0 B6R0.3 C#CC(N)C(=O)O Amb28282694 [0,0,0,0,0,0|1,0,1]=2 1 B6R0.3 C#CC(O)C(=O)O Amb22731622 [0,0,0,0,0,0|2,0,1]=3 2 B6R0.3 C#CC(O)C(=O)[O-] Amb33189353 [0,0,0,0,0,0|2,0,2]=4 3 B6R0.3 C=C(Br)C(C)CC Amb22583745 [0,0,0,0,0,0|4,0,0]=4 4 B6R0.3 C=C(Br)C(C)CO Amb27757394 [0,0,0,0,0,0|3,0,0]=3 5 B6R0.3 C=C(C#N)C(=O)O Amb18638894 [0,0,0,0,0,0|2,0,2]=4 6 B6R0.3 C=C(C)C(Br)CO Amb25707965 [0,0,0,0,0,0|3,0,0]=3 7 B6R0.3 C=C(C)C(C)CBr Amb27844717 [0,0,0,0,0,0|4,0,0]=4 8 B6R0.3 C=C(C)C(C)CN Amb17593078 [0,0,0,0,0,0|4,0,0]=4 9 B6R0.3 C=C(C)C(C)CO Amb24539367 [0,0,0,0,0,0|3,0,0]=3 10 B6R0.3 C=C(C)C(Cl)CBr Amb27408616 [0,0,0,0,0,0|4,0,0]=4 11 B6R0.3 C=C(C)C(Cl)CC Amb27229374 [0,0,0,0,0,0|4,0,0]=4 12 B6R0.3 C=C(C)C(Cl)CO Amb27858700 [0,0,0,0,0,0|3,0,0]=3 13 B6R0.3 C=C(C)C(F)CN Amb27784739 [0,0,0,0,0,0|4,0,0]=4 14 B6R0.3 C=C(C)C(F)CO Amb28043434 [0,0,0,0,0,0|3,0,0]=3 15 B6R0.3 C=C(C)C(N)CO Amb26544297 [0,0,0,0,0,0|2,0,0]=2 16 B6R0.3 C=C(C)C(O)CBr Amb24739517 [0,0,0,0,0,0|4,0,0]=4 17 B6R0.3 C=C(C)C(O)CC Amb26365874 [0,0,0,0,0,0|4,0,0]=4 18 B6R0.3 C=C(C)C(O)CCl Amb24332083 [0,0,0,0,0,0|4,0,0]=4 19 B6R0.3 C=C(C)C(O)CF Amb33199537 [0,0,0,0,0,0|4,0,0]=4 20 B6R0.3 C=C(C)C(O)CI Amb27777240 [0,0,0,0,0,0|4,0,0]=4 21 B6R0.3 C=C(C)C(O)CN Amb27844577 [0,0,0,0,0,0|4,0,0]=4 22 B6R0.3 C=C(C)C(O)CO Amb23570510 [0,0,0,0,0,0|3,0,0]=3 23 B6R0.3 C=C(C)[C@@H](N)CO Amb25693320 [0,0,0,0,0,0|2,0,0]=2 24 B6R0.3 C=C(C)[C@@H](O)CN Amb33226186 [0,0,0,0,0,0|4,0,0]=4 25 B6R0.3 C=C(C)[C@H](C)CO Amb28350373 [0,0,0,0,0,0|3,0,0]=3 26 B6R0.3 C=C(C)[C@H](F)CO Amb27763892 [0,0,0,0,0,0|3,0,0]=3 27 B6R0.3 C=C(C)[C@H](N)CO Amb27174504 [0,0,0,0,0,0|2,0,0]=2 28 B6R0.3 C=C(C)[C@H](O)CN Amb33226204 [0,0,0,0,0,0|4,0,0]=4 29 B6R0.3 C=C(C)\C(N)=N\O Amb24386102 [0,0,0,0,0,0|3,0,1]=4 30 B6R0.3 C=C(CBr)C(=O)O Amb6296612 [0,0,0,0,0,0|2,0,1]=3 31 B6R0.3 C=C(CC)C(=O)Cl Amb22353554 [0,0,0,0,0,0|3,0,1]=4 32 B6R0.3 C=C(CC)C(=O)O Amb18639591 [0,0,0,0,0,0|2,0,1]=3 33 B6R0.3 C=C(CCl)C(=O)Cl Amb28340919 [0,0,0,0,0,0|3,0,1]=4 34 B6R0.3 C=C(CCl)C(=O)O Amb27851591 [0,0,0,0,0,0|2,0,1]=3 35 B6R0.3 C=C(CO)C(=O)O Amb18121817 [0,0,0,0,0,0|1,0,1]=2 36 B6R0.3 C=C(CO)C(C)=O Amb24571845 [0,0,0,0,0,0|2,0,1]=3 37 B6R0.3 C=C(CO)S(C)=O Amb27629340 [0,0,0,0,0,0|3,0,1]=4 38 B6R0.3 C=C(CS)C(=O)O Amb27263242 [0,0,0,0,0,0|1,1,1]=3 39 B6R0.3 C=C(Cl)C(Br)CO Amb27656944 [0,0,0,0,0,0|3,0,0]=3 40 B6R0.3 C=C(Cl)C(Cl)CCl Amb27960303 [0,0,0,0,0,0|4,0,0]=4 41 B6R0.3 C=C(I)C(C)CI Amb27858440 [0,0,0,0,0,0|4,0,0]=4 42 B6R0.3 C=C(I)[C@H](C)CI Amb27646087 [0,0,0,0,0,0|4,0,0]=4 43 B6R0.3 C=C(OC)C(=O)O Amb18639906 [0,0,0,0,0,0|3,0,1]=4 44 B6R0.3 C=C(SC)C(=O)O Amb27882690 [0,0,0,0,0,0|3,0,1]=4 45 B6R0.3 C=C(SS)C(=O)O Amb27593809 [0,0,0,0,0,0|2,1,1]=4 46 B6R0.3 C=C=C(C)C(=O)O Amb17593066 [0,0,0,0,0,0|2,0,2]=4 47 B6R0.3 C=CC(=C)C(=O)O Amb24394371 [0,0,0,0,0,0|2,0,2]=4 48 B6R0.3 C=CC(C)C(=O)O Amb21618706 [0,0,0,0,0,0|2,0,1]=3 49 B6R0.3 C=CC(C)C(N)=O Amb27167730 [0,0,0,0,0,0|3,0,1]=4 50 B6R0.3 C=CC(Cl)C(=O)O Amb27216715 [0,0,0,0,0,0|2,0,1]=3 51 B6R0.3 C=CC(N)C(=O)O Amb20240543 [0,0,0,0,0,0|1,0,1]=2 52 B6R0.3 C=CC(O)C(=O)O Amb24061247 [0,0,0,0,0,0|2,0,1]=3 53 B6R0.3 C=CC(O)C(C)=O Amb27838239 [0,0,0,0,0,0|3,0,1]=4 54 B6R0.3 C=CC(O)C(N)=O Amb27391902 [0,0,0,0,0,0|3,0,1]=4 55 B6R0.3 C=CC(S)C(=O)O Amb28069741 [0,0,0,0,0,0|2,0,1]=3 56 B6R0.3 C=C[C@@H](C)C(=O)O Amb26350417 [0,0,0,0,0,0|2,0,1]=3 57 B6R0.3 C=C[C@@H](N)C(=O)O Amb22756048 [0,0,0,0,0,0|1,0,1]=2 58 B6R0.3 C=C[C@@H](N)C(C)O Amb27213302 [0,0,0,0,0,0|2,0,2]=4 59 B6R0.3 C=C[C@H](C)C(=O)O Amb25929549 [0,0,0,0,0,0|2,0,1]=3 60 B6R0.3 C=C[C@H](N)C(=O)O Amb2699113 [0,0,0,0,0,0|1,0,1]=2 61 B6R0.3 C=C[C@H](O)C(N)=O Amb28282656 [0,0,0,0,0,0|3,0,1]=4 62 B6R0.3 CC(=O)C(=N)NO Amb27433735 [0,0,0,0,0,0|2,0,2]=4 63 B6R0.3 CC(=O)C(=O)CBr Amb17506257 [0,0,0,0,0,0|3,0,1]=4 64 B6R0.3 CC(=O)C(=O)CCl Amb17506258 [0,0,0,0,0,0|3,0,1]=4 65 B6R0.3 CC(=O)C(=O)NO Amb26477907 [0,0,0,0,0,0|3,0,1]=4 66 B6R0.3 CC(=O)C(Br)C=O Amb17232509 [0,0,0,0,0,0|2,0,2]=4 67 B6R0.3 CC(=O)C(Br)CBr Amb27597612 [0,0,0,0,0,0|3,0,0]=3 68 B6R0.3 CC(=O)C(C)C#N Amb8847377 [0,0,0,0,0,0|3,0,1]=4 69 B6R0.3 CC(=O)C(C)C=N Amb28199842 [0,0,0,0,0,0|3,0,1]=4 70 B6R0.3 CC(=O)C(C)C=O Amb18639572 [0,0,0,0,0,0|2,0,2]=4 71 B6R0.3 CC(=O)C(C)CCl Amb26477594 [0,0,0,0,0,0|3,0,0]=3 72 B6R0.3 CC(=O)C(C)CO Amb10844844 [0,0,0,0,0,0|2,0,0]=2 73 B6R0.3 CC(=O)C(Cl)C=O Amb28137911 [0,0,0,0,0,0|2,0,2]=4 74 B6R0.3 CC(=O)C(Cl)CCl Amb27257955 [0,0,0,0,0,0|3,0,0]=3 75 B6R0.3 CC(=O)C(O)CO Amb26463044 [0,0,0,0,0,0|2,0,0]=2 76 B6R0.3 CC(=O)C(S)C#N Amb28202178 [0,0,0,0,0,0|3,0,1]=4 77 B6R0.3 CC(=O)C([Na])C#N Amb25662498 [0,0,0,0,0,0|3,0,1]=4 78 B6R0.3 CC(=O)C([Na])CN Amb28423432 [0,0,0,0,0,0|3,0,0]=3 79 B6R0.3 CC(=O)N(C)CO Amb28191296 [0,0,0,0,0,0|3,0,0]=3 80 B6R0.3 CC(=O)N(N)C#N Amb10604135 [0,0,0,0,0,0|3,0,1]=4 81 B6R0.3 CC(=O)[C@@H](O)CO Amb24686516 [0,0,0,0,0,0|2,0,0]=2 82 B6R0.3 CC(=O)[C@H](N)CO Amb27451047 [0,0,0,0,0,0|1,0,0]=1 83 B6R0.3 CC(=O)\C(Br)=C\O Amb17232510 [0,0,0,0,0,0|2,0,2]=4 84 B6R0.3 CC(=O)\C(C)=N/O Amb9787796 [0,0,0,0,0,0|3,0,1]=4 85 B6R0.3 CC(=O)\C(C)=N\O Amb8389366 [0,0,0,0,0,0|3,0,1]=4 86 B6R0.3 CC(=O)\C(Cl)=C\O Amb27854622 [0,0,0,0,0,0|2,0,2]=4 87 B6R0.3 CC(Br)C(Br)CO Amb30621786 [0,0,0,0,0,0|3,0,1]=4 88 B6R0.3 CC(C#N)C(=O)O Amb17210512 [0,0,0,0,0,0|2,0,1]=3 89 B6R0.3 CC(C)=C(Br)CO Amb24370439 [0,0,0,0,0,0|3,0,1]=4 90 B6R0.3 CC(C)=C(C)CO Amb25107300 [0,0,0,0,0,0|3,0,1]=4 91 B6R0.3 CC(C)=C(F)CO Amb22546803 [0,0,0,0,0,0|3,0,1]=4 92 B6R0.3 CC(C)C(Br)CO Amb27776750 [0,0,0,0,0,0|3,0,1]=4 93 B6R0.3 CC(C)C(C)CO Amb26452810 [0,0,0,0,0,0|3,0,1]=4 94 B6R0.3 CC(C)C(N)CBr Amb27261624 [0,0,0,0,0,0|3,0,1]=4 95 B6R0.3 CC(C)C(N)CCl Amb27777259 [0,0,0,0,0,0|3,0,1]=4 96 B6R0.3 CC(C)C(N)CN Amb19283589 [0,0,0,0,0,0|3,0,1]=4 97 B6R0.3 CC(C)C(N)CN Amb9380667 [0,0,0,0,0,0|3,0,1]=4 98 B6R0.3 CC(C)C(N)CO Amb3939350 [0,0,0,0,0,0|2,0,1]=3 99 B6R0.3 CC(C)C(N)CS Amb28289530 [0,0,0,0,0,0|2,1,1]=4 100 B6R0.3 CC(C)C(O)CO Amb27148682 [0,0,0,0,0,0|3,0,1]=4 101 B6R0.3 CC(C)C(S)CO Amb25809908 [0,0,0,0,0,0|3,0,1]=4 102 B6R0.3 CC(C)[C@@H](C)CO Amb17613247 [0,0,0,0,0,0|3,0,1]=4 103 B6R0.3 CC(C)[C@@H](N)CCl Amb27626961 [0,0,0,0,0,0|3,0,1]=4 104 B6R0.3 CC(C)[C@@H](N)CF Amb33624251 [0,0,0,0,0,0|3,0,1]=4 105 B6R0.3 CC(C)[C@@H](N)CO Amb3939342 [0,0,0,0,0,0|2,0,1]=3 106 B6R0.3 CC(C)[C@H](Br)CO Amb27760382 [0,0,0,0,0,0|3,0,1]=4 107 B6R0.3 CC(C)[C@H](C)CO Amb24332267 [0,0,0,0,0,0|3,0,1]=4 108 B6R0.3 CC(C)[C@H](Cl)CO Amb27488685 [0,0,0,0,0,0|3,0,1]=4 109 B6R0.3 CC(C)[C@H](N)CO Amb2785298 [0,0,0,0,0,0|2,0,1]=3 110 B6R0.3 CC(C=O)C(=O)O Amb27784775 [0,0,0,0,0,0|1,0,2]=3 111 B6R0.3 CC(C=O)C(=O)[Na] Amb27439065 [0,0,0,0,0,0|2,0,2]=4 112 B6R0.3 CC(CBr)C(=O)O Amb22002601 [0,0,0,0,0,0|2,0,0]=2 113 B6R0.3 CC(CCl)C(=O)O Amb18522181 [0,0,0,0,0,0|2,0,0]=2 114 B6R0.3 CC(CCl)[N+](=O)[O-] Amb27655880 [0,0,0,0,0,0|3,0,1]=4 115 B6R0.3 CC(CF)C(=O)O Amb24432331 [0,0,0,0,0,0|2,0,0]=2 116 B6R0.3 CC(CN)C(=N)N Amb28282121 [0,0,0,0,0,0|4,0,0]=4 117 B6R0.3 CC(CN)C(=O)O Amb2699128 [0,0,0,0,0,0|2,0,0]=2 118 B6R0.3 CC(CN)C(=O)O Amb6773978 [0,0,0,0,0,0|2,0,0]=2 119 B6R0.3 CC(CN)C(=O)O Amb8631418 [0,0,0,0,0,0|2,0,0]=2 120 B6R0.3 CC(CN)S(C)=O Amb22157251 [0,0,0,0,0,0|4,0,0]=4 121 B6R0.3 CC(CO)=C(Cl)Cl Amb17593562 [0,0,0,0,0,0|3,0,1]=4 122 B6R0.3 CC(CO)C(=O)O Amb8011522 [0,0,0,0,0,0|1,0,0]=1 123 B6R0.3 CC(CO)C(Cl)Cl Amb27638067 [0,0,0,0,0,0|3,0,1]=4 124 B6R0.3 CC(CO)C(N)=S Amb8869143 [0,0,0,0,0,0|2,1,0]=3 125 B6R0.3 CC(CO)N(C)C Amb8467883 [0,0,0,0,0,0|4,0,0]=4 126 B6R0.3 CC(CO)N(C)N Amb27883234 [0,0,0,0,0,0|4,0,0]=4 127 B6R0.3 CC(CO)[N+](=O)[O-] Amb17600148 [0,0,0,0,0,0|2,0,1]=3 128 B6R0.3 CC(Cl)C(Cl)CO Amb28385636 [0,0,0,0,0,0|3,0,1]=4 129 B6R0.3 CC(Cl)C(O)CO Amb27858806 [0,0,0,0,0,0|3,0,1]=4 130 B6R0.3 CC(F)C(O)CO Amb28350261 [0,0,0,0,0,0|3,0,1]=4 131 B6R0.3 CC(N)C(C)CO Amb18122199 [0,0,0,0,0,0|3,0,1]=4 132 B6R0.3 CC(N)C(N)CO Amb27196655 [0,0,0,0,0,0|2,0,1]=3 133 B6R0.3 CC(N)C(O)CO Amb24583121 [0,0,0,0,0,0|3,0,1]=4 134 B6R0.3 CC(N=O)C(N)=O Amb26600137 [0,0,0,0,0,0|3,0,1]=4 135 B6R0.3 CC(NN)C(=O)O Amb18640367 [0,0,0,0,0,0|3,0,0]=3 136 B6R0.3 CC(O)C(Br)CO Amb28290500 [0,0,0,0,0,0|2,0,1]=3 137 B6R0.3 CC(O)C(C)CN Amb10068614 [0,0,0,0,0,0|3,0,1]=4 138 B6R0.3 CC(O)C(C)CO Amb4019853 [0,0,0,0,0,0|2,0,1]=3 139 B6R0.3 CC(O)C(C)CS Amb24334206 [0,0,0,0,0,0|2,1,1]=4 140 B6R0.3 CC(O)C(C)NO Amb27772254 [0,0,0,0,0,0|3,0,1]=4 141 B6R0.3 CC(O)C(N)C#N Amb27408643 [0,0,0,0,0,0|2,0,2]=4 142 B6R0.3 CC(O)C(N)CN Amb19328774 [0,0,0,0,0,0|2,0,1]=3 143 B6R0.3 CC(O)C(N)CN Amb22059292 [0,0,0,0,0,0|2,0,1]=3 144 B6R0.3 CC(O)C(N)CO Amb17593100 [0,0,0,0,0,0|1,0,1]=2 145 B6R0.3 CC(O)C(N)CO Amb32666361 [0,0,0,0,0,0|1,0,1]=2 146 B6R0.3 CC(O)C(O)CN Amb26871700 [0,0,0,0,0,0|3,0,1]=4 147 B6R0.3 CC(O)C(O)CO Amb22227692 [0,0,0,0,0,0|2,0,1]=3 148 B6R0.3 CC(O)[C@H](F)CN Amb27220559 [0,0,0,0,0,0|3,0,1]=4 149 B6R0.3 CC(O)[C@H](N)CO Amb28050579 [0,0,0,0,0,0|1,0,1]=2 150 B6R0.3 CC(O)\C(N)=N\O Amb8384662 [0,0,0,0,0,0|2,0,2]=4 151 B6R0.3 CC(ON)C(=O)O Amb33038242 [0,0,0,0,0,0|3,0,0]=3 152 B6R0.3 CC(ON)C(N)=O Amb28318742 [0,0,0,0,0,0|4,0,0]=4 153 B6R0.3 CC(S)C(C)CO Amb22641872 [0,0,0,0,0,0|2,1,1]=4 154 B6R0.3 CCC(=O)C(=O)Cl Amb27838251 [0,0,0,0,0,0|3,0,1]=4 155 B6R0.3 CCC(=O)C(=O)O Amb3940359 [0,0,0,0,0,0|2,0,1]=3 156 B6R0.3 CCC(=O)C(=O)[O-] Amb9825450 [0,0,0,0,0,0|2,0,2]=4 157 B6R0.3 CCC(=O)C(C)=O Amb8514604 [0,0,0,0,0,0|3,0,1]=4 158 B6R0.3 CCC(=O)C(N)=O Amb22011827 [0,0,0,0,0,0|3,0,1]=4 159 B6R0.3 CCC(=S)C(=O)O Amb27872099 [0,0,0,0,0,0|2,0,1]=3 160 B6R0.3 CCC(Br)C(=O)Br Amb22002455 [0,0,0,0,0,0|3,0,0]=3 161 B6R0.3 CCC(Br)C(=O)Cl Amb17666758 [0,0,0,0,0,0|3,0,0]=3 162 B6R0.3 CCC(Br)C(=O)O Amb5716858 [0,0,0,0,0,0|2,0,0]=2 163 B6R0.3 CCC(Br)C(C)=O Amb24615269 [0,0,0,0,0,0|3,0,0]=3 164 B6R0.3 CCC(Br)C(N)=O Amb13952819 [0,0,0,0,0,0|3,0,0]=3 165 B6R0.3 CCC(Br)[N+](=O)[O-] Amb17673702 [0,0,0,0,0,0|3,0,1]=4 166 B6R0.3 CCC(C)B(O)O Amb10071974 [0,0,0,0,0,0|3,0,1]=4 167 B6R0.3 CCC(C)C(=N)N Amb6740564 [0,0,0,0,0,0|4,0,0]=4 168 B6R0.3 CCC(C)C(=N)N Amb8630181 [0,0,0,0,0,0|4,0,0]=4 169 B6R0.3 CCC(C)C(=O)Cl Amb3939259 [0,0,0,0,0,0|3,0,0]=3 170 B6R0.3 CCC(C)C(=O)O Amb9703224 [0,0,0,0,0,0|2,0,0]=2 171 B6R0.3 CCC(C)C(C)=O Amb4605996 [0,0,0,0,0,0|3,0,0]=3 172 B6R0.3 CCC(C)C(C)O Amb8513435 [0,0,0,0,0,0|3,0,1]=4 173 B6R0.3 CCC(C)C(N)=O Amb33548100 [0,0,0,0,0,0|3,0,0]=3 174 B6R0.3 CCC(C)C(N)=S Amb6740516 [0,0,0,0,0,0|3,1,0]=4 175 B6R0.3 CCC(C)C(O)O Amb27826789 [0,0,0,0,0,0|2,0,2]=4 176 B6R0.3 CCC(C)S(=O)Cl Amb27841595 [0,0,0,0,0,0|4,0,0]=4 177 B6R0.3 CCC(C)S(=O)[O-] Amb19893328 [0,0,0,0,0,0|3,0,1]=4 178 B6R0.3 CCC(C)S(N)=O Amb32756501 [0,0,0,0,0,0|4,0,0]=4 179 B6R0.3 CCC(C)[C@@H](C)O Amb27946951 [0,0,0,0,0,0|3,0,1]=4 180 B6R0.3 CCC(C)[C@H](C)O Amb28281014 [0,0,0,0,0,0|3,0,1]=4 181 B6R0.3 CCC(C)[N+](=O)[O-] Amb4036169 [0,0,0,0,0,0|3,0,1]=4 182 B6R0.3 CCC(Cl)C(=O)Br Amb28384077 [0,0,0,0,0,0|3,0,0]=3 183 B6R0.3 CCC(Cl)C(=O)Cl Amb22045230 [0,0,0,0,0,0|3,0,0]=3 184 B6R0.3 CCC(Cl)C(=O)O Amb4017887 [0,0,0,0,0,0|2,0,0]=2 185 B6R0.3 CCC(Cl)C(C)=O Amb24078713 [0,0,0,0,0,0|3,0,0]=3 186 B6R0.3 CCC(Cl)C(N)=O Amb21618713 [0,0,0,0,0,0|3,0,0]=3 187 B6R0.3 CCC(Cl)C(O)O Amb27400305 [0,0,0,0,0,0|2,0,2]=4 188 B6R0.3 CCC(Cl)[N+](=O)[O-] Amb4016590 [0,0,0,0,0,0|3,0,1]=4 189 B6R0.3 CCC(F)C(=N)N Amb32456109 [0,0,0,0,0,0|4,0,0]=4 190 B6R0.3 CCC(F)C(=O)O Amb25716167 [0,0,0,0,0,0|2,0,0]=2 191 B6R0.3 CCC(N)B(O)O Amb28367684 [0,0,0,0,0,0|2,0,1]=3 192 B6R0.3 CCC(N)C(=O)Cl Amb17593240 [0,0,0,0,0,0|2,0,0]=2 193 B6R0.3 CCC(N)C(=O)O Amb9729506 [0,0,0,0,0,0|1,0,0]=1 194 B6R0.3 CCC(N)C(C)C Amb10610298 [0,0,0,0,0,0|3,0,1]=4 195 B6R0.3 CCC(N)C(C)C Amb9031905 [0,0,0,0,0,0|3,0,1]=4 196 B6R0.3 CCC(N)C(C)Cl Amb27409375 [0,0,0,0,0,0|3,0,1]=4 197 B6R0.3 CCC(N)C(C)O Amb32662794 [0,0,0,0,0,0|2,0,1]=3 198 B6R0.3 CCC(N)C(C)O Amb8855230 [0,0,0,0,0,0|2,0,1]=3 199 B6R0.3 CCC(N)C(C)S Amb32788301 [0,0,0,0,0,0|2,1,1]=4 200 B6R0.3 CCC(N)C(F)F Amb28050189 [0,0,0,0,0,0|3,0,1]=4 201 B6R0.3 CCC(N)C(F)F Amb32661586 [0,0,0,0,0,0|3,0,1]=4 202 B6R0.3 CCC(N)C(N)=O Amb1914080 [0,0,0,0,0,0|2,0,0]=2 203 B6R0.3 CCC(N)C(N)=O Amb33528521 [0,0,0,0,0,0|2,0,0]=2 204 B6R0.3 CCC(N)C(N)O Amb28348585 [0,0,0,0,0,0|2,0,1]=3 205 B6R0.3 CCC(N)N(C)C Amb24480382 [0,0,0,0,0,0|4,0,0]=4 206 B6R0.3 CCC(N)P(=O)=O Amb27786328 [0,0,0,0,0,0|2,0,1]=3 207 B6R0.3 CCC(O)C(=N)N Amb33321504 [0,0,0,0,0,0|4,0,0]=4 208 B6R0.3 CCC(O)C(=O)O Amb6609018 [0,0,0,0,0,0|2,0,0]=2 209 B6R0.3 CCC(O)C(=O)[O-] Amb17943026 [0,0,0,0,0,0|2,0,1]=3 210 B6R0.3 CCC(O)C(C)=O Amb25336501 [0,0,0,0,0,0|3,0,0]=3 211 B6R0.3 CCC(O)C(C)O Amb2227553 [0,0,0,0,0,0|3,0,1]=4 212 B6R0.3 CCC(O)C(N)=O Amb24116514 [0,0,0,0,0,0|3,0,0]=3 213 B6R0.3 CCC(O)C(N)=S Amb23449332 [0,0,0,0,0,0|3,1,0]=4 214 B6R0.3 CCC(O)S(=O)[O-] Amb27166943 [0,0,0,0,0,0|3,0,1]=4 215 B6R0.3 CCC(S)C(=O)O Amb17501370 [0,0,0,0,0,0|2,0,0]=2 216 B6R0.3 CCC(S)C(C)=O Amb8393170 [0,0,0,0,0,0|3,0,0]=3 217 B6R0.3 CCN(C)C(=O)Cl Amb8390927 [0,0,0,0,0,0|4,0,0]=4 218 B6R0.3 CCN(C)C(C)=O Amb22753516 [0,0,0,0,0,0|4,0,0]=4 219 B6R0.3 CCN(N)C(=N)N Amb28207703 [0,0,0,0,0,0|4,0,0]=4 220 B6R0.3 CCN(N)C(C)=O Amb18639976 [0,0,0,0,0,0|3,0,0]=3 221 B6R0.3 CCN(N)C(N)=O Amb28184355 [0,0,0,0,0,0|3,0,0]=3 222 B6R0.3 CCN(O)C(C)=O Amb27652499 [0,0,0,0,0,0|4,0,0]=4 223 B6R0.3 CC[C@@H](Br)C(=O)O Amb9785161 [0,0,0,0,0,0|2,0,0]=2 224 B6R0.3 CC[C@@H](C)B(O)O Amb27784066 [0,0,0,0,0,0|3,0,1]=4 225 B6R0.3 CC[C@@H](C)C(=O)O Amb8384578 [0,0,0,0,0,0|2,0,0]=2 226 B6R0.3 CC[C@@H](C)C(C)=O Amb28283799 [0,0,0,0,0,0|3,0,0]=3 227 B6R0.3 CC[C@@H](C)[C@@H](C)O Amb27448466 [0,0,0,0,0,0|3,0,1]=4 228 B6R0.3 CC[C@@H](Cl)C(=O)Cl Amb27985877 [0,0,0,0,0,0|3,0,0]=3 229 B6R0.3 CC[C@@H](Cl)C(=O)O Amb22800493 [0,0,0,0,0,0|2,0,0]=2 230 B6R0.3 CC[C@@H](Cl)C(N)=O Amb24579535 [0,0,0,0,0,0|3,0,0]=3 231 B6R0.3 CC[C@@H](N)C(=O)O Amb16233349 [0,0,0,0,0,0|1,0,0]=1 232 B6R0.3 CC[C@@H](N)C(=O)O Amb3940761 [0,0,0,0,0,0|1,0,0]=1 233 B6R0.3 CC[C@@H](N)C(C)=O Amb35594875 [0,0,0,0,0,0|2,0,0]=2 234 B6R0.3 CC[C@@H](N)C(C)C Amb24480517 [0,0,0,0,0,0|3,0,1]=4 235 B6R0.3 CC[C@@H](N)C(C)C Amb32665143 [0,0,0,0,0,0|3,0,1]=4 236 B6R0.3 CC[C@@H](N)C(C)O Amb28280672 [0,0,0,0,0,0|2,0,1]=3 237 B6R0.3 CC[C@@H](N)C(N)=O Amb22232290 [0,0,0,0,0,0|2,0,0]=2 238 B6R0.3 CC[C@@H](N)C(N)=O Amb22899979 [0,0,0,0,0,0|2,0,0]=2 239 B6R0.3 CC[C@@H](N)[C@@H](C)O Amb24117050 [0,0,0,0,0,0|2,0,1]=3 240 B6R0.3 CC[C@@H](O)C(=O)O Amb22369401 [0,0,0,0,0,0|2,0,0]=2 241 B6R0.3 CC[C@@H](O)C(N)=O Amb27792606 [0,0,0,0,0,0|3,0,0]=3 242 B6R0.3 CC[C@H](Br)C(=O)O Amb20242441 [0,0,0,0,0,0|2,0,0]=2 243 B6R0.3 CC[C@H](C)B(O)O Amb25746615 [0,0,0,0,0,0|3,0,1]=4 244 B6R0.3 CC[C@H](C)C(=O)Cl Amb26463969 [0,0,0,0,0,0|3,0,0]=3 245 B6R0.3 CC[C@H](C)C(=O)O Amb8514667 [0,0,0,0,0,0|2,0,0]=2 246 B6R0.3 CC[C@H](C)C(N)=O Amb27440802 [0,0,0,0,0,0|3,0,0]=3 247 B6R0.3 CC[C@H](Cl)C(=O)O Amb25190040 [0,0,0,0,0,0|2,0,0]=2 248 B6R0.3 CC[C@H](N)C(=O)O Amb2694208 [0,0,0,0,0,0|1,0,0]=1 249 B6R0.3 CC[C@H](N)C(=O)O Amb8631089 [0,0,0,0,0,0|1,0,0]=1 250 B6R0.3 CC[C@H](N)C(C)=O Amb29849605 [0,0,0,0,0,0|2,0,0]=2 251 B6R0.3 CC[C@H](N)C(C)C Amb27975596 [0,0,0,0,0,0|3,0,1]=4 252 B6R0.3 CC[C@H](N)C(C)C Amb31291137 [0,0,0,0,0,0|3,0,1]=4 253 B6R0.3 CC[C@H](N)C(F)F Amb28073533 [0,0,0,0,0,0|3,0,1]=4 254 B6R0.3 CC[C@H](N)C(N)=O Amb8387112 [0,0,0,0,0,0|2,0,0]=2 255 B6R0.3 CC[C@H](N)C(N)=O Amb8395789 [0,0,0,0,0,0|2,0,0]=2 256 B6R0.3 CC[C@H](N)[C@@H](C)O Amb24117049 [0,0,0,0,0,0|2,0,1]=3 257 B6R0.3 CC[C@H](O)C(=O)O Amb4166324 [0,0,0,0,0,0|2,0,0]=2 258 B6R0.3 CC[C@H](O)[C@@H](C)O Amb27972258 [0,0,0,0,0,0|3,0,1]=4 259 B6R0.3 CC[C@H](O)[C@H](C)O Amb27664238 [0,0,0,0,0,0|3,0,1]=4 260 B6R0.3 CC[C@H](S)C(=O)O Amb9785162 [0,0,0,0,0,0|2,0,0]=2 261 B6R0.3 CN(C)C(N)CO Amb28399614 [0,0,0,0,0,0|3,0,0]=3 262 B6R0.3 CN(CCl)C(=O)Cl Amb25076174 [0,0,0,0,0,0|4,0,0]=4 263 B6R0.3 CN(CO)C([O-])=S Amb27443577 [0,0,0,0,0,0|2,1,1]=4 264 B6R0.3 CN(CO)[N+](=O)[O-] Amb17618398 [0,0,0,0,0,0|3,0,1]=4 265 B6R0.3 CNC(=O)C(=O)O Amb2691295 [0,0,0,0,0,0|3,0,1]=4 266 B6R0.3 CNC(C)C(=O)O Amb19373699 [0,0,0,0,0,0|3,0,0]=3 267 B6R0.3 CNC(C)C(=O)O Amb9271766 [0,0,0,0,0,0|3,0,0]=3 268 B6R0.3 CNC(C)C(C)=O Amb24369529 [0,0,0,0,0,0|4,0,0]=4 269 B6R0.3 CNC(C)C(N)=O Amb33527202 [0,0,0,0,0,0|4,0,0]=4 270 B6R0.3 CNC(C)C(N)=O Amb7758120 [0,0,0,0,0,0|4,0,0]=4 271 B6R0.3 CNC(O)C(=O)O Amb27229907 [0,0,0,0,0,0|3,0,0]=3 272 B6R0.3 CN[C@@H](C)C(=O)O Amb16233347 [0,0,0,0,0,0|3,0,0]=3 273 B6R0.3 CN[C@@H](C)C(=O)O Amb16233348 [0,0,0,0,0,0|3,0,0]=3 274 B6R0.3 CN[C@@H](C)C(N)=O Amb22587575 [0,0,0,0,0,0|4,0,0]=4 275 B6R0.3 CN[C@@H](C)C(N)=O Amb23385296 [0,0,0,0,0,0|4,0,0]=4 276 B6R0.3 CN[C@H](C)C(=O)O Amb10844859 [0,0,0,0,0,0|3,0,0]=3 277 B6R0.3 CN[C@H](C)C(N)=O Amb22586632 [0,0,0,0,0,0|4,0,0]=4 278 B6R0.3 CN[C@H](C)C(N)=O Amb23385292 [0,0,0,0,0,0|4,0,0]=4 279 B6R0.3 COC(=O)C(=O)O Amb33545007 [0,0,0,0,0,0|3,0,1]=4 280 B6R0.3 COC(Br)C(=O)O Amb27439128 [0,0,0,0,0,0|3,0,0]=3 281 B6R0.3 COC(Br)C(C)=O Amb25360111 [0,0,0,0,0,0|4,0,0]=4 282 B6R0.3 COC(C)C(=O)Cl Amb26005661 [0,0,0,0,0,0|4,0,0]=4 283 B6R0.3 COC(C)C(=O)O Amb9729215 [0,0,0,0,0,0|3,0,0]=3 284 B6R0.3 COC(C)C(C)=O Amb9666021 [0,0,0,0,0,0|4,0,0]=4 285 B6R0.3 COC(C)C(N)=O Amb6541307 [0,0,0,0,0,0|4,0,0]=4 286 B6R0.3 COC(Cl)C(=O)O Amb28280799 [0,0,0,0,0,0|3,0,0]=3 287 B6R0.3 COC(Cl)C(C)=O Amb28118971 [0,0,0,0,0,0|4,0,0]=4 288 B6R0.3 COC(F)C(=O)O Amb27764863 [0,0,0,0,0,0|3,0,0]=3 289 B6R0.3 COC(F)C(=O)[O-] Amb33447021 [0,0,0,0,0,0|3,0,1]=4 290 B6R0.3 COC(O)C(C)=O Amb27954086 [0,0,0,0,0,0|4,0,0]=4 291 B6R0.3 CO[C@@H](C)C(=O)Cl Amb26562182 [0,0,0,0,0,0|4,0,0]=4 292 B6R0.3 CO[C@@H](C)C(=O)O Amb8515766 [0,0,0,0,0,0|3,0,0]=3 293 B6R0.3 CO[C@@H](C)C(N)=O Amb8515768 [0,0,0,0,0,0|4,0,0]=4 294 B6R0.3 CO[C@H](C)C(=O)Cl Amb27588755 [0,0,0,0,0,0|4,0,0]=4 295 B6R0.3 CO[C@H](C)C(=O)O Amb8515771 [0,0,0,0,0,0|3,0,0]=3 296 B6R0.3 CO[C@H](C)C(N)=O Amb17617080 [0,0,0,0,0,0|4,0,0]=4 297 B6R0.3 CSC(C)C(=O)O Amb6274567 [0,0,0,0,0,0|3,0,0]=3 298 B6R0.3 CSC(C)C(N)=O Amb28047863 [0,0,0,0,0,0|4,0,0]=4 299 B6R0.3 CSC(Cl)C(=O)Cl Amb27392297 [0,0,0,0,0,0|4,0,0]=4 300 B6R0.3 CSC(N)C(=O)O Amb28383509 [0,0,0,0,0,0|2,0,0]=2 301 B6R0.3 CS[C@H](C)C(=O)O Amb26611205 [0,0,0,0,0,0|3,0,0]=3 302 B6R0.3 C[C@@H](CF)C(=O)O Amb33743265 [0,0,0,0,0,0|2,0,0]=2 303 B6R0.3 C[C@@H](CI)C(=O)O Amb28322539 [0,0,0,0,0,0|2,0,0]=2 304 B6R0.3 C[C@@H](CN)C(=O)O Amb22756746 [0,0,0,0,0,0|2,0,0]=2 305 B6R0.3 C[C@@H](CN)C(=O)O Amb6600138 [0,0,0,0,0,0|2,0,0]=2 306 B6R0.3 C[C@@H](CO)C(=O)O Amb10844567 [0,0,0,0,0,0|1,0,0]=1 307 B6R0.3 C[C@@H](CO)C(N)=O Amb27254152 [0,0,0,0,0,0|2,0,0]=2 308 B6R0.3 C[C@@H](CO)N(C)C Amb25373937 [0,0,0,0,0,0|4,0,0]=4 309 B6R0.3 C[C@@H](Cl)[C@H](O)CO Amb28137873 [0,0,0,0,0,0|3,0,1]=4 310 B6R0.3 C[C@@H](O)C(O)CN Amb28050484 [0,0,0,0,0,0|3,0,1]=4 311 B6R0.3 C[C@@H](O)[C@@H](N)CO Amb4493367 [0,0,0,0,0,0|1,0,1]=2 312 B6R0.3 C[C@@H](O)[C@@H](O)CO Amb28319973 [0,0,0,0,0,0|2,0,1]=3 313 B6R0.3 C[C@@H](O)[C@H](Br)CO Amb27955199 [0,0,0,0,0,0|2,0,1]=3 314 B6R0.3 C[C@@H](O)[C@H](N)C=O Amb27657440 [0,0,0,0,0,0|1,0,3]=4 315 B6R0.3 C[C@@H](O)[C@H](N)CN Amb19374892 [0,0,0,0,0,0|2,0,1]=3 316 B6R0.3 C[C@@H](O)[C@H](N)CO Amb32661654 [0,0,0,0,0,0|1,0,1]=2 317 B6R0.3 C[C@@H](O)[C@H](N)CO Amb4489737 [0,0,0,0,0,0|1,0,1]=2 318 B6R0.3 C[C@@H](ON)C(=O)O Amb27169414 [0,0,0,0,0,0|3,0,0]=3 319 B6R0.3 C[C@@H](ON)C(=O)O Amb33620846 [0,0,0,0,0,0|3,0,0]=3 320 B6R0.3 C[C@H](CBr)C(=O)O Amb27975404 [0,0,0,0,0,0|2,0,0]=2 321 B6R0.3 C[C@H](CCl)C(=O)Cl Amb22225324 [0,0,0,0,0,0|3,0,0]=3 322 B6R0.3 C[C@H](CF)C(=O)O Amb33727262 [0,0,0,0,0,0|2,0,0]=2 323 B6R0.3 C[C@H](CN)C(=O)O Amb10844022 [0,0,0,0,0,0|2,0,0]=2 324 B6R0.3 C[C@H](CN)C(=O)O Amb24117452 [0,0,0,0,0,0|2,0,0]=2 325 B6R0.3 C[C@H](CO)C(=O)O Amb10844554 [0,0,0,0,0,0|1,0,0]=1 326 B6R0.3 C[C@H](CO)N(C)C Amb27168734 [0,0,0,0,0,0|4,0,0]=4 327 B6R0.3 C[C@H](Cl)[C@H](O)CO Amb28458286 [0,0,0,0,0,0|3,0,1]=4 328 B6R0.3 C[C@H](NBr)C(=O)O Amb28050211 [0,0,0,0,0,0|3,0,0]=3 329 B6R0.3 C[C@H](NN)C(=O)O Amb28247936 [0,0,0,0,0,0|3,0,0]=3 330 B6R0.3 C[C@H](O)C(=O)CO Amb27838238 [0,0,0,0,0,0|2,0,2]=4 331 B6R0.3 C[C@H](O)[C@@H](N)CO Amb8516107 [0,0,0,0,0,0|1,0,1]=2 332 B6R0.3 C[C@H](O)[C@H](N)CO Amb24479858 [0,0,0,0,0,0|1,0,1]=2 333 B6R0.3 C[C@H](ON)C(=O)O Amb25853808 [0,0,0,0,0,0|3,0,0]=3 334 B6R0.3 C[C@H](ON)C(=O)O Amb33620847 [0,0,0,0,0,0|3,0,0]=3 335 B6R0.3 C\C(=C/Br)C(=O)O Amb4014496 [0,0,0,0,0,0|2,0,2]=4 336 B6R0.3 C\C(=C/F)C(=O)O Amb27469080 [0,0,0,0,0,0|2,0,2]=4 337 B6R0.3 C\C(=C/I)C(=O)O Amb27838211 [0,0,0,0,0,0|2,0,2]=4 338 B6R0.3 C\C(=N/O)C(=O)O Amb28187271 [0,0,0,0,0,0|2,0,1]=3 339 B6R0.3 C\C(Br)=C(\C)CO Amb28319890 [0,0,0,0,0,0|3,0,1]=4 340 B6R0.3 C\C(Br)=C(\F)CO Amb27423329 [0,0,0,0,0,0|3,0,1]=4 341 B6R0.3 C\C(Cl)=C(\C)CO Amb27638176 [0,0,0,0,0,0|3,0,1]=4 342 B6R0.3 C\C=C(/Br)C(=O)O Amb18646193 [0,0,0,0,0,0|2,0,2]=4 343 B6R0.3 C\C=C(/C)C(=O)O Amb33723768 [0,0,0,0,0,0|2,0,2]=4 344 B6R0.3 C\C=C(/F)C(=O)O Amb32663762 [0,0,0,0,0,0|2,0,2]=4 345 B6R0.3 C\C=C(/O)C(=O)O Amb22727962 [0,0,0,0,0,0|2,0,2]=4 346 B6R0.3 C\C=C(\Br)C(=O)O Amb4014486 [0,0,0,0,0,0|2,0,2]=4 347 B6R0.3 C\C=C(\C)C(=O)O Amb3445181 [0,0,0,0,0,0|2,0,2]=4 348 B6R0.3 C\C=C(\Cl)C(=O)O Amb28073985 [0,0,0,0,0,0|2,0,2]=4 349 B6R0.3 C\C=C(\I)C(=O)O Amb27841305 [0,0,0,0,0,0|2,0,2]=4 350 B6R0.3 N#CC(Br)C(N)=O Amb9201659 [0,0,0,0,0,0|3,0,1]=4 351 B6R0.3 N#CC(I)C(N)=O Amb27838205 [0,0,0,0,0,0|3,0,1]=4 352 B6R0.3 N#CC(N)C(=O)O Amb25328320 [0,0,0,0,0,0|1,0,1]=2 353 B6R0.3 N#CC(N)C(N)=O Amb33544806 [0,0,0,0,0,0|2,0,1]=3 354 B6R0.3 N#CC(O)C(=O)O Amb27467286 [0,0,0,0,0,0|2,0,1]=3 355 B6R0.3 N#CC([Na])C(N)=O Amb27596629 [0,0,0,0,0,0|3,0,1]=4 356 B6R0.3 NC(=O)C(Br)CBr Amb8390579 [0,0,0,0,0,0|3,0,0]=3 357 B6R0.3 NC(=O)C(Cl)CCl Amb22228204 [0,0,0,0,0,0|3,0,0]=3 358 B6R0.3 NC(=O)C(N)=S=O Amb28314240 [0,0,0,0,0,0|2,0,2]=4 359 B6R0.3 NC(=O)C(N)CO Amb17593097 [0,0,0,0,0,0|1,0,0]=1 360 B6R0.3 NC(=O)C(N)CO Amb2720301 [0,0,0,0,0,0|1,0,0]=1 361 B6R0.3 NC(=O)C(N)CS Amb18641990 [0,0,0,0,0,0|1,1,0]=2 362 B6R0.3 NC(=O)C(N)CS Amb33330875 [0,0,0,0,0,0|1,1,0]=2 363 B6R0.3 NC(=O)C(O)CO Amb27169520 [0,0,0,0,0,0|2,0,0]=2 364 B6R0.3 NC(=O)N(S)CO Amb27249862 [0,0,0,0,0,0|3,0,0]=3 365 B6R0.3 NC(=O)[C@@H](N)CO Amb6336612 [0,0,0,0,0,0|1,0,0]=1 366 B6R0.3 NC(=O)[C@@H](N)CO Amb8387630 [0,0,0,0,0,0|1,0,0]=1 367 B6R0.3 NC(=O)[C@@H](N)CS Amb23437751 [0,0,0,0,0,0|1,1,0]=2 368 B6R0.3 NC(=O)[C@@H](O)CO Amb27816733 [0,0,0,0,0,0|2,0,0]=2 369 B6R0.3 NC(=O)[C@H](N)CO Amb22886957 [0,0,0,0,0,0|1,0,0]=1 370 B6R0.3 NC(=O)[C@H](N)CO Amb26505098 [0,0,0,0,0,0|1,0,0]=1 371 B6R0.3 NC(=O)\C(N)=N\O Amb16186552 [0,0,0,0,0,0|2,0,1]=3 372 B6R0.3 NC(=S)\C(N)=N\O Amb9682648 [0,0,0,0,0,0|2,1,1]=4 373 B6R0.3 NC(CCl)C(=O)O Amb19651457 [0,0,0,0,0,0|1,0,0]=1 374 B6R0.3 NC(CCl)C(=O)O Amb21961077 [0,0,0,0,0,0|1,0,0]=1 375 B6R0.3 NC(CF)C(=O)O Amb10839589 [0,0,0,0,0,0|1,0,0]=1 376 B6R0.3 NC(CF)C(F)F Amb26906607 [0,0,0,0,0,0|3,0,1]=4 377 B6R0.3 NC(CO)C(=O)O Amb9702805 [0,0,0,0,0,0|0,0,0]=0 378 B6R0.3 NC(CO)C(F)F Amb27250856 [0,0,0,0,0,0|2,0,1]=3 379 B6R0.3 NC(CO)P(O)O Amb27953933 [0,0,0,0,0,0|1,0,1]=2 380 B6R0.3 NC(CP)C(=O)O Amb27234251 [0,0,0,0,0,0|1,0,0]=1 381 B6R0.3 NC(CS)C(=O)Cl Amb28050358 [0,0,0,0,0,0|1,1,0]=2 382 B6R0.3 NC(CS)C(=O)O Amb13961966 [0,0,0,0,0,0|0,1,0]=1 383 B6R0.3 NC(CS)C(=O)O Amb22489523 [0,0,0,0,0,0|0,1,0]=1 384 B6R0.3 NC(CS)C(=O)O Amb6537913 [0,0,0,0,0,0|0,1,0]=1 385 B6R0.3 NC(CS)C(=O)O Amb6537914 [0,0,0,0,0,0|0,1,0]=1 386 B6R0.3 NC(CS)C(=O)S Amb27838279 [0,0,0,0,0,0|0,2,0]=2 387 B6R0.3 NC(CS)S(=O)O Amb27238568 [0,0,0,0,0,0|1,1,0]=2 388 B6R0.3 NC(C[NH3+])C(=O)O Amb4004471 [0,0,0,0,0,0|1,0,0]=1 389 B6R0.3 NCC(Br)C(=O)O Amb28385732 [0,0,0,0,0,0|2,0,0]=2 390 B6R0.3 NCC(Cl)C(=O)O Amb17593263 [0,0,0,0,0,0|2,0,0]=2 391 B6R0.3 NCC(F)C(=O)O Amb22733051 [0,0,0,0,0,0|2,0,0]=2 392 B6R0.3 NCC(F)C(=O)O Amb2688010 [0,0,0,0,0,0|2,0,0]=2 393 B6R0.3 NCC(F)C(N)=O Amb26984913 [0,0,0,0,0,0|3,0,0]=3 394 B6R0.3 NCC(F)C(N)=O Amb32667436 [0,0,0,0,0,0|3,0,0]=3 395 B6R0.3 NCC(N)C(=O)O Amb22899095 [0,0,0,0,0,0|1,0,0]=1 396 B6R0.3 NCC(N)C(=O)O Amb2697095 [0,0,0,0,0,0|1,0,0]=1 397 B6R0.3 NCC(N)C(=O)O Amb8514284 [0,0,0,0,0,0|1,0,0]=1 398 B6R0.3 NCC(N)C(F)F Amb27844558 [0,0,0,0,0,0|3,0,1]=4 399 B6R0.3 NCC(O)C(=O)O Amb8517492 [0,0,0,0,0,0|2,0,0]=2 400 B6R0.3 NCC(O)C(N)=O Amb27164291 [0,0,0,0,0,0|3,0,0]=3 401 B6R0.3 NCC(O)C(N)=O Amb28827639 [0,0,0,0,0,0|3,0,0]=3 402 B6R0.3 NCC(S)C(=O)O Amb17593238 [0,0,0,0,0,0|2,0,0]=2 403 B6R0.3 NC[C@@H](F)C(=O)O Amb25824168 [0,0,0,0,0,0|2,0,0]=2 404 B6R0.3 NC[C@@H](F)C(=O)O Amb31291438 [0,0,0,0,0,0|2,0,0]=2 405 B6R0.3 NC[C@@H](N)C(=O)O Amb22745957 [0,0,0,0,0,0|1,0,0]=1 406 B6R0.3 NC[C@@H](N)C(=O)O Amb8515776 [0,0,0,0,0,0|1,0,0]=1 407 B6R0.3 NC[C@@H](N)C(N)=O Amb27981260 [0,0,0,0,0,0|2,0,0]=2 408 B6R0.3 NC[C@@H](O)C(=O)O Amb22169412 [0,0,0,0,0,0|2,0,0]=2 409 B6R0.3 NC[C@@H](O)C(N)=O Amb28282144 [0,0,0,0,0,0|3,0,0]=3 410 B6R0.3 NC[C@H](F)C(=O)O Amb27254153 [0,0,0,0,0,0|2,0,0]=2 411 B6R0.3 NC[C@H](F)C(=O)O Amb31291433 [0,0,0,0,0,0|2,0,0]=2 412 B6R0.3 NC[C@H](N)C(=O)O Amb16183820 [0,0,0,0,0,0|1,0,0]=1 413 B6R0.3 NC[C@H](N)C(=O)O Amb33842544 [0,0,0,0,0,0|1,0,0]=1 414 B6R0.3 NC[C@H](N)C(=O)O Amb8515775 [0,0,0,0,0,0|1,0,0]=1 415 B6R0.3 NC[C@H](O)C(=O)O Amb4166313 [0,0,0,0,0,0|2,0,0]=2 416 B6R0.3 NC[C@H](O)C(N)=O Amb32645211 [0,0,0,0,0,0|3,0,0]=3 417 B6R0.3 NS(=O)C(Cl)CCl Amb32720412 [0,0,0,0,0,0|4,0,0]=4 418 B6R0.3 N[C@@H](C=S)C(=O)O Amb27838199 [0,0,0,0,0,0|0,1,1]=2 419 B6R0.3 N[C@@H](CBr)C(=O)O Amb27188433 [0,0,0,0,0,0|1,0,0]=1 420 B6R0.3 N[C@@H](CCl)C(=O)O Amb22232860 [0,0,0,0,0,0|1,0,0]=1 421 B6R0.3 N[C@@H](CCl)C(=O)O Amb8515277 [0,0,0,0,0,0|1,0,0]=1 422 B6R0.3 N[C@@H](CO)C(=O)O Amb22351170 [0,0,0,0,0,0|0,0,0]=0 423 B6R0.3 N[C@@H](CO)C(=O)O Amb8387621 [0,0,0,0,0,0|0,0,0]=0 424 B6R0.3 N[C@@H](CO)C(F)F Amb27202123 [0,0,0,0,0,0|2,0,1]=3 425 B6R0.3 N[C@@H](CS)C(=O)O Amb3940755 [0,0,0,0,0,0|0,1,0]=1 426 B6R0.3 N[C@@H](CS)C(=O)O Amb8385453 [0,0,0,0,0,0|0,1,0]=1 427 B6R0.3 N[C@@H](CS)C(=O)O Amb9826090 [0,0,0,0,0,0|0,1,0]=1 428 B6R0.3 N[C@@H](CS)S(=O)O Amb27391675 [0,0,0,0,0,0|1,1,0]=2 429 B6R0.3 N[C@@H](C[SeH])C(=O)O Amb31031035 [0,0,0,0,0,0|0,1,0]=1 430 B6R0.3 N[C@H](CCl)C(=O)Cl Amb28143184 [0,0,0,0,0,0|2,0,0]=2 431 B6R0.3 N[C@H](CCl)C(=O)O Amb2699111 [0,0,0,0,0,0|1,0,0]=1 432 B6R0.3 N[C@H](CCl)C(=O)O Amb9813688 [0,0,0,0,0,0|1,0,0]=1 433 B6R0.3 N[C@H](CO)C(=O)Cl Amb28058341 [0,0,0,0,0,0|1,0,0]=1 434 B6R0.3 N[C@H](CO)C(=O)O Amb2690463 [0,0,0,0,0,0|0,0,0]=0 435 B6R0.3 N[C@H](CO)C(F)F Amb33337773 [0,0,0,0,0,0|2,0,1]=3 436 B6R0.3 N[C@H](CS)C(=O)Cl Amb27166396 [0,0,0,0,0,0|1,1,0]=2 437 B6R0.3 N[C@H](CS)C(=O)O Amb17942912 [0,0,0,0,0,0|0,1,0]=1 438 B6R0.3 N[C@H](CS)C(=O)O Amb8394603 [0,0,0,0,0,0|0,1,0]=1 439 B6R0.3 N[C@H](CS)C(=O)O Amb8628479 [0,0,0,0,0,0|0,1,0]=1 440 B6R0.3 N\C(=N/O)C(=O)O Amb24670890 [0,0,0,0,0,0|1,0,1]=2 441 B6R0.3 N\C(O)=C(\N)N=O Amb27844571 [0,0,0,0,0,0|2,0,2]=4 442 B6R0.3 O=C(Cl)C(Br)CBr Amb3940235 [0,0,0,0,0,0|3,0,0]=3 443 B6R0.3 O=C(Cl)C(Br)CCl Amb28198806 [0,0,0,0,0,0|3,0,0]=3 444 B6R0.3 O=C(Cl)C(Br)CF Amb28129447 [0,0,0,0,0,0|3,0,0]=3 445 B6R0.3 O=C(Cl)C(Cl)CCl Amb3940236 [0,0,0,0,0,0|3,0,0]=3 446 B6R0.3 O=C(O)C(=O)CBr Amb10068671 [0,0,0,0,0,0|2,0,1]=3 447 B6R0.3 O=C(O)C(=O)CBr Amb8389349 [0,0,0,0,0,0|2,0,1]=3 448 B6R0.3 O=C(O)C(=O)CCl Amb16233358 [0,0,0,0,0,0|2,0,1]=3 449 B6R0.3 O=C(O)C(=O)CI Amb27659477 [0,0,0,0,0,0|2,0,1]=3 450 B6R0.3 O=C(O)C(=O)CO Amb6600025 [0,0,0,0,0,0|1,0,1]=2 451 B6R0.3 O=C(O)C(=O)CS Amb6600041 [0,0,0,0,0,0|1,1,1]=3 452 B6R0.3 O=C(O)C(=O)NI Amb27643666 [0,0,0,0,0,0|3,0,1]=4 453 B6R0.3 O=C(O)C(=S)NS Amb27469030 [0,0,0,0,0,0|2,1,1]=4 454 B6R0.3 O=C(O)C(Br)CBr Amb8513574 [0,0,0,0,0,0|2,0,0]=2 455 B6R0.3 O=C(O)C(Br)CF Amb10605519 [0,0,0,0,0,0|2,0,0]=2 456 B6R0.3 O=C(O)C(Br)CO Amb18126327 [0,0,0,0,0,0|1,0,0]=1 457 B6R0.3 O=C(O)C(Cl)CCl Amb22228245 [0,0,0,0,0,0|2,0,0]=2 458 B6R0.3 O=C(O)C(Cl)CO Amb18124304 [0,0,0,0,0,0|1,0,0]=1 459 B6R0.3 O=C(O)C(Cl)CS Amb18643661 [0,0,0,0,0,0|1,1,0]=2 460 B6R0.3 O=C(O)C(F)CO Amb17593117 [0,0,0,0,0,0|1,0,0]=1 461 B6R0.3 O=C(O)C(O)CBr Amb24061932 [0,0,0,0,0,0|2,0,0]=2 462 B6R0.3 O=C(O)C(O)CCl Amb6371692 [0,0,0,0,0,0|2,0,0]=2 463 B6R0.3 O=C(O)C(O)CF Amb27476477 [0,0,0,0,0,0|2,0,0]=2 464 B6R0.3 O=C(O)C(O)CO Amb17593103 [0,0,0,0,0,0|1,0,0]=1 465 B6R0.3 O=C(O)C(O)CS Amb18642053 [0,0,0,0,0,0|1,1,0]=2 466 B6R0.3 O=C(O)C(S)CS Amb18643295 [0,0,0,0,0,0|1,1,0]=2 467 B6R0.3 O=C(O)[C@@H](Br)CO Amb10601700 [0,0,0,0,0,0|1,0,0]=1 468 B6R0.3 O=C(O)[C@@H](Cl)CO Amb27968485 [0,0,0,0,0,0|1,0,0]=1 469 B6R0.3 O=C(O)[C@@H](O)CBr Amb27858794 [0,0,0,0,0,0|2,0,0]=2 470 B6R0.3 O=C(O)[C@@H](O)CCl Amb22225325 [0,0,0,0,0,0|2,0,0]=2 471 B6R0.3 O=C(O)[C@@H](O)CF Amb24117272 [0,0,0,0,0,0|2,0,0]=2 472 B6R0.3 O=C(O)[C@@H](O)CO Amb22226732 [0,0,0,0,0,0|1,0,0]=1 473 B6R0.3 O=C(O)[C@H](Cl)CO Amb27759746 [0,0,0,0,0,0|1,0,0]=1 474 B6R0.3 O=C(O)[C@H](O)CBr Amb28137021 [0,0,0,0,0,0|2,0,0]=2 475 B6R0.3 O=C(O)[C@H](O)CF Amb27467272 [0,0,0,0,0,0|2,0,0]=2 476 B6R0.3 O=C(O)[C@H](O)CO Amb4166319 [0,0,0,0,0,0|1,0,0]=1 477 B6R0.3 O=C(O)\C(Br)=N\O Amb26949828 [0,0,0,0,0,0|2,0,1]=3 478 B6R0.3 O=C(O)\C(Cl)=C/Cl Amb17593560 [0,0,0,0,0,0|2,0,2]=4 479 B6R0.3 O=C(O)\C(Cl)=C/O Amb24479774 [0,0,0,0,0,0|1,0,2]=3 480 B6R0.3 O=C(O)\C(Cl)=C\Cl Amb32409784 [0,0,0,0,0,0|2,0,2]=4 481 B6R0.3 O=C(O)\C(Cl)=N\O Amb25839923 [0,0,0,0,0,0|2,0,1]=3 482 B6R0.3 O=C(O)\C(O)=C/O Amb27220871 [0,0,0,0,0,0|1,0,2]=3 483 B6R0.3 O=C([O-])C(=O)CF Amb10839900 [0,0,0,0,0,0|2,0,2]=4 484 B6R0.3 O=C([O-])C(=O)CS Amb22547761 [0,0,0,0,0,0|1,1,2]=4 485 B6R0.3 O=C([O-])C(=O)CS Amb9825929 [0,0,0,0,0,0|1,1,2]=4 486 B6R0.3 O=CC(Br)C(=O)O Amb27793774 [0,0,0,0,0,0|1,0,2]=3 487 B6R0.3 O=CC(F)C(=O)O Amb22055301 [0,0,0,0,0,0|1,0,2]=3 488 B6R0.3 O=C[C@@H](O)C(=O)O Amb27629391 [0,0,0,0,0,0|1,0,2]=3 489 B6R0.3 O=S(Cl)C(Cl)CCl Amb32720401 [0,0,0,0,0,0|4,0,0]=4 490 B6R0.3 O=S([O-])C(Cl)CCl Amb32755557 [0,0,0,0,0,0|3,0,1]=4 491 B6R0.3 O=[N+]([O-])C(Br)CO Amb24479795 [0,0,0,0,0,0|2,0,1]=3 492 B6R0.3 OCC(Cl)=C(Cl)Cl Amb27482147 [0,0,0,0,0,0|3,0,1]=4 493 B6R0.3 OCC(Cl)C(F)F Amb27760423 [0,0,0,0,0,0|3,0,1]=4 494 B6R0.3 OCC(F)=C(F)F Amb24507487 [0,0,0,0,0,0|3,0,1]=4 495 B6R0.3 OC[C@@H](O)C(Cl)Cl Amb27231749 [0,0,0,0,0,0|3,0,1]=4 496 B6R0.3 OC\C(F)=C(/F)Cl Amb27772260 [0,0,0,0,0,0|3,0,1]=4 497 B6R0.3 [C-]#[N+]C(C)C(=O)O Amb27974746 [0,0,0,0,0,0|3,0,0]=3 498 B5R0.1 BC(=O)NCC Amb27430059 [1,0,0,0,0,0|3,0,0]=4 499 B5R0.1 C#CCC(=O)O Amb33532662 [1,0,0,0,0,0|1,0,1]=3 500 B5R0.1 C=C(Br)CCBr Amb25827098 [1,0,0,0,0,0|3,0,0]=4 501 B5R0.1 C=C(Br)CCCl Amb8391241 [1,0,0,0,0,0|3,0,0]=4 502 B5R0.1 C=C(Br)CCO Amb4014497 [1,0,0,0,0,0|2,0,0]=3 503 B5R0.1 C=C(C)CCBr Amb21857866 [1,0,0,0,0,0|3,0,0]=4 504 B5R0.1 C=C(C)CCC Amb8513259 [1,0,0,0,0,0|3,0,0]=4 505 B5R0.1 C=C(C)CCCl Amb27810807 [1,0,0,0,0,0|3,0,0]=4 506 B5R0.1 C=C(C)CCI Amb26649317 [1,0,0,0,0,0|3,0,0]=4 507 B5R0.1 C=C(C)CCN Amb17673481 [1,0,0,0,0,0|3,0,0]=4 508 B5R0.1 C=C(C)CCN Amb33543001 [1,0,0,0,0,0|3,0,0]=4 509 B5R0.1 C=C(C)CCO Amb34916534 [1,0,0,0,0,0|2,0,0]=3 510 B5R0.1 C=C(C)CCO Amb8513522 [1,0,0,0,0,0|2,0,0]=3 511 B5R0.1 C=C(C)CCS Amb25887673 [1,0,0,0,0,0|2,1,0]=4 512 B5R0.1 C=C(C)CNO Amb33199864 [1,0,0,0,0,0|3,0,0]=4 513 B5R0.1 C=C(Cl)CCI Amb28187982 [1,0,0,0,0,0|3,0,0]=4 514 B5R0.1 C=C(Cl)CCN Amb27493165 [1,0,0,0,0,0|3,0,0]=4 515 B5R0.1 C=CCC(=O)Cl Amb33543701 [1,0,0,0,0,0|2,0,1]=4 516 B5R0.1 C=CCC(=O)O Amb3940098 [1,0,0,0,0,0|1,0,1]=3 517 B5R0.1 C=CCC(C)=O Amb8396482 [1,0,0,0,0,0|2,0,1]=4 518 B5R0.1 C=CCC(N)=O Amb17610156 [1,0,0,0,0,0|2,0,1]=4 519 B5R0.1 C=CCS(=O)O Amb33534190 [1,0,0,0,0,0|2,0,1]=4 520 B5R0.1 C=CC[PH](=O)O Amb8391287 [1,0,0,0,0,0|2,0,1]=4 521 B5R0.1 C=NCC(N)=O Amb26548445 [1,0,0,0,0,0|3,0,0]=4 522 B5R0.1 CC#CC(=O)O Amb2685714 [1,0,0,0,0,0|1,0,2]=4 523 B5R0.1 CC(=O)CC#N Amb1102132 [1,0,0,0,0,0|2,0,1]=4 524 B5R0.1 CC(=O)CC=N Amb28285098 [1,0,0,0,0,0|2,0,1]=4 525 B5R0.1 CC(=O)CCBr Amb24078246 [1,0,0,0,0,0|2,0,0]=3 526 B5R0.1 CC(=O)CCCl Amb2720823 [1,0,0,0,0,0|2,0,0]=3 527 B5R0.1 CC(=O)CCF Amb26427773 [1,0,0,0,0,0|2,0,0]=3 528 B5R0.1 CC(=O)CCN Amb18632933 [1,0,0,0,0,0|2,0,0]=3 529 B5R0.1 CC(=O)CCN Amb33544540 [1,0,0,0,0,0|2,0,0]=3 530 B5R0.1 CC(=O)CCO Amb836357 [1,0,0,0,0,0|1,0,0]=2 531 B5R0.1 CC(=O)CC[NH3+] Amb17205167 [1,0,0,0,0,0|2,0,0]=3 532 B5R0.1 CC(=O)CNO Amb28049954 [1,0,0,0,0,0|2,0,0]=3 533 B5R0.1 CC(=O)CSN Amb28430346 [1,0,0,0,0,0|3,0,0]=4 534 B5R0.1 CC(=O)NCO Amb8516057 [1,0,0,0,0,0|2,0,0]=3 535 B5R0.1 CC(=O)OCBr Amb3941481 [1,0,0,0,0,0|3,0,0]=4 536 B5R0.1 CC(=O)OCCl Amb33542858 [1,0,0,0,0,0|3,0,0]=4 537 B5R0.1 CC(=O)OCI Amb25226851 [1,0,0,0,0,0|3,0,0]=4 538 B5R0.1 CC(=O)SCBr Amb25349900 [1,0,0,0,0,0|3,0,0]=4 539 B5R0.1 CC(=O)SCI Amb33339258 [1,0,0,0,0,0|3,0,0]=4 540 B5R0.1 CC(=O)SCO Amb27255261 [1,0,0,0,0,0|2,0,0]=3 541 B5R0.1 CC(=O)\C=N/O Amb26474151 [1,0,0,0,0,0|2,0,1]=4 542 B5R0.1 CC(=O)\C=N\O Amb33719017 [1,0,0,0,0,0|2,0,1]=4 543 B5R0.1 CC(=O)\C=N\O Amb8395285 [1,0,0,0,0,0|2,0,1]=4 544 B5R0.1 CC(C)=CCO Amb4605830 [1,0,0,0,0,0|2,0,1]=4 545 B5R0.1 CC(C)CCO Amb4605831 [1,0,0,0,0,0|2,0,1]=4 546 B5R0.1 CC(Cl)CCO Amb27625144 [1,0,0,0,0,0|2,0,1]=4 547 B5R0.1 CC(F)CCO Amb21951900 [1,0,0,0,0,0|2,0,1]=4 548 B5R0.1 CC(N)CCO Amb2697504 [1,0,0,0,0,0|2,0,1]=4 549 B5R0.1 CC(N)CCO Amb32666060 [1,0,0,0,0,0|2,0,1]=4 550 B5R0.1 CC(O)CCBr Amb33548043 [1,0,0,0,0,0|2,0,1]=4 551 B5R0.1 CC(O)CCCl Amb24551052 [1,0,0,0,0,0|2,0,1]=4 552 B5R0.1 CC(O)CCF Amb26449397 [1,0,0,0,0,0|2,0,1]=4 553 B5R0.1 CC(O)CCN Amb32666140 [1,0,0,0,0,0|2,0,1]=4 554 B5R0.1 CC(O)CCN Amb33537908 [1,0,0,0,0,0|2,0,1]=4 555 B5R0.1 CC(O)CCO Amb6608662 [1,0,0,0,0,0|1,0,1]=3 556 B5R0.1 CC(S)CCO Amb19148316 [1,0,0,0,0,0|1,1,1]=4 557 B5R0.1 CCCB(O)O Amb2447105 [1,0,0,0,0,0|2,0,1]=4 558 B5R0.1 CCCC(=N)N Amb10610381 [1,0,0,0,0,0|3,0,0]=4 559 B5R0.1 CCCC(=N)N Amb2695914 [1,0,0,0,0,0|3,0,0]=4 560 B5R0.1 CCCC(=O)Br Amb22734023 [1,0,0,0,0,0|2,0,0]=3 561 B5R0.1 CCCC(=O)Cl Amb2792903 [1,0,0,0,0,0|2,0,0]=3 562 B5R0.1 CCCC(=O)O Amb3939012 [1,0,0,0,0,0|1,0,0]=2 563 B5R0.1 CCCC(=O)[O-] Amb8514901 [1,0,0,0,0,0|1,0,1]=3 564 B5R0.1 CCCC(=S)Cl Amb24626931 [1,0,0,0,0,0|2,1,0]=4 565 B5R0.1 CCCC(C)=O Amb6608910 [1,0,0,0,0,0|2,0,0]=3 566 B5R0.1 CCCC(C)O Amb4605839 [1,0,0,0,0,0|2,0,1]=4 567 B5R0.1 CCCC(N)=O Amb3886524 [1,0,0,0,0,0|2,0,0]=3 568 B5R0.1 CCCC(N)=S Amb6245403 [1,0,0,0,0,0|2,1,0]=4 569 B5R0.1 CCCC(N)=[NH2+] Amb8384484 [1,0,0,0,0,0|3,0,0]=4 570 B5R0.1 CCCC(O)=S Amb22229383 [1,0,0,0,0,0|1,1,0]=3 571 B5R0.1 CCCC(O)Cl Amb22552567 [1,0,0,0,0,0|2,0,1]=4 572 B5R0.1 CCCC(O)O Amb26364594 [1,0,0,0,0,0|1,0,2]=4 573 B5R0.1 CCCN(C)O Amb25024622 [1,0,0,0,0,0|3,0,0]=4 574 B5R0.1 CCCS(=O)Cl Amb25025566 [1,0,0,0,0,0|3,0,0]=4 575 B5R0.1 CCCS(=O)[O-] Amb19929119 [1,0,0,0,0,0|2,0,1]=4 576 B5R0.1 CCCS(N)=O Amb24733579 [1,0,0,0,0,0|3,0,0]=4 577 B5R0.1 CCC[C@@H](C)O Amb8628178 [1,0,0,0,0,0|2,0,1]=4 578 B5R0.1 CCC[C@@H](N)O Amb28074861 [1,0,0,0,0,0|2,0,1]=4 579 B5R0.1 CCC[C@H](C)O Amb8389338 [1,0,0,0,0,0|2,0,1]=4 580 B5R0.1 CCC[N+](=O)[O-] Amb8513268 [1,0,0,0,0,0|2,0,1]=4 581 B5R0.1 CCNC(=O)Cl Amb25791793 [1,0,0,0,0,0|3,0,0]=4 582 B5R0.1 CCNC(C)=O Amb2780415 [1,0,0,0,0,0|3,0,0]=4 583 B5R0.1 CCNC(N)=O Amb6608844 [1,0,0,0,0,0|3,0,0]=4 584 B5R0.1 CCOC(=O)Cl Amb2793045 [1,0,0,0,0,0|3,0,0]=4 585 B5R0.1 CCOC(=O)O Amb8393208 [1,0,0,0,0,0|2,0,0]=3 586 B5R0.1 CCOC(C)=O Amb3940488 [1,0,0,0,0,0|3,0,0]=4 587 B5R0.1 CCOC(N)=O Amb6608672 [1,0,0,0,0,0|3,0,0]=4 588 B5R0.1 CCO[PH](=O)O Amb22360741 [1,0,0,0,0,0|3,0,0]=4 589 B5R0.1 CCO[Si](=O)O Amb26569259 [1,0,0,0,0,0|2,1,0]=4 590 B5R0.1 CCSC(=O)Cl Amb8516064 [1,0,0,0,0,0|3,0,0]=4 591 B5R0.1 CN(Br)CCO Amb27405311 [1,0,0,0,0,0|3,0,0]=4 592 B5R0.1 CN(C)CCO Amb2793033 [1,0,0,0,0,0|3,0,0]=4 593 B5R0.1 CN(Cl)CCO Amb27457982 [1,0,0,0,0,0|3,0,0]=4 594 B5R0.1 CN(N)CCO Amb28400197 [1,0,0,0,0,0|3,0,0]=4 595 B5R0.1 CN(O)CCCl Amb27473361 [1,0,0,0,0,0|3,0,0]=4 596 B5R0.1 CN(O)CCF Amb33377280 [1,0,0,0,0,0|3,0,0]=4 597 B5R0.1 CNCC(=O)O Amb6298808 [1,0,0,0,0,0|2,0,0]=3 598 B5R0.1 CNCC(=O)O Amb6599996 [1,0,0,0,0,0|2,0,0]=3 599 B5R0.1 CNCC(=O)[O-] Amb20246714 [1,0,0,0,0,0|2,0,1]=4 600 B5R0.1 CNCC(C)=O Amb17621974 [1,0,0,0,0,0|3,0,0]=4 601 B5R0.1 CNCC(C)=O Amb21959975 [1,0,0,0,0,0|3,0,0]=4 602 B5R0.1 CNCC(N)=O Amb19134307 [1,0,0,0,0,0|3,0,0]=4 603 B5R0.1 CNCC(N)=O Amb3940074 [1,0,0,0,0,0|3,0,0]=4 604 B5R0.1 CNCC(N)=O Amb9151172 [1,0,0,0,0,0|3,0,0]=4 605 B5R0.1 COCC(=O)Cl Amb3939326 [1,0,0,0,0,0|3,0,0]=4 606 B5R0.1 COCC(=O)O Amb3939876 [1,0,0,0,0,0|2,0,0]=3 607 B5R0.1 COCC(C)=O Amb8513767 [1,0,0,0,0,0|3,0,0]=4 608 B5R0.1 COCC(N)=O Amb1153776 [1,0,0,0,0,0|3,0,0]=4 609 B5R0.1 CS(=O)CCBr Amb28049280 [1,0,0,0,0,0|3,0,0]=4 610 B5R0.1 CS(=O)CCCl Amb24116979 [1,0,0,0,0,0|3,0,0]=4 611 B5R0.1 CS(=O)CCI Amb27752977 [1,0,0,0,0,0|3,0,0]=4 612 B5R0.1 CS(=O)CCN Amb2786559 [1,0,0,0,0,0|3,0,0]=4 613 B5R0.1 CS(=O)CCN Amb33543191 [1,0,0,0,0,0|3,0,0]=4 614 B5R0.1 CS(=O)CCO Amb28075364 [1,0,0,0,0,0|2,0,0]=3 615 B5R0.1 CSCC(=O)Cl Amb24528357 [1,0,0,0,0,0|3,0,0]=4 616 B5R0.1 CSCC(=O)O Amb1152425 [1,0,0,0,0,0|2,0,0]=3 617 B5R0.1 CSCC(C)=O Amb20621731 [1,0,0,0,0,0|3,0,0]=4 618 B5R0.1 CSCC(N)=O Amb19515874 [1,0,0,0,0,0|3,0,0]=4 619 B5R0.1 C[C@@H](N)CCO Amb19515999 [1,0,0,0,0,0|2,0,1]=4 620 B5R0.1 C[C@@H](N)CCO Amb22746127 [1,0,0,0,0,0|2,0,1]=4 621 B5R0.1 C[C@@H](O)CCBr Amb27392288 [1,0,0,0,0,0|2,0,1]=4 622 B5R0.1 C[C@@H](O)CCF Amb33376906 [1,0,0,0,0,0|2,0,1]=4 623 B5R0.1 C[C@@H](O)CCI Amb27594639 [1,0,0,0,0,0|2,0,1]=4 624 B5R0.1 C[C@@H](O)CCN Amb22736702 [1,0,0,0,0,0|2,0,1]=4 625 B5R0.1 C[C@@H](O)CCN Amb28555327 [1,0,0,0,0,0|2,0,1]=4 626 B5R0.1 C[C@@H](O)CCO Amb4166294 [1,0,0,0,0,0|1,0,1]=3 627 B5R0.1 C[C@@H](S)CCO Amb27255216 [1,0,0,0,0,0|1,1,1]=4 628 B5R0.1 C[C@H](F)CCO Amb28428651 [1,0,0,0,0,0|2,0,1]=4 629 B5R0.1 C[C@H](N)CCO Amb19515998 [1,0,0,0,0,0|2,0,1]=4 630 B5R0.1 C[C@H](N)CCO Amb24055217 [1,0,0,0,0,0|2,0,1]=4 631 B5R0.1 C[C@H](O)CCBr Amb28367228 [1,0,0,0,0,0|2,0,1]=4 632 B5R0.1 C[C@H](O)CCF Amb33376900 [1,0,0,0,0,0|2,0,1]=4 633 B5R0.1 C[C@H](O)CCN Amb22736705 [1,0,0,0,0,0|2,0,1]=4 634 B5R0.1 C[C@H](O)CCN Amb34159890 [1,0,0,0,0,0|2,0,1]=4 635 B5R0.1 C[C@H](O)CCO Amb4166300 [1,0,0,0,0,0|1,0,1]=3 636 B5R0.1 C[NH2+]CC(N)=O Amb4303509 [1,0,0,0,0,0|3,0,0]=4 637 B5R0.1 C\C(Br)=C/CO Amb30621790 [1,0,0,0,0,0|2,0,1]=4 638 B5R0.1 C\C(Cl)=C\CO Amb25663061 [1,0,0,0,0,0|2,0,1]=4 639 B5R0.1 C\C(I)=C/CO Amb17616110 [1,0,0,0,0,0|2,0,1]=4 640 B5R0.1 C\C(I)=C\CO Amb30621783 [1,0,0,0,0,0|2,0,1]=4 641 B5R0.1 C\C(O)=C\CN Amb33294274 [1,0,0,0,0,0|2,0,1]=4 642 B5R0.1 C\C=C/C(=O)O Amb27779315 [1,0,0,0,0,0|1,0,2]=4 643 B5R0.1 C\C=C\C(=O)O Amb8385856 [1,0,0,0,0,0|1,0,2]=4 644 B5R0.1 N#CCC(=O)Cl Amb17593096 [1,0,0,0,0,0|2,0,1]=4 645 B5R0.1 N#CCC(=O)O Amb2609022 [1,0,0,0,0,0|1,0,1]=3 646 B5R0.1 N#CCC(N)=O Amb6336473 [1,0,0,0,0,0|2,0,1]=4 647 B5R0.1 N=C(Br)CCBr Amb27653883 [1,0,0,0,0,0|3,0,0]=4 648 B5R0.1 N=C(N)CCBr Amb4297021 [1,0,0,0,0,0|3,0,0]=4 649 B5R0.1 N=C(N)CCCl Amb25839424 [1,0,0,0,0,0|3,0,0]=4 650 B5R0.1 N=C(N)CCF Amb26024692 [1,0,0,0,0,0|3,0,0]=4 651 B5R0.1 N=C(N)CCN Amb27265608 [1,0,0,0,0,0|3,0,0]=4 652 B5R0.1 N=C(N)CCN Amb32687503 [1,0,0,0,0,0|3,0,0]=4 653 B5R0.1 N=C(N)CCN Amb33164129 [1,0,0,0,0,0|3,0,0]=4 654 B5R0.1 N=C(N)CCO Amb2696134 [1,0,0,0,0,0|2,0,0]=3 655 B5R0.1 N=C(N)CCO Amb8630168 [1,0,0,0,0,0|2,0,0]=3 656 B5R0.1 NC(=O)CC=O Amb25777522 [1,0,0,0,0,0|1,0,2]=4 657 B5R0.1 NC(=O)CCBr Amb21618712 [1,0,0,0,0,0|2,0,0]=3 658 B5R0.1 NC(=O)CCCl Amb1127569 [1,0,0,0,0,0|2,0,0]=3 659 B5R0.1 NC(=O)CCF Amb28289353 [1,0,0,0,0,0|2,0,0]=3 660 B5R0.1 NC(=O)CCI Amb27966778 [1,0,0,0,0,0|2,0,0]=3 661 B5R0.1 NC(=O)CCO Amb9421407 [1,0,0,0,0,0|1,0,0]=2 662 B5R0.1 NC(=O)CCS Amb27154802 [1,0,0,0,0,0|1,1,0]=3 663 B5R0.1 NC(=O)CNCl Amb28315673 [1,0,0,0,0,0|3,0,0]=4 664 B5R0.1 NC(=O)NCO Amb17674341 [1,0,0,0,0,0|2,0,0]=3 665 B5R0.1 NC(=O)SCCl Amb26419693 [1,0,0,0,0,0|3,0,0]=4 666 B5R0.1 NC(=S)CCCl Amb33328368 [1,0,0,0,0,0|2,1,0]=4 667 B5R0.1 NC(=S)CCF Amb27950563 [1,0,0,0,0,0|2,1,0]=4 668 B5R0.1 NC(=S)CCO Amb8855295 [1,0,0,0,0,0|1,1,0]=3 669 B5R0.1 NC(=S)CCS Amb17503271 [1,0,0,0,0,0|1,2,0]=4 670 B5R0.1 NC(=S)NCO Amb27461395 [1,0,0,0,0,0|2,1,0]=4 671 B5R0.1 NC(O)CCO Amb28252327 [1,0,0,0,0,0|1,0,1]=3 672 B5R0.1 NCCB(O)O Amb27859105 [1,0,0,0,0,0|2,0,1]=4 673 B5R0.1 NCCC(=O)Cl Amb24117140 [1,0,0,0,0,0|2,0,0]=3 674 B5R0.1 NCCC(=O)O Amb1935127 [1,0,0,0,0,0|1,0,0]=2 675 B5R0.1 NCCC(=O)[O-] Amb28991330 [1,0,0,0,0,0|1,0,1]=3 676 B5R0.1 NCCC(N)=O Amb1137251 [1,0,0,0,0,0|2,0,0]=3 677 B5R0.1 NCCC(N)=O Amb9147573 [1,0,0,0,0,0|2,0,0]=3 678 B5R0.1 NCCC(N)=S Amb18523221 [1,0,0,0,0,0|2,1,0]=4 679 B5R0.1 NCCC(N)=S Amb33456385 [1,0,0,0,0,0|2,1,0]=4 680 B5R0.1 NCCC(O)O Amb27449145 [1,0,0,0,0,0|1,0,2]=4 681 B5R0.1 NCCS(=O)O Amb6600043 [1,0,0,0,0,0|2,0,0]=3 682 B5R0.1 NCCS(N)=O Amb33512527 [1,0,0,0,0,0|3,0,0]=4 683 B5R0.1 NCC[N+](=O)[O-] Amb18203119 [1,0,0,0,0,0|2,0,1]=4 684 B5R0.1 NCC[PH](=O)O Amb22168066 [1,0,0,0,0,0|2,0,0]=3 685 B5R0.1 NCC[PH](=O)O Amb35788864 [1,0,0,0,0,0|2,0,0]=3 686 B5R0.1 NNCC(=O)O Amb32751165 [1,0,0,0,0,0|2,0,0]=3 687 B5R0.1 NNCC(=O)O Amb6740299 [1,0,0,0,0,0|2,0,0]=3 688 B5R0.1 NNCC(N)=O Amb32990162 [1,0,0,0,0,0|3,0,0]=4 689 B5R0.1 NOCC(=O)O Amb1154237 [1,0,0,0,0,0|2,0,0]=3 690 B5R0.1 NOCC(=O)O Amb4324355 [1,0,0,0,0,0|2,0,0]=3 691 B5R0.1 NOCC(=O)O Amb8513076 [1,0,0,0,0,0|2,0,0]=3 692 B5R0.1 NOCC(N)=O Amb33528973 [1,0,0,0,0,0|3,0,0]=4 693 B5R0.1 NS(=O)CCCl Amb24407159 [1,0,0,0,0,0|3,0,0]=4 694 B5R0.1 NS(=O)CCF Amb32720391 [1,0,0,0,0,0|3,0,0]=4 695 B5R0.1 NS(=O)CCO Amb32720357 [1,0,0,0,0,0|2,0,0]=3 696 B5R0.1 N\C=C\C(=O)O Amb27217920 [1,0,0,0,0,0|1,0,2]=4 697 B5R0.1 O=C(Br)CCBr Amb24624022 [1,0,0,0,0,0|2,0,0]=3 698 B5R0.1 O=C(Cl)CCBr Amb3941484 [1,0,0,0,0,0|2,0,0]=3 699 B5R0.1 O=C(Cl)CCCl Amb3939313 [1,0,0,0,0,0|2,0,0]=3 700 B5R0.1 O=C(Cl)CCF Amb27148631 [1,0,0,0,0,0|2,0,0]=3 701 B5R0.1 O=C(Cl)CCI Amb28454579 [1,0,0,0,0,0|2,0,0]=3 702 B5R0.1 O=C(Cl)CCO Amb27270014 [1,0,0,0,0,0|1,0,0]=2 703 B5R0.1 O=C(Cl)NCCl Amb28315820 [1,0,0,0,0,0|3,0,0]=4 704 B5R0.1 O=C(Cl)OCCl Amb8389474 [1,0,0,0,0,0|3,0,0]=4 705 B5R0.1 O=C(F)CCCl Amb27257545 [1,0,0,0,0,0|2,0,0]=3 706 B5R0.1 O=C(F)OCCl Amb27860169 [1,0,0,0,0,0|3,0,0]=4 707 B5R0.1 O=C(O)C#CBr Amb17593707 [1,0,0,0,0,0|1,0,2]=4 708 B5R0.1 O=C(O)C#CCl Amb17593098 [1,0,0,0,0,0|1,0,2]=4 709 B5R0.1 O=C(O)CCBr Amb2685479 [1,0,0,0,0,0|1,0,0]=2 710 B5R0.1 O=C(O)CCCl Amb5395408 [1,0,0,0,0,0|1,0,0]=2 711 B5R0.1 O=C(O)CCF Amb10603694 [1,0,0,0,0,0|1,0,0]=2 712 B5R0.1 O=C(O)CCI Amb2688882 [1,0,0,0,0,0|1,0,0]=2 713 B5R0.1 O=C(O)CCO Amb2688785 [1,0,0,0,0,0|0,0,0]=1 714 B5R0.1 O=C(O)CCS Amb6608916 [1,0,0,0,0,0|0,1,0]=2 715 B5R0.1 O=C(O)CNO Amb24120360 [1,0,0,0,0,0|1,0,0]=2 716 B5R0.1 O=C(O)\C=C/Br Amb18644453 [1,0,0,0,0,0|1,0,2]=4 717 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [1,0,0,0,0,0|1,0,2]=4 718 B5R0.1 O=C(O)\C=C/I Amb28315824 [1,0,0,0,0,0|1,0,2]=4 719 B5R0.1 O=C(O)\C=C\Br Amb27423608 [1,0,0,0,0,0|1,0,2]=4 720 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [1,0,0,0,0,0|1,0,2]=4 721 B5R0.1 O=C(O)\C=C\I Amb30584673 [1,0,0,0,0,0|1,0,2]=4 722 B5R0.1 O=C(O)\C=C\O Amb26055842 [1,0,0,0,0,0|0,0,2]=3 723 B5R0.1 O=C(O)\C=C\S Amb28401590 [1,0,0,0,0,0|0,1,2]=4 724 B5R0.1 O=C(O)\C=N\O Amb20671938 [1,0,0,0,0,0|1,0,1]=3 725 B5R0.1 O=C(S)CCCl Amb27461454 [1,0,0,0,0,0|1,1,0]=3 726 B5R0.1 O=C([O-])CCO Amb22055495 [1,0,0,0,0,0|0,0,1]=2 727 B5R0.1 O=C([O-])NCCl Amb27777248 [1,0,0,0,0,0|2,0,1]=4 728 B5R0.1 O=CCC(=O)O Amb22169407 [1,0,0,0,0,0|0,0,2]=3 729 B5R0.1 O=CCC(=O)[Na] Amb27949540 [1,0,0,0,0,0|1,0,2]=4 730 B5R0.1 O=S(Cl)CCCl Amb26494051 [1,0,0,0,0,0|3,0,0]=4 731 B5R0.1 O=S(Cl)CCF Amb32720386 [1,0,0,0,0,0|3,0,0]=4 732 B5R0.1 O=S(Cl)CCO Amb32720404 [1,0,0,0,0,0|2,0,0]=3 733 B5R0.1 O=S(O)CCO Amb25937057 [1,0,0,0,0,0|1,0,0]=2 734 B5R0.1 O=S([O-])CCCl Amb27639192 [1,0,0,0,0,0|2,0,1]=4 735 B5R0.1 O=S([O-])CCF Amb27213259 [1,0,0,0,0,0|2,0,1]=4 736 B5R0.1 O=S([O-])CCO Amb32754124 [1,0,0,0,0,0|1,0,1]=3 737 B5R0.1 O=[N+]([O-])CCBr Amb25965752 [1,0,0,0,0,0|2,0,1]=4 738 B5R0.1 O=[N+]([O-])CCCl Amb28381478 [1,0,0,0,0,0|2,0,1]=4 739 B5R0.1 O=[N+]([O-])CCF Amb17674352 [1,0,0,0,0,0|2,0,1]=4 740 B5R0.1 O=[N+]([O-])CCO Amb3940447 [1,0,0,0,0,0|1,0,1]=3 741 B5R0.1 O=[N+]([O-])CCS Amb26620894 [1,0,0,0,0,0|1,1,1]=4 742 B5R0.1 OB(O)CCF Amb27479949 [1,0,0,0,0,0|2,0,1]=4 743 B5R0.1 OC(Br)CCBr Amb27457468 [1,0,0,0,0,0|2,0,1]=4 744 B5R0.1 OC(Cl)CCCl Amb28255432 [1,0,0,0,0,0|2,0,1]=4 745 B5R0.1 OC(O)CCS Amb25746150 [1,0,0,0,0,0|0,1,2]=4 746 B5R0.1 OCC=C(Br)Br Amb25026226 [1,0,0,0,0,0|2,0,1]=4 747 B5R0.1 OCC=C(Cl)Cl Amb17593330 [1,0,0,0,0,0|2,0,1]=4 748 B5R0.1 OCCC(F)F Amb33007913 [1,0,0,0,0,0|2,0,1]=4 749 B5R0.1 OCCC(O)Cl Amb26052481 [1,0,0,0,0,0|1,0,1]=3 750 B5R0.1 OP(O)CCCl Amb27169424 [1,0,0,0,0,0|2,0,1]=4 751 B5R0.3 C#CC(N)C=C Amb28434506 [1,0,0,0,0,0|2,0,1]=4 752 B5R0.3 C#CC(N)CC Amb26316205 [1,0,0,0,0,0|2,0,1]=4 753 B5R0.3 C#CC(N)CC Amb33164073 [1,0,0,0,0,0|2,0,1]=4 754 B5R0.3 C#CC(N)CO Amb26985041 [1,0,0,0,0,0|1,0,1]=3 755 B5R0.3 C#CC(N)CO Amb33551336 [1,0,0,0,0,0|1,0,1]=3 756 B5R0.3 C#C[C@@H](C)CO Amb28207317 [1,0,0,0,0,0|2,0,1]=4 757 B5R0.3 C#C[C@@H](N)CC Amb27837716 [1,0,0,0,0,0|2,0,1]=4 758 B5R0.3 C#C[C@H](N)CO Amb28345581 [1,0,0,0,0,0|1,0,1]=3 759 B5R0.3 C=C(C=O)CC Amb17940102 [1,0,0,0,0,0|2,0,1]=4 760 B5R0.3 C=C(CO)CO Amb8515382 [1,0,0,0,0,0|1,0,2]=4 761 B5R0.3 C=C(CO)N=O Amb27481276 [1,0,0,0,0,0|2,0,1]=4 762 B5R0.3 C=CC(=O)CO Amb28074769 [1,0,0,0,0,0|2,0,1]=4 763 B5R0.3 C=CC(Br)C=O Amb27477894 [1,0,0,0,0,0|2,0,1]=4 764 B5R0.3 C=CC(Br)CBr Amb26649699 [1,0,0,0,0,0|3,0,0]=4 765 B5R0.3 C=CC(Br)CO Amb25888060 [1,0,0,0,0,0|2,0,0]=3 766 B5R0.3 C=CC(C)C=O Amb25737956 [1,0,0,0,0,0|2,0,1]=4 767 B5R0.3 C=CC(C)CBr Amb25310976 [1,0,0,0,0,0|3,0,0]=4 768 B5R0.3 C=CC(C)CC Amb8513436 [1,0,0,0,0,0|3,0,0]=4 769 B5R0.3 C=CC(C)CCl Amb25917438 [1,0,0,0,0,0|3,0,0]=4 770 B5R0.3 C=CC(C)CO Amb22347861 [1,0,0,0,0,0|2,0,0]=3 771 B5R0.3 C=CC(Cl)C=O Amb27477543 [1,0,0,0,0,0|2,0,1]=4 772 B5R0.3 C=CC(Cl)CCl Amb3940257 [1,0,0,0,0,0|3,0,0]=4 773 B5R0.3 C=CC(Cl)CO Amb26946125 [1,0,0,0,0,0|2,0,0]=3 774 B5R0.3 C=CC(F)CN Amb26476565 [1,0,0,0,0,0|3,0,0]=4 775 B5R0.3 C=CC(I)CO Amb28291610 [1,0,0,0,0,0|2,0,0]=3 776 B5R0.3 C=CC(N)CC Amb26349978 [1,0,0,0,0,0|2,0,0]=3 777 B5R0.3 C=CC(N)CC Amb31291608 [1,0,0,0,0,0|2,0,0]=3 778 B5R0.3 C=CC(N)CF Amb27593895 [1,0,0,0,0,0|2,0,0]=3 779 B5R0.3 C=CC(N)CO Amb19374935 [1,0,0,0,0,0|1,0,0]=2 780 B5R0.3 C=CC(N)CO Amb28555332 [1,0,0,0,0,0|1,0,0]=2 781 B5R0.3 C=CC(N)CS Amb18120558 [1,0,0,0,0,0|1,1,0]=3 782 B5R0.3 C=CC(O)CBr Amb10808128 [1,0,0,0,0,0|3,0,0]=4 783 B5R0.3 C=CC(O)CC Amb3940382 [1,0,0,0,0,0|3,0,0]=4 784 B5R0.3 C=CC(O)CCl Amb17593108 [1,0,0,0,0,0|3,0,0]=4 785 B5R0.3 C=CC(O)CF Amb33376917 [1,0,0,0,0,0|3,0,0]=4 786 B5R0.3 C=CC(O)CN Amb8630112 [1,0,0,0,0,0|3,0,0]=4 787 B5R0.3 C=CC(O)CO Amb17610151 [1,0,0,0,0,0|2,0,0]=3 788 B5R0.3 C=CC(S)CO Amb27960052 [1,0,0,0,0,0|2,0,0]=3 789 B5R0.3 C=C[C@@H](N)CO Amb19886656 [1,0,0,0,0,0|1,0,0]=2 790 B5R0.3 C=C[C@@H](N)CO Amb27247092 [1,0,0,0,0,0|1,0,0]=2 791 B5R0.3 C=C[C@@H](O)CC Amb27813799 [1,0,0,0,0,0|3,0,0]=4 792 B5R0.3 C=C[C@@H](O)CN Amb27837717 [1,0,0,0,0,0|3,0,0]=4 793 B5R0.3 C=C[C@H](C)CBr Amb27650555 [1,0,0,0,0,0|3,0,0]=4 794 B5R0.3 C=C[C@H](C)CO Amb27470174 [1,0,0,0,0,0|2,0,0]=3 795 B5R0.3 C=C[C@H](N)CO Amb25147462 [1,0,0,0,0,0|1,0,0]=2 796 B5R0.3 C=C[C@H](N)CO Amb8631419 [1,0,0,0,0,0|1,0,0]=2 797 B5R0.3 C=C[C@H](O)CO Amb19888350 [1,0,0,0,0,0|2,0,0]=3 798 B5R0.3 CC(C#N)C=O Amb9669144 [1,0,0,0,0,0|2,0,1]=4 799 B5R0.3 CC(C#N)CO Amb9028643 [1,0,0,0,0,0|2,0,1]=4 800 B5R0.3 CC(C=O)C=O Amb17593026 [1,0,0,0,0,0|1,0,2]=4 801 B5R0.3 CC(C=O)CF Amb24638421 [1,0,0,0,0,0|2,0,0]=3 802 B5R0.3 CC(C=O)O[SiH3] Amb28284225 [1,0,0,0,0,0|3,0,0]=4 803 B5R0.3 CC(CN)CO Amb2699160 [1,0,0,0,0,0|2,0,1]=4 804 B5R0.3 CC(CN)CO Amb8869013 [1,0,0,0,0,0|2,0,1]=4 805 B5R0.3 CC(CO)CBr Amb33542474 [1,0,0,0,0,0|2,0,1]=4 806 B5R0.3 CC(CO)CCl Amb26381948 [1,0,0,0,0,0|2,0,1]=4 807 B5R0.3 CC(CO)CF Amb27967337 [1,0,0,0,0,0|2,0,1]=4 808 B5R0.3 CC(CO)CI Amb27834997 [1,0,0,0,0,0|2,0,1]=4 809 B5R0.3 CC(CO)CO Amb9788669 [1,0,0,0,0,0|1,0,1]=3 810 B5R0.3 CC(CO)CS Amb19375381 [1,0,0,0,0,0|1,1,1]=4 811 B5R0.3 CC(CO)N=O Amb28365917 [1,0,0,0,0,0|2,0,0]=3 812 B5R0.3 CC(CO)NN Amb20622512 [1,0,0,0,0,0|3,0,0]=4 813 B5R0.3 CC(CO)NN Amb22231763 [1,0,0,0,0,0|3,0,0]=4 814 B5R0.3 CC(CO)NO Amb27471121 [1,0,0,0,0,0|2,0,0]=3 815 B5R0.3 CCC(=O)C=O Amb22228532 [1,0,0,0,0,0|2,0,1]=4 816 B5R0.3 CCC(Br)C=O Amb18124003 [1,0,0,0,0,0|2,0,0]=3 817 B5R0.3 CCC(Br)CO Amb27637663 [1,0,0,0,0,0|2,0,1]=4 818 B5R0.3 CCC(C)C=O Amb3939899 [1,0,0,0,0,0|2,0,0]=3 819 B5R0.3 CCC(C)CO Amb3939046 [1,0,0,0,0,0|2,0,1]=4 820 B5R0.3 CCC(Cl)C=O Amb18122610 [1,0,0,0,0,0|2,0,0]=3 821 B5R0.3 CCC(Cl)CO Amb22011826 [1,0,0,0,0,0|2,0,1]=4 822 B5R0.3 CCC(F)CO Amb27454301 [1,0,0,0,0,0|2,0,1]=4 823 B5R0.3 CCC(N)C#N Amb10203825 [1,0,0,0,0,0|2,0,1]=4 824 B5R0.3 CCC(N)C#N Amb1136995 [1,0,0,0,0,0|2,0,1]=4 825 B5R0.3 CCC(N)CBr Amb26491532 [1,0,0,0,0,0|2,0,1]=4 826 B5R0.3 CCC(N)CC Amb3939864 [1,0,0,0,0,0|2,0,1]=4 827 B5R0.3 CCC(N)CCl Amb28313277 [1,0,0,0,0,0|2,0,1]=4 828 B5R0.3 CCC(N)CF Amb26601671 [1,0,0,0,0,0|2,0,1]=4 829 B5R0.3 CCC(N)CF Amb32652398 [1,0,0,0,0,0|2,0,1]=4 830 B5R0.3 CCC(N)CN Amb33534078 [1,0,0,0,0,0|2,0,1]=4 831 B5R0.3 CCC(N)CN Amb9380664 [1,0,0,0,0,0|2,0,1]=4 832 B5R0.3 CCC(N)CO Amb9703106 [1,0,0,0,0,0|1,0,1]=3 833 B5R0.3 CCC(N)CS Amb18122513 [1,0,0,0,0,0|1,1,1]=4 834 B5R0.3 CCC(N)CS Amb32693424 [1,0,0,0,0,0|1,1,1]=4 835 B5R0.3 CCC(N)[SH]=O Amb28241197 [1,0,0,0,0,0|2,0,0]=3 836 B5R0.3 CCC(O)CO Amb8517157 [1,0,0,0,0,0|2,0,1]=4 837 B5R0.3 CCC(S)CO Amb27211706 [1,0,0,0,0,0|2,0,1]=4 838 B5R0.3 CCN(C)C=O Amb20627285 [1,0,0,0,0,0|3,0,0]=4 839 B5R0.3 CCN(N)C=O Amb24428031 [1,0,0,0,0,0|2,0,0]=3 840 B5R0.3 CC[C@@H](Br)CO Amb27863418 [1,0,0,0,0,0|2,0,1]=4 841 B5R0.3 CC[C@@H](C)C=O Amb27759282 [1,0,0,0,0,0|2,0,0]=3 842 B5R0.3 CC[C@@H](C)CO