)=O Amb24372688 [1,1,0,0,0,0|1,0,1]=4 1680 B7R0.5 CCN[C@H](C)C(O)=O Amb24351099 [1,1,0,0,0,0|1,0,1]=4 1681 B7R0.5 CCO[C@H](C)C(O)=O Amb24660035 [1,1,0,0,0,0|1,0,1]=4 1682 B7R0.5 CCS[C@@H](C)C(O)=O Amb25083211 [1,1,0,0,0,0|1,0,1]=4 1683 B7R0.5 CCS[C@H](C)C(O)=O Amb25259517 [1,1,0,0,0,0|1,0,1]=4 1684 B7R0.5 CNNC(C)C(O)=O Amb24070183 [1,1,0,0,0,0|2,0,0]=4 1685 B7R0.5 COCC(C(=O)O)Br Amb17594709 [1,1,0,0,0,0|1,0,1]=4 1686 B7R0.5 COCC(C(=O)O)Cl Amb10068384 [1,1,0,0,0,0|1,0,1]=4 1687 B7R0.5 COCC(C)C(C)=O Amb24683449 [1,1,0,0,0,0|1,0,1]=4 1688 B7R0.5 COCC(C)S(O)=O Amb25280974 [1,1,0,0,0,0|1,0,1]=4 1689 B7R0.5 COCC(F)C(O)=O Amb24526772 [1,1,0,0,0,0|1,0,1]=4 1690 B7R0.5 COCC(O)C(O)=O Amb18124273 [1,1,0,0,0,0|1,0,1]=4 1691 B7R0.5 COC[C@@H](N)C(O)=O Amb22744762 [1,1,0,0,0,0|1,0,1]=4 1692 B7R0.5 COC[C@@H](O)C(O)=O Amb25829059 [1,1,0,0,0,0|1,0,1]=4 1693 B7R0.5 COC[C@H](C(=O)O)N Amb10604051 [1,1,0,0,0,0|1,0,1]=4 1694 B7R0.5 CO\C=C(\Cl)/C(O)=O Amb24385677 [1,1,0,0,0,0|1,0,1]=4 1695 B7R0.5 CO\C=C(\F)/C(O)=O Amb22641708 [1,1,0,0,0,0|1,0,1]=4 1696 B7R0.5 CSCC(C)C(O)=O Amb18967825 [1,1,0,0,0,0|0,1,1]=4 1697 B7R0.5 CSSC(C)C(O)=O Amb25701741 [1,1,0,0,0,0|1,1,0]=4 1698 B7R0.5 C[C@@H](C(=O)O)CC#C Amb10844029 [1,1,0,0,0,0|1,0,1]=4 1699 B7R0.5 C[C@@H](C(=O)O)CC=C Amb10844040 [1,1,0,0,0,0|1,0,0]=3 1700 B7R0.5 C[C@@H](C(=O)O)CCC Amb10844028 [1,1,0,0,0,0|1,0,1]=4 1701 B7R0.5 C[C@@H](CC=C)C(N)=O Amb25232867 [1,1,0,0,0,0|2,0,0]=4 1702 B7R0.5 C[C@@H](CCS)C(O)=O Amb25786376 [1,1,0,0,0,0|0,1,1]=4 1703 B7R0.5 C[C@@H](NC=O)C(O)=O Amb22746684 [1,1,0,0,0,0|0,0,0]=2 1704 B7R0.5 C[C@@H](NON)C(O)=O Amb24409085 [1,1,0,0,0,0|1,0,0]=3 1705 B7R0.5 C[C@H](C(=O)O)CC#C Amb10844036 [1,1,0,0,0,0|1,0,1]=4 1706 B7R0.5 C[C@H](C(=O)O)CC=C Amb10844033 [1,1,0,0,0,0|1,0,0]=3 1707 B7R0.5 C[C@H](C(=O)O)CCC Amb10844037 [1,1,0,0,0,0|1,0,1]=4 1708 B7R0.5 C[C@H](C(=O)O)CCN Amb10844043 [1,1,0,0,0,0|1,0,1]=4 1709 B7R0.5 C[C@H](C(=O)O)COC Amb10844266 [1,1,0,0,0,0|0,0,1]=3 1710 B7R0.5 C[C@H](CC#N)C(O)=O Amb24725603 [1,1,0,0,0,0|1,0,1]=4 1711 B7R0.5 C[C@H](CCO)C(O)=O Amb24483065 [1,1,0,0,0,0|0,0,1]=3 1712 B7R0.5 C[C@H](N=[N+]=[N-])C(O)=O Amb25274282 [1,1,0,0,0,0|2,0,0]=4 1713 B7R0.5 C[C@H](NCO)C(O)=O Amb24401217 [1,1,0,0,0,0|0,0,1]=3 1714 B7R0.5 C[C@H](SC#N)C(O)=O Amb24333429 [1,1,0,0,0,0|1,0,1]=4 1715 B7R0.5 C\C(=C/C#C)\C(O)=O Amb24472639 [1,1,0,0,0,0|1,0,1]=4 1716 B7R0.5 C\C(=C/C=C)\C(O)=O Amb25258956 [1,1,0,0,0,0|1,0,1]=4 1717 B7R0.5 C\C(=C/CBr)\C(O)=O Amb24433947 [1,1,0,0,0,0|1,0,1]=4 1718 B7R0.5 C\C(=C/CCl)\C(O)=O Amb25844891 [1,1,0,0,0,0|1,0,1]=4 1719 B7R0.5 C\C(=C/CO)\C(C)=O Amb25188393 [1,1,0,0,0,0|1,0,1]=4 1720 B7R0.5 C\C(=C/CO)\C(O)=O Amb18641873 [1,1,0,0,0,0|0,0,1]=3 1721 B7R0.5 C\C(=C/OC)\C(C)=O Amb24691706 [1,1,0,0,0,0|1,0,1]=4 1722 B7R0.5 C\C(=C/OC)\C(O)=O Amb18641867 [1,1,0,0,0,0|0,0,1]=3 1723 B7R0.5 C\C(=C\OC)\C(N)=O Amb25323795 [1,1,0,0,0,0|1,0,1]=4 1724 B7R0.5 C\C=C\C(C)C(N)=O Amb25299936 [1,1,0,0,0,0|2,0,0]=4 1725 B7R0.5 C\C=C\C(C)C(O)=O Amb18641786 [1,1,0,0,0,0|1,0,0]=3 1726 B7R0.5 C\C=C\C(N)C(O)=O Amb24481451 [1,1,0,0,0,0|2,0,0]=4 1727 B7R0.5 C\C=C\C(O)C(O)=O Amb24481382 [1,1,0,0,0,0|2,0,0]=4 1728 B7R0.5 C\C=C\[C@@H](C)C(O)=O Amb25719907 [1,1,0,0,0,0|1,0,0]=3 1729 B7R0.5 C\C=C\[C@H](C)C(O)=O Amb24481336 [1,1,0,0,0,0|1,0,0]=3 1730 B7R0.5 NC(CS=O)C(O)=O Amb24557184 [1,1,0,0,0,0|1,0,1]=4 1731 B7R0.5 NC(CSO)C(O)=O Amb24746797 [1,1,0,0,0,0|1,0,1]=4 1732 B7R0.5 NC(\C=C\Cl)C(O)=O Amb24483058 [1,1,0,0,0,0|2,0,0]=4 1733 B7R0.5 NOCC(N)C(O)=O Amb24184086 [1,1,0,0,0,0|1,0,1]=4 1734 B7R0.5 NOC[C@@H](N)C(O)=O Amb25791301 [1,1,0,0,0,0|1,0,1]=4 1735 B7R0.5 NOC[C@H](N)C(O)=O Amb24548229 [1,1,0,0,0,0|1,0,1]=4 1736 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22746780 [1,1,0,0,0,0|1,0,0]=3 1737 B7R0.5 N[C@@H](CC=O)C(O)=O Amb22748768 [1,1,0,0,0,0|1,0,0]=3 1738 B7R0.5 N[C@@H](CCO)C(O)=O Amb20242705 [1,1,0,0,0,0|1,0,1]=4 1739 B7R0.5 N[C@@H](CNO)C(O)=O Amb24481412 [1,1,0,0,0,0|1,0,1]=4 1740 B7R0.5 N[C@@H](CO[SiH3])C(O)=O Amb24526864 [1,1,0,0,0,0|1,0,1]=4 1741 B7R0.5 N[C@@H](CSO)C(O)=O Amb24481432 [1,1,0,0,0,0|1,0,1]=4 1742 B7R0.5 N[C@H](C(=O)O)CC=C Amb10982568 [1,1,0,0,0,0|2,0,0]=4 1743 B7R0.5 N[C@H](CNO)C(O)=O Amb24745929 [1,1,0,0,0,0|1,0,1]=4 1744 B7R0.5 N[C@H](\C=C\Cl)C(O)=O Amb25230190 [1,1,0,0,0,0|2,0,0]=4 1745 B7R0.5 O=CCC(C(=O)O)N Amb16232081 [1,1,0,0,0,0|1,0,0]=3 1746 B7R0.5 O=CCN(C(=O)C)C Amb17080668 [1,1,0,0,0,0|2,0,0]=4 1747 B7R0.5 O=CNC(C(=O)O)C Amb1144629 [1,1,0,0,0,0|0,0,0]=2 1748 B7R0.5 OC(=O)C(=O)\C=C\O Amb24699120 [1,1,0,0,0,0|1,0,1]=4 1749 B7R0.5 OC(=O)C(O)=CC=O Amb25339531 [1,1,0,0,0,0|1,0,1]=4 1750 B7R0.5 OC(=O)\C(\Br)=C/CO Amb24692651 [1,1,0,0,0,0|1,0,1]=4 1751 B7R0.5 OC(=O)\C(\Br)=C\C=O Amb25242509 [1,1,0,0,0,0|1,0,1]=4 1752 B7R0.5 OC(=O)\C(\Cl)=C/CO Amb24598039 [1,1,0,0,0,0|1,0,1]=4 1753 B7R0.5 OC(=O)\C(\F)=C/CO Amb25737076 [1,1,0,0,0,0|1,0,1]=4 1754 B7R0.5 OC(=O)\C(\O)=C\C=O Amb25082413 [1,1,0,0,0,0|1,0,1]=4 1755 B7R0.5 OC(CC=O)C(O)=O Amb25225249 [1,1,0,0,0,0|1,0,0]=3 1756 B7R0.5 OCCC(O)C(O)=O Amb24689942 [1,1,0,0,0,0|1,0,1]=4 1757 B7R0.5 O[15NH]CC(C(=O)O)N Amb17608097 [1,1,0,0,0,0|1,0,1]=4 1758 B7R0.10 CC(=CN)C(=O)OC Amb24568871 [1,1,0,0,0,0|1,0,1]=4 1759 B7R0.10 CC(C#N)C(=O)NO Amb25106145 [1,1,0,0,0,0|1,0,1]=4 1760 B7R0.10 CC(C(=O)OC)C#N Amb17210509 [1,1,0,0,0,0|1,0,1]=4 1761 B7R0.10 CC(C(=O)OC)CN Amb13952562 [1,1,0,0,0,0|1,0,1]=4 1762 B7R0.10 CC(C=C)C(=O)C=C Amb24619641 [1,1,0,0,0,0|2,0,0]=4 1763 B7R0.10 CC(C=O)C(Br)=CCl Amb24711443 [1,1,0,0,0,0|2,0,0]=4 1764 B7R0.10 CC(C=O)C(C)=CCl Amb24474448 [1,1,0,0,0,0|2,0,0]=4 1765 B7R0.10 CC(C=O)C(C)C=O Amb18641795 [1,1,0,0,0,0|1,0,1]=4 1766 B7R0.10 CC(C=O)C(O)C=C Amb24481507 [1,1,0,0,0,0|1,0,1]=4 1767 B7R0.10 CC(C=O)N(C)C=O Amb24728434 [1,1,0,0,0,0|2,0,0]=4 1768 B7R0.10 CC(C=O)[C@H](O)CC Amb25827452 [1,1,0,0,0,0|1,0,1]=4 1769 B7R0.10 CC(C=O)\C(\Cl)=C\Br Amb24533514 [1,1,0,0,0,0|2,0,0]=4 1770 B7R0.10 CC(CCl)C(=O)NO Amb24659587 [1,1,0,0,0,0|1,0,1]=4 1771 B7R0.10 CC(CO)C(=C)CO Amb25832740 [1,1,0,0,0,0|1,0,1]=4 1772 B7R0.10 CC(CO)C(=O)C=C Amb25370664 [1,1,0,0,0,0|1,0,1]=4 1773 B7R0.10 CC(CO)N(O)N=O Amb24367422 [1,1,0,0,0,0|1,0,1]=4 1774 B7R0.10 CC(OC)C(C)C=O Amb18641882 [1,1,0,0,0,0|1,0,1]=4 1775 B7R0.10 CCC(=C)C(C)C=O Amb18641703 [1,1,0,0,0,0|2,0,0]=4 1776 B7R0.10 CCC(=O)C(C)C=O Amb18641776 [1,1,0,0,0,0|1,0,0]=3 1777 B7R0.10 CCC(=O)C(C)CO Amb25371915 [1,1,0,0,0,0|1,0,1]=4 1778 B7R0.10 CCC(C(C=O)C)O Amb17593201 [1,1,0,0,0,0|1,0,1]=4 1779 B7R0.10 CCC(C)C(=O)CO Amb24680373 [1,1,0,0,0,0|1,0,1]=4 1780 B7R0.10 CC[C@@H](C)C(=O)OC Amb24549105 [1,1,0,0,0,0|1,0,1]=4 1781 B7R0.10 CNC(=O)C(C)NO Amb25131329 [1,1,0,0,0,0|2,0,0]=4 1782 B7R0.10 CNC(=O)[C@@H](C)NO Amb25703163 [1,1,0,0,0,0|2,0,0]=4 1783 B7R0.10 CNC(=O)[C@H](C)NO Amb24659614 [1,1,0,0,0,0|2,0,0]=4 1784 B7R0.10 CNC(C)C(=O)OC Amb18299580 [1,1,0,0,0,0|2,0,0]=4 1785 B7R0.10 CNC(C)C(=O)OC Amb21961535 [1,1,0,0,0,0|2,0,0]=4 1786 B7R0.10 CN[C@@H](C)C(=O)OC Amb22587553 [1,1,0,0,0,0|2,0,0]=4 1787 B7R0.10 CN[C@@H](C)C(=O)OC Amb22745401 [1,1,0,0,0,0|2,0,0]=4 1788 B7R0.10 CN[C@H](C)C(=O)OC Amb22587562 [1,1,0,0,0,0|2,0,0]=4 1789 B7R0.10 COC(=N)C(N)C=O Amb25340734 [1,1,0,0,0,0|2,0,0]=4 1790 B7R0.10 COC(=O)C(/C)=C\O Amb17778951 [1,1,0,0,0,0|0,0,1]=3 1791 B7R0.10 COC(=O)C(=O)C=O Amb24415603 [1,1,0,0,0,0|1,0,1]=4 1792 B7R0.10 COC(=O)C(Br)C=C Amb24483227 [1,1,0,0,0,0|2,0,0]=4 1793 B7R0.10 COC(=O)C(Br)CO Amb22491520 [1,1,0,0,0,0|1,0,1]=4 1794 B7R0.10 COC(=O)C(C)C#C Amb20171370 [1,1,0,0,0,0|1,0,1]=4 1795 B7R0.10 COC(=O)C(C)C=O Amb18641861 [1,1,0,0,0,0|0,0,0]=2 1796 B7R0.10 COC(=O)C(C)CBr Amb23440928 [1,1,0,0,0,0|1,0,1]=4 1797 B7R0.10 COC(=O)C(C)CI Amb25114121 [1,1,0,0,0,0|1,0,1]=4 1798 B7R0.10 COC(=O)C(C)CS Amb17673607 [1,1,0,0,0,0|0,1,1]=4 1799 B7R0.10 COC(=O)C(C)NN Amb24367186 [1,1,0,0,0,0|2,0,0]=4 1800 B7R0.10 COC(=O)C(C)SC Amb22043309 [1,1,0,0,0,0|2,0,0]=4 1801 B7R0.10 COC(=O)C(C=O)Cl Amb17621536 [1,1,0,0,0,0|1,0,0]=3 1802 B7R0.10 COC(=O)C(CO)Cl Amb10605503 [1,1,0,0,0,0|1,0,1]=4 1803 B7R0.10 COC(=O)C(Cl)=CO Amb25847918 [1,1,0,0,0,0|1,0,1]=4 1804 B7R0.10 COC(=O)C(F)CO Amb22235114 [1,1,0,0,0,0|1,0,1]=4 1805 B7R0.10 COC(=O)C(N)C=C Amb24427259 [1,1,0,0,0,0|2,0,0]=4 1806 B7R0.10 COC(=O)C(N)CO Amb22489451 [1,1,0,0,0,0|1,0,1]=4 1807 B7R0.10 COC(=O)C(O)C=C Amb22734006 [1,1,0,0,0,0|2,0,0]=4 1808 B7R0.10 COC(=O)[C@@H](C)C=O Amb25107069 [1,1,0,0,0,0|0,0,0]=2 1809 B7R0.10 COC(=O)[C@@H](C)CBr Amb22225306 [1,1,0,0,0,0|1,0,1]=4 1810 B7R0.10 COC(=O)[C@@H](C)CI Amb23437667 [1,1,0,0,0,0|1,0,1]=4 1811 B7R0.10 COC(=O)[C@@H](C)NN Amb24117928 [1,1,0,0,0,0|2,0,0]=4 1812 B7R0.10 COC(=O)[C@@H](C)NN Amb24377162 [1,1,0,0,0,0|2,0,0]=4 1813 B7R0.10 COC(=O)[C@@H](Cl)CO Amb24739681 [1,1,0,0,0,0|1,0,1]=4 1814 B7R0.10 COC(=O)[C@@H](N)C=C Amb25127988 [1,1,0,0,0,0|2,0,0]=4 1815 B7R0.10 COC(=O)[C@@H](O)CO Amb22226736 [1,1,0,0,0,0|1,0,1]=4 1816 B7R0.10 COC(=O)[C@H](C)CN Amb25317379 [1,1,0,0,0,0|1,0,1]=4 1817 B7R0.10 COC(=O)[C@H](C)NN Amb25115282 [1,1,0,0,0,0|2,0,0]=4 1818 B7R0.10 COC(=O)[C@H](C)ON Amb24439736 [1,1,0,0,0,0|2,0,0]=4 1819 B7R0.10 COC(=O)[C@H](N)C=C Amb24376395 [1,1,0,0,0,0|2,0,0]=4 1820 B7R0.10 C[C@@H](C(=O)OC)CBr Amb10844721 [1,1,0,0,0,0|1,0,1]=4 1821 B7R0.10 C[C@@H](C(=O)OC)CO Amb17615446 [1,1,0,0,0,0|0,0,1]=3 1822 B7R0.10 C[C@@H](C=O)[C@@H](C)C=O Amb25827162 [1,1,0,0,0,0|1,0,1]=4 1823 B7R0.10 C[C@@H](C=O)[C@H](O)CC Amb25223087 [1,1,0,0,0,0|1,0,1]=4 1824 B7R0.10 C[C@@H](OC)[C@@H](C)C=O Amb25372033 [1,1,0,0,0,0|1,0,1]=4 1825 B7R0.10 C[C@H](C(=O)OC)CO Amb17615445 [1,1,0,0,0,0|0,0,1]=3 1826 B7R0.10 C[C@H](C=O)C(O)CC Amb25294541 [1,1,0,0,0,0|1,0,1]=4 1827 B7R0.10 C[C@H](C=O)[C@@H](C)C=O Amb25827161 [1,1,0,0,0,0|1,0,1]=4 1828 B7R0.10 C[C@H](C=O)[C@@H](C)CO Amb24418439 [1,1,0,0,0,0|1,0,1]=4 1829 B7R0.10 C[C@H](C=O)[C@@H](O)C=O Amb24502787 [1,1,0,0,0,0|0,0,1]=3 1830 B7R0.10 C[C@H](C=O)[C@H](C)C=O Amb24482506 [1,1,0,0,0,0|1,0,1]=4 1831 B7R0.10 C[C@H](C=O)[C@H](O)CC Amb25780605 [1,1,0,0,0,0|1,0,1]=4 1832 B7R0.10 C[C@H](OC)[C@@H](C)C=O Amb24741787 [1,1,0,0,0,0|1,0,1]=4 1833 B7R0.10 C[C@H](OC)[C@H](C)C=O Amb24759162 [1,1,0,0,0,0|1,0,1]=4 1834 B7R0.10 C\C(=C/Cl)\C(=O)OC Amb24482370 [1,1,0,0,0,0|1,0,1]=4 1835 B7R0.10 C\C(=C/N)\C(=O)OC Amb25757852 [1,1,0,0,0,0|1,0,1]=4 1836 B7R0.10 C\C(=C/O)\C(=O)CC Amb25371844 [1,1,0,0,0,0|1,0,1]=4 1837 B7R0.10 C\C(=C\C)\C(=O)OC Amb19930194 [1,1,0,0,0,0|1,0,1]=4 1838 B7R0.10 C\C(=N/O)\C(=O)CO Amb24676551 [1,1,0,0,0,0|1,0,1]=4 1839 B7R0.10 C\C(\C=O)=C(\C)/C=O Amb25758523 [1,1,0,0,0,0|1,0,1]=4 1840 B7R0.10 NC(CO)C(=O)NO Amb22352399 [1,1,0,0,0,0|1,0,1]=4 1841 B7R0.10 NC(CO)C(=O)OBr Amb25102550 [1,1,0,0,0,0|1,0,1]=4 1842 B7R0.10 N[C@@H](CO)C(=O)OBr Amb24665775 [1,1,0,0,0,0|1,0,1]=4 1843 B7R0.10 N[C@H](CO)C(=O)NO Amb24555900 [1,1,0,0,0,0|1,0,1]=4 1844 B7R0.10 OC(C=O)=C(Br)C=O Amb24611575 [1,1,0,0,0,0|1,0,1]=4 1845 B7R0.10 ONC(\C(=N/O)\C)C Amb2226895 [1,1,0,0,0,0|2,0,0]=4 1846 B7R0.10 O[C@@H](C=O)[C@@H](O)C=O Amb25309636 [1,1,0,0,0,0|1,0,1]=4 1847 B7R0.10 O[C@@H](CO)C(=O)CO Amb22337027 [1,1,0,0,0,0|1,0,1]=4 1848 B7R0.10 O[C@H](C=O)[C@@H](O)C=O Amb25046496 [1,1,0,0,0,0|1,0,1]=4 1849 B7R0.10 O[C@H](C=O)[C@H](O)C=O Amb24482037 [1,1,0,0,0,0|1,0,1]=4 1850 B7R0.10 O[C@H](CO)C(=O)CO Amb24628483 [1,1,0,0,0,0|1,0,1]=4 1851 B7R0.10 [C-]#[N+][C@@H](C)C(=O)OC Amb25175826 [1,1,0,0,0,0|2,0,0]=4 1852 B7R0.13 C=CC(C(=O)C)(C)C Amb17593169 [1,1,0,0,0,0|2,0,0]=4 1853 B7R0.13 CC(=C)C(C)(O)C=O Amb25142946 [1,1,0,0,0,0|2,0,0]=4 1854 B7R0.13 CC(=O)C(C)(C)C=O Amb18641788 [1,1,0,0,0,0|1,0,0]=3 1855 B7R0.13 CC(=O)C(C)(C)CO Amb24691506 [1,1,0,0,0,0|1,0,1]=4 1856 B7R0.13 CC(=O)C(C)(C)N=O Amb24457952 [1,1,0,0,0,0|2,0,0]=4 1857 B7R0.13 CC(=O)C(C)(C)NO Amb22734768 [1,1,0,0,0,0|2,0,0]=4 1858 B7R0.13 CC(=O)C(C)(C)NO Amb25322857 [1,1,0,0,0,0|2,0,0]=4 1859 B7R0.13 CC(=O)C(C)(Cl)CO Amb24752373 [1,1,0,0,0,0|1,0,1]=4 1860 B7R0.13 CC(=O)C(C)(N)CO Amb25765120 [1,1,0,0,0,0|1,0,1]=4 1861 B7R0.13 CC(=O)C(C)(O)C=C Amb25798379 [1,1,0,0,0,0|2,0,0]=4 1862 B7R0.13 CC(=O)C(C)(O)NO Amb25231984 [1,1,0,0,0,0|2,0,0]=4 1863 B7R0.13 CC(=O)C(C)(S)N=O Amb25032218 [1,1,0,0,0,0|2,0,0]=4 1864 B7R0.13 CC(=O)[C@](C)(O)C=O Amb24481483 [1,1,0,0,0,0|1,0,0]=3 1865 B7R0.13 CC(C(=O)O)(CC)N Amb2235200 [1,1,0,0,0,0|1,0,1]=4 1866 B7R0.13 CC(C)(C=C)C(=O)Cl Amb25300712 [1,1,0,0,0,0|2,0,0]=4 1867 B7R0.13 CC(C)(C=C)P(O)=O Amb24746734 [1,1,0,0,0,0|2,0,0]=4 1868 B7R0.13 CC(C)(C=O)C(O)=O Amb25260968 [1,1,0,0,0,0|0,0,0]=2 1869 B7R0.13 CC(C)(C=O)[N+]([O-])=O Amb21858624 [1,1,0,0,0,0|1,0,1]=4 1870 B7R0.13 CC(C)(CF)C(O)=O Amb22000679 [1,1,0,0,0,0|1,0,1]=4 1871 B7R0.13 CC(C)(CN)C(O)=O Amb22371031 [1,1,0,0,0,0|1,0,1]=4 1872 B7R0.13 CC(C)(NCl)C(O)=O Amb25698269 [1,1,0,0,0,0|2,0,0]=4 1873 B7R0.13 CC(C)(NO)C(O)=O Amb24407386 [1,1,0,0,0,0|1,0,0]=3 1874 B7R0.13 CC(C)(ON)C(O)=O Amb18641969 [1,1,0,0,0,0|2,0,0]=4 1875 B7R0.13 CC(C)(O[NH3+])C(O)=O Amb22167603 [1,1,0,0,0,0|2,0,0]=4 1876 B7R0.13 CC(Cl)(C#C)C(O)=O Amb25771733 [1,1,0,0,0,0|1,0,1]=4 1877 B7R0.13 CC(F)(CF)C(O)=O Amb24545976 [1,1,0,0,0,0|1,0,1]=4 1878 B7R0.13 CC(N)(C#C)C(O)=O Amb23504061 [1,1,0,0,0,0|1,0,1]=4 1879 B7R0.13 CC(N)(C=C)C(O)=O Amb18641826 [1,1,0,0,0,0|1,0,0]=3 1880 B7R0.13 CC(N)(CN)C(O)=O Amb25310586 [1,1,0,0,0,0|1,0,1]=4 1881 B7R0.13 CC(N)(CS)C(O)=O Amb18124446 [1,1,0,0,0,0|0,1,1]=4 1882 B7R0.13 CC(N)(CS)C(O)=O Amb24480151 [1,1,0,0,0,0|0,1,1]=4 1883 B7R0.13 CC(O)(C#C)C(O)=O Amb25071834 [1,1,0,0,0,0|1,0,1]=4 1884 B7R0.13 CC(O)(CBr)C(O)=O Amb18522184 [1,1,0,0,0,0|1,0,1]=4 1885 B7R0.13 CC(O)(CN)C(O)=O Amb25378699 [1,1,0,0,0,0|1,0,1]=4 1886 B7R0.13 CC(O)(CO)C(O)=O Amb22270195 [1,1,0,0,0,0|0,0,1]=3 1887 B7R0.13 CC(O)(NO)C(O)=O Amb24482657 [1,1,0,0,0,0|1,0,0]=3 1888 B7R0.13 CC(O)C(C)(C)C=O Amb18641889 [1,1,0,0,0,0|1,0,1]=4 1889 B7R0.13 CC(S)(C#N)C(O)=O Amb25134394 [1,1,0,0,0,0|1,0,1]=4 1890 B7R0.13 CCC(C)(Br)C(O)=O Amb22228657 [1,1,0,0,0,0|1,0,1]=4 1891 B7R0.13 CCC(C)(Cl)C(O)=O Amb25730682 [1,1,0,0,0,0|1,0,1]=4 1892 B7R0.13 CCC(C)(F)C(O)=O Amb24481385 [1,1,0,0,0,0|1,0,1]=4 1893 B7R0.13 CC[C@@](C)(N)C(O)=O Amb19929605 [1,1,0,0,0,0|1,0,1]=4 1894 B7R0.13 CC[C@](C)(Cl)C(O)=O Amb24402244 [1,1,0,0,0,0|1,0,1]=4 1895 B7R0.13 CNC(C)(F)C(O)=O Amb25225635 [1,1,0,0,0,0|2,0,0]=4 1896 B7R0.13 CN[C@@](C)(F)C(O)=O Amb25697457 [1,1,0,0,0,0|2,0,0]=4 1897 B7R0.13 CN[C@](C)(F)C(O)=O Amb25085415 [1,1,0,0,0,0|2,0,0]=4 1898 B7R0.13 COC(C)(S)C(O)=O Amb25201636 [1,1,0,0,0,0|2,0,0]=4 1899 B7R0.13 CSC(C(=O)O)(C)C Amb17501488 [1,1,0,0,0,0|2,0,0]=4 1900 B7R0.13 C[C@@](C(=O)O)(CC)N Amb16183896 [1,1,0,0,0,0|1,0,1]=4 1901 B7R0.13 C[C@@](C(=O)O)(CC)O Amb10067076 [1,1,0,0,0,0|1,0,1]=4 1902 B7R0.13 C[C@@](N)(CF)C(O)=O Amb25169596 [1,1,0,0,0,0|1,0,1]=4 1903 B7R0.13 C[C@@](N)(CS)C(O)=O Amb22757501 [1,1,0,0,0,0|0,1,1]=4 1904 B7R0.13 C[C@@](O)(CN)C(O)=O Amb24698181 [1,1,0,0,0,0|1,0,1]=4 1905 B7R0.13 C[C@](C(=O)O)(CBr)O Amb17610012 [1,1,0,0,0,0|1,0,1]=4 1906 B7R0.13 C[C@](C(=O)O)(CC)O Amb10067075 [1,1,0,0,0,0|1,0,1]=4 1907 B7R0.13 