0 B7R0.6 C=C(Br)COC(C)C Amb27197438 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.6 C=C(Br)\C=C\C(=O)O Amb26530913 [0,0,0,0,0,0|1,0,2]=3 2 B7R0.6 C=C(C)CCC(=O)O Amb18641793 [0,0,0,0,0,0|0,0,4]=4 3 B7R0.6 C=C(C)NCC(=O)O Amb9173757 [0,0,0,0,0,0|1,0,3]=4 4 B7R0.6 C=C(C)\C=C/C(C)=O Amb28061353 [0,0,0,0,0,0|1,0,2]=3 5 B7R0.6 C=C(C)\C=C\B(O)O Amb25348319 [0,0,0,0,0,0|1,0,3]=4 6 B7R0.6 C=C(C)\C=C\C(=C)C Amb27229870 [0,0,0,0,0,0|2,0,2]=4 7 B7R0.6 C=C(C)\C=C\C(=O)O Amb17593153 [0,0,0,0,0,0|0,0,2]=2 8 B7R0.6 C=C(C)\C=C\C(C)=O Amb33172526 [0,0,0,0,0,0|1,0,2]=3 9 B7R0.6 C=C(C)\C=C\C(C)N Amb33199201 [0,0,0,0,0,0|3,0,0]=3 10 B7R0.6 C=C(C)\C=C\[N+](=O)[O-] Amb33199530 [0,0,0,0,0,0|1,0,3]=4 11 B7R0.6 C=C(N)\C=C\C(=C)O Amb27976241 [0,0,0,0,0,0|2,0,2]=4 12 B7R0.6 C=C(O)\C=C\C(=O)O Amb26391061 [0,0,0,0,0,0|1,0,2]=3 13 B7R0.6 C=C(O)\C=N\N(C)C Amb27209036 [0,0,0,0,0,0|3,0,0]=3 14 B7R0.6 CC(=N)NCC(C)C Amb27865850 [0,0,0,0,0,0|3,0,1]=4 15 B7R0.6 CC(=O)C#C[C@@H](C)O Amb27854924 [0,0,0,0,0,0|2,0,2]=4 16 B7R0.6 CC(=O)CC=C(C)C Amb17593170 [0,0,0,0,0,0|1,0,2]=3 17 B7R0.6 CC(=O)CCC(=O)O Amb534169 [0,0,0,0,0,0|1,0,3]=4 18 B7R0.6 CC(=O)CCC(C)Br Amb27424770 [0,0,0,0,0,0|2,0,2]=4 19 B7R0.6 CC(=O)CCC(C)C Amb4605991 [0,0,0,0,0,0|1,0,2]=3 20 B7R0.6 CC(=O)CCC(C)O Amb25829594 [0,0,0,0,0,0|2,0,2]=4 21 B7R0.6 CC(=O)CCN(C)C Amb1129203 [0,0,0,0,0,0|2,0,2]=4 22 B7R0.6 CC(=O)CCN(C)C Amb343601 [0,0,0,0,0,0|2,0,2]=4 23 B7R0.6 CC(=O)CC[C@@H](C)O Amb22351150 [0,0,0,0,0,0|2,0,2]=4 24 B7R0.6 CC(=O)CNC(C)C Amb28126943 [0,0,0,0,0,0|2,0,1]=3 25 B7R0.6 CC(=O)CNC(C)C Amb32661638 [0,0,0,0,0,0|2,0,1]=3 26 B7R0.6 CC(=O)COC(C)C Amb9665256 [0,0,0,0,0,0|2,0,1]=3 27 B7R0.6 CC(=O)CSC(C)C Amb22549127 [0,0,0,0,0,0|2,0,1]=3 28 B7R0.6 CC(=O)C\C=C(\C)Cl Amb27880641 [0,0,0,0,0,0|2,0,2]=4 29 B7R0.6 CC(=O)NCC(=O)O Amb1215271 [0,0,0,0,0,0|2,0,2]=4 30 B7R0.6 CC(=O)NCC(C)C Amb3364211 [0,0,0,0,0,0|2,0,1]=3 31 B7R0.6 CC(=O)NCC(C)N Amb18631377 [0,0,0,0,0,0|3,0,1]=4 32 B7R0.6 CC(=O)NCC(C)O Amb9276316 [0,0,0,0,0,0|3,0,1]=4 33 B7R0.6 CC(=O)NCN(C)C Amb27838840 [0,0,0,0,0,0|3,0,1]=4 34 B7R0.6 CC(=O)NN=C(C)C Amb1047247 [0,0,0,0,0,0|3,0,1]=4 35 B7R0.6 CC(=O)NNC(C)C Amb22233621 [0,0,0,0,0,0|3,0,0]=3 36 B7R0.6 CC(=O)OCC(=O)O Amb1151259 [0,0,0,0,0,0|2,0,2]=4 37 B7R0.6 CC(=O)OCC(C)Br Amb25360690 [0,0,0,0,0,0|3,0,1]=4 38 B7R0.6 CC(=O)OCC(C)O Amb24056158 [0,0,0,0,0,0|3,0,1]=4 39 B7R0.6 CC(=O)OC[C@H](C)Br Amb27878701 [0,0,0,0,0,0|3,0,1]=4 40 B7R0.6 CC(=O)OC[C@H](C)O Amb28315156 [0,0,0,0,0,0|3,0,1]=4 41 B7R0.6 CC(=O)ON=C(C)C Amb2781649 [0,0,0,0,0,0|3,0,1]=4 42 B7R0.6 CC(=O)SCC(C)O Amb27801534 [0,0,0,0,0,0|3,0,1]=4 43 B7R0.6 CC(=O)\C=C/C(O)O Amb27834325 [0,0,0,0,0,0|3,0,0]=3 44 B7R0.6 CC(=O)\C=C\C(=O)O Amb2722867 [0,0,0,0,0,0|1,0,1]=2 45 B7R0.6 CC(=O)\C=C\C(C)=O Amb22346013 [0,0,0,0,0,0|2,0,1]=3 46 B7R0.6 CC(=O)\C=C\C(C)C Amb28524833 [0,0,0,0,0,0|1,0,0]=1 47 B7R0.6 CC(=O)\C=C\C(C)Cl Amb25782801 [0,0,0,0,0,0|2,0,0]=2 48 B7R0.6 CC(=O)\C=C\C(F)F Amb32811499 [0,0,0,0,0,0|3,0,0]=3 49 B7R0.6 CC(=O)\C=C\C(N)=O Amb24516266 [0,0,0,0,0,0|2,0,1]=3 50 B7R0.6 CC(=O)\C=C\N(C)C Amb4019563 [0,0,0,0,0,0|2,0,0]=2 51 B7R0.6 CC(=O)\C=N\N(C)C Amb28316186 [0,0,0,0,0,0|3,0,0]=3 52 B7R0.6 CC(=O)\N=C\C(=O)O Amb27262053 [0,0,0,0,0,0|2,0,1]=3 53 B7R0.6 CC(=O)\N=C\C(C)O Amb27457691 [0,0,0,0,0,0|3,0,0]=3 54 B7R0.6 CC(=O)\N=C\N(C)C Amb27950201 [0,0,0,0,0,0|3,0,0]=3 55 B7R0.6 CC(=S)NC=C(C)C Amb28397267 [0,0,0,0,0,0|2,1,1]=4 56 B7R0.6 CC(=S)NCC(=O)O Amb24325138 [0,0,0,0,0,0|2,0,2]=4 57 B7R0.6 CC(=S)SCC(=O)O Amb25963237 [0,0,0,0,0,0|2,0,2]=4 58 B7R0.6 CC(=S)\N=C\N(C)C Amb28134087 [0,0,0,0,0,0|3,1,0]=4 59 B7R0.6 CC(Br)CCC(=O)O Amb18124528 [0,0,0,0,0,0|1,0,2]=3 60 B7R0.6 CC(C)=C=CC(C)O Amb17593160 [0,0,0,0,0,0|1,0,3]=4 61 B7R0.6 CC(C)=CC=C(C)C Amb2721453 [0,0,0,0,0,0|2,0,1]=3 62 B7R0.6 CC(C)=CC=C(Cl)Cl Amb20620965 [0,0,0,0,0,0|2,0,1]=3 63 B7R0.6 CC(C)=CCC(=O)O Amb6274419 [0,0,0,0,0,0|0,0,2]=2 64 B7R0.6 CC(C)=CCC(=O)[O-] Amb22491058 [0,0,0,0,0,0|0,0,3]=3 65 B7R0.6 CC(C)=CCC(C)C Amb22731329 [0,0,0,0,0,0|2,0,1]=3 66 B7R0.6 CC(C)=CCC(C)Cl Amb27590455 [0,0,0,0,0,0|3,0,1]=4 67 B7R0.6 CC(C)=CCC(C)N Amb27391176 [0,0,0,0,0,0|3,0,1]=4 68 B7R0.6 CC(C)=CCN(C)C Amb27837555 [0,0,0,0,0,0|3,0,1]=4 69 B7R0.6 CC(C)=CC[C@@H](C)O Amb28315798 [0,0,0,0,0,0|1,0,3]=4 70 B7R0.6 CC(C)=NCC(N)=O Amb27489401 [0,0,0,0,0,0|2,0,2]=4 71 B7R0.6 CC(C)=NNC(C)C Amb28056106 [0,0,0,0,0,0|4,0,0]=4 72 B7R0.6 CC(C)=NNC(N)=O Amb6366342 [0,0,0,0,0,0|3,0,1]=4 73 B7R0.6 CC(C)C#CC(=O)O Amb33544341 [0,0,0,0,0,0|0,0,2]=2 74 B7R0.6 CC(C)CCB(O)O Amb13890540 [0,0,0,0,0,0|1,0,3]=4 75 B7R0.6 CC(C)CCC(=N)N Amb19890005 [0,0,0,0,0,0|2,0,2]=4 76 B7R0.6 CC(C)CCC(=N)N Amb6266403 [0,0,0,0,0,0|2,0,2]=4 77 B7R0.6 CC(C)CCC(=O)Cl Amb3941047 [0,0,0,0,0,0|1,0,2]=3 78 B7R0.6 CC(C)CCC(=O)O Amb1153016 [0,0,0,0,0,0|0,0,2]=2 79 B7R0.6 CC(C)CCC(C)O Amb9748244 [0,0,0,0,0,0|1,0,3]=4 80 B7R0.6 CC(C)CCC(N)=O Amb8997711 [0,0,0,0,0,0|1,0,2]=3 81 B7R0.6 CC(C)CCC(N)=S Amb6248593 [0,0,0,0,0,0|1,1,2]=4 82 B7R0.6 CC(C)CCN(C)O Amb33361677 [0,0,0,0,0,0|2,0,2]=4 83 B7R0.6 CC(C)CCS(=O)Cl Amb27201771 [0,0,0,0,0,0|2,0,2]=4 84 B7R0.6 CC(C)CCS(=O)[O-] Amb25914733 [0,0,0,0,0,0|1,0,3]=4 85 B7R0.6 CC(C)CCS(N)=O Amb32720359 [0,0,0,0,0,0|2,0,2]=4 86 B7R0.6 CC(C)CC[C@@H](C)O Amb26500468 [0,0,0,0,0,0|1,0,3]=4 87 B7R0.6 CC(C)CC[C@H](C)O Amb27768728 [0,0,0,0,0,0|1,0,3]=4 88 B7R0.6 CC(C)CC[N+](=O)[O-] Amb17672612 [0,0,0,0,0,0|1,0,3]=4 89 B7R0.6 CC(C)CNC(=N)N Amb26326628 [0,0,0,0,0,0|3,0,1]=4 90 B7R0.6 CC(C)CNC(=O)Cl Amb35637064 [0,0,0,0,0,0|2,0,1]=3 91 B7R0.6 CC(C)CNC(N)=O Amb1151241 [0,0,0,0,0,0|2,0,1]=3 92 B7R0.6 CC(C)CNC(N)=S Amb2370605 [0,0,0,0,0,0|2,1,1]=4 93 B7R0.6 CC(C)CNC(O)=S Amb27597328 [0,0,0,0,0,0|1,1,1]=3 94 B7R0.6 CC(C)COC(=O)Cl Amb3940231 [0,0,0,0,0,0|2,0,1]=3 95 B7R0.6 CC(C)COC(=S)S Amb27804114 [0,0,0,0,0,0|1,2,1]=4 96 B7R0.6 CC(C)COC(N)=O Amb4020010 [0,0,0,0,0,0|2,0,1]=3 97 B7R0.6 CC(C)COC(O)O Amb28120630 [0,0,0,0,0,0|1,0,3]=4 98 B7R0.6 CC(C)CON(=O)O Amb33780821 [0,0,0,0,0,0|2,0,1]=3 99 B7R0.6 CC(C)CO[N+](=O)[O-] Amb22348027 [0,0,0,0,0,0|2,0,2]=4 100 B7R0.6 CC(C)CO[PH](=O)O Amb27252350 [0,0,0,0,0,0|2,0,1]=3 101 B7R0.6 CC(C)CSC(=N)N Amb20676000 [0,0,0,0,0,0|3,0,1]=4 102 B7R0.6 CC(C)CSC(=N)N Amb27875967 [0,0,0,0,0,0|3,0,1]=4 103 B7R0.6 CC(C)CSC(=O)Cl Amb22337028 [0,0,0,0,0,0|2,0,1]=3 104 B7R0.6 CC(C)NCC(=N)N Amb27186805 [0,0,0,0,0,0|3,0,1]=4 105 B7R0.6 CC(C)NCC(=O)Cl Amb27441169 [0,0,0,0,0,0|2,0,1]=3 106 B7R0.6 CC(C)NCC(=O)O Amb2372347 [0,0,0,0,0,0|1,0,1]=2 107 B7R0.6 CC(C)NCC(=O)O Amb6892753 [0,0,0,0,0,0|1,0,1]=2 108 B7R0.6 CC(C)NCC(N)=O Amb2370772 [0,0,0,0,0,0|2,0,1]=3 109 B7R0.6 CC(C)NCC(N)=O Amb399843 [0,0,0,0,0,0|2,0,1]=3 110 B7R0.6 CC(C)NCC(N)=S Amb17231884 [0,0,0,0,0,0|2,1,1]=4 111 B7R0.6 CC(C)NC[C@@H](C)O Amb27641886 [0,0,0,0,0,0|2,0,2]=4 112 B7R0.6 CC(C)NNC(N)=O Amb27409411 [0,0,0,0,0,0|3,0,0]=3 113 B7R0.6 CC(C)OCB(O)O Amb28058696 [0,0,0,0,0,0|2,0,2]=4 114 B7R0.6 CC(C)OCC(=N)N Amb33551035 [0,0,0,0,0,0|3,0,1]=4 115 B7R0.6 CC(C)OCC(=N)N Amb6268584 [0,0,0,0,0,0|3,0,1]=4 116 B7R0.6 CC(C)OCC(=O)Cl Amb28041673 [0,0,0,0,0,0|2,0,1]=3 117 B7R0.6 CC(C)OCC(=O)O Amb6275796 [0,0,0,0,0,0|1,0,1]=2 118 B7R0.6 CC(C)OCC(N)=O Amb26515707 [0,0,0,0,0,0|2,0,1]=3 119 B7R0.6 CC(C)OCC(N)=S Amb6267503 [0,0,0,0,0,0|2,1,1]=4 120 B7R0.6 CC(C)OC[C@@H](C)O Amb24689920 [0,0,0,0,0,0|2,0,2]=4 121 B7R0.6 CC(C)OC[C@H](C)O Amb24449028 [0,0,0,0,0,0|2,0,2]=4 122 B7R0.6 CC(C)ONC(N)=O Amb2899784 [0,0,0,0,0,0|3,0,0]=3 123 B7R0.6 CC(C)SCC(=O)O Amb1128460 [0,0,0,0,0,0|1,0,1]=2 124 B7R0.6 CC(C)\C=C\B(O)O Amb27149192 [0,0,0,0,0,0|1,0,1]=2 125 B7R0.6 CC(C)\C=C\C(=O)Cl Amb24481563 [0,0,0,0,0,0|1,0,0]=1 126 B7R0.6 CC(C)\C=C\C(=O)O Amb8517064 [0,0,0,0,0,0|0,0,0]=0 127 B7R0.6 CC(C)\C=C\C(C)Br Amb27397074 [0,0,0,0,0,0|2,0,1]=3 128 B7R0.6 CC(C)\C=C\C(C)C Amb4019551 [0,0,0,0,0,0|2,0,1]=3 129 B7R0.6 CC(C)\C=C\C(C)Cl Amb24483228 [0,0,0,0,0,0|2,0,1]=3 130 B7R0.6 CC(C)\C=C\C(C)N Amb32953515 [0,0,0,0,0,0|2,0,1]=3 131 B7R0.6 CC(C)\C=C\C(C)O Amb25746608 [0,0,0,0,0,0|1,0,1]=2 132 B7R0.6 CC(C)\C=C\[C@H](C)O Amb28189174 [0,0,0,0,0,0|1,0,1]=2 133 B7R0.6 CC(C)\C=C\[N+](=O)[O-] Amb32644472 [0,0,0,0,0,0|1,0,1]=2 134 B7R0.6 CC(C)\C=N\S(C)=O Amb35681708 [0,0,0,0,0,0|3,0,0]=3 135 B7R0.6 CC(C)\N=C\C(N)=O Amb28388359 [0,0,0,0,0,0|2,0,0]=2 136 B7R0.6 CC(Cl)C#CC(=O)O Amb28410751 [0,0,0,0,0,0|1,0,2]=3 137 B7R0.6 CC(Cl)CCC(=O)Cl Amb22229744 [0,0,0,0,0,0|2,0,2]=4 138 B7R0.6 CC(Cl)\C=C\C(=O)Cl Amb24579654 [0,0,0,0,0,0|2,0,0]=2 139 B7R0.6 CC(Cl)\C=N\C(C)C Amb28121197 [0,0,0,0,0,0|3,0,1]=4 140 B7R0.6 CC(I)CCC(=O)O Amb25938596 [0,0,0,0,0,0|1,0,2]=3 141 B7R0.6 CC(N)C#CC(=O)O Amb27876109 [0,0,0,0,0,0|1,0,2]=3 142 B7R0.6 CC(N)CC=C(Cl)Cl Amb29870254 [0,0,0,0,0,0|3,0,1]=4 143 B7R0.6 CC(N)CCC(=O)O Amb17593212 [0,0,0,0,0,0|1,0,2]=3 144 B7R0.6 CC(N)CCC(=O)O Amb19515603 [0,0,0,0,0,0|1,0,2]=3 145 B7R0.6 CC(N)CCS(=O)O Amb27839082 [0,0,0,0,0,0|2,0,2]=4 146 B7R0.6 CC(N)CC[PH](=O)O Amb27221659 [0,0,0,0,0,0|2,0,2]=4 147 B7R0.6 CC(N)CNC(N)=O Amb18202688 [0,0,0,0,0,0|3,0,1]=4 148 B7R0.6 CC(N)COC(N)=O Amb29849466 [0,0,0,0,0,0|3,0,1]=4 149 B7R0.6 CC(N)SCC(=O)O Amb27401691 [0,0,0,0,0,0|2,0,1]=3 150 B7R0.6 CC(N)\C=C\C(=O)O Amb33804531 [0,0,0,0,0,0|1,0,0]=1 151 B7R0.6 CC(N)\C=C\C(F)F Amb32811428 [0,0,0,0,0,0|3,0,1]=4 152 B7R0.6 CC(O)C#CC(=O)O Amb27803065 [0,0,0,0,0,0|1,0,2]=3 153 B7R0.6 CC(O)CCC(=O)O Amb18294804 [0,0,0,0,0,0|1,0,2]=3 154 B7R0.6 CC(O)CCC(=O)[O-] Amb32729478 [0,0,0,0,0,0|1,0,3]=4 155 B7R0.6 CC(O)CNC(C)C Amb9247472 [0,0,0,0,0,0|2,0,2]=4 156 B7R0.6 CC(O)COC(N)=O Amb26359577 [0,0,0,0,0,0|3,0,1]=4 157 B7R0.6 CC(O)\C=C\C(C)O Amb22346175 [0,0,0,0,0,0|2,0,1]=3 158 B7R0.6 CC(S)CCC(=O)O Amb8471198 [0,0,0,0,0,0|1,0,2]=3 159 B7R0.6 CC(S)CCC(N)=O Amb28399630 [0,0,0,0,0,0|2,0,2]=4 160 B7R0.6 CN(C)CC=C(Cl)Cl Amb35684044 [0,0,0,0,0,0|3,0,1]=4 161 B7R0.6 CN(C)CCC(=O)Cl Amb26050113 [0,0,0,0,0,0|2,0,2]=4 162 B7R0.6 CN(C)CCC(=O)Cl Amb32652940 [0,0,0,0,0,0|2,0,2]=4 163 B7R0.6 CN(C)CCC(=O)O Amb19888182 [0,0,0,0,0,0|1,0,2]=3 164 B7R0.6 CN(C)CCC(=O)O Amb6633385 [0,0,0,0,0,0|1,0,2]=3 165 B7R0.6 CN(C)CCC(N)=O Amb17231825 [0,0,0,0,0,0|2,0,2]=4 166 B7R0.6 CN(C)OCC(=O)O Amb28120004 [0,0,0,0,0,0|2,0,1]=3 167 B7R0.6 CN(C)SCC(N)=O Amb27838357 [0,0,0,0,0,0|3,0,1]=4 168 B7R0.6 CN(C)\C=C/[N+](=O)[O-] Amb27490064 [0,0,0,0,0,0|2,0,1]=3 169 B7R0.6 CN(C)\C=C\C(=O)O Amb25273624 [0,0,0,0,0,0|1,0,0]=1 170 B7R0.6 CN(C)\C=C\C(N)=S Amb17477842 [0,0,0,0,0,0|2,1,0]=3 171 B7R0.6 CN(C)\C=C\[N+](=O)[O-] Amb33950083 [0,0,0,0,0,0|2,0,1]=3 172 B7R0.6 CN(C)\C=N\C(N)=S Amb2439499 [0,0,0,0,0,0|3,1,0]=4 173 B7R0.6 CN(C)\N=C\C(N)=S Amb27167186 [0,0,0,0,0,0|3,1,0]=4 174 B7R0.6 CN(N)CCC(=O)O Amb2698078 [0,0,0,0,0,0|2,0,2]=4 175 B7R0.6 CN(O)\C=C\C(=O)O Amb27788003 [0,0,0,0,0,0|2,0,0]=2 176 B7R0.6 CS(=O)CCC(=O)O Amb18523762 [0,0,0,0,0,0|2,0,2]=4 177 B7R0.6 CS(=O)NCC(=O)O Amb25237322 [0,0,0,0,0,0|3,0,1]=4 178 B7R0.6 CS(=O)\C=C/C(N)=O Amb27815054 [0,0,0,0,0,0|3,0,0]=3 179 B7R0.6 CS(=O)\C=C\C(=O)O Amb18642965 [0,0,0,0,0,0|2,0,0]=2 180 B7R0.6 C[C@@H](N)CCC(=O)O Amb25960628 [0,0,0,0,0,0|1,0,2]=3 181 B7R0.6 C[C@@H](N)CCC(=O)O Amb35753110 [0,0,0,0,0,0|1,0,2]=3 182 B7R0.6 C[C@@H](O)CNC(N)=O Amb28315793 [0,0,0,0,0,0|3,0,1]=4 183 B7R0.6 C[C@H](N)C#CC(=O)O Amb27644755 [0,0,0,0,0,0|1,0,2]=3 184 B7R0.6 C[C@H](N)CCC(=O)O Amb25047328 [0,0,0,0,0,0|1,0,2]=3 185 B7R0.6 C[C@H](N)CCC(=O)O Amb35752545 [0,0,0,0,0,0|1,0,2]=3 186 B7R0.6 C[C@H](O)CCC(=O)O Amb27656596 [0,0,0,0,0,0|1,0,2]=3 187 B7R0.6 C[C@H](S)CCC(=O)O Amb27170326 [0,0,0,0,0,0|1,0,2]=3 188 B7R0.6 C[S+](C)CCC(=O)O Amb8390782 [0,0,0,0,0,0|1,0,2]=3 189 B7R0.6 C[S+](C)CCC(=O)[O-] Amb20247306 [0,0,0,0,0,0|1,0,3]=4 190 B7R0.6 C\C(Cl)=C/CC(N)=O Amb27750566 [0,0,0,0,0,0|2,0,2]=4 191 B7R0.6 C\C(Cl)=C\CC(=O)O Amb27975492 [0,0,0,0,0,0|1,0,2]=3 192 B7R0.6 NC(=O)\C=C/C(=O)O Amb2719749 [0,0,0,0,0,0|2,0,1]=3 193 B7R0.6 NC(=O)\C=C/C(N)=O Amb4292114 [0,0,0,0,0,0|3,0,1]=4 194 B7R0.6 NC(=O)\C=C\C(=O)O Amb9277095 [0,0,0,0,0,0|2,0,1]=3 195 B7R0.6 NC(=O)\C=C\C(N)=O Amb6334811 [0,0,0,0,0,0|3,0,1]=4 196 B7R0.6 NC(=O)\N=C\C(=O)O Amb27592464 [0,0,0,0,0,0|3,0,1]=4 197 B7R0.6 O=C(Cl)\C=C\C(=O)Cl Amb8513635 [0,0,0,0,0,0|3,0,1]=4 198 B7R0.6 O=C(Cl)\C=C\C(F)F Amb32415914 [0,0,0,0,0,0|3,0,0]=3 199 B7R0.6 O=C(O)C#CC(F)F Amb24455798 [0,0,0,0,0,0|2,0,2]=4 200 B7R0.6 O=C(O)CC=C(Cl)Cl Amb17593875 [0,0,0,0,0,0|2,0,2]=4 201 B7R0.6 O=C(O)CCC(Cl)Cl Amb25059214 [0,0,0,0,0,0|2,0,2]=4 202 B7R0.6 O=C(O)CCC(F)F Amb20623135 [0,0,0,0,0,0|2,0,2]=4 203 B7R0.6 O=C(O)COC(F)F Amb26635492 [0,0,0,0,0,0|3,0,1]=4 204 B7R0.6 O=C(O)CSC(F)F Amb9215372 [0,0,0,0,0,0|3,0,1]=4 205 B7R0.6 O=C(O)\C=C/C(=O)O Amb2792876 [0,0,0,0,0,0|2,0,1]=3 206 B7R0.6 O=C(O)\C=C\B(O)O Amb27864214 [0,0,0,0,0,0|3,0,0]=3 207 B7R0.6 O=C(O)\C=C\C(=O)Cl Amb25890079 [0,0,0,0,0,0|2,0,1]=3 208 B7R0.6 O=C(O)\C=C\C(=O)O Amb6608657 [0,0,0,0,0,0|2,0,1]=3 209 B7R0.6 O=C(O)\C=C\C(=O)O Amb8513055 [0,0,0,0,0,0|2,0,1]=3 210 B7R0.6 O=C(O)\C=C\C(=O)S Amb27468769 [0,0,0,0,0,0|2,0,1]=3 211 B7R0.6 O=C(O)\C=C\C(Cl)Cl Amb26464246 [0,0,0,0,0,0|2,0,0]=2 212 B7R0.6 O=C(O)\C=C\C(F)F Amb24340205 [0,0,0,0,0,0|2,0,0]=2 213 B7R0.6 O=C(O)\C=C\[N+](=O)[O-] Amb25736416 [0,0,0,0,0,0|3,0,0]=3 214 B7R0.6 O=C([O-])\C=C/C(=O)O Amb22168115 [0,0,0,0,0,0|2,0,1]=3 215 B7R0.6 O=C([O-])\C=C/C(=O)O Amb9787714 [0,0,0,0,0,0|2,0,1]=3 216 B7R0.6 O=C([O-])\C=C\C(=O)[O-] Amb20246799 [0,0,0,0,0,0|2,0,2]=4 217 B7R0.6 O=C([O-])\C=C\C(=O)[O-] Amb22002520 [0,0,0,0,0,0|2,0,2]=4 218 B7R0.6 O=C([O-])\C=C\C(=O)[O-] Amb22043369 [0,0,0,0,0,0|2,0,2]=4 219 B7R0.6 O=[N+]([O-])\C=C\C(F)F Amb33447129 [0,0,0,0,0,0|3,0,1]=4 220 B6R0.4 C#C\C=C\C(=O)O Amb17593056 [1,0,0,0,0,0|0,0,2]=3 221 B6R0.4 C#C\C=C\C(C)Br Amb17939762 [1,0,0,0,0,0|2,0,1]=4 222 B6R0.4 C#C\C=C\C(C)C Amb24530443 [1,0,0,0,0,0|1,0,1]=3 223 B6R0.4 C#C\C=C\C(C)O Amb27448467 [1,0,0,0,0,0|2,0,1]=4 224 B6R0.4 C#C\C=C\[C@H](C)O Amb28281377 [1,0,0,0,0,0|2,0,1]=4 225 B6R0.4 C=C(C)\C=C\C=O Amb18120435 [1,0,0,0,0,0|0,0,2]=3 226 B6R0.4 C=C(C)\C=C\CCl Amb25991091 [1,0,0,0,0,0|3,0,0]=4 227 B6R0.4 C=C(C)\C=C\CN Amb33199533 [1,0,0,0,0,0|3,0,0]=4 228 B6R0.4 C=C(C)\C=C\CO Amb33473880 [1,0,0,0,0,0|0,0,3]=4 229 B6R0.4 C=C(F)\C=C\CCl Amb28363835 [1,0,0,0,0,0|3,0,0]=4 230 B6R0.4 C=C=CCC(=O)O Amb26657414 [1,0,0,0,0,0|0,0,3]=4 231 B6R0.4 C=CCNC(C)C Amb10609485 [1,0,0,0,0,0|2,0,1]=4 232 B6R0.4 C=CCNC(C)C Amb6683889 [1,0,0,0,0,0|2,0,1]=4 233 B6R0.4 C=CCNC(C)C Amb8428139 [1,0,0,0,0,0|2,0,1]=4 234 B6R0.4 C=COCC(C)C Amb22338580 [1,0,0,0,0,0|2,0,1]=4 235 B6R0.4 C=COCC(C)C Amb6366362 [1,0,0,0,0,0|2,0,1]=4 236 B6R0.4 C=C\C=C/C(C)=O Amb27165543 [1,0,0,0,0,0|1,0,2]=4 237 B6R0.4 C=C\C=C\C(=O)Cl Amb26530329 [1,0,0,0,0,0|1,0,2]=4 238 B6R0.4 C=C\C=C\C(C)Br Amb27392285 [1,0,0,0,0,0|2,0,0]=3 239 B6R0.4 C=C\C=C\C(C)C Amb27185806 [1,0,0,0,0,0|1,0,0]=2 240 B6R0.4 CC#CCC(=O)O Amb17939740 [1,0,0,0,0,0|0,0,3]=4 241 B6R0.4 CC(=O)\C=C/C#N Amb28050527 [1,0,0,0,0,0|2,0,1]=4 242 B6R0.4 CC(=O)\C=C/C=O Amb27424884 [1,0,0,0,0,0|1,0,1]=3 243 B6R0.4 CC(=O)\C=C\CCl Amb25378305 [1,0,0,0,0,0|2,0,0]=3 244 B6R0.4 CC(=O)\C=C\CF Amb33379250 [1,0,0,0,0,0|2,0,0]=3 245 B6R0.4 CC(C)=C=CCO Amb17593073 [1,0,0,0,0,0|0,0,3]=4 246 B6R0.4 CC(C)=CCC=O Amb18120881 [1,0,0,0,0,0|0,0,2]=3 247 B6R0.4 CC(C)=CCCO Amb22002283 [1,0,0,0,0,0|0,0,3]=4 248 B6R0.4 CC(C)=CN=C=O Amb25288328 [1,0,0,0,0,0|1,0,2]=4 249 B6R0.4 CC(C)=CNC=O Amb27973472 [1,0,0,0,0,0|1,0,1]=3 250 B6R0.4 CC(C)=CNC=S Amb27422992 [1,0,0,0,0,0|1,1,1]=4 251 B6R0.4 CC(C)=C\C=C\Br Amb28244792 [1,0,0,0,0,0|1,0,1]=3 252 B6R0.4 CC(C)=C\C=C\Cl Amb27760419 [1,0,0,0,0,0|1,0,1]=3 253 B6R0.4 CC(C)=NNC=O Amb2419224 [1,0,0,0,0,0|2,0,1]=4 254 B6R0.4 CC(C)CCC=O Amb17673735 [1,0,0,0,0,0|0,0,2]=3 255 B6R0.4 CC(C)CCCO Amb3939329 [1,0,0,0,0,0|0,0,3]=4 256 B6R0.4 CC(C)CCNO Amb27439608 [1,0,0,0,0,0|1,0,2]=4 257 B6R0.4 CC(C)CN=C=O Amb5750714 [1,0,0,0,0,0|1,0,2]=4 258 B6R0.4 CC(C)CNC=S Amb27422882 [1,0,0,0,0,0|1,1,1]=4 259 B6R0.4 CC(C)COC=O Amb8513682 [1,0,0,0,0,0|1,0,1]=3 260 B6R0.4 CC(C)CON=O Amb8514844 [1,0,0,0,0,0|2,0,1]=4 261 B6R0.4 CC(C)C\C=C\Br Amb27974340 [1,0,0,0,0,0|1,0,1]=3 262 B6R0.4 CC(C)C\C=N\N Amb27660829 [1,0,0,0,0,0|2,0,1]=4 263 B6R0.4 CC(C)NCCO Amb3939914 [1,0,0,0,0,0|1,0,2]=4 264 B6R0.4 CC(C)OCC=O Amb25820659 [1,0,0,0,0,0|1,0,1]=3 265 B6R0.4 CC(C)OCCO Amb3939032 [1,0,0,0,0,0|1,0,2]=4 266 B6R0.4 CC(C)O\C=C/Br Amb27632454 [1,0,0,0,0,0|2,0,0]=3 267 B6R0.4 CC(C)SCC=O Amb24479811 [1,0,0,0,0,0|1,0,1]=3 268 B6R0.4 CC(C)SCCO Amb3939476 [1,0,0,0,0,0|1,0,2]=4 269 B6R0.4 CC(C)S\C=C\Cl Amb26031924 [1,0,0,0,0,0|2,0,0]=3 270 B6R0.4 CC(C)\C=C\C#N Amb24438061 [1,0,0,0,0,0|1,0,1]=3 271 B6R0.4 CC(C)\C=C\C=O Amb8515214 [1,0,0,0,0,0|0,0,0]=1 272 B6R0.4 CC(C)\C=C\CBr Amb25138767 [1,0,0,0,0,0|1,0,1]=3 273 B6R0.4 CC(C)\C=C\CN Amb25939521 [1,0,0,0,0,0|1,0,1]=3 274 B6R0.4 CC(C)\C=C\CO Amb25802048 [1,0,0,0,0,0|0,0,1]=2 275 B6R0.4 CC(Cl)CCC=O Amb18124284 [1,0,0,0,0,0|1,0,2]=4 276 B6R0.4 CC(Cl)\C=C\CBr Amb27205161 [1,0,0,0,0,0|2,0,1]=4 277 B6R0.4 CC(N)C\C=C\Cl Amb35606912 [1,0,0,0,0,0|2,0,1]=4 278 B6R0.4 CC(N)\C=C\CF Amb33379248 [1,0,0,0,0,0|2,0,1]=4 279 B6R0.4 CC(O)CCC=O Amb17593090 [1,0,0,0,0,0|1,0,2]=4 280 B6R0.4 CC(O)COC=O Amb27436963 [1,0,0,0,0,0|2,0,1]=4 281 B6R0.4 CC(O)C\C=C\Br Amb27216240 [1,0,0,0,0,0|2,0,1]=4 282 B6R0.4 CC(O)C\C=C\Cl Amb24479438 [1,0,0,0,0,0|2,0,1]=4 283 B6R0.4 CC(O)\C=C/CO Amb30621794 [1,0,0,0,0,0|1,0,1]=3 284 B6R0.4 CC(O)\C=C\C=O Amb18639615 [1,0,0,0,0,0|1,0,0]=2 285 B6R0.4 CC=C=CC(=O)O Amb17593065 [1,0,0,0,0,0|0,0,2]=3 286 B6R0.4 CC=C=C[PH](=O)O Amb27430355 [1,0,0,0,0,0|1,0,2]=4 287 B6R0.4 CCC#CC(=O)O Amb6336503 [1,0,0,0,0,0|0,0,2]=3 288 B6R0.4 CCC#CC(C)=O Amb2721702 [1,0,0,0,0,0|1,0,2]=4 289 B6R0.4 CCCC=C(C)C Amb4035860 [1,0,0,0,0,0|2,0,1]=4 290 B6R0.4 CCCCC(=O)Cl Amb3939066 [1,0,0,0,0,0|1,0,2]=4 291 B6R0.4 CCCCC(=O)O Amb3939877 [1,0,0,0,0,0|0,0,2]=3 292 B6R0.4 CCCCC(=O)[O-] Amb22056343 [1,0,0,0,0,0|0,0,3]=4 293 B6R0.4 CCCCC(C)=O Amb6608652 [1,0,0,0,0,0|1,0,2]=4 294 B6R0.4 CCCCC(N)=O Amb6891958 [1,0,0,0,0,0|1,0,2]=4 295 B6R0.4 CCCC[PH](=O)O Amb8391286 [1,0,0,0,0,0|1,0,2]=4 296 B6R0.4 CCCNC(=O)Cl Amb25688616 [1,0,0,0,0,0|2,0,1]=4 297 B6R0.4 CCCNC(C)=O Amb5835710 [1,0,0,0,0,0|2,0,1]=4 298 B6R0.4 CCCNC(N)=O Amb1152241 [1,0,0,0,0,0|2,0,1]=4 299 B6R0.4 CCCOC(=O)Cl Amb10604123 [1,0,0,0,0,0|2,0,1]=4 300 B6R0.4 CCCOC(=O)F Amb32667886 [1,0,0,0,0,0|2,0,1]=4 301 B6R0.4 CCCOC(N)=O Amb6334809 [1,0,0,0,0,0|2,0,1]=4 302 B6R0.4 CCCSC(C)=O Amb22043301 [1,0,0,0,0,0|2,0,1]=4 303 B6R0.4 CCCSC(N)=O Amb27167907 [1,0,0,0,0,0|2,0,1]=4 304 B6R0.4 CCNCC(=O)Cl Amb27948279 [1,0,0,0,0,0|2,0,1]=4 305 B6R0.4 CCNCC(=O)O Amb10609667 [1,0,0,0,0,0|1,0,1]=3 306 B6R0.4 CCNCC(=O)O Amb7764661 [1,0,0,0,0,0|1,0,1]=3 307 B6R0.4 CCNCC(C)=O Amb24545893 [1,0,0,0,0,0|2,0,1]=4 308 B6R0.4 CCNCC(C)=O Amb32661185 [1,0,0,0,0,0|2,0,1]=4 309 B6R0.4 CCNCC(N)=O Amb1128676 [1,0,0,0,0,0|2,0,1]=4 310 B6R0.4 CCNCC(N)=O Amb4035424 [1,0,0,0,0,0|2,0,1]=4 311 B6R0.4 CCOC=C(C)C Amb27667358 [1,0,0,0,0,0|3,0,0]=4 312 B6R0.4 CCOCC(=O)Cl Amb33528415 [1,0,0,0,0,0|2,0,1]=4 313 B6R0.4 CCOCC(=O)O Amb3939880 [1,0,0,0,0,0|1,0,1]=3 314 B6R0.4 CCOCC(=O)S Amb27813482 [1,0,0,0,0,0|1,1,1]=4 315 B6R0.4 CCOCC(C)=O Amb9666086 [1,0,0,0,0,0|2,0,1]=4 316 B6R0.4 CCONC(C)=O Amb22230675 [1,0,0,0,0,0|3,0,0]=4 317 B6R0.4 CCPCC(=O)O Amb28321137 [1,0,0,0,0,0|1,0,1]=3 318 B6R0.4 CCSCC(=O)O Amb1125185 [1,0,0,0,0,0|1,0,1]=3 319 B6R0.4 CCSCC(C)=O Amb4018179 [1,0,0,0,0,0|2,0,1]=4 320 B6R0.4 CC\C=C/C(=O)O Amb28429841 [1,0,0,0,0,0|0,0,0]=1 321 B6R0.4 CC\C=C/C(C)=O Amb27835645 [1,0,0,0,0,0|1,0,0]=2 322 B6R0.4 CC\C=C\B(O)O Amb24078362 [1,0,0,0,0,0|1,0,1]=3 323 B6R0.4 CC\C=C\C(=N)N Amb33171614 [1,0,0,0,0,0|2,0,0]=3 324 B6R0.4 CC\C=C\C(=O)Cl Amb2690073 [1,0,0,0,0,0|1,0,0]=2 325 B6R0.4 CC\C=C\C(=O)O Amb6608967 [1,0,0,0,0,0|0,0,0]=1 326 B6R0.4 CC\C=C\C(C)=O Amb26022886 [1,0,0,0,0,0|1,0,0]=2 327 B6R0.4 CC\C=C\C(C)C Amb4019550 [1,0,0,0,0,0|1,0,1]=3 328 B6R0.4 CC\C=C\C(C)N Amb26580418 [1,0,0,0,0,0|2,0,1]=4 329 B6R0.4 CC\C=C\C(C)O Amb25888544 [1,0,0,0,0,0|1,0,1]=3 330 B6R0.4 CC\C=C\C(N)=O Amb25770876 [1,0,0,0,0,0|1,0,0]=2 331 B6R0.4 CC\C=C\C(N)=S Amb33272632 [1,0,0,0,0,0|1,1,0]=3 332 B6R0.4 CC\C=C\[C@@H](C)N Amb33268692 [1,0,0,0,0,0|2,0,1]=4 333 B6R0.4 CC\C=C\[C@@H](C)O Amb33429815 [1,0,0,0,0,0|1,0,1]=3 334 B6R0.4 CC\C=C\[C@H](C)N Amb33268691 [1,0,0,0,0,0|2,0,1]=4 335 B6R0.4 CC\C=C\[C@H](C)O Amb33449173 [1,0,0,0,0,0|1,0,1]=3 336 B6R0.4 CC\C=C\[N+](=O)[O-] Amb25190046 [1,0,0,0,0,0|1,0,1]=3 337 B6R0.4 CC\C=N\S(C)=O Amb35681661 [1,0,0,0,0,0|3,0,0]=4 338 B6R0.4 CC\N=C\C(=O)O Amb28041425 [1,0,0,0,0,0|1,0,0]=2 339 B6R0.4 CC\N=C\C(C)=O Amb27854982 [1,0,0,0,0,0|2,0,0]=3 340 B6R0.4 CN(C)C#CC=O Amb27424954 [1,0,0,0,0,0|1,0,2]=4 341 B6R0.4 CN(C)CCC=O Amb22001057 [1,0,0,0,0,0|1,0,2]=4 342 B6R0.4 CN(C)CNC=O Amb27216675 [1,0,0,0,0,0|2,0,1]=4 343 B6R0.4 CN(C)C\C=C/Cl Amb27407781 [1,0,0,0,0,0|2,0,1]=4 344 B6R0.4 CN(C)\C=C/C#N Amb27474900 [1,0,0,0,0,0|2,0,1]=4 345 B6R0.4 CN(C)\C=C\C#N Amb8513614 [1,0,0,0,0,0|2,0,1]=4 346 B6R0.4 CN(C)\C=C\C=O Amb3940430 [1,0,0,0,0,0|1,0,0]=2 347 B6R0.4 CNCCC(=O)O Amb10609760 [1,0,0,0,0,0|1,0,2]=4 348 B6R0.4 CNCCC(=O)O Amb7766400 [1,0,0,0,0,0|1,0,2]=4 349 B6R0.4 CN\C=C\C(C)=O Amb17593076 [1,0,0,0,0,0|2,0,0]=3 350 B6R0.4 CN\C=C\C(C)C Amb27488647 [1,0,0,0,0,0|2,0,0]=3 351 B6R0.4 COCCC(=O)O Amb3938990 [1,0,0,0,0,0|1,0,2]=4 352 B6R0.4 CO\C=C/C(C)=O Amb27264758 [1,0,0,0,0,0|2,0,0]=3 353 B6R0.4 CO\C=C\C(=O)Cl Amb25349516 [1,0,0,0,0,0|2,0,0]=3 354 B6R0.4 CO\C=C\C(=O)O Amb18121767 [1,0,0,0,0,0|1,0,0]=2 355 B6R0.4 CO\C=C\C(C)=O Amb8385700 [1,0,0,0,0,0|2,0,0]=3 356 B6R0.4 CO\C=C\C(N)=O Amb27153308 [1,0,0,0,0,0|2,0,0]=3 357 B6R0.4 CO\N=C\C(=O)O Amb10976081 [1,0,0,0,0,0|2,0,0]=3 358 B6R0.4 CO\N=C\C(C)C Amb28064928 [1,0,0,0,0,0|3,0,0]=4 359 B6R0.4 CSC#CC(=O)O Amb33309663 [1,0,0,0,0,0|1,0,2]=4 360 B6R0.4 CSCCC(=O)O Amb3939879 [1,0,0,0,0,0|1,0,2]=4 361 B6R0.4 CSSCC(=O)O Amb25378801 [1,0,0,0,0,0|2,0,1]=4 362 B6R0.4 CS\C=C/C(C)=O Amb27471812 [1,0,0,0,0,0|2,0,0]=3 363 B6R0.4 CS\C=C\C(=O)O Amb30584688 [1,0,0,0,0,0|1,0,0]=2 364 B6R0.4 CS\C=C\[N+](=O)[O-] Amb35704405 [1,0,0,0,0,0|2,0,1]=4 365 B6R0.4 C[C@@H](Cl)CCC=O Amb27595266 [1,0,0,0,0,0|1,0,2]=4 366 B6R0.4 C[C@@H](Cl)\C=C\CCl Amb28042414 [1,0,0,0,0,0|2,0,1]=4 367 B6R0.4 C[C@H](Cl)CCC=O Amb28141995 [1,0,0,0,0,0|1,0,2]=4 368 B6R0.4 C[C@H](O)CCC=O Amb27188424 [1,0,0,0,0,0|1,0,2]=4 369 B6R0.4 C[N+](C)=C\C=C\Cl Amb28121327 [1,0,0,0,0,0|2,0,0]=3 370 B6R0.4 C\C=C/CC(C)C Amb27421132 [1,0,0,0,0,0|1,0,1]=3 371 B6R0.4 C\C=C\CC(=O)O Amb3941538 [1,0,0,0,0,0|0,0,2]=3 372 B6R0.4 C\C=C\CC(C)N Amb27843415 [1,0,0,0,0,0|2,0,1]=4 373 B6R0.4 C\C=C\CC(N)=O Amb26589975 [1,0,0,0,0,0|1,0,2]=4 374 B6R0.4 C\C=C\C[C@H](C)O Amb27662307 [1,0,0,0,0,0|2,0,1]=4 375 B6R0.4 C\C=C\NC(C)C Amb28457171 [1,0,0,0,0,0|2,0,0]=3 376 B6R0.4 C\N=C\CC(C)=O Amb28202181 [1,0,0,0,0,0|2,0,1]=4 377 B6R0.4 N#C\C=C\C(=O)O Amb25853809 [1,0,0,0,0,0|1,0,1]=3 378 B6R0.4 NCC#CC(=O)O Amb25703096 [1,0,0,0,0,0|1,0,2]=4 379 B6R0.4 NCC#CC(=O)O Amb32666878 [1,0,0,0,0,0|1,0,2]=4 380 B6R0.4 NCCCC(=O)O Amb1935210 [1,0,0,0,0,0|1,0,2]=4 381 B6R0.4 NC\C=C/C(=O)O Amb24117018 [1,0,0,0,0,0|1,0,0]=2 382 B6R0.4 NC\C=C\B(O)O Amb25824731 [1,0,0,0,0,0|2,0,1]=4 383 B6R0.4 NC\C=C\C(=O)O Amb33422010 [1,0,0,0,0,0|1,0,0]=2 384 B6R0.4 NC\C=C\C(=O)O Amb33422035 [1,0,0,0,0,0|1,0,0]=2 385 B6R0.4 O=C(Cl)\C=C\CCl Amb33294776 [1,0,0,0,0,0|2,0,0]=3 386 B6R0.4 O=C(O)C#CCCl Amb33544591 [1,0,0,0,0,0|1,0,2]=4 387 B6R0.4 O=C(O)C#CCI Amb27860307 [1,0,0,0,0,0|1,0,2]=4 388 B6R0.4 O=C(O)C#CCO Amb22002375 [1,0,0,0,0,0|1,0,2]=4 389 B6R0.4 O=C(O)CCCBr Amb8393276 [1,0,0,0,0,0|1,0,2]=4 390 B6R0.4 O=C(O)CCCCl Amb3940333 [1,0,0,0,0,0|1,0,2]=4 391 B6R0.4 O=C(O)CCCF Amb17593104 [1,0,0,0,0,0|1,0,2]=4 392 B6R0.4 O=C(O)CCCI Amb22295911 [1,0,0,0,0,0|1,0,2]=4 393 B6R0.4 O=C(O)CCCO Amb18640332 [1,0,0,0,0,0|1,0,2]=4 394 B6R0.4 O=C(O)CCCS Amb16185429 [1,0,0,0,0,0|1,0,2]=4 395 B6R0.4 O=C(O)COCF Amb33378705 [1,0,0,0,0,0|2,0,1]=4 396 B6R0.4 O=C(O)CPCO Amb28340565 [1,0,0,0,0,0|2,0,1]=4 397 B6R0.4 O=C(O)C\C=C/Br Amb27483815 [1,0,0,0,0,0|1,0,2]=4 398 B6R0.4 O=C(O)C\C=C\Cl Amb25111871 [1,0,0,0,0,0|1,0,2]=4 399 B6R0.4 O=C(O)\C=C\CBr Amb18646194 [1,0,0,0,0,0|1,0,0]=2 400 B6R0.4 O=C(O)\C=C\CCl Amb23399655 [1,0,0,0,0,0|1,0,0]=2 401 B6R0.4 O=C(O)\C=C\CF Amb33470171 [1,0,0,0,0,0|1,0,0]=2 402 B6R0.4 O=C(O)\C=C\CO Amb32662006 [1,0,0,0,0,0|1,0,0]=2 403 B6R0.4 O=C([O-])\C=C\CO Amb33542275 [1,0,0,0,0,0|1,0,1]=3 404 B6R0.4 O=C\C=C/C(=O)O Amb26023446 [1,0,0,0,0,0|1,0,1]=3 405 B6R0.4 O=C\C=C\B(O)O Amb22899676 [1,0,0,0,0,0|3,0,0]=4 406 B6R0.4 O=C\C=C\C(F)F Amb33337786 [1,0,0,0,0,0|2,0,0]=3 407 B6R0.4 O=[N+]([O-])\C=C\CF Amb33379297 [1,0,0,0,0,0|2,0,1]=4 408 B6R0.4 OB(O)\C=C\CCl Amb33964181 [1,0,0,0,0,0|2,0,1]=4 409 B6R0.4 OC\C=C\B(O)O Amb25354850 [1,0,0,0,0,0|2,0,1]=4 410 B6R0.4 OC\C=C\C(F)F Amb33485343 [1,0,0,0,0,0|2,0,1]=4 411 B8R0.9 C#CC(=O)COC(C)C Amb28253401 [0,1,0,0,0,0|2,0,1]=4 412 B8R0.9 C#CC(C)NCC(=O)O Amb27207997 [0,1,0,0,0,0|1,0,2]=4 413 B8R0.9 C#CC(C)SCC(=O)O Amb27168265 [0,1,0,0,0,0|1,0,2]=4 414 B8R0.9 C=C(C)\C=C\C(O)CC Amb28318574 [0,1,0,0,0,0|3,0,0]=4 415 B8R0.9 C=C(C)\C=C\C(O)CO Amb28139021 [0,1,0,0,0,0|3,0,0]=4 416 B8R0.9 C=C(CO)CC=C(C)C Amb27665270 [0,1,0,0,0,0|1,0,2]=4 417 B8R0.9 C=C(CO)SCC(C)C Amb27805315 [0,1,0,0,0,0|2,0,1]=4 418 B8R0.9 C=C(\C=C\C(=O)O)CC Amb27229488 [0,1,0,0,0,0|0,0,2]=3 419 B8R0.9 C=C(\C=C\C(C)=O)CC Amb26492679 [0,1,0,0,0,0|1,0,2]=4 420 B8R0.9 C=CC(=O)CC=C(C)C Amb27838740 [0,1,0,0,0,0|1,0,2]=4 421 B8R0.9 C=CC(=O)CCC(C)C Amb25341966 [0,1,0,0,0,0|1,0,2]=4 422 B8R0.9 C=CC(=O)COC(C)C Amb24614526 [0,1,0,0,0,0|2,0,1]=4 423 B8R0.9 C=CC(=O)CSC(C)C Amb28313053 [0,1,0,0,0,0|2,0,1]=4 424 B8R0.9 C=CC(=O)OCC(C)C Amb3940723 [0,1,0,0,0,0|2,0,1]=4 425 B8R0.9 C=CC(=O)\C=C\C(C)=O Amb24061722 [0,1,0,0,0,0|2,0,1]=4 426 B8R0.9 C=CC(=O)\C=C\C(C)C Amb26344609 [0,1,0,0,0,0|1,0,0]=2 427 B8R0.9 C=CC(C)OCC(=O)O Amb18642764 [0,1,0,0,0,0|1,0,2]=4 428 B8R0.9 C=C\C(C)=C\CC(=O)O Amb33276241 [0,1,0,0,0,0|0,0,3]=4 429 B8R0.9 CC(=O)CCC(C)CO Amb27838673 [0,1,0,0,0,0|1,0,2]=4 430 B8R0.9 CC(=O)CNC(C)CO Amb27614242 [0,1,0,0,0,0|2,0,1]=4 431 B8R0.9 CC(=O)COC(C)CN Amb18110559 [0,1,0,0,0,0|2,0,1]=4 432 B8R0.9 CC(=O)NCC(C)CN Amb18300590 [0,1,0,0,0,0|2,0,1]=4 433 B8R0.9 CC(=O)OCC(C)CBr Amb22386917 [0,1,0,0,0,0|2,0,1]=4 434 B8R0.9 CC(=O)OC[C@H](C)CBr Amb28385279 [0,1,0,0,0,0|2,0,1]=4 435 B8R0.9 CC(=O)O\C=C(/C)CBr Amb27433901 [0,1,0,0,0,0|2,0,1]=4 436 B8R0.9 CC(=O)SCC(C)CCl Amb4605870 [0,1,0,0,0,0|2,0,1]=4 437 B8R0.9 CC(=O)\C=C\C(O)C=O Amb27798118 [0,1,0,0,0,0|1,0,2]=4 438 B8R0.9 CC(C#CC(=O)O)CN Amb33168959 [0,1,0,0,0,0|0,0,2]=3 439 B8R0.9 CC(C#N)NCC(=O)O Amb18293465 [0,1,0,0,0,0|1,0,2]=4 440 B8R0.9 CC(C)=CC[C@@H](C)CO Amb27619671 [0,1,0,0,0,0|2,0,1]=4 441 B8R0.9 CC(C)=CNC(=O)CCl Amb27880254 [0,1,0,0,0,0|2,0,1]=4 442 B8R0.9 CC(C)=C\C=C(/C)C=O Amb28240306 [0,1,0,0,0,0|1,0,1]=3 443 B8R0.9 CC(C)CCC(=O)CCl Amb20668816 [0,1,0,0,0,0|1,0,2]=4 444 B8R0.9 CC(C)CCC(=O)CN Amb27599814 [0,1,0,0,0,0|1,0,2]=4 445 B8R0.9 CC(C)CCC(=O)CO Amb25053147 [0,1,0,0,0,0|0,0,2]=3 446 B8R0.9 CC(C)CCC(=O)NN Amb6744504 [0,1,0,0,0,0|1,0,2]=4 447 B8R0.9 CC(C)CCC(=O)NO Amb6744847 [0,1,0,0,0,0|0,0,2]=3 448 B8R0.9 CC(C)CC\C(Cl)=N\O Amb28366200 [0,1,0,0,0,0|1,0,2]=4 449 B8R0.9 CC(C)CC\C(N)=N\O Amb10205331 [0,1,0,0,0,0|1,0,2]=4 450 B8R0.9 CC(C)CNC(=O)CBr Amb10608023 [0,1,0,0,0,0|2,0,1]=4 451 B8R0.9 CC(C)CNC(=O)CCl Amb1160207 [0,1,0,0,0,0|2,0,1]=4 452 B8R0.9 CC(C)CNC(=O)CN Amb13951745 [0,1,0,0,0,0|2,0,1]=4 453 B8R0.9 CC(C)CNC(=O)CN Amb5783029 [0,1,0,0,0,0|2,0,1]=4 454 B8R0.9 CC(C)CNC(=O)CO Amb9421416 [0,1,0,0,0,0|1,0,1]=3 455 B8R0.9 CC(C)CNC(=O)NN Amb8854030 [0,1,0,0,0,0|2,0,1]=4 456 B8R0.9 CC(C)COC(=O)CBr Amb22036611 [0,1,0,0,0,0|2,0,1]=4 457 B8R0.9 CC(C)COC(=O)CN Amb19011993 [0,1,0,0,0,0|2,0,1]=4 458 B8R0.9 CC(C)COC(=O)CO Amb27218940 [0,1,0,0,0,0|1,0,1]=3 459 B8R0.9 CC(C)CO\C(N)=N\O Amb27653313 [0,1,0,0,0,0|2,0,1]=4 460 B8R0.9 CC(C)NCC(=O)NN Amb27630359 [0,1,0,0,0,0|2,0,1]=4 461 B8R0.9 CC(C)NC\C(N)=N\O Amb27264292 [0,1,0,0,0,0|2,0,1]=4 462 B8R0.9 CC(C)N\C=C(\F)C=O Amb27215808 [0,1,0,0,0,0|2,0,0]=3 463 B8R0.9 CC(C)OCC(=O)CCl Amb24481789 [0,1,0,0,0,0|2,0,1]=4 464 B8R0.9 CC(C)OCC(=O)CN Amb24481788 [0,1,0,0,0,0|2,0,1]=4 465 B8R0.9 CC(C)OCC(=O)NN Amb2089067 [0,1,0,0,0,0|2,0,1]=4 466 B8R0.9 CC(C)OCC(=O)NN Amb2189164 [0,1,0,0,0,0|2,0,1]=4 467 B8R0.9 CC(C)OCC(O)C=O Amb27239297 [0,1,0,0,0,0|1,0,2]=4 468 B8R0.9 CC(C)OC\C(N)=N\O Amb9177999 [0,1,0,0,0,0|2,0,1]=4 469 B8R0.9 CC(C)O\C=C(/Br)C=O Amb26443914 [0,1,0,0,0,0|2,0,0]=3 470 B8R0.9 CC(C)O\C=C(\Br)C=O Amb24670208 [0,1,0,0,0,0|2,0,0]=3 471 B8R0.9 CC(C)SC\C(N)=N\O Amb25771404 [0,1,0,0,0,0|2,0,1]=4 472 B8R0.9 CC(C)\C=C\C(=O)CBr Amb26425645 [0,1,0,0,0,0|1,0,0]=2 473 B8R0.9 CC(C)\C=C\C(N)CO Amb27248221 [0,1,0,0,0,0|1,0,1]=3 474 B8R0.9 CC(C)\C=C\C(O)CN Amb26006392 [0,1,0,0,0,0|1,0,1]=3 475 B8R0.9 CC(C)\C=C\C(O)CO Amb27626045 [0,1,0,0,0,0|0,0,2]=3 476 B8R0.9 CC(C)\C=C\[C@H](C)CO Amb27396357 [0,1,0,0,0,0|1,0,1]=3 477 B8R0.9 CC(C)\C=C\[C@H](O)CO Amb28315474 [0,1,0,0,0,0|0,0,2]=3 478 B8R0.9 CC(CBr)COC(N)=O Amb27879004 [0,1,0,0,0,0|2,0,1]=4 479 B8R0.9 CC(CCC(=O)O)NO Amb27945567 [0,1,0,0,0,0|1,0,2]=4 480 B8R0.9 CC(CCl)CCC(=O)Cl Amb25921088 [0,1,0,0,0,0|1,0,2]=4 481 B8R0.9 CC(CCl)CCC(=O)O Amb27838484 [0,1,0,0,0,0|0,0,2]=3 482 B8R0.9 CC(CN)CCC(=O)O Amb22059189 [0,1,0,0,0,0|0,0,2]=3 483 B8R0.9 CC(CN)CCC(=O)O Amb28935016 [0,1,0,0,0,0|0,0,2]=3 484 B8R0.9 CC(CN)CNC(N)=O Amb18994081 [0,1,0,0,0,0|2,0,1]=4 485 B8R0.9 CC(CN)OCC(=O)O Amb18629591 [0,1,0,0,0,0|1,0,1]=3 486 B8R0.9 CC(CN)SCC(=O)O Amb28142553 [0,1,0,0,0,0|1,0,1]=3 487 B8R0.9 CC(CO)CNC(N)=O Amb18832521 [0,1,0,0,0,0|2,0,1]=4 488 B8R0.9 CC(CO)SCC(N)=O Amb27969999 [0,1,0,0,0,0|2,0,1]=4 489 B8R0.9 CC(N)CCC(=O)NO Amb27606094 [0,1,0,0,0,0|1,0,2]=4 490 B8R0.9 CC(\C=C\C(=O)O)=C/Br Amb27650571 [0,1,0,0,0,0|0,0,2]=3 491 B8R0.9 CC(\C=C\C(=O)O)CN Amb27234754 [0,1,0,0,0,0|0,0,0]=1 492 B8R0.9 CCC(=O)C=C=C(C)C Amb27838691 [0,1,0,0,0,0|1,0,2]=4 493 B8R0.9 CCC(=O)CCC(C)C Amb9031667 [0,1,0,0,0,0|1,0,2]=4 494 B8R0.9 CCC(=O)CNC(C)C Amb28341444 [0,1,0,0,0,0|2,0,1]=4 495 B8R0.9 CCC(=O)COC(C)C Amb27960841 [0,1,0,0,0,0|2,0,1]=4 496 B8R0.9 CCC(=O)CSC(C)C Amb27450301 [0,1,0,0,0,0|2,0,1]=4 497 B8R0.9 CCC(=O)NCC(C)C Amb17798304 [0,1,0,0,0,0|2,0,1]=4 498 B8R0.9 CCC(=O)OCC(C)C Amb8393164 [0,1,0,0,0,0|2,0,1]=4 499 B8R0.9 CCC(=O)\C=C/C(=O)O Amb27838748 [0,1,0,0,0,0|1,0,1]=3 500 B8R0.9 CCC(=O)\C=C/N(C)C Amb27226663 [0,1,0,0,0,0|2,0,0]=3 501 B8R0.9 CCC(=O)\C=C\C(=O)O Amb18642585 [0,1,0,0,0,0|1,0,1]=3 502 B8R0.9 CCC(=O)\C=C\C(C)O Amb28049154 [0,1,0,0,0,0|2,0,0]=3 503 B8R0.9 CCC(=O)\C=N\N(C)C Amb27630514 [0,1,0,0,0,0|3,0,0]=4 504 B8R0.9 CCC(Br)CCC(=O)O Amb28367201 [0,1,0,0,0,0|1,0,2]=4 505 B8R0.9 CCC(C)C#CC(=O)O Amb28145990 [0,1,0,0,0,0|0,0,2]=3 506 B8R0.9 CCC(C)CCC(=O)O Amb22352932 [0,1,0,0,0,0|0,0,2]=3 507 B8R0.9 CCC(C)CCC(C)=O Amb22229980 [0,1,0,0,0,0|1,0,2]=4 508 B8R0.9 CCC(C)CNC(=O)Cl Amb29881345 [0,1,0,0,0,0|2,0,1]=4 509 B8R0.9 CCC(C)CNC(C)=O Amb27643953 [0,1,0,0,0,0|2,0,1]=4 510 B8R0.9 CCC(C)CNC(N)=O Amb27258807 [0,1,0,0,0,0|2,0,1]=4 511 B8R0.9 CCC(C)COC(=O)Cl Amb20246588 [0,1,0,0,0,0|2,0,1]=4 512 B8R0.9 CCC(C)NCC(=O)O Amb7766416 [0,1,0,0,0,0|1,0,1]=3 513 B8R0.9 CCC(C)NCC(=O)O Amb9184562 [0,1,0,0,0,0|1,0,1]=3 514 B8R0.9 CCC(C)NCC(N)=O Amb6661064 [0,1,0,0,0,0|2,0,1]=4 515 B8R0.9 CCC(C)OCC(=O)O Amb18307944 [0,1,0,0,0,0|1,0,1]=3 516 B8R0.9 CCC(C)OCC(C)=O Amb27803509 [0,1,0,0,0,0|2,0,1]=4 517 B8R0.9 CCC(C)OCC(N)=O Amb27167179 [0,1,0,0,0,0|2,0,1]=4 518 B8R0.9 CCC(C)SCC(=O)O Amb6680193 [0,1,0,0,0,0|1,0,1]=3 519 B8R0.9 CCC(C)SCC(N)=O Amb27603087 [0,1,0,0,0,0|2,0,1]=4 520 B8R0.9 CCC(C)\C=C\C(=O)O Amb33171963 [0,1,0,0,0,0|0,0,0]=1 521 B8R0.9 CCC(C)\C=C\C(C)=O Amb24062970 [0,1,0,0,0,0|1,0,0]=2 522 B8R0.9 CCC(C)\C=C\C(C)Br Amb27600555 [0,1,0,0,0,0|2,0,1]=4 523 B8R0.9 CCC(C)\C=C\C(C)Cl Amb28041984 [0,1,0,0,0,0|2,0,1]=4 524 B8R0.9 CCC(C)\C=C\C(C)N Amb32954227 [0,1,0,0,0,0|2,0,1]=4 525 B8R0.9 CCC(C)\C=C\C(N)=O Amb27439352 [0,1,0,0,0,0|1,0,0]=2 526 B8R0.9 CCC(C)\C=C\[N+](=O)[O-] Amb33171818 [0,1,0,0,0,0|1,0,1]=3 527 B8R0.9 CCC(C)\C=N\S(C)=O Amb35685181 [0,1,0,0,0,0|3,0,0]=4 528 B8R0.9 CCC(Cl)CCC(=O)O Amb27955847 [0,1,0,0,0,0|1,0,2]=4 529 B8R0.9 CCC(N)C#CC(=O)O Amb33168922 [0,1,0,0,0,0|1,0,2]=4 530 B8R0.9 CCC(N)CCC(=O)O Amb21961489 [0,1,0,0,0,0|1,0,2]=4 531 B8R0.9 CCC(N)CCC(=O)O Amb5717972 [0,1,0,0,0,0|1,0,2]=4 532 B8R0.9 CCC(N)\C=C\C(=O)O Amb27867410 [0,1,0,0,0,0|1,0,0]=2 533 B8R0.9 CCC(O)C#CC(=O)O Amb27169546 [0,1,0,0,0,0|1,0,2]=4 534 B8R0.9 CCC(O)CCC(=O)O Amb27149373 [0,1,0,0,0,0|1,0,2]=4 535 B8R0.9 CCC(S)CCC(=O)O Amb27954753 [0,1,0,0,0,0|1,0,2]=4 536 B8R0.9 CCN(C)CCC(=O)O Amb8428205 [0,1,0,0,0,0|1,0,2]=4 537 B8R0.9 CCN(C)CCC(=O)O Amb8890954 [0,1,0,0,0,0|1,0,2]=4 538 B8R0.9 CCS(=O)\C=C\C(=O)O Amb28347741 [0,1,0,0,0,0|2,0,0]=3 539 B8R0.9 CCS(=O)\N=C\C(C)C Amb35726593 [0,1,0,0,0,0|3,0,0]=4 540 B8R0.9 CC[C@@H](C)C#CC(=O)O Amb27975780 [0,1,0,0,0,0|0,0,2]=3 541 B8R0.9 CC[C@@H](C)CCC(=O)O Amb25887394 [0,1,0,0,0,0|0,0,2]=3 542 B8R0.9 CC[C@@H](C)\C=C\C(=O)O Amb24117189 [0,1,0,0,0,0|0,0,0]=1 543 B8R0.9 CC[C@H](C)C#CC(=O)O Amb28132200 [0,1,0,0,0,0|0,0,2]=3 544 B8R0.9 CC[C@H](C)CCC(C)=O Amb27447760 [0,1,0,0,0,0|1,0,2]=4 545 B8R0.9 CC[C@H](C)CCC(N)=O Amb28346481 [0,1,0,0,0,0|1,0,2]=4 546 B8R0.9 CC[C@H](C)COC(C)=O Amb27408010 [0,1,0,0,0,0|2,0,1]=4 547 B8R0.9 CC[C@H](N)\C=C\C(=O)O Amb27878954 [0,1,0,0,0,0|1,0,0]=2 548 B8R0.9 CC[C@H](O)CCC(=O)O Amb27170465 [0,1,0,0,0,0|1,0,2]=4 549 B8R0.9 CC\C(C)=C\CC(=O)O Amb22011800 [0,1,0,0,0,0|0,0,2]=3 550 B8R0.9 CN(C)CCC(=O)NO Amb27762089 [0,1,0,0,0,0|1,0,2]=4 