Amb22799907 [1,0,0,0,0,0|2,0,1]=4 843 B5R0.3 CC[C@@H](N)C#N Amb25024729 [1,0,0,0,0,0|2,0,1]=4 844 B5R0.3 CC[C@@H](N)C#N Amb27949151 [1,0,0,0,0,0|2,0,1]=4 845 B5R0.3 CC[C@@H](N)CF Amb33624248 [1,0,0,0,0,0|2,0,1]=4 846 B5R0.3 CC[C@@H](N)CO Amb3940043 [1,0,0,0,0,0|1,0,1]=3 847 B5R0.3 CC[C@@H](O)CO Amb20241381 [1,0,0,0,0,0|2,0,1]=4 848 B5R0.3 CC[C@H](C)C=O Amb27837733 [1,0,0,0,0,0|2,0,0]=3 849 B5R0.3 CC[C@H](C)CO Amb10844611 [1,0,0,0,0,0|2,0,1]=4 850 B5R0.3 CC[C@H](N)C#N Amb25887559 [1,0,0,0,0,0|2,0,1]=4 851 B5R0.3 CC[C@H](N)C#N Amb26415160 [1,0,0,0,0,0|2,0,1]=4 852 B5R0.3 CC[C@H](N)C=O Amb27460588 [1,0,0,0,0,0|1,0,0]=2 853 B5R0.3 CC[C@H](N)CO Amb3939341 [1,0,0,0,0,0|1,0,1]=3 854 B5R0.3 CC[C@H](O)CO Amb20241380 [1,0,0,0,0,0|2,0,1]=4 855 B5R0.3 CC\C(N)=N/O Amb10609125 [1,0,0,0,0,0|2,0,1]=4 856 B5R0.3 CC\C(N)=N\O Amb1125701 [1,0,0,0,0,0|2,0,1]=4 857 B5R0.3 CC\C(N)=N\O Amb19883708 [1,0,0,0,0,0|2,0,1]=4 858 B5R0.3 CN(C=O)CO Amb27253133 [1,0,0,0,0,0|2,0,0]=3 859 B5R0.3 CNC(C)CO Amb32666213 [1,0,0,0,0,0|3,0,0]=4 860 B5R0.3 CNC(C)CO Amb9359998 [1,0,0,0,0,0|3,0,0]=4 861 B5R0.3 CN[C@@H](C)CO Amb26642150 [1,0,0,0,0,0|3,0,0]=4 862 B5R0.3 CN[C@@H](C)CO Amb32652325 [1,0,0,0,0,0|3,0,0]=4 863 B5R0.3 CN[C@H](C)CO Amb26440136 [1,0,0,0,0,0|3,0,0]=4 864 B5R0.3 CN[C@H](C)CO Amb32652448 [1,0,0,0,0,0|3,0,0]=4 865 B5R0.3 COC(C)C=O Amb27875195 [1,0,0,0,0,0|3,0,0]=4 866 B5R0.3 COC(C)CO Amb19517078 [1,0,0,0,0,0|3,0,0]=4 867 B5R0.3 CO[C@@H](C)C=O Amb28121215 [1,0,0,0,0,0|3,0,0]=4 868 B5R0.3 CO[C@@H](C)CO Amb8515772 [1,0,0,0,0,0|3,0,0]=4 869 B5R0.3 CO[C@H](C)C=O Amb28284155 [1,0,0,0,0,0|3,0,0]=4 870 B5R0.3 CO[C@H](C)CO Amb10603218 [1,0,0,0,0,0|3,0,0]=4 871 B5R0.3 CSC(C)C=O Amb27454927 [1,0,0,0,0,0|3,0,0]=4 872 B5R0.3 CSC(C)CO Amb24438636 [1,0,0,0,0,0|3,0,0]=4 873 B5R0.3 CSC(Cl)C=O Amb27233402 [1,0,0,0,0,0|3,0,0]=4 874 B5R0.3 CSC(F)CO Amb28428675 [1,0,0,0,0,0|3,0,0]=4 875 B5R0.3 C[C@@H](C=O)CBr Amb28200669 [1,0,0,0,0,0|2,0,0]=3 876 B5R0.3 C[C@@H](C=O)CO Amb27455063 [1,0,0,0,0,0|1,0,0]=2 877 B5R0.3 C[C@@H](CO)CBr Amb3940168 [1,0,0,0,0,0|2,0,1]=4 878 B5R0.3 C[C@@H](CO)CF Amb26988889 [1,0,0,0,0,0|2,0,1]=4 879 B5R0.3 C[C@H](CN)CO Amb26065118 [1,0,0,0,0,0|2,0,1]=4 880 B5R0.3 C[C@H](CO)CBr Amb3941664 [1,0,0,0,0,0|2,0,1]=4 881 B5R0.3 C[C@H](CO)CF Amb33738443 [1,0,0,0,0,0|2,0,1]=4 882 B5R0.3 C[C@H](CO)CI Amb28454095 [1,0,0,0,0,0|2,0,1]=4 883 B5R0.3 C\C(=C/Br)CO Amb4014500 [1,0,0,0,0,0|2,0,1]=4 884 B5R0.3 C\C(C=O)=C\O Amb27947285 [1,0,0,0,0,0|1,0,2]=4 885 B5R0.3 C\C=C(/C)CO Amb26998405 [1,0,0,0,0,0|2,0,1]=4 886 B5R0.3 C\C=C(/F)CO Amb22546797 [1,0,0,0,0,0|2,0,1]=4 887 B5R0.3 C\C=C(\Br)CO Amb25809972 [1,0,0,0,0,0|2,0,1]=4 888 B5R0.3 C\C=C(\C)CO Amb26581579 [1,0,0,0,0,0|2,0,1]=4 889 B5R0.3 C\C=C(\F)CO Amb28384940 [1,0,0,0,0,0|2,0,1]=4 890 B5R0.3 N#CC(Cl)C=O Amb21963537 [1,0,0,0,0,0|2,0,1]=4 891 B5R0.3 N#CC(N)CN Amb25250533 [1,0,0,0,0,0|2,0,1]=4 892 B5R0.3 N#CC(N)CN Amb33291351 [1,0,0,0,0,0|2,0,1]=4 893 B5R0.3 N#CC(N)CO Amb19372799 [1,0,0,0,0,0|1,0,1]=3 894 B5R0.3 N#CC(N)CO Amb28555331 [1,0,0,0,0,0|1,0,1]=3 895 B5R0.3 N#C[C@H](N)CO Amb28399707 [1,0,0,0,0,0|1,0,1]=3 896 B5R0.3 N=C(CO)NO Amb21520323 [1,0,0,0,0,0|1,0,2]=4 897 B5R0.3 N=CC(Br)C=O Amb28141456 [1,0,0,0,0,0|2,0,1]=4 898 B5R0.3 NC(C=O)C=O Amb22751007 [1,0,0,0,0,0|0,0,2]=3 899 B5R0.3 NC(C=O)CS Amb27626007 [1,0,0,0,0,0|0,1,0]=2 900 B5R0.3 NC(CF)CF Amb21962647 [1,0,0,0,0,0|2,0,1]=4 901 B5R0.3 NC(CF)CF Amb24053296 [1,0,0,0,0,0|2,0,1]=4 902 B5R0.3 NC(CO)CF Amb20622637 [1,0,0,0,0,0|1,0,1]=3 903 B5R0.3 NC(CO)CF Amb25734803 [1,0,0,0,0,0|1,0,1]=3 904 B5R0.3 NC(CO)CO Amb3939868 [1,0,0,0,0,0|0,0,1]=2 905 B5R0.3 NC(CO)CO Amb8396812 [1,0,0,0,0,0|0,0,1]=2 906 B5R0.3 NC(CS)CS Amb24120335 [1,0,0,0,0,0|0,2,1]=4 907 B5R0.3 NCC(Cl)CO Amb27856087 [1,0,0,0,0,0|2,0,1]=4 908 B5R0.3 NCC(F)CO Amb25968755 [1,0,0,0,0,0|2,0,1]=4 909 B5R0.3 NCC(N)CBr Amb25888055 [1,0,0,0,0,0|2,0,1]=4 910 B5R0.3 NCC(N)CCl Amb24117148 [1,0,0,0,0,0|2,0,1]=4 911 B5R0.3 NCC(N)CN Amb19149260 [1,0,0,0,0,0|2,0,1]=4 912 B5R0.3 NCC(N)CO Amb24117147 [1,0,0,0,0,0|1,0,1]=3 913 B5R0.3 NCC(N)CO Amb33292549 [1,0,0,0,0,0|1,0,1]=3 914 B5R0.3 NCC(N)CS Amb27167387 [1,0,0,0,0,0|1,1,1]=4 915 B5R0.3 NCC(O)CO Amb3940459 [1,0,0,0,0,0|2,0,1]=4 916 B5R0.3 NCC(S)CO Amb27811256 [1,0,0,0,0,0|2,0,1]=4 917 B5R0.3 NC[C@@H](F)CO Amb27199563 [1,0,0,0,0,0|2,0,1]=4 918 B5R0.3 NC[C@@H](N)CO Amb19374894 [1,0,0,0,0,0|1,0,1]=3 919 B5R0.3 NC[C@@H](N)CO Amb32990166 [1,0,0,0,0,0|1,0,1]=3 920 B5R0.3 NC[C@@H](O)CO Amb32992847 [1,0,0,0,0,0|2,0,1]=4 921 B5R0.3 NC[C@@H](O)CO Amb4037015 [1,0,0,0,0,0|2,0,1]=4 922 B5R0.3 NC[C@H](F)C=O Amb27204919 [1,0,0,0,0,0|2,0,0]=3 923 B5R0.3 NC[C@H](F)CO Amb27605560 [1,0,0,0,0,0|2,0,1]=4 924 B5R0.3 NC[C@H](F)CO Amb35751724 [1,0,0,0,0,0|2,0,1]=4 925 B5R0.3 NC[C@H](N)CO Amb26390006 [1,0,0,0,0,0|1,0,1]=3 926 B5R0.3 NC[C@H](N)CO Amb32789590 [1,0,0,0,0,0|1,0,1]=3 927 B5R0.3 NC[C@H](O)CO Amb20670545 [1,0,0,0,0,0|2,0,1]=4 928 B5R0.3 NC[C@H](O)CO Amb8386084 [1,0,0,0,0,0|2,0,1]=4 929 B5R0.3 NC\C(N)=N\O Amb28241447 [1,0,0,0,0,0|2,0,1]=4 930 B5R0.3 N[C@@H](CO)CF Amb33376913 [1,0,0,0,0,0|1,0,1]=3 931 B5R0.3 N[C@H](C=O)CO Amb27170308 [1,0,0,0,0,0|0,0,0]=1 932 B5R0.3 N[C@H](CO)CF Amb33376914 [1,0,0,0,0,0|1,0,1]=3 933 B5R0.3 N[C@H](CO)CF Amb33620306 [1,0,0,0,0,0|1,0,1]=3 934 B5R0.3 N\C(C=O)=C/O Amb28315747 [1,0,0,0,0,0|0,0,2]=3 935 B5R0.3 N\C(CBr)=N\O Amb2695915 [1,0,0,0,0,0|2,0,1]=4 936 B5R0.3 N\C(CCl)=N/O Amb1153811 [1,0,0,0,0,0|2,0,1]=4 937 B5R0.3 N\C(CCl)=N\O Amb2696028 [1,0,0,0,0,0|2,0,1]=4 938 B5R0.3 N\C(CF)=N\O Amb2696615 [1,0,0,0,0,0|2,0,1]=4 939 B5R0.3 N\C(CO)=N\O Amb2695931 [1,0,0,0,0,0|1,0,1]=3 940 B5R0.3 O=C(CO)CO Amb6600007 [1,0,0,0,0,0|1,0,2]=4 941 B5R0.3 O=C(CO)NO Amb27596845 [1,0,0,0,0,0|2,0,1]=4 942 B5R0.3 O=CC(=O)CO Amb17593031 [1,0,0,0,0,0|1,0,1]=3 943 B5R0.3 O=CC(Br)C=O Amb2455922 [1,0,0,0,0,0|1,0,2]=4 944 B5R0.3 O=CC(Br)CBr Amb17670591 [1,0,0,0,0,0|2,0,0]=3 945 B5R0.3 O=CC(Br)CCl Amb18647566 [1,0,0,0,0,0|2,0,0]=3 946 B5R0.3 O=CC(Cl)C=O Amb8515721 [1,0,0,0,0,0|1,0,2]=4 947 B5R0.3 O=CC(Cl)CO Amb17593122 [1,0,0,0,0,0|1,0,0]=2 948 B5R0.3 O=CC(F)C=O Amb22230729 [1,0,0,0,0,0|1,0,2]=4 949 B5R0.3 O=CC(F)CF Amb28051572 [1,0,0,0,0,0|2,0,0]=3 950 B5R0.3 O=CC(F)CO Amb28043006 [1,0,0,0,0,0|1,0,0]=2 951 B5R0.3 O=CC(I)C=O Amb24548139 [1,0,0,0,0,0|1,0,2]=4 952 B5R0.3 O=CC(O)C=O Amb17615780 [1,0,0,0,0,0|1,0,2]=4 953 B5R0.3 O=CC(O)CO Amb3940759 [1,0,0,0,0,0|1,0,0]=2 954 B5R0.3 O=CC(S)CO Amb4020723 [1,0,0,0,0,0|1,0,0]=2 955 B5R0.3 O=C[C@@H](O)CF Amb28247090 [1,0,0,0,0,0|2,0,0]=3 956 B5R0.3 O=C[C@@H](O)CO Amb16232009 [1,0,0,0,0,0|1,0,0]=2 957 B5R0.3 O=C[C@H](O)CO Amb20242417 [1,0,0,0,0,0|1,0,0]=2 958 B5R0.3 O=C\C(Br)=C/O Amb24333812 [1,0,0,0,0,0|1,0,2]=4 959 B5R0.3 O=C\C(Br)=C\O Amb24478132 [1,0,0,0,0,0|1,0,2]=4 960 B5R0.3 O=C\C(Cl)=N\O Amb27622504 [1,0,0,0,0,0|2,0,1]=4 961 B5R0.3 O=C\C(F)=C/O Amb27251562 [1,0,0,0,0,0|1,0,2]=4 962 B5R0.3 O=C\C(O)=C\O Amb27863726 [1,0,0,0,0,0|1,0,2]=4 963 B5R0.3 O=NC(Cl)CO Amb27232983 [1,0,0,0,0,0|2,0,0]=3 964 B5R0.3 OCC(Br)CBr Amb10070836 [1,0,0,0,0,0|2,0,1]=4 965 B5R0.3 OCC(Cl)CBr Amb28245340 [1,0,0,0,0,0|2,0,1]=4 966 B5R0.3 OCC(Cl)CCl Amb8516465 [1,0,0,0,0,0|2,0,1]=4 967 B5R0.3 OCC(Cl)CF Amb21951908 [1,0,0,0,0,0|2,0,1]=4 968 B5R0.3 OCC(Cl)CO Amb17611073 [1,0,0,0,0,0|1,0,1]=3 969 B5R0.3 OCC(Cl)CS Amb17593329 [1,0,0,0,0,0|1,1,1]=4 970 B5R0.3 OCC(F)CBr Amb24061909 [1,0,0,0,0,0|2,0,1]=4 971 B5R0.3 OCC(F)CF Amb25344040 [1,0,0,0,0,0|2,0,1]=4 972 B5R0.3 OCC(F)CO Amb25918777 [1,0,0,0,0,0|1,0,1]=3 973 B5R0.3 OCC(O)CBr Amb8514407 [1,0,0,0,0,0|2,0,1]=4 974 B5R0.3 OCC(O)CCl Amb9702856 [1,0,0,0,0,0|2,0,1]=4 975 B5R0.3 OCC(O)CF Amb21961974 [1,0,0,0,0,0|2,0,1]=4 976 B5R0.3 OCC(O)CI Amb22055356 [1,0,0,0,0,0|2,0,1]=4 977 B5R0.3 OCC(O)CO Amb33719574 [1,0,0,0,0,0|1,0,1]=3 978 B5R0.3 OCC(O)CO Amb6608790 [1,0,0,0,0,0|1,0,1]=3 979 B5R0.3 OCC(O)CS Amb8395100 [1,0,0,0,0,0|1,1,1]=4 980 B5R0.3 OCC(S)CO Amb28321614 [1,0,0,0,0,0|1,0,1]=3 981 B5R0.3 OCC(S)CS Amb8513135 [1,0,0,0,0,0|1,1,1]=4 982 B5R0.3 OC[C@@H](O)CBr Amb22225154 [1,0,0,0,0,0|2,0,1]=4 983 B5R0.3 OC[C@@H](O)CCl Amb8396605 [1,0,0,0,0,0|2,0,1]=4 984 B5R0.3 OC[C@@H](O)CF Amb23401456 [1,0,0,0,0,0|2,0,1]=4 985 B5R0.3 OC[C@@H](O)CS Amb25943783 [1,0,0,0,0,0|1,1,1]=4 986 B5R0.3 OC[C@@H](S)CS Amb26887679 [1,0,0,0,0,0|1,1,1]=4 987 B5R0.3 OC[C@H](O)CBr Amb22226653 [1,0,0,0,0,0|2,0,1]=4 988 B5R0.3 OC[C@H](O)CCl Amb8389332 [1,0,0,0,0,0|2,0,1]=4 989 B5R0.3 OC[C@H](O)CF Amb28045026 [1,0,0,0,0,0|2,0,1]=4 990 B5R0.3 OC[C@H](O)CS Amb26635114 [1,0,0,0,0,0|1,1,1]=4 991 B5R0.3 OC[C@H](S)CS Amb26487293 [1,0,0,0,0,0|1,1,1]=4 992 B5R0.3 OC\C(Br)=C\Br Amb22348400 [1,0,0,0,0,0|2,0,1]=4 993 B5R0.3 OC\C(F)=C\F Amb27662411 [1,0,0,0,0,0|2,0,1]=4 994 B5R0.5 C=C(Br)C(=O)O Amb20620403 [1,0,0,0,0,0|1,0,2]=4 995 B5R0.5 C=C(Br)C(C)C Amb22583736 [1,0,0,0,0,0|3,0,0]=4 996 B5R0.5 C=C(C)C(=O)Cl Amb534203 [1,0,0,0,0,0|2,0,1]=4 997 B5R0.5 C=C(C)C(=O)O Amb6608998 [1,0,0,0,0,0|1,0,1]=3 998 B5R0.5 C=C(C)C(C)=O Amb17593021 [1,0,0,0,0,0|2,0,1]=4 999 B5R0.5 C=C(C)C(C)C Amb8513830 [1,0,0,0,0,0|3,0,0]=4 1000 B5R0.5 C=C(C)C(C)Cl Amb24407204 [1,0,0,0,0,0|3,0,0]=4 1001 B5R0.5 C=C(C)C(C)O Amb28282626 [1,0,0,0,0,0|3,0,0]=4 1002 B5R0.5 C=C(C)C(N)=O Amb6609019 [1,0,0,0,0,0|2,0,1]=4 1003 B5R0.5 C=C(C)[C@@H](C)N Amb33199904 [1,0,0,0,0,0|2,0,0]=3 1004 B5R0.5 C=C(C)[C@@H](C)O Amb25834912 [1,0,0,0,0,0|3,0,0]=4 1005 B5R0.5 C=C(C)[C@H](C)N Amb33199903 [1,0,0,0,0,0|2,0,0]=3 1006 B5R0.5 C=C(C)[C@H](C)O Amb25294556 [1,0,0,0,0,0|3,0,0]=4 1007 B5R0.5 C=C(Cl)C(=O)O Amb17933971 [1,0,0,0,0,0|1,0,2]=4 1008 B5R0.5 C=C(Cl)C(C)Cl Amb27400335 [1,0,0,0,0,0|3,0,0]=4 1009 B5R0.5 C=C(F)C(=O)O Amb2688008 [1,0,0,0,0,0|1,0,2]=4 1010 B5R0.5 C=C(F)C(C)Br Amb27212987 [1,0,0,0,0,0|3,0,0]=4 1011 B5R0.5 CC(=N)N(C)N Amb27457767 [1,0,0,0,0,0|3,0,0]=4 1012 B5R0.5 CC(=O)C(=N)N Amb24409561 [1,0,0,0,0,0|2,0,1]=4 1013 B5R0.5 CC(=O)C(=O)Cl Amb17593107 [1,0,0,0,0,0|2,0,1]=4 1014 B5R0.5 CC(=O)C(=O)O Amb932807 [1,0,0,0,0,0|1,0,1]=3 1015 B5R0.5 CC(=O)C(=O)[O-] Amb22043412 [1,0,0,0,0,0|1,0,2]=4 1016 B5R0.5 CC(=O)C(C)=O Amb6608675 [1,0,0,0,0,0|2,0,1]=4 1017 B5R0.5 CC(=O)C(C)=S Amb27632834 [1,0,0,0,0,0|2,0,1]=4 1018 B5R0.5 CC(=O)C(C)Br Amb8384405 [1,0,0,0,0,0|2,0,0]=3 1019 B5R0.5 CC(=O)C(C)C Amb4605987 [1,0,0,0,0,0|2,0,0]=3 1020 B5R0.5 CC(=O)C(C)Cl Amb9702838 [1,0,0,0,0,0|2,0,0]=3 1021 B5R0.5 CC(=O)C(C)F Amb10841897 [1,0,0,0,0,0|2,0,0]=3 1022 B5R0.5 CC(=O)C(C)I Amb28315734 [1,0,0,0,0,0|2,0,0]=3 1023 B5R0.5 CC(=O)C(C)N Amb17593029 [1,0,0,0,0,0|1,0,0]=2 1024 B5R0.5 CC(=O)C(C)N Amb19148817 [1,0,0,0,0,0|1,0,0]=2 1025 B5R0.5 CC(=O)C(C)O Amb6608962 [1,0,0,0,0,0|2,0,0]=3 1026 B5R0.5 CC(=O)C(C)S Amb8393169 [1,0,0,0,0,0|2,0,0]=3 1027 B5R0.5 CC(=O)C(Cl)Cl Amb6608776 [1,0,0,0,0,0|3,0,0]=4 1028 B5R0.5 CC(=O)C(F)Br Amb27165279 [1,0,0,0,0,0|3,0,0]=4 1029 B5R0.5 CC(=O)C(F)F Amb6888584 [1,0,0,0,0,0|3,0,0]=4 1030 B5R0.5 CC(=O)C(N)=O Amb17593028 [1,0,0,0,0,0|1,0,2]=4 1031 B5R0.5 CC(=O)C(N)=S Amb33528965 [1,0,0,0,0,0|1,1,1]=4 1032 B5R0.5 CC(=O)C(O)O Amb22436762 [1,0,0,0,0,0|2,0,0]=3 1033 B5R0.5 CC(=O)N(C)C Amb24323347 [1,0,0,0,0,0|3,0,0]=4 1034 B5R0.5 CC(=O)N(C)C Amb2793066 [1,0,0,0,0,0|3,0,0]=4 1035 B5R0.5 CC(=O)N(C)N Amb17593037 [1,0,0,0,0,0|2,0,0]=3 1036 B5R0.5 CC(=O)N(C)O Amb24066817 [1,0,0,0,0,0|3,0,0]=4 1037 B5R0.5 CC(=O)[C@@H](C)N Amb22748924 [1,0,0,0,0,0|1,0,0]=2 1038 B5R0.5 CC(=O)[C@H](C)N Amb26418661 [1,0,0,0,0,0|1,0,0]=2 1039 B5R0.5 CC(=S)C(=O)O Amb27424126 [1,0,0,0,0,0|1,0,1]=3 1040 B5R0.5 CC(Br)C(=O)Br Amb7969424 [1,0,0,0,0,0|2,0,0]=3 1041 B5R0.5 CC(Br)C(=O)Cl Amb6296592 [1,0,0,0,0,0|2,0,0]=3 1042 B5R0.5 CC(Br)C(=O)O Amb2795764 [1,0,0,0,0,0|1,0,0]=2 1043 B5R0.5 CC(Br)C(N)=O Amb2779903 [1,0,0,0,0,0|2,0,0]=3 1044 B5R0.5 CC(Br)C(N)=S Amb27971550 [1,0,0,0,0,0|2,1,0]=4 1045 B5R0.5 CC(C)B(O)O Amb2447044 [1,0,0,0,0,0|2,0,1]=4 1046 B5R0.5 CC(C)C(=N)N Amb2695035 [1,0,0,0,0,0|3,0,0]=4 1047 B5R0.5 CC(C)C(=N)N Amb2725173 [1,0,0,0,0,0|3,0,0]=4 1048 B5R0.5 CC(C)C(=O)Br Amb22731066 [1,0,0,0,0,0|2,0,0]=3 1049 B5R0.5 CC(C)C(=O)Cl Amb3939052 [1,0,0,0,0,0|2,0,0]=3 1050 B5R0.5 CC(C)C(=O)F Amb25848493 [1,0,0,0,0,0|2,0,0]=3 1051 B5R0.5 CC(C)C(=O)I Amb26992316 [1,0,0,0,0,0|2,0,0]=3 1052 B5R0.5 CC(C)C(=O)O Amb3939822 [1,0,0,0,0,0|1,0,0]=2 1053 B5R0.5 CC(C)C(=O)S Amb33482574 [1,0,0,0,0,0|1,1,0]=3 1054 B5R0.5 CC(C)C(C)N Amb3939835 [1,0,0,0,0,0|2,0,1]=4 1055 B5R0.5 CC(C)C(C)O Amb9748261 [1,0,0,0,0,0|2,0,1]=4 1056 B5R0.5 CC(C)C(N)=O Amb1153145 [1,0,0,0,0,0|2,0,0]=3 1057 B5R0.5 CC(C)C(N)=S Amb6242688 [1,0,0,0,0,0|2,1,0]=4 1058 B5R0.5 CC(C)N(=O)=O Amb8395293 [1,0,0,0,0,0|2,0,1]=4 1059 B5R0.5 CC(C)N(=O)O Amb33789630 [1,0,0,0,0,0|2,0,0]=3 1060 B5R0.5 CC(C)S(=O)Cl Amb27859539 [1,0,0,0,0,0|3,0,0]=4 1061 B5R0.5 CC(C)S(=O)O Amb27245066 [1,0,0,0,0,0|2,0,0]=3 1062 B5R0.5 CC(C)S(=O)[O-] Amb19929129 [1,0,0,0,0,0|2,0,1]=4 1063 B5R0.5 CC(C)S(N)=O Amb25675545 [1,0,0,0,0,0|3,0,0]=4 1064 B5R0.5 CC(C)[C@@H](C)N Amb10844612 [1,0,0,0,0,0|2,0,1]=4 1065 B5R0.5 CC(C)[C@@H](C)N Amb30628646 [1,0,0,0,0,0|2,0,1]=4 1066 B5R0.5 CC(C)[C@@H](C)O Amb13952942 [1,0,0,0,0,0|2,0,1]=4 1067 B5R0.5 CC(C)[C@H](C)N Amb3939620 [1,0,0,0,0,0|2,0,1]=4 1068 B5R0.5 CC(C)[C@H](C)O Amb6366846 [1,0,0,0,0,0|2,0,1]=4 1069 B5R0.5 CC(C)[N+](=O)[O-] Amb6608812 [1,0,0,0,0,0|2,0,1]=4 1070 B5R0.5 CC(Cl)B(O)O Amb28076848 [1,0,0,0,0,0|2,0,1]=4 1071 B5R0.5 CC(Cl)C(=N)Cl Amb27401849 [1,0,0,0,0,0|3,0,0]=4 1072 B5R0.5 CC(Cl)C(=N)N Amb20622290 [1,0,0,0,0,0|3,0,0]=4 1073 B5R0.5 CC(Cl)C(=N)N Amb4297060 [1,0,0,0,0,0|3,0,0]=4 1074 B5R0.5 CC(Cl)C(=O)Cl Amb9703139 [1,0,0,0,0,0|2,0,0]=3 1075 B5R0.5 CC(Cl)C(=O)F Amb27863699 [1,0,0,0,0,0|2,0,0]=3 1076 B5R0.5 CC(Cl)C(=O)O Amb3940363 [1,0,0,0,0,0|1,0,0]=2 1077 B5R0.5 CC(Cl)C(N)=O Amb9745753 [1,0,0,0,0,0|2,0,0]=3 1078 B5R0.5 CC(Cl)C(N)=S Amb33328367 [1,0,0,0,0,0|2,1,0]=4 1079 B5R0.5 CC(Cl)C(O)Cl Amb28239766 [1,0,0,0,0,0|2,0,1]=4 1080 B5R0.5 CC(Cl)S(=O)Cl Amb24442859 [1,0,0,0,0,0|3,0,0]=4 1081 B5R0.5 CC(Cl)S(=O)O Amb27983761 [1,0,0,0,0,0|2,0,0]=3 1082 B5R0.5 CC(Cl)S(=O)[O-] Amb32754760 [1,0,0,0,0,0|2,0,1]=4 1083 B5R0.5 CC(Cl)S(N)=O Amb32720330 [1,0,0,0,0,0|3,0,0]=4 1084 B5R0.5 CC(Cl)[N+](=O)[O-] Amb22732426 [1,0,0,0,0,0|2,0,1]=4 1085 B5R0.5 CC(Cl)[SH](=O)=O Amb27425039 [1,0,0,0,0,0|2,0,1]=4 1086 B5R0.5 CC(F)C(=N)N Amb32455979 [1,0,0,0,0,0|3,0,0]=4 1087 B5R0.5 CC(F)C(=O)O Amb10605770 [1,0,0,0,0,0|1,0,0]=2 1088 B5R0.5 CC(F)C(N)=O Amb28248497 [1,0,0,0,0,0|2,0,0]=3 1089 B5R0.5 CC(I)C(=O)O Amb26450528 [1,0,0,0,0,0|1,0,0]=2 1090 B5R0.5 CC(I)C(N)=O Amb25684673 [1,0,0,0,0,0|2,0,0]=3 1091 B5R0.5 CC(N)B(O)O Amb25844423 [1,0,0,0,0,0|1,0,1]=3 1092 B5R0.5 CC(N)C(=O)O Amb32724352 [1,0,0,0,0,0|0,0,0]=1 1093 B5R0.5 CC(N)C(=O)O Amb5716847 [1,0,0,0,0,0|0,0,0]=1 1094 B5R0.5 CC(N)C(=O)S Amb27175379 [1,0,0,0,0,0|0,1,0]=2 1095 B5R0.5 CC(N)C(C)Br Amb24474359 [1,0,0,0,0,0|2,0,1]=4 1096 B5R0.5 CC(N)C(C)Br Amb32667597 [1,0,0,0,0,0|2,0,1]=4 1097 B5R0.5 CC(N)C(C)F Amb28434496 [1,0,0,0,0,0|2,0,1]=4 1098 B5R0.5 CC(N)C(C)N Amb22330596 [1,0,0,0,0,0|2,0,1]=4 1099 B5R0.5 CC(N)C(C)N Amb33473133 [1,0,0,0,0,0|2,0,1]=4 1100 B5R0.5 CC(N)C(C)O Amb33801453 [1,0,0,0,0,0|1,0,1]=3 1101 B5R0.5 CC(N)C(C)O Amb8630303 [1,0,0,0,0,0|1,0,1]=3 1102 B5R0.5 CC(N)C(C)S Amb27447203 [1,0,0,0,0,0|1,1,1]=4 1103 B5R0.5 CC(N)C(Cl)Cl Amb27961489 [1,0,0,0,0,0|2,0,1]=4 1104 B5R0.5 CC(N)C(F)F Amb19148014 [1,0,0,0,0,0|2,0,1]=4 1105 B5R0.5 CC(N)C(F)F Amb20622283 [1,0,0,0,0,0|2,0,1]=4 1106 B5R0.5 CC(N)C(N)=O Amb21958673 [1,0,0,0,0,0|1,0,0]=2 1107 B5R0.5 CC(N)C(N)=O Amb33532935 [1,0,0,0,0,0|1,0,0]=2 1108 B5R0.5 CC(N)C(N)=S Amb19374914 [1,0,0,0,0,0|1,1,0]=3 1109 B5R0.5 CC(N)C(N)=S Amb33527239 [1,0,0,0,0,0|1,1,0]=3 1110 B5R0.5 CC(O)C(=N)N Amb22587521 [1,0,0,0,0,0|3,0,0]=4 1111 B5R0.5 CC(O)C(=N)N Amb2696133 [1,0,0,0,0,0|3,0,0]=4 1112 B5R0.5 CC(O)C(=O)O Amb9703100 [1,0,0,0,0,0|1,0,0]=2 1113 B5R0.5 CC(O)C(=O)[O-] Amb3499440 [1,0,0,0,0,0|1,0,1]=3 1114 B5R0.5 CC(O)C(=O)[O-] Amb9787591 [1,0,0,0,0,0|1,0,1]=3 1115 B5R0.5 CC(O)C(C)Br Amb17593818 [1,0,0,0,0,0|2,0,1]=4 1116 B5R0.5 CC(O)C(C)Cl Amb4036583 [1,0,0,0,0,0|2,0,1]=4 1117 B5R0.5 CC(O)C(C)O Amb8515777 [1,0,0,0,0,0|2,0,1]=4 1118 B5R0.5 CC(O)C(C)S Amb8393167 [1,0,0,0,0,0|2,0,1]=4 1119 B5R0.5 CC(O)C(N)=O Amb6394657 [1,0,0,0,0,0|2,0,0]=3 1120 B5R0.5 CC(O)C(N)O Amb28341329 [1,0,0,0,0,0|1,0,1]=3 1121 B5R0.5 CC(O)C(O)[SiH3] Amb27219045 [1,0,0,0,0,0|2,0,1]=4 1122 B5R0.5 CC(O)[C@@H](C)N Amb30010753 [1,0,0,0,0,0|1,0,1]=3 1123 B5R0.5 CC(O)[C@H](C)N Amb35713820 [1,0,0,0,0,0|1,0,1]=3 1124 B5R0.5 CC(S)C(=O)O Amb6608753 [1,0,0,0,0,0|1,0,0]=2 1125 B5R0.5 CN(C)C(=O)Cl Amb2793056 [1,0,0,0,0,0|3,0,0]=4 1126 B5R0.5 CN(C)C(=O)O Amb22348477 [1,0,0,0,0,0|2,0,0]=3 1127 B5R0.5 CN(C)C(N)=O Amb2604398 [1,0,0,0,0,0|3,0,0]=4 1128 B5R0.5 CN(N)C(=N)N Amb10552372 [1,0,0,0,0,0|3,0,0]=4 1129 B5R0.5 CN(N)C(=N)N Amb27595677 [1,0,0,0,0,0|3,0,0]=4 1130 B5R0.5 CN(N)C(=S)S Amb27856316 [1,0,0,0,0,0|1,2,0]=4 1131 B5R0.5 CN(N)C(N)=O Amb27167382 [1,0,0,0,0,0|2,0,0]=3 1132 B5R0.5 CN(N)C(N)=S Amb6298790 [1,0,0,0,0,0|2,1,0]=4 1133 B5R0.5 C[C@@H](Br)C(=O)Br Amb27455066 [1,0,0,0,0,0|2,0,0]=3 1134 B5R0.5 C[C@@H](Br)C(=O)Cl Amb26395930 [1,0,0,0,0,0|2,0,0]=3 1135 B5R0.5 C[C@@H](Br)C(=O)O Amb8515030 [1,0,0,0,0,0|1,0,0]=2 1136 B5R0.5 C[C@@H](Cl)C(=O)Cl Amb28140701 [1,0,0,0,0,0|2,0,0]=3 1137 B5R0.5 C[C@@H](Cl)C(=O)O Amb2725594 [1,0,0,0,0,0|1,0,0]=2 1138 B5R0.5 C[C@@H](Cl)S(=O)Cl Amb27632477 [1,0,0,0,0,0|3,0,0]=4 1139 B5R0.5 C[C@@H](I)C(=O)O Amb27878762 [1,0,0,0,0,0|1,0,0]=2 1140 B5R0.5 C[C@@H](I)C(N)=O Amb27863419 [1,0,0,0,0,0|2,0,0]=3 1141 B5R0.5 C[C@@H](N)B(O)O Amb27662188 [1,0,0,0,0,0|1,0,1]=3 1142 B5R0.5 C[C@@H](N)C(=O)O Amb3940457 [1,0,0,0,0,0|0,0,0]=1 1143 B5R0.5 C[C@@H](N)C(F)F Amb25198521 [1,0,0,0,0,0|2,0,1]=4 1144 B5R0.5 C[C@@H](N)C(F)F Amb33743447 [1,0,0,0,0,0|2,0,1]=4 1145 B5R0.5 C[C@@H](N)C(N)=O Amb2371905 [1,0,0,0,0,0|1,0,0]=2 1146 B5R0.5 C[C@@H](N)C(N)=O Amb2778751 [1,0,0,0,0,0|1,0,0]=2 1147 B5R0.5 C[C@@H](N)[C@@H](C)N Amb22800310 [1,0,0,0,0,0|2,0,1]=4 1148 B5R0.5 C[C@@H](N)[C@@H](C)O Amb26068187 [1,0,0,0,0,0|1,0,1]=3 1149 B5R0.5 C[C@@H](O)C(=N)N Amb22587056 [1,0,0,0,0,0|3,0,0]=4 1150 B5R0.5 C[C@@H](O)C(=N)N Amb8630521 [1,0,0,0,0,0|3,0,0]=4 1151 B5R0.5 C[C@@H](O)C(=O)Cl Amb28350419 [1,0,0,0,0,0|2,0,0]=3 1152 B5R0.5 C[C@@H](O)C(=O)O Amb6600026 [1,0,0,0,0,0|1,0,0]=2 1153 B5R0.5 C[C@@H](O)C(=O)[O-] Amb22350432 [1,0,0,0,0,0|1,0,1]=3 1154 B5R0.5 C[C@@H](O)C(=O)[O-] Amb8514494 [1,0,0,0,0,0|1,0,1]=3 1155 B5R0.5 C[C@@H](O)C(N)=O Amb3939680 [1,0,0,0,0,0|2,0,0]=3 1156 B5R0.5 C[C@@H](O)[C@@H](C)Br Amb28144209 [1,0,0,0,0,0|2,0,1]=4 1157 B5R0.5 C[C@@H](O)[C@@H](C)O Amb8514566 [1,0,0,0,0,0|2,0,1]=4 1158 B5R0.5 C[C@H](Br)C(=O)O Amb8515029 [1,0,0,0,0,0|1,0,0]=2 1159 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [1,0,0,0,0,0|2,0,0]=3 1160 B5R0.5 C[C@H](Cl)C(=O)F Amb28138044 [1,0,0,0,0,0|2,0,0]=3 1161 B5R0.5 C[C@H](Cl)C(=O)O Amb17776586 [1,0,0,0,0,0|1,0,0]=2 1162 B5R0.5 C[C@H](Cl)[C@@H](C)N Amb28401487 [1,0,0,0,0,0|2,0,1]=4 1163 B5R0.5 C[C@H](F)C(=O)O Amb27216697 [1,0,0,0,0,0|1,0,0]=2 1164 B5R0.5 C[C@H](F)[C@@H](C)O Amb27256100 [1,0,0,0,0,0|2,0,1]=4 1165 B5R0.5 C[C@H](N)C(=O)O Amb33780861 [1,0,0,0,0,0|0,0,0]=1 1166 B5R0.5 C[C@H](N)C(=O)O Amb6298336 [1,0,0,0,0,0|0,0,0]=1 1167 B5R0.5 C[C@H](N)C(=O)S Amb28315892 [1,0,0,0,0,0|0,1,0]=2 1168 B5R0.5 C[C@H](N)C(F)F Amb33337857 [1,0,0,0,0,0|2,0,1]=4 1169 B5R0.5 C[C@H](N)C(F)F Amb33803878 [1,0,0,0,0,0|2,0,1]=4 1170 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [1,0,0,0,0,0|1,0,0]=2 1171 B5R0.5 C[C@H](N)C(N)=O Amb2371522 [1,0,0,0,0,0|1,0,0]=2 1172 B5R0.5 C[C@H](N)C(N)=O Amb2778752 [1,0,0,0,0,0|1,0,0]=2 1173 B5R0.5 C[C@H](N)C(N)=O Amb33822632 [1,0,0,0,0,0|1,0,0]=2 1174 B5R0.5 C[C@H](N)[C@@H](C)Br Amb27774580 [1,0,0,0,0,0|2,0,1]=4 1175 B5R0.5 C[C@H](N)[C@H](C)O Amb28126703 [1,0,0,0,0,0|1,0,1]=3 1176 B5R0.5 C[C@H](N)[C@H](C)O Amb35789596 [1,0,0,0,0,0|1,0,1]=3 1177 B5R0.5 C[C@H](O)C(=N)N Amb22587541 [1,0,0,0,0,0|3,0,0]=4 1178 B5R0.5 C[C@H](O)C(=N)N Amb34912477 [1,0,0,0,0,0|3,0,0]=4 1179 B5R0.5 C[C@H](O)C(=O)O Amb8386374 [1,0,0,0,0,0|1,0,0]=2 1180 B5R0.5 C[C@H](O)C(=O)[O-] Amb17772234 [1,0,0,0,0,0|1,0,1]=3 1181 B5R0.5 C[C@H](O)C(=O)[O-] Amb8515200 [1,0,0,0,0,0|1,0,1]=3 1182 B5R0.5 C[C@H](O)C(N)=O Amb3939676 [1,0,0,0,0,0|2,0,0]=3 1183 B5R0.5 C[C@H](O)C(O)O Amb27394850 [1,0,0,0,0,0|1,0,2]=4 1184 B5R0.5 C[C@H](O)[C@@H](C)Br Amb27865467 [1,0,0,0,0,0|2,0,1]=4 1185 B5R0.5 C[C@H](O)[C@H](C)O Amb8393638 [1,0,0,0,0,0|2,0,1]=4 1186 B5R0.5 C[C@H](O)[C@H](N)O Amb28066298 [1,0,0,0,0,0|1,0,1]=3 1187 B5R0.5 C[C@H](S)C(=O)O Amb25147510 [1,0,0,0,0,0|1,0,0]=2 1188 B5R0.5 C[N+](N)=C(N)N Amb33421923 [1,0,0,0,0,0|3,0,0]=4 1189 B5R0.5 N=C(N)S(=O)O Amb6600572 [1,0,0,0,0,0|2,0,1]=4 1190 B5R0.5 N=C(S)C(=O)O Amb18640468 [1,0,0,0,0,0|0,1,2]=4 1191 B5R0.5 NC(=O)C(=O)O Amb32666615 [1,0,0,0,0,0|0,0,2]=3 1192 B5R0.5 NC(=O)C(=O)O Amb3940455 [1,0,0,0,0,0|0,0,2]=3 1193 B5R0.5 NC(=O)C(=O)[O-] Amb22053860 [1,0,0,0,0,0|0,0,3]=4 1194 B5R0.5 NC(=O)C(=O)[O-] Amb22730546 [1,0,0,0,0,0|0,0,3]=4 1195 B5R0.5 NC(=O)C(Br)Br Amb3986938 [1,0,0,0,0,0|3,0,0]=4 1196 B5R0.5 NC(=O)C(Cl)Br Amb25288934 [1,0,0,0,0,0|3,0,0]=4 1197 B5R0.5 NC(=O)C(Cl)Cl Amb3886544 [1,0,0,0,0,0|3,0,0]=4 1198 B5R0.5 NC(=O)C(F)Br Amb10841902 [1,0,0,0,0,0|3,0,0]=4 1199 B5R0.5 NC(=O)C(F)Cl Amb10839936 [1,0,0,0,0,0|3,0,0]=4 1200 B5R0.5 NC(=O)C(F)F Amb2222272 [1,0,0,0,0,0|3,0,0]=4 1201 B5R0.5 NC(=O)C(F)I Amb10840454 [1,0,0,0,0,0|3,0,0]=4 1202 B5R0.5 NC(=O)C(N)=O Amb3886526 [1,0,0,0,0,0|1,0,2]=4 1203 B5R0.5 NC(Br)C(=O)O Amb25724348 [1,0,0,0,0,0|1,0,0]=2 1204 B5R0.5 NC(O)C(=O)O Amb24663706 [1,0,0,0,0,0|0,0,0]=1 1205 B5R0.5 NC(S)C(=O)O Amb27253385 [1,0,0,0,0,0|0,1,0]=2 1206 B5R0.5 N[C@@H](S)C(=O)O Amb27788398 [1,0,0,0,0,0|0,1,0]=2 1207 B5R0.5 O=C(Cl)C(Cl)Br Amb27392287 [1,0,0,0,0,0|3,0,0]=4 1208 B5R0.5 O=C(Cl)C(Cl)Cl Amb3940248 [1,0,0,0,0,0|3,0,0]=4 1209 B5R0.5 O=C(Cl)C(F)Cl Amb10839908 [1,0,0,0,0,0|3,0,0]=4 1210 B5R0.5 O=C(Cl)C(F)F Amb10841735 [1,0,0,0,0,0|3,0,0]=4 1211 B5R0.5 O=C(F)C(Cl)Cl Amb28049292 [1,0,0,0,0,0|3,0,0]=4 1212 B5R0.5 O=C(F)C(F)Cl Amb10839909 [1,0,0,0,0,0|3,0,0]=4 1213 B5R0.5 O=C(F)C(F)F Amb10845766 [1,0,0,0,0,0|3,0,0]=4 1214 B5R0.5 O=C(O)C(=O)Br Amb27863598 [1,0,0,0,0,0|1,0,2]=4 1215 B5R0.5 O=C(O)C(=O)O Amb10608980 [1,0,0,0,0,0|1,0,1]=3 1216 B5R0.5 O=C(O)C(=O)O Amb19374136 [1,0,0,0,0,0|1,0,1]=3 1217 B5R0.5 O=C(O)C(=O)O Amb22231343 [1,0,0,0,0,0|1,0,1]=3 1218 B5R0.5 O=C(O)C(=O)O Amb22394874 [1,0,0,0,0,0|1,0,1]=3 1219 B5R0.5 O=C(O)C(=O)O Amb22436461 [1,0,0,0,0,0|1,0,1]=3 1220 B5R0.5 O=C(O)C(=O)O Amb7755827 [1,0,0,0,0,0|1,0,1]=3 1221 B5R0.5 O=C(O)C(=O)O Amb8513282 [1,0,0,0,0,0|1,0,1]=3 1222 B5R0.5 O=C(O)C(Br)I Amb17610018 [1,0,0,0,0,0|2,0,0]=3 1223 B5R0.5 O=C(O)C(Cl)Cl Amb6891960 [1,0,0,0,0,0|2,0,0]=3 1224 B5R0.5 O=C(O)C(Cl)I Amb17610937 [1,0,0,0,0,0|2,0,0]=3 1225 B5R0.5 O=C(O)C(F)Br Amb10841090 [1,0,0,0,0,0|2,0,0]=3 1226 B5R0.5 O=C(O)C(F)Cl Amb10838714 [1,0,0,0,0,0|2,0,0]=3 1227 B5R0.5 O=C(O)C(F)F Amb1953492 [1,0,0,0,0,0|2,0,0]=3 1228 B5R0.5 O=C(O)C(F)I Amb10838458 [1,0,0,0,0,0|2,0,0]=3 1229 B5R0.5 O=C(O)C(I)I Amb17612865 [1,0,0,0,0,0|2,0,0]=3 1230 B5R0.5 O=C(O)C(O)O Amb6608986 [1,0,0,0,0,0|1,0,0]=2 1231 B5R0.5 O=C(O)[C@@H](F)Cl Amb26559563 [1,0,0,0,0,0|2,0,0]=3 1232 B5R0.5 O=C(O)[C@@H](F)I Amb27827825 [1,0,0,0,0,0|2,0,0]=3 1233 B5R0.5 O=C(O)[C@H](F)Br Amb28200717 [1,0,0,0,0,0|2,0,0]=3 1234 B5R0.5 O=C([O-])C(Cl)Cl Amb8515937 [1,0,0,0,0,0|2,0,1]=4 1235 B5R0.5 O=C([O-])C(O)O Amb33512886 [1,0,0,0,0,0|1,0,1]=3 1236 B5R0.5 O=S(O)C(F)F Amb25756691 [1,0,0,0,0,0|3,0,0]=4 1237 B5R0.5 OC(Cl)C(O)Cl Amb28436904 [1,0,0,0,0,0|2,0,1]=4 1238 B7R0.5 C#CCC(=O)C(=O)O Amb27601316 [0,1,0,0,0,0|2,0,1]=4 1239 B7R0.5 C#CCC(C)C(=O)O Amb18633959 [0,1,0,0,0,0|2,0,0]=3 1240 B7R0.5 C#CCC(C)C(C)=O Amb27465169 [0,1,0,0,0,0|3,0,0]=4 1241 B7R0.5 C#CCC(F)C(C)=O Amb28249962 [0,1,0,0,0,0|3,0,0]=4 1242 B7R0.5 C#CCC(N)C(=O)O Amb19944472 [0,1,0,0,0,0|1,0,0]=2 1243 B7R0.5 C#CCC(N)C(=O)O Amb9721758 [0,1,0,0,0,0|1,0,0]=2 1244 B7R0.5 C#CCC(N)C(C)=O Amb27228190 [0,1,0,0,0,0|2,0,0]=3 1245 B7R0.5 C#CCC(N)C(C)O Amb35743443 [0,1,0,0,0,0|2,0,1]=4 1246 B7R0.5 C#CCC(N)C(N)=O Amb22059485 [0,1,0,0,0,0|2,0,0]=3 1247 B7R0.5 C#CCC(N)C(N)=O Amb33543329 [0,1,0,0,0,0|2,0,0]=3 1248 B7R0.5 C#CCC(N)[PH](=O)O Amb27838345 [0,1,0,0,0,0|2,0,0]=3 1249 B7R0.5 C#CCC(O)C(=O)O Amb27154881 [0,1,0,0,0,0|2,0,0]=3 1250 B7R0.5 C#CCC(O)C(C)=O Amb27442415 [0,1,0,0,0,0|3,0,0]=4 1251 B7R0.5 C#CC[C@@H](N)B(O)O Amb27826565 [0,1,0,0,0,0|2,0,1]=4 1252 B7R0.5 C#CC[C@@H](N)C(=O)O Amb16183954 [0,1,0,0,0,0|1,0,0]=2 1253 B7R0.5 C#CC[C@@H](N)C(=O)O Amb22748688 [0,1,0,0,0,0|1,0,0]=2 1254 B7R0.5 C#CC[C@@H](N)C(N)=O Amb27473309 [0,1,0,0,0,0|2,0,0]=3 1255 B7R0.5 C#CC[C@H](C)C(=O)O Amb10844036 [0,1,0,0,0,0|2,0,0]=3 1256 B7R0.5 C#CC[C@H](N)C(=O)O Amb8396606 [0,1,0,0,0,0|1,0,0]=2 1257 B7R0.5 C#CC[C@H](N)C(N)=O Amb28345609 [0,1,0,0,0,0|2,0,0]=3 1258 B7R0.5 C=C(C)C(C)CCO Amb27766618 [0,1,0,0,0,0|3,0,0]=4 1259 B7R0.5 C=C(C)C(C)CON Amb33199600 [0,1,0,0,0,0|3,0,0]=4 1260 B7R0.5 C=C(C)C(N)CCO Amb27391185 [0,1,0,0,0,0|2,0,0]=3 1261 B7R0.5 C=C(C)C(O)COC Amb27662970 [0,1,0,0,0,0|3,0,0]=4 1262 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [0,1,0,0,0,0|2,0,1]=4 1263 B7R0.5 C=C(CCF)C(=O)O Amb33480692 [0,1,0,0,0,0|2,0,1]=4 1264 B7R0.5 C=C(CCN)C(=O)O Amb27267272 [0,1,0,0,0,0|2,0,1]=4 1265 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [0,1,0,0,0,0|1,0,1]=3 1266 B7R0.5 C=C(COC)C(=O)O Amb26978134 [0,1,0,0,0,0|1,0,1]=3 1267 B7R0.5 C=C(CSC)C(=O)O Amb26953041 [0,1,0,0,0,0|1,1,1]=4 1268 B7R0.5 C=CCC(=C)C(=O)O Amb18641687 [0,1,0,0,0,0|2,0,1]=4 1269 B7R0.5 C=CCC(=O)C(=O)O Amb25890017 [0,1,0,0,0,0|2,0,1]=4 1270 B7R0.5 C=CCC(Br)C(C)=O Amb27760403 [0,1,0,0,0,0|3,0,0]=4 1271 B7R0.5 C=CCC(C)C(=O)O Amb33545044 [0,1,0,0,0,0|2,0,0]=3 1272 B7R0.5 C=CCC(C)C(C)=O Amb19373098 [0,1,0,0,0,0|3,0,0]=4 1273 B7R0.5 C=CCC(C)C(N)=O Amb27788519 [0,1,0,0,0,0|3,0,0]=4 1274 B7R0.5 C=CCC(Cl)C(=O)Cl Amb27463323 [0,1,0,0,0,0|3,0,0]=4 1275 B7R0.5 C=CCC(Cl)C(=O)O Amb25056173 [0,1,0,0,0,0|2,0,0]=3 1276 B7R0.5 C=CCC(F)C(=O)O Amb28071391 [0,1,0,0,0,0|2,0,0]=3 1277 B7R0.5 C=CCC(F)C(C)=O Amb19889753 [0,1,0,0,0,0|3,0,0]=4 1278 B7R0.5 C=CCC(N)C(=C)C Amb28316076 [0,1,0,0,0,0|3,0,0]=4 1279 B7R0.5 C=CCC(N)C(=O)Cl Amb27413912 [0,1,0,0,0,0|2,0,0]=3 1280 B7R0.5 C=CCC(N)C(=O)O Amb21856826 [0,1,0,0,0,0|1,0,0]=2 1281 B7R0.5 C=CCC(N)C(=O)O Amb9729145 [0,1,0,0,0,0|1,0,0]=2 1282 B7R0.5 C=CCC(N)C(C)=O Amb27194092 [0,1,0,0,0,0|2,0,0]=3 1283 B7R0.5 C=CCC(N)C(N)=O Amb26585896 [0,1,0,0,0,0|2,0,0]=3 1284 B7R0.5 C=CCC(O)C(C)=O Amb26451431 [0,1,0,0,0,0|3,0,0]=4 1285 B7R0.5 C=CC[C@@H](N)C(=O)O Amb22745310 [0,1,0,0,0,0|1,0,0]=2 1286 B7R0.5 C=CC[C@@H](N)C(=O)O Amb8389451 [0,1,0,0,0,0|1,0,0]=2 1287 B7R0.5 C=CC[C@@H](N)C(N)=O Amb27838370 [0,1,0,0,0,0|2,0,0]=3 1288 B7R0.5 C=CC[C@H](C)C(C)=O Amb26641913 [0,1,0,0,0,0|3,0,0]=4 1289 B7R0.5 C=CC[C@H](N)C(=O)Cl Amb28120452 [0,1,0,0,0,0|2,0,0]=3 1290 B7R0.5 C=CC[C@H](N)C(=O)O Amb10982568 [0,1,0,0,0,0|1,0,0]=2 1291 B7R0.5 C=CC[C@H](N)C(=O)O Amb2699115 [0,1,0,0,0,0|1,0,0]=2 1292 B7R0.5 CC#CC(C)C(=O)O Amb22748425 [0,1,0,0,0,0|2,0,1]=4 1293 B7R0.5 CC#CC(O)C(=O)O Amb27451308 [0,1,0,0,0,0|2,0,1]=4 1294 B7R0.5 CC(=O)C(=O)CCO Amb25074119 [0,1,0,0,0,0|2,0,1]=4 1295 B7R0.5 CC(=O)C(Br)CCBr Amb26442822 [0,1,0,0,0,0|3,0,0]=4 1296 B7R0.5 CC(=O)C(Br)CCO Amb27858653 [0,1,0,0,0,0|2,0,0]=3 1297 B7R0.5 CC(=O)C(C)CC#N Amb27403110 [0,1,0,0,0,0|3,0,0]=4 1298 B7R0.5 CC(=O)C(C)CCBr Amb26849777 [0,1,0,0,0,0|3,0,0]=4 1299 B7R0.5 CC(=O)C(C)CCCl Amb26326637 [0,1,0,0,0,0|3,0,0]=4 1300 B7R0.5 CC(=O)C(C)CCO Amb13881368 [0,1,0,0,0,0|2,0,0]=3 1301 B7R0.5 CC(=O)C(Cl)CC=O Amb18642970 [0,1,0,0,0,0|2,0,1]=4 1302 B7R0.5 CC(=O)C(Cl)CCBr Amb27259779 [0,1,0,0,0,0|3,0,0]=4 1303 B7R0.5 CC(=O)C(Cl)CCCl Amb20671951 [0,1,0,0,0,0|3,0,0]=4 1304 B7R0.5 CC(=O)C(Cl)CCO Amb4017890 [0,1,0,0,0,0|2,0,0]=3 1305 B7R0.5 CC(=O)C(F)CCBr Amb28429129 [0,1,0,0,0,0|3,0,0]=4 1306 B7R0.5 CC(=O)C(F)CCCl Amb27390864 [0,1,0,0,0,0|3,0,0]=4 1307 B7R0.5 CC(=O)C(N)CCO Amb25087112 [0,1,0,0,0,0|1,0,0]=2 1308 B7R0.5 CC(=O)C(S)CCO Amb25831127 [0,1,0,0,0,0|2,0,0]=3 1309 B7R0.5 CC(=O)N(C)CCO Amb5797447 [0,1,0,0,0,0|3,0,0]=4 1310 B7R0.5 CC(=O)[C@@H](C)CC#N Amb26887655 [0,1,0,0,0,0|3,0,0]=4 1311 B7R0.5 CC(=O)[C@@H](N)CCO Amb28410323 [0,1,0,0,0,0|1,0,0]=2 1312 B7R0.5 CC(=O)[C@H](O)CC=O Amb27446551 [0,1,0,0,0,0|2,0,1]=4 1313 B7R0.5 CC(=O)\C(C)=C\CO Amb27472570 [0,1,0,0,0,0|2,0,1]=4 1314 B7R0.5 CC(C)C(N)CCO Amb1993950 [0,1,0,0,0,0|2,0,1]=4 1315 B7R0.5 CC(C)[C@@H](N)CCO Amb26864199 [0,1,0,0,0,0|2,0,1]=4 1316 B7R0.5 CC(C)[C@H](N)CCO Amb28284336 [0,1,0,0,0,0|2,0,1]=4 1317 B7R0.5 CC(CC#N)C(=O)O Amb17334056 [0,1,0,0,0,0|2,0,0]=3 1318 B7R0.5 CC(CC#N)C(N)=O Amb8944748 [0,1,0,0,0,0|3,0,0]=4 1319 B7R0.5 CC(CC=O)C(=O)O Amb27952476 [0,1,0,0,0,0|1,0,1]=3 1320 B7R0.5 CC(CCBr)C(=O)Br Amb27948455 [0,1,0,0,0,0|3,0,0]=4 1321 B7R0.5 CC(CCBr)C(=O)O Amb27409152 [0,1,0,0,0,0|2,0,0]=3 1322 B7R0.5 CC(CCCl)C(=O)Cl Amb25744436 [0,1,0,0,0,0|3,0,0]=4 1323 B7R0.5 CC(CCF)C(=O)O Amb24678386 [0,1,0,0,0,0|2,0,0]=3 1324 B7R0.5 CC(CCN)C(=O)O Amb20667970 [0,1,0,0,0,0|2,0,0]=3 1325 B7R0.5 CC(CCN)C(=O)O Amb538221 [0,1,0,0,0,0|2,0,0]=3 1326 B7R0.5 CC(CCO)C(=O)O Amb18641949 [0,1,0,0,0,0|1,0,0]=2 1327 B7R0.5 CC(CCO)C(=O)[O-] Amb33330478 [0,1,0,0,0,0|1,0,1]=3 1328 B7R0.5 CC(CCO)C(N)=O Amb28280962 [0,1,0,0,0,0|2,0,0]=3 1329 B7R0.5 CC(CCO)S(=O)[O-] Amb28315550 [0,1,0,0,0,0|2,0,1]=4 1330 B7R0.5 CC(CNO)C(=O)O Amb28315956 [0,1,0,0,0,0|1,0,0]=2 1331 B7R0.5 CC(CSS)C(=O)O Amb27437183 [0,1,0,0,0,0|1,1,0]=3 1332 B7R0.5 CC(N=C=O)C(=O)O Amb33471295 [0,1,0,0,0,0|1,0,2]=4 1333 B7R0.5 CC(N=C=S)C(=O)O Amb25945785 [0,1,0,0,0,0|1,1,1]=4 1334 B7R0.5 CC(N=[N+]=[N-])C(=O)O Amb27202649 [0,1,0,0,0,0|3,0,0]=4 1335 B7R0.5 CC(NC=O)C(=O)O Amb1144629 [0,1,0,0,0,0|1,0,2]=4 1336 B7R0.5 CC(NCO)C(=O)O Amb27468253 [0,1,0,0,0,0|1,0,0]=2 1337 B7R0.5 CC(OC=O)C(=O)O Amb27872094 [0,1,0,0,0,0|1,0,2]=4 1338 B7R0.5 CC(\N=N\O)C(=O)O Amb28251041 [0,1,0,0,0,0|2,0,0]=3 1339 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [0,1,0,0,0,0|2,0,1]=4 1340 B7R0.5 CCCC(Br)C(=O)Cl Amb17569837 [0,1,0,0,0,0|3,0,0]=4 1341 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [0,1,0,0,0,0|2,0,0]=3 1342 B7R0.5 CCCC(Br)C(C)=O Amb26870127 [0,1,0,0,0,0|3,0,0]=4 1343 B7R0.5 CCCC(C)C(=O)Cl Amb2689582 [0,1,0,0,0,0|3,0,0]=4 1344 B7R0.5 CCCC(C)C(=O)O Amb3938958 [0,1,0,0,0,0|2,0,0]=3 1345 B7R0.5 CCCC(C)C(C)=O Amb4034597 [0,1,0,0,0,0|3,0,0]=4 1346 B7R0.5 CCCC(C)C(N)=O Amb3886535 [0,1,0,0,0,0|3,0,0]=4 1347 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [0,1,0,0,0,0|2,0,0]=3 1348 B7R0.5 CCCC(F)C(=O)O Amb25842008 [0,1,0,0,0,0|2,0,0]=3 1349 B7R0.5 CCCC(F)C(C)=O Amb28316211 [0,1,0,0,0,0|3,0,0]=4 1350 B7R0.5 CCCC(F)C(N)=O Amb28127390 [0,1,0,0,0,0|3,0,0]=4 1351 B7R0.5 CCCC(N)C(=N)N Amb27222841 [0,1,0,0,0,0|3,0,0]=4 1352 B7R0.5 CCCC(N)C(=O)O Amb6262055 [0,1,0,0,0,0|1,0,0]=2 1353 B7R0.5 CCCC(N)C(C)=O Amb27838289 [0,1,0,0,0,0|2,0,0]=3 1354 B7R0.5 CCCC(N)C(N)=O Amb22284825 [0,1,0,0,0,0|2,0,0]=3 1355 B7R0.5 CCCC(N)C(N)=O Amb9514970 [0,1,0,0,0,0|2,0,0]=3 1356 B7R0.5 CCCC(N)C(N)=S Amb28121515 [0,1,0,0,0,0|2,1,0]=4 1357 B7R0.5 CCCC(O)C(=O)O Amb2818222 [0,1,0,0,0,0|2,0,0]=3 1358 B7R0.5 CCCC(O)C(C)=O Amb22495823 [0,1,0,0,0,0|3,0,0]=4 1359 B7R0.5 CCCC(O)C(N)=O Amb24116553 [0,1,0,0,0,0|3,0,0]=4 1360 B7R0.5 CCCC(S)C(=O)O Amb18124440 [0,1,0,0,0,0|2,0,0]=3 1361 B7R0.5 CCCN(N)C(C)=O Amb18641903 [0,1,0,0,0,0|3,0,0]=4 1362 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [0,1,0,0,0,0|2,0,0]=3 1363 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [0,1,0,0,0,0|2,0,0]=3 1364 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [0,1,0,0,0,0|1,0,0]=2 1365 B7R0.5 CCC[C@@H](N)C(C)=O Amb35659946 [0,1,0,0,0,0|2,0,0]=3 1366 B7R0.5 CCC[C@@H](N)C(C)O Amb29849610 [0,1,0,0,0,0|2,0,1]=4 1367 B7R0.5 CCC[C@@H](N)C(N)=O Amb22745048 [0,1,0,0,0,0|2,0,0]=3 1368 B7R0.5 CCC[C@@H](N)C(N)=O Amb24505187 [0,1,0,0,0,0|2,0,0]=3 1369 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [0,1,0,0,0,0|2,0,0]=3 1370 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [0,1,0,0,0,0|2,0,0]=3 1371 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [0,1,0,0,0,0|2,0,0]=3 1372 B7R0.5 CCC[C@H](C)C(C)=O Amb27463637 [0,1,0,0,0,0|3,0,0]=4 1373 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [0,1,0,0,0,0|2,0,0]=3 1374 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [0,1,0,0,0,0|1,0,0]=2 1375 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [0,1,0,0,0,0|1,0,0]=2 1376 B7R0.5 CCC[C@H](N)C(C)=O Amb35662324 [0,1,0,0,0,0|2,0,0]=3 1377 B7R0.5 CCC[C@H](N)C(C)O Amb35664016 [0,1,0,0,0,0|2,0,1]=4 1378 B7R0.5 CCC[C@H](N)C(N)=O Amb26916392 [0,1,0,0,0,0|2,0,0]=3 1379 B7R0.5 CCC[C@H](N)C(N)=O Amb33813498 [0,1,0,0,0,0|2,0,0]=3 1380 B7R0.5 CCC[C@H](N)[C@H](C)O Amb27883481 [0,1,0,0,0,0|2,0,1]=4 1381 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [0,1,0,0,0,0|2,0,0]=3 1382 B7R0.5 CCC[C@H](O)C(C)=O Amb25097084 [0,1,0,0,0,0|3,0,0]=4 1383 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [0,1,0,0,0,0|2,0,0]=3 1384 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [0,1,0,0,0,0|2,0,1]=4 1385 B7R0.5 CCNC(C)C(=O)O Amb33527634 [0,1,0,0,0,0|2,0,0]=3 1386 B7R0.5 CCNC(C)C(=O)O Amb9326962 [0,1,0,0,0,0|2,0,0]=3 1387 B7R0.5 CCNC(C)C(N)=O Amb21959648 [0,1,0,0,0,0|3,0,0]=4 1388 B7R0.5 CCNC(C)C(N)=O Amb7758139 [0,1,0,0,0,0|3,0,0]=4 1389 B7R0.5 CCNC(O)C(=O)O Amb27259098 [0,1,0,0,0,0|2,0,0]=3 1390 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [0,1,0,0,0,0|2,0,0]=3 1391 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [0,1,0,0,0,0|2,0,0]=3 1392 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [0,1,0,0,0,0|2,0,1]=4 1393 B7R0.5 CCOC(C)C(=O)O Amb9725271 [0,1,0,0,0,0|2,0,0]=3 1394 B7R0.5 CCOC(C)C(C)=O Amb9666103 [0,1,0,0,0,0|3,0,0]=4 1395 B7R0.5 CCOC(C)C(N)=O Amb19960053 [0,1,0,0,0,0|3,0,0]=4 1396 B7R0.5 CCOC(Cl)C(=O)Cl Amb27659279 [0,1,0,0,0,0|3,0,0]=4 1397 B7R0.5 CCOC(Cl)C(N)=O Amb27468650 [0,1,0,0,0,0|3,0,0]=4 1398 B7R0.5 CCOC(F)C(=O)O Amb27210743 [0,1,0,0,0,0|2,0,0]=3 1399 B7R0.5 CCSC(=O)C(=O)O Amb28410577 [0,1,0,0,0,0|2,0,1]=4 1400 B7R0.5 CCSC(C)C(=O)O Amb9721554 [0,1,0,0,0,0|2,0,0]=3 1401 B7R0.5 CCSC(C)C(N)=O Amb27830179 [0,1,0,0,0,0|3,0,0]=4 1402 B7R0.5 CCSC(Cl)C(C)=O Amb27862346 [0,1,0,0,0,0|3,0,0]=4 1403 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [0,1,0,0,0,0|2,0,1]=4 1404 B7R0.5 CC\C=C(/F)C(=O)O Amb27968785 [0,1,0,0,0,0|2,0,1]=4 1405 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [0,1,0,0,0,0|2,0,1]=4 1406 B7R0.5 CNCC(C)C(=O)O Amb13952364 [0,1,0,0,0,0|2,0,0]=3 1407 B7R0.5 CNCC(C)C(=O)O Amb9400281 [0,1,0,0,0,0|2,0,0]=3 1408 B7R0.5 CNCC(C)C(N)=O Amb8943991 [0,1,0,0,0,0|3,0,0]=4 1409 B7R0.5 CNCC(N)C(=O)O Amb10845350 [0,1,0,0,0,0|1,0,0]=2 1410 B7R0.5 CNCC(O)C(=O)O Amb26894610 [0,1,0,0,0,0|2,0,0]=3 1411 B7R0.5 CNC[C@H](N)C(=O)O Amb17617148 [0,1,0,0,0,0|1,0,0]=2 1412 B7R0.5 CNC[C@H](N)C(=O)O Amb19892230 [0,1,0,0,0,0|1,0,0]=2 1413 B7R0.5 COCC(=O)C(C)=O Amb24694271 [0,1,0,0,0,0|2,0,1]=4 1414 B7R0.5 COCC(Br)C(=O)Cl Amb27797270 [0,1,0,0,0,0|2,0,0]=3 1415 B7R0.5 COCC(Br)C(=O)O Amb17594709 [0,1,0,0,0,0|1,0,0]=2 1416 B7R0.5 COCC(C)C(=O)O Amb33545090 [0,1,0,0,0,0|1,0,0]=2 1417 B7R0.5 COCC(C)C(C)=O Amb24683449 [0,1,0,0,0,0|2,0,0]=3 1418 B7R0.5 COCC(C)C(C)O Amb24746662 [0,1,0,0,0,0|2,0,1]=4 1419 B7R0.5 COCC(C)C(N)=O Amb27401584 [0,1,0,0,0,0|2,0,0]=3 1420 B7R0.5 COCC(C)C(N)=S Amb9029622 [0,1,0,0,0,0|2,1,0]=4 1421 B7R0.5 COCC(C)S(=O)Cl Amb26920252 [0,1,0,0,0,0|3,0,0]=4 1422 B7R0.5 COCC(C)S(=O)[O-] Amb24481940 [0,1,0,0,0,0|2,0,1]=4 1423 B7R0.5 COCC(C)S(N)=O Amb32720388 [0,1,0,0,0,0|3,0,0]=4 1424 B7R0.5 COCC(Cl)C(=N)N Amb22493750 [0,1,0,0,0,0|3,0,0]=4 1425 B7R0.5 COCC(Cl)C(=O)O Amb10068384 [0,1,0,0,0,0|1,0,0]=2 1426 B7R0.5 COCC(N)C(=O)O Amb33551350 [0,1,0,0,0,0|0,0,0]=1 1427 B7R0.5 COCC(N)C(=O)O Amb6752055 [0,1,0,0,0,0|0,0,0]=1 1428 B7R0.5 COCC(N)C(C)=O Amb27468401 [0,1,0,0,0,0|1,0,0]=2 1429 B7R0.5 COCC(N)C(C)C Amb18202679 [0,1,0,0,0,0|2,0,1]=4 1430 B7R0.5 COCC(N)C(C)C Amb21954041 [0,1,0,0,0,0|2,0,1]=4 1431 B7R0.5 COCC(N)C(C)O Amb18124266 [0,1,0,0,0,0|1,0,1]=3 1432 B7R0.5 COCC(N)C(F)F Amb28457781 [0,1,0,0,0,0|2,0,1]=4 1433 B7R0.5 COCC(N)C(N)=O Amb18984372 [0,1,0,0,0,0|1,0,0]=2 1434 B7R0.5 COCC(N)C(N)=O Amb32693410 [0,1,0,0,0,0|1,0,0]=2 1435 B7R0.5 COCC(O)C(=N)N Amb27444847 [0,1,0,0,0,0|3,0,0]=4 1436 B7R0.5 COCC(O)C(=O)O Amb18124273 [0,1,0,0,0,0|1,0,0]=2 1437 B7R0.5 COCC(O)C(N)=O Amb28069186 [0,1,0,0,0,0|2,0,0]=3 1438 B7R0.5 COCC(S)C(=O)O Amb27763656 [0,1,0,0,0,0|1,0,0]=2 1439 B7R0.5 COC[C@@H](C)C(=O)O Amb26599229 [0,1,0,0,0,0|1,0,0]=2 1440 B7R0.5 COC[C@@H](N)C(=O)O Amb10604051 [0,1,0,0,0,0|0,0,0]=1 1441 B7R0.5 COC[C@@H](N)C(=O)O Amb22744762 [0,1,0,0,0,0|0,0,0]=1 1442 B7R0.5 COC[C@@H](N)C(C)C Amb17061638 [0,1,0,0,0,0|2,0,1]=4 1443 B7R0.5 COC[C@@H](N)[C@H](C)O Amb27843279 [0,1,0,0,0,0|1,0,1]=3 1444 B7R0.5 COC[C@H](C)C(=O)O Amb10844266 [0,1,0,0,0,0|1,0,0]=2 1445 B7R0.5 COC[C@H](N)C(=O)O Amb33801358 [0,1,0,0,0,0|0,0,0]=1 1446 B7R0.5 COC[C@H](N)C(=O)O Amb8515080 [0,1,0,0,0,0|0,0,0]=1 1447 B7R0.5 COC[C@H](N)C(C)C Amb18016631 [0,1,0,0,0,0|2,0,1]=4 1448 B7R0.5 COC[C@H](N)C(C)C Amb32411970 [0,1,0,0,0,0|2,0,1]=4 1449 B7R0.5 COC[C@H](O)C(=O)O Amb27778843 [0,1,0,0,0,0|1,0,0]=2 1450 B7R0.5 CONC(C)C(N)=O Amb27657313 [0,1,0,0,0,0|3,0,0]=4 1451 B7R0.5 CON[C@@H](C)C(=O)O Amb27862116 [0,1,0,0,0,0|2,0,0]=3 1452 B7R0.5 CO\C=C(/C)C(=O)O Amb18641867 [0,1,0,0,0,0|1,0,2]=4 1453 B7R0.5 CO\C=C(/F)C(=O)O Amb28369284 [0,1,0,0,0,0|1,0,2]=4 1454 B7R0.5 CO\C=C(\F)C(=O)O Amb22641708 [0,1,0,0,0,0|1,0,2]=4 1455 B7R0.5 CO\C=C(\I)C(=O)O Amb27228187 [0,1,0,0,0,0|1,0,2]=4 1456 B7R0.5 CO\C=C(\N)C(=O)O Amb27390812 [0,1,0,0,0,0|0,0,2]=3 1457 B7R0.5 CO\N=C(/C)C(=O)O Amb28203933 [0,1,0,0,0,0|2,0,1]=4 1458 B7R0.5 CSCC(C)C(=O)O Amb18967825 [0,1,0,0,0,0|1,1,0]=3 1459 B7R0.5 CSCC(Cl)C(=O)Cl Amb27801927 [0,1,0,0,0,0|2,1,0]=4 1460 B7R0.5 CSCC(Cl)C(=O)O Amb26878419 [0,1,0,0,0,0|1,1,0]=3 1461 B7R0.5 CSCC(N)C(=O)O Amb33804791 [0,1,0,0,0,0|0,1,0]=2 1462 B7R0.5 CSCC(N)C(=O)O Amb6280829 [0,1,0,0,0,0|0,1,0]=2 1463 B7R0.5 CSCC(O)C(=O)O Amb25131873 [0,1,0,0,0,0|1,1,0]=3 1464 B7R0.5 CSCC(O)C(C)=O Amb25983211 [0,1,0,0,0,0|2,1,0]=4 1465 B7R0.5 CSCC(O)C(N)=O Amb27168145 [0,1,0,0,0,0|2,1,0]=4 1466 B7R0.5 CSC[C@@H](C)C(=O)O Amb26047434 [0,1,0,0,0,0|1,1,0]=3 1467 B7R0.5 CSC[C@@H](N)C(=O)O Amb9813743 [0,1,0,0,0,0|0,1,0]=2 1468 B7R0.5 CSC[C@H](N)C(=O)O Amb6364886 [0,1,0,0,0,0|0,1,0]=2 1469 B7R0.5 CSC[C@H](N)C(N)=O Amb27607700 [0,1,0,0,0,0|1,1,0]=3 1470 B7R0.5 C[C@@H](CCF)C(=O)O Amb33744644 [0,1,0,0,0,0|2,0,0]=3 1471 B7R0.5 C[C@@H](CCN)C(=O)O Amb10844043 [0,1,0,0,0,0|2,0,0]=3 1472 B7R0.5 C[C@@H](N=C=O)C(=O)O Amb33189209 [0,1,0,0,0,0|1,0,2]=4 1473 B7R0.5 C[C@@H](N=C=S)C(=O)O Amb33471579 [0,1,0,0,0,0|1,1,1]=4 1474 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O Amb28325865 [0,1,0,0,0,0|3,0,0]=4 1475 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O Amb32620194 [0,1,0,0,0,0|3,0,0]=4 1476 B7R0.5 C[C@@H](NC#N)C(=O)O Amb35634494 [0,1,0,0,0,0|2,0,1]=4 1477 B7R0.5 C[C@H](CCF)C(=O)O Amb33738115 [0,1,0,0,0,0|2,0,0]=3 1478 B7R0.5 C[C@H](N=C=O)C(=O)O Amb33471333 [0,1,0,0,0,0|1,0,2]=4 1479 B7R0.5 C[C@H](N=C=S)C(=O)O Amb33471562 [0,1,0,0,0,0|1,1,1]=4 1480 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O Amb32620189 [0,1,0,0,0,0|3,0,0]=4 1481 B7R0.5 C[C@H](NC#N)C(=O)O Amb30031667 [0,1,0,0,0,0|2,0,1]=4 1482 B7R0.5 C[C@H](NC=O)C(=O)O Amb28323701 [0,1,0,0,0,0|1,0,2]=4 1483 B7R0.5 C[C@H](NCO)C(=O)O Amb24401217 [0,1,0,0,0,0|1,0,0]=2 1484 B7R0.5 C[Se]C[C@@H](N)C(=O)O Amb22745692 [0,1,0,0,0,0|0,1,0]=2 1485 B7R0.5 C[Se]C[C@H](N)C(=O)O Amb10601626 [0,1,0,0,0,0|0,1,0]=2 1486 B7R0.5 C\C(=C/CCl)C(=O)O Amb25844891 [0,1,0,0,0,0|2,0,1]=4 1487 B7R0.5 C\C(=C/CN)C(=O)O Amb25845292 [0,1,0,0,0,0|2,0,1]=4 1488 B7R0.5 C\C(=C/CS)C(=O)O Amb28041309 [0,1,0,0,0,0|1,1,1]=4 1489 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [0,1,0,0,0,0|2,0,1]=4 1490 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [0,1,0,0,0,0|2,0,1]=4 1491 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [0,1,0,0,0,0|1,0,1]=3 1492 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [0,1,0,0,0,0|2,0,1]=4 1493 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [0,1,0,0,0,0|2,0,1]=4 1494 B7R0.5 N#CCC(N)C(=O)O Amb18641766 [0,1,0,0,0,0|1,0,0]=2 1495 B7R0.5 N#CCC(N)C(N)=O Amb33308724 [0,1,0,0,0,0|2,0,0]=3 1496 B7R0.5 N#CC[C@@H](N)C(=O)O Amb26397494 [0,1,0,0,0,0|1,0,0]=2 1497 B7R0.5 N#CC[C@H](N)C(=O)O Amb16183916 [0,1,0,0,0,0|1,0,0]=2 1498 B7R0.5 NC(=O)C(Br)CCCl Amb27954931 [0,1,0,0,0,0|3,0,0]=4 1499 B7R0.5 NC(=O)C(N)CCF Amb24391278 [0,1,0,0,0,0|2,0,0]=3 1500 B7R0.5 NC(=O)C(N)CCO Amb24481392 [0,1,0,0,0,0|1,0,0]=2 1501 B7R0.5 NC(=O)C(N)CNO Amb27396201 [0,1,0,0,0,0|1,0,0]=2 1502 B7R0.5 NC(CCBr)C(=O)O Amb21858417 [0,1,0,0,0,0|1,0,0]=2 1503 B7R0.5 NC(CCCl)C(=O)O Amb28241385 [0,1,0,0,0,0|1,0,0]=2 1504 B7R0.5 NC(CCF)C(=O)O Amb25889337 [0,1,0,0,0,0|1,0,0]=2 1505 B7R0.5 NC(CCF)C(=O)O Amb28934889 [0,1,0,0,0,0|1,0,0]=2 1506 B7R0.5 NC(CCO)C(=O)O Amb8514287 [0,1,0,0,0,0|0,0,0]=1 1507 B7R0.5 NC(CCO)C(F)F Amb27837545 [0,1,0,0,0,0|2,0,1]=4 1508 B7R0.5 NC(CCS)C(=O)O Amb19267093 [0,1,0,0,0,0|0,1,0]=2 1509 B7R0.5 NC(CCS)C(=O)O Amb3499433 [0,1,0,0,0,0|0,1,0]=2 1510 B7R0.5 NC(CCS)[PH](=O)O Amb27409002 [0,1,0,0,0,0|1,1,0]=3 1511 B7R0.5 NC(CNO)C(=O)O Amb4092732 [0,1,0,0,0,0|0,0,0]=1 1512 B7R0.5 NC(CO[SiH3])C(=O)O Amb27461306 [0,1,0,0,0,0|0,0,0]=1 1513 B7R0.5 NC(\C=C\F)C(=O)O Amb27666430 [0,1,0,0,0,0|1,0,1]=3 1514 B7R0.5 NCCC(Br)C(=O)O Amb28128317 [0,1,0,0,0,0|2,0,0]=3 1515 B7R0.5 NCCC(F)C(=O)O Amb10838221 [0,1,0,0,0,0|2,0,0]=3 1516 B7R0.5 NCCC(F)C(=O)O Amb22229524 [0,1,0,0,0,0|2,0,0]=3 1517 B7R0.5 NCCC(F)[PH](=O)O Amb27639139 [0,1,0,0,0,0|3,0,0]=4 1518 B7R0.5 NCCC(N)C(=O)O Amb2697841 [0,1,0,0,0,0|1,0,0]=2 1519 B7R0.5 NCCC(N)C(=O)O Amb8514694 [0,1,0,0,0,0|1,0,0]=2 1520 B7R0.5 NCCC(O)C(=O)O Amb16232090 [0,1,0,0,0,0|2,0,0]=3 1521 B7R0.5 NCCC(O)C(N)=O Amb28121985 [0,1,0,0,0,0|3,0,0]=4 1522 B7R0.5 NCC[C@@H](F)C(=O)O Amb24055858 [0,1,0,0,0,0|2,0,0]=3 1523 B7R0.5 NCC[C@@H](N)C(=O)O Amb16183852 [0,1,0,0,0,0|1,0,0]=2 1524 B7R0.5 NCC[C@@H](N)C(=O)O Amb23438994 [0,1,0,0,0,0|1,0,0]=2 1525 B7R0.5 NCC[C@@H](N)C(=O)O Amb8390364 [0,1,0,0,0,0|1,0,0]=2 1526 B7R0.5 NCC[C@@H](N)C(N)=O Amb31031077 [0,1,0,0,0,0|2,0,0]=3 1527 B7R0.5 NCC[C@@H](O)C(=O)O Amb22748225 [0,1,0,0,0,0|2,0,0]=3 1528 B7R0.5 NCC[C@H](F)C(=O)O Amb24055857 [0,1,0,0,0,0|2,0,0]=3 1529 B7R0.5 NCC[C@H](N)C(=O)O Amb16183862 [0,1,0,0,0,0|1,0,0]=2 1530 B7R0.5 NCC[C@H](N)C(=O)O Amb2720151 [0,1,0,0,0,0|1,0,0]=2 1531 B7R0.5 NCC[C@H](N)C(=O)O Amb33812683 [0,1,0,0,0,0|1,0,0]=2 1532 B7R0.5 NCC[C@H](N)C(=O)O Amb9825390 [0,1,0,0,0,0|1,0,0]=2 1533 B7R0.5 NCC[C@H](O)C(=O)O Amb8386099 [0,1,0,0,0,0|2,0,0]=3 1534 B7R0.5 NCC[C@H](O)C(N)=O Amb27390493 [0,1,0,0,0,0|3,0,0]=4 1535 B7R0.5 NC\C=C(/F)C(=O)O Amb33802627 [0,1,0,0,0,0|2,0,1]=4 1536 B7R0.5 NC\C=C(\F)C(=O)O Amb28340962 [0,1,0,0,0,0|2,0,1]=4 1537 B7R0.5 NNCC(O)C(=O)[O-] Amb27956514 [0,1,0,0,0,0|2,0,1]=4 1538 B7R0.5 NOCC(N)C(=O)O Amb24184086 [0,1,0,0,0,0|0,0,0]=1 1539 B7R0.5 N[C@@H](CCBr)C(=O)O Amb8515827 [0,1,0,0,0,0|1,0,0]=2 1540 B7R0.5 N[C@@H](CCF)C(=O)O Amb26458628 [0,1,0,0,0,0|1,0,0]=2 1541 B7R0.5 N[C@@H](CCO)C(=O)O Amb20242705 [0,1,0,0,0,0|0,0,0]=1 1542 B7R0.5 N[C@@H](CCO)C(=O)O Amb6600040 [0,1,0,0,0,0|0,0,0]=1 1543 B7R0.5 N[C@@H](CCS)C(=O)O Amb6600039 [0,1,0,0,0,0|0,1,0]=2 1544 B7R0.5 N[C@@H](OCS)C(=O)O Amb27591629 [0,1,0,0,0,0|0,1,0]=2 1545 B7R0.5 N[C@@H](\C=C/F)C(=O)O Amb27447269 [0,1,0,0,0,0|1,0,1]=3 1546 B7R0.5 N[C@H](CC=O)C(=O)O Amb27839576 [0,1,0,0,0,0|0,0,1]=2 1547 B7R0.5 N[C@H](CCF)C(=O)O Amb27206623 [0,1,0,0,0,0|1,0,0]=2 1548 B7R0.5 N[C@H](CCI)C(=O)O Amb27600675 [0,1,0,0,0,0|1,0,0]=2 1549 B7R0.5 N[C@H](CCO)C(=O)O Amb4166299 [0,1,0,0,0,0|0,0,0]=1 1550 B7R0.5 N[C@H](C[SH]=O)C(=O)O Amb27596028 [0,1,0,0,0,0|0,0,1]=2 1551 B7R0.5 O=C(Cl)C(Br)CCBr Amb19930045 [0,1,0,0,0,0|3,0,0]=4 1552 B7R0.5 O=C(Cl)C(Br)CCCl Amb26515711 [0,1,0,0,0,0|3,0,0]=4 1553 B7R0.5 O=C(Cl)C(Cl)CSCl Amb28138021 [0,1,0,0,0,0|2,1,0]=4 1554 B7R0.5 O=C(O)C(=O)CCF Amb33377241 [0,1,0,0,0,0|2,0,1]=4 1555 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [0,1,0,0,0,0|1,0,1]=3 1556 B7R0.5 O=C(O)C(Br)CCBr Amb19889695 [0,1,0,0,0,0|2,0,0]=3 1557 B7R0.5 O=C(O)C(Br)CCO Amb28325416 [0,1,0,0,0,0|1,0,0]=2 1558 B7R0.5 O=C(O)C(Cl)CCCl Amb18126030 [0,1,0,0,0,0|2,0,0]=3 1559 B7R0.5 O=C(O)C(O)CCCl Amb27644540 [0,1,0,0,0,0|2,0,0]=3 1560 B7R0.5 O=C(O)C(O)CCF Amb28071189 [0,1,0,0,0,0|2,0,0]=3 1561 B7R0.5 O=C(O)C(O)CCO Amb24689942 [0,1,0,0,0,0|1,0,0]=2 1562 B7R0.5 O=C(O)C(O)CNO Amb27405525 [0,1,0,0,0,0|1,0,0]=2 1563 B7R0.5 O=C(O)C(S)CCS Amb27634893 [0,1,0,0,0,0|1,1,0]=3 1564 B7R0.5 O=C(O)[C@@H](O)CCBr Amb27238673 [0,1,0,0,0,0|2,0,0]=3 1565 B7R0.5 O=C(O)\C(Br)=C\CO Amb28291530 [0,1,0,0,0,0|1,0,1]=3 1566 B7R0.5 O=C(O)\C(Cl)=C\CBr Amb27875077 [0,1,0,0,0,0|2,0,1]=4 1567 B7R0.5 O=CCC(=O)C(=O)O Amb26326260 [0,1,0,0,0,0|1,0,2]=4 1568 B7R0.5 OCC\C(Br)=C(/O)Br Amb27967773 [0,1,0,0,0,0|2,0,1]=4 1569 B7R0.5 [NH3+]CCC([NH3+])C(=O)[O-] Amb33513240 [0,1,0,0,0,0|1,0,2]=4 1570 B7R0.10 C#CC(=O)C(C)CN Amb27976940 [0,1,0,0,0,0|3,0,0]=4 1571 B7R0.10 C#CC(=O)C(N)CC Amb28422982 [0,1,0,0,0,0|2,0,0]=3 1572 B7R0.10 C#CC(=O)[C@@H](N)CC Amb35601233 [0,1,0,0,0,0|2,0,0]=3 1573 B7R0.10 C#CC(=O)[C@H](N)CC Amb35594876 [0,1,0,0,0,0|2,0,0]=3 1574 B7R0.10 C#CC(O)C(=O)OC Amb27186744 [0,1,0,0,0,0|2,0,1]=4 1575 B7R0.10 C#CC(O)C(N)CC Amb35624529 [0,1,0,0,0,0|2,0,1]=4 1576 B7R0.10 C#CC(O)[C@@H](N)CC Amb35601345 [0,1,0,0,0,0|2,0,1]=4 1577 B7R0.10 C#CC(O)[C@H](N)CC Amb29849607 [0,1,0,0,0,0|2,0,1]=4 1578 B7R0.10 C#C[C@H](O)[C@H](C)CO Amb27219071 [0,1,0,0,0,0|2,0,1]=4 1579 B7R0.10 C=C(C=O)[C@@H](C)CC Amb27390187 [0,1,0,0,0,0|3,0,0]=4 1580 B7R0.10 C=C(CBr)C(=O)OC Amb8516917 [0,1,0,0,0,0|2,0,1]=4 1581 B7R0.10 C=C(CC)C(=O)CO Amb27486129 [0,1,0,0,0,0|2,0,1]=4 1582 B7R0.10 C=C(CC)C(=O)OC Amb24469857 [0,1,0,0,0,0|2,0,1]=4 1583 B7R0.10 C=C(CC)C(O)CO Amb27394780 [0,1,0,0,0,0|3,0,0]=4 1584 B7R0.10 C=C(CCl)C(=O)OC Amb19958340 [0,1,0,0,0,0|2,0,1]=4 1585 B7R0.10 C=C(CF)C(=O)OC Amb27864265 [0,1,0,0,0,0|2,0,1]=4 1586 B7R0.10 C=C(CN)C(=O)OC Amb27599562 [0,1,0,0,0,0|2,0,1]=4 1587 B7R0.10 C=C(CO)C(=O)OC Amb17933844 [0,1,0,0,0,0|1,0,1]=3 1588 B7R0.10 C=C(CO)C(O)CO Amb28345461 [0,1,0,0,0,0|2,0,0]=3 1589 B7R0.10 C=CC(=O)C(C)CC Amb26350444 [0,1,0,0,0,0|3,0,0]=4 1590 B7R0.10 C=CC(=O)C(C)CN Amb27251892 [0,1,0,0,0,0|3,0,0]=4 1591 B7R0.10 C=CC(=O)C(N)CC Amb27593564 [0,1,0,0,0,0|2,0,0]=3 1592 B7R0.10 C=CC(=O)[C@@H](N)CC Amb35601235 [0,1,0,0,0,0|2,0,0]=3 1593 B7R0.10 C=CC(=O)[C@H](N)CC Amb35594877 [0,1,0,0,0,0|2,0,0]=3 1594 B7R0.10 C=CC(Cl)C(=O)OC Amb33548059 [0,1,0,0,0,0|2,0,1]=4 1595 B7R0.10 C=CC(O)C(=O)OC Amb22734006 [0,1,0,0,0,0|2,0,1]=4 1596 B7R0.10 C=CC(O)[C@@H](N)CC Amb35601262 [0,1,0,0,0,0|2,0,1]=4 1597 B7R0.10 C=CC(O)[C@@H](N)CO Amb27786767 [0,1,0,0,0,0|1,0,1]=3 1598 B7R0.10 C=CC(O)[C@H](N)CC Amb35659376 [0,1,0,0,0,0|2,0,1]=4 1599 B7R0.10 C=C[C@@H](O)[C@@H](N)CO Amb24120616 [0,1,0,0,0,0|1,0,1]=3 1600 B7R0.10 C=C[C@@H](O)[C@@H](O)CO Amb26498961 [0,1,0,0,0,0|2,0,1]=4 1601 B7R0.10 C=C[C@@H](O)[C@H](N)CO Amb27188717 [0,1,0,0,0,0|1,0,1]=3 1602 B7R0.10 C=C[C@H](O)[C@H](N)CC Amb27430452 [0,1,0,0,0,0|2,0,1]=4 1603 B7R0.10 C=C[C@H](O)[C@H](O)CO Amb27665226 [0,1,0,0,0,0|2,0,1]=4 1604 B7R0.10 CC(=N/O)\C(N)=N\O Amb27654219 [0,1,0,0,0,0|2,0,1]=4 1605 B7R0.10 CC(C=O)C(C)CO Amb28048946 [0,1,0,0,0,0|2,0,1]=4 1606 B7R0.10 CC(CN)C(=O)NN Amb28422261 [0,1,0,0,0,0|3,0,0]=4 1607 B7R0.10 CC(CN)C(=O)NO Amb27756001 [0,1,0,0,0,0|2,0,0]=3 1608 B7R0.10 CC(CN)C(O)C=O Amb26370126 [0,1,0,0,0,0|2,0,1]=4 1609 B7R0.10 CC(CN)\C(N)=N\O Amb26367204 [0,1,0,0,0,0|3,0,0]=4 1610 B7R0.10 CC(CO)C(=O)NN Amb28048504 [0,1,0,0,0,0|2,0,0]=3 1611 B7R0.10 CC(CO)[C@@H](N)CO Amb27627408 [0,1,0,0,0,0|1,0,1]=3 1612 B7R0.10 CC(CO)[C@H](O)CO Amb27207438 [0,1,0,0,0,0|1,0,2]=4 1613 B7R0.10 CCC(=O)C(=O)CO Amb28316184 [0,1,0,0,0,0|2,0,1]=4 1614 B7R0.10 CCC(=O)C(=O)OC Amb17935757 [0,1,0,0,0,0|2,0,1]=4 1615 B7R0.10 CCC(=O)C(C)CC Amb22229845 [0,1,0,0,0,0|3,0,0]=4 1616 B7R0.10 CCC(=O)C(Cl)CC Amb17593422 [0,1,0,0,0,0|3,0,0]=4 1617 B7R0.10 CCC(=O)C(F)CC Amb28048919 [0,1,0,0,0,0|3,0,0]=4 1618 B7R0.10 CCC(=O)C(O)CC Amb2721046 [0,1,0,0,0,0|3,0,0]=4 1619 B7R0.10 CCC(=O)C(O)CO Amb28074689 [0,1,0,0,0,0|2,0,0]=3 1620 B7R0.10 CCC(=O)N(N)CC Amb33191316 [0,1,0,0,0,0|3,0,0]=4 1621 B7R0.10 CCC(=O)[C@@H](N)CC Amb35601236 [0,1,0,0,0,0|2,0,0]=3 1622 B7R0.10 CCC(=O)[C@H](C)CC Amb27835595 [0,1,0,0,0,0|3,0,0]=4 1623 B7R0.10 CCC(=O)[C@H](C)NO Amb27880702 [0,1,0,0,0,0|3,0,0]=4 1624 B7R0.10 CCC(=O)[C@H](N)CC Amb35594878 [0,1,0,0,0,0|2,0,0]=3 1625 B7R0.10 CCC(Br)C(=O)NC Amb18181033 [0,1,0,0,0,0|3,0,0]=4 1626 B7R0.10 CCC(Br)C(=O)OC Amb1157544 [0,1,0,0,0,0|2,0,0]=3 1627 B7R0.10 CCC(C)C(=N)OC Amb20623203 [0,1,0,0,0,0|3,0,0]=4 1628 B7R0.10 CCC(C)C(=O)CBr Amb24483169 [0,1,0,0,0,0|3,0,0]=4 1629 B7R0.10 CCC(C)C(=O)CCl Amb20667851 [0,1,0,0,0,0|3,0,0]=4 1630 B7R0.10 CCC(C)C(=O)CN Amb26871505 [0,1,0,0,0,0|3,0,0]=4 1631 B7R0.10 CCC(C)C(=O)CO Amb24680373 [0,1,0,0,0,0|2,0,0]=3 1632 B7R0.10 CCC(C)C(=O)NN Amb9706124 [0,1,0,0,0,0|3,0,0]=4 1633 B7R0.10 CCC(C)C(=O)NO Amb6275767 [0,1,0,0,0,0|2,0,0]=3 1634 B7R0.10 CCC(C)C(N)CO Amb19267092 [0,1,0,0,0,0|2,0,1]=4 1635 B7R0.10 CCC(C)C(N)CO Amb8385507 [0,1,0,0,0,0|2,0,1]=4 1636 B7R0.10 CCC(C)C(O)C=O Amb28454245 [0,1,0,0,0,0|2,0,1]=4 1637 B7R0.10 CCC(C)[C@@H](N)CO Amb18015117 [0,1,0,0,0,0|2,0,1]=4 1638 B7R0.10 CCC(C)[C@H](N)CO Amb5785530 [0,1,0,0,0,0|2,0,1]=4 1639 B7R0.10 CCC(C)\C(C)=N\O Amb28124153 [0,1,0,0,0,0|3,0,0]=4 1640 B7R0.10 CCC(C)\C(Cl)=N\O Amb27654809 [0,1,0,0,0,0|3,0,0]=4 1641 B7R0.10 CCC(C)\C(N)=N\O Amb19516921 [0,1,0,0,0,0|3,0,0]=4 1642 B7R0.10 CCC(C)\C(N)=N\O Amb22586630 [0,1,0,0,0,0|3,0,0]=4 1643 B7R0.10 CCC(Cl)C(=O)OC Amb21618748 [0,1,0,0,0,0|2,0,0]=3 1644 B7R0.10 