C[C@](C(=O)O)(CS)N Amb16183893 [1,1,0,0,0,0|0,1,1]=4 1908 B7R0.13 C[C@](F)(CN)C(O)=O Amb25110675 [1,1,0,0,0,0|1,0,1]=4 1909 B7R0.13 C[C@](N)(C#C)C(O)=O Amb24406693 [1,1,0,0,0,0|1,0,1]=4 1910 B7R0.13 C[C@](N)(C=C)C(O)=O Amb24481465 [1,1,0,0,0,0|1,0,0]=3 1911 B7R0.13 C[C@](N)(CF)C(O)=O Amb25775618 [1,1,0,0,0,0|1,0,1]=4 1912 B7R0.13 C[C@](N)(CN)C(O)=O Amb25690446 [1,1,0,0,0,0|1,0,1]=4 1913 B7R0.13 C[C@](N)(CS)C(O)=O Amb22388665 [1,1,0,0,0,0|0,1,1]=4 1914 B7R0.13 C[C@](N)(CS)C(O)=O Amb24053489 [1,1,0,0,0,0|0,1,1]=4 1915 B7R0.13 C[C@](O)(C=C)C(O)=O Amb24556886 [1,1,0,0,0,0|1,0,0]=3 1916 B7R0.13 C[C@](O)(CBr)C(O)=O Amb22224875 [1,1,0,0,0,0|1,0,1]=4 1917 B7R0.13 C[C@](O)(CO)C(O)=O Amb25173833 [1,1,0,0,0,0|0,0,1]=3 1918 B7R0.13 C[C@](O)(NO)C(O)=O Amb24412529 [1,1,0,0,0,0|1,0,0]=3 1919 B7R0.13 O=CC(C(=C)C)(C)C Amb17593157 [1,1,0,0,0,0|2,0,0]=4 1920 B7R0.13 OCC(C(=O)O)(F)F Amb17593305 [1,1,0,0,0,0|1,0,1]=4 1921 B7R0.13 [C-]#[N+]C(C)(C)C(O)=O Amb24481414 [1,1,0,0,0,0|2,0,0]=4 1922 B7R0.14 CC(C=O)P(O)(O)=O Amb24481584 [1,1,0,0,0,0|1,0,0]=3 1923 B7R0.14 CC(C=O)S(C)(=O)=O Amb24481555 [1,1,0,0,0,0|1,0,1]=4 1924 B7R0.14 CC(CO)P(O)(O)=O Amb25135495 [1,1,0,0,0,0|1,0,1]=4 1925 B7R0.14 CC(CO)S(O)(=O)=O Amb25285698 [1,1,0,0,0,0|1,0,1]=4 1926 B7R0.14 C[C@@H](C=O)C(C)(C)O Amb24690253 [1,1,0,0,0,0|1,0,1]=4 1927 B7R0.14 OC(C=O)P(O)(O)=O Amb25081170 [1,1,0,0,0,0|2,0,0]=4 1928 B7R0.14 OP(O)(=O)C(Cl)C=O Amb25783928 [1,1,0,0,0,0|2,0,0]=4 1929 B7R0.14 OS(=O)(=O)C(Cl)C=O Amb24467945 [1,1,0,0,0,0|2,0,0]=4 1930 B7R0.15 C=CC(C#C)C(O)=O Amb24562856 [1,1,0,0,0,0|1,0,1]=4 1931 B7R0.15 C=CC(C=O)C(O)=O Amb25042871 [1,1,0,0,0,0|0,0,1]=3 1932 B7R0.15 CC(=O)C(=CO)OC Amb24631186 [1,1,0,0,0,0|1,0,1]=4 1933 B7R0.15 CC(=O)C(=CO)SC Amb24518437 [1,1,0,0,0,0|1,0,1]=4 1934 B7R0.15 CC(=O)C(CBr)C=O Amb24483303 [1,1,0,0,0,0|1,0,0]=3 1935 B7R0.15 CC(=O)C(CO)CO Amb22904340 [1,1,0,0,0,0|1,0,1]=4 1936 B7R0.15 CC(=O)\C(=C/O)\OC Amb25065808 [1,1,0,0,0,0|1,0,1]=4 1937 B7R0.15 CC=C(OC)C(O)=O Amb25793698 [1,1,0,0,0,0|1,0,1]=4 1938 B7R0.15 CCC(=CC)C(O)=O Amb25781700 [1,1,0,0,0,0|1,0,1]=4 1939 B7R0.15 CCC(C#C)C(O)=O Amb25777159 [1,1,0,0,0,0|1,0,1]=4 1940 B7R0.15 CCC(C(=O)O)C#N Amb17210513 [1,1,0,0,0,0|1,0,1]=4 1941 B7R0.15 CCC(C(=O)O)NC Amb10610245 [1,1,0,0,0,0|1,0,1]=4 1942 B7R0.15 CCC(C(=O)O)SC Amb17501348 [1,1,0,0,0,0|1,0,1]=4 1943 B7R0.15 CCC(CBr)C(O)=O Amb25173840 [1,1,0,0,0,0|1,0,1]=4 1944 B7R0.15 CCC(CN)C(O)=O Amb18987934 [1,1,0,0,0,0|1,0,1]=4 1945 B7R0.15 CCC(CN)C(O)=O Amb19514932 [1,1,0,0,0,0|1,0,1]=4 1946 B7R0.15 CCC(CO)C(C)=O Amb24709237 [1,1,0,0,0,0|1,0,1]=4 1947 B7R0.15 CCC(CO)C(O)=O Amb18641947 [1,1,0,0,0,0|0,0,1]=3 1948 B7R0.15 CCC(CS)C(O)=O Amb24435402 [1,1,0,0,0,0|0,1,1]=4 1949 B7R0.15 CCC(NN)C(O)=O Amb18641955 [1,1,0,0,0,0|2,0,0]=4 1950 B7R0.15 CCC(ON)C(O)=O Amb25697895 [1,1,0,0,0,0|2,0,0]=4 1951 B7R0.15 CC[C@@H](C(=O)O)CO Amb16232065 [1,1,0,0,0,0|0,0,1]=3 1952 B7R0.15 CC[C@@H](CO)C(O)=O Amb22745321 [1,1,0,0,0,0|0,0,1]=3 1953 B7R0.15 CC[C@@H](CS)C(O)=O Amb24429203 [1,1,0,0,0,0|0,1,1]=4 1954 B7R0.15 CC[C@@H](NN)C(O)=O Amb25746090 [1,1,0,0,0,0|2,0,0]=4 1955 B7R0.15 CC[C@H](C=C)C(O)=O Amb24524256 [1,1,0,0,0,0|1,0,0]=3 1956 B7R0.15 CC[C@H](CN)C(O)=O Amb25790771 [1,1,0,0,0,0|1,0,1]=4 1957 B7R0.15 CC[C@H](CS)C(O)=O Amb25131908 [1,1,0,0,0,0|0,1,1]=4 1958 B7R0.15 CC[C@H](NC)C(O)=O Amb24505225 [1,1,0,0,0,0|1,0,1]=4 1959 B7R0.15 CC\C(=C/C)\C(O)=O Amb18641780 [1,1,0,0,0,0|1,0,1]=4 1960 B7R0.15 CC\C(=N/O)\C(O)=O Amb25378085 [1,1,0,0,0,0|1,0,1]=4 1961 B7R0.15 CNC(C=C)C(O)=O Amb25847721 [1,1,0,0,0,0|1,0,0]=3 1962 B7R0.15 CNC(CF)C(O)=O Amb25695388 [1,1,0,0,0,0|1,0,1]=4 1963 B7R0.15 CNC(CN)C(O)=O Amb23515020 [1,1,0,0,0,0|1,0,1]=4 1964 B7R0.15 CNC(CO)C(N)=O Amb18641957 [1,1,0,0,0,0|1,0,1]=4 1965 B7R0.15 CNC(SC)C(O)=O Amb25745282 [1,1,0,0,0,0|2,0,0]=4 1966 B7R0.15 CN[C@@H](CF)C(O)=O Amb25367323 [1,1,0,0,0,0|1,0,1]=4 1967 B7R0.15 CN[C@@H](CN)C(O)=O Amb24397074 [1,1,0,0,0,0|1,0,1]=4 1968 B7R0.15 CN[C@@H](CO)C(N)=O Amb25025437 [1,1,0,0,0,0|1,0,1]=4 1969 B7R0.15 CN[C@H](C(=O)O)CO Amb16183860 [1,1,0,0,0,0|0,0,1]=3 1970 B7R0.15 CN[C@H](CF)C(O)=O Amb25367324 [1,1,0,0,0,0|1,0,1]=4 1971 B7R0.15 COC(=CO)C(O)=O Amb25730461 [1,1,0,0,0,0|0,0,1]=3 1972 B7R0.15 COC(C=C)C(O)=O Amb18641874 [1,1,0,0,0,0|1,0,0]=3 1973 B7R0.15 COC(CCl)C(O)=O Amb18643355 [1,1,0,0,0,0|1,0,1]=4 1974 B7R0.15 COC(CN)C(O)=O Amb22059584 [1,1,0,0,0,0|1,0,1]=4 1975 B7R0.15 COC(CN)C(O)=O Amb24271092 [1,1,0,0,0,0|1,0,1]=4 1976 B7R0.15 COC(CO)C(O)=O Amb24482992 [1,1,0,0,0,0|0,0,1]=3 1977 B7R0.15 COC(CS)C(O)=O Amb25305649 [1,1,0,0,0,0|0,1,1]=4 1978 B7R0.15 CO[C@H](CO)C(N)=O Amb25755894 [1,1,0,0,0,0|1,0,1]=4 1979 B7R0.15 CO\C(=C/Br)\C(O)=O Amb25189037 [1,1,0,0,0,0|1,0,1]=4 1980 B7R0.15 CSC(CCl)C(O)=O Amb24526774 [1,1,0,0,0,0|1,0,1]=4 1981 B7R0.15 CSC(CO)C(C)=O Amb25746293 [1,1,0,0,0,0|1,0,1]=4 1982 B7R0.15 CSC(CO)C(N)=O Amb25849170 [1,1,0,0,0,0|1,0,1]=4 1983 B7R0.15 C\C=C(/CBr)\C(O)=O Amb18128301 [1,1,0,0,0,0|1,0,1]=4 1984 B7R0.15 C\C=C(/OC)\C(O)=O Amb18124260 [1,1,0,0,0,0|1,0,1]=4 1985 B7R0.15 C\C=C(\CBr)/C(O)=O Amb24606924 [1,1,0,0,0,0|1,0,1]=4 1986 B7R0.15 C\C=C(\CO)/C(O)=O Amb25306747 [1,1,0,0,0,0|0,0,2]=4 1987 B7R0.15 NCC(C(=O)O)C#N Amb10842157 [1,1,0,0,0,0|1,0,1]=4 1988 B7R0.15 NCC(CN)C(O)=O Amb25335570 [1,1,0,0,0,0|1,0,1]=4 1989 B7R0.15 NC[C@@H](CO)C(O)=O Amb22756739 [1,1,0,0,0,0|0,0,1]=3 1990 B7R0.15 NNC(CS)C(O)=O Amb24117863 [1,1,0,0,0,0|2,0,0]=4 1991 B7R0.15 NN[C@@H](CO)C(O)=O Amb24384871 [1,1,0,0,0,0|1,0,1]=4 1992 B7R0.15 OC(=O)C(CBr)=NO Amb24621133 [1,1,0,0,0,0|1,0,1]=4 1993 B7R0.15 OC(=O)C(CI)CI Amb17779784 [1,1,0,0,0,0|1,0,1]=4 1994 B7R0.15 OC(=O)C(CO)CO Amb18124271 [1,1,0,0,0,0|0,0,1]=3 1995 B7R0.15 OC(=O)C(CS)=NO Amb24685236 [1,1,0,0,0,0|1,0,1]=4 1996 B7R0.15 OC(=O)C(CS)NS Amb25286626 [1,1,0,0,0,0|1,1,0]=4 1997 B7R0.15 OC(=O)\C(\CS)=N\O Amb24551064 [1,1,0,0,0,0|1,0,1]=4 1998 B7R0.15 OCC(NO)C(O)=O Amb24719766 [1,1,0,0,0,0|1,0,0]=3 1999 B7R0.15 [C-]#[N+]C(CC)C(O)=O Amb24432856 [1,1,0,0,0,0|2,0,0]=4 2000 B9R0.10 CC(CC(O)=O)P(C)(O)=O Amb25059136 [0,1,0,0,0,1|1,0,0]=3 2001 B9R0.10 CC(CC(O)=O)S(C)(=O)=O Amb18971621 [0,1,0,0,0,1|1,0,1]=4 2002 B9R0.10 CN(CC(O)=O)P(O)(O)=O Amb24651000 [0,1,0,0,0,1|2,0,0]=4 2003 B9R0.10 C[C@H](CC(O)=O)S(O)(=O)=O Amb25210783 [0,1,0,0,0,1|1,0,0]=3 2004 B9R0.10 N[C@@H](CC(O)=O)P(O)(O)=O Amb25322981 [0,1,0,0,0,1|2,0,0]=4 2005 B9R0.11 CC(=C)C(C)(C)CC(O)=O Amb25703730 [0,1,0,0,0,1|2,0,0]=4 2006 B9R0.11 CC(=C)C(C)(N)CC(O)=O Amb22641962 [0,1,0,0,0,1|2,0,0]=4 2007 B9R0.11 CC(=C)CC(C)(O)C(O)=O Amb24763776 [0,1,0,0,0,1|2,0,0]=4 2008 B9R0.11 CC(=C)C[C@@](C)(F)C(O)=O Amb25378746 [0,1,0,0,0,1|2,0,0]=4 2009 B9R0.11 CC(=O)C(C)(Br)CC(O)=O Amb24682759 [0,1,0,0,0,1|1,0,0]=3 2010 B9R0.11 CC(=O)C(C)(C)CC(=O)Cl Amb24690787 [0,1,0,0,0,1|2,0,0]=4 2011 B9R0.11 CC(=O)C(C)(C)CC(C)=O Amb25771077 [0,1,0,0,0,1|2,0,0]=4 2012 B9R0.11 CC(=O)C(C)(C)SC(C)=O Amb25735110 [0,1,0,0,0,1|2,0,0]=4 2013 B9R0.11 CC(=O)C(C)(O)CC(O)=O Amb25733298 [0,1,0,0,0,1|1,0,0]=3 2014 B9R0.11 CC(=O)CC(C)(C)C(N)=O Amb25737091 [0,1,0,0,0,1|2,0,0]=4 2015 B9R0.11 CC(=O)CC(C)(C)C(O)=O Amb18644092 [0,1,0,0,0,1|1,0,0]=3 2016 B9R0.11 CC(=O)NC(C(=O)O)(C)C Amb13952726 [0,1,0,0,0,1|1,0,0]=3 2017 B9R0.11 CC(=O)NC(C)(C)C(N)=O Amb25147607 [0,1,0,0,0,1|2,0,0]=4 2018 B9R0.11 CC(=O)NC(O)(Cl)C(O)=O Amb25772842 [0,1,0,0,0,1|2,0,0]=4 2019 B9R0.11 CC(=O)N[C@](C)(S)C(O)=O Amb25793169 [0,1,0,0,0,1|1,0,0]=3 2020 B9R0.11 CC(=O)OC(C)(C)C(N)=O Amb25730514 [0,1,0,0,0,1|2,0,0]=4 2021 B9R0.11 CC(=O)OC(C)(C)C(O)=O Amb18644243 [0,1,0,0,0,1|1,0,0]=3 2022 B9R0.11 CC(=O)SC(C(=O)O)(C)C Amb17607677 [0,1,0,0,0,1|1,0,0]=3 2023 B9R0.11 CC(=O)[C@](C)(O)CC(C)=O Amb25738871 [0,1,0,0,0,1|2,0,0]=4 2024 B9R0.11 CC(=S)C(C)(C)CC(O)=O Amb25227469 [0,1,0,0,0,1|1,1,0]=4 2025 B9R0.11 CC(C)(CC(=O)Cl)C(=O)Cl Amb24528594 [0,1,0,0,0,1|2,0,0]=4 2026 B9R0.11 CC(C)(CC(=O)Cl)C(O)=O Amb25211275 [0,1,0,0,0,1|1,0,0]=3 2027 B9R0.11 CC(C)(CC(N)=O)C(O)=O Amb24721912 [0,1,0,0,0,1|1,0,0]=3 2028 B9R0.11 CC(C)(NC(N)=O)C(N)=O Amb25249590 [0,1,0,0,0,1|2,0,0]=4 2029 B9R0.11 CC(C)(OC(N)=O)C(N)=O Amb25147280 [0,1,0,0,0,1|2,0,0]=4 2030 B9R0.11 CC(C)(O[N+]([O-])=O)C(O)=O Amb22490347 [0,1,0,0,0,1|1,0,1]=4 2031 B9R0.11 CC(C)=CC(C)(O)C(O)=O Amb24666586 [0,1,0,0,0,1|2,0,0]=4 2032 B9R0.11 CC(Cl)(CC(O)=O)C(O)=O Amb18126463 [0,1,0,0,0,1|0,0,0]=2 2033 B9R0.11 CC(N)(CC(N)=O)C(N)=O Amb24436628 [0,1,0,0,0,1|2,0,0]=4 2034 B9R0.11 CC(N)(CC(O)=O)C(O)=O Amb22800383 [0,1,0,0,0,1|0,0,0]=2 2035 B9R0.11 CC(N)(CC(O)=O)P(O)=O Amb25701546 [0,1,0,0,0,1|1,0,0]=3 2036 B9R0.11 CC(O)(CC(N)=O)C(O)=O Amb24744548 [0,1,0,0,0,1|1,0,0]=3 2037 B9R0.11 CC(O)(CC(O)=O)C(N)=O Amb24669300 [0,1,0,0,0,1|1,0,0]=3 2038 B9R0.11 CC(O)(CC(O)=O)C(O)=O Amb22352645 [0,1,0,0,0,1|0,0,0]=2 2039 B9R0.11 CC(O)(CC([O-])=O)C([O-])=O Amb22353060 [0,1,0,0,0,1|0,0,2]=4 2040 B9R0.11 CC(O)CC(C)(C)C(O)=O Amb25230577 [0,1,0,0,0,1|1,0,1]=4 2041 B9R0.11 CC(O)CC(C)(O)C(O)=O Amb25265252 [0,1,0,0,0,1|1,0,1]=4 2042 B9R0.11 CC(S)(CC(O)=O)C(O)=O Amb25053889 [0,1,0,0,0,1|0,0,0]=2 2043 B9R0.11 C[C@@](N)(CC(=C)F)C(O)=O Amb24479080 [0,1,0,0,0,1|2,0,0]=4 2044 B9R0.11 C[C@@](N)(CC(N)=O)C(O)=O Amb22225025 [0,1,0,0,0,1|1,0,0]=3 2045 B9R0.11 C[C@@](O)(CC(O)=O)C(O)=O Amb22336254 [0,1,0,0,0,1|0,0,0]=2 2046 B9R0.11 NC(=O)C(F)(F)CC(O)=O Amb25109736 [0,1,0,0,0,1|2,0,0]=4 2047 B9R0.11 NC(N)(CC(O)=O)C(O)=O Amb24460545 [0,1,0,0,0,1|1,0,0]=3 2048 B9R0.11 OC(=O)C(O)(F)CC(O)=O Amb25798979 [0,1,0,0,0,1|1,0,0]=3 2049 B9R0.11 OC(=O)C(S)(S)CC(O)=O Amb22230560 [0,1,0,0,0,1|1,0,0]=3 2050 B9R0.11 OC(=O)CC(C(=O)O)(N)C Amb10807406 [0,1,0,0,0,1|0,0,0]=2 2051 B9R0.11 OC(=O)CC(C(=O)O)(O)O Amb16232015 [0,1,0,0,0,1|1,0,0]=3 2052 B9R0.11 OC(=O)CC(C(=S)N)(C)C Amb17466449 [0,1,0,0,0,1|1,1,0]=4 2053 B9R0.11 OC(=O)C[C@@](C(=O)O)(N)C Amb10601663 [0,1,0,0,0,1|0,0,0]=2 2054 B9R0.11 OC(=O)C[C@](C(=O)O)(N)C Amb10601664 [0,1,0,0,0,1|0,0,0]=2 2055 B9R0.11 OC(=O)C[C@](C(=O)O)(N)C Amb17608152 [0,1,0,0,0,1|0,0,0]=2 2056 B9R0.23 CC(=C)CC(C)C(=O)NO Amb24751825 [0,1,0,0,0,1|2,0,0]=4 2057 B9R0.23 CC(=CC(O)=O)C(=O)CC Amb24680912 [0,1,0,0,0,1|1,0,1]=4 2058 B9R0.23 CC(=CC(O)=O)C(=O)OC Amb24362654 [0,1,0,0,0,1|0,0,1]=3 2059 B9R0.23 CC(=O)CC(N)C(=O)OC Amb25367296 [0,1,0,0,0,1|2,0,0]=4 2060 B9R0.23 CC(=O)C[C@@H](O)C(=O)OC Amb24408458 [0,1,0,0,0,1|2,0,0]=4 2061 B9R0.23 CC(=O)C[C@H](O)C(=O)OC Amb25146504 [0,1,0,0,0,1|2,0,0]=4 2062 B9R0.23 CC(=O)NC(Br)C(=O)OC Amb24434913 [0,1,0,0,0,1|2,0,0]=4 2063 B9R0.23 CC(=O)NC(C)C(=O)CBr Amb24465214 [0,1,0,0,0,1|2,0,0]=4 2064 B9R0.23 CC(=O)NC(C)C(=O)CCl Amb25695669 [0,1,0,0,0,1|2,0,0]=4 2065 B9R0.23 CC(=O)NC(C)C(=O)OC Amb24650565 [0,1,0,0,0,1|1,0,0]=3 2066 B9R0.23 CC(=O)NC(C)C(=O)SC Amb25195768 [0,1,0,0,0,1|1,1,0]=4 2067 B9R0.23 CC(=O)NC(O)C(=O)OC Amb25147262 [0,1,0,0,0,1|2,0,0]=4 2068 B9R0.23 CC(=O)NN(C)C(=O)OC Amb25169388 [0,1,0,0,0,1|2,0,0]=4 2069 B9R0.23 CC(=O)N[C@@H](C)C(=O)NC Amb22800074 [0,1,0,0,0,1|2,0,0]=4 2070 B9R0.23 CC(=O)N[C@@H](C)C(=O)NN Amb24445106 [0,1,0,0,0,1|2,0,0]=4 2071 B9R0.23 CC(=O)N[C@H](C)C(=O)NN Amb24680992 [0,1,0,0,0,1|2,0,0]=4 2072 B9R0.23 CC(=O)OC(C)C(=C)C=O Amb25324145 [0,1,0,0,0,1|2,0,0]=4 2073 B9R0.23 CC(=O)OC(C)C(=O)C#N Amb25059657 [0,1,0,0,0,1|2,0,0]=4 2074 B9R0.23 CC(=O)OC(C)C(=O)C=C Amb24456772 [0,1,0,0,0,1|2,0,0]=4 2075 B9R0.23 CC(=O)OC(C)C(=O)CBr Amb25062459 [0,1,0,0,0,1|2,0,0]=4 2076 B9R0.23 CC(=O)OC(C)C(=O)CCl Amb25232018 [0,1,0,0,0,1|2,0,0]=4 2077 B9R0.23 CC(=O)OC(C)C(=O)OC Amb24719402 [0,1,0,0,0,1|1,0,0]=3 2078 B9R0.23 CC(=O)O[C@@H](C)C(=O)C#N Amb25146510 [0,1,0,0,0,1|2,0,0]=4 2079 B9R0.23 CC(=O)O[C@@H](C)C(=O)OC Amb24397827 [0,1,0,0,0,1|1,0,0]=3 2080 B9R0.23 CC(=O)\C=C(\C)/C(=O)OC Amb25146692 [0,1,0,0,0,1|1,0,1]=4 2081 B9R0.23 CC(C(=O)NC)CC(=O)N Amb17334220 [0,1,0,0,0,1|2,0,0]=4 2082 B9R0.23 CC(CC(C)O)C(=O)OC Amb25781081 [0,1,0,0,0,1|1,0,1]=4 2083 B9R0.23 CC(CC(O)=O)C(=O)CN Amb25072734 [0,1,0,0,0,1|1,0,0]=3 2084 B9R0.23 CC(CC(O)=O)N(C)C=O Amb24670439 [0,1,0,0,0,1|2,0,0]=4 2085 B9R0.23 CC(NC(N)=O)C(=O)NO Amb24705421 [0,1,0,0,0,1|1,0,0]=3 2086 B9R0.23 CC(NC(N)=O)C(N)=NO Amb24477997 [0,1,0,0,0,1|2,0,0]=4 2087 B9R0.23 CC(OC)C(C)CC(O)=O Amb18202340 [0,1,0,0,0,1|1,0,1]=4 2088 B9R0.23 CCC(=O)[C@@H](C)CC(O)=O Amb24504994 [0,1,0,0,0,1|1,0,0]=3 2089 B9R0.23 CCC(=O)[C@H](C)CC(O)=O Amb24426900 [0,1,0,0,0,1|1,0,0]=3 2090 B9R0.23 CCN(O)C(C)CC(O)=O Amb25379050 [0,1,0,0,0,1|2,0,0]=4 2091 B9R0.23 CCS(=O)C(C)CC(O)=O Amb19012075 [0,1,0,0,0,1|2,0,0]=4 2092 B9R0.23 CN(C(=O)CC)CC(=O)O Amb1113094 [0,1,0,0,0,1|2,0,0]=4 2093 B9R0.23 CN(CC(O)=O)C(=O)CCl Amb21956220 [0,1,0,0,0,1|2,0,0]=4 2094 B9R0.23 CN(CC(O)=O)C(=O)CN Amb21929346 [0,1,0,0,0,1|2,0,0]=4 2095 B9R0.23 CN(CC(O)=O)C(=O)CO Amb25848387 [0,1,0,0,0,1|1,0,0]=3 2096 B9R0.23 CN(CC(O)=O)C(=S)OC Amb24514158 [0,1,0,0,0,1|1,1,0]=4 2097 B9R0.23 CNC(=O)C(N)CC(O)=O Amb18862479 [0,1,0,0,0,1|2,0,0]=4 2098 B9R0.23 CNC(=O)[C@@H](N)CC(O)=O Amb25694374 [0,1,0,0,0,1|2,0,0]=4 2099 B9R0.23 CNC(=O)[C@H](C)NC(N)=O Amb25846014 [0,1,0,0,0,1|2,0,0]=4 2100 B9R0.23 COC(=O)C(Br)CC(N)=O Amb24728398 [0,1,0,0,0,1|2,0,0]=4 2101 B9R0.23 COC(=O)C(Br)CC(O)=O Amb18656999 [0,1,0,0,0,1|1,0,0]=3 2102 B9R0.23 COC(=O)C(C)CC(=O)Cl Amb24648102 [0,1,0,0,0,1|1,0,0]=3 2103 B9R0.23 COC(=O)C(C)CC(N)=N Amb25178681 [0,1,0,0,0,1|2,0,0]=4 2104 B9R0.23 COC(=O)C(C)CC(N)=O Amb25113876 [0,1,0,0,0,1|1,0,0]=3 2105 B9R0.23 COC(=O)C(C)CC(O)=O Amb18644248 [0,1,0,0,0,1|0,0,0]=2 2106 B9R0.23 COC(=O)C(C)CS(C)=O Amb18788308 [0,1,0,0,0,1|2,0,0]=4 2107 B9R0.23 COC(=O)C(C)NC(N)=O Amb20407420 [0,1,0,0,0,1|1,0,0]=3 2108 B9R0.23 COC(=O)C(C)NC(N)=S Amb18180056 [0,1,0,0,0,1|1,1,0]=4 2109 B9R0.23 COC(=O)C(C)SC(N)=[NH2+] Amb22486896 [0,1,0,0,0,1|2,0,0]=4 2110 B9R0.23 COC(=O)C(CC(=O)N)N Amb16243083 [0,1,0,0,0,1|2,0,0]=4 2111 B9R0.23 COC(=O)C(CC(=O)N)N Amb17601698 [0,1,0,0,0,1|2,0,0]=4 2112 B9R0.23 COC(=O)C(CC(=O)O)O Amb17615865 [0,1,0,0,0,1|1,0,0]=3 2113 B9R0.23 COC(=O)C(Cl)OC(=O)Cl Amb25711657 [0,1,0,0,0,1|2,0,0]=4 2114 B9R0.23 COC(=O)C(N)CC(O)=O Amb18644309 [0,1,0,0,0,1|1,0,0]=3 2115 B9R0.23 COC(=O)[C@@H](C)CC(N)=O Amb24351411 [0,1,0,0,0,1|1,0,0]=3 2116 B9R0.23 COC(=O)[C@@H](C)CC(O)=O Amb22226152 [0,1,0,0,0,1|0,0,0]=2 2117 B9R0.23 COC(=O)[C@@H](C)NC(N)=O Amb24400792 [0,1,0,0,0,1|1,0,0]=3 2118 B9R0.23 COC(=O)[C@@H](CC(=O)O)O Amb17615866 [0,1,0,0,0,1|1,0,0]=3 2119 B9R0.23 COC(=O)[C@@H](N)CC(O)=O Amb22746069 [0,1,0,0,0,1|1,0,0]=3 2120 B9R0.23 COC(=O)[C@@H](N)CS(O)=O Amb24592787 [0,1,0,0,0,1|2,0,0]=4 2121 B9R0.23 COC(=O)[C@@H](O)CC(N)=O Amb25147368 [0,1,0,0,0,1|2,0,0]=4 2122 B9R0.23 COC(=O)[C@H](C)CC(N)=O Amb25824598 [0,1,0,0,0,1|1,0,0]=3 2123 B9R0.23 COC(=O)[C@H](C)CC(O)=O Amb24561954 [0,1,0,0,0,1|0,0,0]=2 2124 B9R0.23 COC(=O)[C@H](C)NS(C)=O Amb25346841 [0,1,0,0,0,1|2,0,0]=4 2125 B9R0.23 COC(=O)[C@H](CC(=O)N)N Amb10844909 [0,1,0,0,0,1|2,0,0]=4 2126 B9R0.23 COC(=O)[C@H](CC(=O)O)O Amb17615867 [0,1,0,0,0,1|1,0,0]=3 2127 B9R0.23 COC(=O)[C@H](N)CC(N)=O Amb19883963 [0,1,0,0,0,1|2,0,0]=4 2128 B9R0.23 COC(=O)[C@H](N)CC(O)=O