551 B8R0.9 CNC(=O)CCC(C)C Amb27165938 [0,1,0,0,0,0|1,0,2]=4 552 B8R0.9 CNC(=O)\C=C/C(=O)O Amb2720469 [0,1,0,0,0,0|1,0,1]=3 553 B8R0.9 CNC(=O)\C=C\C(=O)O Amb9277097 [0,1,0,0,0,0|1,0,1]=3 554 B8R0.9 CNC(C)\C=C\C(C)C Amb27790089 [0,1,0,0,0,0|2,0,1]=4 555 B8R0.9 COC(=O)C#CC(C)C Amb28250141 [0,1,0,0,0,0|0,0,2]=3 556 B8R0.9 COC(=O)C#CC(C)Cl Amb27243956 [0,1,0,0,0,0|1,0,2]=4 557 B8R0.9 COC(=O)C#C[C@H](C)O Amb27981745 [0,1,0,0,0,0|1,0,2]=4 558 B8R0.9 COC(=O)C=C=C(C)C Amb32423562 [0,1,0,0,0,0|0,0,2]=3 559 B8R0.9 COC(=O)CCC(C)Br Amb24340280 [0,1,0,0,0,0|1,0,2]=4 560 B8R0.9 COC(=O)CCC(C)C Amb9241809 [0,1,0,0,0,0|0,0,2]=3 561 B8R0.9 COC(=O)CCC(C)Cl Amb24644384 [0,1,0,0,0,0|1,0,2]=4 562 B8R0.9 COC(=O)CCC(C)I Amb27445524 [0,1,0,0,0,0|1,0,2]=4 563 B8R0.9 COC(=O)CCC(C)N Amb18642842 [0,1,0,0,0,0|1,0,2]=4 564 B8R0.9 COC(=O)CCC(C)N Amb35750839 [0,1,0,0,0,0|1,0,2]=4 565 B8R0.9 COC(=O)CCC(C)O Amb26459430 [0,1,0,0,0,0|1,0,2]=4 566 B8R0.9 COC(=O)CCC(C)S Amb28066829 [0,1,0,0,0,0|1,0,2]=4 567 B8R0.9 COC(=O)CCC(C)[O-] Amb30988005 [0,1,0,0,0,0|1,0,2]=4 568 B8R0.9 COC(=O)CCN(C)C Amb7757843 [0,1,0,0,0,0|1,0,2]=4 569 B8R0.9 COC(=O)CC[C@@H](C)N Amb24117060 [0,1,0,0,0,0|1,0,2]=4 570 B8R0.9 COC(=O)CC[C@H](C)N Amb27950697 [0,1,0,0,0,0|1,0,2]=4 571 B8R0.9 COC(=O)CNC(C)C Amb6687063 [0,1,0,0,0,0|1,0,1]=3 572 B8R0.9 COC(=O)COC(C)C Amb9206385 [0,1,0,0,0,0|1,0,1]=3 573 B8R0.9 COC(=O)CSC(C)C Amb28049081 [0,1,0,0,0,0|1,0,1]=3 574 B8R0.9 COC(=O)NCC(C)Cl Amb27401852 [0,1,0,0,0,0|2,0,1]=4 575 B8R0.9 COC(=O)NCC(C)O Amb9285615 [0,1,0,0,0,0|2,0,1]=4 576 B8R0.9 COC(=O)NC[C@@H](C)O Amb28204216 [0,1,0,0,0,0|2,0,1]=4 577 B8R0.9 COC(=O)NNC(C)C Amb22496456 [0,1,0,0,0,0|2,0,0]=3 578 B8R0.9 COC(=O)SCC(C)Cl Amb28386344 [0,1,0,0,0,0|2,0,1]=4 579 B8R0.9 COC(=O)\C=C/C(=O)O Amb6295872 [0,1,0,0,0,0|1,0,1]=3 580 B8R0.9 COC(=O)\C=C\B(O)O Amb26080593 [0,1,0,0,0,0|3,0,0]=4 581 B8R0.9 COC(=O)\C=C\C(=O)Cl Amb32664984 [0,1,0,0,0,0|2,0,1]=4 582 B8R0.9 COC(=O)\C=C\C(=O)O Amb33511119 [0,1,0,0,0,0|1,0,1]=3 583 B8R0.9 COC(=O)\C=C\C(C)=O Amb22336182 [0,1,0,0,0,0|1,0,1]=3 584 B8R0.9 COC(=O)\C=C\C(C)C Amb2689521 [0,1,0,0,0,0|0,0,0]=1 585 B8R0.9 COC(=O)\C=C\C(C)N Amb33069659 [0,1,0,0,0,0|1,0,0]=2 586 B8R0.9 COC(=O)\C=C\C(C)N Amb33069671 [0,1,0,0,0,0|1,0,0]=2 587 B8R0.9 COC(=O)\C=C\C(C)O Amb27484758 [0,1,0,0,0,0|1,0,0]=2 588 B8R0.9 COC(=O)\C=C\N(C)C Amb33986628 [0,1,0,0,0,0|1,0,0]=2 589 B8R0.9 COC(=O)\C=C\N(C)O Amb27202378 [0,1,0,0,0,0|2,0,0]=3 590 B8R0.9 COC(=O)\C=C\S(=O)[O-] Amb32755663 [0,1,0,0,0,0|3,0,0]=4 591 B8R0.9 COC(=O)\C=C\S(C)=O Amb28049230 [0,1,0,0,0,0|2,0,0]=3 592 B8R0.9 COC(=O)\C=C\[C@@H](C)N Amb27252211 [0,1,0,0,0,0|1,0,0]=2 593 B8R0.9 COC(C)CCC(=O)O Amb24271104 [0,1,0,0,0,0|0,0,2]=3 594 B8R0.9 COC(C)CCC(C)=O Amb25880180 [0,1,0,0,0,0|1,0,2]=4 595 B8R0.9 COC(C)CNC(=O)Cl Amb35633401 [0,1,0,0,0,0|2,0,1]=4 596 B8R0.9 COC(C)COC(=O)Cl Amb32656121 [0,1,0,0,0,0|2,0,1]=4 597 B8R0.9 COC(C)COC(C)=O Amb22734341 [0,1,0,0,0,0|2,0,1]=4 598 B8R0.9 COC(C)OCC(C)=O Amb24378350 [0,1,0,0,0,0|2,0,1]=4 599 B8R0.9 COC(C)\C=C\C(=O)O Amb27203687 [0,1,0,0,0,0|0,0,0]=1 600 B8R0.9 COC(C)\C=C\C(C)=O Amb27841431 [0,1,0,0,0,0|1,0,0]=2 601 B8R0.9 COC(C)\C=C\C(C)O Amb27452354 [0,1,0,0,0,0|1,0,1]=3 602 B8R0.9 COC(C)\C=N\S(C)=O Amb35722162 [0,1,0,0,0,0|3,0,0]=4 603 B8R0.9 COC(F)C#CC(=O)O Amb33169067 [0,1,0,0,0,0|1,0,2]=4 604 B8R0.9 CON(C)CCC(=O)O Amb27881744 [0,1,0,0,0,0|1,0,2]=4 605 B8R0.9 CON(C)\C=C\C(=O)O Amb35734889 [0,1,0,0,0,0|1,0,0]=2 606 B8R0.9 CO[C@@H](C)CCC(=O)O Amb28241276 [0,1,0,0,0,0|0,0,2]=3 607 B8R0.9 CO[C@@H](C)CNC(C)=O Amb35605355 [0,1,0,0,0,0|2,0,1]=4 608 B8R0.9 CO[C@@H](C)CNC(N)=O Amb35641866 [0,1,0,0,0,0|2,0,1]=4 609 B8R0.9 CO[C@H](C)CNC(C)=O Amb30024558 [0,1,0,0,0,0|2,0,1]=4 610 B8R0.9 CO[C@H](C)CNC(N)=O Amb29883111 [0,1,0,0,0,0|2,0,1]=4 611 B8R0.9 CO\C(C)=C\CC(=O)O Amb27963206 [0,1,0,0,0,0|0,0,2]=3 612 B8R0.9 CO\P(=O)=C\CC(=O)O Amb27199324 [0,1,0,0,0,0|2,0,1]=4 613 B8R0.9 CSC(=N)\C=C\N(C)C Amb27635326 [0,1,0,0,0,0|2,1,0]=4 614 B8R0.9 CSC(=O)CCC(C)C Amb25743840 [0,1,0,0,0,0|0,1,2]=4 615 B8R0.9 CSC(=O)\C=C/C(C)=O Amb27256793 [0,1,0,0,0,0|1,1,1]=4 616 B8R0.9 CSC(C)CCC(=O)O Amb22059071 [0,1,0,0,0,0|0,0,2]=3 617 B8R0.9 CSC(C)CCC(N)=O Amb27247670 [0,1,0,0,0,0|1,0,2]=4 618 B8R0.9 CSC(C)CNC(=O)Cl Amb35633460 [0,1,0,0,0,0|2,0,1]=4 619 B8R0.9 C[C@H](O)CNC(=O)CO Amb27829811 [0,1,0,0,0,0|2,0,1]=4 620 B8R0.9 C[N+](C)=CNC(=O)CCl Amb27823245 [0,1,0,0,0,0|3,0,0]=4 621 B8R0.9 C\C(=C\C=C(Cl)Cl)CO Amb27801560 [0,1,0,0,0,0|2,0,1]=4 622 B8R0.9 C\C(=C\NC(C)C)CCl Amb28046327 [0,1,0,0,0,0|3,0,0]=4 623 B8R0.9 C\C(C#N)=C\CC(=O)O Amb27196398 [0,1,0,0,0,0|0,0,3]=4 624 B8R0.9 C\C(C=O)=C/OC(C)C Amb27659430 [0,1,0,0,0,0|2,0,0]=3 625 B8R0.9 C\C(C=O)=C\CC(C)C Amb24573481 [0,1,0,0,0,0|1,0,1]=3 626 B8R0.9 C\C(CCC(C)C)=N/O Amb25235824 [0,1,0,0,0,0|1,0,2]=4 627 B8R0.9 C\C(CCC(C)C)=N\O Amb24547350 [0,1,0,0,0,0|1,0,2]=4 628 B8R0.9 C\C(CSC(C)C)=N/O Amb27406156 [0,1,0,0,0,0|2,0,1]=4 629 B8R0.9 C\C=C(C)/C=C/C(=O)O Amb27838460 [0,1,0,0,0,0|0,0,1]=2 630 B8R0.9 C\C=C(C)/C=C/C(C)=O Amb27428251 [0,1,0,0,0,0|1,0,1]=3 631 B8R0.9 C\C=C(C)\C=C/C(C)=O Amb28199822 [0,1,0,0,0,0|1,0,1]=3 632 B8R0.9 C\C=C(C)\C=C\C(=O)O Amb18642399 [0,1,0,0,0,0|0,0,1]=2 633 B8R0.9 C\C=C(Cl)\C=C\C(=O)O Amb28137785 [0,1,0,0,0,0|1,0,1]=3 634 B8R0.9 C\C=C(F)\C=C\C(=O)O Amb27826588 [0,1,0,0,0,0|1,0,1]=3 635 B8R0.9 NC(CCl)CCC(=O)O Amb27440510 [0,1,0,0,0,0|1,0,2]=4 636 B8R0.9 NC(CF)CCC(=O)O Amb19148378 [0,1,0,0,0,0|1,0,2]=4 637 B8R0.9 NC(CF)CCC(=O)O Amb33473114 [0,1,0,0,0,0|1,0,2]=4 638 B8R0.9 NC(CO)CCC(=O)O Amb18642916 [0,1,0,0,0,0|1,0,2]=4 639 B8R0.9 NC(CO)CCC(=O)O Amb32665461 [0,1,0,0,0,0|1,0,2]=4 640 B8R0.9 NC(CS)CCC(=O)O Amb27458291 [0,1,0,0,0,0|1,0,2]=4 641 B8R0.9 NCC(N)CCC(=O)O Amb19328773 [0,1,0,0,0,0|1,0,2]=4 642 B8R0.9 NCC(N)CCC(=O)O Amb27837536 [0,1,0,0,0,0|1,0,2]=4 643 B8R0.9 NCC(O)CCC(=O)O Amb29838305 [0,1,0,0,0,0|1,0,2]=4 644 B8R0.9 NC[C@@H](O)CCC(=O)O Amb27477096 [0,1,0,0,0,0|1,0,2]=4 645 B8R0.9 NC[C@H](N)CCC(=O)O Amb28068164 [0,1,0,0,0,0|1,0,2]=4 646 B8R0.9 N[C@@H](CS)CCC(=O)O Amb28341808 [0,1,0,0,0,0|1,0,2]=4 647 B8R0.9 N[C@H](CF)CCC(=O)O Amb32729481 [0,1,0,0,0,0|1,0,2]=4 648 B8R0.9 N[C@H](CO)CCC(=O)O Amb24685421 [0,1,0,0,0,0|1,0,2]=4 649 B8R0.9 N[C@H](CO)CCC(=O)O Amb32664911 [0,1,0,0,0,0|1,0,2]=4 650 B8R0.9 O=C(O)CCC(O)CCl Amb27799910 [0,1,0,0,0,0|1,0,2]=4 651 B8R0.9 O=C(O)CCC(S)CS Amb27407074 [0,1,0,0,0,0|1,0,2]=4 652 B8R0.9 O=C(O)\C=C\C(=O)NO Amb28060797 [0,1,0,0,0,0|2,0,1]=4 653 B8R0.9 O=C(O)\C=C\C(O)CO Amb18642875 [0,1,0,0,0,0|1,0,0]=2 654 B8R0.9 O=C(O)\C=C\[C@H](O)CO Amb27437218 [0,1,0,0,0,0|1,0,0]=2 655 B8R0.23 C=C(C)C(=O)CC(C)C Amb25222433 [0,1,0,0,0,0|2,0,1]=4 656 B8R0.23 C=C(C)C(=O)NC(C)C Amb20621998 [0,1,0,0,0,0|3,0,0]=4 657 B8R0.23 C=C(C)C(=O)OC(C)C Amb17934142 [0,1,0,0,0,0|3,0,0]=4 658 B8R0.23 C=C(C)CC(=O)C(=O)O Amb28073130 [0,1,0,0,0,0|0,0,3]=4 659 B8R0.23 C=C(C)\C(C)=C\C(=O)O Amb17593311 [0,1,0,0,0,0|0,0,2]=3 660 B8R0.23 C=C(C)\C(C)=C\C(C)=O Amb28130583 [0,1,0,0,0,0|1,0,2]=4 661 B8R0.23 C=C(C)\C(Cl)=C/C(C)=O Amb27826885 [0,1,0,0,0,0|1,0,2]=4 662 B8R0.23 C=C(C)\C(Cl)=C\C(C)=O Amb28052286 [0,1,0,0,0,0|1,0,2]=4 663 B8R0.23 C=C(C)\C(O)=C\C(C)=O Amb27844297 [0,1,0,0,0,0|1,0,2]=4 664 B8R0.23 C=C(CC(=O)O)C(C)=O Amb27831643 [0,1,0,0,0,0|1,0,2]=4 665 B8R0.23 C=C(CC(C)C)C(=O)Cl Amb28256819 [0,1,0,0,0,0|1,0,1]=3 666 B8R0.23 C=C(CC(C)C)C(=O)O Amb33542856 [0,1,0,0,0,0|0,0,1]=2 667 B8R0.23 C=C(CC(C)C)C(C)=O Amb22277685 [0,1,0,0,0,0|1,0,1]=3 668 B8R0.23 C=C(CN(C)C)C(=O)O Amb33544507 [0,1,0,0,0,0|1,0,1]=3 669 B8R0.23 C=C(CN(C)C)C(C)=O Amb8397272 [0,1,0,0,0,0|2,0,1]=4 670 B8R0.23 C=C(CN(C)O)C(=O)O Amb27640409 [0,1,0,0,0,0|2,0,1]=4 671 B8R0.23 C=C(Cl)CC(=O)C(C)C Amb28144043 [0,1,0,0,0,0|2,0,1]=4 672 B8R0.23 C=C(NC(C)=O)C(=O)O Amb8513049 [0,1,0,0,0,0|2,0,1]=4 673 B8R0.23 C=C(O)CC(=C)N(C)C Amb27767982 [0,1,0,0,0,0|2,0,1]=4 674 B8R0.23 C=C(OC(C)C)C(C)=O Amb27263012 [0,1,0,0,0,0|2,0,0]=3 675 B8R0.23 CC(=O)C(=O)C=C(C)C Amb27843950 [0,1,0,0,0,0|1,0,1]=3 676 B8R0.23 CC(=O)C(=O)CC(=O)O Amb17593364 [0,1,0,0,0,0|1,0,2]=4 677 B8R0.23 CC(=O)C(=O)CC(C)C Amb22489717 [0,1,0,0,0,0|1,0,1]=3 678 B8R0.23 CC(=O)C(=O)NC(C)C Amb17399820 [0,1,0,0,0,0|2,0,0]=3 679 B8R0.23 CC(=O)C(=O)OC(C)C Amb22232277 [0,1,0,0,0,0|2,0,0]=3 680 B8R0.23 CC(=O)C(C)CC(C)C Amb24640121 [0,1,0,0,0,0|1,0,2]=4 681 B8R0.23 CC(=O)C(O)CC(C)C Amb26845888 [0,1,0,0,0,0|1,0,2]=4 682 B8R0.23 CC(=O)CC(=O)C(=O)O Amb18642736 [0,1,0,0,0,0|1,0,2]=4 683 B8R0.23 CC(=O)CC(=O)C(C)C Amb17778966 [0,1,0,0,0,0|1,0,1]=3 684 B8R0.23 CC(=O)CC(=O)N(C)C Amb1152296 [0,1,0,0,0,0|2,0,1]=4 685 B8R0.23 CC(=O)CC(=S)N(C)C Amb27836775 [0,1,0,0,0,0|2,0,1]=4 686 B8R0.23 CC(=O)CC(Br)C(C)C Amb28436887 [0,1,0,0,0,0|1,0,2]=4 687 B8R0.23 CC(=O)CC(Cl)=C(C)C Amb28351823 [0,1,0,0,0,0|1,0,2]=4 688 B8R0.23 CC(=O)CC(N)C(C)C Amb27409984 [0,1,0,0,0,0|1,0,2]=4 689 B8R0.23 CC(=O)CN(C)C(C)C Amb22587141 [0,1,0,0,0,0|2,0,1]=4 690 B8R0.23 CC(=O)CS(=O)C(C)C Amb27804515 [0,1,0,0,0,0|2,0,1]=4 691 B8R0.23 CC(=O)C[C@@H](O)C(C)C Amb25135567 [0,1,0,0,0,0|1,0,2]=4 692 B8R0.23 CC(=O)C[C@H](C)C(C)C Amb28285288 [0,1,0,0,0,0|1,0,2]=4 693 B8R0.23 CC(=O)NC(=O)C(C)C Amb28428628 [0,1,0,0,0,0|2,0,0]=3 694 B8R0.23 CC(=O)NC(=O)C(C)Cl Amb9534235 [0,1,0,0,0,0|3,0,0]=4 695 B8R0.23 CC(=O)NC(=S)N(C)C Amb24741222 [0,1,0,0,0,0|3,0,0]=4 696 B8R0.23 CC(=O)OC(=O)C(C)O Amb28049127 [0,1,0,0,0,0|3,0,0]=4 697 B8R0.23 CC(=O)[C@@H](N)CC(C)C Amb28344512 [0,1,0,0,0,0|1,0,2]=4 698 B8R0.23 CC(=O)[C@@H](O)CC(C)C Amb28202353 [0,1,0,0,0,0|1,0,2]=4 699 B8R0.23 CC(=O)[C@H](N)CC(C)C Amb27490707 [0,1,0,0,0,0|1,0,2]=4 700 B8R0.23 CC(=O)\C(Br)=C\C(=O)O Amb27983634 [0,1,0,0,0,0|1,0,1]=3 701 B8R0.23 CC(=O)\C(C)=C/C(C)O Amb27838725 [0,1,0,0,0,0|2,0,0]=3 702 B8R0.23 CC(=O)\C(C)=C/N(C)C Amb27191797 [0,1,0,0,0,0|2,0,0]=3 703 B8R0.23 CC(=O)\C(C)=C\C(=O)O Amb27838567 [0,1,0,0,0,0|1,0,1]=3 704 B8R0.23 CC(=O)\C(C)=C\N(C)C Amb28199737 [0,1,0,0,0,0|2,0,0]=3 705 B8R0.23 CC(=O)\C(C)=N/C(C)C Amb27165098 [0,1,0,0,0,0|2,0,0]=3 706 B8R0.23 CC(=O)\C(C)=N\C(C)C Amb27826830 [0,1,0,0,0,0|2,0,0]=3 707 B8R0.23 CC(=O)\C(C)=N\N(C)C Amb26984737 [0,1,0,0,0,0|3,0,0]=4 708 B8R0.23 CC(=O)\C=C(/C)C(=O)O Amb18642577 [0,1,0,0,0,0|1,0,1]=3 709 B8R0.23 CC(=O)\C=C(/C)C(C)C Amb27649040 [0,1,0,0,0,0|1,0,0]=2 710 B8R0.23 CC(=O)\C=C(/C)N(C)C Amb28429281 [0,1,0,0,0,0|2,0,0]=3 711 B8R0.23 CC(=O)\C=C(/C)[PH](=O)O Amb27838812 [0,1,0,0,0,0|2,0,1]=4 712 B8R0.23 CC(=O)\C=C(/Cl)N(C)C Amb27844137 [0,1,0,0,0,0|2,0,0]=3 713 B8R0.23 CC(=O)\C=C(/N)C(=O)O Amb28206217 [0,1,0,0,0,0|1,0,1]=3 714 B8R0.23 CC(=O)\C=C(/N)C(C)C Amb27477023 [0,1,0,0,0,0|1,0,0]=2 715 B8R0.23 CC(=O)\C=C(/O)C(=O)O Amb28122229 [0,1,0,0,0,0|1,0,1]=3 716 B8R0.23 CC(=O)\C=C(\Br)C(=O)O Amb27419942 [0,1,0,0,0,0|1,0,1]=3 717 B8R0.23 CC(=O)\C=C(\C)[PH](=O)O Amb28248338 [0,1,0,0,0,0|2,0,1]=4 718 B8R0.23 CC(=O)\C=C(\Cl)N(C)C Amb27424743 [0,1,0,0,0,0|2,0,0]=3 719 B8R0.23 CC(=O)\C=C(\O)C(=O)O Amb25856143 [0,1,0,0,0,0|1,0,1]=3 720 B8R0.23 CC(=S)CC(=O)C(C)C Amb27838816 [0,1,0,0,0,0|1,1,1]=4 721 B8R0.23 CC(Br)CC(=O)C(=O)O Amb28146183 [0,1,0,0,0,0|1,0,1]=3 722 B8R0.23 CC(Br)CC(C)C(=O)O Amb27760411 [0,1,0,0,0,0|1,0,2]=4 723 B8R0.23 CC(C)=C(C)CC(=O)O Amb18642613 [0,1,0,0,0,0|0,0,2]=3 724 B8R0.23 CC(C)=CC(=O)C(C)C Amb27389734 [0,1,0,0,0,0|2,0,0]=3 725 B8R0.23 CC(C)=CC(=O)C(C)N Amb28071144 [0,1,0,0,0,0|3,0,0]=4 726 B8R0.23 CC(C)=CC(=O)N(C)C Amb25311833 [0,1,0,0,0,0|3,0,0]=4 727 B8R0.23 CC(C)=CC(=O)[C@@H](C)N Amb30024530 [0,1,0,0,0,0|3,0,0]=4 728 B8R0.23 CC(C)=CC(C)=C(C)C Amb22365199 [0,1,0,0,0,0|2,0,1]=4 729 B8R0.23 CC(C)=CC(O)C(=O)O Amb28346343 [0,1,0,0,0,0|0,0,2]=3 730 B8R0.23 CC(C)=CC(O)C(C)C Amb28187123 [0,1,0,0,0,0|2,0,1]=4 731 B8R0.23 CC(C)=C[C@@H](O)C(=O)O Amb27228179 [0,1,0,0,0,0|0,0,2]=3 732 B8R0.23 CC(C)=C[C@H](O)C(=O)O Amb27473652 [0,1,0,0,0,0|0,0,2]=3 733 B8R0.23 CC(C)=C[C@H](O)C(C)C Amb28049217 [0,1,0,0,0,0|2,0,1]=4 734 B8R0.23 CC(C)C(=O)CS(C)=O Amb28041249 [0,1,0,0,0,0|2,0,1]=4 735 B8R0.23 CC(C)C(=O)C[C@H](C)O Amb28285164 [0,1,0,0,0,0|1,0,2]=4 736 B8R0.23 CC(C)C(=O)C[N+](=O)[O-] Amb27802158 [0,1,0,0,0,0|1,0,2]=4 737 B8R0.23 CC(C)C(=O)NC(N)=O Amb25716051 [0,1,0,0,0,0|2,0,0]=3 738 B8R0.23 CC(C)C(=S)NC(N)=O Amb27168629 [0,1,0,0,0,0|2,0,0]=3 739 B8R0.23 CC(C)C(C)C=C(Br)Br Amb27837696 [0,1,0,0,0,0|2,0,1]=4 740 B8R0.23 CC(C)C(C)CC(=O)O Amb10844380 [0,1,0,0,0,0|0,0,2]=3 741 B8R0.23 CC(C)C(C)CC(N)=O Amb25146130 [0,1,0,0,0,0|1,0,2]=4 742 B8R0.23 CC(C)C(C)NC(=O)Cl Amb35637133 [0,1,0,0,0,0|2,0,1]=4 743 B8R0.23 CC(C)C(C)NC(N)=O Amb7761978 [0,1,0,0,0,0|2,0,1]=4 744 B8R0.23 CC(C)C(C)OC(=O)Cl Amb27835399 [0,1,0,0,0,0|2,0,1]=4 745 B8R0.23 CC(C)C(Cl)C=C(Cl)Cl Amb28458515 [0,1,0,0,0,0|2,0,1]=4 746 B8R0.23 CC(C)C(Cl)CC(=O)O Amb27974166 [0,1,0,0,0,0|0,0,2]=3 747 B8R0.23 CC(C)C(Cl)OC(=O)Cl Amb8515447 [0,1,0,0,0,0|2,0,1]=4 748 B8R0.23 CC(C)C(N)CC(=O)O Amb2436060 [0,1,0,0,0,0|0,0,2]=3 749 B8R0.23 CC(C)C(N)CC(=O)O Amb31307617 [0,1,0,0,0,0|0,0,2]=3 750 B8R0.23 CC(C)C(N)CC(N)=O Amb18296021 [0,1,0,0,0,0|1,0,2]=4 751 B8R0.23 CC(C)C(O)CC(=O)O Amb17231878 [0,1,0,0,0,0|0,0,2]=3 752 B8R0.23 CC(C)CC(=N)C(=O)O Amb27268516 [0,1,0,0,0,0|0,0,1]=2 753 B8R0.23 CC(C)CC(=O)C(=O)Cl Amb28350424 [0,1,0,0,0,0|1,0,1]=3 754 B8R0.23 CC(C)CC(=O)C(=O)O Amb8387123 [0,1,0,0,0,0|0,0,1]=2 755 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb21962530 [0,1,0,0,0,0|0,0,2]=3 756 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb22360647 [0,1,0,0,0,0|0,0,2]=3 757 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb8393074 [0,1,0,0,0,0|0,0,2]=3 758 B8R0.23 CC(C)CC(=O)C(=O)[O-] Amb8513874 [0,1,0,0,0,0|0,0,2]=3 759 B8R0.23 CC(C)CC(=O)C(C)O Amb25808608 [0,1,0,0,0,0|1,0,2]=4 760 B8R0.23 CC(C)CC(=O)C(N)=S Amb28046427 [0,1,0,0,0,0|1,1,1]=4 761 B8R0.23 CC(C)CC(=O)[C@H](C)O Amb27598746 [0,1,0,0,0,0|1,0,2]=4 762 B8R0.23 CC(C)CC(Br)C(=O)Cl Amb26515942 [0,1,0,0,0,0|1,0,2]=4 763 B8R0.23 CC(C)CC(Br)C(=O)O Amb16233356 [0,1,0,0,0,0|0,0,2]=3 764 B8R0.23 CC(C)CC(C)C(=O)O Amb18975244 [0,1,0,0,0,0|0,0,2]=3 765 B8R0.23 CC(C)CC(Cl)C(=O)Cl Amb27400431 [0,1,0,0,0,0|1,0,2]=4 766 B8R0.23 CC(C)CC(Cl)C(=O)O Amb17593753 [0,1,0,0,0,0|0,0,2]=3 767 B8R0.23 CC(C)CC(F)C(=O)O Amb24565634 [0,1,0,0,0,0|0,0,2]=3 768 B8R0.23 CC(C)CC(N)C(=O)O Amb9703094 [0,1,0,0,0,0|0,0,2]=3 769 B8R0.23 CC(C)CC(N)C(N)=O Amb6334827 [0,1,0,0,0,0|1,0,2]=4 770 B8R0.23 CC(C)CC(N)C(N)=O Amb9729639 [0,1,0,0,0,0|1,0,2]=4 771 B8R0.23 CC(C)CC(N)[PH](=O)O Amb27831348 [0,1,0,0,0,0|1,0,2]=4 772 B8R0.23 CC(C)CC(O)C(=O)O Amb2694726 [0,1,0,0,0,0|0,0,2]=3 773 B8R0.23 CC(C)CC(O)C(=O)[O-] Amb33872314 [0,1,0,0,0,0|0,0,3]=4 774 B8R0.23 CC(C)CC(O)[PH](=O)O Amb27255267 [0,1,0,0,0,0|1,0,2]=4 775 B8R0.23 CC(C)CC(S)C(=O)O Amb18296292 [0,1,0,0,0,0|0,0,2]=3 776 B8R0.23 CC(C)CN(C)C(=O)Cl Amb26589878 [0,1,0,0,0,0|2,0,1]=4 777 B8R0.23 CC(C)CN(N)C(N)=O Amb27624191 [0,1,0,0,0,0|2,0,1]=4 778 B8R0.23 CC(C)C[C@@H](C)C(=O)O Amb10844070 [0,1,0,0,0,0|0,0,2]=3 779 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O Amb22800398 [0,1,0,0,0,0|0,0,2]=3 780 B8R0.23 CC(C)C[C@@H](F)C(=O)O Amb24616998 [0,1,0,0,0,0|0,0,2]=3 781 B8R0.23 CC(C)C[C@@H](N)C(=O)O Amb2720579 [0,1,0,0,0,0|0,0,2]=3 782 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb16183944 [0,1,0,0,0,0|1,0,2]=4 783 B8R0.23 CC(C)C[C@@H](N)C(N)=O Amb22745197 [0,1,0,0,0,0|1,0,2]=4 784 B8R0.23 CC(C)C[C@@H](O)C(=O)O Amb8630052 [0,1,0,0,0,0|0,0,2]=3 785 B8R0.23 CC(C)C[C@@H](S)C(=O)O Amb27786874 [0,1,0,0,0,0|0,0,2]=3 786 B8R0.23 CC(C)C[C@H](Br)C(=O)O Amb22226489 [0,1,0,0,0,0|0,0,2]=3 787 B8R0.23 CC(C)C[C@H](Br)C(N)=O Amb28197754 [0,1,0,0,0,0|1,0,2]=4 788 B8R0.23 CC(C)C[C@H](C)C(=O)O Amb10844071 [0,1,0,0,0,0|0,0,2]=3 789 B8R0.23 CC(C)C[C@H](Cl)C(=O)Cl Amb27657532 [0,1,0,0,0,0|1,0,2]=4 790 B8R0.23 CC(C)C[C@H](Cl)C(=O)O Amb22388637 [0,1,0,0,0,0|0,0,2]=3 791 B8R0.23 CC(C)C[C@H](F)C(=O)O Amb10841083 [0,1,0,0,0,0|0,0,2]=3 792 B8R0.23 CC(C)C[C@H](N)C(=O)O Amb3499446 [0,1,0,0,0,0|0,0,2]=3 793 B8R0.23 CC(C)C[C@H](N)C(=O)S Amb27810129 [0,1,0,0,0,0|0,1,2]=4 794 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb10670112 [0,1,0,0,0,0|1,0,2]=4 795 B8R0.23 CC(C)C[C@H](N)C(N)=O Amb8515324 [0,1,0,0,0,0|1,0,2]=4 796 B8R0.23 CC(C)C[C@H](O)C(=O)O Amb16232074 [0,1,0,0,0,0|0,0,2]=3 797 B8R0.23 CC(C)N(C)CC(=O)O Amb10609863 [0,1,0,0,0,0|1,0,1]=3 798 B8R0.23 CC(C)N(C)CC(=O)O Amb6639901 [0,1,0,0,0,0|1,0,1]=3 799 B8R0.23 CC(C)NC(=O)C(=O)O Amb2693957 [0,1,0,0,0,0|1,0,0]=2 800 B8R0.23 CC(C)NC(=O)C(C)O Amb9421392 [0,1,0,0,0,0|2,0,1]=4 801 B8R0.23 CC(C)NC(=O)C(N)=S Amb19514732 [0,1,0,0,0,0|2,1,0]=4 802 B8R0.23 CC(C)NC(=O)N(C)O Amb27174320 [0,1,0,0,0,0|3,0,0]=4 803 B8R0.23 CC(C)NC(=O)[C@@H](C)O Amb25724418 [0,1,0,0,0,0|2,0,1]=4 804 B8R0.23 CC(C)NC(C)C(=O)O Amb10199874 [0,1,0,0,0,0|1,0,1]=3 805 B8R0.23 CC(C)NC(C)C(=O)O Amb1110769 [0,1,0,0,0,0|1,0,1]=3 806 B8R0.23 CC(C)N[C@H](C)C(=O)O Amb26409390 [0,1,0,0,0,0|1,0,1]=3 807 B8R0.23 CC(C)OC(=O)N(C)O Amb25961035 [0,1,0,0,0,0|3,0,0]=4 808 B8R0.23 CC(C)OC(=O)[C@@H](C)O Amb24117117 [0,1,0,0,0,0|2,0,1]=4 809 B8R0.23 CC(C)OC(C)C(=O)O Amb10607866 [0,1,0,0,0,0|1,0,1]=3 810 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb6541556 [0,1,0,0,0,0|1,0,2]=4 811 B8R0.23 CC(C)OC(C)C(=O)[O-] Amb9172207 [0,1,0,0,0,0|1,0,2]=4 812 B8R0.23 CC(C)OC(F)C(=O)O Amb28045324 [0,1,0,0,0,0|1,0,1]=3 813 B8R0.23 CC(C)SC(=S)C(=O)O Amb27196601 [0,1,0,0,0,0|1,0,0]=2 814 B8R0.23 CC(C)SC(C)C(=O)O Amb6263656 [0,1,0,0,0,0|1,0,1]=3 815 B8R0.23 CC(C)SC(C)C(N)=O Amb28071700 [0,1,0,0,0,0|2,0,1]=4 816 B8R0.23 CC(C)S[C@H](C)C(=O)O Amb27771567 [0,1,0,0,0,0|1,0,1]=3 817 B8R0.23 CC(C)[C@@H](C)CC(=O)O Amb27785773 [0,1,0,0,0,0|0,0,2]=3 818 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb16184030 [0,1,0,0,0,0|0,0,2]=3 819 B8R0.23 CC(C)[C@@H](N)CC(=O)O Amb22226647 [0,1,0,0,0,0|0,0,2]=3 820 B8R0.23 CC(C)[C@@H](N)CC(N)=O Amb28340737 [0,1,0,0,0,0|1,0,2]=4 821 B8R0.23 CC(C)[C@@H](O)CC(=O)O Amb25761246 [0,1,0,0,0,0|0,0,2]=3 822 B8R0.23 CC(C)[C@@H](O)CC(N)=O Amb27443470 [0,1,0,0,0,0|1,0,2]=4 823 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb16184024 [0,1,0,0,0,0|0,0,2]=3 824 B8R0.23 CC(C)[C@H](N)CC(=O)O Amb20240790 [0,1,0,0,0,0|0,0,2]=3 825 B8R0.23 CC(C)[C@H](N)CC(N)=O Amb24481857 [0,1,0,0,0,0|1,0,2]=4 826 B8R0.23 CC(C)[C@H](O)CC(=O)O Amb24561913 [0,1,0,0,0,0|0,0,2]=3 827 B8R0.23 CC(C)\C(N)=C\C(N)=O Amb27413103 [0,1,0,0,0,0|1,0,0]=2 828 B8R0.23 CC(C)\C(N)=C\C(N)=S Amb28241427 [0,1,0,0,0,0|1,1,0]=3 829 B8R0.23 CC(C)\C=C(/F)C(=O)O Amb34913203 [0,1,0,0,0,0|0,0,0]=1 830 B8R0.23 CC(C)\C=C(\Br)C(=O)O Amb27789870 [0,1,0,0,0,0|0,0,0]=1 831 B8R0.23 CC(C)\C=C(\F)C(=O)O Amb27838509 [0,1,0,0,0,0|0,0,0]=1 832 B8R0.23 CC(CC(=O)O)N(C)C Amb8428133 [0,1,0,0,0,0|1,0,2]=4 833 B8R0.23 CC(CC(=O)O)N(C)C Amb9173357 [0,1,0,0,0,0|1,0,2]=4 834 B8R0.23 CC(CN(C)C)C(=O)O Amb8428203 [0,1,0,0,0,0|1,0,2]=4 835 B8R0.23 CC(CN(C)C)C(=O)O Amb9173365 [0,1,0,0,0,0|1,0,2]=4 836 B8R0.23 CC(Cl)C(=O)NC(N)=O Amb380836 [0,1,0,0,0,0|3,0,0]=4 837 B8R0.23 CC(Cl)CC(N)C(=O)O Amb28325413 [0,1,0,0,0,0|1,0,2]=4 838 B8R0.23 CC(Cl)\C=C(\O)C(=O)O Amb27658885 [0,1,0,0,0,0|1,0,0]=2 839 B8R0.23 CC(N)C(O)CC(=O)O Amb27796214 [0,1,0,0,0,0|1,0,2]=4 840 B8R0.23 CC(N)CC(N)C(=O)O Amb28144636 [0,1,0,0,0,0|1,0,2]=4 841 B8R0.23 CC(N)CC(O)C(=O)O Amb27975686 [0,1,0,0,0,0|1,0,2]=4 842 B8R0.23 CC(O)C(=O)NC(N)=O Amb9421397 [0,1,0,0,0,0|3,0,0]=4 843 B8R0.23 CC(O)C(N)CC(=O)O Amb27424723 [0,1,0,0,0,0|1,0,2]=4 844 B8R0.23 CC(O)CC(=O)C(=O)O Amb25789747 [0,1,0,0,0,0|1,0,1]=3 845 B8R0.23 CC(O)CC(N)C(=O)O Amb18642918 [0,1,0,0,0,0|1,0,2]=4 846 B8R0.23 CC(O)C[C@@H](N)C(=O)O Amb26985188 [0,1,0,0,0,0|1,0,2]=4 847 B8R0.23 CC(O)C[C@H](N)C(=O)O Amb27185464 [0,1,0,0,0,0|1,0,2]=4 848 B8R0.23 CC(O)OC(=O)C(C)C Amb28049225 [0,1,0,0,0,0|2,0,1]=4 849 B8R0.23 CN(C)C(=O)CC(=O)O Amb17399822 [0,1,0,0,0,0|1,0,1]=3 850 B8R0.23 CN(C)C(=O)CC(N)=O Amb17760295 [0,1,0,0,0,0|2,0,1]=4 851 B8R0.23 CN(C)C(=O)NC(N)=O Amb27254207 [0,1,0,0,0,0|3,0,0]=4 852 B8R0.23 CN(C)CC(N)C(=O)O Amb23558085 [0,1,0,0,0,0|1,0,2]=4 853 B8R0.23 CN(C)CC(N)C(=O)O Amb32644516 [0,1,0,0,0,0|1,0,2]=4 854 B8R0.23 CN(C)CC(N)C(=O)O Amb33756799 [0,1,0,0,0,0|1,0,2]=4 855 B8R0.23 CN(C)CC(O)C(=O)O Amb27856754 [0,1,0,0,0,0|1,0,2]=4 856 B8R0.23 CN(C)C[C@@H](N)C(=O)O Amb19889770 [0,1,0,0,0,0|1,0,2]=4 857 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb24078627 [0,1,0,0,0,0|1,0,2]=4 858 B8R0.23 CN(C)C[C@H](N)C(=O)O Amb8515079 [0,1,0,0,0,0|1,0,2]=4 859 B8R0.23 CN(C)C[C@H](O)C(=O)O Amb24372674 [0,1,0,0,0,0|1,0,2]=4 860 B8R0.23 CN(C)\C(N)=N\C(N)=O Amb24481785 [0,1,0,0,0,0|3,0,0]=4 861 B8R0.23 CN(N)C(=O)CC(=O)O Amb25326354 [0,1,0,0,0,0|2,0,1]=4 862 B8R0.23 C[C@@H](Cl)C[C@H](N)C(=O)O Amb27863035 [0,1,0,0,0,0|1,0,2]=4 863 B8R0.23 C[C@@H](N)C(=O)CC(N)=O Amb28188661 [0,1,0,0,0,0|2,0,1]=4 864 B8R0.23 C[C@@H](O)C[C@@H](N)C(=O)O Amb27254158 [0,1,0,0,0,0|1,0,2]=4 865 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O Amb22168848 [0,1,0,0,0,0|1,0,2]=4 866 B8R0.23 C[C@H](N)C(O)CC(=O)O Amb27622153 [0,1,0,0,0,0|1,0,2]=4 867 B8R0.23 C[C@H](N)C[C@@H](O)C(=O)O Amb27231129 [0,1,0,0,0,0|1,0,2]=4 868 B8R0.23 C[C@H](N)C[C@H](N)C(=O)O Amb27815088 [0,1,0,0,0,0|1,0,2]=4 869 B8R0.23 C[C@H](N)C[C@H](O)C(=O)O Amb27180466 [0,1,0,0,0,0|1,0,2]=4 870 B8R0.23 C[C@H](N)[C@H](O)CC(=O)O Amb27975677 [0,1,0,0,0,0|1,0,2]=4 871 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O Amb16184021 [0,1,0,0,0,0|1,0,2]=4 872 B8R0.23 C\C(=C/B(O)O)C(C)C Amb27241046 [0,1,0,0,0,0|1,0,1]=3 873 B8R0.23 C\C(=C/C(=O)O)C(=O)O Amb9703112 [0,1,0,0,0,0|2,0,1]=4 874 B8R0.23 C\C(=C/C(=O)O)C(C)C Amb17506861 [0,1,0,0,0,0|0,0,0]=1 875 B8R0.23 C\C(=C/C(=O)O)C(F)F Amb33620436 [0,1,0,0,0,0|2,0,0]=3 876 B8R0.23 C\C(=C/C(=O)O)C(N)=O Amb28350555 [0,1,0,0,0,0|2,0,1]=4 877 B8R0.23 C\C(=C/C(C)C)C(=O)O Amb18642616 [0,1,0,0,0,0|0,0,0]=1 878 B8R0.23 C\C(=C/C(C)C)C(N)=O Amb27807446 [0,1,0,0,0,0|1,0,0]=2 879 B8R0.23 C\C(=C/C(C)C)[N+](=O)[O-] Amb28364859 [0,1,0,0,0,0|1,0,1]=3 880 B8R0.23 C\C(=C/C(N)=O)C(=O)O Amb28060883 [0,1,0,0,0,0|2,0,1]=4 881 B8R0.23 C\C(=C/C(N)=O)C(C)C Amb27468615 [0,1,0,0,0,0|1,0,0]=2 882 B8R0.23 C\C(=C/S(C)=O)N(C)C Amb27191743 [0,1,0,0,0,0|3,0,0]=4 883 B8R0.23 C\C(=C/[N+](=O)[O-])C(=O)O Amb27201518 [0,1,0,0,0,0|3,0,0]=4 884 B8R0.23 C\C(=C\C(=O)O)C(=O)O Amb8391132 [0,1,0,0,0,0|2,0,1]=4 885 B8R0.23 C\C(=C\C(C)C)C(C)Br Amb27877814 [0,1,0,0,0,0|2,0,1]=4 886 B8R0.23 C\C(=C\C(C)C)C(C)N Amb27167945 [0,1,0,0,0,0|2,0,1]=4 887 B8R0.23 C\C(=C\C(C)C)C(C)O Amb27488746 [0,1,0,0,0,0|1,0,1]=3 888 B8R0.23 C\C(=C\C(C)C)C(N)=O Amb28350432 [0,1,0,0,0,0|1,0,0]=2 889 B8R0.23 C\C(=C\C(C)N)C(=O)O Amb25731207 [0,1,0,0,0,0|1,0,0]=2 890 B8R0.23 C\C(=C\[N+](=O)[O-])N(C)C Amb28430270 [0,1,0,0,0,0|2,0,1]=4 891 B8R0.23 C\C(=N/S(C)=O)C(C)C Amb29858795 [0,1,0,0,0,0|3,0,0]=4 892 B8R0.23 C\C(Cl)=C/C(=O)C(C)C Amb28144120 [0,1,0,0,0,0|2,0,0]=3 893 B8R0.23 C\C(Cl)=C/C(C)C(=O)O Amb28285105 [0,1,0,0,0,0|1,0,2]=4 894 B8R0.23 C\C(Cl)=C/C(Cl)C(=O)O Amb28128482 [0,1,0,0,0,0|1,0,2]=4 895 B8R0.23 NC(=O)\C(N)=C\C(=O)O Amb28046027 [0,1,0,0,0,0|2,0,1]=4 896 B8R0.23 NC(=O)\C=C(/Cl)C(=O)O Amb27815058 [0,1,0,0,0,0|2,0,1]=4 897 B8R0.23 NC(=O)\C=C(\F)C(=O)O Amb27447226 [0,1,0,0,0,0|2,0,1]=4 898 B8R0.23 N\C(=C/C(=O)O)C(F)F Amb27607399 [0,1,0,0,0,0|2,0,0]=3 899 B8R0.23 O=C(O)C(=O)CC(F)F Amb33337766 [0,1,0,0,0,0|2,0,1]=4 900 B8R0.23 O=C(O)\C=C(/Br)C(=O)O Amb31275762 [0,1,0,0,0,0|2,0,1]=4 901 B8R0.23 O=C(O)\C=C(/Cl)C(=O)O Amb4007497 [0,1,0,0,0,0|2,0,1]=4 902 B8R0.23 O=C(O)\C=C(/F)C(=O)O Amb26860064 [0,1,0,0,0,0|2,0,1]=4 903 B8R0.23 O=C(O)\C=C(/I)C(=O)O Amb10755055 [0,1,0,0,0,0|2,0,1]=4 904 B8R0.23 O=C(O)\C=C(\Br)C(=O)O Amb25746120 [0,1,0,0,0,0|2,0,1]=4 905 B8R0.23 O=C(O)\C=C(\F)C(=O)O Amb18124397 [0,1,0,0,0,0|2,0,1]=4 906 B8R0.29 C=C(C)\C=N\C(C)(C)C Amb27491647 [0,1,0,0,0,0|3,0,0]=4 907 B8R0.29 CC(=O)CCC(C)(C)C Amb27481983 [0,1,0,0,0,0|1,0,2]=4 908 B8R0.29 CC(=O)CCC(C)(C)Cl Amb27260509 [0,1,0,0,0,0|1,0,2]=4 909 B8R0.29 CC(=O)CCC(C)(C)F Amb26512496 [0,1,0,0,0,0|1,0,2]=4 910 B8R0.29 CC(=O)CCC(C)(C)O Amb26961451 [0,1,0,0,0,0|1,0,2]=4 911 B8R0.29 CC(=O)CNC(C)(C)C Amb1091895 [0,1,0,0,0,0|2,0,1]=4 912 B8R0.29 CC(=O)COC(C)(C)C Amb9666858 [0,1,0,0,0,0|2,0,1]=4 913 B8R0.29 CC(=O)CSC(C)(C)C Amb4165959 [0,1,0,0,0,0|2,0,1]=4 914 B8R0.29 CC(=O)NCC(C)(C)N Amb18642812 [0,1,0,0,0,0|2,0,1]=4 915 B8R0.29 CC(=O)NCC(C)(C)O Amb25082896 [0,1,0,0,0,0|2,0,1]=4 916 B8R0.29 CC(=O)NCC(C)(C)S Amb27489471 [0,1,0,0,0,0|2,0,1]=4 917 B8R0.29 CC(=O)OCC(C)(C)Br Amb33276495 [0,1,0,0,0,0|2,0,1]=4 918 B8R0.29 CC(=O)ONC(C)(C)C Amb22263962 [0,1,0,0,0,0|3,0,0]=4 919 B8R0.29 CC(=O)SCC(C)(C)C Amb26932052 [0,1,0,0,0,0|2,0,1]=4 920 B8R0.29 CC(=O)SCC(C)(C)O Amb27397144 [0,1,0,0,0,0|2,0,1]=4 921 B8R0.29 CC(=O)\C=C/C(C)(C)C Amb28202021 [0,1,0,0,0,0|1,0,0]=2 922 B8R0.29 CC(=O)\C=C/C(F)(F)F Amb25349180 [0,1,0,0,0,0|3,0,0]=4 923 B8R0.29 CC(=O)\C=C/[Si](C)(C)C Amb27762902 [0,1,0,0,0,0|1,1,0]=3 924 B8R0.29 CC(=O)\C=C\C(C)(C)C Amb26512040 [0,1,0,0,0,0|1,0,0]=2 925 B8R0.29 CC(=O)\C=C\C(C)(C)F Amb33271799 [0,1,0,0,0,0|1,0,0]=2 926 B8R0.29 CC(=O)\C=C\C(C)(F)F Amb32810163 [0,1,0,0,0,0|2,0,0]=3 927 B8R0.29 CC(=O)\C=C\C(Cl)(Cl)Cl Amb6739925 [0,1,0,0,0,0|3,0,0]=4 928 B8R0.29 CC(=O)\C=C\C(F)(F)F Amb26946375 [0,1,0,0,0,0|3,0,0]=4 929 B8R0.29 CC(=O)\C=C\[Si](C)(C)F Amb26413317 [0,1,0,0,0,0|1,1,0]=3 930 B8R0.29 CC(=O)\C=C\[Si](C)(C)O Amb26515836 [0,1,0,0,0,0|1,1,0]=3 931 B8R0.29 CC(=O)\C=N/C(C)(C)C Amb28193333 [0,1,0,0,0,0|2,0,0]=3 932 B8R0.29 CC(C)(Br)CCC(=O)O Amb27402242 [0,1,0,0,0,0|0,0,2]=3 933 B8R0.29 CC(C)(C)C#CC(=O)O Amb33545064 [0,1,0,0,0,0|0,0,2]=3 934 B8R0.29 CC(C)(C)CCC(=O)Cl Amb25105178 [0,1,0,0,0,0|1,0,2]=4 935 B8R0.29 CC(C)(C)CCC(=O)O Amb8467936 [0,1,0,0,0,0|0,0,2]=3 936 B8R0.29 CC(C)(C)CCC(N)=O Amb28349074 [0,1,0,0,0,0|1,0,2]=4 937 B8R0.29 CC(C)(C)CNC(=O)Cl Amb35625636 [0,1,0,0,0,0|2,0,1]=4 938 B8R0.29 CC(C)(C)CNC(N)=O Amb20623709 [0,1,0,0,0,0|2,0,1]=4 939 B8R0.29 CC(C)(C)COC(=O)Cl Amb10844667 [0,1,0,0,0,0|2,0,1]=4 940 B8R0.29 CC(C)(C)COC(=O)F Amb27238052 [0,1,0,0,0,0|2,0,1]=4 941 B8R0.29 CC(C)(C)NCC(=O)Cl Amb22739730 [0,1,0,0,0,0|2,0,1]=4 942 B8R0.29 CC(C)(C)NCC(=O)Cl Amb26459118 [0,1,0,0,0,0|2,0,1]=4 943 B8R0.29 CC(C)(C)NCC(=O)O Amb10610332 [0,1,0,0,0,0|1,0,1]=3 944 B8R0.29 CC(C)(C)NCC(=O)O Amb7766549 [0,1,0,0,0,0|1,0,1]=3 945 B8R0.29 CC(C)(C)NCC(N)=O Amb6714542 [0,1,0,0,0,0|2,0,1]=4 946 B8R0.29 CC(C)(C)OCC(=O)Cl Amb33552858 [0,1,0,0,0,0|2,0,1]=4 947 B8R0.29 CC(C)(C)OCC(=O)O Amb2691328 [0,1,0,0,0,0|1,0,1]=3 948 B8R0.29 CC(C)(C)OCC(N)=O Amb22228918 [0,1,0,0,0,0|2,0,1]=4 949 B8R0.29 CC(C)(C)SCC(=O)O Amb433078 [0,1,0,0,0,0|1,0,1]=3 950 B8R0.29 CC(C)(C)[NH2+]CC(=O)O Amb2695316 [0,1,0,0,0,0|1,0,1]=3 951 B8R0.29 CC(C)(C)\C=C\B(O)O Amb2455982 [0,1,0,0,0,0|1,0,1]=3 952 B8R0.29 CC(C)(C)\C=C\C(=O)O Amb30585155 [0,1,0,0,0,0|0,0,0]=1 953 B8R0.29 CC(C)(C)\C=C\[N+](=O)[O-] Amb20623007 [0,1,0,0,0,0|1,0,1]=3 954 B8R0.29 CC(C)(Cl)CCC(=O)O Amb18644451 [0,1,0,0,0,0|0,0,2]=3 955 B8R0.29 CC(C)(F)CCC(=O)O Amb26316862 [0,1,0,0,0,0|0,0,2]=3 956 B8R0.29 CC(C)(F)OCC(=O)O Amb33225288 [0,1,0,0,0,0|1,0,1]=3 957 B8R0.29 CC(C)(F)\C=C\C(=O)O Amb33272218 [0,1,0,0,0,0|0,0,0]=1 958 B8R0.29 CC(C)(F)\C=C\[N+](=O)[O-] Amb33271832 [0,1,0,0,0,0|1,0,1]=3 959 B8R0.29 CC(C)(N)CC=C(Cl)Cl Amb35654333 [0,1,0,0,0,0|2,0,1]=4 960 B8R0.29 CC(C)(N)CCC(=O)O Amb13951332 [0,1,0,0,0,0|0,0,2]=3 961 B8R0.29 CC(C)(N)CCC(=O)O Amb6740013 [0,1,0,0,0,0|0,0,2]=3 962 B8R0.29 CC(C)(N)CNC(N)=O Amb8631174 [0,1,0,0,0,0|2,0,1]=4 963 B8R0.29 CC(C)(N)CNC(N)=O Amb8631175 [0,1,0,0,0,0|2,0,1]=4 964 B8R0.29 CC(C)(N)\C=C\C(=O)O Amb26640960 [0,1,0,0,0,0|0,0,0]=1 965 B8R0.29 CC(C)(O)C#CC(=O)O Amb6364820 [0,1,0,0,0,0|0,0,2]=3 966 B8R0.29 CC(C)(O)CCC(=O)[O-] Amb33552947 [0,1,0,0,0,0|0,0,3]=4 967 B8R0.29 CC(C)(O)CCC(N)=O Amb27667598 [0,1,0,0,0,0|1,0,2]=4 968 B8R0.29 CC(C)(O)CNC(N)=O Amb27175271 [0,1,0,0,0,0|2,0,1]=4 969 B8R0.29 CC(C)(O)\C=C\B(O)O Amb25141129 [0,1,0,0,0,0|1,0,1]=3 970 B8R0.29 CC(C)(S)CCC(=O)O Amb22489759 [0,1,0,0,0,0|0,0,2]=3 971 B8R0.29 CC(C)CCS(=O)(=O)O Amb26996755 [0,1,0,0,0,0|1,0,2]=4 972 B8R0.29 CC(C)COP(=O)(O)O Amb25264732 [0,1,0,0,0,0|2,0,1]=4 973 B8R0.29 CC(C)NCS(=O)(=O)O Amb27409883 [0,1,0,0,0,0|2,0,1]=4 974 B8R0.29 CC(Cl)\C=C\C(C)(C)C Amb26921127 [0,1,0,0,0,0|2,0,1]=4 975 B8R0.29 CC(F)(F)CCC(=O)O Amb6252611 [0,1,0,0,0,0|1,0,2]=4 976 B8R0.29 CC(F)(F)OCC(=O)O Amb32809085 [0,1,0,0,0,0|2,0,1]=4 977 B8R0.29 CC(F)(F)\C=C\C(=O)O Amb22295928 [0,1,0,0,0,0|1,0,0]=2 978 B8R0.29 CC(F)(F)\C=C\[N+](=O)[O-] Amb32808579 [0,1,0,0,0,0|2,0,1]=4 979 B8R0.29 CC(N)\C=C\C(C)(C)C Amb27620263 [0,1,0,0,0,0|2,0,1]=4 980 B8R0.29 CC(N)\C=C\C(C)(C)F Amb33271139 [0,1,0,0,0,0|2,0,1]=4 981 B8R0.29 CC(N)\C=C\S(=O)(=O)O Amb27408424 [0,1,0,0,0,0|2,0,0]=3 982 B8R0.29 CS(=O)(=O)\C=C\C(=O)O Amb23511152 [0,1,0,0,0,0|2,0,0]=3 983 B8R0.29 CS(=O)(=O)\C=C\C(N)=O Amb26597337 [0,1,0,0,0,0|3,0,0]=4 984 B8R0.29 CS(=O)\N=C\C(C)(C)C Amb35685215 [0,1,0,0,0,0|3,0,0]=4 985 B8R0.29 CS(C)(=O)=NCC(=O)O Amb27159666 [0,1,0,0,0,0|2,0,1]=4 986 B8R0.29 C[C@@H](O)\C=C\[Si](C)(C)C Amb28045605 [0,1,0,0,0,0|1,1,1]=4 987 B8R0.29 C[C@H](N)\C=C\S(N)(=O)=O Amb27792170 [0,1,0,0,0,0|2,0,1]=4 988 B8R0.29 C[C@H](O)\C=C\[Si](C)(C)C Amb27780522 [0,1,0,0,0,0|1,1,1]=4 989 B8R0.29 C[N+](C)(C)CCC(=O)O Amb24117222 [0,1,0,0,0,0|1,0,2]=4 990 B8R0.29 C[N+](C)(C)CCC(=O)O Amb33803200 [0,1,0,0,0,0|1,0,2]=4 991 B8R0.29 C[N+](C)(C)\C=C\C(=O)[O-] Amb26944755 [0,1,0,0,0,0|1,0,1]=3 992 B8R0.29 C[N+](C)(N)CCC(=O)O Amb27878681 [0,1,0,0,0,0|1,0,2]=4 993 B8R0.29 C[Si](C)(C)C#CC(=O)O Amb2721672 [0,1,0,0,0,0|0,1,2]=4 994 B8R0.29 NC(=O)\C=C/C(F)(F)F Amb26655464 [0,1,0,0,0,0|3,0,0]=4 995 B8R0.29 NC(=O)\C=C\C(F)(F)F Amb2690786 [0,1,0,0,0,0|3,0,0]=4 996 B8R0.29 O=C(Cl)\C=C\C(F)(F)F Amb22388449 [0,1,0,0,0,0|3,0,0]=4 997 B8R0.29 O=C(O)\C=C\C(F)(F)Br Amb10838817 [0,1,0,0,0,0|2,0,0]=3 998 B8R0.29 O=C(O)\C=C\C(F)(F)F Amb34063927 [0,1,0,0,0,0|2,0,0]=3 999 B8R0.29 O=C(O)\C=C\P(=O)(O)O Amb25242468 [0,1,0,0,0,0|3,0,0]=4 1000 B8R0.29 O=C(O)\C=C\S(=O)(=O)Cl Amb25250579 [0,1,0,0,0,0|3,0,0]=4 1001 B8R1.3 CC1=CCC(=O)CC1 Amb17617292 [0,0,0,1,0,0|1,0,2]=4 1002 B8R1.3 CC1=CCC(C)CC1 Amb26354597 [0,0,0,1,0,0|2,0,1]=4 1003 B8R1.3 CC1=CNC(=O)C=C1 Amb18039971 [0,0,0,1,0,0|1,0,2]=4 1004 B8R1.3 CC1=COC(=O)C=C1 Amb27595539 [0,0,0,1,0,0|0,0,2]=3 1005 B8R1.3 CC1=NNC(=O)C=C1 Amb18372841 [0,0,0,1,0,0|2,0,1]=4 1006 B8R1.3 CC1=NNC(=O)C=C1 Amb19373006 [0,0,0,1,0,0|2,0,1]=4 1007 B8R1.3 CC1=NNC(=O)C=C1 Amb19894726 [0,0,0,1,0,0|2,0,1]=4 1008 B8R1.3 CC1C=CC(=N)NC1 Amb25366457 [0,0,0,1,0,0|2,0,0]=3 1009 B8R1.3 CC1C=CC(=O)CC1 Amb24556470 [0,0,0,1,0,0|1,0,0]=2 1010 B8R1.3 CC1C=CC(C)NC1 Amb27839527 [0,0,0,1,0,0|2,0,1]=4 1011 B8R1.3 CC1CC=C(Cl)CC1 Amb27783557 [0,0,0,1,0,0|2,0,1]=4 1012 B8R1.3 CC1CCC(=O)CC1 Amb6608654 [0,0,0,1,0,0|1,0,2]=4 1013 B8R1.3 CC1CCC(=O)CN1 Amb26979747 [0,0,0,1,0,0|2,0,1]=4 1014 B8R1.3 CC1CCC(=O)CN1 Amb32686523 [0,0,0,1,0,0|2,0,1]=4 1015 B8R1.3 CC1CCC(=O)CO1 Amb22491005 [0,0,0,1,0,0|2,0,1]=4 1016 B8R1.3 CC1CCC(=O)CS1 Amb23568547 [0,0,0,1,0,0|2,0,1]=4 1017 B8R1.3 CC1CCC(=O)NC1 Amb13952062 [0,0,0,1,0,0|1,0,2]=4 1018 B8R1.3 CC1CCC(=O)NN1 Amb27443930 [0,0,0,1,0,0|3,0,0]=4 1019 B8R1.3 CC1CCC(=O)OC1 Amb27667524 [0,0,0,1,0,0|0,0,2]=3 1020 B8R1.3 CC1CN=C(O)NC1 Amb25268854 [0,0,0,1,0,0|2,0,1]=4 1021 B8R1.3 CC1CNC(=O)CN1 Amb18833035 [0,0,0,1,0,0|2,0,1]=4 1022 B8R1.3 CC1CNC(=O)CN1 Amb34912937 [0,0,0,1,0,0|2,0,1]=4 1023 B8R1.3 CC1CNC(=O)CO1 Amb22371080 [0,0,0,1,0,0|2,0,1]=4 1024 B8R1.3 CC1COS(=O)OC1 Amb27785765 [0,0,0,1,0,0|2,0,1]=4 1025 B8R1.3 CN1C=CC(=O)CC1 Amb17593148 [0,0,0,1,0,0|2,0,0]=3 1026 B8R1.3 CN1C=CC(N)=CC1 Amb25113880 [0,0,0,1,0,0|3,0,0]=4 1027 B8R1.3 C[C@@H]1C=CC(=O)CC1 Amb28144188 [0,0,0,1,0,0|1,0,0]=2 1028 B8R1.3 C[C@@H]1C=C[C@@H](Cl)CC1 Amb27853647 [0,0,0,1,0,0|2,0,1]=4 1029 B8R1.3 C[C@@H]1CCC(=O)CN1 Amb24481509 [0,0,0,1,0,0|2,0,1]=4 1030 B8R1.3 C[C@@H]1CCC(=O)OC1 Amb26004046 [0,0,0,1,0,0|0,0,2]=3 1031 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22411475 [0,0,0,1,0,0|2,0,1]=4 1032 B8R1.3 C[C@@H]1CNC(=O)CN1 Amb22587592 [0,0,0,1,0,0|2,0,1]=4 1033 B8R1.3 C[C@@H]1CNC(=O)CO1 Amb27470503 [0,0,0,1,0,0|2,0,1]=4 1034 B8R1.3 C[C@H]1C=C[C@@H](O)CC1 Amb27186928 [0,0,0,1,0,0|1,0,1]=3 1035 B8R1.3 C[C@H]1CCC(=O)NC1 Amb27838374 [0,0,0,1,0,0|1,0,2]=4 1036 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22411525 [0,0,0,1,0,0|2,0,1]=4 1037 B8R1.3 C[C@H]1CNC(=O)CN1 Amb22586634 [0,0,0,1,0,0|2,0,1]=4 1038 B8R1.3 C[C@H]1CNC(=O)CO1 Amb24589385 [0,0,0,1,0,0|2,0,1]=4 1039 B8R1.3 Cc1ccc(O)cc1 Amb2793057 [0,0,0,1,0,0|1,0,2]=4 1040 B8R1.3 Cc1ccc(O)cn1 Amb2609944 [0,0,0,1,0,0|2,0,1]=4 1041 B8R1.3 Cc1ccc(O)nc1 Amb2722524 [0,0,0,1,0,0|1,0,2]=4 1042 B8R1.3 Cc1ccc(O)nc1 Amb35826776 [0,0,0,1,0,0|1,0,2]=4 1043 B8R1.3 Cc1ccc(O)nn1 Amb2794468 [0,0,0,1,0,0|2,0,1]=4 1044 B8R1.3 O=C1C=CC(Cl)=CO1 Amb20247269 [0,0,0,1,0,0|1,0,2]=4 1045 B8R1.3 O=C1C=CC(F)C=C1 Amb28124983 [0,0,0,1,0,0|2,0,1]=4 1046 B8R1.3 O=C1C=CC(I)=CO1 Amb20247268 [0,0,0,1,0,0|1,0,2]=4 1047 B8R1.3 O=C1C=CC(O)CC1 Amb28048996 [0,0,0,1,0,0|2,0,0]=3 1048 B8R1.3 O=C1C=CC(O)OC1 Amb17593180 [0,0,0,1,0,0|3,0,0]=4 1049 B8R1.3 O=C1C=CS(=O)CC1 Amb27948688 [0,0,0,1,0,0|3,0,0]=4 1050 B8R1.3 O=C1CCC(O)CO1 Amb26345105 [0,0,0,1,0,0|1,0,2]=4 1051 B8R1.3 O=C1NCC(O)CO1 Amb27210928 [0,0,0,1,0,0|2,0,1]=4 1052 B8R1.3 O=c1ccc(Br)co1 Amb22231971 [0,0,0,1,0,0|1,0,2]=4 1053 B8R1.3 OC1C=CC(O)CC1 Amb26492877 [0,0,0,1,0,0|2,0,1]=4 1054 B8R1.3 O[C@H]1C=C[C@H](Cl)CC1 Amb27444700 [0,0,0,1,0,0|2,0,1]=4 1055 B8R1.20 CC(=O)CC1CC1C Amb26916692 [0,0,0,1,0,0|1,0,2]=4 1056 B8R1.20 CC(=O)C[C@H]1C[C@H]1C Amb28121459 [0,0,0,1,0,0|1,0,2]=4 1057 B8R1.20 CC1CC1CC(=O)O Amb25316515 [0,0,0,1,0,0|0,0,2]=3 1058 B8R1.20 