CCC(F)C(N)CO Amb28421837 [0,1,0,0,0,0|2,0,1]=4 1645 B7R0.10 CCC(N)C(=O)NC Amb33552054 [0,1,0,0,0,0|2,0,0]=3 1646 B7R0.10 CCC(N)C(=O)NC Amb9514096 [0,1,0,0,0,0|2,0,0]=3 1647 B7R0.10 CCC(N)C(=O)NN Amb18061942 [0,1,0,0,0,0|2,0,0]=3 1648 B7R0.10 CCC(N)C(=O)NO Amb21922881 [0,1,0,0,0,0|1,0,0]=2 1649 B7R0.10 CCC(N)C(=O)OC Amb17601372 [0,1,0,0,0,0|1,0,0]=2 1650 B7R0.10 CCC(N)C(=O)OC Amb9271765 [0,1,0,0,0,0|1,0,0]=2 1651 B7R0.10 CCC(N)C(O)CC Amb32663160 [0,1,0,0,0,0|2,0,1]=4 1652 B7R0.10 CCC(N)C(O)CC Amb33551344 [0,1,0,0,0,0|2,0,1]=4 1653 B7R0.10 CCC(N)\C(N)=N\O Amb26605280 [0,1,0,0,0,0|2,0,0]=3 1654 B7R0.10 CCC(O)C(=O)C=O Amb24722957 [0,1,0,0,0,0|2,0,1]=4 1655 B7R0.10 CCC(O)C(=O)CO Amb28316154 [0,1,0,0,0,0|2,0,0]=3 1656 B7R0.10 CCC(O)C(=O)NC Amb27403520 [0,1,0,0,0,0|3,0,0]=4 1657 B7R0.10 CCC(O)C(=O)OC Amb4019849 [0,1,0,0,0,0|2,0,0]=3 1658 B7R0.10 CCC(O)C(C)CO Amb24461954 [0,1,0,0,0,0|2,0,1]=4 1659 B7R0.10 CCC(O)[C@H](N)CC Amb35602699 [0,1,0,0,0,0|2,0,1]=4 1660 B7R0.10 CCC(O)\C(C)=N\O Amb28140362 [0,1,0,0,0,0|3,0,0]=4 1661 B7R0.10 CCC(O)\C(N)=N\O Amb27165466 [0,1,0,0,0,0|3,0,0]=4 1662 B7R0.10 CCC(S)C(=O)OC Amb26860434 [0,1,0,0,0,0|2,0,0]=3 1663 B7R0.10 CCN(C)C(=O)CO Amb9421550 [0,1,0,0,0,0|3,0,0]=4 1664 B7R0.10 CCN(C)C(=O)NO Amb32657190 [0,1,0,0,0,0|3,0,0]=4 1665 B7R0.10 CCN(N)C(=O)OC Amb33191318 [0,1,0,0,0,0|2,0,0]=3 1666 B7R0.10 CC[C@@H](Br)C(=O)OC Amb27607617 [0,1,0,0,0,0|2,0,0]=3 1667 B7R0.10 CC[C@@H](C)[C@@H](N)CO Amb17678825 [0,1,0,0,0,0|2,0,1]=4 1668 B7R0.10 CC[C@@H](C)[C@@H](N)CO Amb33871568 [0,1,0,0,0,0|2,0,1]=4 1669 B7R0.10 CC[C@@H](C)[C@H](N)CO Amb25081749 [0,1,0,0,0,0|2,0,1]=4 1670 B7R0.10 CC[C@@H](N)C(=O)NC Amb27655585 [0,1,0,0,0,0|2,0,0]=3 1671 B7R0.10 CC[C@@H](N)C(=O)NO Amb27602079 [0,1,0,0,0,0|1,0,0]=2 1672 B7R0.10 CC[C@@H](N)C(=O)OC Amb19944650 [0,1,0,0,0,0|1,0,0]=2 1673 B7R0.10 CC[C@@H](N)C(=O)OC Amb22057548 [0,1,0,0,0,0|1,0,0]=2 1674 B7R0.10 CC[C@@H](N)C(C)OC Amb28141408 [0,1,0,0,0,0|2,0,1]=4 1675 B7R0.10 CC[C@@H](O)[C@@H](N)CO Amb25131931 [0,1,0,0,0,0|1,0,1]=3 1676 B7R0.10 CC[C@H](C)C(=O)NC Amb27403795 [0,1,0,0,0,0|3,0,0]=4 1677 B7R0.10 CC[C@H](C)C(=O)OC Amb28145887 [0,1,0,0,0,0|2,0,0]=3 1678 B7R0.10 CC[C@H](C)[C@@H](N)CO Amb27966960 [0,1,0,0,0,0|2,0,1]=4 1679 B7R0.10 CC[C@H](C)[C@H](N)CO Amb2785297 [0,1,0,0,0,0|2,0,1]=4 1680 B7R0.10 CC[C@H](C)[C@H](N)CO Amb30867664 [0,1,0,0,0,0|2,0,1]=4 1681 B7R0.10 CC[C@H](N)C(=O)NN Amb27186616 [0,1,0,0,0,0|2,0,0]=3 1682 B7R0.10 CC[C@H](N)C(=O)NO Amb27869261 [0,1,0,0,0,0|1,0,0]=2 1683 B7R0.10 CC[C@H](N)C(=O)OC Amb22167154 [0,1,0,0,0,0|1,0,0]=2 1684 B7R0.10 CC[C@H](N)C(=O)OC Amb27391053 [0,1,0,0,0,0|1,0,0]=2 1685 B7R0.10 CC[C@H](O)C(=O)CO Amb27433137 [0,1,0,0,0,0|2,0,0]=3 1686 B7R0.10 CC[C@H](O)C(=O)OC Amb26318042 [0,1,0,0,0,0|2,0,0]=3 1687 B7R0.10 CNC(=O)C(C)CN Amb15701296 [0,1,0,0,0,0|3,0,0]=4 1688 B7R0.10 CNC(=O)C(C)CN Amb19929904 [0,1,0,0,0,0|3,0,0]=4 1689 B7R0.10 CNC(=O)C(N)C#N Amb10844809 [0,1,0,0,0,0|2,0,1]=4 1690 B7R0.10 CNC(=O)C(N)CO Amb18641958 [0,1,0,0,0,0|1,0,0]=2 1691 B7R0.10 CNC(=O)C(O)CN Amb26854915 [0,1,0,0,0,0|3,0,0]=4 1692 B7R0.10 CNC(=O)C(O)CN Amb30585133 [0,1,0,0,0,0|3,0,0]=4 1693 B7R0.10 CNC(=O)C(O)CO Amb27838377 [0,1,0,0,0,0|2,0,0]=3 1694 B7R0.10 CNC(=O)N(C)CO Amb27948454 [0,1,0,0,0,0|3,0,0]=4 1695 B7R0.10 CNC(=O)[C@@H](O)CN Amb32645218 [0,1,0,0,0,0|3,0,0]=4 1696 B7R0.10 CNC(=O)[C@H](C)CN Amb28245424 [0,1,0,0,0,0|3,0,0]=4 1697 B7R0.10 CNC(=O)[C@H](N)CO Amb28140756 [0,1,0,0,0,0|1,0,0]=2 1698 B7R0.10 CNC(=O)\C(N)=N/O Amb19517087 [0,1,0,0,0,0|2,0,1]=4 1699 B7R0.10 CNC(=O)\C(N)=N\O Amb19651443 [0,1,0,0,0,0|2,0,1]=4 1700 B7R0.10 CNC(C)C(=O)NO Amb27207236 [0,1,0,0,0,0|3,0,0]=4 1701 B7R0.10 CNC(C)C(=O)OC Amb18299580 [0,1,0,0,0,0|3,0,0]=4 1702 B7R0.10 CNC(C)C(=O)OC Amb21961535 [0,1,0,0,0,0|3,0,0]=4 1703 B7R0.10 CN[C@@H](C)C(=O)OC Amb22587553 [0,1,0,0,0,0|3,0,0]=4 1704 B7R0.10 CN[C@@H](C)C(=O)OC Amb22745401 [0,1,0,0,0,0|3,0,0]=4 1705 B7R0.10 CN[C@H](C)C(=O)OC Amb22587562 [0,1,0,0,0,0|3,0,0]=4 1706 B7R0.10 CN[C@H](C)C(=O)OC Amb34153346 [0,1,0,0,0,0|3,0,0]=4 1707 B7R0.10 COC(=N)C(C)CCl Amb28384653 [0,1,0,0,0,0|3,0,0]=4 1708 B7R0.10 COC(=O)C(=O)CBr Amb2455971 [0,1,0,0,0,0|2,0,1]=4 1709 B7R0.10 COC(=O)C(=O)CCl Amb25929741 [0,1,0,0,0,0|2,0,1]=4 1710 B7R0.10 COC(=O)C(=O)CF Amb27464331 [0,1,0,0,0,0|2,0,1]=4 1711 B7R0.10 COC(=O)C(=O)C[S-] Amb27397384 [0,1,0,0,0,0|1,1,1]=4 1712 B7R0.10 COC(=O)C(Br)C#N Amb18128032 [0,1,0,0,0,0|2,0,1]=4 1713 B7R0.10 COC(=O)C(Br)C=O Amb28385653 [0,1,0,0,0,0|1,0,2]=4 1714 B7R0.10 COC(=O)C(Br)CBr Amb6366470 [0,1,0,0,0,0|2,0,0]=3 1715 B7R0.10 COC(=O)C(Br)CF Amb10605572 [0,1,0,0,0,0|2,0,0]=3 1716 B7R0.10 COC(=O)C(Br)CN Amb27764797 [0,1,0,0,0,0|2,0,0]=3 1717 B7R0.10 COC(=O)C(Br)CO Amb22491520 [0,1,0,0,0,0|1,0,0]=2 1718 B7R0.10 COC(=O)C(Br)OC Amb21964964 [0,1,0,0,0,0|3,0,0]=4 1719 B7R0.10 COC(=O)C(Br)SC Amb27484075 [0,1,0,0,0,0|3,0,0]=4 1720 B7R0.10 COC(=O)C(C)C#N Amb17210509 [0,1,0,0,0,0|2,0,1]=4 1721 B7R0.10 COC(=O)C(C)C=O Amb18641861 [0,1,0,0,0,0|1,0,2]=4 1722 B7R0.10 COC(=O)C(C)CBr Amb23440928 [0,1,0,0,0,0|2,0,0]=3 1723 B7R0.10 COC(=O)C(C)CCl Amb25890022 [0,1,0,0,0,0|2,0,0]=3 1724 B7R0.10 COC(=O)C(C)CF Amb27205725 [0,1,0,0,0,0|2,0,0]=3 1725 B7R0.10 COC(=O)C(C)CN Amb13952562 [0,1,0,0,0,0|2,0,0]=3 1726 B7R0.10 COC(=O)C(C)CN Amb9400287 [0,1,0,0,0,0|2,0,0]=3 1727 B7R0.10 COC(=O)C(C)CO Amb9277786 [0,1,0,0,0,0|1,0,0]=2 1728 B7R0.10 COC(=O)C(C)CS Amb17673607 [0,1,0,0,0,0|1,1,0]=3 1729 B7R0.10 COC(=O)C(C)NO Amb28249757 [0,1,0,0,0,0|2,0,0]=3 1730 B7R0.10 COC(=O)C(C)ON Amb28194398 [0,1,0,0,0,0|3,0,0]=4 1731 B7R0.10 COC(=O)C(C)ON Amb33483516 [0,1,0,0,0,0|3,0,0]=4 1732 B7R0.10 COC(=O)C(C)SC Amb22043309 [0,1,0,0,0,0|3,0,0]=4 1733 B7R0.10 COC(=O)C(Cl)C=O Amb17621536 [0,1,0,0,0,0|1,0,2]=4 1734 B7R0.10 COC(=O)C(Cl)CBr Amb28285211 [0,1,0,0,0,0|2,0,0]=3 1735 B7R0.10 COC(=O)C(Cl)CCl Amb8513901 [0,1,0,0,0,0|2,0,0]=3 1736 B7R0.10 COC(=O)C(Cl)CN Amb27838384 [0,1,0,0,0,0|2,0,0]=3 1737 B7R0.10 COC(=O)C(Cl)CO Amb10605503 [0,1,0,0,0,0|1,0,0]=2 1738 B7R0.10 COC(=O)C(Cl)OC Amb22388783 [0,1,0,0,0,0|3,0,0]=4 1739 B7R0.10 COC(=O)C(F)C#N Amb27199451 [0,1,0,0,0,0|2,0,1]=4 1740 B7R0.10 COC(=O)C(F)CCl Amb22735421 [0,1,0,0,0,0|2,0,0]=3 1741 B7R0.10 COC(=O)C(F)CN Amb25241379 [0,1,0,0,0,0|2,0,0]=3 1742 B7R0.10 COC(=O)C(F)CN Amb32661040 [0,1,0,0,0,0|2,0,0]=3 1743 B7R0.10 COC(=O)C(F)CO Amb22235114 [0,1,0,0,0,0|1,0,0]=2 1744 B7R0.10 COC(=O)C(N)C#N Amb23437075 [0,1,0,0,0,0|1,0,1]=3 1745 B7R0.10 COC(=O)C(N)CCl Amb1019565 [0,1,0,0,0,0|1,0,0]=2 1746 B7R0.10 COC(=O)C(N)CCl Amb10601654 [0,1,0,0,0,0|1,0,0]=2 1747 B7R0.10 COC(=O)C(N)CF Amb24482199 [0,1,0,0,0,0|1,0,0]=2 1748 B7R0.10 COC(=O)C(N)CF Amb28934912 [0,1,0,0,0,0|1,0,0]=2 1749 B7R0.10 COC(=O)C(N)CO Amb22489451 [0,1,0,0,0,0|0,0,0]=1 1750 B7R0.10 COC(=O)C(N)CO Amb2720272 [0,1,0,0,0,0|0,0,0]=1 1751 B7R0.10 COC(=O)C(N)CO Amb9785055 [0,1,0,0,0,0|0,0,0]=1 1752 B7R0.10 COC(=O)C(N)CS Amb2780965 [0,1,0,0,0,0|0,1,0]=2 1753 B7R0.10 COC(=O)C(N)CS Amb381226 [0,1,0,0,0,0|0,1,0]=2 1754 B7R0.10 COC(=O)C(O)C#N Amb23596490 [0,1,0,0,0,0|2,0,1]=4 1755 B7R0.10 COC(=O)C(O)C=O Amb27468135 [0,1,0,0,0,0|1,0,2]=4 1756 B7R0.10 COC(=O)C(O)CCl Amb22261563 [0,1,0,0,0,0|2,0,0]=3 1757 B7R0.10 COC(=O)C(O)CF Amb25734186 [0,1,0,0,0,0|2,0,0]=3 1758 B7R0.10 COC(=O)C(O)CN Amb22058759 [0,1,0,0,0,0|2,0,0]=3 1759 B7R0.10 COC(=O)C(O)CN Amb31194251 [0,1,0,0,0,0|2,0,0]=3 1760 B7R0.10 COC(=O)C(O)CO Amb28435920 [0,1,0,0,0,0|1,0,0]=2 1761 B7R0.10 COC(=O)C(O)CS Amb28138641 [0,1,0,0,0,0|1,1,0]=3 1762 B7R0.10 COC(=O)C(O)OC Amb17593224 [0,1,0,0,0,0|3,0,0]=4 1763 B7R0.10 COC(=O)N(C)CCl Amb25890210 [0,1,0,0,0,0|3,0,0]=4 1764 B7R0.10 COC(=O)[C@@H](C)C=O Amb25107069 [0,1,0,0,0,0|1,0,2]=4 1765 B7R0.10 COC(=O)[C@@H](C)CBr Amb22225306 [0,1,0,0,0,0|2,0,0]=3 1766 B7R0.10 COC(=O)[C@@H](C)CI Amb23437667 [0,1,0,0,0,0|2,0,0]=3 1767 B7R0.10 COC(=O)[C@@H](C)CN Amb27391189 [0,1,0,0,0,0|2,0,0]=3 1768 B7R0.10 COC(=O)[C@@H](C)CN Amb35788514 [0,1,0,0,0,0|2,0,0]=3 1769 B7R0.10 COC(=O)[C@@H](C)CO Amb17615445 [0,1,0,0,0,0|1,0,0]=2 1770 B7R0.10 COC(=O)[C@@H](C)NN Amb24117928 [0,1,0,0,0,0|3,0,0]=4 1771 B7R0.10 COC(=O)[C@@H](C)OC Amb27218042 [0,1,0,0,0,0|3,0,0]=4 1772 B7R0.10 COC(=O)[C@@H](C)ON Amb27763250 [0,1,0,0,0,0|3,0,0]=4 1773 B7R0.10 COC(=O)[C@@H](C)ON Amb33620849 [0,1,0,0,0,0|3,0,0]=4 1774 B7R0.10 COC(=O)[C@@H](F)CN Amb24505312 [0,1,0,0,0,0|2,0,0]=3 1775 B7R0.10 COC(=O)[C@@H](F)CN Amb30585108 [0,1,0,0,0,0|2,0,0]=3 1776 B7R0.10 COC(=O)[C@@H](N)CCl Amb10608842 [0,1,0,0,0,0|1,0,0]=2 1777 B7R0.10 COC(=O)[C@@H](N)CN Amb27412388 [0,1,0,0,0,0|1,0,0]=2 1778 B7R0.10 COC(=O)[C@@H](N)CN Amb9134529 [0,1,0,0,0,0|1,0,0]=2 1779 B7R0.10 COC(=O)[C@@H](N)CO Amb3941539 [0,1,0,0,0,0|0,0,0]=1 1780 B7R0.10 COC(=O)[C@@H](N)CO Amb8513312 [0,1,0,0,0,0|0,0,0]=1 1781 B7R0.10 COC(=O)[C@@H](N)CS Amb3940711 [0,1,0,0,0,0|0,1,0]=2 1782 B7R0.10 COC(=O)[C@@H](N)CS Amb6297280 [0,1,0,0,0,0|0,1,0]=2 1783 B7R0.10 COC(=O)[C@@H](O)CCl Amb27216387 [0,1,0,0,0,0|2,0,0]=3 1784 B7R0.10 COC(=O)[C@@H](O)CN Amb24670217 [0,1,0,0,0,0|2,0,0]=3 1785 B7R0.10 COC(=O)[C@@H](O)CN Amb28934854 [0,1,0,0,0,0|2,0,0]=3 1786 B7R0.10 COC(=O)[C@@H](O)CO Amb22226736 [0,1,0,0,0,0|1,0,0]=2 1787 B7R0.10 COC(=O)[C@H](C)C=O Amb25889345 [0,1,0,0,0,0|1,0,2]=4 1788 B7R0.10 COC(=O)[C@H](C)CBr Amb10844721 [0,1,0,0,0,0|2,0,0]=3 1789 B7R0.10 COC(=O)[C@H](C)CO Amb17615446 [0,1,0,0,0,0|1,0,0]=2 1790 B7R0.10 COC(=O)[C@H](C)OC Amb28316057 [0,1,0,0,0,0|3,0,0]=4 1791 B7R0.10 COC(=O)[C@H](C)ON Amb24439736 [0,1,0,0,0,0|3,0,0]=4 1792 B7R0.10 COC(=O)[C@H](C)ON Amb33620848 [0,1,0,0,0,0|3,0,0]=4 1793 B7R0.10 COC(=O)[C@H](F)CN Amb28140777 [0,1,0,0,0,0|2,0,0]=3 1794 B7R0.10 COC(=O)[C@H](N)CCl Amb10601655 [0,1,0,0,0,0|1,0,0]=2 1795 B7R0.10 COC(=O)[C@H](N)CF Amb24351631 [0,1,0,0,0,0|1,0,0]=2 1796 B7R0.10 COC(=O)[C@H](N)CO Amb3939987 [0,1,0,0,0,0|0,0,0]=1 1797 B7R0.10 COC(=O)[C@H](N)CO Amb8390418 [0,1,0,0,0,0|0,0,0]=1 1798 B7R0.10 COC(=O)[C@H](N)CS Amb27630611 [0,1,0,0,0,0|0,1,0]=2 1799 B7R0.10 COC(=O)[C@H](N)CS Amb33763763 [0,1,0,0,0,0|0,1,0]=2 1800 B7R0.10 COC(=O)[C@H](O)CN Amb24073731 [0,1,0,0,0,0|2,0,0]=3 1801 B7R0.10 COC(=O)[C@H](O)CO Amb8471066 [0,1,0,0,0,0|1,0,0]=2 1802 B7R0.10 COC(=O)\C(C)=N/O Amb25889365 [0,1,0,0,0,0|2,0,1]=4 1803 B7R0.10 COC(=O)\C(C)=N\O Amb28053741 [0,1,0,0,0,0|2,0,1]=4 1804 B7R0.10 COC(=O)\C(Cl)=N/O Amb24665681 [0,1,0,0,0,0|2,0,1]=4 1805 B7R0.10 COC(=O)\C(Cl)=N\O Amb22741121 [0,1,0,0,0,0|2,0,1]=4 1806 B7R0.10 COC(=O)\C(N)=N\Cl Amb27839064 [0,1,0,0,0,0|2,0,1]=4 1807 B7R0.10 COC(=O)\C(N)=N\O Amb22741276 [0,1,0,0,0,0|1,0,1]=3 1808 B7R0.10 COC(C)C(C)CO Amb26508350 [0,1,0,0,0,0|2,0,1]=4 1809 B7R0.10 COC(C)C(N)CN Amb28141371 [0,1,0,0,0,0|2,0,1]=4 1810 B7R0.10 COC(C)[C@@H](C)CO Amb33746684 [0,1,0,0,0,0|2,0,1]=4 1811 B7R0.10 COC(C)[C@H](C)CO Amb33738170 [0,1,0,0,0,0|2,0,1]=4 1812 B7R0.10 CO[C@H](C)[C@H](N)CBr Amb32723117 [0,1,0,0,0,0|2,0,1]=4 1813 B7R0.10 CO[C@H](C)[C@H](N)CCl Amb32723116 [0,1,0,0,0,0|2,0,1]=4 1814 B7R0.10 CO[C@H](C)[C@H](N)CN Amb32723114 [0,1,0,0,0,0|2,0,1]=4 1815 B7R0.10 CO[C@H](C)[C@H](N)CO Amb25221786 [0,1,0,0,0,0|1,0,1]=3 1816 B7R0.10 C[C@@H](CO)[C@@H](N)CO Amb27758321 [0,1,0,0,0,0|1,0,1]=3 1817 B7R0.10 C[C@@H](CO)[C@H](N)CO Amb27628042 [0,1,0,0,0,0|1,0,1]=3 1818 B7R0.10 C[C@@H](CO)[C@H](O)CO Amb28400332 [0,1,0,0,0,0|1,0,2]=4 1819 B7R0.10 C\C(=C/O)C(O)CO Amb27441465 [0,1,0,0,0,0|2,0,0]=3 1820 B7R0.10 C\C(=N\O)C(=O)CO Amb28249683 [0,1,0,0,0,0|2,0,1]=4 1821 B7R0.10 C\C=C(/N)C(=O)OC Amb27438851 [0,1,0,0,0,0|1,0,2]=4 1822 B7R0.10 N#CC(N)C(=O)NN Amb28197965 [0,1,0,0,0,0|2,0,1]=4 1823 B7R0.10 N#C[C@H](O)[C@H](O)CO Amb27978872 [0,1,0,0,0,0|2,0,1]=4 1824 B7R0.10 NC(=N/O)\C(Cl)=N\O Amb27838301 [0,1,0,0,0,0|2,0,1]=4 1825 B7R0.10 NC(=N\O)\C(N)=N/O Amb3620788 [0,1,0,0,0,0|2,0,1]=4 1826 B7R0.10 NC(CCl)C(=O)NO Amb6740291 [0,1,0,0,0,0|1,0,0]=2 1827 B7R0.10 NC(CO)C(=O)NO Amb22352399 [0,1,0,0,0,0|0,0,0]=1 1828 B7R0.10 NC(CO)C(O)CO Amb30884396 [0,1,0,0,0,0|0,0,2]=3 1829 B7R0.10 NCC(O)C(O)CO Amb25775606 [0,1,0,0,0,0|2,0,1]=4 1830 B7R0.10 NC[C@@H](O)[C@@H](O)CO Amb27956175 [0,1,0,0,0,0|2,0,1]=4 1831 B7R0.10 NC[C@@H](O)[C@H](N)CO Amb27167034 [0,1,0,0,0,0|1,0,1]=3 1832 B7R0.10 NC[C@H](O)[C@@H](O)CO Amb27473421 [0,1,0,0,0,0|2,0,1]=4 1833 B7R0.10 NC[C@H](O)[C@H](N)CO Amb27174481 [0,1,0,0,0,0|1,0,1]=3 1834 B7R0.10 NNC(=O)C(N)CO Amb26845977 [0,1,0,0,0,0|1,0,0]=2 1835 B7R0.10 NNC(=O)C(N)CO Amb8393226 [0,1,0,0,0,0|1,0,0]=2 1836 B7R0.10 NNC(=O)[C@@H](N)CO Amb26446598 [0,1,0,0,0,0|1,0,0]=2 1837 B7R0.10 NNC(=O)[C@@H](N)CS Amb16231457 [0,1,0,0,0,0|1,1,0]=3 1838 B7R0.10 NNC(=O)[C@H](N)CO Amb27849893 [0,1,0,0,0,0|1,0,0]=2 1839 B7R0.10 N[C@@H](CCl)C(=O)NO Amb22747830 [0,1,0,0,0,0|1,0,0]=2 1840 B7R0.10 N[C@@H](CCl)[C@H](O)CCl Amb27459767 [0,1,0,0,0,0|2,0,1]=4 1841 B7R0.10 N[C@@H](CO)C(=O)NO Amb28203960 [0,1,0,0,0,0|0,0,0]=1 1842 B7R0.10 N[C@@H](CO)C(=O)OCl Amb27838316 [0,1,0,0,0,0|0,0,0]=1 1843 B7R0.10 N[C@@H](CO)[C@@H](N)CO Amb28398616 [0,1,0,0,0,0|1,0,1]=3 1844 B7R0.10 N[C@@H](CO)[C@H](O)CO Amb27592540 [0,1,0,0,0,0|0,0,2]=3 1845 B7R0.10 N[C@H](CCl)C(=O)NO Amb28040834 [0,1,0,0,0,0|1,0,0]=2 1846 B7R0.10 N[C@H](CO)[C@@H](N)CO Amb27874012 [0,1,0,0,0,0|1,0,1]=3 1847 B7R0.10 N[C@H](CO)[C@@H](O)CO Amb28245425 [0,1,0,0,0,0|0,0,2]=3 1848 B7R0.10 N[C@H](CO)[C@H](N)CO Amb25976799 [0,1,0,0,0,0|1,0,1]=3 1849 B7R0.10 O=C(CO)C(=O)CO Amb28049023 [0,1,0,0,0,0|1,0,1]=3 1850 B7R0.10 O=C(CO)C(O)CO Amb27955920 [0,1,0,0,0,0|1,0,0]=2 1851 B7R0.10 O=C(CO)[C@H](O)CO Amb24628483 [0,1,0,0,0,0|1,0,0]=2 1852 B7R0.10 O=C(NCl)C(Cl)CCl Amb28121133 [0,1,0,0,0,0|3,0,0]=4 1853 B7R0.10 O=CC(=O)[C@@H](O)CO Amb28247115 [0,1,0,0,0,0|1,0,1]=3 1854 B7R0.10 O=CC(=O)[C@H](O)CO Amb27210862 [0,1,0,0,0,0|1,0,1]=3 1855 B7R0.10 O=CC(O)C(O)CO Amb8513487 [0,1,0,0,0,0|1,0,1]=3 1856 B7R0.10 O=C[C@@H](O)[C@@H](O)CO Amb25839823 [0,1,0,0,0,0|1,0,1]=3 1857 B7R0.10 O=C[C@H](O)[C@@H](O)CO Amb24481533 [0,1,0,0,0,0|1,0,1]=3 1858 B7R0.10 O=C[C@H](O)[C@H](O)CO Amb9825398 [0,1,0,0,0,0|1,0,1]=3 1859 B7R0.10 OCC(Br)C(Br)CO Amb8627788 [0,1,0,0,0,0|2,0,1]=4 1860 B7R0.10 OCC(Cl)C(Cl)CO Amb27400287 [0,1,0,0,0,0|2,0,1]=4 1861 B7R0.10 OCC(F)C(F)CO Amb28383491 [0,1,0,0,0,0|2,0,1]=4 1862 B7R0.10 OCC(F)C(O)CF Amb27594740 [0,1,0,0,0,0|2,0,1]=4 1863 B7R0.10 OCC(O)C(O)CO Amb2687705 [0,1,0,0,0,0|1,0,2]=4 1864 B7R0.10 OCC(O)C(O)CS Amb27857963 [0,1,0,0,0,0|1,1,1]=4 1865 B7R0.10 OCC(O)C(S)CO Amb28285221 [0,1,0,0,0,0|1,0,2]=4 1866 B7R0.10 OCC(O)[C@H](O)CO Amb27981952 [0,1,0,0,0,0|1,0,2]=4 1867 B7R0.10 OC[C@@H](Br)[C@H](Br)CO Amb28197222 [0,1,0,0,0,0|2,0,1]=4 1868 B7R0.10 OC[C@@H](Cl)[C@H](Cl)CO Amb27400334 [0,1,0,0,0,0|2,0,1]=4 1869 B7R0.10 OC[C@@H](O)[C@H](O)CO Amb20242423 [0,1,0,0,0,0|1,0,2]=4 1870 B7R0.10 OC[C@H](O)[C@H](F)CO Amb28207169 [0,1,0,0,0,0|1,0,2]=4 1871 B7R0.10 OC[C@H](O)[C@H](O)CO Amb33523573 [0,1,0,0,0,0|1,0,2]=4 1872 B7R0.10 OC\C(Br)=C(/Br)CO Amb6374195 [0,1,0,0,0,0|2,0,1]=4 1873 B7R0.10 OC\C(Br)=C(\Br)CO Amb9825835 [0,1,0,0,0,0|2,0,1]=4 1874 B7R0.10 OC\C(Cl)=C(/Cl)CO Amb28208104 [0,1,0,0,0,0|2,0,1]=4 1875 B7R0.10 OC\C(I)=C(/I)CO Amb31308328 [0,1,0,0,0,0|2,0,1]=4 1876 B7R0.10 [C-]#[N+]C(C)C(=O)OC Amb2688983 [0,1,0,0,0,0|3,0,0]=4 1877 B7R0.10 [C-]#[N+][C@@H](C)C(=O)OC Amb25175826 [0,1,0,0,0,0|3,0,0]=4 1878 B7R0.10 [C-]#[N+][C@H](C)C(=O)OC Amb33733575 [0,1,0,0,0,0|3,0,0]=4 1879 B7R0.13 C#CC(C)(C)C(=O)O Amb5720022 [0,1,0,0,0,0|2,0,1]=4 1880 B7R0.13 C#CC(C)(N)C(=O)O Amb23504061 [0,1,0,0,0,0|1,0,1]=3 1881 B7R0.13 C#C[C@@](C)(Cl)C(=O)O Amb27246275 [0,1,0,0,0,0|2,0,1]=4 1882 B7R0.13 C#C[C@](C)(N)C(=O)O Amb24406693 [0,1,0,0,0,0|1,0,1]=3 1883 B7R0.13 C#C[C@](C)(O)C(=O)O Amb27949299 [0,1,0,0,0,0|2,0,1]=4 1884 B7R0.13 C=C(C)C(C)(C)CO Amb4021192 [0,1,0,0,0,0|3,0,0]=4 1885 B7R0.13 C=C(C)C(C)(N)CO Amb33199514 [0,1,0,0,0,0|2,0,0]=3 1886 B7R0.13 C=C(C)C(C)(N)CS Amb18642863 [0,1,0,0,0,0|2,1,0]=4 1887 B7R0.13 C=C(C)C(F)(F)CO Amb27424473 [0,1,0,0,0,0|3,0,0]=4 1888 B7R0.13 C=CC(C)(C)C(=O)O Amb3994191 [0,1,0,0,0,0|2,0,1]=4 1889 B7R0.13 C=CC(C)(N)C(=O)O Amb18641826 [0,1,0,0,0,0|1,0,1]=3 1890 B7R0.13 C=CC(C)(O)C(=O)O Amb8388580 [0,1,0,0,0,0|2,0,1]=4 1891 B7R0.13 C=CC(F)(F)C(=O)O Amb27815269 [0,1,0,0,0,0|2,0,1]=4 1892 B7R0.13 C=C[C@@](C)(N)C(=O)O Amb25970753 [0,1,0,0,0,0|1,0,1]=3 1893 B7R0.13 CC(=O)C(C)(Br)CCl Amb27847889 [0,1,0,0,0,0|3,0,0]=4 1894 B7R0.13 CC(=O)C(C)(C)CCl Amb25878125 [0,1,0,0,0,0|3,0,0]=4 1895 B7R0.13 CC(=O)C(C)(C)CF Amb27188572 [0,1,0,0,0,0|3,0,0]=4 1896 B7R0.13 CC(=O)C(C)(C)CO Amb24691506 [0,1,0,0,0,0|2,0,0]=3 1897 B7R0.13 CC(=O)C(C)(C)NO Amb25322857 [0,1,0,0,0,0|3,0,0]=4 1898 B7R0.13 CC(=O)C(C)(Cl)CCl Amb28062978 [0,1,0,0,0,0|3,0,0]=4 1899 B7R0.13 CC(=O)C(C)(O)CO Amb27471773 [0,1,0,0,0,0|2,0,0]=3 1900 B7R0.13 CC(=O)C(Cl)(Cl)CO Amb24601361 [0,1,0,0,0,0|2,0,0]=3 1901 B7R0.13 CC(=O)C(F)(F)CBr Amb25286601 [0,1,0,0,0,0|3,0,0]=4 1902 B7R0.13 CC(=O)C(F)(F)CCl Amb28060122 [0,1,0,0,0,0|3,0,0]=4 1903 B7R0.13 CC(=O)C(F)(F)CO Amb25724409 [0,1,0,0,0,0|2,0,0]=3 1904 B7R0.13 CC(=O)[C@](C)(O)CO Amb28195327 [0,1,0,0,0,0|2,0,0]=3 1905 B7R0.13 CC(Br)(CBr)C(=O)O Amb9703187 [0,1,0,0,0,0|2,0,0]=3 1906 B7R0.13 CC(Br)(CCl)C(=O)O Amb28282621 [0,1,0,0,0,0|2,0,0]=3 1907 B7R0.13 CC(Br)(CO)C(N)=O Amb27657597 [0,1,0,0,0,0|2,0,0]=3 1908 B7R0.13 CC(C)(C#N)C(=O)O Amb9677775 [0,1,0,0,0,0|2,0,1]=4 1909 B7R0.13 CC(C)(C=O)C(=O)O Amb25260968 [0,1,0,0,0,0|1,0,2]=4 1910 B7R0.13 CC(C)(CBr)C(=O)O Amb2613668 [0,1,0,0,0,0|2,0,0]=3 1911 B7R0.13 CC(C)(CBr)C(N)=O Amb24635645 [0,1,0,0,0,0|3,0,0]=4 1912 B7R0.13 CC(C)(CCl)C(=O)Cl Amb2782005 [0,1,0,0,0,0|3,0,0]=4 1913 B7R0.13 CC(C)(CCl)C(=O)O Amb3940361 [0,1,0,0,0,0|2,0,0]=3 1914 B7R0.13 CC(C)(CCl)C(N)=O Amb27206927 [0,1,0,0,0,0|3,0,0]=4 1915 B7R0.13 CC(C)(CF)C(=O)O Amb22000679 [0,1,0,0,0,0|2,0,0]=3 1916 B7R0.13 CC(C)(CF)C(N)=O Amb28342317 [0,1,0,0,0,0|3,0,0]=4 1917 B7R0.13 CC(C)(CN)C(=O)O Amb22371031 [0,1,0,0,0,0|2,0,0]=3 1918 B7R0.13 CC(C)(CN)C(=O)O Amb8396020 [0,1,0,0,0,0|2,0,0]=3 1919 B7R0.13 CC(C)(CN)C(N)=O Amb8396021 [0,1,0,0,0,0|3,0,0]=4 1920 B7R0.13 CC(C)(CO)C(=N)N Amb25337772 [0,1,0,0,0,0|3,0,0]=4 1921 B7R0.13 CC(C)(CO)C(=O)O Amb2613656 [0,1,0,0,0,0|1,0,0]=2 1922 B7R0.13 CC(C)(CO)C(N)=S Amb26641111 [0,1,0,0,0,0|2,1,0]=4 1923 B7R0.13 CC(C)(CO)[N+](=O)[O-] Amb21520421 [0,1,0,0,0,0|2,0,1]=4 1924 B7R0.13 CC(C)(NO)C(N)=O Amb27637542 [0,1,0,0,0,0|3,0,0]=4 1925 B7R0.13 CC(C)(ON)C(=O)O Amb18641969 [0,1,0,0,0,0|3,0,0]=4 1926 B7R0.13 CC(C)(ON)C(=O)O Amb8390774 [0,1,0,0,0,0|3,0,0]=4 1927 B7R0.13 CC(C)(O[NH3+])C(=O)O Amb22167603 [0,1,0,0,0,0|3,0,0]=4 1928 B7R0.13 CC(C)C(C)(N)CO Amb18286211 [0,1,0,0,0,0|2,0,1]=4 1929 B7R0.13 CC(C)C(C)(N)CO Amb33552488 [0,1,0,0,0,0|2,0,1]=4 1930 B7R0.13 CC(C)[C@@](C)(N)CO Amb22503794 [0,1,0,0,0,0|2,0,1]=4 1931 B7R0.13 CC(C)[C@](C)(N)CO Amb22503795 [0,1,0,0,0,0|2,0,1]=4 1932 B7R0.13 CC(Cl)(CCl)C(=O)Cl Amb27231719 [0,1,0,0,0,0|3,0,0]=4 1933 B7R0.13 CC(F)(CBr)C(=O)O Amb28121309 [0,1,0,0,0,0|2,0,0]=3 1934 B7R0.13 CC(F)(CN)C(=O)O Amb27794896 [0,1,0,0,0,0|2,0,0]=3 1935 B7R0.13 CC(N)(CF)C(=O)O Amb27435532 [0,1,0,0,0,0|1,0,0]=2 1936 B7R0.13 CC(N)(CN)C(=O)O Amb25310586 [0,1,0,0,0,0|1,0,0]=2 1937 B7R0.13 CC(N)(CN)C(=O)O Amb33550422 [0,1,0,0,0,0|1,0,0]=2 1938 B7R0.13 CC(N)(CO)C(=O)O Amb2780027 [0,1,0,0,0,0|0,0,0]=1 1939 B7R0.13 CC(N)(CO)C(=O)O Amb28934875 [0,1,0,0,0,0|0,0,0]=1 1940 B7R0.13 CC(N)(CO)C(F)F Amb29890166 [0,1,0,0,0,0|2,0,1]=4 1941 B7R0.13 CC(N)(CO)C(F)F Amb33804305 [0,1,0,0,0,0|2,0,1]=4 1942 B7R0.13 CC(N)(CO)C(N)=O Amb28381837 [0,1,0,0,0,0|1,0,0]=2 1943 B7R0.13 CC(N)(CS)C(=O)O Amb18124446 [0,1,0,0,0,0|0,1,0]=2 1944 B7R0.13 CC(N)(CS)C(=O)O Amb24480151 [0,1,0,0,0,0|0,1,0]=2 1945 B7R0.13 CC(O)(CBr)C(=O)O Amb18522184 [0,1,0,0,0,0|2,0,0]=3 1946 B7R0.13 CC(O)(CCl)C(=O)O Amb26497884 [0,1,0,0,0,0|2,0,0]=3 1947 B7R0.13 CC(O)(CO)C(=O)O Amb33544570 [0,1,0,0,0,0|1,0,0]=2 1948 B7R0.13 CC(O)C(C)(C)CO Amb4016409 [0,1,0,0,0,0|2,0,1]=4 1949 B7R0.13 CC(O)C(C)(O)CO Amb24642681 [0,1,0,0,0,0|2,0,1]=4 1950 B7R0.13 CCC(C)(Br)C(=O)O Amb22228657 [0,1,0,0,0,0|2,0,0]=3 1951 B7R0.13 CCC(C)(C)C(=O)Cl Amb8394880 [0,1,0,0,0,0|3,0,0]=4 1952 B7R0.13 CCC(C)(C)C(=O)O Amb4605833 [0,1,0,0,0,0|2,0,0]=3 1953 B7R0.13 CCC(C)(C)C(=O)S Amb22734427 [0,1,0,0,0,0|2,1,0]=4 1954 B7R0.13 CCC(C)(C)C(C)=O Amb2687561 [0,1,0,0,0,0|3,0,0]=4 1955 B7R0.13 CCC(C)(C)C(N)=O Amb3886539 [0,1,0,0,0,0|3,0,0]=4 1956 B7R0.13 CCC(C)(Cl)C(=O)O Amb25730682 [0,1,0,0,0,0|2,0,0]=3 1957 B7R0.13 CCC(C)(Cl)C(N)=O Amb28075797 [0,1,0,0,0,0|3,0,0]=4 1958 B7R0.13 CCC(C)(N)C(=O)O Amb28934789 [0,1,0,0,0,0|1,0,0]=2 1959 B7R0.13 CCC(C)(N)C(=O)O Amb9728371 [0,1,0,0,0,0|1,0,0]=2 1960 B7R0.13 CCC(C)(N)C(N)=O Amb13952193 [0,1,0,0,0,0|2,0,0]=3 1961 B7R0.13 CCC(C)(N)C(N)=O Amb18949646 [0,1,0,0,0,0|2,0,0]=3 1962 B7R0.13 CCC(C)(O)C(=O)Cl Amb28042052 [0,1,0,0,0,0|3,0,0]=4 1963 B7R0.13 CCC(C)(O)C(=O)O Amb2609046 [0,1,0,0,0,0|2,0,0]=3 1964 B7R0.13 CCC(C)(O)C(C)=O Amb17593200 [0,1,0,0,0,0|3,0,0]=4 1965 B7R0.13 CCC(C)(O)C(N)=O Amb24116738 [0,1,0,0,0,0|3,0,0]=4 1966 B7R0.13 CCC(Cl)(Cl)C(=O)O Amb25274946 [0,1,0,0,0,0|2,0,0]=3 1967 B7R0.13 CCC(F)(F)C(=O)O Amb10982488 [0,1,0,0,0,0|2,0,0]=3 1968 B7R0.13 CCC(F)(F)C(N)=O Amb24054261 [0,1,0,0,0,0|3,0,0]=4 1969 B7R0.13 CCC(N)(S)C(=O)O Amb27229859 [0,1,0,0,0,0|1,0,0]=2 1970 B7R0.13 CCC(O)(O)C(=O)O Amb28428544 [0,1,0,0,0,0|2,0,0]=3 1971 B7R0.13 CC[C@@](C)(Cl)C(=O)O Amb27391076 [0,1,0,0,0,0|2,0,0]=3 1972 B7R0.13 CC[C@@](C)(N)C(=O)O Amb8515205 [0,1,0,0,0,0|1,0,0]=2 1973 B7R0.13 CC[C@@](C)(O)C(C)=O Amb24481445 [0,1,0,0,0,0|3,0,0]=4 1974 B7R0.13 CC[C@](C)(N)C(=O)O Amb16183896 [0,1,0,0,0,0|1,0,0]=2 1975 B7R0.13 CC[C@](C)(N)C(=O)O Amb33871585 [0,1,0,0,0,0|1,0,0]=2 1976 B7R0.13 CC[C@](C)(N)C(N)=O Amb27838327 [0,1,0,0,0,0|2,0,0]=3 1977 B7R0.13 CC[C@](C)(O)C(C)=O Amb27860292 [0,1,0,0,0,0|3,0,0]=4 1978 B7R0.13 CC[C@](C)(O)C(N)=O Amb27258058 [0,1,0,0,0,0|3,0,0]=4 1979 B7R0.13 CC[C@](N)(O)C(=O)O Amb28398612 [0,1,0,0,0,0|1,0,0]=2 1980 B7R0.13 CNC(C)(C)C(=O)O Amb30625191 [0,1,0,0,0,0|3,0,0]=4 1981 B7R0.13 CNC(C)(C)C(=O)O Amb4037017 [0,1,0,0,0,0|3,0,0]=4 1982 B7R0.13 COC(C)(C)C(=O)O Amb7089070 [0,1,0,0,0,0|3,0,0]=4 1983 B7R0.13 CSC(C)(C)C(=O)O Amb17501488 [0,1,0,0,0,0|3,0,0]=4 1984 B7R0.13 CSC(Cl)(Cl)C(=O)O Amb27835442 [0,1,0,0,0,0|3,0,0]=4 1985 B7R0.13 CSC(F)(F)C(=O)O Amb23586472 [0,1,0,0,0,0|3,0,0]=4 1986 B7R0.13 C[C@@H](O)C(C)(C)CO Amb27981959 [0,1,0,0,0,0|2,0,1]=4 1987 B7R0.13 C[C@@H](O)[C@](C)(O)CO Amb27211282 [0,1,0,0,0,0|2,0,1]=4 1988 B7R0.13 C[C@@](F)(CN)C(=O)O Amb27880722 [0,1,0,0,0,0|2,0,0]=3 1989 B7R0.13 C[C@@](N)(CO)C(=O)O Amb8515082 [0,1,0,0,0,0|0,0,0]=1 1990 B7R0.13 C[C@@](N)(CS)C(=O)O Amb16183893 [0,1,0,0,0,0|0,1,0]=2 1991 B7R0.13 C[C@@](N)(CS)C(=O)O Amb22757501 [0,1,0,0,0,0|0,1,0]=2 1992 B7R0.13 C[C@@](N)(CS)C(N)=O Amb27843429 [0,1,0,0,0,0|1,1,0]=3 1993 B7R0.13 C[C@@](O)(CBr)C(=O)Cl Amb27454837 [0,1,0,0,0,0|3,0,0]=4 1994 B7R0.13 C[C@@](O)(CBr)C(=O)O Amb17610012 [0,1,0,0,0,0|2,0,0]=3 1995 B7R0.13 C[C@H](O)C(C)(C)CO Amb28065990 [0,1,0,0,0,0|2,0,1]=4 1996 B7R0.13 C[C@H](O)[C@](C)(N)CO Amb27595667 [0,1,0,0,0,0|1,0,1]=3 1997 B7R0.13 C[C@](N)(CN)C(=O)O Amb25690446 [0,1,0,0,0,0|1,0,0]=2 1998 B7R0.13 C[C@](N)(CO)C(=O)O Amb8515081 [0,1,0,0,0,0|0,0,0]=1 1999 B7R0.13 C[C@](O)(CBr)C(=O)O Amb22224875 [0,1,0,0,0,0|2,0,0]=3 2000 B7R0.13 C[C@](O)(CN)C(=O)O Amb27440648 [0,1,0,0,0,0|2,0,0]=3 2001 B7R0.13 C[C@](S)(CN)C(=O)O Amb27489167 [0,1,0,0,0,0|2,0,0]=3 2002 B7R0.13 N#CC(F)(F)C(=O)O Amb23455365 [0,1,0,0,0,0|2,0,1]=4 2003 B7R0.13 NC(=O)C(Cl)(Cl)CCl Amb10844816 [0,1,0,0,0,0|3,0,0]=4 2004 B7R0.13 NC(=O)C(F)(Cl)CCl Amb27961474 [0,1,0,0,0,0|3,0,0]=4 2005 B7R0.13 NC(N)(CS)C(=O)O Amb24746383 [0,1,0,0,0,0|0,1,0]=2 2006 B7R0.13 NCC(F)(F)C(=O)O Amb19888004 [0,1,0,0,0,0|2,0,0]=3 2007 B7R0.13 NCC(F)(F)C(=O)O Amb2697603 [0,1,0,0,0,0|2,0,0]=3 2008 B7R0.13 NCC(F)(F)C(N)=O Amb28049309 [0,1,0,0,0,0|3,0,0]=4 2009 B7R0.13 NCC(F)(F)C(N)=O Amb30585144 [0,1,0,0,0,0|3,0,0]=4 2010 B7R0.13 NOC(F)(F)C(=O)O Amb26462157 [0,1,0,0,0,0|3,0,0]=4 2011 B7R0.13 O=C(Br)C(F)(Br)CBr Amb28190357 [0,1,0,0,0,0|3,0,0]=4 2012 B7R0.13 O=C(Cl)C(F)(Cl)CCl Amb27954253 [0,1,0,0,0,0|3,0,0]=4 2013 B7R0.13 O=C(O)C(Cl)(Cl)CCl Amb22731239 [0,1,0,0,0,0|2,0,0]=3 2014 B7R0.13 O=C(O)C(Cl)(Cl)CO Amb27409099 [0,1,0,0,0,0|1,0,0]=2 2015 B7R0.13 O=C(O)C(F)(Cl)CBr Amb27830396 [0,1,0,0,0,0|2,0,0]=3 2016 B7R0.13 O=C(O)C(F)(F)CBr Amb27455617 [0,1,0,0,0,0|2,0,0]=3 2017 B7R0.13 O=C(O)C(F)(F)CF Amb25711017 [0,1,0,0,0,0|2,0,0]=3 2018 B7R0.13 O=C(O)C(F)(F)CO Amb17593305 [0,1,0,0,0,0|1,0,0]=2 2019 B7R0.13 O=C(O)C(F)(F)CS Amb33171136 [0,1,0,0,0,0|1,1,0]=3 2020 B7R0.13 O=N(=O)C(Br)(Br)CO Amb8631078 [0,1,0,0,0,0|2,0,1]=4 2021 B7R0.13 O=[N+]([O-])C(Br)(Br)CO Amb8384844 [0,1,0,0,0,0|2,0,1]=4 2022 B7R0.13 OCC(O)(Br)C(O)Br Amb24483157 [0,1,0,0,0,0|2,0,1]=4 2023 B7R0.14 C=CC(N)P(=O)(O)O Amb27844718 [0,1,0,0,0,0|2,0,1]=4 2024 B7R0.14 C=CC(N)P(C)(=O)O Amb27430241 [0,1,0,0,0,0|2,0,1]=4 2025 B7R0.14 CC(C)(C)C(N)CO Amb19338133 [0,1,0,0,0,0|2,0,1]=4 2026 B7R0.14 CC(C)(C)C(N)CO Amb8993281 [0,1,0,0,0,0|2,0,1]=4 2027 B7R0.14 CC(C)(C)[C@@H](N)CO Amb3429352 [0,1,0,0,0,0|2,0,1]=4 2028 B7R0.14 CC(C)(C)[C@H](N)CO Amb3939824 [0,1,0,0,0,0|2,0,1]=4 2029 B7R0.14 CC(C)(F)C(N)CO Amb25075200 [0,1,0,0,0,0|2,0,1]=4 2030 B7R0.14 CC(C)(F)[C@@H](N)CO Amb27235628 [0,1,0,0,0,0|2,0,1]=4 2031 B7R0.14 CC(C)(F)[C@H](N)CO Amb26481190 [0,1,0,0,0,0|2,0,1]=4 2032 B7R0.14 CC(C)(O)C(Cl)CO Amb20620744 [0,1,0,0,0,0|2,0,1]=4 2033 B7R0.14 CC(C)(O)[C@@H](N)CO Amb28187036 [0,1,0,0,0,0|1,0,1]=3 2034 B7R0.14 CC(C)(O)[C@H](O)CO Amb28280907 [0,1,0,0,0,0|2,0,1]=4 2035 B7R0.14 CC(C)(S)C(N)CO Amb28422064 [0,1,0,0,0,0|1,1,1]=4 2036 B7R0.14 CC(CO)C(C)(C)O Amb28343216 [0,1,0,0,0,0|2,0,1]=4 2037 B7R0.14 CC(CO)S(C)(=O)=O Amb24340232 [0,1,0,0,0,0|2,0,1]=4 2038 B7R0.14 CC(CO)S(N)(=O)=O Amb24367553 [0,1,0,0,0,0|2,0,1]=4 2039 B7R0.14 CC(F)(F)C(N)CO Amb25207871 [0,1,0,0,0,0|2,0,1]=4 2040 B7R0.14 CC(F)(F)[C@@H](N)CO Amb32809824 [0,1,0,0,0,0|2,0,1]=4 2041 B7R0.14 CC(F)(F)[C@H](N)CO Amb32810145 [0,1,0,0,0,0|2,0,1]=4 2042 B7R0.14 CCC(C)S(=O)(=O)O Amb22372234 [0,1,0,0,0,0|3,0,0]=4 2043 B7R0.14 CCC(Cl)P(=O)(O)O Amb27657245 [0,1,0,0,0,0|3,0,0]=4 2044 B7R0.14 CCC(N)C(C)(C)O Amb18198391 [0,1,0,0,0,0|2,0,1]=4 2045 B7R0.14 CCC(N)C(C)(C)O Amb28934865 [0,1,0,0,0,0|2,0,1]=4 2046 B7R0.14 CCC(N)P(C)(=O)O Amb27390481 [0,1,0,0,0,0|2,0,0]=3 2047 B7R0.14 CCC(O)P(=O)(O)O Amb24354457 [0,1,0,0,0,0|3,0,0]=4 2048 B7R0.14 CCC(O)S(=O)(=O)O Amb35753165 [0,1,0,0,0,0|3,0,0]=4 2049 B7R0.14 CC[C@@H](N)P(=O)(O)O Amb8516010 [0,1,0,0,0,0|2,0,0]=3 2050 B7R0.14 CC[C@H](N)P(=O)(O)O Amb8517200 [0,1,0,0,0,0|2,0,0]=3 2051 B7R0.14 CP(=O)(O)C(N)CO Amb25809584 [0,1,0,0,0,0|1,0,0]=2 2052 B7R0.14 C[C@@H](CN)S(=O)(=O)O Amb27655537 [0,1,0,0,0,0|3,0,0]=4 2053 B7R0.14 C[C@@H](CO)C(C)(C)O Amb22737257 [0,1,0,0,0,0|2,0,1]=4 2054 B7R0.14 C[C@H](CO)C(C)(C)O Amb27480759 [0,1,0,0,0,0|2,0,1]=4 2055 B7R0.14 NC(CCl)P(=O)(O)O Amb27410198 [0,1,0,0,0,0|2,0,0]=3 2056 B7R0.14 NC(CO)C(F)(F)F Amb18202893 [0,1,0,0,0,0|2,0,1]=4 2057 B7R0.14 NC(CO)C(F)(F)F Amb22738564 [0,1,0,0,0,0|2,0,1]=4 2058 B7R0.14 NC(CO)P(O)(O)=S Amb27967305 [0,1,0,0,0,0|1,0,1]=3 2059 B7R0.14 NCC(Br)P(=O)(O)O Amb28184523 [0,1,0,0,0,0|3,0,0]=4 2060 B7R0.14 NCC(F)P(=O)(O)O Amb28132701 [0,1,0,0,0,0|3,0,0]=4 2061 B7R0.14 NCC(N)P(=O)(O)O Amb27839530 [0,1,0,0,0,0|2,0,0]=3 2062 B7R0.14 NCC(O)P(=O)(O)O Amb9805623 [0,1,0,0,0,0|3,0,0]=4 2063 B7R0.14 NC[C@@H](O)P(=O)(O)O Amb25293388 [0,1,0,0,0,0|3,0,0]=4 2064 B7R0.14 N[C@@H](CO)C(F)(F)F Amb19374710 [0,1,0,0,0,0|2,0,1]=4 2065 B7R0.14 N[C@@H](CO)C(F)(F)F Amb24088864 [0,1,0,0,0,0|2,0,1]=4 2066 B7R0.14 N[C@H](CCl)P(=O)(O)O Amb27590220 [0,1,0,0,0,0|2,0,0]=3 2067 B7R0.14 N[C@H](CO)C(F)(F)F Amb24055870 [0,1,0,0,0,0|2,0,1]=4 2068 B7R0.14 N[C@H](CO)C(F)(F)F Amb26074510 [0,1,0,0,0,0|2,0,1]=4 2069 B7R0.14 O=S(=O)(O)C(O)CCl Amb17594012 [0,1,0,0,0,0|3,0,0]=4 2070 B7R0.15 C=C(C)C(CC)CO Amb28453435 [0,1,0,0,0,0|3,0,0]=4 2071 B7R0.15 C=C(C)C(CC)NC Amb27400414 [0,1,0,0,0,0|3,0,0]=4 2072 B7R0.15 C=C(C)C(CC)NN Amb28316204 [0,1,0,0,0,0|3,0,0]=4 2073 B7R0.15 C=C(C)C(CN)CO Amb33199604 [0,1,0,0,0,0|2,0,0]=3 2074 B7R0.15 C=CC(C=C)C(=O)O Amb27663214 [0,1,0,0,0,0|2,0,1]=4 2075 B7R0.15 C=CC(CC)C(=O)O Amb28119400 [0,1,0,0,0,0|2,0,0]=3 2076 B7R0.15 C=CC(CC)C(C)=O Amb28315864 [0,1,0,0,0,0|3,0,0]=4 2077 B7R0.15 CC(=O)C(CN)CN Amb28206451 [0,1,0,0,0,0|2,0,0]=3 2078 B7R0.15 CC(=O)C(CO)CO Amb22904340 [0,1,0,0,0,0|2,0,0]=3 2079 B7R0.15 CC(=O)N(CO)CO Amb28381633 [0,1,0,0,0,0|3,0,0]=4 2080 B7R0.15 CC(C)C(CN)CO Amb22304811 [0,1,0,0,0,0|2,0,1]=4 2081 B7R0.15 CC(C)C(CO)ON Amb25175780 [0,1,0,0,0,0|2,0,1]=4 2082 B7R0.15 CC(C)C(CO)ON Amb32662750 [0,1,0,0,0,0|2,0,1]=4 2083 B7R0.15 CC(O)C(CO)CO Amb34916641 [0,1,0,0,0,0|2,0,1]=4 2084 B7R0.15 CCC(C#N)C(=O)O Amb17210513 [0,1,0,0,0,0|1,0,1]=3 2085 B7R0.15 CCC(C#N)C(C)=O Amb9535904 [0,1,0,0,0,0|2,0,1]=4 2086 B7R0.15 CCC(C#N)C(N)=O Amb27797961 [0,1,0,0,0,0|2,0,1]=4 2087 B7R0.15 CCC(C=O)C(=O)O Amb28410235 [0,1,0,0,0,0|2,0,0]=3 2088 B7R0.15 CCC(CC)C(=O)Cl Amb3939475 [0,1,0,0,0,0|3,0,0]=4 2089 B7R0.15 CCC(CC)C(=O)O Amb4605826 [0,1,0,0,0,0|2,0,0]=3 2090 B7R0.15 CCC(CC)C(=O)[O-] Amb22585838 [0,1,0,0,0,0|2,0,1]=4 2091 B7R0.15 CCC(CC)C(C)=O Amb33536259 [0,1,0,0,0,0|3,0,0]=4 2092 B7R0.15 CCC(CC)C(N)=O Amb33550498 [0,1,0,0,0,0|3,0,0]=4 2093 B7R0.15 CCC(CCl)C(=O)Cl Amb28421936 [0,1,0,0,0,0|3,0,0]=4 2094 B7R0.15 CCC(CCl)C(=O)O Amb27424156 [0,1,0,0,0,0|2,0,0]=3 2095 B7R0.15 CCC(CF)C(=O)O Amb27625346 [0,1,0,0,0,0|2,0,0]=3 2096 B7R0.15 CCC(CN)C(=O)O Amb18987934 [0,1,0,0,0,0|1,0,0]=2 2097 B7R0.15 CCC(CN)C(=O)O Amb19514932 [0,1,0,0,0,0|1,0,0]=2 2098 B7R0.15 CCC(CN)C(C)O Amb27985476 [0,1,0,0,0,0|2,0,1]=4 2099 B7R0.15 CCC(CN)C(N)=O Amb18294192 [0,1,0,0,0,0|2,0,0]=3 2100 B7R0.15 CCC(CO)C(=O)O Amb18641947 [0,1,0,0,0,0|1,0,0]=2 2101 B7R0.15 CCC(CO)C(=O)[O-] Amb28934895 [0,1,0,0,0,0|1,0,1]=3 2102 B7R0.15 CCC(CO)C(C)O Amb28048986 [0,1,0,0,0,0|2,0,1]=4 2103 B7R0.15 CCC(CO)C(N)=O Amb28314312 [0,1,0,0,0,0|2,0,0]=3 2104 B7R0.15 CCC(CO)[N+](=O)[O-] Amb4035129 [0,1,0,0,0,0|2,0,1]=4 2105 B7R0.15 CCC(NC)C(=O)O Amb10610245 [0,1,0,0,0,0|1,0,0]=2 2106 B7R0.15 CCC(NC)C(=O)O Amb9619833 [0,1,0,0,0,0|1,0,0]=2 2107 B7R0.15 CCC(NC)C(C)=O Amb28049011 [0,1,0,0,0,0|2,0,0]=3 2108 B7R0.15 CCC(NC)C(C)O Amb27253936 [0,1,0,0,0,0|2,0,1]=4 2109 B7R0.15 CCC(NC)C(N)=O Amb15701261 [0,1,0,0,0,0|2,0,0]=3 2110 B7R0.15 CCC(NCl)C(=O)O Amb28387574 [0,1,0,0,0,0|1,0,0]=2 2111 B7R0.15 CCC(NN)C(=O)O Amb18641955 [0,1,0,0,0,0|1,0,0]=2 2112 B7R0.15 CCC(NO)C(=O)O Amb4019788 [0,1,0,0,0,0|1,0,0]=2 2113 B7R0.15 CCC(OC)C(=O)O Amb8472685 [0,1,0,0,0,0|2,0,0]=3 2114 B7R0.15 CCC(OC)C(C)=O Amb26004835 [0,1,0,0,0,0|3,0,0]=4 2115 B7R0.15 CCC(OC)C(N)=O Amb2027289 [0,1,0,0,0,0|3,0,0]=4 2116 B7R0.15 CCC(SC)C(=O)O Amb17501348 [0,1,0,0,0,0|2,0,0]=3 2117 B7R0.15 CCC(SC)C(C)=O Amb28460748 [0,1,0,0,0,0|3,0,0]=4 2118 B7R0.15 CC[C@@H](CN)C(=O)O Amb27838297 [0,1,0,0,0,0|1,0,0]=2 2119 B7R0.15 CC[C@@H](CO)C(=O)O Amb22745321 [0,1,0,0,0,0|1,0,0]=2 2120 B7R0.15 CC[C@@H](NC)C(=O)O Amb28315876 [0,1,0,0,0,0|1,0,0]=2 2121 B7R0.15 CC[C@H](CN)C(=O)O Amb25790771 [0,1,0,0,0,0|1,0,0]=2 2122 B7R0.15 CC[C@H](CO)C(=O)O Amb16232065 [0,1,0,0,0,0|1,0,0]=2 2123 B7R0.15 CC[C@H](NC)C(=O)O Amb24505225 [0,1,0,0,0,0|1,0,0]=2 2124 B7R0.15 CC[C@H](NCl)C(=O)O Amb28193501 [0,1,0,0,0,0|1,0,0]=2 2125 B7R0.15 CC[C@H](NN)C(=O)O Amb28289412 [0,1,0,0,0,0|1,0,0]=2 2126 B7R0.15 CC[C@H](OC)C(C)=O Amb27243431 [0,1,0,0,0,0|3,0,0]=4 2127 B7R0.15 CN(C)C(CN)CO Amb28119405 [0,1,0,0,0,0|3,0,0]=4 2128 B7R0.15 CNC(CN)C(=O)O Amb23515020 [0,1,0,0,0,0|1,0,0]=2 2129 B7R0.15 CNC(CN)C(=O)O Amb28934876 [0,1,0,0,0,0|1,0,0]=2 2130 B7R0.15 CNC(CO)C(=O)O Amb26068513 [0,1,0,0,0,0|0,0,0]=1 2131 B7R0.15 CNC(CO)C(C)C Amb18291223 [0,1,0,0,0,0|2,0,1]=4 2132 B7R0.15 CNC(CO)C(C)O Amb27794828 [0,1,0,0,0,0|1,0,1]=3 2133 B7R0.15 CNC(CO)C(N)=O Amb18641957 [0,1,0,0,0,0|1,0,0]=2 2134 B7R0.15 CNC(CS)C(=O)O Amb2781760 [0,1,0,0,0,0|0,1,0]=2 2135 B7R0.15 CN[C@@H](CO)C(=O)O Amb16183860 [0,1,0,0,0,0|0,0,0]=1 2136 B7R0.15 CN[C@@H](CO)C(C)=O Amb26476298 [0,1,0,0,0,0|1,0,0]=2 2137 B7R0.15 CN[C@@H](CO)C(C)C Amb28286878 [0,1,0,0,0,0|2,0,1]=4 2138 B7R0.15 CN[C@@H](CS)C(=O)O Amb27630049 [0,1,0,0,0,0|0,1,0]=2 2139 B7R0.15 CN[C@@H](CS)C(=O)O Amb33875997 [0,1,0,0,0,0|0,1,0]=2 2140 B7R0.15 CN[C@H](CO)C(=O)O Amb26948665 [0,1,0,0,0,0|0,0,0]=1 2141 B7R0.15 CN[C@H](CO)[C@@H](C)O Amb27239292 [0,1,0,0,0,0|1,0,1]=3 2142 B7R0.15 CN\C(CO)=C(\C)O Amb25210013 [0,1,0,0,0,0|1,0,1]=3 2143 B7R0.15 COC(CCl)C(=O)Cl Amb27404499 [0,1,0,0,0,0|3,0,0]=4 2144 B7R0.15 COC(CN)C(=O)O Amb22059584 [0,1,0,0,0,0|2,0,0]=3 2145 B7R0.15 COC(CN)C(=O)O Amb24271092 [0,1,0,0,0,0|2,0,0]=3 2146 B7R0.15 COC(OC)C(=O)O Amb26446254 [0,1,0,0,0,0|3,0,0]=4 2147 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679591 [0,1,0,0,0,0|2,0,0]=3 2148 B7R0.15 CO[C@@H](CN)C(=O)O Amb32679853 [0,1,0,0,0,0|2,0,0]=3 2149 B7R0.15 CO[C@@H](CO)C(=O)O Amb27409917 [0,1,0,0,0,0|1,0,0]=2 2150 B7R0.15 CSC(C=O)C(=O)O Amb27399075 [0,1,0,0,0,0|1,0,2]=4 2151 B7R0.15 CSC(CCl)C(=O)O Amb24526774 [0,1,0,0,0,0|2,0,0]=3 2152 B7R0.15 CSC(CN)C(=O)O Amb28346880 [0,1,0,0,0,0|2,0,0]=3 2153 B7R0.15 CSC(SC)C(=O)O Amb28245282 [0,1,0,0,0,0|3,0,0]=4 2154 B7R0.15 C\C=C(/CBr)C(=O)O Amb18128301 [0,1,0,0,0,0|2,0,1]=4 2155 B7R0.15 C\C=C(/CC)C(=O)O Amb18641780 [0,1,0,0,0,0|2,0,1]=4 2156 B7R0.15 C\C=C(\CO)C(=O)O Amb25306747 [0,1,0,0,0,0|1,0,1]=3 2157 B7R0.15 C\N=C(/NC)C(=O)O Amb28349086 [0,1,0,0,0,0|2,0,1]=4 2158 B7R0.15 N#CC(CO)C(=O)O Amb27246245 [0,1,0,0,0,0|0,0,1]=2 2159 B7R0.15 N#C\C(=N/O)C(=O)O Amb26018397 [0,1,0,0,0,0|1,0,2]=4 2160 B7R0.15 NC(=O)N(CO)CO Amb22167903 [0,1,0,0,0,0|3,0,0]=4 2161 B7R0.15 NCC(CF)C(=O)O Amb26995116 [0,1,0,0,0,0|1,0,0]=2 2162 B7R0.15 NCC(CO)C(F)F Amb25971013 [0,1,0,0,0,0|2,0,1]=4 2163 B7R0.15 NC[C@H](CO)C(=O)O Amb26873333 [0,1,0,0,0,0|0,0,0]=1 2164 B7R0.15 NNC(CO)C(=O)O Amb27595622 [0,1,0,0,0,0|0,0,0]=1 2165 B7R0.15 NNC(CS)C(=O)O Amb24117863 [0,1,0,0,0,0|0,1,0]=2 2166 B7R0.15 NNC(CS)C(=O)O Amb27834344 [0,1,0,0,0,0|0,1,0]=2 2167 B7R0.15 NOC(CO)C(=O)O Amb27173883 [0,1,0,0,0,0|0,0,0]=1 2168 B7R0.15 O=C(O)C(CBr)CBr Amb2778682 [0,1,0,0,0,0|2,0,0]=3 2169 B7R0.15 O=C(O)C(CI)CI Amb17779784 [0,1,0,0,0,0|2,0,0]=3 2170 B7R0.15 O=C(O)C(CO)NCl Amb28120918 [0,1,0,0,0,0|0,0,0]=1 2171 B7R0.15 O=C(O)C(CS)CS Amb26600542 [0,1,0,0,0,0|1,1,0]=3 2172 B7R0.15 O=C(O)[C@H](CS)NS Amb27750416 [0,1,0,0,0,0|0,1,0]=2 2173 B7R0.15 O=C([O-])\C(CO)=N\O Amb27432170 [0,1,0,0,0,0|0,0,3]=4 2174 B7R0.15 O=[N+]([O-])C(CO)CO Amb3429581 [0,1,0,0,0,0|2,0,1]=4 2175 B7R0.16 C=C(Br)C(C)C(C)O Amb27978585 [0,1,0,0,0,0|3,0,0]=4 2176 B7R0.16 C=C(Br)C(N)C(=O)O Amb28193255 [0,1,0,0,0,0|1,0,1]=3 2177 B7R0.16 C=C(Br)[C@@H](O)[C@@H](C)O Amb28321601 [0,1,0,0,0,0|3,0,0]=4 2178 B7R0.16 C=C(C(=O)O)C(C)C Amb17593189 [0,1,0,0,0,0|2,0,1]=4 2179 B7R0.16 C=C(C(=O)O)C(C)N Amb27794714 [0,1,0,0,0,0|2,0,1]=4 2180 B7R0.16 C=C(C(=O)O)C(F)F Amb24117234 [0,1,0,0,0,0|2,0,1]=4 2181 B7R0.16 C=C(C(=O)O)[C@@H](C)N Amb27440248 [0,1,0,0,0,0|2,0,1]=4 2182 B7R0.16 C=C(C(=O)O)[C@H](C)O Amb27410183 [0,1,0,0,0,0|1,0,1]=3 2183 B7R0.16 C=C(C(C)=O)[C@@H](C)O Amb26964906 [0,1,0,0,0,0|2,0,1]=4 2184 B7R0.16 C=C(C(C)=O)[C@H](C)O Amb27424236 [0,1,0,0,0,0|2,0,1]=4 2185 B7R0.16 C=C(C)C(C)C(=O)O Amb18641781 [0,1,0,0,0,0|2,0,1]=4 2186 B7R0.16 C=C(C)C(C)C(C)O Amb28045615 [0,1,0,0,0,0|3,0,0]=4 2187 B7R0.16 C=C(C)C(N)C(=C)O Amb27762325 [0,1,0,0,0,0|2,0,1]=4 2188 B7R0.16 C=C(C)C(N)C(=O)O Amb18641831 [0,1,0,0,0,0|1,0,1]=3 2189 B7R0.16 C=C(C)C(N)C(C)C Amb18641748 [0,1,0,0,0,0|3,0,0]=4 2190 B7R0.16 C=C(C)C(N)C(F)F Amb24720668 [0,1,0,0,0,0|3,0,0]=4 2191 B7R0.16 C=C(C)C(O)C(=O)O Amb27859701 [0,1,0,0,0,0|2,0,1]=4 2192 B7R0.16 C=C(C)[C@@H](N)C(=O)O Amb26012631 [0,1,0,0,0,0|1,0,1]=3 2193 B7R0.16 C=C(C)[C@@H](O)C(=O)O Amb28071409 [0,1,0,0,0,0|2,0,1]=4 2194 B7R0.16 C=C(C)[C@H](O)[C@@H](C)O Amb27980717 [0,1,0,0,0,0|3,0,0]=4 2195 B7R0.16 CC(=O)C(Br)C(C)C Amb2389580 [0,1,0,0,0,0|3,0,0]=4 2196 B7R0.16 CC(=O)C(Br)C(C)Cl Amb27791473 [0,1,0,0,0,0|3,0,0]=4 2197 B7R0.16 CC(=O)C(C)C(C)O Amb17593202 [0,1,0,0,0,0|2,0,0]=3 2198 B7R0.16 CC(=O)C(C)[C@@H](C)O Amb28316228 [0,1,0,0,0,0|2,0,0]=3 2199 B7R0.16 CC(=O)C(Cl)C(C)C Amb24483197 [0,1,0,0,0,0|3,0,0]=4 2200 B7R0.16 CC(=O)C(F)C(C)O Amb28437134 [0,1,0,0,0,0|2,0,0]=3 2201 B7R0.16 CC(=O)C(N)C(=O)O Amb21962887 [0,1,0,0,0,0|0,0,2]=3 2202 B7R0.16 CC(=O)C(N)C(C)=O Amb18632931 [0,1,0,0,0,0|1,0,2]=4 2203 B7R0.16 CC(=O)C(N)C(C)=O Amb6893881 [0,1,0,0,0,0|1,0,2]=4 2204 B7R0.16 CC(=O)C(N)C(C)C Amb23536905 [0,1,0,0,0,0|2,0,0]=3 2205 B7R0.16 CC(=O)C(O)C(C)C Amb25087800 [0,1,0,0,0,0|3,0,0]=4 2206 B7R0.16 CC(=O)C(O)C(C)O Amb26597030 [0,1,0,0,0,0|2,0,0]=3 2207 B7R0.16 CC(=O)C(S)C(C)C Amb28254219 [0,1,0,0,0,0|3,0,0]=4 2208 B7R0.16 CC(=O)N(N)C(C)C Amb18641904 [0,1,0,0,0,0|3,0,0]=4 2209 B7R0.16 CC(=O)[C@@H](C)[C@@H](C)Cl Amb28325873 [0,1,0,0,0,0|3,0,0]=4 2210 B7R0.16 CC(=O)[C@@H](C)[C@H](C)O Amb26966954 [0,1,0,0,0,0|2,0,0]=3 2211 B7R0.16 CC(=O)[C@@H](N)C(C)C Amb28410324 [0,1,0,0,0,0|2,0,0]=3 2212 B7R0.16 CC(=O)[C@@H](O)[C@@H](C)O Amb24481484 [0,1,0,0,0,0|2,0,0]=3 2213 B7R0.16 CC(=O)[C@@H](O)[C@H](C)O Amb28045145 [0,1,0,0,0,0|2,0,0]=3 2214 B7R0.16 CC(=O)[C@H](C)C(C)C Amb24753185 [0,1,0,0,0,0|3,0,0]=4 2215 B7R0.16 CC(=O)[C@H](C)[C@H](C)O Amb28249967 [0,1,0,0,0,0|2,0,0]=3 2216 B7R0.16 CC(=O)[C@H](O)C(C)C Amb24379445 [0,1,0,0,0,0|3,0,0]=4 2217 B7R0.16 CC(=O)[C@H](O)[C@@H](C)O Amb24701454 [0,1,0,0,0,0|2,0,0]=3 2218 B7R0.16 CC(=O)\C(N)=C(/C)O Amb26452525 [0,1,0,0,0,0|1,0,2]=4 2219 B7R0.16 CC(=S)C(S)C(=O)O Amb27791825 [0,1,0,0,0,0|1,1,1]=4 2220 B7R0.16 CC(Br)C(=O)C(=O)O Amb23400913 [0,1,0,0,0,0|2,0,1]=4 2221 B7R0.16 CC(Br)C(Br)C(=O)Cl Amb27482606 [0,1,0,0,0,0|3,0,0]=4 2222 B7R0.16 CC(Br)C(Br)C(=O)O Amb4008645 [0,1,0,0,0,0|2,0,0]=3 2223 B7R0.16 CC(C(=O)O)C(=O)O Amb6600127 [0,1,0,0,0,0|1,0,1]=3 2224 B7R0.16 CC(C(=O)O)N(C)C Amb21955631 [0,1,0,0,0,0|3,0,0]=4 2225 B7R0.16 CC(C(=O)O)N(C)C Amb6653762 [0,1,0,0,0,0|3,0,0]=4 2226 B7R0.16 CC(C(=O)O)N(C)N Amb22372039 [0,1,0,0,0,0|3,0,0]=4 2227 B7R0.16 CC(C(=O)[O-])[C@H](C)O Amb27835918 [0,1,0,0,0,0|1,0,1]=3 2228 B7R0.16 CC(C(N)=O)C(=O)O Amb27401562 [0,1,0,0,0,0|1,0,2]=4 2229 B7R0.16 CC(C)C(=N)C(=O)O Amb28073845 [0,1,0,0,0,0|1,0,2]=4 2230 B7R0.16 CC(C)C(=O)C(=O)O Amb6600000 [0,1,0,0,0,0|2,0,1]=4 2231 B7R0.16 CC(C)C(Br)C(=O)Cl Amb17569838 [0,1,0,0,0,0|3,0,0]=4 2232 B7R0.16 CC(C)C(Br)C(=O)O Amb9703217 [0,1,0,0,0,0|2,0,0]=3 2233 B7R0.16 CC(C)C(Br)C(N)=O Amb9725771 [0,1,0,0,0,0|3,0,0]=4 2234 B7R0.16 CC(C)C(C)C(=O)Cl Amb27645335 [0,1,0,0,0,0|3,0,0]=4 2235 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [0,1,0,0,0,0|2,0,0]=3 2236 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,1,0,0,0,0|3,0,0]=4 2237 B7R0.16 CC(C)C(Cl)C(=O)O Amb6739911 [0,1,0,0,0,0|2,0,0]=3 2238 B7R0.16 CC(C)C(F)C(=O)O Amb19957386 [0,1,0,0,0,0|2,0,0]=3 2239 B7R0.16 CC(C)C(N)B(O)O Amb24482349 [0,1,0,0,0,0|2,0,1]=4 2240 B7R0.16 CC(C)C(N)C(=O)Cl Amb6740265 [0,1,0,0,0,0|2,0,0]=3 2241 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [0,1,0,0,0,0|1,0,0]=2 2242 B7R0.16 CC(C)C(N)C(C)O Amb18641932 [0,1,0,0,0,0|2,0,1]=4 2243 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,1,0,0,0,0|2,0,0]=3 2244 B7R0.16 CC(C)C(N)C(N)=O Amb32666402 [0,1,0,0,0,0|2,0,0]=3 2245 B7R0.16 CC(C)C(N)C(N)=O Amb6271181 [0,1,0,0,0,0|2,0,0]=3 2246 B7R0.16 CC(C)C(N)C(N)=S Amb19148044 [0,1,0,0,0,0|2,1,0]=4 2247 B7R0.16 CC(C)C(O)C(=O)Cl Amb27213311 [0,1,0,0,0,0|3,0,0]=4 2248 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [0,1,0,0,0,0|2,0,0]=3 2249 B7R0.16 CC(C)C(O)[PH](=O)O Amb27430184 [0,1,0,0,0,0|3,0,0]=4 2250 B7R0.16 CC(C)C(S)C(=O)O Amb18282761 [0,1,0,0,0,0|2,0,0]=3 2251 B7R0.16 CC(C)[C@@H](Br)C(=O)O Amb8629113 [0,1,0,0,0,0|2,0,0]=3 2252 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [0,1,0,0,0,0|2,0,0]=3 2253 B7R0.16 CC(C)[C@@H](C)C(N)=O Amb27838382 [0,1,0,0,0,0|3,0,0]=4 2254 B7R0.16 CC(C)[C@@H](Cl)C(=O)Cl Amb32658177 [0,1,0,0,0,0|3,0,0]=4 2255 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [0,1,0,0,0,0|1,0,0]=2 2256 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,1,0,0,0,0|2,0,0]=3 2257 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,1,0,0,0,0|2,0,0]=3 2258 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb4013551 [0,1,0,0,0,0|2,0,0]=3 2259 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [0,1,0,0,0,0|2,0,0]=3 2260 B7R0.16 CC(C)[C@@H](O)C(N)=O Amb27879443 [0,1,0,0,0,0|3,0,0]=4 2261 B7R0.16 CC(C)[C@H](Br)C(=O)O Amb8629114 [0,1,0,0,0,0|2,0,0]=3 2262 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [0,1,0,0,0,0|2,0,0]=3 2263 B7R0.16 CC(C)[C@H](C)C(N)=O Amb28345619 [0,1,0,0,0,0|3,0,0]=4 2264 B7R0.16 CC(C)[C@H](Cl)C(=O)Cl Amb27407011 [0,1,0,0,0,0|3,0,0]=4 2265 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [0,1,0,0,0,0|1,0,0]=2 2266 B7R0.16 CC(C)[C@H](N)C(C)O Amb35623965 [0,1,0,0,0,0|2,0,1]=4 2267 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16183986 [0,1,0,0,0,0|2,0,0]=3 2268 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16231400 [0,1,0,0,0,0|2,0,0]=3 2269 B7R0.16 CC(C)[C@H](N)C(N)=O Amb30595108 [0,1,0,0,0,0|2,0,0]=3 2270 B7R0.16 CC(C)[C@H](N)[C@H](C)O Amb27167748 [0,1,0,0,0,0|2,0,1]=4 2271 B7R0.16 CC(C)[C@H](N)[PH](=O)O Amb27814729 [0,1,0,0,0,0|2,0,0]=3 2272 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [0,1,0,0,0,0|2,0,0]=3 2273 B7R0.16 CC(Cl)C(C)C(=O)O Amb28325096 [0,1,0,0,0,0|2,0,0]=3 2274 B7R0.16 CC(Cl)C(Cl)C(=O)Cl Amb27634873 [0,1,0,0,0,0|3,0,0]=4 2275 B7R0.16 CC(Cl)C(Cl)C(=O)O Amb28396619 [0,1,0,0,0,0|2,0,0]=3 2276 B7R0.16 CC(F)C(=O)C(=O)O Amb27246511 [0,1,0,0,0,0|2,0,1]=4 2277 B7R0.16 CC(F)C(N)C(=O)O Amb10838661 [0,1,0,0,0,0|1,0,0]=2 2278 B7R0.16 CC(F)C(N)C(=O)O Amb32752736 [0,1,0,0,0,0|1,0,0]=2 2279 B7R0.16 CC(F)C(N)C(N)=O Amb28250824 [0,1,0,0,0,0|2,0,0]=3 2280 B7R0.16 CC(F)[C@@H](N)C(=O)O Amb28316197 [0,1,0,0,0,0|1,0,0]=2 2281 B7R0.16 CC(N)C(C)C(=O)O Amb18124261 [0,1,0,0,0,0|2,0,0]=3 2282 B7R0.16 CC(N)C(C)C(=O)O Amb28934866 [0,1,0,0,0,0|2,0,0]=3 2283 B7R0.16 CC(N)C(C)C(N)=O Amb27172764 [0,1,0,0,0,0|3,0,0]=4 2284 B7R0.16 CC(N)C(F)C(=O)O Amb27411861 [0,1,0,0,0,0|2,0,0]=3 2285 B7R0.16 CC(N)C(N)C(=O)O Amb22728051 [0,1,0,0,0,0|1,0,0]=2 2286 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [0,1,0,0,0,0|2,0,0]=3 2287 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [0,1,0,0,0,0|2,0,0]=3 2288 B7R0.16 CC(N)C(O)C(N)=O Amb27483181 [0,1,0,0,0,0|3,0,0]=4 2289 B7R0.16 CC(N)[C@H](N)C(=O)O Amb25083113 [0,1,0,0,0,0|1,0,0]=2 2290 B7R0.16 CC(N)[C@H](N)C(=O)O Amb33740158 [0,1,0,0,0,0|1,0,0]=2 2291 B7R0.16 CC(O)C(=O)C(=O)O Amb24481396 [0,1,0,0,0,0|1,0,1]=3 2292 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,1,0,0,0,0|1,0,0]=2 2293 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,1,0,0,0,0|1,0,0]=2 2294 B7R0.16 CC(O)C(C)C(C)O Amb2818287 [0,1,0,0,0,0|2,0,1]=4 2295 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,1,0,0,0,0|1,0,0]=2 2296 B7R0.16 CC(O)C(Cl)C(C)O Amb27971887 [0,1,0,0,0,0|2,0,1]=4 2297 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,1,0,0,0,0|1,0,0]=2 2298 B7R0.16 CC(O)C(N)C(=O)Cl Amb27830226 [0,1,0,0,0,0|1,0,0]=2 2299 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,1,0,0,0,0|0,0,0]=1 2300 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,1,0,0,0,0|0,0,0]=1 2301 B7R0.16 CC(O)C(N)C(N)=O Amb18641954 [0,1,0,0,0,0|1,0,0]=2 2302 B7R0.16 CC(O)C(N)C(N)=O Amb4006836 [0,1,0,0,0,0|1,0,0]=2 2303 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,1,0,0,0,0|1,0,0]=2 2304 B7R0.16 CC(O)C(O)C(C)O Amb27826429 [0,1,0,0,0,0|2,0,1]=4 2305 B7R0.16 CC(O)C(O)[C@@H](C)O Amb27775950 [0,1,0,0,0,0|2,0,1]=4 2306 B7R0.16 CC(O)[C@H](N)C(N)=O Amb27643319 [0,1,0,0,0,0|1,0,0]=2 2307 B7R0.16 CC(S)C(=O)C(=O)O Amb28128312 [0,1,0,0,0,0|1,1,1]=4 2308 B7R0.16 CC(S)C(N)C(=O)O Amb17593434 [0,1,0,0,0,0|0,1,0]=2 2309 B7R0.16 CC(S)[C@@H](N)C(=O)O Amb24606864 [0,1,0,0,0,0|0,1,0]=2 2310 B7R0.16 CC([C@@H](C)O)[C@@H](C)O Amb27396018 [0,1,0,0,0,0|2,0,1]=4 2311 B7R0.16 CC([C@H](C)O)[C@H](C)O Amb27659871 [0,1,0,0,0,0|2,0,1]=4 2312 B7R0.16 CN(C)C(O)C(=O)O Amb28399618 [0,1,0,0,0,0|3,0,0]=4 2313 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb22587534 [0,1,0,0,0,0|3,0,0]=4 2314 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb28934882 [0,1,0,0,0,0|3,0,0]=4 2315 B7R0.16 C[C@@H](Cl)[C@@H](Cl)C(=O)O Amb28343001 [0,1,0,0,0,0|2,0,0]=3 2316 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(=O)O Amb28283911 [0,1,0,0,0,0|2,0,0]=3 2317 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(N)=O Amb27607679 [0,1,0,0,0,0|3,0,0]=4 2318 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb28286576 [0,1,0,0,0,0|1,0,0]=2 2319 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb32668519 [0,1,0,0,0,0|1,0,0]=2 2320 B7R0.16 C[C@@H](N)[C@@H](C)C(=O)O Amb25679842 [0,1,0,0,0,0|2,0,0]=3 2321 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb22745441 [0,1,0,0,0,0|1,0,0]=2 2322 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb24481409 [0,1,0,0,0,0|1,0,0]=2 2323 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,1,0,0,0,0|0,0,0]=1 2324 B7R0.16 C[C@@H](O)[C@@H](C)S(C)=O Amb28249125 [0,1,0,0,0,0|3,0,0]=4 2325 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,1,0,0,0,0|1,0,0]=2 2326 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,1,0,0,0,0|0,0,0]=1 2327 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,1,0,0,0,0|1,0,0]=2 2328 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,1,0,0,0,0|1,0,0]=2 2329 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,1,0,0,0,0|0,0,0]=1 2330 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,1,0,0,0,0|0,0,0]=1 2331 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,1,0,0,0,0|0,0,0]=1 2332 B7R0.16 C[C@@H](O)[C@H](N)C(N)=O Amb17942942 [0,1,0,0,0,0|1,0,0]=2 2333 B7R0.16 C[C@@H](S)[C@H](N)C(=O)O Amb24117242 [0,1,0,0,0,0|0,1,0]=2 2334 B7R0.16 C[C@H](C(=O)O)N(C)C Amb22586633 [0,1,0,0,0,0|3,0,0]=4 2335 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,1,0,0,0,0|1,0,0]=2 2336 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)Cl Amb28384464 [0,1,0,0,0,0|3,0,0]=4 2337 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)O Amb27955873 [0,1,0,0,0,0|2,0,0]=3 2338 B7R0.16 C[C@H](N)[C@@H](C)C(=O)O Amb26887656 [0,1,0,0,0,0|2,0,0]=3 2339 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [0,1,0,0,0,0|2,0,0]=3 2340 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb17678797 [0,1,0,0,0,0|1,0,0]=2 2341 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb26887696 [0,1,0,0,0,0|1,0,0]=2 2342 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,1,0,0,0,0|1,0,0]=2 2343 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,1,0,0,0,0|1,0,0]=2 2344 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,1,0,0,0,0|0,0,0]=1 2345 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,1,0,0,0,0|1,0,0]=2 2346 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,1,0,0,0,0|1,0,0]=2 2347 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,1,0,0,0,0|1,0,0]=2 2348 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,1,0,0,0,0|1,0,0]=2 2349 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,1,0,0,0,0|0,0,0]=1 2350 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,1,0,0,0,0|0,0,0]=1 2351 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,1,0,0,0,0|1,0,0]=2 2352 B7R0.16 C[PH](=O)C(O)C(=O)O Amb34916646 [0,1,0,0,0,0|2,0,1]=4 2353 B7R0.16 C\C(O)=C(/N)C(N)=O Amb28429800 [0,1,0,0,0,0|1,0,2]=4 2354 B7R0.16 C\C(O)=C(\N)C(=O)O Amb27191761 [0,1,0,0,0,0|0,0,2]=3 2355 B7R0.16 C\C(O)=C(\O)C(=O)O Amb28282804 [0,1,0,0,0,0|1,0,2]=4 2356 B7R0.16 C\C(O)=C(\O)C(C)O Amb25227909 [0,1,0,0,0,0|2,0,1]=4 2357 B7R0.16 C\C(O)=C(\O)[C@@H](C)O Amb27862909 [0,1,0,0,0,0|2,0,1]=4 2358 B7R0.16 N=C(N)C(N)C(N)=O Amb27601378 [0,1,0,0,0,0|2,0,1]=4 2359 B7R0.16 NC(=O)C(N)C(N)=O Amb518675 [0,1,0,0,0,0|1,0,2]=4 2360 B7R0.16 NC(=O)[C@H](N)C(=O)O Amb28397054 [0,1,0,0,0,0|0,0,2]=3 2361 B7R0.16 NC(C(=O)O)C(=O)O Amb10603956 [0,1,0,0,0,0|0,0,1]=2 2362 B7R0.16 NC(C(=O)O)C(F)F Amb24713127 [0,1,0,0,0,0|1,0,0]=2 2363 B7R0.16 NC(C(=O)O)C(F)F Amb32644474 [0,1,0,0,0,0|1,0,0]=2 2364 B7R0.16 N[C@@H](C(=O)O)S(=O)O Amb28125643 [0,1,0,0,0,0|1,0,0]=2 2365 B7R0.16 N[C@H](C(=O)O)C(O)O Amb27867398 [0,1,0,0,0,0|0,0,0]=1 2366 B7R0.16 O=C(Cl)C(Cl)C(Cl)Cl Amb27605896 [0,1,0,0,0,0|3,0,0]=4 2367 B7R0.16 O=C(O)C(=O)C(=O)O Amb18641943 [0,1,0,0,0,0|1,0,2]=4 2368 B7R0.16 O=C(O)C(=O)C(Br)Br Amb24179214 [0,1,0,0,0,0|2,0,1]=4 2369 B7R0.16 O=C(O)C(=O)C(Cl)Br Amb27830042 [0,1,0,0,0,0|2,0,1]=4 2370 B7R0.16 O=C(O)C(Br)C(=O)O Amb17594708 [0,1,0,0,0,0|1,0,1]=3 2371 B7R0.16 O=C(O)C(F)C(=O)O Amb24055884 [0,1,0,0,0,0|1,0,1]=3 2372 B7R0.16 O=C(O)C(F)C(Cl)Cl Amb4015382 [0,1,0,0,0,0|2,0,0]=3 2373 B7R0.16 O=C(O)C(F)C(F)F Amb27481077 [0,1,0,0,0,0|2,0,0]=3 2374 B7R0.16 O=C(O)C(O)C(=O)O Amb1215315 [0,1,0,0,0,0|1,0,1]=3 2375 B7R0.16 O=C(O)C(O)C(Cl)Cl Amb27212773 [0,1,0,0,0,0|2,0,0]=3 2376 B7R0.16 O=C(O)C(O)C(F)F Amb25074883 [0,1,0,0,0,0|2,0,0]=3 2377 B7R0.16 O=C(O)C(S)C(=O)O Amb28346986 [0,1,0,0,0,0|1,0,1]=3 2378 B7R0.16 OC(Cl)C(O)C(O)Cl Amb27594148 [0,1,0,0,0,0|2,0,1]=4 2379 B7R1.4 C=C1CCOC1=O Amb3941636 [0,0,0,1,0,0|2,0,1]=4 2380 B7R1.4 C=C1COCC1N Amb31252146 [0,0,0,1,0,0|2,0,0]=3 2381 B7R1.4 C=C1COCC1N Amb32795022 [0,0,0,1,0,0|2,0,0]=3 2382 B7R1.4 C=C1COCC1O Amb24423437 [0,0,0,1,0,0|3,0,0]=4 2383 B7R1.4 CC1C=COC1=O Amb27862334 [0,0,0,1,0,0|2,0,1]=4 2384 B7R1.4 CC1CCCC1=O Amb8514830 [0,0,0,1,0,0|3,0,0]=4 2385 B7R1.4 CC1CCNC1=O Amb10603701 [0,0,0,1,0,0|3,0,0]=4 2386 B7R1.4 CC1CCOC1=O Amb16185414 [0,0,0,1,0,0|2,0,0]=3 2387 B7R1.4 CC1CNNC1=O Amb27228083 [0,0,0,1,0,0|3,0,0]=4 2388 B7R1.4 CC1COCC1=O Amb24333426 [0,0,0,1,0,0|2,0,0]=3 2389 B7R1.4 CC1COCC1N Amb26929448 [0,0,0,1,0,0|2,0,1]=4 2390 B7R1.4 CC1COCC1O Amb26864629 [0,0,0,1,0,0|2,0,1]=4 2391 B7R1.4 CC1CON=C1N Amb27404510 [0,0,0,1,0,0|3,0,0]=4 2392 B7R1.4 CC1CONC1=O Amb33714888 [0,0,0,1,0,0|2,0,0]=3 2393 B7R1.4 CC1CSCC1=O Amb21964769 [0,0,0,1,0,0|2,1,0]=4 2394 B7R1.4 CC1OCCC1N Amb22058722 [0,0,0,1,0,0|2,0,1]=4 2395 B7R1.4 