Amb19944281 [0,1,0,0,0,1|1,0,0]=3 2129 B9R0.23 COC(=O)[C@H](NC(=O)C)C Amb17621817 [0,1,0,0,0,1|1,0,0]=3 2130 B9R0.23 COC(=O)\C(=C\C(=O)O)\Br Amb15695379 [0,1,0,0,0,1|1,0,1]=4 2131 B9R0.23 COC(=O)\C(\Cl)=C/C(O)=O Amb24482175 [0,1,0,0,0,1|1,0,1]=4 2132 B9R0.23 C[C@H](CC(O)=O)[C@H](O)CN Amb25131743 [0,1,0,0,0,1|1,0,1]=4 2133 B9R0.23 C\C(=C/C(O)=O)\C(=O)CC Amb24462868 [0,1,0,0,0,1|1,0,1]=4 2134 B9R0.23 C\C(=C\C(O)=O)\C(=O)NC Amb24560263 [0,1,0,0,0,1|1,0,1]=4 2135 B9R0.23 NC(CC(O)=O)C(=O)O[Na] Amb22352689 [0,1,0,0,0,1|1,0,0]=3 2136 B9R0.23 NC(CC([O-])=O)C(=O)O[Cu+] Amb22540451 [0,1,0,0,0,1|1,0,1]=4 2137 B9R0.23 NCC(=O)C(N)CC(O)=O Amb24745663 [0,1,0,0,0,1|2,0,0]=4 2138 B9R0.23 N[C@@H](CC(O)=O)C(=O)NO Amb25762946 [0,1,0,0,0,1|1,0,0]=3 2139 B9R0.23 OC(=O)CC(C(=O)CBr)Br Amb15772353 [0,1,0,0,0,1|2,0,0]=4 2140 B9R0.23 OC(=O)CC(Cl)C(=O)CCl Amb24426203 [0,1,0,0,0,1|2,0,0]=4 2141 B9R0.23 OC(=O)CC(O)C(=O)CO Amb25124913 [0,1,0,0,0,1|1,0,0]=3 2142 B9R0.23 OC(=O)C[C@H](O)C(=O)CO Amb25259211 [0,1,0,0,0,1|1,0,0]=3 2143 B9R0.39 C=NC(CC(O)=O)C(O)=O Amb24350770 [0,1,0,0,0,1|0,0,1]=3 2144 B9R0.39 CC(=C)CC(CC)C(O)=O Amb24480742 [0,1,0,0,0,1|2,0,0]=4 2145 B9R0.39 CC(=O)C(CC(O)=O)CC Amb24410015 [0,1,0,0,0,1|1,0,0]=3 2146 B9R0.39 CC(=O)C(CC(O)=O)NC Amb18611382 [0,1,0,0,0,1|1,0,0]=3 2147 B9R0.39 CC(=O)C(CS)NC(C)=O Amb25053025 [0,1,0,0,0,1|2,0,0]=4 2148 B9R0.39 CC(=O)CC(CC)C(O)=O Amb18644109 [0,1,0,0,0,1|1,0,0]=3 2149 B9R0.39 CC(=O)CC(NC)C(O)=O Amb25690263 [0,1,0,0,0,1|1,0,0]=3 2150 B9R0.39 CC(=O)NC(C#N)C(O)=O Amb25147351 [0,1,0,0,0,1|1,0,1]=4 2151 B9R0.39 CC(=O)NC(C=C)C(O)=O Amb18124622 [0,1,0,0,0,1|1,0,1]=4 2152 B9R0.39 CC(=O)NC(CC)C(N)=O Amb24352660 [0,1,0,0,0,1|2,0,0]=4 2153 B9R0.39 CC(=O)NC(CCl)C(N)=O Amb24411046 [0,1,0,0,0,1|2,0,0]=4 2154 B9R0.39 CC(=O)NC(CN)C(N)=O Amb24558471 [0,1,0,0,0,1|2,0,0]=4 2155 B9R0.39 CC(=O)NC(CS)C(N)=O Amb24482241 [0,1,0,0,0,1|2,0,0]=4 2156 B9R0.39 CC(=O)NC(SC)C(O)=O Amb24482255 [0,1,0,0,0,1|1,0,0]=3 2157 B9R0.39 CC(=O)N[C@@H](CN)C(O)=O Amb24479068 [0,1,0,0,0,1|1,0,0]=3 2158 B9R0.39 CC(=O)N[C@@H](CO)C(O)=O Amb22746917 [0,1,0,0,0,1|1,0,0]=3 2159 B9R0.39 CC(=O)N[C@@H](CS)C(N)=O Amb24183864 [0,1,0,0,0,1|2,0,0]=4 2160 B9R0.39 CC(=O)N[C@H](CC)C(N)=O Amb25768366 [0,1,0,0,0,1|2,0,0]=4 2161 B9R0.39 CC(=O)N[C@H](CO)C(N)=O Amb25791565 [0,1,0,0,0,1|2,0,0]=4 2162 B9R0.39 CC(=O)N[C@H](CO)C(O)=O Amb22886955 [0,1,0,0,0,1|1,0,0]=3 2163 B9R0.39 CC(=O)N\C(=C/C)\C(O)=O Amb24669908 [0,1,0,0,0,1|1,0,1]=4 2164 B9R0.39 CC(=O)OC(C=C)C(O)=O Amb24410879 [0,1,0,0,0,1|1,0,1]=4 2165 B9R0.39 CC(=O)OC(CC)C(N)=O Amb25274332 [0,1,0,0,0,1|2,0,0]=4 2166 B9R0.39 CC(=O)OC(CC)C(O)=O Amb18644246 [0,1,0,0,0,1|1,0,0]=3 2167 B9R0.39 CC(=O)OC(CN)C(O)=O Amb25082692 [0,1,0,0,0,1|1,0,0]=3 2168 B9R0.39 CC(=O)OC(SC)C(O)=O Amb25061355 [0,1,0,0,0,1|1,0,0]=3 2169 B9R0.39 CC(=O)O[C@@H](CC)C(N)=O Amb25709607 [0,1,0,0,0,1|2,0,0]=4 2170 B9R0.39 CC(=O)S[C@@H](CC)C(O)=O Amb24738694 [0,1,0,0,0,1|1,0,0]=3 2171 B9R0.39 CC(C)=CC(OC)C(O)=O Amb20621506 [0,1,0,0,0,1|2,0,0]=4 2172 B9R0.39 CC(O)C(CC(O)=O)CC Amb18831453 [0,1,0,0,0,1|1,0,1]=4 2173 B9R0.39 CC(O)C(CC(O)=O)NC Amb24400678 [0,1,0,0,0,1|1,0,1]=4 2174 B9R0.39 CCC(C(=O)O)CC(=O)O Amb10071696 [0,1,0,0,0,1|0,0,0]=2 2175 B9R0.39 CCC(C(=O)O)NC(=O)C Amb2099651 [0,1,0,0,0,1|1,0,0]=3 2176 B9R0.39 CCC(CP(O)=O)C(O)=O Amb24482481 [0,1,0,0,0,1|1,0,0]=3 2177 B9R0.39 CCC(NC(N)=N)C(O)=O Amb24686049 [0,1,0,0,0,1|2,0,0]=4 2178 B9R0.39 CCC(NS(C)=O)C(O)=O Amb25177157 [0,1,0,0,0,1|2,0,0]=4 2179 B9R0.39 CCC(OC(C)=O)C(C)=O Amb25276388 [0,1,0,0,0,1|2,0,0]=4 2180 B9R0.39 CCC(SC(N)=N)C(O)=O Amb24704702 [0,1,0,0,0,1|2,0,0]=4 2181 B9R0.39 CCN(C(=O)C)CC(=O)O Amb17399887 [0,1,0,0,0,1|2,0,0]=4 2182 B9R0.39 CCN(CC(O)=O)C(N)=O Amb18999255 [0,1,0,0,0,1|2,0,0]=4 2183 B9R0.39 CC[C@@H](NC(N)=O)C(N)=O Amb25177334 [0,1,0,0,0,1|2,0,0]=4 2184 B9R0.39 CC[C@@H](NC(N)=O)C(O)=O Amb24715718 [0,1,0,0,0,1|1,0,0]=3 2185 B9R0.39 CC[C@@H](NS(C)=O)C(O)=O Amb25177158 [0,1,0,0,0,1|2,0,0]=4 2186 B9R0.39 CC[C@@H](OC(C)=O)C(C)=O Amb24504997 [0,1,0,0,0,1|2,0,0]=4 2187 B9R0.39 CC[C@H](CC(O)=O)C(O)=O Amb24643194 [0,1,0,0,0,1|0,0,0]=2 2188 B9R0.39 CC[C@H](NC(N)=O)C(O)=O Amb24538029 [0,1,0,0,0,1|1,0,0]=3 2189 B9R0.39 CC[C@H](OC(C)=O)C(C)=O Amb24571835 [0,1,0,0,0,1|2,0,0]=4 2190 B9R0.39 CC\C(=C/C(O)=O)\C(O)=O Amb18644060 [0,1,0,0,0,1|0,0,1]=3 2191 B9R0.39 CNC(C(=O)O)CC(=O)O Amb1905634 [0,1,0,0,0,1|0,0,0]=2 2192 B9R0.39 CNC(CC(N)=O)C(N)=O Amb25680930 [0,1,0,0,0,1|2,0,0]=4 2193 B9R0.39 CNC(CC(N)=O)C(O)=O Amb18644255 [0,1,0,0,0,1|1,0,0]=3 2194 B9R0.39 CNC(CS(O)=O)C(O)=O Amb25765774 [0,1,0,0,0,1|1,0,0]=3 2195 B9R0.39 CN[C@@H](CC(O)=O)C(O)=O Amb22748003 [0,1,0,0,0,1|0,0,0]=2 2196 B9R0.39 CN[C@@H](CS(O)=O)C(O)=O Amb24482415 [0,1,0,0,0,1|1,0,0]=3 2197 B9R0.39 COC(=CC(O)=O)C(O)=O Amb24615646 [0,1,0,0,0,1|0,0,1]=3 2198 B9R0.39 COC(CC(N)=O)C(N)=O Amb24685112 [0,1,0,0,0,1|2,0,0]=4 2199 B9R0.39 COC(CC(O)=O)C(N)=O Amb23536075 [0,1,0,0,0,1|1,0,0]=3 2200 B9R0.39 COC(CC(O)=O)C(O)=O Amb18124863 [0,1,0,0,0,1|0,0,0]=2 2201 B9R0.39 COC(NC(N)=O)C(O)=O Amb18124866 [0,1,0,0,0,1|1,0,0]=3 2202 B9R0.39 COC(OC(C)=O)C(C)=O Amb25146803 [0,1,0,0,0,1|2,0,0]=4 2203 B9R0.39 CON(CC(O)=O)C(N)=O Amb24359859 [0,1,0,0,0,1|2,0,0]=4 2204 B9R0.39 CO[C@@H](CC(N)=O)C(N)=O Amb25268728 [0,1,0,0,0,1|2,0,0]=4 2205 B9R0.39 CO[C@@H](CC(O)=O)C(O)=O Amb25122107 [0,1,0,0,0,1|0,0,0]=2 2206 B9R0.39 CO\C(=C/C(O)=O)\C(O)=O Amb24480750 [0,1,0,0,0,1|0,0,1]=3 2207 B9R0.39 CS(=O)N[C@@H](CO)C(O)=O Amb24583469 [0,1,0,0,0,1|2,0,0]=4 2208 B9R0.39 CSC(CC(N)=O)C(O)=O Amb25694730 [0,1,0,0,0,1|1,0,0]=3 2209 B9R0.39 CSC(CC(O)=O)C(O)=O Amb18646024 [0,1,0,0,0,1|0,0,0]=2 2210 B9R0.39 CSC(NC(N)=O)C(O)=O Amb18126402 [0,1,0,0,0,1|1,0,0]=3 2211 B9R0.39 CS[C@@H](CC(O)=O)C(O)=O Amb25191487 [0,1,0,0,0,1|0,0,0]=2 2212 B9R0.39 CS[C@H](CC(N)=O)C(O)=O Amb25101496 [0,1,0,0,0,1|1,0,0]=3 2213 B9R0.39 CS[C@H](CC(O)=O)C(O)=O Amb24423669 [0,1,0,0,0,1|0,0,0]=2 2214 B9R0.39 C[C@H](O)[C@@H](CC(O)=O)NC Amb24460369 [0,1,0,0,0,1|1,0,1]=4 2215 B9R0.39 C\C=C(\CC(O)=O)/C(O)=O Amb25292254 [0,1,0,0,0,1|0,0,1]=3 2216 B9R0.39 N#CC(CC(O)=O)C(O)=O Amb24434922 [0,1,0,0,0,1|0,0,1]=3 2217 B9R0.39 NC(=N)NC(CO)C(O)=O Amb25073417 [0,1,0,0,0,1|2,0,0]=4 2218 B9R0.39 NC(=N)NC(CS)C(O)=O Amb24711320 [0,1,0,0,0,1|2,0,0]=4 2219 B9R0.39 NC(=N)N[C@H](CO)C(O)=O Amb24685566 [0,1,0,0,0,1|2,0,0]=4 2220 B9R0.39 NC(=O)N[C@@H](CN)C(O)=O Amb25083442 [0,1,0,0,0,1|1,0,0]=3 2221 B9R0.39 NC(=O)N[C@@H](CO)C(O)=O Amb24505082 [0,1,0,0,0,1|1,0,0]=3 2222 B9R0.39 NC(=O)N[C@H](CN)C(O)=O Amb24478873 [0,1,0,0,0,1|1,0,0]=3 2223 B9R0.39 NC(=O)N[C@H](CO)C(O)=O Amb25147528 [0,1,0,0,0,1|1,0,0]=3 2224 B9R0.39 NCC(CC(O)=O)C(O)=O Amb22546423 [0,1,0,0,0,1|0,0,0]=2 2225 B9R0.39 NCC(CC(O)=O)C(O)=O Amb24538047 [0,1,0,0,0,1|0,0,0]=2 2226 B9R0.39 NC[C@H](CC(O)=O)C(O)=O Amb25147272 [0,1,0,0,0,1|0,0,0]=2 2227 B9R0.39 NN[C@@H](CC(O)=O)C(O)=O Amb24117193 [0,1,0,0,0,1|1,0,0]=3 2228 B9R0.39 OC(=O)C(CBr)CC(O)=O Amb22752144 [0,1,0,0,0,1|0,0,0]=2 2229 B9R0.39 OC(=O)C(CC(O)=O)=CBr Amb25225990 [0,1,0,0,0,1|0,0,2]=4 2230 B9R0.39 OC(=O)C(CC(O)=O)=CCl Amb25321956 [0,1,0,0,0,1|0,0,2]=4 2231 B9R0.39 OC(=O)C(CC(O)=O)C=O Amb24732382 [0,1,0,0,0,1|0,0,1]=3 2232 B9R0.39 OC(=O)C(CC(O)=O)NO Amb24685872 [0,1,0,0,0,1|1,0,0]=3 2233 B9R0.39 OC(=O)C(CC(O)=O)NS Amb25808901 [0,1,0,0,0,1|1,0,0]=3 2234 B9R0.39 OC(=O)C(CCl)CC(O)=O Amb25840030 [0,1,0,0,0,1|0,0,0]=2 2235 B9R0.39 OC(=O)C(CS)NS(O)=O Amb24482299 [0,1,0,0,0,1|1,0,0]=3 2236 B9R0.39 OC(=O)[C@H](CC(O)=O)NO Amb24117497 [0,1,0,0,0,1|1,0,0]=3 2237 B9R0.39 OC(=O)[C@H](CC(O)=O)NO Amb24630025 [0,1,0,0,0,1|1,0,0]=3 2238 B9R0.39 OC(=O)\C(=C/C(O)=O)\C=O Amb24568885 [0,1,0,0,0,1|0,0,2]=4 2239 B9R0.39 OC(=O)\C(=C\C(O)=O)\C=O Amb18644051 [0,1,0,0,0,1|0,0,2]=4 2240 B9R0.39 OC(=O)\C(\CBr)=C/C(O)=O Amb24477098 [0,1,0,0,0,1|0,0,1]=3 2241 B9R0.39 OC(=O)\C(\CC(O)=O)=C\Br Amb25758898 [0,1,0,0,0,1|0,0,2]=4 2242 B9R0.39 OC(=O)\C(\CC(O)=O)=N\O Amb24117074 [0,1,0,0,0,1|1,0,1]=4 2243 B9R0.39 OCC(C(=O)O)NC(=O)C Amb1115493 [0,1,0,0,0,1|1,0,0]=3 2244 B9R0.39 OCC(C(=O)O)NC(=O)N Amb1055147 [0,1,0,0,0,1|1,0,0]=3 2245 B9R0.39 OCC(CC(O)=O)C(O)=O Amb24629722 [0,1,0,0,0,1|0,0,0]=2 2246 B9R0.39 SCC(C(=O)O)NC(=O)C Amb1112748 [0,1,0,0,0,1|1,0,0]=3 2247 B9R0.39 SCC(C(=O)O)NC(=O)N Amb1119403 [0,1,0,0,0,1|1,0,0]=3 2248 B9R0.39 SC[C@@H](C(=O)O)NC(=O)N Amb17610484 [0,1,0,0,0,1|1,0,0]=3 2249 B9R0.42 CC(=O)C(C)=CC(=O)OC Amb20668358 [0,1,0,0,0,1|1,0,1]=4 2250 B9R0.42 CC(=O)C(C)CC(=C)CO Amb24477027 [0,1,0,0,0,1|2,0,0]=4 2251 B9R0.42 CC(=O)C(C)CC(=O)CC Amb25146752 [0,1,0,0,0,1|2,0,0]=4 2252 B9R0.42 CC(=O)C(C)NC(=O)C=C Amb25141954 [0,1,0,0,0,1|2,0,0]=4 2253 B9R0.42 CC(=O)C(C)NC(=O)CBr Amb25726340 [0,1,0,0,0,1|2,0,0]=4 2254 B9R0.42 CC(=O)C(C)NC(=O)NC Amb24672055 [0,1,0,0,0,1|2,0,0]=4 2255 B9R0.42 CC(=O)C(C)OC(=O)CO Amb24482745 [0,1,0,0,0,1|1,0,0]=3 2256 B9R0.42 CC(=O)C(C)OC(=O)OC Amb24647748 [0,1,0,0,0,1|1,0,0]=3 2257 B9R0.42 CC(=O)C(C)SC(=S)OC Amb24575972 [0,1,0,0,0,1|1,1,0]=4 2258 B9R0.42 CC(=O)C(C)\C=C(\C)/C=O Amb24715740 [0,1,0,0,0,1|2,0,0]=4 2259 B9R0.42 CC(=O)C(Cl)CC(=O)OC Amb25061154 [0,1,0,0,0,1|2,0,0]=4 2260 B9R0.42 CC(=O)C(N)CC(=O)OC Amb24529258 [0,1,0,0,0,1|2,0,0]=4 2261 B9R0.42 CC(=O)C(O)CC(=O)OC Amb25146688 [0,1,0,0,0,1|2,0,0]=4 2262 B9R0.42 CC(=O)[C@@H](C)CC(=C)CO Amb24423877 [0,1,0,0,0,1|2,0,0]=4 2263 B9R0.42 CC(=O)[C@H](C)NC(=O)OC Amb24377158 [0,1,0,0,0,1|1,0,0]=3 2264 B9R0.42 CC(=O)\C(\C)=C/C(=O)OC Amb25106945 [0,1,0,0,0,1|1,0,1]=4 2265 B9R0.42 CC(=O)\C(\C)=C\C(=O)OC Amb24545647 [0,1,0,0,0,1|1,0,1]=4 2266 B9R0.42 CC(=O)\C(\C)=N\C(=O)OC Amb25146686 [0,1,0,0,0,1|1,0,1]=4 2267 B9R0.42 CC(C(=O)N)CC(=O)NC Amb17334219 [0,1,0,0,0,1|2,0,0]=4 2268 B9R0.42 CC(C(=O)O)NC(=O)CC Amb1116933 [0,1,0,0,0,1|1,0,0]=3 2269 B9R0.42 CC(C(=O)O)NC(=O)NC Amb1130316 [0,1,0,0,0,1|1,0,0]=3 2270 B9R0.42 CC(CC(=O)CCl)C(O)=O Amb24585160 [0,1,0,0,0,1|1,0,0]=3 2271 B9R0.42 CC(CC(=O)CN)C(O)=O Amb25758299 [0,1,0,0,0,1|1,0,0]=3 2272 B9R0.42 CC(CC(=O)OC)C(C)O Amb25260435 [0,1,0,0,0,1|1,0,1]=4 2273 B9R0.42 CC(CC(C)C=O)C(O)=O Amb18644134 [0,1,0,0,0,1|1,0,1]=4 2274 B9R0.42 CC(CC(O)C(O)=O)=NO Amb25291967 [0,1,0,0,0,1|2,0,0]=4 2275 B9R0.42 CC(CC(O)CN)C(O)=O Amb25375725 [0,1,0,0,0,1|1,0,1]=4 2276 B9R0.42 CC(CN(C)C=O)C(O)=O Amb18292993 [0,1,0,0,0,1|2,0,0]=4 2277 B9R0.42 CC(NC(=O)C#C)C(N)=O Amb24430797 [0,1,0,0,0,1|2,0,0]=4 2278 B9R0.42 CC(NC(=O)CS)C(N)=O Amb24482112 [0,1,0,0,0,1|1,1,0]=4 2279 B9R0.42 CC(NC(C)CO)C(O)=O Amb18315378 [0,1,0,0,0,1|1,0,1]=4 2280 B9R0.42 CC(NC(N)=NO)C(N)=O Amb24739344 [0,1,0,0,0,1|2,0,0]=4 2281 B9R0.42 CC(OC(=O)CBr)C(N)=O Amb25695321 [0,1,0,0,0,1|2,0,0]=4 2282 B9R0.42 CC(OC(=O)CN)C(O)=O Amb25305694 [0,1,0,0,0,1|1,0,0]=3 2283 B9R0.42 CC(OC(=O)CO)C(O)=O Amb24480687 [0,1,0,0,0,1|0,0,0]=2 2284 B9R0.42 CC(SC(C)CO)C(O)=O Amb24687156 [0,1,0,0,0,1|1,0,1]=4 2285 B9R0.42 CCC(=C)CC(C)C(O)=O Amb25342029 [0,1,0,0,0,1|2,0,0]=4 2286 B9R0.42 CCC(=C)C[C@H](C)C(O)=O Amb24384990 [0,1,0,0,0,1|2,0,0]=4 2287 B9R0.42 CCC(=O)CC(N)C(O)=O Amb22546324 [0,1,0,0,0,1|2,0,0]=4 2288 B9R0.42 CCC(=O)CC(N)C(O)=O Amb24479073 [0,1,0,0,0,1|2,0,0]=4 2289 B9R0.42 CCC(=O)C[C@@H](C)C(O)=O Amb24680887 [0,1,0,0,0,1|1,0,0]=3 2290 B9R0.42 CCC(=O)C[C@H](N)C(O)=O Amb24479266 [0,1,0,0,0,1|2,0,0]=4 2291 B9R0.42 CCC(=O)NC(C)C(N)=O Amb25067448 [0,1,0,0,0,1|2,0,0]=4 2292 B9R0.42 CCC(=O)N[C@@H](C)C(O)=O Amb22901053 [0,1,0,0,0,1|1,0,0]=3 2293 B9R0.42 CCC(=O)OC(C)C(N)=O Amb25780866 [0,1,0,0,0,1|2,0,0]=4 2294 B9R0.42 CCC(=O)OC(C)C(O)=O Amb18644241 [0,1,0,0,0,1|1,0,0]=3 2295 B9R0.42 CCS(=O)CC(C)C(O)=O Amb19012076 [0,1,0,0,0,1|2,0,0]=4 2296 B9R0.42 CCS(=O)N[C@H](C)C(O)=O Amb24572538 [0,1,0,0,0,1|2,0,0]=4 2297 B9R0.42 CNC(=O)C[C@@H](N)C(O)=O Amb20240891 [0,1,0,0,0,1|2,0,0]=4 2298 B9R0.42 CNC(=O)C[C@H](N)C(O)=O Amb20242140 [0,1,0,0,0,1|2,0,0]=4 2299 B9R0.42 CNC(=O)N[C@@H](C)C(O)=O Amb24478025 [0,1,0,0,0,1|1,0,0]=3 2300 B9R0.42 CNC(=O)N[C@H](C)C(N)=O Amb24734187 [0,1,0,0,0,1|2,0,0]=4 2301 B9R0.42 CNC(=O)N[C@H](C)C(O)=O Amb24558529 [0,1,0,0,0,1|1,0,0]=3 2302 B9R0.42 CNC(=S)N[C@@H](C)C(O)=O Amb25123317 [0,1,0,0,0,1|1,1,0]=4 2303 B9R0.42 CNC(=S)N[C@H](C)C(O)=O Amb24470154 [0,1,0,0,0,1|1,1,0]=4 2304 B9R0.42 COC(=O)CC(=O)C(O)=O Amb22728219 [0,1,0,0,0,1|1,0,1]=4 2305 B9R0.42 COC(=O)CC(Br)C(O)=O Amb18656998 [0,1,0,0,0,1|1,0,0]=3 2306 B9R0.42 COC(=O)CC(C(=O)C)Br Amb17403794 [0,1,0,0,0,1|2,0,0]=4 2307 B9R0.42 COC(=O)CC(C)C(N)=O Amb24604307 [0,1,0,0,0,1|1,0,0]=3 2308 B9R0.42 COC(=O)CC(C)C(O)=O Amb18644239 [0,1,0,0,0,1|0,0,0]=2 2309 B9R0.42 COC(=O)CC(C)S(C)=O Amb18788309 [0,1,0,0,0,1|2,0,0]=4 2310 B9R0.42 COC(=O)CC(N)C(O)=O Amb22489498 [0,1,0,0,0,1|1,0,0]=3 2311 B9R0.42 COC(=O)CC(O)C(O)=O Amb25786182 [0,1,0,0,0,1|1,0,0]=3 2312 B9R0.42 COC(=O)C[C@@H](C(=O)O)N Amb13884879 [0,1,0,0,0,1|1,0,0]=3 2313 B9R0.42 COC(=O)C[C@@H](C)C(=O)Cl Amb24556752 [0,1,0,0,0,1|1,0,0]=3 2314 B9R0.42 COC(=O)C[C@@H](N)C(O)=O Amb22745861 [0,1,0,0,0,1|1,0,0]=3 2315 B9R0.42 COC(=O)C[C@@H](O)C(O)=O Amb23603858 [0,1,0,0,0,1|1,0,0]=3 2316 B9R0.42 COC(=O)C[C@H](Br)C(N)=O Amb25326024 [0,1,0,0,0,1|2,0,0]=4 2317 B9R0.42 COC(=O)C[C@H](O)C(O)=O Amb25367304 [0,1,0,0,0,1|1,0,0]=3 2318 B9R0.42 COC(=O)C[C@H]([NH3+])C(=O)O Amb10574406 [0,1,0,0,0,1|1,0,0]=3 2319 B9R0.42 COC(=O)NC(C)C(=O)Cl Amb25365583 [0,1,0,0,0,1|1,0,0]=3 2320 B9R0.42 COC(=O)NC(C)C(N)=O Amb24459048 [0,1,0,0,0,1|1,0,0]=3 2321 B9R0.42 COC(=O)NC(C)C(N)=S Amb18180045 [0,1,0,0,0,1|1,1,0]=4 2322 B9R0.42 COC(=O)NN(C)C(N)=O Amb25305829 [0,1,0,0,0,1|2,0,0]=4 2323 B9R0.42 COC(=O)N[C@@H](C)C(O)=O Amb24477985 [0,1,0,0,0,1|0,0,0]=2 2324 B9R0.42 COC(=O)N[C@H](C)C(=O)Cl Amb24505067 [0,1,0,0,0,1|1,0,0]=3 2325 B9R0.42 COC(=O)N[C@H](C)C(O)=O Amb24381066 [0,1,0,0,0,1|0,0,0]=2 2326 B9R0.42 COC(=S)NC(C)C(O)=O Amb24740723 [0,1,0,0,0,1|0,1,0]=3 2327 B9R0.42 COC(=S)N[C@@H](C)C(O)=O Amb25088529 [0,1,0,0,0,1|0,1,0]=3 2328 B9R0.42 CO[C@@H](C)C[C@H](C)C(O)=O Amb24691586 [0,1,0,0,0,1|1,0,1]=4 2329 B9R0.42 CSC(=S)NC(C)C(O)=O Amb24536549 [0,1,0,0,0,1|0,2,0]=4 2330 B9R0.42 CSC(=S)N[C@H](C)C(O)=O Amb25798847 [0,1,0,0,0,1|0,2,0]=4 2331 B9R0.42 C[C@@H](CC(=O)OC)[C@H](C)O Amb25206323 [0,1,0,0,0,1|1,0,1]=4 2332 B9R0.42 C[C@@H](C[C@H](O)CN)C(O)=O Amb24447195 [0,1,0,0,0,1|1,0,1]=4 2333 B9R0.42 C[C@@H](NC(=O)C#C)C(N)=O Amb25046994 [0,1,0,0,0,1|2,0,0]=4 2334 B9R0.42 C[C@@H](NC(=O)C#C)C(O)=O Amb25289450 [0,1,0,0,0,1|1,0,0]=3 2335 B9R0.42 C[C@@H](NC(=O)C=C)C(O)=O Amb25780798 [0,1,0,0,0,1|1,0,0]=3 2336 B9R0.42 C[C@@H](NC(=O)CBr)C(N)=O Amb25694906 [0,1,0,0,0,1|2,0,0]=4 2337 B9R0.42 C[C@@H](NC(=O)CN)C(N)=O Amb22799926 [0,1,0,0,0,1|2,0,0]=4 2338 B9R0.42 C[C@@H](NC(=O)CN)C(O)=O Amb22746707 [0,1,0,0,0,1|1,0,0]=3 2339 B9R0.42 C[C@H](C(=O)O)NC(=O)CCl Amb10842258 [0,1,0,0,0,1|1,0,0]=3 2340 B9R0.42 C[C@H](C[C@H](C)CO)C(O)=O Amb24480419 [0,1,0,0,0,1|1,0,1]=4 2341 B9R0.42 C[C@H](NC(=O)C#C)C(N)=O Amb25766276 [0,1,0,0,0,1|2,0,0]=4 2342 B9R0.42 C[C@H](NC(=O)C=C)C(O)=O Amb25805764 [0,1,0,0,0,1|1,0,0]=3 2343 B9R0.42 C[C@H](NC(=O)CBr)C(N)=O