CC1CC1NC(=O)Cl Amb35625773 [0,0,0,1,0,0|2,0,1]=4 1059 B8R1.20 CC1C\C1=C/C(=O)O Amb25256441 [0,0,0,1,0,0|0,0,0]=1 1060 B8R1.20 C[C@@H]1C[C@H]1CC(=O)O Amb28058267 [0,0,0,1,0,0|0,0,2]=3 1061 B8R1.20 C[C@@H]1C[C@H]1NC(N)=O Amb28059830 [0,0,0,1,0,0|2,0,1]=4 1062 B8R1.20 NC1CC1CC(=O)O Amb27201670 [0,0,0,1,0,0|1,0,2]=4 1063 B8R1.20 N[C@@H]1C[C@H]1CC(=O)O Amb27252154 [0,0,0,1,0,0|1,0,2]=4 1064 B8R1.20 O=C(O)CC1CC1O Amb27981662 [0,0,0,1,0,0|1,0,2]=4 1065 B8R1.23 CC(=O)C1=CC(C)C1 Amb27802162 [0,0,0,1,0,0|1,0,0]=2 1066 B8R1.23 CC(=O)C1C=C(C)C1 Amb24676939 [0,0,0,1,0,0|1,0,2]=4 1067 B8R1.23 CC(=O)C1CC(C)C1 Amb23590280 [0,0,0,1,0,0|1,0,2]=4 1068 B8R1.23 CC(=O)[C@H]1C[C@@H](C)C1 Amb28253646 [0,0,0,1,0,0|1,0,2]=4 1069 B8R1.23 CC(C)C1=CC(=O)C1 Amb27948687 [0,0,0,1,0,0|1,0,0]=2 1070 B8R1.23 CC(C)C1CC(=O)C1 Amb25806486 [0,0,0,1,0,0|1,0,2]=4 1071 B8R1.23 CC(C)C1CC(=O)N1 Amb26450589 [0,0,0,1,0,0|1,0,2]=4 1072 B8R1.23 CC(C)[C@@H]1CC(=O)N1 Amb28363876 [0,0,0,1,0,0|1,0,2]=4 1073 B8R1.23 CC(Cl)C1CC(=O)O1 Amb27878702 [0,0,0,1,0,0|1,0,2]=4 1074 B8R1.23 CC1CC(C(=O)O)C1 Amb19515989 [0,0,0,1,0,0|0,0,2]=3 1075 B8R1.23 CC1CC(C(=O)O)N1 Amb27816510 [0,0,0,1,0,0|1,0,1]=3 1076 B8R1.23 CC1CC(C(=O)O)N1 Amb33482923 [0,0,0,1,0,0|1,0,1]=3 1077 B8R1.23 CC1CC(C(N)=O)C1 Amb27954948 [0,0,0,1,0,0|1,0,2]=4 1078 B8R1.23 CC1CN(C(=O)Cl)C1 Amb35667757 [0,0,0,1,0,0|2,0,1]=4 1079 B8R1.23 CC1CN(C(N)=O)C1 Amb30039472 [0,0,0,1,0,0|2,0,1]=4 1080 B8R1.23 CN1CC(C(=O)O)C1 Amb19958116 [0,0,0,1,0,0|1,0,2]=4 1081 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483898 [0,0,0,1,0,0|1,0,1]=3 1082 B8R1.23 C[C@@H]1C[C@@H](C(=O)O)N1 Amb33483920 [0,0,0,1,0,0|1,0,1]=3 1083 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483819 [0,0,0,1,0,0|1,0,1]=3 1084 B8R1.23 C[C@@H]1C[C@H](C(=O)O)N1 Amb33483820 [0,0,0,1,0,0|1,0,1]=3 1085 B8R1.23 C[C@H]1C[C@@H](C(=O)O)C1 Amb22746374 [0,0,0,1,0,0|0,0,2]=3 1086 B8R1.23 C[C@H]1C[C@H](C(=O)O)C1 Amb22746375 [0,0,0,1,0,0|0,0,2]=3 1087 B8R1.23 NC1CC(C(=O)O)C1 Amb10610660 [0,0,0,1,0,0|1,0,2]=4 1088 B8R1.23 NC1CC(C(=O)O)C1 Amb33533143 [0,0,0,1,0,0|1,0,2]=4 1089 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb10604131 [0,0,0,1,0,0|1,0,2]=4 1090 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 Amb6893769 [0,0,0,1,0,0|1,0,2]=4 1091 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb19514893 [0,0,0,1,0,0|1,0,2]=4 1092 B8R1.23 N[C@H]1C[C@H](C(=O)O)C1 Amb33524058 [0,0,0,1,0,0|1,0,2]=4 1093 B8R1.23 O=C(O)C1CC(Br)C1 Amb25889305 [0,0,0,1,0,0|1,0,2]=4 1094 B8R1.23 O=C(O)C1CC(Cl)C1 Amb16233600 [0,0,0,1,0,0|1,0,2]=4 1095 B8R1.23 O=C(O)C1CC(F)C1 Amb20621267 [0,0,0,1,0,0|1,0,2]=4 1096 B8R1.23 O=C(O)C1CC(O)C1 Amb8011535 [0,0,0,1,0,0|1,0,2]=4 1097 B8R1.23 O=C(O)[C@H]1C[C@@H](Br)C1 Amb35751665 [0,0,0,1,0,0|1,0,2]=4 1098 B8R1.23 O=C(O)[C@H]1C[C@@H](Cl)C1 Amb28119343 [0,0,0,1,0,0|1,0,2]=4 1099 B8R1.23 O=C(O)[C@H]1C[C@@H](F)C1 Amb27974528 [0,0,0,1,0,0|1,0,2]=4 1100 B8R1.23 O=C(O)[C@H]1C[C@@H](O)C1 Amb19516179 [0,0,0,1,0,0|1,0,2]=4 1101 B8R1.23 O=C(O)[C@H]1C[C@H](Br)C1 Amb24339433 [0,0,0,1,0,0|1,0,2]=4 1102 B8R1.23 O=C(O)[C@H]1C[C@H](Cl)C1 Amb25883786 [0,0,0,1,0,0|1,0,2]=4 1103 B8R1.23 O=C(O)[C@H]1C[C@H](F)C1 Amb27883529 [0,0,0,1,0,0|1,0,2]=4 1104 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 Amb19516178 [0,0,0,1,0,0|1,0,2]=4 1105 B8R1.35 CC(=O)CCC1CC1 Amb25305448 [0,0,0,1,0,0|1,0,2]=4 1106 B8R1.35 CC(=O)CNC1CC1 Amb27831542 [0,0,0,1,0,0|2,0,1]=4 1107 B8R1.35 CC(=O)NCC1CC1 Amb2782861 [0,0,0,1,0,0|2,0,1]=4 1108 B8R1.35 CC(=O)\C=C\C1CC1 Amb32955627 [0,0,0,1,0,0|1,0,0]=2 1109 B8R1.35 CC(N)\C=C\C1CC1 Amb28069413 [0,0,0,1,0,0|2,0,1]=4 1110 B8R1.35 CC(O)\C=C\C1CC1 Amb27406054 [0,0,0,1,0,0|1,0,1]=3 1111 B8R1.35 CS(=O)\N=C\C1CC1 Amb35685198 [0,0,0,1,0,0|3,0,0]=4 1112 B8R1.35 NC(=O)CCC1CC1 Amb28066625 [0,0,0,1,0,0|1,0,2]=4 1113 B8R1.35 NC(=O)CNC1CC1 Amb18368582 [0,0,0,1,0,0|2,0,1]=4 1114 B8R1.35 NC(=O)CNC1CC1 Amb6246049 [0,0,0,1,0,0|2,0,1]=4 1115 B8R1.35 NC(=O)NCC1CC1 Amb1138798 [0,0,0,1,0,0|2,0,1]=4 1116 B8R1.35 NC(=O)OCC1CC1 Amb27668381 [0,0,0,1,0,0|2,0,1]=4 1117 B8R1.35 NC(=O)\C=C/C1CC1 Amb27422387 [0,0,0,1,0,0|1,0,0]=2 1118 B8R1.35 O=C(Cl)CCC1CC1 Amb25337452 [0,0,0,1,0,0|1,0,2]=4 1119 B8R1.35 O=C(Cl)NCC1CC1 Amb27410108 [0,0,0,1,0,0|2,0,1]=4 1120 B8R1.35 O=C(Cl)OCC1CC1 Amb33528888 [0,0,0,1,0,0|2,0,1]=4 1121 B8R1.35 O=C(O)C#CC1CC1 Amb1036650 [0,0,0,1,0,0|0,0,2]=3 1122 B8R1.35 O=C(O)CCC1CC1 Amb2686667 [0,0,0,1,0,0|0,0,2]=3 1123 B8R1.35 O=C(O)CCC1CO1 Amb27667995 [0,0,0,1,0,0|1,0,2]=4 1124 B8R1.35 O=C(O)CNC1CC1 Amb7766401 [0,0,0,1,0,0|1,0,1]=3 1125 B8R1.35 O=C(O)CNC1CC1 Amb9677481 [0,0,0,1,0,0|1,0,1]=3 1126 B8R1.35 O=C(O)COC1CC1 Amb27214838 [0,0,0,1,0,0|1,0,1]=3 1127 B8R1.35 O=C(O)CSC1CC1 Amb6760620 [0,0,0,1,0,0|1,0,1]=3 1128 B8R1.35 O=C(O)\C=C/C1CC1 Amb28247513 [0,0,0,1,0,0|0,0,0]=1 1129 B8R1.35 O=C(O)\C=C\C1CC1 Amb18285135 [0,0,0,1,0,0|0,0,0]=1 1130 B8R1.35 O=C(O)\C=C\C1CC1 Amb33714766 [0,0,0,1,0,0|0,0,0]=1 1131 B8R1.35 O=C(O)\C=C\C1CO1 Amb24548089 [0,0,0,1,0,0|1,0,0]=2 1132 B8R1.35 O=[N+]([O-])\C=C\C1CC1 Amb26515752 [0,0,0,1,0,0|1,0,1]=3 1133 B8R1.35 OB(O)\C=C\C1CC1 Amb32653367 [0,0,0,1,0,0|1,0,1]=3 1134 B8R1.51 CC1(C)C=CC(=O)C1 Amb15693471 [0,0,0,1,0,0|1,0,0]=2 1135 B8R1.51 CC1(C)C=CC(Br)=C1 Amb25924321 [0,0,0,1,0,0|2,0,0]=3 1136 B8R1.51 CC1(C)C=CC(O)O1 Amb28138642 [0,0,0,1,0,0|0,0,2]=3 1137 B8R1.51 CC1(C)CC(=O)CN1 Amb24460323 [0,0,0,1,0,0|2,0,1]=4 1138 B8R1.51 CC1(C)CC(=O)CN1 Amb32693438 [0,0,0,1,0,0|2,0,1]=4 1139 B8R1.51 CC1(C)CC(=O)CO1 Amb24083194 [0,0,0,1,0,0|2,0,1]=4 1140 B8R1.51 CC1(C)CC(=O)NN1 Amb22289371 [0,0,0,1,0,0|3,0,0]=4 1141 B8R1.51 CC1(C)CC(=O)NO1 Amb26895186 [0,0,0,1,0,0|3,0,0]=4 1142 B8R1.51 CC1(C)CC=C(Br)C1 Amb28315141 [0,0,0,1,0,0|2,0,1]=4 1143 B8R1.51 CC1(C)CCC(=O)C1 Amb19516867 [0,0,0,1,0,0|1,0,2]=4 1144 B8R1.51 CC1(C)CCC(=O)N1 Amb9173662 [0,0,0,1,0,0|1,0,2]=4 1145 B8R1.51 CC1(C)CCC(=O)O1 Amb8631207 [0,0,0,1,0,0|0,0,2]=3 1146 B8R1.51 CC1(C)CN=C(N)O1 Amb25720624 [0,0,0,1,0,0|2,0,1]=4 1147 B8R1.51 CC1(C)CNC(=O)C1 Amb6752004 [0,0,0,1,0,0|2,0,1]=4 1148 B8R1.51 CC1(C)CNC(=O)N1 Amb4022598 [0,0,0,1,0,0|2,0,1]=4 1149 B8R1.51 CC1(C)CNC(=O)O1 Amb16202554 [0,0,0,1,0,0|1,0,1]=3 1150 B8R1.51 CC1(C)CNC(=O)S1 Amb27655652 [0,0,0,1,0,0|1,1,1]=4 1151 B8R1.51 CC1(C)CNC(=S)O1 Amb27838912 [0,0,0,1,0,0|1,1,1]=4 1152 B8R1.51 CC1(C)COC(=O)C1 Amb22284870 [0,0,0,1,0,0|2,0,1]=4 1153 B8R1.51 CC1(C)COC(=O)N1 Amb19516997 [0,0,0,1,0,0|2,0,1]=4 1154 B8R1.51 CC1(C)COC(=O)O1 Amb24404748 [0,0,0,1,0,0|1,0,1]=3 1155 B8R1.51 CC1(C)CSC(=O)N1 Amb27173093 [0,0,0,1,0,0|2,0,1]=4 1156 B8R1.51 CC1(C)N=CC(N)=N1 Amb27595104 [0,0,0,1,0,0|3,0,0]=4 1157 B8R1.51 CC1(C)NCC(=N)O1 Amb27838287 [0,0,0,1,0,0|2,0,1]=4 1158 B8R1.51 CC1(C)NCC(=O)N1 Amb27770341 [0,0,0,1,0,0|2,0,1]=4 1159 B8R1.51 CC1(C)NCC(=O)O1 Amb27969182 [0,0,0,1,0,0|1,0,1]=3 1160 B8R1.51 CC1(C)OCC(=O)O1 Amb10601611 [0,0,0,1,0,0|1,0,1]=3 1161 B8R1.51 CC1(F)CCC(=O)O1 Amb27597762 [0,0,0,1,0,0|1,0,2]=4 1162 B8R1.51 CC1(F)COC(=O)O1 Amb27420932 [0,0,0,1,0,0|2,0,1]=4 1163 B8R1.51 CC1(O)C=CC(=O)C1 Amb28316243 [0,0,0,1,0,0|2,0,0]=3 1164 B8R1.51 CC1(O)C=CC(=O)O1 Amb26551626 [0,0,0,1,0,0|1,0,0]=2 1165 B8R1.51 CC1(O)C=CC(O)O1 Amb27397334 [0,0,0,1,0,0|1,0,2]=4 1166 B8R1.51 C[C@@]1(O)C=C[C@@H](O)C1 Amb27197628 [0,0,0,1,0,0|2,0,1]=4 1167 B8R1.51 C[C@]1(O)C=C[C@@H](O)C1 Amb27970587 [0,0,0,1,0,0|2,0,1]=4 1168 B8R1.51 C[Si]1(C)C=CC(O)C1 Amb27757222 [0,0,0,1,0,0|1,1,1]=4 1169 B8R1.51 NC1C=CS(=O)(=O)C1 Amb2370936 [0,0,0,1,0,0|2,0,1]=4 1170 B8R1.51 NC1C=CS(=O)(=O)C1 Amb410503 [0,0,0,1,0,0|2,0,1]=4 1171 B8R1.51 O=C1C=CC(Cl)(Cl)O1 Amb25758877 [0,0,0,1,0,0|2,0,0]=3 1172 B8R1.51 O=S1(=O)C=CC(Br)C1 Amb1105830 [0,0,0,1,0,0|2,0,1]=4 1173 B8R1.51 O=S1(=O)C=CC(Cl)C1 Amb1652058 [0,0,0,1,0,0|2,0,1]=4 1174 B8R1.51 O=S1(=O)C=CC(O)C1 Amb760002 [0,0,0,1,0,0|2,0,1]=4 1175 B8R1.51 [NH3+]C1C=CS(=O)(=O)C1 Amb3318763 [0,0,0,1,0,0|2,0,1]=4 1176 B8R1.51 [NH3+]C1C=CS(=O)(=O)C1 Amb5716886 [0,0,0,1,0,0|2,0,1]=4 1177 B8R1.69 CC1(C)C=CS1(=O)=O Amb28398636 [0,0,0,1,0,0|1,0,1]=3 1178 B8R1.77 CC(=O)C1CC1(C)C Amb22011884 [0,0,0,1,0,0|1,0,2]=4 1179 B8R1.77 CC(=O)C1OC1(C)C Amb4605897 [0,0,0,1,0,0|2,0,1]=4 1180 B8R1.77 CC(O)C1=CC1(C)C Amb28191917 [0,0,0,1,0,0|1,0,1]=3 1181 B8R1.77 CC1(Br)CC1C(=O)O Amb26021075 [0,0,0,1,0,0|1,0,2]=4 1182 B8R1.77 CC1(C)CC1C(=O)Cl Amb16230811 [0,0,0,1,0,0|1,0,2]=4 1183 B8R1.77 CC1(C)CC1C(=O)O Amb8385610 [0,0,0,1,0,0|0,0,2]=3 1184 B8R1.77 CC1(C)CC1C(N)=O Amb2778846 [0,0,0,1,0,0|1,0,2]=4 1185 B8R1.77 CC1(C)C[C@@H]1C(=O)O Amb8629067 [0,0,0,1,0,0|0,0,2]=3 1186 B8R1.77 CC1(C)C[C@@H]1C(N)=O Amb4166316 [0,0,0,1,0,0|1,0,2]=4 1187 B8R1.77 CC1(C)C[C@H]1C(N)=O Amb10072071 [0,0,0,1,0,0|1,0,2]=4 1188 B8R1.77 CC1(C)OC1C(=O)O Amb24481352 [0,0,0,1,0,0|1,0,1]=3 1189 B8R1.77 CC1(C)SC1C(N)=O Amb27838390 [0,0,0,1,0,0|2,0,1]=4 1190 B8R1.77 C[C@@]1(Br)C[C@@H]1C(=O)O Amb27477854 [0,0,0,1,0,0|1,0,2]=4 1191 B6R0.2 C=C(Br)CC(C)C Amb22583739 [0,0,0,0,1,0|2,0,1]=4 1192 B6R0.2 C=C(C)C=C(C)C Amb8513505 [0,0,0,0,1,0|2,0,1]=4 1193 B6R0.2 C=C(C)CC(=O)O Amb6278832 [0,0,0,0,1,0|0,0,3]=4 1194 B6R0.2 C=C(C)CC(C)C Amb4019530 [0,0,0,0,1,0|2,0,1]=4 1195 B6R0.2 CC(=O)C=C(C)C Amb2793052 [0,0,0,0,1,0|1,0,1]=3 1196 B6R0.2 CC(=O)CC(=O)O Amb377432 [0,0,0,0,1,0|1,0,2]=4 1197 B6R0.2 CC(=O)CC(C)C Amb4605990 [0,0,0,0,1,0|1,0,1]=3 1198 B6R0.2 CC(=O)CC(C)Cl Amb17593234 [0,0,0,0,1,0|2,0,1]=4 1199 B6R0.2 CC(=O)CC(C)N Amb22587050 [0,0,0,0,1,0|2,0,1]=4 1200 B6R0.2 CC(=O)CC(C)N Amb2583230 [0,0,0,0,1,0|2,0,1]=4 1201 B6R0.2 CC(=O)CC(C)O Amb17593091 [0,0,0,0,1,0|2,0,1]=4 1202 B6R0.2 CC(=O)CC(C)S Amb24600676 [0,0,0,0,1,0|2,0,1]=4 1203 B6R0.2 CC(=O)CC(C)[O-] Amb22053622 [0,0,0,0,1,0|2,0,1]=4 1204 B6R0.2 CC(=O)CN(C)C Amb9217324 [0,0,0,0,1,0|2,0,1]=4 1205 B6R0.2 CC(=O)C[C@@H](C)N Amb27493422 [0,0,0,0,1,0|2,0,1]=4 1206 B6R0.2 CC(=O)C[C@H](C)N Amb27222720 [0,0,0,0,1,0|2,0,1]=4 1207 B6R0.2 CC(=O)NC(C)Br Amb27444682 [0,0,0,0,1,0|3,0,0]=4 1208 B6R0.2 CC(=O)NC(C)C Amb3366263 [0,0,0,0,1,0|2,0,0]=3 1209 B6R0.2 CC(=O)NC(C)N Amb27468729 [0,0,0,0,1,0|3,0,0]=4 1210 B6R0.2 CC(=O)NN(C)C Amb25064806 [0,0,0,0,1,0|3,0,0]=4 1211 B6R0.2 CC(=O)OC(C)Br Amb19958925 [0,0,0,0,1,0|3,0,0]=4 1212 B6R0.2 CC(=O)OC(C)C Amb3940484 [0,0,0,0,1,0|2,0,0]=3 1213 B6R0.2 CC(=O)OC(C)Cl Amb24058273 [0,0,0,0,1,0|3,0,0]=4 1214 B6R0.2 CC(=O)OC(C)N Amb27184949 [0,0,0,0,1,0|3,0,0]=4 1215 B6R0.2 CC(=O)OC(C)O Amb27457187 [0,0,0,0,1,0|3,0,0]=4 1216 B6R0.2 CC(=O)O[SiH](C)C Amb2687439 [0,0,0,0,1,0|2,1,0]=4 1217 B6R0.2 CC(=O)\C=C(/C)N Amb1149988 [0,0,0,0,1,0|2,0,1]=4 1218 B6R0.2 CC(=O)\C=C(/C)S Amb27658727 [0,0,0,0,1,0|2,0,1]=4 1219 B6R0.2 CC(=O)\C=C(\C)Br Amb27838200 [0,0,0,0,1,0|2,0,1]=4 1220 B6R0.2 CC(=O)\C=C(\C)Cl Amb27196730 [0,0,0,0,1,0|2,0,1]=4 1221 B6R0.2 CC(=O)\C=C(\C)N Amb2720902 [0,0,0,0,1,0|2,0,1]=4 1222 B6R0.2 CC(=O)\C=C(\C)O Amb34915197 [0,0,0,0,1,0|2,0,1]=4 1223 B6R0.2 CC(=O)\C=C(\C)S Amb26910658 [0,0,0,0,1,0|2,0,1]=4 1224 B6R0.2 CC(=O)\C=C(\C)[O-] Amb19959976 [0,0,0,0,1,0|2,0,1]=4 1225 B6R0.2 CC(=O)\C=C(\C)[O-] Amb20239443 [0,0,0,0,1,0|2,0,1]=4 1226 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22045408 [0,0,0,0,1,0|2,0,1]=4 1227 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053071 [0,0,0,0,1,0|2,0,1]=4 1228 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053499 [0,0,0,0,1,0|2,0,1]=4 1229 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053500 [0,0,0,0,1,0|2,0,1]=4 1230 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053502 [0,0,0,0,1,0|2,0,1]=4 1231 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053503 [0,0,0,0,1,0|2,0,1]=4 1232 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053694 [0,0,0,0,1,0|2,0,1]=4 1233 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22053940 [0,0,0,0,1,0|2,0,1]=4 1234 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22054020 [0,0,0,0,1,0|2,0,1]=4 1235 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22466635 [0,0,0,0,1,0|2,0,1]=4 1236 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22729908 [0,0,0,0,1,0|2,0,1]=4 1237 B6R0.2 CC(=O)\C=C(\C)[O-] Amb22730050 [0,0,0,0,1,0|2,0,1]=4 1238 B6R0.2 CC(=O)\C=C(\C)[O-] Amb34915499 [0,0,0,0,1,0|2,0,1]=4 1239 B6R0.2 CC(=S)CC(=O)O Amb28067768 [0,0,0,0,1,0|1,0,2]=4 1240 B6R0.2 CC(=S)NC(C)C Amb27953313 [0,0,0,0,1,0|2,1,0]=4 1241 B6R0.2 CC(=S)OC(C)C Amb24697607 [0,0,0,0,1,0|2,1,0]=4 1242 B6R0.2 CC(Br)CC(=O)O Amb8517108 [0,0,0,0,1,0|1,0,1]=3 1243 B6R0.2 CC(C)=CB(O)O Amb2455988 [0,0,0,0,1,0|1,0,2]=4 1244 B6R0.2 CC(C)=CC(=O)Cl Amb2782315 [0,0,0,0,1,0|1,0,1]=3 1245 B6R0.2 CC(C)=CC(=O)O Amb1485519 [0,0,0,0,1,0|0,0,1]=2 1246 B6R0.2 CC(C)=CC(C)C Amb4016282 [0,0,0,0,1,0|2,0,0]=3 1247 B6R0.2 CC(C)=CC(C)Cl Amb27841415 [0,0,0,0,1,0|3,0,0]=4 1248 B6R0.2 CC(C)=CC(C)N Amb27258040 [0,0,0,0,1,0|3,0,0]=4 1249 B6R0.2 CC(C)=CC(C)O Amb22229846 [0,0,0,0,1,0|1,0,2]=4 1250 B6R0.2 CC(C)=CC(N)=O Amb10561758 [0,0,0,0,1,0|1,0,1]=3 1251 B6R0.2 CC(C)=CC(N)=S Amb18108367 [0,0,0,0,1,0|1,1,1]=4 1252 B6R0.2 CC(C)=CN(C)C Amb4017579 [0,0,0,0,1,0|3,0,0]=4 1253 B6R0.2 CC(C)=C[C@@H](C)N Amb27405038 [0,0,0,0,1,0|3,0,0]=4 1254 B6R0.2 CC(C)=C[N+](=O)[O-] Amb22167019 [0,0,0,0,1,0|1,0,2]=4 1255 B6R0.2 CC(C)=NC(C)C Amb2689015 [0,0,0,0,1,0|3,0,0]=4 1256 B6R0.2 CC(C)CB(O)O Amb2447316 [0,0,0,0,1,0|1,0,2]=4 1257 B6R0.2 CC(C)CC(=N)N Amb10066934 [0,0,0,0,1,0|2,0,1]=4 1258 B6R0.2 CC(C)CC(=N)N Amb2696279 [0,0,0,0,1,0|2,0,1]=4 1259 B6R0.2 CC(C)CC(=O)Br Amb26486664 [0,0,0,0,1,0|1,0,1]=3 1260 B6R0.2 CC(C)CC(=O)Cl Amb2792902 [0,0,0,0,1,0|1,0,1]=3 1261 B6R0.2 CC(C)CC(=O)F Amb32667643 [0,0,0,0,1,0|1,0,1]=3 1262 B6R0.2 CC(C)CC(=O)O Amb3939848 [0,0,0,0,1,0|0,0,1]=2 1263 B6R0.2 CC(C)CC(C)O Amb6608920 [0,0,0,0,1,0|1,0,2]=4 1264 B6R0.2 CC(C)CC(N)=O Amb2722931 [0,0,0,0,1,0|1,0,1]=3 1265 B6R0.2 CC(C)CC(N)=S Amb6246355 [0,0,0,0,1,0|1,1,1]=4 1266 B6R0.2 CC(C)CC(N)O Amb28383510 [0,0,0,0,1,0|1,0,2]=4 1267 B6R0.2 CC(C)CC(O)O Amb27207854 [0,0,0,0,1,0|0,0,3]=4 1268 B6R0.2 CC(C)CN(C)O Amb33360311 [0,0,0,0,1,0|2,0,1]=4 1269 B6R0.2 CC(C)CS(=O)Cl Amb26409520 [0,0,0,0,1,0|2,0,1]=4 1270 B6R0.2 CC(C)CS(=O)[O-] Amb19930010 [0,0,0,0,1,0|1,0,2]=4 1271 B6R0.2 CC(C)CS(C)=O Amb27972160 [0,0,0,0,1,0|2,0,1]=4 1272 B6R0.2 CC(C)CS(N)=O Amb24527860 [0,0,0,0,1,0|2,0,1]=4 1273 B6R0.2 CC(C)C[C@@H](C)O Amb8517525 [0,0,0,0,1,0|1,0,2]=4 1274 B6R0.2 CC(C)C[C@H](C)O Amb8517526 [0,0,0,0,1,0|1,0,2]=4 1275 B6R0.2 CC(C)C[N+](=O)[O-] Amb17672613 [0,0,0,0,1,0|1,0,2]=4 1276 B6R0.2 CC(C)NC(=N)N Amb24271074 [0,0,0,0,1,0|3,0,0]=4 1277 B6R0.2 CC(C)NC(=N)N Amb26339394 [0,0,0,0,1,0|3,0,0]=4 1278 B6R0.2 CC(C)NC(=N)N Amb32410104 [0,0,0,0,1,0|3,0,0]=4 1279 B6R0.2 CC(C)NC(=O)Cl Amb27780560 [0,0,0,0,1,0|2,0,0]=3 1280 B6R0.2 CC(C)NC(=O)S Amb27817487 [0,0,0,0,1,0|1,1,0]=3 1281 B6R0.2 CC(C)NC(N)=O Amb1104587 [0,0,0,0,1,0|2,0,0]=3 1282 B6R0.2 CC(C)NC(N)=S Amb1152626 [0,0,0,0,1,0|2,1,0]=4 1283 B6R0.2 CC(C)NS(C)=O Amb27777975 [0,0,0,0,1,0|3,0,0]=4 1284 B6R0.2 CC(C)OB(O)O Amb28410460 [0,0,0,0,1,0|2,0,1]=4 1285 B6R0.2 CC(C)OC(=O)Cl Amb3941687 [0,0,0,0,1,0|2,0,0]=3 1286 B6R0.2 CC(C)OC(=S)S Amb24465791 [0,0,0,0,1,0|1,2,0]=4 1287 B6R0.2 CC(C)OC(=S)[S-] Amb19748282 [0,0,0,0,1,0|1,2,0]=4 1288 B6R0.2 CC(C)OC(=S)[S-] Amb534231 [0,0,0,0,1,0|1,2,0]=4 1289 B6R0.2 CC(C)OC(N)=O Amb4017684 [0,0,0,0,1,0|2,0,0]=3 1290 B6R0.2 CC(C)OC(N)=S Amb25732665 [0,0,0,0,1,0|2,1,0]=4 1291 B6R0.2 CC(C)O[PH](=O)S Amb27447273 [0,0,0,0,1,0|2,1,0]=4 1292 B6R0.2 CC(C)SC(=N)N Amb1093763 [0,0,0,0,1,0|3,0,0]=4 1293 B6R0.2 CC(C)SC(=O)Cl Amb22352802 [0,0,0,0,1,0|2,0,0]=3 1294 B6R0.2 CC(Cl)CC(=O)Cl Amb28343061 [0,0,0,0,1,0|2,0,1]=4 1295 B6R0.2 CC(Cl)CC(=O)O Amb3940607 [0,0,0,0,1,0|1,0,1]=3 1296 B6R0.2 CC(Cl)NC(N)=O Amb28130611 [0,0,0,0,1,0|3,0,0]=4 1297 B6R0.2 CC(Cl)OC(=O)Cl Amb6608999 [0,0,0,0,1,0|3,0,0]=4 1298 B6R0.2 CC(I)CC(=O)O Amb28398380 [0,0,0,0,1,0|1,0,1]=3 1299 B6R0.2 CC(N)CC(=O)O Amb8379759 [0,0,0,0,1,0|1,0,1]=3 1300 B6R0.2 CC(N)CC(=O)S Amb27413857 [0,0,0,0,1,0|1,1,1]=4 1301 B6R0.2 CC(N)CC(N)=O Amb18281237 [0,0,0,0,1,0|2,0,1]=4 1302 B6R0.2 CC(N)CC(N)=O Amb33532770 [0,0,0,0,1,0|2,0,1]=4 1303 B6R0.2 CC(O)CC(=O)O Amb8513187 [0,0,0,0,1,0|1,0,1]=3 1304 B6R0.2 CC(O)CC(=O)[O-] Amb2725536 [0,0,0,0,1,0|1,0,2]=4 1305 B6R0.2 CC(O)CC(N)=O Amb26394320 [0,0,0,0,1,0|2,0,1]=4 1306 B6R0.2 CC(S)CC(=O)O Amb33538201 [0,0,0,0,1,0|1,0,1]=3 1307 B6R0.2 CN(C)CC(=O)Cl Amb22732502 [0,0,0,0,1,0|2,0,1]=4 1308 B6R0.2 CN(C)CC(=O)Cl Amb3939582 [0,0,0,0,1,0|2,0,1]=4 1309 B6R0.2 CN(C)CC(=O)O Amb3319051 [0,0,0,0,1,0|1,0,1]=3 1310 B6R0.2 CN(C)CC(=O)O Amb3940366 [0,0,0,0,1,0|1,0,1]=3 1311 B6R0.2 CN(C)CC(N)=O Amb17231806 [0,0,0,0,1,0|2,0,1]=4 1312 B6R0.2 CN(C)CC(N)=O Amb33321491 [0,0,0,0,1,0|2,0,1]=4 1313 B6R0.2 CN(C)NC(=O)Cl Amb35637051 [0,0,0,0,1,0|3,0,0]=4 1314 B6R0.2 CN(C)NC(N)=O Amb24325231 [0,0,0,0,1,0|3,0,0]=4 1315 B6R0.2 CN(N)CC(=O)O Amb23592296 [0,0,0,0,1,0|2,0,1]=4 1316 B6R0.2 CN(O)CC(=O)O Amb29838290 [0,0,0,0,1,0|2,0,1]=4 1317 B6R0.2 CS(C)=NC(N)=O Amb27837994 [0,0,0,0,1,0|3,0,0]=4 1318 B6R0.2 C[C@@H](Br)CC(=O)O Amb27637683 [0,0,0,0,1,0|1,0,1]=3 1319 B6R0.2 C[C@@H](Cl)CC(=O)O Amb27851223 [0,0,0,0,1,0|1,0,1]=3 1320 B6R0.2 C[C@@H](N)CC(=O)O Amb16184009 [0,0,0,0,1,0|1,0,1]=3 1321 B6R0.2 C[C@@H](N)CC(=O)O Amb8397201 [0,0,0,0,1,0|1,0,1]=3 1322 B6R0.2 C[C@@H](O)CC(=O)O Amb4166322 [0,0,0,0,1,0|1,0,1]=3 1323 B6R0.2 C[C@@H](O)CC(=O)[O-] Amb8470924 [0,0,0,0,1,0|1,0,2]=4 1324 B6R0.2 C[C@H](Br)CC(=O)O Amb24432019 [0,0,0,0,1,0|1,0,1]=3 1325 B6R0.2 C[C@H](N)CC(=O)O Amb16184012 [0,0,0,0,1,0|1,0,1]=3 1326 B6R0.2 C[C@H](N)CC(=O)O Amb8397200 [0,0,0,0,1,0|1,0,1]=3 1327 B6R0.2 C[C@H](N)CC(N)=O Amb27873963 [0,0,0,0,1,0|2,0,1]=4 1328 B6R0.2 C[C@H](O)CC(=O)O Amb22232025 [0,0,0,0,1,0|1,0,1]=3 1329 B6R0.2 C[NH+](C)CC(=O)Cl Amb24113885 [0,0,0,0,1,0|2,0,1]=4 1330 B6R0.2 C[NH+](C)CC(=O)O Amb24113881 [0,0,0,0,1,0|1,0,1]=3 1331 B6R0.2 C[NH+](C)CC(=O)O Amb4007789 [0,0,0,0,1,0|1,0,1]=3 1332 B6R0.2 C[S+](C)CC(=O)[O-] Amb26065720 [0,0,0,0,1,0|1,0,2]=4 1333 B6R0.2 C\C(Cl)=C/C(=O)O Amb18123483 [0,0,0,0,1,0|1,0,1]=3 1334 B6R0.2 C\C(Cl)=C\C(=O)O Amb28050474 [0,0,0,0,1,0|1,0,1]=3 1335 B6R0.2 C\C(F)=C/C(=O)O Amb27185433 [0,0,0,0,1,0|1,0,1]=3 1336 B6R0.2 C\C(I)=C/C(=O)O Amb33329900 [0,0,0,0,1,0|1,0,1]=3 1337 B6R0.2 C\C(I)=C\C(=O)O Amb24741877 [0,0,0,0,1,0|1,0,1]=3 1338 B6R0.2 C\C(I)=C\C(N)=O Amb28058366 [0,0,0,0,1,0|2,0,1]=4 1339 B6R0.2 C\C(N)=C/C(=O)O Amb27421114 [0,0,0,0,1,0|1,0,1]=3 1340 B6R0.2 C\C(N)=C/C(N)=O Amb26600164 [0,0,0,0,1,0|2,0,1]=4 1341 B6R0.2 C\C(S)=C\C(N)=O Amb27596108 [0,0,0,0,1,0|2,0,1]=4 1342 B6R0.2 NC(N)=CC(=O)O Amb27618962 [0,0,0,0,1,0|2,0,1]=4 1343 B6R0.2 NC(S)CC(=O)O Amb27391244 [0,0,0,0,1,0|2,0,1]=4 1344 B6R0.2 O=C(O)C=C(Br)Br Amb24435008 [0,0,0,0,1,0|2,0,1]=4 1345 B6R0.2 O=C(O)C=C(Cl)Cl Amb33544334 [0,0,0,0,1,0|2,0,1]=4 1346 B6R0.2 O=C(O)C=C(F)F Amb24116995 [0,0,0,0,1,0|2,0,1]=4 1347 B6R0.2 O=C(O)CC(Cl)Cl Amb27815068 [0,0,0,0,1,0|2,0,1]=4 1348 B6R0.2 O=C(O)CC(F)F Amb22001551 [0,0,0,0,1,0|2,0,1]=4 1349 B6R0.2 O=C(O)\C=C(\Cl)Br Amb27955839 [0,0,0,0,1,0|2,0,1]=4 1350 B8R0.28 C=C(C)C=C=CC(C)O Amb28049120 [0,0,0,0,0,1|3,0,0]=4 1351 B8R0.28 C=C(C)C\C=C\C(=O)O Amb27602149 [0,0,0,0,0,1|0,0,2]=3 1352 B8R0.28 C=C(C)\C=C\CC(=O)O Amb18642409 [0,0,0,0,0,1|0,0,2]=3 1353 B8R0.28 C=C(C)\C=C\CC(C)=O Amb24744667 [0,0,0,0,0,1|1,0,2]=4 1354 B8R0.28 CC(=O)C#CC=C(C)C Amb25680869 [0,0,0,0,0,1|1,0,2]=4 1355 B8R0.28 CC(=O)C#CCC(C)C Amb27442442 [0,0,0,0,0,1|1,0,2]=4 1356 B8R0.28 CC(=O)CC=C=C(C)C Amb17593280 [0,0,0,0,0,1|1,0,2]=4 1357 B8R0.28 CC(=O)CCC=C(C)C Amb533052 [0,0,0,0,0,1|1,0,2]=4 1358 B8R0.28 CC(=O)CCCC(C)C Amb33532191 [0,0,0,0,0,1|1,0,2]=4 1359 B8R0.28 CC(=O)CCNC(C)C Amb26463473 [0,0,0,0,0,1|1,0,2]=4 1360 B8R0.28 CC(=O)CCOC(C)C Amb22229804 [0,0,0,0,0,1|1,0,2]=4 1361 B8R0.28 CC(=O)CNCC(C)C Amb25067661 [0,0,0,0,0,1|1,0,2]=4 1362 B8R0.28 CC(=O)CNCC(C)C Amb32663767 [0,0,0,0,0,1|1,0,2]=4 1363 B8R0.28 CC(=O)CSCC(C)C Amb9269384 [0,0,0,0,0,1|1,0,2]=4 1364 B8R0.28 CC(=O)C\C=C\C(C)C Amb26846089 [0,0,0,0,0,1|1,0,0]=2 1365 B8R0.28 CC(=O)C\C=C\C(C)O Amb26528351 [0,0,0,0,0,1|2,0,0]=3 1366 B8R0.28 CC(=O)C\C=C\N(C)C Amb27191796 [0,0,0,0,0,1|2,0,0]=3 1367 B8R0.28 CC(=O)NCC=C(C)C Amb26606550 [0,0,0,0,0,1|1,0,2]=4 1368 B8R0.28 CC(=O)N\C=C/C(C)=S Amb27472902 [0,0,0,0,0,1|2,0,1]=4 1369 B8R0.28 CC(=O)N\C=C/C(C)C Amb28437296 [0,0,0,0,0,1|1,0,0]=2 1370 B8R0.28 CC(=O)N\C=C\C(C)=S Amb27229569 [0,0,0,0,0,1|2,0,1]=4 1371 B8R0.28 CC(=O)OCC=C(C)C Amb22002433 [0,0,0,0,0,1|1,0,2]=4 1372 B8R0.28 CC(=O)OCCC(C)C Amb2793054 [0,0,0,0,0,1|1,0,2]=4 1373 B8R0.28 CC(=O)O\N=C/C(=O)O Amb27593741 [0,0,0,0,0,1|2,0,1]=4 1374 B8R0.28 CC(=O)SCC=C(C)C Amb17617246 [0,0,0,0,0,1|1,0,2]=4 1375 B8R0.28 CC(=O)S\C=C\C(=O)O Amb26969288 [0,0,0,0,0,1|1,0,1]=3 1376 B8R0.28 CC(=O)\C=C/C=C(C)C Amb28198620 [0,0,0,0,0,1|1,0,1]=3 1377 B8R0.28 CC(=O)\C=C/CC(C)C Amb27190424 [0,0,0,0,0,1|1,0,0]=2 1378 B8R0.28 CC(=O)\C=C/NC(C)C Amb28388378 [0,0,0,0,0,1|1,0,0]=2 1379 B8R0.28 CC(=O)\C=C/OC(C)=O Amb28364680 [0,0,0,0,0,1|2,0,1]=4 1380 B8R0.28 CC(=O)\C=C\C=C(C)C Amb26890921 [0,0,0,0,0,1|1,0,1]=3 1381 B8R0.28 CC(=O)\C=C\CC(=O)O Amb26900226 [0,0,0,0,0,1|1,0,1]=3 1382 B8R0.28 CC(=O)\C=C\CC(C)C Amb3354778 [0,0,0,0,0,1|1,0,0]=2 1383 B8R0.28 CC(=O)\C=N\C=[N+](/C)[O-] Amb27199464 [0,0,0,0,0,1|3,0,0]=4 1384 B8R0.28 CC(=O)\C=N\NC(C)C Amb27600772 [0,0,0,0,0,1|2,0,0]=3 1385 B8R0.28 CC(C)=CCCC(=O)O Amb10601609 [0,0,0,0,0,1|0,0,2]=3 1386 B8R0.28 CC(C)=CCCC(C)C Amb30023884 [0,0,0,0,0,1|2,0,1]=4 1387 B8R0.28 CC(C)=CCNC(C)C Amb18642550 [0,0,0,0,0,1|2,0,1]=4 1388 B8R0.28 CC(C)=CNCC(C)C Amb28364333 [0,0,0,0,0,1|2,0,1]=4 1389 B8R0.28 CC(C)=C\C=C\C(=O)O Amb18642414 [0,0,0,0,0,1|0,0,1]=2 1390 B8R0.28 CC(C)=C\C=C\C(C)O Amb27956644 [0,0,0,0,0,1|1,0,2]=4 1391 B8R0.28 CC(C)=NNCC(=O)O Amb27958222 [0,0,0,0,0,1|1,0,2]=4 1392 B8R0.28 CC(C)C#CCC(=O)O Amb26516061 [0,0,0,0,0,1|0,0,2]=3 1393 B8R0.28 CC(C)C=C=CC(C)O Amb27852516 [0,0,0,0,0,1|1,0,1]=3 1394 B8R0.28 CC(C)CC#CC(=O)O Amb28398479 [0,0,0,0,0,1|0,0,2]=3 1395 B8R0.28 CC(C)CCCC(=O)O Amb3941255 [0,0,0,0,0,1|0,0,2]=3 1396 B8R0.28 CC(C)CCNC(N)=O Amb1104833 [0,0,0,0,0,1|1,0,2]=4 1397 B8R0.28 CC(C)CCOC(=O)Cl Amb27463593 [0,0,0,0,0,1|1,0,2]=4 1398 B8R0.28 CC(C)CCOC(N)=O Amb25299964 [0,0,0,0,0,1|1,0,2]=4 1399 B8R0.28 CC(C)CNCC(=O)O Amb19373106 [0,0,0,0,0,1|0,0,2]=3 1400 B8R0.28 CC(C)CNCC(=O)O Amb7766417 [0,0,0,0,0,1|0,0,2]=3 1401 B8R0.28 CC(C)CNCC(N)=O Amb1118171 [0,0,0,0,0,1|1,0,2]=4 1402 B8R0.28 CC(C)CNCC(N)=O Amb6892556 [0,0,0,0,0,1|1,0,2]=4 1403 B8R0.28 CC(C)COCC(=O)O Amb2608476 [0,0,0,0,0,1|0,0,2]=3 1404 B8R0.28 CC(C)CSCC(=O)O Amb1134811 [0,0,0,0,0,1|0,0,2]=3 1405 B8R0.28 CC(C)C\C=C\B(O)O Amb21856369 [0,0,0,0,0,1|1,0,1]=3 1406 B8R0.28 CC(C)C\C=C\C(=O)O Amb8392407 [0,0,0,0,0,1|0,0,0]=1 1407 B8R0.28 CC(C)C\C=C\[N+](=O)[O-] Amb32412856 [0,0,0,0,0,1|1,0,1]=3 1408 B8R0.28 CC(C)C\C=N\S(C)=O Amb35681170 [0,0,0,0,0,1|2,0,1]=4 1409 B8R0.28 CC(C)NCC=C(Cl)Cl Amb35684048 [0,0,0,0,0,1|2,0,1]=4 1410 B8R0.28 CC(C)NCCC(=O)O Amb1106349 [0,0,0,0,0,1|0,0,2]=3 1411 B8R0.28 CC(C)NCCC(=O)O Amb528114 [0,0,0,0,0,1|0,0,2]=3 1412 B8R0.28 CC(C)NCCC(N)=O Amb8841611 [0,0,0,0,0,1|1,0,2]=4 1413 B8R0.28 CC(C)NCC[PH](=O)O Amb28056178 [0,0,0,0,0,1|1,0,2]=4 1414 B8R0.28 CC(C)OCCC(=O)Cl Amb24423336 [0,0,0,0,0,1|1,0,2]=4 1415 B8R0.28 CC(C)OCCC(=O)O Amb6260272 [0,0,0,0,0,1|0,0,2]=3 1416 B8R0.28 CC(C)SCCC(=O)O Amb6267279 [0,0,0,0,0,1|0,0,2]=3 1417 B8R0.28 CC(C)S\C=C\C(=O)O Amb27838559 [0,0,0,0,0,1|0,0,0]=1 1418 B8R0.28 CC(C)\C=C\CC(=O)O Amb17844074 [0,0,0,0,0,1|0,0,0]=1 1419 B8R0.28 CC(C)\C=C\CC(C)C Amb26979730 [0,0,0,0,0,1|2,0,1]=4 1420 B8R0.28 CC(C)\C=C\CC(C)Cl Amb28399539 [0,0,0,0,0,1|2,0,1]=4 1421 B8R0.28 CC(C)\C=C\CC(C)N Amb27168917 [0,0,0,0,0,1|2,0,1]=4 1422 B8R0.28 CC(C)\C=N\NC(N)=S Amb8465935 [0,0,0,0,0,1|2,1,0]=4 1423 B8R0.28 CC(F)CCCC(=O)O Amb28144031 [0,0,0,0,0,1|1,0,2]=4 1424 B8R0.28 CC(N)CCCC(=O)O Amb22059416 [0,0,0,0,0,1|1,0,2]=4 1425 B8R0.28 CC(N)CCCC(=O)O Amb28934990 [0,0,0,0,0,1|1,0,2]=4 1426 B8R0.28 CC(N)CSCC(=O)O Amb27221487 [0,0,0,0,0,1|1,0,2]=4 1427 B8R0.28 CC(N)C\C=C\C(=O)O Amb27863954 [0,0,0,0,0,1|1,0,0]=2 1428 B8R0.28 CC(N)\C=C\CC(C)C Amb33474030 [0,0,0,0,0,1|2,0,1]=4 1429 B8R0.28 CC(O)CCCC(=O)O Amb2371277 [0,0,0,0,0,1|1,0,2]=4 1430 B8R0.28 CC(O)CNCC(=O)O Amb9359979 [0,0,0,0,0,1|1,0,2]=4 1431 B8R0.28 CC(O)COCC(=O)O Amb27968624 [0,0,0,0,0,1|1,0,2]=4 1432 B8R0.28 CC(O)CSCC(=O)O Amb19005278 [0,0,0,0,0,1|1,0,2]=4 1433 B8R0.28 CC(O)\C=C\CC(C)C Amb27242551 [0,0,0,0,0,1|1,0,1]=3 1434 B8R0.28 CC(O)\C=N\NC(N)=O Amb28285238 [0,0,0,0,0,1|3,0,0]=4 1435 B8R0.28 CN(C)CCCC(=O)O Amb2716225 [0,0,0,0,0,1|1,0,2]=4 1436 B8R0.28 CN(C)CCCC(=O)O Amb9176338 [0,0,0,0,0,1|1,0,2]=4 1437 B8R0.28 CN(C)C\C=C/C(=O)O Amb26347338 [0,0,0,0,0,1|1,0,0]=2 1438 B8R0.28 CN(C)C\C=C/C(=O)[O-] Amb32674754 [0,0,0,0,0,1|1,0,1]=3 1439 B8R0.28 CN(C)C\C=C\C(=O)Cl Amb32666591 [0,0,0,0,0,1|2,0,0]=3 1440 B8R0.28 CN(C)C\C=C\C(=O)Cl Amb32666795 [0,0,0,0,0,1|2,0,0]=3 1441 B8R0.28 CN(C)C\C=C\C(=O)O Amb15695416 [0,0,0,0,0,1|1,0,0]=2 1442 B8R0.28 CN(C)C\C=C\C(=O)O Amb33716600 [0,0,0,0,0,1|1,0,0]=2 1443 B8R0.28 CN(C)C\C=C\C(=O)O Amb8395946 [0,0,0,0,0,1|1,0,0]=2 1444 B8R0.28 CN(C)C\C=C\C(N)=O Amb24476695 [0,0,0,0,0,1|2,0,0]=3 1445 B8R0.28 CN(C)\C=N\NC(N)=O Amb26416482 [0,0,0,0,0,1|3,0,0]=4 1446 B8R0.28 C[C@H](N)C\C=C\C(=O)O Amb27784845 [0,0,0,0,0,1|1,0,0]=2 1447 B8R0.28 C[C@H](N)\C=C\CC(=O)O Amb28044026 [0,0,0,0,0,1|1,0,0]=2 1448 B8R0.28 C[C@H](O)C\C=C\B(O)O Amb25233561 [0,0,0,0,0,1|2,0,1]=4 1449 B8R0.28 C[C@H](O)C\C=C\C(=O)O Amb27812394 [0,0,0,0,0,1|1,0,0]=2 1450 B8R0.28 C[NH+](C)CCCC(=O)O Amb9786711 [0,0,0,0,0,1|1,0,2]=4 1451 B8R0.28 C\C(Br)=C/CCC(C)C Amb8389870 [0,0,0,0,0,1|2,0,1]=4 1452 B8R0.28 C\C(O)=C/C=C/C(C)O Amb27776889 [0,0,0,0,0,1|2,0,0]=3 1453 B8R0.28 C\C(O)=C\C=C/C(C)O Amb28076045 [0,0,0,0,0,1|2,0,0]=3 1454 B8R0.28 C\C(O)=C\C=C\C(C)O Amb27848184 [0,0,0,0,0,1|2,0,0]=3 1455 B8R0.28 N=C(N)S\C=C/C(=O)O Amb28314144 [0,0,0,0,0,1|2,0,1]=4 1456 B8R0.28 NC(=O)N\C=C/C(=O)O Amb28437236 [0,0,0,0,0,1|2,0,1]=4 1457 B8R0.28 NC(=O)N\C=C\C(=O)O Amb541061 [0,0,0,0,0,1|2,0,1]=4 1458 B8R0.28 NC(=S)S\C=C/C(=O)O Amb28325316 [0,0,0,0,0,1|2,0,1]=4 1459 B8R0.28 NC(=S)S\C=C\C(=O)O Amb10552410 [0,0,0,0,0,1|2,0,1]=4 1460 B8R0.28 O=C(O)C=C=CC(=O)O Amb17593335 [0,0,0,0,0,1|2,0,1]=4 1461 B8R0.28 O=C(O)\C=C/CC(=O)O Amb27882014 [0,0,0,0,0,1|2,0,1]=4 1462 B8R0.28 O=C(O)\C=C\C=C(Cl)Cl Amb27478030 [0,0,0,0,0,1|2,0,1]=4 1463 B8R0.28 O=C(O)\C=C\CC(=O)O Amb1154189 [0,0,0,0,0,1|2,0,1]=4 1464 B5R0.1 BC(=O)NCC Amb27430059 [2,0,0,0,0,0|2,0,0]=4 1465 B5R0.1 C=CC=C(C)C Amb22229813 [2,0,0,0,0,0|0,0,1]=3 1466 B5R0.1 C=CCC(=O)O Amb3940098 [2,0,0,0,0,0|0,0,2]=4 1467 B5R0.1 C=CCC(C)Br Amb26870150 [2,0,0,0,0,0|1,0,1]=4 1468 B5R0.1 C=CCC(C)C Amb8513260 [2,0,0,0,0,0|0,0,1]=3 1469 B5R0.1 C=CCC(C)Cl Amb26588784 [2,0,0,0,0,0|1,0,1]=4 1470 B5R0.1 C=CCC(C)N Amb17673480 [2,0,0,0,0,0|1,0,1]=4 1471 B5R0.1 C=CCC(C)N Amb19515336 [2,0,0,0,0,0|1,0,1]=4 1472 B5R0.1 C=CCC(C)O Amb33539328 [2,0,0,0,0,0|1,0,1]=4 1473 B5R0.1 C=CC[C@@H](C)O Amb22225370 [2,0,0,0,0,0|1,0,1]=4 1474 B5R0.1 C=CC[C@H](C)N Amb28315904 [2,0,0,0,0,0|1,0,1]=4 1475 B5R0.1 C=CC[C@H](C)O Amb22226758 [2,0,0,0,0,0|1,0,1]=4 1476 B5R0.1 C=CNC(C)C Amb28075363 [2,0,0,0,0,0|1,0,0]=3 1477 B5R0.1 C=COC(C)C Amb22230777 [2,0,0,0,0,0|1,0,0]=3 1478 B5R0.1 CC#CC(=O)O Amb2685714 [2,0,0,0,0,0|0,0,2]=4 1479 B5R0.1 CC(=O)\C=C/N Amb25147403 [2,0,0,0,0,0|2,0,0]=4 1480 B5R0.1 CC(=O)\C=C/[O-] Amb30876865 [2,0,0,0,0,0|2,0,0]=4 1481 B5R0.1 CC(=O)\C=C\Cl Amb17593099 [2,0,0,0,0,0|2,0,0]=4 1482 B5R0.1 CC(=O)\C=C\N Amb8395283 [2,0,0,0,0,0|2,0,0]=4 1483 B5R0.1 CC(=O)\C=C\[O-] Amb32644521 [2,0,0,0,0,0|2,0,0]=4 1484 B5R0.1 CC(Br)\C=C\Cl Amb25196204 [2,0,0,0,0,0|2,0,0]=4 1485 B5R0.1 CC(Br)\C=N\O Amb28137926 [2,0,0,0,0,0|2,0,0]=4 1486 B5R0.1 CC(C)=CC=O Amb8385061 [2,0,0,0,0,0|0,0,1]=3 1487 B5R0.1 CC(C)=CCO Amb4605830 [2,0,0,0,0,0|0,0,2]=4 1488 B5R0.1 CC(C)C=C=O Amb27858445 [2,0,0,0,0,0|0,0,1]=3 1489 B5R0.1 CC(C)CC=O Amb3939851 [2,0,0,0,0,0|0,0,1]=3 1490 B5R0.1 CC(C)CCO Amb4605831 [2,0,0,0,0,0|0,0,2]=4 1491 B5R0.1 CC(C)CNO Amb25887512 [2,0,0,0,0,0|1,0,1]=4 1492 B5R0.1 CC(C)N=C=O Amb3939055 [2,0,0,0,0,0|1,0,1]=4 1493 B5R0.1 CC(C)NC=O Amb4017634 [2,0,0,0,0,0|1,0,0]=3 1494 B5R0.1 CC(C)NC=S Amb28049627 [2,0,0,0,0,0|1,1,0]=4 1495 B5R0.1 CC(C)OC=N Amb22337834 [2,0,0,0,0,0|2,0,0]=4 1496 B5R0.1 CC(C)OC=O Amb9787311 [2,0,0,0,0,0|1,0,0]=3 1497 B5R0.1 CC(C)ON=O Amb17938692 [2,0,0,0,0,0|2,0,0]=4 1498 B5R0.1 CC(C)\C=N\O Amb2455920 [2,0,0,0,0,0|1,0,0]=3 1499 B5R0.1 CC(Cl)\C=C\Cl Amb25256868 [2,0,0,0,0,0|2,0,0]=4 1500 B5R0.1 CC(F)CC=O Amb28051612 [2,0,0,0,0,0|1,0,1]=4 1501 B5R0.1 CC(N)\C=N\O Amb28073035 [2,0,0,0,0,0|2,0,0]=4 1502 B5R0.1 CC(O)CC=O Amb4036424 [2,0,0,0,0,0|1,0,1]=4 1503 B5R0.1 CC(O)NC=O Amb28049622 [2,0,0,0,0,0|2,0,0]=4 1504 B5R0.1 CCC=C(Br)Br Amb25887651 [2,0,0,0,0,0|2,0,0]=4 1505 B5R0.1 CCC=C(C)C Amb22336412 [2,0,0,0,0,0|2,0,0]=4 1506 B5R0.1 CCC=C(F)F Amb10839842 [2,0,0,0,0,0|2,0,0]=4 1507 B5R0.1 CCCC(=O)Br Amb22734023 [2,0,0,0,0,0|1,0,1]=4 1508 B5R0.1 CCCC(=O)Cl Amb2792903 [2,0,0,0,0,0|1,0,1]=4 1509 B5R0.1 CCCC(=O)O Amb3939012 [2,0,0,0,0,0|0,0,1]=3 1510 B5R0.1 CCCC(=O)[O-] Amb8514901 [2,0,0,0,0,0|0,0,2]=4 1511 B5R0.1 CCCC(C)=O Amb6608910 [2,0,0,0,0,0|1,0,1]=4 1512 B5R0.1 CCCC(N)=O Amb3886524 [2,0,0,0,0,0|1,0,1]=4 1513 B5R0.1 CCCC(O)=S Amb22229383 [2,0,0,0,0,0|0,1,1]=4 1514 B5R0.1 CCNC(=O)Cl Amb25791793 [2,0,0,0,0,0|2,0,0]=4 1515 B5R0.1 CCNC(C)=O Amb2780415 [2,0,0,0,0,0|2,0,0]=4 1516 B5R0.1 CCNC(N)=O Amb6608844 [2,0,0,0,0,0|2,0,0]=4 1517 B5R0.1 CCOC(=O)Cl Amb2793045 [2,0,0,0,0,0|2,0,0]=4 1518 B5R0.1 CCOC(=O)O Amb8393208 [2,0,0,0,0,0|1,0,0]=3 1519 B5R0.1 CCOC(C)=O Amb3940488 [2,0,0,0,0,0|2,0,0]=4 1520 B5R0.1 CCOC(N)=O Amb6608672 [2,0,0,0,0,0|2,0,0]=4 1521 B5R0.1 CCO[PH](=O)O Amb22360741 [2,0,0,0,0,0|2,0,0]=4 1522 B5R0.1 CCO[Si](=O)O Amb26569259 [2,0,0,0,0,0|1,1,0]=4 1523 B5R0.1 CCSC(=O)Cl Amb8516064 [2,0,0,0,0,0|2,0,0]=4 1524 B5R0.1 CN(C)CC=O Amb22002191 [2,0,0,0,0,0|1,0,1]=4 1525 B5R0.1 CN(C)CC=O Amb22491245 [2,0,0,0,0,0|1,0,1]=4 1526 B5R0.1 CN(C)NC=O Amb1930732 [2,0,0,0,0,0|2,0,0]=4 1527 B5R0.1 CN(C)\C=C\N Amb26443108 [2,0,0,0,0,0|2,0,0]=4 1528 B5R0.1 CNCC(=O)O Amb6298808 [2,0,0,0,0,0|1,0,1]=4 1529 B5R0.1 CNCC(=O)O Amb6599996 [2,0,0,0,0,0|1,0,1]=4 1530 B5R0.1 COCC(=O)O Amb3939876 [2,0,0,0,0,0|1,0,1]=4 1531 B5R0.1 CSCC(=O)O Amb1152425 [2,0,0,0,0,0|1,0,1]=4 1532 B5R0.1 C[C@H](O)CC=O Amb27595676 [2,0,0,0,0,0|1,0,1]=4 1533 B5R0.1 C\C(Br)=C/C=O Amb27202112 [2,0,0,0,0,0|1,0,1]=4 1534 B5R0.1 C\C(Br)=C\C=O Amb27201671 [2,0,0,0,0,0|1,0,1]=4 1535 B5R0.1 C\C(N)=C/C=O Amb2612039 [2,0,0,0,0,0|1,0,1]=4 1536 B5R0.1 C\C(O)=C\CN Amb33294274 [2,0,0,0,0,0|2,0,0]=4 1537 B5R0.1 C\C=C/B(O)O Amb24547752 [2,0,0,0,0,0|1,0,1]=4 1538 B5R0.1 C\C=C/C(=O)O Amb27779315 [2,0,0,0,0,0|0,0,0]=2 1539 B5R0.1 C\C=C/C(C)=O Amb28351405 [2,0,0,0,0,0|1,0,0]=3 1540 B5R0.1 C\C=C/C(C)C Amb20618870 [2,0,0,0,0,0|0,0,1]=3 1541 B5R0.1 C\C=C\B(O)O Amb33964180 [2,0,0,0,0,0|1,0,1]=4 1542 B5R0.1 C\C=C\C(=O)Br Amb25026006 [2,0,0,0,0,0|1,0,0]=3 1543 B5R0.1 C\C=C\C(=O)Cl Amb8517577 [2,0,0,0,0,0|1,0,0]=3 1544 B5R0.1 C\C=C\C(=O)O Amb8385856 [2,0,0,0,0,0|0,0,0]=2 1545 B5R0.1 C\C=C\C(C)=O Amb33941980 [2,0,0,0,0,0|1,0,0]=3 1546 B5R0.1 C\C=C\C(C)Br Amb24725263 [2,0,0,0,0,0|1,0,1]=4 1547 B5R0.1 C\C=C\C(C)C Amb4019538 [2,0,0,0,0,0|0,0,1]=3 1548 B5R0.1 C\C=C\C(C)Cl Amb24377224 [2,0,0,0,0,0|1,0,1]=4 1549 B5R0.1 C\C=C\C(C)N Amb19514513 [2,0,0,0,0,0|1,0,1]=4 1550 B5R0.1 C\C=C\C(C)N Amb33295164 [2,0,0,0,0,0|1,0,1]=4 1551 B5R0.1 C\C=C\C(C)O Amb2721243 [2,0,0,0,0,0|1,0,1]=4 1552 B5R0.1 C\C=C\C(N)=O Amb4025906 [2,0,0,0,0,0|1,0,0]=3 1553 B5R0.1 C\C=C\C(O)O Amb26001148 [2,0,0,0,0,0|0,0,2]=4 1554 B5R0.1 C\C=C\S(=O)[O-] Amb32754562 [2,0,0,0,0,0|1,0,1]=4 1555 B5R0.1 C\C=C\[N+](=O)[O-] Amb25943859 [2,0,0,0,0,0|1,0,1]=4 1556 B5R0.1 NC(=O)\C=C\I Amb27791850 [2,0,0,0,0,0|2,0,0]=4 1557 B5R0.1 NCCC(=O)O Amb1935127 [2,0,0,0,0,0|1,0,1]=4 1558 B5R0.1 N\C=C\C(=O)O Amb27217920 [2,0,0,0,0,0|1,0,0]=3 1559 B5R0.1 N\C=C\C(N)=O Amb27237320 [2,0,0,0,0,0|2,0,0]=4 1560 B5R0.1 O=C(Cl)\C=C/Cl Amb27463694 [2,0,0,0,0,0|2,0,0]=4 1561 B5R0.1 O=C(O)CCBr Amb2685479 [2,0,0,0,0,0|1,0,1]=4 1562 B5R0.1 O=C(O)CCCl Amb5395408 [2,0,0,0,0,0|1,0,1]=4 1563 B5R0.1 O=C(O)CCF Amb10603694 [2,0,0,0,0,0|1,0,1]=4 1564 B5R0.1 O=C(O)CCI Amb2688882 [2,0,0,0,0,0|1,0,1]=4 1565 B5R0.1 O=C(O)CCO Amb2688785 [2,0,0,0,0,0|1,0,1]=4 1566 B5R0.1 O=C(O)CCS Amb6608916 [2,0,0,0,0,0|1,0,1]=4 1567 B5R0.1 O=C(O)\C=C/Br Amb18644453 [2,0,0,0,0,0|1,0,0]=3 1568 B5R0.1 O=C(O)\C=C/Cl Amb8513768 [2,0,0,0,0,0|1,0,0]=3 1569 B5R0.1 O=C(O)\C=C/I Amb28315824 [2,0,0,0,0,0|1,0,0]=3 1570 B5R0.1 O=C(O)\C=C\Br Amb27423608 [2,0,0,0,0,0|1,0,0]=3 1571 B5R0.1 O=C(O)\C=C\Cl Amb33986098 [2,0,0,0,0,0|1,0,0]=3 1572 B5R0.1 O=C(O)\C=C\I Amb30584673 [2,0,0,0,0,0|1,0,0]=3 1573 B5R0.1 O=C(O)\C=C\O Amb26055842 [2,0,0,0,0,0|1,0,0]=3 1574 B5R0.1 O=C(O)\C=C\S Amb28401590 [2,0,0,0,0,0|1,0,0]=3 1575 B5R0.1 O=C(O)\C=N\O Amb20671938 [2,0,0,0,0,0|2,0,0]=4 1576 B5R0.1 O=CCC(=O)O Amb22169407 [2,0,0,0,0,0|1,0,1]=4 1577 B5R0.2 C#C\C=C\C=O Amb17593013 [2,0,0,0,0,0|0,0,2]=4 1578 B5R0.2 C#C\C=C\CC Amb33267987 [2,0,0,0,0,0|1,0,1]=4 1579 B5R0.2 C=C\C=C\C=O Amb26369847 [2,0,0,0,0,0|0,0,2]=4 1580 B5R0.2 C=C\C=C\CBr Amb24350542 [2,0,0,0,0,0|2,0,0]=4 1581 B5R0.2 C=C\C=C\CC Amb8513434 [2,0,0,0,0,0|1,0,0]=3 1582 B5R0.2 C=C\C=C\CCl Amb24401492 [2,0,0,0,0,0|2,0,0]=4 1583 B5R0.2 C=C\C=C\CN Amb26011188 [2,0,0,0,0,0|2,0,0]=4 1584 B5R0.2 C=C\C=C\CN Amb32824809 [2,0,0,0,0,0|2,0,0]=4 1585 B5R0.2 CCC#CC=O Amb25663194 [2,0,0,0,0,0|0,0,2]=4 1586 B5R0.2 CCC=C=CBr Amb27194333 [2,0,0,0,0,0|1,0,1]=4 1587 B5R0.2 CCCCC=O Amb3939655 [2,0,0,0,0,0|0,0,2]=4 