CC1OCCC1N Amb32660981 [0,0,0,1,0,0|2,0,1]=4 2396 B7R1.4 CN1CCOC1=O Amb22347786 [0,0,0,1,0,0|3,0,0]=4 2397 B7R1.4 C[C@@H]1CCNC1=O Amb22748230 [0,0,0,1,0,0|3,0,0]=4 2398 B7R1.4 C[C@@H]1COC[C@@H]1O Amb22886816 [0,0,0,1,0,0|2,0,1]=4 2399 B7R1.4 C[C@@H]1COC[C@H]1N Amb24353575 [0,0,0,1,0,0|2,0,1]=4 2400 B7R1.4 C[C@@H]1COC[C@H]1N Amb30869718 [0,0,0,1,0,0|2,0,1]=4 2401 B7R1.4 C[C@@H]1COC[C@H]1O Amb22886616 [0,0,0,1,0,0|2,0,1]=4 2402 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb22886254 [0,0,0,1,0,0|2,0,1]=4 2403 B7R1.4 C[C@@H]1OCC[C@@H]1N Amb24629226 [0,0,0,1,0,0|2,0,1]=4 2404 B7R1.4 C[C@@H]1OCC[C@H]1N Amb27435305 [0,0,0,1,0,0|2,0,1]=4 2405 B7R1.4 C[C@@H]1OCC[C@H]1N Amb34915721 [0,0,0,1,0,0|2,0,1]=4 2406 B7R1.4 C[C@H]1CCCC1=O Amb27640064 [0,0,0,1,0,0|3,0,0]=4 2407 B7R1.4 C[C@H]1CCNC1=O Amb27949295 [0,0,0,1,0,0|3,0,0]=4 2408 B7R1.4 C[C@H]1COC[C@@H]1N Amb33805302 [0,0,0,1,0,0|2,0,1]=4 2409 B7R1.4 C[C@H]1COC[C@@H]1O Amb24609705 [0,0,0,1,0,0|2,0,1]=4 2410 B7R1.4 C[C@H]1COC[C@H]1N Amb27202968 [0,0,0,1,0,0|2,0,1]=4 2411 B7R1.4 C[C@H]1COC[C@H]1O Amb26400701 [0,0,0,1,0,0|2,0,1]=4 2412 B7R1.4 C[C@H]1OCC[C@H]1N Amb25174385 [0,0,0,1,0,0|2,0,1]=4 2413 B7R1.4 N=C1OCCN1N Amb27803735 [0,0,0,1,0,0|3,0,0]=4 2414 B7R1.4 NC1=CCOC1=O Amb22234102 [0,0,0,1,0,0|1,0,2]=4 2415 B7R1.4 NC1=CONC1=O Amb18203033 [0,0,0,1,0,0|1,0,2]=4 2416 B7R1.4 NC1C=NNC1=O Amb18202634 [0,0,0,1,0,0|2,0,1]=4 2417 B7R1.4 NC1CCC=C1Br Amb33295394 [0,0,0,1,0,0|3,0,0]=4 2418 B7R1.4 NC1CCC=C1Br Amb33484034 [0,0,0,1,0,0|3,0,0]=4 2419 B7R1.4 NC1CCCC1=O Amb17939050 [0,0,0,1,0,0|2,0,0]=3 2420 B7R1.4 NC1CCCC1=O Amb28994832 [0,0,0,1,0,0|2,0,0]=3 2421 B7R1.4 NC1CCCC1O Amb13951342 [0,0,0,1,0,0|2,0,1]=4 2422 B7R1.4 NC1CCCC1O Amb8385206 [0,0,0,1,0,0|2,0,1]=4 2423 B7R1.4 NC1CCNC1=O Amb21955321 [0,0,0,1,0,0|2,0,0]=3 2424 B7R1.4 NC1CCNC1=O Amb6739903 [0,0,0,1,0,0|2,0,0]=3 2425 B7R1.4 NC1CCOC1=O Amb17614991 [0,0,0,1,0,0|1,0,0]=2 2426 B7R1.4 NC1CCOC1=O Amb6609049 [0,0,0,1,0,0|1,0,0]=2 2427 B7R1.4 NC1CCOC1=O Amb9761351 [0,0,0,1,0,0|1,0,0]=2 2428 B7R1.4 NC1CCOC1O Amb27408022 [0,0,0,1,0,0|1,0,2]=4 2429 B7R1.4 NC1CCSC1=O Amb1151877 [0,0,0,1,0,0|1,1,0]=3 2430 B7R1.4 NC1CCSC1=O Amb2720274 [0,0,0,1,0,0|1,1,0]=3 2431 B7R1.4 NC1CNCC1O Amb22235661 [0,0,0,1,0,0|2,0,1]=4 2432 B7R1.4 NC1COCC1=O Amb18202885 [0,0,0,1,0,0|1,0,0]=2 2433 B7R1.4 NC1COCC1=O Amb33328736 [0,0,0,1,0,0|1,0,0]=2 2434 B7R1.4 NC1COCC1N Amb23590778 [0,0,0,1,0,0|2,0,1]=4 2435 B7R1.4 NC1COCC1N Amb32665881 [0,0,0,1,0,0|2,0,1]=4 2436 B7R1.4 NC1COCC1O Amb18277417 [0,0,0,1,0,0|1,0,1]=3 2437 B7R1.4 NC1COCC1O Amb19515137 [0,0,0,1,0,0|1,0,1]=3 2438 B7R1.4 NC1CONC1=O Amb1865548 [0,0,0,1,0,0|1,0,0]=2 2439 B7R1.4 NC1CSCC1=O Amb18202693 [0,0,0,1,0,0|1,1,0]=3 2440 B7R1.4 NC1CSCC1O Amb2693597 [0,0,0,1,0,0|1,1,1]=4 2441 B7R1.4 NC1CSCC1O Amb5634210 [0,0,0,1,0,0|1,1,1]=4 2442 B7R1.4 NC1CSCC1O Amb8565080 [0,0,0,1,0,0|1,1,1]=4 2443 B7R1.4 NC1CSNC1=O Amb27435893 [0,0,0,1,0,0|1,1,0]=3 2444 B7R1.4 NN1CCCC1=O Amb8496496 [0,0,0,1,0,0|3,0,0]=4 2445 B7R1.4 NN1CCCC1=O Amb9174227 [0,0,0,1,0,0|3,0,0]=4 2446 B7R1.4 NN1CCNC1=O Amb5722000 [0,0,0,1,0,0|3,0,0]=4 2447 B7R1.4 NN1CCOC1=O Amb10068971 [0,0,0,1,0,0|2,0,0]=3 2448 B7R1.4 NN1CCOC1=O Amb33532698 [0,0,0,1,0,0|2,0,0]=3 2449 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993810 [0,0,0,1,0,0|2,0,1]=4 2450 B7R1.4 N[C@@H]1CCC[C@@H]1O Amb1993921 [0,0,0,1,0,0|2,0,1]=4 2451 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993811 [0,0,0,1,0,0|2,0,1]=4 2452 B7R1.4 N[C@@H]1CCC[C@H]1O Amb1993922 [0,0,0,1,0,0|2,0,1]=4 2453 B7R1.4 N[C@@H]1CCC[C@H]1O Amb30451169 [0,0,0,1,0,0|2,0,1]=4 2454 B7R1.4 N[C@@H]1CCC[C@H]1O Amb33714404 [0,0,0,1,0,0|2,0,1]=4 2455 B7R1.4 N[C@@H]1CCNC1=O Amb19515791 [0,0,0,1,0,0|2,0,0]=3 2456 B7R1.4 N[C@@H]1CCNC1=O Amb22745816 [0,0,0,1,0,0|2,0,0]=3 2457 B7R1.4 N[C@@H]1CCOC1=O Amb10601656 [0,0,0,1,0,0|1,0,0]=2 2458 B7R1.4 N[C@@H]1CCOC1=O Amb22745863 [0,0,0,1,0,0|1,0,0]=2 2459 B7R1.4 N[C@@H]1CCOC1=O Amb3941712 [0,0,0,1,0,0|1,0,0]=2 2460 B7R1.4 N[C@@H]1CNC[C@@H]1O Amb25911176 [0,0,0,1,0,0|2,0,1]=4 2461 B7R1.4 N[C@@H]1COC[C@@H]1F Amb31188298 [0,0,0,1,0,0|2,0,1]=4 2462 B7R1.4 N[C@@H]1COC[C@@H]1F Amb33456080 [0,0,0,1,0,0|2,0,1]=4 2463 B7R1.4 N[C@@H]1COC[C@@H]1N Amb19515126 [0,0,0,1,0,0|2,0,1]=4 2464 B7R1.4 N[C@@H]1COC[C@@H]1N Amb22802084 [0,0,0,1,0,0|2,0,1]=4 2465 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22748842 [0,0,0,1,0,0|1,0,1]=3 2466 B7R1.4 N[C@@H]1COC[C@@H]1O Amb22754535 [0,0,0,1,0,0|1,0,1]=3 2467 B7R1.4 N[C@@H]1COC[C@H]1F Amb33719125 [0,0,0,1,0,0|2,0,1]=4 2468 B7R1.4 N[C@@H]1COC[C@H]1N Amb22231694 [0,0,0,1,0,0|2,0,1]=4 2469 B7R1.4 N[C@@H]1COC[C@H]1N Amb22802083 [0,0,0,1,0,0|2,0,1]=4 2470 B7R1.4 N[C@@H]1COC[C@H]1O Amb17933202 [0,0,0,1,0,0|1,0,1]=3 2471 B7R1.4 N[C@@H]1COC[C@H]1O Amb22746728 [0,0,0,1,0,0|1,0,1]=3 2472 B7R1.4 N[C@@H]1COC[C@H]1O Amb24107553 [0,0,0,1,0,0|1,0,1]=3 2473 B7R1.4 N[C@@H]1COC[C@H]1O Amb33715897 [0,0,0,1,0,0|1,0,1]=3 2474 B7R1.4 N[C@@H]1CONC1=O Amb533888 [0,0,0,1,0,0|1,0,0]=2 2475 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb23482790 [0,0,0,1,0,0|1,1,1]=4 2476 B7R1.4 N[C@@H]1CSC[C@@H]1O Amb532933 [0,0,0,1,0,0|1,1,1]=4 2477 B7R1.4 N[C@@H]1CSC[C@H]1O Amb1099355 [0,0,0,1,0,0|1,1,1]=4 2478 B7R1.4 N[C@H]1CCC[C@@H]1O Amb10604100 [0,0,0,1,0,0|2,0,1]=4 2479 B7R1.4 N[C@H]1CCC[C@@H]1O Amb3941725 [0,0,0,1,0,0|2,0,1]=4 2480 B7R1.4 N[C@H]1CCC[C@H]1O Amb10603107 [0,0,0,1,0,0|2,0,1]=4 2481 B7R1.4 N[C@H]1CCC[C@H]1O Amb28133706 [0,0,0,1,0,0|2,0,1]=4 2482 B7R1.4 N[C@H]1CCNC1=O Amb19887769 [0,0,0,1,0,0|2,0,0]=3 2483 B7R1.4 N[C@H]1CCNC1=O Amb23385346 [0,0,0,1,0,0|2,0,0]=3 2484 B7R1.4 N[C@H]1CCOC1=O Amb10982617 [0,0,0,1,0,0|1,0,0]=2 2485 B7R1.4 N[C@H]1CCOC1=O Amb541960 [0,0,0,1,0,0|1,0,0]=2 2486 B7R1.4 N[C@H]1CCOC1=O Amb5718691 [0,0,0,1,0,0|1,0,0]=2 2487 B7R1.4 N[C@H]1CCSC1=O Amb22362833 [0,0,0,1,0,0|1,1,0]=3 2488 B7R1.4 N[C@H]1CCSC1=O Amb33758042 [0,0,0,1,0,0|1,1,0]=3 2489 B7R1.4 N[C@H]1CCSC1=O Amb8628572 [0,0,0,1,0,0|1,1,0]=3 2490 B7R1.4 N[C@H]1CNC[C@H]1O Amb27621416 [0,0,0,1,0,0|2,0,1]=4 2491 B7R1.4 N[C@H]1CNOC1=O Amb27778477 [0,0,0,1,0,0|1,0,0]=2 2492 B7R1.4 N[C@H]1COC[C@@H]1N Amb26937236 [0,0,0,1,0,0|2,0,1]=4 2493 B7R1.4 N[C@H]1COC[C@@H]1O Amb10608341 [0,0,0,1,0,0|1,0,1]=3 2494 B7R1.4 N[C@H]1COC[C@@H]1O Amb22224915 [0,0,0,1,0,0|1,0,1]=3 2495 B7R1.4 N[C@H]1COC[C@H]1F Amb35825425 [0,0,0,1,0,0|2,0,1]=4 2496 B7R1.4 N[C@H]1COC[C@H]1O Amb25259808 [0,0,0,1,0,0|1,0,1]=3 2497 B7R1.4 N[C@H]1COC[C@H]1O Amb33774994 [0,0,0,1,0,0|1,0,1]=3 2498 B7R1.4 N[C@H]1CONC1=O Amb2719694 [0,0,0,1,0,0|1,0,0]=2 2499 B7R1.4 Nc1nonc1O Amb574750 [0,0,0,1,0,0|2,0,1]=4 2500 B7R1.4 O=C1C=CCC1Cl Amb27482393 [0,0,0,1,0,0|3,0,0]=4 2501 B7R1.4 O=C1CCCC1Br Amb16234114 [0,0,0,1,0,0|3,0,0]=4 2502 B7R1.4 O=C1CCCC1Cl Amb3939970 [0,0,0,1,0,0|3,0,0]=4 2503 B7R1.4 O=C1CCCC1F Amb28050533 [0,0,0,1,0,0|3,0,0]=4 2504 B7R1.4 O=C1CCCC1I Amb25756212 [0,0,0,1,0,0|3,0,0]=4 2505 B7R1.4 O=C1CCCC1O Amb17593081 [0,0,0,1,0,0|3,0,0]=4 2506 B7R1.4 O=C1CCCC1S Amb27838260 [0,0,0,1,0,0|3,0,0]=4 2507 B7R1.4 O=C1CCC[C@@H]1F Amb35788466 [0,0,0,1,0,0|3,0,0]=4 2508 B7R1.4 O=C1CCC[C@H]1F Amb25834416 [0,0,0,1,0,0|3,0,0]=4 2509 B7R1.4 O=C1CCOC1=O Amb27849805 [0,0,0,1,0,0|2,0,1]=4 2510 B7R1.4 O=C1COC=C1O Amb27838226 [0,0,0,1,0,0|2,0,1]=4 2511 B7R1.4 O=C1NCCC1Br Amb20623055 [0,0,0,1,0,0|3,0,0]=4 2512 B7R1.4 O=C1NCCC1Cl Amb28050511 [0,0,0,1,0,0|3,0,0]=4 2513 B7R1.4 O=C1NCCC1F Amb25838145 [0,0,0,1,0,0|3,0,0]=4 2514 B7R1.4 O=C1NCCC1O Amb10603089 [0,0,0,1,0,0|3,0,0]=4 2515 B7R1.4 O=C1NCCC1S Amb18202686 [0,0,0,1,0,0|3,0,0]=4 2516 B7R1.4 O=C1NCC[C@@H]1O Amb10603274 [0,0,0,1,0,0|3,0,0]=4 2517 B7R1.4 O=C1NCC[C@H]1O Amb22225343 [0,0,0,1,0,0|3,0,0]=4 2518 B7R1.4 O=C1OC=CC1Br Amb22015332 [0,0,0,1,0,0|2,0,1]=4 2519 B7R1.4 O=C1OC=CC1S Amb27624883 [0,0,0,1,0,0|2,0,1]=4 2520 B7R1.4 O=C1OC=C[C@@H]1O Amb27472742 [0,0,0,1,0,0|2,0,1]=4 2521 B7R1.4 O=C1OCCC1Br Amb3940058 [0,0,0,1,0,0|2,0,0]=3 2522 B7R1.4 O=C1OCCC1F Amb27642041 [0,0,0,1,0,0|2,0,0]=3 2523 B7R1.4 O=C1OCCC1I Amb24418518 [0,0,0,1,0,0|2,0,0]=3 2524 B7R1.4 O=C1OCCC1O Amb5718058 [0,0,0,1,0,0|2,0,0]=3 2525 B7R1.4 O=C1OCCC1S Amb25146639 [0,0,0,1,0,0|2,0,0]=3 2526 B7R1.4 O=C1OCC[C@@H]1O Amb3939677 [0,0,0,1,0,0|2,0,0]=3 2527 B7R1.4 O=C1OCC[C@H]1Br Amb27407127 [0,0,0,1,0,0|2,0,0]=3 2528 B7R1.4 O=C1OCC[C@H]1Cl Amb28207894 [0,0,0,1,0,0|2,0,0]=3 2529 B7R1.4 O=C1OCC[C@H]1O Amb3939679 [0,0,0,1,0,0|2,0,0]=3 2530 B7R1.4 O=C1OCC[C@H]1S Amb27862288 [0,0,0,1,0,0|2,0,0]=3 2531 B7R1.4 O=C1OCNC1Br Amb25299209 [0,0,0,1,0,0|3,0,0]=4 2532 B7R1.4 O=C1SCC[C@@H]1Br Amb27482200 [0,0,0,1,0,0|2,1,0]=4 2533 B7R1.4 OC1COCC1Br Amb25321008 [0,0,0,1,0,0|2,0,1]=4 2534 B7R1.4 OC1COCC1F Amb26475960 [0,0,0,1,0,0|2,0,1]=4 2535 B7R1.4 OC1COCC1I Amb24332672 [0,0,0,1,0,0|2,0,1]=4 2536 B7R1.4 OC1COCC1O Amb532982 [0,0,0,1,0,0|2,0,1]=4 2537 B7R1.4 OC1COCC1S Amb27970973 [0,0,0,1,0,0|2,0,1]=4 2538 B7R1.4 O[C@@H]1COC[C@@H]1F Amb24600177 [0,0,0,1,0,0|2,0,1]=4 2539 B7R1.4 O[C@@H]1COC[C@H]1Br Amb24356806 [0,0,0,1,0,0|2,0,1]=4 2540 B7R1.4 O[C@@H]1COC[C@H]1F Amb22886831 [0,0,0,1,0,0|2,0,1]=4 2541 B7R1.4 O[C@@H]1COC[C@H]1O Amb22231695 [0,0,0,1,0,0|2,0,1]=4 2542 B7R1.4 O[C@H]1COC[C@@H]1Br Amb24519174 [0,0,0,1,0,0|2,0,1]=4 2543 B7R1.4 O[C@H]1COC[C@@H]1O Amb17938167 [0,0,0,1,0,0|2,0,1]=4 2544 B7R1.4 O[C@H]1COC[C@H]1O Amb22406017 [0,0,0,1,0,0|2,0,1]=4 2545 B7R1.4 [NH3+]C1CCSC1=O Amb22045205 [0,0,0,1,0,0|1,1,1]=4 2546 B7R1.4 [NH3+]C1CCSC1=O Amb24112879 [0,0,0,1,0,0|1,1,1]=4 2547 B7R1.8 CCC1CCC1=O Amb28137082 [0,0,0,1,0,0|3,0,0]=4 2548 B7R1.8 CCC1OCC1=O Amb23456089 [0,0,0,1,0,0|3,0,0]=4 2549 B7R1.8 NCC1CNC1=O Amb25888547 [0,0,0,1,0,0|3,0,0]=4 2550 B7R1.8 O=C1CCC1CBr Amb24633095 [0,0,0,1,0,0|3,0,0]=4 2551 B7R1.8 O=C1CCC1CCl Amb28197139 [0,0,0,1,0,0|3,0,0]=4 2552 B7R1.8 O=C1CCC1CO Amb24722181 [0,0,0,1,0,0|2,0,0]=3 2553 B7R1.8 O=C1CCN1CO Amb28207292 [0,0,0,1,0,0|3,0,0]=4 2554 B7R1.8 O=C1NCC1CO Amb28196532 [0,0,0,1,0,0|2,0,0]=3 2555 B7R1.8 OCC1CCC1O Amb26956761 [0,0,0,1,0,0|2,0,1]=4 2556 B7R1.8 OCC1NC[C@@H]1O Amb27265630 [0,0,0,1,0,0|1,0,1]=3 2557 B7R1.8 OC[C@@H]1CC[C@H]1O Amb34160319 [0,0,0,1,0,0|2,0,1]=4 2558 B7R1.8 OC[C@H]1CC[C@H]1O Amb25662759 [0,0,0,1,0,0|2,0,1]=4 2559 B7R1.8 OC[C@H]1NC[C@H]1O Amb28383856 [0,0,0,1,0,0|1,0,1]=3 2560 B7R1.8 OC[C@H]1SC[C@@H]1O Amb28136441 [0,0,0,1,0,0|2,0,1]=4 2561 B7R1.8 OC[C@H]1SC[C@H]1O Amb27195387 [0,0,0,1,0,0|2,0,1]=4 2562 B7R1.12 C=C1CC1C(=O)O Amb9774969 [0,0,0,1,0,0|2,0,1]=4 2563 B7R1.12 CC(=O)C1CC1C Amb25720437 [0,0,0,1,0,0|3,0,0]=4 2564 B7R1.12 CC(=O)C1OC1C Amb25920285 [0,0,0,1,0,0|3,0,0]=4 2565 B7R1.12 CC(=O)[C@@H]1C[C@H]1C Amb27262976 [0,0,0,1,0,0|3,0,0]=4 2566 B7R1.12 CC(=O)[C@@H]1OC1C Amb27165592 [0,0,0,1,0,0|3,0,0]=4 2567 B7R1.12 CC(=O)[C@H]1C[C@@H]1C Amb27493483 [0,0,0,1,0,0|3,0,0]=4 2568 B7R1.12 CC(=O)[C@H]1O[C@H]1C Amb28052513 [0,0,0,1,0,0|3,0,0]=4 2569 B7R1.12 CC(=O)[C@H]1S[C@@H]1C Amb27231676 [0,0,0,1,0,0|3,0,0]=4 2570 B7R1.12 CC1=CC1C(=O)O Amb27157805 [0,0,0,1,0,0|2,0,1]=4 2571 B7R1.12 CC1CC1C(=O)Cl Amb33528387 [0,0,0,1,0,0|3,0,0]=4 2572 B7R1.12 CC1CC1C(=O)O Amb9703126 [0,0,0,1,0,0|2,0,0]=3 2573 B7R1.12 CC1CC1C(N)=O Amb8858378 [0,0,0,1,0,0|3,0,0]=4 2574 B7R1.12 CC1OC1C(=O)O Amb17593088 [0,0,0,1,0,0|2,0,0]=3 2575 B7R1.12 CC1SC1C(=O)O Amb27195238 [0,0,0,1,0,0|2,0,0]=3 2576 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [0,0,0,1,0,0|2,0,0]=3 2577 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [0,0,0,1,0,0|2,0,0]=3 2578 B7R1.12 C[C@@H]1C[C@H]1C(=O)Cl Amb13883573 [0,0,0,1,0,0|3,0,0]=4 2579 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [0,0,0,1,0,0|2,0,0]=3 2580 B7R1.12 C[C@@H]1C[C@H]1C(N)=O Amb27201134 [0,0,0,1,0,0|3,0,0]=4 2581 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [0,0,0,1,0,0|1,0,0]=2 2582 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [0,0,0,1,0,0|2,0,0]=3 2583 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [0,0,0,1,0,0|2,0,0]=3 2584 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [0,0,0,1,0,0|2,0,0]=3 2585 B7R1.12 C[C@H]1C[C@@H]1C(N)=O Amb27213992 [0,0,0,1,0,0|3,0,0]=4 2586 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [0,0,0,1,0,0|2,0,0]=3 2587 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [0,0,0,1,0,0|2,0,0]=3 2588 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [0,0,0,1,0,0|2,0,0]=3 2589 B7R1.12 NC(=O)C1CC1Br Amb27838278 [0,0,0,1,0,0|3,0,0]=4 2590 B7R1.12 NC(=O)C1CC1F Amb26026786 [0,0,0,1,0,0|3,0,0]=4 2591 B7R1.12 NC(=O)C1CC1N Amb18279694 [0,0,0,1,0,0|3,0,0]=4 2592 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F Amb27758752 [0,0,0,1,0,0|3,0,0]=4 2593 B7R1.12 NC(=O)[C@@H]1C[C@H]1F Amb27403700 [0,0,0,1,0,0|3,0,0]=4 2594 B7R1.12 NC1CC1C(=O)O Amb7762823 [0,0,0,1,0,0|2,0,0]=3 2595 B7R1.12 N[C@@H]1C[C@@H]1C(=O)O Amb25708637 [0,0,0,1,0,0|2,0,0]=3 2596 B7R1.12 N[C@H]1C[C@H]1C(=O)O Amb27630656 [0,0,0,1,0,0|2,0,0]=3 2597 B7R1.12 O=C(Cl)C1CC1Cl Amb27865442 [0,0,0,1,0,0|3,0,0]=4 2598 B7R1.12 O=C(Cl)C1CC1F Amb8389490 [0,0,0,1,0,0|3,0,0]=4 2599 B7R1.12 O=C(Cl)[C@@H]1C[C@@H]1Cl Amb28291528 [0,0,0,1,0,0|3,0,0]=4 2600 B7R1.12 O=C(Cl)[C@H]1C[C@@H]1F Amb22224871 [0,0,0,1,0,0|3,0,0]=4 2601 B7R1.12 O=C(O)C1CC1Br Amb27760446 [0,0,0,1,0,0|2,0,0]=3 2602 B7R1.12 O=C(O)C1CC1Cl Amb28289730 [0,0,0,1,0,0|2,0,0]=3 2603 B7R1.12 O=C(O)C1CC1F Amb22490547 [0,0,0,1,0,0|2,0,0]=3 2604 B7R1.12 O=C(O)C1CC1I Amb26047069 [0,0,0,1,0,0|2,0,0]=3 2605 B7R1.12 O=C(O)C1CC1S Amb20246988 [0,0,0,1,0,0|1,1,0]=3 2606 B7R1.12 O=C(O)[C@@H]1CC1I Amb27616342 [0,0,0,1,0,0|2,0,0]=3 2607 B7R1.12 O=C(O)[C@@H]1C[C@@H]1Br Amb27232903 [0,0,0,1,0,0|2,0,0]=3 2608 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb22737600 [0,0,0,1,0,0|2,0,0]=3 2609 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F Amb33716967 [0,0,0,1,0,0|2,0,0]=3 2610 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I Amb22756600 [0,0,0,1,0,0|2,0,0]=3 2611 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br Amb24570997 [0,0,0,1,0,0|2,0,0]=3 2612 B7R1.12 O=C(O)[C@@H]1C[C@H]1Cl Amb28252777 [0,0,0,1,0,0|2,0,0]=3 2613 B7R1.12 O=C(O)[C@@H]1C[C@H]1F Amb22737604 [0,0,0,1,0,0|2,0,0]=3 2614 B7R1.12 O=C(O)[C@@H]1C[C@H]1I Amb26636211 [0,0,0,1,0,0|2,0,0]=3 2615 B7R1.12 O=C(O)[C@H]1C[C@@H]1Cl Amb27655606 [0,0,0,1,0,0|2,0,0]=3 2616 B7R1.12 O=C(O)[C@H]1C[C@@H]1F Amb22736113 [0,0,0,1,0,0|2,0,0]=3 2617 B7R1.12 O=C(O)[C@H]1C[C@@H]1I Amb27968689 [0,0,0,1,0,0|2,0,0]=3 2618 B7R1.12 O=C(O)[C@H]1C[C@H]1F Amb22738580 [0,0,0,1,0,0|2,0,0]=3 2619 B7R1.12 O=C(O)[C@H]1C[C@H]1I Amb22736654 [0,0,0,1,0,0|2,0,0]=3 2620 B7R1.15 CC1C(=O)CC1O Amb28423178 [0,0,0,1,0,0|2,0,0]=3 2621 B7R1.15 CC1CC(=O)C1C Amb33551302 [0,0,0,1,0,0|3,0,0]=4 2622 B7R1.15 CC1NC(=O)C1C Amb22364651 [0,0,0,1,0,0|3,0,0]=4 2623 B7R1.15 CC1NC(=O)C1N Amb26077932 [0,0,0,1,0,0|2,0,0]=3 2624 B7R1.15 C[C@@H]1C(=O)C[C@H]1C Amb27865634 [0,0,0,1,0,0|3,0,0]=4 2625 B7R1.15 C[C@@H]1NC(=O)[C@H]1Br Amb28051851 [0,0,0,1,0,0|3,0,0]=4 2626 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22388492 [0,0,0,1,0,0|2,0,0]=3 2627 B7R1.15 C[C@@H]1NC(=O)[C@H]1N Amb22757240 [0,0,0,1,0,0|2,0,0]=3 2628 B7R1.15 C[C@H]1CC(=O)[C@@H]1C Amb27433516 [0,0,0,1,0,0|3,0,0]=4 2629 B7R1.15 C[C@H]1CC(=O)[C@H]1C Amb27788507 [0,0,0,1,0,0|3,0,0]=4 2630 B7R1.15 C[C@H]1OC(=O)[C@H]1N Amb27629736 [0,0,0,1,0,0|1,0,0]=2 2631 B7R1.17 CC1(C)OCC1N Amb26946725 [0,0,0,1,0,0|2,0,1]=4 2632 B7R1.17 CC1(O)CCC1N Amb24117490 [0,0,0,1,0,0|2,0,1]=4 2633 B7R1.17 CC1(O)CCC1N Amb25968766 [0,0,0,1,0,0|2,0,1]=4 2634 B7R1.17 C[C@@]1(O)CC[C@H]1N Amb32664480 [0,0,0,1,0,0|2,0,1]=4 2635 B7R1.17 C[C@@]1(O)CC[C@H]1N Amb32664481 [0,0,0,1,0,0|2,0,1]=4 2636 B7R1.18 C=C(C)C1CCN1 Amb33199611 [0,0,0,1,0,0|3,0,0]=4 2637 B7R1.18 CC(=O)C1CCC1 Amb4037098 [0,0,0,1,0,0|3,0,0]=4 2638 B7R1.18 CC(=O)C1CCN1 Amb28142364 [0,0,0,1,0,0|2,0,0]=3 2639 B7R1.18 CC(=O)C1CNC1 Amb23400009 [0,0,0,1,0,0|3,0,0]=4 2640 B7R1.18 CC(=O)C1CNC1 Amb23401240 [0,0,0,1,0,0|3,0,0]=4 2641 B7R1.18 CC(=O)C1CNC1 Amb33473586 [0,0,0,1,0,0|3,0,0]=4 2642 B7R1.18 CC(=O)C1COC1 Amb27397483 [0,0,0,1,0,0|2,0,0]=3 2643 B7R1.18 CC(=O)C1CSC1 Amb29849423 [0,0,0,1,0,0|2,1,0]=4 2644 B7R1.18 CC(O)C1COC1 Amb33715759 [0,0,0,1,0,0|2,0,1]=4 2645 B7R1.18 N=C(N)C1CCN1 Amb28410949 [0,0,0,1,0,0|3,0,0]=4 2646 B7R1.18 N=C(N)[C@@H]1CCN1 Amb27790002 [0,0,0,1,0,0|3,0,0]=4 2647 B7R1.18 NC(=O)C1CCC1 Amb33552668 [0,0,0,1,0,0|3,0,0]=4 2648 B7R1.18 NC(=O)C1CCN1 Amb22230240 [0,0,0,1,0,0|2,0,0]=3 2649 B7R1.18 NC(=O)C1CCN1 Amb22491865 [0,0,0,1,0,0|2,0,0]=3 2650 B7R1.18 NC(=O)C1CNC1 Amb10976072 [0,0,0,1,0,0|3,0,0]=4 2651 B7R1.18 NC(=O)C1CNC1 Amb20061301 [0,0,0,1,0,0|3,0,0]=4 2652 B7R1.18 NC(=O)C1CNC1 Amb21960249 [0,0,0,1,0,0|3,0,0]=4 2653 B7R1.18 NC(=O)C1CSC1 Amb27209831 [0,0,0,1,0,0|2,1,0]=4 2654 B7R1.18 NC(=O)[C@@H]1CCN1 Amb27454228 [0,0,0,1,0,0|2,0,0]=3 2655 B7R1.18 NS(=O)C1COC1 Amb32720384 [0,0,0,1,0,0|3,0,0]=4 2656 B7R1.18 O=C(Br)C1CCC1 Amb28291328 [0,0,0,1,0,0|3,0,0]=4 2657 B7R1.18 O=C(Cl)C1CCC1 Amb33528386 [0,0,0,1,0,0|3,0,0]=4 2658 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [0,0,0,1,0,0|2,0,1]=4 2659 B7R1.18 O=C(O)C1CCC1 Amb2686619 [0,0,0,1,0,0|2,0,0]=3 2660 B7R1.18 O=C(O)C1CCN1 Amb2371568 [0,0,0,1,0,0|1,0,0]=2 2661 B7R1.18 O=C(O)C1CCN1 Amb8391098 [0,0,0,1,0,0|1,0,0]=2 2662 B7R1.18 O=C(O)C1CCO1 Amb2383526 [0,0,0,1,0,0|2,0,0]=3 2663 B7R1.18 O=C(O)C1CCS1 Amb27209836 [0,0,0,1,0,0|2,0,0]=3 2664 B7R1.18 O=C(O)C1CNC1 Amb2444164 [0,0,0,1,0,0|2,0,0]=3 2665 B7R1.18 O=C(O)C1CNC1 Amb8384273 [0,0,0,1,0,0|2,0,0]=3 2666 B7R1.18 O=C(O)C1COC1 Amb33542663 [0,0,0,1,0,0|1,0,0]=2 2667 B7R1.18 O=C(O)C1CSC1 Amb20171470 [0,0,0,1,0,0|1,1,0]=3 2668 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [0,0,0,1,0,0|1,0,0]=2 2669 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [0,0,0,1,0,0|1,0,0]=2 2670 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [0,0,0,1,0,0|2,0,0]=3 2671 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [0,0,0,1,0,0|1,0,0]=2 2672 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [0,0,0,1,0,0|1,0,0]=2 2673 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [0,0,0,1,0,0|2,0,0]=3 2674 B7R1.18 O=S(Cl)C1COC1 Amb32720383 [0,0,0,1,0,0|3,0,0]=4 2675 B7R1.18 O=[N+]([O-])C1COC1 Amb22289560 [0,0,0,1,0,0|2,0,1]=4 2676 B7R1.19 C=C(C)C1(C)CO1 Amb25888509 [0,0,0,1,0,0|3,0,0]=4 2677 B7R1.19 C=C(C)C1(N)CC1 Amb33199908 [0,0,0,1,0,0|3,0,0]=4 2678 B7R1.19 CC(=O)C1(Br)CC1 Amb22498709 [0,0,0,1,0,0|3,0,0]=4 2679 B7R1.19 CC(=O)C1(C)CC1 Amb1161819 [0,0,0,1,0,0|3,0,0]=4 2680 B7R1.19 CC(=O)C1(C)CO1 Amb9677568 [0,0,0,1,0,0|2,0,0]=3 2681 B7R1.19 CC(=O)C1(Cl)CC1 Amb20671915 [0,0,0,1,0,0|3,0,0]=4 2682 B7R1.19 CC(=O)C1(F)CC1 Amb22388893 [0,0,0,1,0,0|3,0,0]=4 2683 B7R1.19 CC(=O)C1(N)CC1 Amb25279285 [0,0,0,1,0,0|2,0,0]=3 2684 B7R1.19 CC(=O)C1(N)CC1 Amb28827658 [0,0,0,1,0,0|2,0,0]=3 2685 B7R1.19 CC(=O)[C@@]1(C)CO1 Amb28050546 [0,0,0,1,0,0|2,0,0]=3 2686 B7R1.19 CC(O)C1(C)CO1 Amb27763622 [0,0,0,1,0,0|2,0,1]=4 2687 B7R1.19 CC(O)C1(N)CC1 Amb29849543 [0,0,0,1,0,0|2,0,1]=4 2688 B7R1.19 CC1(C(=O)Cl)CC1 Amb16230812 [0,0,0,1,0,0|3,0,0]=4 2689 B7R1.19 CC1(C(=O)O)CC1 Amb2779924 [0,0,0,1,0,0|2,0,0]=3 2690 B7R1.19 CC1(C(=O)O)CO1 Amb33542864 [0,0,0,1,0,0|1,0,0]=2 2691 B7R1.19 CC1(C(N)=O)CC1 Amb19958822 [0,0,0,1,0,0|3,0,0]=4 2692 B7R1.19 N=C(N)C1(N)CC1 Amb35595082 [0,0,0,1,0,0|3,0,0]=4 2693 B7R1.19 NC(=O)C1(Br)CC1 Amb22234538 [0,0,0,1,0,0|3,0,0]=4 2694 B7R1.19 NC(=O)C1(Cl)CC1 Amb28187965 [0,0,0,1,0,0|3,0,0]=4 2695 B7R1.19 NC(=O)C1(F)CC1 Amb27851813 [0,0,0,1,0,0|3,0,0]=4 2696 B7R1.19 NC(=O)C1(N)CC1 Amb22001522 [0,0,0,1,0,0|2,0,0]=3 2697 B7R1.19 NC(=O)C1(N)CC1 Amb33544868 [0,0,0,1,0,0|2,0,0]=3 2698 B7R1.19 NC(=O)C1(O)CC1 Amb25745829 [0,0,0,1,0,0|3,0,0]=4 2699 B7R1.19 NC1(C(=O)O)CC1 Amb4296883 [0,0,0,1,0,0|1,0,0]=2 2700 B7R1.19 NC1(C(=O)O)CC1 Amb6223185 [0,0,0,1,0,0|1,0,0]=2 2701 B7R1.19 NC1([PH](=O)O)CC1 Amb27655512 [0,0,0,1,0,0|2,0,0]=3 2702 B7R1.19 O=C(O)C1(Br)CC1 Amb33544592 [0,0,0,1,0,0|2,0,0]=3 2703 B7R1.19 O=C(O)C1(Cl)CC1 Amb25841916 [0,0,0,1,0,0|2,0,0]=3 2704 B7R1.19 O=C(O)C1(F)CC1 Amb22001836 [0,0,0,1,0,0|2,0,0]=3 2705 B7R1.19 O=C(O)C1(O)CC1 Amb6609000 [0,0,0,1,0,0|2,0,0]=3 2706 B7R1.22 NC(CO)C1CC1 Amb18282445 [0,0,0,1,0,0|2,0,1]=4 2707 B7R1.22 NC(CO)C1CC1 Amb19374057 [0,0,0,1,0,0|2,0,1]=4 2708 B7R1.22 N[C@@H](CO)C1CC1 Amb24077521 [0,0,0,1,0,0|2,0,1]=4 2709 B7R1.22 N[C@@H](CO)C1CC1 Amb25798421 [0,0,0,1,0,0|2,0,1]=4 2710 B7R1.22 N[C@H](CO)C1CC1 Amb24077489 [0,0,0,1,0,0|2,0,1]=4 2711 B7R1.22 N[C@H](CO)C1CC1 Amb24568257 [0,0,0,1,0,0|2,0,1]=4 2712 B7R1.22 OCC(O)C1CO1 Amb26046743 [0,0,0,1,0,0|2,0,1]=4 2713 B7R1.22 OC[C@@H](O)[C@H]1CO1 Amb27432222 [0,0,0,1,0,0|2,0,1]=4 2714 B7R1.27 C=C1CC1(N)CO Amb27463476 [0,0,0,1,0,0|2,0,0]=3 2715 B7R1.27 CC1CC1(N)CO Amb27209727 [0,0,0,1,0,0|2,0,1]=4 2716 B7R1.27 CC1OC1(C)CO Amb27480879 [0,0,0,1,0,0|2,0,1]=4 2717 B7R1.27 C[C@@H]1O[C@@]1(C)CO Amb27207277 [0,0,0,1,0,0|2,0,1]=4 2718 B7R1.27 C[C@H]1C[C@]1(N)CO Amb27192484 [0,0,0,1,0,0|2,0,1]=4 2719 B7R1.27 C[C@H]1O[C@]1(C)CO Amb27451635 [0,0,0,1,0,0|2,0,1]=4 2720 B7R0.2 C#CC(C)CC(=O)O Amb27246384 [0,0,0,0,0,1|2,0,1]=4 2721 B7R0.2 C#C[C@H](O)CC(=O)O Amb28285208 [0,0,0,0,0,1|2,0,1]=4 2722 B7R0.2 C=C(Br)CC(O)CO Amb27206509 [0,0,0,0,0,1|3,0,0]=4 2723 B7R0.2 C=C(Br)C[C@@H](C)CO Amb28069642 [0,0,0,0,0,1|3,0,0]=4 2724 B7R0.2 C=C(Br)C[C@H](C)CO Amb27196706 [0,0,0,0,0,1|3,0,0]=4 2725 B7R0.2 C=C(C)CC(F)CO Amb28079110 [0,0,0,0,0,1|3,0,0]=4 2726 B7R0.2 C=C(C)CC(N)CO Amb24665584 [0,0,0,0,0,1|2,0,0]=3 2727 B7R0.2 C=C(C)C[C@H](N)CO Amb27633094 [0,0,0,0,0,1|2,0,0]=3 2728 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [0,0,0,0,0,1|2,0,1]=4 2729 B7R0.2 C=C(Cl)C[C@H](O)CO Amb24560451 [0,0,0,0,0,1|3,0,0]=4 2730 B7R0.2 C=CC(C)CC(=O)O Amb18641774 [0,0,0,0,0,1|2,0,1]=4 2731 B7R0.2 C=CC(N)CC(=O)O Amb22641963 [0,0,0,0,0,1|1,0,1]=3 2732 B7R0.2 C=CC(N)CC(=O)O Amb31307621 [0,0,0,0,0,1|1,0,1]=3 2733 B7R0.2 C=CC(O)CC(=O)O Amb18641866 [0,0,0,0,0,1|2,0,1]=4 2734 B7R0.2 C=C[C@@H](C)CC(=O)O Amb27868377 [0,0,0,0,0,1|2,0,1]=4 2735 B7R0.2 C=C[C@@H](N)CC(=O)O Amb28315938 [0,0,0,0,0,1|1,0,1]=3 2736 B7R0.2 C=C[C@H](C)CC(=O)O Amb25791667 [0,0,0,0,0,1|2,0,1]=4 2737 B7R0.2 CC(=O)CC(=O)CO Amb28316150 [0,0,0,0,0,1|2,0,1]=4 2738 B7R0.2 CC(=O)CC(C)CCl Amb28313530 [0,0,0,0,0,1|3,0,0]=4 2739 B7R0.2 CC(=O)CC(C)CN Amb18251072 [0,0,0,0,0,1|3,0,0]=4 2740 B7R0.2 CC(=O)CC(N)CO Amb27240210 [0,0,0,0,0,1|1,0,0]=2 2741 B7R0.2 CC(=O)CC(O)CCl Amb27827457 [0,0,0,0,0,1|3,0,0]=4 2742 B7R0.2 CC(=O)C[C@@H](O)CCl Amb27817734 [0,0,0,0,0,1|3,0,0]=4 2743 B7R0.2 CC(=O)C[C@H](O)CO Amb28316148 [0,0,0,0,0,1|2,0,0]=3 2744 B7R0.2 CC(=O)NC(C)CCl Amb33542146 [0,0,0,0,0,1|3,0,0]=4 2745 B7R0.2 CC(=O)NC(C)CO Amb9276356 [0,0,0,0,0,1|2,0,0]=3 2746 B7R0.2 CC(=O)N[C@@H](C)CN Amb27768700 [0,0,0,0,0,1|3,0,0]=4 2747 B7R0.2 CC(=O)N[C@@H](C)CO Amb26515722 [0,0,0,0,0,1|2,0,0]=3 2748 B7R0.2 CC(=O)N[C@H](C)CO Amb24426644 [0,0,0,0,0,1|2,0,0]=3 2749 B7R0.2 CC(=O)OC(Br)CBr Amb21520423 [0,0,0,0,0,1|3,0,0]=4 2750 B7R0.2 CC(=O)OC(C)CBr Amb26477506 [0,0,0,0,0,1|3,0,0]=4 2751 B7R0.2 CC(=O)OC(C)CN Amb27838841 [0,0,0,0,0,1|3,0,0]=4 2752 B7R0.2 CC(=O)OC(F)CBr Amb28239801 [0,0,0,0,0,1|3,0,0]=4 2753 B7R0.2 CC(=O)OC(F)CCl Amb27473993 [0,0,0,0,0,1|3,0,0]=4 2754 B7R0.2 CC(=O)OC(O)CN Amb27839430 [0,0,0,0,0,1|3,0,0]=4 2755 B7R0.2 CC(=O)SC(C)CBr Amb27983834 [0,0,0,0,0,1|3,0,0]=4 2756 B7R0.2 CC(=O)SC(C)CCl Amb27253145 [0,0,0,0,0,1|3,0,0]=4 2757 B7R0.2 CC(=O)\C=C(/C)CO Amb25240045 [0,0,0,0,0,1|2,0,1]=4 2758 B7R0.2 CC(=O)\C=C(/N)CO Amb27839108 [0,0,0,0,0,1|1,0,1]=3 2759 B7R0.2 CC(=O)\C=C(\C)CO Amb24518297 [0,0,0,0,0,1|2,0,1]=4 2760 B7R0.2 CC(C#N)CC(=O)O Amb17334057 [0,0,0,0,0,1|2,0,1]=4 2761 B7R0.2 CC(C)=CC(C)CO Amb28318182 [0,0,0,0,0,1|3,0,0]=4 2762 B7R0.2 CC(C)CC(N)CO Amb18015118 [0,0,0,0,0,1|2,0,1]=4 2763 B7R0.2 CC(C)C[C@@H](N)CO Amb22746869 [0,0,0,0,0,1|2,0,1]=4 2764 B7R0.2 CC(C)C[C@@H](N)CO Amb3939340 [0,0,0,0,0,1|2,0,1]=4 2765 B7R0.2 CC(C)C[C@H](N)CO Amb22504556 [0,0,0,0,0,1|2,0,1]=4 2766 B7R0.2 CC(C)C[C@H](N)CO Amb3940063 [0,0,0,0,0,1|2,0,1]=4 2767 B7R0.2 CC(CC(=O)O)NN Amb28346224 [0,0,0,0,0,1|3,0,0]=4 2768 B7R0.2 CC(CC(=O)O)NN Amb33141007 [0,0,0,0,0,1|3,0,0]=4 2769 B7R0.2 CC(CCl)CC(=O)Cl Amb27949867 [0,0,0,0,0,1|3,0,0]=4 2770 B7R0.2 CC(CCl)OC(=O)Cl Amb27482960 [0,0,0,0,0,1|3,0,0]=4 2771 B7R0.2 CC(CCl)OC(=O)F Amb27424209 [0,0,0,0,0,1|3,0,0]=4 2772 B7R0.2 CC(CF)CC(=O)O Amb25990964 [0,0,0,0,0,1|2,0,0]=3 2773 B7R0.2 CC(CN)CC(=O)O Amb18124263 [0,0,0,0,0,1|2,0,0]=3 2774 B7R0.2 CC(CN)CC(=O)O Amb20669501 [0,0,0,0,0,1|2,0,0]=3 2775 B7R0.2 CC(CN)CC(=O)O Amb32752805 [0,0,0,0,0,1|2,0,0]=3 2776 B7R0.2 CC(CN)CC(N)=O Amb18641899 [0,0,0,0,0,1|3,0,0]=4 2777 B7R0.2 CC(CN)NC(N)=O Amb18202682 [0,0,0,0,0,1|3,0,0]=4 2778 B7R0.2 CC(CN)O[PH](=O)O Amb28388782 [0,0,0,0,0,1|3,0,0]=4 2779 B7R0.2 CC(CO)CC(=O)O Amb18198168 [0,0,0,0,0,1|1,0,0]=2 2780 B7R0.2 CC(CO)CC(=O)[O-] Amb33329956 [0,0,0,0,0,1|1,0,1]=3 2781 B7R0.2 CC(CO)NS(C)=O Amb28286003 [0,0,0,0,0,1|3,0,0]=4 2782 B7R0.2 CC(CO)OC(N)=O Amb26402233 [0,0,0,0,0,1|2,0,0]=3 2783 B7R0.2 CC(CO)OP(O)O Amb27982304 [0,0,0,0,0,1|2,0,1]=4 2784 B7R0.2 CC(CO)O[N+](=O)[O-] Amb33299443 [0,0,0,0,0,1|2,0,1]=4 2785 B7R0.2 CC(O)C[C@H](C)CO Amb27394893 [0,0,0,0,0,1|2,0,1]=4 2786 B7R0.2 CC(O)C[C@H](O)CO Amb27397070 [0,0,0,0,0,1|2,0,1]=4 2787 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [0,0,0,0,0,1|2,0,1]=4 2788 B7R0.2 CCC(C)CC(=O)Cl Amb10844649 [0,0,0,0,0,1|3,0,0]=4 2789 B7R0.2 CCC(C)CC(=O)O Amb2689581 [0,0,0,0,0,1|2,0,0]=3 2790 B7R0.2 CCC(C)CC(C)=O Amb10608208 [0,0,0,0,0,1|3,0,0]=4 2791 B7R0.2 CCC(C)CC(N)=O Amb25230669 [0,0,0,0,0,1|3,0,0]=4 2792 B7R0.2 CCC(C)NC(=O)Cl Amb27838339 [0,0,0,0,0,1|3,0,0]=4 2793 B7R0.2 CCC(C)NC(C)=O Amb3358085 [0,0,0,0,0,1|3,0,0]=4 2794 B7R0.2 CCC(C)NC(N)=O Amb9702507 [0,0,0,0,0,1|3,0,0]=4 2795 B7R0.2 CCC(C)OC(=O)Cl Amb22168283 [0,0,0,0,0,1|3,0,0]=4 2796 B7R0.2 CCC(C)SC(=O)Cl Amb22350350 [0,0,0,0,0,1|3,0,0]=4 2797 B7R0.2 CCC(Cl)CC(C)=O Amb28121450 [0,0,0,0,0,1|3,0,0]=4 2798 B7R0.2 CCC(Cl)OC(C)=O Amb27392214 [0,0,0,0,0,1|3,0,0]=4 2799 B7R0.2 CCC(Cl)SC(=O)Cl Amb27945612 [0,0,0,0,0,1|3,0,0]=4 2800 B7R0.2 CCC(Cl)SC(C)=O Amb27407733 [0,0,0,0,0,1|3,0,0]=4 2801 B7R0.2 CCC(N)C=C(C)C Amb27450297 [0,0,0,0,0,1|3,0,0]=4 2802 B7R0.2 CCC(N)CC(=O)O Amb1993862 [0,0,0,0,0,1|1,0,0]=2 2803 B7R0.2 CCC(N)CC(=O)O Amb8631361 [0,0,0,0,0,1|1,0,0]=2 2804 B7R0.2 CCC(N)CC(C)=O Amb18631696 [0,0,0,0,0,1|2,0,0]=3 2805 B7R0.2 CCC(N)CC(C)=O Amb26895708 [0,0,0,0,0,1|2,0,0]=3 2806 B7R0.2 CCC(N)CC(C)O Amb27604743 [0,0,0,0,0,1|2,0,1]=4 2807 B7R0.2 CCC(N)CC(N)=O Amb25727686 [0,0,0,0,0,1|2,0,0]=3 2808 B7R0.2 CCC(N)CC(N)=S Amb28078345 [0,0,0,0,0,1|2,1,0]=4 2809 B7R0.2 CCC(O)CC(=O)O Amb10844270 [0,0,0,0,0,1|2,0,0]=3 2810 B7R0.2 CCC(O)CC(C)=O Amb25065181 [0,0,0,0,0,1|3,0,0]=4 2811 B7R0.2 CCC(O)OC(C)=O Amb28256771 [0,0,0,0,0,1|3,0,0]=4 2812 B7R0.2 CCN(C)CC(=O)O Amb33620688 [0,0,0,0,0,1|3,0,0]=4 2813 B7R0.2 CCN(C)CC(=O)O Amb8428140 [0,0,0,0,0,1|3,0,0]=4 2814 B7R0.2 CCN(O)CC(=O)O Amb28195485 [0,0,0,0,0,1|3,0,0]=4 2815 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [0,0,0,0,0,1|3,0,0]=4 2816 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [0,0,0,0,0,1|2,0,0]=3 2817 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [0,0,0,0,0,1|1,0,0]=2 2818 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [0,0,0,0,0,1|1,0,0]=2 2819 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [0,0,0,0,0,1|2,0,0]=3 2820 B7R0.2 CC[C@@H](O)CC(C)=O Amb25060158 [0,0,0,0,0,1|3,0,0]=4 2821 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [0,0,0,0,0,1|2,0,0]=3 2822 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [0,0,0,0,0,1|1,0,0]=2 2823 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [0,0,0,0,0,1|1,0,0]=2 2824 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [0,0,0,0,0,1|2,0,0]=3 2825 B7R0.2 CC[C@H](O)CC(C)=O Amb26980782 [0,0,0,0,0,1|3,0,0]=4 2826 B7R0.2 CC\C(Br)=C\C(=O)O Amb27409320 [0,0,0,0,0,1|2,0,1]=4 2827 B7R0.2 CC\C(C)=C/C(=O)O Amb18281014 [0,0,0,0,0,1|2,0,1]=4 2828 B7R0.2 CC\C(C)=C\C(=O)O Amb33528462 [0,0,0,0,0,1|2,0,1]=4 2829 B7R0.2 CC\C(F)=C/C(=O)O Amb27780201 [0,0,0,0,0,1|2,0,1]=4 2830 B7R0.2 CC\C(N)=C\C(=O)O Amb28145108 [0,0,0,0,0,1|1,0,1]=3 2831 B7R0.2 CC\C(N)=C\C(N)=O Amb27621383 [0,0,0,0,0,1|2,0,1]=4 2832 B7R0.2 CC\C(N)=N\C(C)=O Amb27391863 [0,0,0,0,0,1|2,0,1]=4 2833 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [0,0,0,0,0,1|2,0,1]=4 2834 B7R0.2 CN(C)CC(N)CO Amb25742525 [0,0,0,0,0,1|3,0,0]=4 2835 B7R0.2 CN(C)CC(N)CO Amb28934849 [0,0,0,0,0,1|3,0,0]=4 2836 B7R0.2 CN(CO)CC(=O)O Amb27663224 [0,0,0,0,0,1|2,0,0]=3 2837 B7R0.2 CNC(C)CC(=O)O Amb21959674 [0,0,0,0,0,1|3,0,0]=4 2838 B7R0.2 CNC(C)CC(=O)O Amb9398363 [0,0,0,0,0,1|3,0,0]=4 2839 B7R0.2 CN[C@H](C)CC(=O)O Amb25339129 [0,0,0,0,0,1|3,0,0]=4 2840 B7R0.2 COC(C)CC(=O)O Amb4001695 [0,0,0,0,0,1|3,0,0]=4 2841 B7R0.2 CO[C@H](C)CC(=O)O Amb27266082 [0,0,0,0,0,1|3,0,0]=4 2842 B7R0.2 CSC(C)CC(=O)O Amb18967824 [0,0,0,0,0,1|3,0,0]=4 2843 B7R0.2 CS[C@H](C)CC(=O)O Amb27648548 [0,0,0,0,0,1|3,0,0]=4 2844 B7R0.2 C[C@@H](CCl)CC(=O)Cl Amb27855839 [0,0,0,0,0,1|3,0,0]=4 2845 B7R0.2 C[C@@H](CF)NC(N)=O Amb27660553 [0,0,0,0,0,1|3,0,0]=4 2846 B7R0.2 C[C@@H](CN)CC(=O)O Amb26864355 [0,0,0,0,0,1|2,0,0]=3 2847 B7R0.2 C[C@@H](CN)CC(=O)O Amb32656230 [0,0,0,0,0,1|2,0,0]=3 2848 B7R0.2 C[C@H](CN)CC(=O)O Amb26887694 [0,0,0,0,0,1|2,0,0]=3 2849 B7R0.2 C[C@H](CN)CC(=O)O Amb32663834 [0,0,0,0,0,1|2,0,0]=3 2850 B7R0.2 C[C@H](CN)NC(N)=O Amb28049036 [0,0,0,0,0,1|3,0,0]=4 2851 B7R0.2 C[C@H](CO)CC(=O)O Amb28040661 [0,0,0,0,0,1|1,0,0]=2 2852 B7R0.2 C[C@H](CO)NS(C)=O Amb27226913 [0,0,0,0,0,1|3,0,0]=4 2853 B7R0.2 C[C@H](O)C[C@H](O)CO Amb27472671 [0,0,0,0,0,1|2,0,1]=4 2854 B7R0.2 C\C(=C/C(=O)O)CO Amb18641871 [0,0,0,0,0,1|1,0,1]=3 2855 B7R0.2 C\C(Br)=C\[C@@H](C)CO Amb28206195 [0,0,0,0,0,1|3,0,0]=4 2856 B7R0.2 C\C(CC(=O)O)=N/O Amb28388976 [0,0,0,0,0,1|2,0,1]=4 2857 B7R0.2 N#CC(N)CC(=O)O Amb27985578 [0,0,0,0,0,1|1,0,1]=3 2858 B7R0.2 N#CC(N)CC(N)=O Amb24122907 [0,0,0,0,0,1|2,0,1]=4 2859 B7R0.2 NC(=O)CC(Br)CO Amb28384721 [0,0,0,0,0,1|2,0,0]=3 2860 B7R0.2 NC(=O)CC(N)CCl Amb26458731 [0,0,0,0,0,1|2,0,0]=3 2861 B7R0.2 NC(=O)CC(O)CO Amb25662216 [0,0,0,0,0,1|2,0,0]=3 2862 B7R0.2 NC(=O)C[C@@H](O)CCl Amb27173051 [0,0,0,0,0,1|3,0,0]=4 2863 B7R0.2 NC(=O)C[C@H](O)CO Amb8388588 [0,0,0,0,0,1|2,0,0]=3 2864 B7R0.2 NC(=O)C\C(N)=N/O Amb8559051 [0,0,0,0,0,1|2,0,1]=4 2865 B7R0.2 NC(=O)C\C(N)=N\O Amb577388 [0,0,0,0,0,1|2,0,1]=4 2866 B7R0.2 NC(=S)CC(O)CO Amb27793984 [0,0,0,0,0,1|2,1,0]=4 2867 B7R0.2 NC(C=O)CC(=O)O Amb27669608 [0,0,0,0,0,1|0,0,2]=3 2868 B7R0.2 NC(CF)CC(=O)O Amb24428065 [0,0,0,0,0,1|1,0,0]=2 2869 B7R0.2 NC(CO)CC(F)F Amb32729395 [0,0,0,0,0,1|2,0,1]=4 2870 B7R0.2 NC(CS)CC(=O)O Amb25090412 [0,0,0,0,0,1|0,1,0]=2 2871 B7R0.2 NCC(F)C[PH](=O)O Amb28398603 [0,0,0,0,0,1|3,0,0]=4 2872 B7R0.2 NCC(N)CC(=O)O Amb19515145 [0,0,0,0,0,1|1,0,0]=2 2873 B7R0.2 NCC(N)CC(=O)O Amb21858324 [0,0,0,0,0,1|1,0,0]=2 2874 B7R0.2 NCC(N)CC(N)=O Amb27603845 [0,0,0,0,0,1|2,0,0]=3 2875 B7R0.2 NCC(O)CC(=O)O Amb32663899 [0,0,0,0,0,1|2,0,0]=3 2876 B7R0.2 NCC(O)CC(=O)O Amb33544754 [0,0,0,0,0,1|2,0,0]=3 2877 B7R0.2 NCC(O)CS(=O)O Amb27831981 [0,0,0,0,0,1|3,0,0]=4 2878 B7R0.2 NC[C@@H](F)CC(=O)O Amb27481078 [0,0,0,0,0,1|2,0,0]=3 2879 B7R0.2 NC[C@@H](F)CS(=O)O Amb27460870 [0,0,0,0,0,1|3,0,0]=4 2880 B7R0.2 NC[C@@H](F)C[PH](=O)O Amb24481490 [0,0,0,0,0,1|3,0,0]=4 2881 B7R0.2 NC[C@@H](N)CC(=O)O Amb10603267 [0,0,0,0,0,1|1,0,0]=2 2882 B7R0.2 NC[C@@H](O)CC(=O)O Amb32665211 [0,0,0,0,0,1|2,0,0]=3 2883 B7R0.2 NC[C@@H](O)CC(=O)O Amb8386098 [0,0,0,0,0,1|2,0,0]=3 2884 B7R0.2 NC[C@@H](O)CC(N)=O Amb27838875 [0,0,0,0,0,1|3,0,0]=4 2885 B7R0.2 NC[C@@H](O)C[PH](=O)O Amb27596096 [0,0,0,0,0,1|3,0,0]=4 2886 B7R0.2 NC[C@H](F)C[PH](=O)O Amb27216774 [0,0,0,0,0,1|3,0,0]=4 2887 B7R0.2 NC[C@H](O)CC(=O)O Amb8628962 [0,0,0,0,0,1|2,0,0]=3 2888 B7R0.2 NC\C(I)=C\C(=O)O Amb28386476 [0,0,0,0,0,1|2,0,1]=4 2889 B7R0.2 N[C@@H](CO)CC(=O)O Amb16184020 [0,0,0,0,0,1|0,0,0]=1 2890 B7R0.2 N[C@@H](CO)CC(=O)O Amb22388520 [0,0,0,0,0,1|0,0,0]=1 2891 B7R0.2 N[C@H](C=O)CC(=O)O Amb28428447 [0,0,0,0,0,1|0,0,2]=3 2892 B7R0.2 N[C@H](CO)CC(=O)O Amb2694944 [0,0,0,0,0,1|0,0,0]=1 2893 B7R0.2 N[C@H](CS)CC(=O)O Amb28326106 [0,0,0,0,0,1|0,1,0]=2 2894 B7R0.2 N\C(CC(=O)O)=N/O Amb8384544 [0,0,0,0,0,1|1,0,1]=3 2895 B7R0.2 O=C(Cl)OC(Cl)CCl Amb27483797 [0,0,0,0,0,1|3,0,0]=4 2896 B7R0.2 O=C(O)CC(=O)CCl Amb18124484 [0,0,0,0,0,1|2,0,1]=4 2897 B7R0.2 O=C(O)CC(O)CBr Amb27592126 [0,0,0,0,0,1|2,0,0]=3 2898 B7R0.2 O=C(O)CC(O)CF Amb26557587 [0,0,0,0,0,1|2,0,0]=3 2899 B7R0.2 O=C(O)CC(O)CO Amb28120003 [0,0,0,0,0,1|1,0,0]=2 2900 B7R0.2 O=C(O)CC(O)CS Amb27244674 [0,0,0,0,0,1|1,1,0]=3 2901 B7R0.2 O=C(O)C[C@@H](O)CF Amb33377449 [0,0,0,0,0,1|2,0,0]=3 2902 B7R0.2 O=C(O)C[C@H](O)CBr Amb28325607 [0,0,0,0,0,1|2,0,0]=3 2903 B7R0.2 O=C(O)C[C@H](O)CCl Amb27830780 [0,0,0,0,0,1|2,0,0]=3 2904 B7R0.2 O=C(O)C[C@H](O)CF Amb33377451 [0,0,0,0,0,1|2,0,0]=3 2905 B7R0.2 O=C(O)C[C@H](O)CO Amb26353423 [0,0,0,0,0,1|1,0,0]=2 2906 B7R0.2 O=C(O)\C=C(/Br)CO Amb27424808 [0,0,0,0,0,1|1,0,1]=3 2907 B7R0.2 O=C(O)\C=C(\O)CBr Amb28458506 [0,0,0,0,0,1|2,0,1]=4 2908 B7R0.2 O=C([O-])CC(O)CO Amb24117078 [0,0,0,0,0,1|1,0,1]=3 2909 B7R0.2 OCC(F)C=C(Cl)Cl Amb27452022 [0,0,0,0,0,1|3,0,0]=4 2910 B4R0.1 C#CC(=O)O Amb6600128 [2,0,0,0,0,0|0,0,2]=4 2911 B4R0.1 C#CC(C)N Amb19148041 [2,0,0,0,0,0|1,0,1]=4 2912 B4R0.1 C#CC(C)N Amb22266061 [2,0,0,0,0,0|1,0,1]=4 2913 B4R0.1 C#C[C@@H](C)N Amb27807228 [2,0,0,0,0,0|1,0,1]=4 2914 B4R0.1 C#C[C@H](C)N Amb27229818 [2,0,0,0,0,0|1,0,1]=4 2915 B4R0.1 C=C(Br)CN Amb13951282 [2,0,0,0,0,0|2,0,0]=4 2916 B4R0.1 C=C(Br)CO Amb33535555 [2,0,0,0,0,0|1,0,1]=4 2917 B4R0.1 C=C(C)C=O Amb3941638 [2,0,0,0,0,0|1,0,1]=4 2918 B4R0.1 C=C(C)CN Amb17749039 [2,0,0,0,0,0|2,0,0]=4 2919 B4R0.1 C=C(C)CO Amb8513444 [2,0,0,0,0,0|1,0,1]=4 2920 B4R0.1 C=C(Cl)CC Amb22228725 [2,0,0,0,0,0|2,0,0]=4 2921 B4R0.1 C=C(Cl)CN Amb18948531 [2,0,0,0,0,0|2,0,0]=4 2922 B4R0.1 C=C(Cl)CN Amb19514508 [2,0,0,0,0,0|2,0,0]=4 2923 B4R0.1 C=C(Cl)CO Amb9277799 [2,0,0,0,0,0|1,0,1]=4 2924 B4R0.1 C=C(F)CN Amb22008378 [2,0,0,0,0,0|2,0,0]=4 2925 B4R0.1 C=C(F)CO Amb22008254 [2,0,0,0,0,0|1,0,1]=4 2926 B4R0.1 C=C(I)CO Amb27762751 [2,0,0,0,0,0|1,0,1]=4 2927 B4R0.1 C=CC(=O)O Amb2792871 [2,0,0,0,0,0|0,0,2]=4 2928 B4R0.1 C=CC(C)Br Amb17939275 [2,0,0,0,0,0|2,0,0]=4 2929 B4R0.1 C=CC(C)C Amb17666952 [2,0,0,0,0,0|2,0,0]=4 2930 B4R0.1 C=CC(C)Cl Amb8516912 [2,0,0,0,0,0|2,0,0]=4 2931 B4R0.1 C=CC(C)F Amb27793802 [2,0,0,0,0,0|2,0,0]=4 2932 B4R0.1 C=CC(C)N Amb19338158 [2,0,0,0,0,0|1,0,0]=3 2933 B4R0.1 C=CC(C)N Amb20669464 [2,0,0,0,0,0|1,0,0]=3 2934 B4R0.1 C=CC(C)O Amb3940379 [2,0,0,0,0,0|2,0,0]=4 2935 B4R0.1 C=C[C@@H](C)N Amb22225390 [2,0,0,0,0,0|1,0,0]=3 2936 B4R0.1 C=C[C@@H](C)N Amb31291110 [2,0,0,0,0,0|1,0,0]=3 2937 B4R0.1 C=C[C@@H](C)O Amb26328808 [2,0,0,0,0,0|2,0,0]=4 2938 B4R0.1 C=C[C@H](C)N Amb22226721 [2,0,0,0,0,0|1,0,0]=3 2939 B4R0.1 C=C[C@H](C)N Amb33483954 [2,0,0,0,0,0|1,0,0]=3 2940 B4R0.1 CC(=O)C=O Amb3940421 [2,0,0,0,0,0|1,0,1]=4 2941 B4R0.1 CC(=O)CBr Amb6673867 [2,0,0,0,0,0|2,0,0]=4 2942 B4R0.1 CC(=O)CCl Amb2792923 [2,0,0,0,0,0|2,0,0]=4 2943 B4R0.1 CC(=O)CI Amb22831972 [2,0,0,0,0,0|2,0,0]=4 2944 B4R0.1 CC(=O)CN Amb10603379 [2,0,0,0,0,0|1,0,0]=3 2945 B4R0.1 CC(=O)CN Amb22489444 [2,0,0,0,0,0|1,0,0]=3 2946 B4R0.1 CC(=O)CN Amb8393368 [2,0,0,0,0,0|1,0,0]=3 2947 B4R0.1 CC(=O)CO Amb2404925 [2,0,0,0,0,0|1,0,0]=3 2948 B4R0.1 CC(=O)CS Amb19148935 [2,0,0,0,0,0|1,1,0]=4 2949 B4R0.1 CC(=O)NN Amb1153969 [2,0,0,0,0,0|2,0,0]=4 2950 B4R0.1 CC(=O)NO Amb2781575 [2,0,0,0,0,0|2,0,0]=4 2951 B4R0.1 CC(=O)OO Amb8517283 [2,0,0,0,0,0|2,0,0]=4 2952 B4R0.1 CC(Br)C=O Amb8395192 [2,0,0,0,0,0|1,0,0]=3 2953 B4R0.1 CC(Br)CO Amb28145838 [2,0,0,0,0,0|1,0,1]=4 2954 B4R0.1 CC(C)C=O Amb3939852 [2,0,0,0,0,0|1,0,0]=3 2955 B4R0.1 CC(C)CO Amb3939148 [2,0,0,0,0,0|1,0,1]=4 2956 B4R0.1 CC(C)NO Amb22058701 [2,0,0,0,0,0|2,0,0]=4 2957 B4R0.1 CC(C)NO Amb8515003 [2,0,0,0,0,0|2,0,0]=4 2958 B4R0.1 CC(C)[IH2]=O Amb27985313 [2,0,0,0,0,0|2,0,0]=4 2959 B4R0.1 CC(Cl)C=O Amb10603585 [2,0,0,0,0,0|1,0,0]=3 2960 B4R0.1 CC(Cl)CO Amb20623180 [2,0,0,0,0,0|1,0,1]=4 2961 B4R0.1 CC(F)C=O Amb28366193 [2,0,0,0,0,0|1,0,0]=3 2962 B4R0.1 CC(F)CO Amb8393922 [2,0,0,0,0,0|1,0,1]=4 2963 B4R0.1 CC(N)C#N Amb1130364 [2,0,0,0,0,0|1,0,1]=4 2964 B4R0.1 CC(N)C#N Amb6892769 [2,0,0,0,0,0|1,0,1]=4 2965 B4R0.1 CC(N)C=O Amb24476907 [2,0,0,0,0,0|0,0,0]=2 2966 B4R0.1 CC(N)CCl Amb24670798 [2,0,0,0,0,0|1,0,1]=4 2967 B4R0.1 CC(N)CCl Amb33543148 [2,0,0,0,0,0|1,0,1]=4 2968 B4R0.1 CC(N)CF Amb24113179 [2,0,0,0,0,0|1,0,1]=4 2969 B4R0.1 CC(N)CF Amb27817810 [2,0,0,0,0,0|1,0,1]=4 2970 B4R0.1 CC(N)CN Amb32665956 [2,0,0,0,0,0|1,0,1]=4 2971 B4R0.1 CC(N)CN Amb6306671 [2,0,0,0,0,0|1,0,1]=4 2972 B4R0.1 CC(N)CN Amb9703107 [2,0,0,0,0,0|1,0,1]=4 2973 B4R0.1 CC(N)CO Amb9703231 [2,0,0,0,0,0|0,0,1]=3 2974 B4R0.1 CC(N)CS Amb24476863 [2,0,0,0,0,0|0,1,1]=4 2975 B4R0.1 CC(N)CS Amb29083222 [2,0,0,0,0,0|0,1,1]=4 2976 B4R0.1 CC(O)C=O Amb24477285 [2,0,0,0,0,0|1,0,0]=3 2977 B4R0.1 CC(O)CBr Amb2685478 [2,0,0,0,0,0|2,0,0]=4 2978 B4R0.1 CC(O)CCl Amb2720530 [2,0,0,0,0,0|2,0,0]=4 2979 B4R0.1 CC(O)CF Amb10841218 [2,0,0,0,0,0|2,0,0]=4 2980 B4R0.1 CC(O)CI Amb33546467 [2,0,0,0,0,0|2,0,0]=4 2981 B4R0.1 CC(O)CN Amb3939026 [2,0,0,0,0,0|1,0,1]=4 2982 B4R0.1 CC(O)CO Amb6608977 [2,0,0,0,0,0|1,0,0]=3 2983 B4R0.1 CC(O)CS Amb22348002 [2,0,0,0,0,0|1,1,0]=4 2984 B4R0.1 CC(S)C=O Amb25799633 [2,0,0,0,0,0|1,0,0]=3 2985 B4R0.1 CC(S)CO Amb19375527 [2,0,0,0,0,0|1,0,1]=4 2986 B4R0.1 CCB(O)O Amb8387605 [2,0,0,0,0,0|1,0,1]=4 2987 B4R0.1 CCC(=N)N Amb2695032 [2,0,0,0,0,0|2,0,0]=4 2988 B4R0.1 CCC(=N)N Amb6316131 [2,0,0,0,0,0|2,0,0]=4 2989 B4R0.1 CCC(=O)Br Amb8517649 [2,0,0,0,0,0|1,0,0]=3 2990 B4R0.1 CCC(=O)Cl Amb2792924 [2,0,0,0,0,0|1,0,0]=3 2991 B4R0.1 CCC(=O)F Amb10839798 [2,0,0,0,0,0|1,0,0]=3 2992 B4R0.1 CCC(=O)O Amb3938995 [2,0,0,0,0,0|0,0,0]=2 2993 B4R0.1 CCC(=O)S Amb26953905 [2,0,0,0,0,0|0,1,0]=3 2994 B4R0.1 CCC(=O)[O-] Amb22731204 [2,0,0,0,0,0|0,0,1]=3 2995 B4R0.1 CCC(=O)[O-] Amb8513417 [2,0,0,0,0,0|0,0,1]=3 2996 B4R0.1 CCC(C)=O Amb4606002 [2,0,0,0,0,0|1,0,0]=3 2997 B4R0.1 CCC(C)N Amb3939365 [2,0,0,0,0,0|1,0,1]=4 2998 B4R0.1 CCC(C)O Amb9748253 [2,0,0,0,0,0|1,0,1]=4 2999 B4R0.1 CCC(N)=O Amb3886522 [2,0,0,0,0,0|1,0,0]=3 3000 B4R0.1 CCC(N)=S Amb1114671 [2,0,0,0,0,0|1,1,0]=4 3001 B4R0.1 CCC(O)F Amb27763763 [2,0,0,0,0,0|1,0,1]=4 3002 B4R0.1 CCC(O)O Amb28280915 [2,0,0,0,0,0|0,0,2]=4 3003 B4R0.1 CCN(C)O Amb25746619 [2,0,0,0,0,0|2,0,0]=4 3004 B4R0.1 CCS(=O)Cl Amb24647938 [2,0,0,0,0,0|2,0,0]=4 3005 B4R0.1 CCS(=O)O Amb24332177 [2,0,0,0,0,0|1,0,0]=3 3006 B4R0.1 CCS(=O)[O-] Amb17943109 [2,0,0,0,0,0|1,0,1]=4 3007 B4R0.1 CCS(=O)[O-] Amb22411287 [2,0,0,0,0,0|1,0,1]=4 3008 B4R0.1 CCS(C)=O Amb25301908 [2,0,0,0,0,0|2,0,0]=4 3009 B4R0.1 CCS(N)=O Amb24734600 [2,0,0,0,0,0|2,0,0]=4 3010 B4R0.1 CC[C@@H](C)N Amb3939366 [2,0,0,0,0,0|1,0,1]=4 3011 B4R0.1 CC[C@@H](C)O Amb8514550 [2,0,0,0,0,0|1,0,1]=4 3012 B4R0.1 CC[C@H](C)N Amb19889468 [2,0,0,0,0,0|1,0,1]=4 3013 B4R0.1 CC[C@H](C)N Amb3939823 [2,0,0,0,0,0|1,0,1]=4 3014 B4R0.1 CC[C@H](C)O Amb4606006 [2,0,0,0,0,0|1,0,1]=4 3015 B4R0.1 CC[N+](=O)[O-] Amb6608854 [2,0,0,0,0,0|1,0,1]=4 3016 B4R0.1 CC[PH](=O)O Amb8391284 [2,0,0,0,0,0|1,0,0]=3 3017 B4R0.1 CN(C)C=O Amb2793011 [2,0,0,0,0,0|2,0,0]=4 3018 B4R0.1 CN(Cl)C=O Amb28345656 [2,0,0,0,0,0|2,0,0]=4 3019 B4R0.1 CN(N)C=O Amb10843911 [2,0,0,0,0,0|1,0,0]=3 3020 B4R0.1 CN(O)C=O Amb28291395 [2,0,0,0,0,0|2,0,0]=4 3021 B4R0.1 CNC(=O)Cl Amb17942998 [2,0,0,0,0,0|2,0,0]=4 3022 B4R0.1 CNC(=O)F Amb27778388 [2,0,0,0,0,0|2,0,0]=4 3023 B4R0.1 CNC(C)=O Amb3886523 [2,0,0,0,0,0|2,0,0]=4 3024 B4R0.1 CNC(N)=O Amb1152075 [2,0,0,0,0,0|2,0,0]=4 3025 B4R0.1 COC(=O)Cl Amb3940230 [2,0,0,0,0,0|2,0,0]=4 3026 B4R0.1 COC(=O)[O-] Amb25688001 [2,0,0,0,0,0|1,0,1]=4 3027 B4R0.1 COC(C)=O Amb6608821 [2,0,0,0,0,0|2,0,0]=4 3028 B4R0.1 COC(N)=O Amb6608701 [2,0,0,0,0,0|2,0,0]=4 3029 B4R0.1 CO[PH](=O)O Amb27489021 [2,0,0,0,0,0|2,0,0]=4 3030 B4R0.1 CSC(=O)Cl Amb22336225 [2,0,0,0,0,0|2,0,0]=4 3031 B4R0.1 CSC(N)=O Amb25082577 [2,0,0,0,0,0|2,0,0]=4 3032 B4R0.1 C[C@@H](Cl)CO Amb8514856 [2,0,0,0,0,0|1,0,1]=4 3033 B4R0.1 C[C@@H](F)CO Amb10840974 [2,0,0,0,0,0|1,0,1]=4 3034 B4R0.1 C[C@@H](N)C#N Amb18542349 [2,0,0,0,0,0|1,0,1]=4 3035 B4R0.1 C[C@@H](N)C#N Amb31307890 [2,0,0,0,0,0|1,0,1]=4 3036 B4R0.1 C[C@@H](N)CF Amb25745231 [2,0,0,0,0,0|1,0,1]=4 3037 B4R0.1 C[C@@H](N)CF Amb30628536 [2,0,0,0,0,0|1,0,1]=4 3038 B4R0.1 C[C@@H](N)CN Amb6307216 [2,0,0,0,0,0|1,0,1]=4 3039 B4R0.1 C[C@@H](N)CN Amb8384322 [2,0,0,0,0,0|1,0,1]=4 3040 B4R0.1 C[C@@H](N)CN Amb8627757 [2,0,0,0,0,0|1,0,1]=4 3041 B4R0.1 C[C@@H](N)CO Amb3938978 [2,0,0,0,0,0|0,0,1]=3 3042 B4R0.1 C[C@@H](N)CS Amb25745019 [2,0,0,0,0,0|0,1,1]=4 3043 B4R0.1 C[C@@H](N)CS Amb33456897 [2,0,0,0,0,0|0,1,1]=4 3044 B4R0.1 C[C@@H](O)C=O Amb25745956 [2,0,0,0,0,0|1,0,0]=3 3045 B4R0.1 C[C@@H](O)CBr Amb20242351 [2,0,0,0,0,0|2,0,0]=4 3046 B4R0.1 C[C@@H](O)CCl Amb8628179 [2,0,0,0,0,0|2,0,0]=4 3047 B4R0.1 C[C@@H](O)CF Amb27600176 [2,0,0,0,0,0|2,0,0]=4 3048 B4R0.1 C[C@@H](O)CI Amb20241371 [2,0,0,0,0,0|2,0,0]=4 3049 B4R0.1 C[C@@H](O)CN Amb3940167 [2,0,0,0,0,0|1,0,1]=4 3050 B4R0.1 C[C@@H](O)CO Amb8386155 [2,0,0,0,0,0|1,0,0]=3 3051 B4R0.1 C[C@@H](O)CS Amb25662551 [2,0,0,0,0,0|1,1,0]=4 3052 B4R0.1 C[C@@H](O)C[NH3+] Amb32411908 [2,0,0,0,0,0|2,0,0]=4 3053 B4R0.1 C[C@H](Cl)C=O Amb27244768 [2,0,0,0,0,0|1,0,0]=3 3054 B4R0.1 C[C@H](Cl)CO Amb8389340 [2,0,0,0,0,0|1,0,1]=4 3055 B4R0.1 C[C@H](F)CO Amb10840975 [2,0,0,0,0,0|1,0,1]=4 3056 B4R0.1 C[C@H](N)C#N Amb17399782 [2,0,0,0,0,0|1,0,1]=4 3057 B4R0.1 C[C@H](N)C#N Amb33871548 [2,0,0,0,0,0|1,0,1]=4 3058 B4R0.1 C[C@H](N)CCl Amb27629756 [2,0,0,0,0,0|1,0,1]=4 3059 B4R0.1 C[C@H](N)CF Amb20622784 [2,0,0,0,0,0|1,0,1]=4 3060 B4R0.1 C[C@H](N)CF Amb26415712 [2,0,0,0,0,0|1,0,1]=4 3061 B4R0.1 C[C@H](N)CI Amb27233568 [2,0,0,0,0,0|1,0,1]=4 3062 B4R0.1 C[C@H](N)CN Amb19515858 [2,0,0,0,0,0|1,0,1]=4 3063 B4R0.1 C[C@H](N)CN Amb20623334 [2,0,0,0,0,0|1,0,1]=4 3064 B4R0.1 C[C@H](N)CO Amb2607774 [2,0,0,0,0,0|0,0,1]=3 3065 B4R0.1 C[C@H](N)CS Amb24332667 [2,0,0,0,0,0|0,1,1]=4 3066 B4R0.1 C[C@H](N)CS Amb33328790 [2,0,0,0,0,0|0,1,1]=4 3067 B4R0.1 C[C@H](O)CBr Amb24477066 [2,0,0,0,0,0|2,0,0]=4 3068 B4R0.1 C[C@H](O)CCl Amb8389339 [2,0,0,0,0,0|2,0,0]=4 3069 B4R0.1 C[C@H](O)CF Amb24524627 [2,0,0,0,0,0|2,0,0]=4 3070 B4R0.1 C[C@H](O)CI Amb27407782 [2,0,0,0,0,0|2,0,0]=4 3071 B4R0.1 C[C@H](O)CN Amb3939339 [2,0,0,0,0,0|1,0,1]=4 3072 B4R0.1 C[C@H](O)CO Amb8396604 [2,0,0,0,0,0|1,0,0]=3 3073 B4R0.1 C[C@H](O)CS Amb24554233 [2,0,0,0,0,0|1,1,0]=4 3074 B4R0.1 C[N+](C)=CO Amb22731321 [2,0,0,0,0,0|2,0,0]=4 3075 B4R0.1 C\C(N)=N/O Amb499287 [2,0,0,0,0,0|1,0,1]=4 3076 B4R0.1 C\C(N)=N\O Amb10610482 [2,0,0,0,0,0|1,0,1]=4 3077 B4R0.1 C\C(N)=N\O Amb2695158 [2,0,0,0,0,0|1,0,1]=4 3078 B4R0.1 C\C(O)=N\O Amb22492489 [2,0,0,0,0,0|2,0,0]=4 3079 B4R0.1 C\C=C(\C)N Amb26529209 [2,0,0,0,0,0|1,0,1]=4 3080 B4R0.1 N=C(N)CN Amb24053305 [2,0,0,0,0,0|2,0,0]=4 3081 B4R0.1 N=C(N)CN Amb8383568 [2,0,0,0,0,0|2,0,0]=4 3082 B4R0.1 N=C(N)CO Amb2696247 [2,0,0,0,0,0|1,0,1]=4 3083 B4R0.1 N=C(N)CO Amb8630173 [2,0,0,0,0,0|1,0,1]=4 3084 B4R0.1 NC(=O)CBr Amb4477263 [2,0,0,0,0,0|1,0,1]=4 3085 B4R0.1 NC(=O)CCl Amb1933827 [2,0,0,0,0,0|1,0,1]=4 3086 B4R0.1 NC(=O)CF Amb6891955 [2,0,0,0,0,0|1,0,1]=4 3087 B4R0.1 NC(=O)CI Amb2688829 [2,0,0,0,0,0|1,0,1]=4 3088 B4R0.1 NC(=O)CO Amb1804460 [2,0,0,0,0,0|0,0,1]=3 3089 B4R0.1 NC(=O)CS Amb2724286 [2,0,0,0,0,0|0,1,1]=4 3090 B4R0.1 NC(=O)C[SiH3] Amb27807227 [2,0,0,0,0,0|1,0,1]=4 3091 B4R0.1 NC(=O)NO Amb932781 [2,0,0,0,0,0|1,0,1]=4 3092 B4R0.1 NC(=S)CO Amb9214998 [2,0,0,0,0,0|0,1,1]=4 3093 B4R0.1 NC(Cl)CCl Amb27804153 [2,0,0,0,0,0|2,0,0]=4 3094 B4R0.1 NCB(O)O Amb24477493 [2,0,0,0,0,0|1,0,1]=4 3095 B4R0.1 NCB(O)O Amb32665365 [2,0,0,0,0,0|1,0,1]=4 3096 B4R0.1 NCC(=O)Br Amb27810916 [2,0,0,0,0,0|1,0,0]=3 3097 B4R0.1 NCC(=O)Cl Amb6740270 [2,0,0,0,0,0|1,0,0]=3 3098 B4R0.1 NCC(=O)O Amb2609025 [2,0,0,0,0,0|0,0,0]=2 3099 B4R0.1 NCC(=O)O Amb33869972 [2,0,0,0,0,0|0,0,0]=2 3100 B4R0.1 NCC(=O)O Amb8516646 [2,0,0,0,0,0|0,0,0]=2 3101 B4R0.1 NCC(=O)S Amb17593043 [2,0,0,0,0,0|0,1,0]=3 3102 B4R0.1 NCC(=O)[O-] Amb21962917 [2,0,0,0,0,0|0,0,1]=3 3103 B4R0.1 NCC(=O)[O-] Amb22493796 [2,0,0,0,0,0|0,0,1]=3 3104 B4R0.1 NCC(=O)[O-] Amb440282 [2,0,0,0,0,0|0,0,1]=3 3105 B4R0.1 NCC(=O)[O-] Amb5722007 [2,0,0,0,0,0|0,0,1]=3 3106 B4R0.1 NCC(N)=O Amb10604177 [2,0,0,0,0,0|1,0,0]=3 3107 B4R0.1 NCC(N)=O Amb22234569 [2,0,0,0,0,0|1,0,0]=3 3108 B4R0.1 NCC(N)=O Amb6609053 [2,0,0,0,0,0|1,0,0]=3 3109 B4R0.1 NCC(N)=S Amb22059483 [2,0,0,0,0,0|1,1,0]=4 3110 B4R0.1 NCC(N)=S Amb33527546 [2,0,0,0,0,0|1,1,0]=4 3111 B4R0.1 NC[N+](=O)[O-] Amb28284766 [2,0,0,0,0,0|1,0,1]=4 3112 B4R0.1 NC[PH](=O)O Amb776032 [2,0,0,0,0,0|1,0,0]=3 3113 B4R0.1 NNC(=O)O Amb33512897 [2,0,0,0,0,0|1,0,0]=3 3114 B4R0.1 NNC(N)=O Amb7757834 [2,0,0,0,0,0|2,0,0]=4 3115 B4R0.1 NNC(N)=O Amb8513311 [2,0,0,0,0,0|2,0,0]=4 3116 B4R0.1 NS(=O)CBr Amb32720323 [2,0,0,0,0,0|2,0,0]=4 3117 B4R0.1 NS(=O)CCl Amb32720310 [2,0,0,0,0,0|2,0,0]=4 3118 B4R0.1 NS(=O)CF Amb32720411 [2,0,0,0,0,0|2,0,0]=4 3119 B4R0.1 O=C(Br)CBr Amb2793022 [2,0,0,0,0,0|2,0,0]=4 3120 B4R0.1 O=C(Br)CCl Amb27168386 [2,0,0,0,0,0|2,0,0]=4 3121 B4R0.1 O=C(Cl)CBr Amb6608953 [2,0,0,0,0,0|2,0,0]=4 3122 B4R0.1 O=C(Cl)CCl Amb2793043 [2,0,0,0,0,0|2,0,0]=4 3123 B4R0.1 O=C(Cl)CF Amb16185604 [2,0,0,0,0,0|2,0,0]=4 3124 B4R0.1 O=C(Cl)CI Amb22045163 [2,0,0,0,0,0|2,0,0]=4 3125 B4R0.1 O=C(F)CCl Amb10839258 [2,0,0,0,0,0|2,0,0]=4 3126 B4R0.1 O=C(I)CCl Amb27639296 [2,0,0,0,0,0|2,0,0]=4 3127 B4R0.1 O=C(O)C=S Amb28042222 [2,0,0,0,0,0|0,1,1]=4 3128 B4R0.1 O=C(O)CBr Amb6608658 [2,0,0,0,0,0|1,0,0]=3 3129 B4R0.1 O=C(O)CCl Amb2792919 [2,0,0,0,0,0|1,0,0]=3 3130 B4R0.1 O=C(O)CF Amb6740304 [2,0,0,0,0,0|1,0,0]=3 3131 B4R0.1 O=C(O)CI Amb1916034 [2,0,0,0,0,0|1,0,0]=3 3132 B4R0.1 O=C(O)CO Amb2793019 [2,0,0,0,0,0|0,0,0]=2 3133 B4R0.1 O=C(O)CS Amb6608659 [2,0,0,0,0,0|0,1,0]=3 3134 B4R0.1 O=C(O)C[Na] Amb28255644 [2,0,0,0,0,0|1,0,0]=3 3135 B4R0.1 O=C(O)O[Na] Amb22411585 [2,0,0,0,0,0|2,0,0]=4 3136 B4R0.1 O=C([O-])CO Amb22730982 [2,0,0,0,0,0|0,0,1]=3 3137 B4R0.1 O=C([O-])CO Amb8516148 [2,0,0,0,0,0|0,0,1]=3 3138 B4R0.1 O=C([O-])CS Amb8395172 [2,0,0,0,0,0|0,1,1]=4 3139 B4R0.1 O=CC(=O)O Amb3940872 [2,0,0,0,0,0|0,0,2]=4 3140 B4R0.1 O=CC(=O)O Amb6609044 [2,0,0,0,0,0|0,0,2]=4 3141 B4R0.1 O=CC(Br)Br Amb27799983 [2,0,0,0,0,0|2,0,0]=4 3142 B4R0.1 O=CC(Cl)Cl Amb17593172 [2,0,0,0,0,0|2,0,0]=4 3143 B4R0.1 O=CC(Cl)Cl Amb22055052 [2,0,0,0,0,0|2,0,0]=4 3144 B4R0.1 O=CC(F)Cl Amb27424384 [2,0,0,0,0,0|2,0,0]=4 3145 B4R0.1 O=CC(F)F Amb27757615 [2,0,0,0,0,0|2,0,0]=4 3146 B4R0.1 O=CC(O)O Amb26610012 [2,0,0,0,0,0|1,0,0]=3 3147 B4R0.1 O=S(O)CCl Amb27468736 [2,0,0,0,0,0|2,0,0]=4 3148 B4R0.1 O=S(O)CO Amb27621151 [2,0,0,0,0,0|1,0,0]=3 3149 B4R0.1 O=S([O-])CO Amb31290940 [2,0,0,0,0,0|1,0,1]=4 3150 B4R0.1 O=S([O-])CO Amb8513422 [2,0,0,0,0,0|1,0,1]=4 3151 B4R0.1 OC(Cl)CBr Amb28127665 [2,0,0,0,0,0|2,0,0]=4 3152 B4R0.1 OC(O)CCl Amb10575922 [2,0,0,0,0,0|2,0,0]=4 3153 B4R0.1 OCC(=S)S Amb25746765 [2,0,0,0,0,0|0,2,0]=4 3154 B4R0.1 OCC(Cl)Cl Amb3939319 [2,0,0,0,0,0|2,0,0]=4 3155 B4R0.1 OCC(F)Br Amb22228819 [2,0,0,0,0,0|2,0,0]=4 3156 B4R0.1 OCC(F)Cl Amb27231984 [2,0,0,0,0,0|2,0,0]=4 3157 B4R0.1 OCC(F)F Amb2687128 [2,0,0,0,0,0|2,0,0]=4 3158 B4R0.1 OCC(S)S Amb28280931 [2,0,0,0,0,0|1,1,0]=4 3159 B4R0.2 C#CCCO Amb2685716 [2,0,0,0,0,0|1,0,1]=4 3160 B4R0.2 C#CCCO Amb34916688 [2,0,0,0,0,0|1,0,1]=4 3161 B4R0.2 C=CCC=O Amb25058716 [2,0,0,0,0,0|1,0,1]=4 3162 B4R0.2 C=CCCBr Amb2684977 [2,0,0,0,0,0|2,0,0]=4 3163 B4R0.2 C=CCCC Amb8514606 [2,0,0,0,0,0|2,0,0]=4 3164 B4R0.2 C=CCCCl Amb22229725 [2,0,0,0,0,0|2,0,0]=4 3165 B4R0.2 C=CCCF Amb27869562 [2,0,0,0,0,0|2,0,0]=4 3166 B4R0.2 C=CCCI Amb33546459 [2,0,0,0,0,0|2,0,0]=4 3167 B4R0.2 C=CCCN Amb10601640 [2,0,0,0,0,0|2,0,0]=4 3168 B4R0.2 C=CCCN Amb33484127 [2,0,0,0,0,0|2,0,0]=4 3169 B4R0.2 C=CCCN Amb5717434 [2,0,0,0,0,0|2,0,0]=4 3170 B4R0.2 C=CCCO Amb6609024 [2,0,0,0,0,0|1,0,0]=3 3171 B4R0.2 C=CCC[NH3+] Amb5718705 [2,0,0,0,0,0|2,0,0]=4 3172 B4R0.2 C=NCCO Amb27827243 [2,0,0,0,0,0|2,0,0]=4 3173 B4R0.2 CCCC=O Amb3940026 [2,0,0,0,0,0|1,0,0]=3 3174 B4R0.2 CCCCO Amb2793053 [2,0,0,0,0,0|1,0,1]=4 3175 B4R0.2 CCNC=O Amb22229692 [2,0,0,0,0,0|2,0,0]=4 3176 B4R0.2 CCOC=O Amb3429671 [2,0,0,0,0,0|2,0,0]=4 3177 B4R0.2 CNCC=O Amb28133605 [2,0,0,0,0,0|2,0,0]=4 3178 B4R0.2 CNCCO Amb2793086 [2,0,0,0,0,0|2,0,0]=4 3179 B4R0.2 COCC=O Amb3941034 [2,0,0,0,0,0|2,0,0]=4 3180 B4R0.2 COCCO Amb4605828 [2,0,0,0,0,0|2,0,0]=4 3181 B4R0.2 CPCCO Amb27594723 [2,0,0,0,0,0|2,0,0]=4 3182 B4R0.2 CSCC=O Amb27250514 [2,0,0,0,0,0|2,0,0]=4 3183 B4R0.2 CSCCO Amb3568993 [2,0,0,0,0,0|2,0,0]=4 3184 B4R0.2 C\C=C\CO Amb9277796 [2,0,0,0,0,0|1,0,1]=4 3185 B4R0.2 N#CCC=O Amb9669129 [2,0,0,0,0,0|1,0,1]=4 3186 B4R0.2 N#CCCO Amb534940 [2,0,0,0,0,0|1,0,1]=4 3187 B4R0.2 NCCC=S Amb28366830 [2,0,0,0,0,0|1,1,0]=4 3188 B4R0.2 NCCCO Amb22229163 [2,0,0,0,0,0|1,0,1]=4 3189 B4R0.2 NCCCO Amb2793042 [2,0,0,0,0,0|1,0,1]=4 3190 B4R0.2 NCCNO Amb24476856 [2,0,0,0,0,0|2,0,0]=4 3191 B4R0.2 NNCCO Amb2695098 [2,0,0,0,0,0|2,0,0]=4 3192 B4R0.2 NOCCO Amb17190317 [2,0,0,0,0,0|2,0,0]=4 3193 B4R0.2 N[NH2+]CCO Amb27867172 [2,0,0,0,0,0|2,0,0]=4 3194 B4R0.2 O=CCC=O Amb33512721 [2,0,0,0,0,0|0,0,2]=4 3195 B4R0.2 O=CCCCl Amb16233605 [2,0,0,0,0,0|1,0,0]=3 3196 B4R0.2 O=CCCF Amb21858609 [2,0,0,0,0,0|1,0,0]=3 3197 B4R0.2 O=CCCI Amb26847605 [2,0,0,0,0,0|1,0,0]=3 3198 B4R0.2 O=CCCO Amb24412391 [2,0,0,0,0,0|0,0,0]=2 3199 B4R0.2 O=CCCS Amb27755008 [2,0,0,0,0,0|0,1,0]=3 3200 B4R0.2 O=CNCO Amb27754843 [2,0,0,0,0,0|1,0,0]=3 3201 B4R0.2 O=CNCS Amb27846487 [2,0,0,0,0,0|1,1,0]=4 3202 B4R0.2 O=C\C=N\O Amb25746308 [2,0,0,0,0,0|1,0,1]=4 3203 B4R0.2 OCCCBr Amb932815 [2,0,0,0,0,0|1,0,1]=4 3204 B4R0.2 OCCCCl Amb6608905 [2,0,0,0,0,0|1,0,1]=4 3205 B4R0.2 OCCCF Amb2688406 [2,0,0,0,0,0|1,0,1]=4 3206 B4R0.2 OCCCI Amb2688881 [2,0,0,0,0,0|1,0,1]=4 3207 B4R0.2 OCCCO Amb2793089 [2,0,0,0,0,0|0,0,1]=3 3208 B4R0.2 OCCCS Amb8517566 [2,0,0,0,0,0|0,1,1]=4 3209 B4R0.2 OCCNBr Amb27265947 [2,0,0,0,0,0|2,0,0]=4 3210 B4R0.2 OCCNCl Amb27206146 [2,0,0,0,0,0|2,0,0]=4 3211 B4R0.2 OCCNF Amb27775764 [2,0,0,0,0,0|2,0,0]=4 3212 B4R0.2 OCNCO Amb2793034 [2,0,0,0,0,0|1,0,1]=4 3213 B4R0.2 OCSCO Amb27812260 [2,0,0,0,0,0|1,0,1]=4 3214 B4R0.2 OC\C=C/I Amb23539305 [2,0,0,0,0,0|1,0,1]=4 3215 B4R0.2 OC\C=C\Br Amb32653556 [2,0,0,0,0,0|1,0,1]=4 3216 B4R0.2 OC\C=C\Cl Amb33531874 [2,0,0,0,0,0|1,0,1]=4 3217 B4R0.2 OC\C=C\I Amb24642752 [2,0,0,0,0,0|1,0,1]=4 3218 B4R0.2 ONCCF Amb25931834 [2,0,0,0,0,0|2,0,0]=4 3219 B4R0.2 O\C=C\CCl Amb27449221 [2,0,0,0,0,0|1,0,1]=4 3220 B6R0.1 C#CC(=O)CCC Amb25696103 [1,1,0,0,0,0|2,0,0]=4 3221 B6R0.1 C#CCC(=O)OC Amb5722531 [1,1,0,0,0,0|1,0,1]=4 3222 B6R0.1 C#C[C@@H](O)CCO Amb27829544 [1,1,0,0,0,0|1,0,1]=4 3223 B6R0.1 C=C(C=O)CCF Amb28253937 [1,1,0,0,0,0|2,0,0]=4 3224 B6R0.1 C=C(CC)CCO Amb25261191 [1,1,0,0,0,0|2,0,0]=4 3225 B6R0.1 C=C(CCC)OC Amb27433625 [1,1,0,0,0,0|2,0,0]=4 3226 B6R0.1 C=C(CO)CCN Amb24426567 [1,1,0,0,0,0|2,0,0]=4 3227 B6R0.1 C=C(CO)CCO Amb25825219 [1,1,0,0,0,0|1,0,0]=3 3228 B6R0.1 C=CC(=O)CCC Amb8630773 [1,1,0,0,0,0|2,0,0]=4 3229 B6R0.1 C=CC(=O)CCCl Amb24446646 [1,1,0,0,0,0|2,0,0]=4 3230 B6R0.1 C=CC(=O)CCF Amb33480698 [1,1,0,0,0,0|2,0,0]=4 3231 B6R0.1 C=CC(O)CCO Amb27978087 [1,1,0,0,0,0|1,0,1]=4 3232 B6R0.1 C=C[C@@H](O)CCO Amb28318694 [1,1,0,0,0,0|1,0,1]=4 3233 B6R0.1 CC(C=O)CCO Amb28208492 [1,1,0,0,0,0|1,0,1]=4 3234 B6R0.1 CC(CO)CCO Amb4035955 [1,1,0,0,0,0|1,0,1]=4 3235 B6R0.1 CCC(=O)CCBr Amb27401869 [1,1,0,0,0,0|2,0,0]=4 3236 B6R0.1 CCC(=O)CCI Amb27232362 [1,1,0,0,0,0|2,0,0]=4 3237 B6R0.1 CCC(=O)CCN Amb18202790 [1,1,0,0,0,0|2,0,0]=4 3238 B6R0.1 CCC(=O)CCO Amb26872941 [1,1,0,0,0,0|1,0,0]=3 3239 B6R0.1 CCC(=O)CCS Amb24733984 [1,1,0,0,0,0|1,1,0]=4 3240 B6R0.1 CCC(=O)CNO Amb27434221 [1,1,0,0,0,0|2,0,0]=4 3241 B6R0.1 CCC(=O)NCO Amb27235623 [1,1,0,0,0,0|2,0,0]=4 3242 B6R0.1 CCC(O)CCO Amb28341820 [1,1,0,0,0,0|1,0,1]=4 3243 B6R0.1 CCCC(=O)CBr Amb24433274 [1,1,0,0,0,0|2,0,0]=4 3244 B6R0.1 CCCC(=O)CC Amb8513390 [1,1,0,0,0,0|2,0,0]=4 3245 B6R0.1 CCCC(=O)CCl Amb19372924 [1,1,0,0,0,0|2,0,0]=4 3246 B6R0.1 CCCC(=O)CI Amb27876205 [1,1,0,0,0,0|2,0,0]=4 3247 B6R0.1 CCCC(=O)CN Amb17593086 [1,1,0,0,0,0|2,0,0]=4 3248 B6R0.1 CCCC(=O)CN Amb28827644 [1,1,0,0,0,0|2,0,0]=4 3249 B6R0.1 CCCC(=O)CO Amb25125092 [1,1,0,0,0,0|1,0,0]=3 3250 B6R0.1 CCCC(=O)NC Amb3886531 [1,1,0,0,0,0|2,0,0]=4 3251 B6R0.1 CCCC(=O)NN Amb6366352 [1,1,0,0,0,0|2,0,0]=4 3252 B6R0.1 CCCC(=O)NO Amb6260495 [1,1,0,0,0,0|1,0,0]=3 3253 B6R0.1 CCCC(=O)OC Amb8516697 [1,1,0,0,0,0|1,0,0]=3 3254 B6R0.1 CCCC(=O)SC Amb8393184 [1,1,0,0,0,0|1,1,0]=4 3255 B6R0.1 CCCC(=S)OC Amb22043317 [1,1,0,0,0,0|1,1,0]=4 3256 B6R0.1 CCC\C(C)=N\O Amb24693854 [1,1,0,0,0,0|2,0,0]=4 3257 B6R0.1 CCC\C(Cl)=N\O Amb27829565 [1,1,0,0,0,0|2,0,0]=4 3258 B6R0.1 CCC\C(N)=N\O Amb19890174 [1,1,0,0,0,0|2,0,0]=4 3259 B6R0.1 CCC\C(N)=N\O Amb2724965 [1,1,0,0,0,0|2,0,0]=4 3260 B6R0.1 CCNC(=O)CO Amb9421415 [1,1,0,0,0,0|2,0,0]=4 3261 B6R0.1 CCNC(=O)NO Amb28345704 [1,1,0,0,0,0|2,0,0]=4 3262 B6R0.1 CCNC(=O)OC Amb22734099 [1,1,0,0,0,0|2,0,0]=4 3263 B6R0.1 CCOC(=O)CO Amb3939196 [1,1,0,0,0,0|2,0,0]=4 3264 B6R0.1 CCOC(=O)NO Amb8384324 [1,1,0,0,0,0|2,0,0]=4 3265 B6R0.1 CCOC(=O)OC Amb22732530 [1,1,0,0,0,0|2,0,0]=4 3266 B6R0.1 CCS(=O)CCO Amb10669566 [1,1,0,0,0,0|2,0,0]=4 3267 B6R0.1 CC[C@@H](O)CCO Amb27448609 [1,1,0,0,0,0|1,0,1]=4 3268 B6R0.1 CC[C@H](O)CCO Amb27757196 [1,1,0,0,0,0|1,0,1]=4 3269 B6R0.1 CC\C=C(/O)C=O Amb27849683 [1,1,0,0,0,0|1,0,1]=4 3270 B6R0.1 CC\C=C(\O)C=O Amb27195226 [1,1,0,0,0,0|1,0,1]=4 3271 B6R0.1 CN(C=O)CCO Amb25849655 [1,1,0,0,0,0|2,0,0]=4 3272 B6R0.1 CN(CCO)N=O Amb26393134 [1,1,0,0,0,0|2,0,0]=4 3273 B6R0.1 CNC(=N)CCO Amb25114075 [1,1,0,0,0,0|2,0,0]=4 3274 B6R0.1 CNC(=N)CCO Amb32680454 [1,1,0,0,0,0|2,0,0]=4 3275 B6R0.1 CNC(=O)CCBr Amb17332890 [1,1,0,0,0,0|2,0,0]=4 3276 B6R0.1 CNC(=O)CCCl Amb1130566 [1,1,0,0,0,0|2,0,0]=4 3277 B6R0.1 CNC(=O)CCN Amb1139824 [1,1,0,0,0,0|2,0,0]=4 3278 B6R0.1 CNC(=O)CCN Amb6893005 [1,1,0,0,0,0|2,0,0]=4 3279 B6R0.1 CNC(=O)CCO Amb10608414 [1,1,0,0,0,0|1,0,0]=3 3280 B6R0.1 CNC(=O)CCS Amb25727705 [1,1,0,0,0,0|1,1,0]=4 3281 B6R0.1 CNCC(=O)OC Amb1153975 [1,1,0,0,0,0|2,0,0]=4 3282 B6R0.1 CNCC(=O)OC Amb2371116 [1,1,0,0,0,0|2,0,0]=4 3283 B6R0.1 COC(=N)CCBr Amb27478260 [1,1,0,0,0,0|2,0,0]=4 3284 B6R0.1 COC(=N)CCCl Amb19958799 [1,1,0,0,0,0|2,0,0]=4 3285 B6R0.1 COC(=N)CCCl Amb22234673 [1,1,0,0,0,0|2,0,0]=4 3286 B6R0.1 COC(=N)CCO Amb17593095 [1,1,0,0,0,0|1,0,0]=3 3287 B6R0.1 COC(=O)CC#N Amb3940296 [1,1,0,0,0,0|1,0,1]=4 3288 B6R0.1 COC(=O)CC=O Amb18199826 [1,1,0,0,0,0|0,0,2]=4 3289 B6R0.1 COC(=O)CCBr Amb3940216 [1,1,0,0,0,0|1,0,0]=3 3290 B6R0.1 COC(=O)CCCl Amb8387395 [1,1,0,0,0,0|1,0,0]=3 3291 B6R0.1 COC(=O)CCI Amb24442243 [1,1,0,0,0,0|1,0,0]=3 3292 B6R0.1 COC(=O)CCN Amb1105940 [1,1,0,0,0,0|1,0,0]=3 3293 B6R0.1 COC(=O)CCN Amb2605985 [1,1,0,0,0,0|1,0,0]=3 3294 B6R0.1 COC(=O)CCO Amb8855137 [1,1,0,0,0,0|0,0,0]=2 3295 B6R0.1 COC(=O)CCS Amb2725528 [1,1,0,0,0,0|0,1,0]=3 3296 B6R0.1 COC(=O)CON Amb18640433 [1,1,0,0,0,0|2,0,0]=4 3297 B6R0.1 COC(=O)CON Amb29848090 [1,1,0,0,0,0|2,0,0]=4 3298 B6R0.1 COC(=O)CSC Amb2689527 [1,1,0,0,0,0|2,0,0]=4 3299 B6R0.1 COC(=O)OCCl Amb20623618 [1,1,0,0,0,0|2,0,0]=4 3300 B6R0.1 COC(=O)OCI Amb35753057 [1,1,0,0,0,0|2,0,0]=4 3301 B6R0.1 COC(C)CCO Amb3939327 [1,1,0,0,0,0|1,0,1]=4 3302 B6R0.1 COCC(=O)OC Amb8513624 [1,1,0,0,0,0|2,0,0]=4 3303 B6R0.1 CON(C)CCO Amb28320019 [1,1,0,0,0,0|2,0,0]=4 3304 B6R0.1 COS(=O)CCBr Amb27403603 [1,1,0,0,0,0|2,0,0]=4 3305 B6R0.1 CO[PH](=O)CCBr Amb27657609 [1,1,0,0,0,0|2,0,0]=4 3306 B6R0.1 CO\C(C)=C\CO Amb27429427 [1,1,0,0,0,0|1,0,1]=4 3307 B6R0.1 CSC(=O)CCO Amb27662309 [1,1,0,0,0,0|0,1,0]=3 3308 B6R0.1 CSCC(=O)NO Amb28057751 [1,1,0,0,0,0|2,0,0]=4 3309 B6R0.1 C[C@@H](C=O)CCO Amb27394744 [1,1,0,0,0,0|1,0,1]=4 3310 B6R0.1 C[C@@H](CO)CCO Amb22225176 [1,1,0,0,0,0|1,0,1]=4 3311 B6R0.1 C[C@H](C=O)CCO Amb27260814 [1,1,0,0,0,0|1,0,1]=4 3312 B6R0.1 C[C@H](CO)CCO Amb19944691 [1,1,0,0,0,0|1,0,1]=4 3313 B6R0.1 C[NH2+]CC(=O)OC Amb22045201 [1,1,0,0,0,0|2,0,0]=4 3314 B6R0.1 C[NH2+]CC(=O)OC Amb24113851 [1,1,0,0,0,0|2,0,0]=4 3315 B6R0.1 C\C(=C/I)CCO Amb27977006 [1,1,0,0,0,0|2,0,0]=4 3316 B6R0.1 C\C(CCCl)=N/O Amb27832450 [1,1,0,0,0,0|2,0,0]=4 3317 B6R0.1 C\C(CCO)=N/N Amb28453929 [1,1,0,0,0,0|2,0,0]=4 3318 B6R0.1 C\C=C(/C)CCO Amb24674649 [1,1,0,0,0,0|2,0,0]=4 3319 B6R0.1 C\C=C(\C)CCO Amb28077117 [1,1,0,0,0,0|2,0,0]=4 3320 B6R0.1 N=C(CCO)NO Amb22491265 [1,1,0,0,0,0|1,0,0]=3 3321 B6R0.1 NC(CO)CCO Amb27948796 [1,1,0,0,0,0|1,0,1]=4 3322 B6R0.1 NC(CO)CCO Amb32666185 [1,1,0,0,0,0|1,0,1]=4 3323 B6R0.1 NCC(=O)CCF Amb26604148 [1,1,0,0,0,0|2,0,0]=4 3324 B6R0.1 NCC(O)CCO Amb22011571 [1,1,0,0,0,0|1,0,1]=4 3325 B6R0.1 NCCC(=O)CF Amb33377162 [1,1,0,0,0,0|2,0,0]=4 3326 B6R0.1 NCCC(=O)CN Amb18121893 [1,1,0,0,0,0|2,0,0]=4 3327 B6R0.1 NCCC(=O)NN Amb18559344 [1,1,0,0,0,0|2,0,0]=4 3328 B6R0.1 NCCC(=O)NO Amb33543073 [1,1,0,0,0,0|1,0,0]=3 3329 B6R0.1 NCCC(O)C=O Amb25682881 [1,1,0,0,0,0|1,0,1]=4 3330 B6R0.1 NCC\C(N)=N\O Amb24761482 [1,1,0,0,0,0|2,0,0]=4 3331 B6R0.1 NC[C@@H](O)CCO Amb28191136 [1,1,0,0,0,0|1,0,1]=4 3332 B6R0.1 NNC(=O)CCO Amb20622339 [1,1,0,0,0,0|1,0,0]=3 3333 B6R0.1 NNC(=O)CCS Amb20622690 [1,1,0,0,0,0|1,1,0]=4 3334 B6R0.1 N[C@@H](CO)CCO Amb26855089 [1,1,0,0,0,0|1,0,1]=4 3335 B6R0.1 N[C@H](CO)CCO Amb33362376 [1,1,0,0,0,0|1,0,1]=4 3336 B6R0.1 N[C@H](CO)CCO Amb6893747 [1,1,0,0,0,0|1,0,1]=4 3337 B6R0.1 N\C(CCCl)=N/O Amb2695182 [1,1,0,0,0,0|2,0,0]=4 3338 B6R0.1 N\C(CCO)=N/O Amb1113605 [1,1,0,0,0,0|1,0,0]=3 3339 B6R0.1 O=C(CBr)CCBr Amb26567374 [1,1,0,0,0,0|2,0,0]=4 3340 B6R0.1 O=C(CBr)CCCl Amb27984732 [1,1,0,0,0,0|2,0,0]=4 3341 B6R0.1 O=C(CBr)NCO Amb25286051 [1,1,0,0,0,0|2,0,0]=4 3342 B6R0.1 O=C(CCBr)NO Amb28195718 [1,1,0,0,0,0|1,0,0]=3 3343 B6R0.1 O=C(CCCl)NO Amb25865278 [1,1,0,0,0,0|1,0,0]=3 3344 B6R0.1 O=C(CCl)CCCl Amb22395038 [1,1,0,0,0,0|2,0,0]=4 3345 B6R0.1 O=C(CCl)CCF Amb33413998 [1,1,0,0,0,0|2,0,0]=4 3346 B6R0.1 O=C(CCl)NCO Amb1153096 [1,1,0,0,0,0|2,0,0]=4 3347 B6R0.1 O=C(CF)CCF Amb28424077 [1,1,0,0,0,0|2,0,0]=4 3348 B6R0.1 O=C(CF)NCO Amb27625787 [1,1,0,0,0,0|2,0,0]=4 3349 B6R0.1 O=C(CO)CCO Amb10603377 [1,1,0,0,0,0|0,0,0]=2 3350 B6R0.1 O=C(CO)NCO Amb27593459 [1,1,0,0,0,0|1,0,0]=3 3351 B6R0.1 O=C(NO)OCCl Amb29886186 [1,1,0,0,0,0|2,0,0]=4 3352 B6R0.1 O=CC(=O)CCO Amb28050238 [1,1,0,0,0,0|0,0,1]=3 3353 B6R0.1 O=CC(Br)CCO Amb28206552 [1,1,0,0,0,0|1,0,1]=4 3354 B6R0.1 O=CC(O)CCBr Amb27838276 [1,1,0,0,0,0|1,0,1]=4 3355 B6R0.1 O=CC(O)CCO Amb27955546 [1,1,0,0,0,0|0,0,1]=3 3356 B6R0.1 O=C[C@H](O)CCBr Amb28399793 [1,1,0,0,0,0|1,0,1]=4 3357 B6R0.1 OCCC(F)CO Amb27981514 [1,1,0,0,0,0|1,0,1]=4 3358 B6R0.1 OCCC(O)CBr Amb26393869 [1,1,0,0,0,0|1,0,1]=4 3359 B6R0.1 OCCC(O)CCl Amb25361069 [1,1,0,0,0,0|1,0,1]=4 3360 B6R0.1 OCCC(O)CO Amb6608827 [1,1,0,0,0,0|0,0,2]=4 3361 B6R0.1 OCC[C@@H](Cl)CO Amb28137912 [1,1,0,0,0,0|1,0,1]=4 3362 B6R0.1 OCC[C@@H](O)CCl Amb4166321 [1,1,0,0,0,0|1,0,1]=4 3363 B6R0.1 OCC[C@@H](O)CO Amb10071064 [1,1,0,0,0,0|0,0,2]=4 3364 B6R0.1 OCC[C@H](Br)CO Amb28050148 [1,1,0,0,0,0|1,0,1]=4 3365 B6R0.1 OCC[C@H](Cl)CO Amb28384118 [1,1,0,0,0,0|1,0,1]=4 3366 B6R0.1 OCC[C@H](O)CBr Amb27202737 [1,1,0,0,0,0|1,0,1]=4 3367 B6R0.1 OCC[C@H](O)CO Amb8386061 [1,1,0,0,0,0|0,0,2]=4 3368 B6R0.1 OC\C=C(\Br)CO Amb28400680 [1,1,0,0,0,0|1,0,1]=4 3369 B6R0.1 OC\C=C(\Cl)CO Amb27804390 [1,1,0,0,0,0|1,0,1]=4 3370 B6R0.1 [C-]#[N+]CC(=O)OC Amb2697203 [1,1,0,0,0,0|2,0,0]=4 3371 B6R0.2 C=C(C)CC(=O)O Amb6278832 [1,1,0,0,0,0|1,0,1]=4 3372 B6R0.2 C=C(C)CC(C)O Amb17593083 [1,1,0,0,0,0|2,0,0]=4 3373 B6R0.2 C=C(C)C[C@@H](C)O Amb25888510 [1,1,0,0,0,0|2,0,0]=4 3374 B6R0.2 C=C(C)C[C@H](C)O Amb27466720 [1,1,0,0,0,0|2,0,0]=4 3375 B6R0.2 C=C(Cl)CC(=O)O Amb28118668 [1,1,0,0,0,0|1,0,1]=4 3376 B6R0.2 C=C(I)CC(=O)O Amb27598435 [1,1,0,0,0,0|1,0,1]=4 3377 B6R0.2 CC(=O)CC(=O)O Amb377432 [1,1,0,0,0,0|0,0,2]=4 3378 B6R0.2 CC(=O)CC(C)C Amb4605990 [1,1,0,0,0,0|2,0,0]=4 3379 B6R0.2 CC(=O)CC(C)Cl Amb17593234 [1,1,0,0,0,0|2,0,0]=4 3380 B6R0.2 CC(=O)CC(C)N Amb22587050 [1,1,0,0,0,0|2,0,0]=4 3381 B6R0.2 CC(=O)CC(C)N Amb2583230 [1,1,0,0,0,0|2,0,0]=4 3382 B6R0.2 CC(=O)CC(C)O Amb17593091 [1,1,0,0,0,0|1,0,0]=3 3383 B6R0.2 CC(=O)CC(C)S Amb24600676 [1,1,0,0,0,0|1,1,0]=4 3384 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [1,1,0,0,0,0|1,0,1]=4 3385 B6R0.2 CC(=O)CC(F)F Amb24669174 [1,1,0,0,0,0|2,0,0]=4 3386 B6R0.2 CC(=O)C[C@@H](C)N Amb27493422 [1,1,0,0,0,0|2,0,0]=4 3387 B6R0.2 CC(=O)C[C@H](C)N Amb27222720 [1,1,0,0,0,0|2,0,0]=4 3388 B6R0.2 CC(=O)C[PH](=O)O Amb27975190 [1,1,0,0,0,0|2,0,0]=4 3389 B6R0.2 CC(=O)OC(C)O Amb27457187 [1,1,0,0,0,0|2,0,0]=4 3390 B6R0.2 CC(=S)CC(=O)O Amb28067768 [1,1,0,0,0,0|0,1,1]=4 3391 B6R0.2 CC(Br)CC(=O)O Amb8517108 [1,1,0,0,0,0|1,0,0]=3 3392 B6R0.2 CC(C)CC(=O)Br Amb26486664 [1,1,0,0,0,0|2,0,0]=4 3393 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [1,1,0,0,0,0|2,0,0]=4 3394 B6R0.2 CC(C)CC(=O)F Amb32667643 [1,1,0,0,0,0|2,0,0]=4 3395 B6R0.2 CC(C)CC(=O)O Amb3939848 [1,1,0,0,0,0|1,0,0]=3 3396 B6R0.2 CC(C)CC(N)=O Amb2722931 [1,1,0,0,0,0|2,0,0]=4 3397 B6R0.2 CC(Cl)CC(=O)Cl Amb28343061 [1,1,0,0,0,0|2,0,0]=4 3398 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [1,1,0,0,0,0|1,0,0]=3 3399 B6R0.2 CC(I)CC(=O)O Amb28398380 [1,1,0,0,0,0|1,0,0]=3 3400 B6R0.2 CC(N)CC(=O)O Amb8379759 [1,1,0,0,0,0|1,0,0]=3 3401 B6R0.2 CC(N)CC(=O)S Amb27413857 [1,1,0,0,0,0|1,1,0]=4 3402 B6R0.2 CC(N)CC(N)=O Amb18281237 [1,1,0,0,0,0|2,0,0]=4 3403 B6R0.2 CC(N)CC(N)=O Amb33532770 [1,1,0,0,0,0|2,0,0]=4 3404 B6R0.2 CC(O)CC(=O)O Amb8513187 [1,1,0,0,0,0|0,0,0]=2 3405 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [1,1,0,0,0,0|0,0,1]=3 3406 B6R0.2 CC(O)CC(C)O Amb10068523 [1,1,0,0,0,0|1,0,1]=4 3407 B6R0.2 CC(O)CC(N)=O Amb26394320 [1,1,0,0,0,0|1,0,0]=3 3408 B6R0.2 CC(O)CC(N)=S Amb24479794 [1,1,0,0,0,0|1,1,0]=4 3409 B6R0.2 CC(O)CS(C)=O Amb28137235 [1,1,0,0,0,0|2,0,0]=4 3410 B6R0.2 CC(O)C[N+](=O)[O-] Amb9678341 [1,1,0,0,0,0|1,0,1]=4 3411 B6R0.2 CC(S)CC(=O)O Amb33538201 [1,1,0,0,0,0|0,1,0]=3 3412 B6R0.2 CN(C)CC(=O)O Amb3319051 [1,1,0,0,0,0|2,0,0]=4 3413 B6R0.2 CN(C)CC(=O)O Amb3940366 [1,1,0,0,0,0|2,0,0]=4 3414 B6R0.2 CN(N)CC(=O)O Amb23592296 [1,1,0,0,0,0|2,0,0]=4 3415 B6R0.2 CN(O)CC(=O)O Amb29838290 [1,1,0,0,0,0|1,0,0]=3 3416 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [1,1,0,0,0,0|1,0,0]=3 3417 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [1,1,0,0,0,0|1,0,0]=3 3418 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [1,1,0,0,0,0|1,0,0]=3 3419 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [1,1,0,0,0,0|1,0,0]=3 3420 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [1,1,0,0,0,0|0,0,0]=2 3421 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [1,1,0,0,0,0|0,0,1]=3 3422 B6R0.2 C[C@@H](O)CS(C)=O Amb27457390 [1,1,0,0,0,0|2,0,0]=4 3423 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [1,1,0,0,0,0|1,0,0]=3 3424 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [1,1,0,0,0,0|1,0,0]=3 3425 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [1,1,0,0,0,0|1,0,0]=3 3426 B6R0.2 C[C@H](N)CC(N)=O Amb27873963 [1,1,0,0,0,0|2,0,0]=4 3427 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [1,1,0,0,0,0|0,0,0]=2 3428 B6R0.2 C[C@H](O)C[C@@H](C)O Amb27273041 [1,1,0,0,0,0|1,0,1]=4 3429 B6R0.2 C[C@H](O)C[C@H](C)O Amb20242416 [1,1,0,0,0,0|1,0,1]=4 3430 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [1,1,0,0,0,0|2,0,0]=4 3431 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [1,1,0,0,0,0|2,0,0]=4 3432 B6R0.2 NC(=O)CC(=O)O Amb4034884 [1,1,0,0,0,0|0,0,2]=4 3433 B6R0.2 NC(=O)CC(F)F Amb28401488 [1,1,0,0,0,0|2,0,0]=4 3434 B6R0.2 NC(=S)CC(=O)O Amb17465742 [1,1,0,0,0,0|0,1,1]=4 3435 B6R0.2 NC(S)CC(=O)O Amb27391244 [1,1,0,0,0,0|0,1,0]=3 3436 B6R0.2 O=C(O)CB(O)O Amb24053058 [1,1,0,0,0,0|1,0,0]=3 3437 B6R0.2 O=C(O)CC(=O)Cl Amb26946943 [1,1,0,0,0,0|0,0,2]=4 3438 B6R0.2 O=C(O)CC(=O)O Amb2689065 [1,1,0,0,0,0|0,0,1]=3 3439 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [1,1,0,0,0,0|1,0,0]=3 3440 B6R0.2 O=C(O)CC(F)F Amb22001551 [1,1,0,0,0,0|1,0,0]=3 3441 B6R0.2 O=C(O)CS(=O)O Amb27788997 [1,1,0,0,0,0|1,0,0]=3 3442 B6R0.2 O=C([O-])CC(F)F Amb24117960 [1,1,0,0,0,0|1,0,1]=4 3443 B6R0.2 O=S(O)CC(F)F Amb30035176 [1,1,0,0,0,0|2,0,0]=4 3444 B6R0.2 OC(=S)CC(F)F Amb34179023 [1,1,0,0,0,0|1,1,0]=4 3445 B6R0.2 OC(O)CC(O)O Amb27632053 [1,1,0,0,0,0|0,0,2]=4 3446 B6R0.4 C#CCCC(=O)Cl Amb26949181 [1,1,0,0,0,0|2,0,0]=4 3447 B6R0.4 C#CCCC(=O)O Amb33532622 [1,1,0,0,0,0|1,0,0]=3 3448 B6R0.4 C#CCCC(=O)[O-] Amb22232009 [1,1,0,0,0,0|1,0,1]=4 3449 B6R0.4 C#CCCC(C)=O Amb8869638 [1,1,0,0,0,0|2,0,0]=4 3450 B6R0.4 C=C(Br)CCCO Amb27471781 [1,1,0,0,0,0|2,0,0]=4 3451 B6R0.4 C=C(C)CCCO Amb22886814 [1,1,0,0,0,0|2,0,0]=4 3452 B6R0.4 C=C(C)CCOC Amb33546340 [1,1,0,0,0,0|2,0,0]=4 3453 B6R0.4 C=C(C)CCON Amb25862621 [1,1,0,0,0,0|2,0,0]=4 3454 B6R0.4 C=C(Cl)CCCO Amb28065233 [1,1,0,0,0,0|2,0,0]=4 3455 B6R0.4 C=C(F)CCCO Amb25811029 [1,1,0,0,0,0|2,0,0]=4 3456 B6R0.4 C=C=CCC(=O)O Amb26657414 [1,1,0,0,0,0|1,0,1]=4 3457 B6R0.4 C=CCCC(=O)Cl Amb3939003 [1,1,0,0,0,0|2,0,0]=4 3458 B6R0.4 C=CCCC(=O)O Amb3940112 [1,1,0,0,0,0|1,0,0]=3 3459 B6R0.4 C=CCCC(C)=O Amb2721704 [1,1,0,0,0,0|2,0,0]=4 3460 B6R0.4 C=CCCC(N)=O Amb28136349 [1,1,0,0,0,0|2,0,0]=4 3461 B6R0.4 C=CNCC(=O)O Amb28346027 [1,1,0,0,0,0|1,0,1]=4 3462 B6R0.4 C=COCC(=O)O Amb27247261 [1,1,0,0,0,0|1,0,1]=4 3463 B6R0.4 CC#CCC(=O)O Amb17939740 [1,1,0,0,0,0|1,0,1]=4 3464 B6R0.4 CC(=O)CC#CO Amb27463647 [1,1,0,0,0,0|1,0,1]=4 3465 B6R0.4 CC(=O)CCC#N Amb17334046 [1,1,0,0,0,0|2,0,0]=4 3466 B6R0.4 CC(=O)CCC=O Amb18639597 [1,1,0,0,0,0|1,0,1]=4 3467 B6R0.4 CC(=O)CCCBr Amb8394105 [1,1,0,0,0,0|2,0,0]=4 3468 B6R0.4 CC(=O)CCCCl Amb3940272 [1,1,0,0,0,0|2,0,0]=4 3469 B6R0.4 CC(=O)CCCF Amb25068187 [1,1,0,0,0,0|2,0,0]=4 3470 B6R0.4 CC(=O)CCCN Amb18121547 [1,1,0,0,0,0|2,0,0]=4 3471 B6R0.4 CC(=O)CCCN Amb32661221 [1,1,0,0,0,0|2,0,0]=4 3472 B6R0.4 CC(=O)CCCN Amb32661286 [1,1,0,0,0,0|2,0,0]=4 3473 B6R0.4 CC(=O)CCCO Amb3940340 [1,1,0,0,0,0|1,0,0]=3 3474 B6R0.4 CC(=O)C\C=N\O Amb27750272 [1,1,0,0,0,0|1,0,1]=4 3475 B6R0.4 CC(=O)NCCBr Amb4311522 [1,1,0,0,0,0|2,0,0]=4 3476 B6R0.4 CC(=O)NCCCl Amb423758 [1,1,0,0,0,0|2,0,0]=4 3477 B6R0.4 CC(=O)NCCN Amb1218225 [1,1,0,0,0,0|2,0,0]=4 3478 B6R0.4 CC(=O)NCCO Amb2720909 [1,1,0,0,0,0|1,0,0]=3 3479 B6R0.4 CC(=O)NCCS Amb22230992 [1,1,0,0,0,0|1,1,0]=4 3480 B6R0.4 CC(=O)OCCBr Amb3940209 [1,1,0,0,0,0|2,0,0]=4 3481 B6R0.4 CC(=O)OCCN Amb18121947 [1,1,0,0,0,0|2,0,0]=4 3482 B6R0.4 CC(=O)OCCN Amb28827650 [1,1,0,0,0,0|2,0,0]=4 3483 B6R0.4 CC(=O)OCCO Amb3941004 [1,1,0,0,0,0|1,0,0]=3 3484 B6R0.4 CC(=O)SCCBr Amb24608039 [1,1,0,0,0,0|2,0,0]=4 3485 B6R0.4 CC(=O)SCCN Amb21953963 [1,1,0,0,0,0|2,0,0]=4 3486 B6R0.4 CC(=O)SCCN Amb22011516 [1,1,0,0,0,0|2,0,0]=4 3487 B6R0.4 CC(=O)SCCN Amb31291049 [1,1,0,0,0,0|2,0,0]=4 3488 B6R0.4 CC(=O)SCCO Amb27481182 [1,1,0,0,0,0|1,0,0]=3 3489 B6R0.4 CC(=S)SCCO Amb28350218 [1,1,0,0,0,0|1,1,0]=4 3490 B6R0.4 CC(C)=CCCO Amb22002283 [1,1,0,0,0,0|2,0,0]=4 3491 B6R0.4 CC(C)=NCCO Amb27612560 [1,1,0,0,0,0|2,0,0]=4 3492 B6R0.4 CC(O)CCCO Amb22227752 [1,1,0,0,0,0|1,0,1]=4 3493 B6R0.4 CC(O)COCO Amb27764974 [1,1,0,0,0,0|1,0,1]=4 3494 B6R0.4 CC(O)OCCO Amb28065279 [1,1,0,0,0,0|1,0,1]=4 3495 B6R0.4 CCC#CC(=O)O Amb6336503 [1,1,0,0,0,0|1,0,1]=4 3496 B6R0.4 CCCCC(=O)Cl Amb3939066 [1,1,0,0,0,0|2,0,0]=4 3497 B6R0.4 CCCCC(=O)O Amb3939877 [1,1,0,0,0,0|1,0,0]=3 3498 B6R0.4 CCCCC(=O)[O-] Amb22056343 [1,1,0,0,0,0|1,0,1]=4 3499 B6R0.4 CCCCC(C)=O Amb6608652 [1,1,0,0,0,0|2,0,0]=4 3500 B6R0.4 CCCCC(N)=O Amb6891958 [1,1,0,0,0,0|2,0,0]=4 3501 B6R0.4 CCCC[PH](=O)O Amb8391286 [1,1,0,0,0,0|2,0,0]=4 3502 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,1,0,0,0,0|2,0,0]=4 3503 B6R0.4 CCCNC(C)=O Amb5835710 [1,1,0,0,0,0|2,0,0]=4 3504 B6R0.4 CCCNC(N)=O Amb1152241 [1,1,0,0,0,0|2,0,0]=4 3505 B6R0.4 CCCOC(=O)Cl Amb10604123 [1,1,0,0,0,0|2,0,0]=4 3506 B6R0.4 CCCOC(=O)F Amb32667886 [1,1,0,0,0,0|2,0,0]=4 3507 B6R0.4 CCCOC(N)=O Amb6334809 [1,1,0,0,0,0|2,0,0]=4 3508 B6R0.4 CCCSC(C)=O Amb22043301 [1,1,0,0,0,0|2,0,0]=4 3509 B6R0.4 CCCSC(N)=O Amb27167907 [1,1,0,0,0,0|2,0,0]=4 3510 B6R0.4 CCNCC(=O)Cl Amb27948279 [1,1,0,0,0,0|2,0,0]=4 3511 B6R0.4 CCNCC(=O)O Amb10609667 [1,1,0,0,0,0|1,0,0]=3 3512 B6R0.4 CCNCC(=O)O Amb7764661 [1,1,0,0,0,0|1,0,0]=3 3513 B6R0.4 CCNCC(C)=O Amb24545893 [1,1,0,0,0,0|2,0,0]=4 3514 B6R0.4 CCNCC(C)=O Amb32661185 [1,1,0,0,0,0|2,0,0]=4 3515 B6R0.4 CCNCC(N)=O Amb1128676 [1,1,0,0,0,0|2,0,0]=4 3516 B6R0.4 CCNCC(N)=O Amb4035424 [1,1,0,0,0,0|2,0,0]=4 3517 B6R0.4 CCOCC(=O)Cl Amb33528415 [1,1,0,0,0,0|2,0,0]=4 3518 B6R0.4 CCOCC(=O)O Amb3939880 [1,1,0,0,0,0|1,0,0]=3 3519 B6R0.4 CCOCC(=O)S Amb27813482 [1,1,0,0,0,0|1,1,0]=4 3520 B6R0.4 CCOCC(C)=O Amb9666086 [1,1,0,0,0,0|2,0,0]=4 3521 B6R0.4 CCPCC(=O)O Amb28321137 [1,1,0,0,0,0|1,0,0]=3 3522 B6R0.4 CCSCC(=O)O Amb1125185 [1,1,0,0,0,0|1,0,0]=3 3523 B6R0.4 CCSCC(C)=O Amb4018179 [1,1,0,0,0,0|2,0,0]=4 3524 B6R0.4 CC\C=C/C(=O)O Amb28429841 [1,1,0,0,0,0|1,0,1]=4 3525 B6R0.4 CC\C=C\C(=O)O Amb6608967 [1,1,0,0,0,0|1,0,1]=4 3526 B6R0.4 CC\N=C\C(=O)O Amb28041425 [1,1,0,0,0,0|1,0,1]=4 3527 B6R0.4 CNCCC(=O)Cl Amb27422890 [1,1,0,0,0,0|2,0,0]=4 3528 B6R0.4 CNCCC(=O)O Amb10609760 [1,1,0,0,0,0|1,0,0]=3 3529 B6R0.4 CNCCC(=O)O Amb7766400 [1,1,0,0,0,0|1,0,0]=3 3530 B6R0.4 CNCCC(C)=O Amb24560306 [1,1,0,0,0,0|2,0,0]=4 3531 B6R0.4 CNCCC(C)=O Amb28827637 [1,1,0,0,0,0|2,0,0]=4 3532 B6R0.4 CNCCC(N)=O Amb19959913 [1,1,0,0,0,0|2,0,0]=4 3533 B6R0.4 CNCCC(N)=O Amb33538309 [1,1,0,0,0,0|2,0,0]=4 3534 B6R0.4 COCCB(O)O Amb27173037 [1,1,0,0,0,0|1,0,1]=4 3535 B6R0.4 COCCC(=N)N Amb2696283 [1,1,0,0,0,0|2,0,0]=4 3536 B6R0.4 COCCC(=N)N Amb8630184 [1,1,0,0,0,0|2,0,0]=4 3537 B6R0.4 COCCC(=O)Cl Amb2689274 [1,1,0,0,0,0|1,0,0]=3 3538 B6R0.4 COCCC(=O)O Amb3938990 [1,1,0,0,0,0|0,0,0]=2 3539 B6R0.4 COCCC(C)=O Amb7764907 [1,1,0,0,0,0|1,0,0]=3 3540 B6R0.4 COCCC(C)O Amb20621489 [1,1,0,0,0,0|1,0,1]=4 3541 B6R0.4 COCCC(N)=O Amb33538943 [1,1,0,0,0,0|1,0,0]=3 3542 B6R0.4 COCCC(N)=S Amb6250669 [1,1,0,0,0,0|1,1,0]=4 3543 B6R0.4 COCCC(O)Br Amb20242943 [1,1,0,0,0,0|1,0,1]=4 3544 B6R0.4 COCCC(O)O Amb28410462 [1,1,0,0,0,0|0,0,2]=4 3545 B6R0.4 COCCN(C)O Amb33428857 [1,1,0,0,0,0|2,0,0]=4 3546 B6R0.4 COCCS(=O)Cl Amb25914790 [1,1,0,0,0,0|2,0,0]=4 3547 B6R0.4 COCCS(=O)[O-] Amb26874008 [1,1,0,0,0,0|1,0,1]=4 3548 B6R0.4 COCCS(N)=O Amb32720336 [1,1,0,0,0,0|2,0,0]=4 3549 B6R0.4 COCC[C@@H](C)O Amb27237141 [1,1,0,0,0,0|1,0,1]=4 3550 B6R0.4 COCC[C@H](C)O Amb26559043 [1,1,0,0,0,0|1,0,1]=4 3551 B6R0.4 COCNC(N)=O Amb25744350 [1,1,0,0,0,0|2,0,0]=4 3552 B6R0.4 CONCC(N)=O Amb28455463 [1,1,0,0,0,0|2,0,0]=4 3553 B6R0.4 CO\C=C\C(=O)O Amb18121767 [1,1,0,0,0,0|0,0,2]=4 3554 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,1,0,0,0,0|1,0,1]=4 3555 B6R0.4 CSCCC(=O)O Amb3939879 [1,1,0,0,0,0|0,1,0]=3 3556 B6R0.4 CSCCC(C)=O Amb8392858 [1,1,0,0,0,0|1,1,0]=4 3557 B6R0.4 CSSCC(=O)O Amb25378801 [1,1,0,0,0,0|1,1,0]=4 3558 B6R0.4 C[C@@H](O)CCCO Amb28047449 [1,1,0,0,0,0|1,0,1]=4 3559 B6R0.4 C\C(Cl)=C\CCO Amb27956430 [1,1,0,0,0,0|2,0,0]=4 3560 B6R0.4 C\C(N)=N\CCO Amb26857579 [1,1,0,0,0,0|2,0,0]=4 3561 B6R0.4 C\C=C\CC(=O)O Amb3941538 [1,1,0,0,0,0|1,0,1]=4 3562 B6R0.4 N#CCCC(=O)Cl Amb25106570 [1,1,0,0,0,0|2,0,0]=4 3563 B6R0.4 N#CCCC(=O)O Amb2694975 [1,1,0,0,0,0|1,0,0]=3 3564 B6R0.4 N#CCCC(N)=O Amb8841150 [1,1,0,0,0,0|2,0,0]=4 3565 B6R0.4 N=C(N)CCCO Amb33038287 [1,1,0,0,0,0|2,0,0]=4 3566 B6R0.4 N=C(N)NCCO Amb16231403 [1,1,0,0,0,0|2,0,0]=4 3567 B6R0.4 N=C(N)NCCO Amb6429694 [1,1,0,0,0,0|2,0,0]=4 3568 B6R0.4 N=C(N)SCCO Amb1160204 [1,1,0,0,0,0|2,0,0]=4 3569 B6R0.4 N=C(N)SCCO Amb34916582 [1,1,0,0,0,0|2,0,0]=4 3570 B6R0.4 N=CNCC(=O)O Amb24670244 [1,1,0,0,0,0|1,0,1]=4 3571 B6R0.4 NC(=O)CCCCl Amb1138237 [1,1,0,0,0,0|2,0,0]=4 3572 B6R0.4 NC(=O)CCCF Amb28073400 [1,1,0,0,0,0|2,0,0]=4 3573 B6R0.4 NC(=O)CCCO Amb20623438 [1,1,0,0,0,0|1,0,0]=3 3574 B6R0.4 NC(=O)CCCS Amb27174778 [1,1,0,0,0,0|1,1,0]=4 3575 B6R0.4 NC(=O)NCCBr Amb28385599 [1,1,0,0,0,0|2,0,0]=4 3576 B6R0.4 NC(=O)NCCF Amb27446994 [1,1,0,0,0,0|2,0,0]=4 3577 B6R0.4 NC(=O)NCCI Amb27454955 [1,1,0,0,0,0|2,0,0]=4 3578 B6R0.4 NC(=O)NCCO Amb1146041 [1,1,0,0,0,0|1,0,0]=3 3579 B6R0.4 NC(=O)OCCCl Amb3940645 [1,1,0,0,0,0|2,0,0]=4 3580 B6R0.4 NC(=O)OCCO Amb20623788 [1,1,0,0,0,0|1,0,0]=3 3581 B6R0.4 NC(=O)SCCCl Amb27619850 [1,1,0,0,0,0|2,0,0]=4 3582 B6R0.4 NC(=S)CCCO Amb9215001 [1,1,0,0,0,0|1,1,0]=4 3583 B6R0.4 NC(=S)NCCO Amb19515723 [1,1,0,0,0,0|1,1,0]=4 3584 B6R0.4 NC(N)=NCCO Amb19374418 [1,1,0,0,0,0|2,0,0]=4 3585 B6R0.4 NCC#CC(=O)O Amb25703096 [1,1,0,0,0,0|1,0,1]=4 3586 B6R0.4 NCC#CC(=O)O Amb32666878 [1,1,0,0,0,0|1,0,1]=4 3587 B6R0.4 NCCCC(=O)Cl Amb1935063 [1,1,0,0,0,0|2,0,0]=4 3588 B6R0.4 NCCCC(=O)O Amb1935210 [1,1,0,0,0,0|1,0,0]=3 3589 B6R0.4 NCCCC(N)=O Amb2099583 [1,1,0,0,0,0|2,0,0]=4 3590 B6R0.4 NCCCC(N)=O Amb6543438 [1,1,0,0,0,0|2,0,0]=4 3591 B6R0.4 NCCCS(=O)O Amb25185942 [1,1,0,0,0,0|2,0,0]=4 3592 B6R0.4 NCCC[PH](=O)O Amb22370049 [1,1,0,0,0,0|2,0,0]=4 3593 B6R0.4 NCCNC(N)=O Amb19374121 [1,1,0,0,0,0|2,0,0]=4 3594 B6R0.4 NCCNC(N)=O Amb32665340 [1,1,0,0,0,0|2,0,0]=4 3595 B6R0.4 NCCNC(N)=O Amb6254968 [1,1,0,0,0,0|2,0,0]=4 3596 B6R0.4 NCCOC(N)=O Amb22059480 [1,1,0,0,0,0|2,0,0]=4 3597 B6R0.4 NCCOC(N)=O Amb24271076 [1,1,0,0,0,0|2,0,0]=4 3598 B6R0.4 NCCOS(=O)O Amb25843211 [1,1,0,0,0,0|2,0,0]=4 3599 B6R0.4 NCCO[PH](=O)O Amb28046334 [1,1,0,0,0,0|2,0,0]=4 3600 B6R0.4 NC\C=C/C(=O)O Amb24117018 [1,1,0,0,0,0|1,0,1]=4 3601 B6R0.4 NC\C=C\C(=O)O Amb33422010 [1,1,0,0,0,0|1,0,1]=4 3602 B6R0.4 NC\C=C\C(=O)O Amb33422035 [1,1,0,0,0,0|1,0,1]=4 3603 B6R0.4 NNCCC(=O)O Amb33756816 [1,1,0,0,0,0|1,0,0]=3 3604 B6R0.4 NOCCC(=O)O Amb17569891 [1,1,0,0,0,0|0,0,0]=2 3605 B6R0.4 NOCCC(=O)O Amb32693437 [1,1,0,0,0,0|0,0,0]=2 3606 B6R0.4 NOCCC(N)=O Amb27838275 [1,1,0,0,0,0|1,0,0]=3 3607 B6R0.4 O=C(Br)CCCBr Amb25724818 [1,1,0,0,0,0|2,0,0]=4 3608 B6R0.4 O=C(Cl)CCCBr Amb3940241 [1,1,0,0,0,0|2,0,0]=4 3609 B6R0.4 O=C(Cl)CCCCl Amb6608638 [1,1,0,0,0,0|2,0,0]=4 3610 B6R0.4 O=C(Cl)NCCBr Amb28123956 [1,1,0,0,0,0|2,0,0]=4 3611 B6R0.4 O=C(Cl)NCCCl Amb24479815 [1,1,0,0,0,0|2,0,0]=4 3612 B6R0.4 O=C(Cl)NCCF Amb35633248 [1,1,0,0,0,0|2,0,0]=4 3613 B6R0.4 O=C(Cl)OCCBr Amb8514406 [1,1,0,0,0,0|2,0,0]=4 3614 B6R0.4 O=C(Cl)OCCCl Amb6608837 [1,1,0,0,0,0|2,0,0]=4 3615 B6R0.4 O=C(Cl)OCCF Amb21618836 [1,1,0,0,0,0|2,0,0]=4 3616 B6R0.4 O=C(O)C#CCCl Amb33544591 [1,1,0,0,0,0|1,0,1]=4 3617 B6R0.4 O=C(O)C#CCI Amb27860307 [1,1,0,0,0,0|1,0,1]=4 3618 B6R0.4 O=C(O)C#CCO Amb22002375 [1,1,0,0,0,0|0,0,1]=3 3619 B6R0.4 O=C(O)CCCBr Amb8393276 [1,1,0,0,0,0|1,0,0]=3 3620 B6R0.4 O=C(O)CCCCl Amb3940333 [1,1,0,0,0,0|1,0,0]=3 3621 B6R0.4 O=C(O)CCCF Amb17593104 [1,1,0,0,0,0|1,0,0]=3 3622 B6R0.4 O=C(O)CCCI Amb22295911 [1,1,0,0,0,0|1,0,0]=3 3623 B6R0.4 O=C(O)CCCO Amb18640332 [1,1,0,0,0,0|0,0,0]=2 3624 B6R0.4 O=C(O)CCCS Amb16185429 [1,1,0,0,0,0|0,1,0]=3 3625 B6R0.4 O=C(O)CCNO Amb28067767 [1,1,0,0,0,0|0,0,0]=2 3626 B6R0.4 O=C(O)CCSCl Amb28387511 [1,1,0,0,0,0|0,1,0]=3 3627 B6R0.4 O=C(O)COCF Amb33378705 [1,1,0,0,0,0|1,0,0]=3 3628 B6R0.4 O=C(O)CPCO Amb28340565 [1,1,0,0,0,0|0,0,0]=2 3629 B6R0.4 O=C(O)CSSCl Amb27477882 [1,1,0,0,0,0|1,1,0]=4 3630 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [1,1,0,0,0,0|1,0,1]=4 3631 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [1,1,0,0,0,0|1,0,1]=4 3632 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [1,1,0,0,0,0|1,0,1]=4 3633 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [1,1,0,0,0,0|1,0,1]=4 3634 B6R0.4 O=C(O)\C=C\CF Amb33470171 [1,1,0,0,0,0|1,0,1]=4 3635 B6R0.4 O=C(O)\C=C\CO Amb32662006 [1,1,0,0,0,0|0,0,1]=3 3636 B6R0.4 O=C(S)NCCO Amb27430045 [1,1,0,0,0,0|0,1,0]=3 3637 B6R0.4 O=C([O-])CCCO Amb3429667 [1,1,0,0,0,0|0,0,1]=3 3638 B6R0.4 O=C([O-])CNCO Amb8383630 [1,1,0,0,0,0|0,0,1]=3 3639 B6R0.4 O=C([O-])\C=C\CO Amb33542275 [1,1,0,0,0,0|0,0,2]=4 3640 B6R0.4 O=CCCC(=O)O Amb17673897 [1,1,0,0,0,0|0,0,1]=3 3641 B6R0.4 O=CNCC(=O)O Amb1911508 [1,1,0,0,0,0|0,0,2]=4 3642 B6R0.4 O=COCC(=O)O Amb26624011 [1,1,0,0,0,0|0,0,2]=4 3643 B6R0.4 O=S(O)COCO Amb27410575 [1,1,0,0,0,0|1,0,0]=3 3644 B6R0.4 O=S(O)OCCCl Amb27786730 [1,1,0,0,0,0|2,0,0]=4 3645 B6R0.4 O=S([O-])CCCO Amb27221257 [1,1,0,0,0,0|1,0,1]=4 3646 B6R0.4 O=[N+]([O-])CCCO Amb20247690 [1,1,0,0,0,0|1,0,1]=4 3647 B6R0.4 O=[N+]([O-])NCCO Amb17618377 [1,1,0,0,0,0|1,0,1]=4 3648 B6R0.4 O=[PH](O)CCCO Amb28345330 [1,1,0,0,0,0|1,0,0]=3 3649 B6R0.4 O=[PH](S)OCCO Amb27981751 [1,1,0,0,0,0|1,1,0]=4 3650 B6R0.4 OCCC=C(Cl)Cl Amb17593563 [1,1,0,0,0,0|2,0,0]=4 3651 B6R0.4 OCCCB(O)O Amb27391604 [1,1,0,0,0,0|1,0,1]=4 3652 B6R0.4 OCCOP(O)O Amb28283645 [1,1,0,0,0,0|1,0,1]=4 3653 B6R0.4 [N-]=[N+]=NCC(=O)O Amb10070956 [1,1,0,0,0,0|2,0,0]=4 3654 B6R0.5 CC(C)(O)CCO Amb8517368 [1,1,0,0,0,0|1,0,1]=4 3655 B6R0.5 CCCP(=O)(O)O Amb22230045 [1,1,0,0,0,0|2,0,0]=4 3656 B6R0.5 CS(=N)(=O)CCO Amb33457507 [1,1,0,0,0,0|2,0,0]=4 3657 B6R0.5 CS(=O)(=O)CCO Amb3939193 [1,1,0,0,0,0|1,0,1]=4 3658 B6R0.5 C[S@](=N)(=O)CCO Amb33744008 [1,1,0,0,0,0|2,0,0]=4 3659 B6R0.5 NCCP(=O)(O)O Amb4297144 [1,1,0,0,0,0|2,0,0]=4 3660 B6R0.5 NCCS(=O)(=O)O Amb2695361 [1,1,0,0,0,0|2,0,0]=4 3661 B6R0.5 NCC[PH](=O)(=O)O Amb28365875 [1,1,0,0,0,0|2,0,0]=4 3662 B6R0.5 NS(=O)(=O)CCO Amb33549411 [1,1,0,0,0,0|1,0,1]=4 3663 B6R0.5 O=P(O)(O)CCBr Amb8479835 [1,1,0,0,0,0|2,0,0]=4 3664 B6R0.5 O=P(O)(O)CCCl Amb6297766 [1,1,0,0,0,0|2,0,0]=4 3665 B6R0.5 O=P(O)(O)CCO Amb22388824 [1,1,0,0,0,0|1,0,0]=3 3666 B6R0.5 O=S(=O)(Cl)CCO Amb19148996 [1,1,0,0,0,0|1,0,1]=4 3667 B6R0.5 O=S(=O)(F)CCO Amb27197511 [1,1,0,0,0,0|1,0,1]=4 3668 B6R0.5 O=S(=O)(O)CCBr Amb17938633 [1,1,0,0,0,0|2,0,0]=4 3669 B6R0.5 O=S(=O)(O)CCCl Amb33513054 [1,1,0,0,0,0|2,0,0]=4 3670 B6R0.5 O=S(=O)(O)CCO Amb8383477 [1,1,0,0,0,0|1,0,0]=3 3671 B6R0.5 O=S(=O)(O)CCS Amb22337676 [1,1,0,0,0,0|1,1,0]=4 3672 B6R0.5 O=S(=O)([O-])CCO Amb8514291 [1,1,0,0,0,0|1,0,1]=4 3673 B6R0.8 C=CC(C)(C)CO Amb22232102 [1,1,0,0,0,0|2,0,0]=4 3674 B6R0.8 C=CC(C)(N)CC Amb24441335 [1,1,0,0,0,0|2,0,0]=4 3675 B6R0.8 C=CC(C)(N)CC Amb31188308 [1,1,0,0,0,0|2,0,0]=4 3676 B6R0.8 C=CC(C)(N)CO Amb19374999 [1,1,0,0,0,0|1,0,0]=3 3677 B6R0.8 C=CC(N)(O)C=O Amb28075478 [1,1,0,0,0,0|1,0,1]=4 3678 B6R0.8 CC(C)(C=O)CBr Amb18126378 [1,1,0,0,0,0|2,0,0]=4 3679 B6R0.8 CC(C)(C=O)CCl Amb18124283 [1,1,0,0,0,0|2,0,0]=4 3680 B6R0.8 CC(C)(C=O)CF Amb26500542 [1,1,0,0,0,0|2,0,0]=4 3681 B6R0.8 CC(C)(C=O)CO Amb4025820 [1,1,0,0,0,0|1,0,0]=3 3682 B6R0.8 CC(C)(CO)CO Amb5722396 [1,1,0,0,0,0|1,0,1]=4 3683 B6R0.8 CC(C)(CO)NO Amb28386429 [1,1,0,0,0,0|2,0,0]=4 3684 B6R0.8 CC(Cl)(C=O)CCl Amb27636344 [1,1,0,0,0,0|2,0,0]=4 3685 B6R0.8 CC(Cl)(C=O)CO Amb28050404 [1,1,0,0,0,0|1,0,0]=3 3686 B6R0.8 CC(F)(CO)CO Amb28127564 [1,1,0,0,0,0|1,0,1]=4 3687 B6R0.8 CC(N)(C#N)CO Amb25810521 [1,1,0,0,0,0|1,0,1]=4 3688 B6R0.8 CC(N)(C#N)CO Amb28827652 [1,1,0,0,0,0|1,0,1]=4 3689 B6R0.8 CC(N)(CO)CF Amb33379295 [1,1,0,0,0,0|1,0,1]=4 3690 B6R0.8 CC(N)(CO)CI Amb28075273 [1,1,0,0,0,0|1,0,1]=4 3691 B6R0.8 CC(N)(CO)CO Amb2720351 [1,1,0,0,0,0|0,0,1]=3 3692 B6R0.8 CC(O)(CO)CO Amb24431597 [1,1,0,0,0,0|1,0,1]=4 3693 B6R0.8 CCC(Br)(Br)C=O Amb25095515 [1,1,0,0,0,0|2,0,0]=4 3694 B6R0.8 CCC(C)(C)C=O Amb19148820 [1,1,0,0,0,0|2,0,0]=4 3695 B6R0.8 CCC(C)(N)CO Amb13951706 [1,1,0,0,0,0|1,0,1]=4 3696 B6R0.8 CCC(C)(O)C=O Amb18639932 [1,1,0,0,0,0|2,0,0]=4 3697 B6R0.8 CCC(Cl)(Br)C=O Amb28050229 [1,1,0,0,0,0|2,0,0]=4 3698 B6R0.8 CC[C@@](C)(N)CO Amb27874925 [1,1,0,0,0,0|1,0,1]=4 3699 B6R0.8 CC[C@](C)(O)C=O Amb27838212 [1,1,0,0,0,0|2,0,0]=4 3700 B6R0.8 NC(O)(CO)CO Amb27640412 [1,1,0,0,0,0|0,0,1]=3 3701 B6R0.8 O=CC(Br)(Br)CBr Amb20622046 [1,1,0,0,0,0|2,0,0]=4 3702 B6R0.8 OCC(F)(F)CO Amb20670754 [1,1,0,0,0,0|1,0,1]=4 3703 B6R0.9 C#CC(CO)NC Amb28043063 [1,1,0,0,0,0|1,0,1]=4 3704 B6R0.9 C=CC(CC)NC Amb27223815 [1,1,0,0,0,0|2,0,0]=4 3705 B6R0.9 C=CC(CC)NN Amb27972402 [1,1,0,0,0,0|2,0,0]=4 3706 B6R0.9 C=CC(CO)CO Amb26896788 [1,1,0,0,0,0|1,0,1]=4 3707 B6R0.9 C=CC(CO)OC Amb22228508 [1,1,0,0,0,0|2,0,0]=4 3708 B6R0.9 C=C[C@@H](CO)NC Amb27838264 [1,1,0,0,0,0|1,0,0]=3 3709 B6R0.9 C=C[C@H](CO)OC Amb27835146 [1,1,0,0,0,0|2,0,0]=4 3710 B6R0.9 CCC(C#N)C=O Amb9669146 [1,1,0,0,0,0|1,0,1]=4 3711 B6R0.9 CCC(C=O)C=O Amb25798416 [1,1,0,0,0,0|2,0,0]=4 3712 B6R0.9 CCC(C=O)CC Amb3939947 [1,1,0,0,0,0|2,0,0]=4 3713 B6R0.9 CCC(C=O)CO Amb27986136 [1,1,0,0,0,0|1,0,0]=3 3714 B6R0.9 CCC(C=O)CS Amb27826916 [1,1,0,0,0,0|1,1,0]=4 3715 B6R0.9 CCC(C=O)OC Amb18121854 [1,1,0,0,0,0|2,0,0]=4 3716 B6R0.9 CCC(CN)CO Amb26043125 [1,1,0,0,0,0|1,0,1]=4 3717 B6R0.9 CCC(CO)CO Amb33543850 [1,1,0,0,0,0|1,0,1]=4 3718 B6R0.9 CCC(CO)NC Amb9247426 [1,1,0,0,0,0|1,0,1]=4 3719 B6R0.9 CCC(CO)NCl Amb28281889 [1,1,0,0,0,0|1,0,1]=4 3720 B6R0.9 CC[C@@H](CO)NC Amb24480613 [1,1,0,0,0,0|1,0,1]=4 3721 B6R0.9 CC[C@H](CO)NC Amb28324827 [1,1,0,0,0,0|1,0,1]=4 3722 B6R0.9 CC\C(C=O)=C\N Amb28248353 [1,1,0,0,0,0|1,0,1]=4 3723 B6R0.9 CNC(CO)CO Amb26047305 [1,1,0,0,0,0|0,0,1]=3 3724 B6R0.9 CNC(CO)CO Amb28827636 [1,1,0,0,0,0|0,0,1]=3 3725 B6R0.9 COC(CN)CO Amb28290297 [1,1,0,0,0,0|2,0,0]=4 3726 B6R0.9 COC(CN)CO Amb30982561 [1,1,0,0,0,0|2,0,0]=4 3727 B6R0.9 COC(CO)CO Amb24117539 [1,1,0,0,0,0|1,0,1]=4 3728 B6R0.9 CO[C@@H](C=O)CO Amb27759414 [1,1,0,0,0,0|1,0,0]=3 3729 B6R0.9 CO[C@H](CN)CO Amb33803482 [1,1,0,0,0,0|2,0,0]=4 3730 B6R0.9 CO[C@H](CN)CO Amb33803866 [1,1,0,0,0,0|2,0,0]=4 3731 B6R0.9 C\C=C(\C=O)CO Amb28388682 [1,1,0,0,0,0|1,0,1]=4 3732 B6R0.9 NCC(CN)CO Amb28365883 [1,1,0,0,0,0|1,0,1]=4 3733 B6R0.9 NCC(CO)CF Amb24695461 [1,1,0,0,0,0|1,0,1]=4 3734 B6R0.9 NCC(CO)CO Amb18640484 [1,1,0,0,0,0|0,0,1]=3 3735 B6R0.9 NCC(CO)CO Amb32708526 [1,1,0,0,0,0|0,0,1]=3 3736 B6R0.9 NN=C(CO)CO Amb28206623 [1,1,0,0,0,0|0,0,2]=4 3737 B6R0.9 OCC(CF)NO Amb27763848 [1,1,0,0,0,0|1,0,1]=4 3738 B6R0.9 OCC(CO)CF Amb27211305 [1,1,0,0,0,0|1,0,1]=4 3739 B6R0.9 OCC(CO)CO Amb20240672 [1,1,0,0,0,0|1,0,1]=4 3740 B6R0.7 C=C(C)C(C)(C)N Amb28290298 [1,1,0,0,0,0|2,0,0]=4 3741 B6R0.7 C=C(N)C(C)(N)N Amb28283232 [1,1,0,0,0,0|2,0,0]=4 3742 B6R0.7 CC(=O)C(C)(C)Br Amb2389573 [1,1,0,0,0,0|2,0,0]=4 3743 B6R0.7 CC(=O)C(C)(C)C Amb2690343 [1,1,0,0,0,0|2,0,0]=4 3744 B6R0.7 CC(=O)C(C)(C)Cl Amb2721559 [1,1,0,0,0,0|2,0,0]=4 3745 B6R0.7 CC(=O)C(C)(C)F Amb24479081 [1,1,0,0,0,0|2,0,0]=4 3746 B6R0.7 CC(=O)C(C)(C)N Amb1087903 [1,1,0,0,0,0|1,0,0]=3 3747 B6R0.7 CC(=O)C(C)(C)N Amb22283888 [1,1,0,0,0,0|1,0,0]=3 3748 B6R0.7 CC(=O)C(C)(C)O Amb4037279 [1,1,0,0,0,0|2,0,0]=4 3749 B6R0.7 CC(=O)C(C)(C)S Amb28146340 [1,1,0,0,0,0|2,0,0]=4 3750 B6R0.7 CC(=O)C(C)(Cl)Cl Amb26030995 [1,1,0,0,0,0|2,0,0]=4 3751 B6R0.7 CC(=O)C(C)(F)Cl Amb28194624 [1,1,0,0,0,0|2,0,0]=4 3752 B6R0.7 CC(=O)C(C)(F)F Amb26857301 [1,1,0,0,0,0|2,0,0]=4 3753 B6R0.7 CC(Br)(Br)C(=O)O Amb26856468 [1,1,0,0,0,0|1,0,0]=3 3754 B6R0.7 CC(C)(Br)C(=O)Br Amb8516518 [1,1,0,0,0,0|2,0,0]=4 3755 B6R0.7 CC(C)(Br)C(=O)Cl Amb18090808 [1,1,0,0,0,0|2,0,0]=4 3756 B6R0.7 CC(C)(Br)C(=O)O Amb8389348 [1,1,0,0,0,0|1,0,0]=3 3757 B6R0.7 CC(C)(Br)C(N)=O Amb10071123 [1,1,0,0,0,0|2,0,0]=4 3758 B6R0.7 CC(C)(C)C(=O)Cl Amb3939335 [1,1,0,0,0,0|2,0,0]=4 3759 B6R0.7 CC(C)(C)C(=O)O Amb3939854 [1,1,0,0,0,0|1,0,0]=3 3760 B6R0.7 CC(C)(C)C(=O)S Amb20240548 [1,1,0,0,0,0|1,1,0]=4 3761 B6R0.7 CC(C)(C)C(=O)[O-] Amb16192974 [1,1,0,0,0,0|1,0,1]=4 3762 B6R0.7 CC(C)(C)C(=O)[O-] Amb8516460 [1,1,0,0,0,0|1,0,1]=4 3763 B6R0.7 CC(C)(C)C(N)=O Amb1151239 [1,1,0,0,0,0|2,0,0]=4 3764 B6R0.7 CC(C)(C)S(=O)O Amb25194337 [1,1,0,0,0,0|2,0,0]=4 3765 B6R0.7 CC(C)(Cl)C(=O)Cl Amb20668299 [1,1,0,0,0,0|2,0,0]=4 3766 B6R0.7 CC(C)(Cl)C(=O)O Amb8390677 [1,1,0,0,0,0|1,0,0]=3 3767 B6R0.7 CC(C)(Cl)C(N)=O Amb24122839 [1,1,0,0,0,0|2,0,0]=4 3768 B6R0.7 CC(C)(F)C(=O)O Amb2688137 [1,1,0,0,0,0|1,0,0]=3 3769 B6R0.7 CC(C)(F)C(N)=O Amb20671475 [1,1,0,0,0,0|2,0,0]=4 3770 B6R0.7 CC(C)(N)C(=N)N Amb23596457 [1,1,0,0,0,0|2,0,0]=4 3771 B6R0.7 CC(C)(N)C(=N)N Amb33038301 [1,1,0,0,0,0|2,0,0]=4 3772 B6R0.7 CC(C)(N)C(=O)Cl Amb24479876 [1,1,0,0,0,0|1,0,0]=3 3773 B6R0.7 CC(C)(N)C(=O)O Amb6392202 [1,1,0,0,0,0|0,0,0]=2 3774 B6R0.7 CC(C)(N)C(N)=O Amb10608162 [1,1,0,0,0,0|1,0,0]=3 3775 B6R0.7 CC(C)(N)C(N)=O Amb10609802 [1,1,0,0,0,0|1,0,0]=3 3776 B6R0.7 CC(C)(N)C(N)=S Amb19374913 [1,1,0,0,0,0|1,1,0]=4 3777 B6R0.7 CC(C)(O)C(=O)O Amb1159101 [1,1,0,0,0,0|1,0,0]=3 3778 B6R0.7 CC(C)(O)C(N)=O Amb8389355 [1,1,0,0,0,0|2,0,0]=4 3779 B6R0.7 CC(C)(S)C(=O)O Amb17501520 [1,1,0,0,0,0|1,0,0]=3 3780 B6R0.7 CC(C)P(=O)(O)O Amb4297373 [1,1,0,0,0,0|2,0,0]=4 3781 B6R0.7 CC(C)S(=O)(=O)O Amb27802966 [1,1,0,0,0,0|2,0,0]=4 3782 B6R0.7 CC(Cl)(Cl)C(=O)Cl Amb27155609 [1,1,0,0,0,0|2,0,0]=4 3783 B6R0.7 CC(Cl)(Cl)C(=O)O Amb2720940 [1,1,0,0,0,0|1,0,0]=3 3784 B6R0.7 CC(Cl)(Cl)C(N)=O Amb22229722 [1,1,0,0,0,0|2,0,0]=4 3785 B6R0.7 CC(Cl)S(=O)(=O)O Amb27955272 [1,1,0,0,0,0|2,0,0]=4 3786 B6R0.7 CC(F)(Br)C(=O)O Amb19895446 [1,1,0,0,0,0|1,0,0]=3 3787 B6R0.7 CC(F)(Cl)C(=O)O Amb22011870 [1,1,0,0,0,0|1,0,0]=3 3788 B6R0.7 CC(F)(F)C(=O)Cl Amb25795425 [1,1,0,0,0,0|2,0,0]=4 3789 B6R0.7 CC(F)(F)C(=O)O Amb2687267 [1,1,0,0,0,0|1,0,0]=3 3790 B6R0.7 CC(F)(F)C(=O)[O-] Amb22008197 [1,1,0,0,0,0|1,0,1]=4 3791 B6R0.7 CC(F)(F)C(N)=O Amb10838721 [1,1,0,0,0,0|2,0,0]=4 3792 B6R0.7 CC(N)(F)C(N)=O Amb28067625 [1,1,0,0,0,0|1,0,0]=3 3793 B6R0.7 CC(N)(S)C(=O)O Amb27202694 [1,1,0,0,0,0|0,0,0]=2 3794 B6R0.7 CC(N)C(C)(C)O Amb13951783 [1,1,0,0,0,0|1,0,1]=4 3795 B6R0.7 CC(N)C(C)(C)O Amb33544846 [1,1,0,0,0,0|1,0,1]=4 3796 B6R0.7 CC(O)(Cl)C(=O)O Amb27877877 [1,1,0,0,0,0|1,0,0]=3 3797 B6R0.7 CC(O)(O)C(=O)O Amb25337924 [1,1,0,0,0,0|1,0,0]=3 3798 B6R0.7 CC(O)C(C)(C)N Amb17470362 [1,1,0,0,0,0|1,0,1]=4 3799 B6R0.7 CC(O)C(C)(C)N Amb35749912 [1,1,0,0,0,0|1,0,1]=4 3800 B6R0.7 C[C@@H](N)C(C)(C)O Amb22747486 [1,1,0,0,0,0|1,0,1]=4 3801 B6R0.7 C[C@@H](N)P(=O)(O)O Amb546329 [1,1,0,0,0,0|1,0,0]=3 3802 B6R0.7 C[C@@H](O)P(=O)(O)O Amb27763847 [1,1,0,0,0,0|2,0,0]=4 3803 B6R0.7 C[C@H](N)C(C)(C)O Amb22736077 [1,1,0,0,0,0|1,0,1]=4 3804 B6R0.7 C[C@H](N)C(C)(C)O Amb32406944 [1,1,0,0,0,0|1,0,1]=4 3805 B6R0.7 C[C@H](N)P(=O)(O)O Amb568738 [1,1,0,0,0,0|1,0,0]=3 3806 B6R0.7 C[C@H](O)P(=O)(O)O Amb27987308 [1,1,0,0,0,0|2,0,0]=4 3807 B6R0.7 O=C(O)C(Br)(Br)Br Amb8513360 [1,1,0,0,0,0|2,0,0]=4 3808 B6R0.7 O=C(O)C(Cl)(Br)Br Amb22732050 [1,1,0,0,0,0|2,0,0]=4 3809 B6R0.7 O=C(O)C(Cl)(Cl)Br Amb27224018 [1,1,0,0,0,0|2,0,0]=4 3810 B6R0.7 O=C(O)C(Cl)(Cl)Cl Amb3940360 [1,1,0,0,0,0|2,0,0]=4 3811 B6R0.7 O=C(O)C(F)(Br)Br Amb10839150 [1,1,0,0,0,0|2,0,0]=4 3812 B6R0.7 O=C(O)C(F)(Cl)Br Amb24528668 [1,1,0,0,0,0|2,0,0]=4 3813 B6R0.7 O=C(O)C(F)(Cl)Cl Amb22738911 [1,1,0,0,0,0|2,0,0]=4 3814 B6R0.7 O=C(O)C(F)(F)Br Amb2691919 [1,1,0,0,0,0|2,0,0]=4 3815 B6R0.7 O=C(O)C(F)(F)Cl Amb2685819 [1,1,0,0,0,0|2,0,0]=4 3816 B6R0.7 O=C(O)C(F)(F)F Amb19883782 [1,1,0,0,0,0|2,0,0]=4 3817 B6R0.7 O=C(O)C(F)(F)F Amb23439505 [1,1,0,0,0,0|2,0,0]=4 3818 B6R0.7 O=C(O)C(F)(F)F Amb2690694 [1,1,0,0,0,0|2,0,0]=4 3819 B6R0.7 O=C(O)C(F)(F)F Amb31308079 [1,1,0,0,0,0|2,0,0]=4 3820 B6R0.7 O=C(O)C(F)(F)F Amb32412020 [1,1,0,0,0,0|2,0,0]=4 3821 B6R0.7 O=C(O)C(F)(F)F Amb32661646 [1,1,0,0,0,0|2,0,0]=4 3822 B6R0.7 O=C(O)C(F)(F)F Amb32663314 [1,1,0,0,0,0|2,0,0]=4 3823 B6R0.7 O=C(O)C(F)(F)F Amb32663497 [1,1,0,0,0,0|2,0,0]=4 3824 B6R0.7 O=C(O)C(F)(F)F Amb32663859 [1,1,0,0,0,0|2,0,0]=4 3825 B6R0.7 O=C(O)C(F)(F)F Amb32664999 [1,1,0,0,0,0|2,0,0]=4 3826 B6R0.7 O=C(O)C(F)(F)F Amb32675075 [1,1,0,0,0,0|2,0,0]=4 3827 B6R0.7 O=C(O)C(F)(F)F Amb32676719 [1,1,0,0,0,0|2,0,0]=4 3828 B6R0.7 O=C(O)C(F)(F)F Amb33307157 [1,1,0,0,0,0|2,0,0]=4 3829 B6R0.7 O=C(O)C(F)(F)F Amb33483641 [1,1,0,0,0,0|2,0,0]=4 3830 B6R0.7 O=C(O)C(F)(F)F Amb33551171 [1,1,0,0,0,0|2,0,0]=4 3831 B6R0.7 O=C(O)C(F)(F)F Amb33714478 [1,1,0,0,0,0|2,0,0]=4 3832 B6R0.7 O=C(O)C(F)(F)F Amb33801059 [1,1,0,0,0,0|2,0,0]=4 3833 B6R0.7 O=C(O)C(F)(F)F Amb33801060 [1,1,0,0,0,0|2,0,0]=4 3834 B6R0.7 O=C(O)C(F)(F)F Amb34912845 [1,1,0,0,0,0|2,0,0]=4 3835 B6R0.7 O=C(O)C(F)(F)F Amb34916203 [1,1,0,0,0,0|2,0,0]=4 3836 B6R0.7 O=C(O)C(F)(F)F Amb35748150 [1,1,0,0,0,0|2,0,0]=4 3837 B6R0.7 O=C(O)C(F)(F)F Amb35789059 [1,1,0,0,0,0|2,0,0]=4 3838 B6R0.7 O=C(O)C(F)(F)F Amb35825508 [1,1,0,0,0,0|2,0,0]=4 3839 B6R0.7 O=C(O)C(F)(F)I Amb22738912 [1,1,0,0,0,0|2,0,0]=4 3840 B6R0.7 O=C(O)C(F)(F)S Amb28287580 [1,1,0,0,0,0|1,1,0]=4 3841 B6R0.7 O=C(O)C(I)(I)I Amb17621003 [1,1,0,0,0,0|2,0,0]=4 3842 B8R0.2 C=C(C(=O)O)C(C)CC Amb18642655 [0,1,0,0,0,1|2,0,0]=4 3843 B8R0.2 C=C(C(=O)O)[C@@H](O)CC Amb28253249 [0,1,0,0,0,1|2,0,0]=4 3844 B8R0.2 C=C(C(C)=O)[C@H](C)CO Amb28202165 [0,1,0,0,0,1|2,0,0]=4 3845 B8R0.2 C=CC(N)C(C)C(=O)O Amb33036213 [0,1,0,0,0,1|1,0,1]=4 3846 B8R0.2 CC(=O)C(=O)C(O)CO Amb25830733 [0,1,0,0,0,1|2,0,0]=4 3847 B8R0.2 CC(=O)C(=O)[C@@H](O)CO Amb25697046 [0,1,0,0,0,1|2,0,0]=4 3848 B8R0.2 CC(=O)C(=O)[C@H](O)CO Amb27490779 [0,1,0,0,0,1|2,0,0]=4 3849 B8R0.2 CC(=O)C(C)C(N)CO Amb27186035 [0,1,0,0,0,1|1,0,0]=3 3850 B8R0.2 CC(=O)C(O)C(O)CO Amb26636819 [0,1,0,0,0,1|2,0,0]=4 3851 B8R0.2 CC(=O)N(C)C(C)CO Amb27628421 [0,1,0,0,0,1|2,0,0]=4 3852 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO Amb26654815 [0,1,0,0,0,1|2,0,0]=4 3853 B8R0.2 CC(=O)[C@H](O)[C@@H](O)CO Amb28201025 [0,1,0,0,0,1|2,0,0]=4 3854 B8R0.2 CC(=O)[C@H](O)[C@H](O)CO Amb24477828 [0,1,0,0,0,1|2,0,0]=4 3855 B8R0.2 CC(C(=O)O)C(N)CN Amb24532823 [0,1,0,0,0,1|1,0,0]=3 3856 B8R0.2 CC(CCl)C(N)C(=O)O Amb27470876 [0,1,0,0,0,1|2,0,0]=4 3857 B8R0.2 CC(CN)C(C)C(=O)O Amb27217450 [0,1,0,0,0,1|2,0,0]=4 3858 B8R0.2 CC(CN)C(F)C(=O)O Amb35750952 [0,1,0,0,0,1|2,0,0]=4 3859 B8R0.2 CC(CN)C(F)C(=O)O Amb35751592 [0,1,0,0,0,1|2,0,0]=4 3860 B8R0.2 CC(CN)C(O)C(=O)O Amb18642919 [0,1,0,0,0,1|2,0,0]=4 3861 B8R0.2 CC(CO)C(C)C(=O)O Amb27255789 [0,1,0,0,0,1|1,0,0]=3 3862 B8R0.2 CC(CO)C(N)C(=O)O Amb27629815 [0,1,0,0,0,1|1,0,0]=3 3863 B8R0.2 CC(CO)C(N)C(N)=O Amb33308985 [0,1,0,0,0,1|2,0,0]=4 3864 B8R0.2 CC(CO)[C@@H](N)C(=O)O Amb33308939 [0,1,0,0,0,1|1,0,0]=3 3865 B8R0.2 CC(CO)[C@H](N)C(=O)O Amb25918803 [0,1,0,0,0,1|1,0,0]=3 3866 B8R0.2 CC(CS)C(C)C(=O)O Amb17593702 [0,1,0,0,0,1|1,1,0]=4 3867 B8R0.2 CC(NO)C(C)C(=O)O Amb27185439 [0,1,0,0,0,1|2,0,0]=4 3868 B8R0.2 CCC(Br)C(=O)C(=O)O Amb27232743 [0,1,0,0,0,1|2,0,0]=4 3869 B8R0.2 CCC(C)C(=O)C(=O)O Amb2695339 [0,1,0,0,0,1|2,0,0]=4 3870 B8R0.2 CCC(C)C(Br)C(=O)O Amb4015586 [0,1,0,0,0,1|2,0,0]=4 3871 B8R0.2 CCC(C)C(C)C(=O)O Amb18290719 [0,1,0,0,0,1|2,0,0]=4 3872 B8R0.2 CCC(C)C(Cl)C(=O)O Amb17593752 [0,1,0,0,0,1|2,0,0]=4 3873 B8R0.2 CCC(C)C(N)C(=O)O Amb9702778 [0,1,0,0,0,1|2,0,0]=4 3874 B8R0.2 CCC(C)C(O)C(=O)O Amb18288809 [0,1,0,0,0,1|2,0,0]=4 3875 B8R0.2 CCC(C)C(S)C(=O)O Amb27667077 [0,1,0,0,0,1|2,0,0]=4 3876 B8R0.2 CCC(C)[C@@H](C)C(=O)O Amb10844494 [0,1,0,0,0,1|2,0,0]=4 3877 B8R0.2 CCC(C)[C@@H](N)C(=O)O Amb10844500 [0,1,0,0,0,1|2,0,0]=4 3878 B8R0.2 CCC(C)[C@H](Br)C(=O)O Amb28183049 [0,1,0,0,0,1|2,0,0]=4 3879 B8R0.2 CCC(C)[C@H](C)C(=O)O Amb10844495 [0,1,0,0,0,1|2,0,0]=4 3880 B8R0.2 CCC(C)[C@H](Cl)C(=O)O Amb28314442 [0,1,0,0,0,1|2,0,0]=4 3881 B8R0.2 CCC(C)[C@H](N)C(=O)O Amb10844501 [0,1,0,0,0,1|2,0,0]=4 3882 B8R0.2 CCC(F)C(=O)C(=O)O Amb27489910 [0,1,0,0,0,1|2,0,0]=4 3883 B8R0.2 CCC(F)C(Br)C(=O)O Amb27858717 [0,1,0,0,0,1|2,0,0]=4 3884 B8R0.2 CCC(N)C(F)C(=O)O Amb33036406 [0,1,0,0,0,1|1,0,0]=3 3885 B8R0.2 CCC(N)C(O)C(N)=O Amb28055940 [0,1,0,0,0,1|2,0,0]=4 3886 B8R0.2 CCC(O)C(C)C(=O)O Amb10844267 [0,1,0,0,0,1|2,0,0]=4 3887 B8R0.2 CCC(O)C(F)C(=O)O Amb33136388 [0,1,0,0,0,1|2,0,0]=4 3888 B8R0.2 CCC(O)C(N)C(=O)O Amb18203168 [0,1,0,0,0,1|2,0,0]=4 3889 B8R0.2 CCC(O)[C@H](N)C(=O)O Amb24364655 [0,1,0,0,0,1|2,0,0]=4 3890 B8R0.2 CCN(N)C(C)C(=O)O Amb27655613 [0,1,0,0,0,1|2,0,0]=4 3891 B8R0.2 CC[C@@H](C)C(Cl)C(=O)O Amb27472040 [0,1,0,0,0,1|2,0,0]=4 3892 B8R0.2 CC[C@@H](C)[C@@H](Cl)C(=O)O Amb28130604 [0,1,0,0,0,1|2,0,0]=4 3893 B8R0.2 CC[C@@H](C)[C@@H](F)C(=O)O Amb28347222 [0,1,0,0,0,1|2,0,0]=4 3894 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O Amb8513329 [0,1,0,0,0,1|2,0,0]=4 3895 B8R0.2 CC[C@@H](C)[C@@H](O)C(=O)O Amb26063750 [0,1,0,0,0,1|2,0,0]=4 3896 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O Amb26866576 [0,1,0,0,0,1|2,0,0]=4 3897 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O Amb10068321 [0,1,0,0,0,1|2,0,0]=4 3898 B8R0.2 CC[C@@H](O)[C@@H](C)C(=O)O Amb27879857 [0,1,0,0,0,1|2,0,0]=4 3899 B8R0.2 CC[C@H](Br)[C@H](Br)C(=O)O Amb16233350 [0,1,0,0,0,1|2,0,0]=4 3900 B8R0.2 CC[C@H](C)C(=O)C(=O)O Amb28075584 [0,1,0,0,0,1|2,0,0]=4 3901 B8R0.2 CC[C@H](C)C(C)C(=O)O Amb27950556 [0,1,0,0,0,1|2,0,0]=4 3902 B8R0.2 CC[C@H](C)C(N)C(=O)O Amb27209489 [0,1,0,0,0,1|2,0,0]=4 3903 B8R0.2 CC[C@H](C)[C@@H](Br)C(=O)O Amb23401386 [0,1,0,0,0,1|2,0,0]=4 3904 B8R0.2 CC[C@H](C)[C@@H](F)C(=O)O Amb27954743 [0,1,0,0,0,1|2,0,0]=4 3905 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O Amb8516280 [0,1,0,0,0,1|2,0,0]=4 3906 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O Amb22388560 [0,1,0,0,0,1|2,0,0]=4 3907 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O Amb3940753 [0,1,0,0,0,1|2,0,0]=4 3908 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O Amb2694797 [0,1,0,0,0,1|2,0,0]=4 3909 B8R0.2 CC[C@H](N)[C@H](C)C(=O)O Amb27779460 [0,1,0,0,0,1|1,0,0]=3 3910 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O Amb26981388 [0,1,0,0,0,1|2,0,0]=4 3911 B8R0.2 CC[C@H](O)[C@H](Br)C(=O)O Amb28285137 [0,1,0,0,0,1|2,0,0]=4 3912 B8R0.2 CC[C@H](O)[C@H](N)C(=O)O Amb26024594 [0,1,0,0,0,1|2,0,0]=4 3913 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb24117487 [0,1,0,0,0,1|1,0,0]=3 3914 B8R0.2 C[C@@H](CO)[C@@H](N)C(=O)O Amb27828649 [0,1,0,0,0,1|1,0,0]=3 3915 B8R0.2 C[C@@H](CO)[C@H](N)C(=O)O Amb24117488 [0,1,0,0,0,1|1,0,0]=3 3916 B8R0.2 C[C@H](C(=O)O)[C@@H](O)CN Amb28056248 [0,1,0,0,0,1|2,0,0]=4 3917 B8R0.2 C[C@H](CN)[C@@H](O)C(=O)O Amb27455474 [0,1,0,0,0,1|2,0,0]=4 3918 B8R0.2 NC(=O)[C@@H](F)[C@@H](O)CO Amb27668286 [0,1,0,0,0,1|2,0,0]=4 3919 B8R0.2 NC(=O)[C@H](O)[C@@H](O)CO Amb27814631 [0,1,0,0,0,1|2,0,0]=4 3920 B8R0.2 NC(C(=O)O)C(F)CO Amb27950986 [0,1,0,0,0,1|1,0,0]=3 3921 B8R0.2 NC(C(=O)O)C(O)CCl Amb27846402 [0,1,0,0,0,1|2,0,0]=4 3922 B8R0.2 NC(C(=O)O)C(O)CF Amb27592597 [0,1,0,0,0,1|2,0,0]=4 3923 B8R0.2 NC(C(=O)O)C(S)CO Amb27199680 [0,1,0,0,0,1|1,0,0]=3 3924 B8R0.2 NC(CO)C(N)C(=O)O Amb28208230 [0,1,0,0,0,1|0,0,0]=2 3925 B8R0.2 NCC(O)C(N)C(=O)O Amb27876292 [0,1,0,0,0,1|2,0,0]=4 3926 B8R0.2 NCC(O)C(O)C(=O)O Amb27830532 [0,1,0,0,0,1|2,0,0]=4 3927 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb27945588 [0,1,0,0,0,1|2,0,0]=4 3928 B8R0.2 NC[C@@H](O)[C@@H](O)C(=O)O Amb33209939 [0,1,0,0,0,1|2,0,0]=4 3929 B8R0.2 NC[C@@H](O)[C@H](N)C(=O)O Amb30884414 [0,1,0,0,0,1|2,0,0]=4 3930 B8R0.2 NC[C@H](F)[C@H](F)C(=O)O Amb27224824 [0,1,0,0,0,1|2,0,0]=4 3931 B8R0.2 N[C@@H](C(=O)O)C(O)CBr Amb28245344 [0,1,0,0,0,1|2,0,0]=4 3932 B8R0.2 N[C@@H](C(=O)O)C(S)CO Amb27233478 [0,1,0,0,0,1|1,0,0]=3 3933 B8R0.2 N[C@@H](C(=O)O)[C@H](O)CO Amb24671346 [0,1,0,0,0,1|1,0,0]=3 3934 B8R0.2 N[C@H](C(=O)O)C(O)CCl Amb27212707 [0,1,0,0,0,1|2,0,0]=4 3935 B8R0.2 N[C@H](C(=O)O)C(O)CO Amb28255690 [0,1,0,0,0,1|1,0,0]=3 3936 B8R0.2 N[C@H](C(=O)O)[C@@H](O)CO Amb25678241 [0,1,0,0,0,1|1,0,0]=3 3937 B8R0.2 O=C(O)C(=O)C(O)CO Amb27408895 [0,1,0,0,0,1|1,0,0]=3 3938 B8R0.2 O=C(O)C(Br)C(Br)CBr Amb22347644 [0,1,0,0,0,1|2,0,0]=4 3939 B8R0.2 O=C(O)C(O)C(O)CO Amb22495524 [0,1,0,0,0,1|1,0,0]=3 3940 B8R0.2 O=C(O)[C@@H](F)[C@H](O)CO Amb27195151 [0,1,0,0,0,1|1,0,0]=3 3941 B8R0.2 O=C(O)[C@H](O)C(O)CO Amb27229496 [0,1,0,0,0,1|1,0,0]=3 3942 B8R0.2 O=C(O)[C@H](O)[C@@H](O)CO Amb27849401 [0,1,0,0,0,1|1,0,0]=3 3943 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO Amb32644462 [0,1,0,0,0,1|1,0,0]=3 3944 B8R0.2 O=C([O-])C(O)C(O)CO Amb22733096 [0,1,0,0,0,1|1,0,1]=4 3945 B8R0.2 O=C([O-])[C@@H](O)[C@H](O)CO Amb22744783 [0,1,0,0,0,1|1,0,1]=4 3946 B8R0.2 O=C([O-])[C@@H](O)[C@H](O)CO Amb32414707 [0,1,0,0,0,1|1,0,1]=4 3947 B8R0.5 C#CCC(N)CC(=O)O Amb26909337 [0,1,0,0,0,1|1,0,0]=3 3948 B8R0.5 C#CC[C@@H](N)CC(=O)O Amb22746284 [0,1,0,0,0,1|1,0,0]=3 3949 B8R0.5 C#CC[C@@H](N)CC(=O)O Amb24539924 [0,1,0,0,0,1|1,0,0]=3 3950 B8R0.5 C=C(C)CC(N)COC Amb27171032 [0,1,0,0,0,1|2,0,0]=4 3951 B8R0.5 C=CCC(C)CC(=O)O Amb18642628 [0,1,0,0,0,1|2,0,0]=4 3952 B8R0.5 C=CCC(N)CC(=O)O Amb22641964 [0,1,0,0,0,1|1,0,0]=3 3953 B8R0.5 C=CCC(N)CC(=O)O Amb31307622 [0,1,0,0,0,1|1,0,0]=3 3954 B8R0.5 C=CCC(O)CC(=O)O Amb18642785 [0,1,0,0,0,1|2,0,0]=4 3955 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb22746166 [0,1,0,0,0,1|1,0,0]=3 3956 B8R0.5 C=CC[C@@H](N)CC(=O)O Amb2699117 [0,1,0,0,0,1|1,0,0]=3 3957 B8R0.5 C=CC[C@@H](O)CC(=O)O Amb28073530 [0,1,0,0,0,1|2,0,0]=4 3958 B8R0.5 C=CC[C@H](N)CC(=O)O Amb2699116 [0,1,0,0,0,1|1,0,0]=3 3959 B8R0.5 C=CC[C@H](N)CC(=O)O Amb33726074 [0,1,0,0,0,1|1,0,0]=3 3960 B8R0.5 C=CC[C@H](O)CC(=O)O Amb28345940 [0,1,0,0,0,1|2,0,0]=4 3961 B8R0.5 CC(=O)NC(C)CCO Amb27656183 [0,1,0,0,0,1|2,0,0]=4 3962 B8R0.5 CC(=O)NC(C)CON Amb17138376 [0,1,0,0,0,1|2,0,0]=4 3963 B8R0.5 CC(=O)N[C@H](C)CCO Amb28454929 [0,1,0,0,0,1|2,0,0]=4 3964 B8R0.5 CC(CC#N)CC(=O)O Amb18642506 [0,1,0,0,0,1|2,0,0]=4 3965 B8R0.5 CC(CCF)CC(=O)O Amb24477914 [0,1,0,0,0,1|2,0,0]=4 3966 B8R0.5 CC(CCN)CC(=O)O Amb20667689 [0,1,0,0,0,1|2,0,0]=4 3967 B8R0.5 CC(CCN)CC(=O)O Amb24376646 [0,1,0,0,0,1|2,0,0]=4 3968 B8R0.5 CC(CCO)CC(=O)O Amb18642882 [0,1,0,0,0,1|1,0,0]=3 3969 B8R0.5 CCCC(C)CC(=O)O Amb6749227 [0,1,0,0,0,1|2,0,0]=4 3970 B8R0.5 CCCC(N)CC(=O)O Amb1993864 [0,1,0,0,0,1|1,0,0]=3 3971 B8R0.5 CCCC(N)CC(C)=O Amb28069229 [0,1,0,0,0,1|2,0,0]=4 3972 B8R0.5 CCCC(N)CC(N)=O Amb25128031 [0,1,0,0,0,1|2,0,0]=4 3973 B8R0.5 CCCC(O)CC(=O)O Amb2699832 [0,1,0,0,0,1|2,0,0]=4 3974 B8R0.5 CCC[C@@H](N)CC(=O)O Amb22225223 [0,1,0,0,0,1|1,0,0]=3 3975 B8R0.5 CCC[C@@H](N)CC(=O)O Amb24739278 [0,1,0,0,0,1|1,0,0]=3 3976 B8R0.5 CCC[C@@H](O)CC(=O)O Amb25188904 [0,1,0,0,0,1|2,0,0]=4 3977 B8R0.5 CCC[C@H](C)CC(=O)O Amb10844381 [0,1,0,0,0,1|2,0,0]=4 3978 B8R0.5 CCC[C@H](N)CC(=O)O Amb22226359 [0,1,0,0,0,1|1,0,0]=3 3979 B8R0.5 CCC[C@H](N)CC(=O)O Amb27464904 [0,1,0,0,0,1|1,0,0]=3 3980 B8R0.5 CCC[C@H](O)CC(=O)O Amb25367955 [0,1,0,0,0,1|2,0,0]=4 3981 B8R0.5 CCNC(C)CC(=O)O Amb13952759 [0,1,0,0,0,1|2,0,0]=4 3982 B8R0.5 CCNC(C)CC(=O)O Amb9398369 [0,1,0,0,0,1|2,0,0]=4 3983 B8R0.5 CCOC(C)CC(=O)O Amb9397849 [0,1,0,0,0,1|2,0,0]=4 3984 B8R0.5 CCO\C(N)=C\C(=O)O Amb28285256 [0,1,0,0,0,1|1,0,1]=4 3985 B8R0.5 CCSC(C)CC(=O)O Amb9398136 [0,1,0,0,0,1|2,0,0]=4 3986 B8R0.5 CN(CCO)CC(=O)O Amb5767486 [0,1,0,0,0,1|2,0,0]=4 3987 B8R0.5 CNCC(O)CC(=O)O Amb28423259 [0,1,0,0,0,1|2,0,0]=4 3988 B8R0.5 CNCC(O)CC(=O)O Amb32661843 [0,1,0,0,0,1|2,0,0]=4 3989 B8R0.5 CNC[C@H](N)CC(=O)O Amb27798881 [0,1,0,0,0,1|1,0,0]=3 3990 B8R0.5 COCC(=O)CC(=O)O Amb24093174 [0,1,0,0,0,1|1,0,1]=4 3991 B8R0.5 COCC(C)CC(=O)O Amb19024342 [0,1,0,0,0,1|1,0,0]=3 3992 B8R0.5 COCC(C)CC(C)=O Amb27464321 [0,1,0,0,0,1|2,0,0]=4 3993 B8R0.5 COCC(C)CC(N)=O Amb27860801 [0,1,0,0,0,1|2,0,0]=4 3994 B8R0.5 COCC(C)NC(=O)Cl Amb35637106 [0,1,0,0,0,1|2,0,0]=4 3995 B8R0.5 COCC(C)NC(N)=O Amb405922 [0,1,0,0,0,1|2,0,0]=4 3996 B8R0.5 COCC(C)OC(=O)Cl Amb27395128 [0,1,0,0,0,1|2,0,0]=4 3997 B8R0.5 COCC(C)OC(C)=O Amb8516695 [0,1,0,0,0,1|2,0,0]=4 3998 B8R0.5 COCC(C)OC(N)=O Amb24645730 [0,1,0,0,0,1|2,0,0]=4 3999 B8R0.5 COCC(N)C=C(C)C Amb27413277 [0,1,0,0,0,1|2,0,0]=4 4000 B8R0.5 COCC(N)CC(=O)O Amb26641146 [0,1,0,0,0,1|0,0,0]=2 4001 B8R0.5 COCC(N)CC(C)O Amb27433240 [0,1,0,0,0,1|1,0,1]=4 4002 B8R0.5 COCC(N)CC(N)=O Amb33308419 [0,1,0,0,0,1|1,0,0]=3 4003 B8R0.5 COCC(O)CC(=O)O Amb18832518 [0,1,0,0,0,1|1,0,0]=3 4004 B8R0.5 COC[C@@H](C)OC(C)=O Amb27460270 [0,1,0,0,0,1|2,0,0]=4 4005 B8R0.5 COC[C@@H](O)CC(=O)O Amb33428853 [0,1,0,0,0,1|1,0,0]=3 4006 B8R0.5 COC[C@H](N)CC(=O)O Amb33038388 [0,1,0,0,0,1|0,0,0]=2 4007 B8R0.5 COC[C@H](N)CC(=O)O Amb33330661 [0,1,0,0,0,1|0,0,0]=2 4008 B8R0.5 COC[C@H](O)CC(=O)O Amb33428852 [0,1,0,0,0,1|1,0,0]=3 4009 B8R0.5 COC\C(C)=C\C(=O)O Amb25311787 [0,1,0,0,0,1|1,0,1]=4 4010 B8R0.5 CONC(C)CC(=O)O Amb26844930 [0,1,0,0,0,1|2,0,0]=4 4011 B8R0.5 CPCC(N)CC(=O)O Amb27184896 [0,1,0,0,0,1|1,0,0]=3 4012 B8R0.5 