Amb25040226 [0,1,0,0,0,1|2,0,0]=4 2344 B9R0.42 C[C@H](NC(=O)CBr)C(O)=O Amb25804070 [0,1,0,0,0,1|1,0,0]=3 2345 B9R0.42 C[C@H](NC(=O)CCl)C(=O)Cl Amb24482424 [0,1,0,0,0,1|2,0,0]=4 2346 B9R0.42 C[C@H](NC(=O)CN)C(N)=O Amb19929924 [0,1,0,0,0,1|2,0,0]=4 2347 B9R0.42 C[C@H](NC(=O)CN)C(N)=O Amb24761022 [0,1,0,0,0,1|2,0,0]=4 2348 B9R0.42 C[C@H](OC(=O)CO)C(O)=O Amb24469338 [0,1,0,0,0,1|0,0,0]=2 2349 B9R0.42 C\C(=C/C(=O)OC)\C(N)=O Amb25809435 [0,1,0,0,0,1|1,0,1]=4 2350 B9R0.42 C\C(=C/C(=O)OC)\C(O)=O Amb18644070 [0,1,0,0,0,1|0,0,1]=3 2351 B9R0.42 C\C(=C\C(=O)NC)\C(O)=O Amb25271038 [0,1,0,0,0,1|1,0,1]=4 2352 B9R0.42 C\C(=C\C(=O)OC)\C(O)=O Amb24670134 [0,1,0,0,0,1|0,0,1]=3 2353 B9R0.42 C\C(=N\C(=O)CO)\C(O)=O Amb24505276 [0,1,0,0,0,1|0,0,1]=3 2354 B9R0.42 C\C(\C=C)=C/[C@H](C)C(O)=O Amb25239302 [0,1,0,0,0,1|2,0,0]=4 2355 B9R0.42 C\C(\C=C)=C\C(C)C(O)=O Amb24381514 [0,1,0,0,0,1|2,0,0]=4 2356 B9R0.42 C\C(\CCl)=C/[C@H](C)C(O)=O Amb25313581 [0,1,0,0,0,1|2,0,0]=4 2357 B9R0.42 C\C(\CO)=C/[C@H](C)C(C)=O Amb24371636 [0,1,0,0,0,1|2,0,0]=4 2358 B9R0.42 NC(CC(=O)CBr)C(O)=O Amb24477386 [0,1,0,0,0,1|2,0,0]=4 2359 B9R0.42 NC(CC(=O)CCl)C(O)=O Amb24061070 [0,1,0,0,0,1|2,0,0]=4 2360 B9R0.42 NC(CC(=O)CO)C(O)=O Amb18644310 [0,1,0,0,0,1|1,0,0]=3 2361 B9R0.42 NC(CC(=O)NCl)C(O)=O Amb24454054 [0,1,0,0,0,1|2,0,0]=4 2362 B9R0.42 NC(CC(=O)NO)C(O)=O Amb22349932 [0,1,0,0,0,1|1,0,0]=3 2363 B9R0.42 NC(\C=C(\P)/C=O)C(O)=O Amb25361040 [0,1,0,0,0,1|2,0,0]=4 2364 B9R0.42 NCC(=O)CC(F)C(O)=O Amb25367166 [0,1,0,0,0,1|2,0,0]=4 2365 B9R0.42 NCC(=O)CC(N)C(O)=O Amb24462002 [0,1,0,0,0,1|2,0,0]=4 2366 B9R0.42 NCC(=O)C[C@H](N)C(O)=O Amb25757838 [0,1,0,0,0,1|2,0,0]=4 2367 B9R0.42 NNC(=O)C[C@H](N)C(O)=O Amb24680907 [0,1,0,0,0,1|2,0,0]=4 2368 B9R0.42 N[C@@H](CC(=O)CBr)C(O)=O Amb24477399 [0,1,0,0,0,1|2,0,0]=4 2369 B9R0.42 N[C@@H](C[C@@H](O)C=O)C(O)=O Amb25367252 [0,1,0,0,0,1|1,0,1]=4 2370 B9R0.42 N[C@H](CC(=O)NO)C(O)=O Amb24451287 [0,1,0,0,0,1|1,0,0]=3 2371 B9R0.42 O=NN(CC(C(=O)O)N)O Amb17607757 [0,1,0,0,0,1|2,0,0]=4 2372 B9R0.42 O=NN(C[C@@H](C(=O)O)N)O Amb17607759 [0,1,0,0,0,1|2,0,0]=4 2373 B9R0.42 O=[15N][15N](CC(C(=O)O)N)O Amb17607758 [0,1,0,0,0,1|2,0,0]=4 2374 B9R0.42 OC(=O)C(O)CC(=O)CBr Amb24477419 [0,1,0,0,0,1|2,0,0]=4 2375 B9R0.57 CC(=CP(O)(O)=O)C(O)=O Amb24677590 [0,1,0,0,0,1|1,0,1]=4 2376 B9R0.57 CC(CC(C)(C)O)C(O)=O Amb24529313 [0,1,0,0,0,1|1,0,1]=4 2377 B9R0.57 CC(CS(=O)(=O)Cl)C(O)=O Amb25243850 [0,1,0,0,0,1|1,0,1]=4 2378 B9R0.57 CC(CS(C)(=O)=O)C(O)=O Amb18971622 [0,1,0,0,0,1|1,0,1]=4 2379 B9R0.57 CC(CS(N)(=O)=O)C(O)=O Amb18563379 [0,1,0,0,0,1|1,0,1]=4 2380 B9R0.57 CC(CS(O)(=O)=O)C(O)=O Amb25101588 [0,1,0,0,0,1|1,0,0]=3 2381 B9R0.57 CC(NP(O)(O)=O)C(O)=O Amb25138603 [0,1,0,0,0,1|1,0,0]=3 2382 B9R0.57 CC(OP(O)(O)=O)C(C)=O Amb24450163 [0,1,0,0,0,1|2,0,0]=4 2383 B9R0.57 CC(OP(O)(O)=O)C(N)=O Amb25074106 [0,1,0,0,0,1|2,0,0]=4 2384 B9R0.57 C[C@@H](CS(C)(=O)=O)C(O)=O Amb24652197 [0,1,0,0,0,1|1,0,1]=4 2385 B9R0.57 C[C@@H](NS(C)(=O)=O)C(O)=O Amb18792765 [0,1,0,0,0,1|1,0,1]=4 2386 B9R0.57 C[C@@H](OS(C)(=O)=O)C(O)=O Amb22746830 [0,1,0,0,0,1|1,0,1]=4 2387 B9R0.57 C[C@H](CS(C)(=O)=O)C(O)=O Amb24436447 [0,1,0,0,0,1|1,0,1]=4 2388 B9R0.57 C[C@H](OP(O)(O)=O)C(O)=O Amb24400328 [0,1,0,0,0,1|1,0,0]=3 2389 B9R0.57 C[C@H](OS(C)(=O)=O)C(O)=O Amb25701707 [0,1,0,0,0,1|1,0,1]=4 2390 B9R0.57 C\C(=C/P(O)(O)=O)\C(O)=O Amb25774905 [0,1,0,0,0,1|1,0,1]=4 2391 B9R0.57 NC(CS(O)(=O)=O)C(O)=O Amb21929317 [0,1,0,0,0,1|2,0,0]=4 2392 B9R0.57 N[C@@H](CS(O)(=O)=O)C(O)=O Amb17942867 [0,1,0,0,0,1|2,0,0]=4 2393 B9R0.57 OC(=O)C(NS(=O)(=O)C)C Amb1116653 [0,1,0,0,0,1|1,0,1]=4 2394 B9R0.57 OC(=O)[C@H](C[C](=O)(O)C)N Amb10604178 [0,1,0,0,0,1|1,0,1]=4 2395 B9R0.57 OC(CS(O)(=O)=O)C(O)=O Amb20247567 [0,1,0,0,0,1|2,0,0]=4 2396 B9R0.57 OC(OP(O)(O)=O)C(O)=O Amb25380880 [0,1,0,0,0,1|2,0,0]=4 2397 B9R0.57 O[C@H](CS(O)(=O)=O)C(O)=O Amb24482388 [0,1,0,0,0,1|2,0,0]=4 2398 B9R0.79 C=C(C(N)C(O)=O)C(N)=O Amb25316245 [0,1,0,0,0,1|2,0,0]=4 2399 B9R0.79 C=C(C(N)C(O)=O)C(O)=O Amb18644186 [0,1,0,0,0,1|1,0,0]=3 2400 B9R0.79 C=C(C(O)=O)C(=C)C(O)=O Amb18643786 [0,1,0,0,0,1|0,0,2]=4 2401 B9R0.79 C=C(C(O)C(O)=O)C(O)=O Amb20671613 [0,1,0,0,0,1|1,0,0]=3 2402 B9R0.79 CC(=C)C(O)C(C)C(O)=O Amb18644101 [0,1,0,0,0,1|2,0,0]=4 2403 B9R0.79 CC(=C)[C@@H](C)[C@H](C)C(O)=O Amb24480381 [0,1,0,0,0,1|2,0,0]=4 2404 B9R0.79 CC(=C)[C@@H](O)[C@H](C)C(O)=O Amb24599978 [0,1,0,0,0,1|2,0,0]=4 2405 B9R0.79 CC(=C)[C@H](C)[C@H](C)C(O)=O Amb25122106 [0,1,0,0,0,1|2,0,0]=4 2406 B9R0.79 CC(=C)[C@H](O)[C@@H](C)C(O)=O Amb25111582 [0,1,0,0,0,1|2,0,0]=4 2407 B9R0.79 CC(=O)C(=C)C(O)C(O)=O Amb24563821 [0,1,0,0,0,1|2,0,0]=4 2408 B9R0.79 CC(=O)C(C)=C(C)C(O)=O Amb25273854 [0,1,0,0,0,1|1,0,1]=4 2409 B9R0.79 CC(=O)C(C)C(C)C(O)=O Amb24401092 [0,1,0,0,0,1|1,0,0]=3 2410 B9R0.79 CC(=O)C(C)C(N)C(O)=O Amb18202116 [0,1,0,0,0,1|1,0,0]=3 2411 B9R0.79 CC(=O)C(C)C(O)C(O)=O Amb25341155 [0,1,0,0,0,1|1,0,0]=3 2412 B9R0.79 CC(=O)C(O)C(C)C(O)=O Amb25255327 [0,1,0,0,0,1|1,0,0]=3 2413 B9R0.79 CC(=O)C(O)C(O)C(O)=O Amb25292189 [0,1,0,0,0,1|2,0,0]=4 2414 B9R0.79 CC(=O)N(C)C(=C)C(O)=O Amb24117538 [0,1,0,0,0,1|2,0,0]=4 2415 B9R0.79 CC(=O)N(C)C(C)C(N)=O Amb25147335 [0,1,0,0,0,1|2,0,0]=4 2416 B9R0.79 CC(=O)N(C)C(C)C(O)=O Amb18288022 [0,1,0,0,0,1|1,0,0]=3 2417 B9R0.79 CC(=O)N(C)[C@@H](C)C(N)=O Amb24427958 [0,1,0,0,0,1|2,0,0]=4 2418 B9R0.79 CC(=O)N(C)[C@@H](C)C(O)=O Amb25709201 [0,1,0,0,0,1|1,0,0]=3 2419 B9R0.79 CC(=O)N(C)[C@H](C)C(N)=O Amb24372366 [0,1,0,0,0,1|2,0,0]=4 2420 B9R0.79 CC(=O)[C@@H](C)[C@@H](C)C(C)=O Amb25146730 [0,1,0,0,0,1|2,0,0]=4 2421 B9R0.79 CC(=O)[C@@H](C)[C@H](C)C(O)=O Amb25771163 [0,1,0,0,0,1|1,0,0]=3 2422 B9R0.79 CC(=O)[C@@H](C)[C@H](N)C(O)=O Amb25703453 [0,1,0,0,0,1|1,0,0]=3 2423 B9R0.79 CC(=O)[C@@H](O)[C@H](C)C(O)=O Amb25077192 [0,1,0,0,0,1|1,0,0]=3 2424 B9R0.79 CC(=O)[C@H](C)[C@H](C)C(O)=O Amb25805859 [0,1,0,0,0,1|1,0,0]=3 2425 B9R0.79 CC(=O)[C@H](C)[C@H](O)C(O)=O Amb24376865 [0,1,0,0,0,1|1,0,0]=3 2426 B9R0.79 CC(C(=C)C(O)=O)C(O)=O Amb18644063 [0,1,0,0,0,1|0,0,0]=2 2427 B9R0.79 CC(C(=O)C(C)=O)C(C)=O Amb25692911 [0,1,0,0,0,1|2,0,0]=4 2428 B9R0.79 CC(C(C)C(=O)Cl)C(=O)Cl Amb22347385 [0,1,0,0,0,1|2,0,0]=4 2429 B9R0.79 CC(C(C)O)C(=O)C(O)=O Amb24454984 [0,1,0,0,0,1|1,0,1]=4 2430 B9R0.79 CC(C(Cl)C(C)=O)C(C)=O Amb24357432 [0,1,0,0,0,1|2,0,0]=4 2431 B9R0.79 CC(C(N)=O)N(C)C(N)=O Amb25147563 [0,1,0,0,0,1|2,0,0]=4 2432 B9R0.79 CC(C(O)=O)=C(C)C(O)=O Amb24712245 [0,1,0,0,0,1|0,0,1]=3 2433 B9R0.79 CC(C(O)=O)N(C)C(N)=O Amb18962712 [0,1,0,0,0,1|1,0,0]=3 2434 B9R0.79 CC(C(O)=O)N(C)S(C)=O Amb25177141 [0,1,0,0,0,1|2,0,0]=4 2435 B9R0.79 CC(C(O)C(N)=O)C(O)=O Amb25728281 [0,1,0,0,0,1|1,0,0]=3 2436 B9R0.79 CC(O)C(C)C(N)C(O)=O Amb21953714 [0,1,0,0,0,1|1,0,1]=4 2437 B9R0.79 CC(O)C(C)[C@@H](N)C(O)=O Amb22800202 [0,1,0,0,0,1|1,0,1]=4 2438 B9R0.79 CC(O)[C@@H](C)[C@@H](N)C(O)=O Amb24052812 [0,1,0,0,0,1|1,0,1]=4 2439 B9R0.79 CC([C@@H](N)C(O)=O)C(O)=O Amb22745450 [0,1,0,0,0,1|0,0,0]=2 2440 B9R0.79 CC([C@@H]([C@@H](C(=O)O)N)C)O Amb10603785 [0,1,0,0,0,1|1,0,1]=4 2441 B9R0.79 CN(C(C)C(O)=O)C(N)=N Amb24434986 [0,1,0,0,0,1|2,0,0]=4 2442 B9R0.79 CN(O)C(C)C(C)C(O)=O Amb24540667 [0,1,0,0,0,1|2,0,0]=4 2443 B9R0.79 C[C@@H](O)[C@@H](C)[C@@H](N)C(O)=O Amb25693814 [0,1,0,0,0,1|1,0,1]=4 2444 B9R0.79 C[C@@H](O)[C@@H](C)[C@H](N)C(O)=O Amb24340188 [0,1,0,0,0,1|1,0,1]=4 2445 B9R0.79 C[C@@H]([C@@H](C)C(O)=O)C(O)=O Amb22801175 [0,1,0,0,0,1|0,0,0]=2 2446 B9R0.79 C[C@@H]([C@H](N)C(O)=O)C(O)=O Amb22756698 [0,1,0,0,0,1|0,0,0]=2 2447 B9R0.79 C[C@H](C(=C)C(O)=O)C(O)=O Amb24480380 [0,1,0,0,0,1|0,0,0]=2 2448 B9R0.79 C[C@H](O)C(C)[C@H](N)C(O)=O Amb22735316 [0,1,0,0,0,1|1,0,1]=4 2449 B9R0.79 C[C@H]([C@@H](C)C(O)=O)C(N)=O Amb25113911 [0,1,0,0,0,1|1,0,0]=3 2450 B9R0.79 C[C@H]([C@@H]([C@@H](C(=O)O)N)C)O Amb17615448 [0,1,0,0,0,1|1,0,1]=4 2451 B9R0.79 C[C@H]([C@H](C)C(N)=O)C(N)=O Amb25091711 [0,1,0,0,0,1|2,0,0]=4 2452 B9R0.79 C[C@H]([C@H](Cl)C(O)=O)C(O)=O Amb25684803 [0,1,0,0,0,1|0,0,0]=2 2453 B9R0.79 C[C@H]([C@H](N)C(O)=O)C(O)=O Amb25324829 [0,1,0,0,0,1|0,0,0]=2 2454 B9R0.79 C\C(\C(N)=O)=C(\C)/C(O)=O Amb24479070 [0,1,0,0,0,1|1,0,1]=4 2455 B9R0.79 C\C(\C(O)=O)=C(/C)\C(O)=O Amb18644072 [0,1,0,0,0,1|0,0,1]=3 2456 B9R0.79 C\C(\C(O)=O)=C(\C)/C(O)=O Amb24308873 [0,1,0,0,0,1|0,0,1]=3 2457 B9R0.79 NC(=O)C(F)C(N)C(O)=O Amb25300324 [0,1,0,0,0,1|2,0,0]=4 2458 B9R0.79 NC(=O)C(F)[C@H](N)C(O)=O Amb24691333 [0,1,0,0,0,1|2,0,0]=4 2459 B9R0.79 NC(=O)C(O)C(N)C(O)=O Amb25218088 [0,1,0,0,0,1|2,0,0]=4 2460 B9R0.79 NC(=O)C(O)C(O)C(O)=O Amb24112928 [0,1,0,0,0,1|2,0,0]=4 2461 B9R0.79 NC(=O)[C@@H](N)[C@H](O)C(O)=O Amb24584998 [0,1,0,0,0,1|2,0,0]=4 2462 B9R0.79 NC(=O)[C@@H](O)[C@H](N)C(O)=O Amb24763774 [0,1,0,0,0,1|2,0,0]=4 2463 B9R0.79 NC(=O)[C@@H](O)[C@H](O)C(O)=O Amb25147369 [0,1,0,0,0,1|2,0,0]=4 2464 B9R0.79 NC(=O)[C@H](N)[C@H](N)C(O)=O Amb24358166 [0,1,0,0,0,1|2,0,0]=4 2465 B9R0.79 NC(=O)[C@H](N)[C@H](O)C(O)=O Amb25789713 [0,1,0,0,0,1|2,0,0]=4 2466 B9R0.79 NC(=O)[C@H](O)[C@H](O)C(O)=O Amb24630392 [0,1,0,0,0,1|2,0,0]=4 2467 B9R0.79 NC(C(Br)C(O)=O)C(O)=O Amb18657078 [0,1,0,0,0,1|1,0,0]=3 2468 B9R0.79 NC(C(Cl)C(O)=O)C(O)=O Amb18126453 [0,1,0,0,0,1|1,0,0]=3 2469 B9R0.79 NC(C(F)C(O)=O)C(O)=O Amb24061061 [0,1,0,0,0,1|1,0,0]=3 2470 B9R0.79 NC(C(N)C(O)=O)C(O)=O Amb18124865 [0,1,0,0,0,1|1,0,0]=3 2471 B9R0.79 NC(C(N)C(O)=O)C(O)=O Amb24117894 [0,1,0,0,0,1|1,0,0]=3 2472 B9R0.79 NC(C(O)=O)=C(N)C(O)=O Amb25349480 [0,1,0,0,0,1|1,0,1]=4 2473 B9R0.79 NC([C@H](O)C(O)=O)C(O)=O Amb24513602 [0,1,0,0,0,1|1,0,0]=3 2474 B9R0.79 N[C@@H](C(O)C(O)=O)C(O)=O Amb22229324 [0,1,0,0,0,1|1,0,0]=3 2475 B9R0.79 N[C@@H]([C@@H](O)C(O)=O)C(O)=O Amb24087715 [0,1,0,0,0,1|1,0,0]=3 2476 B9R0.79 N[C@@H]([C@@H](O)C(O)=O)C(O)=O Amb24117974 [0,1,0,0,0,1|1,0,0]=3 2477 B9R0.79 N[C@H]([C@@H](C(=O)O)N)C(=O)O Amb10072362 [0,1,0,0,0,1|1,0,0]=3 2478 B9R0.79 N[C@H]([C@@H](F)C(O)=O)C(O)=O Amb22229006 [0,1,0,0,0,1|1,0,0]=3 2479 B9R0.79 N[C@H]([C@@H](N)C(O)=O)C(O)=O Amb22802394 [0,1,0,0,0,1|1,0,0]=3 2480 B9R0.79 N[C@H]([C@@H](O)C(O)=O)C(O)=O Amb17942870 [0,1,0,0,0,1|1,0,0]=3 2481 B9R0.79 N[C@H]([C@H](F)C(O)=O)C(O)=O Amb24634454 [0,1,0,0,0,1|1,0,0]=3 2482 B9R0.79 N\C(\C(O)=O)=C(/N)\C(O)=O Amb24578776 [0,1,0,0,0,1|1,0,1]=4 2483 B9R0.79 OC(=O)C(=O)C(=O)C(O)=O Amb22234966 [0,1,0,0,0,1|1,0,1]=4 2484 B9R0.79 OC(=O)C(C(C(=O)O)C)Cl Amb17594150 [0,1,0,0,0,1|0,0,0]=2 2485 B9R0.79 OC(=O)C(C(C(=O)O)C)N Amb2099482 [0,1,0,0,0,1|0,0,0]=2 2486 B9R0.79 OC(=O)C(C(C(=O)O)C)O Amb17593680 [0,1,0,0,0,1|0,0,0]=2 2487 B9R0.79 OC(=O)C(C(C(=O)O)O)Cl Amb17594225 [0,1,0,0,0,1|1,0,0]=3 2488 B9R0.79 OC(=O)C(C(C(=O)O)O)O Amb16224824 [0,1,0,0,0,1|1,0,0]=3 2489 B9R0.79 OC(=O)C(C(C(=O)O)O)O Amb2553366 [0,1,0,0,0,1|1,0,0]=3 2490 B9R0.79 OC(=O)C(C(C(=O)O)O)O Amb2553386 [0,1,0,0,0,1|1,0,0]=3 2491 B9R0.79 OC(=O)C(Cl)=C(Cl)C(O)=O Amb25173036 [0,1,0,0,0,1|1,0,1]=4 2492 B9R0.79 OC(=O)C(F)C(Br)C(O)=O Amb24759132 [0,1,0,0,0,1|1,0,0]=3 2493 B9R0.79 OC(=O)C(F)C(F)C(O)=O Amb24482465 [0,1,0,0,0,1|1,0,0]=3 2494 B9R0.79 OC(=O)C(O)C(O)C(O)=O Amb22732623 [0,1,0,0,0,1|1,0,0]=3 2495 B9R0.79 OC(=O)C(O)C(O)C(O)=O Amb22747860 [0,1,0,0,0,1|1,0,0]=3 2496 B9R0.79 OC(=O)C(O)C(O)C(O)=O Amb22904195 [0,1,0,0,0,1|1,0,0]=3 2497 B9R0.79 OC(=O)C(O)C(O)C(O)=O Amb24107517 [0,1,0,0,0,1|1,0,0]=3 2498 B9R0.79 OC(=O)C(O)C(O)C(O)=O Amb24668916 [0,1,0,0,0,1|1,0,0]=3 2499 B9R0.79 OC(=O)[C@@H](Cl)[C@@H](Cl)C(O)=O Amb25146239 [0,1,0,0,0,1|1,0,0]=3 2500 B9R0.79 OC(=O)[C@@H](F)[C@H](Cl)C(O)=O Amb25061294 [0,1,0,0,0,1|1,0,0]=3 2501 B9R0.79 OC(=O)[C@@H](O)[C@@H](O)C(O)=O Amb22230832 [0,1,0,0,0,1|1,0,0]=3 2502 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb19884028 [0,1,0,0,0,1|1,0,0]=3 2503 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22224835 [0,1,0,0,0,1|1,0,0]=3 2504 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22750609 [0,1,0,0,0,1|1,0,0]=3 2505 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22756774 [0,1,0,0,0,1|1,0,0]=3 2506 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22800414 [0,1,0,0,0,1|1,0,0]=3 2507 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22801138 [0,1,0,0,0,1|1,0,0]=3 2508 B9R0.79 OC(=O)[C@@H](O)[C@H](O)C(O)=O Amb22801799 [0,1,0,0,0,1|1,0,0]=3 2509 B9R0.79 OC(=O)[C@H](C(C(=O)O)C)N Amb16232531 [0,1,0,0,0,1|0,0,0]=2 2510 B9R0.79 OC(=O)[C@H](Cl)[C@@H](Cl)C(O)=O Amb24390367 [0,1,0,0,0,1|1,0,0]=3 2511 B9R0.79 OC(=O)[C@H](F)[C@H](Cl)C(O)=O Amb25774512 [0,1,0,0,0,1|1,0,0]=3 2512 B9R0.79 OC(=O)[C@H](O)[C@@H](O)C(O)=O Amb19884026 [0,1,0,0,0,1|1,0,0]=3 2513 B9R0.79 OC(=O)[C@H](O)[C@@H](O)C(O)=O Amb20240604 [0,1,0,0,0,1|1,0,0]=3 2514 B9R0.79 OC(=O)[C@H](O)[C@@H](O)C(O)=O Amb20670711 [0,1,0,0,0,1|1,0,0]=3 2515 B9R0.79 OC(=O)[C@H](S)[C@@H](S)C(O)=O Amb25374645 [0,1,0,0,0,1|1,0,0]=3 2516 B9R0.79 OC(=O)[C@H]([C@@H](C(=O)O)N)O Amb17615140 [0,1,0,0,0,1|1,0,0]=3 2517 B9R0.79 OC(=O)[C@H]([C@@H](C(=O)O)O)O Amb10604195 [0,1,0,0,0,1|1,0,0]=3 2518 B9R0.79 OC(=O)\C(\Br)=C(\Br)/C(O)=O Amb22347940 [0,1,0,0,0,1|1,0,1]=4 2519 B9R0.79 OC(=O)\C(\Cl)=C(\Cl)/C(O)=O Amb18522185 [0,1,0,0,0,1|1,0,1]=4 2520 B9R0.79 OC(=O)\C(\F)=C(\Cl)/C(O)=O Amb24711227 [0,1,0,0,0,1|1,0,1]=4 2521 B9R0.79 OC(=O)\C(\O)=C(/O)\C(O)=O Amb18511532 [0,1,0,0,0,1|1,0,1]=4 2522 B9R0.79 OC(C(F)C(O)=O)C(O)=O Amb24479232 [0,1,0,0,0,1|1,0,0]=3 2523 B9R0.79 OC(C(S)C(O)=O)C(O)=O Amb25776261 [0,1,0,0,0,1|1,0,0]=3 2524 B9R0.79 O[C@@H]([C@@H](Cl)C(O)=O)C(O)=O Amb24524583 [0,1,0,0,0,1|1,0,0]=3 2525 B9R0.79 O[C@@H]([C@H](Br)C(O)=O)C(O)=O Amb24680321 [0,1,0,0,0,1|1,0,0]=3 2526 B9R0.79 O[C@@H]([C@H](F)C(O)=O)C(O)=O Amb24470062 [0,1,0,0,0,1|1,0,0]=3 2527 B9R0.79 O[C@H]([C@@H](Cl)C(O)=O)C(O)=O Amb24390265 [0,1,0,0,0,1|1,0,0]=3 2528 B9R0.79 O\C(=C(\C(=O)O)/O)\C(=O)O Amb17593679 [0,1,0,0,0,1|1,0,1]=4 2529 B9R0.79 [2H]\C(\C(O)=O)=C(\[2H])/C(O)=O Amb22338640 [0,1,0,0,0,1|1,0,1]=4 2530 B9R0.79 [O-]C(=O)C(O)C(O)C(O)=O Amb20246422 [0,1,0,0,0,1|1,0,1]=4 2531 B9R0.79 [O-]C(=O)C(O)C(O)C(O)=O Amb22052542 [0,1,0,0,0,1|1,0,1]=4 2532 B9R0.79 [O-]C(=O)[C@@H](O)[C@H](O)C(O)=O Amb22348349 [0,1,0,0,0,1|1,0,1]=4 2533 B9R0.79 [O-]C(=O)[C@@H](O)[C@H](O)C(O)=O Amb22800925 [0,1,0,0,0,1|1,0,1]=4 2534 B9R0.79 [O-]C(=O)[C@H](O)[C@@H](O)C(O)=O Amb22353007 [0,1,0,0,0,1|1,0,1]=4 2535 B9R0.6 CC(=C)C(C)C(=O)OCC Amb25308143 [0,2,0,0,0,0|2,0,0]=4 2536 B9R0.6 CC(=O)C(Br)C(=O)OC=C Amb25738997 [0,2,0,0,0,0|2,0,0]=4 2537 B9R0.6 CC(=O)C(Br)C(=O)OCC Amb22232107 [0,2,0,0,0,0|2,0,0]=4 2538 B9R0.6 CC(=O)C(C)C(=O)CC=C Amb25262687 [0,2,0,0,0,0|2,0,0]=4 2539 B9R0.6 CC(=O)C(C)C(=O)NCC Amb24096571 [0,2,0,0,0,0|2,0,0]=4 2540 B9R0.6 CC(=O)C(N)C(=O)OCC Amb18124722 [0,2,0,0,0,0|2,0,0]=4 2541 B9R0.6 CC(=O)[C@H](C)C(=O)OCC Amb24524695 [0,2,0,0,0,0|1,0,0]=3 2542 B9R0.6 CC(C(C)CC=O)C(O)=O Amb18644133 [0,2,0,0,0,0|1,0,1]=4 2543 B9R0.6 CC(C(C)NC=O)C(O)=O Amb24543868 [0,2,0,0,0,0|1,0,1]=4 2544 B9R0.6 CC(C(C)NOC)C(O)=O Amb24465798 [0,2,0,0,0,0|1,0,1]=4 2545 B9R0.6 CC(C(O)=O)S(=O)CC#N Amb18289518 [0,2,0,0,0,0|2,0,0]=4 2546 B9R0.6 CC(C(O)=O)S(=O)CCF Amb24638591 [0,2,0,0,0,0|2,0,0]=4 2547 B9R0.6 CC(C(O)CCC)C(O)=O Amb18310700 [0,2,0,0,0,0|1,0,1]=4 2548 B9R0.6 CC(C(O)\C=C\C)C(O)=O Amb18644138 [0,2,0,0,0,0|1,0,1]=4 2549 B9R0.6 CC([C@@H](C)O)C(=O)OCC Amb25316250 [0,2,0,0,0,0|1,0,1]=4 2550 B9R0.6 CCCC(=O)C(C(=O)C)C Amb17593599 [0,2,0,0,0,0|2,0,0]=4 2551 B9R0.6 CCCS(=O)C(C)C(O)=O Amb18304634 [0,2,0,0,0,0|2,0,0]=4 2552 B9R0.6 CCOC(=O)C(=C)C(O)=O Amb25368796 [0,2,0,0,0,0|0,0,2]=4 2553 B9R0.6 CCOC(=O)C(Br)C(N)=O Amb25290149 [0,2,0,0,0,0|2,0,0]=4 2554 B9R0.6 CCOC(=O)C(Br)C(O)=O Amb24729305 [0,2,0,0,0,0|1,0,0]=3 2555 B9R0.6 CCOC(=O)C(C(=O)C)O Amb17593653 [0,2,0,0,0,0|2,0,0]=4 2556 B9R0.6 CCOC(=O)C(C(O)C)C Amb17615516 [0,2,0,0,0,0|1,0,1]=4 2557 B9R0.6 CCOC(=O)C(C)S(C)=O Amb18798267 [0,2,0,0,0,0|2,0,0]=4 2558 B9R0.6 CCOC(=O)C(Cl)C(O)=O Amb18126462 [0,2,0,0,0,0|1,0,0]=3 2559 B9R0.6 CCOC(=O)C(F)C(O)=O Amb25774508 [0,2,0,0,0,0|1,0,0]=3 2560 B9R0.6 CCOC(=O)[C@@H](F)C(O)=O Amb24652368 [0,2,0,0,0,0|1,0,0]=3 2561 B9R0.6 CCOC(=O)[C@H](C)C(O)=O Amb25368327 [0,2,0,0,0,0|0,0,0]=2 2562 B9R0.6 CCOC(C)=C(C)C(O)=O Amb24629929 [0,2,0,0,0,0|1,0,1]=4 2563 B9R0.6 CCSC(=O)C(C)C(O)=O Amb25032473 [0,2,0,0,0,0|0,1,0]=3 2564 B9R0.6 COCC(=C)C(O)C(O)=O Amb24607009 [0,2,0,0,0,0|2,0,0]=4 2565 B9R0.6 CON=[N+]([O-])C(C)C(O)=O Amb24592534 [0,2,0,0,0,0|1,0,1]=4 2566 B9R0.6 C[C@@H]([C@@H](O)CCC)C(O)=O Amb24445556 [0,2,0,0,0,0|1,0,1]=4 2567 B9R0.6 C[C@@H]([C@H](O)CCC)C(O)=O Amb24529277 [0,2,0,0,0,0|1,0,1]=4 2568 B9R0.6 C[C@@H]([C@H](O)\C=C\C)C(O)=O Amb25340404 [0,2,0,0,0,0|1,0,1]=4 2569 B9R0.6 C[C@H](C(O)CCC)C(O)=O Amb25096562 [0,2,0,0,0,0|1,0,1]=4 2570 B9R0.6 C[C@H]([C@@H](O)CCC)C(O)=O Amb25789993 [0,2,0,0,0,0|1,0,1]=4 2571 B9R0.6 C[C@H]([C@@H](O)\C=C\C)C(O)=O Amb24359088 [0,2,0,0,0,0|1,0,1]=4 2572 B9R0.6 C[C@H]([C@H](C)NOC)C(O)=O Amb24451571 [0,2,0,0,0,0|1,0,1]=4 2573 B9R0.6 C[C@H]([C@H](C)O)C(=O)OCC Amb25191994 [0,2,0,0,0,0|1,0,1]=4 2574 B9R0.6 C[C@H]([C@H](C)OC=O)C(O)=O Amb24479221 [0,2,0,0,0,0|1,0,1]=4 2575 B9R0.6 C[C@H]([C@H](O)\C=C\C)C(O)=O Amb25378724 [0,2,0,0,0,0|1,0,1]=4 2576 B9R0.6 C\C(\C(O)=O)=C(/Br)\COC Amb18130266 [0,2,0,0,0,0|1,0,1]=4 2577 B9R0.25 CC(C(=O)CO)C(C)(C)O Amb25792770 [0,2,0,0,0,0|1,0,1]=4 2578 B9R0.25 CCC(=O)C(C)S(O)(=O)=O Amb24478379 [0,2,0,0,0,0|2,0,0]=4 2579 B9R0.25 COC(=O)C(C)S(C)(=O)=O Amb18177821 [0,2,0,0,0,0|1,0,1]=4 2580 B9R0.25 COC(=O)C(C)S(N)(=O)=O Amb18180116 [0,2,0,0,0,0|1,0,1]=4 2581 B9R0.25 COC(=O)C(C)S([O-])(=O)=O Amb22364942 [0,2,0,0,0,0|1,0,1]=4 2582 B9R0.25 COC(=O)C(C)S([O-])(=O)=O Amb24653107 [0,2,0,0,0,0|1,0,1]=4 2583 B9R0.25 COC(=O)[C@@H](C)S(C)(=O)=O Amb25076817 [0,2,0,0,0,0|1,0,1]=4 2584 B9R0.25 ONC(=O)C(O)P(O)(O)=O Amb25369451 [0,2,0,0,0,0|2,0,0]=4 2585 B9R0.27 CC(C(=O)OC)C(=O)OC Amb20246809 [0,2,0,0,0,0|0,0,0]=2 2586 B9R0.27 CC(C(=O)OC)N(C)OC Amb24482762 [0,2,0,0,0,0|2,0,0]=4 2587 B9R0.27 CC(C(C)C=O)C(=O)OC Amb25828591 [0,2,0,0,0,0|1,0,1]=4 2588 B9R0.27 CC(C(O)CC)C(=O)OC Amb24731247 [0,2,0,0,0,0|1,0,1]=4 2589 B9R0.27 CC(C(O)OC)C(=O)OC Amb25049424 [0,2,0,0,0,0|0,0,2]=4 2590 B9R0.27 CC([C@@H](O)CC)C(=O)OC Amb25740781 [0,2,0,0,0,0|1,0,1]=4 2591 B9R0.27 CCC(=O)C(Br)C(=O)OC Amb25214433 [0,2,0,0,0,0|2,0,0]=4 2592 B9R0.27 CCC(=O)C(C)C(=O)C=C Amb24439762 [0,2,0,0,0,0|2,0,0]=4 2593 B9R0.27 CCC(=O)C(Cl)C(=O)OC Amb18368799 [0,2,0,0,0,0|2,0,0]=4 2594 B9R0.27 CCC(=O)C(N)C(=O)OC Amb18124723 [0,2,0,0,0,0|2,0,0]=4 2595 B9R0.27 CCS(=O)C(C)C(=O)OC Amb18798266 [0,2,0,0,0,0|2,0,0]=4 2596 B9R0.27 COC(=O)C(=C)C(=O)OC Amb25703937 [0,2,0,0,0,0|0,0,2]=4 2597 B9R0.27 COC(=O)C(C(=O)OC)F Amb1154614 [0,2,0,0,0,0|1,0,0]=3 2598 B9R0.27 COC(=O)C(C)C(=O)CBr Amb25835122 [0,2,0,0,0,0|1,0,0]=3 2599 B9R0.27 COC(=O)C(F)C(=O)CF Amb24095955 [0,2,0,0,0,0|2,0,0]=4 2600 B9R0.27 COC(=O)C(O)C(=O)OC Amb25078615 [0,2,0,0,0,0|1,0,0]=3 2601 B9R0.27 COC(=O)N(C)C(=O)CCl Amb25292270 [0,2,0,0,0,0|2,0,0]=4 2602 B9R0.27 C[C@@H]([C@@H](C)C=O)C(=O)OC Amb25142663 [0,2,0,0,0,0|1,0,1]=4 2603 B9R0.27 C[C@@H]([C@@H](C)CO)C(=O)OC Amb25279746 [0,2,0,0,0,0|1,0,1]=4 2604 B9R0.27 C[C@@H]([C@@H](O)CC)C(=O)NO Amb25058433 [0,2,0,0,0,0|1,0,1]=4 2605 B9R0.27 C[C@@H]([C@@H](O)CC)C(=O)OC Amb25769352 [0,2,0,0,0,0|1,0,1]=4 2606 B9R0.27 C[C@@H]([C@H](O)C=C)C(=O)OC Amb24429580 [0,2,0,0,0,0|1,0,1]=4 2607 B9R0.27 C[C@@H]([C@H](O)CC)C(=O)OC Amb24556034 [0,2,0,0,0,0|1,0,1]=4 2608 B9R0.27 C[C@H]([C@@H](O)C=C)C(=O)OC Amb25215424 [0,2,0,0,0,0|1,0,1]=4 2609 B9R0.27 C[C@H]([C@H](O)C=C)C(=O)OC Amb25706084 [0,2,0,0,0,0|1,0,1]=4 2610 B9R0.27 C[C@H]([C@H](O)CC)C(=O)OC Amb25045706 [0,2,0,0,0,0|1,0,1]=4 2611 B9R0.28 CC(=C)C(C)(N)C(=O)OC Amb18124642 [0,2,0,0,0,0|2,0,0]=4 2612 B9R0.28 CC(=C=C)C(C)(C)C(O)=O Amb24480402 [0,2,0,0,0,0|2,0,0]=4 2613 B9R0.28 CC(=CBr)C(C)(C)C(O)=O Amb25251880 [0,2,0,0,0,0|2,0,0]=4 2614 B9R0.28 CC(=NO)C(C)(C)C(N)=O Amb24587475 [0,2,0,0,0,0|2,0,0]=4 2615 B9R0.28 CC(=O)C(C)(C)C(=O)CBr Amb24477317 [0,2,0,0,0,0|2,0,0]=4 2616 B9R0.28 CC(=O)C(C)(C)C(=O)CCl Amb25144764 [0,2,0,0,0,0|2,0,0]=4 2617 B9R0.28 CC(=O)C(C)(C)N(O)N=O Amb24608633 [0,2,0,0,0,0|2,0,0]=4 2618 B9R0.28 CC(=O)C(C)(O)C(=O)OC Amb22230872 [0,2,0,0,0,0|1,0,0]=3 2619 B9R0.28 CC(=O)C(Cl)(Cl)C(=O)OC Amb25349459 [0,2,0,0,0,0|2,0,0]=4 2620 B9R0.28 CC(=O)[C@](C)(O)C(=O)OC Amb25146828 [0,2,0,0,0,0|1,0,0]=3 2621 B9R0.28 CC(C)(C(N)=N)C(=O)OC Amb21970936 [0,2,0,0,0,0|2,0,0]=4 2622 B9R0.28 CC(C)(C(N)=O)C(N)=NO Amb24478099 [0,2,0,0,0,0|2,0,0]=4 2623 B9R0.28 CC(C)(C(O)C=C)C(O)=O Amb24568657 [0,2,0,0,0,0|1,0,1]=4 2624 B9R0.28 CC(C)([C@H](N)CO)C(O)=O Amb25245841 [0,2,0,0,0,0|1,0,1]=4 2625 B9R0.28 CC(C=O)C(C)(C)C(O)=O Amb25063874 [0,2,0,0,0,0|1,0,1]=4 2626 B9R0.28 CC(O)([C@H](O)CO)C(O)=O Amb24524547 [0,2,0,0,0,0|0,0,2]=4 2627 B9R0.28 CCC(=O)C(C)(C)C(N)=O Amb24502289 [0,2,0,0,0,0|2,0,0]=4 2628 B9R0.28 CCC(O)C(C)(O)C(O)=O Amb18644353 [0,2,0,0,0,0|1,0,1]=4 2629 B9R0.28 CCS(=O)C(C)(C)C(O)=O Amb25679415 [0,2,0,0,0,0|2,0,0]=4 2630 B9R0.28 CC[C@@H](O)[C@](C)(O)C(O)=O Amb25111955 [0,2,0,0,0,0|1,0,1]=4 2631 B9R0.28 CC[C@H](O)[C@](C)(O)C(O)=O Amb24624659 [0,2,0,0,0,0|1,0,1]=4 2632 B9R0.28 CN(C=O)C(C)(C)C(O)=O Amb18287602 [0,2,0,0,0,0|2,0,0]=4 2633 B9R0.28 CN(N=O)C(C)(C)C(O)=O Amb24350936 [0,2,0,0,0,0|2,0,0]=4 2634 B9R0.28 CNC(=O)C(C)(C)C(O)=O Amb25141026 [0,2,0,0,0,0|1,0,0]=3 2635 B9R0.28 COC(=O)C(C(=O)C)(C)C Amb10807393 [0,2,0,0,0,0|1,0,0]=3 2636 B9R0.28 COC(=O)C(C)(C)C(=O)Cl Amb25241843 [0,2,0,0,0,0|1,0,0]=3 2637 B9R0.28 COC(=O)C(C)(C)[C@@H](C)O Amb25381341 [0,2,0,0,0,0|1,0,1]=4 2638 B9R0.28 COC(=O)C(C)(F)C(O)=O Amb24373165 [0,2,0,0,0,0|0,0,0]=2 2639 B9R0.28 COC(=O)C(C)(N)C(C)O Amb18644324 [0,2,0,0,0,0|1,0,1]=4 2640 B9R0.28 COC(=O)C(C)(N)C(O)=O Amb24585696 [0,2,0,0,0,0|0,0,0]=2 2641 B9R0.28 COC(=O)C(C)(O)C(O)=O Amb24359375 [0,2,0,0,0,0|0,0,0]=2 2642 B9R0.28 COC(=O)[C@@](C)(O)[C@H](C)O Amb25296400 [0,2,0,0,0,0|1,0,1]=4 2643 B9R0.28 COC(=O)[C@](C)(N)[C@@H](C)O Amb24554415 [0,2,0,0,0,0|1,0,1]=4 2644 B9R0.28 COC(=O)[C@](C)(O)[C@@H](C)O Amb25356388 [0,2,0,0,0,0|1,0,1]=4 2645 B9R0.28 COC(C)C(C)(C)C(O)=O Amb25211514 [0,2,0,0,0,0|1,0,1]=4 2646 B9R0.28 COC(C)C(C)(N)C(O)=O Amb25336838 [0,2,0,0,0,0|1,0,1]=4 2647 B9R0.28 C[C@@](O)([C@H](O)CO)C(O)=O Amb24687216 [0,2,0,0,0,0|0,0,2]=4 2648 B9R0.28 C\C(=N/O)\C(C)(C)C(C)=O Amb24357151 [0,2,0,0,0,0|2,0,0]=4 2649 B9R0.28 C\C(=N/O)\C(C)(C)C(O)=O Amb24480723 [0,2,0,0,0,0|1,0,0]=3 2650 B9R0.29 CC(=C=C)C(CC)C(O)=O Amb24673950 [0,2,0,0,0,0|2,0,0]=4 2651 B9R0.29 CC(=O)C(=CC)C(=O)OC Amb24662325 [0,2,0,0,0,0|1,0,1]=4 2652 B9R0.29 CC(=O)C(C#N)C(=O)OC Amb22261464 [0,2,0,0,0,0|1,0,1]=4 2653 B9R0.29 CC(=O)C(N=O)C(=O)OC Amb25146631 [0,2,0,0,0,0|2,0,0]=4 2654 B9R0.29 CC(=O)C(NO)C(=O)OC Amb24708176 [0,2,0,0,0,0|2,0,0]=4 2655 B9R0.29 CC(=O)C(OC)C(=O)OC Amb21857332 [0,2,0,0,0,0|1,0,0]=3 2656 B9R0.29 CC(=O)\C(=C/C)\C(=O)OC Amb25330280 [0,2,0,0,0,0|1,0,1]=4 2657 B9R0.29 CC(=O)\C(=N\C)\C(=O)OC Amb25214380 [0,2,0,0,0,0|1,0,1]=4 2658 B9R0.29 CC(CO)C(NC)C(O)=O Amb18644323 [0,2,0,0,0,0|1,0,1]=4 2659 B9R0.29 CC(O)C(CC)C(=O)OC Amb25325694 [0,2,0,0,0,0|1,0,1]=4 2660 B9R0.29 CC(O)C(OC)C(=O)OC Amb24454859 [0,2,0,0,0,0|1,0,1]=4 2661 B9R0.29 CC(O)C(SC)C(=O)OC Amb25056674 [0,2,0,0,0,0|1,0,1]=4 2662 B9R0.29 CC(O)[C@@H](NC)C(=O)OC Amb23603655 [0,2,0,0,0,0|1,0,1]=4 2663 B9R0.29 CC(OC)C(CC)C(O)=O Amb24597787 [0,2,0,0,0,0|1,0,1]=4 2664 B9R0.29 CC(OC)C(NC)C(O)=O Amb24117895 [0,2,0,0,0,0|1,0,1]=4 2665 B9R0.29 CC(OC)C(NC)C(O)=O Amb24596308 [0,2,0,0,0,0|1,0,1]=4 2666 B9R0.29 CCC(=O)C(C(=O)C)CC Amb17593598 [0,2,0,0,0,0|2,0,0]=4 2667 B9R0.29 CCC(C(=O)NO)C(O)=O Amb25064281 [0,2,0,0,0,0|0,0,0]=2 2668 B9R0.29 CCC(C(N)=O)C(N)=NO Amb25731713 [0,2,0,0,0,0|2,0,0]=4 2669 B9R0.29 CCC(C(O)=O)C(=O)OC Amb25709569 [0,2,0,0,0,0|0,0,0]=2 2670 B9R0.29 CCC(C(O)=O)N(C)C=O Amb18983107 [0,2,0,0,0,0|2,0,0]=4 2671 B9R0.29 CCC(C(O)=O)N(O)N=O Amb25756450 [0,2,0,0,0,0|1,0,0]=3 2672 B9R0.29 CCC(O)C(NC)C(O)=O Amb25046706 [0,2,0,0,0,0|1,0,1]=4 2673 B9R0.29 CCC(O)C(OC)C(O)=O Amb18644355 [0,2,0,0,0,0|1,0,1]=4 2674 B9R0.29 CCN(C(N)=O)C(=O)OC Amb25261188 [0,2,0,0,0,0|2,0,0]=4 2675 B9R0.29 CCN(O)C(CN)C(O)=O Amb24548240 [0,2,0,0,0,0|2,0,0]=4 2676 B9R0.29 CCS(=O)C(CC)C(O)=O Amb18306058 [0,2,0,0,0,0|2,0,0]=4 2677 B9R0.29 CC[C@H](O)[C@H](NC)C(O)=O Amb24446992 [0,2,0,0,0,0|1,0,1]=4 2678 B9R0.29 CN(N=O)C(CN)C(O)=O Amb24349972 [0,2,0,0,0,0|2,0,0]=4 2679 B9R0.29 CNC(C(N)=O)C(=O)OC Amb25081607 [0,2,0,0,0,0|1,0,0]=3 2680 B9R0.29 COC(=O)C(=NO)C(O)=O Amb25260934 [0,2,0,0,0,0|1,0,1]=4 2681 B9R0.29 COC(=O)C(C#N)C(N)=O Amb24746685 [0,2,0,0,0,0|1,0,1]=4 2682 B9R0.29 COC(=O)C(CN)S(C)=O Amb24481157 [0,2,0,0,0,0|2,0,0]=4 2683 B9R0.29 COC(=O)C(SC)C(O)=O Amb25321843 [0,2,0,0,0,0|0,0,0]=2 2684 B9R0.29 CO[C@H](C(O)=O)C(=O)OC Amb24480710 [0,2,0,0,0,0|0,0,0]=2 2685 B9R0.29 CO[C@H]([C@@H](O)CO)C(O)=O Amb25065328 [0,2,0,0,0,0|0,0,2]=4 2686 B9R0.29 CO[C@H]([C@H](O)CO)C(O)=O Amb25053877 [0,2,0,0,0,0|0,0,2]=4 2687 B9R0.29 CO\C(\Cl)=C(/OC)\C(O)=O Amb25708346 [0,2,0,0,0,0|1,0,1]=4 2688 B9R0.29 C[C@@H](O)C(CO)C(=O)OC Amb25235714 [0,2,0,0,0,0|1,0,1]=4 2689 B9R0.29 C[C@@H](OC)[C@H](NC)C(O)=O Amb25340790 [0,2,0,0,0,0|1,0,1]=4 2690 B9R0.29 C[C@@H](OC)[C@H](OC)C(O)=O Amb25677780 [0,2,0,0,0,0|1,0,1]=4 2691 B9R0.29 C[C@H](O)[C@@H](CC)C(=O)OC Amb24371110 [0,2,0,0,0,0|1,0,1]=4 2692 B9R0.29 C[C@H](O)[C@@H](SC)C(=O)OC Amb25169364 [0,2,0,0,0,0|1,0,1]=4 2693 B9R0.29 C[C@H](O)[C@H](CC)C(=O)OC Amb24733645 [0,2,0,0,0,0|1,0,1]=4 2694 B9R0.29 C[C@H](OC)[C@H](NC)C(O)=O Amb24478844 [0,2,0,0,0,0|1,0,1]=4 2695 B9R0.29 C\C=C(\C(O)=O)/C(=O)OC Amb18644061 [0,2,0,0,0,0|0,0,1]=3 2696 B9R0.29 NC[C@@H]([C@H](O)CF)C(O)=O Amb25102471 [0,2,0,0,0,0|1,0,1]=4 2697 B9R0.29 OC(=O)C(=NO)C(=O)NO Amb25823662 [0,2,0,0,0,0|1,0,1]=4 2698 B9R0.32 CC(C(O)=O)C(C)(O)C#N Amb25367972 [0,2,0,0,0,0|1,0,1]=4 2699 B9R0.32 CCC(C)(O)C(C)C(O)=O Amb18990593 [0,2,0,0,0,0|1,0,1]=4 2700 B9R0.32 CCS(=O)(=O)[C@H](C)C(O)=O Amb25279556 [0,2,0,0,0,0|1,0,1]=4 2701 B9R0.32 CC[C@](C)(O)[C@H](C)C(O)=O Amb24480440 [0,2,0,0,0,0|1,0,1]=4 2702 B9R0.32 CNS(=O)(=O)C(C)C(O)=O Amb18978160 [0,2,0,0,0,0|1,0,1]=4 2703 B9R0.32 COP(O)(=O)C(C)C(C)=O Amb24690851 [0,2,0,0,0,0|2,0,0]=4 2704 B9R0.32 OCP(O)(=O)C(O)C(O)=O Amb24462681 [0,2,0,0,0,0|2,0,0]=4 2705 B9R0.41 CC(=O)N(C)C(C=O)=CO Amb24604770 [0,2,0,0,0,0|2,0,0]=4 2706 B9R0.41 CC(=O)N(C)\C(\C=O)=C/O Amb25274305 [0,2,0,0,0,0|2,0,0]=4 2707 B9R0.41 CC(C(C=C)OC)C(O)=O Amb25340446 [0,2,0,0,0,0|1,0,1]=4 2708 B9R0.41 CC(C(OC)OC)C(O)=O Amb24401121 [0,2,0,0,0,0|0,0,2]=4 2709 B9R0.41 CCC(=CC)C(C)C(O)=O Amb25259508 [0,2,0,0,0,0|2,0,0]=4 2710 B9R0.41 CCN(N=O)C(C)C(O)=O Amb24445502 [0,2,0,0,0,0|2,0,0]=4 2711 B9R0.41 CC\C(=C/C)\C(C)C(O)=O Amb18643898 [0,2,0,0,0,0|2,0,0]=4 2712 B9R0.41 C[C@@H](C(OC)OC)C(O)=O Amb25694344 [0,2,0,0,0,0|0,0,2]=4 2713 B9R0.41 C[C@@H]([C@@H](C=C)OC)C(O)=O Amb25840435 [0,2,0,0,0,0|1,0,1]=4 2714 B9R0.41 C\C=C(/C=O)\C(N)C(O)=O Amb24756701 [0,2,0,0,0,0|2,0,0]=4 2715 B9R0.33 CC(=C)C(OCC)C(O)=O Amb25770135 [0,2,0,0,0,0|2,0,0]=4 2716 B9R0.33 CC(=O)C(CC#C)C(C)=O Amb18633828 [0,2,0,0,0,0|2,0,0]=4 2717 B9R0.33 CC(=O)C(CC=C)C(N)=O Amb24426800 [0,2,0,0,0,0|2,0,0]=4 2718 B9R0.33 CC(=O)C(CCC)C(N)=O Amb24744722 [0,2,0,0,0,0|2,0,0]=4 2719 B9R0.33 CC(=O)C(CCO)C(C)=O Amb25706995 [0,2,0,0,0,0|2,0,0]=4 2720 B9R0.33 CC(=O)C(CCO)C(N)=O Amb24447028 [0,2,0,0,0,0|2,0,0]=4 2721 B9R0.33 CC(O)C(NCC)C(O)=O Amb25702357 [0,2,0,0,0,0|1,0,1]=4 2722 B9R0.33 CCCC(C(C)=O)C(C)=O Amb22734682 [0,2,0,0,0,0|2,0,0]=4 2723 B9R0.33 CCCC(C(N)=O)C(N)=O Amb24380863 [0,2,0,0,0,0|2,0,0]=4 2724 B9R0.33 CCNC(C(N)=O)C(N)=O Amb24746706 [0,2,0,0,0,0|2,0,0]=4 2725 B9R0.33 CCOC(C(N)=O)C(N)=O Amb24392976 [0,2,0,0,0,0|2,0,0]=4 2726 B9R0.33 CCSC(C(C)=O)C(C)=O Amb24509819 [0,2,0,0,0,0|2,0,0]=4 2727 B9R0.33 CCSC(C(O)=O)C(O)=O Amb24524307 [0,2,0,0,0,0|0,0,0]=2 2728 B9R0.33 CNN=C(C(O)=O)C(O)=O Amb24680910 [0,2,0,0,0,0|0,0,1]=3 2729 B9R0.33 COCC(C(C)=O)C(C)=O Amb25319898 [0,2,0,0,0,0|2,0,0]=4 2730 B9R0.33 CON=C(C(O)=O)C(O)=O Amb25118902 [0,2,0,0,0,0|0,0,1]=3 2731 B9R0.33 C[C@@H](O)[C@@H](CC#C)C(O)=O Amb24745676 [0,2,0,0,0,0|1,0,1]=4 2732 B9R0.33 C[C@H](O)[C@H](CC=C)C(O)=O Amb24672255 [0,2,0,0,0,0|1,0,1]=4 2733 B9R0.33 C\C(\O)=C(\CC=C)/C(O)=O Amb24562833 [0,2,0,0,0,0|1,0,1]=4 2734 B9R0.33 C\C=C\C(C(C)=O)C(C)=O Amb25793040 [0,2,0,0,0,0|2,0,0]=4 2735 B9R0.33 N=CCC(C(O)=O)C(O)=O Amb25839503 [0,2,0,0,0,0|0,0,0]=2 2736 B9R0.33 NCCC(P(O)=O)P(O)=O Amb24444279 [0,2,0,0,0,0|2,0,0]=4 2737 B9R0.33 O=CCC(C(=O)C)C(=O)C Amb17593588 [0,2,0,0,0,0|2,0,0]=4 2738 B9R0.33 OC(=O)C(CCBr)C(O)=O Amb25062477 [0,2,0,0,0,0|0,0,0]=2 2739 B9R0.33 OC(=O)C(NC=O)C(O)=O Amb25118158 [0,2,0,0,0,0|0,0,1]=3 2740 B9R0.33 OC(=O)C(OCF)C(O)=O Amb25856093 [0,2,0,0,0,0|0,0,0]=2 2741 B9R0.54 CC(=C)C(C(C)C)C(O)=O Amb18643917 [0,2,0,0,0,0|2,0,0]=4 2742 B9R0.54 CC(=C)[C@H](C(C)C)C(O)=O Amb24680337 [0,2,0,0,0,0|2,0,0]=4 2743 B9R0.54 CC(=O)C(C(C)=O)C(C)=O Amb22231697 [0,2,0,0,0,0|2,0,0]=4 2744 B9R0.54 CC(=O)C(C(N)=O)C(C)=O Amb25106796 [0,2,0,0,0,0|2,0,0]=4 2745 B9R0.54 CC(=O)C(C(O)=O)C(O)=O Amb17678826 [0,2,0,0,0,0|0,0,0]=2 2746 B9R0.54 CC(C)=C(C(O)=O)C(O)=O Amb18644067 [0,2,0,0,0,0|0,0,1]=3 2747 B9R0.54 CC(C)C(C(=O)Cl)C(=O)Cl Amb25249313 [0,2,0,0,0,0|2,0,0]=4 2748 B9R0.54 CC(C)C(C(C)=O)C(C)=O Amb17689200 [0,2,0,0,0,0|2,0,0]=4 2749 B9R0.54 CC(C)C(C(O)=O)N(C)O Amb25024913 [0,2,0,0,0,0|2,0,0]=4 2750 B9R0.54 CC(C)C(C(O)=O)S(C)=O Amb18290928 [0,2,0,0,0,0|2,0,0]=4 2751 B9R0.54 CC(N)C(C(O)=O)P(O)=O Amb24373175 [0,2,0,0,0,0|1,0,0]=3 2752 B9R0.54 CC(O)C(C(O)=O)C(O)=O Amb24480725 [0,2,0,0,0,0|0,0,0]=2 2753 B9R0.54 CC(O)[C@@H](C(O)=O)N(C)C Amb24698989 [0,2,0,0,0,0|1,0,1]=4 2754 B9R0.54 CN(C)C(C(C)=O)C(C)=O Amb25146773 [0,2,0,0,0,0|2,0,0]=4 2755 B9R0.54 C[C@@H](O)[C@@H]([C@H](C)N)C(O)=O Amb25789955 [0,2,0,0,0,0|1,0,1]=4 2756 B9R0.54 C[C@H](O)[C@@H](C(O)=O)N(C)C Amb25316187 [0,2,0,0,0,0|1,0,1]=4 2757 B9R0.54 C[C@H](O)[C@@H]([C@@H](C)N)C(O)=O Amb25340296 [0,2,0,0,0,0|1,0,1]=4 2758 B9R0.54 NC(=O)C(C(O)=O)C(N)=S Amb25185289 [0,2,0,0,0,0|1,0,1]=4 2759 B9R0.54 OC(=O)C(=C(Cl)Cl)C(O)=O Amb25772803 [0,2,0,0,0,0|0,0,2]=4 2760 