1588 B5R0.2 CCC\C=C\Br Amb17673688 [2,0,0,0,0,0|1,0,1]=4 1589 B5R0.2 CCC\C=C\Cl Amb25026521 [2,0,0,0,0,0|1,0,1]=4 1590 B5R0.2 CCC\C=C\N Amb27217273 [2,0,0,0,0,0|1,0,1]=4 1591 B5R0.2 CCC\C=N\O Amb27213413 [2,0,0,0,0,0|1,0,1]=4 1592 B5R0.2 CCO\C=C/Br Amb2455970 [2,0,0,0,0,0|2,0,0]=4 1593 B5R0.2 CCO\C=C/Cl Amb28315611 [2,0,0,0,0,0|2,0,0]=4 1594 B5R0.2 CCO\C=C\Br Amb10068669 [2,0,0,0,0,0|2,0,0]=4 1595 B5R0.2 CCSCC=O Amb17940620 [2,0,0,0,0,0|1,0,1]=4 1596 B5R0.2 CCS\C=C/Cl Amb28244706 [2,0,0,0,0,0|2,0,0]=4 1597 B5R0.2 CC\C=C/C#N Amb25707862 [2,0,0,0,0,0|1,0,1]=4 1598 B5R0.2 CC\C=C/CBr Amb33483269 [2,0,0,0,0,0|1,0,1]=4 1599 B5R0.2 CC\C=C/CC Amb8517211 [2,0,0,0,0,0|1,0,1]=4 1600 B5R0.2 CC\C=C/CO Amb10975881 [2,0,0,0,0,0|0,0,1]=3 1601 B5R0.2 CC\C=C\C#N Amb9703178 [2,0,0,0,0,0|1,0,1]=4 1602 B5R0.2 CC\C=C\C=O Amb33986391 [2,0,0,0,0,0|0,0,0]=2 1603 B5R0.2 CC\C=C\CBr Amb3940176 [2,0,0,0,0,0|1,0,1]=4 1604 B5R0.2 CC\C=C\CC Amb4016243 [2,0,0,0,0,0|1,0,1]=4 1605 B5R0.2 CC\C=C\CCl Amb33051993 [2,0,0,0,0,0|1,0,1]=4 1606 B5R0.2 CC\C=C\CI Amb27634949 [2,0,0,0,0,0|1,0,1]=4 1607 B5R0.2 CC\C=C\CN Amb27447017 [2,0,0,0,0,0|1,0,1]=4 1608 B5R0.2 CC\C=C\CN Amb33526952 [2,0,0,0,0,0|1,0,1]=4 1609 B5R0.2 CC\C=C\CO Amb22347892 [2,0,0,0,0,0|0,0,1]=3 1610 B5R0.2 CC\C=C\CS Amb33341360 [2,0,0,0,0,0|0,1,1]=4 1611 B5R0.2 CN\C=C\C=O Amb24564349 [2,0,0,0,0,0|1,0,0]=3 1612 B5R0.2 CO\C=C/C=O Amb28049941 [2,0,0,0,0,0|1,0,0]=3 1613 B5R0.2 CO\C=C\C=O Amb26873964 [2,0,0,0,0,0|1,0,0]=3 1614 B5R0.2 C\C=C/C=C/C Amb26318493 [2,0,0,0,0,0|1,0,1]=4 1615 B5R0.2 C\C=C/CCC Amb6366719 [2,0,0,0,0,0|1,0,1]=4 1616 B5R0.2 C\C=C\C=C\Br Amb27791828 [2,0,0,0,0,0|1,0,1]=4 1617 B5R0.2 C\C=C\C=C\C Amb27622458 [2,0,0,0,0,0|1,0,1]=4 1618 B5R0.2 C\C=C\CC=O Amb26655030 [2,0,0,0,0,0|0,0,2]=4 1619 B5R0.2 C\C=C\OCC Amb8516635 [2,0,0,0,0,0|2,0,0]=4 1620 B5R0.2 NC\C=C\CO Amb33212383 [2,0,0,0,0,0|1,0,1]=4 1621 B5R0.2 NC\C=C\CO Amb33495152 [2,0,0,0,0,0|1,0,1]=4 1622 B5R0.2 O=C\C=C/C=O Amb28146767 [2,0,0,0,0,0|1,0,1]=4 1623 B5R0.2 O=C\C=C\C=O Amb17593019 [2,0,0,0,0,0|1,0,1]=4 1624 B5R0.2 O=C\C=C\CCl Amb18122401 [2,0,0,0,0,0|1,0,0]=3 1625 B5R0.2 O=C\C=C\CF Amb33475269 [2,0,0,0,0,0|1,0,0]=3 1626 B5R0.2 O=C\C=C\CO Amb24356008 [2,0,0,0,0,0|1,0,0]=3 1627 B5R0.2 OC\C=C/CO Amb8383639 [2,0,0,0,0,0|1,0,1]=4 1628 B5R0.2 OC\C=C\CBr Amb22054537 [2,0,0,0,0,0|1,0,1]=4 1629 B5R0.2 OC\C=C\CCl Amb17593109 [2,0,0,0,0,0|1,0,1]=4 1630 B5R0.2 OC\C=C\CF Amb33379282 [2,0,0,0,0,0|1,0,1]=4 1631 B5R0.2 OC\C=C\CO Amb22733427 [2,0,0,0,0,0|1,0,1]=4 1632 B5R0.2 OC\C=C\CO Amb6609016 [2,0,0,0,0,0|1,0,1]=4 1633 B5R0.2 O\C=C\C=N\O Amb27831482 [2,0,0,0,0,0|2,0,0]=4 1634 B7R0.2 C#C\C(C)=C\C(=O)O Amb27950241 [1,1,0,0,0,0|0,0,2]=4 1635 B7R0.2 C=C(C)\C=C(/C)C=O Amb27464033 [1,1,0,0,0,0|0,0,2]=4 1636 B7R0.2 C=C(CC)CC(=O)O Amb18641782 [1,1,0,0,0,0|0,0,1]=3 1637 B7R0.2 C=C(CC)CC(N)=O Amb27394598 [1,1,0,0,0,0|1,0,1]=4 1638 B7R0.2 C=C(CC)OC(C)=O Amb25202254 [1,1,0,0,0,0|2,0,0]=4 1639 B7R0.2 C=C(CO)CC(C)C Amb25889172 [1,1,0,0,0,0|0,0,2]=4 1640 B7R0.2 C=C(O)\C=C(/C)OC Amb27635019 [1,1,0,0,0,0|2,0,0]=4 1641 B7R0.2 C=CC(=O)CC(C)C Amb27412805 [1,1,0,0,0,0|1,0,1]=4 1642 B7R0.2 C=CC(=O)NC(C)C Amb3940719 [1,1,0,0,0,0|2,0,0]=4 1643 B7R0.2 C=CC(=O)OC(C)C Amb22734220 [1,1,0,0,0,0|2,0,0]=4 1644 B7R0.2 C=C\C(Br)=C/[C@H](C)O Amb27768632 [1,1,0,0,0,0|2,0,0]=4 1645 B7R0.2 C=C\C(C)=C/C(=O)O Amb18641686 [1,1,0,0,0,0|0,0,2]=4 1646 B7R0.2 C=C\C(C)=C/C(C)O Amb28061923 [1,1,0,0,0,0|2,0,0]=4 1647 B7R0.2 CC(=O)\C=C(/C)C=O Amb27607120 [1,1,0,0,0,0|1,0,1]=4 1648 B7R0.2 CC(=O)\C=C(/C)CO Amb25240045 [1,1,0,0,0,0|2,0,0]=4 1649 B7R0.2 CC(=O)\C=C(/Cl)CCl Amb27832426 [1,1,0,0,0,0|2,0,0]=4 1650 B7R0.2 CC(=O)\C=C(/N)CO Amb27839108 [1,1,0,0,0,0|2,0,0]=4 1651 B7R0.2 CC(=O)\C=C(/O)CCl Amb27768762 [1,1,0,0,0,0|2,0,0]=4 1652 B7R0.2 CC(=O)\C=C(\C)C=O Amb18641689 [1,1,0,0,0,0|1,0,1]=4 1653 B7R0.2 CC(=O)\C=C(\C)CO Amb24518297 [1,1,0,0,0,0|2,0,0]=4 1654 B7R0.2 CC(=O)\C=C(\O)CCl Amb27259051 [1,1,0,0,0,0|2,0,0]=4 1655 B7R0.2 CC(C)=CC(=N)NO Amb27623180 [1,1,0,0,0,0|1,0,1]=4 1656 B7R0.2 CC(C)=CC(=O)CO Amb28048944 [1,1,0,0,0,0|0,0,2]=4 1657 B7R0.2 CC(C)=CC(=O)NO Amb27835078 [1,1,0,0,0,0|1,0,1]=4 1658 B7R0.2 CC(C)CC(=O)C=O Amb25189904 [1,1,0,0,0,0|0,0,1]=3 1659 B7R0.2 CC(C)CC(=O)CO Amb18559774 [1,1,0,0,0,0|0,0,2]=4 1660 B7R0.2 CC(C)CC(=O)NO Amb6280209 [1,1,0,0,0,0|1,0,1]=4 1661 B7R0.2 CC(C)CC(C)C=O Amb18641813 [1,1,0,0,0,0|0,0,2]=4 1662 B7R0.2 CC(C)CC(O)C=O Amb27250174 [1,1,0,0,0,0|0,0,2]=4 1663 B7R0.2 CC(C)C[C@@H](C)C=O Amb27164638 [1,1,0,0,0,0|0,0,2]=4 1664 B7R0.2 CC(C)C[C@H](N)C=O Amb26851754 [1,1,0,0,0,0|0,0,2]=4 1665 B7R0.2 CC(C)C\C(N)=N/O Amb2696576 [1,1,0,0,0,0|1,0,1]=4 1666 B7R0.2 CC(C)C\C(N)=N\O Amb8384557 [1,1,0,0,0,0|1,0,1]=4 1667 B7R0.2 CC(C)NC(=O)C=O Amb27881630 [1,1,0,0,0,0|1,0,0]=3 1668 B7R0.2 CC(C)NC(=O)CO Amb5798170 [1,1,0,0,0,0|1,0,1]=4 1669 B7R0.2 CC(C)NC(=O)NO Amb27838415 [1,1,0,0,0,0|2,0,0]=4 1670 B7R0.2 CC(C)N\C(N)=N\O Amb2697162 [1,1,0,0,0,0|2,0,0]=4 1671 B7R0.2 CC(C)OC(=O)CO Amb3941003 [1,1,0,0,0,0|1,0,1]=4 1672 B7R0.2 CC(C)OC(C)C=O Amb25243083 [1,1,0,0,0,0|1,0,1]=4 1673 B7R0.2 CC(C)OC(N)=S=O Amb27814664 [1,1,0,0,0,0|2,0,0]=4 1674 B7R0.2 CC(C)O\C(Cl)=C/Cl Amb28048863 [1,1,0,0,0,0|2,0,0]=4 1675 B7R0.2 CC(C)SC(C)C=O Amb18642905 [1,1,0,0,0,0|1,0,1]=4 1676 B7R0.2 CC(C)S\C(N)=N\O Amb24505936 [1,1,0,0,0,0|2,0,0]=4 1677 B7R0.2 CC(C)\C=C(\F)CO Amb27662199 [1,1,0,0,0,0|0,0,1]=3 1678 B7R0.2 CCC(=O)C=C(C)C Amb25715052 [1,1,0,0,0,0|2,0,0]=4 1679 B7R0.2 CCC(=O)CC(=O)O Amb18641869 [1,1,0,0,0,0|0,0,1]=3 1680 B7R0.2 CCC(=O)CC(C)=O Amb9775078 [1,1,0,0,0,0|1,0,1]=4 1681 B7R0.2 CCC(=O)CC(N)=O Amb8384375 [1,1,0,0,0,0|1,0,1]=4 1682 B7R0.2 CCC(=O)NC(C)=O Amb27800787 [1,1,0,0,0,0|2,0,0]=4 1683 B7R0.2 CCC(=O)NC(N)=O Amb27643460 [1,1,0,0,0,0|2,0,0]=4 1684 B7R0.2 CCC(=O)OC(C)=O Amb21858081 [1,1,0,0,0,0|2,0,0]=4 1685 B7R0.2 CCC(=O)\C=C(/C)Br Amb28315626 [1,1,0,0,0,0|2,0,0]=4 1686 B7R0.2 CCC(=O)\C=C(\C)N Amb26526823 [1,1,0,0,0,0|2,0,0]=4 1687 B7R0.2 CCC(C)CC(=O)O Amb2689581 [1,1,0,0,0,0|0,0,2]=4 1688 B7R0.2 CCC(N)CC(=O)O Amb1993862 [1,1,0,0,0,0|0,0,2]=4 1689 B7R0.2 CCC(N)CC(=O)O Amb8631361 [1,1,0,0,0,0|0,0,2]=4 1690 B7R0.2 CCC(O)CC(=O)O Amb10844270 [1,1,0,0,0,0|0,0,2]=4 1691 B7R0.2 CCN(C)CC(=O)O Amb33620688 [1,1,0,0,0,0|1,0,1]=4 1692 B7R0.2 CCN(C)CC(=O)O Amb8428140 [1,1,0,0,0,0|1,0,1]=4 1693 B7R0.2 CCN(O)CC(=O)O Amb28195485 [1,1,0,0,0,0|1,0,1]=4 1694 B7R0.2 CCS(=O)CC(=O)O Amb10608063 [1,1,0,0,0,0|1,0,1]=4 1695 B7R0.2 CC[C@@H](C)CC(=O)O Amb2696314 [1,1,0,0,0,0|0,0,2]=4 1696 B7R0.2 CC[C@@H](N)CC(=O)O Amb22225305 [1,1,0,0,0,0|0,0,2]=4 1697 B7R0.2 CC[C@@H](N)CC(=O)O Amb8397198 [1,1,0,0,0,0|0,0,2]=4 1698 B7R0.2 CC[C@@H](O)CC(=O)O Amb27601320 [1,1,0,0,0,0|0,0,2]=4 1699 B7R0.2 CC[C@H](C)CC(=O)O Amb2696313 [1,1,0,0,0,0|0,0,2]=4 1700 B7R0.2 CC[C@H](N)CC(=O)O Amb22226650 [1,1,0,0,0,0|0,0,2]=4 1701 B7R0.2 CC[C@H](N)CC(=O)O Amb8397197 [1,1,0,0,0,0|0,0,2]=4 1702 B7R0.2 CC[C@H](O)CC(=O)O Amb33189078 [1,1,0,0,0,0|0,0,2]=4 1703 B7R0.2 CC\C(Br)=C\C(=O)O Amb27409320 [1,1,0,0,0,0|0,0,0]=2 1704 B7R0.2 CC\C(C)=C/C(=O)O Amb18281014 [1,1,0,0,0,0|0,0,0]=2 1705 B7R0.2 CC\C(C)=C/C(C)=O Amb27424977 [1,1,0,0,0,0|1,0,0]=3 1706 B7R0.2 CC\C(C)=C\C(=O)O Amb33528462 [1,1,0,0,0,0|0,0,0]=2 1707 B7R0.2 CC\C(C)=C\C(C)=O Amb27985733 [1,1,0,0,0,0|1,0,0]=3 1708 B7R0.2 CC\C(C)=C\C(C)O Amb28128461 [1,1,0,0,0,0|1,0,1]=4 1709 B7R0.2 CC\C(F)=C/C(=O)O Amb27780201 [1,1,0,0,0,0|0,0,0]=2 1710 B7R0.2 CC\C(N)=C\C(=O)O Amb28145108 [1,1,0,0,0,0|0,0,0]=2 1711 B7R0.2 CC\C(N)=C\C(N)=O Amb27621383 [1,1,0,0,0,0|1,0,0]=3 1712 B7R0.2 CC\C(N)=N\C(C)=O Amb27391863 [1,1,0,0,0,0|2,0,0]=4 1713 B7R0.2 CC\C(O)=C\C(=O)O Amb27837122 [1,1,0,0,0,0|0,0,0]=2 1714 B7R0.2 CC\C(S)=C\C(C)=O Amb27775797 [1,1,0,0,0,0|1,0,0]=3 1715 B7R0.2 CC\C([O-])=C\C(C)=O Amb19960031 [1,1,0,0,0,0|1,0,0]=3 1716 B7R0.2 CN(C)\C=C(/Br)C=O Amb20622479 [1,1,0,0,0,0|1,0,0]=3 1717 B7R0.2 CN(C)\C=C(/Cl)C=O Amb27392189 [1,1,0,0,0,0|1,0,0]=3 1718 B7R0.2 CN(C)\C=C(/I)C=O Amb28077233 [1,1,0,0,0,0|1,0,0]=3 1719 B7R0.2 CNC(=O)CC(=O)O Amb33529761 [1,1,0,0,0,0|1,0,1]=4 1720 B7R0.2 CN\C(C)=C/C(C)=O Amb15691784 [1,1,0,0,0,0|2,0,0]=4 1721 B7R0.2 CN\C(C)=C\C(C)=O Amb27486166 [1,1,0,0,0,0|2,0,0]=4 1722 B7R0.2 COC(=O)CC(=O)O Amb16232032 [1,1,0,0,0,0|1,0,1]=4 1723 B7R0.2 CO\C(C)=C/C(=O)O Amb2611888 [1,1,0,0,0,0|1,0,0]=3 1724 B7R0.2 CO\C(C)=C/C(C)=O Amb28145644 [1,1,0,0,0,0|2,0,0]=4 1725 B7R0.2 CO\C(C)=C\C(=O)O Amb27631657 [1,1,0,0,0,0|1,0,0]=3 1726 B7R0.2 CO\C(N)=C\C(C)=O Amb27947759 [1,1,0,0,0,0|2,0,0]=4 1727 B7R0.2 CS\C(C)=C\C(C)=O Amb28315811 [1,1,0,0,0,0|2,0,0]=4 1728 B7R0.2 CS\C(N)=C/C(C)=O Amb8554013 [1,1,0,0,0,0|2,0,0]=4 1729 B7R0.2 CS\C(N)=C\C(C)=O Amb27420945 [1,1,0,0,0,0|2,0,0]=4 1730 B7R0.2 C\C(=C/C(=O)Cl)CBr Amb27477400 [1,1,0,0,0,0|2,0,0]=4 1731 B7R0.2 C\C(=C/C(=O)Cl)CCl Amb28134682 [1,1,0,0,0,0|2,0,0]=4 1732 B7R0.2 C\C(=C/C(=O)O)CO Amb18641871 [1,1,0,0,0,0|1,0,0]=3 1733 B7R0.2 C\C(=C/C(N)=O)CN Amb28288035 [1,1,0,0,0,0|2,0,0]=4 1734 B7R0.2 C\C(=C/[C@H](C)N)CO Amb27838303 [1,1,0,0,0,0|1,0,1]=4 1735 B7R0.2 C\C(=C\C(C)C)CCl Amb27875838 [1,1,0,0,0,0|1,0,1]=4 1736 B7R0.2 C\C(=C\C(C)N)CO Amb28240215 [1,1,0,0,0,0|1,0,1]=4 1737 B7R0.2 C\C(=C\Cl)CC(C)C Amb30621737 [1,1,0,0,0,0|1,0,1]=4 1738 B7R0.2 C\C(=C\[C@@H](C)N)CO Amb27635084 [1,1,0,0,0,0|1,0,1]=4 1739 B7R0.2 C\C(C#N)=C/C(=O)O Amb27830669 [1,1,0,0,0,0|1,0,1]=4 1740 B7R0.2 C\C(C=O)=C/N(C)C Amb2779776 [1,1,0,0,0,0|1,0,0]=3 1741 B7R0.2 C\C(C=O)=C\C(C)O Amb27802195 [1,1,0,0,0,0|1,0,0]=3 1742 B7R0.2 C\C(C=O)=C\N(C)C Amb19651322 [1,1,0,0,0,0|1,0,0]=3 1743 B7R0.2 C\C(CC(C)C)=N/O Amb26630838 [1,1,0,0,0,0|1,0,1]=4 1744 B7R0.2 C\C(CC(C)C)=N\O Amb27624178 [1,1,0,0,0,0|1,0,1]=4 1745 B7R0.2 C\C=C(/C)CC(C)C Amb27459658 [1,1,0,0,0,0|1,0,1]=4 1746 B7R0.2 C\C=C(\C)CC(C)C Amb24566930 [1,1,0,0,0,0|1,0,1]=4 1747 B7R0.2 C\C=C(\Cl)CC(=O)O Amb25174797 [1,1,0,0,0,0|0,0,2]=4 1748 B7R0.2 C\N=C(C)/C=C(\C)O Amb27637850 [1,1,0,0,0,0|2,0,0]=4 1749 B7R0.2 NC\C(I)=C\C(=O)O Amb28386476 [1,1,0,0,0,0|1,0,0]=3 1750 B7R0.2 O=C(O)CC(=O)CCl Amb18124484 [1,1,0,0,0,0|1,0,1]=4 1751 B7R0.2 O=C(O)\C=C(/Br)CO Amb27424808 [1,1,0,0,0,0|1,0,0]=3 1752 B7R0.2 O=C(O)\C=C(\O)CBr Amb28458506 [1,1,0,0,0,0|1,0,0]=3 1753 B7R0.2 O=C\C(Cl)=C/C(=O)O Amb27852924 [1,1,0,0,0,0|1,0,1]=4 1754 B7R0.3 C=C(\C=C\CC)CBr Amb33480597 [1,1,0,0,0,0|2,0,0]=4 1755 B7R0.3 C=C(\C=C\CC)CCl Amb33057664 [1,1,0,0,0,0|2,0,0]=4 1756 B7R0.3 C=C(\C=C\CC)CN Amb33225015 [1,1,0,0,0,0|2,0,0]=4 1757 B7R0.3 C=CC(=O)\C=C\CC Amb27156684 [1,1,0,0,0,0|1,0,0]=3 1758 B7R0.3 C=CC(C)\C=C\CO Amb27978586 [1,1,0,0,0,0|0,0,2]=4 1759 B7R0.3 C=CC(O)\C=C\CC Amb27451021 [1,1,0,0,0,0|1,0,1]=4 1760 B7R0.3 C=C\C=C/[C@H](C)C=O Amb27592910 [1,1,0,0,0,0|1,0,1]=4 1761 B7R0.3 C=C\C=C\C(=O)OC Amb22350484 [1,1,0,0,0,0|0,0,2]=4 1762 B7R0.3 C=C\C=C\C(C)C=C Amb4035858 [1,1,0,0,0,0|1,0,1]=4 1763 B7R0.3 C=C\C=C\C(C)C=O Amb28048951 [1,1,0,0,0,0|1,0,1]=4 1764 B7R0.3 C=C\C=C\C(O)CO Amb28074781 [1,1,0,0,0,0|2,0,0]=4 1765 B7R0.3 CC(C=C=CBr)CO Amb27393018 [1,1,0,0,0,0|1,0,1]=4 1766 B7R0.3 CC(CO)CNC=O Amb27482480 [1,1,0,0,0,0|1,0,1]=4 1767 B7R0.3 CC(\C=C\CN)CO Amb26629186 [1,1,0,0,0,0|1,0,1]=4 1768 B7R0.3 CC=C=CC(=O)OC Amb26575881 [1,1,0,0,0,0|0,0,2]=4 1769 B7R0.3 CCC#CC(=O)OC Amb27838321 [1,1,0,0,0,0|0,0,2]=4 1770 B7R0.3 CCC(=O)\C=C\C=O Amb18641682 [1,1,0,0,0,0|1,0,1]=4 1771 B7R0.3 CCC(C)C#CC=O Amb27828859 [1,1,0,0,0,0|0,0,2]=4 1772 B7R0.3 CCC(C)C\C=N\O Amb27843883 [1,1,0,0,0,0|1,0,1]=4 1773 B7R0.3 CCC(C)\C=C\C=O Amb32954899 [1,1,0,0,0,0|0,0,0]=2 1774 B7R0.3 CCC(C)\C=C\CBr Amb27233120 [1,1,0,0,0,0|1,0,1]=4 1775 B7R0.3 CCC(C)\C=C\CN Amb33171992 [1,1,0,0,0,0|1,0,1]=4 1776 B7R0.3 CCC(C)\C=C\CO Amb32954901 [1,1,0,0,0,0|0,0,1]=3 1777 B7R0.3 CCC(O)\C=C\C=O Amb16233610 [1,1,0,0,0,0|1,0,0]=3 1778 B7R0.3 CCCCC(=O)CO Amb26073501 [1,1,0,0,0,0|0,0,2]=4 1779 B7R0.3 CCCCC(=O)NO Amb6269796 [1,1,0,0,0,0|0,0,2]=4 1780 B7R0.3 CCCNC(=O)CO Amb5798169 [1,1,0,0,0,0|1,0,1]=4 1781 B7R0.3 CCCOC(=O)CO Amb25964379 [1,1,0,0,0,0|1,0,1]=4 1782 B7R0.3 CCCOC(=O)OC Amb27153532 [1,1,0,0,0,0|1,0,1]=4 1783 B7R0.3 CCC\C=C(/Cl)C=O Amb27201672 [1,1,0,0,0,0|1,0,1]=4 1784 B7R0.3 CCNCC(=O)NO Amb27755137 [1,1,0,0,0,0|1,0,1]=4 1785 B7R0.3 CCNCC(=O)OC Amb19514718 [1,1,0,0,0,0|1,0,1]=4 1786 B7R0.3 CCNCC(=O)OC Amb6687125 [1,1,0,0,0,0|1,0,1]=4 1787 B7R0.3 CCOCC(=O)CO Amb28066809 [1,1,0,0,0,0|1,0,1]=4 1788 B7R0.3 CCOCC(=O)OC Amb7753022 [1,1,0,0,0,0|1,0,1]=4 1789 B7R0.3 CCONC(=O)CO Amb27762105 [1,1,0,0,0,0|2,0,0]=4 1790 B7R0.3 CCO\C=C(/C)C=O Amb8514481 [1,1,0,0,0,0|2,0,0]=4 1791 B7R0.3 CCO\C=C(\C)C=O Amb18641771 [1,1,0,0,0,0|2,0,0]=4 1792 B7R0.3 CCSCC(=O)OC Amb7753193 [1,1,0,0,0,0|1,0,1]=4 1793 B7R0.3 CCS\C=C(\O)C=O Amb27412581 [1,1,0,0,0,0|1,0,0]=3 1794 B7R0.3 CC[C@@H](C)CCC=O Amb27949584 [1,1,0,0,0,0|0,0,2]=4 1795 B7R0.3 CC[C@H](C)\C=C\C=O Amb27873518 [1,1,0,0,0,0|0,0,0]=2 1796 B7R0.3 CC[C@H](O)\C=C\C=O Amb28070938 [1,1,0,0,0,0|1,0,0]=3 1797 B7R0.3 CC\C=C\C(=O)CBr Amb25251595 [1,1,0,0,0,0|1,0,0]=3 1798 B7R0.3 CC\C=C\C(=O)CC Amb25283354 [1,1,0,0,0,0|1,0,0]=3 1799 B7R0.3 CC\C=C\C(=O)CCl Amb33057661 [1,1,0,0,0,0|1,0,0]=3 1800 B7R0.3 CC\C=C\C(=O)CN Amb33268678 [1,1,0,0,0,0|1,0,0]=3 1801 B7R0.3 CC\C=C\C(=O)OC Amb2689583 [1,1,0,0,0,0|0,0,0]=2 1802 B7R0.3 CC\C=C\C(C)C=O Amb33474380 [1,1,0,0,0,0|1,0,1]=4 1803 B7R0.3 CC\C=C\C(C)CBr Amb33009079 [1,1,0,0,0,0|1,0,1]=4 1804 B7R0.3 CC\C=C\C(C)CC Amb26433198 [1,1,0,0,0,0|1,0,1]=4 1805 B7R0.3 CC\C=C\C(C)CN Amb33269951 [1,1,0,0,0,0|1,0,1]=4 1806 B7R0.3 CC\C=C\C(C)ON Amb33268113 [1,1,0,0,0,0|1,0,1]=4 1807 B7R0.3 CC\C=C\C(F)C=O Amb26049149 [1,1,0,0,0,0|1,0,1]=4 1808 B7R0.3 CC\C=C\C(N)CO Amb33268713 [1,1,0,0,0,0|1,0,1]=4 1809 B7R0.3 CC\C=C\C(O)CBr Amb33009081 [1,1,0,0,0,0|1,0,1]=4 1810 B7R0.3 CC\C=C\C(O)CC Amb27619562 [1,1,0,0,0,0|1,0,1]=4 1811 B7R0.3 CC\C=C\C(O)CCl Amb33262139 [1,1,0,0,0,0|1,0,1]=4 1812 B7R0.3 CC\C=C\C(O)CF Amb33267982 [1,1,0,0,0,0|1,0,1]=4 1813 B7R0.3 CC\C=C\C(O)CN Amb33359770 [1,1,0,0,0,0|1,0,1]=4 1814 B7R0.3 CC\C=C\C(O)CO Amb32953425 [1,1,0,0,0,0|0,0,2]=4 1815 B7R0.3 CC\C=C\[C@@H](C)CO Amb28366044 [1,1,0,0,0,0|1,0,1]=4 1816 B7R0.3 CC\C=C\[C@@H](N)CO Amb33268251 [1,1,0,0,0,0|1,0,1]=4 1817 B7R0.3 CC\C=C\[C@@H](O)CC Amb28188274 [1,1,0,0,0,0|1,0,1]=4 1818 B7R0.3 CC\C=C\[C@@H](O)CN Amb33268255 [1,1,0,0,0,0|1,0,1]=4 1819 B7R0.3 CC\C=C\[C@H](N)CO Amb33268252 [1,1,0,0,0,0|1,0,1]=4 1820 B7R0.3 CC\C=C\[C@H](O)CN Amb33268254 [1,1,0,0,0,0|1,0,1]=4 1821 B7R0.3 CNC(=O)\C=C\CN Amb27196933 [1,1,0,0,0,0|2,0,0]=4 1822 B7R0.3 CNC(=O)\C=C\CN Amb29083397 [1,1,0,0,0,0|2,0,0]=4 1823 B7R0.3 COC(=O)\C=C\C=O Amb18641759 [1,1,0,0,0,0|1,0,1]=4 1824 B7R0.3 COC(=O)\C=C\CBr Amb8513243 [1,1,0,0,0,0|1,0,0]=3 1825 B7R0.3 COC(=O)\C=C\CF Amb35747826 [1,1,0,0,0,0|1,0,0]=3 1826 B7R0.3 COC(=O)\C=C\CN Amb24117125 [1,1,0,0,0,0|1,0,0]=3 1827 B7R0.3 COC(=O)\C=C\CN Amb30634316 [1,1,0,0,0,0|1,0,0]=3 1828 B7R0.3 COC(=O)\C=C\NO Amb28315962 [1,1,0,0,0,0|2,0,0]=4 1829 B7R0.3 COC(=O)\C=C\SC Amb33473626 [1,1,0,0,0,0|1,0,0]=3 1830 B7R0.3 COC(C)CCC=O Amb25917630 [1,1,0,0,0,0|0,0,2]=4 1831 B7R0.3 COC(C)\C=C\C#N Amb27654172 [1,1,0,0,0,0|1,0,1]=4 1832 B7R0.3 COC(C)\C=C\C=O Amb27640624 [1,1,0,0,0,0|0,0,0]=2 1833 B7R0.3 COC(C)\C=C\CN Amb27841637 [1,1,0,0,0,0|1,0,1]=4 1834 B7R0.3 CO[C@@H](C)CNC=O Amb35605354 [1,1,0,0,0,0|1,0,1]=4 1835 B7R0.3 CO[C@H](C)CNC=O Amb35605356 [1,1,0,0,0,0|1,0,1]=4 1836 B7R0.3 CO\C(C)=C\CC=O Amb28283269 [1,1,0,0,0,0|0,0,2]=4 1837 B7R0.3 CO\C=C\C(=O)CBr Amb26323620 [1,1,0,0,0,0|2,0,0]=4 1838 B7R0.3 CO\C=C\C(=O)OC Amb6600489 [1,1,0,0,0,0|1,0,0]=3 1839 B7R0.3 CS\C=C\C(=O)NN Amb27458500 [1,1,0,0,0,0|2,0,0]=4 1840 B7R0.3 C\C=C/C=C(/C)C=O Amb27392706 [1,1,0,0,0,0|1,0,1]=4 1841 B7R0.3 C\C=C\C=C(/C)C=O Amb27204994 [1,1,0,0,0,0|1,0,1]=4 1842 B7R0.3 C\C=C\CC(=O)OC Amb8394879 [1,1,0,0,0,0|0,0,2]=4 1843 B7R0.3 C\C=C\C[C@@H](C)CO Amb27650152 [1,1,0,0,0,0|1,0,1]=4 1844 B7R0.3 C\C=C\NC(=O)OC Amb27838402 [1,1,0,0,0,0|1,0,1]=4 1845 B7R0.3 N#CC(=O)\C=C\CBr Amb26075400 [1,1,0,0,0,0|2,0,0]=4 1846 B7R0.3 NC(\C=C\CO)CO Amb27831437 [1,1,0,0,0,0|1,0,1]=4 1847 B7R0.3 O=C\C=C\C(=O)CO Amb24574003 [1,1,0,0,0,0|1,0,1]=4 1848 B7R0.3 O=C\C=C\[C@H](O)CO Amb28208342 [1,1,0,0,0,0|1,0,0]=3 1849 B7R0.4 C=C(C)C\C=C\C=O Amb18640955 [1,1,0,0,0,0|0,0,2]=4 1850 B7R0.4 C=C\C=C\CC(=O)O Amb34916435 [1,1,0,0,0,0|0,0,2]=4 1851 B7R0.4 C=C\C=C\CN(C)C Amb27420207 [1,1,0,0,0,0|2,0,0]=4 1852 B7R0.4 C=C\C=C\C[C@@H](C)O Amb27946739 [1,1,0,0,0,0|2,0,0]=4 1853 B7R0.4 CC(=O)C=C=CCO Amb28284681 [1,1,0,0,0,0|2,0,0]=4 1854 B7R0.4 CC(=O)C\C=C\C=O Amb27165276 [1,1,0,0,0,0|1,0,1]=4 1855 B7R0.4 CC(=O)\C=C\CCF Amb33196081 [1,1,0,0,0,0|1,0,0]=3 1856 B7R0.4 CC(=O)\C=C\CCO Amb26479998 [1,1,0,0,0,0|1,0,0]=3 1857 B7R0.4 CC(Br)C=C=CCO Amb27484054 [1,1,0,0,0,0|1,0,1]=4 1858 B7R0.4 CC(C)=CCCC=O Amb17593168 [1,1,0,0,0,0|0,0,2]=4 1859 B7R0.4 CC(C)=CCNC=O Amb27838354 [1,1,0,0,0,0|0,0,2]=4 1860 B7R0.4 CC(C)=C\C=C/C=O Amb27169113 [1,1,0,0,0,0|0,0,1]=3 1861 B7R0.4 CC(C)=C\C=C\CCl Amb27778733 [1,1,0,0,0,0|1,0,1]=4 1862 B7R0.4 CC(C)=C\C=C\CO Amb28400370 [1,1,0,0,0,0|0,0,1]=3 1863 B7R0.4 CC(C)C=C=CCO Amb27424344 [1,1,0,0,0,0|0,0,1]=3 1864 B7R0.4 CC(C)CCCC=O Amb17940235 [1,1,0,0,0,0|0,0,2]=4 1865 B7R0.4 CC(C)CCNC=O Amb27460935 [1,1,0,0,0,0|0,0,2]=4 1866 B7R0.4 CC(C)C\C=C\C=O Amb33359709 [1,1,0,0,0,0|0,0,0]=2 1867 B7R0.4 CC(C)C\C=C\CN Amb24615023 [1,1,0,0,0,0|1,0,1]=4 1868 B7R0.4 CC(C)C\C=C\CO Amb25851501 [1,1,0,0,0,0|0,0,1]=3 1869 B7R0.4 CC(C)N\C=C\C=O Amb26418674 [1,1,0,0,0,0|0,0,0]=2 1870 B7R0.4 CC(C)OCCC=O Amb26443003 [1,1,0,0,0,0|0,0,2]=4 1871 B7R0.4 CC(C)OC\C=C/Br Amb28291637 [1,1,0,0,0,0|1,0,1]=4 1872 B7R0.4 CC(C)\C=C\CC#N Amb24428238 [1,1,0,0,0,0|1,0,1]=4 1873 B7R0.4 CC(C)\C=C\CCBr Amb17570209 [1,1,0,0,0,0|1,0,1]=4 1874 B7R0.4 CC(C)\C=C\CCN Amb17569896 [1,1,0,0,0,0|1,0,1]=4 1875 B7R0.4 CC(C)\C=C\CCO Amb25117403 [1,1,0,0,0,0|0,0,1]=3 1876 B7R0.4 CC(C)\C=C\N=C=O Amb27228159 [1,1,0,0,0,0|0,0,1]=3 1877 B7R0.4 CC(O)C\C=C\CO Amb27432058 [1,1,0,0,0,0|1,0,1]=4 1878 B7R0.4 CC(O)\C=C\C=C\Cl Amb27454846 [1,1,0,0,0,0|2,0,0]=4 1879 B7R0.4 CC(O)\C=C\CCBr Amb27228895 [1,1,0,0,0,0|1,0,1]=4 1880 B7R0.4 CC(O)\C=C\CCO Amb28138579 [1,1,0,0,0,0|1,0,1]=4 1881 B7R0.4 CCC#CCC(=O)O Amb26515701 [1,1,0,0,0,0|0,0,2]=4 1882 B7R0.4 CCC=C=CC(C)=O Amb25830543 [1,1,0,0,0,0|1,0,0]=3 1883 B7R0.4 CCCC#CC(=O)O Amb2721706 [1,1,0,0,0,0|0,0,2]=4 1884 B7R0.4 CCCCCC(=O)O Amb3939846 [1,1,0,0,0,0|0,0,2]=4 1885 B7R0.4 CCCNCC(=O)O Amb10609640 [1,1,0,0,0,0|0,0,2]=4 1886 B7R0.4 CCCNCC(=O)O Amb1110628 [1,1,0,0,0,0|0,0,2]=4 1887 B7R0.4 CCCOCC(=O)O Amb8874504 [1,1,0,0,0,0|0,0,2]=4 1888 B7R0.4 CCCSCC(=O)O Amb1137113 [1,1,0,0,0,0|0,0,2]=4 1889 B7R0.4 CCC\C=C/C(C)=O Amb17593161 [1,1,0,0,0,0|1,0,0]=3 1890 B7R0.4 CCC\C=C\C(=N)N Amb33358507 [1,1,0,0,0,0|2,0,0]=4 1891 B7R0.4 CCC\C=C\C(=O)Cl Amb2688716 [1,1,0,0,0,0|1,0,0]=3 1892 B7R0.4 CCC\C=C\C(=O)O Amb2688715 [1,1,0,0,0,0|0,0,0]=2 1893 B7R0.4 CCC\C=C\C(C)=O Amb20240563 [1,1,0,0,0,0|1,0,0]=3 1894 B7R0.4 CCC\C=C\C(C)C Amb4019553 [1,1,0,0,0,0|1,0,1]=4 1895 B7R0.4 CCC\C=C\C(C)O Amb25083446 [1,1,0,0,0,0|1,0,1]=4 1896 B7R0.4 CCC\C=C\C(N)=O Amb26397290 [1,1,0,0,0,0|1,0,0]=3 1897 B7R0.4 CCC\C=C\[C@@H](C)O Amb33429966 [1,1,0,0,0,0|1,0,1]=4 1898 B7R0.4 CCC\C=C\[C@H](C)O Amb27857282 [1,1,0,0,0,0|1,0,1]=4 1899 B7R0.4 CCC\C=C\[N+](=O)[O-] Amb24558342 [1,1,0,0,0,0|1,0,1]=4 1900 B7R0.4 CCN=C=CC(C)=O Amb24481402 [1,1,0,0,0,0|1,0,1]=4 1901 B7R0.4 CCNCCC(=O)O Amb28934794 [1,1,0,0,0,0|0,0,2]=4 1902 B7R0.4 CCNCCC(=O)O Amb7766402 [1,1,0,0,0,0|0,0,2]=4 1903 B7R0.4 CCNNCC(=O)O Amb28326075 [1,1,0,0,0,0|1,0,1]=4 1904 B7R0.4 CCOCCC(=O)O Amb3939859 [1,1,0,0,0,0|0,0,2]=4 1905 B7R0.4 CCO\C=C\B(O)O Amb28430050 [1,1,0,0,0,0|1,0,1]=4 1906 B7R0.4 CCO\C=C\C(=O)Cl Amb33943049 [1,1,0,0,0,0|1,0,0]=3 1907 B7R0.4 CCO\C=C\C(=O)O Amb2725260 [1,1,0,0,0,0|0,0,0]=2 1908 B7R0.4 CCO\C=C\C(C)=O Amb25330041 [1,1,0,0,0,0|1,0,0]=3 1909 B7R0.4 CCO\C=C\C(C)C Amb22261439 [1,1,0,0,0,0|1,0,1]=4 1910 B7R0.4 CCO\N=C\C(=O)O Amb27468748 [1,1,0,0,0,0|1,0,0]=3 1911 B7R0.4 CCO\N=C\C(N)=O Amb27949484 [1,1,0,0,0,0|2,0,0]=4 1912 B7R0.4 CCSCCC(=O)O Amb6273140 [1,1,0,0,0,0|0,0,2]=4 1913 B7R0.4 CCS\C=C/C(C)=O Amb28122375 [1,1,0,0,0,0|1,0,0]=3 1914 B7R0.4 CC\C=C/CC(=O)O Amb2720526 [1,1,0,0,0,0|0,0,0]=2 1915 B7R0.4 CC\C=C/CC(C)=O Amb27974504 [1,1,0,0,0,0|1,0,0]=3 1916 B7R0.4 CC\C=C\CC(=O)Cl Amb27228151 [1,1,0,0,0,0|1,0,0]=3 1917 B7R0.4 CC\C=C\CC(=O)O Amb3940332 [1,1,0,0,0,0|0,0,0]=2 1918 B7R0.4 CC\C=C\CC(C)=O Amb25953857 [1,1,0,0,0,0|1,0,0]=3 1919 B7R0.4 CC\C=C\CC(C)C Amb4016285 [1,1,0,0,0,0|1,0,1]=4 1920 B7R0.4 CC\C=C\CC(C)O Amb33079090 [1,1,0,0,0,0|1,0,1]=4 1921 B7R0.4 CC\C=C\CC(N)=S Amb33225501 [1,1,0,0,0,0|1,1,0]=4 1922 B7R0.4 CC\C=C\CN(C)O Amb33268704 [1,1,0,0,0,0|2,0,0]=4 1923 B7R0.4 CC\C=C\C[C@@H](C)O Amb33359513 [1,1,0,0,0,0|1,0,1]=4 1924 B7R0.4 CC\C=C\C[C@H](C)O Amb33474377 [1,1,0,0,0,0|1,0,1]=4 1925 B7R0.4 CC\C=C\C[N+](=O)[O-] Amb33267962 [1,1,0,0,0,0|1,0,1]=4 1926 B7R0.4 CC\C=C\C[PH](=O)O Amb8391288 [1,1,0,0,0,0|1,0,0]=3 1927 B7R0.4 CC\C=N\NC(N)=O Amb26899579 [1,1,0,0,0,0|2,0,0]=4 1928 B7R0.4 CNCC#CC(=O)O Amb27218273 [1,1,0,0,0,0|0,0,2]=4 1929 B7R0.4 CNCCCC(=O)O Amb1153115 [1,1,0,0,0,0|0,0,2]=4 1930 B7R0.4 CNCCCC(=O)O Amb4521435 [1,1,0,0,0,0|0,0,2]=4 1931 B7R0.4 CNC\C=C\C(=O)O Amb25368293 [1,1,0,0,0,0|0,0,0]=2 1932 B7R0.4 CNC\C=C\C(C)C Amb27828260 [1,1,0,0,0,0|1,0,1]=4 1933 B7R0.4 COCC#CC(=O)O Amb33544473 [1,1,0,0,0,0|0,0,2]=4 1934 B7R0.4 COCCCC(=O)O Amb6275629 [1,1,0,0,0,0|0,0,2]=4 1935 B7R0.4 COCOCC(=O)O Amb28059312 [1,1,0,0,0,0|1,0,1]=4 1936 B7R0.4 COCSCC(=O)O Amb27466837 [1,1,0,0,0,0|1,0,1]=4 1937 B7R0.4 COC\C=C\B(O)O Amb17617079 [1,1,0,0,0,0|1,0,1]=4 1938 B7R0.4 COC\C=C\C(=O)O Amb33986212 [1,1,0,0,0,0|0,0,0]=2 1939 B7R0.4 COC\C=C\C(C)=O Amb33359822 [1,1,0,0,0,0|1,0,0]=3 1940 B7R0.4 COC\C=C\C(C)Cl Amb27791751 [1,1,0,0,0,0|1,0,1]=4 1941 B7R0.4 COC\C=C\C(C)N Amb33429413 [1,1,0,0,0,0|1,0,1]=4 1942 B7R0.4 COC\C=C\[N+](=O)[O-] Amb33428677 [1,1,0,0,0,0|1,0,1]=4 1943 B7R0.4 CO\C=C/NC(C)=O Amb27391649 [1,1,0,0,0,0|2,0,0]=4 1944 B7R0.4 CO\C=C\NC(C)=O Amb28198239 [1,1,0,0,0,0|2,0,0]=4 1945 B7R0.4 CSCCCC(=O)O Amb17503622 [1,1,0,0,0,0|0,0,2]=4 1946 B7R0.4 CSCSCC(=O)O Amb27858824 [1,1,0,0,0,0|1,0,1]=4 1947 B7R0.4 CSC\C=C/C(C)=O Amb25713058 [1,1,0,0,0,0|1,0,0]=3 1948 B7R0.4 CSC\C=C\C(C)=O Amb33359530 [1,1,0,0,0,0|1,0,0]=3 1949 B7R0.4 CSC\C=C\[N+](=O)[O-] Amb33271736 [1,1,0,0,0,0|1,0,1]=4 1950 B7R0.4 CS\C=C\CC(=O)O Amb26656267 [1,1,0,0,0,0|1,0,0]=3 1951 B7R0.4 C[C@H](O)C\C=C\CO Amb27945050 [1,1,0,0,0,0|1,0,1]=4 1952 B7R0.4 C\C=C/C=C/C(C)=O Amb28129038 [1,1,0,0,0,0|1,0,1]=4 1953 B7R0.4 C\C=C\C#CC(=O)O Amb17593127 [1,1,0,0,0,0|0,0,2]=4 1954 B7R0.4 C\C=C\C=C/C(C)O Amb22342426 [1,1,0,0,0,0|2,0,0]=4 1955 B7R0.4 C\C=C\C=C\C(=O)Cl Amb32664141 [1,1,0,0,0,0|1,0,1]=4 1956 B7R0.4 C\C=C\C=C\C(=O)O Amb17784698 [1,1,0,0,0,0|0,0,1]=3 1957 B7R0.4 C\C=C\C=C\C(=O)[O-] Amb33512746 [1,1,0,0,0,0|0,0,2]=4 1958 B7R0.4 C\C=C\C=C\C(=O)[O-] Amb33723188 [1,1,0,0,0,0|0,0,2]=4 1959 B7R0.4 C\C=C\C=C\C(C)=O Amb17593137 [1,1,0,0,0,0|1,0,1]=4 1960 B7R0.4 C\C=C\C=C\C(C)O Amb27843477 [1,1,0,0,0,0|2,0,0]=4 1961 B7R0.4 C\C=C\C=C\C(N)=O Amb28400805 [1,1,0,0,0,0|1,0,1]=4 1962 B7R0.4 C\C=C\C=C\[C@@H](C)O Amb27223068 [1,1,0,0,0,0|2,0,0]=4 1963 B7R0.4 C\C=C\C=N\N(C)C Amb27398333 [1,1,0,0,0,0|2,0,0]=4 1964 B7R0.4 C\C=C\CCC(=O)O Amb34910859 [1,1,0,0,0,0|0,0,2]=4 1965 B7R0.4 C\C=C\CCC(C)C Amb24401080 [1,1,0,0,0,0|1,0,1]=4 1966 B7R0.4 C\C=C\CNC(C)C Amb18641745 [1,1,0,0,0,0|1,0,1]=4 1967 B7R0.4 C\C=C\NCC(C)C Amb27839051 [1,1,0,0,0,0|1,0,1]=4 1968 B7R0.4 N#CS\C=C/C(=O)O Amb28203932 [1,1,0,0,0,0|1,0,1]=4 1969 B7R0.4 N#CS\C=C\C(=O)O Amb28435246 [1,1,0,0,0,0|1,0,1]=4 1970 B7R0.4 NCCC#CC(=O)O Amb32656225 [1,1,0,0,0,0|0,0,2]=4 1971 B7R0.4 NCCCCC(=O)O Amb2780021 [1,1,0,0,0,0|0,0,2]=4 1972 B7R0.4 NCCCCC(=O)O Amb3941646 [1,1,0,0,0,0|0,0,2]=4 1973 B7R0.4 NCCCCC(=O)O Amb9825855 [1,1,0,0,0,0|0,0,2]=4 1974 B7R0.4 NCCCNC(=O)O Amb24093884 [1,1,0,0,0,0|1,0,1]=4 1975 B7R0.4 NCCNCC(=O)O Amb17608063 [1,1,0,0,0,0|1,0,1]=4 1976 B7R0.4 NCCNCC(=O)O Amb33339058 [1,1,0,0,0,0|1,0,1]=4 1977 B7R0.4 NCCOCC(=O)O Amb18630146 [1,1,0,0,0,0|1,0,1]=4 1978 B7R0.4 NCCOCC(=O)O Amb33550947 [1,1,0,0,0,0|1,0,1]=4 1979 B7R0.4 NCCSCC(=O)O Amb17500446 [1,1,0,0,0,0|1,0,1]=4 1980 B7R0.4 NCCSCC(=O)O Amb20622325 [1,1,0,0,0,0|1,0,1]=4 1981 B7R0.4 NCC\C=C/C(=O)O Amb27201417 [1,1,0,0,0,0|0,0,0]=2 1982 B7R0.4 O=C(Cl)\C=C\CCCl Amb27413542 [1,1,0,0,0,0|1,0,0]=3 1983 B7R0.4 O=C(O)C#CCCO Amb25844914 [1,1,0,0,0,0|0,0,2]=4 1984 B7R0.4 O=C(O)CCCCBr Amb6608763 [1,1,0,0,0,0|0,0,2]=4 1985 B7R0.4 O=C(O)CCCCCl Amb3940369 [1,1,0,0,0,0|0,0,2]=4 1986 B7R0.4 O=C(O)CCCCF Amb26639920 [1,1,0,0,0,0|0,0,2]=4 1987 B7R0.4 O=C(O)CCCCO Amb9214971 [1,1,0,0,0,0|0,0,2]=4 1988 B7R0.4 O=C(O)CCCCS Amb17503767 [1,1,0,0,0,0|0,0,2]=4 1989 B7R0.4 O=C(O)CNCCF Amb28076282 [1,1,0,0,0,0|1,0,1]=4 1990 B7R0.4 O=C(O)CNCCO Amb9325653 [1,1,0,0,0,0|1,0,1]=4 1991 B7R0.4 O=C(O)COCCCl Amb21857870 [1,1,0,0,0,0|1,0,1]=4 1992 B7R0.4 O=C(O)COCCF Amb27866609 [1,1,0,0,0,0|1,0,1]=4 1993 B7R0.4 O=C(O)COCCO Amb6680914 [1,1,0,0,0,0|1,0,1]=4 1994 B7R0.4 O=C(O)CSCCCl Amb18644703 [1,1,0,0,0,0|1,0,1]=4 1995 B7R0.4 O=C(O)C\C=C/CS Amb18124361 [1,1,0,0,0,0|1,0,0]=3 1996 B7R0.4 O=C(O)C\C=C\CO Amb28429811 [1,1,0,0,0,0|1,0,0]=3 1997 B7R0.4 O=C(O)C\C=C\CS Amb24693621 [1,1,0,0,0,0|1,0,0]=3 1998 B7R0.4 O=C(O)\C=C/C=N/O Amb27449866 [1,1,0,0,0,0|1,0,1]=4 1999 B7R0.4 O=C(O)\C=C\C#CBr Amb27198995 [1,1,0,0,0,0|0,0,2]=4 2000 B7R0.4 O=C(O)\C=C\C=C\Cl Amb28189602 [1,1,0,0,0,0|0,0,2]=4 2001 B7R0.4 O=C(O)\C=C\CCBr Amb25702661 [1,1,0,0,0,0|0,0,0]=2 2002 B7R0.4 O=C(O)\C=C\CCF Amb33196445 [1,1,0,0,0,0|0,0,0]=2 2003 B7R0.4 O=[N+]([O-])\C=C\CCF Amb33196117 [1,1,0,0,0,0|1,0,1]=4 2004 B7R0.4 OB(O)\C=C\CCF Amb26925510 [1,1,0,0,0,0|1,0,1]=4 2005 B7R0.4 OCC\C=C\B(O)O Amb26996240 [1,1,0,0,0,0|1,0,1]=4 2006 B7R0.5 C=C(C)\C(C)=C\C=O Amb27852094 [1,1,0,0,0,0|0,0,2]=4 2007 B7R0.5 C=C(CCC)C(=O)O Amb18641779 [1,1,0,0,0,0|0,0,1]=3 2008 B7R0.5 C=C(CCF)C(=O)O Amb33480692 [1,1,0,0,0,0|1,0,1]=4 2009 B7R0.5 C=C(CCN)C(=O)O Amb27267272 [1,1,0,0,0,0|1,0,1]=4 2010 B7R0.5 C=C(CCO)C(=O)O Amb27173904 [1,1,0,0,0,0|1,0,1]=4 2011 B7R0.5 C=C(COC)C(=O)O Amb26978134 [1,1,0,0,0,0|1,0,1]=4 2012 B7R0.5 C=C(CSC)C(=O)O Amb26953041 [1,1,0,0,0,0|1,0,1]=4 2013 B7R0.5 C=C(N=C=O)C(C)C Amb27828008 [1,1,0,0,0,0|1,0,1]=4 2014 B7R0.5 C=C(\C=C\C)C(C)=O Amb25712751 [1,1,0,0,0,0|1,0,1]=4 2015 B7R0.5 C=CNC(=O)C(C)C Amb28252471 [1,1,0,0,0,0|2,0,0]=4 2016 B7R0.5 C=COC(=O)C(C)C Amb26422505 [1,1,0,0,0,0|2,0,0]=4 2017 B7R0.5 C=C\C=C(/C)C(C)N Amb28456278 [1,1,0,0,0,0|2,0,0]=4 2018 B7R0.5 C=C\C=C(/Cl)C(=O)O Amb18642910 [1,1,0,0,0,0|0,0,2]=4 2019 B7R0.5 C=C\C=C(\C)C(=O)O Amb27221069 [1,1,0,0,0,0|0,0,2]=4 2020 B7R0.5 CC(=O)\C(C)=C\C=O Amb28208341 [1,1,0,0,0,0|1,0,1]=4 2021 B7R0.5 CC(=O)\C(C)=C\CO Amb27472570 [1,1,0,0,0,0|2,0,0]=4 2022 B7R0.5 CC(C)=C(C)CC=O Amb27625010 [1,1,0,0,0,0|0,0,2]=4 2023 B7R0.5 CC(C)C(=O)C=[N+]=[N-] Amb24557187 [1,1,0,0,0,0|2,0,0]=4 2024 B7R0.5 CC(C)C(=O)CC=O Amb25771325 [1,1,0,0,0,0|0,0,1]=3 2025 B7R0.5 CC(C)C(=O)CCO Amb20669209 [1,1,0,0,0,0|0,0,2]=4 2026 B7R0.5 CC(C)C(=O)N=C=O Amb33547669 [1,1,0,0,0,0|1,0,1]=4 2027 B7R0.5 CC(C)C(=O)NCO Amb27838418 [1,1,0,0,0,0|1,0,1]=4 2028 B7R0.5 CC(C)C(=O)\C=C\Cl Amb34915330 [1,1,0,0,0,0|1,0,0]=3 2029 B7R0.5 CC(C)C(=O)\C=C\N Amb25083174 [1,1,0,0,0,0|1,0,0]=3 2030 B7R0.5 CC(C)C(=O)\C=C\[O-] Amb27837535 [1,1,0,0,0,0|0,0,1]=3 2031 B7R0.5 CC(C)C(=O)\C=N\O Amb28382384 [1,1,0,0,0,0|1,0,0]=3 2032 B7R0.5 CC(C)C(=O)\N=C\S Amb27949045 [1,1,0,0,0,0|1,1,0]=4 2033 B7R0.5 CC(C)C(C)CC=O Amb18641816 [1,1,0,0,0,0|0,0,2]=4 2034 B7R0.5 CC(C)C(C)\C=N\O Amb27184671 [1,1,0,0,0,0|1,0,1]=4 2035 B7R0.5 CC(C)C(Cl)\C=N\O Amb27424666 [1,1,0,0,0,0|1,0,1]=4 2036 B7R0.5 CC(C)C(N)CC=O Amb27628058 [1,1,0,0,0,0|0,0,2]=4 2037 B7R0.5 CC(C)C(O)\C=C\Br Amb27231802 [1,1,0,0,0,0|1,0,1]=4 2038 B7R0.5 CC(C)[C@@H](C)CC=O Amb28388606 [1,1,0,0,0,0|0,0,2]=4 2039 B7R0.5 CC(C)[C@H](N)NC=O Amb28187220 [1,1,0,0,0,0|1,0,1]=4 2040 B7R0.5 CC(C)\C(N)=C/C#N Amb35744437 [1,1,0,0,0,0|1,0,1]=4 2041 B7R0.5 CC(C)\C(N)=C\C#N Amb28423511 [1,1,0,0,0,0|1,0,1]=4 2042 B7R0.5 CC(Cl)C(=O)\C=C\Cl Amb17593817 [1,1,0,0,0,0|2,0,0]=4 2043 B7R0.5 CCCC(=O)C(=O)O Amb22347924 [1,1,0,0,0,0|0,0,1]=3 2044 B7R0.5 CCCC(=O)C(C)=O Amb8517524 [1,1,0,0,0,0|1,0,1]=4 2045 B7R0.5 CCCC(Br)C(=O)O Amb2795765 [1,1,0,0,0,0|0,0,2]=4 2046 B7R0.5 CCCC(C)C(=O)O Amb3938958 [1,1,0,0,0,0|0,0,2]=4 2047 B7R0.5 CCCC(Cl)C(=O)O Amb17593470 [1,1,0,0,0,0|0,0,2]=4 2048 B7R0.5 CCCC(F)C(=O)O Amb25842008 [1,1,0,0,0,0|0,0,2]=4 2049 B7R0.5 CCCC(N)C(=O)O Amb6262055 [1,1,0,0,0,0|0,0,2]=4 2050 B7R0.5 CCCC(O)C(=O)O Amb2818222 [1,1,0,0,0,0|0,0,2]=4 2051 B7R0.5 CCCC(S)C(=O)O Amb18124440 [1,1,0,0,0,0|0,0,2]=4 2052 B7R0.5 CCC[C@@H](C)C(=O)O Amb10844028 [1,1,0,0,0,0|0,0,2]=4 2053 B7R0.5 CCC[C@@H](Cl)C(=O)O Amb27266071 [1,1,0,0,0,0|0,0,2]=4 2054 B7R0.5 CCC[C@@H](N)C(=O)O Amb8514700 [1,1,0,0,0,0|0,0,2]=4 2055 B7R0.5 CCC[C@@H](O)C(=O)O Amb22746731 [1,1,0,0,0,0|0,0,2]=4 2056 B7R0.5 CCC[C@H](Br)C(=O)O Amb26515784 [1,1,0,0,0,0|0,0,2]=4 2057 B7R0.5 CCC[C@H](C)C(=O)O Amb10844037 [1,1,0,0,0,0|0,0,2]=4 2058 B7R0.5 CCC[C@H](Cl)C(=O)O Amb27801931 [1,1,0,0,0,0|0,0,2]=4 2059 B7R0.5 CCC[C@H](N)C(=O)O Amb30647420 [1,1,0,0,0,0|0,0,2]=4 2060 B7R0.5 CCC[C@H](N)C(=O)O Amb8514701 [1,1,0,0,0,0|0,0,2]=4 2061 B7R0.5 CCC[C@H](O)C(=O)O Amb22226514 [1,1,0,0,0,0|0,0,2]=4 2062 B7R0.5 CCC[C@H](S)C(=O)O Amb28045752 [1,1,0,0,0,0|0,0,2]=4 2063 B7R0.5 CCNC(=O)C(=O)O Amb9303800 [1,1,0,0,0,0|1,0,0]=3 2064 B7R0.5 CCNC(=O)C(C)=O Amb17399798 [1,1,0,0,0,0|2,0,0]=4 2065 B7R0.5 CCNC(=O)C(N)=O Amb27969146 [1,1,0,0,0,0|2,0,0]=4 2066 B7R0.5 CCNC(C)C(=O)O Amb33527634 [1,1,0,0,0,0|1,0,1]=4 2067 B7R0.5 CCNC(C)C(=O)O Amb9326962 [1,1,0,0,0,0|1,0,1]=4 2068 B7R0.5 CCNC(O)C(=O)O Amb27259098 [1,1,0,0,0,0|1,0,1]=4 2069 B7R0.5 CCN[C@@H](C)C(=O)O Amb26579594 [1,1,0,0,0,0|1,0,1]=4 2070 B7R0.5 CCN[C@H](C)C(=O)O Amb24351099 [1,1,0,0,0,0|1,0,1]=4 2071 B7R0.5 CCOC(=O)C(=O)Cl Amb932808 [1,1,0,0,0,0|2,0,0]=4 2072 B7R0.5 CCOC(=O)C(=O)O Amb16192090 [1,1,0,0,0,0|1,0,0]=3 2073 B7R0.5 CCOC(=O)C(=O)[O-] Amb16192061 [1,1,0,0,0,0|1,0,1]=4 2074 B7R0.5 CCOC(=O)C(C)=O Amb2793051 [1,1,0,0,0,0|2,0,0]=4 2075 B7R0.5 CCOC(=O)C(N)=O Amb3886540 [1,1,0,0,0,0|2,0,0]=4 2076 B7R0.5 CCOC(=S)C(N)=O Amb10604171 [1,1,0,0,0,0|2,0,0]=4 2077 B7R0.5 CCOC(C)C(=O)O Amb9725271 [1,1,0,0,0,0|1,0,1]=4 2078 B7R0.5 CCOC(F)C(=O)O Amb27210743 [1,1,0,0,0,0|1,0,1]=4 2079 B7R0.5 CCSC(=O)C(=O)O Amb28410577 [1,1,0,0,0,0|1,0,0]=3 2080 B7R0.5 CCSC(=O)C(C)=O Amb27972957 [1,1,0,0,0,0|2,0,0]=4 2081 B7R0.5 CCSC(C)C(=O)O Amb9721554 [1,1,0,0,0,0|1,0,1]=4 2082 B7R0.5 CC\C=C(/C)C(=O)O Amb2689584 [1,1,0,0,0,0|0,0,0]=2 2083 B7R0.5 CC\C=C(/C)C(C)C Amb4016284 [1,1,0,0,0,0|1,0,1]=4 2084 B7R0.5 CC\C=C(/C)C(C)O Amb27761819 [1,1,0,0,0,0|1,0,1]=4 2085 B7R0.5 CC\C=C(/C)C(N)=O Amb27985331 [1,1,0,0,0,0|1,0,0]=3 2086 B7R0.5 CC\C=C(/Cl)C(C)=O Amb27199134 [1,1,0,0,0,0|1,0,0]=3 2087 B7R0.5 CC\C=C(/F)C(=O)O Amb27968785 [1,1,0,0,0,0|0,0,0]=2 2088 B7R0.5 CC\C=C(\C)C(=O)O Amb27233430 [1,1,0,0,0,0|0,0,0]=2 2089 B7R0.5 CC\C=C(\C)[C@@H](C)O Amb27484789 [1,1,0,0,0,0|1,0,1]=4 2090 B7R0.5 CC\C=C(\Cl)C(C)=O Amb27486079 [1,1,0,0,0,0|1,0,0]=3 2091 B7R0.5 CN(C)C(=O)NC=O Amb27391650 [1,1,0,0,0,0|2,0,0]=4 2092 B7R0.5 CN(C)C(=S)CC=O Amb27974853 [1,1,0,0,0,0|1,0,1]=4 2093 B7R0.5 CN(C)\C(O)=C\C=O Amb27830087 [1,1,0,0,0,0|1,0,0]=3 2094 B7R0.5 CN\C=C(/C)C(N)=O Amb27235593 [1,1,0,0,0,0|2,0,0]=4 2095 B7R0.5 CN\C=C(\C)C(C)=O Amb24640763 [1,1,0,0,0,0|2,0,0]=4 2096 B7R0.5 CN\C=C(\C)C(N)=O Amb28199153 [1,1,0,0,0,0|2,0,0]=4 2097 B7R0.5 CN\N=C(/C)C(=O)O Amb27489531 [1,1,0,0,0,0|2,0,0]=4 2098 B7R0.5 CO\C=C(/C)C(=O)O Amb18641867 [1,1,0,0,0,0|1,0,0]=3 2099 B7R0.5 CO\C=C(/F)C(=O)Cl Amb22641619 [1,1,0,0,0,0|2,0,0]=4 2100 B7R0.5 CO\C=C(/F)C(=O)O Amb28369284 [1,1,0,0,0,0|1,0,0]=3 2101 B7R0.5 CO\C=C(/F)C(C)=O Amb26343815 [1,1,0,0,0,0|2,0,0]=4 2102 B7R0.5 CO\C=C(/O)C(C)=O Amb27423656 [1,1,0,0,0,0|2,0,0]=4 2103 B7R0.5 CO\C=C(\C)C(C)=O Amb26391054 [1,1,0,0,0,0|2,0,0]=4 2104 B7R0.5 CO\C=C(\Cl)C(C)=O Amb27427743 [1,1,0,0,0,0|2,0,0]=4 2105 B7R0.5 CO\C=C(\F)C(=O)O Amb22641708 [1,1,0,0,0,0|1,0,0]=3 2106 B7R0.5 CO\C=C(\F)C(C)=O Amb27191747 [1,1,0,0,0,0|2,0,0]=4 2107 B7R0.5 CO\C=C(\I)C(=O)O Amb27228187 [1,1,0,0,0,0|1,0,0]=3 2108 B7R0.5 CO\C=C(\N)C(=O)O Amb27390812 [1,1,0,0,0,0|1,0,0]=3 2109 B7R0.5 CO\C=C(\O)C(C)=O Amb27435154 [1,1,0,0,0,0|2,0,0]=4 2110 B7R0.5 CO\N=C(/C)C(=O)O Amb28203933 [1,1,0,0,0,0|2,0,0]=4 2111 B7R0.5 CS\C=C(/C)C(C)=O Amb24481401 [1,1,0,0,0,0|2,0,0]=4 2112 B7R0.5 C[N+](C)=C(Cl)\C=C\O Amb28065177 [1,1,0,0,0,0|1,0,0]=3 2113 B7R0.5 C\C(=C/C=O)C(=O)O Amb27165186 [1,1,0,0,0,0|1,0,1]=4 2114 B7R0.5 C\C(=C/C=O)C(C)C Amb18641697 [1,1,0,0,0,0|0,0,0]=2 2115 B7R0.5 C\C(=C/C=O)C(Cl)Cl Amb27802410 [1,1,0,0,0,0|2,0,0]=4 2116 B7R0.5 C\C(=C/CCl)C(=O)O Amb25844891 [1,1,0,0,0,0|1,0,0]=3 2117 B7R0.5 C\C(=C/CCl)C(C)C Amb27408079 [1,1,0,0,0,0|1,0,1]=4 2118 B7R0.5 C\C(=C/CN)C(=O)O Amb25845292 [1,1,0,0,0,0|1,0,0]=3 2119 B7R0.5 C\C(=C/CN)C(C)C Amb28045473 [1,1,0,0,0,0|1,0,1]=4 2120 B7R0.5 C\C(=C/CN)C(N)=O Amb30030310 [1,1,0,0,0,0|2,0,0]=4 2121 B7R0.5 C\C(=C/CO)C(C)C Amb25662075 [1,1,0,0,0,0|0,0,1]=3 2122 B7R0.5 C\C(=C/CO)[C@@H](C)O Amb27255232 [1,1,0,0,0,0|1,0,1]=4 2123 B7R0.5 C\C(=C/CS)C(=O)O Amb28041309 [1,1,0,0,0,0|1,0,0]=3 2124 B7R0.5 C\C(=C\C=O)C(C)C Amb27872238 [1,1,0,0,0,0|0,0,0]=2 2125 B7R0.5 C\C=C\C(=O)C(C)C Amb25718415 [1,1,0,0,0,0|1,0,0]=3 2126 B7R0.5 C\C=C\C(=O)N(C)C Amb28058173 [1,1,0,0,0,0|2,0,0]=4 2127 B7R0.5 C\C=C\C(Br)C(=O)O Amb27451575 [1,1,0,0,0,0|0,0,2]=4 