CSCC(C)CC(=O)O Amb33273729 [0,1,0,0,0,1|1,1,0]=4 4013 B8R0.5 CSCC(N)CC(=O)O Amb25960719 [0,1,0,0,0,1|0,1,0]=3 4014 B8R0.5 CSCC(O)CC(=O)O Amb24621046 [0,1,0,0,0,1|1,1,0]=4 4015 B8R0.5 CSC[C@@H](N)CC(=O)O Amb27961000 [0,1,0,0,0,1|0,1,0]=3 4016 B8R0.5 CSC[C@@H](O)CC(=O)O Amb33271747 [0,1,0,0,0,1|1,1,0]=4 4017 B8R0.5 CSC[C@H](O)CC(=O)O Amb33271746 [0,1,0,0,0,1|1,1,0]=4 4018 B8R0.5 C[C@H](CCO)CC(=O)O Amb27461411 [0,1,0,0,0,1|1,0,0]=3 4019 B8R0.5 C\C=C\C(N)CC(=O)O Amb25975538 [0,1,0,0,0,1|1,0,1]=4 4020 B8R0.5 N#CCC(O)CC(=O)O Amb27249794 [0,1,0,0,0,1|2,0,0]=4 4021 B8R0.5 NC(CCF)CC(=O)O Amb33038391 [0,1,0,0,0,1|1,0,0]=3 4022 B8R0.5 NCCC(N)CC(=O)O Amb26043872 [0,1,0,0,0,1|1,0,0]=3 4023 B8R0.5 NCCC(O)CC(=O)O Amb27882021 [0,1,0,0,0,1|2,0,0]=4 4024 B8R0.5 NCCC(O)CC(=O)O Amb31031000 [0,1,0,0,0,1|2,0,0]=4 4025 B8R0.5 NCC[C@H](N)CC(=O)O Amb10067021 [0,1,0,0,0,1|1,0,0]=3 4026 B8R0.5 NCC[C@H](N)CC(=O)O Amb35750363 [0,1,0,0,0,1|1,0,0]=3 4027 B8R0.5 N[C@H](CCO)CC(=O)O Amb27169169 [0,1,0,0,0,1|0,0,0]=2 4028 B8R0.5 O=C(O)CC(O)CCF Amb33196428 [0,1,0,0,0,1|2,0,0]=4 4029 B8R0.5 O=C(O)CC(O)CCO Amb31031042 [0,1,0,0,0,1|1,0,0]=3 4030 B8R0.5 O=C(O)CC(O)CNO Amb28044304 [0,1,0,0,0,1|1,0,0]=3 4031 B8R0.5 O=C(O)C[C@@H](O)CCF Amb33196426 [0,1,0,0,0,1|2,0,0]=4 4032 B8R0.5 O=C(O)C[C@H](O)CCF Amb33196427 [0,1,0,0,0,1|2,0,0]=4 4033 B8R0.5 O=C(O)\C=C(/Cl)CCO Amb27845284 [0,1,0,0,0,1|1,0,1]=4 4034 B8R0.16 C#CC(CO)NC(C)=O Amb28052706 [0,1,0,0,0,1|2,0,0]=4 4035 B8R0.16 C=CC(CC)CC(=O)O Amb18642661 [0,1,0,0,0,1|2,0,0]=4 4036 B8R0.16 C=C[C@@H](CC)CC(=O)O Amb27784737 [0,1,0,0,0,1|2,0,0]=4 4037 B8R0.16 CC(=O)NC(C=O)CO Amb27816982 [0,1,0,0,0,1|2,0,0]=4 4038 B8R0.16 CC(=O)NC(CO)CO Amb25127062 [0,1,0,0,0,1|2,0,0]=4 4039 B8R0.16 CC(=O)N[C@@H](CO)CS Amb27393209 [0,1,0,0,0,1|2,0,0]=4 4040 B8R0.16 CC(=O)OC(CN)CBr Amb28244785 [0,1,0,0,0,1|2,0,0]=4 4041 B8R0.16 CC(=O)OC(CO)CBr Amb28286806 [0,1,0,0,0,1|2,0,0]=4 4042 B8R0.16 CC(=O)O[C@H](CO)CCl Amb27945582 [0,1,0,0,0,1|2,0,0]=4 4043 B8R0.16 CC(=O)SC(CN)CN Amb24117511 [0,1,0,0,0,1|2,0,0]=4 4044 B8R0.16 CCC(C#N)CC(=O)O Amb26871850 [0,1,0,0,0,1|1,0,1]=4 4045 B8R0.16 CCC(CC(=O)O)OC Amb19037306 [0,1,0,0,0,1|2,0,0]=4 4046 B8R0.16 CCC(CC(=O)O)SC Amb18316304 [0,1,0,0,0,1|2,0,0]=4 4047 B8R0.16 CCC(CC(N)=O)NC Amb27666636 [0,1,0,0,0,1|2,0,0]=4 4048 B8R0.16 CCC(CC)CC(=O)O Amb6749211 [0,1,0,0,0,1|2,0,0]=4 4049 B8R0.16 CCC(CN)CC(=O)O Amb20669457 [0,1,0,0,0,1|1,0,0]=3 4050 B8R0.16 CCC(CN)CC(=O)O Amb22059482 [0,1,0,0,0,1|1,0,0]=3 4051 B8R0.16 CCC(CN)NC(C)=O Amb18112590 [0,1,0,0,0,1|2,0,0]=4 4052 B8R0.16 CCC(CN)NC(N)=O Amb18908302 [0,1,0,0,0,1|2,0,0]=4 4053 B8R0.16 CC[C@@H](CO)NC(C)=O Amb27251985 [0,1,0,0,0,1|2,0,0]=4 4054 B8R0.16 CC[C@@H](CO)OC(C)=O Amb27879395 [0,1,0,0,0,1|2,0,0]=4 4055 B8R0.16 CNC(CN)CC(N)=O Amb28247281 [0,1,0,0,0,1|2,0,0]=4 4056 B8R0.16 COC(CN)CC(=O)O Amb27806172 [0,1,0,0,0,1|2,0,0]=4 4057 B8R0.16 COC(CN)CC(=O)O Amb28555397 [0,1,0,0,0,1|2,0,0]=4 4058 B8R0.16 CSC(CCl)CC(=O)O Amb28042698 [0,1,0,0,0,1|2,0,0]=4 4059 B8R0.16 NC(=O)NC(CO)CO Amb27814601 [0,1,0,0,0,1|2,0,0]=4 4060 B8R0.16 NCC(CF)CC(=O)O Amb27244579 [0,1,0,0,0,1|1,0,0]=3 4061 B8R0.16 NCC(CO)CC(=O)O Amb22546422 [0,1,0,0,0,1|0,0,0]=2 4062 B8R0.16 O=C(O)CC(CF)CF Amb27448541 [0,1,0,0,0,1|2,0,0]=4 4063 B8R0.16 O=C(O)CC(CO)CCl Amb27468690 [0,1,0,0,0,1|1,0,0]=3 4064 B8R0.16 O=C(O)CN(CO)CO Amb27412887 [0,1,0,0,0,1|2,0,0]=4 4065 B8R0.16 O=[PH](O)OC(CO)CO Amb27853107 [0,1,0,0,0,1|2,0,0]=4 4066 B8R0.19 C#CC(=O)N[C@@H](C)CO Amb27166336 [0,1,0,0,0,1|2,0,0]=4 4067 B8R0.19 C#C[C@@H](N)CC(=O)OC Amb27393788 [0,1,0,0,0,1|1,0,1]=4 4068 B8R0.19 C=C(CO)CC(=O)OC Amb28455395 [0,1,0,0,0,1|1,0,1]=4 4069 B8R0.19 C=CC(=O)OC(O)CO Amb27829733 [0,1,0,0,0,1|2,0,0]=4 4070 B8R0.19 CC(CN)CC(=O)NO Amb27395401 [0,1,0,0,0,1|2,0,0]=4 4071 B8R0.19 CC(CO)NC(=O)CCl Amb18791488 [0,1,0,0,0,1|2,0,0]=4 4072 B8R0.19 CC(CO)NC(=O)CO Amb27652814 [0,1,0,0,0,1|1,0,0]=3 4073 B8R0.19 CC(CO)NC(=O)CS Amb28364720 [0,1,0,0,0,1|1,1,0]=4 4074 B8R0.19 CCC(=O)NC(C)CO Amb9275911 [0,1,0,0,0,1|2,0,0]=4 4075 B8R0.19 CCC(=O)N[C@@H](C)CO Amb27811661 [0,1,0,0,0,1|2,0,0]=4 4076 B8R0.19 CCC(=O)N[C@H](C)CO Amb27240730 [0,1,0,0,0,1|2,0,0]=4 4077 B8R0.19 CCC(=O)\C=C(/N)CO Amb28049853 [0,1,0,0,0,1|1,0,1]=4 4078 B8R0.19 CCC(=O)\C=C(\N)CO Amb27422020 [0,1,0,0,0,1|1,0,1]=4 4079 B8R0.19 CCC(Br)CC(=O)OC Amb27477901 [0,1,0,0,0,1|2,0,0]=4 4080 B8R0.19 CCC(C)CC(=O)CO Amb26515791 [0,1,0,0,0,1|2,0,0]=4 4081 B8R0.19 CCC(C)CC(=O)NO Amb28321295 [0,1,0,0,0,1|2,0,0]=4 4082 B8R0.19 CCC(C)CC(=O)OC Amb22352867 [0,1,0,0,0,1|2,0,0]=4 4083 B8R0.19 CCC(C)NC(=O)CO Amb5798172 [0,1,0,0,0,1|2,0,0]=4 4084 B8R0.19 CCC(Cl)CC(=O)OC Amb27971680 [0,1,0,0,0,1|2,0,0]=4 4085 B8R0.19 CCC(N)CC(=O)OC Amb18203185 [0,1,0,0,0,1|1,0,0]=3 4086 B8R0.19 CCC(N)CC(=O)OC Amb22264719 [0,1,0,0,0,1|1,0,0]=3 4087 B8R0.19 CCC(N)C\C(N)=N\O Amb24379538 [0,1,0,0,0,1|2,0,0]=4 4088 B8R0.19 CCC(O)CC(=O)OC Amb24425172 [0,1,0,0,0,1|2,0,0]=4 4089 B8R0.19 CC[C@@H](C)CC(=O)OC Amb28059460 [0,1,0,0,0,1|2,0,0]=4 4090 B8R0.19 CC[C@@H](N)CC(=O)OC Amb20241226 [0,1,0,0,0,1|1,0,0]=3 4091 B8R0.19 CC[C@@H](N)CC(=O)OC Amb26016603 [0,1,0,0,0,1|1,0,0]=3 4092 B8R0.19 CC[C@@H](O)CC(=O)OC Amb22224793 [0,1,0,0,0,1|2,0,0]=4 4093 B8R0.19 CC[C@H](C)NC(=O)OC Amb28049899 [0,1,0,0,0,1|2,0,0]=4 4094 B8R0.19 CC[C@H](N)CC(=O)OC Amb27411455 [0,1,0,0,0,1|1,0,0]=3 4095 B8R0.19 CC[C@H](N)CC(=O)OC Amb33457880 [0,1,0,0,0,1|1,0,0]=3 4096 B8R0.19 CC[C@H](O)CC(=O)OC Amb20240681 [0,1,0,0,0,1|2,0,0]=4 4097 B8R0.19 CC\C(N)=C\C(=O)OC Amb26515846 [0,1,0,0,0,1|1,0,1]=4 4098 B8R0.19 CNC(=O)CC(O)CO Amb25960171 [0,1,0,0,0,1|2,0,0]=4 4099 B8R0.19 COC(=O)CC(C)CBr Amb24692917 [0,1,0,0,0,1|2,0,0]=4 4100 B8R0.19 COC(=O)CC(C)CN Amb18642843 [0,1,0,0,0,1|2,0,0]=4 4101 B8R0.19 COC(=O)CC(C)CN Amb33457749 [0,1,0,0,0,1|2,0,0]=4 4102 B8R0.19 COC(=O)CC(F)CBr Amb28400231 [0,1,0,0,0,1|2,0,0]=4 4103 B8R0.19 COC(=O)CC(F)CN Amb28400247 [0,1,0,0,0,1|2,0,0]=4 4104 B8R0.19 COC(=O)CC(N)CN Amb22264781 [0,1,0,0,0,1|1,0,0]=3 4105 B8R0.19 COC(=O)CC(O)CCl Amb20241285 [0,1,0,0,0,1|2,0,0]=4 4106 B8R0.19 COC(=O)CC(O)CF Amb26920791 [0,1,0,0,0,1|2,0,0]=4 4107 B8R0.19 COC(=O)CC(O)CN Amb25146166 [0,1,0,0,0,1|2,0,0]=4 4108 B8R0.19 COC(=O)CC(O)CN Amb32668884 [0,1,0,0,0,1|2,0,0]=4 4109 B8R0.19 COC(=O)CC(O)CO Amb6600485 [0,1,0,0,0,1|1,0,0]=3 4110 B8R0.19 COC(=O)CC([NH3+])C[NH3+] Amb24112943 [0,1,0,0,0,1|1,0,1]=4 4111 B8R0.19 COC(=O)C[C@@H](C)CN Amb27216066 [0,1,0,0,0,1|2,0,0]=4 4112 B8R0.19 COC(=O)C[C@@H](C)CO Amb22747755 [0,1,0,0,0,1|1,0,0]=3 4113 B8R0.19 COC(=O)C[C@@H](O)CBr Amb23437907 [0,1,0,0,0,1|2,0,0]=4 4114 B8R0.19 COC(=O)C[C@@H](O)CCl Amb8394990 [0,1,0,0,0,1|2,0,0]=4 4115 B8R0.19 COC(=O)C[C@@H](O)CF Amb33358243 [0,1,0,0,0,1|2,0,0]=4 4116 B8R0.19 COC(=O)C[C@@H](O)CN Amb24113025 [0,1,0,0,0,1|2,0,0]=4 4117 B8R0.19 COC(=O)C[C@@H](O)CN Amb33330793 [0,1,0,0,0,1|2,0,0]=4 4118 B8R0.19 COC(=O)C[C@H](C)CN Amb27202560 [0,1,0,0,0,1|2,0,0]=4 4119 B8R0.19 COC(=O)C[C@H](C)CO Amb27831499 [0,1,0,0,0,1|1,0,0]=3 4120 B8R0.19 COC(=O)C[C@H](O)CBr Amb8384043 [0,1,0,0,0,1|2,0,0]=4 4121 B8R0.19 COC(=O)C[C@H](O)CCl Amb2695337 [0,1,0,0,0,1|2,0,0]=4 4122 B8R0.19 COC(=O)C[C@H](O)CF Amb33358247 [0,1,0,0,0,1|2,0,0]=4 4123 B8R0.19 COC(=O)C[C@H](O)CN Amb26604358 [0,1,0,0,0,1|2,0,0]=4 4124 B8R0.19 COC(=O)C[C@H](O)CN Amb33331047 [0,1,0,0,0,1|2,0,0]=4 4125 B8R0.19 COC(=O)C[C@H](O)CO Amb13883661 [0,1,0,0,0,1|1,0,0]=3 4126 B8R0.19 COC(=O)NC(C)CN Amb18251139 [0,1,0,0,0,1|2,0,0]=4 4127 B8R0.19 COC(=O)N[C@@H](C)CN Amb28071139 [0,1,0,0,0,1|2,0,0]=4 4128 B8R0.19 COC(=O)N[C@@H](C)CO Amb27238443 [0,1,0,0,0,1|1,0,0]=3 4129 B8R0.19 COC(=O)N[C@H](C)CN Amb27794832 [0,1,0,0,0,1|2,0,0]=4 4130 B8R0.19 COC(=O)OC(C)CBr Amb28348252 [0,1,0,0,0,1|2,0,0]=4 4131 B8R0.19 COC(=O)OC(C)CO Amb28315454 [0,1,0,0,0,1|1,0,0]=3 4132 B8R0.19 COC(=O)O[C@H](C)CO Amb27981874 [0,1,0,0,0,1|1,0,0]=3 4133 B8R0.19 COC(=O)\C=C(/N)CF Amb28437058 [0,1,0,0,0,1|1,0,1]=4 4134 B8R0.19 COC(=O)\C=C(\C)CO Amb27827476 [0,1,0,0,0,1|1,0,1]=4 4135 B8R0.19 COC(C)CC(N)CO Amb28365968 [0,1,0,0,0,1|1,0,1]=4 4136 B8R0.19 C[C@@H](CO)NC(=O)CCl Amb22831873 [0,1,0,0,0,1|2,0,0]=4 4137 B8R0.19 C[C@H](CO)NC(=O)CBr Amb27768828 [0,1,0,0,0,1|2,0,0]=4 4138 B8R0.19 C[C@H](CO)NC(=O)CN Amb28369296 [0,1,0,0,0,1|2,0,0]=4 4139 B8R0.19 C\C(C=O)=C\C(C)CO Amb28410987 [0,1,0,0,0,1|2,0,0]=4 4140 B8R0.19 C\C(CO)=N/C(C)CO Amb27867215 [0,1,0,0,0,1|2,0,0]=4 4141 B8R0.19 C\C=C(/C)CC(N)CO Amb28422746 [0,1,0,0,0,1|2,0,0]=4 4142 B8R0.19 C\C=C(\C)CC(N)CO Amb28410977 [0,1,0,0,0,1|2,0,0]=4 4143 B8R0.19 NC(CO)CC(N)CO Amb28344616 [0,1,0,0,0,1|1,0,1]=4 4144 B8R0.19 NCC(=O)NC(N)CN Amb27413779 [0,1,0,0,0,1|2,0,0]=4 4145 B8R0.19 N[C@@H](CO)C[C@@H](N)CO Amb27789641 [0,1,0,0,0,1|1,0,1]=4 4146 B8R0.19 N[C@H](CO)C[C@@H](N)CO Amb28056242 [0,1,0,0,0,1|1,0,1]=4 4147 B8R0.19 N\C(CC(=O)NO)=N/O Amb26021862 [0,1,0,0,0,1|1,0,1]=4 4148 B8R0.19 O=C(CO)CC(O)CO Amb26067178 [0,1,0,0,0,1|1,0,0]=3 4149 B8R0.19 O=C(CO)OC(=O)CO Amb27835164 [0,1,0,0,0,1|1,0,1]=4 4150 B8R0.19 O=CC(=O)CC(O)CO Amb28202610 [0,1,0,0,0,1|1,0,1]=4 4151 B8R0.19 O=CC(=O)C[C@@H](O)CO Amb27873015 [0,1,0,0,0,1|1,0,1]=4 4152 B8R0.19 O=CC(O)CC(O)CO Amb22731319 [0,1,0,0,0,1|1,0,1]=4 4153 B8R0.19 O=C[C@@H](O)C[C@@H](O)CO Amb27394636 [0,1,0,0,0,1|1,0,1]=4 4154 B8R0.19 O=C[C@@H](O)C[C@H](O)CO Amb28388612 [0,1,0,0,0,1|1,0,1]=4 4155 B8R0.23 BC(CC(=O)O)C(=O)O Amb28287358 [0,1,0,0,0,1|1,0,1]=4 4156 B8R0.23 C=C(C)C(N)CC(=O)O Amb2697570 [0,1,0,0,0,1|1,0,1]=4 4157 B8R0.23 C=C(O)CC(O)C(O)O Amb24730260 [0,1,0,0,0,1|2,0,0]=4 4158 B8R0.23 CC(=O)C(N)CC(=O)O Amb2697582 [0,1,0,0,0,1|0,0,2]=4 4159 B8R0.23 CC(=O)CC(N)C(=O)O Amb18832532 [0,1,0,0,0,1|1,0,1]=4 4160 B8R0.23 CC(=O)CC(N)C(=O)O Amb22546289 [0,1,0,0,0,1|1,0,1]=4 4161 B8R0.23 CC(=O)CC(N)C(C)C Amb27409984 [0,1,0,0,0,1|2,0,0]=4 4162 B8R0.23 CC(=O)C[C@@H](N)C(=O)O Amb22745939 [0,1,0,0,0,1|1,0,1]=4 4163 B8R0.23 CC(=O)C[C@H](N)C(=O)O Amb27832342 [0,1,0,0,0,1|1,0,1]=4 4164 B8R0.23 CC(=O)OC(C)C(C)O Amb28366888 [0,1,0,0,0,1|2,0,0]=4 4165 B8R0.23 CC(=O)O[C@@H](C)[C@H](C)O Amb28321279 [0,1,0,0,0,1|2,0,0]=4 4166 B8R0.23 CC(=O)O[C@H](C)C(C)O Amb27192959 [0,1,0,0,0,1|2,0,0]=4 4167 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,1,0,0,0,1|2,0,0]=4 4168 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [0,1,0,0,0,1|2,0,0]=4 4169 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [0,1,0,0,0,1|1,0,0]=3 4170 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [0,1,0,0,0,1|1,0,0]=3 4171 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,1,0,0,0,1|2,0,0]=4 4172 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [0,1,0,0,0,1|2,0,0]=4 4173 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,1,0,0,0,1|2,0,0]=4 4174 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [0,1,0,0,0,1|1,0,0]=3 4175 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [0,1,0,0,0,1|1,0,0]=3 4176 B8R0.23 CC(C)[C@@H](N)CC(N)=O Amb28340737 [0,1,0,0,0,1|2,0,0]=4 4177 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [0,1,0,0,0,1|2,0,0]=4 4178 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [0,1,0,0,0,1|1,0,0]=3 4179 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [0,1,0,0,0,1|1,0,0]=3 4180 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,1,0,0,0,1|2,0,0]=4 4181 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [0,1,0,0,0,1|2,0,0]=4 4182 B8R0.23 CC(CC(=O)O)C(=O)O Amb1935053 [0,1,0,0,0,1|1,0,1]=4 4183 B8R0.23 CC(CC(=O)O)C(F)F Amb27441233 [0,1,0,0,0,1|2,0,0]=4 4184 B8R0.23 CC(CC(=O)O)C(N)N Amb27481204 [0,1,0,0,0,1|2,0,0]=4 4185 B8R0.23 CC(CC(=O)O)N(C)O Amb27639550 [0,1,0,0,0,1|2,0,0]=4 4186 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [0,1,0,0,0,1|2,0,0]=4 4187 B8R0.23 CC(O)C(C)NC(N)=O Amb27254184 [0,1,0,0,0,1|2,0,0]=4 4188 B8R0.23 CC(O)C(C)OC(N)=O Amb27644455 [0,1,0,0,0,1|2,0,0]=4 4189 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [0,1,0,0,0,1|0,0,0]=2 4190 B8R0.23 CC(O)C(N)CC(N)=O Amb27246007 [0,1,0,0,0,1|1,0,0]=3 4191 B8R0.23 C[C@@H](CC(=O)O)C(=O)O Amb22226742 [0,1,0,0,0,1|1,0,1]=4 4192 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [0,1,0,0,0,1|0,0,0]=2 4193 B8R0.23 C[C@H](CC(=O)O)C(=O)O Amb22225399 [0,1,0,0,0,1|1,0,1]=4 4194 B8R0.23 C[C@H](CC(=O)O)C(Cl)Cl Amb28292581 [0,1,0,0,0,1|2,0,0]=4 4195 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [0,1,0,0,0,1|2,0,0]=4 4196 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [0,1,0,0,0,1|2,0,0]=4 4197 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [0,1,0,0,0,1|0,0,0]=2 4198 B8R0.23 NC(=O)C(N)CC(=O)O Amb18124347 [0,1,0,0,0,1|0,0,2]=4 4199 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666212 [0,1,0,0,0,1|0,0,2]=4 4200 B8R0.23 NC(=O)C(N)CC(=O)O Amb32666239 [0,1,0,0,0,1|0,0,2]=4 4201 B8R0.23 NC(=O)CC(N)C(=O)O Amb2725509 [0,1,0,0,0,1|1,0,1]=4 4202 B8R0.23 NC(=O)CC(N)C(=O)O Amb3940878 [0,1,0,0,0,1|1,0,1]=4 4203 B8R0.23 NC(=O)CC(N)C(F)F Amb32418214 [0,1,0,0,0,1|2,0,0]=4 4204 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb10071271 [0,1,0,0,0,1|1,0,1]=4 4205 B8R0.23 NC(=O)C[C@@H](N)C(=O)O Amb17749060 [0,1,0,0,0,1|1,0,1]=4 4206 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb3940760 [0,1,0,0,0,1|1,0,1]=4 4207 B8R0.23 NC(=O)C[C@H](N)C(=O)O Amb8513755 [0,1,0,0,0,1|1,0,1]=4 4208 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb19334954 [0,1,0,0,0,1|0,0,2]=4 4209 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb31291739 [0,1,0,0,0,1|0,0,2]=4 4210 B8R0.23 NC(=O)[C@@H](N)CC(=O)O Amb32652393 [0,1,0,0,0,1|0,0,2]=4 4211 B8R0.23 NC(=O)[C@H](N)CC(=O)O Amb27768775 [0,1,0,0,0,1|0,0,2]=4 4212 B8R0.23 NC(CC(=O)O)C(=O)O Amb9702780 [0,1,0,0,0,1|0,0,1]=3 4213 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22167994 [0,1,0,0,0,1|0,0,2]=4 4214 B8R0.23 NC(CC(=O)O)C(=O)[O-] Amb22337568 [0,1,0,0,0,1|0,0,2]=4 4215 B8R0.23 NC(CC(=O)O)C(Cl)Cl Amb27964120 [0,1,0,0,0,1|1,0,0]=3 4216 B8R0.23 NC(CC(=O)O)C(F)F Amb23570587 [0,1,0,0,0,1|1,0,0]=3 4217 B8R0.23 NC(CS(=O)O)C(=O)O Amb541272 [0,1,0,0,0,1|1,0,1]=4 4218 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb34163080 [0,1,0,0,0,1|0,0,1]=3 4219 B8R0.23 N[C@@H](CC(=O)O)C(=O)O Amb3940320 [0,1,0,0,0,1|0,0,1]=3 4220 B8R0.23 N[C@@H](CC(=O)O)C(=O)[O-] Amb22801032 [0,1,0,0,0,1|0,0,2]=4 4221 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb20240565 [0,1,0,0,0,1|0,0,2]=4 4222 B8R0.23 N[C@@H](CC(=O)[O-])C(=O)O Amb22748769 [0,1,0,0,0,1|0,0,2]=4 4223 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb6600148 [0,1,0,0,0,1|1,0,1]=4 4224 B8R0.23 N[C@@H](CS(=O)O)C(=O)O Amb9809803 [0,1,0,0,0,1|1,0,1]=4 4225 B8R0.23 N[C@H](CC(=O)O)C(=O)O Amb6599992 [0,1,0,0,0,1|0,0,1]=3 4226 B8R0.23 N\C(=C/C(=O)O)C(F)F Amb27607399 [0,1,0,0,0,1|1,0,1]=4 4227 B8R0.23 O=C(O)CC(Br)C(=O)O Amb3941503 [0,1,0,0,0,1|1,0,1]=4 4228 B8R0.23 O=C(O)CC(Cl)C(=O)O Amb9825869 [0,1,0,0,0,1|1,0,1]=4 4229 B8R0.23 O=C(O)CC(O)C(=O)O Amb8513238 [0,1,0,0,0,1|1,0,1]=4 4230 B8R0.23 O=C(O)CC(O)C(Cl)Cl Amb27985520 [0,1,0,0,0,1|2,0,0]=4 4231 B8R0.23 O=C(O)CC(S)C(=O)O Amb2779994 [0,1,0,0,0,1|1,0,1]=4 4232 B8R0.23 O=C(O)C[C@@H](Br)C(=O)O Amb22504149 [0,1,0,0,0,1|1,0,1]=4 4233 B8R0.23 O=C(O)C[C@@H](Cl)C(=O)O Amb20242424 [0,1,0,0,0,1|1,0,1]=4 4234 B8R0.23 O=C(O)C[C@@H](F)C(=O)O Amb27173500 [0,1,0,0,0,1|1,0,1]=4 4235 B8R0.23 O=C(O)C[C@@H](O)C(=O)O Amb4166311 [0,1,0,0,0,1|1,0,1]=4 4236 B8R0.23 O=C(O)C[C@@H](O)C(F)F Amb33337779 [0,1,0,0,0,1|2,0,0]=4 4237 B8R0.23 O=C(O)C[C@H](Br)C(=O)O Amb8629197 [0,1,0,0,0,1|1,0,1]=4 4238 B8R0.23 O=C(O)C[C@H](Cl)C(=O)O Amb20242425 [0,1,0,0,0,1|1,0,1]=4 4239 B8R0.23 O=C(O)C[C@H](F)C(=O)O Amb27167819 [0,1,0,0,0,1|1,0,1]=4 4240 B8R0.23 O=C(O)C[C@H](O)C(=O)O Amb6599993 [0,1,0,0,0,1|1,0,1]=4 4241 B8R0.23 O=C(O)C[C@H](O)C(F)F Amb33485299 [0,1,0,0,0,1|2,0,0]=4 4242 B8R0.24 CC(C)(O)C[C@H](N)CO Amb27786310 [0,1,0,0,0,1|1,0,1]=4 4243 B8R0.24 CC(CO)OP(=O)(O)O Amb25121032 [0,1,0,0,0,1|2,0,0]=4 4244 B8R0.24 CCC(N)CP(=O)(O)O Amb27407104 [0,1,0,0,0,1|2,0,0]=4 4245 B8R0.24 CCC(N)CS(=O)(=O)O Amb27454945 [0,1,0,0,0,1|2,0,0]=4 4246 B8R0.24 CS(=O)(=O)CC(N)CO Amb25967787 [0,1,0,0,0,1|1,0,1]=4 4247 B8R0.24 CS(=O)(=O)C[C@@H](N)CO Amb33055788 [0,1,0,0,0,1|1,0,1]=4 4248 B8R0.24 CS(=O)(=O)C[C@H](N)CO Amb27467791 [0,1,0,0,0,1|1,0,1]=4 4249 B8R0.24 C[C@@H](CO)OP(=O)(O)O Amb27956601 [0,1,0,0,0,1|2,0,0]=4 4250 B8R0.24 N[C@@H](CO)CS(=O)(=O)O Amb28118562 [0,1,0,0,0,1|1,0,0]=3 4251 B8R0.24 O=S(=O)(O)CC(O)CO Amb25802047 [0,1,0,0,0,1|2,0,0]=4 4252 B8R0.34 C=C(C)CC(C)(N)CO Amb33199505 [0,1,0,0,0,1|2,0,0]=4 4253 B8R0.34 C=CC(C)(N)CC(=O)O Amb22641965 [0,1,0,0,0,1|1,0,1]=4 4254 B8R0.34 C=CC(C)(N)CC(=O)O Amb31307623 [0,1,0,0,0,1|1,0,1]=4 4255 B8R0.34 CC(=O)CC(C)(C)CO Amb24689736 [0,1,0,0,0,1|2,0,0]=4 4256 B8R0.34 CC(=O)NC(C)(C)CO Amb9243962 [0,1,0,0,0,1|2,0,0]=4 4257 B8R0.34 CC(C)(CBr)CC(=O)O Amb24480039 [0,1,0,0,0,1|2,0,0]=4 4258 B8R0.34 CC(C)(CC(=O)O)NO Amb27859691 [0,1,0,0,0,1|2,0,0]=4 4259 B8R0.34 CC(C)(CF)CC(=O)O Amb26575195 [0,1,0,0,0,1|2,0,0]=4 4260 B8R0.34 CC(C)(CI)CC(=O)O Amb33295131 [0,1,0,0,0,1|2,0,0]=4 4261 B8R0.34 CC(C)(CN)CC(=O)O Amb4245619 [0,1,0,0,0,1|2,0,0]=4 4262 B8R0.34 CC(C)(CN)CC(=O)O Amb578353 [0,1,0,0,0,1|2,0,0]=4 4263 B8R0.34 CC(C)(CO)CC(=O)O Amb24116870 [0,1,0,0,0,1|1,0,0]=3 4264 B8R0.34 CC(C)(CO)CC(=O)[O-] Amb24178915 [0,1,0,0,0,1|1,0,1]=4 4265 B8R0.34 CC(N)(CCl)CC(=O)O Amb22641961 [0,1,0,0,0,1|1,0,0]=3 4266 B8R0.34 CC(N)(CN)CC(=O)O Amb32787831 [0,1,0,0,0,1|1,0,0]=3 4267 B8R0.34 CC(N)(CN)CC(N)=O Amb32787386 [0,1,0,0,0,1|2,0,0]=4 4268 B8R0.34 CC(N)(CO)CC(=O)O Amb27162086 [0,1,0,0,0,1|0,0,0]=2 4269 B8R0.34 CC(O)(CCl)CC(=O)O Amb27409236 [0,1,0,0,0,1|2,0,0]=4 4270 B8R0.34 CC(O)(CN)CC(=O)O Amb25188898 [0,1,0,0,0,1|2,0,0]=4 4271 B8R0.34 CC(O)(CN)CC(=O)O Amb28935004 [0,1,0,0,0,1|2,0,0]=4 4272 B8R0.34 CC(O)CC(C)(N)CO Amb29850597 [0,1,0,0,0,1|1,0,1]=4 4273 B8R0.34 CCC(C)(C)CC(=O)O Amb10573669 [0,1,0,0,0,1|2,0,0]=4 4274 B8R0.34 CCC(C)(F)CC(=O)O Amb27645740 [0,1,0,0,0,1|2,0,0]=4 4275 B8R0.34 CCC(C)(N)CC(=O)O Amb25853863 [0,1,0,0,0,1|1,0,0]=3 4276 B8R0.34 CCC(C)(N)CC(N)=O Amb33254471 [0,1,0,0,0,1|2,0,0]=4 4277 B8R0.34 CCC(C)(O)CC(=O)O Amb18298122 [0,1,0,0,0,1|2,0,0]=4 4278 B8R0.34 CCC(F)(F)CC(=O)O Amb32666992 [0,1,0,0,0,1|2,0,0]=4 4279 B8R0.34 CC[C@@](C)(N)CC(=O)O Amb25738026 [0,1,0,0,0,1|1,0,0]=3 4280 B8R0.34 NCC(F)(F)CC(=O)O Amb19148532 [0,1,0,0,0,1|2,0,0]=4 4281 B8R0.34 NCC(F)(F)CC(=O)O Amb32693401 [0,1,0,0,0,1|2,0,0]=4 4282 B8R0.34 O=C(O)CC(F)(F)CBr Amb27592325 [0,1,0,0,0,1|2,0,0]=4 4283 B8R0.34 O=C(O)CC(F)(F)CCl Amb33741692 [0,1,0,0,0,1|2,0,0]=4 4284 B8R0.34 O=C(O)CC(F)(F)CF Amb33402041 [0,1,0,0,0,1|2,0,0]=4 4285 B8R0.3 C#CC(=O)C(C)CCO Amb28125122 [0,2,0,0,0,0|2,0,0]=4 4286 B8R0.3 C#CC(=O)[C@@H](N)CCC Amb35662325 [0,2,0,0,0,0|2,0,0]=4 4287 B8R0.3 C#CC(=O)[C@H](N)CCC Amb35659947 [0,2,0,0,0,0|2,0,0]=4 4288 B8R0.3 C#CC(O)C(N)COC Amb29849503 [0,2,0,0,0,0|1,0,1]=4 4289 B8R0.3 C#CCC(=O)[C@@H](N)CC Amb35601237 [0,2,0,0,0,0|2,0,0]=4 4290 B8R0.3 C#CCC(=O)[C@H](N)CC Amb35595864 [0,2,0,0,0,0|2,0,0]=4 4291 B8R0.3 C#CCC(C)C(=O)OC Amb18115942 [0,2,0,0,0,0|2,0,0]=4 4292 B8R0.3 C#CCC(N)C(=O)C=C Amb27392873 [0,2,0,0,0,0|2,0,0]=4 4293 B8R0.3 C#CCC(N)C(=O)NN Amb24737524 [0,2,0,0,0,0|2,0,0]=4 4294 B8R0.3 C#CCC(N)C(=O)NN Amb32663420 [0,2,0,0,0,0|2,0,0]=4 4295 B8R0.3 C#CCC(N)C(=O)OC Amb24426865 [0,2,0,0,0,0|1,0,0]=3 4296 B8R0.3 C#CCC(N)C(=O)OC Amb32663324 [0,2,0,0,0,0|1,0,0]=3 4297 B8R0.3 C#CC[C@@H](N)C(=O)OC Amb26919399 [0,2,0,0,0,0|1,0,0]=3 4298 B8R0.3 C#CC[C@H](N)C(=O)OC Amb22746034 [0,2,0,0,0,0|1,0,0]=3 4299 B8R0.3 C#CC[C@H](N)C(=O)OC Amb27870421 [0,2,0,0,0,0|1,0,0]=3 4300 B8R0.3 C=C(CCO)C(=O)OC Amb27258056 [0,2,0,0,0,0|1,0,1]=4 4301 B8R0.3 C=C(CCO)[C@H](N)CO Amb28057584 [0,2,0,0,0,0|1,0,0]=3 4302 B8R0.3 C=C(CO)C(=O)OCC Amb17614080 [0,2,0,0,0,0|1,0,1]=4 4303 B8R0.3 C=C(COC)C(=O)OC Amb27172332 [0,2,0,0,0,0|1,0,1]=4 4304 B8R0.3 C=C=CC(N)C(=O)OC Amb27393031 [0,2,0,0,0,0|1,0,1]=4 4305 B8R0.3 C=CC(=O)C(N)CCC Amb27251910 [0,2,0,0,0,0|2,0,0]=4 4306 B8R0.3 C=CC(N)C(=O)OCC Amb18642705 [0,2,0,0,0,0|1,0,1]=4 4307 B8R0.3 C=CCC(C)C(=O)OC Amb27787724 [0,2,0,0,0,0|2,0,0]=4 4308 B8R0.3 C=CCC(Cl)C(=O)OC Amb25365264 [0,2,0,0,0,0|2,0,0]=4 4309 B8R0.3 C=CCC(N)C(=O)NO Amb28322025 [0,2,0,0,0,0|1,0,0]=3 4310 B8R0.3 C=CCC(N)C(=O)OC Amb18642703 [0,2,0,0,0,0|1,0,0]=3 4311 B8R0.3 C=CCC(N)C(=O)OC Amb22757544 [0,2,0,0,0,0|1,0,0]=3 4312 B8R0.3 C=CCC(O)C(=O)OC Amb28435077 [0,2,0,0,0,0|2,0,0]=4 4313 B8R0.3 C=CCC(O)C(N)CO Amb27394170 [0,2,0,0,0,0|1,0,1]=4 4314 B8R0.3 C=CC[C@@H](N)C(=O)OC Amb24635550 [0,2,0,0,0,0|1,0,0]=3 4315 B8R0.3 C=CC[C@@H](N)C(=O)OC Amb33868785 [0,2,0,0,0,0|1,0,0]=3 4316 B8R0.3 C=CC[C@H](N)C(=O)OC Amb22750599 [0,2,0,0,0,0|1,0,0]=3 4317 B8R0.3 C=CC[C@H](N)C(=O)OC Amb24120340 [0,2,0,0,0,0|1,0,0]=3 4318 B8R0.3 C=COC(=O)C(C)CCl Amb28254482 [0,2,0,0,0,0|2,0,0]=4 4319 B8R0.3 C=C[C@H](N)C(=O)OCC Amb27424651 [0,2,0,0,0,0|1,0,1]=4 4320 B8R0.3 CC#CC(N)C(=O)OC Amb27625818 [0,2,0,0,0,0|1,0,1]=4 4321 B8R0.3 CC(CCN)C(=O)CO Amb24478589 [0,2,0,0,0,0|2,0,0]=4 4322 B8R0.3 CC(CCO)C(O)C=O Amb27614168 [0,2,0,0,0,0|1,0,1]=4 4323 B8R0.3 CC(CO)C(=O)OCO Amb28205113 [0,2,0,0,0,0|1,0,0]=3 4324 B8R0.3 CCC(=O)C(Br)COC Amb28121135 [0,2,0,0,0,0|2,0,0]=4 4325 B8R0.3 CCC(=O)C(C)COC Amb27960816 [0,2,0,0,0,0|2,0,0]=4 4326 B8R0.3 CCC(=O)C(Cl)CCO Amb26477870 [0,2,0,0,0,0|2,0,0]=4 4327 B8R0.3 CCC(C)C(=O)OCCl Amb27971607 [0,2,0,0,0,0|2,0,0]=4 4328 B8R0.3 CCC(C)C(=O)OCI Amb27603509 [0,2,0,0,0,0|2,0,0]=4 4329 B8R0.3 CCC(C)C(=O)\C=N\O Amb27787495 [0,2,0,0,0,0|2,0,0]=4 4330 B8R0.3 CCC(Cl)C(=O)CCO Amb24409195 [0,2,0,0,0,0|2,0,0]=4 4331 B8R0.3 CCC(N)C(=O)NC#N Amb27788617 [0,2,0,0,0,0|2,0,0]=4 4332 B8R0.3 CCC(N)C(=O)NOC Amb27983426 [0,2,0,0,0,0|1,0,0]=3 4333 B8R0.3 CCCC(=O)C(Cl)CO Amb26627095 [0,2,0,0,0,0|2,0,0]=4 4334 B8R0.3 CCCC(=O)[C@@H](N)CO Amb27461749 [0,2,0,0,0,0|1,0,0]=3 4335 B8R0.3 CCCC(Br)C(=O)OC Amb20621576 [0,2,0,0,0,0|2,0,0]=4 4336 B8R0.3 CCCC(Cl)C(=O)OF Amb28399722 [0,2,0,0,0,0|2,0,0]=4 4337 B8R0.3 CCCC(N)C(=O)NC Amb9514804 [0,2,0,0,0,0|2,0,0]=4 4338 B8R0.3 CCCC(N)C(=O)NO Amb22059373 [0,2,0,0,0,0|1,0,0]=3 4339 B8R0.3 CCCC(N)C(=O)OC Amb2786376 [0,2,0,0,0,0|1,0,0]=3 4340 B8R0.3 CCCC(N)C(=O)OC Amb33549293 [0,2,0,0,0,0|1,0,0]=3 4341 B8R0.3 CCCC(N)\C(N)=N\O Amb24749079 [0,2,0,0,0,0|2,0,0]=4 4342 B8R0.3 CCCC(N)\C(O)=N\O Amb20669260 [0,2,0,0,0,0|1,0,1]=4 4343 B8R0.3 CCCC(O)C(=O)CO Amb27802691 [0,2,0,0,0,0|2,0,0]=4 4344 B8R0.3 CCCC(O)C(=O)OC Amb23454534 [0,2,0,0,0,0|2,0,0]=4 4345 B8R0.3 CCCC(O)C(N)CO Amb24478778 [0,2,0,0,0,0|1,0,1]=4 4346 B8R0.3 CCCN(N)C(=O)OC Amb33191592 [0,2,0,0,0,0|2,0,0]=4 4347 B8R0.3 CCC[C@@H](Br)C(=O)OC Amb27166248 [0,2,0,0,0,0|2,0,0]=4 4348 B8R0.3 CCC[C@@H](Cl)C(=O)OC Amb27179954 [0,2,0,0,0,0|2,0,0]=4 4349 B8R0.3 CCC[C@@H](N)C(=O)NN Amb27844787 [0,2,0,0,0,0|2,0,0]=4 4350 B8R0.3 CCC[C@@H](N)C(=O)NO Amb28314574 [0,2,0,0,0,0|1,0,0]=3 4351 B8R0.3 CCC[C@@H](N)C(=O)OC Amb25146086 [0,2,0,0,0,0|1,0,0]=3 4352 B8R0.3 CCC[C@@H](N)C(=O)OC Amb30526950 [0,2,0,0,0,0|1,0,0]=3 4353 B8R0.3 CCC[C@@H](O)C(=O)CO Amb27802757 [0,2,0,0,0,0|2,0,0]=4 4354 B8R0.3 CCC[C@@H](O)C(=O)OC Amb28344665 [0,2,0,0,0,0|2,0,0]=4 4355 B8R0.3 CCC[C@H](Br)C(=O)OC Amb28346240 [0,2,0,0,0,0|2,0,0]=4 4356 B8R0.3 CCC[C@H](C)C(=O)OC Amb28344077 [0,2,0,0,0,0|2,0,0]=4 4357 B8R0.3 CCC[C@H](N)C(=O)NC Amb25991661 [0,2,0,0,0,0|2,0,0]=4 4358 B8R0.3 CCC[C@H](N)C(=O)OC Amb10844887 [0,2,0,0,0,0|1,0,0]=3 4359 B8R0.3 CCC[C@H](N)C(=O)OC Amb17942871 [0,2,0,0,0,0|1,0,0]=3 4360 B8R0.3 CCC[C@H](O)C(=O)CO Amb27838685 [0,2,0,0,0,0|2,0,0]=4 4361 B8R0.3 CCC[C@H](O)[C@@H](N)CO Amb28455449 [0,2,0,0,0,0|1,0,1]=4 4362 B8R0.3 CCN(N)C(=O)COC Amb33191309 [0,2,0,0,0,0|2,0,0]=4 4363 B8R0.3 CCNC(=O)C(N)CC Amb9514098 [0,2,0,0,0,0|2,0,0]=4 4364 B8R0.3 CCNC(=O)[C@@H](N)CC Amb25732232 [0,2,0,0,0,0|2,0,0]=4 4365 B8R0.3 CCNC(=O)[C@@H](N)CC Amb33950965 [0,2,0,0,0,0|2,0,0]=4 4366 B8R0.3 CCNC(=O)[C@H](N)CC Amb26410051 [0,2,0,0,0,0|2,0,0]=4 4367 B8R0.3 CCNC(=O)[C@H](N)CC Amb28994709 [0,2,0,0,0,0|2,0,0]=4 4368 B8R0.3 CCNC(=O)[C@H](N)CO Amb27466260 [0,2,0,0,0,0|1,0,0]=3 4369 B8R0.3 CCNC(C)C(=O)OC Amb19003120 [0,2,0,0,0,0|2,0,0]=4 4370 B8R0.3 CCNC(C)C(=O)OC Amb32751752 [0,2,0,0,0,0|2,0,0]=4 4371 B8R0.3 CCN[C@@H](C)C(=O)OC Amb9228630 [0,2,0,0,0,0|2,0,0]=4 4372 B8R0.3 CCOC(=O)C(Br)CBr Amb9703151 [0,2,0,0,0,0|2,0,0]=4 4373 B8R0.3 CCOC(=O)C(Br)CC Amb3939965 [0,2,0,0,0,0|2,0,0]=4 4374 B8R0.3 CCOC(=O)C(Br)CO Amb27632489 [0,2,0,0,0,0|1,0,0]=3 4375 B8R0.3 CCOC(=O)C(C)CBr Amb19375560 [0,2,0,0,0,0|2,0,0]=4 4376 B8R0.3 CCOC(=O)C(C)CC Amb8514839 [0,2,0,0,0,0|2,0,0]=4 4377 B8R0.3 CCOC(=O)C(C)CCl Amb22549464 [0,2,0,0,0,0|2,0,0]=4 4378 B8R0.3 CCOC(=O)C(C)CN Amb2697516 [0,2,0,0,0,0|2,0,0]=4 4379 B8R0.3 CCOC(=O)C(C)CN Amb8630270 [0,2,0,0,0,0|2,0,0]=4 4380 B8R0.3 CCOC(=O)C(C)CO Amb20623263 [0,2,0,0,0,0|1,0,0]=3 4381 B8R0.3 CCOC(=O)C(C)CS Amb27852969 [0,2,0,0,0,0|1,1,0]=4 4382 B8R0.3 CCOC(=O)C(Cl)CBr Amb27786878 [0,2,0,0,0,0|2,0,0]=4 4383 B8R0.3 CCOC(=O)C(Cl)CCl Amb22169781 [0,2,0,0,0,0|2,0,0]=4 4384 B8R0.3 CCOC(=O)C(F)CC Amb4036431 [0,2,0,0,0,0|2,0,0]=4 4385 B8R0.3 CCOC(=O)C(F)CN Amb25884088 [0,2,0,0,0,0|2,0,0]=4 4386 B8R0.3 CCOC(=O)C(F)CO Amb26631024 [0,2,0,0,0,0|1,0,0]=3 4387 B8R0.3 CCOC(=O)C(I)CC Amb28285314 [0,2,0,0,0,0|2,0,0]=4 4388 B8R0.3 CCOC(=O)C(N)C#N Amb10549349 [0,2,0,0,0,0|1,0,1]=4 4389 B8R0.3 CCOC(=O)C(N)C#N Amb32409536 [0,2,0,0,0,0|1,0,1]=4 4390 B8R0.3 CCOC(=O)C(N)C#N Amb647083 [0,2,0,0,0,0|1,0,1]=4 4391 B8R0.3 CCOC(=O)C(N)CC Amb6307326 [0,2,0,0,0,0|1,0,0]=3 4392 B8R0.3 CCOC(=O)C(N)CC Amb9330296 [0,2,0,0,0,0|1,0,0]=3 4393 B8R0.3 CCOC(=O)C(N)CCl Amb24117929 [0,2,0,0,0,0|1,0,0]=3 4394 B8R0.3 CCOC(=O)C(N)CF Amb26452436 [0,2,0,0,0,0|1,0,0]=3 4395 B8R0.3 CCOC(=O)C(N)CN Amb4042205 [0,2,0,0,0,0|1,0,0]=3 4396 B8R0.3 CCOC(=O)C(N)CO Amb2780963 [0,2,0,0,0,0|0,0,0]=2 4397 B8R0.3 CCOC(=O)C(N)CO Amb3941322 [0,2,0,0,0,0|0,0,0]=2 4398 B8R0.3 CCOC(=O)C(N)CS Amb2780964 [0,2,0,0,0,0|0,1,0]=3 4399 B8R0.3 CCOC(=O)C(N)CS Amb9204479 [0,2,0,0,0,0|0,1,0]=3 4400 B8R0.3 CCOC(=O)C(O)CBr Amb24480251 [0,2,0,0,0,0|2,0,0]=4 4401 B8R0.3 CCOC(=O)C(O)CC Amb3939695 [0,2,0,0,0,0|2,0,0]=4 4402 B8R0.3 CCOC(=O)C(O)CCl Amb22055205 [0,2,0,0,0,0|2,0,0]=4 4403 B8R0.3 CCOC(=O)C(O)CN Amb25805599 [0,2,0,0,0,0|2,0,0]=4 4404 B8R0.3 CCOC(=O)C(O)CO Amb17593407 [0,2,0,0,0,0|1,0,0]=3 4405 B8R0.3 CCOC(=O)C(O)CS Amb28315469 [0,2,0,0,0,0|1,1,0]=4 4406 B8R0.3 CCOC(=O)C(S)CC Amb20623543 [0,2,0,0,0,0|2,0,0]=4 4407 B8R0.3 CCOC(=O)C(S)CN Amb28241322 [0,2,0,0,0,0|2,0,0]=4 4408 B8R0.3 CCOC(=O)[C@@H](Br)CO Amb27400416 [0,2,0,0,0,0|1,0,0]=3 4409 B8R0.3 CCOC(=O)[C@@H](C)CO Amb27270913 [0,2,0,0,0,0|1,0,0]=3 4410 B8R0.3 CCOC(=O)[C@@H](F)CN Amb33739800 [0,2,0,0,0,0|2,0,0]=4 4411 B8R0.3 CCOC(=O)[C@@H](N)C=O Amb27237210 [0,2,0,0,0,0|0,0,2]=4 4412 B8R0.3 CCOC(=O)[C@@H](N)CC Amb28345705 [0,2,0,0,0,0|1,0,0]=3 4413 B8R0.3 CCOC(=O)[C@@H](N)CC Amb33801538 [0,2,0,0,0,0|1,0,0]=3 4414 B8R0.3 CCOC(=O)[C@@H](N)CCl Amb27470166 [0,2,0,0,0,0|1,0,0]=3 4415 B8R0.3 CCOC(=O)[C@@H](N)CN Amb33801472 [0,2,0,0,0,0|1,0,0]=3 4416 B8R0.3 CCOC(=O)[C@@H](N)CO Amb3940141 [0,2,0,0,0,0|0,0,0]=2 4417 B8R0.3 CCOC(=O)[C@@H](N)CO Amb6486662 [0,2,0,0,0,0|0,0,0]=2 4418 B8R0.3 CCOC(=O)[C@@H](N)CS Amb8390394 [0,2,0,0,0,0|0,1,0]=3 4419 B8R0.3 CCOC(=O)[C@@H](N)CS Amb8513096 [0,2,0,0,0,0|0,1,0]=3 4420 B8R0.3 CCOC(=O)[C@@H](O)CBr Amb27650580 [0,2,0,0,0,0|2,0,0]=4 4421 B8R0.3 CCOC(=O)[C@@H](O)CC Amb27169160 [0,2,0,0,0,0|2,0,0]=4 4422 B8R0.3 CCOC(=O)[C@@H](O)CN Amb26327160 [0,2,0,0,0,0|2,0,0]=4 4423 B8R0.3 CCOC(=O)[C@H](C)CC Amb28255534 [0,2,0,0,0,0|2,0,0]=4 4424 B8R0.3 CCOC(=O)[C@H](C)CO Amb27437207 [0,2,0,0,0,0|1,0,0]=3 4425 B8R0.3 CCOC(=O)[C@H](F)CN Amb25084408 [0,2,0,0,0,0|2,0,0]=4 4426 B8R0.3 CCOC(=O)[C@H](F)CO Amb28401229 [0,2,0,0,0,0|1,0,0]=3 4427 B8R0.3 CCOC(=O)[C@H](N)CC Amb22745247 [0,2,0,0,0,0|1,0,0]=3 4428 B8R0.3 CCOC(=O)[C@H](N)CC Amb27603000 [0,2,0,0,0,0|1,0,0]=3 4429 B8R0.3 CCOC(=O)[C@H](N)CO Amb22169869 [0,2,0,0,0,0|0,0,0]=2 4430 B8R0.3 CCOC(=O)[C@H](N)CO Amb24524167 [0,2,0,0,0,0|0,0,0]=2 4431 B8R0.3 CCOC(=O)[C@H](N)CS Amb10842242 [0,2,0,0,0,0|0,1,0]=3 4432 B8R0.3 CCOC(=O)[C@H](O)CBr Amb27945592 [0,2,0,0,0,0|2,0,0]=4 4433 B8R0.3 CCOC(=O)[C@H](O)CC Amb27156876 [0,2,0,0,0,0|2,0,0]=4 4434 B8R0.3 CCOC(=O)[C@H](O)CN Amb27592376 [0,2,0,0,0,0|2,0,0]=4 4435 B8R0.3 CCOC(=O)\C(N)=N/O Amb9807247 [0,2,0,0,0,0|1,0,1]=4 4436 B8R0.3 CCOC(=O)\C(N)=N\O Amb21858685 [0,2,0,0,0,0|1,0,1]=4 4437 B8R0.3 CCOC(=O)\C(N)=N\O Amb33714753 [0,2,0,0,0,0|1,0,1]=4 4438 B8R0.3 CCOC(=S)C(O)CO Amb27807215 [0,2,0,0,0,0|1,1,0]=4 4439 B8R0.3 CCOC(Br)C(=O)OC Amb28342296 [0,2,0,0,0,0|2,0,0]=4 4440 B8R0.3 CCOC(C)C(N)CO Amb33425732 [0,2,0,0,0,0|1,0,1]=4 4441 B8R0.3 CCOC(C)[C@@H](N)CO Amb33425385 [0,2,0,0,0,0|1,0,1]=4 4442 B8R0.3 CCOC(C)[C@H](N)CO Amb33425387 [0,2,0,0,0,0|1,0,1]=4 4443 B8R0.3 CCO[C@@H](C)C(=O)OC Amb28060813 [0,2,0,0,0,0|2,0,0]=4 4444 B8R0.3 CCSC(Cl)C(=O)OC Amb27845442 [0,2,0,0,0,0|2,0,0]=4 4445 B8R0.3 CC\C=C(\N)C(=O)OC Amb27255558 [0,2,0,0,0,0|1,0,1]=4 4446 B8R0.3 CN(CCO)C(=O)CO Amb5798177 [0,2,0,0,0,0|2,0,0]=4 4447 B8R0.3 CNC(=O)N(N)CCO Amb27391218 [0,2,0,0,0,0|2,0,0]=4 4448 B8R0.3 CNC(=O)[C@@H](N)CCN Amb28197475 [0,2,0,0,0,0|2,0,0]=4 4449 B8R0.3 CNCC(C)C(=O)NO Amb28120671 [0,2,0,0,0,0|2,0,0]=4 4450 B8R0.3 CNCC(C)C(=O)OC Amb9288459 [0,2,0,0,0,0|2,0,0]=4 4451 B8R0.3 CNCC(N)C(=O)OC Amb27758128 [0,2,0,0,0,0|1,0,0]=3 4452 B8R0.3 COC(=O)C(Br)CCBr Amb4441764 [0,2,0,0,0,0|2,0,0]=4 4453 B8R0.3 COC(=O)C(Br)CCCl Amb27424625 [0,2,0,0,0,0|2,0,0]=4 4454 B8R0.3 COC(=O)C(Br)CSC Amb28321151 [0,2,0,0,0,0|1,1,0]=4 4455 B8R0.3 COC(=O)C(C)CC#N Amb17334094 [0,2,0,0,0,0|2,0,0]=4 4456 B8R0.3 COC(=O)C(C)CC=O Amb18642746 [0,2,0,0,0,0|1,0,1]=4 4457 B8R0.3 COC(=O)C(C)CCBr Amb26493267 [0,2,0,0,0,0|2,0,0]=4 4458 B8R0.3 COC(=O)C(C)CCCl Amb16230918 [0,2,0,0,0,0|2,0,0]=4 4459 B8R0.3 COC(=O)C(C)CCN Amb26438013 [0,2,0,0,0,0|2,0,0]=4 4460 B8R0.3 COC(=O)C(C)CCN Amb31156338 [0,2,0,0,0,0|2,0,0]=4 4461 B8R0.3 COC(=O)C(C)CON Amb27944891 [0,2,0,0,0,0|1,0,0]=3 4462 B8R0.3 COC(=O)C(C)CSC Amb28203970 [0,2,0,0,0,0|1,1,0]=4 4463 B8R0.3 COC(=O)C(F)CCN Amb22388532 [0,2,0,0,0,0|2,0,0]=4 4464 B8R0.3 COC(=O)C(N)CC#N Amb26573884 [0,2,0,0,0,0|1,0,0]=3 4465 B8R0.3 COC(=O)C(N)CCBr Amb2695255 [0,2,0,0,0,0|1,0,0]=3 4466 B8R0.3 COC(=O)C(N)CCBr Amb4296941 [0,2,0,0,0,0|1,0,0]=3 4467 B8R0.3 COC(=O)C(N)CCCl Amb27855259 [0,2,0,0,0,0|1,0,0]=3 4468 B8R0.3 COC(=O)C(N)CCF Amb25066743 [0,2,0,0,0,0|1,0,0]=3 4469 B8R0.3 COC(=O)C(N)CCN Amb24113143 [0,2,0,0,0,0|1,0,0]=3 4470 B8R0.3 COC(=O)C(N)CCN Amb25733368 [0,2,0,0,0,0|1,0,0]=3 4471 B8R0.3 COC(=O)C(N)CCO Amb18305497 [0,2,0,0,0,0|0,0,0]=2 4472 B8R0.3 COC(=O)C(N)CON Amb27451370 [0,2,0,0,0,0|0,0,0]=2 4473 B8R0.3 COC(=O)C(N)CON Amb33329476 [0,2,0,0,0,0|0,0,0]=2 4474 B8R0.3 COC(=O)C(N)CSC Amb19878256 [0,2,0,0,0,0|0,1,0]=3 4475 B8R0.3 COC(=O)C(N)CSC Amb22052594 [0,2,0,0,0,0|0,1,0]=3 4476 B8R0.3 COC(=O)C(O)CC#N Amb25716720 [0,2,0,0,0,0|2,0,0]=4 4477 B8R0.3 COC(=O)C(O)CCBr Amb28385691 [0,2,0,0,0,0|2,0,0]=4 4478 B8R0.3 COC(=O)C(O)CCF Amb25114455 [0,2,0,0,0,0|2,0,0]=4 4479 B8R0.3 COC(=O)C(O)CCN Amb26960420 [0,2,0,0,0,0|2,0,0]=4 4480 B8R0.3 COC(=O)C(O)CSC Amb26009506 [0,2,0,0,0,0|1,1,0]=4 4481 B8R0.3 COC(=O)N(C)CCO Amb28049300 [0,2,0,0,0,0|2,0,0]=4 4482 B8R0.3 COC(=O)[C@@H](N)CCBr Amb2695271 [0,2,0,0,0,0|1,0,0]=3 4483 B8R0.3 COC(=O)[C@@H](N)CCBr Amb4296950 [0,2,0,0,0,0|1,0,0]=3 4484 B8R0.3 COC(=O)[C@@H](N)CCI Amb27806573 [0,2,0,0,0,0|1,0,0]=3 4485 B8R0.3 COC(=O)[C@@H](N)CCN Amb25727598 [0,2,0,0,0,0|1,0,0]=3 4486 B8R0.3 COC(=O)[C@@H](N)CCN Amb32658006 [0,2,0,0,0,0|1,0,0]=3 4487 B8R0.3 COC(=O)[C@@H](N)CCO Amb24746756 [0,2,0,0,0,0|0,0,0]=2 4488 B8R0.3 COC(=O)[C@@H](N)CSC Amb15701265 [0,2,0,0,0,0|0,1,0]=3 4489 B8R0.3 COC(=O)[C@@H](N)CSC Amb17322841 [0,2,0,0,0,0|0,1,0]=3 4490 B8R0.3 COC(=O)[C@@H](O)CCN Amb25146066 [0,2,0,0,0,0|2,0,0]=4 4491 B8R0.3 COC(=O)[C@@H](O)CCN Amb33457506 [0,2,0,0,0,0|2,0,0]=4 4492 B8R0.3 COC(=O)[C@@H](O)CCO Amb27406740 [0,2,0,0,0,0|1,0,0]=3 4493 B8R0.3 COC(=O)[C@H](C)CC=O Amb28388611 [0,2,0,0,0,0|1,0,1]=4 4494 B8R0.3 COC(=O)[C@H](C)CCO Amb28134520 [0,2,0,0,0,0|1,0,0]=3 4495 B8R0.3 COC(=O)[C@H](N)CCBr Amb2695267 [0,2,0,0,0,0|1,0,0]=3 4496 B8R0.3 COC(=O)[C@H](N)CCO Amb26475851 [0,2,0,0,0,0|0,0,0]=2 4497 B8R0.3 COC(=O)[C@H](N)CON Amb27949646 [0,2,0,0,0,0|0,0,0]=2 4498 B8R0.3 COC(=O)[C@H](N)CSC Amb27788444 [0,2,0,0,0,0|0,1,0]=3 4499 B8R0.3 COC(=O)[C@H](O)CCBr Amb27863444 [0,2,0,0,0,0|2,0,0]=4 4500 B8R0.3 COC(=O)[C@H](O)CCO Amb28315513 [0,2,0,0,0,0|1,0,0]=3 4501 B8R0.3 COCC(Br)C(=O)OC Amb10070673 [0,2,0,0,0,0|1,0,0]=3 4502 B8R0.3 COCC(C)C(N)CO Amb27954927 [0,2,0,0,0,0|1,0,1]=4 4503 B8R0.3 COCC(Cl)C(=N)OC Amb27657220 [0,2,0,0,0,0|2,0,0]=4 4504 B8R0.3 COCC(Cl)C(=O)OC Amb27477958 [0,2,0,0,0,0|1,0,0]=3 4505 B8R0.3 COCC(N)C(=O)NO Amb27838499 [0,2,0,0,0,0|0,0,0]=2 4506 B8R0.3 COCC(N)C(=O)OC Amb23454660 [0,2,0,0,0,0|0,0,0]=2 4507 B8R0.3 COCC(N)C(=O)OC Amb32941874 [0,2,0,0,0,0|0,0,0]=2 4508 B8R0.3 COCC(N)C(C)OC Amb28079381 [0,2,0,0,0,0|1,0,1]=4 4509 B8R0.3 COCC(O)C(=O)OC Amb23596463 [0,2,0,0,0,0|1,0,0]=3 4510 B8R0.3 COCC(O)C(N)CO Amb28285279 [0,2,0,0,0,0|0,0,2]=4 4511 B8R0.3 COCN(C)C(=O)CO Amb27472523 [0,2,0,0,0,0|2,0,0]=4 4512 B8R0.3 COCN(C)C(=O)OC Amb27201767 [0,2,0,0,0,0|2,0,0]=4 4513 B8R0.3 COC[C@@H](N)C(=O)OC Amb33871640 [0,2,0,0,0,0|0,0,0]=2 4514 B8R0.3 COC[C@@H](O)C(=O)CO Amb27180388 [0,2,0,0,0,0|1,0,0]=3 4515 B8R0.3 COC[C@@H](O)[C@H](O)C=O Amb28121213 [0,2,0,0,0,0|1,0,1]=4 4516 B8R0.3 COC[C@H](N)C(=O)OC Amb27882809 [0,2,0,0,0,0|0,0,0]=2 4517 B8R0.3 CONC(=O)C(C)CCl Amb25258204 [0,2,0,0,0,0|2,0,0]=4 4518 B8R0.3 CONC(=O)C(C)CN Amb27758297 [0,2,0,0,0,0|2,0,0]=4 4519 B8R0.3 CONC(=O)[C@H](N)CO Amb27205229 [0,2,0,0,0,0|0,0,0]=2 4520 B8R0.3 CONC(C)C(=O)OC Amb32729489 [0,2,0,0,0,0|2,0,0]=4 4521 B8R0.3 CO[C@H](C)C(N)CCO Amb32946722 [0,2,0,0,0,0|1,0,1]=4 4522 B8R0.3 CSCC(N)C(=O)NN Amb27951018 [0,2,0,0,0,0|1,1,0]=4 4523 B8R0.3 CSCC(O)C(=O)CO Amb28141435 [0,2,0,0,0,0|1,1,0]=4 4524 B8R0.3 C\C=C/C(O)[C@H](N)CO Amb27469648 [0,2,0,0,0,0|1,0,1]=4 4525 B8R0.3 NC(CCO)C(O)C=O Amb28123154 [0,2,0,0,0,0|0,0,1]=3 4526 B8R0.3 NC(CCO)C(O)CO Amb27647506 [0,2,0,0,0,0|0,0,2]=4 4527 B8R0.3 NC(CO)C(N)CCO Amb28208485 [0,2,0,0,0,0|1,0,1]=4 4528 B8R0.3 N[C@H](CO)[C@@H](N)CCO Amb27265635 [0,2,0,0,0,0|1,0,1]=4 4529 B8R0.3 O=CCC(=O)[C@H](O)CO Amb28397444 [0,2,0,0,0,0|1,0,1]=4 4530 B8R0.3 O=CCC(O)C(O)CO Amb8513489 [0,2,0,0,0,0|1,0,1]=4 4531 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO Amb17943012 [0,2,0,0,0,0|1,0,1]=4 4532 B8R0.3 O=CC[C@H](O)[C@H](O)CO Amb2725665 [0,2,0,0,0,0|1,0,1]=4 4533 B8R0.8 C#CCCC(C)C(=O)O Amb27464960 [0,2,0,0,0,0|2,0,0]=4 4534 B8R0.8 C#CCCC(N)C(=O)O Amb6277526 [0,2,0,0,0,0|1,0,0]=3 4535 B8R0.8 C#CCCC(N)C(N)=O Amb25703121 [0,2,0,0,0,0|2,0,0]=4 4536 B8R0.8 C#CCC[C@@H](N)C(=O)O Amb24088809 [0,2,0,0,0,0|1,0,0]=3 4537 B8R0.8 C#CCC[C@H](N)C(=O)O Amb24088866 [0,2,0,0,0,0|1,0,0]=3 4538 B8R0.8 C#CCC[C@H](N)C(=O)O Amb33744060 [0,2,0,0,0,0|1,0,0]=3 4539 B8R0.8 C#CCNC(C)C(=O)O Amb9327029 [0,2,0,0,0,0|2,0,0]=4 4540 B8R0.8 C#CCN[C@H](C)C(=O)O Amb27815665 [0,2,0,0,0,0|2,0,0]=4 4541 B8R0.8 C#CCOC(C)C(=O)O Amb9208661 [0,2,0,0,0,0|2,0,0]=4 4542 B8R0.8 C#CCO[C@H](C)C(=O)O Amb28042909 [0,2,0,0,0,0|2,0,0]=4 4543 B8R0.8 C#CCSC(C)C(=O)O Amb6274343 [0,2,0,0,0,0|2,0,0]=4 4544 B8R0.8 C=C(CCCO)C(=O)O Amb28313844 [0,2,0,0,0,0|1,0,1]=4 4545 B8R0.8 C=C(CCOC)C(=O)O Amb26588153 [0,2,0,0,0,0|1,0,1]=4 4546 B8R0.8 C=C(COCC)C(=O)O Amb27444042 [0,2,0,0,0,0|1,0,1]=4 4547 B8R0.8 C=C(OCOC)C(=O)O Amb27467648 [0,2,0,0,0,0|1,0,1]=4 4548 B8R0.8 C=C=CCC(N)C(=O)O Amb25843448 [0,2,0,0,0,0|1,0,0]=3 4549 B8R0.8 C=C=CC[C@@H](N)C(=O)O Amb28070890 [0,2,0,0,0,0|1,0,0]=3 4550 B8R0.8 C=C=CC[C@@H](N)C(N)=O Amb27623437 [0,2,0,0,0,0|2,0,0]=4 4551 B8R0.8 C=CCCC(Br)C(=O)O Amb28047448 [0,2,0,0,0,0|2,0,0]=4 4552 B8R0.8 C=CCCC(C)C(=O)O Amb18642656 [0,2,0,0,0,0|2,0,0]=4 4553 B8R0.8 C=CCCC(N)C(=O)O Amb24383848 [0,2,0,0,0,0|1,0,0]=3 4554 B8R0.8 C=CCCC(N)C(=O)O Amb28934988 [0,2,0,0,0,0|1,0,0]=3 4555 B8R0.8 C=CCCC(N)C(N)=O Amb24333721 [0,2,0,0,0,0|2,0,0]=4 4556 B8R0.8 C=CCC[C@@H](N)C(=O)O Amb23439045 [0,2,0,0,0,0|1,0,0]=3 4557 B8R0.8 C=CCC[C@@H](N)C(N)=O Amb27168705 [0,2,0,0,0,0|2,0,0]=4 4558 B8R0.8 C=CCC[C@H](N)C(=O)O Amb28285244 [0,2,0,0,0,0|1,0,0]=3 4559 B8R0.8 C=CCC[C@H](O)C(=O)O Amb28122952 [0,2,0,0,0,0|2,0,0]=4 4560 B8R0.8 C=CCNC(C)C(=O)O Amb9326762 [0,2,0,0,0,0|2,0,0]=4 4561 B8R0.8 C=CCOC(C)C(=O)O Amb9208699 [0,2,0,0,0,0|2,0,0]=4 4562 B8R0.8 C=CCSC(C)C(=O)O Amb6273705 [0,2,0,0,0,0|2,0,0]=4 4563 B8R0.8 C=CSCC(N)C(=O)O Amb28321669 [0,2,0,0,0,0|0,1,0]=3 4564 B8R0.8 C=C\C=C\[C@H](N)C(=O)O Amb28324791 [0,2,0,0,0,0|1,0,1]=4 4565 B8R0.8 CC#CCC(C)C(=O)O Amb28281174 [0,2,0,0,0,0|2,0,0]=4 4566 B8R0.8 CC#CCC(N)C(=O)O Amb18988250 [0,2,0,0,0,0|1,0,0]=3 4567 B8R0.8 CC#CCC(N)C(=O)O Amb33551077 [0,2,0,0,0,0|1,0,0]=3 4568 B8R0.8 CC#CCC(N)C(N)=O Amb25793338 [0,2,0,0,0,0|2,0,0]=4 4569 B8R0.8 CC#CC[C@@H](N)C(=O)O Amb22746783 [0,2,0,0,0,0|1,0,0]=3 4570 B8R0.8 CC#CC[C@H](N)C(=O)O Amb27815040 [0,2,0,0,0,0|1,0,0]=3 4571 B8R0.8 CC(=O)C(C)CCCO Amb27628329 [0,2,0,0,0,0|2,0,0]=4 4572 B8R0.8 CC(=O)C(Cl)CCCO Amb27860344 [0,2,0,0,0,0|2,0,0]=4 4573 B8R0.8 CC(=O)[C@@H](N)CCCO Amb27835141 [0,2,0,0,0,0|1,0,0]=3 4574 B8R0.8 CC(CCC#N)C(=O)O Amb24462559 [0,2,0,0,0,0|2,0,0]=4 4575 B8R0.8 CC(CCCCl)C(=O)O Amb2720283 [0,2,0,0,0,0|2,0,0]=4 4576 B8R0.8 CC(CCCF)C(=O)O Amb25244585 [0,2,0,0,0,0|2,0,0]=4 4577 B8R0.8 CC(CCCN)C(=O)O Amb25146072 [0,2,0,0,0,0|2,0,0]=4 4578 B8R0.8 CC(CCCN)C(=O)O Amb32686960 [0,2,0,0,0,0|2,0,0]=4 4579 B8R0.8 CC(CN=C=O)C(=O)O Amb33471309 [0,2,0,0,0,0|1,0,1]=4 4580 B8R0.8 CC(CN=C=S)C(=O)O Amb33471538 [0,2,0,0,0,0|1,1,0]=4 4581 B8R0.8 CC(CNC#N)C(=O)O Amb35634505 [0,2,0,0,0,0|2,0,0]=4 4582 B8R0.8 CC(C\C=N\O)C(=O)O Amb27217284 [0,2,0,0,0,0|1,0,0]=3 4583 B8R0.8 CC(NCCS)C(=O)O Amb28057720 [0,2,0,0,0,0|1,1,0]=4 4584 B8R0.8 CC(OCC#N)C(=O)O Amb27465969 [0,2,0,0,0,0|2,0,0]=4 4585 B8R0.8 CC(OCCF)C(=O)O Amb27240801 [0,2,0,0,0,0|2,0,0]=4 4586 B8R0.8 CC(OCCN)C(=O)O Amb22546285 [0,2,0,0,0,0|2,0,0]=4 4587 B8R0.8 CC(OCCO)C(=O)O Amb6680915 [0,2,0,0,0,0|1,0,0]=3 4588 B8R0.8 CC(OCCS)C(=O)O Amb27857332 [0,2,0,0,0,0|1,1,0]=4 4589 B8R0.8 CC(SCC#N)C(=O)O Amb6260833 [0,2,0,0,0,0|2,0,0]=4 4590 B8R0.8 CC(SCCCl)C(=O)O Amb27404902 [0,2,0,0,0,0|2,0,0]=4 4591 B8R0.8 CC(SCCN)C(=O)O Amb17500447 [0,2,0,0,0,0|2,0,0]=4 4592 B8R0.8 CCCCC(Br)C(=O)O Amb9703129 [0,2,0,0,0,0|2,0,0]=4 4593 B8R0.8 CCCCC(C)C(=O)O Amb3939937 [0,2,0,0,0,0|2,0,0]=4 4594 B8R0.8 CCCCC(Cl)C(=O)O Amb17593750 [0,2,0,0,0,0|2,0,0]=4 4595 B8R0.8 CCCCC(F)C(=O)O Amb25238781 [0,2,0,0,0,0|2,0,0]=4 4596 B8R0.8 CCCCC(N)C(=O)O Amb4134813 [0,2,0,0,0,0|1,0,0]=3 4597 B8R0.8 CCCCC(N)C(C)=O Amb1099238 [0,2,0,0,0,0|2,0,0]=4 4598 B8R0.8 CCCCC(N)C(C)=O Amb22284085 [0,2,0,0,0,0|2,0,0]=4 4599 B8R0.8 CCCCC(N)C(N)=O Amb18303664 [0,2,0,0,0,0|2,0,0]=4 4600 B8R0.8 CCCCC(N)[PH](=O)O Amb27863480 [0,2,0,0,0,0|2,0,0]=4 4601 B8R0.8 CCCCC(O)C(=O)O Amb3941634 [0,2,0,0,0,0|2,0,0]=4 4602 B8R0.8 CCCCC(S)C(=O)O Amb25323873 [0,2,0,0,0,0|2,0,0]=4 4603 B8R0.8 CCCC[C@@H](C)C(=O)O Amb24590691 [0,2,0,0,0,0|2,0,0]=4 4604 B8R0.8 CCCC[C@@H](Cl)C(=O)O Amb27471038 [0,2,0,0,0,0|2,0,0]=4 4605 B8R0.8 CCCC[C@@H](N)C(=O)O Amb1995006 [0,2,0,0,0,0|1,0,0]=3 4606 B8R0.8 CCCC[C@H](Br)C(=O)O Amb28385588 [0,2,0,0,0,0|2,0,0]=4 4607 B8R0.8 CCCC[C@H](C)C(=O)O Amb25850678 [0,2,0,0,0,0|2,0,0]=4 4608 B8R0.8 CCCC[C@H](Cl)C(=O)O Amb27955265 [0,2,0,0,0,0|2,0,0]=4 4609 B8R0.8 CCCC[C@H](N)C(=O)O Amb1995007 [0,2,0,0,0,0|1,0,0]=3 4610 B8R0.8 CCCC[C@H](N)C(N)=O Amb9813732 [0,2,0,0,0,0|2,0,0]=4 4611 B8R0.8 CCCC[C@H](O)C(=O)O Amb27626002 [0,2,0,0,0,0|2,0,0]=4 4612 B8R0.8 CCCNC(C)C(=O)O Amb9326994 [0,2,0,0,0,0|2,0,0]=4 4613 B8R0.8 CCCN[C@H](C)C(=O)O Amb28073462 [0,2,0,0,0,0|2,0,0]=4 4614 B8R0.8 CCCOC(C)C(=O)O Amb8874518 [0,2,0,0,0,0|2,0,0]=4 4615 B8R0.8 CCCSC(C)C(=O)O Amb6274283 [0,2,0,0,0,0|2,0,0]=4 4616 B8R0.8 CCCSC(F)C(=O)O Amb27655346 [0,2,0,0,0,0|2,0,0]=4 4617 B8R0.8 CCCSC(N)C(=O)O Amb27865736 [0,2,0,0,0,0|1,0,0]=3 4618 B8R0.8 CCCSC(O)C(=O)O Amb27592135 [0,2,0,0,0,0|2,0,0]=4 4619 B8R0.8 CCNCC(C)C(=O)O Amb13952782 [0,2,0,0,0,0|2,0,0]=4 4620 B8R0.8 CCNCC(C)C(=O)O Amb9400285 [0,2,0,0,0,0|2,0,0]=4 4621 B8R0.8 CCOCC(Br)C(=O)O Amb28458425 [0,2,0,0,0,0|1,0,0]=3 4622 B8R0.8 CCOCC(C)C(=O)O Amb9172215 [0,2,0,0,0,0|1,0,0]=3 4623 B8R0.8 CCOCC(C)C(N)=O Amb28067564 [0,2,0,0,0,0|2,0,0]=4 4624 B8R0.8 CCOCC(N)C(=O)O Amb28048685 [0,2,0,0,0,0|0,0,0]=2 4625 B8R0.8 CCOCC(N)C(=O)O Amb33542705 [0,2,0,0,0,0|0,0,0]=2 4626 B8R0.8 CCOCC(N)C(N)=O Amb26973746 [0,2,0,0,0,0|1,0,0]=3 4627 B8R0.8 CCOC[C@@H](C)C(=O)O Amb25790635 [0,2,0,0,0,0|1,0,0]=3 4628 B8R0.8 CCOC[C@@H](N)C(=O)O Amb25889733 [0,2,0,0,0,0|0,0,0]=2 4629 B8R0.8 CCOC[C@@H](N)C(=O)O Amb30585227 [0,2,0,0,0,0|0,0,0]=2 4630 B8R0.8 CCOC[C@@H](O)C(=O)O Amb33347463 [0,2,0,0,0,0|1,0,0]=3 4631 B8R0.8 CCOC[C@H](C)C(=O)O Amb10844265 [0,2,0,0,0,0|1,0,0]=3 4632 B8R0.8 CCOC[C@H](N)C(=O)O Amb22737184 [0,2,0,0,0,0|0,0,0]=2 4633 B8R0.8 CCOC[C@H](N)C(=O)O Amb24478577 [0,2,0,0,0,0|0,0,0]=2 4634 B8R0.8 CCSCC(C)C(=O)O Amb9400067 [0,2,0,0,0,0|1,1,0]=4 4635 B8R0.8 CCSCC(N)C(=O)O Amb6257004 [0,2,0,0,0,0|0,1,0]=3 4636 B8R0.8 CCSCC(O)C(=O)O Amb27231753 [0,2,0,0,0,0|1,1,0]=4 4637 B8R0.8 CCSC[C@H](O)C(=O)O Amb27983830 [0,2,0,0,0,0|1,1,0]=4 4638 B8R0.8 CC\C=C\C(C)C(=O)O Amb33172515 [0,2,0,0,0,0|2,0,0]=4 4639 B8R0.8 CC\C=C\C(N)C(=O)O Amb33449874 [0,2,0,0,0,0|1,0,0]=3 4640 B8R0.8 CC\C=C\C(O)C(=O)O Amb27781864 [0,2,0,0,0,0|2,0,0]=4 4641 B8R0.8 CC\C=C\[C@@H](N)C(=O)O Amb27239476 [0,2,0,0,0,0|1,0,0]=3 4642 B8R0.8 COCCC(=O)C(=O)O Amb27959741 [0,2,0,0,0,0|1,0,1]=4 4643 B8R0.8 COCCC(Br)C(=O)Cl Amb27209614 [0,2,0,0,0,0|2,0,0]=4 4644 B8R0.8 COCCC(C)C(=O)O Amb18523823 [0,2,0,0,0,0|1,0,0]=3 4645 B8R0.8 COCCC(Cl)C(=O)Cl Amb28118917 [0,2,0,0,0,0|2,0,0]=4 4646 B8R0.8 COCCC(Cl)C(=O)O Amb27424361 [0,2,0,0,0,0|1,0,0]=3 4647 B8R0.8 COCCC(N)C(=O)O Amb32675454 [0,2,0,0,0,0|0,0,0]=2 4648 B8R0.8 COCCC(N)C(=O)O Amb6281324 [0,2,0,0,0,0|0,0,0]=2 4649 B8R0.8 COCCC(N)C(N)=O Amb18311365 [0,2,0,0,0,0|1,0,0]=3 4650 B8R0.8 COCCC(N)C(N)=O Amb32712112 [0,2,0,0,0,0|1,0,0]=3 4651 B8R0.8 COCCC(O)C(=O)O Amb27647966 [0,2,0,0,0,0|1,0,0]=3 4652 B8R0.8 COCCN(C)C(=O)O Amb32677018 [0,2,0,0,0,0|2,0,0]=4 4653 B8R0.8 COCC[C@@H](N)C(=O)O Amb16183870 [0,2,0,0,0,0|0,0,0]=2 4654 B8R0.8 COCC[C@H](N)C(=O)O Amb16183872 [0,2,0,0,0,0|0,0,0]=2 4655 B8R0.8 COCC[C@H](N)C(=O)O Amb24054991 [0,2,0,0,0,0|0,0,0]=2 4656 B8R0.8 COCOC(C)C(=O)O Amb28120688 [0,2,0,0,0,0|1,0,0]=3 4657 B8R0.8 COCOC(C)C(C)=O Amb24563208 [0,2,0,0,0,0|2,0,0]=4 4658 B8R0.8 COCSC(C)C(=O)O Amb28410278 [0,2,0,0,0,0|1,0,0]=3 4659 B8R0.8 COCSC(C)C(C)=O Amb28189229 [0,2,0,0,0,0|2,0,0]=4 4660 B8R0.8 COC\C=C(\Br)C(=O)O Amb24580462 [0,2,0,0,0,0|1,0,1]=4 4661 B8R0.8 COC\C=C(\C)C(=O)O Amb27169036 [0,2,0,0,0,0|1,0,1]=4 4662 B8R0.8 COC\C=C(\F)C(=O)O Amb27872029 [0,2,0,0,0,0|1,0,1]=4 4663 B8R0.8 CONCC(N)C(N)=O Amb27216151 [0,2,0,0,0,0|1,0,0]=3 4664 B8R0.8 CO\C=C\[C@@H](N)C(=O)O Amb27427471 [0,2,0,0,0,0|0,0,1]=3 4665 B8R0.8 CPOC[C@H](N)C(=O)O Amb27424475 [0,2,0,0,0,0|0,0,0]=2 4666 B8R0.8 CSCCC(C)C(=O)O Amb24739356 [0,2,0,0,0,0|1,1,0]=4 4667 B8R0.8 CSCCC(Cl)C(=O)O Amb27468599 [0,2,0,0,0,0|1,1,0]=4 4668 B8R0.8 CSCCC(N)C(=O)O Amb9703095 [0,2,0,0,0,0|0,1,0]=3 4669 B8R0.8 CSCCC(N)C(C)=O Amb28388741 [0,2,0,0,0,0|1,1,0]=4 4670 B8R0.8 CSCCC(N)C(N)=O Amb17142872 [0,2,0,0,0,0|1,1,0]=4 4671 B8R0.8 CSCCC(N)C(N)=O Amb32752921 [0,2,0,0,0,0|1,1,0]=4 4672 B8R0.8 CSCCC(O)C(=O)O Amb18304609 [0,2,0,0,0,0|1,1,0]=4 4673 B8R0.8 CSCC[C@@H](N)C(=O)O Amb2720567 [0,2,0,0,0,0|0,1,0]=3 4674 B8R0.8 CSCC[C@@H](N)C(=O)[O-] Amb32414686 [0,2,0,0,0,0|0,1,1]=4 4675 B8R0.8 CSCC[C@@H](N)C(N)=O Amb18035930 [0,2,0,0,0,0|1,1,0]=4 4676 B8R0.8 CSCC[C@@H](N)C(N)=O Amb22750575 [0,2,0,0,0,0|1,1,0]=4 4677 B8R0.8 CSCC[C@@H](O)C(=O)O Amb25124092 [0,2,0,0,0,0|1,1,0]=4 4678 B8R0.8 CSCC[C@H](Cl)C(=O)O Amb28286496 [0,2,0,0,0,0|1,1,0]=4 4679 B8R0.8 CSCC[C@H](N)C(=O)O Amb5720611 [0,2,0,0,0,0|0,1,0]=3 4680 B8R0.8 CSCC[C@H](N)C(C)=O Amb27763449 [0,2,0,0,0,0|1,1,0]=4 4681 B8R0.8 CSCC[C@H](N)C(N)=O Amb8390412 [0,2,0,0,0,0|1,1,0]=4 4682 B8R0.8 CSCC[C@H](N)C(N)=O Amb9813735 [0,2,0,0,0,0|1,1,0]=4 4683 B8R0.8 CSCC[C@H](O)C(=O)O Amb28285270 [0,2,0,0,0,0|1,1,0]=4 4684 B8R0.8 CSCOC(N)C(=O)O Amb27634144 [0,2,0,0,0,0|0,1,0]=3 4685 B8R0.8 CSCO[C@H](N)C(=O)O Amb28183053 [0,2,0,0,0,0|0,1,0]=3 4686 B8R0.8 CSOCC(N)C(=O)O Amb28285144 [0,2,0,0,0,0|0,0,0]=2 4687 B8R0.8 CSSCC(C)C(=O)O Amb27240302 [0,2,0,0,0,0|1,1,0]=4 4688 B8R0.8 CSSC[C@@H](N)C(=O)O Amb28381312 [0,2,0,0,0,0|0,1,0]=3 4689 B8R0.8 CSSC[C@H](N)C(=O)O Amb28118786 [0,2,0,0,0,0|0,1,0]=3 4690 B8R0.8 CS\C=C/[C@H](N)C(=O)O Amb26006745 [0,2,0,0,0,0|0,1,1]=4 4691 B8R0.8 CS\C=C\C(N)C(=O)O Amb27759361 [0,2,0,0,0,0|0,1,1]=4 4692 B8R0.8 C[C@@H](CCC#N)C(=O)O Amb27870712 [0,2,0,0,0,0|2,0,0]=4 4693 B8R0.8 C[C@@H](CCCN)C(=O)O Amb28314637 [0,2,0,0,0,0|2,0,0]=4 4694 B8R0.8 C[C@@H](CN=[N+]=[N-])C(=O)O Amb27955982 [0,2,0,0,0,0|2,0,0]=4 4695 B8R0.8 C[C@@H](NCCF)C(=O)O Amb28073998 [0,2,0,0,0,0|2,0,0]=4 4696 B8R0.8 C[C@@H](NCCO)C(=O)O Amb26885478 [0,2,0,0,0,0|1,0,0]=3 4697 B8R0.8 C[C@@H](OCCF)C(=O)O Amb27763930 [0,2,0,0,0,0|2,0,0]=4 4698 B8R0.8 C[C@@H](OCCO)C(=O)O Amb28318043 [0,2,0,0,0,0|1,0,0]=3 4699 B8R0.8 C[C@@H](SCCN)C(=O)O Amb27170977 [0,2,0,0,0,0|2,0,0]=4 4700 B8R0.8 C[C@H](NCC#N)C(=O)O Amb28079480 [0,2,0,0,0,0|2,0,0]=4 4701 B8R0.8 C[C@H](NCCO)C(=O)O Amb28058421 [0,2,0,0,0,0|1,0,0]=3 4702 B8R0.8 C[C@H](OCCN)C(=O)O Amb27479935 [0,2,0,0,0,0|2,0,0]=4 4703 B8R0.8 C[C@H](OCCO)C(=O)O Amb27398048 [0,2,0,0,0,0|1,0,0]=3 4704 B8R0.8 C[Se]CCC(N)C(=O)O Amb8514803 [0,2,0,0,0,0|0,1,0]=3 4705 B8R0.8 C[Se]CC[C@@H](N)C(=O)O Amb31031165 [0,2,0,0,0,0|0,1,0]=3 4706 B8R0.8 C[Se]CC[C@H](N)C(=O)O Amb8514895 [0,2,0,0,0,0|0,1,0]=3 4707 B8R0.8 C\C(=C/CON)C(=O)O Amb28207816 [0,2,0,0,0,0|1,0,1]=4 4708 B8R0.8 C\C=C\CC(C)C(=O)O Amb18642630 [0,2,0,0,0,0|2,0,0]=4 4709 B8R0.8 C\C=C\CC(F)C(=O)O Amb27959670 [0,2,0,0,0,0|2,0,0]=4 4710 B8R0.8 C\C=C\CC(N)C(=O)O Amb6256663 [0,2,0,0,0,0|1,0,0]=3 4711 B8R0.8 C\C=C\CC(N)C(N)=O Amb26904386 [0,2,0,0,0,0|2,0,0]=4 4712 B8R0.8 C\C=C\C[C@@H](N)C(=O)O Amb33065673 [0,2,0,0,0,0|1,0,0]=3 4713 B8R0.8 C\C=C\C[C@H](C)C(=O)O Amb28368854 [0,2,0,0,0,0|2,0,0]=4 4714 B8R0.8 C\C=C\C[C@H](N)C(=O)O Amb27768785 [0,2,0,0,0,0|1,0,0]=3 4715 B8R0.8 N#CCCC(Br)C(=O)O Amb27863558 [0,2,0,0,0,0|2,0,0]=4 4716 B8R0.8 N#CCCC(N)C(=O)O Amb18642589 [0,2,0,0,0,0|1,0,0]=3 4717 B8R0.8 N#CCCC(N)C(N)=O Amb26567424 [0,2,0,0,0,0|2,0,0]=4 4718 B8R0.8 N#CCCC(O)C(=O)O Amb28239951 [0,2,0,0,0,0|2,0,0]=4 4719 B8R0.8 N#CCCC([AlH5])C(=O)O Amb31132465 [0,2,0,0,0,0|2,0,0]=4 4720 B8R0.8 N#CCC[C@@H](N)C(=O)O Amb25063958 [0,2,0,0,0,0|1,0,0]=3 4721 B8R0.8 N#CCC[C@H](N)C(=O)O Amb16183912 [0,2,0,0,0,0|1,0,0]=3 4722 B8R0.8 N#CCC[C@H](O)C(=O)O Amb28144260 [0,2,0,0,0,0|2,0,0]=4 4723 B8R0.8 N#CNCC(O)C(=O)O Amb35634509 [0,2,0,0,0,0|2,0,0]=4 4724 B8R0.8 N#CNC[C@H](O)C(=O)O Amb35634507 [0,2,0,0,0,0|2,0,0]=4 4725 B8R0.8 N#CSCC(N)C(=O)O Amb17593655 [0,2,0,0,0,0|0,1,0]=3 4726 B8R0.8 N=C(NCCO)C(=O)O Amb18124348 [0,2,0,0,0,0|0,0,2]=4 4727 B8R0.8 NC(=O)C(N)CCCF Amb27424739 [0,2,0,0,0,0|2,0,0]=4 4728 B8R0.8 NC(=O)C(N)CCCO Amb33066182 [0,2,0,0,0,0|1,0,0]=3 4729 B8R0.8 NC(=O)C(N)C\C=C\Cl Amb27860856 [0,2,0,0,0,0|2,0,0]=4 4730 B8R0.8 NC(CCCBr)C(=O)O Amb24480263 [0,2,0,0,0,0|1,0,0]=3 4731 B8R0.8 NC(CCCF)C(=O)O Amb25366994 [0,2,0,0,0,0|1,0,0]=3 4732 B8R0.8 NC(CCCO)C(=O)O Amb18642915 [0,2,0,0,0,0|0,0,0]=2 4733 B8R0.8 NC(CCCO)C(=O)O Amb22900028 [0,2,0,0,0,0|0,0,0]=2 4734 B8R0.8 NC(CCCS)C(=O)O Amb27947968 [0,2,0,0,0,0|0,1,0]=3 4735 B8R0.8 NC(CCNO)C(=O)O Amb28285114 [0,2,0,0,0,0|0,0,0]=2 4736 B8R0.8 NC(CN=C=S)C(=O)O Amb28281778 [0,2,0,0,0,0|0,1,0]=3 4737 B8R0.8 NC(C\C=C\Br)C(=O)O Amb27607572 [0,2,0,0,0,0|1,0,0]=3 4738 B8R0.8 NC(C\C=C\Cl)C(=O)O Amb33037023 [0,2,0,0,0,0|1,0,0]=3 4739 B8R0.8 NCCCC(Br)C(=O)O Amb17595166 [0,2,0,0,0,0|2,0,0]=4 4740 B8R0.8 NCCCC(F)C(=O)O Amb27235092 [0,2,0,0,0,0|2,0,0]=4 4741 B8R0.8 NCCCC(N)C(=O)O Amb22489477 [0,2,0,0,0,0|1,0,0]=3 4742 B8R0.8 NCCCC(N)C(=O)O Amb4006442 [0,2,0,0,0,0|1,0,0]=3 4743 B8R0.8 NCCCC(N)C(=O)O Amb9173756 [0,2,0,0,0,0|1,0,0]=3 4744 B8R0.8 NCCCC(N)C(N)=O Amb24118008 [0,2,0,0,0,0|2,0,0]=4 4745 B8R0.8 NCCCC(N)[PH](=O)O Amb27645413 [0,2,0,0,0,0|2,0,0]=4 4746 B8R0.8 NCCC[C@@H](N)C(=O)O Amb32411789 [0,2,0,0,0,0|1,0,0]=3 4747 B8R0.8 NCCC[C@@H](N)C(=O)O Amb6600152 [0,2,0,0,0,0|1,0,0]=3 4748 B8R0.8 NCCC[C@@H](N)C(=O)O Amb8390415 [0,2,0,0,0,0|1,0,0]=3 4749 B8R0.8 NCCC[C@H](N)C(=O)O Amb20240598 [0,2,0,0,0,0|1,0,0]=3 4750 B8R0.8 NCCC[C@H](N)C(=O)O Amb22746434 [0,2,0,0,0,0|1,0,0]=3 4751 B8R0.8 NCCC[C@H](N)C(=O)O Amb8513279 [0,2,0,0,0,0|1,0,0]=3 4752 B8R0.8 NCCC[C@H](N)C(=O)O Amb8627869 [0,2,0,0,0,0|1,0,0]=3 4753 B8R0.8 NCCC[C@H](O)C(=O)O Amb27804309 [0,2,0,0,0,0|2,0,0]=4 4754 B8R0.8 NCOCC(N)C(=O)O Amb27429950 [0,2,0,0,0,0|0,0,0]=2 4755 B8R0.8 NCOC[C@@H](N)C(=O)O Amb27233969 [0,2,0,0,0,0|0,0,0]=2 4756 B8R0.8 NC\C=C\[C@H](N)C(=O)O Amb24580033 [0,2,0,0,0,0|1,0,0]=3 4757 B8R0.8 NOCCC(N)C(=O)O Amb17593409 [0,2,0,0,0,0|0,0,0]=2 4758 B8R0.8 NOCCC(N)C(=O)O Amb21858490 [0,2,0,0,0,0|0,0,0]=2 4759 B8R0.8 NOCC[C@H](N)C(=O)O Amb26346874 [0,2,0,0,0,0|0,0,0]=2 4760 B8R0.8 NOCC[C@H](N)C(=O)O Amb33038084 [0,2,0,0,0,0|0,0,0]=2 4761 B8R0.8 N[C@@H](CCCCl)C(=O)O Amb27227989 [0,2,0,0,0,0|1,0,0]=3 4762 B8R0.8 N[C@@H](CCCF)C(=O)O Amb27223043 [0,2,0,0,0,0|1,0,0]=3 4763 B8R0.8 N[C@@H](CCCO)C(=O)O Amb16183887 [0,2,0,0,0,0|0,0,0]=2 4764 B8R0.8 N[C@@H](CCNO)C(=O)O Amb24117852 [0,2,0,0,0,0|0,0,0]=2 4765 B8R0.8 N[C@@H](CSCO)C(=O)O Amb27470985 [0,2,0,0,0,0|0,0,0]=2 4766 B8R0.8 N[C@@H](CSN=O)C(=O)O Amb28182982 [0,2,0,0,0,0|0,0,1]=3 4767 B8R0.8 N[C@@H](C\C=C\Cl)C(=O)O Amb33065741 [0,2,0,0,0,0|1,0,0]=3 4768 B8R0.8 N[C@H](CCCBr)C(=O)O Amb26080278 [0,2,0,0,0,0|1,0,0]=3 4769 B8R0.8 N[C@H](CCCF)C(=O)O Amb26908418 [0,2,0,0,0,0|1,0,0]=3 4770 B8R0.8 N[C@H](CCCO)C(=O)O Amb28120579 [0,2,0,0,0,0|0,0,0]=2 4771 B8R0.8 N[C@H](CCCO)C(=O)O Amb34913429 [0,2,0,0,0,0|0,0,0]=2 4772 B8R0.8 N[C@H](CSN=O)C(=O)O