B9R0.72 CCC(C(O)=O)P(O)(O)=O Amb22045234 [0,2,0,0,0,0|1,0,0]=3 2761 B9R0.72 CCC(C(O)=O)S(O)(=O)=O Amb25375086 [0,2,0,0,0,0|1,0,0]=3 2762 B9R0.72 CCC(S(=O)(=O)C)C(=O)O Amb17501412 [0,2,0,0,0,0|1,0,1]=4 2763 B9R0.72 CC[C@@H](C(O)=O)S(O)(=O)=O Amb24634003 [0,2,0,0,0,0|1,0,0]=3 2764 B9R0.72 CNC(C(O)=O)C(C)(C)O Amb18644319 [0,2,0,0,0,0|1,0,1]=4 2765 B9R0.72 C\C=C(/C(O)=O)\S(O)(=O)=O Amb25124043 [0,2,0,0,0,0|1,0,1]=4 2766 B9R0.72 NCC(C(O)=O)S(O)(=O)=O Amb21982536 [0,2,0,0,0,0|1,0,0]=3 2767 B9R0.76 C=CC(N)(C(O)=O)C(O)=O Amb24479037 [0,2,0,0,0,0|0,0,1]=3 2768 B9R0.76 CC(=C)C(C)(CC)C(O)=O Amb18643949 [0,2,0,0,0,0|2,0,0]=4 2769 B9R0.76 CC(=C)C(O)(CC)C(O)=O Amb24746725 [0,2,0,0,0,0|2,0,0]=4 2770 B9R0.76 CC(=O)C(C)(CCl)C(=O)Cl Amb24482162 [0,2,0,0,0,0|2,0,0]=4 2771 B9R0.76 CC(C=C)(C(O)=O)C(O)=O Amb24117504 [0,2,0,0,0,0|0,0,0]=2 2772 B9R0.76 CC(CO)(C(C)=O)C(C)=O Amb25146661 [0,2,0,0,0,0|2,0,0]=4 2773 B9R0.76 CC(CO)(C(O)=O)C(O)=O Amb24657251 [0,2,0,0,0,0|0,0,0]=2 2774 B9R0.76 CC(N=O)(C(O)=O)C(O)=O Amb25292153 [0,2,0,0,0,0|0,0,0]=2 2775 B9R0.76 CC(O)C(C)(C=C)C(O)=O Amb18644147 [0,2,0,0,0,0|1,0,1]=4 2776 B9R0.76 CC(O)C(N)(CO)C(O)=O Amb25147371 [0,2,0,0,0,0|1,0,1]=4 2777 B9R0.76 CC(OC)(C(=C)Br)C(O)=O Amb18131053 [0,2,0,0,0,0|2,0,0]=4 2778 B9R0.76 CCC(Br)(C(N)=O)C(N)=O Amb24378108 [0,2,0,0,0,0|2,0,0]=4 2779 B9R0.76 CCC(Br)(C(O)=O)C(O)=O Amb25290221 [0,2,0,0,0,0|0,0,0]=2 2780 B9R0.76 CCC(C)(C(C)=O)C(C)=O Amb24524379 [0,2,0,0,0,0|2,0,0]=4 2781 B9R0.76 CCC(C)(C(C)O)C(O)=O Amb25826200 [0,2,0,0,0,0|1,0,1]=4 2782 B9R0.76 CCC(C)(C(O)=O)C(O)=O Amb18644240 [0,2,0,0,0,0|0,0,0]=2 2783 B9R0.76 CCC(Cl)(C(C)=O)C(C)=O Amb25146748 [0,2,0,0,0,0|2,0,0]=4 2784 B9R0.76 CCC(Cl)(C(O)=O)C(O)=O Amb24415337 [0,2,0,0,0,0|0,0,0]=2 2785 B9R0.76 CCC(F)(C(N)=O)C(N)=O Amb25147330 [0,2,0,0,0,0|2,0,0]=4 2786 B9R0.76 CCC(O)(C(C)=O)C(C)=O Amb25059494 [0,2,0,0,0,0|2,0,0]=4 2787 B9R0.76 CCC(O)(C(O)=O)C(O)=O Amb24746727 [0,2,0,0,0,0|0,0,0]=2 2788 B9R0.76 CC[C@@](N)([C@@H](C)O)C(O)=O Amb25082905 [0,2,0,0,0,0|1,0,1]=4 2789 B9R0.76 CC[C@@](O)([C@@H](C)O)C(O)=O Amb25214139 [0,2,0,0,0,0|1,0,1]=4 2790 B9R0.76 COC(F)(C(O)=O)C(O)=O Amb25213677 [0,2,0,0,0,0|0,0,0]=2 2791 B9R0.76 NC(=O)C(F)(CO)C(N)=O Amb25288111 [0,2,0,0,0,0|2,0,0]=4 2792 B9R0.76 NC(CO)(C(O)=O)C(O)=O Amb25339816 [0,2,0,0,0,0|0,0,0]=2 2793 B9R0.49 CC(P(O)(O)=O)P(O)(O)=O Amb24721253 [0,2,0,0,0,0|2,0,0]=4 2794 B9R0.80 CC(=O)C(C)(O)P(C)(O)=O Amb25059509 [0,2,0,0,0,0|2,0,0]=4 2795 B9R0.80 CC(C)(C(O)=O)S(N)(=O)=O Amb24693989 [0,2,0,0,0,0|1,0,1]=4 2796 B9R0.80 CC(C)(C(O)=O)S(O)(=O)=O Amb24726171 [0,2,0,0,0,0|1,0,0]=3 2797 B9R0.80 CC(C)(O)C(C)(C)C(O)=O Amb18281599 [0,2,0,0,0,0|1,0,1]=4 2798 B9R0.80 CC(C)(O)[C@@](C)(N)C(O)=O Amb25117586 [0,2,0,0,0,0|1,0,1]=4 2799 B9R0.80 CC(Cl)(C(O)=O)S(O)(=O)=O Amb24482368 [0,2,0,0,0,0|1,0,0]=3 2800 B9R0.80 CC(O)(C(O)=O)P(O)(O)=O Amb25765531 [0,2,0,0,0,0|1,0,0]=3 2801 B9R0.80 OC(=O)C(Cl)(Cl)P(O)(O)=O Amb24524351 [0,2,0,0,0,0|2,0,0]=4 2802 B9R0.80 OC(=O)C(F)(Cl)S(O)(=O)=O Amb25288057 [0,2,0,0,0,0|2,0,0]=4 2803 B9R0.80 OC(=O)C(O)(O)P(O)(O)=O Amb25310946 [0,2,0,0,0,0|2,0,0]=4 2804 B9R0.80 OC(=O)C(S(=O)(=O)C)(C)C Amb17501569 [0,2,0,0,0,0|1,0,1]=4 2805 B7R1.2 C=C1CC(=O)OC1 Amb24589821 [1,0,0,1,0,0|2,0,0]=4 2806 B7R1.2 CC=1CC(=O)ON1 Amb22274079 [1,0,0,1,0,0|2,0,0]=4 2807 B7R1.2 O=C1CC(=O)C=C1 Amb22338203 [1,0,0,1,0,0|2,0,0]=4 2808 B7R1.2 O=C1CNC(=O)C1 Amb18202984 [1,0,0,1,0,0|2,0,0]=4 2809 B7R1.2 O=C1CSC(=O)C1 Amb22731927 [1,0,0,1,0,0|1,1,0]=4 2810 B7R1.2 O=C1NOC(=O)N1 Amb22002584 [1,0,0,1,0,0|2,0,0]=4 2811 B7R1.2 O=C1OC=C(C1)O Amb17621628 [1,0,0,1,0,0|1,0,0]=3 2812 B7R1.2 O=C1OCC(=O)N1 Amb1625991 [1,0,0,1,0,0|2,0,0]=4 2813 B7R1.12 C=C1C[C@@H]1C(O)=O Amb24683036 [1,0,0,1,0,0|2,0,0]=4 2814 B7R1.12 C=C1C[C@H]1C(O)=O Amb24368112 [1,0,0,1,0,0|2,0,0]=4 2815 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|1,0,1]=4 2816 B7R1.12 C[C@@H]1O[C@H]1C(O)=O Amb25738149 [1,0,0,1,0,0|1,0,1]=4 2817 B7R1.12 OC1CC1C(O)=O Amb24360896 [1,0,0,1,0,0|1,0,1]=4 2818 B7R1.20 OC(=O)CC1CO1 Amb25244347 [1,0,0,1,0,0|1,0,1]=4 2819 B7R1.4 CC1=CNOC1=O Amb25843682 [1,0,0,1,0,0|1,0,1]=4 2820 B7R1.4 CC1C=CCC1=O Amb25233761 [1,0,0,1,0,0|2,0,0]=4 2821 B7R1.4 CC1C=NNC1=O Amb22232312 [1,0,0,1,0,0|2,0,0]=4 2822 B7R1.4 CC1COCC1=O Amb24333426 [1,0,0,1,0,0|1,0,1]=4 2823 B7R1.4 CC1N=COC1=O Amb24518855 [1,0,0,1,0,0|2,0,0]=4 2824 B7R1.4 CC1NCOC1=O Amb24409631 [1,0,0,1,0,0|2,0,0]=4 2825 B7R1.4 CC1O[Ag]OC1=O Amb22352183 [1,0,0,1,0,0|2,0,0]=4 2826 B7R1.4 CC1SCOC1=O Amb25347819 [1,0,0,1,0,0|2,0,0]=4 2827 B7R1.4 C[C@@H]1NCOC1=O Amb25273957 [1,0,0,1,0,0|2,0,0]=4 2828 B7R1.4 Cc1cocc1O Amb24411637 [1,0,0,1,0,0|1,0,1]=4 2829 B7R1.4 N[C@H]1C=COC1=O Amb25259750 [1,0,0,1,0,0|2,0,0]=4 2830 B7R1.4 O=C1OC=CC1Br Amb22015332 [1,0,0,1,0,0|2,0,0]=4 2831 B7R1.4 O=C1OC=CC1I Amb24679050 [1,0,0,1,0,0|2,0,0]=4 2832 B7R1.4 O=C1OCC=C1C Amb16231256 [1,0,0,1,0,0|1,0,1]=4 2833 B7R1.4 O=C1OCCC1C Amb16185414 [1,0,0,1,0,0|1,0,1]=4 2834 B7R1.4 OC1C=COC1=O Amb25296159 [1,0,0,1,0,0|2,0,0]=4 2835 B7R1.8 OCC1CCC1=O Amb24722181 [1,0,0,1,0,0|1,0,1]=4 2836 B7R1.15 CC1=CC(=O)C1C Amb24690597 [1,0,0,1,0,0|2,0,0]=4 2837 B7R1.15 CC1C(=O)CC1=O Amb24364046 [1,0,0,1,0,0|1,0,0]=3 2838 B7R1.18 CC(=O)C1CC=C1 Amb25807635 [1,0,0,1,0,0|2,0,0]=4 2839 B7R1.18 O=C(Cl)C1COC1 Amb25201101 [1,0,0,1,0,0|1,0,1]=4 2840 B7R1.18 OC(=O)C1=CCC1 Amb17593068 [1,0,0,1,0,0|1,0,1]=4 2841 B7R1.18 OC(=O)C1CCN1 Amb2371568 [1,0,0,1,0,0|2,0,0]=4 2842 B7R1.18 OC(=O)C1CCO1 Amb2383526 [1,0,0,1,0,0|2,0,0]=4 2843 B7R1.18 OC(=O)C1CNC1 Amb2444164 [1,0,0,1,0,0|1,0,1]=4 2844 B7R1.18 OC(=O)C1CSC1 Amb20171470 [1,0,0,1,0,0|0,1,1]=4 2845 B7R1.19 CC1(C=C1)C(O)=O Amb25042785 [1,0,0,1,0,0|1,0,0]=3 2846 B7R1.19 CC1(CO1)C(=O)O Amb17593087 [1,0,0,1,0,0|0,0,1]=3 2847 B7R1.19 CC1(CO1)C(N)=O Amb25261467 [1,0,0,1,0,0|1,0,1]=4 2848 B7R1.19 CC1(CS1)C(O)=O Amb24760846 [1,0,0,1,0,0|0,1,1]=4 2849 B7R1.19 C[C@@]1(CO1)C(O)=O Amb25785347 [1,0,0,1,0,0|0,0,1]=3 2850 B7R1.19 C[C@]1(CO1)C(O)=O Amb25063884 [1,0,0,1,0,0|0,0,1]=3 2851 B7R1.27 CC1(CC1=O)C=C Amb25116558 [1,0,0,1,0,0|2,0,0]=4 2852 B9R1.35 C=C(Br)C1CC(=O)OC1 Amb25707934 [0,0,0,1,0,1|2,0,0]=4 2853 B9R1.35 CC(=C)C1COC(=O)N1 Amb24477743 [0,0,0,1,0,1|2,0,0]=4 2854 B9R1.35 CC(=O)C1CC(=O)CC1 Amb24423910 [0,0,0,1,0,1|2,0,0]=4 2855 B9R1.35 CC(=O)C1CCC(=O)N1 Amb24432249 [0,0,0,1,0,1|2,0,0]=4 2856 B9R1.35 CC(=O)C1CSC(=O)N1 Amb25706778 [0,0,0,1,0,1|1,1,0]=4 2857 B9R1.35 CC(=O)[C@@H]1CC(=O)OC1 Amb18832647 [0,0,0,1,0,1|1,0,0]=3 2858 B9R1.35 CC(=O)[C@@H]1CCC(=O)O1 Amb24182046 [0,0,0,1,0,1|2,0,0]=4 2859 B9R1.35 CC(=O)[C@@H]1CSC(=O)N1 Amb25809473 [0,0,0,1,0,1|1,1,0]=4 2860 B9R1.35 CC(=O)[C@H]1CC(=O)CC1 Amb24407171 [0,0,0,1,0,1|2,0,0]=4 2861 B9R1.35 CC(=O)[C@H]1CC(=O)OC1 Amb24390313 [0,0,0,1,0,1|1,0,0]=3 2862 B9R1.35 CC(=O)[C@H]1CCC(=O)O1 Amb24524212 [0,0,0,1,0,1|2,0,0]=4 2863 B9R1.35 CC(O)C1CC(=O)OC1 Amb25739837 [0,0,0,1,0,1|1,0,1]=4 2864 B9R1.35 CC(O)C1COC(=O)O1 Amb24592152 [0,0,0,1,0,1|1,0,1]=4 2865 B9R1.35 CC1=NC(CO1)C(O)=O Amb20621597 [0,0,0,1,0,1|1,0,0]=3 2866 B9R1.35 CC1=NC(CS1)C(O)=O Amb18124720 [0,0,0,1,0,1|1,1,0]=4 2867 B9R1.35 CC=1CC(CC1)C(O)=O Amb18642425 [0,0,0,1,0,1|2,0,0]=4 2868 B9R1.35 CC=1CCC(N1)C(O)=O Amb23438203 [0,0,0,1,0,1|2,0,0]=4 2869 B9R1.35 CC=1CCC([NH+]1)C(O)=O Amb22372048 [0,0,0,1,0,1|2,0,0]=4 2870 B9R1.35 CC=1C[C@H](CC1)C(O)=O Amb24350803 [0,0,0,1,0,1|2,0,0]=4 2871 B9R1.35 CC=1NC(CN1)C(O)=O Amb24599993 [0,0,0,1,0,1|2,0,0]=4 2872 B9R1.35 C[C@@H](O)[C@H]1CC(=O)OC1 Amb25215452 [0,0,0,1,0,1|1,0,1]=4 2873 B9R1.35 N=C1CCC(N1)C(O)=O Amb18642592 [0,0,0,1,0,1|2,0,0]=4 2874 B9R1.35 NC(=O)C1CCC(=O)O1 Amb24466803 [0,0,0,1,0,1|2,0,0]=4 2875 B9R1.35 NC(=O)C1CNC(=O)N1 Amb25380692 [0,0,0,1,0,1|2,0,0]=4 2876 B9R1.35 NC(=O)C1CNC(=O)S1 Amb25789527 [0,0,0,1,0,1|2,0,0]=4 2877 B9R1.35 NC(=O)C1COC(=O)N1 Amb24683685 [0,0,0,1,0,1|1,0,0]=3 2878 B9R1.35 NC(=O)[C@@H]1CCC(=O)O1 Amb25146823 [0,0,0,1,0,1|2,0,0]=4 2879 B9R1.35 NC(=O)[C@@H]1CNC(=O)N1 Amb25740143 [0,0,0,1,0,1|2,0,0]=4 2880 B9R1.35 NC1=NCC(S1)C(O)=O Amb24105967 [0,0,0,1,0,1|2,0,0]=4 2881 B9R1.35 NC1=N[C@H](CS1)C(O)=O Amb24099777 [0,0,0,1,0,1|1,1,0]=4 2882 B9R1.35 NC=1CC[C@H](N1)C(O)=O Amb25346757 [0,0,0,1,0,1|2,0,0]=4 2883 B9R1.35 NC=1NCC(N1)C(O)=O Amb25146049 [0,0,0,1,0,1|2,0,0]=4 2884 B9R1.35 O=C1C=C(CO1)C(=O)Cl Amb25147108 [0,0,0,1,0,1|1,0,1]=4 2885 B9R1.35 O=C1CC(CN1)C(=O)Cl Amb24742783 [0,0,0,1,0,1|2,0,0]=4 2886 B9R1.35 O=C1CC(CO1)C(=O)Cl Amb25146217 [0,0,0,1,0,1|1,0,0]=3 2887 B9R1.35 O=C1CC(CS1)C(=O)Cl Amb25689754 [0,0,0,1,0,1|1,1,0]=4 2888 B9R1.35 O=C1CCC(=C1)C(=O)O Amb13883804 [0,0,0,1,0,1|1,0,1]=4 2889 B9R1.35 O=C1CCC(C1)C(=O)Cl Amb25282784 [0,0,0,1,0,1|2,0,0]=4 2890 B9R1.35 O=C1CCC(N1)C(=O)Cl Amb17142869 [0,0,0,1,0,1|2,0,0]=4 2891 B9R1.35 O=C1CCC(N1)C(=O)N Amb17142856 [0,0,0,1,0,1|2,0,0]=4 2892 B9R1.35 O=C1CCC(O1)C(=O)Cl Amb24648754 [0,0,0,1,0,1|2,0,0]=4 2893 B9R1.35 O=C1CC[C@@H](N1)C(=O)Cl Amb24746659 [0,0,0,1,0,1|2,0,0]=4 2894 B9R1.35 O=C1CC[C@@H](O1)C(=O)Cl Amb22747149 [0,0,0,1,0,1|2,0,0]=4 2895 B9R1.35 O=C1CC[C@H](N1)C(=O)O Amb1995036 [0,0,0,1,0,1|1,0,0]=3 2896 B9R1.35 O=C1CC[C@H](O1)C(=O)Cl Amb22388653 [0,0,0,1,0,1|2,0,0]=4 2897 B9R1.35 O=C1NCC(C1)C(=O)N Amb1803351 [0,0,0,1,0,1|2,0,0]=4 2898 B9R1.35 O=C1NCC(C1)C(=O)O Amb1129202 [0,0,0,1,0,1|1,0,0]=3 2899 B9R1.35 O=C1N[C@@H](CS1)C(=O)Cl Amb25112049 [0,0,0,1,0,1|1,1,0]=4 2900 B9R1.35 O=C1OCC(N1)C(=O)O Amb15701690 [0,0,0,1,0,1|0,0,0]=2 2901 B9R1.35 O=C1SCC(C1)C(=O)O Amb10073724 [0,0,0,1,0,1|0,1,0]=3 2902 B9R1.35 O=C1SC[C@H](N1)C(=O)O Amb1157856 [0,0,0,1,0,1|0,1,0]=3 2903 B9R1.35 OB(O)C1COC(=O)C1 Amb24481982 [0,0,0,1,0,1|1,0,1]=4 2904 B9R1.35 OC(=O)C1CC(=O)CS1 Amb24061425 [0,0,0,1,0,1|2,0,0]=4 2905 B9R1.35 OC(=O)C1CC(=O)NN1 Amb18642739 [0,0,0,1,0,1|2,0,0]=4 2906 B9R1.35 OC(=O)C1CC(=O)OC1 Amb22642307 [0,0,0,1,0,1|0,0,0]=2 2907 B9R1.35 OC(=O)C1CC(Cl)=CC1 Amb23594523 [0,0,0,1,0,1|2,0,0]=4 2908 B9R1.35 OC(=O)C1CC=C(Br)O1 Amb25251659 [0,0,0,1,0,1|2,0,0]=4 2909 B9R1.35 OC(=O)C1CCC(=O)N1 Amb22282321 [0,0,0,1,0,1|1,0,0]=3 2910 B9R1.35 OC(=O)C1CCC(=O)O1 Amb20623076 [0,0,0,1,0,1|1,0,0]=3 2911 B9R1.35 OC(=O)C1CCC(=O)S1 Amb23439315 [0,0,0,1,0,1|1,0,0]=3 2912 B9R1.35 OC(=O)C1CCC(=S)N1 Amb24477679 [0,0,0,1,0,1|1,1,0]=4 2913 B9R1.35 OC(=O)C1CNC(=O)O1 Amb24112958 [0,0,0,1,0,1|1,0,0]=3 2914 B9R1.35 OC(=O)C1CNC(=O)S1 Amb24084914 [0,0,0,1,0,1|1,0,0]=3 2915 B9R1.35 OC(=O)C1CNC(=S)S1 Amb25180946 [0,0,0,1,0,1|1,1,0]=4 2916 B9R1.35 OC(=O)C1COC(=O)N1 Amb24288785 [0,0,0,1,0,1|0,0,0]=2 2917 B9R1.35 OC(=O)C1COC(=O)O1 Amb25767974 [0,0,0,1,0,1|0,0,0]=2 2918 B9R1.35 OC(=O)C1CSC(=O)S1 Amb23504458 [0,0,0,1,0,1|0,1,0]=3 2919 B9R1.35 OC(=O)C1OC(=O)CS1 Amb25063335 [0,0,0,1,0,1|2,0,0]=4 2920 B9R1.35 OC(=O)C=1CC(=O)ON1 Amb25700026 [0,0,0,1,0,1|1,0,1]=4 2921 B9R1.35 OC(=O)C=1COC(=O)C1 Amb18642559 [0,0,0,1,0,1|0,0,1]=3 2922 B9R1.35 OC(=O)[C@@H]1C=CC(=O)N1 Amb25140391 [0,0,0,1,0,1|1,0,1]=4 2923 B9R1.35 OC(=O)[C@@H]1CC(=O)CC1 Amb22746923 [0,0,0,1,0,1|1,0,0]=3 2924 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb19516117 [0,0,0,1,0,1|2,0,0]=4 2925 B9R1.35 OC(=O)[C@@H]1CC(=O)CN1 Amb22747440 [0,0,0,1,0,1|2,0,0]=4 2926 B9R1.35 OC(=O)[C@@H]1CC(=O)NC1 Amb23439643 [0,0,0,1,0,1|1,0,0]=3 2927 B9R1.35 OC(=O)[C@@H]1CCC(=O)N1 Amb24099403 [0,0,0,1,0,1|1,0,0]=3 2928 B9R1.35 OC(=O)[C@@H]1CNC(=O)O1 Amb25146207 [0,0,0,1,0,1|1,0,0]=3 2929 B9R1.35 OC(=O)[C@@H]1COC(=O)N1 Amb19517080 [0,0,0,1,0,1|0,0,0]=2 2930 B9R1.35 OC(=O)[C@H]1CC(=O)CN1 Amb25360885 [0,0,0,1,0,1|2,0,0]=4 2931 B9R1.35 OC(=O)[C@H]1CNC(=O)N1 Amb24079612 [0,0,0,1,0,1|1,0,0]=3 2932 B9R1.35 OC(=O)[C@H]1COC(=O)N1 Amb24340149 [0,0,0,1,0,1|0,0,0]=2 2933 B9R1.35 OC1=CC(NN1)C(O)=O Amb25224097 [0,0,0,1,0,1|2,0,0]=4 2934 B9R1.35 OC1CCC(C1)C(O)=O Amb21963572 [0,0,0,1,0,1|1,0,1]=4 2935 B9R1.35 OC1NC(CS1)C(O)=O Amb25759113 [0,0,0,1,0,1|0,1,1]=4 2936 B9R1.35 O[13C](=O)[13CH]1[13CH2]SC(=S)N1 Amb17620633 [0,0,0,1,0,1|0,2,0]=4 2937 B9R1.35 O[C@@H]1CC[C@@H](C1)C(O)=O Amb22746073 [0,0,0,1,0,1|1,0,1]=4 2938 B9R1.35 O[C@@H]1CC[C@H](C1)C(O)=O Amb22746558 [0,0,0,1,0,1|1,0,1]=4 2939 B9R1.35 O[C@@H]1CC[C@H](N1)C(O)=O Amb24515622 [0,0,0,1,0,1|1,0,1]=4 2940 B9R1.35 [15NH2][13C]1=[15N]C(CS1)C(O)=O Amb22054325 [0,0,0,1,0,1|1,1,0]=4 2941 B9R1.55 CC1C(NC1=O)C(O)=O Amb25339232 [0,0,0,1,0,1|1,0,0]=3 2942 B9R1.55 CC1C(OC1=O)C(C)O Amb25177629 [0,0,0,1,0,1|1,0,1]=4 2943 B9R1.55 CN1C(CC1=O)C(O)=O Amb22011579 [0,0,0,1,0,1|2,0,0]=4 2944 B9R1.67 CC(=O)CC1CCC1=O Amb24434546 [0,0,0,1,0,1|2,0,0]=4 2945 B9R1.67 CC(=O)NC1CCC1=O Amb22896798 [0,0,0,1,0,1|2,0,0]=4 2946 B9R1.67 CC(=O)OC1CNC1=O Amb22492524 [0,0,0,1,0,1|2,0,0]=4 2947 B9R1.67 OC(=O)CN1CCC1=O Amb25368422 [0,0,0,1,0,1|2,0,0]=4 2948 B9R1.69 CC1NC(=O)CNC1=O Amb24477892 [0,0,0,1,0,1|2,0,0]=4 2949 B9R1.69 CC1NC(=O)COC1=O Amb20669551 [0,0,0,1,0,1|1,0,0]=3 2950 B9R1.69 CC1NC(=O)NNC1=O Amb25789519 [0,0,0,1,0,1|2,0,0]=4 2951 B9R1.69 CC1NC(=O)OCC1=O Amb25685634 [0,0,0,1,0,1|1,0,0]=3 2952 B9R1.69 CC1OC(=O)CNC1=O Amb25145608 [0,0,0,1,0,1|2,0,0]=4 2953 B9R1.69 CC1SC(=O)CNC1=O Amb24746743 [0,0,0,1,0,1|2,0,0]=4 2954 B9R1.69 CC=1COC(=O)C(C)N1 Amb24353611 [0,0,0,1,0,1|2,0,0]=4 2955 B9R1.69 C[C@@H]1NC(=O)CNC1=O Amb22233064 [0,0,0,1,0,1|2,0,0]=4 2956 B9R1.69 C[C@@H]1NC(=O)OCC1=O Amb24745337 [0,0,0,1,0,1|1,0,0]=3 2957 B9R1.69 C[C@@H]1OC(=O)C=CC1=O Amb24633316 [0,0,0,1,0,1|2,0,0]=4 2958 B9R1.69 C[C@H]1NC(=O)CNC1=O Amb25726602 [0,0,0,1,0,1|2,0,0]=4 2959 B9R1.69 C[C@H]1OC(=O)CCC1=O Amb25749526 [0,0,0,1,0,1|2,0,0]=4 2960 B9R1.152 CC(=O)[C@]1(C)CC(=O)O1 Amb24340260 [0,0,0,1,0,1|1,0,0]=3 2961 B9R1.152 CC1(CC(=O)C1)C(O)=O Amb22406208 [0,0,0,1,0,1|1,0,0]=3 2962 B9R1.161 CC(=C)[C@@H]1C[C@@H]1C(O)=O Amb24514832 [0,0,0,1,0,1|2,0,0]=4 2963 B9R1.161 CC(=O)C1C[C@H]1C(C)=O Amb25319021 [0,0,0,1,0,1|2,0,0]=4 2964 B9R1.161 CC(=O)C1OC1C(O)=O Amb25233192 [0,0,0,1,0,1|2,0,0]=4 2965 B9R1.161 NC(=O)C1CC1C(=O)O Amb17606123 [0,0,0,1,0,1|1,0,0]=3 2966 B9R1.161 NC(=O)C1OC1C(O)=O Amb25695985 [0,0,0,1,0,1|2,0,0]=4 2967 B9R1.161 NC(=O)[C@@H]1C[C@@H]1C(O)=O Amb24623178 [0,0,0,1,0,1|1,0,0]=3 2968 B9R1.161 NC(=O)[C@@H]1C[C@H]1C(N)=O Amb25273795 [0,0,0,1,0,1|2,0,0]=4 2969 B9R1.161 NC(=O)[C@H]1C[C@@H]1C(N)=O Amb24760759 [0,0,0,1,0,1|2,0,0]=4 2970 B9R1.161 NC(=O)[C@H]1C[C@H]1C(N)=O Amb24671257 [0,0,0,1,0,1|2,0,0]=4 2971 B9R1.161 NC(=O)[C@H]1O[C@H]1C(O)=O Amb25174864 [0,0,0,1,0,1|2,0,0]=4 2972 B9R1.161 OC(=O)C1CC1C(=O)O Amb1350467 [0,0,0,1,0,1|0,0,0]=2 2973 B9R1.161 OC(=O)[C@@H]1C[C@@H]1C(=O)Cl Amb25175103 [0,0,0,1,0,1|1,0,0]=3 2974 B9R1.161 OC(=O)[C@@H]1C[C@H]1C(=O)Cl Amb24402096 [0,0,0,1,0,1|1,0,0]=3 2975 B9R1.161 OC(=O)[C@@H]1C[C@H]1C(O)=O Amb22901897 [0,0,0,1,0,1|0,0,0]=2 2976 B9R1.161 OC(=O)[C@@H]1O[C@H]1C(O)=O Amb22799776 [0,0,0,1,0,1|1,0,0]=3 2977 B9R1.161 OC(=O)[C@H]1O[C@@H]1C(O)=O Amb22262951 [0,0,0,1,0,1|1,0,0]=3 2978 B9R1.161 [O-][N+](=O)[C@@H]1C[C@H]1C(O)=O Amb25109456 [0,0,0,1,0,1|1,0,1]=4 2979 B9R1.161 [O-][N+](=O)[C@H]1C[C@H]1C(O)=O Amb25755764 [0,0,0,1,0,1|1,0,1]=4 2980 B9R1.164 