2128 B7R0.5 C\C=C\C(Br)C(C)C Amb24333001 [1,1,0,0,0,0|1,0,1]=4 2129 B7R0.5 C\C=C\C(N)C(C)C Amb24473868 [1,1,0,0,0,0|1,0,1]=4 2130 B7R0.5 C\C=C\C(O)C(=O)O Amb30585115 [1,1,0,0,0,0|0,0,2]=4 2131 B7R0.5 C\C=C\C(O)C(C)C Amb22231665 [1,1,0,0,0,0|1,0,1]=4 2132 B7R0.5 C\C=C\[C@@H](N)C(=O)O Amb27948524 [1,1,0,0,0,0|0,0,2]=4 2133 B7R0.5 C\C=C\[C@@H](O)C(=O)O Amb28368832 [1,1,0,0,0,0|0,0,2]=4 2134 B7R0.5 C\C=C\[C@H](O)C(=O)O Amb27162651 [1,1,0,0,0,0|0,0,2]=4 2135 B7R0.5 C\N=C\C(=O)C(C)C Amb28048921 [1,1,0,0,0,0|2,0,0]=4 2136 B7R0.5 NC\C=C(/F)C(=O)O Amb33802627 [1,1,0,0,0,0|1,0,0]=3 2137 B7R0.5 NC\C=C(\F)C(=O)O Amb28340962 [1,1,0,0,0,0|1,0,0]=3 2138 B7R0.5 O=C(O)C(=O)CCF Amb33377241 [1,1,0,0,0,0|1,0,1]=4 2139 B7R0.5 O=C(O)C(=O)CCO Amb25677024 [1,1,0,0,0,0|1,0,1]=4 2140 B7R0.5 O=C(O)\C(Br)=C\CO Amb28291530 [1,1,0,0,0,0|1,0,0]=3 2141 B7R0.5 O=C(O)\C(Cl)=C\CBr Amb27875077 [1,1,0,0,0,0|1,0,0]=3 2142 B7R0.5 O=C\C=C(/Br)C(=O)O Amb28320595 [1,1,0,0,0,0|1,0,1]=4 2143 B7R0.5 O=C\C=C(/Cl)C(=O)O Amb27784434 [1,1,0,0,0,0|1,0,1]=4 2144 B7R0.8 C=C\C=C\C(C)(C)C Amb26394419 [1,1,0,0,0,0|1,0,0]=3 2145 B7R0.8 C=C\C=C\C(C)(C)O Amb27603756 [1,1,0,0,0,0|1,0,0]=3 2146 B7R0.8 C=C\C=C\[Si](C)(C)C Amb27185884 [1,1,0,0,0,0|1,1,0]=4 2147 B7R0.8 CC(C)(C)C#CC=O Amb17593130 [1,1,0,0,0,0|0,0,2]=4 2148 B7R0.8 CC(C)(C)CCC=O Amb18641814 [1,1,0,0,0,0|0,0,2]=4 2149 B7R0.8 CC(C)(C)C\C=C/Br Amb28206708 [1,1,0,0,0,0|1,0,1]=4 2150 B7R0.8 CC(C)(C)N\C=N\O Amb27838388 [1,1,0,0,0,0|2,0,0]=4 2151 B7R0.8 CC(C)(C)O\C=C\Br Amb27185981 [1,1,0,0,0,0|2,0,0]=4 2152 B7R0.8 CC(C)(C)S\C=C\Br Amb27407092 [1,1,0,0,0,0|2,0,0]=4 2153 B7R0.8 CC(C)(C)S\C=C\Cl Amb27433655 [1,1,0,0,0,0|2,0,0]=4 2154 B7R0.8 CC(C)(C)\C=C\C=O Amb18641695 [1,1,0,0,0,0|0,0,0]=2 2155 B7R0.8 CC(C)(C)\C=C\CBr Amb24483079 [1,1,0,0,0,0|1,0,1]=4 2156 B7R0.8 CC(C)(C)\C=C\CN Amb26515728 [1,1,0,0,0,0|1,0,1]=4 2157 B7R0.8 CC(C)(C)\C=C\CO Amb33136404 [1,1,0,0,0,0|0,0,1]=3 2158 B7R0.8 CC(C)(F)CCC=O Amb25223234 [1,1,0,0,0,0|0,0,2]=4 2159 B7R0.8 CC(C)(F)\C=C\C=O Amb33271856 [1,1,0,0,0,0|0,0,0]=2 2160 B7R0.8 CC(C)(F)\C=C\CN Amb33271854 [1,1,0,0,0,0|1,0,1]=4 2161 B7R0.8 CC(C)(F)\C=C\CO Amb33271855 [1,1,0,0,0,0|0,0,1]=3 2162 B7R0.8 CC(C)(N)C#CC=O Amb24657217 [1,1,0,0,0,0|0,0,2]=4 2163 B7R0.8 CC(C)(N)C\C=C\Cl Amb35657862 [1,1,0,0,0,0|1,0,1]=4 2164 B7R0.8 CC(C)(O)C#CC=O Amb25084561 [1,1,0,0,0,0|0,0,2]=4 2165 B7R0.8 CC(C)(O)CNC=O Amb28250027 [1,1,0,0,0,0|1,0,1]=4 2166 B7R0.8 CC(C)(O)\C=C\CCl Amb27205195 [1,1,0,0,0,0|1,0,1]=4 2167 B7R0.8 CC(F)(F)\C=C\C=O Amb33482336 [1,1,0,0,0,0|1,0,0]=3 2168 B7R0.8 CC(F)(F)\C=C\CO Amb32810190 [1,1,0,0,0,0|1,0,1]=4 2169 B7R0.8 CC\C=C/C(C)(C)C Amb4036316 [1,1,0,0,0,0|1,0,1]=4 2170 B7R0.8 CC\C=C\C(C)(C)C Amb4020583 [1,1,0,0,0,0|1,0,1]=4 2171 B7R0.8 CC\C=C\C(C)(C)N Amb33473924 [1,1,0,0,0,0|1,0,1]=4 2172 B7R0.8 CC\C=C\C(C)(C)O Amb33268272 [1,1,0,0,0,0|1,0,1]=4 2173 B7R0.8 CC\C=C\P(=O)(O)O Amb22388769 [1,1,0,0,0,0|1,0,0]=3 2174 B7R0.8 CO\C=C/C(C)(C)C Amb30621744 [1,1,0,0,0,0|2,0,0]=4 2175 B7R0.8 C[Si](C)(C)C\C=C\O Amb24054162 [1,1,0,0,0,0|0,1,1]=4 2176 B7R0.8 C[Si](C)(C)\C=C\CO Amb22169744 [1,1,0,0,0,0|0,1,1]=4 2177 B7R0.8 C\C=C\CC(C)(C)C Amb26516327 [1,1,0,0,0,0|1,0,1]=4 2178 B7R0.8 C\C=C\CC(C)(C)N Amb35653978 [1,1,0,0,0,0|1,0,1]=4 2179 B7R0.8 C\C=C\NC(C)(C)C Amb33868897 [1,1,0,0,0,0|2,0,0]=4 2180 B7R0.8 O=C\C=C\C(F)(F)F Amb33008420 [1,1,0,0,0,0|2,0,0]=4 2181 B7R0.9 CC(=O)CC(C)(C)C Amb4605984 [0,1,0,0,1,0|1,0,1]=4 2182 B7R0.9 CC(=O)CC(C)(C)Cl Amb27861037 [0,1,0,0,1,0|1,0,1]=4 2183 B7R0.9 CC(=O)CC(C)(C)N Amb3940544 [0,1,0,0,1,0|1,0,1]=4 2184 B7R0.9 CC(=O)CC(C)(C)N Amb4136360 [0,1,0,0,1,0|1,0,1]=4 2185 B7R0.9 CC(=O)CC(C)(C)O Amb2721701 [0,1,0,0,1,0|1,0,1]=4 2186 B7R0.9 CC(=O)CC(C)(C)S Amb17593394 [0,1,0,0,1,0|1,0,1]=4 2187 B7R0.9 CC(=O)NC(C)(C)C Amb2721059 [0,1,0,0,1,0|2,0,0]=4 2188 B7R0.9 CC(=O)OC(C)(C)C Amb8386362 [0,1,0,0,1,0|2,0,0]=4 2189 B7R0.9 CC(=O)OC(C)(C)Cl Amb28456284 [0,1,0,0,1,0|2,0,0]=4 2190 B7R0.9 CC(=O)SC(C)(C)C Amb22231459 [0,1,0,0,1,0|2,0,0]=4 2191 B7R0.9 CC(C)(Br)CC(=O)Cl Amb32665504 [0,1,0,0,1,0|1,0,1]=4 2192 B7R0.9 CC(C)(Br)CC(=O)O Amb27400399 [0,1,0,0,1,0|0,0,1]=3 2193 B7R0.9 CC(C)(C)CC(=O)Cl Amb3939309 [0,1,0,0,1,0|1,0,1]=4 2194 B7R0.9 CC(C)(C)CC(=O)O Amb3939865 [0,1,0,0,1,0|0,0,1]=3 2195 B7R0.9 CC(C)(C)CC(N)=O Amb3886534 [0,1,0,0,1,0|1,0,1]=4 2196 B7R0.9 CC(C)(C)NC(N)=O Amb2721329 [0,1,0,0,1,0|2,0,0]=4 2197 B7R0.9 CC(C)(C)OC(=O)Cl Amb6743390 [0,1,0,0,1,0|2,0,0]=4 2198 B7R0.9 CC(C)(C)OC(N)=O Amb2236390 [0,1,0,0,1,0|2,0,0]=4 2199 B7R0.9 CC(C)(C)SC(=O)Cl Amb22353785 [0,1,0,0,1,0|2,0,0]=4 2200 B7R0.9 CC(C)(Cl)CC(=O)O Amb28047719 [0,1,0,0,1,0|0,0,1]=3 2201 B7R0.9 CC(C)(F)CC(=O)O Amb26360155 [0,1,0,0,1,0|0,0,1]=3 2202 B7R0.9 CC(C)(N)C=C(Cl)Cl Amb27878721 [0,1,0,0,1,0|2,0,0]=4 2203 B7R0.9 CC(C)(N)CC(=O)Cl Amb27173472 [0,1,0,0,1,0|1,0,1]=4 2204 B7R0.9 CC(C)(N)CC(=O)O Amb19267108 [0,1,0,0,1,0|0,0,1]=3 2205 B7R0.9 CC(C)(N)CC(=O)O Amb2691269 [0,1,0,0,1,0|0,0,1]=3 2206 B7R0.9 CC(C)(N)CC(=O)O Amb33109875 [0,1,0,0,1,0|0,0,1]=3 2207 B7R0.9 CC(C)(N)CC(N)=O Amb23402094 [0,1,0,0,1,0|1,0,1]=4 2208 B7R0.9 CC(C)(N)CC(N)=O Amb24271090 [0,1,0,0,1,0|1,0,1]=4 2209 B7R0.9 CC(C)(O)CC(=O)O Amb10605560 [0,1,0,0,1,0|0,0,1]=3 2210 B7R0.9 CC(C)(O)CC(=O)[O-] Amb17678748 [0,1,0,0,1,0|0,0,2]=4 2211 B7R0.9 CC(C)(O)CC(=O)[O-] Amb22729769 [0,1,0,0,1,0|0,0,2]=4 2212 B7R0.9 CC(C)(O)CC(N)=O Amb25889946 [0,1,0,0,1,0|1,0,1]=4 2213 B7R0.9 CC(C)(S)CC(=O)O Amb28314250 [0,1,0,0,1,0|0,0,1]=3 2214 B7R0.9 CC(C)=CC(C)(C)Cl Amb26533525 [0,1,0,0,1,0|2,0,0]=4 2215 B7R0.9 CC(C)CS(=O)(=O)O Amb28349282 [0,1,0,0,1,0|1,0,1]=4 2216 B7R0.9 CC(C)NS(=O)(=O)O Amb28385158 [0,1,0,0,1,0|2,0,0]=4 2217 B7R0.9 CC(C)OP(=O)(O)O Amb22493772 [0,1,0,0,1,0|2,0,0]=4 2218 B7R0.9 CC(C)OP(C)(=O)O Amb10842159 [0,1,0,0,1,0|2,0,0]=4 2219 B7R0.9 CC(F)(F)CC(=O)O Amb26018420 [0,1,0,0,1,0|1,0,1]=4 2220 B7R0.9 CC(O)(F)CC(=O)O Amb28072926 [0,1,0,0,1,0|1,0,1]=4 2221 B7R0.9 CC(O)(O)CC(=O)O Amb27405076 [0,1,0,0,1,0|1,0,1]=4 2222 B7R0.9 CP(C)(=O)CC(=O)O Amb25197683 [0,1,0,0,1,0|1,0,1]=4 2223 B7R0.9 CS(C)(=O)=CC(N)=O Amb28397881 [0,1,0,0,1,0|2,0,0]=4 2224 B7R0.9 CS(C)(Cl)CC(=O)O Amb27633859 [0,1,0,0,1,0|1,0,1]=4 2225 B7R0.9 C[N+](C)(C)CC(=O)O Amb3428940 [0,1,0,0,1,0|1,0,1]=4 2226 B7R0.9 C[N+](C)(N)CC(=O)O Amb27242840 [0,1,0,0,1,0|1,0,1]=4 2227 B7R0.9 C[Si](C)(C)CC(=O)O Amb19894126 [0,1,0,0,1,0|0,1,1]=4 2228 B7R0.16 C=C(C(=O)O)C(C)C Amb17593189 [0,1,0,0,1,0|0,0,0]=2 2229 B7R0.16 C=C(C(=O)O)C(C)N Amb27794714 [0,1,0,0,1,0|1,0,0]=3 2230 B7R0.16 C=C(C(=O)O)C(F)F Amb24117234 [0,1,0,0,1,0|2,0,0]=4 2231 B7R0.16 C=C(C(=O)O)N(C)C Amb27162682 [0,1,0,0,1,0|1,0,0]=3 2232 B7R0.16 C=C(C(=O)O)[C@@H](C)N Amb27440248 [0,1,0,0,1,0|1,0,0]=3 2233 B7R0.16 C=C(C(=O)O)[C@H](C)O Amb27410183 [0,1,0,0,1,0|1,0,0]=3 2234 B7R0.16 C=C(C(C)=O)[C@@H](C)O Amb26964906 [0,1,0,0,1,0|2,0,0]=4 2235 B7R0.16 C=C(C(C)=O)[C@H](C)O Amb27424236 [0,1,0,0,1,0|2,0,0]=4 2236 B7R0.16 C=C(C)C(=C)C(=O)O Amb33199524 [0,1,0,0,1,0|0,0,2]=4 2237 B7R0.16 C=C(C)C(=O)C(C)C Amb25353284 [0,1,0,0,1,0|2,0,0]=4 2238 B7R0.16 CC(=O)C(=O)C(=O)O Amb24101563 [0,1,0,0,1,0|1,0,1]=4 2239 B7R0.16 CC(=O)C(=O)C(C)Br Amb24055325 [0,1,0,0,1,0|2,0,0]=4 2240 B7R0.16 CC(=O)C(=O)C(C)C Amb26614542 [0,1,0,0,1,0|1,0,0]=3 2241 B7R0.16 CC(=O)C(=O)N(C)C Amb17399799 [0,1,0,0,1,0|2,0,0]=4 2242 B7R0.16 CC(=O)C(=S)N(C)C Amb27409555 [0,1,0,0,1,0|2,0,0]=4 2243 B7R0.16 CC(=O)C(Br)C(C)C Amb2389580 [0,1,0,0,1,0|1,0,1]=4 2244 B7R0.16 CC(=O)C(C)=C(C)C Amb17593162 [0,1,0,0,1,0|1,0,1]=4 2245 B7R0.16 CC(=O)C(Cl)=C(C)C Amb28048939 [0,1,0,0,1,0|1,0,1]=4 2246 B7R0.16 CC(=O)C(Cl)C(C)C Amb24483197 [0,1,0,0,1,0|1,0,1]=4 2247 B7R0.16 CC(=O)C(N)C(C)C Amb23536905 [0,1,0,0,1,0|1,0,1]=4 2248 B7R0.16 CC(=O)C(O)C(C)C Amb25087800 [0,1,0,0,1,0|1,0,1]=4 2249 B7R0.16 CC(=O)C(S)C(C)C Amb28254219 [0,1,0,0,1,0|1,0,1]=4 2250 B7R0.16 CC(=O)N(C)C(C)C Amb28435200 [0,1,0,0,1,0|2,0,0]=4 2251 B7R0.16 CC(=O)N(N)C(C)C Amb18641904 [0,1,0,0,1,0|2,0,0]=4 2252 B7R0.16 CC(=O)[C@@H](N)C(C)C Amb28410324 [0,1,0,0,1,0|1,0,1]=4 2253 B7R0.16 CC(=O)[C@H](C)C(C)C Amb24753185 [0,1,0,0,1,0|1,0,1]=4 2254 B7R0.16 CC(=O)[C@H](O)C(C)C Amb24379445 [0,1,0,0,1,0|1,0,1]=4 2255 B7R0.16 CC(Br)C(=O)C(=O)O Amb23400913 [0,1,0,0,1,0|1,0,0]=3 2256 B7R0.16 CC(Br)C(Br)C(=O)O Amb4008645 [0,1,0,0,1,0|1,0,1]=4 2257 B7R0.16 CC(C(=O)O)N(C)C Amb21955631 [0,1,0,0,1,0|1,0,1]=4 2258 B7R0.16 CC(C(=O)O)N(C)C Amb6653762 [0,1,0,0,1,0|1,0,1]=4 2259 B7R0.16 CC(C)=C(Br)C(=O)O Amb17594579 [0,1,0,0,1,0|0,0,1]=3 2260 B7R0.16 CC(C)=C(C)C(=O)O Amb17593186 [0,1,0,0,1,0|0,0,1]=3 2261 B7R0.16 CC(C)=C(C)C(C)C Amb22347879 [0,1,0,0,1,0|2,0,0]=4 2262 B7R0.16 CC(C)=C(Cl)C(=O)O Amb18642954 [0,1,0,0,1,0|0,0,1]=3 2263 B7R0.16 CC(C)=C(F)C(=O)O Amb20669103 [0,1,0,0,1,0|0,0,1]=3 2264 B7R0.16 CC(C)C(=N)C(=O)O Amb28073845 [0,1,0,0,1,0|0,0,0]=2 2265 B7R0.16 CC(C)C(=O)C(=O)Cl Amb27843357 [0,1,0,0,1,0|1,0,0]=3 2266 B7R0.16 CC(C)C(=O)C(=O)O Amb6600000 [0,1,0,0,1,0|0,0,0]=2 2267 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8393075 [0,1,0,0,1,0|0,0,1]=3 2268 B7R0.16 CC(C)C(=O)C(=O)[O-] Amb8513875 [0,1,0,0,1,0|0,0,1]=3 2269 B7R0.16 CC(C)C(=O)C(C)O Amb26478614 [0,1,0,0,1,0|1,0,1]=4 2270 B7R0.16 CC(C)C(=O)C(N)=O Amb28119959 [0,1,0,0,1,0|1,0,0]=3 2271 B7R0.16 CC(C)C(=O)N(C)O Amb27963828 [0,1,0,0,1,0|2,0,0]=4 2272 B7R0.16 CC(C)C(=O)[C@H](C)O Amb27985493 [0,1,0,0,1,0|1,0,1]=4 2273 B7R0.16 CC(C)C(=O)[N+](=O)[O-] Amb28049032 [0,1,0,0,1,0|1,0,1]=4 2274 B7R0.16 CC(C)C(Br)C(=O)Cl Amb17569838 [0,1,0,0,1,0|1,0,1]=4 2275 B7R0.16 CC(C)C(Br)C(=O)O Amb9703217 [0,1,0,0,1,0|0,0,1]=3 2276 B7R0.16 CC(C)C(Br)C(N)=O Amb9725771 [0,1,0,0,1,0|1,0,1]=4 2277 B7R0.16 CC(C)C(C)C(=O)Cl Amb27645335 [0,1,0,0,1,0|1,0,1]=4 2278 B7R0.16 CC(C)C(C)C(=O)O Amb17087469 [0,1,0,0,1,0|0,0,1]=3 2279 B7R0.16 CC(C)C(Cl)C(=O)Cl Amb24483174 [0,1,0,0,1,0|1,0,1]=4 2280 B7R0.16 CC(C)C(Cl)C(=O)O Amb6739911 [0,1,0,0,1,0|0,0,1]=3 2281 B7R0.16 CC(C)C(F)C(=O)O Amb19957386 [0,1,0,0,1,0|0,0,1]=3 2282 B7R0.16 CC(C)C(N)C(=O)Cl Amb6740265 [0,1,0,0,1,0|1,0,1]=4 2283 B7R0.16 CC(C)C(N)C(=O)O Amb5718386 [0,1,0,0,1,0|0,0,1]=3 2284 B7R0.16 CC(C)C(N)C(N)=O Amb19267095 [0,1,0,0,1,0|1,0,1]=4 2285 B7R0.16 CC(C)C(N)C(N)=O Amb32666402 [0,1,0,0,1,0|1,0,1]=4 2286 B7R0.16 CC(C)C(N)C(N)=O Amb6271181 [0,1,0,0,1,0|1,0,1]=4 2287 B7R0.16 CC(C)C(O)C(=O)Cl Amb27213311 [0,1,0,0,1,0|1,0,1]=4 2288 B7R0.16 CC(C)C(O)C(=O)O Amb2582547 [0,1,0,0,1,0|0,0,1]=3 2289 B7R0.16 CC(C)C(O)[PH](=O)O Amb27430184 [0,1,0,0,1,0|1,0,1]=4 2290 B7R0.16 CC(C)C(S)C(=O)O Amb18282761 [0,1,0,0,1,0|0,0,1]=3 2291 B7R0.16 CC(C)N(C)C(=O)Cl Amb25807313 [0,1,0,0,1,0|2,0,0]=4 2292 B7R0.16 CC(C)N(O)C(N)=O Amb18202545 [0,1,0,0,1,0|2,0,0]=4 2293 B7R0.16 CC(C)[C@@H](Br)C(=O)O Amb8629113 [0,1,0,0,1,0|0,0,1]=3 2294 B7R0.16 CC(C)[C@@H](C)C(=O)O Amb10844600 [0,1,0,0,1,0|0,0,1]=3 2295 B7R0.16 CC(C)[C@@H](C)C(N)=O Amb27838382 [0,1,0,0,1,0|1,0,1]=4 2296 B7R0.16 CC(C)[C@@H](Cl)C(=O)Cl Amb32658177 [0,1,0,0,1,0|1,0,1]=4 2297 B7R0.16 CC(C)[C@@H](N)C(=O)O Amb2720566 [0,1,0,0,1,0|0,0,1]=3 2298 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb22169898 [0,1,0,0,1,0|1,0,1]=4 2299 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb25132118 [0,1,0,0,1,0|1,0,1]=4 2300 B7R0.16 CC(C)[C@@H](N)C(N)=O Amb4013551 [0,1,0,0,1,0|1,0,1]=4 2301 B7R0.16 CC(C)[C@@H](O)C(=O)O Amb10071589 [0,1,0,0,1,0|0,0,1]=3 2302 B7R0.16 CC(C)[C@@H](O)C(N)=O Amb27879443 [0,1,0,0,1,0|1,0,1]=4 2303 B7R0.16 CC(C)[C@H](Br)C(=O)O Amb8629114 [0,1,0,0,1,0|0,0,1]=3 2304 B7R0.16 CC(C)[C@H](C)C(=O)O Amb10844601 [0,1,0,0,1,0|0,0,1]=3 2305 B7R0.16 CC(C)[C@H](C)C(N)=O Amb28345619 [0,1,0,0,1,0|1,0,1]=4 2306 B7R0.16 CC(C)[C@H](Cl)C(=O)Cl Amb27407011 [0,1,0,0,1,0|1,0,1]=4 2307 B7R0.16 CC(C)[C@H](N)C(=O)O Amb2725465 [0,1,0,0,1,0|0,0,1]=3 2308 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16183986 [0,1,0,0,1,0|1,0,1]=4 2309 B7R0.16 CC(C)[C@H](N)C(N)=O Amb16231400 [0,1,0,0,1,0|1,0,1]=4 2310 B7R0.16 CC(C)[C@H](N)C(N)=O Amb30595108 [0,1,0,0,1,0|1,0,1]=4 2311 B7R0.16 CC(C)[C@H](N)[PH](=O)O Amb27814729 [0,1,0,0,1,0|1,0,1]=4 2312 B7R0.16 CC(C)[C@H](O)C(=O)O Amb2694861 [0,1,0,0,1,0|0,0,1]=3 2313 B7R0.16 CC(Cl)C(C)C(=O)O Amb28325096 [0,1,0,0,1,0|1,0,1]=4 2314 B7R0.16 CC(Cl)C(Cl)C(=O)O Amb28396619 [0,1,0,0,1,0|1,0,1]=4 2315 B7R0.16 CC(F)C(=O)C(=O)O Amb27246511 [0,1,0,0,1,0|1,0,0]=3 2316 B7R0.16 CC(F)C(N)C(=O)O Amb10838661 [0,1,0,0,1,0|1,0,1]=4 2317 B7R0.16 CC(F)C(N)C(=O)O Amb32752736 [0,1,0,0,1,0|1,0,1]=4 2318 B7R0.16 CC(F)[C@@H](N)C(=O)O Amb28316197 [0,1,0,0,1,0|1,0,1]=4 2319 B7R0.16 CC(N)C(C)C(=O)O Amb18124261 [0,1,0,0,1,0|1,0,1]=4 2320 B7R0.16 CC(N)C(C)C(=O)O Amb28934866 [0,1,0,0,1,0|1,0,1]=4 2321 B7R0.16 CC(N)C(F)C(=O)O Amb27411861 [0,1,0,0,1,0|1,0,1]=4 2322 B7R0.16 CC(N)C(N)C(=O)O Amb22728051 [0,1,0,0,1,0|1,0,1]=4 2323 B7R0.16 CC(N)C(O)C(=O)O Amb18641970 [0,1,0,0,1,0|1,0,1]=4 2324 B7R0.16 CC(N)C(O)C(=O)O Amb33299223 [0,1,0,0,1,0|1,0,1]=4 2325 B7R0.16 CC(N)[C@H](N)C(=O)O Amb25083113 [0,1,0,0,1,0|1,0,1]=4 2326 B7R0.16 CC(N)[C@H](N)C(=O)O Amb33740158 [0,1,0,0,1,0|1,0,1]=4 2327 B7R0.16 CC(O)C(=O)C(=O)O Amb24481396 [0,1,0,0,1,0|1,0,0]=3 2328 B7R0.16 CC(O)C(Br)C(=O)O Amb17594710 [0,1,0,0,1,0|1,0,1]=4 2329 B7R0.16 CC(O)C(C)C(=O)O Amb17615515 [0,1,0,0,1,0|1,0,1]=4 2330 B7R0.16 CC(O)C(Cl)C(=O)O Amb17593522 [0,1,0,0,1,0|1,0,1]=4 2331 B7R0.16 CC(O)C(F)C(=O)O Amb33544667 [0,1,0,0,1,0|1,0,1]=4 2332 B7R0.16 CC(O)C(N)C(=O)O Amb32665460 [0,1,0,0,1,0|1,0,1]=4 2333 B7R0.16 CC(O)C(N)C(=O)O Amb9703096 [0,1,0,0,1,0|1,0,1]=4 2334 B7R0.16 CC(O)C(O)C(=O)O Amb18124272 [0,1,0,0,1,0|1,0,1]=4 2335 B7R0.16 CC(S)C(=O)C(=O)O Amb28128312 [0,1,0,0,1,0|1,0,0]=3 2336 B7R0.16 CC(S)C(N)C(=O)O Amb17593434 [0,1,0,0,1,0|1,0,1]=4 2337 B7R0.16 CC(S)[C@@H](N)C(=O)O Amb24606864 [0,1,0,0,1,0|1,0,1]=4 2338 B7R0.16 CN(C)C(=N)C(=O)O Amb18641880 [0,1,0,0,1,0|1,0,0]=3 2339 B7R0.16 CN(C)C(=O)C(=O)O Amb2691325 [0,1,0,0,1,0|1,0,0]=3 2340 B7R0.16 CN(C)C(O)C(=O)O Amb28399618 [0,1,0,0,1,0|1,0,1]=4 2341 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb22587534 [0,1,0,0,1,0|1,0,1]=4 2342 B7R0.16 C[C@@H](C(=O)O)N(C)C Amb28934882 [0,1,0,0,1,0|1,0,1]=4 2343 B7R0.16 C[C@@H](Cl)[C@@H](Cl)C(=O)O Amb28343001 [0,1,0,0,1,0|1,0,1]=4 2344 B7R0.16 C[C@@H](Cl)[C@H](Cl)C(=O)O Amb28283911 [0,1,0,0,1,0|1,0,1]=4 2345 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb28286576 [0,1,0,0,1,0|1,0,1]=4 2346 B7R0.16 C[C@@H](F)[C@@H](N)C(=O)O Amb32668519 [0,1,0,0,1,0|1,0,1]=4 2347 B7R0.16 C[C@@H](N)[C@@H](C)C(=O)O Amb25679842 [0,1,0,0,1,0|1,0,1]=4 2348 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb22745441 [0,1,0,0,1,0|1,0,1]=4 2349 B7R0.16 C[C@@H](N)[C@H](N)C(=O)O Amb24481409 [0,1,0,0,1,0|1,0,1]=4 2350 B7R0.16 C[C@@H](O)C(N)C(=O)O Amb26397429 [0,1,0,0,1,0|1,0,1]=4 2351 B7R0.16 C[C@@H](O)[C@@H](Cl)C(=O)O Amb27489415 [0,1,0,0,1,0|1,0,1]=4 2352 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O Amb8514159 [0,1,0,0,1,0|1,0,1]=4 2353 B7R0.16 C[C@@H](O)[C@@H](O)C(=O)O Amb27812084 [0,1,0,0,1,0|1,0,1]=4 2354 B7R0.16 C[C@@H](O)[C@H](Cl)C(=O)O Amb27188843 [0,1,0,0,1,0|1,0,1]=4 2355 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb22351168 [0,1,0,0,1,0|1,0,1]=4 2356 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb33623705 [0,1,0,0,1,0|1,0,1]=4 2357 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O Amb6599999 [0,1,0,0,1,0|1,0,1]=4 2358 B7R0.16 C[C@@H](S)[C@H](N)C(=O)O Amb24117242 [0,1,0,0,1,0|1,0,1]=4 2359 B7R0.16 C[C@H](C(=O)O)N(C)C Amb22586633 [0,1,0,0,1,0|1,0,1]=4 2360 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O Amb10844572 [0,1,0,0,1,0|1,0,1]=4 2361 B7R0.16 C[C@H](Cl)[C@H](Cl)C(=O)O Amb27955873 [0,1,0,0,1,0|1,0,1]=4 2362 B7R0.16 C[C@H](N)[C@@H](C)C(=O)O Amb26887656 [0,1,0,0,1,0|1,0,1]=4 2363 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O Amb27751951 [0,1,0,0,1,0|1,0,1]=4 2364 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb17678797 [0,1,0,0,1,0|1,0,1]=4 2365 B7R0.16 C[C@H](N)[C@H](N)C(=O)O Amb26887696 [0,1,0,0,1,0|1,0,1]=4 2366 B7R0.16 C[C@H](O)[C@@H](Br)C(=O)O Amb27476235 [0,1,0,0,1,0|1,0,1]=4 2367 B7R0.16 C[C@H](O)[C@@H](F)C(=O)O Amb27837922 [0,1,0,0,1,0|1,0,1]=4 2368 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O Amb6297293 [0,1,0,0,1,0|1,0,1]=4 2369 B7R0.16 C[C@H](O)[C@@H](O)C(=O)O Amb25844932 [0,1,0,0,1,0|1,0,1]=4 2370 B7R0.16 C[C@H](O)[C@H](Br)C(=O)O Amb27409077 [0,1,0,0,1,0|1,0,1]=4 2371 B7R0.16 C[C@H](O)[C@H](C)C(=O)O Amb27440373 [0,1,0,0,1,0|1,0,1]=4 2372 B7R0.16 C[C@H](O)[C@H](Cl)C(=O)O Amb27410667 [0,1,0,0,1,0|1,0,1]=4 2373 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb32663639 [0,1,0,0,1,0|1,0,1]=4 2374 B7R0.16 C[C@H](O)[C@H](N)C(=O)O Amb8514158 [0,1,0,0,1,0|1,0,1]=4 2375 B7R0.16 C[C@H](O)[C@H](O)C(=O)O Amb27831803 [0,1,0,0,1,0|1,0,1]=4 2376 B7R0.16 C\C(Br)=C(/C)C(=O)O Amb2611697 [0,1,0,0,1,0|1,0,1]=4 2377 B7R0.16 C\C(O)=C(\N)C(=O)O Amb27191761 [0,1,0,0,1,0|1,0,1]=4 2378 B7R0.16 C\C(O)=C(\O)C(=O)O Amb28282804 [0,1,0,0,1,0|1,0,1]=4 2379 B7R0.16 C\C(O)=C(\O)C(C)O Amb25227909 [0,1,0,0,1,0|2,0,0]=4 2380 B7R0.16 C\C(O)=C(\O)[C@@H](C)O Amb27862909 [0,1,0,0,1,0|2,0,0]=4 2381 B7R0.16 O=C(O)C(=O)C(Br)Br Amb24179214 [0,1,0,0,1,0|2,0,0]=4 2382 B7R0.16 O=C(O)C(=O)C(Cl)Br Amb27830042 [0,1,0,0,1,0|2,0,0]=4 2383 B9R0.1 C#CC(C)N\C=C\C(=O)O Amb28076159 [0,1,0,0,0,1|0,0,1]=3 2384 B9R0.1 CC(=O)O\C=C/[C@H](C)C=O Amb28049875 [0,1,0,0,0,1|1,0,1]=4 2385 B9R0.1 CC(=O)O\C=C\[C@H](C)C=O Amb27432554 [0,1,0,0,0,1|1,0,1]=4 2386 B9R0.1 CC(=O)\C=C\C=C(/C)CBr Amb28057200 [0,1,0,0,0,1|1,0,1]=4 2387 B9R0.1 CC(C#N)C\C=C\C(=O)O Amb24670837 [0,1,0,0,0,1|0,0,1]=3 2388 B9R0.1 CC(C)=CC\C=C(/C)CO Amb27480674 [0,1,0,0,0,1|1,0,1]=4 2389 B9R0.1 CC(C)=C\C=C\C(C)CO Amb27588854 [0,1,0,0,0,1|2,0,0]=4 2390 B9R0.1 CC(C)C=C=C[C@@H](C)CO Amb27826387 [0,1,0,0,0,1|1,0,1]=4 2391 B9R0.1 CC(C)CCCC(=O)CO Amb26467261 [0,1,0,0,0,1|0,0,2]=4 2392 B9R0.1 CC(C)CCNC(=O)CO Amb9421652 [0,1,0,0,0,1|0,0,2]=4 2393 B9R0.1 CC(C)CCOC(=O)CO Amb27626229 [0,1,0,0,0,1|0,0,2]=4 2394 B9R0.1 CC(C)C\C=C\[C@@H](C)C=O Amb27458412 [0,1,0,0,0,1|1,0,1]=4 2395 B9R0.1 CC(C)NCCC(=O)NO Amb27948303 [0,1,0,0,0,1|0,0,2]=4 2396 B9R0.1 CC(CN)CCCC(=O)O Amb27592530 [0,1,0,0,0,1|0,0,2]=4 2397 B9R0.1 CC(CN)CSCC(=O)O Amb27639745 [0,1,0,0,0,1|0,0,2]=4 2398 B9R0.1 CC(CN)OCCC(=O)O Amb18629690 [0,1,0,0,0,1|0,0,2]=4 2399 B9R0.1 CC(CN)SCCC(=O)O Amb27425055 [0,1,0,0,0,1|0,0,2]=4 2400 B9R0.1 CC(CO)CNCC(=O)O Amb28246419 [0,1,0,0,0,1|0,0,2]=4 2401 B9R0.1 CC(CO)COCC(=O)O Amb28280816 [0,1,0,0,0,1|0,0,2]=4 2402 B9R0.1 CC(CO)CSCC(=O)O Amb28365901 [0,1,0,0,0,1|0,0,2]=4 2403 B9R0.1 CC(CO)N\C=C\C(=O)O Amb27776997 [0,1,0,0,0,1|0,0,0]=2 2404 B9R0.1 CCC(=O)O\C=C\C(C)O Amb28289046 [0,1,0,0,0,1|2,0,0]=4 2405 B9R0.1 CCC(=O)O\C=C\[C@@H](C)O Amb28292187 [0,1,0,0,0,1|2,0,0]=4 2406 B9R0.1 CCC(=O)\C=C\C=C(C)C Amb25735248 [0,1,0,0,0,1|1,0,1]=4 2407 B9R0.1 CCC(C)CC#CC(=O)O Amb24661749 [0,1,0,0,0,1|0,0,2]=4 2408 B9R0.1 CCC(C)CCCC(=O)O Amb18124682 [0,1,0,0,0,1|0,0,2]=4 2409 B9R0.1 CCC(C)COCC(=O)O Amb28368866 [0,1,0,0,0,1|0,0,2]=4 2410 B9R0.1 CCC(C)OCCC(=O)O Amb27947378 [0,1,0,0,0,1|0,0,2]=4 2411 B9R0.1 CCN(C)C\C=C\C(=O)O Amb19020698 [0,1,0,0,0,1|1,0,0]=3 2412 B9R0.1 CCN(C)C\C=C\C(N)=O Amb26458649 [0,1,0,0,0,1|2,0,0]=4 2413 B9R0.1 CCN(O)C\C=C\C(=O)O Amb27784415 [0,1,0,0,0,1|2,0,0]=4 2414 B9R0.1 CC[C@H](C)CCCC(=O)O Amb28313011 [0,1,0,0,0,1|0,0,2]=4 2415 B9R0.1 CC[C@H](C)C\C=C/C(=O)O Amb27779551 [0,1,0,0,0,1|0,0,0]=2 2416 B9R0.1 CC\C(C)=C\CCC(=O)O Amb27474810 [0,1,0,0,0,1|0,0,2]=4 2417 B9R0.1 CNC(=O)O\N=C\C(C)C Amb27842001 [0,1,0,0,0,1|2,0,0]=4 2418 B9R0.1 CNC(=O)\C=C\CN(C)C Amb28315992 [0,1,0,0,0,1|2,0,0]=4 2419 B9R0.1 CNC(=S)S\C=C/C(=O)O Amb28396514 [0,1,0,0,0,1|1,0,1]=4 2420 B9R0.1 COC(=O)C#CCC(C)C Amb25915710 [0,1,0,0,0,1|0,0,2]=4 2421 B9R0.1 COC(=O)CCNC(C)C Amb9203616 [0,1,0,0,0,1|0,0,2]=4 2422 B9R0.1 COC(=O)CCOC(C)C Amb9206383 [0,1,0,0,0,1|0,0,2]=4 2423 B9R0.1 COC(=O)CNCC(C)C Amb6686983 [0,1,0,0,0,1|0,0,2]=4 2424 B9R0.1 COC(=O)COCC(C)C Amb9206382 [0,1,0,0,0,1|0,0,2]=4 2425 B9R0.1 COC(=O)CSCC(C)C Amb839626 [0,1,0,0,0,1|0,0,2]=4 2426 B9R0.1 COC(=O)C\C=C\C(C)=O Amb25205440 [0,1,0,0,0,1|1,0,1]=4 2427 B9R0.1 COC(=O)C\C=C\C(C)O Amb27756374 [0,1,0,0,0,1|1,0,0]=3 2428 B9R0.1 COC(=O)C\C=C\[C@@H](C)O Amb28321357 [0,1,0,0,0,1|1,0,0]=3 2429 B9R0.1 COC(=O)N\C=C/C(C)=O Amb27627638 [0,1,0,0,0,1|1,0,1]=4 2430 B9R0.1 COC(=O)N\N=C\N(C)C Amb28063793 [0,1,0,0,0,1|2,0,0]=4 2431 B9R0.1 COC(=O)OCCC(C)C Amb27777595 [0,1,0,0,0,1|0,0,2]=4 2432 B9R0.1 COC(=O)\C=C/CC(C)C Amb10071548 [0,1,0,0,0,1|0,0,0]=2 2433 B9R0.1 COC(=O)\C=C/NC(C)=O Amb28067616 [0,1,0,0,0,1|1,0,1]=4 2434 B9R0.1 COC(=O)\C=C\CC(C)C Amb2689517 [0,1,0,0,0,1|0,0,0]=2 2435 B9R0.1 COC(=O)\C=C\CC(C)C Amb33714772 [0,1,0,0,0,1|0,0,0]=2 2436 B9R0.1 COC(=O)\C=C\CN(C)C Amb17612878 [0,1,0,0,0,1|1,0,0]=3 2437 B9R0.1 COC(=O)\C=C\CN(C)O Amb28349189 [0,1,0,0,0,1|2,0,0]=4 2438 B9R0.1 COC(=O)\C=C\SC(C)C Amb27197412 [0,1,0,0,0,1|0,0,0]=2 2439 B9R0.1 COC(C)\C=N\NC(C)=O Amb27750727 [0,1,0,0,0,1|2,0,0]=4 2440 B9R0.1 CSC(C)\C=C/CC(=O)O Amb28121047 [0,1,0,0,0,1|0,0,0]=2 2441 B9R0.1 CSC(C)\C=C\CC(=O)O Amb18645413 [0,1,0,0,0,1|0,0,0]=2 2442 B9R0.1 C\C(=C\C=C\C(=O)O)CO Amb27975896 [0,1,0,0,0,1|0,0,1]=3 2443 B9R0.1 C\C(C=O)=C/COC(C)C Amb28398385 [0,1,0,0,0,1|1,0,1]=4 2444 B9R0.1 C\C(C=O)=C\COC(C)C Amb28052700 [0,1,0,0,0,1|1,0,1]=4 2445 B9R0.1 O=C(O)\C=C\NC(=O)CCl Amb27494076 [0,1,0,0,0,1|1,0,1]=4 2446 B9R0.7 C=C(C)\C=C\C(O)C(C)C Amb27588917 [0,1,0,0,0,1|2,0,0]=4 2447 B9R0.7 C=C(CCC(=O)O)C(C)C Amb28050060 [0,1,0,0,0,1|0,0,1]=3 2448 B9R0.7 C=C(CCN(C)C)C(=O)O Amb28903893 [0,1,0,0,0,1|1,0,1]=4 2449 B9R0.7 C=C(CCN(C)C)C(=O)O Amb32667385 [0,1,0,0,0,1|1,0,1]=4 2450 B9R0.7 C=C(COC(C)C)C(=O)O Amb25958768 [0,1,0,0,0,1|0,0,1]=3 2451 B9R0.7 C=C(OCC(C)C)C(=O)Cl Amb27233166 [0,1,0,0,0,1|1,0,1]=4 2452 B9R0.7 CC(=O)C(=O)NCC(C)C Amb17399879 [0,1,0,0,0,1|1,0,1]=4 2453 B9R0.7 CC(=O)C(=O)OCC(C)C Amb28254557 [0,1,0,0,0,1|1,0,1]=4 2454 B9R0.7 CC(=O)C(=O)\C=C\C(=O)O Amb27803733 [0,1,0,0,0,1|1,0,1]=4 2455 B9R0.7 CC(=O)C(=O)\C=C\N(C)C Amb33291070 [0,1,0,0,0,1|2,0,0]=4 2456 B9R0.7 CC(=O)CCC(=O)C(C)C Amb19515553 [0,1,0,0,0,1|1,0,1]=4 2457 B9R0.7 CC(=O)COC(=O)C(C)C Amb27198382 [0,1,0,0,0,1|1,0,1]=4 2458 B9R0.7 CC(=O)C\C=C(/C)C(C)C Amb24725292 [0,1,0,0,0,1|1,0,0]=3 2459 B9R0.7 CC(=O)C\C=C(\C)C(C)C Amb24408897 [0,1,0,0,0,1|1,0,0]=3 2460 B9R0.7 CC(=O)OCC(=O)C(C)C Amb24456861 [0,1,0,0,0,1|1,0,1]=4 2461 B9R0.7 CC(=O)O\C=C(\F)C(=O)O Amb27236545 [0,1,0,0,0,1|1,0,1]=4 2462 B9R0.7 CC(=O)SCC(=O)C(C)C Amb27858864 [0,1,0,0,0,1|1,0,1]=4 2463 B9R0.7 CC(=O)\C=C\C(=O)N(C)C Amb24415333 [0,1,0,0,0,1|2,0,0]=4 2464 B9R0.7 CC(=O)\C=C\C(C)=C(C)C Amb26841996 [0,1,0,0,0,1|1,0,1]=4 2465 B9R0.7 CC(=O)\C=C\C(F)=C(C)C Amb27490297 [0,1,0,0,0,1|1,0,1]=4 2466 B9R0.7 CC(=O)\C=C\[C@H](C)C(C)C Amb27859468 [0,1,0,0,0,1|1,0,0]=3 2467 B9R0.7 CC(Br)C(=O)NCC(=O)O Amb4015128 [0,1,0,0,0,1|1,0,1]=4 2468 B9R0.7 CC(Br)C(Br)\C=C\C(=O)O Amb22347457 [0,1,0,0,0,1|1,0,0]=3 2469 B9R0.7 CC(C)=C(C)\C=C\C(=O)O Amb18643593 [0,1,0,0,0,1|0,0,1]=3 2470 B9R0.7 CC(C)=CCC(C)C(=O)O Amb18643879 [0,1,0,0,0,1|0,0,2]=4 2471 B9R0.7 CC(C)=CCC(N)C(=O)O Amb6276273 [0,1,0,0,0,1|0,0,2]=4 2472 B9R0.7 CC(C)=CC[C@@H](N)C(=O)O Amb27254062 [0,1,0,0,0,1|0,0,2]=4 2473 B9R0.7 CC(C)=CC[C@H](N)C(=O)O Amb25836895 [0,1,0,0,0,1|0,0,2]=4 2474 B9R0.7 CC(C)=C\C=C(/C)C(=O)O Amb27210759 [0,1,0,0,0,1|0,0,1]=3 2475 B9R0.7 CC(C)=C\C=C(/C)C(N)=O Amb4035443 [0,1,0,0,0,1|1,0,1]=4 2476 B9R0.7 CC(C)=C\C=C(/F)C(=O)O Amb28050050 [0,1,0,0,0,1|0,0,1]=3 2477 B9R0.7 CC(C)C#CC(C)C(=O)O Amb27646536 [0,1,0,0,0,1|0,0,2]=4 2478 B9R0.7 CC(C)C(=N)NCC(=O)O Amb27162604 [0,1,0,0,0,1|0,0,1]=3 2479 B9R0.7 CC(C)C(=O)CNC(N)=O Amb27262218 [0,1,0,0,0,1|1,0,1]=4 2480 B9R0.7 CC(C)C(=O)NCC(=O)O Amb1112853 [0,1,0,0,0,1|0,0,1]=3 2481 B9R0.7 CC(C)C(=O)NCC(N)=O Amb17231981 [0,1,0,0,0,1|1,0,1]=4 2482 B9R0.7 CC(C)C(=O)NNC(N)=O Amb26876073 [0,1,0,0,0,1|2,0,0]=4 2483 B9R0.7 CC(C)C(=O)\C=C\C(=O)O Amb25117573 [0,1,0,0,0,1|0,0,0]=2 2484 B9R0.7 CC(C)C(=S)SCC(=O)O Amb27878469 [0,1,0,0,0,1|0,0,1]=3 2485 B9R0.7 CC(C)C(C)\C=C\[N+](=O)[O-] Amb27750590 [0,1,0,0,0,1|1,0,1]=4 2486 B9R0.7 CC(C)C(N)C#CC(=O)O Amb27408416 [0,1,0,0,0,1|0,0,2]=4 2487 B9R0.7 CC(C)C(N)CCC(=O)O Amb18124745 [0,1,0,0,0,1|0,0,2]=4 2488 B9R0.7 CC(C)C(O)CCC(=O)O Amb25252592 [0,1,0,0,0,1|0,0,2]=4 2489 B9R0.7 CC(C)CCC(=O)C(=O)O Amb26508699 [0,1,0,0,0,1|0,0,1]=3 2490 B9R0.7 CC(C)CCC(Br)C(=O)O Amb18131059 [0,1,0,0,0,1|0,0,2]=4 2491 B9R0.7 CC(C)CCC(C)C(=O)O Amb19033547 [0,1,0,0,0,1|0,0,2]=4 2492 B9R0.7 CC(C)CCC(F)C(=O)O Amb26612835 [0,1,0,0,0,1|0,0,2]=4 2493 B9R0.7 CC(C)CCC(N)C(=O)O Amb19269152 [0,1,0,0,0,1|0,0,2]=4 2494 B9R0.7 CC(C)CCC(N)C(=O)O Amb6269218 [0,1,0,0,0,1|0,0,2]=4 2495 B9R0.7 CC(C)CCC(O)C(=O)O Amb27788603 [0,1,0,0,0,1|0,0,2]=4 2496 B9R0.7 CC(C)CC[C@@H](C)C(=O)O Amb26983027 [0,1,0,0,0,1|0,0,2]=4 2497 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb19133196 [0,1,0,0,0,1|0,0,2]=4 2498 B9R0.7 CC(C)CC[C@@H](N)C(=O)O Amb22899130 [0,1,0,0,0,1|0,0,2]=4 2499 B9R0.7 CC(C)CC[C@H](C)C(=O)O Amb27227250 [0,1,0,0,0,1|0,0,2]=4 2500 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb16183866 [0,1,0,0,0,1|0,0,2]=4 2501 B9R0.7 CC(C)CC[C@H](N)C(=O)O Amb33339290 [0,1,0,0,0,1|0,0,2]=4 2502 B9R0.7 CC(C)CNC(=O)C(=O)O Amb2693956 [0,1,0,0,0,1|0,0,1]=3 2503 B9R0.7 CC(C)CNC(C)C(=O)O Amb9326958 [0,1,0,0,0,1|0,0,2]=4 2504 B9R0.7 CC(C)CN[C@@H](C)C(=O)O Amb27872965 [0,1,0,0,0,1|0,0,2]=4 2505 B9R0.7 CC(C)COC(C)C(=O)O Amb6258223 [0,1,0,0,0,1|0,0,2]=4 2506 B9R0.7 CC(C)COC(F)C(=O)O Amb27825878 [0,1,0,0,0,1|0,0,2]=4 2507 B9R0.7 CC(C)CSC(C)C(=O)O Amb6270237 [0,1,0,0,0,1|0,0,2]=4 2508 B9R0.7 CC(C)C\C=C(/F)C(=O)O Amb18124770 [0,1,0,0,0,1|0,0,0]=2 2509 B9R0.7 CC(C)N(C)CCC(=O)O Amb6611753 [0,1,0,0,0,1|0,0,2]=4 2510 B9R0.7 CC(C)N(C)CCC(=O)O Amb8428206 [0,1,0,0,0,1|0,0,2]=4 2511 B9R0.7 CC(C)N(C)\C=C\C(=O)O Amb27768790 [0,1,0,0,0,1|0,0,0]=2 2512 B9R0.7 CC(C)NCC(C)C(=O)O Amb9400283 [0,1,0,0,0,1|0,0,2]=4 2513 B9R0.7 CC(C)OCC(=O)C(=O)O Amb27620494 [0,1,0,0,0,1|0,0,1]=3 2514 B9R0.7 CC(C)OCC(C)C(=O)O Amb26037515 [0,1,0,0,0,1|0,0,2]=4 2515 B9R0.7 CC(C)OCC(Cl)C(=O)O Amb27770474 [0,1,0,0,0,1|0,0,2]=4 2516 B9R0.7 CC(C)OCC(N)C(=O)O Amb25956723 [0,1,0,0,0,1|0,0,2]=4 2517 B9R0.7 CC(C)OCC(N)C(=O)O Amb32665467 [0,1,0,0,0,1|0,0,2]=4 2518 B9R0.7 CC(C)OCC(O)C(=O)O Amb24583914 [0,1,0,0,0,1|0,0,2]=4 2519 B9R0.7 CC(C)OC[C@@H](N)C(=O)O Amb24479342 [0,1,0,0,0,1|0,0,2]=4 2520 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb26960408 [0,1,0,0,0,1|0,0,2]=4 2521 B9R0.7 CC(C)OC[C@H](N)C(=O)O Amb32664966 [0,1,0,0,0,1|0,0,2]=4 2522 B9R0.7 CC(C)S(=O)\C=C\C(=O)O Amb27166984 [0,1,0,0,0,1|0,0,0]=2 2523 B9R0.7 CC(C)SCC(N)C(=O)O Amb6273927 [0,1,0,0,0,1|0,0,2]=4 2524 B9R0.7 CC(C)[C@@H](O)CCC(=O)O Amb28314215 [0,1,0,0,0,1|0,0,2]=4 2525 B9R0.7 CC(C)\C=C\C(O)C(C)O Amb27617247 [0,1,0,0,0,1|1,0,1]=4 2526 B9R0.7 CC(Cl)C(=O)CCC(=O)O Amb25362323 [0,1,0,0,0,1|1,0,1]=4 2527 B9R0.7 CC(Cl)C(=O)NCC(=O)O Amb8393827 [0,1,0,0,0,1|1,0,1]=4 2528 B9R0.7 CC(N)C(=O)NCC(=O)O Amb2778754 [0,1,0,0,0,1|1,0,1]=4 2529 B9R0.7 CC(O)C(=O)OCC(=O)O Amb27392962 [0,1,0,0,0,1|1,0,1]=4 2530 B9R0.7 CC(O)C(C)\C=C\C(=O)O Amb27759324 [0,1,0,0,0,1|1,0,0]=3 2531 B9R0.7 CC(O)CCC(=O)C(=O)O Amb27799217 [0,1,0,0,0,1|1,0,1]=4 2532 B9R0.7 CC(O)\C=C\C(C)C(=O)O Amb28246267 [0,1,0,0,0,1|1,0,0]=3 2533 B9R0.7 CC(S)C(=O)NCC(=O)O Amb2777540 [0,1,0,0,0,1|1,0,1]=4 2534 B9R0.7 CN(C)C(=O)C#CC(=O)O Amb26940350 [0,1,0,0,0,1|1,0,1]=4 2535 B9R0.7 CN(C)C(=O)CCC(=O)O Amb1135807 [0,1,0,0,0,1|1,0,1]=4 2536 B9R0.7 CN(C)C(=O)NCC(=O)O Amb9304726 [0,1,0,0,0,1|1,0,1]=4 2537 B9R0.7 CN(C)C(=O)SCC(=O)O Amb28199270 [0,1,0,0,0,1|1,0,1]=4 2538 B9R0.7 CN(C)C(=O)\C=C/C(=O)O Amb2967257 [0,1,0,0,0,1|1,0,0]=3 2539 B9R0.7 CN(C)C(=O)\C=C\C(=O)O Amb34913235 [0,1,0,0,0,1|1,0,0]=3 2540 B9R0.7 CN(C)C(=O)\C=C\C(N)=O Amb28132660 [0,1,0,0,0,1|2,0,0]=4 2541 B9R0.7 CN(C)C(=S)NCC(=O)O Amb25708504 [0,1,0,0,0,1|1,0,1]=4 2542 B9R0.7 CN(C)C(=S)SCC(=O)O Amb3986957 [0,1,0,0,0,1|1,0,1]=4 2543 B9R0.7 CN(C)CCC(=O)C(=O)O Amb33272647 [0,1,0,0,0,1|1,0,1]=4 2544 B9R0.7 CN(C)\C=C\C(=O)C(=O)O Amb27615648 [0,1,0,0,0,1|1,0,0]=3 2545 B9R0.7 C[C@@H](Br)C(=O)NCC(=O)O Amb27169385 [0,1,0,0,0,1|1,0,1]=4 2546 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb22756673 [0,1,0,0,0,1|1,0,1]=4 2547 B9R0.7 C[C@@H](N)C(=O)NCC(=O)O Amb30867950 [0,1,0,0,0,1|1,0,1]=4 2548 B9R0.7 C[C@@H](O)[C@@H](O)\C=C\C(=O)O Amb28067737 [0,1,0,0,0,1|1,0,0]=3 2549 B9R0.7 C[C@H](Br)[C@H](O)\C=C\C(=O)O Amb27751397 [0,1,0,0,0,1|1,0,0]=3 2550 B9R0.7 C[C@H](Cl)C(=O)NCC(=O)O Amb27776749 [0,1,0,0,0,1|1,0,1]=4 2551 B9R0.7 C[C@H](N)C(=O)NCC(=O)O Amb4035944 [0,1,0,0,0,1|1,0,1]=4 2552 B9R0.7 C[C@H](O)[C@@H](C)\C=C\C(=O)O Amb28239463 [0,1,0,0,0,1|1,0,0]=3 2553 B9R0.7 C[C@H](O)\C=C\[C@@H](C)C(=O)O Amb27617100 [0,1,0,0,0,1|1,0,0]=3 2554 B9R0.7 C\C(=C/CC(=O)O)C(C)C Amb25866328 [0,1,0,0,0,1|0,0,0]=2 2555 B9R0.7 C\C(=C/CC(C)C)C(=O)O Amb27815070 [0,1,0,0,0,1|0,0,0]=2 2556 B9R0.7 C\C(=C/C[C@@H](C)O)C(=O)O Amb27254118 [0,1,0,0,0,1|1,0,0]=3 2557 B9R0.7 C\C(=C\CC(C)C)C(=O)O Amb27203321 [0,1,0,0,0,1|0,0,0]=2 2558 B9R0.7 C\C(=N/CC(C)C)C(=O)O Amb27426682 [0,1,0,0,0,1|0,0,1]=3 2559 B9R0.7 C\C(=N/NC(C)C)C(=O)O Amb27881746 [0,1,0,0,0,1|1,0,0]=3 2560 B9R0.7 C\C(=N/NC(N)=O)C(C)C Amb27260870 [0,1,0,0,0,1|2,0,0]=4 2561 B9R0.53 C=C(C)\C=C(/C)NC(C)C Amb27489927 [0,1,0,0,0,1|2,0,0]=4 2562 B9R0.53 C=C(CC(=O)O)CC(C)C Amb18643897 [0,1,0,0,0,1|0,0,1]=3 2563 B9R0.53 CC(=O)CC(=O)CC(C)C Amb8516702 [0,1,0,0,0,1|1,0,1]=4 2564 B9R0.53 CC(=O)CC(=O)OC(C)C Amb6608870 [0,1,0,0,0,1|1,0,1]=4 2565 B9R0.53 CC(=O)NC(=O)C=C(C)C Amb27876464 [0,1,0,0,0,1|1,0,1]=4 2566 B9R0.53 CC(=O)NC(=S)OC(C)C Amb28071008 [0,1,0,0,0,1|2,0,0]=4 2567 B9R0.53 CC(=O)N\C(C)=C/N(C)C Amb27635058 [0,1,0,0,0,1|2,0,0]=4 2568 B9R0.53 CC(=O)O\C(C)=C/C(C)Br Amb28049986 [0,1,0,0,0,1|2,0,0]=4 2569 B9R0.53 CC(=O)\C=C(/C)CC(C)C Amb28063284 [0,1,0,0,0,1|1,0,0]=3 2570 B9R0.53 CC(=O)\C=C(/C)CN(C)C Amb26872810 [0,1,0,0,0,1|2,0,0]=4 2571 B9R0.53 CC(=O)\C=C(/O)C=C(C)C Amb28198590 [0,1,0,0,0,1|1,0,1]=4 2572 B9R0.53 CC(=O)\C=C(/O)CC(C)C Amb28288330 [0,1,0,0,0,1|1,0,0]=3 2573 B9R0.53 CC(=O)\C=C(\C)NN(C)C Amb27615145 [0,1,0,0,0,1|2,0,0]=4 2574 B9R0.53 CC(C)=CC(=O)NC(N)=O Amb27814879 [0,1,0,0,0,1|1,0,1]=4 2575 B9R0.53 CC(C)=CC(=O)SC(C)C Amb22231438 [0,1,0,0,0,1|2,0,0]=4 2576 B9R0.53 CC(C)=C\C(C)=C\C(=O)O Amb27422044 [0,1,0,0,0,1|0,0,1]=3 2577 B9R0.53 CC(C)CC(=N)CC(N)=O Amb27827487 [0,1,0,0,0,1|1,0,1]=4 2578 B9R0.53 CC(C)CC(C)CC(=O)O Amb6749218 [0,1,0,0,0,1|0,0,2]=4 2579 B9R0.53 CC(C)CC(N)CC(=O)O Amb2438867 [0,1,0,0,0,1|0,0,2]=4 2580 B9R0.53 CC(C)CC(O)CC(=O)O Amb17232005 [0,1,0,0,0,1|0,0,2]=4 2581 B9R0.53 CC(C)CN(C)CC(=O)O Amb8900040 [0,1,0,0,0,1|0,0,2]=4 2582 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631385 [0,1,0,0,0,1|0,0,2]=4 2583 B9R0.53 CC(C)C[C@@H](N)CC(=O)O Amb8631386 [0,1,0,0,0,1|0,0,2]=4 2584 B9R0.53 CC(C)C[C@@H](O)CC(=O)O Amb28050162 [0,1,0,0,0,1|0,0,2]=4 2585 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb16184017 [0,1,0,0,0,1|0,0,2]=4 2586 B9R0.53 CC(C)C[C@H](N)CC(=O)O Amb19944305 [0,1,0,0,0,1|0,0,2]=4 2587 B9R0.53 CC(C)C[C@H](O)CC(=O)O Amb24505145 [0,1,0,0,0,1|0,0,2]=4 2588 B9R0.53 CC(C)C\C(N)=C\C(N)=S Amb27881766 [0,1,0,0,0,1|1,1,0]=4 2589 B9R0.53 CC(C)NC(=O)CC(=O)O Amb17399889 [0,1,0,0,0,1|0,0,1]=3 2590 B9R0.53 CC(C)NC(=O)CC(N)=O Amb28050038 [0,1,0,0,0,1|1,0,1]=4 2591 B9R0.53 CC(C)NC(C)CC(=O)O Amb9398367 [0,1,0,0,0,1|0,0,2]=4 2592 B9R0.53 CC(C)OC(=O)C=C(Cl)Cl Amb28061013 [0,1,0,0,0,1|2,0,0]=4 2593 B9R0.53 CC(C)OC(=O)CC(=O)O Amb25887628 [0,1,0,0,0,1|0,0,1]=3 2594 B9R0.53 CC(C)OC(=O)CC(N)=O Amb27765049 [0,1,0,0,0,1|1,0,1]=4 2595 B9R0.53 CC(C)SC(=N)NC(N)=O Amb27487342 [0,1,0,0,0,1|2,0,0]=4 2596 B9R0.53 CN(C)NC(=O)CC(=O)O Amb20246800 [0,1,0,0,0,1|1,0,1]=4 2597 B9R0.53 C\C(=C/C(=O)O)CN(C)O Amb27459209 [0,1,0,0,0,1|2,0,0]=4 2598 B9R0.53 C\C(=C\C(=O)O)CC(C)C Amb26947874 [0,1,0,0,0,1|0,0,0]=2 2599 B9R0.53 C\C(=C\C(C)C)CC(=O)O Amb27784871 [0,1,0,0,0,1|0,0,0]=2 2600 B9R0.53 C\C(=C\C(C)C)NC(N)=S Amb27440464 [0,1,0,0,0,1|1,1,0]=4 2601 B9R0.53 C\C(Cl)=C\C(=O)NC(C)C Amb25063189 [0,1,0,0,0,1|2,0,0]=4 2602 B9R0.53 C\C(N)=C/C(=O)OC(C)C Amb33512913 [0,1,0,0,0,1|2,0,0]=4 2603 B9R0.53 C\C(N)=C\C(=O)OC(C)C Amb4016229 [0,1,0,0,0,1|2,0,0]=4 2604 B9R0.53 C\C(N)=C\C(=O)SC(C)C Amb27780159 [0,1,0,0,0,1|2,0,0]=4 2605 B9R0.56 CC(=O)C\C=C\[Si](C)(C)C Amb26447708 [0,1,0,0,0,1|1,1,0]=4 2606 B9R0.56 CC(=O)\C=C/NC(C)(C)C Amb2384233 [0,1,0,0,0,1|1,0,0]=3 2607 B9R0.56 CC(=O)\C=C/O[Si](C)(C)C Amb28144171 [0,1,0,0,0,1|1,1,0]=4 2608 B9R0.56 CC(=O)\C=C\CC(C)(C)C Amb33473937 [0,1,0,0,0,1|1,0,0]=3 2609 B9R0.56 CC(=O)\C=C\N=S(C)(C)=O Amb26449275 [0,1,0,0,0,1|2,0,0]=4 2610 B9R0.56 CC(=O)\C=N\NC(C)(C)C Amb28077561 [0,1,0,0,0,1|2,0,0]=4 2611 B9R0.56 CC(C)(C)C=C=CC(=O)O Amb17593545 [0,1,0,0,0,1|0,0,0]=2 2612 B9R0.56 CC(C)(C)CC#CC(=O)O Amb25342948 [0,1,0,0,0,1|0,0,2]=4 2613 B9R0.56 CC(C)(C)CCCC(=O)O Amb18307485 [0,1,0,0,0,1|0,0,2]=4 2614 B9R0.56 CC(C)(C)CNCC(=O)O Amb19012829 [0,1,0,0,0,1|0,0,2]=4 2615 B9R0.56 CC(C)(C)CNCC(=O)O Amb28555432 [0,1,0,0,0,1|0,0,2]=4 2616 B9R0.56 CC(C)(C)COCC(=O)O Amb25079059 [0,1,0,0,0,1|0,0,2]=4 2617 B9R0.56 CC(C)(C)CSCC(=O)O Amb28050005 [0,1,0,0,0,1|0,0,2]=4 2618 B9R0.56 CC(C)(C)C\C=C\C(N)=O Amb27843454 [0,1,0,0,0,1|1,0,0]=3 2619 B9R0.56 CC(C)(C)C\C=C\[N+](=O)[O-] Amb33362526 [0,1,0,0,0,1|1,0,1]=4 2620 B9R0.56 CC(C)(C)NCCC(=O)O Amb1106324 [0,1,0,0,0,1|0,0,2]=4 2621 B9R0.56 CC(C)(C)NCCC(=O)O Amb528113 [0,1,0,0,0,1|0,0,2]=4 2622 B9R0.56 CC(C)(C)OCCC(=O)O Amb2691288 [0,1,0,0,0,1|0,0,2]=4 2623 B9R0.56 CC(C)(C)SCCC(=O)O Amb6680208 [0,1,0,0,0,1|0,0,2]=4 2624 B9R0.56 CC(C)(C)\C=C\CB(O)O