Amb27845439 [0,2,0,0,0,0|0,0,1]=3 4773 B8R0.8 N[C@H](C\C=C\Cl)C(=O)O Amb33309034 [0,2,0,0,0,0|1,0,0]=3 4774 B8R0.8 O=C(O)C(=O)CCCO Amb27470301 [0,2,0,0,0,0|1,0,1]=4 4775 B8R0.8 O=C(O)C(=O)CCCO Amb30666618 [0,2,0,0,0,0|1,0,1]=4 4776 B8R0.8 O=C(O)C(Br)CCCCl Amb17595866 [0,2,0,0,0,0|2,0,0]=4 4777 B8R0.8 O=C(O)C(Br)CCCO Amb28313364 [0,2,0,0,0,0|1,0,0]=3 4778 B8R0.8 O=C(O)C(O)CC#CBr Amb27634839 [0,2,0,0,0,0|2,0,0]=4 4779 B8R0.8 O=C(O)C(O)CCCF Amb33196454 [0,2,0,0,0,0|2,0,0]=4 4780 B8R0.8 O=C(O)C(O)CCCO Amb18642939 [0,2,0,0,0,0|1,0,0]=3 4781 B8R0.8 O=C(O)[C@H](F)CN=C=S Amb33471626 [0,2,0,0,0,0|1,1,0]=4 4782 B8R0.8 O=C([O-])C(O)CCCO Amb28935028 [0,2,0,0,0,0|1,0,1]=4 4783 B8R0.8 O=C=NC[C@@H](F)C(=O)O Amb33037069 [0,2,0,0,0,0|1,0,1]=4 4784 B8R0.8 O=CNC[C@@H](O)C(=O)O Amb27637039 [0,2,0,0,0,0|1,0,1]=4 4785 B8R0.8 O=COCC(Cl)C(=O)O Amb27477082 [0,2,0,0,0,0|1,0,0]=3 4786 B8R0.8 [N-]=[N+]=NCC(N)C(=O)O Amb28342834 [0,2,0,0,0,0|1,0,0]=3 4787 B8R0.8 [N-]=[N+]=NCC(N)C(=O)O Amb35752605 [0,2,0,0,0,0|1,0,0]=3 4788 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O Amb26007532 [0,2,0,0,0,0|1,0,0]=3 4789 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O Amb33734276 [0,2,0,0,0,0|1,0,0]=3 4790 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O Amb25072668 [0,2,0,0,0,0|1,0,0]=3 4791 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O Amb30586485 [0,2,0,0,0,0|1,0,0]=3 4792 B8R0.12 C#CCC(C)(C)C(=O)O Amb18636154 [0,2,0,0,0,0|2,0,0]=4 4793 B8R0.12 C#CC[C@](C)(N)C(=O)O Amb16183909 [0,2,0,0,0,0|1,0,0]=3 4794 B8R0.12 C=CCC(C)(C)C(=O)O Amb10603495 [0,2,0,0,0,0|2,0,0]=4 4795 B8R0.12 C=CCC(C)(N)[PH](=O)O Amb27595680 [0,2,0,0,0,0|2,0,0]=4 4796 B8R0.12 C=CCC(F)(F)C(=O)O Amb10982503 [0,2,0,0,0,0|2,0,0]=4 4797 B8R0.12 C=CC[C@@](C)(N)C(=O)O Amb8389450 [0,2,0,0,0,0|1,0,0]=3 4798 B8R0.12 C=CC[C@@](C)(N)C(N)=O Amb27851367 [0,2,0,0,0,0|2,0,0]=4 4799 B8R0.12 C=CC[C@@](C)(O)C(=O)O Amb27412350 [0,2,0,0,0,0|2,0,0]=4 4800 B8R0.12 C=CC[C@](C)(N)C(=O)O Amb8514992 [0,2,0,0,0,0|1,0,0]=3 4801 B8R0.12 C=CC[C@](C)(O)C(=O)O Amb27958223 [0,2,0,0,0,0|2,0,0]=4 4802 B8R0.12 CC(=O)C(C)(C)CCO Amb27838668 [0,2,0,0,0,0|2,0,0]=4 4803 B8R0.12 CC(=O)C(F)(F)CCO Amb27476544 [0,2,0,0,0,0|2,0,0]=4 4804 B8R0.12 CC(C)(CC#N)C(=O)O Amb33545085 [0,2,0,0,0,0|2,0,0]=4 4805 B8R0.12 CC(C)(CCCl)C(=O)O Amb27953901 [0,2,0,0,0,0|2,0,0]=4 4806 B8R0.12 CC(C)(CCF)C(=O)O Amb27838513 [0,2,0,0,0,0|2,0,0]=4 4807 B8R0.12 CC(C)(CCN)C(=O)O Amb2694929 [0,2,0,0,0,0|2,0,0]=4 4808 B8R0.12 CC(C)(CCN)C(=O)O Amb8630069 [0,2,0,0,0,0|2,0,0]=4 4809 B8R0.12 CC(C)(CCO)C(=O)O Amb24763728 [0,2,0,0,0,0|1,0,0]=3 4810 B8R0.12 CC(C)(CCO)C(=O)[O-] Amb29083409 [0,2,0,0,0,0|1,0,1]=4 4811 B8R0.12 CC(N)(CCCl)C(N)=O Amb25887461 [0,2,0,0,0,0|2,0,0]=4 4812 B8R0.12 CC(N)(CCF)C(=O)O Amb27961476 [0,2,0,0,0,0|1,0,0]=3 4813 B8R0.12 CC(N)(CCF)C(=O)O Amb28934998 [0,2,0,0,0,0|1,0,0]=3 4814 B8R0.12 CC(N)(CCO)C(N)=O Amb30013972 [0,2,0,0,0,0|1,0,0]=3 4815 B8R0.12 CC(O)(CC#N)C(=O)O Amb27260344 [0,2,0,0,0,0|2,0,0]=4 4816 B8R0.12 CC(O)(CCF)C(=O)O Amb33379277 [0,2,0,0,0,0|2,0,0]=4 4817 B8R0.12 CCCC(C)(C)C(=O)O Amb2720786 [0,2,0,0,0,0|2,0,0]=4 4818 B8R0.12 CCCC(C)(Cl)C(=O)O Amb17593751 [0,2,0,0,0,0|2,0,0]=4 4819 B8R0.12 CCCC(C)(F)C(=O)O Amb27797327 [0,2,0,0,0,0|2,0,0]=4 4820 B8R0.12 CCCC(C)(N)C(=O)O Amb9720287 [0,2,0,0,0,0|1,0,0]=3 4821 B8R0.12 CCCC(C)(O)C(=O)O Amb18288835 [0,2,0,0,0,0|2,0,0]=4 4822 B8R0.12 CCCC(Cl)(Cl)C(=O)O Amb2720219 [0,2,0,0,0,0|2,0,0]=4 4823 B8R0.12 CCCC(F)(F)C(=O)O Amb19929277 [0,2,0,0,0,0|2,0,0]=4 4824 B8R0.12 CCC[C@@](C)(N)C(=O)O Amb2699127 [0,2,0,0,0,0|1,0,0]=3 4825 B8R0.12 CCC[C@](C)(N)C(=O)O Amb16232632 [0,2,0,0,0,0|1,0,0]=3 4826 B8R0.12 CCNC(C)(C)C(=O)O Amb13952777 [0,2,0,0,0,0|2,0,0]=4 4827 B8R0.12 CCNC(C)(C)C(=O)O Amb9619876 [0,2,0,0,0,0|2,0,0]=4 4828 B8R0.12 CCOC(C)(C)C(=O)O Amb18976723 [0,2,0,0,0,0|2,0,0]=4 4829 B8R0.12 CCOC(Cl)(Cl)C(=O)O Amb27422864 [0,2,0,0,0,0|2,0,0]=4 4830 B8R0.12 CCSC(C)(C)C(=O)O Amb17501487 [0,2,0,0,0,0|2,0,0]=4 4831 B8R0.12 CCSC(F)(F)C(=O)O Amb28182780 [0,2,0,0,0,0|2,0,0]=4 4832 B8R0.12 CNCC(C)(C)C(=O)O Amb26557784 [0,2,0,0,0,0|2,0,0]=4 4833 B8R0.12 CNCC(C)(C)C(=O)O Amb33249638 [0,2,0,0,0,0|2,0,0]=4 4834 B8R0.12 CNCC(C)(O)C(=O)O Amb27478763 [0,2,0,0,0,0|2,0,0]=4 4835 B8R0.12 CNCC(F)(F)C(=O)O Amb22497225 [0,2,0,0,0,0|2,0,0]=4 4836 B8R0.12 CNCC(F)(F)C(=O)O Amb22523480 [0,2,0,0,0,0|2,0,0]=4 4837 B8R0.12 CNC[C@@](C)(N)C(=O)O Amb27975719 [0,2,0,0,0,0|1,0,0]=3 4838 B8R0.12 CNC[C@](C)(N)C(=O)O Amb25882845 [0,2,0,0,0,0|1,0,0]=3 4839 B8R0.12 COCC(C)(C)C(=O)O Amb10608195 [0,2,0,0,0,0|1,0,0]=3 4840 B8R0.12 COCC(C)(N)C(=O)O Amb18990135 [0,2,0,0,0,0|0,0,0]=2 4841 B8R0.12 COCC(C)(N)C(=O)O Amb20622455 [0,2,0,0,0,0|0,0,0]=2 4842 B8R0.12 COCC(C)(N)C(C)O Amb35742367 [0,2,0,0,0,0|1,0,1]=4 4843 B8R0.12 COCC(C)(N)C(N)=O Amb18298766 [0,2,0,0,0,0|1,0,0]=3 4844 B8R0.12 COCC(C)(N)C(N)=O Amb19515079 [0,2,0,0,0,0|1,0,0]=3 4845 B8R0.12 COCC(C)(O)C(=O)O Amb18992608 [0,2,0,0,0,0|1,0,0]=3 4846 B8R0.12 COCC(C)(O)C(C)=O Amb27598932 [0,2,0,0,0,0|2,0,0]=4 4847 B8R0.12 COCC(C)(O)C(N)=O Amb27460227 [0,2,0,0,0,0|2,0,0]=4 4848 B8R0.12 COCC(F)(F)C(=O)O Amb24518571 [0,2,0,0,0,0|1,0,0]=3 4849 B8R0.12 COC[C@](C)(N)C(=O)O Amb24568285 [0,2,0,0,0,0|0,0,0]=2 4850 B8R0.12 CSCC(C)(C)C(=O)O Amb18124874 [0,2,0,0,0,0|1,1,0]=4 4851 B8R0.12 CSCC(C)(N)C(=O)O Amb18294541 [0,2,0,0,0,0|0,1,0]=3 4852 B8R0.12 CSCC(F)(F)C(=O)O Amb23590987 [0,2,0,0,0,0|1,1,0]=4 4853 B8R0.12 C[C@@](N)(CCO)C(=O)O Amb28048736 [0,2,0,0,0,0|0,0,0]=2 4854 B8R0.12 C[C@](N)(CCN)C(=O)O Amb25348479 [0,2,0,0,0,0|1,0,0]=3 4855 B8R0.12 C\C=C\C(C)(N)C(=O)O Amb24671255 [0,2,0,0,0,0|1,0,1]=4 4856 B8R0.12 N#CCC(F)(F)C(=O)O Amb27186473 [0,2,0,0,0,0|2,0,0]=4 4857 B8R0.12 NCCC(F)(F)C(=O)O Amb2697352 [0,2,0,0,0,0|2,0,0]=4 4858 B8R0.12 NCCC(F)(F)C(=O)O Amb31378944 [0,2,0,0,0,0|2,0,0]=4 4859 B8R0.12 NOCC(F)(F)C(=O)O Amb33171236 [0,2,0,0,0,0|1,0,0]=3 4860 B8R0.12 O=C(O)C(F)(F)CCF Amb32811300 [0,2,0,0,0,0|2,0,0]=4 4861 B8R0.12 O=C(O)C(F)(F)CNO Amb33170566 [0,2,0,0,0,0|1,0,0]=3 4862 B8R0.12 O=C(O)P(=O)([O-])OCO Amb28399018 [0,2,0,0,0,0|2,0,0]=4 4863 B8R0.14 CC(CCO)P(=O)(O)O Amb28125457 [0,2,0,0,0,0|2,0,0]=4 4864 B8R0.14 CCCC(N)P(=O)(O)O Amb8516011 [0,2,0,0,0,0|2,0,0]=4 4865 B8R0.14 CCCC(N)S(=O)(=O)O Amb28075743 [0,2,0,0,0,0|2,0,0]=4 4866 B8R0.14 COCC(N)C(C)(C)O Amb33214882 [0,2,0,0,0,0|1,0,1]=4 4867 B8R0.14 C[C@H](CCO)P(=O)(O)O Amb27765916 [0,2,0,0,0,0|2,0,0]=4 4868 B8R0.14 N[C@@H](CCO)P(=O)(O)O Amb27424703 [0,2,0,0,0,0|1,0,0]=3 4869 B8R0.15 C#CCC(C#N)C(=O)O Amb35741463 [0,2,0,0,0,0|1,0,1]=4 4870 B8R0.15 C#CC[C@H](CC)C(=O)O Amb28120786 [0,2,0,0,0,0|2,0,0]=4 4871 B8R0.15 C=CC(SCC)C(=O)O Amb27757608 [0,2,0,0,0,0|2,0,0]=4 4872 B8R0.15 C=CCC(C#N)C(=O)O Amb27657209 [0,2,0,0,0,0|1,0,1]=4 4873 B8R0.15 C=CCC(C=O)C(=O)O Amb28313315 [0,2,0,0,0,0|2,0,0]=4 4874 B8R0.15 C=CCC(CC)C(=O)O Amb18642632 [0,2,0,0,0,0|2,0,0]=4 4875 B8R0.15 C=CCC(NO)C(=O)O Amb27768789 [0,2,0,0,0,0|1,0,0]=3 4876 B8R0.15 C=CC[C@@H](C=C)C(=O)O Amb28285259 [0,2,0,0,0,0|2,0,0]=4 4877 B8R0.15 C=C[C@@H](CCC)C(=O)O Amb27658640 [0,2,0,0,0,0|2,0,0]=4 4878 B8R0.15 CCC(CCF)C(=O)O Amb26321627 [0,2,0,0,0,0|2,0,0]=4 4879 B8R0.15 CCC(CCN)C(=O)O Amb24699884 [0,2,0,0,0,0|1,0,0]=3 4880 B8R0.15 CCC(CCN)C(=O)O Amb32662662 [0,2,0,0,0,0|1,0,0]=3 4881 B8R0.15 CCC(CCO)C(=O)O Amb18642884 [0,2,0,0,0,0|1,0,0]=3 4882 B8R0.15 CCC(COC)C(=O)O Amb18124352 [0,2,0,0,0,0|1,0,0]=3 4883 B8R0.15 CCC(COC)C(C)=O Amb27593031 [0,2,0,0,0,0|2,0,0]=4 4884 B8R0.15 CCC(CSC)C(=O)O Amb33272061 [0,2,0,0,0,0|1,1,0]=4 4885 B8R0.15 CCC(N=C=O)C(=O)O Amb33471298 [0,2,0,0,0,0|1,0,1]=4 4886 B8R0.15 CCC(N=C=S)C(=O)O Amb27265491 [0,2,0,0,0,0|1,0,1]=4 4887 B8R0.15 CCC(NC#N)C(=O)O Amb35634498 [0,2,0,0,0,0|1,0,0]=3 4888 B8R0.15 CCC(NC=O)C(=O)O Amb4016839 [0,2,0,0,0,0|1,0,0]=3 4889 B8R0.15 CCC(SSC)C(=O)O Amb27236075 [0,2,0,0,0,0|2,0,0]=4 4890 B8R0.15 CCCC(C=O)C(=O)O Amb27464964 [0,2,0,0,0,0|2,0,0]=4 4891 B8R0.15 CCCC(CC)C(=O)O Amb19009626 [0,2,0,0,0,0|2,0,0]=4 4892 B8R0.15 CCCC(CF)C(=O)O Amb27186472 [0,2,0,0,0,0|2,0,0]=4 4893 B8R0.15 CCCC(CN)C(=O)O Amb19373497 [0,2,0,0,0,0|1,0,0]=3 4894 B8R0.15 CCCC(CO)C(=O)O Amb25881510 [0,2,0,0,0,0|1,0,0]=3 4895 B8R0.15 CCCC(NC)C(=O)O Amb21961534 [0,2,0,0,0,0|1,0,0]=3 4896 B8R0.15 CCCC(NC)C(=O)O Amb22587444 [0,2,0,0,0,0|1,0,0]=3 4897 B8R0.15 CCCC(NC)C(=O)O Amb9496293 [0,2,0,0,0,0|1,0,0]=3 4898 B8R0.15 CCCC(NC)C(N)=O Amb19006602 [0,2,0,0,0,0|2,0,0]=4 4899 B8R0.15 CCCC(NO)C(=O)O Amb22372057 [0,2,0,0,0,0|1,0,0]=3 4900 B8R0.15 CCCC(OC)C(=O)O Amb8455302 [0,2,0,0,0,0|2,0,0]=4 4901 B8R0.15 CCCC(SC)C(=O)O Amb28289849 [0,2,0,0,0,0|2,0,0]=4 4902 B8R0.15 CCC[C@@H](CO)C(=O)O Amb24571859 [0,2,0,0,0,0|1,0,0]=3 4903 B8R0.15 CCC[C@@H](NC)C(=O)O Amb25771939 [0,2,0,0,0,0|1,0,0]=3 4904 B8R0.15 CCC[C@@H](NC)C(=O)O Amb33801471 [0,2,0,0,0,0|1,0,0]=3 4905 B8R0.15 CCC[C@H](CN)C(=O)O Amb27460612 [0,2,0,0,0,0|1,0,0]=3 4906 B8R0.15 CCC[C@H](CO)C(=O)O Amb25063310 [0,2,0,0,0,0|1,0,0]=3 4907 B8R0.15 CCC[C@H](NC)C(=O)O Amb25062610 [0,2,0,0,0,0|1,0,0]=3 4908 B8R0.15 CCC[C@H](NC)C(=O)O Amb33456398 [0,2,0,0,0,0|1,0,0]=3 4909 B8R0.15 CCC[C@H](NC)C(N)=O Amb27475077 [0,2,0,0,0,0|2,0,0]=4 4910 B8R0.15 CCNC(CC)C(=O)O Amb33339265 [0,2,0,0,0,0|1,0,0]=3 4911 B8R0.15 CCNC(CC)C(=O)O Amb9620054 [0,2,0,0,0,0|1,0,0]=3 4912 B8R0.15 CCNC(CC)C(N)=O Amb19006590 [0,2,0,0,0,0|2,0,0]=4 4913 B8R0.15 CCN[C@@H](CC)C(=O)O Amb26019582 [0,2,0,0,0,0|1,0,0]=3 4914 B8R0.15 CCN[C@H](CC)C(=O)O Amb33347493 [0,2,0,0,0,0|1,0,0]=3 4915 B8R0.15 CCOC(CC)C(=O)O Amb9675410 [0,2,0,0,0,0|2,0,0]=4 4916 B8R0.15 CCOC(CS)C(=O)O Amb19037339 [0,2,0,0,0,0|1,1,0]=4 4917 B8R0.15 CCSC(CC)C(=O)O Amb9675503 [0,2,0,0,0,0|2,0,0]=4 4918 B8R0.15 CC[C@@H](N=C=O)C(=O)O Amb33471357 [0,2,0,0,0,0|1,0,1]=4 4919 B8R0.15 CC[C@@H](N=C=S)C(=O)O Amb33471337 [0,2,0,0,0,0|1,0,1]=4 4920 B8R0.15 CC[C@@H](NC#N)C(=O)O Amb35634501 [0,2,0,0,0,0|1,0,0]=3 4921 B8R0.15 CC[C@@H](NC#N)C(N)=O Amb27426551 [0,2,0,0,0,0|2,0,0]=4 4922 B8R0.15 CC[C@H](CCN)C(=O)O Amb27754665 [0,2,0,0,0,0|1,0,0]=3 4923 B8R0.15 CC[C@H](NC#N)C(=O)O Amb35634500 [0,2,0,0,0,0|1,0,0]=3 4924 B8R0.15 CNC(CCO)C(=O)O Amb27390592 [0,2,0,0,0,0|0,0,0]=2 4925 B8R0.15 CNC(CCO)C(C)O Amb27849768 [0,2,0,0,0,0|1,0,1]=4 4926 B8R0.15 CNC(COC)C(=O)O Amb19304133 [0,2,0,0,0,0|0,0,0]=2 4927 B8R0.15 CNC(COC)C(=O)O Amb22059040 [0,2,0,0,0,0|0,0,0]=2 4928 B8R0.15 CNC(COC)C(N)=O Amb24120142 [0,2,0,0,0,0|1,0,0]=3 4929 B8R0.15 CNC(COC)C(N)=O Amb32666305 [0,2,0,0,0,0|1,0,0]=3 4930 B8R0.15 CNCC(C#N)C(=O)O Amb25756304 [0,2,0,0,0,0|1,0,1]=4 4931 B8R0.15 CNCC(CO)C(=O)O Amb26352745 [0,2,0,0,0,0|0,0,0]=2 4932 B8R0.15 CNCC(CO)C(=O)O Amb32661056 [0,2,0,0,0,0|0,0,0]=2 4933 B8R0.15 CN[C@@H](COC)C(N)=O Amb26458948 [0,2,0,0,0,0|1,0,0]=3 4934 B8R0.15 CN[C@@H](COC)C(N)=O Amb28935003 [0,2,0,0,0,0|1,0,0]=3 4935 B8R0.15 CN[C@H](CCO)[C@H](C)O Amb27489692 [0,2,0,0,0,0|1,0,1]=4 4936 B8R0.15 CN[C@H](COC)C(=O)O Amb33347473 [0,2,0,0,0,0|0,0,0]=2 4937 B8R0.15 CN[C@H](COC)C(N)=O Amb26507221 [0,2,0,0,0,0|1,0,0]=3 4938 B8R0.15 CN[C@H](COC)C(N)=O Amb32661128 [0,2,0,0,0,0|1,0,0]=3 4939 B8R0.15 COC(CC#N)C(=O)O Amb27157791 [0,2,0,0,0,0|2,0,0]=4 4940 B8R0.15 COC(CCF)C(=O)O Amb33379286 [0,2,0,0,0,0|2,0,0]=4 4941 B8R0.15 COC(CCN)C(=O)O Amb26631814 [0,2,0,0,0,0|2,0,0]=4 4942 B8R0.15 COC(CCN)C(=O)O Amb32661022 [0,2,0,0,0,0|2,0,0]=4 4943 B8R0.15 COCC(CN)C(=O)O Amb27219429 [0,2,0,0,0,0|0,0,0]=2 4944 B8R0.15 COCC(NO)C(=O)O Amb27247213 [0,2,0,0,0,0|0,0,0]=2 4945 B8R0.15 COCC(OC)C(=O)O Amb26627988 [0,2,0,0,0,0|1,0,0]=3 4946 B8R0.15 COCC(ON)C(=O)O Amb27251693 [0,2,0,0,0,0|0,0,0]=2 4947 B8R0.15 COCC(ON)C(=O)O Amb32670944 [0,2,0,0,0,0|0,0,0]=2 4948 B8R0.15 COCC(SC)C(=O)O Amb28046503 [0,2,0,0,0,0|1,0,0]=3 4949 B8R0.15 CSCC(CN)C(=O)O Amb33272062 [0,2,0,0,0,0|0,1,0]=3 4950 B8R0.15 C\C=C\[C@@H](CC)C(=O)O Amb28388676 [0,2,0,0,0,0|2,0,0]=4 4951 B8R0.15 C\C=N\[C@H](CO)C(=O)O Amb28423512 [0,2,0,0,0,0|0,0,1]=3 4952 B8R0.15 N#CC(CCF)C(=O)O Amb35741465 [0,2,0,0,0,0|1,0,1]=4 4953 B8R0.15 N#CC(CCO)C(=O)O Amb35741464 [0,2,0,0,0,0|0,0,1]=3 4954 B8R0.15 N#CC(NC=O)C(=O)O Amb27444484 [0,2,0,0,0,0|1,0,1]=4 4955 B8R0.15 N#CCC(C#N)C(=O)O Amb35621636 [0,2,0,0,0,0|1,0,1]=4 4956 B8R0.15 N#CNC(CO)C(=O)O Amb35634506 [0,2,0,0,0,0|0,0,0]=2 4957 B8R0.15 N#CN[C@@H](CO)C(=O)O Amb35634510 [0,2,0,0,0,0|0,0,0]=2 4958 B8R0.15 N#CN[C@H](CO)C(=O)O Amb35634508 [0,2,0,0,0,0|0,0,0]=2 4959 B8R0.15 NCC(CCF)C(=O)O Amb33196465 [0,2,0,0,0,0|1,0,0]=3 4960 B8R0.15 NC\C=C(/CO)C(=O)O Amb27214653 [0,2,0,0,0,0|0,0,1]=3 4961 B8R0.15 O=C(O)C(CO)CCF Amb27876842 [0,2,0,0,0,0|1,0,0]=3 4962 B8R0.15 O=C(O)C(CS)CCS Amb27477377 [0,2,0,0,0,0|1,1,0]=4 4963 B8R0.15 O=C(O)C(CS)N=C=S Amb33471524 [0,2,0,0,0,0|0,1,1]=4 4964 B8R0.15 O=C(O)[C@H](CS)NCO Amb27980938 [0,2,0,0,0,0|0,1,0]=3 4965 B8R0.15 O=C(O)\C(=C\CO)CO Amb27494197 [0,2,0,0,0,0|1,0,1]=4 4966 B8R0.15 O=C=NC(CS)C(=O)O Amb33471296 [0,2,0,0,0,0|0,1,1]=4 4967 B8R0.15 O=CNC(CO)C(=O)O Amb18290435 [0,2,0,0,0,0|0,0,0]=2 4968 B8R0.15 O=CNC(CS)C(=O)O Amb20093366 [0,2,0,0,0,0|0,1,0]=3 4969 B8R0.15 O=CN[C@H](CO)C(=O)O Amb28248397 [0,2,0,0,0,0|0,0,0]=2 4970 B8R0.15 [N-]=[N+]=NC(CN)C(=O)O Amb27876138 [0,2,0,0,0,0|1,0,1]=4 4971 B8R0.15 [N-]=[N+]=N[C@@H](CN)C(=O)O Amb27173531 [0,2,0,0,0,0|1,0,1]=4 4972 B8R0.15 [N-]=[N+]=N[C@@H](CO)C(=O)O Amb27956143 [0,2,0,0,0,0|0,0,1]=3 4973 B8R0.15 [N-]=[N+]=N[C@@H](CO)C(=O)O Amb32620210 [0,2,0,0,0,0|0,0,1]=3 4974 B8R0.15 [N-]=[N+]=N[C@H](CN)C(=O)O Amb27791957 [0,2,0,0,0,0|1,0,1]=4 4975 B8R0.15 [N-]=[N+]=N[C@H](CO)C(=O)O Amb32620243 [0,2,0,0,0,0|0,0,1]=3 4976 B8R0.13 C#CC(C)(O)C(N)CO Amb27205875 [0,2,0,0,0,0|1,0,1]=4 4977 B8R0.13 C=CC(=O)C(C)(C)CO Amb33200315 [0,2,0,0,0,0|2,0,0]=4 4978 B8R0.13 C=CC(C)(N)C(=O)OC Amb27393739 [0,2,0,0,0,0|1,0,1]=4 4979 B8R0.13 CC(C)(CCl)C(=O)NO Amb591297 [0,2,0,0,0,0|2,0,0]=4 4980 B8R0.13 CC(C)(CO)C(=N)NO Amb27167634 [0,2,0,0,0,0|2,0,0]=4 4981 B8R0.13 CC(C)(CO)C(=O)CCl Amb25368330 [0,2,0,0,0,0|2,0,0]=4 4982 B8R0.13 CC(C)(CO)C(=O)CN Amb33200370 [0,2,0,0,0,0|2,0,0]=4 4983 B8R0.13 CC(C)(CO)C(=O)NN Amb28280318 [0,2,0,0,0,0|2,0,0]=4 4984 B8R0.13 CC(C)(CO)C(N)CO Amb26589164 [0,2,0,0,0,0|1,0,1]=4 4985 B8R0.13 CC(C)(CO)[C@@H](N)CO Amb26536693 [0,2,0,0,0,0|1,0,1]=4 4986 B8R0.13 CC(C)(CO)[C@H](N)CO Amb26570574 [0,2,0,0,0,0|1,0,1]=4 4987 B8R0.13 CC(O)(CO)C(=O)CO Amb28253704 [0,2,0,0,0,0|1,0,0]=3 4988 B8R0.13 CCC(=O)C(C)(N)CC Amb28399663 [0,2,0,0,0,0|2,0,0]=4 4989 B8R0.13 CCC(=O)C(C)(O)CO Amb27629462 [0,2,0,0,0,0|2,0,0]=4 4990 B8R0.13 CCC(C)(Br)C(=O)OC Amb24643650 [0,2,0,0,0,0|2,0,0]=4 4991 B8R0.13 CCC(C)(C)C(=O)CO Amb27779511 [0,2,0,0,0,0|2,0,0]=4 4992 B8R0.13 CCC(C)(C)C(=O)OC Amb27399795 [0,2,0,0,0,0|2,0,0]=4 4993 B8R0.13 CCC(C)(Cl)C(=O)OC Amb25889480 [0,2,0,0,0,0|2,0,0]=4 4994 B8R0.13 CCC(C)(N)C(=O)CCl Amb24697911 [0,2,0,0,0,0|2,0,0]=4 4995 B8R0.13 CCC(C)(N)C(=O)CCl Amb32667487 [0,2,0,0,0,0|2,0,0]=4 4996 B8R0.13 CCC(C)(N)C(=O)NC Amb27838536 [0,2,0,0,0,0|2,0,0]=4 4997 B8R0.13 CCC(C)(N)C(=O)NN Amb27838535 [0,2,0,0,0,0|2,0,0]=4 4998 B8R0.13 CCC(C)(N)C(=O)NO Amb28285161 [0,2,0,0,0,0|1,0,0]=3 4999 B8R0.13 CCC(C)(N)C(=O)OC Amb18288973 [0,2,0,0,0,0|1,0,0]=3 5000 B8R0.13 CCC(C)(N)C(=O)OC Amb19514608 [0,2,0,0,0,0|1,0,0]=3 5001 B8R0.13 CCC(C)(N)\C(C)=N\O Amb27231530 [0,2,0,0,0,0|2,0,0]=4 5002 B8R0.13 CCC(C)(N)\C(N)=N\O Amb25147191 [0,2,0,0,0,0|2,0,0]=4 5003 B8R0.13 CCC(C)(O)C(=O)CO Amb26626775 [0,2,0,0,0,0|2,0,0]=4 5004 B8R0.13 CCC(C)(O)C(=O)OC Amb24116777 [0,2,0,0,0,0|2,0,0]=4 5005 B8R0.13 CCC(N)P(=O)(O)OC Amb27424631 [0,2,0,0,0,0|2,0,0]=4 5006 B8R0.13 CC[C@@H](N)P(=O)(O)OC Amb27238648 [0,2,0,0,0,0|2,0,0]=4 5007 B8R0.13 CC[C@@](C)(N)C(=O)OC Amb26505426 [0,2,0,0,0,0|1,0,0]=3 5008 B8R0.13 CC[C@@](C)(O)[C@H](N)CO Amb27169949 [0,2,0,0,0,0|1,0,1]=4 5009 B8R0.13 CC[C@](C)(N)C(=O)OC Amb19888376 [0,2,0,0,0,0|1,0,0]=3 5010 B8R0.13 CNC(=O)C(C)(O)CO Amb27181205 [0,2,0,0,0,0|2,0,0]=4 5011 B8R0.13 COC(=O)C(C)(Br)CBr Amb4018445 [0,2,0,0,0,0|2,0,0]=4 5012 B8R0.13 COC(=O)C(C)(Br)CCl Amb24459877 [0,2,0,0,0,0|2,0,0]=4 5013 B8R0.13 COC(=O)C(C)(C)CBr Amb27607611 [0,2,0,0,0,0|2,0,0]=4 5014 B8R0.13 COC(=O)C(C)(C)CCl Amb18090829 [0,2,0,0,0,0|2,0,0]=4 5015 B8R0.13 COC(=O)C(C)(C)CF Amb28199173 [0,2,0,0,0,0|2,0,0]=4 5016 B8R0.13 COC(=O)C(C)(C)CI Amb22232804 [0,2,0,0,0,0|2,0,0]=4 5017 B8R0.13 COC(=O)C(C)(C)CN Amb18993084 [0,2,0,0,0,0|2,0,0]=4 5018 B8R0.13 COC(=O)C(C)(C)CN Amb6751910 [0,2,0,0,0,0|2,0,0]=4 5019 B8R0.13 COC(=O)C(C)(C)CO Amb3939118 [0,2,0,0,0,0|1,0,0]=3 5020 B8R0.13 COC(=O)C(C)(C)CS Amb28344432 [0,2,0,0,0,0|1,1,0]=4 5021 B8R0.13 COC(=O)C(C)(C)NO Amb24417546 [0,2,0,0,0,0|2,0,0]=4 5022 B8R0.13 COC(=O)C(C)(Cl)CCl Amb27808891 [0,2,0,0,0,0|2,0,0]=4 5023 B8R0.13 COC(=O)C(C)(F)CBr Amb19149270 [0,2,0,0,0,0|2,0,0]=4 5024 B8R0.13 COC(=O)C(C)(F)CCl Amb27619149 [0,2,0,0,0,0|2,0,0]=4 5025 B8R0.13 COC(=O)C(C)(N)CCl Amb28322103 [0,2,0,0,0,0|1,0,0]=3 5026 B8R0.13 COC(=O)C(C)(N)CO Amb18642913 [0,2,0,0,0,0|0,0,0]=2 5027 B8R0.13 COC(=O)C(C)(N)CO Amb28989684 [0,2,0,0,0,0|0,0,0]=2 5028 B8R0.13 COC(=O)C(C)(N)CS Amb27424653 [0,2,0,0,0,0|0,1,0]=3 5029 B8R0.13 COC(=O)C(C)(O)CCl Amb19373528 [0,2,0,0,0,0|2,0,0]=4 5030 B8R0.13 COC(=O)C(C)(O)CN Amb26630722 [0,2,0,0,0,0|2,0,0]=4 5031 B8R0.13 COC(=O)C(C)(O)CN Amb33164085 [0,2,0,0,0,0|2,0,0]=4 5032 B8R0.13 COC(=O)C(C)(O)CS Amb27476392 [0,2,0,0,0,0|1,1,0]=4 5033 B8R0.13 COC(=O)C(F)(F)CBr Amb25300769 [0,2,0,0,0,0|2,0,0]=4 5034 B8R0.13 COC(=O)C(F)(F)CN Amb26971535 [0,2,0,0,0,0|2,0,0]=4 5035 B8R0.13 COC(=O)C(F)(F)CN Amb30585225 [0,2,0,0,0,0|2,0,0]=4 5036 B8R0.13 COC(=O)[C@@](C)(N)CN Amb27181158 [0,2,0,0,0,0|1,0,0]=3 5037 B8R0.13 COC(=O)[C@@](C)(N)CO Amb25146070 [0,2,0,0,0,0|0,0,0]=2 5038 B8R0.13 COC(=O)[C@@](C)(O)CO Amb17613070 [0,2,0,0,0,0|1,0,0]=3 5039 B8R0.13 COC(=O)[C@](C)(N)CS Amb27638446 [0,2,0,0,0,0|0,1,0]=3 5040 B8R0.13 COC(C)C(C)(N)CO Amb28352349 [0,2,0,0,0,0|1,0,1]=4 5041 B8R0.13 C[C@@](O)(CO)[C@@H](O)C=O Amb28286662 [0,2,0,0,0,0|1,0,1]=4 5042 B8R0.13 C[C@](O)(CO)[C@@H](O)C=O Amb28401409 [0,2,0,0,0,0|1,0,1]=4 5043 B8R0.13 NC(CO)C(F)(F)CO Amb27768677 [0,2,0,0,0,0|1,0,1]=4 5044 B8R0.13 NCC(F)(F)C(=O)NO Amb27631719 [0,2,0,0,0,0|2,0,0]=4 5045 B8R0.13 NNC(=O)C(F)(F)CO Amb33169872 [0,2,0,0,0,0|2,0,0]=4 5046 B8R0.13 N[C@@H](CO)C(F)(F)CO Amb28053328 [0,2,0,0,0,0|1,0,1]=4 5047 B8R0.13 O=CC(O)(O)C(O)CO Amb27208401 [0,2,0,0,0,0|1,0,1]=4 5048 B8R0.13 O=CC(O)(O)[C@H](O)CO Amb27782465 [0,2,0,0,0,0|1,0,1]=4 5049 B8R0.20 C#CC(=O)C(CC)NC Amb35681968 [0,2,0,0,0,0|2,0,0]=4 5050 B8R0.20 C=C[C@H](NC)C(=O)OC Amb27628533 [0,2,0,0,0,0|1,0,1]=4 5051 B8R0.20 CCC(C)\C(C=O)=C\O Amb27838676 [0,2,0,0,0,0|2,0,0]=4 5052 B8R0.20 CCC(C)\C(C=O)=N\O Amb28287725 [0,2,0,0,0,0|2,0,0]=4 5053 B8R0.20 CCC(CC)C(=O)NO Amb6263030 [0,2,0,0,0,0|2,0,0]=4 5054 B8R0.20 CCC(CC)C(=O)OC Amb4019616 [0,2,0,0,0,0|2,0,0]=4 5055 B8R0.20 CCC(CN)C(=O)OC Amb24698179 [0,2,0,0,0,0|1,0,0]=3 5056 B8R0.20 CCC(CN)C(=O)OC Amb28935005 [0,2,0,0,0,0|1,0,0]=3 5057 B8R0.20 CCC(CN)C(O)C=O Amb25225405 [0,2,0,0,0,0|1,0,1]=4 5058 B8R0.20 CCC(CO)C(=O)OC Amb27750479 [0,2,0,0,0,0|1,0,0]=3 5059 B8R0.20 CCC(NC)C(=O)NO Amb35727246 [0,2,0,0,0,0|1,0,0]=3 5060 B8R0.20 CCC(NC)C(=O)OC Amb19516943 [0,2,0,0,0,0|1,0,0]=3 5061 B8R0.20 CCC(NC)C(=O)OC Amb33549577 [0,2,0,0,0,0|1,0,0]=3 5062 B8R0.20 CCC(NN)C(=O)OC Amb27592417 [0,2,0,0,0,0|1,0,0]=3 5063 B8R0.20 CCC(NO)C(=O)OC Amb27764822 [0,2,0,0,0,0|1,0,0]=3 5064 B8R0.20 CCC(OC)C(=O)NO Amb27665087 [0,2,0,0,0,0|2,0,0]=4 5065 B8R0.20 CCC(OC)C(=O)OC Amb8455373 [0,2,0,0,0,0|2,0,0]=4 5066 B8R0.20 CCC(OC)C(N)CO Amb27841395 [0,2,0,0,0,0|1,0,1]=4 5067 B8R0.20 CCC(OC)[C@@H](N)CO Amb33326025 [0,2,0,0,0,0|1,0,1]=4 5068 B8R0.20 CCC(OC)[C@H](N)CO Amb33326026 [0,2,0,0,0,0|1,0,1]=4 5069 B8R0.20 CCC(ON)C(=O)OC Amb28125809 [0,2,0,0,0,0|1,0,0]=3 5070 B8R0.20 CCC(SC)C(=O)NO Amb27614102 [0,2,0,0,0,0|2,0,0]=4 5071 B8R0.20 CC[C@@H](CN)C(=O)OC Amb25046723 [0,2,0,0,0,0|1,0,0]=3 5072 B8R0.20 CC[C@@H](CN)C(=O)OC Amb33482739 [0,2,0,0,0,0|1,0,0]=3 5073 B8R0.20 CC[C@@H](CO)C(=O)OC Amb27660097 [0,2,0,0,0,0|1,0,0]=3 5074 B8R0.20 CC[C@@H](NC)C(=O)OC Amb28057526 [0,2,0,0,0,0|1,0,0]=3 5075 B8R0.20 CC[C@H](C)\C(C=O)=C\O Amb27446671 [0,2,0,0,0,0|2,0,0]=4 5076 B8R0.20 CC[C@H](CN)C(=O)OC Amb25921089 [0,2,0,0,0,0|1,0,0]=3 5077 B8R0.20 CC[C@H](CN)C(=O)OC Amb33482740 [0,2,0,0,0,0|1,0,0]=3 5078 B8R0.20 CC[C@H](NC)C(=O)OC Amb26610759 [0,2,0,0,0,0|1,0,0]=3 5079 B8R0.20 CC[C@H](NC)C(=O)OC Amb33038477 [0,2,0,0,0,0|1,0,0]=3 5080 B8R0.20 CNC(CCl)C(=O)OC Amb27463058 [0,2,0,0,0,0|1,0,0]=3 5081 B8R0.20 CNC(CN)C(=O)OC Amb27617811 [0,2,0,0,0,0|1,0,0]=3 5082 B8R0.20 CN[C@@H](CO)C(=O)OC Amb24116973 [0,2,0,0,0,0|0,0,0]=2 5083 B8R0.20 COC(=O)C(C#N)CO Amb35624575 [0,2,0,0,0,0|0,0,1]=3 5084 B8R0.20 COC(=O)C(CBr)CBr Amb8517185 [0,2,0,0,0,0|2,0,0]=4 5085 B8R0.20 COC(=O)C(CN)CF Amb24663335 [0,2,0,0,0,0|1,0,0]=3 5086 B8R0.20 COC(=O)C(CN)CN Amb22436786 [0,2,0,0,0,0|1,0,0]=3 5087 B8R0.20 COC(=O)C(CN)OC Amb24440902 [0,2,0,0,0,0|2,0,0]=4 5088 B8R0.20 COC(=O)C(CN)OC Amb32661097 [0,2,0,0,0,0|2,0,0]=4 5089 B8R0.20 COC(=O)C(CN)ON Amb27766827 [0,2,0,0,0,0|1,0,0]=3 5090 B8R0.20 COC(=O)N(CO)CO Amb28457844 [0,2,0,0,0,0|2,0,0]=4 5091 B8R0.20 COC(=O)[C@@H](CN)OC Amb28364169 [0,2,0,0,0,0|2,0,0]=4 5092 B8R0.20 COC(=O)[C@H](CN)OC Amb28344815 [0,2,0,0,0,0|2,0,0]=4 5093 B8R0.20 COC(=O)[C@H](CN)OC Amb32679868 [0,2,0,0,0,0|2,0,0]=4 5094 B8R0.20 COC(OC)C(N)CO Amb33341992 [0,2,0,0,0,0|0,0,2]=4 5095 B8R0.20 COC(OC)[C@@H](N)CO Amb33342066 [0,2,0,0,0,0|0,0,2]=4 5096 B8R0.20 COC(OC)[C@H](N)CO Amb33340605 [0,2,0,0,0,0|0,0,2]=4 5097 B8R0.20 CO[C@@H](C=O)[C@H](O)CO Amb27267116 [0,2,0,0,0,0|1,0,1]=4 5098 B8R0.20 [C-]#[N+]C(CC)C(=O)OC Amb27807220 [0,2,0,0,0,0|1,0,1]=4 5099 B8R0.17 CC(C)(O)C(C)(N)CO Amb27400055 [0,2,0,0,0,0|1,0,1]=4 5100 B8R0.17 CC(S)(CO)S(=O)(=O)O Amb27761666 [0,2,0,0,0,0|2,0,0]=4 5101 B8R0.17 CCC(N)(S)P(=O)(O)O Amb27238645 [0,2,0,0,0,0|2,0,0]=4 5102 B8R0.36 C#CC(O)(CC)C(=O)O Amb27249849 [0,2,0,0,0,0|2,0,0]=4 5103 B8R0.36 C=C(C)C(C)(CN)CO Amb33199605 [0,2,0,0,0,0|2,0,0]=4 5104 B8R0.36 C=CC(C)(CC)C(=O)O Amb26346491 [0,2,0,0,0,0|2,0,0]=4 5105 B8R0.36 C=CC(N)(CO)C(=O)O Amb18642831 [0,2,0,0,0,0|0,0,0]=2 5106 B8R0.36 C=C[C@@](N)(CC)C(=O)O Amb27814518 [0,2,0,0,0,0|1,0,0]=3 5107 B8R0.36 C=C[C@](C)(CC)C(=O)O Amb27971483 [0,2,0,0,0,0|2,0,0]=4 5108 B8R0.36 C=C[C@](N)(CC)C(=O)O Amb27462806 [0,2,0,0,0,0|1,0,0]=3 5109 B8R0.36 CC(CF)(CF)C(=O)O Amb22497450 [0,2,0,0,0,0|2,0,0]=4 5110 B8R0.36 CC(CO)(CO)C(=O)O Amb8513406 [0,2,0,0,0,0|1,0,0]=3 5111 B8R0.36 CCC(Br)(CC)C(=O)O Amb18127183 [0,2,0,0,0,0|2,0,0]=4 5112 B8R0.36 CCC(C)(C#N)C(=O)O Amb33544489 [0,2,0,0,0,0|1,0,1]=4 5113 B8R0.36 CCC(C)(CBr)C(=O)O Amb27954835 [0,2,0,0,0,0|2,0,0]=4 5114 B8R0.36 CCC(C)(CC)C(=O)O Amb16232089 [0,2,0,0,0,0|2,0,0]=4 5115 B8R0.36 CCC(C)(CN)C(=O)O Amb22157184 [0,2,0,0,0,0|1,0,0]=3 5116 B8R0.36 CCC(C)(CO)C(=O)O Amb25367931 [0,2,0,0,0,0|1,0,0]=3 5117 B8R0.36 CCC(C)(CS)C(=O)O Amb27945586 [0,2,0,0,0,0|1,1,0]=4 5118 B8R0.36 CCC(C)(C[NH3+])C(=O)O Amb28555365 [0,2,0,0,0,0|1,0,1]=4 5119 B8R0.36 CCC(C)(OC)C(=O)O Amb8455321 [0,2,0,0,0,0|2,0,0]=4 5120 B8R0.36 CCC(F)(CC)C(=O)O Amb24120633 [0,2,0,0,0,0|2,0,0]=4 5121 B8R0.36 CCC(N)(CC)C(=O)O Amb33550775 [0,2,0,0,0,0|1,0,0]=3 5122 B8R0.36 CCC(N)(CC)C(=O)O Amb4134829 [0,2,0,0,0,0|1,0,0]=3 5123 B8R0.36 CCC(N)(CC)C(N)=O Amb13952025 [0,2,0,0,0,0|2,0,0]=4 5124 B8R0.36 CCC(N)(CC)C(N)=O Amb18288980 [0,2,0,0,0,0|2,0,0]=4 5125 B8R0.36 CCC(N)(CN)C(=O)O Amb27875677 [0,2,0,0,0,0|1,0,0]=3 5126 B8R0.36 CCC(N)(CO)C(N)=O Amb27413827 [0,2,0,0,0,0|1,0,0]=3 5127 B8R0.36 CCC(O)(CC)C(=O)O Amb8513562 [0,2,0,0,0,0|2,0,0]=4 5128 B8R0.36 CCC(O)(CCl)C(=O)O Amb27801584 [0,2,0,0,0,0|2,0,0]=4 5129 B8R0.36 CCC(O)(CO)C(C)=O Amb27482846 [0,2,0,0,0,0|2,0,0]=4 5130 B8R0.36 CCC(O)(SC)C(=O)O Amb27262602 [0,2,0,0,0,0|2,0,0]=4 5131 B8R0.36 CC[C@](C)(C#N)C(=O)O Amb28187166 [0,2,0,0,0,0|1,0,1]=4 5132 B8R0.36 CC[C@](N)(CS)C(=O)O Amb27778924 [0,2,0,0,0,0|0,1,0]=3 5133 B8R0.36 CC[C@](O)(CBr)C(=O)O Amb27955829 [0,2,0,0,0,0|2,0,0]=4 5134 B8R0.36 CNC(C)(CO)C(=O)O Amb27165182 [0,2,0,0,0,0|0,0,0]=2 5135 B8R0.36 CSC(C)(CN)C(=O)O Amb27210830 [0,2,0,0,0,0|2,0,0]=4 5136 B8R0.36 CSC(C)(CS)C(=O)O Amb27865545 [0,2,0,0,0,0|1,1,0]=4 5137 B8R0.36 NC(CF)(CF)C(=O)O Amb24117510 [0,2,0,0,0,0|1,0,0]=3 5138 B8R0.36 NC(CO)(CO)C(=O)O Amb28072904 [0,2,0,0,0,0|0,0,0]=2 5139 B8R0.36 NCC(O)(CF)C(=O)O Amb27646382 [0,2,0,0,0,0|1,0,0]=3 5140 B8R0.36 NC[C@](O)(CF)C(=O)O Amb27168661 [0,2,0,0,0,0|1,0,0]=3 5141 B8R0.36 O=C(O)C(O)(CCl)CCl Amb27645421 [0,2,0,0,0,0|2,0,0]=4 5142 B8R0.36 O=C(O)C(O)(CF)CF Amb27663870 [0,2,0,0,0,0|2,0,0]=4 5143 B8R0.37 CC(=O)C(C)(O)C(C)O Amb28246397 [0,2,0,0,0,0|2,0,0]=4 5144 B8R0.37 CC(=O)[C@@](C)(O)[C@H](C)O Amb28321993 [0,2,0,0,0,0|2,0,0]=4 5145 B8R0.37 CC(Br)C(C)(Br)C(=O)O Amb2612513 [0,2,0,0,0,0|2,0,0]=4 5146 B8R0.37 CC(C)(C(=O)O)C(=O)O Amb2613653 [0,2,0,0,0,0|1,0,1]=4 5147 B8R0.37 CC(C)(C(=O)O)C(Cl)Cl Amb27461230 [0,2,0,0,0,0|2,0,0]=4 5148 B8R0.37 CC(C)(C(=O)O)C(F)F Amb28935029 [0,2,0,0,0,0|2,0,0]=4 5149 B8R0.37 CC(C)C(C)(C)C(=O)O Amb17593377 [0,2,0,0,0,0|2,0,0]=4 5150 B8R0.37 CC(C)C(C)(N)C(=O)O Amb4134845 [0,2,0,0,0,0|1,0,0]=3 5151 B8R0.37 CC(C)C(C)(N)C(N)=O Amb8384332 [0,2,0,0,0,0|2,0,0]=4 5152 B8R0.37 CC(C)C(C)(O)C(=O)O Amb18286212 [0,2,0,0,0,0|2,0,0]=4 5153 B8R0.37 CC(C)C(F)(F)C(=O)O Amb26019477 [0,2,0,0,0,0|2,0,0]=4 5154 B8R0.37 CC(C)[C@@](C)(N)C(=O)O Amb16183901 [0,2,0,0,0,0|1,0,0]=3 5155 B8R0.37 CC(C)[C@@](C)(N)C(N)=O Amb25886638 [0,2,0,0,0,0|2,0,0]=4 5156 B8R0.37 CC(C)[C@](C)(N)C(=O)O Amb10603127 [0,2,0,0,0,0|1,0,0]=3 5157 B8R0.37 CC(C)[C@](C)(N)C(N)=O Amb25132092 [0,2,0,0,0,0|2,0,0]=4 5158 B8R0.37 CC(C)[C@](C)(O)C(=O)O Amb16231522 [0,2,0,0,0,0|2,0,0]=4 5159 B8R0.37 CC(Cl)C(C)(O)C(=O)O Amb27243989 [0,2,0,0,0,0|2,0,0]=4 5160 B8R0.37 CC(Cl)C(Cl)(Cl)C(=O)O Amb22168920 [0,2,0,0,0,0|2,0,0]=4 5161 B8R0.37 CC(F)C(F)(F)C(=O)O Amb26315929 [0,2,0,0,0,0|2,0,0]=4 5162 B8R0.37 CC(N)(C(=O)O)C(=O)O Amb28347069 [0,2,0,0,0,0|0,0,1]=3 5163 B8R0.37 CC(N)(C(=O)O)C(F)F Amb26502497 [0,2,0,0,0,0|1,0,0]=3 5164 B8R0.37 CC(N)(C(=O)O)C(F)F Amb33328723 [0,2,0,0,0,0|1,0,0]=3 5165 B8R0.37 CC(N)(C(N)=O)C(=O)O Amb27593792 [0,2,0,0,0,0|0,0,2]=4 5166 B8R0.37 CC(N)(C(N)=O)C(F)F Amb27236529 [0,2,0,0,0,0|2,0,0]=4 5167 B8R0.37 CC(N)C(C)(C)C(=O)O Amb24681858 [0,2,0,0,0,0|2,0,0]=4 5168 B8R0.37 CC(N)C(F)(F)C(=O)O Amb25188946 [0,2,0,0,0,0|2,0,0]=4 5169 B8R0.37 CC(O)C(C)(C)C(=O)O Amb18961474 [0,2,0,0,0,0|1,0,0]=3 5170 B8R0.37 CC(O)C(C)(N)C(=O)O Amb2780038 [0,2,0,0,0,0|0,0,0]=2 5171 B8R0.37 CC(O)C(C)(N)C(=O)O Amb30585196 [0,2,0,0,0,0|0,0,0]=2 5172 B8R0.37 CC(O)C(C)(O)C(=O)O Amb18124401 [0,2,0,0,0,0|1,0,0]=3 5173 B8R0.37 CC(O)C(F)(F)C(=O)O Amb30623506 [0,2,0,0,0,0|1,0,0]=3 5174 B8R0.37 C[C@@H](F)[C@@](C)(N)C(=O)O Amb26917123 [0,2,0,0,0,0|1,0,0]=3 5175 B8R0.37 C[C@@H](O)[C@@](C)(N)C(=O)O Amb26458741 [0,2,0,0,0,0|0,0,0]=2 5176 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O Amb27776914 [0,2,0,0,0,0|0,0,0]=2 5177 B8R0.37 C[C@@](N)(C(=O)O)C(F)F Amb25107781 [0,2,0,0,0,0|1,0,0]=3 5178 B8R0.37 C[C@H](N)C(F)(F)C(=O)O Amb28457233 [0,2,0,0,0,0|2,0,0]=4 5179 B8R0.37 C[C@H](O)[C@@](C)(N)C(=O)O Amb22232016 [0,2,0,0,0,0|0,0,0]=2 5180 B8R0.37 C[C@H](O)[C@](C)(N)C(=O)O Amb26390846 [0,2,0,0,0,0|0,0,0]=2 5181 B8R0.37 C[C@H](O)[C@](C)(O)C(=O)O Amb27974163 [0,2,0,0,0,0|1,0,0]=3 5182 B8R0.37 O=C(O)C(Cl)(Cl)C(=O)O Amb17594338 [0,2,0,0,0,0|1,0,1]=4 5183 B8R0.37 O=C(O)C(F)(F)C(=O)O Amb24088375 [0,2,0,0,0,0|1,0,1]=4 5184 B8R0.37 O=C(O)C(F)(F)C(F)Br Amb10839241 [0,2,0,0,0,0|2,0,0]=4 5185 B8R0.37 O=C(O)C(F)(F)C(F)Cl Amb17594051 [0,2,0,0,0,0|2,0,0]=4 5186 B8R0.37 O=C(O)C(F)(F)C(F)F Amb2690535 [0,2,0,0,0,0|2,0,0]=4 5187 B8R0.37 O=C(O)C(O)(Br)C(=O)O Amb27634888 [0,2,0,0,0,0|1,0,1]=4 5188 B8R0.37 O=C(O)C(O)(O)C(=O)O Amb22002022 [0,2,0,0,0,0|1,0,1]=4 5189 B8R0.26 CCC(CN)P(=O)(O)O Amb28146001 [0,2,0,0,0,0|2,0,0]=4 5190 B8R0.26 CCC(CO)P(=O)(O)O Amb27196393 [0,2,0,0,0,0|2,0,0]=4 5191 B8R0.26 NCC(CO)S(=O)(=O)O Amb27783090 [0,2,0,0,0,0|1,0,0]=3 5192 B8R0.27 CC(=O)C(Cl)C(C)(C)O Amb25933618 [0,2,0,0,0,0|2,0,0]=4 5193 B8R0.27 CC(=O)C(N)P(=O)(O)O Amb27835752 [0,2,0,0,0,0|2,0,0]=4 5194 B8R0.27 CC(=O)C(O)C(C)(C)O Amb17593385 [0,2,0,0,0,0|2,0,0]=4 5195 B8R0.27 CC(C(=O)O)C(C)(C)C Amb4477144 [0,2,0,0,0,0|2,0,0]=4 5196 B8R0.27 CC(C(=O)O)C(C)(C)F Amb10843986 [0,2,0,0,0,0|2,0,0]=4 5197 B8R0.27 CC(C(=O)O)C(C)(C)N Amb24459511 [0,2,0,0,0,0|2,0,0]=4 5198 B8R0.27 CC(C(=O)O)C(C)(C)O Amb10844263 [0,2,0,0,0,0|1,0,0]=3 5199 B8R0.27 CC(C(=O)O)C(C)(F)F Amb27626900 [0,2,0,0,0,0|2,0,0]=4 5200 B8R0.27 CC(C(=O)O)C(F)(F)F Amb19148979 [0,2,0,0,0,0|2,0,0]=4 5201 B8R0.27 CC(C(=O)O)P(=O)(O)O Amb9814224 [0,2,0,0,0,0|2,0,0]=4 5202 B8R0.27 CC(C(=O)O)S(=O)(=O)O Amb25765487 [0,2,0,0,0,0|2,0,0]=4 5203 B8R0.27 CC(C)(Br)C(Br)C(=O)O Amb16192461 [0,2,0,0,0,0|2,0,0]=4 5204 B8R0.27 CC(C)(C)C(Br)C(=O)O Amb18127181 [0,2,0,0,0,0|2,0,0]=4 5205 B8R0.27 CC(C)(C)C(F)C(=O)O Amb28285305 [0,2,0,0,0,0|2,0,0]=4 5206 B8R0.27 CC(C)(C)C(N)C(=O)O Amb493874 [0,2,0,0,0,0|1,0,0]=3 5207 B8R0.27 CC(C)(C)C(N)C(=O)O Amb9747344 [0,2,0,0,0,0|1,0,0]=3 5208 B8R0.27 CC(C)(C)C(N)C(N)=O Amb18281879 [0,2,0,0,0,0|2,0,0]=4 5209 B8R0.27 CC(C)(C)C(N)C(N)=O Amb19373321 [0,2,0,0,0,0|2,0,0]=4 5210 B8R0.27 CC(C)(C)C(O)C(=O)O Amb19299856 [0,2,0,0,0,0|2,0,0]=4 5211 B8R0.27 CC(C)(C)C(S)C(=O)O Amb27880919 [0,2,0,0,0,0|2,0,0]=4 5212 B8R0.27 CC(C)(C)[C@@H](Br)C(=O)O Amb22746895 [0,2,0,0,0,0|2,0,0]=4 5213 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O Amb22744938 [0,2,0,0,0,0|1,0,0]=3 5214 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O Amb8513330 [0,2,0,0,0,0|1,0,0]=3 5215 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22754654 [0,2,0,0,0,0|2,0,0]=4 5216 B8R0.27 CC(C)(C)[C@@H](N)C(N)=O Amb22899171 [0,2,0,0,0,0|2,0,0]=4 5217 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O Amb22225174 [0,2,0,0,0,0|2,0,0]=4 5218 B8R0.27 CC(C)(C)[C@H](Br)C(=O)O Amb22226488 [0,2,0,0,0,0|2,0,0]=4 5219 B8R0.27 CC(C)(C)[C@H](Cl)C(=O)O Amb3429554 [0,2,0,0,0,0|2,0,0]=4 5220 B8R0.27 CC(C)(C)[C@H](N)C(=O)O Amb2720519 [0,2,0,0,0,0|1,0,0]=3 5221 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb24271101 [0,2,0,0,0,0|2,0,0]=4 5222 B8R0.27 CC(C)(C)[C@H](N)C(N)=O Amb25215486 [0,2,0,0,0,0|2,0,0]=4 5223 B8R0.27 CC(C)(C)[C@H](O)C(=O)O Amb10603129 [0,2,0,0,0,0|2,0,0]=4 5224 B8R0.27 CC(C)(Cl)C(Cl)C(=O)O Amb18126746 [0,2,0,0,0,0|2,0,0]=4 5225 B8R0.27 CC(C)(Cl)C(N)C(N)=O Amb28069484 [0,2,0,0,0,0|2,0,0]=4 5226 B8R0.27 CC(C)(Cl)C(O)C(=O)O Amb27232684 [0,2,0,0,0,0|2,0,0]=4 5227 B8R0.27 CC(C)(F)C(Br)C(=O)O Amb10605635 [0,2,0,0,0,0|2,0,0]=4 5228 B8R0.27 CC(C)(F)C(N)C(=O)O Amb2695553 [0,2,0,0,0,0|1,0,0]=3 5229 B8R0.27 CC(C)(F)C(O)C(=O)O Amb25868881 [0,2,0,0,0,0|2,0,0]=4 5230 B8R0.27 CC(C)(F)[C@@H](N)C(=O)O Amb27599060 [0,2,0,0,0,0|1,0,0]=3 5231 B8R0.27 CC(C)(F)[C@@H](N)C(=O)O Amb30666687 [0,2,0,0,0,0|1,0,0]=3 5232 B8R0.27 CC(C)(F)[C@@H](O)C(=O)O Amb27660747 [0,2,0,0,0,0|2,0,0]=4 5233 B8R0.27 CC(C)(F)[C@H](N)C(=O)O Amb24369670 [0,2,0,0,0,0|1,0,0]=3 5234 B8R0.27 CC(C)(N)C(F)C(=O)O Amb33036292 [0,2,0,0,0,0|2,0,0]=4 5235 B8R0.27 CC(C)(N)C(O)C(=O)O Amb25075483 [0,2,0,0,0,0|2,0,0]=4 5236 B8R0.27 CC(C)(O)C(Br)C(=O)O Amb17595209 [0,2,0,0,0,0|1,0,0]=3 5237 B8R0.27 CC(C)(O)C(F)C(=O)O Amb32664861 [0,2,0,0,0,0|1,0,0]=3 5238 B8R0.27 CC(C)(O)C(N)C(=O)O Amb18642914 [0,2,0,0,0,0|0,0,0]=2 5239 B8R0.27 CC(C)(O)C(O)C(=O)O Amb25118477 [0,2,0,0,0,0|1,0,0]=3 5240 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O Amb8389457 [0,2,0,0,0,0|0,0,0]=2 5241 B8R0.27 CC(C)(O)[C@@H](O)C(=O)O Amb27974877 [0,2,0,0,0,0|1,0,0]=3 5242 B8R0.27 CC(C)(O)[C@H](N)C(=O)O Amb33872154 [0,2,0,0,0,0|0,0,0]=2 5243 B8R0.27 CC(C)(O)[C@H](N)C(=O)O Amb8397144 [0,2,0,0,0,0|0,0,0]=2 5244 B8R0.27 CC(C)(O)[C@H](O)C(=O)O Amb27469612 [0,2,0,0,0,0|1,0,0]=3 5245 B8R0.27 CC(C)(S)C(N)C(=O)O Amb4006839 [0,2,0,0,0,0|0,1,0]=3 5246 B8R0.27 CC(C)(S)C(N)C(=O)O Amb9703216 [0,2,0,0,0,0|0,1,0]=3 5247 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O Amb28524814 [0,2,0,0,0,0|0,1,0]=3 5248 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O Amb533607 [0,2,0,0,0,0|0,1,0]=3 5249 B8R0.27 CC(C)(S)[C@H](N)C(=O)O Amb2709386 [0,2,0,0,0,0|0,1,0]=3 5250 B8R0.27 CC(C)C(N)P(=O)(O)O Amb2719706 [0,2,0,0,0,0|2,0,0]=4 5251 B8R0.27 CC(C)C(N)S(=O)(=O)O Amb25918816 [0,2,0,0,0,0|2,0,0]=4 5252 B8R0.27 CC(C)[C@@H](N)P(=O)(O)O Amb8517217 [0,2,0,0,0,0|2,0,0]=4 5253 B8R0.27 CC(C)[C@H](N)P(=O)(O)O Amb8517216 [0,2,0,0,0,0|2,0,0]=4 5254 B8R0.27 CC(F)(F)C(F)C(=O)O Amb32675224 [0,2,0,0,0,0|2,0,0]=4 5255 B8R0.27 CC(F)(F)C(N)C(=O)O Amb26413853 [0,2,0,0,0,0|1,0,0]=3 5256 B8R0.27 CC(F)(F)C(O)C(=O)O Amb32809793 [0,2,0,0,0,0|2,0,0]=4 5257 B8R0.27 CC(N)C(N)S(=O)(=O)O Amb27202229 [0,2,0,0,0,0|2,0,0]=4 5258 B8R0.27 CC(O)C(O)P(=O)(O)O Amb25235589 [0,2,0,0,0,0|2,0,0]=4 5259 B8R0.27 C[C@@H](C(=O)O)C(C)(C)C Amb10844023 [0,2,0,0,0,0|2,0,0]=4 5260 B8R0.27 C[C@@H](C(=O)O)C(C)(C)Cl Amb28399702 [0,2,0,0,0,0|2,0,0]=4 5261 B8R0.27 C[C@@H](C(=O)O)C(C)(C)O Amb10844262 [0,2,0,0,0,0|1,0,0]=3 5262 B8R0.27 C[C@@H](C(=O)O)C(C)(F)F Amb33728209 [0,2,0,0,0,0|2,0,0]=4 5263 B8R0.27 C[C@@H](C(=O)O)C(F)(F)F Amb24120617 [0,2,0,0,0,0|2,0,0]=4 5264 B8R0.27 C[C@@H](O)[C@@H](N)P(=O)(O)O Amb28254589 [0,2,0,0,0,0|1,0,0]=3 5265 B8R0.27 C[C@H](C(=O)O)C(C)(C)C Amb10844034 [0,2,0,0,0,0|2,0,0]=4 5266 B8R0.27 C[C@H](C(=O)O)C(C)(F)F Amb33749542 [0,2,0,0,0,0|2,0,0]=4 5267 B8R0.27 C[C@H](C(=O)O)C(F)(F)F Amb26536055 [0,2,0,0,0,0|2,0,0]=4 5268 B8R0.27 C[C@H](C(=O)O)S(=O)(=O)O Amb28385771 [0,2,0,0,0,0|2,0,0]=4 5269 B8R0.27 C[C@H](O)[C@H](N)C(C)(C)O Amb28388930 [0,2,0,0,0,0|1,0,1]=4 5270 B8R0.27 C[C@H](O)[C@H](N)P(=O)(O)O Amb28366442 [0,2,0,0,0,0|1,0,0]=3 5271 B8R0.27 NC(=O)C(N)C(F)(F)F Amb26624320 [0,2,0,0,0,0|2,0,0]=4 5272 B8R0.27 NC(=O)C(N)C(F)(F)F Amb27955525 [0,2,0,0,0,0|2,0,0]=4 5273 B8R0.27 NC(C(=O)O)C(Cl)(Cl)Cl Amb24480186 [0,2,0,0,0,0|1,0,0]=3 5274 B8R0.27 NC(C(=O)O)C(F)(F)F Amb10607071 [0,2,0,0,0,0|1,0,0]=3 5275 B8R0.27 NC(C(=O)O)C(F)(F)F Amb2690712 [0,2,0,0,0,0|1,0,0]=3 5276 B8R0.27 N[C@@H](C(=O)O)C(F)(F)F Amb25378031 [0,2,0,0,0,0|1,0,0]=3 5277 B8R0.27 N[C@H](C(=O)O)C(F)(F)F Amb24650499 [0,2,0,0,0,0|1,0,0]=3 5278 B8R0.27 O=C(O)C(Br)C(F)(F)F Amb22274799 [0,2,0,0,0,0|2,0,0]=4 5279 B8R0.27 O=C(O)C(F)C(F)(F)F Amb2690534 [0,2,0,0,0,0|2,0,0]=4 5280 B8R0.27 O=C(O)C(F)C(F)(F)F Amb32882484 [0,2,0,0,0,0|2,0,0]=4 5281 B8R0.27 O=C(O)C(O)C(Cl)(Cl)Cl Amb24467776 [0,2,0,0,0,0|2,0,0]=4 5282 B8R0.27 O=C(O)C(O)C(F)(F)Br Amb27481079 [0,2,0,0,0,0|2,0,0]=4 5283 B8R0.27 O=C(O)C(O)C(F)(F)F Amb4084805 [0,2,0,0,0,0|2,0,0]=4 5284 B8R0.27 O=C(O)C(O)P(=O)(O)O Amb24117287 [0,2,0,0,0,0|2,0,0]=4 5285 B8R0.27 O=C(O)C(S)C(F)(F)F Amb27409127 [0,2,0,0,0,0|2,0,0]=4 5286 B8R0.18 C#CC(C(=O)O)C(=O)O Amb27493331 [0,2,0,0,0,0|1,0,1]=4 5287 B8R0.18 C=C(C)C(CC)C(=O)O Amb18642606 [0,2,0,0,0,0|2,0,0]=4 5288 B8R0.18 C=C(C)C(CN)C(=O)O Amb33199955 [0,2,0,0,0,0|1,0,1]=4 5289 B8R0.18 C=C(C)C(NC)C(C)O Amb27482851 [0,2,0,0,0,0|2,0,0]=4 5290 B8R0.18 C=C(C)[C@@H](NC)[C@@H](C)O Amb27216072 [0,2,0,0,0,0|2,0,0]=4 5291 B8R0.18 C=CC(C(=O)O)C(=O)O Amb27655691 [0,2,0,0,0,0|1,0,1]=4 5292 B8R0.18 C=CC(C(=O)O)N(C)C Amb27757609 [0,2,0,0,0,0|1,0,1]=4 5293 B8R0.18 C=NC(C(=O)O)C(C)C Amb27409212 [0,2,0,0,0,0|1,0,1]=4 5294 B8R0.18 CC(C)C(C#N)C(=O)O Amb10066977 [0,2,0,0,0,0|1,0,1]=4 5295 B8R0.18 CC(C)C(CF)C(=O)O Amb26965957 [0,2,0,0,0,0|2,0,0]=4 5296 B8R0.18 CC(C)C(CN)C(=O)O Amb18987935 [0,2,0,0,0,0|1,0,0]=3 5297 B8R0.18 CC(C)C(CN)C(=O)O Amb19375052 [0,2,0,0,0,0|1,0,0]=3 5298 B8R0.18 CC(C)C(CO)C(=O)O Amb24116921 [0,2,0,0,0,0|1,0,0]=3 5299 B8R0.18 CC(C)C(CO)C(=O)[O-] Amb32655908 [0,2,0,0,0,0|1,0,1]=4 5300 B8R0.18 CC(C)C(CS)C(=O)O Amb17593703 [0,2,0,0,0,0|1,1,0]=4 5301 B8R0.18 CC(C)C(NN)C(=O)O Amb18642886 [0,2,0,0,0,0|1,0,0]=3 5302 B8R0.18 CC(C)C(NO)C(=O)O Amb28429830 [0,2,0,0,0,0|1,0,0]=3 5303 B8R0.18 CC(C)C(ON)C(=O)O Amb24477865 [0,2,0,0,0,0|1,0,0]=3 5304 B8R0.18 CC(C)C(ON)C(=O)O Amb32652494 [0,2,0,0,0,0|1,0,0]=3 5305 B8R0.18 CC(C)[C@@H](CN)C(=O)O Amb22756745 [0,2,0,0,0,0|1,0,0]=3 5306 B8R0.18 CC(C)[C@@H](CN)C(=O)O Amb22756747 [0,2,0,0,0,0|1,0,0]=3 5307 B8R0.18 CC(C)[C@@H](NN)C(=O)O Amb27468667 [0,2,0,0,0,0|1,0,0]=3 5308 B8R0.18 CC(C)[C@@H](NO)C(N)=O Amb27469128 [0,2,0,0,0,0|2,0,0]=4 5309 B8R0.18 CC(C)[C@@H](ON)C(=O)O Amb24117143 [0,2,0,0,0,0|1,0,0]=3 5310 B8R0.18 CC(C)[C@H](CN)C(=O)O Amb25283442 [0,2,0,0,0,0|1,0,0]=3 5311 B8R0.18 CC(C)[C@H](CN)C(=O)O Amb32620230 [0,2,0,0,0,0|1,0,0]=3 5312 B8R0.18 CC(C)[C@H](CO)C(=O)O Amb27249807 [0,2,0,0,0,0|1,0,0]=3 5313 B8R0.18 CC(C)[C@H](NN)C(=O)O Amb27946435 [0,2,0,0,0,0|1,0,0]=3 5314 B8R0.18 CC(C)[C@H](NO)C(=O)O Amb27859675 [0,2,0,0,0,0|1,0,0]=3 5315 B8R0.18 CC(O)C(NN)C(=O)O Amb18642940 [0,2,0,0,0,0|0,0,0]=2 5316 B8R0.18 CCC(C(=O)O)C(=O)O Amb6297197 [0,2,0,0,0,0|1,0,1]=4 5317 B8R0.18 CCC(C(=O)O)C(C)C Amb18972345 [0,2,0,0,0,0|2,0,0]=4 5318 B8R0.18 CCC(C(=O)O)C(C)O Amb18990651 [0,2,0,0,0,0|1,0,0]=3 5319 B8R0.18 CCC(C(=O)O)C(F)F Amb33337288 [0,2,0,0,0,0|2,0,0]=4 5320 B8R0.18 CCC(C(=O)O)N(C)C Amb33551144 [0,2,0,0,0,0|1,0,0]=3 5321 B8R0.18 CCC(C(=O)O)N(C)C Amb8455277 [0,2,0,0,0,0|1,0,0]=3 5322 B8R0.18 CCC(C(=O)O)N(C)N Amb25145584 [0,2,0,0,0,0|1,0,0]=3 5323 B8R0.18 CCC(C(=O)O)S(C)=O Amb18290930 [0,2,0,0,0,0|2,0,0]=4 5324 B8R0.18 CCC(C(N)=O)C(=O)O Amb28410332 [0,2,0,0,0,0|1,0,0]=3 5325 B8R0.18 CCC(C(N)=O)C(N)=O Amb25848912 [0,2,0,0,0,0|2,0,0]=4 5326 B8R0.18 CC[C@@H](C(=O)O)N(C)C Amb25823446 [0,2,0,0,0,0|1,0,0]=3 5327 B8R0.18 CC[C@@H](C(=O)O)N(O)O Amb16233002 [0,2,0,0,0,0|1,0,0]=3 5328 B8R0.18 CC[C@@H](C(=O)O)[C@@H](C)O Amb28410568 [0,2,0,0,0,0|1,0,0]=3 5329 B8R0.18 CC[C@@H](C(C)=O)[C@H](C)O Amb27164629 [0,2,0,0,0,0|2,0,0]=4 5330 B8R0.18 CC[C@H](C(=O)O)N(C)C Amb32668789 [0,2,0,0,0,0|1,0,0]=3 5331 B8R0.18 CC[C@H](C(=O)O)[C@H](C)O Amb27655638 [0,2,0,0,0,0|1,0,0]=3 5332 B8R0.18 CN(C)C(CN)C(=O)O Amb26350112 [0,2,0,0,0,0|1,0,0]=3 5333 B8R0.18 CN(C)C(CO)C(=O)O Amb24407402 [0,2,0,0,0,0|0,0,0]=2 5334 B8R0.18 CN(C)[C@@H](CO)C(=O)O Amb27397686 [0,2,0,0,0,0|0,0,0]=2 5335 B8R0.18 CN(C)[C@@H](CO)C(N)=O Amb25114181 [0,2,0,0,0,0|1,0,0]=3 5336 B8R0.18 CN(C)[C@H](CO)C(N)=O Amb27757984 [0,2,0,0,0,0|1,0,0]=3 5337 B8R0.18 CNC(C(=O)O)C(C)C Amb21961623 [0,2,0,0,0,0|1,0,0]=3 5338 B8R0.18 CNC(C(=O)O)C(C)C Amb4035989 [0,2,0,0,0,0|1,0,0]=3 5339 B8R0.18 CNC(C(=O)O)C(C)F Amb27596009 [0,2,0,0,0,0|1,0,0]=3 5340 B8R0.18 CNC(C(C)=O)C(C)C Amb2369975 [0,2,0,0,0,0|2,0,0]=4 5341 B8R0.18 CNC(C(N)=O)C(C)O Amb30037144 [0,2,0,0,0,0|1,0,0]=3 5342 B8R0.18 CN[C@@H](C(=O)O)C(C)C Amb22231334 [0,2,0,0,0,0|1,0,0]=3 5343 B8R0.18 CN[C@@H](C(=O)O)C(C)C Amb22749002 [0,2,0,0,0,0|1,0,0]=3 5344 B8R0.18 CN[C@@H](C(=O)O)C(C)O Amb22800385 [0,2,0,0,0,0|0,0,0]=2 5345 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb16183861 [0,2,0,0,0,0|1,0,0]=3 5346 B8R0.18 CN[C@H](C(=O)O)C(C)C Amb33812559 [0,2,0,0,0,0|1,0,0]=3 5347 B8R0.18 CN[C@H](C(=O)O)C(C)O Amb27446656 [0,2,0,0,0,0|0,0,0]=2 5348 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O Amb25887203 [0,2,0,0,0,0|0,0,0]=2 5349 B8R0.18 COC(C(=O)O)C(=O)O Amb27396318 [0,2,0,0,0,0|1,0,1]=4 5350 B8R0.18 COC(C(=O)O)C(C)C Amb33532796 [0,2,0,0,0,0|2,0,0]=4 5351 B8R0.18 COC(C(=O)O)C(C)O Amb26003623 [0,2,0,0,0,0|1,0,0]=3 5352 B8R0.18 CO[C@H](C(=O)O)C(C)C Amb27966715 [0,2,0,0,0,0|2,0,0]=4 5353 B8R0.18 CSC(C(=O)O)C(=O)O Amb27407760 [0,2,0,0,0,0|1,0,1]=4 5354 B8R0.18 CSC(C(=O)O)C(C)C Amb17503902 [0,2,0,0,0,0|2,0,0]=4 5355 B8R0.18 N#CC(C(N)=O)C(=O)O Amb28121468 [0,2,0,0,0,0|1,0,1]=4 5356 B8R0.18 NC=C(C(=O)O)C(=O)O Amb27236633 [0,2,0,0,0,0|0,0,2]=4 5357 B8R0.18 NCC(C(=O)O)C(=O)O Amb27408219 [0,2,0,0,0,0|0,0,1]=3 5358 B8R0.18 NCC(C(=O)O)C(F)F Amb27438118 [0,2,0,0,0,0|1,0,0]=3 5359 B8R0.18 O=C(O)C(CO)C(=O)O Amb27849072 [0,2,0,0,0,0|1,0,0]=3 5360 B8R0.18 [C-]#[N+]C(C(=O)O)C(C)C Amb27945578 [0,2,0,0,0,0|1,0,1]=4 5361 B6R1.2 BrC1=COCC1 Amb24322594 [1,0,0,1,0,0|2,0,0]=4 5362 B6R1.2 FC1=COCC1 Amb24322813 [1,0,0,1,0,0|2,0,0]=4 5363 B6R1.2 IC1=COCC1 Amb24322814 [1,0,0,1,0,0|2,0,0]=4 5364 B6R1.2 NC1=NOCC1 Amb27975619 [1,0,0,1,0,0|2,0,0]=4 5365 B6R1.2 O=C1C=CCC1 Amb4019519 [1,0,0,1,0,0|2,0,0]=4 5366 B6R1.2 O=C1CC=NO1 Amb27654112 [1,0,0,1,0,0|1,0,1]=4 5367 B6R1.2 O=C1CCCC1 Amb2793024 [1,0,0,1,0,0|2,0,0]=4 5368 B6R1.2 O=C1CCCN1 Amb22169686 [1,0,0,1,0,0|2,0,0]=4 5369 B6R1.2 O=C1CCCN1 Amb6608645 [1,0,0,1,0,0|2,0,0]=4 5370 B6R1.2 O=C1CCCO1 Amb3940401 [1,0,0,1,0,0|1,0,0]=3 5371 B6R1.2 O=C1CCCS1 Amb22338102 [1,0,0,1,0,0|1,1,0]=4 5372 B6R1.2 O=C1CCNC1 Amb2700623 [1,0,0,1,0,0|2,0,0]=4 5373 B6R1.2 O=C1CCNC1 Amb8386645 [1,0,0,1,0,0|2,0,0]=4 5374 B6R1.2 O=C1CCNN1 Amb33551041 [1,0,0,1,0,0|2,0,0]=4 5375 B6R1.2 O=C1CCNN1 Amb3428540 [1,0,0,1,0,0|2,0,0]=4 5376 B6R1.2 O=C1CCOC1 Amb7990143 [1,0,0,1,0,0|1,0,0]=3 5377 B6R1.2 O=C1CCON1 Amb22235009 [1,0,0,1,0,0|1,0,0]=3 5378 B6R1.2 O=C1CCSC1 Amb2720904 [1,0,0,1,0,0|1,1,0]=4 5379 B6R1.2 O=C1COCN1 Amb28132686 [1,0,0,1,0,0|2,0,0]=4 5380 B6R1.2 O=C1NCCO1 Amb6608807 [1,0,0,1,0,0|2,0,0]=4 5381 B6R1.2 O=C1OCCO1 Amb4057710 [1,0,0,1,0,0|2,0,0]=4 5382 B6R1.2 O=C1OCCS1 Amb27398683 [1,0,0,1,0,0|2,0,0]=4 5383 B6R1.2 OC1=NNCC1 Amb2111955 [1,0,0,1,0,0|2,0,0]=4 5384 B6R1.2 OC1=NNCC1 Amb844737 [1,0,0,1,0,0|2,0,0]=4 5385 B6R1.2 OC1CCOC1 Amb2688794 [1,0,0,1,0,0|1,0,1]=4 5386 B6R1.2 O[C@@H]1CCOC1 Amb8628960 [1,0,0,1,0,0|1,0,1]=4 5387 B6R1.2 O[C@H]1CCOC1 Amb32409449 [1,0,0,1,0,0|1,0,1]=4 5388 B6R1.2 O[C@H]1CCOC1 Amb33718794 [1,0,0,1,0,0|1,0,1]=4 5389 B6R1.2 O[C@H]1CCOC1 Amb3940165 [1,0,0,1,0,0|1,0,1]=4 5390 B6R1.2 S=C1CCCO1 Amb27808589 [1,0,0,1,0,0|1,1,0]=4 5391 B6R1.3 OCCC1CO1 Amb24334074 [1,0,0,1,0,0|1,0,1]=4 5392 B6R1.3 OCC[C@@H]1CO1 Amb24120634 [1,0,0,1,0,0|1,0,1]=4 5393 B6R1.3 OCC[C@H]1CO1 Amb25052254 [1,0,0,1,0,0|1,0,1]=4 5394 B6R1.5 C=C1CC(O)C1 Amb28126950 [1,0,0,1,0,0|2,0,0]=4 5395 B6R1.5 CC1CC(=O)C1 Amb22284831 [1,0,0,1,0,0|2,0,0]=4 5396 B6R1.5 CC1CC(=O)N1 Amb28383498 [1,0,0,1,0,0|2,0,0]=4 5397 B6R1.5 CC1CC(=O)O1 Amb13777279 [1,0,0,1,0,0|1,0,0]=3 5398 B6R1.5 CC1CC(=O)S1 Amb27424521 [1,0,0,1,0,0|1,1,0]=4 5399 B6R1.5 C[C@@H]1CC(=O)N1 Amb26611068 [1,0,0,1,0,0|2,0,0]=4 5400 B6R1.5 C[C@H]1CC(=O)O1 Amb16234264 [1,0,0,1,0,0|1,0,0]=3 5401 B6R1.5 NC1CC(=O)C1 Amb20241928 [1,0,0,1,0,0|2,0,0]=4 5402 B6R1.5 NC1CC(=O)C1 Amb23439093 [1,0,0,1,0,0|2,0,0]=4 5403 B6R1.5 O=C1CC(Br)C1 Amb33548005 [1,0,0,1,0,0|2,0,0]=4 5404 B6R1.5 O=C1CC(F)C1 Amb27260513 [1,0,0,1,0,0|2,0,0]=4 5405 B6R1.5 O=C1CC(F)N1 Amb24588463 [1,0,0,1,0,0|2,0,0]=4 5406 B6R1.5 O=C1CC(O)C1 Amb22235480 [1,0,0,1,0,0|1,0,0]=3 5407 B6R1.5 O=C1C[C@@H](Br)N1 Amb26634817 [1,0,0,1,0,0|2,0,0]=4 5408 B6R1.5 OC1CC(O)C1 Amb33550902 [1,0,0,1,0,0|1,0,1]=4 5409 B6R1.5 O[C@H]1C[C@@H](O)C1 Amb26562258 [1,0,0,1,0,0|1,0,1]=4 5410 B6R1.5 O[C@H]1C[C@H](O)C1 Amb26657998 [1,0,0,1,0,0|1,0,1]=4 5411 B6R1.8 C=C1CC1CO Amb22224918 [1,0,0,1,0,0|2,0,0]=4 5412 B6R1.8 C=C1C[C@@H]1CO Amb25359146 [1,0,0,1,0,0|2,0,0]=4 5413 B6R1.8 CC1=CC1CO Amb25106800 [1,0,0,1,0,0|2,0,0]=4 5414 B6R1.8 CC1OC1CO Amb25868965 [1,0,0,1,0,0|1,0,1]=4 5415 B6R1.8 C[C@@H]1O[C@H]1CO Amb26413882 [1,0,0,1,0,0|1,0,1]=4 5416 B6R1.8 C[C@H]1O[C@@H]1CO Amb27874000 [1,0,0,1,0,0|1,0,1]=4 5417 B6R1.9 O=S1(=O)CC1O Amb28321613 [1,0,0,1,0,0|1,0,1]=4 5418 B6R1.11 C=C(C)C1CO1 Amb19516025 [1,0,0,1,0,0|2,0,0]=4 5419 B6R1.11 C=C(C)[C@@H]1CO1 Amb33199037 [1,0,0,1,0,0|2,0,0]=4 5420 B6R1.11 C=C(C)[C@H]1CO1 Amb33199151 [1,0,0,1,0,0|2,0,0]=4 5421 B6R1.11 CC(=O)C1CC1 Amb2686663 [1,0,0,1,0,0|2,0,0]=4 5422 B6R1.11 CC(=O)C1CO1 Amb4477044 [1,0,0,1,0,0|1,0,0]=3 5423 B6R1.11 CC(O)C1CO1 Amb17593033 [1,0,0,1,0,0|1,0,1]=4 5424 B6R1.11 C[C@@H](O)[C@@H]1CO1 Amb27268412 [1,0,0,1,0,0|1,0,1]=4 5425 B6R1.11 NC(=O)C1CC1 Amb33546284 [1,0,0,1,0,0|2,0,0]=4 5426 B6R1.11 NC(=O)C1CO1 Amb6261241 [1,0,0,1,0,0|1,0,0]=3 5427 B6R1.11 NC(=O)C1CS1 Amb27217272 [1,0,0,1,0,0|1,1,0]=4 5428 B6R1.11 O=C(Br)C1CC1 Amb27457101 [1,0,0,1,0,0|2,0,0]=4 5429 B6R1.11 O=C(Cl)C1CC1 Amb3939317 [1,0,0,1,0,0|2,0,0]=4 5430 B6R1.11 O=C(I)C1CC1 Amb28315968 [1,0,0,1,0,0|2,0,0]=4 5431 B6R1.11 O=C(O)C1C=C1 Amb27185565 [1,0,0,1,0,0|1,0,1]=4 5432 B6R1.11 O=C(O)C1CC1 Amb2686655 [1,0,0,1,0,0|1,0,0]=3 5433 B6R1.11 O=C(O)C1CN1 Amb21864773 [1,0,0,1,0,0|1,0,0]=3 5434 B6R1.11 O=C(O)C1CO1 Amb8395277 [1,0,0,1,0,0|0,0,0]=2 5435 B6R1.11 O=C(O)C1NN1 Amb27949037 [1,0,0,1,0,0|2,0,0]=4 5436 B6R1.11 O=C(O)[C@@H]1CN1 Amb22745452 [1,0,0,1,0,0|1,0,0]=3 5437 B6R1.11 O=C(O)[C@@H]1CO1 Amb26994292 [1,0,0,1,0,0|0,0,0]=2 5438 B6R1.11 O=C(O)[C@@H]1CS1 Amb28396934 [1,0,0,1,0,0|0,1,0]=3 5439 B6R1.11 O=C(O)[C@H]1CS1 Amb27845518 [1,0,0,1,0,0|0,1,0]=3 5440 B6R1.11 O=C([O-])C1CO1 Amb22492453 [1,0,0,1,0,0|0,0,1]=3 5441 B6R1.11 O=S(O)C1CC1 Amb24334290 [1,0,0,1,0,0|2,0,0]=4 5442 B6R1.11 O=[PH](O)C1CC1 Amb8391285 [1,0,0,1,0,0|2,0,0]=4 5443 B6R1.4 CC1CCC1=O Amb17593022 [1,0,0,1,0,0|2,0,0]=4 5444 B6R1.4 CC1CNC1=O Amb24444140 [1,0,0,1,0,0|2,0,0]=4 5445 B6R1.4 CC1COC1=O Amb25794274 [1,0,0,1,0,0|1,0,0]=3 5446 B6R1.4 C[C@H]1CNC1=O Amb27620602 [1,0,0,1,0,0|2,0,0]=4 5447 B6R1.4 NC1CCC1=O Amb22896568 [1,0,0,1,0,0|1,0,0]=3 5448 B6R1.4 NC1CCC1=O Amb25887804 [1,0,0,1,0,0|1,0,0]=3 5449 B6R1.4 NC1CCC1O Amb19148610 [1,0,0,1,0,0|1,0,1]=4 5450 B6R1.4 NC1CCC1O Amb31291441 [1,0,0,1,0,0|1,0,1]=4 5451 B6R1.4 NC1CNC1=O Amb18832512 [1,0,0,1,0,0|1,0,0]=3 5452 B6R1.4 NC1CNC1=O Amb32671465 [1,0,0,1,0,0|1,0,0]=3 5453 B6R1.4 NN1CCC1=O Amb27860475 [1,0,0,1,0,0|2,0,0]=4 5454 B6R1.4 NN1CCC1=O Amb30625658 [1,0,0,1,0,0|2,0,0]=4 5455 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22757952 [1,0,0,1,0,0|1,0,1]=4 5456 B6R1.4 N[C@@H]1CC[C@@H]1O Amb22823228 [1,0,0,1,0,0|1,0,1]=4 5457 B6R1.4 N[C@@H]1CC[C@H]1O Amb22757953 [1,0,0,1,0,0|1,0,1]=4 5458 B6R1.4 N[C@@H]1CC[C@H]1O Amb22823232 [1,0,0,1,0,0|1,0,1]=4 5459 B6R1.4 N[C@@H]1CC[C@H]1O Amb33719048 [1,0,0,1,0,0|1,0,1]=4 5460 B6R1.4 N[C@@H]1CNC1=O Amb22751418 [1,0,0,1,0,0|1,0,0]=3 5461 B6R1.4 N[C@@H]1CNC1=O Amb30982058 [1,0,0,1,0,0|1,0,0]=3 5462 B6R1.4 N[C@@H]1COC1=O Amb22748014 [1,0,0,1,0,0|0,0,0]=2 5463 B6R1.4 N[C@H]1CC[C@@H]1O Amb24579886 [1,0,0,1,0,0|1,0,1]=4 5464 B6R1.4 N[C@H]1CC[C@H]1O Amb24580190 [1,0,0,1,0,0|1,0,1]=4 5465 B6R1.4 N[C@H]1CNC1=O Amb25811302 [1,0,0,1,0,0|1,0,0]=3 5466 B6R1.4 N[C@H]1CNC1=O Amb31291144 [1,0,0,1,0,0|1,0,0]=3 5467 B6R1.4 N[C@H]1COC1=O Amb28315731 [1,0,0,1,0,0|0,0,0]=2 5468 B6R1.4 N[C@H]1CSC1=O Amb27391192 [1,0,0,1,0,0|0,1,0]=3 5469 B6R1.4 O=C1CCC1Br Amb21964157 [1,0,0,1,0,0|2,0,0]=4 5470 B6R1.4 O=C1CCC1Cl Amb33544158 [1,0,0,1,0,0|2,0,0]=4 5471 B6R1.4 O=C1CCC1O Amb17593027 [1,0,0,1,0,0|2,0,0]=4 5472 B6R1.4 O=C1NCC1O Amb24689689 [1,0,0,1,0,0|2,0,0]=4 5473 B6R1.6 C=C[C@H]1CCN1 Amb27164530 [1,0,0,1,0,0|2,0,0]=4 5474 B6R1.6 O=CC1CCC1 Amb8009552 [1,0,0,1,0,0|2,0,0]=4 5475 B6R1.6 O=CC1CCN1 Amb25757222 [1,0,0,1,0,0|1,0,0]=3 5476 B6R1.6 O=CC1CCS1 Amb27644631 [1,0,0,1,0,0|2,0,0]=4 5477 B6R1.6 O=CC1CNC1 Amb25919428 [1,0,0,1,0,0|2,0,0]=4 5478 B6R1.6 O=CC1COC1 Amb21857829 [1,0,0,1,0,0|1,0,0]=3 5479 B6R1.6 OCC1C=CC1 Amb26987497 [1,0,0,1,0,0|2,0,0]=4 5480 B6R1.6 OCC1CCN1 Amb21963462 [1,0,0,1,0,0|1,0,1]=4 5481 B6R1.6 OCC1CCN1 Amb32682448 [1,0,0,1,0,0|1,0,1]=4 5482 B6R1.6 OCC1COC1 Amb33546888 [1,0,0,1,0,0|1,0,1]=4 5483 B6R1.6 OC[C@@H]1CCN1 Amb22406086 [1,0,0,1,0,0|1,0,1]=4 5484 B6R1.6 OC[C@@H]1CCN1 Amb34913959 [1,0,0,1,0,0|1,0,1]=4 5485 B6R1.6 OC[C@H]1CCN1 Amb22233159 [1,0,0,1,0,0|1,0,1]=4 5486 B6R1.6 OC[C@H]1CCN1 Amb33859052 [1,0,0,1,0,0|1,0,1]=4 5487 B6R1.6 ONC1COC1 Amb28201079 [1,0,0,1,0,0|2,0,0]=4 5488 B6R1.7 C=CC1(N)CC1 Amb25663115 [1,0,0,1,0,0|2,0,0]=4 5489 B6R1.7 CC1(C=O)CC1 Amb8010172 [1,0,0,1,0,0|2,0,0]=4 5490 B6R1.7 CC1(C=O)CO1 Amb28400192 [1,0,0,1,0,0|1,0,0]=3 5491 B6R1.7 CC1(CO)C=C1 Amb27164464 [1,0,0,1,0,0|2,0,0]=4 5492 B6R1.7 CC1(CO)CO1 Amb22001420 [1,0,0,1,0,0|1,0,1]=4 5493 B6R1.7 C[C@@]1(CO)CO1 Amb22801681 [1,0,0,1,0,0|1,0,1]=4 5494 B6R1.7 C[C@]1(CO)CO1 Amb27244117 [1,0,0,1,0,0|1,0,1]=4 5495 B6R1.7 NC1(CO)CC1 Amb6307339 [1,0,0,1,0,0|1,0,1]=4 5496 B6R1.7 NC1(CO)CC1 Amb8010899 [1,0,0,1,0,0|1,0,1]=4 5497 B6R1.7 O=CC1(F)CC1 Amb25359463 [1,0,0,1,0,0|2,0,0]=4 5498 B6R1.12 O=C1C(F)C1F Amb27226966 [1,0,0,1,0,0|2,0,0]=4 5499 B8R1.1 C=C1CN[C@H](CO)C1 Amb27205082 [0,0,0,1,0,1|2,0,0]=4 5500 B8R1.1 CCC1CC(=O)NN1 Amb29862365 [0,0,0,1,0,1|2,0,0]=4 5501 B8R1.1 CCC1COC(=O)C1 Amb27854064 [0,0,0,1,0,1|2,0,0]=4 5502 B8R1.1 CCC1COC(=O)N1 Amb19516988 [0,0,0,1,0,1|2,0,0]=4 5503 B8R1.1 CCC1COC(=O)O1 Amb2721339 [0,0,0,1,0,1|2,0,0]=4 5504 B8R1.1 CC[C@H]1COC(=O)N1 Amb27411564 [0,0,0,1,0,1|2,0,0]=4 5505 B8R1.1 NCC1=NC(=O)ON1 Amb28934819 [0,0,0,1,0,1|1,0,1]=4 5506 B8R1.1 NCC1COC(=O)N1 Amb27852206 [0,0,0,1,0,1|2,0,0]=4 5507 B8R1.1 NCC1COC(=O)N1 Amb28934922 [0,0,0,1,0,1|2,0,0]=4 5508 B8R1.1 O=C1C=C(CO)CO1 Amb23557062 [0,0,0,1,0,1|1,0,1]=4 5509 B8R1.1 O=C1C=C[C@@H](CO)O1 Amb3939187 [0,0,0,1,0,1|2,0,0]=4 5510 B8R1.1 O=C1C=C[C@H](CO)O1 Amb2699833 [0,0,0,1,0,1|2,0,0]=4 5511 B8R1.1 O=C1CC(CF)CO1 Amb23557063 [0,0,0,1,0,1|2,0,0]=4 5512 B8R1.1 O=C1CC(CO)CN1 Amb9902173 [0,0,0,1,0,1|2,0,0]=4 5513 B8R1.1 O=C1CC(CO)CO1 Amb22886806 [0,0,0,1,0,1|1,0,0]=3 5514 B8R1.1 O=C1CC(CO)NN1 Amb35686080 [0,0,0,1,0,1|1,0,0]=3 5515 B8R1.1 O=C1CCC(CO)C1 Amb22168734 [0,0,0,1,0,1|2,0,0]=4 5516 B8R1.1 O=C1CCC(CO)N1 Amb33544815 [0,0,0,1,0,1|2,0,0]=4 5517 B8R1.1 O=C1CCC(CO)O1 Amb20240701 [0,0,0,1,0,1|2,0,0]=4 5518 B8R1.1 O=C1CCC(CO)S1 Amb28202904 [0,0,0,1,0,1|2,0,0]=4 5519 B8R1.1 O=C1CC[C@@H](CO)N1 Amb2371840 [0,0,0,1,0,1|2,0,0]=4 5520 B8R1.1 O=C1CC[C@@H](CO)O1 Amb8515911 [0,0,0,1,0,1|2,0,0]=4 5521 B8R1.1 O=C1CC[C@H](CO)N1 Amb2694795 [0,0,0,1,0,1|2,0,0]=4 5522 B8R1.1 O=C1CC[C@H](CO)O1 Amb4037005 [0,0,0,1,0,1|2,0,0]=4 5523 B8R1.1 O=C1CNC(CCl)C1 Amb27864068 [0,0,0,1,0,1|2,0,0]=4 5524 B8R1.1 O=C1COC(CO)C1 Amb24117838 [0,0,0,1,0,1|2,0,0]=4 5525 B8R1.1 O=C1COC(CO)N1 Amb27789986 [0,0,0,1,0,1|2,0,0]=4 5526 B8R1.1 O=C1C[C@@H](CBr)CO1 Amb27590526 [0,0,0,1,0,1|2,0,0]=4 5527 B8R1.1 O=C1C[C@@H](CO)CN1 Amb24515579 [0,0,0,1,0,1|2,0,0]=4 5528 B8R1.1 O=C1C[C@H](CF)CO1 Amb24626048 [0,0,0,1,0,1|2,0,0]=4 5529 B8R1.1 O=C1C[C@H](CO)CN1 Amb25745471 [0,0,0,1,0,1|2,0,0]=4 5530 B8R1.1 O=C1NC(CCl)CO1 Amb28282690 [0,0,0,1,0,1|2,0,0]=4 5531 B8R1.1 O=C1NC(CF)CO1 