CC1(O)CC(C1)C(O)=O Amb19958862 [0,0,0,1,0,1|1,0,1]=4 2981 B9R1.164 C[C@@]1(O)C[C@@H](C1)C(O)=O Amb23440037 [0,0,0,1,0,1|1,0,1]=4 2982 B9R1.164 C[C@@]1(O)C[C@H](C1)C(O)=O Amb23440038 [0,0,0,1,0,1|1,0,1]=4 2983 B9R1.3 CC1=C(O)C=COC1=O Amb21855895 [0,1,0,1,0,0|1,0,1]=4 2984 B9R1.3 CC1C(=O)COCC1=O Amb24621297 [0,1,0,1,0,0|1,0,0]=3 2985 B9R1.3 CC1C(=O)NCCC1=O Amb25220145 [0,1,0,1,0,0|2,0,0]=4 2986 B9R1.3 CC1C(O)CCOC1=O Amb24592874 [0,1,0,1,0,0|1,0,1]=4 2987 B9R1.3 O=C1COCC(=O)C1[Na] Amb24605327 [0,1,0,1,0,0|2,0,0]=4 2988 B9R1.37 CC1=C(Br)C(=O)OC1=O Amb22499286 [0,1,0,1,0,0|1,0,1]=4 2989 B9R1.37 CC1=C(C)C(=O)OC1O Amb17778789 [0,1,0,1,0,0|1,0,1]=4 2990 B9R1.37 CC1=C(O)C(=O)CC1=O Amb22338544 [0,1,0,1,0,0|1,0,1]=4 2991 B9R1.37 CC1=CC(=O)C(C)C1=O Amb24583564 [0,1,0,1,0,0|2,0,0]=4 2992 B9R1.37 CC1C(=O)C=C(O)C1=O Amb25059233 [0,1,0,1,0,0|1,0,0]=3 2993 B9R1.37 CC1C(=O)OC(=O)C1=O Amb25358983 [0,1,0,1,0,0|0,0,1]=3 2994 B9R1.37 CC1C(=O)OC(=O)N1C Amb24718553 [0,1,0,1,0,0|2,0,0]=4 2995 B9R1.37 CC1C(C)C(O)OC1=O Amb24705671 [0,1,0,1,0,0|1,0,1]=4 2996 B9R1.37 CC1C(N)C(=O)OC1=O Amb24549009 [0,1,0,1,0,0|1,0,1]=4 2997 B9R1.37 CC1C(O)C(=O)NC1=O Amb24749603 [0,1,0,1,0,0|1,0,1]=4 2998 B9R1.37 CC1C(O)C(C)OC1=O Amb25056081 [0,1,0,1,0,0|1,0,1]=4 2999 B9R1.37 CC1OC(=O)C(C)C1=O Amb25347361 [0,1,0,1,0,0|1,0,0]=3 3000 B9R1.37 CC1OC(=O)C(F)C1=O Amb24736506 [0,1,0,1,0,0|2,0,0]=4 3001 B9R1.37 CC=1C(=O)OC(O)C1Br Amb24529085 [0,1,0,1,0,0|1,0,1]=4 3002 B9R1.37 CC=1C(=O)O[C@H](O)C1C Amb25853978 [0,1,0,1,0,0|1,0,1]=4 3003 B9R1.37 CC=1OC(=O)C(O)C1O Amb25769590 [0,1,0,1,0,0|2,0,0]=4 3004 B9R1.37 CN1C(=O)CC(O)C1=O Amb22388645 [0,1,0,1,0,0|2,0,0]=4 3005 B9R1.37 C[C@@H]1C(=O)OC(=O)N1C Amb24183510 [0,1,0,1,0,0|2,0,0]=4 3006 B9R1.37 C[C@@H]1[C@@H](O)[C@@H](C)OC1=O Amb24686935 [0,1,0,1,0,0|1,0,1]=4 3007 B9R1.37 C[C@@H]1[C@H](O)[C@@H](C)OC1=O Amb25343889 [0,1,0,1,0,0|1,0,1]=4 3008 B9R1.37 C[C@H]1C(=O)OC(=O)N1C Amb24528343 [0,1,0,1,0,0|2,0,0]=4 3009 B9R1.37 C[C@H]1[C@@H](O)[C@H](C)OC1=O Amb24520333 [0,1,0,1,0,0|1,0,1]=4 3010 B9R1.37 C[C@H]1[C@H](O)[C@@H](C)OC1=O Amb25235586 [0,1,0,1,0,0|1,0,1]=4 3011 B9R1.37 C[C@H]1[C@H](O)[C@H](C)OC1=O Amb25176668 [0,1,0,1,0,0|1,0,1]=4 3012 B9R1.37 OC1C(O)C(=O)OC1=O Amb25188995 [0,1,0,1,0,0|1,0,1]=4 3013 B9R1.37 OC1CC(=O)C(O)C1=O Amb25759526 [0,1,0,1,0,0|2,0,0]=4 3014 B9R1.37 OC=1OC(=O)C(Cl)C1Cl Amb22015300 [0,1,0,1,0,0|2,0,0]=4 3015 B9R1.41 C=C1CCCC1C(O)=O Amb18642417 [0,1,0,1,0,0|2,0,0]=4 3016 B9R1.41 CC(=O)C1CCOC1=O Amb2404781 [0,1,0,1,0,0|1,0,0]=3 3017 B9R1.41 CC(=O)C1CCSC1=O Amb24340323 [0,1,0,1,0,0|1,1,0]=4 3018 B9R1.41 CC1=CCSC1C(O)=O Amb25801334 [0,1,0,1,0,0|2,0,0]=4 3019 B9R1.41 CC1=COCC1C(C)=O Amb25244405 [0,1,0,1,0,0|2,0,0]=4 3020 B9R1.41 CC1COCC1C(O)=O Amb25326733 [0,1,0,1,0,0|1,0,1]=4 3021 B9R1.41 CC1OCCC1C(O)=O Amb22059743 [0,1,0,1,0,0|1,0,1]=4 3022 B9R1.41 CC1OCNC1C(O)=O Amb24564435 [0,1,0,1,0,0|1,0,1]=4 3023 B9R1.41 C[C@@H]1COC[C@@H]1C(O)=O Amb24649146 [0,1,0,1,0,0|1,0,1]=4 3024 B9R1.41 C[C@@H]1OCC[C@@H]1C(O)=O Amb22886528 [0,1,0,1,0,0|1,0,1]=4 3025 B9R1.41 C[C@H](O)[C@@H]1CCOC1=O Amb25233110 [0,1,0,1,0,0|1,0,1]=4 3026 B9R1.41 C[C@H]1OCC[C@H]1C(O)=O Amb25253338 [0,1,0,1,0,0|1,0,1]=4 3027 B9R1.41 NC(=O)C1CCCC1=O Amb16233729 [0,1,0,1,0,0|2,0,0]=4 3028 B9R1.41 NC(=O)C1CCNC1=O Amb24581573 [0,1,0,1,0,0|2,0,0]=4 3029 B9R1.41 NC(=O)C1CCOC1=O Amb24575255 [0,1,0,1,0,0|1,0,0]=3 3030 B9R1.41 NC(=O)[C@@H]1CCCC1=O Amb24182045 [0,1,0,1,0,0|2,0,0]=4 3031 B9R1.41 NC1COCC1C(O)=O Amb24709230 [0,1,0,1,0,0|1,0,1]=4 3032 B9R1.41 NC1OCCC1C(O)=O Amb24441640 [0,1,0,1,0,0|1,0,1]=4 3033 B9R1.41 N[C@@H]1COC[C@@H]1C(O)=O Amb24078777 [0,1,0,1,0,0|1,0,1]=4 3034 B9R1.41 N[C@@H]1OCC[C@@H]1C(O)=O Amb24581227 [0,1,0,1,0,0|1,0,1]=4 3035 B9R1.41 N[C@H]1COC[C@@H]1C(O)=O Amb24605467 [0,1,0,1,0,0|1,0,1]=4 3036 B9R1.41 N[C@H]1COC[C@H]1C(O)=O Amb24763623 [0,1,0,1,0,0|1,0,1]=4 3037 B9R1.41 O=C1CCCC1C(=O)Cl Amb21961757 [0,1,0,1,0,0|2,0,0]=4 3038 B9R1.41 O=C1OCCC1C(=O)Cl Amb24078751 [0,1,0,1,0,0|1,0,0]=3 3039 B9R1.41 O=C1OCCN1C(=O)Cl Amb24478587 [0,1,0,1,0,0|2,0,0]=4 3040 B9R1.41 OC(=O)C1=CCOC1=O Amb24540268 [0,1,0,1,0,0|0,0,1]=3 3041 B9R1.41 OC(=O)C1=CONC1=O Amb18832582 [0,1,0,1,0,0|0,0,2]=4 3042 B9R1.41 OC(=O)C1C=NNC1=O Amb25083116 [0,1,0,1,0,0|1,0,1]=4 3043 B9R1.41 OC(=O)C1C=NOC1=O Amb25825326 [0,1,0,1,0,0|0,0,1]=3 3044 B9R1.41 OC(=O)C1CCCC1=O Amb18642571 [0,1,0,1,0,0|1,0,0]=3 3045 B9R1.41 OC(=O)C1CCCC1=S Amb25273371 [0,1,0,1,0,0|1,1,0]=4 3046 B9R1.41 OC(=O)C1CCNC1=O Amb18642691 [0,1,0,1,0,0|1,0,0]=3 3047 B9R1.41 OC(=O)C1CCOC1=O Amb17593365 [0,1,0,1,0,0|0,0,0]=2 3048 B9R1.41 OC(=O)C1CON=C1Br Amb24626592 [0,1,0,1,0,0|1,0,0]=3 3049 B9R1.41 OC(=O)C1CSCC1=O Amb16230660 [0,1,0,1,0,0|0,1,0]=3 3050 B9R1.41 OC(=O)C1CSNC1=O Amb25234069 [0,1,0,1,0,0|0,1,0]=3 3051 B9R1.41 OC(=O)C1NCCC1=S Amb25147125 [0,1,0,1,0,0|1,1,0]=4 3052 B9R1.41 OC(=O)[C@@H]1CSCC1=O Amb24182054 [0,1,0,1,0,0|0,1,0]=3 3053 B9R1.41 OC1CCCC1C(O)=O Amb19148040 [0,1,0,1,0,0|1,0,1]=4 3054 B9R1.41 OC1CCNC1C(O)=O Amb22387784 [0,1,0,1,0,0|1,0,1]=4 3055 B9R1.41 OC1CCN[C@@H]1C(=O)O Amb10604192 [0,1,0,1,0,0|1,0,1]=4 3056 B9R1.41 OC1CCN[C@H]1C(O)=O Amb24359065 [0,1,0,1,0,0|1,0,1]=4 3057 B9R1.41 OC1CCSC1C(O)=O Amb24061424 [0,1,0,1,0,0|1,0,1]=4 3058 B9R1.41 OC1CNCC1C(O)=O Amb22886381 [0,1,0,1,0,0|1,0,1]=4 3059 B9R1.41 OC1CSCC1C(O)=O Amb18831363 [0,1,0,1,0,0|0,1,1]=4 3060 B9R1.41 OC=1CCCC1C(O)=O Amb25697344 [0,1,0,1,0,0|1,0,1]=4 3061 B9R1.41 O[C@@H]1CCC[C@@H]1C(O)=O Amb22747315 [0,1,0,1,0,0|1,0,1]=4 3062 B9R1.41 O[C@@H]1CCC[C@H]1C(O)=O Amb24120349 [0,1,0,1,0,0|1,0,1]=4 3063 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb22746928 [0,1,0,1,0,0|1,0,1]=4 3064 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb23439285 [0,1,0,1,0,0|1,0,1]=4 3065 B9R1.41 O[C@@H]1CCN[C@@H]1C(O)=O Amb24183503 [0,1,0,1,0,0|1,0,1]=4 3066 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb22746713 [0,1,0,1,0,0|1,0,1]=4 3067 B9R1.41 O[C@@H]1CCN[C@H]1C(O)=O Amb24183557 [0,1,0,1,0,0|1,0,1]=4 3068 B9R1.41 O[C@@H]1CNC[C@H]1C(O)=O Amb24120417 [0,1,0,1,0,0|1,0,1]=4 3069 B9R1.41 O[C@H]1CCC[C@H]1C(=O)O Amb10844853 [0,1,0,1,0,0|1,0,1]=4 3070 B9R1.41 O[C@H]1CCN[C@@H]1C(O)=O Amb24055327 [0,1,0,1,0,0|1,0,1]=4 3071 B9R1.41 O[C@H]1CCN[C@H]1C(O)=O Amb22230426 [0,1,0,1,0,0|1,0,1]=4 3072 B9R1.41 O[C@H]1CNC[C@H]1C(O)=O Amb22274552 [0,1,0,1,0,0|1,0,1]=4 3073 B9R1.81 COC(=O)C1CCC1O Amb24448430 [0,1,0,1,0,0|1,0,1]=4 3074 B9R1.81 COC(=O)C1CNC1=O Amb24665696 [0,1,0,1,0,0|1,0,0]=3 3075 B9R1.81 COC(=O)N1CCC1=O Amb24078326 [0,1,0,1,0,0|2,0,0]=4 3076 B9R1.81 COC(=O)[C@H]1NCC1=O Amb24471980 [0,1,0,1,0,0|2,0,0]=4 3077 B9R1.93 CC1(CC1CO)C(O)=O Amb24559345 [0,1,0,1,0,0|1,0,1]=4 3078 B9R1.93 CC1(OC1CO)C(O)=O Amb24746000 [0,1,0,1,0,0|0,0,2]=4 3079 B9R1.93 CCC1OC1(C)C(O)=O Amb25843946 [0,1,0,1,0,0|1,0,1]=4 3080 B9R1.96 O=NN1CC[C@H]1C(=O)O Amb17618565 [0,1,0,1,0,0|2,0,0]=4 3081 B9R1.96 OC(=O)C1CCC1C=O Amb25302625 [0,1,0,1,0,0|1,0,1]=4 3082 B9R1.96 OC(=O)C1CCN1N=O Amb24726882 [0,1,0,1,0,0|2,0,0]=4 3083 B9R1.96 OC(=O)[C@H]1CCN1N=O Amb24340220 [0,1,0,1,0,0|2,0,0]=4 3084 B9R1.96 OCC1CCC1C(O)=O Amb24340315 [0,1,0,1,0,0|1,0,1]=4 3085 B9R1.96 ONC1CCC1C(O)=O Amb24471809 [0,1,0,1,0,0|1,0,1]=4 3086 B9R1.127 CC1(CC1C(O)=O)CO Amb24529046 [0,1,0,1,0,0|1,0,1]=4 3087 B9R1.127 OC[C@@]1(Cl)C[C@H]1C(O)=O Amb24511974 [0,1,0,1,0,0|1,0,1]=4 3088 B9R1.127 OC[C@]1(Cl)C[C@H]1C(O)=O Amb25201489 [0,1,0,1,0,0|1,0,1]=4 3089 B9R1.132 CC1=C(CO)COC1=O Amb24398034 [0,1,0,1,0,0|1,0,1]=4 3090 B9R1.132 CC1C(C=O)=NOC1=O Amb25248838 [0,1,0,1,0,0|1,0,0]=3 3091 B9R1.159 CC(=O)C1(C)CCC1=O Amb25050231 [0,1,0,1,0,0|2,0,0]=4 3092 B9R1.159 CC1(N=CC1O)C(O)=O Amb24078332 [0,1,0,1,0,0|1,0,1]=4 3093 B9R1.159 N[C@@]1(CC[C@H]1O)C(O)=O Amb25313173 [0,1,0,1,0,0|1,0,1]=4 3094 B9R1.159 OC1CCC1(O)C(O)=O Amb24477886 [0,1,0,1,0,0|1,0,1]=4 3095 B9R1.27 CCC1C(=O)CSC1=O Amb25092161 [0,1,0,1,0,0|1,1,0]=4 3096 B9R1.27 CCC1C(N)=NOC1=O Amb24555555 [0,1,0,1,0,0|2,0,0]=4 3097 B9R1.27 CCC1C(O)COC1=O Amb24420023 [0,1,0,1,0,0|1,0,1]=4 3098 B9R1.27 CC[C@@H]1[C@@H](O)COC1=O Amb25332099 [0,1,0,1,0,0|1,0,1]=4 3099 B9R1.27 COC1C(=O)CCC1=O Amb25202706 [0,1,0,1,0,0|2,0,0]=4 3100 B9R1.27 O=C1OCC(=O)C1C=O Amb18642561 [0,1,0,1,0,0|1,0,1]=4 3101 B9R1.52 CC(=O)C1C(=O)OC1=O Amb24686390 [0,1,0,1,0,0|1,0,1]=4 3102 B9R1.130 CCC1(OC1=O)C(O)=O Amb25737563 [0,1,0,1,0,0|0,0,0]=2 3103 B9R1.168 CC(=C)C1(CC1)C(O)=O Amb25356431 [0,1,0,1,0,0|2,0,0]=4 3104 B9R1.168 CC(=O)C1(CC1)C(=O)O Amb16233343 [0,1,0,1,0,0|1,0,0]=3 3105 B9R1.168 CC(=O)C1(CC1)C(C)=O Amb17836206 [0,1,0,1,0,0|2,0,0]=4 3106 B9R1.168 CC(=O)C1(CC1)C(N)=O Amb25709592 [0,1,0,1,0,0|2,0,0]=4 3107 B9R1.168 NC(=O)C1(CC1)C(=O)N Amb10808792 [0,1,0,1,0,0|2,0,0]=4 3108 B9R1.168 OC(=O)C1(C=C1)C(O)=O Amb22011760 [0,1,0,1,0,0|0,0,1]=3 3109 B9R1.168 OC(=O)C1(N=N1)C(O)=O Amb25145963 [0,1,0,1,0,0|1,0,0]=3 3110 B9R1.106 CC1(C)C(=O)NNC1=O Amb24481999 [0,1,0,1,0,0|2,0,0]=4 3111 B9R1.106 CC1(C)C(=O)OOC1=O Amb17779665 [0,1,0,1,0,0|0,0,0]=2 3112 B9R1.106 CC1(C)[C@@H](O)COC1=O Amb24466275 [0,1,0,1,0,0|1,0,1]=4 3113 B9R1.106 CC1(Cl)C(=O)COC1=O Amb25031799 [0,1,0,1,0,0|1,0,0]=3 3114 B9R1.106 CC1(Cl)C(O)COC1=O Amb24355065 [0,1,0,1,0,0|1,0,1]=4 3115 B9R1.106 CC1(F)C(=O)CCC1=O Amb24723927 [0,1,0,1,0,0|2,0,0]=4 3116 B9R1.106 CC1(O)C(O)COC1=O Amb25182892 [0,1,0,1,0,0|1,0,1]=4 3117 B9R1.106 C[C@@]1(O)[C@@H](O)COC1=O Amb24555298 [0,1,0,1,0,0|1,0,1]=4 3118 B9R1.106 C[C@@]1(O)[C@H](O)COC1=O Amb22745011 [0,1,0,1,0,0|1,0,1]=4 3119 B9R1.106 C[C@]1(Cl)[C@@H](O)COC1=O Amb25345157 [0,1,0,1,0,0|1,0,1]=4 3120 B9R1.165 CC(N)(C1CO1)C(O)=O Amb25082874 [0,1,0,1,0,0|1,0,1]=4 3121 B7R0.6 C=C(Br)CCC(O)=O Amb18648212 [1,0,0,0,0,1|2,0,0]=4 3122 B7R0.6 C=C(Cl)CCC(O)=O Amb18642971 [1,0,0,0,0,1|2,0,0]=4 3123 B7R0.6 C=C(F)CCC(O)=O Amb25141041 [1,0,0,0,0,1|2,0,0]=4 3124 B7R0.6 CC(=C)CCC(O)=O Amb18641793 [1,0,0,0,0,1|2,0,0]=4 3125 B7R0.6 CC(=N)SCC(O)=O Amb25704672 [1,0,0,0,0,1|2,0,0]=4 3126 B7R0.6 CC(=O)CCC(=O)Cl Amb17142859 [1,0,0,0,0,1|2,0,0]=4 3127 B7R0.6 CC(=O)CCC(=O)N Amb17142854 [1,0,0,0,0,1|2,0,0]=4 3128 B7R0.6 CC(=O)CCC([O-])=O Amb22350071 [1,0,0,0,0,1|1,0,1]=4 3129 B7R0.6 CC(=O)CCP(O)=O Amb24647699 [1,0,0,0,0,1|2,0,0]=4 3130 B7R0.6 CC(=O)CNC(N)=O Amb24697691 [1,0,0,0,0,1|2,0,0]=4 3131 B7R0.6 CC(=O)NCC(=O)N Amb17231824 [1,0,0,0,0,1|2,0,0]=4 3132 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [1,0,0,0,0,1|1,0,0]=3 3133 B7R0.6 CC(=O)OCC(=O)Br Amb25032214 [1,0,0,0,0,1|2,0,0]=4 3134 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [1,0,0,0,0,1|1,0,0]=3 3135 B7R0.6 CC(=O)OCC(N)=O Amb24670486 [1,0,0,0,0,1|2,0,0]=4 3136 B7R0.6 CC(=O)SCC(=O)Cl Amb24451416 [1,0,0,0,0,1|2,0,0]=4 3137 B7R0.6 CC(=O)SCC(=O)O Amb17607669 [1,0,0,0,0,1|1,0,0]=3 3138 B7R0.6 CC(=O)SCC(C)=O Amb25131248 [1,0,0,0,0,1|2,0,0]=4 3139 B7R0.6 CC(=O)SCC(N)=O Amb22353247 [1,0,0,0,0,1|2,0,0]=4 3140 B7R0.6 CC(=O)\C=C/C(O)=O Amb24662475 [1,0,0,0,0,1|1,0,1]=4 3141 B7R0.6 CC(=S)NCC(O)=O Amb24325138 [1,0,0,0,0,1|1,1,0]=4 3142 B7R0.6 CC(C)=NCC(O)=O Amb24481383 [1,0,0,0,0,1|2,0,0]=4 3143 B7R0.6 CC(O)CCC(O)=O Amb18294804 [1,0,0,0,0,1|1,0,1]=4 3144 B7R0.6 CC(O)NCC(O)=O Amb25141558 [1,0,0,0,0,1|1,0,1]=4 3145 B7R0.6 CS(=O)CCC(O)=O Amb18523762 [1,0,0,0,0,1|2,0,0]=4 3146 B7R0.6 CS(=O)NCC(O)=O Amb25237322 [1,0,0,0,0,1|2,0,0]=4 3147 B7R0.6 C[C@@H](COC(=O)O)O Amb16232417 [1,0,0,0,0,1|1,0,1]=4 3148 B7R0.6 NC(=N)CCC(O)=O Amb25736788 [1,0,0,0,0,1|2,0,0]=4 3149 B7R0.6 NC(=N)NCC(=O)O Amb16231404 [1,0,0,0,0,1|2,0,0]=4 3150 B7R0.6 NC(=N)N[13CH2][13C](=O)O Amb17614848 [1,0,0,0,0,1|2,0,0]=4 3151 B7R0.6 NC(=N)OCC(O)=O Amb24394884 [1,0,0,0,0,1|2,0,0]=4 3152 B7R0.6 NC(=N)SCC(O)=O Amb21955777 [1,0,0,0,0,1|2,0,0]=4 3153 B7R0.6 NC(=O)CCC(=O)N Amb1353209 [1,0,0,0,0,1|2,0,0]=4 3154 B7R0.6 NC(=O)CCP(O)=O Amb25840251 [1,0,0,0,0,1|2,0,0]=4 3155 B7R0.6 NC(=O)CNC(O)=O Amb24705097 [1,0,0,0,0,1|1,0,0]=3 3156 B7R0.6 NC(=O)NCC(=O)N Amb1136421 [1,0,0,0,0,1|2,0,0]=4 3157 B7R0.6 NC(=O)NCC(=O)O Amb16205895 [1,0,0,0,0,1|1,0,0]=3 3158 B7R0.6 NC(=O)OCC(=O)Cl Amb25259155 [1,0,0,0,0,1|2,0,0]=4 3159 B7R0.6 NC(=O)OCC(N)=O Amb25724808 [1,0,0,0,0,1|2,0,0]=4 3160 B7R0.6 NC(=O)OCC(O)=O Amb25777061 [1,0,0,0,0,1|1,0,0]=3 3161 B7R0.6 NC(=O)SCC(N)=O Amb24359876 [1,0,0,0,0,1|2,0,0]=4 3162 B7R0.6 NC(=O)SCC(O)=O Amb24640543 [1,0,0,0,0,1|1,0,0]=3 3163 B7R0.6 NC(=S)CCC(O)=O Amb18102382 [1,0,0,0,0,1|1,1,0]=4 3164 B7R0.6 NC(=S)OCC(O)=O Amb25340403 [1,0,0,0,0,1|1,1,0]=4 3165 B7R0.6 NC(=S)SCC(O)=O Amb25108057 [1,0,0,0,0,1|1,1,0]=4 3166 B7R0.6 O=C(F)CCC(=O)F Amb24483270 [1,0,0,0,0,1|2,0,0]=4 3167 B7R0.6 OB(O)CCC(O)=O Amb24640288 [1,0,0,0,0,1|1,0,1]=4 3168 B7R0.6 OC(=O)C=CC(O)=O Amb22487311 [1,0,0,0,0,1|0,0,1]=3 3169 B7R0.6 OC(=O)C=CC(O)=O Amb22487315 [1,0,0,0,0,1|0,0,1]=3 3170 B7R0.6 OC(=O)CC=C(Cl)Cl Amb17593875 [1,0,0,0,0,1|2,0,0]=4 3171 B7R0.6 OC(=O)CC=C(F)F Amb25127059 [1,0,0,0,0,1|2,0,0]=4 3172 B7R0.6 OC(=O)CCC(=O)Cl Amb17593468 [1,0,0,0,0,1|1,0,0]=3 3173 B7R0.6 OC(=O)CCC(O)=O Amb22168124 [1,0,0,0,0,1|0,0,0]=2 3174 B7R0.6 OC(=O)CCC(O)=O Amb22349196 [1,0,0,0,0,1|0,0,0]=2 3175 B7R0.6 OC(=O)CCC(O)=O Amb22353352 [1,0,0,0,0,1|0,0,0]=2 3176 B7R0.6 OC(=O)CCC(O)=O Amb22360649 [1,0,0,0,0,1|0,0,0]=2 3177 B7R0.6 OC(=O)CNC(=O)Cl Amb25277149 [1,0,0,0,0,1|1,0,0]=3 3178 B7R0.6 OC(=O)CNC(S)=S Amb24739663 [1,0,0,0,0,1|0,2,0]=4 3179 B7R0.6 OC(=O)COC(S)=S Amb24739791 [1,0,0,0,0,1|0,2,0]=4 3180 B7R0.6 OC(=O)COS(=O)=O Amb25064798 [1,0,0,0,0,1|1,0,1]=4 3181 B7R0.6 OC(=O)CSC(S)=S Amb24608205 [1,0,0,0,0,1|0,2,0]=4 3182 B7R0.6 OC(=O)C[13CH2][13C](O)=O Amb22353421 [1,0,0,0,0,1|0,0,0]=2 3183 B7R0.6 OC(=O)C\C=C(\F)/Cl Amb24599232 [1,0,0,0,0,1|2,0,0]=4 3184 B7R0.6 OC(=O)SCC(O)=O Amb24699018 [1,0,0,0,0,1|0,0,0]=2 3185 B7R0.6 OC(=O)[13CH2][13CH2]C(O)=O Amb22338081 [1,0,0,0,0,1|0,0,0]=2 3186 B7R0.6 OC(=O)[14CH2][14CH2]C(O)=O Amb22337597 [1,0,0,0,0,1|0,0,0]=2 3187 B7R0.6 OC(=O)\C=C/C(O)=O Amb22274309 [1,0,0,0,0,1|0,0,1]=3 3188 B7R0.6 OC(=O)\C=C/C(O)=O Amb22350132 [1,0,0,0,0,1|0,0,1]=3 3189 B7R0.6 OC(=O)\C=C\C(=O)O Amb10072561 [1,0,0,0,0,1|0,0,1]=3 3190 B7R0.6 OC(=O)\C=C\C(O)=O Amb22336584 [1,0,0,0,0,1|0,0,1]=3 3191 B7R0.6 OC(=O)\C=C\C(O)=O Amb22352586 [1,0,0,0,0,1|0,0,1]=3 3192 B7R0.6 OC(=O)\C=C\C(O)=O Amb22353441 [1,0,0,0,0,1|0,0,1]=3 3193 B7R0.6 OC(=O)\C=C\C(O)=O Amb22353537 [1,0,0,0,0,1|0,0,1]=3 3194 B7R0.6 OC(=O)\C=C\C(O)=O Amb22360655 [1,0,0,0,0,1|0,0,1]=3 3195 B7R0.6 OC(=O)\C=C\P(O)=O Amb24622481 [1,0,0,0,0,1|1,0,1]=4 3196 B7R0.6 OC(=O)\[13CH]=[13CH]\C(O)=O Amb22363150 [1,0,0,0,0,1|0,0,1]=3 3197 B7R0.6 OC(=O)\[14CH]=[14CH]/C(O)=O Amb22352435 [1,0,0,0,0,1|0,0,1]=3 3198 B7R0.6 OC(=S)CCC(O)=O Amb24586272 [1,0,0,0,0,1|0,1,0]=3 3199 B7R0.6 OC(O)CCC(O)=O Amb25762802 [1,0,0,0,0,1|0,0,2]=4 3200 B7R0.6 O[13C](=O)CC[13C](O)=O Amb22056173 [1,0,0,0,0,1|0,0,0]=2 3201 B7R0.6 O[13C](=O)[13CH2][13CH2][13C](O)=O Amb22056172 [1,0,0,0,0,1|0,0,0]=2 3202 B7R0.6 O[13C](=O)\[13CH]=[13CH]\[13C](O)=O Amb22055283 [1,0,0,0,0,1|0,0,1]=3 3203 B7R0.6 O[14C](=O)CC[14C](O)=O Amb22352661 [1,0,0,0,0,1|0,0,0]=2 3204 B7R0.6 [13CH3][13C](=O)[13CH2]CC(O)=O Amb22056002 [1,0,0,0,0,1|1,0,0]=3 3205 B7R0.6 [O-]C(=O)C#CC(O)=O Amb19748298 [1,0,0,0,0,1|0,0,2]=4 3206 B7R0.6 [O-]C(=O)CCC(O)=O Amb22730137 [1,0,0,0,0,1|0,0,1]=3 3207 B7R0.6 [O-]C(=O)CCC(O)=O Amb22733837 [1,0,0,0,0,1|0,0,1]=3 3208 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22230230 [1,0,0,0,0,1|0,0,2]=4 3209 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22330623 [1,0,0,0,0,1|0,0,2]=4 3210 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22360668 [1,0,0,0,0,1|0,0,2]=4 3211 B7R0.6 [O-]C(=O)CCC([O-])=O Amb22731284 [1,0,0,0,0,1|0,0,2]=4 3212 B7R0.6 [O-]C(=O)NCC([O-])=O Amb22731445 [1,0,0,0,0,1|0,0,2]=4 3213 B7R0.6 [O-]C(=O)\C=C/C(O)=O Amb22168115 [1,0,0,0,0,1|0,0,2]=4 3214 B7R0.6 [O-]C(=O)\C=C\C(O)=O Amb22043387 [1,0,0,0,0,1|0,0,2]=4 3215 B7R0.6 [O-]C(=O)\C=C\C(O)=O Amb22734231 [1,0,0,0,0,1|0,0,2]=4 3216 B7R0.6 [O-][N+](=O)CCC(=O)O Amb10843224 [1,0,0,0,0,1|1,0,1]=4 3217 B9R0.7 C=C(NCC(O)=O)C(O)=O Amb24350752 [0,0,0,0,0,2|0,0,2]=4 3218 B9R0.7 CC(=C)CCC(C)C(O)=O Amb25809141 [0,0,0,0,0,2|2,0,0]=4 3219 B9R0.7 CC(=C)CC[C@@H](C)C(O)=O Amb25685103 [0,0,0,0,0,2|2,0,0]=4 3220 B9R0.7 CC(=C)COC(C)C(O)=O Amb24549744 [0,0,0,0,0,2|2,0,0]=4 3221 B9R0.7 CC(=C)CO[C@@H](C)C(O)=O Amb24505175 [0,0,0,0,0,2|2,0,0]=4 3222 B9R0.7 CC(=C)CO[C@H](C)C(O)=O Amb25772492 [0,0,0,0,0,2|2,0,0]=4 3223 B9R0.7 CC(=NNC(N)=O)C(O)=O Amb24516860 [0,0,0,0,0,2|1,0,1]=4 3224 B9R0.7 CC(=O)C(Br)CCC(O)=O Amb25733508 [0,0,0,0,0,2|2,0,0]=4 3225 B9R0.7 CC(=O)C(C)C=NC(N)=O Amb24695370 [0,0,0,0,0,2|2,0,0]=4 3226 B9R0.7 CC(=O)C(C)CCC(N)=O Amb25843826 [0,0,0,0,0,2|2,0,0]=4 3227 B9R0.7 CC(=O)C(C)CNC(C)=O Amb24072033 [0,0,0,0,0,2|2,0,0]=4 3228 B9R0.7 CC(=O)C(C)SCC(C)=O Amb24482830 [0,0,0,0,0,2|2,0,0]=4 3229 B9R0.7 CC(=O)C(C)\C=N\C(N)=O Amb25789488 [0,0,0,0,0,2|2,0,0]=4 3230 B9R0.7 CC(=O)CCC(C)C(C)=O Amb25146789 [0,0,0,0,0,2|2,0,0]=4 3231 B9R0.7 CC(=O)CCC(C)C(O)=O Amb18644099 [0,0,0,0,0,2|1,0,0]=3 3232 B9R0.7 CC(=O)CCC(N)C(O)=O Amb20669473 [0,0,0,0,0,2|2,0,0]=4 3233 B9R0.7 CC(=O)CCC(N)C(O)=O Amb22157242 [0,0,0,0,0,2|2,0,0]=4 3234 B9R0.7 CC(=O)CC[C@@H](N)C(O)=O Amb19130479 [0,0,0,0,0,2|2,0,0]=4 3235 B9R0.7 CC(=O)CC[C@H](C)C(C)=O Amb25692099 [0,0,0,0,0,2|2,0,0]=4 3236 B9R0.7 CC(=O)CC[C@H](N)C(O)=O Amb25147501 [0,0,0,0,0,2|2,0,0]=4 3237 B9R0.7 CC(=O)CSC(C(=O)O)C Amb17501621 [0,0,0,0,0,2|1,0,0]=3 3238 B9R0.7 CC(=O)NCC(C)C(O)=O Amb18300085 [0,0,0,0,0,2|1,0,0]=3 3239 B9R0.7 CC(=O)NCC(F)C(O)=O Amb25356174 [0,0,0,0,0,2|2,0,0]=4 3240 B9R0.7 CC(=O)NCC(O)C(O)=O Amb25374579 [0,0,0,0,0,2|2,0,0]=4 3241 B9R0.7 CC(=O)NC[C@H](N)C(O)=O Amb25772091 [0,0,0,0,0,2|2,0,0]=4 3242 B9R0.7 CC(=O)NC[C@H](O)C(O)=O Amb24480830 [0,0,0,0,0,2|2,0,0]=4 3243 B9R0.7 CC(=O)NN=C(C)C(O)=O Amb25367709 [0,0,0,0,0,2|1,0,1]=4 3244 B9R0.7 CC(=O)NNC(C)C(N)=O Amb24688902 [0,0,0,0,0,2|2,0,0]=4 3245 B9R0.7 CC(=O)NNC(C)C(O)=O Amb24679763 [0,0,0,0,0,2|1,0,0]=3 3246 B9R0.7 CC(=O)NN[C@@H](C)C(O)=O Amb24068257 [0,0,0,0,0,2|1,0,0]=3 3247 B9R0.7 CC(=O)OCC(C(=O)O)N Amb17593668 [0,0,0,0,0,2|2,0,0]=4 3248 B9R0.7 CC(=O)OCC(C)C(N)=O Amb24356443 [0,0,0,0,0,2|2,0,0]=4 3249 B9R0.7 CC(=O)OCC(Cl)C(O)=O Amb24425506 [0,0,0,0,0,2|2,0,0]=4 3250 B9R0.7 CC(=O)OC[C@@H](C)C(O)=O Amb25187888 [0,0,0,0,0,2|1,0,0]=3 3251 B9R0.7 CC(=O)OC[C@@H](N)C(O)=O Amb22756697 [0,0,0,0,0,2|2,0,0]=4 3252 B9R0.7 CC(=O)OC[C@H](C)C(N)=O Amb25147342 [0,0,0,0,0,2|2,0,0]=4 3253 B9R0.7 CC(=O)ON[C@@H](C)C(O)=O Amb25096728 [0,0,0,0,0,2|1,0,0]=3 3254 B9R0.7 CC(=O)O\N=C(/C)\C(O)=O Amb24579771 [0,0,0,0,0,2|1,0,1]=4 3255 B9R0.7 CC(=O)SCC(C(=O)Cl)C Amb16232721 [0,0,0,0,0,2|2,0,0]=4 3256 B9R0.7 CC(=O)SCC(C)C(N)=O Amb22586594 [0,0,0,0,0,2|2,0,0]=4 3257 B9R0.7 CC(=O)SCC(Cl)C(O)=O Amb24423824 [0,0,0,0,0,2|2,0,0]=4 3258 B9R0.7 CC(=O)SCC(N)C(O)=O Amb22490452 [0,0,0,0,0,2|2,0,0]=4 3259 B9R0.7 CC(=O)SC[C@@H](C(=O)O)N Amb16185419 [0,0,0,0,0,2|2,0,0]=4 3260 B9R0.7 CC(=O)SC[C@H](C)C(=O)Cl Amb25230202 [0,0,0,0,0,2|2,0,0]=4 3261 B9R0.7 CC(=O)[C@@H](C)CCC(O)=O Amb25333003 [0,0,0,0,0,2|1,0,0]=3 3262 B9R0.7 CC(=O)[C@@H](N)CCC(O)=O Amb24386065 [0,0,0,0,0,2|2,0,0]=4 3263 B9R0.7 CC(=O)[C@H](C)CCC(O)=O Amb24671283 [0,0,0,0,0,2|1,0,0]=3 3264 B9R0.7 CC(=O)[C@H](C)COC(C)=O Amb24457434 [0,0,0,0,0,2|2,0,0]=4 3265 B9R0.7 CC(=O)\C=C\C(C)C(C)=O Amb25112484 [0,0,0,0,0,2|2,0,0]=4 3266 B9R0.7 CC(C)=C=CC(C)C(O)=O Amb25063829 [0,0,0,0,0,2|2,0,0]=4 3267 B9R0.7 CC(C)=CCC(C)C(O)=O Amb18643879 [0,0,0,0,0,2|2,0,0]=4 3268 B9R0.7 CC(C)=CC[C@@H](C)C(O)=O Amb24698988 [0,0,0,0,0,2|2,0,0]=4 3269 B9R0.7 CC(C)=NO[C@@H](C)C(O)=O Amb24349833 [0,0,0,0,0,2|2,0,0]=4 3270 B9R0.7 CC(CCC(O)=O)[N+]([O-])=O Amb25221792 [0,0,0,0,0,2|1,0,1]=4 3271 B9R0.7 CC(CNC(N)=O)C(O)=O Amb18298054 [0,0,0,0,0,2|1,0,0]=3 3272 B9R0.7 CC(CSC(N)=S)C(O)=O Amb24509733 [0,0,0,0,0,2|1,1,0]=4 3273 B9R0.7 CC(N=CC(O)=O)C(O)=O Amb24446584 [0,0,0,0,0,2|0,0,0]=2 3274 B9R0.7 CC(NCC(=C)Br)C(O)=O Amb18303282 [0,0,0,0,0,2|2,0,0]=4 3275 B9R0.7 CC(NNC(N)=S)C(O)=O Amb25702740 [0,0,0,0,0,2|1,1,0]=4 3276 B9R0.7 CC(O)C(C)C#CC(O)=O Amb25310844 [0,0,0,0,0,2|1,0,1]=4 3277 B9R0.7 CC(O)C(C)OCC(O)=O Amb25185257 [0,0,0,0,0,2|1,0,1]=4 3278 B9R0.7 CC(O)CCC(C)C(O)=O Amb25848509 [0,0,0,0,0,2|1,0,1]=4 3279 B9R0.7 CC(O)CNC(C)C(O)=O Amb18523859 [0,0,0,0,0,2|1,0,1]=4 3280 B9R0.7 CC(O)CN[C@@H](C)C(O)=O Amb25129862 [0,0,0,0,0,2|1,0,1]=4 3281 B9R0.7 CC(O)COC(C)C(O)=O Amb25146942 [0,0,0,0,0,2|1,0,1]=4 3282 B9R0.7 CC(O)CSC(C)C(O)=O Amb18303285 [0,0,0,0,0,2|1,0,1]=4 3283 B9R0.7 CC(OCC(N)=O)C(N)=O Amb25727276 [0,0,0,0,0,2|2,0,0]=4 3284 B9R0.7 CC(OCC(N)=O)C(O)=O Amb24660109 [0,0,0,0,0,2|1,0,0]=3 3285 B9R0.7 CC(OCC(O)=O)C(O)=O Amb25292152 [0,0,0,0,0,2|0,0,0]=2 3286 B9R0.7 CC(ONC(N)=N)C(O)=O Amb25836833 [0,0,0,0,0,2|2,0,0]=4 3287 B9R0.7 CC(ONC(N)=O)C(N)=O Amb25845986 [0,0,0,0,0,2|2,0,0]=4 3288 B9R0.7 CC(SCC(=C)Br)C(O)=O Amb19005210 [0,0,0,0,0,2|2,0,0]=4 3289 B9R0.7 CC(\C=C\C(N)=O)C(O)=O Amb25174967 [0,0,0,0,0,2|1,0,0]=3 3290 B9R0.7 CC(\C=C\C(O)=O)C(O)=O Amb24409525 [0,0,0,0,0,2|0,0,0]=2 3291 B9R0.7 CN(CCC(O)=O)C(N)=O Amb18984979 [0,0,0,0,0,2|2,0,0]=4 3292 B9R0.7 CN(N=CC(O)=O)C(N)=O Amb25737345 [0,0,0,0,0,2|2,0,0]=4 3293 B9R0.7 CN(\C=C\C(O)=O)C(N)=O Amb25084386 [0,0,0,0,0,2|2,0,0]=4 3294 B9R0.7 C[C@@H](CCC(O)=O)C(O)=O Amb22799543 [0,0,0,0,0,2|0,0,0]=2 3295 B9R0.7 C[C@@H](CC[N+]([O-])=O)C(O)=O Amb24330210 [0,0,0,0,0,2|1,0,1]=4 3296 B9R0.7 C[C@@H](NCC(=C)Br)C(O)=O Amb24441867 [0,0,0,0,0,2|2,0,0]=4 3297 B9R0.7 C[C@@H](NCC(=C)Cl)C(O)=O Amb25085078 [0,0,0,0,0,2|2,0,0]=4 3298 B9R0.7 C[C@@H](NCC(N)=O)C(O)=O Amb25849548 [0,0,0,0,0,2|1,0,0]=3 3299 B9R0.7 C[C@@H](NCC(O)=O)C(O)=O Amb22748947 [0,0,0,0,0,2|0,0,0]=2 3300 B9R0.7 C[C@@H](O)[C@H](C)SCC(O)=O Amb25774489 [0,0,0,0,0,2|1,0,1]=4 3301 B9R0.7 C[C@@H](OCC(=C)Br)C(O)=O Amb25061755 [0,0,0,0,0,2|2,0,0]=4 3302 B9R0.7 C[C@@H](OCC(=C)Cl)C(O)=O Amb25146946 [0,0,0,0,0,2|2,0,0]=4 3303 B9R0.7 C[C@@H](SCC(O)=O)C(O)=O Amb24482305 [0,0,0,0,0,2|0,0,0]=2 3304 B9R0.7 C[C@H](CCC(O)=O)C(O)=O Amb22225175 [0,0,0,0,0,2|0,0,0]=2 3305 B9R0.7 C[C@H](NCC(=C)Cl)C(O)=O Amb25135747 [0,0,0,0,0,2|2,0,0]=4 3306 B9R0.7 C[C@H](NCC(N)=O)C(O)=O Amb24753576 [0,0,0,0,0,2|1,0,0]=3 3307 B9R0.7 C[C@H](NCC(O)=O)C(O)=O Amb25133540 [0,0,0,0,0,2|0,0,0]=2 3308 B9R0.7 C[C@H](O)CC[C@@H](C)C(O)=O Amb25378744 [0,0,0,0,0,2|1,0,1]=4 3309 B9R0.7 C[C@H](O)[C@H](C)CCC(O)=O Amb25340448 [0,0,0,0,0,2|1,0,1]=4 3310 B9R0.7 C[C@H](OCC(=C)Br)C(O)=O Amb24471685 [0,0,0,0,0,2|2,0,0]=4 3311 B9R0.7 C[C@H](OCC(=C)Cl)C(O)=O Amb25146948 [0,0,0,0,0,2|2,0,0]=4 3312 B9R0.7 C[C@H](OCC(O)=O)C(O)=O Amb24393806 [0,0,0,0,0,2|0,0,0]=2 3313 B9R0.7 C\C(\Cl)=C\CC(C)C(O)=O Amb18126350 [0,0,0,0,0,2|2,0,0]=4 3314 B9R0.7 N=C(CCC(O)=O)C(O)=O Amb25064299 [0,0,0,0,0,2|1,0,1]=4 3315 B9R0.7 NC(=O)C(N)CCC(O)=O Amb18644256 [0,0,0,0,0,2|2,0,0]=4 3316 B9R0.7 NC(=O)CCC(F)C(O)=O Amb24745286 [0,0,0,0,0,2|2,0,0]=4 3317 B9R0.7 NC(=O)CCC(O)C(O)=O Amb25275311 [0,0,0,0,0,2|2,0,0]=4 3318 B9R0.7 NC(=O)CC[13C@H](N)[13C](O)=O Amb22338972 [0,0,0,0,0,2|2,0,0]=4 3319 B9R0.7 NC(=O)CC[C@H](Br)C(O)=O Amb25223377 [0,0,0,0,0,2|2,0,0]=4 3320 B9R0.7 NC(=O)NCC(C(=O)O)F Amb17610485 [0,0,0,0,0,2|2,0,0]=4 3321 B9R0.7 NC(=O)NC[C@@H](C(=O)O)C Amb10844047 [0,0,0,0,0,2|1,0,0]=3 3322 B9R0.7 NC(=O)NC[C@@H](F)C(O)=O Amb24389552 [0,0,0,0,0,2|2,0,0]=4 3323 B9R0.7 NC(=O)NC[C@H](C(=O)O)N Amb10068479 [0,0,0,0,0,2|2,0,0]=4 3324 B9R0.7 NC(=O)N[13CH2][13CH]([13C](=O)O)F Amb17610486 [0,0,0,0,0,2|2,0,0]=4 3325 B9R0.7 NC(=O)SC[C@H](C(=O)O)N Amb10072293 [0,0,0,0,0,2|2,0,0]=4 3326 B9R0.7 NC(=O)SC[C@H](N)C(O)=O Amb22735296 [0,0,0,0,0,2|2,0,0]=4 3327 B9R0.7 NC(=O)[C@@H](N)CCC(O)=O Amb22745051 [0,0,0,0,0,2|2,0,0]=4 3328 B9R0.7 NC(=O)[C@H](N)CCC(O)=O Amb24557281 [0,0,0,0,0,2|2,0,0]=4 3329 B9R0.7 NC(=S)CSC(C(=O)O)C Amb17503393 [0,0,0,0,0,2|1,1,0]=4 3330 B9R0.7 NC(CCC(=O)Br)C(O)=O Amb25224344 [0,0,0,0,0,2|2,0,0]=4 3331 B9R0.7 NC(CCC(O)=O)C(=O)[Na] Amb24375221 [0,0,0,0,0,2|2,0,0]=4 3332 B9R0.7 NC(CCC(O)=O)C(O)=O Amb22350008 [0,0,0,0,0,2|1,0,0]=3 3333 B9R0.7 NC(CCC(O)=O)C(O)=O Amb22350165 [0,0,0,0,0,2|1,0,0]=3 3334 B9R0.7 NC(CCC(O)=O)P(O)=O Amb24340498 [0,0,0,0,0,2|2,0,0]=4 3335 B9R0.7 NC(CCC(O)=O)[13C](O)=O Amb22367384 [0,0,0,0,0,2|1,0,0]=3 3336 B9R0.7 NC(CCC(O)=S)C(O)=O Amb25039924 [0,0,0,0,0,2|1,1,0]=4 3337 B9R0.7 NC(CCP(O)=O)C(O)=O Amb25276313 [0,0,0,0,0,2|2,0,0]=4 3338 B9R0.7 NC(CCS(O)=O)C(O)=O Amb22349645 [0,0,0,0,0,2|2,0,0]=4 3339 B9R0.7 NC(CC[13C](O)=O)C(O)=O Amb22366853 [0,0,0,0,0,2|1,0,0]=3 3340 B9R0.7 N[13C](=O)CC[C@@H](C(=O)O)N Amb17614783 [0,0,0,0,0,2|2,0,0]=4 3341 B9R0.7 N[13C](=O)[13CH2][13CH2][13C@H](N)[13C](O)=O Amb22367371 [0,0,0,0,0,2|2,0,0]=4 3342 B9R0.7 N[C@@H](CCC(=O)Br)C(O)=O Amb25123825 [0,0,0,0,0,2|2,0,0]=4 3343 B9R0.7 N[C@@H](CCC(=O)Cl)C(O)=O Amb25065344 [0,0,0,0,0,2|2,0,0]=4 3344 B9R0.7 N[C@@H](CCC(O)=O)C([O-])=O Amb22745619 [0,0,0,0,0,2|1,0,1]=4 3345 B9R0.7 N[C@@H](CCC(O)=O)[13C](O)=O Amb22353662 [0,0,0,0,0,2|1,0,0]=3 3346 B9R0.7 N[C@@H](CCC(O)=S)C(O)=O Amb24480492 [0,0,0,0,0,2|1,1,0]=4 3347 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22338524 [0,0,0,0,0,2|1,0,1]=4 3348 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22350063 [0,0,0,0,0,2|1,0,1]=4 3349 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22800016 [0,0,0,0,0,2|1,0,1]=4 3350 B9R0.7 N[C@@H](CCC([O-])=O)C(O)=O Amb22801488 [0,0,0,0,0,2|1,0,1]=4 3351 B9R0.7 N[C@@H](CCP(O)=O)C(O)=O Amb22904307 [0,0,0,0,0,2|2,0,0]=4 3352 B9R0.7 N[C@@H]([13CH2]CC(O)=O)C(O)=O Amb22338711 [0,0,0,0,0,2|1,0,0]=3 3353 B9R0.7 N[C@H](CCS(O)=O)C(O)=O Amb24099404 [0,0,0,0,0,2|2,0,0]=4 3354 B9R0.7 OC(=O)C(=S)NCC(O)=O Amb24423880 [0,0,0,0,0,2|1,0,1]=4 3355 B9R0.7 OC(=O)C(Cl)SCC(O)=O Amb24390363 [0,0,0,0,0,2|1,0,0]=3 3356 B9R0.7 OC(=O)C(O)SCC(O)=O Amb24524554 [0,0,0,0,0,2|1,0,0]=3 3357 B9R0.7 OC(=O)C=C=C(C(=O)O)C Amb17593578 [0,0,0,0,0,2|0,0,1]=3 3358 B9R0.7 OC(=O)CCC(=O)C(=O)O Amb1154117 [0,0,0,0,0,2|1,0,1]=4 3359 B9R0.7 OC(=O)CCC(=O)C(O)=O Amb22349893 [0,0,0,0,0,2|1,0,1]=4 3360 B9R0.7 OC(=O)CCC(=O)C(O)=O Amb22350267 [0,0,0,0,0,2|1,0,1]=4 3361 B9R0.7 OC(=O)CCC(=O)C(O)=O Amb22746233 [0,0,0,0,0,2|1,0,1]=4 3362 B9R0.7 OC(=O)CCC(=O)[13C](O)=O Amb22055609 [0,0,0,0,0,2|1,0,1]=4 3363 B9R0.7 OC(=O)CCC(C(=O)O)Cl Amb17594149 [0,0,0,0,0,2|1,0,0]=3 3364 B9R0.7 OC(=O)CCC(C(=O)O)N Amb1778181 [0,0,0,0,0,2|1,0,0]=3 3365 B9R0.7 OC(=O)CCC(F)C(O)=O Amb25708515 [0,0,0,0,0,2|1,0,0]=3 3366 B9R0.7 OC(=O)CCC(O)C(O)=O Amb18124864 [0,0,0,0,0,2|1,0,0]=3 3367 B9R0.7 OC(=O)CC[C@@H](O)C(O)=O Amb22799690 [0,0,0,0,0,2|1,0,0]=3 3368 B9R0.7 OC(=O)CNC(=O)C(=O)O Amb2447304 [0,0,0,0,0,2|1,0,1]=4 3369 B9R0.7 OC(=O)CSC(C(=O)O)C Amb2431034 [0,0,0,0,0,2|0,0,0]=2 3370 B9R0.7 OC(=O)\C(\Br)=C/CC(O)=O Amb25364176 [0,0,0,0,0,2|1,0,1]=4 3371 B9R0.7 OC(=O)\C=C/C(O)C(O)=O Amb25757882 [0,0,0,0,0,2|1,0,0]=3 3372 B9R0.7 [15NH2]C(=O)CC[C@@H](C(=O)O)N Amb17614782 [0,0,0,0,0,2|2,0,0]=4 3373 B9R0.7 [15NH2]C(=O)CC[C@H]([15NH2])C(O)=O Amb22338766 [0,0,0,0,0,2|2,0,0]=4 3374 B9R0.7 [15NH2]C(CCC(O)=O)C(O)=O Amb22336520 [0,0,0,0,0,2|1,0,0]=3 3375 B9R0.7 [15NH2][13C@@H]([13CH2][13CH2][13C](O)=O)[13C](O)=O Amb22353585 [0,0,0,0,0,2|1,0,0]=3 3376 B9R0.7 [15NH2][13C](=O)[13CH2][13CH2][13C@H]([15NH2])[13C](O)=O Amb22353586 [0,0,0,0,0,2|2,0,0]=4 3377 B9R0.7 [O-][N+](=O)CC[C@H](C(=O)O)C Amb13883662 [0,0,0,0,0,2|1,0,1]=4 3378 B9R0.53 C=C(CC(O)=O)CC(O)=O Amb18644057 [0,0,0,0,0,2|0,0,2]=4 3379 B9R0.53 CC(=C)CC(C)CC(O)=O Amb18643943 [0,0,0,0,0,2|2,0,0]=4 3380 B9R0.53 CC(=CC(O)=O)NC(N)=O Amb25314556 [0,0,0,0,0,2|1,0,1]=4 3381 B9R0.53 CC(=O)CC(C)CC(O)=O Amb18644106 [0,0,0,0,0,2|1,0,0]=3 3382 B9R0.53 CC(=O)C[C@@H](CC(=O)O)C Amb10844399 [0,0,0,0,0,2|1,0,0]=3 3383 B9R0.53 CC(=O)C\C(\C)=C\C(O)=O Amb25833580 [0,0,0,0,0,2|1,0,1]=4 3384 B9R0.53 CC(=O)NC(C)CC(C)=O Amb24096345 [0,0,0,0,0,2|2,0,0]=4 3385 B9R0.53 CC(=O)NN(C)CC(O)=O Amb24430379 [0,0,0,0,0,2|2,0,0]=4 3386 B9R0.53 CC(=O)N[C@H](C)CC(C)=O Amb24478882 [0,0,0,0,0,2|2,0,0]=4 3387 B9R0.53 CC(=O)OC(C)CC(C)=O Amb25690313 [0,0,0,0,0,2|2,0,0]=4 3388 B9R0.53 CC(=O)OC(C)CC(O)=O Amb18644244 [0,0,0,0,0,2|1,0,0]=3 3389 B9R0.53 CC(=O)OC(C)NC(C)=O Amb25090413 [0,0,0,0,0,2|2,0,0]=4 3390 B9R0.53 CC(=O)O[C@H](C)CC(O)=O Amb25062672 [0,0,0,0,0,2|1,0,0]=3 3391 B9R0.53 CC(=O)\C=C(/C)\CC(O)=O Amb25838743 [0,0,0,0,0,2|1,0,1]=4 3392 B9R0.53 CC(=O)\C=C(\C)/CC(O)=O Amb24446679 [0,0,0,0,0,2|1,0,1]=4 3393 B9R0.53 CC(C)=CC(C)CC(O)=O Amb24480766 [0,0,0,0,0,2|2,0,0]=4 3394 B9R0.53 CC(CC(N)=O)NC(N)=O Amb25365692 [0,0,0,0,0,2|2,0,0]=4 3395 B9R0.53 CC(CC(O)=O)=CC(O)=O Amb24556420 [0,0,0,0,0,2|0,0,1]=3 3396 B9R0.53 CC(CC(O)=O)CC(N)=O Amb19034796 [0,0,0,0,0,2|1,0,0]=3 3397 B9R0.53 CC(CC(O)=O)C[N+]([O-])=O Amb25142280 [0,0,0,0,0,2|1,0,1]=4 3398 B9R0.53 CC(CC(O)=O)NC(N)=N Amb25696242 [0,0,0,0,0,2|2,0,0]=4 3399 B9R0.53 CC(CC(O)=O)NS(C)=O Amb25347318 [0,0,0,0,0,2|2,0,0]=4 3400 B9R0.53 CC(CC(O)=O)SC(N)=N Amb24429158 [0,0,0,0,0,2|2,0,0]=4 3401 B9R0.53 CC(CC(O)=O)SC(N)=S Amb24391550 [0,0,0,0,0,2|1,1,0]=4 3402 B9R0.53 CN(CC(=O)O)CC(=O)O Amb1156001 [0,0,0,0,0,2|1,0,0]=3 3403 B9R0.53 N=C(CC(O)=O)CC(O)=O Amb25703517 [0,0,0,0,0,2|1,0,1]=4 3404 B9R0.53 NC(=O)CC(O)CC(O)=O Amb25147276 [0,0,0,0,0,2|2,0,0]=4 3405 B9R0.53 NC(CC(=O)O)CC(=O)O Amb16184013 [0,0,0,0,0,2|1,0,0]=3 3406 B9R0.53 OC(=O)C=C(Br)CC(O)=O Amb24573499 [0,0,0,0,0,2|1,0,1]=4 3407 B9R0.53 OC(=O)CC(Cl)CC(O)=O Amb18126464 [0,0,0,0,0,2|1,0,0]=3 3408 B9R0.53 OC(=O)CN(Br)CC(O)=O Amb25277216 [0,0,0,0,0,2|2,0,0]=4 3409 B9R0.53 OC(=O)CN(Cl)CC(O)=O Amb24482142 [0,0,0,0,0,2|2,0,0]=4 3410 B9R0.53 OC(=O)C[C@@H](NC(=O)C)C Amb2372568 [0,0,0,0,0,2|1,0,0]=3 3411 B9R0.53 OC(=O)C[C@H](NC(=O)C)C Amb2372567 [0,0,0,0,0,2|1,0,0]=3 3412 B9R0.53 OC(=O)\C=C(/Br)\CC(O)=O Amb25123824 [0,0,0,0,0,2|1,0,1]=4 3413 B9R0.53 OC(CC(=O)O)CC(=O)O Amb17615401 [0,0,0,0,0,2|1,0,0]=3 3414 B9R0.53 ON(CC(O)=O)CC(O)=O Amb25062474 [0,0,0,0,0,2|2,0,0]=4 3415 B9R0.53 [NH3+]N(CC(O)=O)CC(O)=O Amb23453377 [0,0,0,0,0,2|2,0,0]=4 3416 B9R0.53 [NH3+]N(CC(O)=O)CC(O)=O Amb24121533 [0,0,0,0,0,2|2,0,0]=4