Amb24694293 [0,1,0,0,0,1|1,0,1]=4 2625 B9R0.56 CC(C)(C)\C=C\CC(=O)O Amb24608675 [0,1,0,0,0,1|0,0,0]=2 2626 B9R0.56 CC(C)(F)CCCC(=O)O Amb25270576 [0,1,0,0,0,1|0,0,2]=4 2627 B9R0.56 CC(C)(N)CC#CC(=O)O Amb33168977 [0,1,0,0,0,1|0,0,2]=4 2628 B9R0.56 CC(C)(N)COCC(=O)O Amb18630788 [0,1,0,0,0,1|0,0,2]=4 2629 B9R0.56 CC(C)(O)CCCC(=O)O Amb24340189 [0,1,0,0,0,1|0,0,2]=4 2630 B9R0.56 CC(C)(O)CSCC(=O)O Amb18307056 [0,1,0,0,0,1|0,0,2]=4 2631 B9R0.56 CC(C)(O)C\C=C\C(=O)O Amb18644104 [0,1,0,0,0,1|0,0,0]=2 2632 B9R0.56 CC(C)=C\C=C\C(C)(C)C Amb22641679 [0,1,0,0,0,1|2,0,0]=4 2633 B9R0.56 CC(C)=C\C=N\C(C)(C)C Amb22732367 [0,1,0,0,0,1|2,0,0]=4 2634 B9R0.56 CC(C)\C=C\CS(=O)(=O)Cl Amb26484787 [0,1,0,0,0,1|1,0,1]=4 2635 B9R0.56 CC(O)C\C=C\C(C)(C)C Amb27598604 [0,1,0,0,0,1|1,0,1]=4 2636 B9R0.56 CS(=O)(=O)C\C=C\C(=O)O Amb33481784 [0,1,0,0,0,1|2,0,0]=4 2637 B9R0.56 C[N+](C)(C)C\C=C\C(=O)[O-] Amb22054782 [0,1,0,0,0,1|1,0,1]=4 2638 B9R0.56 C[Si](C)(C)C\C=C/C(=O)O Amb27434781 [0,1,0,0,0,1|0,1,0]=3 2639 B9R0.56 C[Si](C)(C)O\C=C\C(=O)O Amb27863599 [0,1,0,0,0,1|0,1,0]=3 2640 B9R0.56 O=C(O)\C=C\CC(Cl)(Cl)Cl Amb25887685 [0,1,0,0,0,1|2,0,0]=4 2641 B9R0.56 O=C(O)\C=C\CC(F)(F)F Amb22388452 [0,1,0,0,0,1|2,0,0]=4 2642 B9R0.21 C#CC(O)\C=C\C(C)(C)C Amb27603091 [0,2,0,0,0,0|1,0,1]=4 2643 B9R0.21 C=CC(O)\C=C\C(C)(C)C Amb27839318 [0,2,0,0,0,0|1,0,1]=4 2644 B9R0.21 C=C[C@H](O)\C=C\C(C)(C)C Amb27857889 [0,2,0,0,0,0|1,0,1]=4 2645 B9R0.21 CC(=C=CC(C)(C)C)CO Amb27452090 [0,2,0,0,0,0|1,0,1]=4 2646 B9R0.21 CC(C)(C)NCC(=O)NO Amb27830850 [0,2,0,0,0,0|1,0,1]=4 2647 B9R0.21 CC(C)(C)OCC(=O)NO Amb27425147 [0,2,0,0,0,0|1,0,1]=4 2648 B9R0.21 CCC(=O)\C=C\[N+](C)(C)C Amb25092520 [0,2,0,0,0,0|2,0,0]=4 2649 B9R0.21 CCC(=O)\C=C\[Si](C)(C)C Amb24580711 [0,2,0,0,0,0|1,1,0]=4 2650 B9R0.21 CCC(O)\C=C\C(C)(C)C Amb27812649 [0,2,0,0,0,0|1,0,1]=4 2651 B9R0.21 COC(=O)C#CC(C)(C)C Amb9791084 [0,2,0,0,0,0|0,0,2]=4 2652 B9R0.21 COC(=O)C#CC(C)(C)F Amb28430752 [0,2,0,0,0,0|0,0,2]=4 2653 B9R0.21 COC(=O)C#CC(C)(C)N Amb32671658 [0,2,0,0,0,0|0,0,2]=4 2654 B9R0.21 COC(=O)C#CC(C)(C)O Amb9790321 [0,2,0,0,0,0|0,0,2]=4 2655 B9R0.21 COC(=O)CCC(C)(C)N Amb19415866 [0,2,0,0,0,0|0,0,2]=4 2656 B9R0.21 COC(=O)CCC(C)(C)N Amb24383846 [0,2,0,0,0,0|0,0,2]=4 2657 B9R0.21 COC(=O)CNC(C)(C)C Amb2779525 [0,2,0,0,0,0|1,0,1]=4 2658 B9R0.21 COC(=O)COC(C)(C)C Amb7789989 [0,2,0,0,0,0|1,0,1]=4 2659 B9R0.21 COC(=O)CSC(C)(C)C Amb7752950 [0,2,0,0,0,0|1,0,1]=4 2660 B9R0.21 COC(=O)\C=C/C(F)(F)F Amb26541462 [0,2,0,0,0,0|2,0,0]=4 2661 B9R0.21 COC(=O)\C=C\C(C)(C)C Amb32789660 [0,2,0,0,0,0|0,0,0]=2 2662 B9R0.21 COC(=O)\C=C\C(C)(C)N Amb33330542 [0,2,0,0,0,0|0,0,0]=2 2663 B9R0.21 COC(=O)\C=C\C(C)(C)N Amb33330543 [0,2,0,0,0,0|0,0,0]=2 2664 B9R0.21 COC(=O)\C=C\C(F)(F)F Amb32409335 [0,2,0,0,0,0|2,0,0]=4 2665 B9R0.21 COC(=O)\C=C\S(C)(=O)=O Amb24538735 [0,2,0,0,0,0|2,0,0]=4 2666 B9R0.21 C\C(=C/SC(C)(C)C)CO Amb27757993 [0,2,0,0,0,0|2,0,0]=4 2667 B9R0.21 O=P(O)(O)\C=C\C(O)CO Amb28126858 [0,2,0,0,0,0|2,0,0]=4 2668 B9R0.23 C=C(CC(C)C)C(=O)OC Amb27827319 [0,2,0,0,0,0|0,0,1]=3 2669 B9R0.23 C=C(CO)C(=O)OC(C)C Amb27839197 [0,2,0,0,0,0|2,0,0]=4 2670 B9R0.23 CC(=O)NC(=O)C(C)CCl Amb18798253 [0,2,0,0,0,0|2,0,0]=4 2671 B9R0.23 CC(C)=C=C(C)C(=O)CO Amb28049895 [0,2,0,0,0,0|0,0,2]=4 2672 B9R0.23 CC(C)=CC(=O)C(=O)CBr Amb27777252 [0,2,0,0,0,0|1,0,1]=4 2673 B9R0.23 CC(C)=CC(=O)C(C)CN Amb28050470 [0,2,0,0,0,0|2,0,0]=4 2674 B9R0.23 CC(C)CC(=O)C(=O)CBr Amb28346721 [0,2,0,0,0,0|1,0,1]=4 2675 B9R0.23 CC(C)CC(=O)\C(Cl)=N/O Amb27470975 [0,2,0,0,0,0|1,0,1]=4 2676 B9R0.23 CC(C)CC(N)C(=O)NO Amb27264492 [0,2,0,0,0,0|0,0,2]=4 2677 B9R0.23 CC(C)C[C@H](N)C(=O)NO Amb24440728 [0,2,0,0,0,0|0,0,2]=4 2678 B9R0.23 CC(C)NC(=O)C(=O)NN Amb436365 [0,2,0,0,0,0|2,0,0]=4 2679 B9R0.23 CC(C)OC(=O)C(=O)CBr Amb22231989 [0,2,0,0,0,0|2,0,0]=4 2680 B9R0.23 CC(C)OC(=O)C(=O)CCl Amb27479239 [0,2,0,0,0,0|2,0,0]=4 2681 B9R0.23 CC(CN)N(C)CC(=O)O Amb27453888 [0,2,0,0,0,0|1,0,1]=4 2682 B9R0.23 CCC(C)C(=N)CC(C)=O Amb27629398 [0,2,0,0,0,0|1,0,1]=4 2683 B9R0.23 CCC(C)C(=O)CC(C)=O Amb24544654 [0,2,0,0,0,0|1,0,1]=4 2684 B9R0.23 CCC(C)C(=O)NC(N)=O Amb28050080 [0,2,0,0,0,0|2,0,0]=4 2685 B9R0.23 CCC(C)C(C)CC(=O)O Amb18304200 [0,2,0,0,0,0|0,0,2]=4 2686 B9R0.23 CCC(C)C(N)CC(=O)O Amb2438880 [0,2,0,0,0,0|0,0,2]=4 2687 B9R0.23 CCC(C)C(O)CC(=O)O Amb18310690 [0,2,0,0,0,0|0,0,2]=4 2688 B9R0.23 CCC(C)N(C)CC(=O)O Amb8900884 [0,2,0,0,0,0|1,0,1]=4 2689 B9R0.23 CCC(C)S(=O)CC(=O)O Amb18523822 [0,2,0,0,0,0|1,0,1]=4 2690 B9R0.23 CCC(C)[C@@H](N)CC(=O)O Amb28455466 [0,2,0,0,0,0|0,0,2]=4 2691 B9R0.23 CCC(C)[C@@H](O)CC(=O)O Amb33318493 [0,2,0,0,0,0|0,0,2]=4 2692 B9R0.23 CCC(C)[C@H](N)CC(=O)O Amb25117039 [0,2,0,0,0,0|0,0,2]=4 2693 B9R0.23 CCC(C)[C@H](O)CC(=O)O Amb33318492 [0,2,0,0,0,0|0,0,2]=4 2694 B9R0.23 CCC(C)\C(C)=C\C(=O)O Amb27837581 [0,2,0,0,0,0|0,0,0]=2 2695 B9R0.23 CCC(C)\C(C)=C\C(C)=O Amb27196911 [0,2,0,0,0,0|1,0,0]=3 2696 B9R0.23 CCC(C)\C(Cl)=C\C(=O)O Amb28254394 [0,2,0,0,0,0|0,0,0]=2 2697 B9R0.23 CCN(C)C(=O)CC(=O)O Amb18987423 [0,2,0,0,0,0|1,0,1]=4 2698 B9R0.23 CCS(=O)\C(C)=C/C(=O)O Amb27878557 [0,2,0,0,0,0|2,0,0]=4 2699 B9R0.23 CCS(=O)\C(C)=C\C(=O)O Amb27817744 [0,2,0,0,0,0|2,0,0]=4 2700 B9R0.23 CC[C@@H](C)C(N)CC(=O)O Amb32687892 [0,2,0,0,0,0|0,0,2]=4 2701 B9R0.23 CC[C@@H](C)[C@@H](N)CC(=O)O Amb25689818 [0,2,0,0,0,0|0,0,2]=4 2702 B9R0.23 CC[C@H](C)C(N)CC(=O)O Amb32687890 [0,2,0,0,0,0|0,0,2]=4 2703 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O Amb16184016 [0,2,0,0,0,0|0,0,2]=4 2704 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb19944304 [0,2,0,0,0,0|0,0,2]=4 2705 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O Amb25068405 [0,2,0,0,0,0|0,0,2]=4 2706 B9R0.23 CC[C@H](O)\C(C)=C\C(C)C Amb28138793 [0,2,0,0,0,0|1,0,1]=4 2707 B9R0.23 CC\C(C)=C(/C)CC(=O)O Amb28050046 [0,2,0,0,0,0|0,0,2]=4 2708 B9R0.23 CNC(=O)\C(C)=C\C(=O)O Amb27202767 [0,2,0,0,0,0|1,0,1]=4 2709 B9R0.23 CN[C@@H](C)C(=O)C=C(C)C Amb29890640 [0,2,0,0,0,0|2,0,0]=4 2710 B9R0.23 COC(=O)C(=O)CC(C)C Amb17740021 [0,2,0,0,0,0|0,0,1]=3 2711 B9R0.23 COC(=O)C(Br)CC(C)C Amb22490955 [0,2,0,0,0,0|0,0,2]=4 2712 B9R0.23 COC(=O)C(C)=C=C(C)C Amb32423563 [0,2,0,0,0,0|0,0,2]=4 2713 B9R0.23 COC(=O)C(C)NC(C)C Amb19003119 [0,2,0,0,0,0|1,0,1]=4 2714 B9R0.23 COC(=O)C(Cl)CC(C)C Amb18800856 [0,2,0,0,0,0|0,0,2]=4 2715 B9R0.23 COC(=O)C(N)CC(C)C Amb1152419 [0,2,0,0,0,0|0,0,2]=4 2716 B9R0.23 COC(=O)C(N)CC(C)C Amb22489476 [0,2,0,0,0,0|0,0,2]=4 2717 B9R0.23 COC(=O)C(N)CC(C)C Amb932819 [0,2,0,0,0,0|0,0,2]=4 2718 B9R0.23 COC(=O)C(O)CC(C)C Amb19306745 [0,2,0,0,0,0|0,0,2]=4 2719 B9R0.23 COC(=O)[C@@H](Br)CC(C)C Amb27400688 [0,2,0,0,0,0|0,0,2]=4 2720 B9R0.23 COC(=O)[C@@H](N)CC(C)C Amb533935 [0,2,0,0,0,0|0,0,2]=4 2721 B9R0.23 COC(=O)[C@@H](N)CC(C)C Amb8513236 [0,2,0,0,0,0|0,0,2]=4 2722 B9R0.23 COC(=O)[C@H](Br)CC(C)C Amb27796257 [0,2,0,0,0,0|0,0,2]=4 2723 B9R0.23 COC(=O)[C@H](C)NC(C)C Amb9228611 [0,2,0,0,0,0|1,0,1]=4 2724 B9R0.23 COC(=O)[C@H](N)CC(C)C Amb2719741 [0,2,0,0,0,0|0,0,2]=4 2725 B9R0.23 COC(=O)[C@H](N)CC(C)C Amb3941143 [0,2,0,0,0,0|0,0,2]=4 2726 B9R0.23 COC(=O)[C@H](O)C=C(C)C Amb27432220 [0,2,0,0,0,0|0,0,2]=4 2727 B9R0.23 COC(=O)[C@H](O)CC(C)C Amb26022448 [0,2,0,0,0,0|0,0,2]=4 2728 B9R0.23 COC(=O)\C(Br)=C\C(=O)O Amb15695379 [0,2,0,0,0,0|1,0,1]=4 2729 B9R0.23 COC(=O)\C(C)=C\C(=O)O Amb27221493 [0,2,0,0,0,0|1,0,1]=4 2730 B9R0.23 COC(=O)\C(C)=C\C(C)=O Amb27164598 [0,2,0,0,0,0|1,0,1]=4 2731 B9R0.23 COC(=O)\C(F)=C\C(=O)O Amb28288995 [0,2,0,0,0,0|1,0,1]=4 2732 B9R0.23 COC(=O)\C(I)=C\C(C)C Amb27230893 [0,2,0,0,0,0|0,0,0]=2 2733 B9R0.23 COC(=O)\C(N)=C\C(C)=O Amb24411031 [0,2,0,0,0,0|1,0,1]=4 2734 B9R0.23 COC(=O)\C(N)=C\C(C)C Amb28050074 [0,2,0,0,0,0|0,0,0]=2 2735 B9R0.23 COC(=O)\C(O)=C\C(C)=O Amb1981446 [0,2,0,0,0,0|1,0,1]=4 2736 B9R0.23 COC(=O)\C([O-])=C\C(C)=O Amb29083217 [0,2,0,0,0,0|1,0,1]=4 2737 B9R0.23 COC(C)C(=O)CC(C)=O Amb26479508 [0,2,0,0,0,0|1,0,1]=4 2738 B9R0.23 COC(C)C(C)CC(=O)O Amb18202340 [0,2,0,0,0,0|0,0,2]=4 2739 B9R0.23 COC(C)C(N)CC(=O)O Amb26567214 [0,2,0,0,0,0|0,0,2]=4 2740 B9R0.23 COC(C)\C(C)=C\C(C)=O Amb27780973 [0,2,0,0,0,0|1,0,0]=3 2741 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35788177 [0,2,0,0,0,0|0,0,2]=4 2742 B9R0.23 CO[C@H](C)[C@H](N)CC(=O)O Amb35789671 [0,2,0,0,0,0|0,0,2]=4 2743 B9R0.23 C[C@H](CO)N(C)CC(=O)O Amb28254590 [0,2,0,0,0,0|1,0,1]=4 2744 B9R0.23 C\C(=C/O)C(=O)CC(C)C Amb28056098 [0,2,0,0,0,0|1,0,1]=4 2745 B9R0.23 C\C(=N/O)C(=O)CC(C)C Amb28381111 [0,2,0,0,0,0|1,0,1]=4 2746 B9R0.23 C\C(C=O)=C(\O)CC(C)C Amb27439095 [0,2,0,0,0,0|1,0,1]=4 2747 B9R0.24 CCC(C)C#CC(=O)OC Amb25333980 [0,2,0,0,0,0|0,0,2]=4 2748 B9R0.24 CCC(C)CCC(=O)OC Amb25690993 [0,2,0,0,0,0|0,0,2]=4 2749 B9R0.24 CCC(C)COC(=O)CO Amb27425710 [0,2,0,0,0,0|1,0,1]=4 2750 B9R0.24 CCC(C)C\C=C(\C)C=O Amb27493317 [0,2,0,0,0,0|1,0,1]=4 2751 B9R0.24 CCC(C)NCC(=O)OC Amb6687134 [0,2,0,0,0,0|1,0,1]=4 2752 B9R0.24 CCC(C)\C=C/C(=O)OC Amb27760361 [0,2,0,0,0,0|0,0,0]=2 2753 B9R0.24 CCC(C)\C=C\C(=O)OC Amb28049396 [0,2,0,0,0,0|0,0,0]=2 2754 B9R0.24 CC[C@H](C)\C=C\[C@@H](O)CO Amb28050738 [0,2,0,0,0,0|0,0,2]=4 2755 B9R0.24 CNC(C)\C=C\C(C)OC Amb27841480 [0,2,0,0,0,0|1,0,1]=4 2756 B9R0.24 COC(=O)C#CC(C)CN Amb33168811 [0,2,0,0,0,0|0,0,2]=4 2757 B9R0.24 COC(=O)C=C=C(C)CO Amb28281347 [0,2,0,0,0,0|0,0,2]=4 2758 B9R0.24 COC(=O)CCC(C)CN Amb26032831 [0,2,0,0,0,0|0,0,2]=4 2759 B9R0.24 COC(=O)CCC(C)CO Amb28319952 [0,2,0,0,0,0|0,0,2]=4 2760 B9R0.24 COC(=O)CCC(C)OC Amb26355788 [0,2,0,0,0,0|0,0,2]=4 2761 B9R0.24 COC(=O)CC[C@@H](C)CN Amb27468094 [0,2,0,0,0,0|0,0,2]=4 2762 B9R0.24 COC(=O)CC[C@@H](C)CO Amb28050698 [0,2,0,0,0,0|0,0,2]=4 2763 B9R0.24 COC(=O)C\C=C(\C)CO Amb28050664 [0,2,0,0,0,0|0,0,2]=4 2764 B9R0.24 COC(=O)NCC(C)CO Amb28286586 [0,2,0,0,0,0|1,0,1]=4 2765 B9R0.24 COC(=O)OCC(C)CBr Amb27391484 [0,2,0,0,0,0|1,0,1]=4 2766 B9R0.24 COC(=O)\C=C/C(=O)OC Amb8514575 [0,2,0,0,0,0|1,0,1]=4 2767 B9R0.24 COC(=O)\C=C\C(=O)CBr Amb26539741 [0,2,0,0,0,0|1,0,1]=4 2768 B9R0.24 COC(=O)\C=C\C(=O)OC Amb1789270 [0,2,0,0,0,0|1,0,1]=4 2769 B9R0.24 COC(=O)\C=C\C(C)CO Amb28454593 [0,2,0,0,0,0|0,0,0]=2 2770 B9R0.24 COC(=O)\C=C\C(N)CF Amb27961898 [0,2,0,0,0,0|1,0,0]=3 2771 B9R0.24 COC(=O)\C=C\[C@@H](Br)CO Amb28050001 [0,2,0,0,0,0|1,0,0]=3 2772 B9R0.24 COC(=O)\C=C\[C@@H](O)CO Amb27775775 [0,2,0,0,0,0|1,0,0]=3 2773 B9R0.24 C\C=C(C)\C=C\C(=O)CC Amb27204819 [0,2,0,0,0,0|1,0,1]=4 2774 B9R0.24 O=C(\C=C\C(O)CO)CO Amb26531357 [0,2,0,0,0,0|1,0,0]=3 2775 B9R0.24 O=CC(=O)\C=C/[C@H](O)CO Amb24665600 [0,2,0,0,0,0|1,0,1]=4 2776 B9R0.24 O=CC(=O)\C=C\C(O)CO Amb25887828 [0,2,0,0,0,0|1,0,1]=4 2777 B9R0.42 C=C(C=O)CC(=O)C(C)C Amb28436744 [0,2,0,0,0,0|1,0,1]=4 2778 B9R0.42 C=C(CC(C)CC)C(=O)O Amb27794839 [0,2,0,0,0,0|0,0,1]=3 2779 B9R0.42 C=C(CC(O)CC)C(=O)O Amb27427164 [0,2,0,0,0,0|1,0,1]=4 2780 B9R0.42 C=C(CC(O)CO)C(=O)O Amb28050042 [0,2,0,0,0,0|1,0,1]=4 2781 B9R0.42 C=C(C[C@@H](C)CC)C(C)=O Amb26853718 [0,2,0,0,0,0|1,0,1]=4 2782 B9R0.42 C=CC(=O)\C=C(/C)C(C)C Amb26910599 [0,2,0,0,0,0|1,0,0]=3 2783 B9R0.42 C=C\C(Cl)=C/C(=O)C(C)C Amb24508943 [0,2,0,0,0,0|2,0,0]=4 2784 B9R0.42 CC(=C/Br)\C=C(/C)C(=O)O Amb28050022 [0,2,0,0,0,0|0,0,2]=4 2785 B9R0.42 CC(=O)C(=O)OC(C)CCl Amb27848531 [0,2,0,0,0,0|2,0,0]=4 2786 B9R0.42 CC(C#N)NC(=O)C(=O)O Amb18563433 [0,2,0,0,0,0|1,0,1]=4 2787 B9R0.42 CC(C)=C(C)\C=C(/C)C=O Amb28052687 [0,2,0,0,0,0|1,0,1]=4 2788 B9R0.42 CC(C)C(=O)NC(=O)CCl Amb1107207 [0,2,0,0,0,0|2,0,0]=4 2789 B9R0.42 CC(C)C(=O)\C=C(\Cl)CCl Amb28244787 [0,2,0,0,0,0|2,0,0]=4 2790 B9R0.42 CC(CF)CC(N)C(=O)O Amb27838056 [0,2,0,0,0,0|0,0,2]=4 2791 B9R0.42 CC(CN)NC(=O)C(=O)O Amb28340502 [0,2,0,0,0,0|1,0,0]=3 2792 B9R0.42 CC(CO)CC(C)C(=O)O Amb27838009 [0,2,0,0,0,0|0,0,2]=4 2793 B9R0.42 CC(CO)CC(N)C(=O)O Amb25147300 [0,2,0,0,0,0|0,0,2]=4 2794 B9R0.42 CC(CO)C[C@@H](N)C(=O)O Amb33036727 [0,2,0,0,0,0|0,0,2]=4 2795 B9R0.42 CC(CO)C[C@H](N)C(=O)O Amb32865934 [0,2,0,0,0,0|0,0,2]=4 2796 B9R0.42 CC(CO)OC(C)C(=O)O Amb27664032 [0,2,0,0,0,0|1,0,1]=4 2797 B9R0.42 CC(CO)O[C@@H](C)C(=O)O Amb28255959 [0,2,0,0,0,0|1,0,1]=4 2798 B9R0.42 CC(CO)O[C@H](C)C(=O)O Amb27450794 [0,2,0,0,0,0|1,0,1]=4 2799 B9R0.42 CC(CO)SC(F)C(=O)O Amb28205607 [0,2,0,0,0,0|1,0,1]=4 2800 B9R0.42 CC(O)C(=O)OC(=O)CO Amb27197247 [0,2,0,0,0,0|2,0,0]=4 2801 B9R0.42 CCC(=O)CC(=O)C(C)C Amb9775083 [0,2,0,0,0,0|1,0,1]=4 2802 B9R0.42 CCC(=O)NC(=O)C(C)C Amb27797221 [0,2,0,0,0,0|2,0,0]=4 2803 B9R0.42 CCC(=O)OC(=O)C(C)C Amb15692551 [0,2,0,0,0,0|2,0,0]=4 2804 B9R0.42 CCC(=O)\C=C(/C)C(=O)O Amb27613306 [0,2,0,0,0,0|1,0,1]=4 2805 B9R0.42 CCC(=O)\C=C(\C)N(C)C Amb27973057 [0,2,0,0,0,0|2,0,0]=4 2806 B9R0.42 CCC(C)CC(=O)C(=O)O Amb27600368 [0,2,0,0,0,0|0,0,1]=3 2807 B9R0.42 CCC(C)CC(C)C(=O)O Amb22228338 [0,2,0,0,0,0|0,0,2]=4 2808 B9R0.42 CCC(C)CC(Cl)C(=O)O Amb28050903 [0,2,0,0,0,0|0,0,2]=4 2809 B9R0.42 CCC(C)CC(N)C(=O)O Amb18313985 [0,2,0,0,0,0|0,0,2]=4 2810 B9R0.42 CCC(C)CC(N)C(=O)O Amb20667726 [0,2,0,0,0,0|0,0,2]=4 2811 B9R0.42 CCC(C)CC(O)C(=O)O Amb25849308 [0,2,0,0,0,0|0,0,2]=4 2812 B9R0.42 CCC(C)CC(S)C(=O)O Amb18798152 [0,2,0,0,0,0|0,0,2]=4 2813 B9R0.42 CCC(C)C[C@@H](C)C(=O)O Amb33727258 [0,2,0,0,0,0|0,0,2]=4 2814 B9R0.42 CCC(C)C[C@@H](N)C(=O)O Amb25127143 [0,2,0,0,0,0|0,0,2]=4 2815 B9R0.42 CCC(C)C[C@H](C)C(=O)O Amb33743264 [0,2,0,0,0,0|0,0,2]=4 2816 B9R0.42 CCC(C)C[C@H](N)C(=O)O Amb27471067 [0,2,0,0,0,0|0,0,2]=4 2817 B9R0.42 CCC(C)NC(=O)C(=O)O Amb9303796 [0,2,0,0,0,0|1,0,0]=3 2818 B9R0.42 CCC(C)NC(=O)C(C)=O Amb17399880 [0,2,0,0,0,0|2,0,0]=4 2819 B9R0.42 CCC(C)NC(=O)C(N)=O Amb28050528 [0,2,0,0,0,0|2,0,0]=4 2820 B9R0.42 CCC(C)N[C@@H](C)C(=O)O Amb25691180 [0,2,0,0,0,0|1,0,1]=4 2821 B9R0.42 CCC(C)OC(=O)C(C)=O Amb28198630 [0,2,0,0,0,0|2,0,0]=4 2822 B9R0.42 CCC(C)OC(=O)C(N)=O Amb27216908 [0,2,0,0,0,0|2,0,0]=4 2823 B9R0.42 CCC(C)O[C@@H](C)C(=O)O Amb27395318 [0,2,0,0,0,0|1,0,1]=4 2824 B9R0.42 CCC(C)O[C@H](C)C(=O)O Amb27495202 [0,2,0,0,0,0|1,0,1]=4 2825 B9R0.42 CCC(C)SC(F)C(=O)O Amb27272834 [0,2,0,0,0,0|1,0,1]=4 2826 B9R0.42 CCC(C)\C=C(/C)C(=O)O Amb18643945 [0,2,0,0,0,0|0,0,0]=2 2827 B9R0.42 CCC(C)\C=C(\C)C(=O)O Amb27837721 [0,2,0,0,0,0|0,0,0]=2 2828 B9R0.42 CCC(C)\C=C(\C)[N+](=O)[O-] Amb27482458 [0,2,0,0,0,0|1,0,1]=4 2829 B9R0.42 CCC(O)\C=C(\C)C(N)=O Amb27446249 [0,2,0,0,0,0|2,0,0]=4 2830 B9R0.42 CC[C@@H](C)C[C@@H](C)C(=O)O Amb28248596 [0,2,0,0,0,0|0,0,2]=4 2831 B9R0.42 CC[C@@H](C)C[C@H](O)C(=O)O Amb27770344 [0,2,0,0,0,0|0,0,2]=4 2832 B9R0.42 CC[C@H](C)CC(=O)C(=O)O Amb27473360 [0,2,0,0,0,0|0,0,1]=3 2833 B9R0.42 CC[C@H](C)CC(C)C(=O)O Amb27770364 [0,2,0,0,0,0|0,0,2]=4 2834 B9R0.42 CC[C@H](C)CC(N)C(=O)O Amb28364291 [0,2,0,0,0,0|0,0,2]=4 2835 B9R0.42 CC[C@H](C)C[C@H](C)C(=O)O Amb27472997 [0,2,0,0,0,0|0,0,2]=4 2836 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb25662528 [0,2,0,0,0,0|0,0,2]=4 2837 B9R0.42 CC[C@H](C)C[C@H](N)C(=O)O Amb33620552 [0,2,0,0,0,0|0,0,2]=4 2838 B9R0.42 CC[C@H](C)\C=C(/C)C(=O)O Amb27831923 [0,2,0,0,0,0|0,0,0]=2 2839 B9R0.42 CC[C@H](C)\C=C(/C)C(C)=O Amb24586848 [0,2,0,0,0,0|1,0,0]=3 2840 B9R0.42 CC\C(S)=C\C(=O)C(C)C Amb27433805 [0,2,0,0,0,0|1,1,0]=4 2841 B9R0.42 COC(=O)CC(=O)C(C)Br Amb19888842 [0,2,0,0,0,0|1,0,1]=4 2842 B9R0.42 COC(=O)CC(=O)C(C)C Amb2689576 [0,2,0,0,0,0|0,0,1]=3 2843 B9R0.42 COC(=O)CC(=O)C(C)Cl Amb27592185 [0,2,0,0,0,0|1,0,1]=4 2844 B9R0.42 COC(=O)CC(=O)C(C)F Amb24589068 [0,2,0,0,0,0|1,0,1]=4 2845 B9R0.42 COC(=O)CC(=O)C(C)O Amb27827292 [0,2,0,0,0,0|1,0,1]=4 2846 B9R0.42 COC(=O)CC(=O)N(C)C Amb17399891 [0,2,0,0,0,0|1,0,1]=4 2847 B9R0.42 COC(=O)CC(N)C(C)C Amb22168224 [0,2,0,0,0,0|0,0,2]=4 2848 B9R0.42 COC(=O)CC(N)C(C)C Amb26870018 [0,2,0,0,0,0|0,0,2]=4 2849 B9R0.42 COC(=O)CC(O)C(C)C Amb24423234 [0,2,0,0,0,0|0,0,2]=4 2850 B9R0.42 COC(=O)CN(C)C(C)C Amb7757820 [0,2,0,0,0,0|1,0,1]=4 2851 B9R0.42 COC(=O)C[C@@H](N)C(C)C Amb26391960 [0,2,0,0,0,0|0,0,2]=4 2852 B9R0.42 COC(=O)C[C@@H](N)C(C)C Amb30640927 [0,2,0,0,0,0|0,0,2]=4 2853 B9R0.42 COC(=O)C[C@@H](O)C(C)C Amb25847717 [0,2,0,0,0,0|0,0,2]=4 2854 B9R0.42 COC(=O)C[C@H](N)C(C)C Amb23401522 [0,2,0,0,0,0|0,0,2]=4 2855 B9R0.42 COC(=O)C[C@H](N)C(C)C Amb25865860 [0,2,0,0,0,0|0,0,2]=4 2856 B9R0.42 COC(=O)C[C@H](O)C(C)C Amb26322416 [0,2,0,0,0,0|0,0,2]=4 2857 B9R0.42 COC(=O)NC(=O)C(C)Cl Amb444963 [0,2,0,0,0,0|2,0,0]=4 2858 B9R0.42 COC(=O)\C=C(/C)C(=O)O Amb18644070 [0,2,0,0,0,0|1,0,1]=4 2859 B9R0.42 COC(=O)\C=C(/C)C(C)=O Amb20668358 [0,2,0,0,0,0|1,0,1]=4 2860 B9R0.42 COC(=O)\C=C(/C)C(C)C Amb33472138 [0,2,0,0,0,0|0,0,0]=2 2861 B9R0.42 COC(=O)\C=C(/N)C(C)C Amb32701567 [0,2,0,0,0,0|0,0,0]=2 2862 B9R0.42 COC(=O)\C=C(/N)C(F)F Amb28247396 [0,2,0,0,0,0|2,0,0]=4 2863 B9R0.42 COC(=O)\C=C(/N)N(C)C Amb27216562 [0,2,0,0,0,0|1,0,0]=3 2864 B9R0.42 COC(=O)\C=C(\C)C(F)F Amb33492919 [0,2,0,0,0,0|2,0,0]=4 2865 B9R0.42 COC(=O)\C=C(\C)N(C)C Amb2386647 [0,2,0,0,0,0|1,0,0]=3 2866 B9R0.42 COC(=O)\N=C(/N)C(C)C Amb25147336 [0,2,0,0,0,0|1,0,0]=3 2867 B9R0.42 COC(C)CC(=O)C(=O)O Amb27614317 [0,2,0,0,0,0|0,0,1]=3 2868 B9R0.42 COC(C)CC(N)C(=O)O Amb25147752 [0,2,0,0,0,0|0,0,2]=4 2869 B9R0.42 COC(C)CC(O)C(=O)O Amb33353368 [0,2,0,0,0,0|0,0,2]=4 2870 B9R0.42 COC(C)C[C@@H](N)C(=O)O Amb24412403 [0,2,0,0,0,0|0,0,2]=4 2871 B9R0.42 COC(C)C[C@H](N)C(=O)O Amb27801695 [0,2,0,0,0,0|0,0,2]=4 2872 B9R0.42 COC(C)\C=C(\C)C(=O)O Amb27432877 [0,2,0,0,0,0|0,0,0]=2 2873 B9R0.42 COC(C)\C=C(\C)[N+](=O)[O-] Amb27432954 [0,2,0,0,0,0|1,0,1]=4 2874 B9R0.42 CO\C(C)=C\C(=O)C(C)C Amb28428756 [0,2,0,0,0,0|1,0,0]=3 2875 B9R0.42 CSC(C)C[C@H](N)C(=O)O Amb28208334 [0,2,0,0,0,0|0,0,2]=4 2876 B9R0.42 CS[C@@H](C)C[C@@H](N)C(=O)O Amb27755570 [0,2,0,0,0,0|0,0,2]=4 2877 B9R0.42 C[C@@H](CN)NC(=O)C(=O)O Amb28316025 [0,2,0,0,0,0|1,0,0]=3 2878 B9R0.42 C[C@@H](CO)C[C@@H](N)C(=O)O Amb27398331 [0,2,0,0,0,0|0,0,2]=4 2879 B9R0.42 C[C@@H](CO)NC(=O)C(=O)O Amb28049727 [0,2,0,0,0,0|1,0,0]=3 2880 B9R0.42 C[C@H](CO)C[C@H](N)C(=O)O Amb27625117 [0,2,0,0,0,0|0,0,2]=4 2881 B9R0.42 C\C(=C/C(=O)C(C)C)CCl Amb27469639 [0,2,0,0,0,0|2,0,0]=4 2882 B9R0.42 C\C(=C/[C@H](C)CO)[C@H](C)O Amb27605447 [0,2,0,0,0,0|1,0,1]=4 2883 B9R0.42 C\C(=C\C(N)C(C)C)CO Amb28118444 [0,2,0,0,0,0|1,0,1]=4 2884 B9R0.42 C\C=C(C)/C=C(\C)C(C)=O Amb27640694 [0,2,0,0,0,0|1,0,1]=4 2885 B9R0.42 O=C(O)C(=O)C[C@H](O)CO Amb26605764 [0,2,0,0,0,0|1,0,1]=4 2886 B9R0.43 CC(C)\C=C\C(CN)CO Amb27234142 [0,2,0,0,0,0|1,0,1]=4 2887 B9R0.43 CC(C)\C=C\[C@H](CN)CO Amb28188666 [0,2,0,0,0,0|1,0,1]=4 2888 B9R0.43 CCC(C#CC(=O)O)CC Amb27982193 [0,2,0,0,0,0|0,0,2]=4 2889 B9R0.43 CCC(C#CC(=O)O)SC Amb33169062 [0,2,0,0,0,0|0,0,2]=4 2890 B9R0.43 CCC(CC)CCC(=O)O Amb27462787 [0,2,0,0,0,0|0,0,2]=4 2891 B9R0.43 CCC(CC)OCC(=O)O Amb28051262 [0,2,0,0,0,0|1,0,1]=4 2892 B9R0.43 CCC(CC)SCC(=O)O Amb28182473 [0,2,0,0,0,0|1,0,1]=4 2893 B9R0.43 CCC(CCC(=O)O)NC Amb27230822 [0,2,0,0,0,0|0,0,2]=4 2894 B9R0.43 CCC(CCC(=O)O)OC Amb26936159 [0,2,0,0,0,0|0,0,2]=4 2895 B9R0.43 CCC(OC)OCC(=O)O Amb33341549 [0,2,0,0,0,0|1,0,1]=4 2896 B9R0.43 CCC(\C=C\C(=O)O)CC Amb24375784 [0,2,0,0,0,0|0,0,0]=2 2897 B9R0.43 CCC(\C=C\C(=O)O)OC Amb33326095 [0,2,0,0,0,0|0,0,0]=2 2898 B9R0.43 CCC(\C=C\C(C)=O)CC Amb26977622 [0,2,0,0,0,0|1,0,0]=3 2899 B9R0.43 CCC(\C=C\C(C)=O)OC Amb33326146 [0,2,0,0,0,0|1,0,0]=3 2900 B9R0.43 CCC(\C=C\[N+](=O)[O-])CC Amb25784884 [0,2,0,0,0,0|1,0,1]=4 2901 B9R0.43 CCC(\C=C\[N+](=O)[O-])OC Amb33326148 [0,2,0,0,0,0|1,0,1]=4 2902 B9R0.43 CCN(\C=C\C(N)=O)CC Amb26604570 [0,2,0,0,0,0|2,0,0]=4 2903 B9R0.43 CC\C(C=O)=C\CC(C)C Amb27640555 [0,2,0,0,0,0|1,0,1]=4 2904 B9R0.43 COC(C#CC(=O)O)OC Amb27769936 [0,2,0,0,0,0|0,0,2]=4 2905 B9R0.43 COC(CCC(=O)O)OC Amb24657204 [0,2,0,0,0,0|0,0,2]=4 2906 B9R0.43 COC(OC)OCC(=O)O Amb33340630 [0,2,0,0,0,0|1,0,1]=4 2907 B9R0.43 COC(\C=C\C(C)=O)OC Amb33343253 [0,2,0,0,0,0|1,0,0]=3 2908 B9R0.43 COC(\C=C\C(C)O)OC Amb27839341 [0,2,0,0,0,0|1,0,1]=4 2909 B9R0.43 COC(\C=C\[N+](=O)[O-])OC Amb25961818 [0,2,0,0,0,0|1,0,1]=4 2910 B9R0.43 C\C=C(/C=C/C(=O)O)CC Amb28315773 [0,2,0,0,0,0|0,0,1]=3 2911 B9R0.43 C\C=C(\C=C\C(=O)O)CC Amb18643591 [0,2,0,0,0,0|0,0,1]=3 2912 B9R0.43 C\C=C(\C=C\C(N)=O)CC Amb27593317 [0,2,0,0,0,0|1,0,1]=4 2913 B9R0.43 O=C(O)CSC(CS)CS Amb27400350 [0,2,0,0,0,0|1,0,1]=4 2914 B9R0.48 C#CCN(C)\C=C\C(=O)O Amb27243643 [0,2,0,0,0,0|1,0,0]=3 2915 B9R0.48 C=C(C)\C=C\C(=O)OCC Amb26890933 [0,2,0,0,0,0|0,0,2]=4 2916 B9R0.48 C=C(\C=C\C(C)C)CC=O Amb27423206 [0,2,0,0,0,0|1,0,0]=3 2917 B9R0.48 C=C=CC(N)\C=C\C(=O)O Amb25261307 [0,2,0,0,0,0|1,0,1]=4 2918 B9R0.48 C=CCC(C)CCC(=O)O Amb27605823 [0,2,0,0,0,0|0,0,2]=4 2919 B9R0.48 C=CCC(O)\C=C\C(=O)O Amb27620632 [0,2,0,0,0,0|1,0,0]=3 2920 B9R0.48 C=CCN(C)\C=C\C(=O)O Amb27422117 [0,2,0,0,0,0|1,0,0]=3 2921 B9R0.48 CC(=C\C=O)\C=C\C(=O)O Amb27210491 [0,2,0,0,0,0|0,0,2]=4 2922 B9R0.48 CC(=O)\C=C\C(C)N=[N+]=[N-] Amb25255417 [0,2,0,0,0,0|2,0,0]=4 2923 B9R0.48 CC(=O)\C=C\N(C)CCO Amb26847094 [0,2,0,0,0,0|2,0,0]=4 2924 B9R0.48 CC(C)CCC(=O)OCCl Amb24480678 [0,2,0,0,0,0|0,0,2]=4 2925 B9R0.48 CC(C)CNC(=O)CCO Amb17334239 [0,2,0,0,0,0|1,0,1]=4 2926 B9R0.48 CC(C)CNC(=O)CNO Amb28072902 [0,2,0,0,0,0|1,0,1]=4 2927 B9R0.48 CC(C)COC(=O)OCCl Amb27847524 [0,2,0,0,0,0|1,0,1]=4 2928 B9R0.48 CC(C)NNC(=O)CCO Amb28050638 [0,2,0,0,0,0|2,0,0]=4 2929 B9R0.48 CC(C)\C=C\C(=O)C=[N+]=[N-] Amb20248605 [0,2,0,0,0,0|1,0,0]=3 2930 B9R0.48 CC(C)\C=C\C(=O)\C=C\O Amb27427742 [0,2,0,0,0,0|0,0,0]=2 2931 B9R0.48 CC(C)\C=C\C(C)CCO Amb27651668 [0,2,0,0,0,0|1,0,1]=4 2932 B9R0.48 CC(C)\C=C\C(N)CCO Amb26459702 [0,2,0,0,0,0|1,0,1]=4 2933 B9R0.48 CC(CC=O)CCC(=O)O Amb27439382 [0,2,0,0,0,0|0,0,2]=4 2934 B9R0.48 CC(CCCl)CCC(=O)O Amb27834348 [0,2,0,0,0,0|0,0,2]=4 2935 B9R0.48 CC(CCN)CCC(=O)O Amb18124749 [0,2,0,0,0,0|0,0,2]=4 2936 B9R0.48 CC(CCN)SCC(=O)O Amb27244497 [0,2,0,0,0,0|1,0,1]=4 2937 B9R0.48 CC(CCO)NCC(=O)O Amb27174877 [0,2,0,0,0,0|1,0,1]=4 2938 B9R0.48 CC(CCS)CCC(=O)O Amb28291582 [0,2,0,0,0,0|0,0,2]=4 2939 B9R0.48 CC(\C=C\C(=O)O)=C/C=O Amb27215348 [0,2,0,0,0,0|0,0,2]=4 2940 B9R0.48 CC(\C=C\C(=O)O)CCO Amb27646330 [0,2,0,0,0,0|0,0,0]=2 2941 B9R0.48 CC(\C=C\N(C)C)=C/C=O Amb27239569 [0,2,0,0,0,0|2,0,0]=4 2942 B9R0.48 CCCC(Br)\C=C\C(C)=O Amb27463361 [0,2,0,0,0,0|2,0,0]=4 2943 B9R0.48 CCCC(C)C#CC(=O)O Amb27981033 [0,2,0,0,0,0|0,0,2]=4 2944 B9R0.48 CCCC(C)CCC(=O)O Amb28193257 [0,2,0,0,0,0|0,0,2]=4 2945 B9R0.48 CCCC(C)OCC(=O)O Amb18124782 [0,2,0,0,0,0|1,0,1]=4 2946 B9R0.48 CCCC(C)\C=C\C(=O)O Amb33474963 [0,2,0,0,0,0|0,0,0]=2 2947 B9R0.48 CCCC(C)\C=C\C(C)=O Amb24686480 [0,2,0,0,0,0|1,0,0]=3 2948 B9R0.48 CCCC(C)\C=C\C(C)O Amb27262557 [0,2,0,0,0,0|1,0,1]=4 2949 B9R0.48 CCCC(C)\C=C\[N+](=O)[O-] Amb27472221 [0,2,0,0,0,0|1,0,1]=4 2950 B9R0.48 CCCC(O)\C=C\C(=O)O Amb27790698 [0,2,0,0,0,0|1,0,0]=3 2951 B9R0.48 CCC[C@@H](O)\C=C\C(=O)O Amb27961045 [0,2,0,0,0,0|1,0,0]=3 2952 B9R0.48 CCC[C@H](C)CCC(=O)O Amb24446759 [0,2,0,0,0,0|0,0,2]=4 2953 B9R0.48 CCNC(=O)\C=C/C(=O)O Amb1235096 [0,2,0,0,0,0|1,0,1]=4 2954 B9R0.48 CCNC(=O)\C=C\C(=O)O Amb9251696 [0,2,0,0,0,0|1,0,1]=4 2955 B9R0.48 CCOC(=O)C#CC(C)C Amb10604567 [0,2,0,0,0,0|0,0,2]=4 2956 B9R0.48 CCOC(=O)CC=C(C)C Amb4036274 [0,2,0,0,0,0|0,0,2]=4 2957 B9R0.48 CCOC(=O)CCC(C)C Amb9273760 [0,2,0,0,0,0|0,0,2]=4 2958 B9R0.48 CCOC(=O)CNC(C)C Amb19887458 [0,2,0,0,0,0|1,0,1]=4 2959 B9R0.48 CCOC(=O)CNC(C)C Amb6706356 [0,2,0,0,0,0|1,0,1]=4 2960 B9R0.48 CCOC(=O)COC(C)C Amb9206384 [0,2,0,0,0,0|1,0,1]=4 2961 B9R0.48 CCOC(=O)NCC(C)C Amb17862254 [0,2,0,0,0,0|1,0,1]=4 2962 B9R0.48 CCOC(=O)OCC(C)C Amb26419608 [0,2,0,0,0,0|1,0,1]=4 2963 B9R0.48 CCOC(=O)\C=C/C(=O)O Amb24462678 [0,2,0,0,0,0|1,0,1]=4 2964 B9R0.48 CCOC(=O)\C=C/N(C)C Amb23554946 [0,2,0,0,0,0|1,0,0]=3 2965 B9R0.48 CCOC(=O)\C=C\C(=O)O Amb2189151 [0,2,0,0,0,0|1,0,1]=4 2966 B9R0.48 CCOC(=O)\C=C\C(C)=O Amb3428594 [0,2,0,0,0,0|1,0,1]=4 2967 B9R0.48 CCOC(=O)\C=C\C(C)C Amb20247117 [0,2,0,0,0,0|0,0,0]=2 2968 B9R0.48 CCOC(=O)\C=C\C(C)N Amb27843363 [0,2,0,0,0,0|1,0,0]=3 2969 B9R0.48 CCOC(=O)\C=C\C(F)F Amb20668965 [0,2,0,0,0,0|2,0,0]=4 2970 B9R0.48 CCOC(=O)\C=C\N(C)C Amb35826729 [0,2,0,0,0,0|1,0,0]=3 2971 B9R0.48 CCOC(=O)\C=C\N(C)C Amb8387434 [0,2,0,0,0,0|1,0,0]=3 2972 B9R0.48 CCOC(=O)\C=C\[C@H](C)N Amb27461424 [0,2,0,0,0,0|1,0,0]=3 2973 B9R0.48 CCOC(C)CCC(=O)O Amb24690847 [0,2,0,0,0,0|0,0,2]=4 2974 B9R0.48 CCOC(C)OCC(=O)O Amb28126960 [0,2,0,0,0,0|1,0,1]=4 2975 B9R0.48 CCOC(C)\C=C\C(=O)O Amb33425399 [0,2,0,0,0,0|0,0,0]=2 2976 B9R0.48 CCOC(C)\C=C\C(C)=O Amb33424994 [0,2,0,0,0,0|1,0,0]=3 2977 B9R0.48 CCOC(C)\C=C\[N+](=O)[O-] Amb33425045 [0,2,0,0,0,0|1,0,1]=4 2978 B9R0.48 CC\C=C(C)/C=C/C(C)=O Amb27861011 [0,2,0,0,0,0|1,0,1]=4 2979 B9R0.48 CN(C)\C=C\C(Cl)=C\C=O Amb27592926 [0,2,0,0,0,0|2,0,0]=4 2980 B9R0.48 CN(C)\C=N\C(=O)\C=C\O Amb27213680 [0,2,0,0,0,0|2,0,0]=4 2981 B9R0.48 CNCC(C)C#CC(=O)O Amb33169001 [0,2,0,0,0,0|0,0,2]=4 2982 B9R0.48 COCC(=O)CC=C(C)C Amb27233842 [0,2,0,0,0,0|0,0,2]=4 2983 B9R0.48 COCC(=O)CCC(C)C Amb28069967 [0,2,0,0,0,0|0,0,2]=4 2984 B9R0.48 COCC(=O)CNC(C)C Amb27231606 [0,2,0,0,0,0|1,0,1]=4 2985 B9R0.48 COCC(=O)\C=C/N(C)C Amb28385150 [0,2,0,0,0,0|1,0,0]=3 2986 B9R0.48 COCC(C)C#CC(=O)O Amb33168980 [0,2,0,0,0,0|0,0,2]=4 2987 B9R0.48 COCC(C)NCC(=O)O Amb33549979 [0,2,0,0,0,0|1,0,1]=4 2988 B9R0.48 COCC(C)NCC(=O)O Amb7766445 [0,2,0,0,0,0|1,0,1]=4 2989 B9R0.48 COCC(C)OCC(=O)O Amb27807862 [0,2,0,0,0,0|1,0,1]=4 2990 B9R0.48 CONC(=O)CCC(C)C Amb27491099 [0,2,0,0,0,0|0,0,2]=4 2991 B9R0.48 CONC(=O)CSC(C)C Amb27490607 [0,2,0,0,0,0|1,0,1]=4 2992 B9R0.48 CONC(=O)\C=C/C(=O)O Amb27855758 [0,2,0,0,0,0|1,0,1]=4 2993 B9R0.48 CSSC(C)CCC(=O)O Amb27843301 [0,2,0,0,0,0|0,0,2]=4 2994 B9R0.48 C[C@@H](CC#N)CCC(=O)O Amb27950078 [0,2,0,0,0,0|0,0,2]=4 2995 B9R0.48 C[C@@H](CCO)CCC(=O)O Amb28250798 [0,2,0,0,0,0|0,0,2]=4 2996 B9R0.48 C[C@H](\C=C\C(=O)O)CCO Amb28050109 [0,2,0,0,0,0|0,0,0]=2 2997 B9R0.48 C\C(=C\CC(C)C)CC=O Amb28247159 [0,2,0,0,0,0|1,0,1]=4 2998 B9R0.48 C\C=C/C(C)\C=C\C(C)=O Amb27434173 [0,2,0,0,0,0|1,0,0]=3 2999 B9R0.48 C\C=C\C(=O)\C=C\C(C)O Amb28202050 [0,2,0,0,0,0|2,0,0]=4 3000 B9R0.48 C\C=C\C(=O)\C=C\N(C)C Amb27440004 [0,2,0,0,0,0|2,0,0]=4 3001 B9R0.48 C\C=C\C(C)\C=C/C(=O)O Amb27468642 [0,2,0,0,0,0|0,0,0]=2 3002 B9R0.48 O=C(O)\C=C\C(=O)NCO Amb28346249 [0,2,0,0,0,0|1,0,1]=4 3003 B9R0.64 C#CC(C)(C)OCC(=O)O Amb27630706 [0,2,0,0,0,0|1,0,1]=4 3004 B9R0.64 C=C(C)\C=C\C(C)(C)CO Amb27839210 [0,2,0,0,0,0|2,0,0]=4 3005 B9R0.64 C=CC(C)(C)CCC(=O)O Amb28429810 [0,2,0,0,0,0|0,0,2]=4 3006 B9R0.64 CC(=O)\C=C\C(C)(C)CO Amb33475115 [0,2,0,0,0,0|1,0,0]=3 3007 B9R0.64 CC(C)(C#N)CCC(=O)O Amb26858929 [0,2,0,0,0,0|0,0,2]=4 3008 B9R0.64 CC(C)(C#N)NCC(=O)O Amb25699825 [0,2,0,0,0,0|1,0,1]=4 3009 B9R0.64 CC(C)(C=O)CCC(=O)O Amb18644118 [0,2,0,0,0,0|0,0,2]=4 3010 B9R0.64 CC(C)(C=O)\C=C/C(=O)O Amb27473340 [0,2,0,0,0,0|0,0,0]=2 3011 B9R0.64 CC(C)(CN)CCC(=O)O Amb27790470 [0,2,0,0,0,0|0,0,2]=4 3012 B9R0.64 CC(C)(CO)CCC(=O)O Amb27173192 [0,2,0,0,0,0|0,0,2]=4 3013 B9R0.64 CC(C)(CO)OCC(=O)O Amb33202720 [0,2,0,0,0,0|1,0,1]=4 3014 B9R0.64 CC(C)(\C=C\C(=O)O)CO Amb26900319 [0,2,0,0,0,0|0,0,0]=2 3015 B9R0.64 CC(C)(\C=C\[N+](=O)[O-])CO Amb33197712 [0,2,0,0,0,0|1,0,1]=4 3016 B9R0.64 CC(C)\C=C\C(C)(C)CO Amb28197512 [0,2,0,0,0,0|1,0,1]=4 3017 B9R0.64 CCC(C)(C)C#CC(=O)O Amb27836215 [0,2,0,0,0,0|0,0,2]=4 3018 B9R0.64 CCC(C)(C)CCC(=O)O Amb18644164 [0,2,0,0,0,0|0,0,2]=4 3019 B9R0.64 CCC(C)(C)OCC(=O)O Amb9208491 [0,2,0,0,0,0|1,0,1]=4 3020 B9R0.64 CCC(C)(C)\C=C\C(=O)O Amb33428990 [0,2,0,0,0,0|0,0,0]=2 3021 B9R0.64 CCC(C)(C)\C=C\C(C)=O Amb32954786 [0,2,0,0,0,0|1,0,0]=3 3022 B9R0.64 CCC(C)(C)\C=C\[N+](=O)[O-] Amb27232114 [0,2,0,0,0,0|1,0,1]=4 3023 B9R0.64 CCC(C)(C)\N=C/C(C)=O Amb27265391 [0,2,0,0,0,0|2,0,0]=4 3024 B9R0.64 CCC(C)(N)C#CC(=O)O Amb33168969 [0,2,0,0,0,0|0,0,2]=4 3025 B9R0.64 CCC(C)(N)CCC(=O)O Amb33036311 [0,2,0,0,0,0|0,0,2]=4 3026 B9R0.64 CCC(C)(O)CCC(=O)O Amb25317242 [0,2,0,0,0,0|0,0,2]=4 3027 B9R0.64 CCC(C)(O)\C=C\C(C)O Amb27766561 [0,2,0,0,0,0|1,0,1]=4 3028 B9R0.64 CCP(=O)(O)\C=C\C(=O)O Amb32661617 [0,2,0,0,0,0|2,0,0]=4 3029 B9R0.64 CCS(=O)(=O)\C=C\C(=O)O Amb32665830 [0,2,0,0,0,0|2,0,0]=4 3030 B9R0.64 CC[C@](C)(O)CCC(=O)O Amb27810635 [0,2,0,0,0,0|0,0,2]=4 3031 B9R0.64 COC(C)(C)C#CC(=O)O Amb25777780 [0,2,0,0,0,0|0,0,2]=4 3032 B9R0.64 COC(C)(C)CCC(=O)O Amb27835401 [0,2,0,0,0,0|0,0,2]=4 3033 B9R0.64 COC(C)(C)\C=C\C(C)=O Amb27956075 [0,2,0,0,0,0|1,0,0]=3 3034 B9R0.64 COC(C)(C)\C=C\C(C)O Amb27470660 [0,2,0,0,0,0|1,0,1]=4 3035 B9R0.64 COC(C)(C)\C=C\[N+](=O)[O-] Amb27246318 [0,2,0,0,0,0|1,0,1]=4 3036 B9R0.64 COS(=O)(=O)\C=C\C(C)O Amb27978218 [0,2,0,0,0,0|2,0,0]=4 3037 B9R0.64 CSC(C)(C)CCC(=O)O Amb28245393 [0,2,0,0,0,0|0,0,2]=4 3038 B9R0.64 O=C(O)\C=C\C(Cl)(Cl)CCl Amb28053532 [0,2,0,0,0,0|1,0,0]=3 3039 B9R0.10 CC(=O)CC(=O)C(C)(C)C Amb7764664 [0,2,0,0,0,0|1,0,1]=4 3040 B9R0.10 CC(=O)NC(=O)C(C)(C)Br Amb28041264 [0,2,0,0,0,0|2,0,0]=4 3041 B9R0.10 CC(=O)NC(=O)C(C)(C)C Amb27194404 [0,2,0,0,0,0|2,0,0]=4 3042 B9R0.10 CC(=O)\C=C(/C)C(C)(C)C Amb21948345 [0,2,0,0,0,0|1,0,0]=3 3043 B9R0.10 CC(=O)\C=C(/Cl)[Si](C)(C)C Amb27615143 [0,2,0,0,0,0|1,1,0]=4 3044 B9R0.10 CC(=O)\C=C(\N)C(C)(C)O Amb27788212 [0,2,0,0,0,0|1,0,0]=3 3045 B9R0.10 CC(C)(Br)C(=O)NC(N)=O Amb27268423 [0,2,0,0,0,0|2,0,0]=4 3046 B9R0.10 CC(C)(C)C(=O)CC(=O)[Na] Amb27762570 [0,2,0,0,0,0|1,0,1]=4 3047 B9R0.10 CC(C)(C)C(=O)CC(N)=O Amb28240438 [0,2,0,0,0,0|1,0,1]=4 3048 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb31307616 [0,2,0,0,0,0|0,0,2]=4 3049 B9R0.10 CC(C)(C)C(N)CC(=O)O Amb8515866 [0,2,0,0,0,0|0,0,2]=4 3050 B9R0.10 CC(C)(C)C(O)CC(=O)O Amb17232006 [0,2,0,0,0,0|0,0,2]=4 3051 B9R0.10 CC(C)(C)S(=O)CC(=O)O Amb18974534 [0,2,0,0,0,0|1,0,1]=4 3052 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb19888358 [0,2,0,0,0,0|0,0,2]=4 3053 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O Amb33456414 [0,2,0,0,0,0|0,0,2]=4 3054 B9R0.10 CC(C)(C)[C@@H](O)CC(=O)O Amb24505172 [0,2,0,0,0,0|0,0,2]=4 3055 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O Amb33456294 [0,2,0,0,0,0|0,0,2]=4 3056 B9R0.10 CC(C)(C)[C@H](O)CC(=O)O Amb25889023 [0,2,0,0,0,0|0,0,2]=4 3057 B9R0.10 CC(C)(C)\C(N)=C\C(=O)O Amb28313951 [0,2,0,0,0,0|0,0,0]=2 3058 B9R0.10 CC(C)(C)\C(N)=C\C(N)=S Amb27866100 [0,2,0,0,0,0|1,1,0]=4 3059 B9R0.10 CC(C)(C)\C(O)=C\C(N)=O Amb28456576 [0,2,0,0,0,0|1,0,0]=3 3060 B9R0.10 CC(C)(F)C(N)CC(=O)O Amb33273018 [0,2,0,0,0,0|0,0,2]=4 3061 B9R0.10 CC(C)(F)C(O)CC(=O)O Amb33272209 [0,2,0,0,0,0|0,0,2]=4 3062 B9R0.10 CC(C)(F)[C@@H](O)CC(=O)O Amb33272208 [0,2,0,0,0,0|0,0,2]=4 3063 B9R0.10 CC(C)(F)[C@H](O)CC(=O)O Amb33225482 [0,2,0,0,0,0|0,0,2]=4 3064 B9R0.10 CC(C)(N)C(=O)NC(N)=O Amb27945636 [0,2,0,0,0,0|2,0,0]=4 3065 B9R0.10 CC(C)(S)C(N)CC(=O)O Amb28182470 [0,2,0,0,0,0|0,0,2]=4 3066 B9R0.10 CC(C)=CC(=O)C(C)(C)N Amb27391414 [0,2,0,0,0,0|2,0,0]=4 3067 B9R0.10 CC(CC(=O)O)C(C)(C)C Amb6749223 [0,2,0,0,0,0|0,0,2]=4 3068 B9R0.10 CC(CC(=O)O)C(C)(C)F Amb27633286 [0,2,0,0,0,0|0,0,2]=4 3069 B9R0.10 CC(CC(=O)O)C(C)(C)N Amb19651352 [0,2,0,0,0,0|0,0,2]=4 3070 B9R0.10 CC(CC(=O)O)C(C)(C)O Amb27815005 [0,2,0,0,0,0|0,0,2]=4 3071 B9R0.10 CN(CC(=O)O)C(C)(C)C Amb17334246 [0,2,0,0,0,0|1,0,1]=4 3072 B9R0.10 C[C@@H](CC(=O)O)C(C)(C)C Amb28050110 [0,2,0,0,0,0|0,0,2]=4 3073 B9R0.10 C[Si](C)(C)\C(Cl)=C\C(=O)O Amb27657462 [0,2,0,0,0,0|0,1,0]=3 3074 B9R0.10 C\C(=C/C(=O)O)C(C)(C)C Amb6749108 [0,2,0,0,0,0|0,0,0]=2 3075 B9R0.10 C\C(=C/C(=O)O)C(F)(F)F Amb25353163 [0,2,0,0,0,0|2,0,0]=4 3076 B9R0.10 C\C(=C/C(N)=O)C(C)(C)C Amb28429721 [0,2,0,0,0,0|1,0,0]=3 3077 B9R0.10 C\C(=C\C(=O)O)C(C)(C)C Amb28314071 [0,2,0,0,0,0|0,0,0]=2 3078 B9R0.10 C\C(=C\C(=O)O)C(F)(F)F Amb9809685 [0,2,0,0,0,0|2,0,0]=4 3079 B9R0.10 C\C(N)=C/C(=O)C(C)(C)C Amb28131576 [0,2,0,0,0,0|2,0,0]=4 3080 B9R0.10 O=C(O)\C=C(\F)C(F)(F)F Amb27954866 [0,2,0,0,0,0|2,0,0]=4 3081 B9R0.11 CC(C)=CC(C)(C)C(=O)O Amb27162610 [0,2,0,0,0,0|0,0,2]=4 3082 B9R0.11 CC(C)C(C)(C)CC(=O)O Amb18124695 [0,2,0,0,0,0|0,0,2]=4 3083 B9R0.11 CC(C)C(C)(N)CC(=O)O Amb25934755 [0,2,0,0,0,0|0,0,2]=4 3084 B9R0.11 CC(C)C(C)(O)CC(=O)O Amb18991699 [0,2,0,0,0,0|0,0,2]=4 3085 B9R0.11 CC(C)C(F)(F)CC(=O)O Amb26991653 [0,2,0,0,0,0|0,0,2]=4 3086 B9R0.11 CC(C)CC(C)(C)C(=O)O Amb10843993 [0,2,0,0,0,0|0,0,2]=4 3087 B9R0.11 CC(C)CC(C)(F)C(=O)O Amb25997944 [0,2,0,0,0,0|0,0,2]=4 3088 B9R0.11 CC(C)CC(C)(N)C(=O)O Amb4134832 [0,2,0,0,0,0|0,0,2]=4 3089 B9R0.11 CC(C)CC(C)(O)C(=O)O Amb18523766 [0,2,0,0,0,0|0,0,2]=4 3090 B9R0.11 CC(C)CC(F)(F)C(=O)O Amb25773701 [0,2,0,0,0,0|0,0,2]=4 3091 B9R0.11 CC(C)C[C@@](C)(N)C(=O)O Amb8630501 [0,2,0,0,0,0|0,0,2]=4 3092 B9R0.11 CC(C)C[C@](C)(N)C(=O)O Amb10066904 [0,2,0,0,0,0|0,0,2]=4 3093 B9R0.11 CC(C)NC(C)(C)C(=O)O Amb3978636 [0,2,0,0,0,0|1,0,1]=4 3094 B9R0.11 CC(C)OC(C)(C)C(=O)O Amb18976739 [0,2,0,0,0,0|1,0,1]=4 3095 B9R0.11 CC(C)S(=O)(=O)CC(=O)O Amb6281038 [0,2,0,0,0,0|1,0,1]=4 3096 B9R0.11 CC(C)SC(C)(C)C(=O)O Amb17501486 [0,2,0,0,0,0|1,0,1]=4 3097 B9R0.11 CC(C)[C@@](C)(N)CC(=O)O Amb27185746 [0,2,0,0,0,0|0,0,2]=4 3098 B9R0.11 CC(C)[C@](C)(N)CC(=O)O Amb28346262 [0,2,0,0,0,0|0,0,2]=4 3099 B9R0.11 CC(C)[C@](C)(O)CC(=O)O Amb27810826 [0,2,0,0,0,0|0,0,2]=4 3100 B9R0.39 C#CC(CC(=O)O)C(C)C Amb27408324 [0,2,0,0,0,0|0,0,2]=4 3101 B9R0.39 C#C[C@@H](CC(=O)O)C(C)C Amb27977044 [0,2,0,0,0,0|0,0,2]=4 3102 B9R0.39 C#C[C@H](CC(=O)O)C(C)C Amb27253902 [0,2,0,0,0,0|0,0,2]=4 3103 B9R0.39 C=C(C)\C=C(/CC)C(=O)O Amb28457972 [0,2,0,0,0,0|0,0,2]=4 3104 B9R0.39 C=C(C)\C=C(/CO)C(C)C Amb27267465 [0,2,0,0,0,0|2,0,0]=4 3105 B9R0.39 C=CC(CC(=O)O)C(C)C Amb18643903 [0,2,0,0,0,0|0,0,2]=4 3106 B9R0.39 C=CC(SC(C)C)C(=O)O Amb28123807 [0,2,0,0,0,0|1,0,1]=4 3107 B9R0.39 C=C[C@@H](CC(=O)O)C(C)C Amb27881786 [0,2,0,0,0,0|0,0,2]=4 3108 B9R0.39 C=C[C@H](CC(=O)O)C(C)C Amb27962891 [0,2,0,0,0,0|0,0,2]=4 3109 B9R0.39 C=C\C(=C/C(C)=O)N(C)C Amb26890154 [0,2,0,0,0,0|2,0,0]=4 3110 B9R0.39 CC(=O)\C(=C/C(C)C)CBr Amb27630403 [0,2,0,0,0,0|1,0,0]=3 3111 B9R0.39 CC(=O)\C(=C/Cl)CC(C)C