Amb33358226 [0,0,0,1,0,1|2,0,0]=4 5532 B8R1.1 O=C1NC(CO)CO1 Amb22410779 [0,0,0,1,0,1|1,0,0]=3 5533 B8R1.1 O=C1NC(CO)CS1 Amb27170689 [0,0,0,1,0,1|1,1,0]=4 5534 B8R1.1 O=C1NCC(CO)O1 Amb9421413 [0,0,0,1,0,1|2,0,0]=4 5535 B8R1.1 O=C1NC[C@@H](CO)N1 Amb33482781 [0,0,0,1,0,1|2,0,0]=4 5536 B8R1.1 O=C1NC[C@@H](CO)O1 Amb24183552 [0,0,0,1,0,1|2,0,0]=4 5537 B8R1.1 O=C1NC[C@H](CO)N1 Amb33620311 [0,0,0,1,0,1|2,0,0]=4 5538 B8R1.1 O=C1NC[C@H](CO)O1 Amb22737250 [0,0,0,1,0,1|2,0,0]=4 5539 B8R1.1 O=C1N[C@@H](CI)CO1 Amb22746832 [0,0,0,1,0,1|2,0,0]=4 5540 B8R1.1 O=C1N[C@@H](CO)CO1 Amb26396455 [0,0,0,1,0,1|1,0,0]=3 5541 B8R1.1 O=C1N[C@H](CI)CO1 Amb28048135 [0,0,0,1,0,1|2,0,0]=4 5542 B8R1.1 O=C1N[C@H](CO)CO1 Amb26653948 [0,0,0,1,0,1|1,0,0]=3 5543 B8R1.1 O=C1N[C@H](CO)CS1 Amb27655608 [0,0,0,1,0,1|1,1,0]=4 5544 B8R1.1 O=C1OCC(CCl)O1 Amb3940630 [0,0,0,1,0,1|2,0,0]=4 5545 B8R1.1 O=C1OCC(CF)O1 Amb28348445 [0,0,0,1,0,1|2,0,0]=4 5546 B8R1.1 O=C1OCC(CO)O1 Amb3939438 [0,0,0,1,0,1|1,0,0]=3 5547 B8R1.1 O=C1OCC(CS)O1 Amb32650873 [0,0,0,1,0,1|1,1,0]=4 5548 B8R1.1 O=C1SCC(CO)S1 Amb27394779 [0,0,0,1,0,1|1,1,0]=4 5549 B8R1.1 O=S1OCC(CO)O1 Amb25802802 [0,0,0,1,0,1|2,0,0]=4 5550 B8R1.1 OCC1CC(O)CN1 Amb1102176 [0,0,0,1,0,1|1,0,1]=4 5551 B8R1.1 OCC1CC(O)CN1 Amb24268900 [0,0,0,1,0,1|1,0,1]=4 5552 B8R1.1 OCC1CNC(O)=N1 Amb24602100 [0,0,0,1,0,1|2,0,0]=4 5553 B8R1.1 OCC1COC(=S)N1 Amb27168182 [0,0,0,1,0,1|1,1,0]=4 5554 B8R1.1 OC[C@@H]1CC(O)CN1 Amb27591630 [0,0,0,1,0,1|1,0,1]=4 5555 B8R1.1 OC[C@@H]1C[C@@H](O)CN1 Amb19929426 [0,0,0,1,0,1|1,0,1]=4 5556 B8R1.1 OC[C@@H]1C[C@@H](O)CN1 Amb27783820 [0,0,0,1,0,1|1,0,1]=4 5557 B8R1.1 OC[C@@H]1C[C@H](O)CN1 Amb24117087 [0,0,0,1,0,1|1,0,1]=4 5558 B8R1.1 OC[C@@H]1C[C@H](O)CN1 Amb30634319 [0,0,0,1,0,1|1,0,1]=4 5559 B8R1.1 OC[C@H]1CC(O)CN1 Amb27430315 [0,0,0,1,0,1|1,0,1]=4 5560 B8R1.1 OC[C@H]1C[C@@H](O)CN1 Amb33858981 [0,0,0,1,0,1|1,0,1]=4 5561 B8R1.1 OC[C@H]1C[C@H](O)CN1 Amb22756284 [0,0,0,1,0,1|1,0,1]=4 5562 B8R1.4 CC1CCOC(=O)N1 Amb27655650 [0,0,0,1,0,1|2,0,0]=4 5563 B8R1.4 CC1CCOC(=O)O1 Amb33714707 [0,0,0,1,0,1|2,0,0]=4 5564 B8R1.4 CC1COCC(=O)N1 Amb10608100 [0,0,0,1,0,1|2,0,0]=4 5565 B8R1.4 C[C@@H]1COCC(=O)N1 Amb15693112 [0,0,0,1,0,1|2,0,0]=4 5566 B8R1.4 C[C@H]1COCC(=O)N1 Amb22232054 [0,0,0,1,0,1|2,0,0]=4 5567 B8R1.4 NC1=CC(=O)COC1 Amb25785409 [0,0,0,1,0,1|1,0,1]=4 5568 B8R1.4 NC1CCCC(=O)C1 Amb23440459 [0,0,0,1,0,1|2,0,0]=4 5569 B8R1.4 NC1CCCC(=O)C1 Amb8387391 [0,0,0,1,0,1|2,0,0]=4 5570 B8R1.4 NC1CCNC(=O)C1 Amb10067177 [0,0,0,1,0,1|2,0,0]=4 5571 B8R1.4 NC1CCNC(=O)C1 Amb19957631 [0,0,0,1,0,1|2,0,0]=4 5572 B8R1.4 NC1CCNC(=O)C1 Amb21960626 [0,0,0,1,0,1|2,0,0]=4 5573 B8R1.4 NC1COCC(=O)C1 Amb33623050 [0,0,0,1,0,1|1,0,0]=3 5574 B8R1.4 NC1COCC(=O)C1 Amb33716160 [0,0,0,1,0,1|1,0,0]=3 5575 B8R1.4 NC1COCC(O)C1 Amb24526934 [0,0,0,1,0,1|1,0,1]=4 5576 B8R1.4 NC1COCC(O)C1 Amb31291238 [0,0,0,1,0,1|1,0,1]=4 5577 B8R1.4 N[C@@H]1CCNC(=O)C1 Amb27489147 [0,0,0,1,0,1|2,0,0]=4 5578 B8R1.4 N[C@H]1CCNC(=O)C1 Amb25168718 [0,0,0,1,0,1|2,0,0]=4 5579 B8R1.4 N[C@H]1COC[C@H](O)C1 Amb26008196 [0,0,0,1,0,1|1,0,1]=4 5580 B8R1.18 CC1=CC(=O)OC1O Amb8389484 [0,0,0,1,0,1|1,0,1]=4 5581 B8R1.18 CC1CC(=O)NC1O Amb27975748 [0,0,0,1,0,1|2,0,0]=4 5582 B8R1.18 CC1CC(=O)OC1C Amb27873473 [0,0,0,1,0,1|2,0,0]=4 5583 B8R1.18 CC1CC(=O)OC1O Amb26536810 [0,0,0,1,0,1|1,0,0]=3 5584 B8R1.18 CC1NC(=O)CC1O Amb27792924 [0,0,0,1,0,1|2,0,0]=4 5585 B8R1.18 CC1NC(=O)OC1C Amb25747248 [0,0,0,1,0,1|2,0,0]=4 5586 B8R1.18 CC1OC(=O)C=C1N Amb27838294 [0,0,0,1,0,1|1,0,1]=4 5587 B8R1.18 CC1OC(=O)OC1C Amb27485944 [0,0,0,1,0,1|2,0,0]=4 5588 B8R1.18 C[C@@H]1NC(=O)O[C@@H]1C Amb28132650 [0,0,0,1,0,1|2,0,0]=4 5589 B8R1.18 C[C@@H]1OC(=O)C[C@H]1Cl Amb27252234 [0,0,0,1,0,1|2,0,0]=4 5590 B8R1.18 C[C@H]1CC(=O)O[C@H]1C Amb27471867 [0,0,0,1,0,1|2,0,0]=4 5591 B8R1.18 C[C@H]1NC(=O)C[C@@H]1O Amb28128239 [0,0,0,1,0,1|2,0,0]=4 5592 B8R1.18 C[C@H]1NC(=O)C[C@H]1O Amb28131156 [0,0,0,1,0,1|2,0,0]=4 5593 B8R1.18 C[C@H]1OC(=O)C[C@@H]1N Amb27973900 [0,0,0,1,0,1|1,0,0]=3 5594 B8R1.18 C[C@H]1OC(=O)C[C@H]1O Amb27775518 [0,0,0,1,0,1|2,0,0]=4 5595 B8R1.18 NC1CC(=O)CC1N Amb27486601 [0,0,0,1,0,1|2,0,0]=4 5596 B8R1.18 NC1CC(=O)OC1=O Amb27216215 [0,0,0,1,0,1|0,0,2]=4 5597 B8R1.18 NC1CC(O)CC1O Amb27431336 [0,0,0,1,0,1|1,0,1]=4 5598 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb25992097 [0,0,0,1,0,1|0,0,2]=4 5599 B8R1.18 N[C@@H]1CC(=O)OC1=O Amb8631355 [0,0,0,1,0,1|0,0,2]=4 5600 B8R1.18 N[C@@H]1C[C@H](O)C[C@H]1O Amb26952064 [0,0,0,1,0,1|1,0,1]=4 5601 B8R1.18 N[C@@H]1C[C@H](O)C[C@H]1O Amb35752607 [0,0,0,1,0,1|1,0,1]=4 5602 B8R1.18 N[C@H]1CC(=O)OC1=O Amb24745675 [0,0,0,1,0,1|0,0,2]=4 5603 B8R1.18 N[C@H]1CC(=O)O[C@H]1O Amb28196677 [0,0,0,1,0,1|0,0,0]=2 5604 B8R1.18 N[C@H]1C[C@H](O)C[C@@H]1O Amb27881771 [0,0,0,1,0,1|1,0,1]=4 5605 B8R1.18 O=C1C=C(Cl)C(O)O1 Amb25889252 [0,0,0,1,0,1|1,0,1]=4 5606 B8R1.18 O=C1C[C@@H](O)[C@H](O)C1 Amb27841798 [0,0,0,1,0,1|2,0,0]=4 5607 B8R1.18 O=C1NC(O)C(O)N1 Amb6342569 [0,0,0,1,0,1|2,0,0]=4 5608 B8R1.18 O=C1OC(Cl)C(Cl)O1 Amb20670724 [0,0,0,1,0,1|2,0,0]=4 5609 B8R1.18 O=C1O[C@@H](Cl)[C@H](Cl)O1 Amb25061412 [0,0,0,1,0,1|2,0,0]=4 5610 B8R1.20 CC1CC1CC(=O)O Amb25316515 [0,0,0,1,0,1|2,0,0]=4 5611 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [0,0,0,1,0,1|2,0,0]=4 5612 B8R1.20 NC1CC1CC(=O)O Amb27201670 [0,0,0,1,0,1|2,0,0]=4 5613 B8R1.20 N[C@@H]1C[C@H]1CC(=O)O Amb27252154 [0,0,0,1,0,1|2,0,0]=4 5614 B8R1.20 O=C(O)CC1CC1O Amb27981662 [0,0,0,1,0,1|1,0,0]=3 5615 B8R1.31 CC1CCC1C(=O)O Amb21857447 [0,0,0,1,0,1|2,0,0]=4 5616 B8R1.31 C[C@@H]1CC[C@@H]1C(=O)O Amb28203929 [0,0,0,1,0,1|2,0,0]=4 5617 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb24597629 [0,0,0,1,0,1|2,0,0]=4 5618 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O Amb33620541 [0,0,0,1,0,1|2,0,0]=4 5619 B8R1.31 NC(=O)C1CCC1N Amb20248288 [0,0,0,1,0,1|2,0,0]=4 5620 B8R1.31 NC(=O)[C@@H]1CC[C@H]1N Amb27225132 [0,0,0,1,0,1|2,0,0]=4 5621 B8R1.31 NC1CCC1C(=O)O Amb26979562 [0,0,0,1,0,1|1,0,0]=3 5622 B8R1.31 NC1COC1C(=O)O Amb28428430 [0,0,0,1,0,1|0,0,0]=2 5623 B8R1.31 NN1CC[C@H]1C(=O)O Amb27261518 [0,0,0,1,0,1|2,0,0]=4 5624 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24117048 [0,0,0,1,0,1|1,0,0]=3 5625 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O Amb24183584 [0,0,0,1,0,1|1,0,0]=3 5626 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb25976891 [0,0,0,1,0,1|1,0,0]=3 5627 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O Amb31291972 [0,0,0,1,0,1|1,0,0]=3 5628 B8R1.31 N[C@@H]1CO[C@H]1C(=O)O Amb24681491 [0,0,0,1,0,1|0,0,0]=2 5629 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb27187220 [0,0,0,1,0,1|1,0,0]=3 5630 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O Amb33805288 [0,0,0,1,0,1|1,0,0]=3 5631 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb25911896 [0,0,0,1,0,1|1,0,0]=3 5632 B8R1.31 N[C@H]1CC[C@H]1C(=O)O Amb33801366 [0,0,0,1,0,1|1,0,0]=3 5633 B8R1.31 N[C@H]1CO[C@@H]1C(=O)O Amb25324265 [0,0,0,1,0,1|0,0,0]=2 5634 B8R1.31 N[C@H]1CO[C@H]1C(=O)O Amb25929776 [0,0,0,1,0,1|0,0,0]=2 5635 B8R1.31 O=C(O)C1CCC1Cl Amb27490061 [0,0,0,1,0,1|2,0,0]=4 5636 B8R1.31 O=C(O)C1CCC1F Amb27835547 [0,0,0,1,0,1|2,0,0]=4 5637 B8R1.31 O=C(O)C1CCC1O Amb24481384 [0,0,0,1,0,1|2,0,0]=4 5638 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O Amb27619188 [0,0,0,1,0,1|2,0,0]=4 5639 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O Amb34913090 [0,0,0,1,0,1|2,0,0]=4 5640 B8R1.34 CC(=O)CC1COC1 Amb22728373 [0,0,0,1,0,1|2,0,0]=4 5641 B8R1.34 CC(=O)OC1COC1 Amb25257353 [0,0,0,1,0,1|2,0,0]=4 5642 B8R1.34 CC(=O)SC1COC1 Amb28074762 [0,0,0,1,0,1|2,0,0]=4 5643 B8R1.34 O=C(Cl)OC1COC1 Amb28048913 [0,0,0,1,0,1|2,0,0]=4 5644 B8R1.34 O=C(O)C=C1COC1 Amb26866250 [0,0,0,1,0,1|1,0,1]=4 5645 B8R1.34 O=C(O)CC1CCC1 Amb2696078 [0,0,0,1,0,1|2,0,0]=4 5646 B8R1.34 O=C(O)CC1CCN1 Amb25068427 [0,0,0,1,0,1|1,0,0]=3 5647 B8R1.34 O=C(O)CC1CCO1 Amb28136625 [0,0,0,1,0,1|2,0,0]=4 5648 B8R1.34 O=C(O)CC1CNC1 Amb21856240 [0,0,0,1,0,1|2,0,0]=4 5649 B8R1.34 O=C(O)CC1CNC1 Amb22057370 [0,0,0,1,0,1|2,0,0]=4 5650 B8R1.34 O=C(O)CC1CNC1 Amb22739043 [0,0,0,1,0,1|2,0,0]=4 5651 B8R1.34 O=C(O)CC1COC1 Amb18199145 [0,0,0,1,0,1|1,0,0]=3 5652 B8R1.34 O=C(O)CC1CSC1 Amb26049907 [0,0,0,1,0,1|1,1,0]=4 5653 B8R1.34 O=C(O)C[C@@H]1CCO1 Amb33715997 [0,0,0,1,0,1|2,0,0]=4 5654 B8R1.34 O=C(O)C[C@H]1CCO1 Amb26570015 [0,0,0,1,0,1|2,0,0]=4 5655 B8R1.34 O=C([O-])CC1COC1 Amb32664987 [0,0,0,1,0,1|1,0,1]=4 5656 B8R1.42 CC(=O)CC1(N)CC1 Amb28073167 [0,0,0,1,0,1|2,0,0]=4 5657 B8R1.42 CC1(CC(=O)O)CC1 Amb33544283 [0,0,0,1,0,1|2,0,0]=4 5658 B8R1.42 NC(=O)CC1(N)CC1 Amb26530454 [0,0,0,1,0,1|2,0,0]=4 5659 B8R1.42 NC1(CC(=O)O)CC1 Amb18833024 [0,0,0,1,0,1|1,0,0]=3 5660 B8R1.42 NC1(CC(=O)O)CC1 Amb33550832 [0,0,0,1,0,1|1,0,0]=3 5661 B8R1.42 O=C(O)CC1(Br)CC1 Amb27261767 [0,0,0,1,0,1|2,0,0]=4 5662 B8R1.42 O=C(O)CC1(Cl)CC1 Amb35743975 [0,0,0,1,0,1|2,0,0]=4 5663 B8R1.42 O=C(O)CC1(F)CC1 Amb28434812 [0,0,0,1,0,1|2,0,0]=4 5664 B8R1.42 O=C(O)CC1(O)CC1 Amb24117238 [0,0,0,1,0,1|2,0,0]=4 5665 B8R1.43 CC(=O)[C@@H]1C[C@@H]1CO Amb28074697 [0,0,0,1,0,1|2,0,0]=4 5666 B8R1.43 CC(=O)[C@@H]1C[C@H]1CO Amb26561383 [0,0,0,1,0,1|2,0,0]=4 5667 B8R1.43 CCC1CC1C(=O)O Amb18961272 [0,0,0,1,0,1|2,0,0]=4 5668 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O Amb24112910 [0,0,0,1,0,1|2,0,0]=4 5669 B8R1.43 CC[C@@H]1O[C@@H]1C(=O)O Amb27855470 [0,0,0,1,0,1|2,0,0]=4 5670 B8R1.43 CC[C@H]1C[C@H]1C(=O)O Amb33098417 [0,0,0,1,0,1|2,0,0]=4 5671 B8R1.43 CC[C@H]1O[C@@H]1C(=O)O Amb27811556 [0,0,0,1,0,1|2,0,0]=4 5672 B8R1.43 CC[C@H]1O[C@H]1C(=O)O Amb27222314 [0,0,0,1,0,1|2,0,0]=4 5673 B8R1.43 NC(=O)C1CC1CO Amb23538670 [0,0,0,1,0,1|2,0,0]=4 5674 B8R1.43 NCC1CC1C(=O)O Amb2694938 [0,0,0,1,0,1|2,0,0]=4 5675 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb24680970 [0,0,0,1,0,1|2,0,0]=4 5676 B8R1.43 NC[C@@H]1C[C@@H]1C(=O)O Amb32992808 [0,0,0,1,0,1|2,0,0]=4 5677 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O Amb27205078 [0,0,0,1,0,1|2,0,0]=4 5678 B8R1.43 NC[C@H]1C[C@@H]1C(=O)O Amb27252099 [0,0,0,1,0,1|2,0,0]=4 5679 B8R1.43 NC[C@H]1C[C@H]1C(=O)O Amb28069146 [0,0,0,1,0,1|2,0,0]=4 5680 B8R1.43 O=C(O)C1CC1CBr Amb27407770 [0,0,0,1,0,1|2,0,0]=4 5681 B8R1.43 O=C(O)C1CC1CCl Amb26895220 [0,0,0,1,0,1|2,0,0]=4 5682 B8R1.43 O=C(O)C1CC1CO Amb25173469 [0,0,0,1,0,1|1,0,0]=3 5683 B8R1.43 O=C(O)[C@@H]1C[C@@H]1CO Amb28198703 [0,0,0,1,0,1|1,0,0]=3 5684 B8R1.43 O=C(O)[C@@H]1C[C@H]1CBr Amb26552185 [0,0,0,1,0,1|2,0,0]=4 5685 B8R1.43 O=C(O)[C@@H]1C[C@H]1CF Amb33098414 [0,0,0,1,0,1|2,0,0]=4 5686 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO Amb25231147 [0,0,0,1,0,1|1,0,0]=3 5687 B8R1.43 O=C(O)[C@H]1C[C@H]1CO Amb26916980 [0,0,0,1,0,1|1,0,0]=3 5688 B8R1.43 O=C([O-])C1CC1CO Amb33534503 [0,0,0,1,0,1|1,0,1]=4 5689 B8R1.43 O=C([O-])[C@@H]1C[C@H]1CO Amb35789135 [0,0,0,1,0,1|1,0,1]=4 5690 B8R1.62 CC1(CO)CC(=O)C1 Amb22406263 [0,0,0,1,0,1|2,0,0]=4 5691 B8R1.62 O=C1CC(Cl)(CCl)O1 Amb27493123 [0,0,0,1,0,1|2,0,0]=4 5692 B8R1.67 CC1C(Cl)C1C(=O)O Amb32656377 [0,0,0,1,0,1|2,0,0]=4 5693 B8R1.67 C[C@@H]1C(C(=O)O)[C@@H]1C Amb25937319 [0,0,0,1,0,1|2,0,0]=4 5694 B8R1.67 C[C@@H]1[C@@H](N)[C@@H]1C(=O)O Amb28365983 [0,0,0,1,0,1|1,0,0]=3 5695 B8R1.67 O=C(O)C1C(Cl)C1Cl Amb25918156 [0,0,0,1,0,1|2,0,0]=4 5696 B8R1.5 CC1CCCOC1=O Amb26933974 [0,1,0,1,0,0|2,0,0]=4 5697 B8R1.5 CC1CCOCC1=O Amb25718285 [0,1,0,1,0,0|2,0,0]=4 5698 B8R1.5 CC1COC=CC1=O Amb28124249 [0,1,0,1,0,0|2,0,0]=4 5699 B8R1.5 CC1COCCC1=O Amb21856147 [0,1,0,1,0,0|2,0,0]=4 5700 B8R1.5 NC1CCCCC1=O Amb17939051 [0,1,0,1,0,0|2,0,0]=4 5701 B8R1.5 NC1CCCCC1=O Amb22001819 [0,1,0,1,0,0|2,0,0]=4 5702 B8R1.5 NC1CCCNC1=O Amb1088746 [0,1,0,1,0,0|2,0,0]=4 5703 B8R1.5 NC1CCCNC1=O Amb8428208 [0,1,0,1,0,0|2,0,0]=4 5704 B8R1.5 NC1CCOCC1O Amb18198453 [0,1,0,1,0,0|1,0,1]=4 5705 B8R1.5 NC1CCOCC1O Amb28934888 [0,1,0,1,0,0|1,0,1]=4 5706 B8R1.5 NC1CCONC1=O Amb22295935 [0,1,0,1,0,0|1,0,0]=3 5707 B8R1.5 NC1CNCCC1=O Amb27635311 [0,1,0,1,0,0|2,0,0]=4 5708 B8R1.5 NC1COCCC1=O Amb18833021 [0,1,0,1,0,0|1,0,0]=3 5709 B8R1.5 NC1COCCC1=O Amb32670691 [0,1,0,1,0,0|1,0,0]=3 5710 B8R1.5 NC1COCCC1O Amb18198755 [0,1,0,1,0,0|1,0,1]=4 5711 B8R1.5 NC1COCCC1O Amb32753157 [0,1,0,1,0,0|1,0,1]=4 5712 B8R1.5 NC1CSCCC1=O Amb4296938 [0,1,0,1,0,0|1,1,0]=4 5713 B8R1.5 NN1CCCOC1=O Amb17608306 [0,1,0,1,0,0|2,0,0]=4 5714 B8R1.5 NN1CCOCC1=O Amb27238452 [0,1,0,1,0,0|2,0,0]=4 5715 B8R1.5 N[C@@H]1CCCNC1=O Amb19943908 [0,1,0,1,0,0|2,0,0]=4 5716 B8R1.5 N[C@@H]1CCCNC1=O Amb22388613 [0,1,0,1,0,0|2,0,0]=4 5717 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb22406155 [0,1,0,1,0,0|1,0,1]=4 5718 B8R1.5 N[C@@H]1CCOC[C@@H]1O Amb23385312 [0,1,0,1,0,0|1,0,1]=4 5719 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb22406158 [0,1,0,1,0,0|1,0,1]=4 5720 B8R1.5 N[C@@H]1CCOC[C@H]1O Amb23385253 [0,1,0,1,0,0|1,0,1]=4 5721 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb23385320 [0,1,0,1,0,0|1,0,1]=4 5722 B8R1.5 N[C@@H]1COCC[C@@H]1O Amb26888092 [0,1,0,1,0,0|1,0,1]=4 5723 B8R1.5 N[C@@H]1COCC[C@H]1O Amb22748653 [0,1,0,1,0,0|1,0,1]=4 5724 B8R1.5 N[C@@H]1COCC[C@H]1O Amb23385302 [0,1,0,1,0,0|1,0,1]=4 5725 B8R1.5 N[C@H]1CCCNC1=O Amb10603272 [0,1,0,1,0,0|2,0,0]=4 5726 B8R1.5 N[C@H]1CCCNC1=O Amb8631316 [0,1,0,1,0,0|2,0,0]=4 5727 B8R1.5 N[C@H]1CCOC[C@@H]1O Amb25970035 [0,1,0,1,0,0|1,0,1]=4 5728 B8R1.5 N[C@H]1CCOC[C@@H]1O Amb33725444 [0,1,0,1,0,0|1,0,1]=4 5729 B8R1.5 N[C@H]1CCOC[C@H]1O Amb26407654 [0,1,0,1,0,0|1,0,1]=4 5730 B8R1.5 N[C@H]1CCOC[C@H]1O Amb33801116 [0,1,0,1,0,0|1,0,1]=4 5731 B8R1.5 N[C@H]1COCC[C@@H]1O Amb25231772 [0,1,0,1,0,0|1,0,1]=4 5732 B8R1.5 N[C@H]1COCC[C@H]1O Amb24617518 [0,1,0,1,0,0|1,0,1]=4 5733 B8R1.5 N[C@H]1COCC[C@H]1O Amb33872533 [0,1,0,1,0,0|1,0,1]=4 5734 B8R1.5 O=C1CCOCC1Br Amb21864837 [0,1,0,1,0,0|2,0,0]=4 5735 B8R1.5 O=C1CCOCC1Cl Amb21857938 [0,1,0,1,0,0|2,0,0]=4 5736 B8R1.5 O=C1CCOCC1F Amb19958536 [0,1,0,1,0,0|2,0,0]=4 5737 B8R1.5 O=C1CCOCC1O Amb26966688 [0,1,0,1,0,0|2,0,0]=4 5738 B8R1.5 O=C1CCOC[C@@H]1Br Amb26936362 [0,1,0,1,0,0|2,0,0]=4 5739 B8R1.5 O=C1CCOC[C@@H]1F Amb27813369 [0,1,0,1,0,0|2,0,0]=4 5740 B8R1.5 O=C1CCOC[C@H]1F Amb24732439 [0,1,0,1,0,0|2,0,0]=4 5741 B8R1.5 O=C1COCCC1Br Amb24416092 [0,1,0,1,0,0|2,0,0]=4 5742 B8R1.5 O=C1COCCC1F Amb28048950 [0,1,0,1,0,0|2,0,0]=4 5743 B8R1.5 O=C1COCC[C@H]1F Amb27207103 [0,1,0,1,0,0|2,0,0]=4 5744 B8R1.5 O=C1OCCCC1Br Amb22289164 [0,1,0,1,0,0|2,0,0]=4 5745 B8R1.5 O=C1OCCCC1Cl Amb28195106 [0,1,0,1,0,0|2,0,0]=4 5746 B8R1.5 O=C1OCCCC1O Amb19959000 [0,1,0,1,0,0|2,0,0]=4 5747 B8R1.5 O=C1OCCSC1Br Amb27776793 [0,1,0,1,0,0|2,0,0]=4 5748 B8R1.7 CC(=O)C1CC=CN1 Amb26979687 [0,1,0,1,0,0|2,0,0]=4 5749 B8R1.7 CC(=O)C1CCCN1 Amb17231815 [0,1,0,1,0,0|2,0,0]=4 5750 B8R1.7 CC(=O)C1CCCN1 Amb33870768 [0,1,0,1,0,0|2,0,0]=4 5751 B8R1.7 CC(=O)C1CCNC1 Amb18833067 [0,1,0,1,0,0|2,0,0]=4 5752 B8R1.7 CC(=O)C1CCNC1 Amb22899078 [0,1,0,1,0,0|2,0,0]=4 5753 B8R1.7 CC(=O)C1CCOC1 Amb18833038 [0,1,0,1,0,0|2,0,0]=4 5754 B8R1.7 CC(=O)C1NCCS1 Amb22757393 [0,1,0,1,0,0|2,0,0]=4 5755 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb27170693 [0,1,0,1,0,0|2,0,0]=4 5756 B8R1.7 CC(=O)[C@@H]1CCCN1 Amb31291120 [0,1,0,1,0,0|2,0,0]=4 5757 B8R1.7 CC(=O)[C@@H]1CCNC1 Amb30039124 [0,1,0,1,0,0|2,0,0]=4 5758 B8R1.7 CC(=O)[C@H]1CCCN1 Amb27453624 [0,1,0,1,0,0|2,0,0]=4 5759 B8R1.7 CC(=O)[C@H]1CCNC1 Amb33132071 [0,1,0,1,0,0|2,0,0]=4 5760 B8R1.7 NC(=O)C1CCCN1 Amb2720282 [0,1,0,1,0,0|2,0,0]=4 5761 B8R1.7 NC(=O)C1CCCN1 Amb9724672 [0,1,0,1,0,0|2,0,0]=4 5762 B8R1.7 NC(=O)C1CCNC1 Amb19373271 [0,1,0,1,0,0|2,0,0]=4 5763 B8R1.7 NC(=O)C1CCNC1 Amb9728548 [0,1,0,1,0,0|2,0,0]=4 5764 B8R1.7 NC(=O)C1CCOC1 Amb9677690 [0,1,0,1,0,0|2,0,0]=4 5765 B8R1.7 NC(=O)C1CSCN1 Amb2967256 [0,1,0,1,0,0|1,1,0]=4 5766 B8R1.7 NC(=O)C1NCCS1 Amb27655014 [0,1,0,1,0,0|2,0,0]=4 5767 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb20240600 [0,1,0,1,0,0|2,0,0]=4 5768 B8R1.7 NC(=O)[C@@H]1CCCN1 Amb2690398 [0,1,0,1,0,0|2,0,0]=4 5769 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb20671394 [0,1,0,1,0,0|2,0,0]=4 5770 B8R1.7 NC(=O)[C@@H]1CCNC1 Amb22405894 [0,1,0,1,0,0|2,0,0]=4 5771 B8R1.7 NC(=O)[C@@H]1CCOC1 Amb27413583 [0,1,0,1,0,0|2,0,0]=4 5772 B8R1.7 NC(=O)[C@@H]1COCN1 Amb27194677 [0,1,0,1,0,0|1,0,0]=3 5773 B8R1.7 NC(=O)[C@H]1CCCN1 Amb17942785 [0,1,0,1,0,0|2,0,0]=4 5774 B8R1.7 NC(=O)[C@H]1CCCN1 Amb2690397 [0,1,0,1,0,0|2,0,0]=4 5775 B8R1.7 NC(=O)[C@H]1CCNC1 Amb20671395 [0,1,0,1,0,0|2,0,0]=4 5776 B8R1.7 NC(=O)[C@H]1CCNC1 Amb22405893 [0,1,0,1,0,0|2,0,0]=4 5777 B8R1.7 NC(=O)[C@H]1CCOC1 Amb33228699 [0,1,0,1,0,0|2,0,0]=4 5778 B8R1.7 O=C(Cl)C1CCCN1 Amb27258805 [0,1,0,1,0,0|2,0,0]=4 5779 B8R1.7 O=C(Cl)C1CCNC1 Amb28316213 [0,1,0,1,0,0|2,0,0]=4 5780 B8R1.7 O=C(Cl)C1CCOC1 Amb9677595 [0,1,0,1,0,0|2,0,0]=4 5781 B8R1.7 O=C(Cl)C1CSCN1 Amb17142875 [0,1,0,1,0,0|1,1,0]=4 5782 B8R1.7 O=C(Cl)[C@@H]1CCCN1 Amb28313801 [0,1,0,1,0,0|2,0,0]=4 5783 B8R1.7 O=C(O)C1=CCCN1 Amb17593173 [0,1,0,1,0,0|1,0,1]=4 5784 B8R1.7 O=C(O)C1=CCOC1 Amb24434391 [0,1,0,1,0,0|1,0,1]=4 5785 B8R1.7 O=C(O)C1=COCC1 Amb18124248 [0,1,0,1,0,0|1,0,1]=4 5786 B8R1.7 O=C(O)C1=NCCN1 Amb27787520 [0,1,0,1,0,0|1,0,1]=4 5787 B8R1.7 O=C(O)C1=NOCC1 Amb24353499 [0,1,0,1,0,0|0,0,2]=4 5788 B8R1.7 O=C(O)C1C=CCC1 Amb18641680 [0,1,0,1,0,0|2,0,0]=4 5789 B8R1.7 O=C(O)C1C=CCN1 Amb22899488 [0,1,0,1,0,0|1,0,1]=4 5790 B8R1.7 O=C(O)C1C=CCN1 Amb9804432 [0,1,0,1,0,0|1,0,1]=4 5791 B8R1.7 O=C(O)C1C=CCO1 Amb18641762 [0,1,0,1,0,0|2,0,0]=4 5792 B8R1.7 O=C(O)C1CC=CC1 Amb2694750 [0,1,0,1,0,0|2,0,0]=4 5793 B8R1.7 O=C(O)C1CC=NN1 Amb18641765 [0,1,0,1,0,0|1,0,0]=3 5794 B8R1.7 O=C(O)C1CC=NO1 Amb27216537 [0,1,0,1,0,0|1,0,1]=4 5795 B8R1.7 O=C(O)C1CCC=N1 Amb27849168 [0,1,0,1,0,0|1,0,1]=4 5796 B8R1.7 O=C(O)C1CCCC1 Amb3939849 [0,1,0,1,0,0|2,0,0]=4 5797 B8R1.7 O=C(O)C1CCCN1 Amb1157517 [0,1,0,1,0,0|1,0,0]=3 5798 B8R1.7 O=C(O)C1CCCN1 Amb22040086 [0,1,0,1,0,0|1,0,0]=3 5799 B8R1.7 O=C(O)C1CCCO1 Amb9702828 [0,1,0,1,0,0|2,0,0]=4 5800 B8R1.7 O=C(O)C1CCCS1 Amb18124363 [0,1,0,1,0,0|2,0,0]=4 5801 B8R1.7 O=C(O)C1CCNC1 Amb16230724 [0,1,0,1,0,0|1,0,0]=3 5802 B8R1.7 O=C(O)C1CCNC1 Amb16233446 [0,1,0,1,0,0|1,0,0]=3 5803 B8R1.7 O=C(O)C1CCNC1 Amb2694866 [0,1,0,1,0,0|1,0,0]=3 5804 B8R1.7 O=C(O)C1CCNO1 Amb28205451 [0,1,0,1,0,0|1,0,0]=3 5805 B8R1.7 O=C(O)C1CCNO1 Amb33329025 [0,1,0,1,0,0|1,0,0]=3 5806 B8R1.7 O=C(O)C1CCOC1 Amb33542759 [0,1,0,1,0,0|1,0,0]=3 5807 B8R1.7 O=C(O)C1CCSC1 Amb18124360 [0,1,0,1,0,0|1,1,0]=4 5808 B8R1.7 O=C(O)C1CCSS1 Amb8388097 [0,1,0,1,0,0|1,1,0]=4 5809 B8R1.7 O=C(O)C1CNCN1 Amb27597638 [0,1,0,1,0,0|1,0,0]=3 5810 B8R1.7 O=C(O)C1COC=N1 Amb28291372 [0,1,0,1,0,0|0,0,1]=3 5811 B8R1.7 O=C(O)C1COCN1 Amb2694915 [0,1,0,1,0,0|0,0,0]=2 5812 B8R1.7 O=C(O)C1COCN1 Amb2696354 [0,1,0,1,0,0|0,0,0]=2 5813 B8R1.7 O=C(O)C1COCO1 Amb27810510 [0,1,0,1,0,0|1,0,0]=3 5814 B8R1.7 O=C(O)C1CSCN1 Amb532947 [0,1,0,1,0,0|0,1,0]=3 5815 B8R1.7 O=C(O)C1CSSC1 Amb17593735 [0,1,0,1,0,0|1,1,0]=4 5816 B8R1.7 O=C(O)C1NCCS1 Amb2444644 [0,1,0,1,0,0|1,0,0]=3 5817 B8R1.7 O=C(O)C1OCCO1 Amb24349582 [0,1,0,1,0,0|2,0,0]=4 5818 B8R1.7 O=C(O)C1SCCS1 Amb20669087 [0,1,0,1,0,0|2,0,0]=4 5819 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb16183937 [0,1,0,1,0,0|1,0,1]=4 5820 B8R1.7 O=C(O)[C@@H]1C=CCN1 Amb22750611 [0,1,0,1,0,0|1,0,1]=4 5821 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb3940757 [0,1,0,1,0,0|1,0,0]=3 5822 B8R1.7 O=C(O)[C@@H]1CCCN1 Amb6754105 [0,1,0,1,0,0|1,0,0]=3 5823 B8R1.7 O=C(O)[C@@H]1CCCO1 Amb3940908 [0,1,0,1,0,0|2,0,0]=4 5824 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb6893875 [0,1,0,1,0,0|1,0,0]=3 5825 B8R1.7 O=C(O)[C@@H]1CCNC1 Amb8630322 [0,1,0,1,0,0|1,0,0]=3 5826 B8R1.7 O=C(O)[C@@H]1CCOC1 Amb10603235 [0,1,0,1,0,0|1,0,0]=3 5827 B8R1.7 O=C(O)[C@@H]1CCON1 Amb26919409 [0,1,0,1,0,0|0,0,0]=2 5828 B8R1.7 O=C(O)[C@@H]1COCN1 Amb19515958 [0,1,0,1,0,0|0,0,0]=2 5829 B8R1.7 O=C(O)[C@@H]1CSC=N1 Amb35648199 [0,1,0,1,0,0|0,1,1]=4 5830 B8R1.7 O=C(O)[C@@H]1CSCN1 Amb3940400 [0,1,0,1,0,0|0,1,0]=3 5831 B8R1.7 O=C(O)[C@H]1C=CCC1 Amb27872028 [0,1,0,1,0,0|2,0,0]=4 5832 B8R1.7 O=C(O)[C@H]1C=CCN1 Amb34158387 [0,1,0,1,0,0|1,0,1]=4 5833 B8R1.7 O=C(O)[C@H]1CCC=N1 Amb28128325 [0,1,0,1,0,0|1,0,1]=4 5834 B8R1.7 O=C(O)[C@H]1CCCN1 Amb2720569 [0,1,0,1,0,0|1,0,0]=3 5835 B8R1.7 O=C(O)[C@H]1CCCO1 Amb3941554 [0,1,0,1,0,0|2,0,0]=4 5836 B8R1.7 O=C(O)[C@H]1CCNC1 Amb2700058 [0,1,0,1,0,0|1,0,0]=3 5837 B8R1.7 O=C(O)[C@H]1CCNC1 Amb6893874 [0,1,0,1,0,0|1,0,0]=3 5838 B8R1.7 O=C(O)[C@H]1CCOC1 Amb22226787 [0,1,0,1,0,0|1,0,0]=3 5839 B8R1.7 O=C(O)[C@H]1CCSC1 Amb28241390 [0,1,0,1,0,0|1,1,0]=4 5840 B8R1.7 O=C(O)[C@H]1CNCS1 Amb27414077 [0,1,0,1,0,0|2,0,0]=4 5841 B8R1.7 O=C(O)[C@H]1CSC=N1 Amb35641724 [0,1,0,1,0,0|0,1,1]=4 5842 B8R1.7 O=C(O)[C@H]1CSCN1 Amb544887 [0,1,0,1,0,0|0,1,0]=3 5843 B8R1.7 O=C(O)[C@H]1NCCS1 Amb25920370 [0,1,0,1,0,0|1,0,0]=3 5844 B8R1.7 O=C(S)[C@@H]1CCCN1 Amb27468669 [0,1,0,1,0,0|1,1,0]=4 5845 B8R1.7 O=C([O-])[C@@H]1CCCN1 Amb34160472 [0,1,0,1,0,0|1,0,1]=4 5846 B8R1.7 O=S(O)C1NCCN1 Amb27846291 [0,1,0,1,0,0|2,0,0]=4 5847 B8R1.7 O=[PH](O)C1CCCN1 Amb27450678 [0,1,0,1,0,0|2,0,0]=4 5848 B8R1.13 COCC1CCC1=O Amb28069700 [0,1,0,1,0,0|2,0,0]=4 5849 B8R1.19 CC1(Br)CCOC1=O Amb3940887 [0,1,0,1,0,0|2,0,0]=4 5850 B8R1.19 CC1(C)CCOC1=O Amb10603955 [0,1,0,1,0,0|2,0,0]=4 5851 B8R1.19 CC1(C)COCC1=O Amb26970932 [0,1,0,1,0,0|2,0,0]=4 5852 B8R1.19 CC1(C)CONC1=O Amb21927202 [0,1,0,1,0,0|2,0,0]=4 5853 B8R1.19 CC1(N)CCNC1=O Amb18124254 [0,1,0,1,0,0|2,0,0]=4 5854 B8R1.19 CC1(N)CCOC1=O Amb28934923 [0,1,0,1,0,0|1,0,0]=3 5855 B8R1.19 CC1(N)CCSC1=O Amb27838410 [0,1,0,1,0,0|1,1,0]=4 5856 B8R1.19 C[C@@]1(N)CONC1=O Amb25929798 [0,1,0,1,0,0|1,0,0]=3 5857 B8R1.19 C[C@]1(N)CCOC1=O Amb27629673 [0,1,0,1,0,0|1,0,0]=3 5858 B8R1.19 C[C@]1(N)CCSC1=O Amb27431520 [0,1,0,1,0,0|1,1,0]=4 5859 B8R1.19 C[C@]1(N)CONC1=O Amb25947476 [0,1,0,1,0,0|1,0,0]=3 5860 B8R1.19 O=C1OCCC1(Br)Br Amb25227692 [0,1,0,1,0,0|2,0,0]=4 5861 B8R1.23 C=C1CC(C(=O)O)C1 Amb613197 [0,1,0,1,0,0|2,0,0]=4 5862 B8R1.23 CC(=O)C1CC(O)C1 Amb25718423 [0,1,0,1,0,0|2,0,0]=4 5863 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [0,1,0,1,0,0|2,0,0]=4 5864 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [0,1,0,1,0,0|1,0,0]=3 5865 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [0,1,0,1,0,0|1,0,0]=3 5866 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [0,1,0,1,0,0|2,0,0]=4 5867 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [0,1,0,1,0,0|1,0,0]=3 5868 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [0,1,0,1,0,0|1,0,0]=3 5869 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [0,1,0,1,0,0|1,0,0]=3 5870 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [0,1,0,1,0,0|1,0,0]=3 5871 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [0,1,0,1,0,0|2,0,0]=4 5872 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [0,1,0,1,0,0|2,0,0]=4 5873 B8R1.23 NC(=O)C1CC(=O)N1 Amb27214249 [0,1,0,1,0,0|1,0,1]=4 5874 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [0,1,0,1,0,0|2,0,0]=4 5875 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [0,1,0,1,0,0|2,0,0]=4 5876 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [0,1,0,1,0,0|2,0,0]=4 5877 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [0,1,0,1,0,0|2,0,0]=4 5878 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [0,1,0,1,0,0|2,0,0]=4 5879 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [0,1,0,1,0,0|2,0,0]=4 5880 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [0,1,0,1,0,0|2,0,0]=4 5881 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [0,1,0,1,0,0|2,0,0]=4 5882 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [0,1,0,1,0,0|2,0,0]=4 5883 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [0,1,0,1,0,0|1,0,0]=3 5884 B8R1.23 O=C(O)C1CS(=O)C1 Amb26056015 [0,1,0,1,0,0|1,0,1]=4 5885 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [0,1,0,1,0,0|2,0,0]=4 5886 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [0,1,0,1,0,0|2,0,0]=4 5887 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [0,1,0,1,0,0|2,0,0]=4 5888 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [0,1,0,1,0,0|1,0,0]=3 5889 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [0,1,0,1,0,0|2,0,0]=4 5890 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [0,1,0,1,0,0|2,0,0]=4 5891 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [0,1,0,1,0,0|2,0,0]=4 5892 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [0,1,0,1,0,0|1,0,0]=3 5893 B8R1.23 O=C1CC(C(=O)O)C1 Amb33544325 [0,1,0,1,0,0|1,0,1]=4 5894 B8R1.23 O=C1CC(C(=O)O)N1 Amb16232079 [0,1,0,1,0,0|0,0,1]=3 5895 B8R1.23 O=C1CC(C(=O)O)O1 Amb26887454 [0,1,0,1,0,0|1,0,1]=4 5896 B8R1.23 O=C1CC(S(=O)O)N1 Amb27595618 [0,1,0,1,0,0|1,0,1]=4 5897 B8R1.23 O=C1C[C@@H](C(=O)O)N1 Amb22367070 [0,1,0,1,0,0|0,0,1]=3 5898 B8R1.23 O=C1C[C@H](C(=O)O)N1 Amb26975061 [0,1,0,1,0,0|0,0,1]=3 5899 B8R1.24 CC1(C)C(=O)CC1O Amb24707960 [0,1,0,1,0,0|2,0,0]=4 5900 B8R1.30 C=C1CC1(N)C(=O)O Amb22274582 [0,1,0,1,0,0|1,0,0]=3 5901 B8R1.30 CC1(C(=O)O)CC1Br Amb25889224 [0,1,0,1,0,0|2,0,0]=4 5902 B8R1.30 CC1(C(=O)O)CC1Cl Amb28325885 [0,1,0,1,0,0|2,0,0]=4 5903 B8R1.30 CC1(C(=O)O)CC1F Amb24445672 [0,1,0,1,0,0|2,0,0]=4 5904 B8R1.30 CC1CC1(C)C(=O)O Amb28456906 [0,1,0,1,0,0|2,0,0]=4 5905 B8R1.30 CC1CC1(F)C(=O)O Amb32679974 [0,1,0,1,0,0|2,0,0]=4 5906 B8R1.30 CC1CC1(N)C(=O)O Amb26066646 [0,1,0,1,0,0|1,0,0]=3 5907 B8R1.30 CC1CC1(N)C(N)=O Amb28434643 [0,1,0,1,0,0|2,0,0]=4 5908 B8R1.30 C[C@@H]1C[C@@]1(C)C(=O)O Amb24680945 [0,1,0,1,0,0|2,0,0]=4 5909 B8R1.30 C[C@@H]1C[C@@]1(N)C(N)=O Amb27969162 [0,1,0,1,0,0|2,0,0]=4 5910 B8R1.30 C[C@@H]1C[C@@]1(O)C(=O)O Amb28133921 [0,1,0,1,0,0|2,0,0]=4 5911 B8R1.30 C[C@@H]1O[C@]1(C)C(=O)O Amb28057500 [0,1,0,1,0,0|1,0,0]=3 5912 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1Cl Amb28134278 [0,1,0,1,0,0|2,0,0]=4 5913 B8R1.30 C[C@@]1(C(=O)O)C[C@@H]1F Amb24053139 [0,1,0,1,0,0|2,0,0]=4 5914 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Br Amb27222642 [0,1,0,1,0,0|2,0,0]=4 5915 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1Cl Amb28196682 [0,1,0,1,0,0|2,0,0]=4 5916 B8R1.30 C[C@@]1(C(=O)O)C[C@H]1F Amb26656665 [0,1,0,1,0,0|2,0,0]=4 5917 B8R1.30 C[C@H]1C[C@@]1(C)C(=O)O Amb27789627 [0,1,0,1,0,0|2,0,0]=4 5918 B8R1.30 C[C@H]1C[C@@]1(Cl)C(=O)O Amb28286348 [0,1,0,1,0,0|2,0,0]=4 5919 B8R1.30 C[C@H]1C[C@]1(N)C(=O)O Amb27873946 [0,1,0,1,0,0|1,0,0]=3 5920 B8R1.30 C[C@H]1C[C@]1(N)C(N)=O Amb27419998 [0,1,0,1,0,0|2,0,0]=4 5921 B8R1.30 C[C@H]1C[C@]1(O)C(=O)O Amb27881113 [0,1,0,1,0,0|2,0,0]=4 5922 B8R1.30 C[C@]1(C(=O)O)C[C@@H]1F Amb26987734 [0,1,0,1,0,0|2,0,0]=4 5923 B8R1.30 C[C@]1(C(=O)O)C[C@H]1F Amb26870422 [0,1,0,1,0,0|2,0,0]=4 5924 B8R1.30 NC1(C(=O)O)CC1Br Amb27430541 [0,1,0,1,0,0|1,0,0]=3 5925 B8R1.30 NC1(C(=O)O)CC1Cl Amb27596928 [0,1,0,1,0,0|1,0,0]=3 5926 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Br Amb28411230 [0,1,0,1,0,0|1,0,0]=3 5927 B8R1.30 N[C@@]1(C(=O)O)C[C@@H]1Cl Amb25245700 [0,1,0,1,0,0|1,0,0]=3 5928 B8R1.30 N[C@@]1(C(=O)O)C[C@H]1Cl Amb28436769 [0,1,0,1,0,0|1,0,0]=3 5929 B8R1.30 N[C@]1(C(=O)O)C[C@@H]1Cl Amb26587370 [0,1,0,1,0,0|1,0,0]=3 5930 B8R1.30 N[C@]1(C(=O)O)C[C@H]1Cl Amb22748908 [0,1,0,1,0,0|1,0,0]=3 5931 B8R1.46 C=C1C(=O)N[C@H]1CC Amb27251965 [0,1,0,1,0,0|2,0,0]=4 5932 B8R1.46 CC1C(=O)NC1CO Amb27785549 [0,1,0,1,0,0|1,0,1]=4 5933 B8R1.46 NC1C(=O)NC1CCl Amb27429760 [0,1,0,1,0,0|2,0,0]=4 5934 B8R1.46 NC1C(=O)NC1CO Amb27985586 [0,1,0,1,0,0|1,0,0]=3 5935 B8R1.46 N[C@@H]1C(=O)N[C@@H]1CO Amb28058411 [0,1,0,1,0,0|1,0,0]=3 5936 B8R1.46 O=C1CC(CO)C1F Amb27973059 [0,1,0,1,0,0|2,0,0]=4 5937 B8R1.46 O=C1C[C@H](CO)N1O Amb27833657 [0,1,0,1,0,0|2,0,0]=4 5938 B8R1.46 O=C1O[C@H](CO)[C@H]1O Amb27659903 [0,1,0,1,0,0|1,0,0]=3 5939 B8R1.54 CC(=O)C(N)C1CC1 Amb27668423 [0,1,0,1,0,0|2,0,0]=4 5940 B8R1.54 CC(C(=O)O)C1CC1 Amb33537630 [0,1,0,1,0,0|2,0,0]=4 5941 B8R1.54 C[C@@H](C(=O)O)C1CC1 Amb33732043 [0,1,0,1,0,0|2,0,0]=4 5942 B8R1.54 C[C@H](C(=O)O)C1CC1 Amb33744363 [0,1,0,1,0,0|2,0,0]=4 5943 B8R1.54 NC(=O)C(N)C1CC1 Amb18282442 [0,1,0,1,0,0|2,0,0]=4 5944 B8R1.54 NC(=O)C(N)C1CC1 Amb28991331 [0,1,0,1,0,0|2,0,0]=4 5945 B8R1.54 NC(=O)[C@H](N)C1CC1 Amb27436476 [0,1,0,1,0,0|2,0,0]=4 5946 B8R1.54 NC(C(=O)O)C1CC1 Amb19515010 [0,1,0,1,0,0|1,0,0]=3 5947 B8R1.54 NC(C(=O)O)C1CC1 Amb2696737 [0,1,0,1,0,0|1,0,0]=3 5948 B8R1.54 N[C@@H](C(=O)O)C1CC1 Amb2699141 [0,1,0,1,0,0|1,0,0]=3 5949 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb19929447 [0,1,0,1,0,0|1,0,0]=3 5950 B8R1.54 N[C@H](C(=O)O)C1CC1 Amb2694840 [0,1,0,1,0,0|1,0,0]=3 5951 B8R1.54 O=C(O)C(F)C1CC1 Amb25936979 [0,1,0,1,0,0|2,0,0]=4 5952 B8R1.54 O=C(O)C(O)C1CC1 Amb18282441 [0,1,0,1,0,0|2,0,0]=4 5953 B8R1.78 C=C(O)C1(C)COC1 Amb27790823 [0,1,0,1,0,0|2,0,0]=4 5954 B8R1.78 CC(=O)C1(C)CCN1 Amb35747959 [0,1,0,1,0,0|2,0,0]=4 5955 B8R1.78 CC(=O)C1(C)CCN1 Amb35748148 [0,1,0,1,0,0|2,0,0]=4 5956 B8R1.78 CC(=O)C1(C)COC1 Amb22406104 [0,1,0,1,0,0|2,0,0]=4 5957 B8R1.78 CC(=O)C1(N)CCC1 Amb26578364 [0,1,0,1,0,0|2,0,0]=4 5958 B8R1.78 CC1(C(=O)O)CCC1 Amb33544631 [0,1,0,1,0,0|2,0,0]=4 5959 B8R1.78 CC1(C(=O)O)CCN1 Amb24483061 [0,1,0,1,0,0|1,0,0]=3 5960 B8R1.78 CC1(C(=O)O)CCN1 Amb33483840 [0,1,0,1,0,0|1,0,0]=3 5961 B8R1.78 CC1(C(=O)O)CCN1 Amb34138205 [0,1,0,1,0,0|1,0,0]=3 5962 B8R1.78 CC1(C(=O)O)CCO1 Amb22001906 [0,1,0,1,0,0|1,0,0]=3 5963 B8R1.78 CC1(C(=O)O)CNC1 Amb24077476 [0,1,0,1,0,0|2,0,0]=4 5964 B8R1.78 CC1(C(=O)O)CNC1 Amb24561978 [0,1,0,1,0,0|2,0,0]=4 5965 B8R1.78 CC1(C(=O)O)COC1 Amb33543882 [0,1,0,1,0,0|1,0,0]=3 5966 B8R1.78 CC1(C(=O)O)CSC1 Amb21960451 [0,1,0,1,0,0|1,1,0]=4 5967 B8R1.78 CC1(C(N)=O)COC1 Amb27837831 [0,1,0,1,0,0|2,0,0]=4 5968 B8R1.78 NC(=O)C1(N)CCC1 Amb18523727 [0,1,0,1,0,0|2,0,0]=4 5969 B8R1.78 NC(=O)C1(N)CCC1 Amb33550276 [0,1,0,1,0,0|2,0,0]=4 5970 B8R1.78 NC(=O)C1(N)CNC1 Amb26851458 [0,1,0,1,0,0|2,0,0]=4 5971 B8R1.78 NC(=O)C1(N)CNC1 Amb33482864 [0,1,0,1,0,0|2,0,0]=4 5972 B8R1.78 NC(=O)C1(N)COC1 Amb24483241 [0,1,0,1,0,0|1,0,0]=3 5973 B8R1.78 NC(=O)C1(N)COC1 Amb32679270 [0,1,0,1,0,0|1,0,0]=3 5974 B8R1.78 NC1(C(=O)Cl)CCC1 Amb32409362 [0,1,0,1,0,0|2,0,0]=4 5975 B8R1.78 NC1(C(=O)F)CCC1 Amb34148081 [0,1,0,1,0,0|2,0,0]=4 5976 B8R1.78 NC1(C(=O)O)CCC1 Amb2694933 [0,1,0,1,0,0|1,0,0]=3 5977 B8R1.78 NC1(C(=O)O)CCC1 Amb8630070 [0,1,0,1,0,0|1,0,0]=3 5978 B8R1.78 NC1(C(=O)O)CNC1 Amb19895006 [0,1,0,1,0,0|1,0,0]=3 5979 B8R1.78 NC1(C(=O)O)CNC1 Amb21960937 [0,1,0,1,0,0|1,0,0]=3 5980 B8R1.78 NC1(C(=O)O)COC1 Amb18199133 [0,1,0,1,0,0|0,0,0]=2 5981 B8R1.78 NC1(C(=O)O)COC1 Amb33109883 [0,1,0,1,0,0|0,0,0]=2 5982 B8R1.78 NC1(C(=O)O)CSC1 Amb21927718 [0,1,0,1,0,0|0,1,0]=3 5983 B8R1.78 O=C(O)C1(Br)CCC1 Amb495556 [0,1,0,1,0,0|2,0,0]=4 5984 B8R1.78 O=C(O)C1(Cl)CCC1 Amb24422884 [0,1,0,1,0,0|2,0,0]=4 5985 B8R1.78 O=C(O)C1(F)CCC1 Amb22886536 [0,1,0,1,0,0|2,0,0]=4 5986 B8R1.78 O=C(O)C1(F)CNC1 Amb23440120 [0,1,0,1,0,0|2,0,0]=4 5987 B8R1.78 O=C(O)C1(O)CCC1 Amb495557 [0,1,0,1,0,0|2,0,0]=4 5988 B8R1.78 O=C(O)C1(O)CNC1 Amb24122891 [0,1,0,1,0,0|2,0,0]=4 5989 B8R1.78 O=C(O)C1(O)CNC1 Amb28934838 [0,1,0,1,0,0|2,0,0]=4 5990 B8R1.78 O=C(O)C1(O)COC1 Amb25714262 [0,1,0,1,0,0|1,0,0]=3 5991 B8R1.78 O=C(O)C1(S)CCC1 Amb34159631 [0,1,0,1,0,0|2,0,0]=4 5992 B8R1.11 CC1COC\C1=N/O Amb35646817 [0,1,0,1,0,0|2,0,0]=4 5993 B8R1.11 CCC1CCOC1=O Amb23538353 [0,1,0,1,0,0|2,0,0]=4 5994 B8R1.11 CCC1COCC1=O Amb29866231 [0,1,0,1,0,0|2,0,0]=4 5995 B8R1.11 CCC1NCCC1=O Amb18833066 [0,1,0,1,0,0|2,0,0]=4 5996 B8R1.11 CNC1CCNC1=O Amb22059501 [0,1,0,1,0,0|2,0,0]=4 5997 B8R1.11 CNC1CCNC1=O Amb28990981 [0,1,0,1,0,0|2,0,0]=4 5998 B8R1.11 CNC1CCSC1=O Amb27234396 [0,1,0,1,0,0|1,1,0]=4 5999 B8R1.11 CNC1COCC1O Amb18944293 [0,1,0,1,0,0|1,0,1]=4 6000 B8R1.11 CN[C@@H]1COC[C@@H]1O Amb24700231 [0,1,0,1,0,0|1,0,1]=4 6001 B8R1.11 CN[C@@H]1COC[C@H]1O Amb22748628 [0,1,0,1,0,0|1,0,1]=4 6002 B8R1.11 CN[C@@H]1COC[C@H]1O Amb22757852 [0,1,0,1,0,0|1,0,1]=4 6003 B8R1.11 CN[C@H]1CCNC1=O Amb28042561 [0,1,0,1,0,0|2,0,0]=4 6004 B8R1.11 CN[C@H]1CCOC1=O Amb28288608 [0,1,0,1,0,0|1,0,0]=3 6005 B8R1.11 CN[C@H]1COC[C@@H]1O Amb10608328 [0,1,0,1,0,0|1,0,1]=4 6006 B8R1.11 COC1CCOC1=O Amb28127714 [0,1,0,1,0,0|2,0,0]=4 6007 B8R1.11 COC1COCC1N Amb17606146 [0,1,0,1,0,0|1,0,1]=4 6008 B8R1.11 COC1COCC1N Amb28994082 [0,1,0,1,0,0|1,0,1]=4 6009 B8R1.11 CO[C@@H]1COC[C@@H]1N Amb22757962 [0,1,0,1,0,0|1,0,1]=4 6010 B8R1.11 CO[C@@H]1COC[C@@H]1N Amb24539352 [0,1,0,1,0,0|1,0,1]=4 6011 B8R1.11 CO[C@@H]1COC[C@H]1N Amb22757840 [0,1,0,1,0,0|1,0,1]=4 6012 B8R1.11 CO[C@@H]1COC[C@H]1N Amb23438206 [0,1,0,1,0,0|1,0,1]=4 6013 B8R1.11 CO[C@H]1COC[C@@H]1N Amb10608202 [0,1,0,1,0,0|1,0,1]=4 6014 B8R1.11 CO[C@H]1COC[C@H]1N Amb25683516 [0,1,0,1,0,0|1,0,1]=4 6015 B8R1.11 N#CC1CCOC1=O Amb6669560 [0,1,0,1,0,0|1,0,1]=4 6016 B8R1.11 N#CC1COCC1=O Amb24183529 [0,1,0,1,0,0|1,0,1]=4 6017 B8R1.11 NC1COCC1CO Amb24581733 [0,1,0,1,0,0|1,0,1]=4 6018 B8R1.11 NC1COCC1CO Amb30585130 [0,1,0,1,0,0|1,0,1]=4 6019 B8R1.11 NCC1CCCC1=O Amb18833069 [0,1,0,1,0,0|2,0,0]=4 6020 B8R1.11 NCC1CCCC1=O Amb28934823 [0,1,0,1,0,0|2,0,0]=4 6021 B8R1.11 NCC1CCNC1=O Amb18833033 [0,1,0,1,0,0|2,0,0]=4 6022 B8R1.11 NCC1CCOC1=O Amb28398456 [0,1,0,1,0,0|1,0,0]=3 6023 B8R1.11 NCC1CCOC1=O Amb32653583 [0,1,0,1,0,0|1,0,0]=3 6024 B8R1.11 NCC1COCC1O Amb25728184 [0,1,0,1,0,0|1,0,1]=4 6025 B8R1.11 NCC1COCC1O Amb32753532 [0,1,0,1,0,0|1,0,1]=4 6026 B8R1.11 NCC1CSCC1=O Amb24529601 [0,1,0,1,0,0|1,1,0]=4 6027 B8R1.11 NC[C@@H]1COC[C@@H]1O Amb23439671 [0,1,0,1,0,0|1,0,1]=4 6028 B8R1.11 NC[C@@H]1COC[C@@H]1O Amb32680795 [0,1,0,1,0,0|1,0,1]=4 6029 B8R1.11 NC[C@@H]1COC[C@H]1O Amb23439670 [0,1,0,1,0,0|1,0,1]=4 6030 B8R1.11 NC[C@@H]1COC[C@H]1O Amb25277795 [0,1,0,1,0,0|1,0,1]=4 6031 B8R1.11 NC[C@H]1COC[C@@H]1O Amb26894025 [0,1,0,1,0,0|1,0,1]=4 6032 B8R1.11 NC[C@H]1COC[C@@H]1O Amb34156215 [0,1,0,1,0,0|1,0,1]=4 6033 B8R1.11 NC[C@H]1COC[C@H]1O Amb25351472 [0,1,0,1,0,0|1,0,1]=4 6034 B8R1.11 NNC1CNNC1=O Amb28057143 [0,1,0,1,0,0|2,0,0]=4 6035 B8R1.11 NNC1COCC1O Amb24706024 [0,1,0,1,0,0|1,0,1]=4 6036 B8R1.11 NNC1COCC1O Amb32646040 [0,1,0,1,0,0|1,0,1]=4 6037 B8R1.11 NN[C@@H]1COC[C@H]1O Amb33069638 [0,1,0,1,0,0|1,0,1]=4 6038 B8R1.11 NOC1COCC1O Amb27479135 [0,1,0,1,0,0|1,0,1]=4 6039 B8R1.11 N[C@@H]1COC[C@@H]1CO Amb31169044 [0,1,0,1,0,0|1,0,1]=4 6040 B8R1.11 N[C@@H]1COC[C@@H]1CO Amb33456236 [0,1,0,1,0,0|1,0,1]=4 6041 B8R1.11 N[C@H]1COC[C@H]1CO Amb27188192 [0,1,0,1,0,0|1,0,1]=4 6042 B8R1.11 N\C=C1\CCOC1=O Amb24575038 [0,1,0,1,0,0|1,0,1]=4 6043 B8R1.11 O=C1C=CCC1CO Amb27802494 [0,1,0,1,0,0|2,0,0]=4 6044 B8R1.11 O=C1C=COC1CO Amb27482018 [0,1,0,1,0,0|2,0,0]=4 6045 B8R1.11 O=C1CCCC1CO Amb22491993 [0,1,0,1,0,0|2,0,0]=4 6046 B8R1.11 O=C1CCC[C@@H]1CO Amb28049022 [0,1,0,1,0,0|2,0,0]=4 6047 B8R1.11 O=C1NCCC1CO Amb33531235 [0,1,0,1,0,0|2,0,0]=4 6048 B8R1.11 O=C1OC=CC1CO Amb28129883 [0,1,0,1,0,0|1,0,0]=3 6049 B8R1.11 O=C1OCCC1CO Amb26431337 [0,1,0,1,0,0|1,0,0]=3 6050 B8R1.11 O=C1OCOC1CCl Amb28367648 [0,1,0,1,0,0|2,0,0]=4 6051 B8R1.11 O=C1SCCC1CO Amb17593391 [0,1,0,1,0,0|1,1,0]=4 6052 B8R1.11 O=CC1CCOC1=O Amb17593177 [0,1,0,1,0,0|2,0,0]=4 6053 B8R1.11 O=CC1COCC1=O Amb27165171 [0,1,0,1,0,0|2,0,0]=4 6054 B8R1.11 OCC1CNCC1O Amb22587601 [0,1,0,1,0,0|1,0,1]=4 6055 B8R1.11 OCC1CNCC1O Amb26440714 [0,1,0,1,0,0|1,0,1]=4 6056 B8R1.11 OCC1NCCC1O Amb18641923 [0,1,0,1,0,0|1,0,1]=4 6057 B8R1.11 OCC1NCCC1O Amb24117910 [0,1,0,1,0,0|1,0,1]=4 6058 B8R1.11 OC[C@@H]1CNC[C@H]1O Amb22757877 [0,1,0,1,0,0|1,0,1]=4 6059 B8R1.11 OC[C@H]1CNC[C@H]1O Amb22757874 [0,1,0,1,0,0|1,0,1]=4 6060 B8R1.11 OC[C@H]1CNC[C@H]1O Amb27420150 [0,1,0,1,0,0|1,0,1]=4 6061 B8R1.11 OC[C@H]1NCC[C@@H]1O Amb27246014 [0,1,0,1,0,0|1,0,1]=4 6062 B8R1.11 OC[C@H]1NCC[C@@H]1O Amb31291450 [0,1,0,1,0,0|1,0,1]=4 6063 B8R1.25 O=C1C(O)C(O)C1O Amb28316227 [0,1,0,1,0,0|1,0,0]=3 6064 B8R1.38 CCC(=O)C1COC1 Amb30024290 [0,1,0,1,0,0|2,0,0]=4 6065 B8R1.38 CNC(=O)[C@H]1CCN1 Amb27837634 [0,1,0,1,0,0|2,0,0]=4 6066 B8R1.38 COC(=O)C1C=CC1 Amb33715996 [0,1,0,1,0,0|2,0,0]=4 6067 B8R1.38 COC(=O)C1CCC1 Amb6366581 [0,1,0,1,0,0|2,0,0]=4 6068 B8R1.38 COC(=O)C1CCN1 Amb2699142 [0,1,0,1,0,0|1,0,0]=3 6069 B8R1.38 COC(=O)C1CCN1 Amb33544519 [0,1,0,1,0,0|1,0,0]=3 6070 B8R1.38 COC(=O)C1CNC1 Amb10604008 [0,1,0,1,0,0|2,0,0]=4 6071 B8R1.38 COC(=O)C1CNC1 Amb13883580 [0,1,0,1,0,0|2,0,0]=4 6072 B8R1.38 COC(=O)C1COC1 Amb21961760 [0,1,0,1,0,0|1,0,0]=3 6073 B8R1.38 COC(=O)[C@@H]1CCN1 Amb19888362 [0,1,0,1,0,0|1,0,0]=3 6074 B8R1.38 COC(=O)[C@@H]1CCN1 Amb22405994 [0,1,0,1,0,0|1,0,0]=3 6075 B8R1.38 COC(=O)[C@H]1CCN1 Amb22737543 [0,1,0,1,0,0|1,0,0]=3 6076 B8R1.38 COC(=O)[C@H]1CCN1 Amb24694404 [0,1,0,1,0,0|1,0,0]=3 6077 B8R1.38 NNC(=O)C1CCN1 Amb27490207 [0,1,0,1,0,0|2,0,0]=4 6078 B8R1.38 NNC(=O)[C@H]1CCN1 Amb27604154 [0,1,0,1,0,0|2,0,0]=4 6079 B8R1.38 O=C(CO)C1CCC1 Amb28188903 [0,1,0,1,0,0|2,0,0]=4 6080 B8R1.38 O=C(NO)C1CCC1 Amb6265921 [0,1,0,1,0,0|2,0,0]=4 6081 B8R1.38 O=C(NO)C1CCN1 Amb27659056 [0,1,0,1,0,0|1,0,0]=3 6082 B8R1.39 C#CC(=O)C1(C)CO1 Amb27449146 [0,1,0,1,0,0|2,0,0]=4 6083 B8R1.39 C#CC(=O)C1(N)CC1 Amb25104611 [0,1,0,1,0,0|2,0,0]=4 6084 B8R1.39 C=CC(=O)C1(N)CC1 Amb25081556 [0,1,0,1,0,0|2,0,0]=4 6085 B8R1.39 CCC(=O)C1(N)CC1 Amb26370542 [0,1,0,1,0,0|2,0,0]=4 6086 B8R1.39 CNC(=O)C1(N)CC1 Amb27793789 [0,1,0,1,0,0|2,0,0]=4 6087 B8R1.39 CNC(=O)C1(N)CC1 Amb33338795 [0,1,0,1,0,0|2,0,0]=4 6088 B8R1.39 COC(=O)C1(Br)CC1 Amb19888923 [0,1,0,1,0,0|2,0,0]=4 6089 B8R1.39 COC(=O)C1(C)CC1 Amb10604239 [0,1,0,1,0,0|2,0,0]=4 6090 B8R1.39 COC(=O)C1(C)CO1 Amb17672313 [0,1,0,1,0,0|1,0,0]=3 6091 B8R1.39 COC(=O)C1(F)CC1 Amb28285226 [0,1,0,1,0,0|2,0,0]=4 6092 B8R1.39 COC(=O)C1(N)CC1 Amb10069999 [0,1,0,1,0,0|1,0,0]=3 6093 B8R1.39 COC(=O)C1(N)CC1 Amb10844951 [0,1,0,1,0,0|1,0,0]=3 6094 B8R1.39 COC(=O)C1(N)CC1 Amb17607966 [0,1,0,1,0,0|1,0,0]=3 6095 B8R1.39 COC(=O)C1(O)CC1 Amb8515310 [0,1,0,1,0,0|2,0,0]=4 6096 B8R1.39 N\C(=N/O)C1(N)CC1 Amb35676467 [0,1,0,1,0,0|2,0,0]=4 6097 B8R1.39 O=C(CO)C1(Cl)CC1 Amb29875648 [0,1,0,1,0,0|2,0,0]=4 6098 B8R1.44 N[C@]1(CO)C[C@@H]1CO Amb27625487 [0,1,0,1,0,0|1,0,1]=4 6099 B8R1.50 C=C1C(=O)OCC1N Amb18641720 [0,1,0,1,0,0|1,0,0]=3 6100 B8R1.50 C=C1C(=O)OCC1O Amb27768713 [0,1,0,1,0,0|1,0,1]=4 6101 B8R1.50 C=C1C(=O)OC[C@H]1O Amb27945232 [0,1,0,1,0,0|1,0,1]=4 6102 B8R1.50 CC1=C(O)C(=O)OC1 Amb23571854 [0,1,0,1,0,0|1,0,1]=4 6103 B8R1.50 CC1C(=O)OC[C@@H]1O Amb27208229 [0,1,0,1,0,0|1,0,0]=3 6104 B8R1.50 CC1C(=O)OC[C@H]1O Amb27484790 [0,1,0,1,0,0|1,0,0]=3 6105 B8R1.50 CC1CCC(=O)C1N Amb25675652 [0,1,0,1,0,0|2,0,0]=4 6106 B8R1.50 CC1COC(=O)C1=O Amb27262699 [0,1,0,1,0,0|1,0,1]=4 6107 B8R1.50 CC1COC(=O)C1Br Amb27401963 [0,1,0,1,0,0|2,0,0]=4 6108 B8R1.50 CC1OCC(=O)C1C Amb29866230 [0,1,0,1,0,0|2,0,0]=4 6109 B8R1.50 CC1OCC(=O)C1O Amb28131956 [0,1,0,1,0,0|2,0,0]=4 6110 B8R1.50 CC1OCC(O)C1=O Amb28048942 [0,1,0,1,0,0|2,0,0]=4 6111 B8R1.50 CN1CCC(N)C1=O Amb22491599 [0,1,0,1,0,0|2,0,0]=4 6112 B8R1.50 CN1CCC(N)C1=O Amb33538759 [0,1,0,1,0,0|2,0,0]=4 6113 B8R1.50 CN1CC[C@@H](N)C1=O Amb25303747 [0,1,0,1,0,0|2,0,0]=4 6114 B8R1.50 CN1CC[C@H](N)C1=O Amb25889201 [0,1,0,1,0,0|2,0,0]=4 6115 B8R1.50 CN1OCC(Br)C1=O Amb28396643 [0,1,0,1,0,0|2,0,0]=4 6116 B8R1.50 CN1OCC(N)C1=O Amb25867269 [0,1,0,1,0,0|1,0,0]=3 6117 B8R1.50 CN1OCC(N)C1=S Amb27620645 [0,1,0,1,0,0|1,1,0]=4 6118 B8R1.50 C[C@@H]1C(=O)C=C[C@H]1O Amb27785473 [0,1,0,1,0,0|2,0,0]=4 6119 B8R1.50 C[C@@H]1C(=O)CC[C@@H]1O Amb28253966 [0,1,0,1,0,0|2,0,0]=4 6120 B8R1.50 C[C@@H]1C(=O)NC[C@H]1O Amb27881742 [0,1,0,1,0,0|2,0,0]=4 6121 B8R1.50 C[C@@H]1C(=O)OC[C@@H]1N Amb28055949 [0,1,0,1,0,0|1,0,1]=4 6122 B8R1.50 C[C@@H]1CNC(=O)[C@@H]1N Amb27488737 [0,1,0,1,0,0|2,0,0]=4 6123 B8R1.50 C[C@@H]1COC(=O)[C@@H]1C Amb28411565 [0,1,0,1,0,0|2,0,0]=4 6124 B8R1.50 C[C@H]1C(=O)OC[C@H]1N Amb27635064 [0,1,0,1,0,0|1,0,1]=4 6125 B8R1.50 N=C1COC(=O)C1N Amb27839054 [0,1,0,1,0,0|1,0,1]=4 6126 B8R1.50 NC1=C(O)COC1=O Amb27830449 [0,1,0,1,0,0|0,0,2]=4 6127 B8R1.50 NC1CCN(O)C1=O Amb8631273 [0,1,0,1,0,0|1,0,0]=3 6128 B8R1.50 NC1CNC(=O)C1N Amb18641832 [0,1,0,1,0,0|2,0,0]=4 6129 B8R1.50 N[C@@H]1C(=O)NC[C@@H]1O Amb27420900 [0,1,0,1,0,0|1,0,0]=3 6130 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O Amb28289413 [0,1,0,1,0,0|1,0,0]=3 6131 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb24697759 [0,1,0,1,0,0|0,0,0]=2 6132 B8R1.50 N[C@@H]1C(=O)OC[C@@H]1O Amb32751750 [0,1,0,1,0,0|0,0,0]=2 6133 B8R1.50 N[C@@H]1C(=O)OC[C@H]1O Amb27202409 [0,1,0,1,0,0|0,0,0]=2 6134 B8R1.50 N[C@@H]1CCN(O)C1=O Amb22362895 [0,1,0,1,0,0|1,0,0]=3 6135 B8R1.50 N[C@H]1C(=O)NC[C@H]1O Amb28346232 [0,1,0,1,0,0|1,0,0]=3 6136 B8R1.50 N[C@H]1C(=O)OC[C@@H]1O Amb27620425 [0,1,0,1,0,0|0,0,0]=2 6137 B8R1.50 N[C@H]1CCN(O)C1=O Amb25345964 [0,1,0,1,0,0|1,0,0]=3 6138 B8R1.50 O=C1C=CC(O)C1Cl Amb27863645 [0,1,0,1,0,0|2,0,0]=4 6139 B8R1.50 O=C1C=C[C@@H](O)[C@@H]1Cl Amb28324060 [0,1,0,1,0,0|2,0,0]=4 6140 B8R1.50 O=C1CC[C@H](O)[C@@H]1O Amb28253888 [0,1,0,1,0,0|2,0,0]=4 6141 B8R1.50 O=C1NCC(O)C1O Amb27813982 [0,1,0,1,0,0|2,0,0]=4 6142 B8R1.50 O=C1OC=C(O)C1Cl Amb28396605 [0,1,0,1,0,0|1,0,1]=4 6143 B8R1.50 O=C1OCC(O)=C1O Amb23505710 [0,1,0,1,0,0|1,0,1]=4 6144 B8R1.50 O=C1OCC(O)C1O Amb22730078 [0,1,0,1,0,0|1,0,0]=3 6145 B8R1.50 O=C1OC[C@@H](O)[C@@H]1O Amb24609731 [0,1,0,1,0,0|1,0,0]=3 6146 B8R1.50 O=C1OC[C@@H](O)[C@H]1Br Amb32414616 [0,1,0,1,0,0|1,0,0]=3 6147 B8R1.50 O=C1OC[C@@H](O)[C@H]1O Amb8515014 [0,1,0,1,0,0|1,0,0]=3 6148 B8R1.50 O=C1OC[C@H](O)[C@@H]1Br Amb10067848 [0,1,0,1,0,0|1,0,0]=3 6149 B8R1.50 O=C1OC[C@H](O)[C@@H]1O Amb27440225 [0,1,0,1,0,0|1,0,0]=3 6150 B8R1.50 O=C1OC[C@H](O)[C@H]1Br Amb27634828 [0,1,0,1,0,0|1,0,0]=3 6151 B8R1.50 O=C1OC[C@H](O)[C@H]1F Amb27775907 [0,1,0,1,0,0|1,0,0]=3 6152 B8R1.50 O=C1OC[C@H](O)[C@H]1O Amb15692412 [0,1,0,1,0,0|1,0,0]=3 6153 B8R1.50 O=C1ON=C(O)C1F Amb27193869 [0,1,0,1,0,0|1,0,1]=4 6154 B8R1.58 CC1(CO)COC1=O Amb26453407 [0,1,0,1,0,0|1,0,0]=3 6155 B8R1.58 C[C@@]1(CO)CCC1=O Amb27836789 [0,1,0,1,0,0|2,0,0]=4 6156 B8R1.58 C[C@]1(CO)CCC1=O Amb28066160 [0,1,0,1,0,0|2,0,0]=4 6157 B8R1.58 C[C@]1(CO)COC1=O Amb27213954 [0,1,0,1,0,0|1,0,0]=3 6158 B8R1.63 C#CC1(C(=O)O)CC1 Amb24560584 [0,1,0,1,0,0|2,0,0]=4 6159 B8R1.63 C=CC1(C(=O)O)CC1 Amb28314261 [0,1,0,1,0,0|2,0,0]=4 6160 B8R1.63 CC(=O)C1(CN)CC1 Amb33447085 [0,1,0,1,0,0|2,0,0]=4 6161 B8R1.63 CC(=O)C1(CO)CC1 Amb24481444 [0,1,0,1,0,0|2,0,0]=4 6162 B8R1.63 CCC1(C(=O)O)CC1 Amb18560530 [0,1,0,1,0,0|2,0,0]=4 6163 B8R1.63 CCC1(C(C)=O)CO1 Amb24754014 [0,1,0,1,0,0|2,0,0]=4 6164 B8R1.63 CNC1(C(=O)O)CC1 Amb22757078 [0,1,0,1,0,0|1,0,0]=3 6165 B8R1.63 CNC1(C(=O)O)CC1 Amb27413357 [0,1,0,1,0,0|1,0,0]=3 6166 B8R1.63 CNC1(C(=O)O)CC1 Amb31157030 [0,1,0,1,0,0|1,0,0]=3 6167 B8R1.63 CNC1(C(C)=O)CC1 Amb33132680 [0,1,0,1,0,0|2,0,0]=4 6168 B8R1.63 COC1(C(=O)O)CC1 Amb24358755 [0,1,0,1,0,0|2,0,0]=4 6169 B8R1.63 CSC1(C(=O)O)CC1 Amb24481335 [0,1,0,1,0,0|2,0,0]=4 6170 B8R1.63 N#CC1(C(=O)O)CC1 Amb2686578 [0,1,0,1,0,0|1,0,1]=4 6171 B8R1.63 NC(=O)C1(CO)CC1 Amb10608173 [0,1,0,1,0,0|2,0,0]=4 6172 B8R1.63 NCC1(C(=O)O)CC1 Amb10607863 [0,1,0,1,0,0|1,0,0]=3 6173 B8R1.63 NCC1(C(=O)O)CC1 Amb21959700 [0,1,0,1,0,0|1,0,0]=3 6174 B8R1.63 NCC1(C(N)=O)CC1 Amb22741302 [0,1,0,1,0,0|2,0,0]=4 6175 B8R1.63 O=C(O)C1(CBr)CC1 Amb26586671 [0,1,0,1,0,0|2,0,0]=4 6176 B8R1.63 O=C(O)C1(CF)CC1 Amb24054902 [0,1,0,1,0,0|2,0,0]=4 6177 B8R1.63 O=C(O)C1(CO)CC1 Amb33545077 [0,1,0,1,0,0|1,0,0]=3 6178 B8R1.63 O=C(O)C1(CS)CC1 Amb27950685 [0,1,0,1,0,0|1,1,0]=4 6179 B8R1.63 O=C(O)[C@@]1(CF)CO1 Amb28128326 [0,1,0,1,0,0|1,0,0]=3 6180 B8R1.63 O=CC1(C(=O)O)CC1 Amb33544742 [0,1,0,1,0,0|2,0,0]=4 6181 B8R1.21 O=P(O)(O)C1OC1O Amb27266153 [0,1,0,1,0,0|2,0,0]=4 6182 B8R1.21 O=P(O)(O)[C@H]1O[C@H]1O Amb27194681 [0,1,0,1,0,0|2,0,0]=4 6183 B8R1.70 NC1(P(=O)(O)O)CC1 Amb26007575 [0,1,0,1,0,0|2,0,0]=4 6184 B8R1.16 C[C@@H]1NC(=O)[C@H]1CN Amb27968911 [0,1,0,1,0,0|2,0,0]=4 6185 B8R1.77 CC(=O)C1CC1(C)O Amb27963572 [0,1,0,1,0,0|2,0,0]=4 6186 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [0,1,0,1,0,0|2,0,0]=4 6187 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [0,1,0,1,0,0|2,0,0]=4 6188 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [0,1,0,1,0,0|2,0,0]=4 6189 B8R1.77 CC1(C)OC1C(=O)O Amb24481352 [0,1,0,1,0,0|2,0,0]=4 6190 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [0,1,0,1,0,0|2,0,0]=4 6191 B8R1.77 O=C(O)C1CC1(Cl)Cl Amb1106460 [0,1,0,1,0,0|2,0,0]=4 6192 B8R1.77 O=C(O)C1CC1(F)Br Amb25952257 [0,1,0,1,0,0|2,0,0]=4 6193 B8R1.77 O=C(O)C1CC1(F)Cl Amb10841879 [0,1,0,1,0,0|2,0,0]=4 6194 B8R1.77 O=C(O)C1CC1(F)F Amb2691845 [0,1,0,1,0,0|2,0,0]=4 6195 B8R1.77 O=C(O)[C@@H]1CC1(F)F Amb30869365 [0,1,0,1,0,0|2,0,0]=4 6196 B8R1.77 O=C(O)[C@@H]1C[C@@]1(F)Cl Amb28252683 [0,1,0,1,0,0|2,0,0]=4 6197 B8R1.77 O=C(O)[C@H]1CC1(Cl)Cl Amb27444143 [0,1,0,1,0,0|2,0,0]=4 6198 B8R1.77 O=C(O)[C@H]1CC1(F)F Amb33802940 [0,1,0,1,0,0|2,0,0]=4 6199 B8R2.38 O=C1OCC2CC12 Amb24113373 [0,0,0,2,0,0|2,0,0]=4 6200 B8R2.38 O=C1OC[C@H]2C[C@@H]12 Amb27421949 [0,0,0,2,0,0|2,0,0]=4 6201 B8R2.66 O=C(O)C12CC1C2 Amb24732235 [0,0,0,2,0,0|2,0,0]=4 6202 B8R0.9 C#CC(N)CCC(=O)O Amb22352566 [0,0,0,0,0,2|1,0,1]=4 6203 B8R0.9 C=CC(N)CCC(=O)O Amb10843623 [0,0,0,0,0,2|1,0,1]=4 6204 B8R0.9 C=CC(N)CCC(=O)O Amb22056347 [0,0,0,0,0,2|1,0,1]=4 6205 B8R0.9 C=C[C@H](N)CCC(=O)O Amb25694354 [0,0,0,0,0,2|1,0,1]=4 6206 B8R0.9 CC(=O)CCC(C)CO Amb27838673 [0,0,0,0,0,2|2,0,0]=4 6207 B8R0.9 CC(=O)CCC(F)CO Amb25200909 [0,0,0,0,0,2|2,0,0]=4 6208 B8R0.9 CC(=O)CNC(C)CO Amb27614242 [0,0,0,0,0,2|2,0,0]=4 6209 B8R0.9 CC(=O)NCC(N)NO Amb27413098 [0,0,0,0,0,2|2,0,0]=4 6210 B8R0.9 CC(=O)NC[C@@H](O)CO Amb27156658 [0,0,0,0,0,2|2,0,0]=4 6211 B8R0.9 CC(=O)OCC(F)CO Amb27443281 [0,0,0,0,0,2|2,0,0]=4 6212 B8R0.9 CC(=O)OCC(N)CO Amb33140919 [0,0,0,0,0,2|1,0,0]=3 6213 B8R0.9 CC(=O)OCC(O)CO Amb22043222 [0,0,0,0,0,2|2,0,0]=4 6214 B8R0.9 CC(=O)SC[C@H](O)CO Amb27261704 [0,0,0,0,0,2|2,0,0]=4 6215 B8R0.9 CC(C#CC(=O)O)CN Amb33168959 [0,0,0,0,0,2|2,0,0]=4 6216 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [0,0,0,0,0,2|2,0,0]=4 6217 B8R0.9 CC(CCl)CCC(=O)O Amb27838484 [0,0,0,0,0,2|2,0,0]=4 6218 B8R0.9 CC(CN)CCC(=O)O Amb22059189 [0,0,0,0,0,2|2,0,0]=4 6219 B8R0.9 CC(CN)CCC(=O)O Amb28935016 [0,0,0,0,0,2|2,0,0]=4 6220 B8R0.9 CC(CN)OCC(=O)O Amb18629591 [0,0,0,0,0,2|2,0,0]=4 6221 B8R0.9 CC(CN)SCC(=O)O Amb28142553 [0,0,0,0,0,2|2,0,0]=4 6222 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,0,0,0,0,2|2,0,0]=4 6223 B8R0.9 CC(CO)SCC(N)=O Amb27969999 [0,0,0,0,0,2|2,0,0]=4 6224 B8R0.9 CC(\C=C\C(=O)O)CN Amb27234754 [0,0,0,0,0,2|2,0,0]=4 6225 B8R0.9 CCC(Br)CCC(=O)O Amb28367201 [0,0,0,0,0,2|2,0,0]=4 6226 B8R0.9 CCC(C)C#CC(=O)O Amb28145990 [0,0,0,0,0,2|2,0,0]=4 6227 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,0,0,0,0,2|2,0,0]=4 6228 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,0,0,0,0,2|2,0,0]=4 6229 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,0,0,0,0,2|2,0,0]=4 6230 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,0,0,0,0,2|2,0,0]=4 6231 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,0,0,0,0,2|2,0,0]=4 6232 B8R0.9 CCC(C)\C=C\C(=O)O Amb33171963 [0,0,0,0,0,2|2,0,0]=4 6233 B8R0.9 CCC(Cl)CCC(=O)O Amb27955847 [0,0,0,0,0,2|2,0,0]=4 6234 B8R0.9 CCC(N)C#CC(=O)O Amb33168922 [0,0,0,0,0,2|1,0,0]=3 6235 B8R0.9 CCC(N)CCC(=O)O Amb21961489 [0,0,0,0,0,2|1,0,0]=3 6236 B8R0.9 CCC(N)CCC(=O)O Amb5717972 [0,0,0,0,0,2|1,0,0]=3 6237 B8R0.9 CCC(N)CCC(N)=O Amb27194979 [0,0,0,0,0,2|2,0,0]=4 6238 B8R0.9 CCC(N)CNC(N)=O Amb27437062 [0,0,0,0,0,2|2,0,0]=4 6239 B8R0.9 CCC(N)\C=C\C(=O)O Amb27867410 [0,0,0,0,0,2|1,0,0]=3 6240 B8R0.9 CCC(O)C#CC(=O)O Amb27169546 [0,0,0,0,0,2|2,0,0]=4 6241 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [0,0,0,0,0,2|2,0,0]=4 6242 B8R0.9 CCC(S)CCC(=O)O Amb27954753 [0,0,0,0,0,2|2,0,0]=4 6243 B8R0.9 CC[C@@H](C)C#CC(=O)O Amb27975780 [0,0,0,0,0,2|2,0,0]=4 6244 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,0,0,0,0,2|2,0,0]=4 6245 B8R0.9 CC[C@@H](C)\C=C\C(=O)O Amb24117189 [0,0,0,0,0,2|2,0,0]=4 6246 B8R0.9 CC[C@H](C)C#CC(=O)O Amb28132200 [0,0,0,0,0,2|2,0,0]=4 6247 B8R0.9 CC[C@H](N)\C=C\C(=O)O Amb27878954 [0,0,0,0,0,2|1,0,0]=3 6248 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [0,0,0,0,0,2|2,0,0]=4 6249 B8R0.9 CS(=O)CCC(N)CO Amb27867840 [0,0,0,0,0,2|2,0,0]=4 6250 B8R0.9 CS(=O)NCC(N)CO Amb27778086 [0,0,0,0,0,2|2,0,0]=4 6251 B8R0.9 N#CC(N)CCC(=O)O Amb27596135 [0,0,0,0,0,2|1,0,1]=4 6252 B8R0.9 N#CC(N)CCC(=O)O Amb30666632 [0,0,0,0,0,2|1,0,1]=4 6253 B8R0.9 NC(=O)CCC(O)CO Amb28073389 [0,0,0,0,0,2|2,0,0]=4 6254 B8R0.9 NC(=O)CC[C@H](N)CF Amb27431484 [0,0,0,0,0,2|2,0,0]=4 6255 B8R0.9 NC(=O)CC[C@H](N)CO Amb24368577 [0,0,0,0,0,2|1,0,0]=3 6256 B8R0.9 NC(=O)OCC(N)CO Amb27956487 [0,0,0,0,0,2|1,0,0]=3 6257 B8R0.9 NC(CCl)CCC(=O)O Amb27440510 [0,0,0,0,0,2|1,0,0]=3 6258 B8R0.9 NC(CF)CCC(=O)Cl Amb27876552 [0,0,0,0,0,2|2,0,0]=4 6259 B8R0.9 NC(CF)CCC(=O)O Amb19148378 [0,0,0,0,0,2|1,0,0]=3 6260 B8R0.9 NC(CF)CCC(=O)O Amb33473114 [0,0,0,0,0,2|1,0,0]=3 6261 B8R0.9 NC(CO)CC=C(Cl)Cl Amb30013539 [0,0,0,0,0,2|2,0,0]=4 6262 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [0,0,0,0,0,2|0,0,0]=2 6263 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [0,0,0,0,0,2|0,0,0]=2 6264 B8R0.9 NC(CS)CCC(=O)O Amb27458291 [0,0,0,0,0,2|0,1,0]=3 6265 B8R0.9 NCC(N)CCC(=O)O Amb19328773 [0,0,0,0,0,2|1,0,0]=3 6266 B8R0.9 NCC(N)CCC(=O)O Amb27837536 [0,0,0,0,0,2|1,0,0]=3 6267 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [0,0,0,0,0,2|2,0,0]=4 6268 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [0,0,0,0,0,2|2,0,0]=4 6269 B8R0.9 NC[C@H](N)CCC(=O)O Amb28068164 [0,0,0,0,0,2|1,0,0]=3 6270 B8R0.9 N[C@@H](CS)CCC(=O)O Amb28341808 [0,0,0,0,0,2|0,1,0]=3 6271 B8R0.9 N[C@H](CF)CCC(=O)O Amb32729481 [0,0,0,0,0,2|1,0,0]=3 6272 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [0,0,0,0,0,2|0,0,0]=2 6273 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [0,0,0,0,0,2|0,0,0]=2 6274 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [0,0,0,0,0,2|2,0,0]=4 6275 B8R0.9 O=C(O)CCC(S)CS Amb27407074 [0,0,0,0,0,2|1,1,0]=4 6276 B8R0.9 O=C(O)CNC(=O)CO Amb18124375 [0,0,0,0,0,2|1,0,1]=4 6277 B8R0.9 O=C(O)\C=C\C(O)CO Amb18642875 [0,0,0,0,0,2|1,0,0]=3 6278 B8R0.9 O=C(O)\C=C\[C@H](O)CO Amb27437218 [0,0,0,0,0,2|1,0,0]=3