Amb27614904 [0,2,0,0,0,0|1,0,1]=4 3112 B9R0.39 CC(=O)\C(=C/O)CC(C)C Amb27752064 [0,2,0,0,0,0|1,0,1]=4 3113 B9R0.39 CC(=O)\C(C#N)=C/N(C)C Amb23453423 [0,2,0,0,0,0|2,0,0]=4 3114 B9R0.39 CC(=O)\C(C#N)=C\C(C)C Amb27669051 [0,2,0,0,0,0|1,0,0]=3 3115 B9R0.39 CC(=O)\C(C#N)=C\N(C)C Amb8394810 [0,2,0,0,0,0|2,0,0]=4 3116 B9R0.39 CC(C)C(C#N)CC(=O)O Amb25818234 [0,2,0,0,0,0|0,0,2]=4 3117 B9R0.39 CC(C)C(CN)CC(=O)O Amb26910759 [0,2,0,0,0,0|0,0,2]=4 3118 B9R0.39 CC(C)CC(C#N)C(=O)O Amb23558965 [0,2,0,0,0,0|0,0,2]=4 3119 B9R0.39 CC(C)CC(CN)C(=O)O Amb19021764 [0,2,0,0,0,0|0,0,2]=4 3120 B9R0.39 CC(C)CC(CN)C(=O)O Amb28555451 [0,2,0,0,0,0|0,0,2]=4 3121 B9R0.39 CC(C)CC(CO)C(=O)O Amb18124780 [0,2,0,0,0,0|0,0,2]=4 3122 B9R0.39 CC(C)CC(N=O)C(=O)O Amb27461396 [0,2,0,0,0,0|0,0,2]=4 3123 B9R0.39 CC(C)CC(NCl)C(=O)O Amb27401848 [0,2,0,0,0,0|0,0,2]=4 3124 B9R0.39 CC(C)CC(ON)C(=O)O Amb18644321 [0,2,0,0,0,0|0,0,2]=4 3125 B9R0.39 CC(C)CC(ON)C(=O)O Amb33484371 [0,2,0,0,0,0|0,0,2]=4 3126 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756732 [0,2,0,0,0,0|0,0,2]=4 3127 B9R0.39 CC(C)C[C@@H](CN)C(=O)O Amb22756740 [0,2,0,0,0,0|0,0,2]=4 3128 B9R0.39 CC(C)C[C@@H](NN)C(=O)O Amb27424998 [0,2,0,0,0,0|0,0,2]=4 3129 B9R0.39 CC(C)C[C@@H](ON)C(=O)O Amb27975779 [0,2,0,0,0,0|0,0,2]=4 3130 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb26390781 [0,2,0,0,0,0|0,0,2]=4 3131 B9R0.39 CC(C)C[C@H](CN)C(=O)O Amb32620226 [0,2,0,0,0,0|0,0,2]=4 3132 B9R0.39 CC(C)C[C@H](NN)C(=O)O Amb27488207 [0,2,0,0,0,0|0,0,2]=4 3133 B9R0.39 CC(C)C\C(=N\O)C(N)=O Amb27450654 [0,2,0,0,0,0|1,0,1]=4 3134 B9R0.39 CC(C)N(C#N)CC(=O)O Amb35634517 [0,2,0,0,0,0|1,0,1]=4 3135 B9R0.39 CC(C)NC(CN)C(=O)O Amb28291039 [0,2,0,0,0,0|1,0,1]=4 3136 B9R0.39 CC(C)NC(CO)C(=O)O Amb26046487 [0,2,0,0,0,0|1,0,1]=4 3137 B9R0.39 CC(C)NC(CS)C(=O)O Amb27233014 [0,2,0,0,0,0|1,0,1]=4 3138 B9R0.39 CC(C)N[C@@H](CS)C(=O)O Amb25299344 [0,2,0,0,0,0|1,0,1]=4 3139 B9R0.39 CC(C)S[C@@H](CN)C(=O)O Amb27444140 [0,2,0,0,0,0|1,0,1]=4 3140 B9R0.39 CC(C)S\C(=N\O)C(N)=O Amb28458278 [0,2,0,0,0,0|2,0,0]=4 3141 B9R0.39 CC(C)[C@@H](C#N)CC(=O)O Amb27473398 [0,2,0,0,0,0|0,0,2]=4 3142 B9R0.39 CC(C)[C@H](C#N)CC(=O)O Amb28184580 [0,2,0,0,0,0|0,0,2]=4 3143 B9R0.39 CC(C)\C=C(/C#N)C(=O)O Amb25864734 [0,2,0,0,0,0|0,0,0]=2 3144 B9R0.39 CC(C)\C=C(/C#N)C(N)=S Amb27239917 [0,2,0,0,0,0|1,1,0]=4 3145 B9R0.39 CCC(CC(=O)O)C(C)C Amb33534084 [0,2,0,0,0,0|0,0,2]=4 3146 B9R0.39 CCC(CC(C)C)C(=O)O Amb19014184 [0,2,0,0,0,0|0,0,2]=4 3147 B9R0.39 CCC(NC(C)C)C(=O)O Amb28555426 [0,2,0,0,0,0|1,0,1]=4 3148 B9R0.39 CCC(NC(C)C)C(=O)O Amb9620437 [0,2,0,0,0,0|1,0,1]=4 3149 B9R0.39 CCC(SC(C)C)C(=O)O Amb17501347 [0,2,0,0,0,0|1,0,1]=4 3150 B9R0.39 CC[C@@H](CC(C)C)C(=O)O Amb28397993 [0,2,0,0,0,0|0,0,2]=4 3151 B9R0.39 CC[C@H](CC(=O)O)C(C)C Amb25989910 [0,2,0,0,0,0|0,0,2]=4 3152 B9R0.39 CC\C(=C/C(=O)O)C(C)=O Amb26391990 [0,2,0,0,0,0|1,0,1]=4 3153 B9R0.39 CC\C(=C/C(=O)O)C(C)C Amb18967765 [0,2,0,0,0,0|0,0,0]=2 3154 B9R0.39 CC\C(=C/C(C)=O)C(C)C Amb28189821 [0,2,0,0,0,0|1,0,0]=3 3155 B9R0.39 CC\C(=C/C(C)C)C(=O)O Amb18643946 [0,2,0,0,0,0|0,0,0]=2 3156 B9R0.39 CC\C(=C/C(C)C)C(C)O Amb27430989 [0,2,0,0,0,0|1,0,1]=4 3157 B9R0.39 CC\C(=N/N(C)C)C(=O)O Amb28423305 [0,2,0,0,0,0|2,0,0]=4 3158 B9R0.39 CN(C)\C=C(/C#N)C(N)=O Amb4139694 [0,2,0,0,0,0|2,0,0]=4 3159 B9R0.39 CN(C)\C=C(\C#N)C(N)=O Amb10609090 [0,2,0,0,0,0|2,0,0]=4 3160 B9R0.39 CNC(CC(=O)O)C(C)C Amb27209417 [0,2,0,0,0,0|0,0,2]=4 3161 B9R0.39 CNC(CC(C)C)C(=O)O Amb22274694 [0,2,0,0,0,0|0,0,2]=4 3162 B9R0.39 CNC(CC(C)C)C(=O)O Amb9283589 [0,2,0,0,0,0|0,0,2]=4 3163 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb16183858 [0,2,0,0,0,0|0,0,2]=4 3164 B9R0.39 CN[C@@H](CC(C)C)C(=O)O Amb2779901 [0,2,0,0,0,0|0,0,2]=4 3165 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb10842218 [0,2,0,0,0,0|0,0,2]=4 3166 B9R0.39 CN[C@H](CC(C)C)C(=O)O Amb22745995 [0,2,0,0,0,0|0,0,2]=4 3167 B9R0.39 CN\C(=C/N(C)C)C(C)=O Amb27222350 [0,2,0,0,0,0|2,0,0]=4 3168 B9R0.39 CN\C(=C\C(C)=O)N(C)C Amb28321932 [0,2,0,0,0,0|2,0,0]=4 3169 B9R0.39 COC(C=C(C)C)C(=O)O Amb20621506 [0,2,0,0,0,0|0,0,2]=4 3170 B9R0.39 COC(CC(C)C)C(=O)O Amb26656466 [0,2,0,0,0,0|0,0,2]=4 3171 B9R0.39 CO[C@@H](CC(C)C)C(=O)O Amb28126876 [0,2,0,0,0,0|0,0,2]=4 3172 B9R0.39 CO\C(=C/C(=O)O)C(C)=O Amb28345759 [0,2,0,0,0,0|1,0,1]=4 3173 B9R0.39 CSC(CC(C)C)C(=O)O Amb27658945 [0,2,0,0,0,0|0,0,2]=4 3174 B9R0.39 C\C=C(\CC(C)=O)C(C)C Amb25265231 [0,2,0,0,0,0|1,0,1]=4 3175 B9R0.39 O=C\C(=C/C(=O)O)C(Cl)Cl Amb27392225 [0,2,0,0,0,0|2,0,0]=4 3176 B9R0.39 O=C\C(=C\C(=O)O)C(Cl)Cl Amb27630396 [0,2,0,0,0,0|2,0,0]=4 3177 B9R0.57 C=C(CC(C)(C)C)C(=O)O Amb27815006 [0,2,0,0,0,0|0,0,1]=3 3178 B9R0.57 C=C(OC(C)(C)C)C(=O)O Amb18644144 [0,2,0,0,0,0|1,0,0]=3 3179 B9R0.57 CC(=O)C(=O)NC(C)(C)C Amb17399882 [0,2,0,0,0,0|2,0,0]=4 3180 B9R0.57 CC(=O)C(=O)OC(C)(C)C Amb27973047 [0,2,0,0,0,0|2,0,0]=4 3181 B9R0.57 CC(=O)\C(C)=C\C(C)(C)C Amb27616506 [0,2,0,0,0,0|1,0,0]=3 3182 B9R0.57 CC(=O)\C(C)=C\[Si](C)(C)C Amb28053978 [0,2,0,0,0,0|1,1,0]=4 3183 B9R0.57 CC(=O)\C(Cl)=N\C(C)(C)C Amb28052217 [0,2,0,0,0,0|2,0,0]=4 3184 B9R0.57 CC(C)(C)CC(=O)C(=O)O Amb6295779 [0,2,0,0,0,0|0,0,1]=3 3185 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb7172575 [0,2,0,0,0,0|0,0,2]=4 3186 B9R0.57 CC(C)(C)CC(N)C(=O)O Amb8385710 [0,2,0,0,0,0|0,0,2]=4 3187 B9R0.57 CC(C)(C)CC(O)C(=O)O Amb18302187 [0,2,0,0,0,0|0,0,2]=4 3188 B9R0.57 CC(C)(C)C[C@@H](Br)C(=O)O Amb28049945 [0,2,0,0,0,0|0,0,2]=4 3189 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O Amb16184025 [0,2,0,0,0,0|0,0,2]=4 3190 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O Amb6295897 [0,2,0,0,0,0|0,0,2]=4 3191 B9R0.57 CC(C)(C)NC(=O)C(=O)Cl Amb28049997 [0,2,0,0,0,0|2,0,0]=4 3192 B9R0.57 CC(C)(C)NC(=O)C(=O)O Amb2693955 [0,2,0,0,0,0|1,0,0]=3 3193 B9R0.57 CC(C)(C)NC(=O)C(N)=O Amb3613981 [0,2,0,0,0,0|2,0,0]=4 3194 B9R0.57 CC(C)(C)OC(=O)C(=O)Cl Amb22736009 [0,2,0,0,0,0|2,0,0]=4 3195 B9R0.57 CC(C)(C)OC(=O)C(=O)[O-] Amb22436495 [0,2,0,0,0,0|1,0,1]=4 3196 B9R0.57 CC(C)(C)OC(=O)C(N)=O Amb22546413 [0,2,0,0,0,0|2,0,0]=4 3197 B9R0.57 CC(C)(C)OC(F)C(=O)O Amb27399823 [0,2,0,0,0,0|1,0,1]=4 3198 B9R0.57 CC(C)(C)\C=C(/F)C(=O)O Amb27194420 [0,2,0,0,0,0|0,0,0]=2 3199 B9R0.57 CC(C)(C)\C=C(\Br)C(=O)O Amb27230191 [0,2,0,0,0,0|0,0,0]=2 3200 B9R0.57 CC(C)(Cl)CC(N)C(=O)O Amb28555620 [0,2,0,0,0,0|0,0,2]=4 3201 B9R0.57 CC(C)(F)CC(=O)C(=O)O Amb33273007 [0,2,0,0,0,0|0,0,1]=3 3202 B9R0.57 CC(C)(F)CC(N)C(=O)O Amb26496047 [0,2,0,0,0,0|0,0,2]=4 3203 B9R0.57 CC(C)(F)CC(O)C(=O)O Amb33272231 [0,2,0,0,0,0|0,0,2]=4 3204 B9R0.57 CC(C)(F)C[C@@H](N)C(=O)O Amb24055873 [0,2,0,0,0,0|0,0,2]=4 3205 B9R0.57 CC(C)(F)C[C@H](N)C(=O)O Amb26959500 [0,2,0,0,0,0|0,0,2]=4 3206 B9R0.57 CC(C)(O)CC(N)C(=O)O Amb18644326 [0,2,0,0,0,0|0,0,2]=4 3207 B9R0.57 CC(C)(O)CC(O)C(=O)O Amb27953570 [0,2,0,0,0,0|0,0,2]=4 3208 B9R0.57 CC(C)(O)C[C@@H](N)C(=O)O Amb24479570 [0,2,0,0,0,0|0,0,2]=4 3209 B9R0.57 CC(C)(O)C[C@@H](O)C(=O)O Amb27254266 [0,2,0,0,0,0|0,0,2]=4 3210 B9R0.57 CC(C)(O)C[C@H](N)C(=O)O Amb25992355 [0,2,0,0,0,0|0,0,2]=4 3211 B9R0.57 CC(C)(S)CC(N)C(=O)O Amb27984144 [0,2,0,0,0,0|0,0,2]=4 3212 B9R0.57 CC(CC(C)(C)C)C(=O)O Amb18124693 [0,2,0,0,0,0|0,0,2]=4 3213 B9R0.57 CC(CC(C)(C)F)C(=O)O Amb25971880 [0,2,0,0,0,0|0,0,2]=4 3214 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb22364426 [0,2,0,0,0,0|0,0,2]=4 3215 B9R0.57 CC(CC(C)(C)N)C(=O)O Amb28555536 [0,2,0,0,0,0|0,0,2]=4 3216 B9R0.57 CC(F)(F)CC(=O)C(=O)O Amb32809797 [0,2,0,0,0,0|1,0,1]=4 3217 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb17399895 [0,2,0,0,0,0|1,0,1]=4 3218 B9R0.57 CC(NC(C)(C)C)C(=O)O Amb28991327 [0,2,0,0,0,0|1,0,1]=4 3219 B9R0.57 CC(OC(C)(C)C)C(=O)O Amb9208483 [0,2,0,0,0,0|1,0,1]=4 3220 B9R0.57 CS(C)(=O)=NC(=O)C(=O)O Amb25027853 [0,2,0,0,0,0|2,0,0]=4 3221 B9R0.57 C[C@@H](CC(C)(C)C)C(=O)O Amb10844016 [0,2,0,0,0,0|0,0,2]=4 3222 B9R0.57 C[C@H](CC(C)(C)C)C(=O)O Amb10844015 [0,2,0,0,0,0|0,0,2]=4 3223 B9R0.57 C\C(=C/C(C)(C)C)C(=O)O Amb28050296 [0,2,0,0,0,0|0,0,0]=2 3224 B9R0.79 C=C(C(=O)O)C(O)C(C)C Amb27468733 [0,2,0,0,0,0|0,0,1]=3 3225 B9R0.79 C=C(C(N)=O)[C@@H](O)C(C)C Amb27246122 [0,2,0,0,0,0|1,0,1]=4 3226 B9R0.79 CC(=O)C(C)C(=O)C(C)C Amb17778960 [0,2,0,0,0,0|1,0,1]=4 3227 B9R0.79 CC(=O)C(O)C(=O)C(C)C Amb27480227 [0,2,0,0,0,0|1,0,1]=4 3228 B9R0.79 CC(=O)\C(C)=C(/C)C(C)C Amb27973084 [0,2,0,0,0,0|1,0,0]=3 3229 B9R0.79 CC(=O)\C(C)=C(/C)C(C)O Amb27828869 [0,2,0,0,0,0|2,0,0]=4 3230 B9R0.79 CC(C(=O)O)C(=O)N(C)C Amb24454556 [0,2,0,0,0,0|1,0,1]=4 3231 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33330058 [0,2,0,0,0,0|0,0,2]=4 3232 B9R0.79 CC(C)=C(C)C(N)C(=O)O Amb33484307 [0,2,0,0,0,0|0,0,2]=4 3233 B9R0.79 CC(C)C(=O)C(=O)C(=O)O Amb31099538 [0,2,0,0,0,0|0,0,0]=2 3234 B9R0.79 CC(C)C(=S)[C@H](N)C(=O)O Amb26586364 [0,2,0,0,0,0|0,0,1]=3 3235 B9R0.79 CC(C)C(C)C(=O)C(=O)O Amb27473341 [0,2,0,0,0,0|0,0,1]=3 3236 B9R0.79 CC(C)C(C)C(=O)C(N)=O Amb27413554 [0,2,0,0,0,0|1,0,1]=4 3237 B9R0.79 CC(C)C(C)C(N)C(=O)O Amb26965499 [0,2,0,0,0,0|0,0,2]=4 3238 B9R0.79 CC(C)C(C)[C@@H](N)C(=O)O Amb28119442 [0,2,0,0,0,0|0,0,2]=4 3239 B9R0.79 CC(C)C(C)[C@H](N)C(=O)O Amb27951299 [0,2,0,0,0,0|0,0,2]=4 3240 B9R0.79 CC(C)C(Cl)C(=O)C(=O)O Amb18646182 [0,2,0,0,0,0|0,0,1]=3 3241 B9R0.79 CC(C)C(F)C(N)C(=O)O Amb28071157 [0,2,0,0,0,0|0,0,2]=4 3242 B9R0.79 CC(C)C(F)[C@@H](N)C(=O)O Amb27248487 [0,2,0,0,0,0|0,0,2]=4 3243 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb25863595 [0,2,0,0,0,0|0,0,2]=4 3244 B9R0.79 CC(C)C(F)[C@H](N)C(=O)O Amb33328671 [0,2,0,0,0,0|0,0,2]=4 3245 B9R0.79 CC(C)C(N)C(C)C(=O)O Amb28121227 [0,2,0,0,0,0|0,0,2]=4 3246 B9R0.79 CC(C)C(N)C(F)C(=O)O Amb28385013 [0,2,0,0,0,0|0,0,2]=4 3247 B9R0.79 CC(C)C(N)C(O)C(=O)O Amb27615047 [0,2,0,0,0,0|0,0,2]=4 3248 B9R0.79 CC(C)C(O)C(C)C(=O)O Amb18990636 [0,2,0,0,0,0|0,0,2]=4 3249 B9R0.79 CC(C)C(O)C(F)C(=O)O Amb33136392 [0,2,0,0,0,0|0,0,2]=4 3250 B9R0.79 CC(C)C(O)C(N)C(=O)O Amb23399656 [0,2,0,0,0,0|0,0,2]=4 3251 B9R0.79 CC(C)C(O)C(O)C(=O)O Amb27655491 [0,2,0,0,0,0|0,0,2]=4 3252 B9R0.79 CC(C)C(O)[C@@H](C)C(=O)O Amb27494047 [0,2,0,0,0,0|0,0,2]=4 3253 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O Amb24509492 [0,2,0,0,0,0|0,0,2]=4 3254 B9R0.79 CC(C)C(S)C(N)C(=O)O Amb28076641 [0,2,0,0,0,0|0,0,2]=4 3255 B9R0.79 CC(C)N(C)C(=O)C(=O)O Amb9303810 [0,2,0,0,0,0|1,0,0]=3 3256 B9R0.79 CC(C)N(N)C(C)C(=O)O Amb27850417 [0,2,0,0,0,0|1,0,1]=4 3257 B9R0.79 CC(C)N(O)C(=O)C(=O)O Amb24671329 [0,2,0,0,0,0|1,0,0]=3 3258 B9R0.79 CC(C)[C@@H](Cl)[C@@H](N)C(=O)O Amb27409092 [0,2,0,0,0,0|0,0,2]=4 3259 B9R0.79 CC(C)[C@@H](O)[C@@H](Br)C(=O)O Amb27394249 [0,2,0,0,0,0|0,0,2]=4 3260 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O Amb27874042 [0,2,0,0,0,0|0,0,2]=4 3261 B9R0.79 CC(C)[C@@H](O)[C@H](C)C(=O)O Amb28347218 [0,2,0,0,0,0|0,0,2]=4 3262 B9R0.79 CC(C)[C@H](Cl)[C@@H](N)C(=O)O Amb27796326 [0,2,0,0,0,0|0,0,2]=4 3263 B9R0.79 CC(C)[C@H](N)[C@H](C)C(=O)O Amb27216704 [0,2,0,0,0,0|0,0,2]=4 3264 B9R0.79 CC(C)[C@H](N)[C@H](O)C(=O)O Amb25147282 [0,2,0,0,0,0|0,0,2]=4 3265 B9R0.79 CC(C)[C@H](O)[C@@H](C)C(=O)O Amb10844253 [0,2,0,0,0,0|0,0,2]=4 3266 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O Amb10807407 [0,2,0,0,0,0|0,0,2]=4 3267 B9R0.79 CC(C)[C@H](O)[C@H](C)C(=O)O Amb28346279 [0,2,0,0,0,0|0,0,2]=4 3268 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O Amb26333625 [0,2,0,0,0,0|0,0,2]=4 3269 B9R0.79 CC(C)[C@H](O)[C@H](O)C(=O)O Amb28050049 [0,2,0,0,0,0|0,0,2]=4 3270 B9R0.79 CN(C)C(=O)C(=O)C(=O)O Amb28316062 [0,2,0,0,0,0|1,0,0]=3 3271 B9R0.79 CN(C)C(=O)C(F)C(=O)O Amb28050091 [0,2,0,0,0,0|1,0,1]=4 3272 B9R0.79 C\C(=C(\F)C(=O)O)C(C)C Amb27615103 [0,2,0,0,0,0|0,0,0]=2 3273 B9R0.79 C\C(O)=C(\C)C(=O)C(C)C Amb27859396 [0,2,0,0,0,0|1,0,0]=3 3274 B9R0.77 CC(C)(N)\C=C\C(C)(C)O Amb27391578 [0,2,0,0,0,0|1,0,1]=4 3275 B9R0.77 CC(C)(O)\C=C\C(C)(C)O Amb33869783 [0,2,0,0,0,0|1,0,1]=4 3276 B7R1.2 CC1=COC(=O)C1 Amb27624758 [1,0,0,1,0,0|1,0,1]=4 3277 B7R1.2 CC1=NC(C)C=C1 Amb27442121 [1,0,0,1,0,0|2,0,0]=4 3278 B7R1.2 CC1C=CC(=O)C1 Amb27260718 [1,0,0,1,0,0|0,0,0]=2 3279 B7R1.2 CC1C=CC(=O)O1 Amb24053964 [1,0,0,1,0,0|0,0,0]=2 3280 B7R1.2 CC1C=CC(=O)S1 Amb25746305 [1,0,0,1,0,0|0,1,0]=3 3281 B7R1.2 CC1C=CC(C)C1 Amb28365868 [1,0,0,1,0,0|1,0,1]=4 3282 B7R1.2 CC1CC(=O)CN1 Amb28349308 [1,0,0,1,0,0|1,0,1]=4 3283 B7R1.2 CC1CC(=O)CO1 Amb25888380 [1,0,0,1,0,0|1,0,1]=4 3284 B7R1.2 CC1CC(=O)CS1 Amb23598370 [1,0,0,1,0,0|1,0,1]=4 3285 B7R1.2 CC1CC(=O)NN1 Amb493880 [1,0,0,1,0,0|2,0,0]=4 3286 B7R1.2 CC1CCC(=O)C1 Amb8513672 [1,0,0,1,0,0|0,0,2]=4 3287 B7R1.2 CC1CCC(=O)O1 Amb6298321 [1,0,0,1,0,0|0,0,2]=4 3288 B7R1.2 CC1CNC(=O)C1 Amb10608004 [1,0,0,1,0,0|1,0,1]=4 3289 B7R1.2 CC1CNC(=O)O1 Amb19651732 [1,0,0,1,0,0|1,0,1]=4 3290 B7R1.2 CC1COC(=O)C1 Amb22231914 [1,0,0,1,0,0|1,0,1]=4 3291 B7R1.2 CC1COC(=O)O1 Amb8513300 [1,0,0,1,0,0|1,0,1]=4 3292 B7R1.2 CC1OC(=O)CS1 Amb25314322 [1,0,0,1,0,0|1,0,1]=4 3293 B7R1.2 CN1C=CC(=O)C1 Amb28201569 [1,0,0,1,0,0|1,0,0]=3 3294 B7R1.2 C[C@@H]1C=CC(=O)C1 Amb28199837 [1,0,0,1,0,0|0,0,0]=2 3295 B7R1.2 C[C@@H]1CCC(=O)C1 Amb10844734 [1,0,0,1,0,0|0,0,2]=4 3296 B7R1.2 C[C@@H]1CCC(=O)O1 Amb4166301 [1,0,0,1,0,0|0,0,2]=4 3297 B7R1.2 C[C@@H]1CNC(=O)C1 Amb22746719 [1,0,0,1,0,0|1,0,1]=4 3298 B7R1.2 C[C@@H]1CNC(=O)O1 Amb25041458 [1,0,0,1,0,0|1,0,1]=4 3299 B7R1.2 C[C@@H]1COC(=O)C1 Amb19944613 [1,0,0,1,0,0|1,0,1]=4 3300 B7R1.2 C[C@@H]1COC(=O)O1 Amb8383956 [1,0,0,1,0,0|1,0,1]=4 3301 B7R1.2 C[C@H]1C=CC(=O)C1 Amb27262978 [1,0,0,1,0,0|0,0,0]=2 3302 B7R1.2 C[C@H]1CCC(=O)O1 Amb26539040 [1,0,0,1,0,0|0,0,2]=4 3303 B7R1.2 C[C@H]1CNC(=O)C1 Amb26584475 [1,0,0,1,0,0|1,0,1]=4 3304 B7R1.2 C[C@H]1COC(=O)C1 Amb25064301 [1,0,0,1,0,0|1,0,1]=4 3305 B7R1.2 C[C@H]1COC(=O)O1 Amb8516313 [1,0,0,1,0,0|1,0,1]=4 3306 B7R1.2 Cc1ccc(Br)o1 Amb10600628 [1,0,0,1,0,0|1,0,1]=4 3307 B7R1.2 Cc1ccc(C)o1 Amb2447078 [1,0,0,1,0,0|1,0,1]=4 3308 B7R1.2 Cc1ccc(Cl)o1 Amb25242029 [1,0,0,1,0,0|1,0,1]=4 3309 B7R1.2 Cc1ccc(F)o1 Amb27397440 [1,0,0,1,0,0|1,0,1]=4 3310 B7R1.2 Cc1ccc(I)o1 Amb25723970 [1,0,0,1,0,0|1,0,1]=4 3311 B7R1.2 Cc1ccc(N)o1 Amb10600629 [1,0,0,1,0,0|1,0,1]=4 3312 B7R1.2 Cc1ccc(O)o1 Amb26645726 [1,0,0,1,0,0|0,0,2]=4 3313 B7R1.2 Cc1ccc(O)s1 Amb17593190 [1,0,0,1,0,0|0,1,1]=4 3314 B7R1.2 Cc1ccc(S)o1 Amb25888543 [1,0,0,1,0,0|0,1,1]=4 3315 B7R1.2 Cn1ccc(O)n1 Amb22388466 [1,0,0,1,0,0|2,0,0]=4 3316 B7R1.2 NC1C=CC(=O)C1 Amb27445487 [1,0,0,1,0,0|1,0,0]=3 3317 B7R1.2 NC1C=CC(O)C1 Amb27948080 [1,0,0,1,0,0|1,0,1]=4 3318 B7R1.2 O=C1C=CC(=O)C1 Amb22338203 [1,0,0,1,0,0|1,0,1]=4 3319 B7R1.2 O=C1C=CC(=O)O1 Amb20246531 [1,0,0,1,0,0|1,0,1]=4 3320 B7R1.2 O=C1C=CC(=O)O1 Amb6297783 [1,0,0,1,0,0|1,0,1]=4 3321 B7R1.2 O=C1C=CC(Br)C1 Amb27809803 [1,0,0,1,0,0|1,0,0]=3 3322 B7R1.2 O=C1C=CC(Br)O1 Amb22001603 [1,0,0,1,0,0|1,0,0]=3 3323 B7R1.2 O=C1C=CC(Br)S1 Amb26530759 [1,0,0,1,0,0|1,1,0]=4 3324 B7R1.2 O=C1C=CC(Cl)O1 Amb27760027 [1,0,0,1,0,0|1,0,0]=3 3325 B7R1.2 O=C1C=CC(Cl)S1 Amb28428650 [1,0,0,1,0,0|1,1,0]=4 3326 B7R1.2 O=C1C=CC(F)O1 Amb27778280 [1,0,0,1,0,0|1,0,0]=3 3327 B7R1.2 O=C1C=CC(O)C1 Amb9782767 [1,0,0,1,0,0|1,0,0]=3 3328 B7R1.2 O=C1C=CC(O)N1 Amb27978638 [1,0,0,1,0,0|2,0,0]=4 3329 B7R1.2 O=C1C=CC(O)O1 Amb24544763 [1,0,0,1,0,0|1,0,0]=3 3330 B7R1.2 O=C1C=C[C@@H](O)C1 Amb27256512 [1,0,0,1,0,0|1,0,0]=3 3331 B7R1.2 O=C1C=C[C@H](Cl)C1 Amb27984687 [1,0,0,1,0,0|1,0,0]=3 3332 B7R1.2 O=C1C=C[C@H](O)C1 Amb2694980 [1,0,0,1,0,0|1,0,0]=3 3333 B7R1.2 OC1C=CC(F)C1 Amb27859641 [1,0,0,1,0,0|1,0,1]=4 3334 B7R1.2 OC1C=CC(O)C1 Amb4034755 [1,0,0,1,0,0|1,0,1]=4 3335 B7R1.2 O[C@@H]1C=C[C@H](O)C1 Amb8395199 [1,0,0,1,0,0|1,0,1]=4 3336 B7R1.2 O[C@H]1C=CC(Cl)C1 Amb28291629 [1,0,0,1,0,0|1,0,1]=4 3337 B7R1.3 BrC1=CCCCO1 Amb24322651 [1,0,0,1,0,0|1,0,1]=4 3338 B7R1.3 BrC1=COCCO1 Amb24322806 [1,0,0,1,0,0|2,0,0]=4 3339 B7R1.3 CC1=CCCCO1 Amb24480530 [1,0,0,1,0,0|1,0,1]=4 3340 B7R1.3 CC1C=CC=CN1 Amb27843995 [1,0,0,1,0,0|2,0,0]=4 3341 B7R1.3 CC1C=CCCC1 Amb8515346 [1,0,0,1,0,0|1,0,1]=4 3342 B7R1.3 CC1C=CCCO1 Amb33715160 [1,0,0,1,0,0|1,0,1]=4 3343 B7R1.3 CC1C=CCNC1 Amb27170704 [1,0,0,1,0,0|1,0,1]=4 3344 B7R1.3 CC1C=COCC1 Amb27985265 [1,0,0,1,0,0|2,0,0]=4 3345 B7R1.3 ClC1=CCCCO1 Amb27449514 [1,0,0,1,0,0|1,0,1]=4 3346 B7R1.3 ClC1=COCCO1 Amb27826498 [1,0,0,1,0,0|2,0,0]=4 3347 B7R1.3 ClC1C=CCOC1 Amb27955246 [1,0,0,1,0,0|1,0,1]=4 3348 B7R1.3 ClC1CC=COC1 Amb27400096 [1,0,0,1,0,0|1,0,1]=4 3349 B7R1.3 IC1=COCCO1 Amb24322818 [1,0,0,1,0,0|2,0,0]=4 3350 B7R1.3 NC1=CC=CCO1 Amb22167473 [1,0,0,1,0,0|1,0,1]=4 3351 B7R1.3 O=C1C=CC=CO1 Amb21951679 [1,0,0,1,0,0|0,0,2]=4 3352 B7R1.3 O=C1C=CCC=N1 Amb24076140 [1,0,0,1,0,0|1,0,1]=4 3353 B7R1.3 O=C1C=CCCC1 Amb17843126 [1,0,0,1,0,0|1,0,0]=3 3354 B7R1.3 O=C1C=CCCN1 Amb22001783 [1,0,0,1,0,0|1,0,0]=3 3355 B7R1.3 O=C1C=CCCO1 Amb15693457 [1,0,0,1,0,0|0,0,0]=2 3356 B7R1.3 O=C1C=CCOC1 Amb22234519 [1,0,0,1,0,0|2,0,0]=4 3357 B7R1.3 O=C1C=CCSC1 Amb26544956 [1,0,0,1,0,0|2,0,0]=4 3358 B7R1.3 O=C1C=CNCC1 Amb2700614 [1,0,0,1,0,0|2,0,0]=4 3359 B7R1.3 O=C1C=COCC1 Amb22000873 [1,0,0,1,0,0|2,0,0]=4 3360 B7R1.3 O=C1C=CSCC1 Amb25375022 [1,0,0,1,0,0|2,0,0]=4 3361 B7R1.3 O=C1C=NCCN1 Amb28341190 [1,0,0,1,0,0|2,0,0]=4 3362 B7R1.3 O=C1CCCCO1 Amb8513592 [1,0,0,1,0,0|0,0,2]=4 3363 B7R1.3 O=C1CNCCO1 Amb19958702 [1,0,0,1,0,0|1,0,1]=4 3364 B7R1.3 O=C1CNCCO1 Amb32410210 [1,0,0,1,0,0|1,0,1]=4 3365 B7R1.3 O=C1COCCO1 Amb17933352 [1,0,0,1,0,0|1,0,1]=4 3366 B7R1.3 O=C1CSCCO1 Amb28069740 [1,0,0,1,0,0|1,0,1]=4 3367 B7R1.3 O=C1N=CCCN1 Amb24480889 [1,0,0,1,0,0|2,0,0]=4 3368 B7R1.3 O=C1NCCCO1 Amb10608499 [1,0,0,1,0,0|1,0,1]=4 3369 B7R1.3 O=C1NNCCO1 Amb32683554 [1,0,0,1,0,0|2,0,0]=4 3370 B7R1.3 O=C1OCCCO1 Amb4034896 [1,0,0,1,0,0|1,0,1]=4 3371 B7R1.3 OC1C=CCCC1 Amb4605824 [1,0,0,1,0,0|1,0,1]=4 3372 B7R1.3 OC1C=CCOC1 Amb25662556 [1,0,0,1,0,0|1,0,1]=4 3373 B7R1.3 O[C@H]1C=CCCC1 Amb10601567 [1,0,0,1,0,0|1,0,1]=4 3374 B7R1.3 O[C@H]1C=CCOC1 Amb8393976 [1,0,0,1,0,0|1,0,1]=4 3375 B7R1.5 CC1CC1CC=O Amb25737156 [1,0,0,1,0,0|0,0,2]=4 3376 B7R1.5 CC1CC1NC=O Amb28200843 [1,0,0,1,0,0|1,0,1]=4 3377 B7R1.7 CC\C=C\C1CO1 Amb33449783 [1,0,0,1,0,0|1,0,1]=4 3378 B7R1.7 CC\C=C\[C@@H]1CO1 Amb33272599 [1,0,0,1,0,0|1,0,1]=4 3379 B7R1.7 CC\C=C\[C@H]1CO1 Amb33272601 [1,0,0,1,0,0|1,0,1]=4 3380 B7R1.7 CO\C=C\C1CC1 Amb25367957 [1,0,0,1,0,0|2,0,0]=4 3381 B7R1.7 N#C\C=C\C1CC1 Amb25168920 [1,0,0,1,0,0|1,0,1]=4 3382 B7R1.7 NC\C=C\C1CC1 Amb32661239 [1,0,0,1,0,0|1,0,1]=4 3383 B7R1.7 NC\C=C\C1CC1 Amb33538361 [1,0,0,1,0,0|1,0,1]=4 3384 B7R1.7 O=CCC=C1CC1 Amb27799822 [1,0,0,1,0,0|0,0,2]=4 3385 B7R1.7 O=CCCC1CC1 Amb21864768 [1,0,0,1,0,0|0,0,2]=4 3386 B7R1.7 O=CNCC1CC1 Amb28322746 [1,0,0,1,0,0|1,0,1]=4 3387 B7R1.7 O=C\C=C\C1CC1 Amb32664515 [1,0,0,1,0,0|0,0,0]=2 3388 B7R1.7 OC\C=C/C1CC1 Amb33483698 [1,0,0,1,0,0|0,0,1]=3 3389 B7R1.7 OC\C=C\C1CC1 Amb26963162 [1,0,0,1,0,0|0,0,1]=3 3390 B7R1.7 O\N=C\CC1CC1 Amb24627412 [1,0,0,1,0,0|1,0,1]=4 3391 B7R1.10 CC1CC(C=O)C1 Amb27827798 [1,0,0,1,0,0|0,0,2]=4 3392 B7R1.10 CC1CN(C=O)C1 Amb35587584 [1,0,0,1,0,0|1,0,1]=4 3393 B7R1.10 COC1=CC(=O)C1 Amb25092069 [1,0,0,1,0,0|2,0,0]=4 3394 B7R1.12 CC(C)C1=C(Br)C1 Amb25972622 [1,0,0,1,0,0|1,0,1]=4 3395 B7R1.12 CC1=CC1C(=O)O Amb27157805 [1,0,0,1,0,0|0,0,2]=4 3396 B7R1.12 CC1CC1C(=O)O Amb9703126 [1,0,0,1,0,0|0,0,2]=4 3397 B7R1.12 CC1OC1C(=O)O Amb17593088 [1,0,0,1,0,0|1,0,1]=4 3398 B7R1.12 CC1SC1C(=O)O Amb27195238 [1,0,0,1,0,0|1,0,1]=4 3399 B7R1.12 CC1S[C@H]1C(=O)O Amb27399596 [1,0,0,1,0,0|1,0,1]=4 3400 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O Amb25851678 [1,0,0,1,0,0|0,0,2]=4 3401 B7R1.12 C[C@@H]1C[C@H]1C(=O)O Amb22735875 [1,0,0,1,0,0|0,0,2]=4 3402 B7R1.12 C[C@@H]1N[C@H]1C(=O)O Amb24120621 [1,0,0,1,0,0|1,0,1]=4 3403 B7R1.12 C[C@@H]1O[C@@H]1C(=O)O Amb28347451 [1,0,0,1,0,0|1,0,1]=4 3404 B7R1.12 C[C@@H]1O[C@H]1C(=O)O Amb25738149 [1,0,0,1,0,0|1,0,1]=4 3405 B7R1.12 C[C@H]1C[C@@H]1C(=O)O Amb22735974 [1,0,0,1,0,0|0,0,2]=4 3406 B7R1.12 C[C@H]1C[C@H]1C(=O)O Amb16233326 [1,0,0,1,0,0|0,0,2]=4 3407 B7R1.12 C[C@H]1O[C@@H]1C(=O)O Amb27420167 [1,0,0,1,0,0|1,0,1]=4 3408 B7R1.12 C[C@H]1O[C@H]1C(=O)O Amb27237050 [1,0,0,1,0,0|1,0,1]=4 3409 B7R1.14 CC1(C)C=CCC1 Amb27471019 [1,0,0,1,0,0|1,0,1]=4 3410 B7R1.14 CC1(C)C=CCN1 Amb33743434 [1,0,0,1,0,0|1,0,1]=4 3411 B7R1.14 CC1(C)C=CCN1 Amb33743597 [1,0,0,1,0,0|1,0,1]=4 3412 B7R1.14 CP1(=O)C=CCC1 Amb27833507 [1,0,0,1,0,0|2,0,0]=4 3413 B7R1.14 O=P1(F)C=CCC1 Amb35789660 [1,0,0,1,0,0|2,0,0]=4 3414 B7R1.14 O=S1(=O)C=CCC1 Amb1099221 [1,0,0,1,0,0|1,0,1]=4 3415 B7R1.17 CC1(C)C=CC1=O Amb27486040 [1,0,0,1,0,0|0,0,0]=2 3416 B7R1.17 CC1(C)CCC1=O Amb28050382 [1,0,0,1,0,0|0,0,2]=4 3417 B7R1.17 CC1(C)CNC1=O Amb26954140 [1,0,0,1,0,0|1,0,1]=4 3418 B7R1.17 CC1(C)COC1=O Amb17619458 [1,0,0,1,0,0|1,0,1]=4 3419 B7R1.17 CC1(C)OCC1=O Amb27666218 [1,0,0,1,0,0|1,0,1]=4 3420 B7R1.17 CC1C=CS1(=O)=O Amb22364955 [1,0,0,1,0,0|1,0,1]=4 3421 B7R1.17 O=C1C=CC1(F)F Amb27838270 [1,0,0,1,0,0|2,0,0]=4 3422 B7R1.18 CC(=O)C1=CCC1 Amb23453500 [1,0,0,1,0,0|1,0,0]=3 3423 B7R1.18 O=C(O)C1=CCC1 Amb17593068 [1,0,0,1,0,0|0,0,0]=2 3424 B7R1.18 O=C(O)C1CCC1 Amb2686619 [1,0,0,1,0,0|0,0,2]=4 3425 B7R1.18 O=C(O)C1CCN1 Amb2371568 [1,0,0,1,0,0|1,0,1]=4 3426 B7R1.18 O=C(O)C1CCN1 Amb8391098 [1,0,0,1,0,0|1,0,1]=4 3427 B7R1.18 O=C(O)C1CCO1 Amb2383526 [1,0,0,1,0,0|1,0,1]=4 3428 B7R1.18 O=C(O)C1CCS1 Amb27209836 [1,0,0,1,0,0|1,0,1]=4 3429 B7R1.18 O=C(O)[C@@H]1CCN1 Amb2698263 [1,0,0,1,0,0|1,0,1]=4 3430 B7R1.18 O=C(O)[C@@H]1CCN1 Amb8631077 [1,0,0,1,0,0|1,0,1]=4 3431 B7R1.18 O=C(O)[C@@H]1CCO1 Amb33482870 [1,0,0,1,0,0|1,0,1]=4 3432 B7R1.18 O=C(O)[C@H]1CCN1 Amb2698264 [1,0,0,1,0,0|1,0,1]=4 3433 B7R1.18 O=C(O)[C@H]1CCN1 Amb33801322 [1,0,0,1,0,0|1,0,1]=4 3434 B7R1.18 O=C(O)[C@H]1CCO1 Amb33483353 [1,0,0,1,0,0|1,0,1]=4 3435 B7R1.18 O=C([O-])C1=CCC1 Amb34165365 [1,0,0,1,0,0|0,0,1]=3 3436 B7R1.20 CC(=O)C=C1CC1 Amb28201596 [1,0,0,1,0,0|1,0,0]=3 3437 B7R1.20 CC(O)C=C1CC1 Amb28189418 [1,0,0,1,0,0|1,0,1]=4 3438 B7R1.20 O=C(O)C=C1CC1 Amb8392543 [1,0,0,1,0,0|0,0,0]=2 3439 B7R1.20 O=C(O)CC1CC1 Amb2686657 [1,0,0,1,0,0|0,0,2]=4 3440 B7R1.20 O=S([O-])C=C1CC1 Amb32755418 [1,0,0,1,0,0|1,0,1]=4 3441 B7R1.23 CC1(C)CC1C=O Amb28071200 [1,0,0,1,0,0|0,0,2]=4 3442 B7R1.23 CC1(C)C[C@@H]1C=O Amb26416941 [1,0,0,1,0,0|0,0,2]=4 3443 B7R1.23 CC1(C)C\C1=C/Cl Amb27407556 [1,0,0,1,0,0|1,0,1]=4 3444 B7R1.23 CC1(C)OC1C=O Amb24724709 [1,0,0,1,0,0|1,0,1]=4 3445 B7R1.23 CC1(C)O[C@@H]1C=O Amb28050526 [1,0,0,1,0,0|1,0,1]=4 3446 B7R1.16 CC1(C)CC(=O)C1 Amb24117921 [0,0,0,1,1,0|1,0,1]=4 3447 B7R1.16 CC1(C)CC(=O)N1 Amb19515692 [0,0,0,1,1,0|1,0,1]=4 3448 B7R1.16 CC1(C)CC(=O)O1 Amb17940813 [0,0,0,1,1,0|0,0,1]=3 3449 B9R1.35 CC(=O)C1=CCC(N)C1 Amb35741226 [0,0,0,1,0,1|2,0,0]=4 3450 B9R1.35 CC(=O)C1C=CC(N)C1 Amb25889700 [0,0,0,1,0,1|2,0,0]=4 3451 B9R1.35 CC(C)=C1N=CC(=O)O1 Amb27843713 [0,0,0,1,0,1|0,0,1]=3 3452 B9R1.35 CC(C)C1=CC(=O)CC1 Amb26866593 [0,0,0,1,0,1|1,0,1]=4 3453 B9R1.35 CC(C)C1=CC(=O)NO1 Amb25956301 [0,0,0,1,0,1|2,0,0]=4 3454 B9R1.35 CC(C)C1=CCC(=O)O1 Amb27462536 [0,0,0,1,0,1|0,0,0]=2 3455 B9R1.35 CC(C)C1=CCC(O)C1 Amb28049097 [0,0,0,1,0,1|1,0,1]=4 3456 B9R1.35 CC(C)C1=CNC(=N)S1 Amb19332250 [0,0,0,1,0,1|1,1,0]=4 3457 B9R1.35 CC(C)C1=CNC(=O)N1 Amb25068480 [0,0,0,1,0,1|1,0,0]=3 3458 B9R1.35 CC(C)C1=NC(=O)NO1 Amb20246896 [0,0,0,1,0,1|2,0,0]=4 3459 B9R1.35 CC(C)C1=NCC(=O)N1 Amb27446386 [0,0,0,1,0,1|1,0,1]=4 3460 B9R1.35 CC(C)C1=NNC(=O)C1 Amb9202907 [0,0,0,1,0,1|2,0,0]=4 3461 B9R1.35 CC(C)C1=NNC(=O)O1 Amb20246867 [0,0,0,1,0,1|1,0,0]=3 3462 B9R1.35 CC(C)C1=NOC(=O)C1 Amb26851580 [0,0,0,1,0,1|2,0,0]=4 3463 B9R1.35 CC(C)C1=NOC(=O)N1 Amb22059086 [0,0,0,1,0,1|2,0,0]=4 3464 B9R1.35 CC(C)C1=NSC(=O)O1 Amb27762657 [0,0,0,1,0,1|1,0,0]=3 3465 B9R1.35 CC(C)C1C=CC(=O)C1 Amb27838734 [0,0,0,1,0,1|1,0,0]=3 3466 B9R1.35 CC(C)C1CNC(=O)O1 Amb27494066 [0,0,0,1,0,1|0,0,2]=4 3467 B9R1.35 CC(C)c1cc(Br)cs1 Amb18783656 [0,0,0,1,0,1|2,0,0]=4 3468 B9R1.35 CC(C)c1ccc(Br)o1 Amb10600622 [0,0,0,1,0,1|1,0,0]=3 3469 B9R1.35 CC(C)c1ccc(Br)s1 Amb10600620 [0,0,0,1,0,1|1,1,0]=4 3470 B9R1.35 CC(C)c1ccc(I)s1 Amb27445990 [0,0,0,1,0,1|1,1,0]=4 3471 B9R1.35 CC(C)c1ccc(N)o1 Amb10600623 [0,0,0,1,0,1|1,0,0]=3 3472 B9R1.35 CC(C)c1ccc(N)s1 Amb10600621 [0,0,0,1,0,1|1,1,0]=4 3473 B9R1.35 CC(C)c1ccc(O)s1 Amb20617566 [0,0,0,1,0,1|0,1,0]=3 3474 B9R1.35 CC(C)c1cnc(Br)o1 Amb28205320 [0,0,0,1,0,1|1,0,0]=3 3475 B9R1.35 CC(C)c1cnc(Br)s1 Amb10600917 [0,0,0,1,0,1|1,1,0]=4 3476 B9R1.35 CC(C)c1cnc(Cl)o1 Amb25943703 [0,0,0,1,0,1|1,0,0]=3 3477 B9R1.35 CC(C)c1cnc(Cl)s1 Amb22500457 [0,0,0,1,0,1|1,1,0]=4 3478 B9R1.35 CC(C)c1cnc(N)o1 Amb27413394 [0,0,0,1,0,1|1,0,0]=3 3479 B9R1.35 CC(C)c1cnc(N)s1 Amb13884183 [0,0,0,1,0,1|1,1,0]=4 3480 B9R1.35 CC(C)c1cnc(O)s1 Amb13884343 [0,0,0,1,0,1|0,1,0]=3 3481 B9R1.35 CC(C)c1cnn(O)c1 Amb24504055 [0,0,0,1,0,1|2,0,0]=4 3482 B9R1.35 CC(C)c1coc(Br)c1 Amb10600626 [0,0,0,1,0,1|2,0,0]=4 3483 B9R1.35 CC(C)c1coc(Br)n1 Amb28144974 [0,0,0,1,0,1|2,0,0]=4 3484 B9R1.35 CC(C)c1coc(I)n1 Amb27768796 [0,0,0,1,0,1|2,0,0]=4 3485 B9R1.35 CC(C)c1coc(N)c1 Amb10600627 [0,0,0,1,0,1|2,0,0]=4 3486 B9R1.35 CC(C)c1coc(N)n1 Amb18946537 [0,0,0,1,0,1|2,0,0]=4 3487 B9R1.35 CC(C)c1csc(Br)c1 Amb10600624 [0,0,0,1,0,1|2,0,0]=4 3488 B9R1.35 CC(C)c1csc(Br)n1 Amb10600918 [0,0,0,1,0,1|2,0,0]=4 3489 B9R1.35 CC(C)c1csc(Cl)n1 Amb18177761 [0,0,0,1,0,1|2,0,0]=4 3490 B9R1.35 CC(C)c1csc(N)c1 Amb10600625 [0,0,0,1,0,1|2,0,0]=4 3491 B9R1.35 CC(C)c1csc(N)n1 Amb19117040 [0,0,0,1,0,1|2,0,0]=4 3492 B9R1.35 CC(C)c1csc(N)n1 Amb6334480 [0,0,0,1,0,1|2,0,0]=4 3493 B9R1.35 CC(C)c1csc(O)c1 Amb20617592 [0,0,0,1,0,1|1,0,0]=3 3494 B9R1.35 CC(C)c1csc(S)n1 Amb18118516 [0,0,0,1,0,1|1,1,0]=4 3495 B9R1.35 CC(C)c1nc(Br)cs1 Amb2455675 [0,0,0,1,0,1|2,0,0]=4 3496 B9R1.35 CC(C)c1nc(N)cs1 Amb10599935 [0,0,0,1,0,1|2,0,0]=4 3497 B9R1.35 CC(C)c1nc(O)cs1 Amb10599936 [0,0,0,1,0,1|1,0,0]=3 3498 B9R1.35 CC(C)c1ncc(Br)o1 Amb24368755 [0,0,0,1,0,1|1,0,0]=3 3499 B9R1.35 CC(C)c1ncc(Br)s1 Amb10600218 [0,0,0,1,0,1|1,1,0]=4 3500 B9R1.35 CC(C)c1ncc(I)s1 Amb27475885 [0,0,0,1,0,1|1,1,0]=4 3501 B9R1.35 CC(C)c1ncc(N)o1 Amb18062956 [0,0,0,1,0,1|1,0,0]=3 3502 B9R1.35 CC(C)c1ncc(N)s1 Amb10600220 [0,0,0,1,0,1|1,1,0]=4 3503 B9R1.35 CC(C)c1ncc(O)s1 Amb10600221 [0,0,0,1,0,1|0,1,0]=3 3504 B9R1.35 CC(C)c1ncc(S)s1 Amb33344649 [0,0,0,1,0,1|0,2,0]=4 3505 B9R1.35 CC(C)c1nnc(Br)o1 Amb18066259 [0,0,0,1,0,1|2,0,0]=4 3506 B9R1.35 CC(C)c1nnc(Cl)o1 Amb18063441 [0,0,0,1,0,1|2,0,0]=4 3507 B9R1.35 CC(C)c1nnc(N)o1 Amb1108910 [0,0,0,1,0,1|2,0,0]=4 3508 B9R1.35 CC(C)c1nnc(O)s1 Amb19516959 [0,0,0,1,0,1|1,1,0]=4 3509 B9R1.35 CC(C)c1nnc(S)o1 Amb841884 [0,0,0,1,0,1|1,1,0]=4 3510 B9R1.35 CC(C)c1noc(O)n1 Amb15701656 [0,0,0,1,0,1|2,0,0]=4 3511 B9R1.35 CC(C)n1cc(O)cn1 Amb22900940 [0,0,0,1,0,1|2,0,0]=4 3512 B9R1.35 CC(C)n1ccc(Br)c1 Amb24317677 [0,0,0,1,0,1|2,0,0]=4 3513 B9R1.35 CC(C)n1ccc(Br)n1 Amb20619956 [0,0,0,1,0,1|2,0,0]=4 3514 B9R1.35 CC(C)n1ccc(I)n1 Amb20620006 [0,0,0,1,0,1|2,0,0]=4 3515 B9R1.35 CC(C)n1ccc(N)c1 Amb24317665 [0,0,0,1,0,1|2,0,0]=4 3516 B9R1.35 CC(C)n1ccc(N)n1 Amb6888953 [0,0,0,1,0,1|2,0,0]=4 3517 B9R1.35 CC(C)n1ccc(O)n1 Amb25340953 [0,0,0,1,0,1|1,0,0]=3 3518 B9R1.35 CC(Cl)c1ccc(Cl)o1 Amb26397531 [0,0,0,1,0,1|2,0,0]=4 3519 B9R1.35 CC(N)c1cc(O)co1 Amb27759208 [0,0,0,1,0,1|2,0,0]=4 3520 B9R1.35 CC(N)c1ccc(Br)o1 Amb25867182 [0,0,0,1,0,1|2,0,0]=4 3521 B9R1.35 CC(N)c1ccc(Cl)o1 Amb28069189 [0,0,0,1,0,1|2,0,0]=4 3522 B9R1.35 CC(N)c1ccc(O)s1 Amb27860172 [0,0,0,1,0,1|1,1,0]=4 3523 B9R1.35 CC(N)c1cnc(Cl)o1 Amb27225080 [0,0,0,1,0,1|2,0,0]=4 3524 B9R1.35 CC(N)c1nc(O)cs1 Amb28411040 [0,0,0,1,0,1|2,0,0]=4 3525 B9R1.35 CC(O)[C@H]1C=CC(=O)O1 Amb27632756 [0,0,0,1,0,1|1,0,0]=3 3526 B9R1.35 CC(O)c1ccc(Br)o1 Amb28049060 [0,0,0,1,0,1|2,0,0]=4 3527 B9R1.35 CC(O)c1ccc(Cl)o1 Amb24554790 [0,0,0,1,0,1|2,0,0]=4 3528 B9R1.35 CC(O)c1csc(O)n1 Amb27835075 [0,0,0,1,0,1|2,0,0]=4 3529 B9R1.35 CC(O)c1nc(O)cs1 Amb35710099 [0,0,0,1,0,1|2,0,0]=4 3530 B9R1.35 CC(S)c1ccc(Br)o1 Amb26989930 [0,0,0,1,0,1|2,0,0]=4 3531 B9R1.35 CC1=CC(C(C)C)=CC1 Amb27764105 [0,0,0,1,0,1|2,0,0]=4 3532 B9R1.35 CC1C=C(C(=O)O)CC1 Amb18642397 [0,0,0,1,0,1|0,0,2]=4 3533 B9R1.35 CC1C=CC(C(=O)O)O1 Amb18642586 [0,0,0,1,0,1|1,0,0]=3 3534 B9R1.35 CC1CC(C(=O)O)=NO1 Amb25694020 [0,0,0,1,0,1|1,0,0]=3 3535 B9R1.35 CC1CC(C(=O)O)CN1 Amb18832566 [0,0,0,1,0,1|0,0,2]=4 3536 B9R1.35 CC1CC(C(=O)O)CO1 Amb25922998 [0,0,0,1,0,1|0,0,2]=4 3537 B9R1.35 CC1CC(C(=O)O)SS1 Amb28385584 [0,0,0,1,0,1|1,0,1]=4 3538 B9R1.35 CC1CC(C(N)=O)=NO1 Amb27391094 [0,0,0,1,0,1|2,0,0]=4 3539 B9R1.35 CC1CCC(C(=O)O)C1 Amb18642624 [0,0,0,1,0,1|0,0,2]=4 3540 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb33756822 [0,0,0,1,0,1|0,0,2]=4 3541 B9R1.35 CC1CN[C@H](C(=O)O)C1 Amb8386516 [0,0,0,1,0,1|0,0,2]=4 3542 B9R1.35 CC1COC(C(=O)O)C1 Amb32679237 [0,0,0,1,0,1|0,0,2]=4 3543 B9R1.35 CN(C)C1=NCC(=O)O1 Amb28075156 [0,0,0,1,0,1|1,0,1]=4 3544 B9R1.35 CN(C)c1ccc(Br)o1 Amb24317621 [0,0,0,1,0,1|2,0,0]=4 3545 B9R1.35 CN1C=NC(C(=O)O)C1 Amb28934983 [0,0,0,1,0,1|1,0,1]=4 3546 B9R1.35 CN1C=NC(C(=O)O)C1 Amb8393352 [0,0,0,1,0,1|1,0,1]=4 3547 B9R1.35 CN1CC(C(=O)O)=CO1 Amb22388521 [0,0,0,1,0,1|1,0,0]=3 3548 B9R1.35 C[C@@H](N)C1=NNC(=O)O1 Amb27645868 [0,0,0,1,0,1|2,0,0]=4 3549 B9R1.35 C[C@@H](N)c1ccc(Br)o1 Amb27810660 [0,0,0,1,0,1|2,0,0]=4 3550 B9R1.35 C[C@@H](N)c1ccc(Cl)o1 Amb27473386 [0,0,0,1,0,1|2,0,0]=4 3551 B9R1.35 C[C@@H](N)c1nc(O)cs1 Amb29863411 [0,0,0,1,0,1|2,0,0]=4 3552 B9R1.35 C[C@@H](O)c1ccc(Br)o1 Amb26920850 [0,0,0,1,0,1|2,0,0]=4 3553 B9R1.35 C[C@@H](O)c1ccc(Cl)o1 Amb33258299 [0,0,0,1,0,1|2,0,0]=4 3554 B9R1.35 C[C@@H]1C=C[C@@H](C(=O)Cl)O1 Amb27658769 [0,0,0,1,0,1|2,0,0]=4 3555 B9R1.35 C[C@@H]1C=C[C@@H](C(=O)O)S1 Amb28347473 [0,0,0,1,0,1|1,0,0]=3 3556 B9R1.35 C[C@@H]1C=N[C@H](C(=O)O)C1 Amb27468755 [0,0,0,1,0,1|0,0,1]=3 3557 B9R1.35 C[C@@H]1CC[C@@H](C(=O)O)C1 Amb28429501 [0,0,0,1,0,1|0,0,2]=4 3558 B9R1.35 C[C@@H]1CC[C@H](C(=O)O)C1 Amb10843961 [0,0,0,1,0,1|0,0,2]=4 3559 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb19888348 [0,0,0,1,0,1|0,0,2]=4 3560 B9R1.35 C[C@@H]1CN[C@H](C(=O)O)C1 Amb33812626 [0,0,0,1,0,1|0,0,2]=4 3561 B9R1.35 C[C@@H]1C[C@H](C(=O)O)CO1 Amb27961253 [0,0,0,1,0,1|0,0,2]=4 3562 B9R1.35 C[C@H](N)C1=NNC(=O)O1 Amb27796727 [0,0,0,1,0,1|2,0,0]=4 3563 B9R1.35 C[C@H](N)c1ccc(Br)o1 Amb27168658 [0,0,0,1,0,1|2,0,0]=4 3564 B9R1.35 C[C@H](N)c1ccc(Cl)o1 Amb26931153 [0,0,0,1,0,1|2,0,0]=4 3565 B9R1.35 C[C@H](N)c1ccc(F)o1 Amb28134653 [0,0,0,1,0,1|2,0,0]=4 3566 B9R1.35 C[C@H](N)c1csc(O)c1 Amb27838438 [0,0,0,1,0,1|2,0,0]=4 3567 B9R1.35 C[C@H](N)c1nc(O)cs1 Amb35671484 [0,0,0,1,0,1|2,0,0]=4 3568 B9R1.35 C[C@H](O)[C@@H]1C=CC(=O)O1 Amb27213832 [0,0,0,1,0,1|1,0,0]=3 3569 B9R1.35 C[C@H](O)[C@H]1C=CC(=O)O1 Amb28435793 [0,0,0,1,0,1|1,0,0]=3 3570 B9R1.35 C[C@H](O)c1ccc(Br)o1 Amb28321678 [0,0,0,1,0,1|2,0,0]=4 3571 B9R1.35 C[C@H](O)c1ccc(Cl)o1 Amb33258305 [0,0,0,1,0,1|2,0,0]=4 3572 B9R1.35 C[C@H]1C=C[C@H](C(=O)Cl)O1 Amb27827754 [0,0,0,1,0,1|2,0,0]=4 3573 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb19887682 [0,0,0,1,0,1|0,0,2]=4 3574 B9R1.35 C[C@H]1CN[C@@H](C(=O)O)C1 Amb23439040 [0,0,0,1,0,1|0,0,2]=4 3575 B9R1.35 Cc1cc(C(=O)O)co1 Amb16231454 [0,0,0,1,0,1|0,0,2]=4 3576 B9R1.35 Cc1cc(C(=O)O)cs1 Amb6335894 [0,0,0,1,0,1|0,0,2]=4 3577 B9R1.35 Cc1ccc(C(=O)O)o1 Amb6318544 [0,0,0,1,0,1|1,0,1]=4 3578 B9R1.35 Cc1ccc(C(=O)O)s1 Amb1157149 [0,0,0,1,0,1|1,0,1]=4 3579 B9R1.35 Cc1ccc(C(C)C)o1 Amb22749543 [0,0,0,1,0,1|1,0,0]=3 3580 B9R1.35 Cc1ccc(C(C)C)s1 Amb27185525 [0,0,0,1,0,1|1,1,0]=4 3581 B9R1.35 Cc1ccc(C(C)N)o1 Amb487237 [0,0,0,1,0,1|2,0,0]=4 3582 B9R1.35 Cc1ccc(C(C)O)o1 Amb6705773 [0,0,0,1,0,1|2,0,0]=4 3583 B9R1.35 Cc1ccc(C(C)S)o1 Amb9208021 [0,0,0,1,0,1|2,0,0]=4 3584 B9R1.35 Cc1ccc([C@@H](C)N)o1 Amb13952993 [0,0,0,1,0,1|2,0,0]=4 3585 B9R1.35 Cc1ccc([C@@H](C)N)o1 Amb33712017 [0,0,0,1,0,1|2,0,0]=4 3586 B9R1.35 Cc1ccc([C@@H](C)O)o1 Amb13952991 [0,0,0,1,0,1|2,0,0]=4 3587 B9R1.35 Cc1ccc([C@H](C)N)o1 Amb13952995 [0,0,0,1,0,1|2,0,0]=4 3588 B9R1.35 Cc1ccc([C@H](C)O)o1 Amb13952992 [0,0,0,1,0,1|2,0,0]=4 3589 B9R1.35 Cc1ccc([SiH](C)C)o1 Amb27843651 [0,0,0,1,0,1|1,1,0]=4 3590 B9R1.35 Cc1ccn(C(C)C)n1 Amb6890180 [0,0,0,1,0,1|2,0,0]=4 3591 B9R1.35 Cc1cnc(C(=O)O)o1 Amb18832708 [0,0,0,1,0,1|1,0,1]=4 3592 B9R1.35 Cc1cnc(C(=O)O)s1 Amb8010646 [0,0,0,1,0,1|1,0,1]=4 3593 B9R1.35 Cc1cnc(C(C)C)o1 Amb23456251 [0,0,0,1,0,1|1,0,0]=3 3594 B9R1.35 Cc1cnc(C(C)C)s1 Amb27595399 [0,0,0,1,0,1|1,1,0]=4 3595 B9R1.35 Cc1cnc(C(C)Cl)o1 Amb22059657 [0,0,0,1,0,1|2,0,0]=4 3596 B9R1.35 Cc1cnc(C(C)N)o1 Amb5733072 [0,0,0,1,0,1|2,0,0]=4 3597 B9R1.35 Cc1cnc([C@@H](C)N)o1 Amb19373386 [0,0,0,1,0,1|2,0,0]=4 3598 B9R1.35 Cc1coc(C(=O)O)c1 Amb18642368 [0,0,0,1,0,1|0,0,2]=4 3599 B9R1.35 Cc1coc(C(=O)O)n1 Amb18832706 [0,0,0,1,0,1|1,0,1]=4 3600 B9R1.35 Cc1csc(C(=O)O)c1 Amb2691600 [0,0,0,1,0,1|0,0,2]=4 3601 B9R1.35 Cc1csc(C(=O)O)n1 Amb5759010 [0,0,0,1,0,1|1,0,1]=4 3602 B9R1.35 Cc1csc(C(C)C)n1 Amb2689023 [0,0,0,1,0,1|2,0,0]=4 3603 B9R1.35 Cc1nc(C(=O)O)co1 Amb6307241 [0,0,0,1,0,1|1,0,1]=4 3604 B9R1.35 Cc1nc(C(=O)O)cs1 Amb22587710 [0,0,0,1,0,1|1,0,1]=4 3605 B9R1.35 Cc1nc(C(=O)O)cs1 Amb2723085 [0,0,0,1,0,1|1,0,1]=4 3606 B9R1.35 Cc1nc(C(=O)O)cs1 Amb33446967 [0,0,0,1,0,1|1,0,1]=4 3607 B9R1.35 Cc1nc(C(C)C)cs1 Amb27882723 [0,0,0,1,0,1|2,0,0]=4 3608 B9R1.35 Cc1ncc(C(=O)O)o1 Amb17399815 [0,0,0,1,0,1|1,0,1]=4 3609 B9R1.35 Cc1ncc(C(=O)O)s1 Amb8630402 [0,0,0,1,0,1|1,0,1]=4 3610 B9R1.35 Cc1ncc(N(C)C)o1 Amb22748778 [0,0,0,1,0,1|2,0,0]=4 3611 B9R1.35 Cn1cc(C(=O)O)cn1 Amb1099256 [0,0,0,1,0,1|1,0,1]=4 3612 B9R1.35 Cn1ccc(C(=O)O)c1 Amb10603441 [0,0,0,1,0,1|1,0,1]=4 3613 B9R1.35 Cn1ccc(C(=O)O)n1 Amb33544330 [0,0,0,1,0,1|2,0,0]=4 3614 B9R1.35 Cn1cnc(C(=O)O)c1 Amb33545050 [0,0,0,1,0,1|1,0,1]=4 3615 B9R1.35 Cn1cnc(C(=O)O)n1 Amb33545103 [0,0,0,1,0,1|2,0,0]=4 3616 B9R1.35 Cn1ncc(C(=O)O)n1 Amb18222482 [0,0,0,1,0,1|2,0,0]=4 3617 B9R1.35 NC1C=CC(C(=O)O)C1 Amb20622377 [0,0,0,1,0,1|1,0,0]=3 3618 B9R1.35 NC1C=CC(C(=O)O)C1 Amb20623555 [0,0,0,1,0,1|1,0,0]=3 3619 B9R1.35 NC1CC=C(C(=O)O)C1 Amb18642495 [0,0,0,1,0,1|1,0,0]=3 3620 B9R1.35 NC1CC=C(C(=O)O)C1 Amb32667606 [0,0,0,1,0,1|1,0,0]=3 3621 B9R1.35 N[C@@H]1C=C[C@H](C(=O)O)C1 Amb8516355 [0,0,0,1,0,1|1,0,0]=3 3622 B9R1.35 N[C@@H]1CC=C(C(=O)O)C1 Amb25824589 [0,0,0,1,0,1|1,0,0]=3 3623 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 Amb16232675 [0,0,0,1,0,1|1,0,0]=3 3624 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 Amb19515761 [0,0,0,1,0,1|1,0,0]=3 3625 B9R1.35 N[C@H]1CC=C(C(=O)O)C1 Amb25143919 [0,0,0,1,0,1|1,0,0]=3 3626 B9R1.35 O=C(O)C1=NC[C@@H](O)C1 Amb28198348 [0,0,0,1,0,1|1,0,1]=4 3627 B9R1.35 O=C(O)[C@@H]1C[C@@H](O)C=N1 Amb27215307 [0,0,0,1,0,1|1,0,1]=4 3628 B9R1.35 O=C1C=CC(C(=O)O)C1 Amb26002884 [0,0,0,1,0,1|1,0,1]=4 3629 B9R1.35 O=C1CC(C(=O)O)=CN1 Amb18832707 [0,0,0,1,0,1|1,0,1]=4 3630 B9R1.35 O=C1CC(C(=O)O)=CO1 Amb3499387 [0,0,0,1,0,1|1,0,1]=4 3631 B9R1.46 CC(=O)\C=C\C1CC1C Amb33143910 [0,0,0,1,0,1|1,0,0]=3 3632 B9R1.46 CC(=O)\C=C\[C@@H]1O[C@H]1C Amb26924328 [0,0,0,1,0,1|2,0,0]=4 3633 B9R1.46 CC1CC1C#CC(=O)O Amb24390173 [0,0,0,1,0,1|0,0,2]=4 3634 B9R1.46 CC1CC1CCC(=O)O Amb27220003 [0,0,0,1,0,1|0,0,2]=4 3635 B9R1.46 CC1CC1OCC(=O)O Amb33144889 [0,0,0,1,0,1|0,0,2]=4 3636 B9R1.46 CC1CC1\C=C\C(=O)O Amb33226425 [0,0,0,1,0,1|0,0,0]=2 3637 B9R1.46 CC1CC1\C=C\[N+](=O)[O-] Amb33144896 [0,0,0,1,0,1|1,0,1]=4 3638 B9R1.46 C[C@@H]1O[C@H]1\C=C\C(=O)O Amb27191995 [0,0,0,1,0,1|1,0,0]=3 3639 B9R1.46 C[C@H]1O[C@H]1\C=C\C(=O)O Amb27614487 [0,0,0,1,0,1|1,0,0]=3 3640 B9R1.49 CC1CC=CC(=O)CC1 Amb27838660 [0,0,0,1,0,1|1,0,0]=3 3641 B9R1.49 O=C1NC=CC(O)CN1 Amb27409827 [0,0,0,1,0,1|2,0,0]=4 3642 B9R1.53 CC1CC(CC(=O)O)C1 Amb27461451 [0,0,0,1,0,1|0,0,2]=4 3643 B9R1.53 CC1CN(CC(=O)O)C1 Amb27838507 [0,0,0,1,0,1|0,0,2]=4 3644 B9R1.53 CC1CN(CC(=O)O)C1 Amb32661050 [0,0,0,1,0,1|0,0,2]=4 3645 B9R1.53 C[C@H]1C[C@H](CC(=O)O)C1 Amb27859343 [0,0,0,1,0,1|0,0,2]=4 3646 B9R1.66 CC1(C)C=CCC(O)C1 Amb28049242 [0,0,0,1,0,1|1,0,1]=4 3647 B9R1.66 CC1(C)C=CNC(S)=N1 Amb27596671 [0,0,0,1,0,1|1,1,0]=4 3648 B9R1.66 CC1(C)C=COC(=O)C1 Amb26551706 [0,0,0,1,0,1|1,0,0]=3 3649 B9R1.66 CC1(C)CC(=O)C=CO1 Amb27791423 [0,0,0,1,0,1|1,0,0]=3 3650 B9R1.66 CC1(C)CC=CC(=O)C1 Amb9782605 [0,0,0,1,0,1|1,0,0]=3 3651 B9R1.66 CC1(C)CC=CC(O)C1 Amb27431061 [0,0,0,1,0,1|1,0,1]=4 3652 B9R1.66 CC1(C)CC=C[C@@H](O)C1 Amb28281908 [0,0,0,1,0,1|1,0,1]=4 3653 B9R1.66 CC1(C)CCCC(=O)O1 Amb25863489 [0,0,0,1,0,1|0,0,2]=4 3654 B9R1.66 CC1(C)CNCC(=O)O1 Amb28122961 [0,0,0,1,0,1|0,0,2]=4 3655 B9R1.66 CC1(C)N=CNC(O)=N1 Amb27170655 [0,0,0,1,0,1|2,0,0]=4 3656 B9R1.66 CC1(C)OC=CC(=O)O1 Amb27635269 [0,0,0,1,0,1|0,0,0]=2 3657 B9R1.66 CC1=NC(C)(C)NC=C1 Amb27424880 [0,0,0,1,0,1|2,0,0]=4 3658 B9R1.85 CC(=O)C\C=C\C1CO1 Amb32938577 [0,0,0,1,0,1|2,0,0]=4 3659 B9R1.85 CC(=O)N\N=C\C1CC1 Amb28429930 [0,0,0,1,0,1|2,0,0]=4 3660 B9R1.85 CC(=O)\C=C\CC1CC1 Amb33361179 [0,0,0,1,0,1|1,0,0]=3 3661 B9R1.85 O=C(O)CCCC1CC1 Amb18832629 [0,0,0,1,0,1|0,0,2]=4 3662 B9R1.85 O=C(O)CCNC1CC1 Amb1106410 [0,0,0,1,0,1|0,0,2]=4 3663 B9R1.85 O=C(O)CCNC1CC1 Amb532234 [0,0,0,1,0,1|0,0,2]=4 3664 B9R1.85 O=C(O)CCOC1CC1 Amb25926315 [0,0,0,1,0,1|0,0,2]=4 3665 B9R1.85 O=C(O)CNCC1CC1 Amb33038298 [0,0,0,1,0,1|0,0,2]=4 3666 B9R1.85 O=C(O)CNCC1CC1 Amb7766420 [0,0,0,1,0,1|0,0,2]=4 3667 B9R1.85 O=C(O)COCC1CC1 Amb6680905 [0,0,0,1,0,1|0,0,2]=4 3668 B9R1.85 O=C(O)CSCC1CC1 Amb9173460 [0,0,0,1,0,1|0,0,2]=4 3669 B9R1.85 O=C(O)\C=C\CC1CC1 Amb33362399 [0,0,0,1,0,1|0,0,0]=2 3670 B9R1.85 O=C(O)\C=C\NC1CC1 Amb22363623 [0,0,0,1,0,1|0,0,0]=2 3671 B9R1.85 O=C(O)\C=N\OC1CC1 Amb26008284 [0,0,0,1,0,1|1,0,0]=3 3672 B9R1.85 O=[N+]([O-])\C=C\CC1CC1 Amb33361207 [0,0,0,1,0,1|1,0,1]=4 3673 B9R1.161 CC(C)C1CC1C(=O)O Amb18285139 [0,0,0,1,0,1|0,0,2]=4 3674 B9R1.161 CC(C)[C@@H]1C[C@H]1C(=O)O Amb33360310 [0,0,0,1,0,1|0,0,2]=4 3675 B9R1.161 CC(C)[C@@H]1O[C@H]1C(=O)O Amb28252782 [0,0,0,1,0,1|0,0,2]=4 3676 B9R1.166 CC1(C)CCC1C(=O)O Amb25032090 [0,0,0,1,0,1|0,0,2]=4 3677 B9R1.166 CC1(C)CNC1C(=O)O Amb24117326 [0,0,0,1,0,1|0,0,2]=4 3678 B9R1.166 CC1(C)CNC1C(=O)O Amb27253737 [0,0,0,1,0,1|0,0,2]=4 3679 B9R1.166 CC1(C)CN[C@@H]1C(=O)O Amb30869393 [0,0,0,1,0,1|0,0,2]=4 3680 B9R1.166 CC1(C)CN[C@H]1C(=O)O Amb34161295 [0,0,0,1,0,1|0,0,2]=4 3681 B9R1.166 CC1(C)COC1C(=O)O Amb8010835 [0,0,0,1,0,1|0,0,2]=4 3682 B9R1.170 CC(O)\C=C1\CC1(C)C Amb28069767 [0,0,0,1,0,1|1,0,1]=4 3683 B9R1.170 CC1(C)CC1CC(=O)O Amb25145962 [0,0,0,1,0,1|0,0,2]=4 3684 B9R1.170 CC1(C)C\C1=C/C(=O)O Amb25056977 [0,0,0,1,0,1|0,0,0]=2 3685 B9R1.1 CCC1C=CC(=O)CC1 Amb26870913 [0,1,0,1,0,0|1,0,0]=3 3686 B9R1.1 CCC1COC(=O)CN1 Amb27179683 [0,1,0,1,0,0|1,0,1]=4 3687 B9R1.1 CC[C@@H]1C=C[C@H](O)CC1 Amb27443552 [0,1,0,1,0,0|1,0,1]=4 3688 B9R1.1 COC1C=CC(=O)CC1 Amb27256443 [0,1,0,1,0,0|1,0,0]=3 3689 B9R1.1 COC1C=CC(=O)CO1 Amb24713481 [0,1,0,1,0,0|2,0,0]=4 3690 B9R1.1 COC1C=CC(O)CC1 Amb27790233 [0,1,0,1,0,0|1,0,1]=4 3691 B9R1.1 CO[C@@H]1C=CC(=O)CO1 Amb27265732 [0,1,0,1,0,0|2,0,0]=4 3692 B9R1.1 CO[C@@H]1C=C[C@H](O)CC1 Amb28077905 [0,1,0,1,0,0|1,0,1]=4 3693 B9R1.1 CSC1C=CC(=O)CC1 Amb27211800 [0,1,0,1,0,0|1,0,0]=3 3694 B9R1.1 NCC1COC(=O)CO1 Amb26575044 [0,1,0,1,0,0|1,0,1]=4 3695 B9R1.1 O=C1C=CC(CO)=CO1 Amb25835811 [0,1,0,1,0,0|0,0,2]=4 3696 B9R1.1 O=C1C=C[C@@H](CO)CC1 Amb27838659 [0,1,0,1,0,0|1,0,0]=3 3697 B9R1.1 O=C1COC(CCl)CO1 Amb33734959 [0,1,0,1,0,0|1,0,1]=4 3698 B9R1.1 O=C1COC(CO)CO1 Amb28315509 [0,1,0,1,0,0|1,0,1]=4 3699 B9R1.1 OCC1C=C=C(O)C=C1 Amb27206728 [0,1,0,1,0,0|1,0,1]=4 3700 B9R1.1 OCC1CC=C(O)CC1 Amb27465669 [0,1,0,1,0,0|1,0,1]=4 3701 B9R1.1 O\N=C1/C=CC(Cl)CC1 Amb27232636 [0,1,0,1,0,0|2,0,0]=4 3702 B9R1.10 CC1(C)C=CC(=O)CC1 Amb8515573 [0,1,0,1,0,0|1,0,0]=3 3703 B9R1.10 CC1(C)C=CC(=O)CS1 Amb28144116 [0,1,0,1,0,0|0,1,0]=3 3704 B9R1.10 CC1(C)C=CC(O)CC1 Amb27827311 [0,1,0,1,0,0|1,0,1]=4 3705 B9R1.10 CC1(C)CC=C(O)CC1 Amb27641416 [0,1,0,1,0,0|1,0,1]=4 3706 B9R1.10 CC1(C)CCC(=O)OC1 Amb28120623 [0,1,0,1,0,0|0,0,2]=4 3707 B9R1.10 CC1(C)CNC(=O)CO1 Amb26423126 [0,1,0,1,0,0|1,0,1]=4 3708 B9R1.10 CC1(C)CNC(=O)OC1 Amb8392177 [0,1,0,1,0,0|1,0,1]=4 3709 B9R1.10 CC1(C)OCC(=O)CO1 Amb5718679 [0,1,0,1,0,0|1,0,1]=4 3710 B9R1.10 CC1(Cl)C=CC(=O)C=C1 Amb28285172 [0,1,0,1,0,0|1,0,1]=4 3711 B9R1.10 CC1(N)C=CC(=O)C=C1 Amb27971345 [0,1,0,1,0,0|1,0,1]=4 3712 B9R1.10 CC1C=CC(C)(O)CC1 Amb32864483 [0,1,0,1,0,0|1,0,1]=4 3713 B9R1.10 O=C1C=CC(F)(F)CC1 Amb25217348 [0,1,0,1,0,0|2,0,0]=4 3714 B9R1.55 CC(=O)C1=C(C)C(C)C1 Amb28122458 [0,1,0,1,0,0|1,0,0]=3 3715 B9R1.55 CC(C)=C1CC(C)C1=O Amb27838814 [0,1,0,1,0,0|2,0,0]=4 3716 B9R1.55 CC(C)[C@@H]1OC(=O)[C@H]1O Amb27196798 [0,1,0,1,0,0|0,0,2]=4 3717 B9R1.55 CC1CC(C(=O)O)N1C Amb28285280 [0,1,0,1,0,0|0,0,2]=4 3718 B9R1.55 CN1CC(C(=O)O)C1=O Amb17593354 [0,1,0,1,0,0|1,0,1]=4 3719 B9R1.55 C[C@H]1CC(C(=O)O)[C@@H]1C Amb28132441 [0,1,0,1,0,0|0,0,2]=4 3720 B9R1.67 CC(=O)\C=C1/CCC1C Amb28251863 [0,1,0,1,0,0|1,0,0]=3 3721 B9R1.67 CC(C)\C=C1\CCC1=O Amb35752264 [0,1,0,1,0,0|1,0,0]=3 3722 B9R1.67 CC1CCN1CC(=O)O Amb27838508 [0,1,0,1,0,0|1,0,1]=4 3723 B9R1.67 CC1CCN1CC(=O)O Amb33552557 [0,1,0,1,0,0|1,0,1]=4 3724 B9R1.67 CN(C)\C=C1/CCC1=O Amb33457240 [0,1,0,1,0,0|2,0,0]=4 3725 B9R1.69 C=C1CC(C)CNC1=O Amb27640032 [0,1,0,1,0,0|1,0,1]=4 3726 B9R1.69 CC1=C(C)NC(=O)C=C1 Amb19516765 [0,1,0,1,0,0|1,0,1]=4 3727 B9R1.69 CC1=CC(=O)C(C)CC1 Amb28323862 [0,1,0,1,0,0|2,0,0]=4 3728 B9R1.69 CC1=CC(=O)C=CC1O Amb27750285 [0,1,0,1,0,0|2,0,0]=4 3729 B9R1.69 CC1=CC(=O)C=CN1C Amb22522501 [0,1,0,1,0,0|2,0,0]=4 3730 B9R1.69 CC1=CC(=O)CC[C@H]1C Amb27838729 [0,1,0,1,0,0|1,0,0]=3 3731 B9R1.69 CC1=CC(=O)OCC1O Amb28457807 [0,1,0,1,0,0|1,0,0]=3 3732 B9R1.69 CC1=CC(=O)[C@H](C)CC1 Amb27598775 [0,1,0,1,0,0|2,0,0]=4 3733 B9R1.69 CC1=CC(C)CNC1=O Amb27435183 [0,1,0,1,0,0|1,0,0]=3 3734 B9R1.69 CC1=CC(O)CCC1=O Amb27838743 [0,1,0,1,0,0|2,0,0]=4 3735 B9R1.69 CC1=CC(O)CCC1C Amb27218950 [0,1,0,1,0,0|1,0,1]=4 3736 B9R1.69 CC1=CC(O)CC[C@H]1C Amb28350322 [0,1,0,1,0,0|1,0,1]=4 3737 B9R1.69 CC1=CC=C(O)C(=O)N1 Amb24725980 [0,1,0,1,0,0|1,0,1]=4 3738 B9R1.69 CC1=CCC(C)C(O)O1 Amb27206419 [0,1,0,1,0,0|1,0,1]=4 3739 B9R1.69 CC1=CCC(C)CC1O Amb27842013 [0,1,0,1,0,0|1,0,1]=4 3740 B9R1.69 CC1=CC[C@@H](C)C[C@H]1O Amb28401379 [0,1,0,1,0,0|1,0,1]=4 3741 B9R1.69 CC1C=C(I)C(=O)CC1 Amb32867829 [0,1,0,1,0,0|1,0,0]=3 3742 B9R1.69 CC1C=CC(=O)C(C)C1 Amb27433057 [0,1,0,1,0,0|1,0,0]=3 3743 B9R1.69 CC1C=CC(C)C(O)C1 Amb27395845 [0,1,0,1,0,0|1,0,1]=4 3744 B9R1.69 CC1C=CC(O)C(O)C1 Amb27394816 [0,1,0,1,0,0|0,0,2]=4 3745 B9R1.69 CC1C=CC(O)CC1C Amb27808814 [0,1,0,1,0,0|1,0,1]=4 3746 B9R1.69 CC1CC(=O)C(O)=CO1 Amb28351460 [0,1,0,1,0,0|1,0,0]=3 3747 B9R1.69 CC1CC=C(Br)C(O)C1 Amb27662803 [0,1,0,1,0,0|1,0,1]=4 3748 B9R1.69 CC1CC=C(Cl)C(=O)C1 Amb27199164 [0,1,0,1,0,0|1,0,1]=4 3749 B9R1.69 CC1CCC(=O)C(O)C1 Amb25333970 [0,1,0,1,0,0|0,0,2]=4 3750 B9R1.69 CC1CCC(=O)C=C1O Amb26053264 [0,1,0,1,0,0|1,0,0]=3 3751 B9R1.69 CC1CCC(=O)CC1=O Amb24053090 [0,1,0,1,0,0|1,0,1]=4 3752 B9R1.69 CC1CCC(=O)NC1=O Amb21963732 [0,1,0,1,0,0|2,0,0]=4 3753 B9R1.69 CC1CCC(=O)OC1=O Amb24117247 [0,1,0,1,0,0|2,0,0]=4 3754 B9R1.69 CC1CCC(O)=CC1=O Amb24532888 [0,1,0,1,0,0|1,0,0]=3 3755 B9R1.69 CC1CNC(=O)C(=O)O1 Amb27961492 [0,1,0,1,0,0|2,0,0]=4 3756 B9R1.69 CC1CNC(=O)CC1=O Amb19958593 [0,1,0,1,0,0|1,0,1]=4 3757 B9R1.69 CC1CNC(=O)NC1=O Amb1152691 [0,1,0,1,0,0|2,0,0]=4 3758 B9R1.69 CC1CNC(O)=NC1=O Amb4256704 [0,1,0,1,0,0|2,0,0]=4 3759 B9R1.69 CC1OC(=O)C=CC1=O Amb27948593 [0,1,0,1,0,0|1,0,1]=4 3760 B9R1.69 CC1OCC(=O)C=C1N Amb27799172 [0,1,0,1,0,0|2,0,0]=4 3761 B9R1.69 CN1C=CC(=O)C(O)=C1 Amb21520366 [0,1,0,1,0,0|1,0,1]=4 3762 B9R1.69 C[C@@H]1C=CC(=O)[C@@H](C)O1 Amb27267068 [0,1,0,1,0,0|2,0,0]=4 3763 B9R1.69 C[C@@H]1CC(=O)C(O)=CO1 Amb28350976 [0,1,0,1,0,0|1,0,0]=3 3764 B9R1.69 C[C@@H]1CCC(=O)C(O)C1 Amb27838716 [0,1,0,1,0,0|0,0,2]=4 3765 B9R1.69 C[C@@H]1CCC(=O)[C@H](O)C1 Amb27434293 [0,1,0,1,0,0|0,0,2]=4 3766 B9R1.69 C[C@@H]1COC(=O)N[C@H]1C Amb27203324 [0,1,0,1,0,0|1,0,1]=4 3767 B9R1.69 C[C@H]1CNC(=O)NC1=O Amb27655087 [0,1,0,1,0,0|2,0,0]=4 3768 B9R1.69 C[C@H]1CNC(=O)O[C@H]1C Amb27492970 [0,1,0,1,0,0|1,0,1]=4 3769 B9R1.69 C[C@H]1COC(=O)C[C@@H]1O Amb27853905 [0,1,0,1,0,0|0,0,2]=4 3770 B9R1.69 C[C@H]1C[C@@H](C)COC1=O Amb27251551 [0,1,0,1,0,0|0,0,2]=4 3771 B9R1.69 C[C@H]1C[C@H](O)C=CC1=O Amb27434201 [0,1,0,1,0,0|2,0,0]=4 3772 B9R1.69 C[C@H]1OC(=O)C=CC1=O Amb28351021 [0,1,0,1,0,0|1,0,1]=4 3773 B9R1.69 Cc1ccc(O)cc1C Amb3939551 [0,1,0,1,0,0|1,0,1]=4 3774 B9R1.69 Cn1ccc(=O)c(O)c1 Amb22504110 [0,1,0,1,0,0|1,0,1]=4 3775 B9R1.69 O=C1C=C(Br)C(O)CC1 Amb28049179 [0,1,0,1,0,0|2,0,0]=4 3776 B9R1.69 O=C1C=CC(=O)C(O)C1 Amb27191875 [0,1,0,1,0,0|1,0,1]=4 3777 B9R1.69 O=C1C=CC(=O)N(O)C1 Amb27227026 [0,1,0,1,0,0|1,0,1]=4 3778 B9R1.69 O=C1C=CC(O)C(O)C1 Amb27984020 [0,1,0,1,0,0|2,0,0]=4 3779 B9R1.69 O=C1C=CC(O)[C@H](O)C1 Amb27836776 [0,1,0,1,0,0|2,0,0]=4 3780 B9R1.69 O=C1CCC(O)C=C1Br Amb27768825 [0,1,0,1,0,0|2,0,0]=4 3781 B9R1.69 O=C1OCC(Br)C=C1Br Amb25727424 [0,1,0,1,0,0|1,0,0]=3 3782 B9R1.78 CC1CC1CC(=O)NO Amb27981204 [0,1,0,1,0,0|0,0,2]=4 3783 B9R1.78 C[C@@H]1C[C@H]1NC(=O)CO Amb27944646 [0,1,0,1,0,0|1,0,1]=4 3784 B9R1.80 CNC(=O)\C=C\C1CC1 Amb27770566 [0,1,0,1,0,0|1,0,0]=3 3785 B9R1.80 COC(=O)C#CC1CC1 Amb1036567 [0,1,0,1,0,0|0,0,2]=4 3786 B9R1.80 COC(=O)CNC1CC1 Amb20622332 [0,1,0,1,0,0|1,0,1]=4 3787 B9R1.80 COC(=O)CNC1CC1 Amb6706354 [0,1,0,1,0,0|1,0,1]=4 3788 B9R1.80 COC(=O)CSC1CC1 Amb6760569 [0,1,0,1,0,0|1,0,1]=4 3789 B9R1.80 COC(=O)\C=C\C1CC1 Amb33986066 [0,1,0,1,0,0|0,0,0]=2 3790 B9R1.80 NNC(=O)\C=C\C1CC1 Amb27255172 [0,1,0,1,0,0|1,0,0]=3 3791 B9R1.80 O=C(CCC1CC1)NO Amb28248660 [0,1,0,1,0,0|0,0,2]=4 3792 B9R1.80 O=C(CNC1CC1)NO Amb27395406 [0,1,0,1,0,0|1,0,1]=4 3793 B9R1.80 O=C(CO)OCC1CC1 Amb27806245 [0,1,0,1,0,0|1,0,1]=4 3794 B9R1.82 CC(CO)C1CC(=O)O1 Amb28315511 [0,1,0,1,0,0|0,0,2]=4 3795 B9R1.82 CC1CC(C(=O)NO)C1 Amb27203488 [0,1,0,1,0,0|0,0,2]=4 3796 B9R1.82 COC(=O)C1CC(C)C1 Amb25771219 [0,1,0,1,0,0|0,0,2]=4 3797 B9R1.82 COC(=O)C1CC(C)N1 Amb33743739 [0,1,0,1,0,0|1,0,1]=4 3798 B9R1.82 COC(=O)C1CC(C)N1 Amb33743758 [0,1,0,1,0,0|1,0,1]=4 3799 B9R1.82 COC(=O)C1CC(C)O1 Amb22737249 [0,1,0,1,0,0|1,0,1]=4 3800 B9R1.82 COC(=O)[C@@H]1C[C@@H](C)O1 Amb24056487 [0,1,0,1,0,0|1,0,1]=4 3801 B9R1.82 COC(=O)[C@@H]1C[C@H](C)O1 Amb26885653 [0,1,0,1,0,0|1,0,1]=4 3802 B9R1.84 CC(=O)\C=C\C1CCC1 Amb33448508 [0,1,0,1,0,0|1,0,0]=3 3803 B9R1.84 CC(O)\C=C\C1CCC1 Amb27645263 [0,1,0,1,0,0|1,0,1]=4 3804 B9R1.84 NC(=O)\C=C\C1CCC1 Amb27615014 [0,1,0,1,0,0|1,0,0]=3 3805 B9R1.84 O=C(O)C#CC1CCC1 Amb26413119 [0,1,0,1,0,0|0,0,2]=4 3806 B9R1.84 O=C(O)C#CC1CCN1 Amb33168952 [0,1,0,1,0,0|0,0,2]=4 3807 B9R1.84 O=C(O)C#CC1CNC1 Amb32656048 [0,1,0,1,0,0|0,0,2]=4 3808 B9R1.84 O=C(O)C#CC1CNC1 Amb33299377 [0,1,0,1,0,0|0,0,2]=4 3809 B9R1.84 O=C(O)C#CC1COC1 Amb33169027 [0,1,0,1,0,0|0,0,2]=4 3810 B9R1.84 O=C(O)CCC1CCC1 Amb8011305 [0,1,0,1,0,0|0,0,2]=4 3811 B9R1.84 O=C(O)CCC1CCO1 Amb28280741 [0,1,0,1,0,0|0,0,2]=4 3812 B9R1.84 O=C(O)CC[C@@H]1CCN1 Amb27439305 [0,1,0,1,0,0|0,0,2]=4 3813 B9R1.84 O=C(O)CNC1CCC1 Amb18982434 [0,1,0,1,0,0|1,0,1]=4 3814 B9R1.84 O=C(O)CNC1COC1 Amb22737320 [0,1,0,1,0,0|1,0,1]=4 3815 B9R1.84 O=C(O)CNC1CSC1 Amb27186145 [0,1,0,1,0,0|1,0,1]=4 3816 B9R1.84 O=C(O)COC1CCC1 Amb18295877 [0,1,0,1,0,0|1,0,1]=4 3817 B9R1.84 O=C(O)COC1CNC1 Amb24454311 [0,1,0,1,0,0|1,0,1]=4 3818 B9R1.84 O=C(O)COC1CNC1 Amb28555348 [0,1,0,1,0,0|1,0,1]=4 3819 B9R1.84 O=C(O)COC1CNC1 Amb32665028 [0,1,0,1,0,0|1,0,1]=4 3820 B9R1.84 O=C(O)COC1COC1 Amb24539538 [0,1,0,1,0,0|1,0,1]=4 3821 B9R1.84 O=C(O)CSC1COC1 Amb27589904 [0,1,0,1,0,0|1,0,1]=4 3822 B9R1.84 O=C(O)\C=C\C1CCC1 Amb20624021 [0,1,0,1,0,0|0,0,0]=2 3823 B9R1.84 O=C(O)\C=C\N1CCC1 Amb27494371 [0,1,0,1,0,0|1,0,0]=3 3824 B9R1.84 O=[N+]([O-])\C=C\C1CCC1 Amb32953886 [0,1,0,1,0,0|1,0,1]=4 3825 B9R1.86 CCC1CC1CC(=O)O Amb27249848 [0,1,0,1,0,0|0,0,2]=4 3826 B9R1.86 O=C(O)CC1CC1CF Amb27237859 [0,1,0,1,0,0|0,0,2]=4 3827 B9R1.95 CCC1C=C(C(N)=O)C1 Amb28049401 [0,1,0,1,0,0|1,0,0]=3 3828 B9R1.95 CCC1CC(C(=O)O)C1 Amb23456004 [0,1,0,1,0,0|0,0,2]=4 3829 B9R1.95 CNC1CC(C(=O)O)C1 Amb20622656 [0,1,0,1,0,0|0,0,2]=4 3830 B9R1.95 CNC1CC(C(=O)O)C1 Amb32668940 [0,1,0,1,0,0|0,0,2]=4 3831 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb28903920 [0,1,0,1,0,0|0,0,2]=4 3832 B9R1.95 CN[C@H]1C[C@@H](C(=O)O)C1 Amb32667482 [0,1,0,1,0,0|0,0,2]=4 3833 B9R1.95 COC1CC(C(=O)O)C1 Amb8011538 [0,1,0,1,0,0|0,0,2]=4 3834 B9R1.95 CO[C@H]1C[C@@H](C(=O)O)C1 Amb23440276 [0,1,0,1,0,0|0,0,2]=4 3835 B9R1.95 CO[C@H]1C[C@H](C(=O)O)C1 Amb23440277 [0,1,0,1,0,0|0,0,2]=4 3836 B9R1.95 NCC1CC(C(=O)O)C1 Amb26631130 [0,1,0,1,0,0|0,0,2]=4 3837 B9R1.95 NCC1CC(C(=O)O)C1 Amb31307793 [0,1,0,1,0,0|0,0,2]=4 3838 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34136858 [0,1,0,1,0,0|0,0,2]=4 3839 B9R1.95 NC[C@H]1C[C@@H](C(=O)O)C1 Amb34148892 [0,1,0,1,0,0|0,0,2]=4 3840 B9R1.95 NC[C@H]1C[C@H](C(=O)O)C1 Amb33715808 [0,1,0,1,0,0|0,0,2]=4 3841 B9R1.95 O=C(O)C1CC(CBr)C1 Amb19958667 [0,1,0,1,0,0|0,0,2]=4 3842 B9R1.95 O=C(O)C1CC(CF)C1 Amb27186059 [0,1,0,1,0,0|0,0,2]=4 3843 B9R1.95 O=C(O)C1CC(CO)C1 Amb22002175 [0,1,0,1,0,0|0,0,2]=4 3844 B9R1.95 O=C(O)[C@H]1C[C@H](CO)C1 Amb34162163 [0,1,0,1,0,0|0,0,2]=4 3845 B9R1.125 CC1(CBr)CNC(=O)O1 Amb24753177 [0,1,0,1,0,0|1,0,1]=4 3846 B9R1.125 CC1(CN)CCC(=O)O1 Amb27815595 [0,1,0,1,0,0|0,0,2]=4 3847 B9R1.125 CC1(CO)C=CC(O)C1 Amb27164205 [0,1,0,1,0,0|1,0,1]=4 3848 B9R1.125 COP1(=O)C=CC(O)C1 Amb27208738 [0,1,0,1,0,0|2,0,0]=4 3849 B9R1.125 C[C@@]1(CCl)CNC(=O)O1 Amb27229268 [0,1,0,1,0,0|1,0,1]=4 3850 B9R1.125 C[C@]1(CO)C=CC(=O)C1 Amb27838760 [0,1,0,1,0,0|1,0,0]=3 3851 B9R1.125 O=C1C=CC(O)(CCl)O1 Amb27589361 [0,1,0,1,0,0|1,0,0]=3 3852 B9R1.127 CC1(CN)CC1C(=O)O Amb27481579 [0,1,0,1,0,0|0,0,2]=4 3853 B9R1.127 CCC1(C)CC1C(=O)O Amb18285802 [0,1,0,1,0,0|0,0,2]=4 3854 B9R1.133 CC1(C)C=CC(CO)C1 Amb28460690 [0,1,0,1,0,0|1,0,1]=4 3855 B9R1.133 CC1(C)OC=C(CO)O1 Amb27588531 [0,1,0,1,0,0|1,0,1]=4 3856 B9R1.133 CNC1C=CS(=O)(=O)C1 Amb27816995 [0,1,0,1,0,0|1,0,1]=4 3857 B9R1.133 CN[C@H]1C=CS(=O)(=O)C1 Amb27881574 [0,1,0,1,0,0|1,0,1]=4 3858 B9R1.133 COC1C=CC(C)(C)C1 Amb26451897 [0,1,0,1,0,0|1,0,1]=4 3859 B9R1.133 COC1C=CS(=O)(=O)C1 Amb7092046 [0,1,0,1,0,0|1,0,1]=4 3860 B9R1.138 C=C1C(=O)C=CC1(C)C Amb28060554 [0,1,0,1,0,0|1,0,0]=3 3861 B9R1.138 CC1(C)C=CC(=O)C1=O Amb28054370 [0,1,0,1,0,0|0,0,1]=3 3862 B9R1.138 CC1(C)CC=C(Br)C1O Amb27841903 [0,1,0,1,0,0|1,0,1]=4 3863 B9R1.138 CC1(C)CNC(=O)C1O Amb16203297 [0,1,0,1,0,0|1,0,1]=4 3864 B9R1.138 CC1(C)COC(=O)C1O Amb532977 [0,1,0,1,0,0|1,0,1]=4 3865 B9R1.138 CC1(C)COC(=O)[C@@H]1O Amb2719697 [0,1,0,1,0,0|1,0,1]=4 3866 B9R1.138 CC1(C)COC(=O)[C@H]1O Amb3939674 [0,1,0,1,0,0|1,0,1]=4 3867 B9R1.138 CC1(C)CSC(=O)C1O Amb27405285 [0,1,0,1,0,0|1,0,1]=4 3868 B9R1.138 CC1(C)NCC(=O)N1O Amb27945580 [0,1,0,1,0,0|1,0,1]=4 3869 B9R1.138 CC1C(=O)C=CC1(C)C Amb28197621 [0,1,0,1,0,0|1,0,0]=3 3870 B9R1.138 CC1C(=O)C=CC1(C)O Amb27838630 [0,1,0,1,0,0|2,0,0]=4 3871 B9R1.138 CC1C=CC(C)(O)C1Cl Amb27232718 [0,1,0,1,0,0|1,0,1]=4 3872 B9R1.138 C[C@@]1(Br)C=CC(=O)[C@H]1Cl Amb27966714 [0,1,0,1,0,0|2,0,0]=4 3873 B9R1.138 C[C@@]1(O)CC=C(O)C1=O Amb28351523 [0,1,0,1,0,0|1,0,1]=4 3874 B9R1.138 C[C@]1(Br)C=CC(=O)[C@@H]1Cl Amb28247106 [0,1,0,1,0,0|2,0,0]=4 3875 B9R1.147 CC(=O)\C=C\C1(C)CC1 Amb33079784 [0,1,0,1,0,0|1,0,0]=3 3876 B9R1.147 CC1(C#CC(=O)O)CC1 Amb25662631 [0,1,0,1,0,0|0,0,2]=4 3877 B9R1.147 CC1(CCC(=O)O)CC1 Amb8009614 [0,1,0,1,0,0|0,0,2]=4 3878 B9R1.147 CC1(NCC(=O)O)CC1 Amb27444501 [0,1,0,1,0,0|1,0,1]=4 3879 B9R1.147 CC1(OCC(=O)O)CC1 Amb26056469 [0,1,0,1,0,0|1,0,1]=4 3880 B9R1.147 CC1(\C=C\C(=O)O)CC1 Amb33313120 [0,1,0,1,0,0|0,0,0]=2 3881 B9R1.147 CC1(\C=C\[N+](=O)[O-])CC1 Amb33313100 [0,1,0,1,0,0|1,0,1]=4 3882 B9R1.147 NC1(CCC(=O)O)CC1 Amb18832570 [0,1,0,1,0,0|0,0,2]=4 3883 B9R1.147 O=C(O)CCC1(Cl)CC1 Amb25865061 [0,1,0,1,0,0|0,0,2]=4 3884 B9R1.147 O=C(O)CCC1(F)CC1 Amb27423404 [0,1,0,1,0,0|0,0,2]=4 3885 B9R1.147 O=C(O)CCC1(O)CC1 Amb28325490 [0,1,0,1,0,0|0,0,2]=4 3886 B9R1.185 COC(=O)C1CC1(C)C Amb25762943 [0,1,0,1,0,0|0,0,2]=4 3887 B9R1.185 COC(=O)C1OC1(C)C Amb4418353 [0,1,0,1,0,0|1,0,1]=4 3888 B9R1.36 C=C1CC(C)(C)NC1=O Amb27224823 [0,1,0,1,0,0|1,0,1]=4 3889 B9R1.36 C=C1CC(C)(C)OC1=O Amb27879663 [0,1,0,1,0,0|0,0,1]=3 3890 B9R1.36 CC1(C)C=C(Br)C(=O)C1 Amb26512356 [0,1,0,1,0,0|1,0,0]=3 3891 B9R1.36 CC1(C)CC(=O)C(=O)C1 Amb25888889 [0,1,0,1,0,0|1,0,1]=4 3892 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb18124322 [0,1,0,1,0,0|0,0,2]=4 3893 B9R1.36 CC1(C)CC(N)C(=O)O1 Amb32674857 [0,1,0,1,0,0|0,0,2]=4 3894 B9R1.36 CC1(C)C[C@@H](N)C(=O)O1 Amb28196700 [0,1,0,1,0,0|0,0,2]=4 3895 B9R1.36 CC1(C)C[C@@H](O)C(=O)O1 Amb27472564 [0,1,0,1,0,0|0,0,2]=4 3896 B9R1.36 CC1(C)C[C@H](N)C(=O)O1 Amb24476611 [0,1,0,1,0,0|0,0,2]=4 3897 B9R1.36 CC1(C)C[C@H](O)C(=O)O1 Amb28205922 [0,1,0,1,0,0|0,0,2]=4 3898 B9R1.36 CC1(C)NC(=O)C(=O)N1 Amb25137176 [0,1,0,1,0,0|2,0,0]=4 3899 B9R1.36 CC1(C)NC(=S)C(=O)S1 Amb28056026 [0,1,0,1,0,0|1,1,0]=4 3900 B9R1.36 CC1=CC(C)(C)CC1O Amb27969092 [0,1,0,1,0,0|1,0,1]=4 3901 B9R1.36 CC1=CC(C)(C)NC1=O Amb26654163 [0,1,0,1,0,0|1,0,0]=3 3902 B9R1.36 CC1=CC(C)(O)NC1=O Amb28190787 [0,1,0,1,0,0|2,0,0]=4 3903 B9R1.36 CC1=NC(C)(C)NC1=O Amb27873384 [0,1,0,1,0,0|2,0,0]=4 3904 B9R1.36 CC1CC(C)(C)OC1=O Amb24444118 [0,1,0,1,0,0|0,0,2]=4 3905 B9R1.38 C=C1C=C(C)C(C)(C)N1 Amb27955002 [0,1,0,1,0,0|2,0,0]=4 3906 B9R1.38 C=C1OC(=O)OC1(C)C Amb1033029 [0,1,0,1,0,0|1,0,0]=3 3907 B9R1.38 C=C1OC(=O)OC1(C)Cl Amb26064671 [0,1,0,1,0,0|2,0,0]=4 3908 B9R1.38 CC1(C)CC(=O)CC1=O Amb25993979 [0,1,0,1,0,0|1,0,1]=4 3909 B9R1.38 CC1(C)CC(=O)N=C1N Amb24412394 [0,1,0,1,0,0|2,0,0]=4 3910 B9R1.38 CC1(C)CC(=O)NC1=O Amb8845622 [0,1,0,1,0,0|2,0,0]=4 3911 B9R1.38 CC1(C)CC(=O)NC1=S Amb27827420 [0,1,0,1,0,0|2,0,0]=4 3912 B9R1.38 CC1(C)CC(=O)OC1=O Amb2687615 [0,1,0,1,0,0|2,0,0]=4 3913 B9R1.38 CC1(C)NC(=O)CC1=O Amb18832699 [0,1,0,1,0,0|1,0,1]=4 3914 B9R1.38 CC1(C)NC(=O)N=C1N Amb20667594 [0,1,0,1,0,0|2,0,0]=4 3915 B9R1.38 CC1(C)NC(=O)NC1=O Amb1145663 [0,1,0,1,0,0|2,0,0]=4 3916 B9R1.38 CC1(C)NC(=O)NC1=S Amb27644002 [0,1,0,1,0,0|2,0,0]=4 3917 B9R1.38 CC1(C)NC(=O)OC1=O Amb26615190 [0,1,0,1,0,0|2,0,0]=4 3918 B9R1.38 CC1(C)OC(=N)C=C1N Amb17593313 [0,1,0,1,0,0|1,0,0]=3 3919 B9R1.38 CC1(C)OC(=O)C=C1N Amb28193555 [0,1,0,1,0,0|0,0,0]=2 3920 B9R1.38 CC1(C)OC(=O)C=C1O Amb28060059 [0,1,0,1,0,0|0,0,0]=2 3921 B9R1.38 CC1(C)OC(=O)CC1=O Amb27838818 [0,1,0,1,0,0|0,0,1]=3 3922 B9R1.38 CC1(C)OC(=O)C[C@H]1O Amb27208228 [0,1,0,1,0,0|0,0,2]=4 3923 B9R1.38 CC1(C)OC(=O)N=C1N Amb23515141 [0,1,0,1,0,0|1,0,0]=3 3924 B9R1.38 CC1(C)OC(=O)NC1=O Amb6296615 [0,1,0,1,0,0|1,0,0]=3 3925 B9R1.38 CC1(C)OC(=S)NC1=O Amb16226161 [0,1,0,1,0,0|1,1,0]=4 3926 B9R1.38 CC1(C)SC(=O)NC1=O Amb20622849 [0,1,0,1,0,0|1,1,0]=4 3927 B9R1.38 CC1=CC(=O)C(C)(C)O1 Amb25319517 [0,1,0,1,0,0|1,0,0]=3 3928 B9R1.38 CC1=CC(=O)CC1(C)C Amb16191973 [0,1,0,1,0,0|1,0,0]=3 3929 B9R1.38 CC1=CC(=O)CC1(C)O Amb27838694 [0,1,0,1,0,0|2,0,0]=4 3930 B9R1.38 CC1=CC(=O)OC1(C)C Amb32664388 [0,1,0,1,0,0|0,0,0]=2 3931 B9R1.38 CC1=CC(C)=NC1(C)C Amb25844089 [0,1,0,1,0,0|2,0,0]=4 3932 B9R1.38 CC1=CC(O)CC1(C)C Amb28065211 [0,1,0,1,0,0|1,0,1]=4 3933 B9R1.38 CC1CC(=O)OC1(C)C Amb28206444 [0,1,0,1,0,0|0,0,2]=4 3934 B9R1.38 CC1NC(=O)OC1(C)C Amb28457652 [0,1,0,1,0,0|1,0,1]=4 3935 B9R1.44 CC1CC1(N)CC(=O)O Amb27816522 [0,1,0,1,0,0|0,0,2]=4 3936 B9R1.45 C=C(C(=O)O)C1CC1C Amb33144231 [0,1,0,1,0,0|0,0,1]=3 3937 B9R1.45 CC1CC1C(=O)C(=O)O Amb24760671 [0,1,0,1,0,0|0,0,1]=3 3938 B9R1.45 CC1CC1C(C)C(=O)O Amb25708709 [0,1,0,1,0,0|0,0,2]=4 3939 B9R1.45 CC1CC1C(N)C(=O)O Amb33359576 [0,1,0,1,0,0|0,0,2]=4 3940 B9R1.45 CC1CC1C(O)C(=O)O Amb33474336 [0,1,0,1,0,0|0,0,2]=4 3941 B9R1.112 CC(=O)C(=O)NC1CC1 Amb17399817 [0,1,0,1,0,0|2,0,0]=4 3942 B9R1.112 CC(CC1CC1)C(=O)O Amb28075498 [0,1,0,1,0,0|0,0,2]=4 3943 B9R1.112 CC(NC1CC1)C(=O)O Amb9620653 [0,1,0,1,0,0|1,0,1]=4 3944 B9R1.112 CC(OC1CC1)C(=O)O Amb27667232 [0,1,0,1,0,0|1,0,1]=4 3945 B9R1.112 C[C@@H](CC1CC1)C(=O)O Amb10844014 [0,1,0,1,0,0|0,0,2]=4 3946 B9R1.112 C[C@@H](NC1CC1)C(=O)O Amb24398132 [0,1,0,1,0,0|1,0,1]=4 3947 B9R1.112 C[C@H](CC1CC1)C(=O)O Amb33749387 [0,1,0,1,0,0|0,0,2]=4 3948 B9R1.112 C\C(=C/C1CC1)C(=O)O Amb25996000 [0,1,0,1,0,0|0,0,0]=2 3949 B9R1.112 C\C(=C/C1CC1)[N+](=O)[O-] Amb27816048 [0,1,0,1,0,0|1,0,1]=4 3950 B9R1.112 NC(=O)C(=O)NC1CC1 Amb28255966 [0,1,0,1,0,0|2,0,0]=4 3951 B9R1.112 NC(CC1CC1)C(=O)O Amb23399727 [0,1,0,1,0,0|0,0,2]=4 3952 B9R1.112 NC(CC1CC1)C(=O)O Amb4019455 [0,1,0,1,0,0|0,0,2]=4 3953 B9R1.112 N[C@@H](CC1CC1)C(=O)O Amb24329024 [0,1,0,1,0,0|0,0,2]=4 3954 B9R1.112 N[C@H](CC1CC1)C(=O)O Amb2699114 [0,1,0,1,0,0|0,0,2]=4 3955 B9R1.112 O=C(O)C(=O)CC1CC1 Amb18988329 [0,1,0,1,0,0|0,0,1]=3 3956 B9R1.112 O=C(O)C(=O)NC1CC1 Amb9303797 [0,1,0,1,0,0|1,0,0]=3 3957 B9R1.112 O=C(O)C(F)CC1CC1 Amb27838541 [0,1,0,1,0,0|0,0,2]=4 3958 B9R1.112 O=C(O)C(O)CC1CC1 Amb25082516 [0,1,0,1,0,0|0,0,2]=4 3959 B9R1.112 O=C(O)C(S)CC1CC1 Amb18296302 [0,1,0,1,0,0|0,0,2]=4 3960 B9R1.112 O=C(O)[C@@H](O)CC1CC1 Amb23401512 [0,1,0,1,0,0|0,0,2]=4 3961 B9R1.112 O=C(O)[C@H](O)CC1CC1 Amb26014645 [0,1,0,1,0,0|0,0,2]=4 3962 B9R1.112 O=C(O)\C(F)=C\C1CC1 Amb25102827 [0,1,0,1,0,0|0,0,0]=2 3963 B9R1.137 CC(=O)CC(=O)C1CC1 Amb9206108 [0,1,0,1,0,0|1,0,1]=4 3964 B9R1.137 CC(=O)\C=C(/C)C1CC1 Amb28351677 [0,1,0,1,0,0|1,0,0]=3 3965 B9R1.137 CC(=O)\C=C(\C)C1CC1 Amb25889814 [0,1,0,1,0,0|1,0,0]=3 3966 B9R1.137 CC(C)=CC(=O)C1CC1 Amb28367871 [0,1,0,1,0,0|2,0,0]=4 3967 B9R1.137 CC(CC(=O)O)C1CC1 Amb6749210 [0,1,0,1,0,0|0,0,2]=4 3968 B9R1.137 CN(CC(=O)O)C1CC1 Amb8892577 [0,1,0,1,0,0|1,0,1]=4 3969 B9R1.137 C\C(=C/C(=O)O)C1CC1 Amb10609547 [0,1,0,1,0,0|0,0,0]=2 3970 B9R1.137 C\C(=C\C(=O)O)C1CC1 Amb10718081 [0,1,0,1,0,0|0,0,0]=2 3971 B9R1.137 C\C(=C\C(C)O)C1CC1 Amb28397596 [0,1,0,1,0,0|1,0,1]=4 3972 B9R1.137 C\C(N)=C/C(=O)C1CC1 Amb27648094 [0,1,0,1,0,0|2,0,0]=4 3973 B9R1.137 NC(=O)NC(=O)C1CC1 Amb25104753 [0,1,0,1,0,0|2,0,0]=4 3974 B9R1.137 NC(CC(=O)O)C1CC1 Amb2683273 [0,1,0,1,0,0|0,0,2]=4 3975 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb26989123 [0,1,0,1,0,0|0,0,2]=4 3976 B9R1.137 N[C@@H](CC(=O)O)C1CC1 Amb33329309 [0,1,0,1,0,0|0,0,2]=4 3977 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb24349802 [0,1,0,1,0,0|0,0,2]=4 3978 B9R1.137 N[C@H](CC(=O)O)C1CC1 Amb33329112 [0,1,0,1,0,0|0,0,2]=4 3979 B9R1.137 O=C(O)CC(=O)C1CC1 Amb10576272 [0,1,0,1,0,0|0,0,1]=3 3980 B9R1.137 O=C(O)CC(O)C1CC1 Amb17231863 [0,1,0,1,0,0|0,0,2]=4 3981 B9R1.137 O=C(O)C[C@@H](O)C1CC1 Amb25367343 [0,1,0,1,0,0|0,0,2]=4 3982 B9R1.137 O=C(O)C[C@H](O)C1CC1 Amb27468740 [0,1,0,1,0,0|0,0,2]=4 3983 B9R1.137 O=C(O)\C=C(\Cl)C1CC1 Amb25272142 [0,1,0,1,0,0|0,0,0]=2 3984 B9R1.139 C=C1C(C(C)=O)C1(C)C Amb27762509 [0,1,0,1,0,0|1,0,1]=4 3985 B9R1.139 CC1(C)C(Br)C1C(=O)O Amb28078793 [0,1,0,1,0,0|0,0,2]=4 3986 B9R1.139 CC1(C)C(C(=O)O)[C@H]1Cl Amb28043135 [0,1,0,1,0,0|0,0,2]=4 3987 B9R1.139 CC1(C)C(O)C1C(=O)O Amb27642274 [0,1,0,1,0,0|0,0,2]=4 3988 B9R1.139 C[C@@H]1[C@@H](C(=O)O)C1(C)C Amb27247272 [0,1,0,1,0,0|0,0,2]=4 3989 B9R1.139 C[C@H]1[C@@H](C(=O)O)C1(C)C Amb28429827 [0,1,0,1,0,0|0,0,2]=4 3990 B9R1.152 CC1CC(C)(C(=O)O)C1 Amb23448860 [0,1,0,1,0,0|0,0,2]=4 3991 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb25821754 [0,1,0,1,0,0|0,0,2]=4 3992 B9R1.152 CC1CC(N)(C(=O)O)C1 Amb30585229 [0,1,0,1,0,0|0,0,2]=4 3993 B9R1.164 CC1(C)C=C(C(=O)O)C1 Amb22405981 [0,1,0,1,0,0|0,0,0]=2 3994 B9R1.164 CC1(C)CC(C(=O)O)C1 Amb33542624 [0,1,0,1,0,0|0,0,2]=4 3995 B9R1.164 CC1(C)CC(C(=O)O)N1 Amb24117447 [0,1,0,1,0,0|0,0,2]=4 3996 B9R1.164 CC1(Cl)CC(C(=O)O)C1 Amb28364447 [0,1,0,1,0,0|0,0,2]=4 3997 B9R1.164 CC1(F)CC(C(=O)O)C1 Amb23439467 [0,1,0,1,0,0|0,0,2]=4 3998 B9R1.164 CC1(O)CC(C(=O)O)C1 Amb33545096 [0,1,0,1,0,0|0,0,2]=4 3999 B9R1.164 C[C@]1(Cl)C[C@@H](C(=O)O)C1 Amb27170444 [0,1,0,1,0,0|0,0,2]=4 4000 B9R1.164 C[C@]1(F)C[C@@H](C(=O)O)C1 Amb26394027 [0,1,0,1,0,0|0,0,2]=4 4001 B9R1.164 C[C@]1(F)C[C@H](C(=O)O)C1 Amb28350729 [0,1,0,1,0,0|0,0,2]=4 4002 B9R1.164 C[C@]1(O)C[C@@H](C(=O)O)C1 Amb23440037 [0,1,0,1,0,0|0,0,2]=4 4003 B9R1.164 C[C@]1(O)C[C@H](C(=O)O)C1 Amb23440038 [0,1,0,1,0,0|0,0,2]=4 4004 B9R1.169 CC1(C)CC1(N)C(=O)O Amb35788491 [0,1,0,1,0,0|0,0,2]=4 4005 B9R1.169 CC1(C)CC1(N)C(=O)O Amb4296872 [0,1,0,1,0,0|0,0,2]=4 4006 B9R1.169 CC1(C)C[C@@]1(N)C(=O)O Amb4296946 [0,1,0,1,0,0|0,0,2]=4 4007 B9R1.146 CC1(C)C=CP(=O)(O)O1 Amb2780620 [0,1,0,1,0,0|1,0,0]=3 4008 B9R2.19 OC1C=CC2CC1C2 Amb28207135 [0,0,0,2,0,0|1,0,1]=4 4009 B9R2.21 O=C1C=CC2CC2C1 Amb28284686 [0,0,0,2,0,0|1,0,0]=3 4010 B9R2.21 O=C1CCC2CC2O1 Amb27422131 [0,0,0,2,0,0|0,0,2]=4 4011 B9R2.21 O=C1NC2CC2CO1 Amb28247932 [0,0,0,2,0,0|1,0,1]=4 4012 B9R2.21 OC1C=C[C@@H]2C[C@@H]2C1 Amb27197544 [0,0,0,2,0,0|1,0,1]=4 4013 B9R2.21 O[C@@H]1C=C[C@H]2C[C@H]2C1 Amb28202543 [0,0,0,2,0,0|1,0,1]=4 4014 B9R2.150 O=C(O)C1CC2CC21 Amb25049722 [0,0,0,2,0,0|0,0,2]=4 4015 B9R2.145 O=C(O)C12CC(C1)C2 Amb22493631 [0,0,0,2,0,0|0,0,2]=4 4016 B9R2.143 O=C(O)C1CC12CC2 Amb8010165 [0,0,0,2,0,0|0,0,2]=4 4017 B9R2.143 O=C(O)[C@@H]1CC12CC2 Amb28071386 [0,0,0,2,0,0|0,0,2]=4 4018 B5R0.5 C=C(Br)C(C)C Amb22583736 [0,0,0,0,2,0|2,0,0]=4 4019 B5R0.5 C=C(C)C(=O)O Amb6608998 [0,0,0,0,2,0|0,0,2]=4 4020 B5R0.5 C=C(C)C(C)C Amb8513830 [0,0,0,0,2,0|2,0,0]=4 4021 B5R0.5 CC(=O)C(=O)O Amb932807 [0,0,0,0,2,0|1,0,1]=4 4022 B5R0.5 CC(=O)C(C)Br Amb8384405 [0,0,0,0,2,0|2,0,0]=4 4023 B5R0.5 CC(=O)C(C)C Amb4605987 [0,0,0,0,2,0|1,0,0]=3 4024 B5R0.5 CC(=O)C(C)Cl Amb9702838 [0,0,0,0,2,0|2,0,0]=4 4025 B5R0.5 CC(=O)C(C)F Amb10841897 [0,0,0,0,2,0|2,0,0]=4 4026 B5R0.5 CC(=O)C(C)I Amb28315734 [0,0,0,0,2,0|2,0,0]=4 4027 B5R0.5 CC(=O)C(C)N Amb17593029 [0,0,0,0,2,0|2,0,0]=4 4028 B5R0.5 CC(=O)C(C)N Amb19148817 [0,0,0,0,2,0|2,0,0]=4 4029 B5R0.5 CC(=O)C(C)O Amb6608962 [0,0,0,0,2,0|2,0,0]=4 4030 B5R0.5 CC(=O)C(C)S Amb8393169 [0,0,0,0,2,0|2,0,0]=4 4031 B5R0.5 CC(=O)N(C)C Amb24323347 [0,0,0,0,2,0|2,0,0]=4 4032 B5R0.5 CC(=O)N(C)C Amb2793066 [0,0,0,0,2,0|2,0,0]=4 4033 B5R0.5 CC(=O)[C@@H](C)N Amb22748924 [0,0,0,0,2,0|2,0,0]=4 4034 B5R0.5 CC(=O)[C@H](C)N Amb26418661 [0,0,0,0,2,0|2,0,0]=4 4035 B5R0.5 CC(=S)C(=O)O Amb27424126 [0,0,0,0,2,0|1,0,1]=4 4036 B5R0.5 CC(Br)C(=O)Br Amb7969424 [0,0,0,0,2,0|2,0,0]=4 4037 B5R0.5 CC(Br)C(=O)Cl Amb6296592 [0,0,0,0,2,0|2,0,0]=4 4038 B5R0.5 CC(Br)C(=O)O Amb2795764 [0,0,0,0,2,0|1,0,0]=3 4039 B5R0.5 CC(Br)C(N)=O Amb2779903 [0,0,0,0,2,0|2,0,0]=4 4040 B5R0.5 CC(C)B(O)O Amb2447044 [0,0,0,0,2,0|1,0,1]=4 4041 B5R0.5 CC(C)C(=N)N Amb2695035 [0,0,0,0,2,0|2,0,0]=4 4042 B5R0.5 CC(C)C(=N)N Amb2725173 [0,0,0,0,2,0|2,0,0]=4 4043 B5R0.5 CC(C)C(=O)Br Amb22731066 [0,0,0,0,2,0|1,0,0]=3 4044 B5R0.5 CC(C)C(=O)Cl Amb3939052 [0,0,0,0,2,0|1,0,0]=3 4045 B5R0.5 CC(C)C(=O)F Amb25848493 [0,0,0,0,2,0|1,0,0]=3 4046 B5R0.5 CC(C)C(=O)I Amb26992316 [0,0,0,0,2,0|1,0,0]=3 4047 B5R0.5 CC(C)C(=O)O Amb3939822 [0,0,0,0,2,0|0,0,0]=2 4048 B5R0.5 CC(C)C(=O)S Amb33482574 [0,0,0,0,2,0|0,1,0]=3 4049 B5R0.5 CC(C)C(C)O Amb9748261 [0,0,0,0,2,0|1,0,1]=4 4050 B5R0.5 CC(C)C(N)=O Amb1153145 [0,0,0,0,2,0|1,0,0]=3 4051 B5R0.5 CC(C)C(N)=S Amb6242688 [0,0,0,0,2,0|1,1,0]=4 4052 B5R0.5 CC(C)N(=O)=O Amb8395293 [0,0,0,0,2,0|1,0,1]=4 4053 B5R0.5 CC(C)N(=O)O Amb33789630 [0,0,0,0,2,0|1,0,0]=3 4054 B5R0.5 CC(C)S(=O)Cl Amb27859539 [0,0,0,0,2,0|2,0,0]=4 4055 B5R0.5 CC(C)S(=O)O Amb27245066 [0,0,0,0,2,0|1,0,0]=3 4056 B5R0.5 CC(C)S(=O)[O-] Amb19929129 [0,0,0,0,2,0|1,0,1]=4 4057 B5R0.5 CC(C)S(N)=O Amb25675545 [0,0,0,0,2,0|2,0,0]=4 4058 B5R0.5 CC(C)[C@@H](C)O Amb13952942 [0,0,0,0,2,0|1,0,1]=4 4059 B5R0.5 CC(C)[C@H](C)O Amb6366846 [0,0,0,0,2,0|1,0,1]=4 4060 B5R0.5 CC(C)[N+](=O)[O-] Amb6608812 [0,0,0,0,2,0|1,0,1]=4 4061 B5R0.5 CC(Cl)C(=O)Cl Amb9703139 [0,0,0,0,2,0|2,0,0]=4 4062 B5R0.5 CC(Cl)C(=O)F Amb27863699 [0,0,0,0,2,0|2,0,0]=4 4063 B5R0.5 CC(Cl)C(=O)O Amb3940363 [0,0,0,0,2,0|1,0,0]=3 4064 B5R0.5 CC(Cl)C(N)=O Amb9745753 [0,0,0,0,2,0|2,0,0]=4 4065 B5R0.5 CC(Cl)S(=O)O Amb27983761 [0,0,0,0,2,0|2,0,0]=4 4066 B5R0.5 CC(F)C(=O)O Amb10605770 [0,0,0,0,2,0|1,0,0]=3 4067 B5R0.5 CC(F)C(N)=O Amb28248497 [0,0,0,0,2,0|2,0,0]=4 4068 B5R0.5 CC(I)C(=O)O Amb26450528 [0,0,0,0,2,0|1,0,0]=3 4069 B5R0.5 CC(I)C(N)=O Amb25684673 [0,0,0,0,2,0|2,0,0]=4 4070 B5R0.5 CC(N)C(=O)O Amb32724352 [0,0,0,0,2,0|1,0,0]=3 4071 B5R0.5 CC(N)C(=O)O Amb5716847 [0,0,0,0,2,0|1,0,0]=3 4072 B5R0.5 CC(N)C(=O)S Amb27175379 [0,0,0,0,2,0|1,1,0]=4 4073 B5R0.5 CC(N)C(N)=O Amb21958673 [0,0,0,0,2,0|2,0,0]=4 4074 B5R0.5 CC(N)C(N)=O Amb33532935 [0,0,0,0,2,0|2,0,0]=4 4075 B5R0.5 CC(O)C(=O)O Amb9703100 [0,0,0,0,2,0|1,0,0]=3 4076 B5R0.5 CC(O)C(=O)[O-] Amb3499440 [0,0,0,0,2,0|1,0,1]=4 4077 B5R0.5 CC(O)C(=O)[O-] Amb9787591 [0,0,0,0,2,0|1,0,1]=4 4078 B5R0.5 CC(O)C(N)=O Amb6394657 [0,0,0,0,2,0|2,0,0]=4 4079 B5R0.5 CC(S)C(=O)O Amb6608753 [0,0,0,0,2,0|1,0,0]=3 4080 B5R0.5 CN(C)C(=O)Cl Amb2793056 [0,0,0,0,2,0|2,0,0]=4 4081 B5R0.5 CN(C)C(=O)O Amb22348477 [0,0,0,0,2,0|1,0,0]=3 4082 B5R0.5 CN(C)C(N)=O Amb2604398 [0,0,0,0,2,0|2,0,0]=4 4083 B5R0.5 C[C@@H](Br)C(=O)Br Amb27455066 [0,0,0,0,2,0|2,0,0]=4 4084 B5R0.5 C[C@@H](Br)C(=O)Cl Amb26395930 [0,0,0,0,2,0|2,0,0]=4 4085 B5R0.5 C[C@@H](Br)C(=O)O Amb8515030 [0,0,0,0,2,0|1,0,0]=3 4086 B5R0.5 C[C@@H](Cl)C(=O)Cl Amb28140701 [0,0,0,0,2,0|2,0,0]=4 4087 B5R0.5 C[C@@H](Cl)C(=O)O Amb2725594 [0,0,0,0,2,0|1,0,0]=3 4088 B5R0.5 C[C@@H](I)C(=O)O Amb27878762 [0,0,0,0,2,0|1,0,0]=3 4089 B5R0.5 C[C@@H](I)C(N)=O Amb27863419 [0,0,0,0,2,0|2,0,0]=4 4090 B5R0.5 C[C@@H](N)C(=O)O Amb3940457 [0,0,0,0,2,0|1,0,0]=3 4091 B5R0.5 C[C@@H](N)C(N)=O Amb2371905 [0,0,0,0,2,0|2,0,0]=4 4092 B5R0.5 C[C@@H](N)C(N)=O Amb2778751 [0,0,0,0,2,0|2,0,0]=4 4093 B5R0.5 C[C@@H](O)C(=O)Cl Amb28350419 [0,0,0,0,2,0|2,0,0]=4 4094 B5R0.5 C[C@@H](O)C(=O)O Amb6600026 [0,0,0,0,2,0|1,0,0]=3 4095 B5R0.5 C[C@@H](O)C(=O)[O-] Amb22350432 [0,0,0,0,2,0|1,0,1]=4 4096 B5R0.5 C[C@@H](O)C(=O)[O-] Amb8514494 [0,0,0,0,2,0|1,0,1]=4 4097 B5R0.5 C[C@@H](O)C(N)=O Amb3939680 [0,0,0,0,2,0|2,0,0]=4 4098 B5R0.5 C[C@H](Br)C(=O)O Amb8515029 [0,0,0,0,2,0|1,0,0]=3 4099 B5R0.5 C[C@H](Cl)C(=O)Cl Amb24373163 [0,0,0,0,2,0|2,0,0]=4 4100 B5R0.5 C[C@H](Cl)C(=O)F Amb28138044 [0,0,0,0,2,0|2,0,0]=4 4101 B5R0.5 C[C@H](Cl)C(=O)O Amb17776586 [0,0,0,0,2,0|1,0,0]=3 4102 B5R0.5 C[C@H](F)C(=O)O Amb27216697 [0,0,0,0,2,0|1,0,0]=3 4103 B5R0.5 C[C@H](N)C(=O)O Amb33780861 [0,0,0,0,2,0|1,0,0]=3 4104 B5R0.5 C[C@H](N)C(=O)O Amb6298336 [0,0,0,0,2,0|1,0,0]=3 4105 B5R0.5 C[C@H](N)C(=O)S Amb28315892 [0,0,0,0,2,0|1,1,0]=4 4106 B5R0.5 C[C@H](N)C(N)=O Amb20670443 [0,0,0,0,2,0|2,0,0]=4 4107 B5R0.5 C[C@H](N)C(N)=O Amb2371522 [0,0,0,0,2,0|2,0,0]=4 4108 B5R0.5 C[C@H](N)C(N)=O Amb2778752 [0,0,0,0,2,0|2,0,0]=4 4109 B5R0.5 C[C@H](N)C(N)=O Amb33822632 [0,0,0,0,2,0|2,0,0]=4 4110 B5R0.5 C[C@H](O)C(=O)O Amb8386374 [0,0,0,0,2,0|1,0,0]=3 4111 B5R0.5 C[C@H](O)C(=O)[O-] Amb17772234 [0,0,0,0,2,0|1,0,1]=4 4112 B5R0.5 C[C@H](O)C(=O)[O-] Amb8515200 [0,0,0,0,2,0|1,0,1]=4 4113 B5R0.5 C[C@H](O)C(N)=O Amb3939676 [0,0,0,0,2,0|2,0,0]=4 4114 B5R0.5 C[C@H](S)C(=O)O Amb25147510 [0,0,0,0,2,0|1,0,0]=3 4115 B5R0.5 NC(Br)C(=O)O Amb25724348 [0,0,0,0,2,0|2,0,0]=4 4116 B5R0.5 NC(O)C(=O)O Amb24663706 [0,0,0,0,2,0|2,0,0]=4 4117 B5R0.5 NC(S)C(=O)O Amb27253385 [0,0,0,0,2,0|2,0,0]=4 4118 B5R0.5 N[C@@H](S)C(=O)O Amb27788398 [0,0,0,0,2,0|2,0,0]=4 4119 B5R0.5 O=C(O)C(Br)I Amb17610018 [0,0,0,0,2,0|2,0,0]=4 4120 B5R0.5 O=C(O)C(Cl)Cl Amb6891960 [0,0,0,0,2,0|2,0,0]=4 4121 B5R0.5 O=C(O)C(Cl)I Amb17610937 [0,0,0,0,2,0|2,0,0]=4 4122 B5R0.5 O=C(O)C(F)Br Amb10841090 [0,0,0,0,2,0|2,0,0]=4 4123 B5R0.5 O=C(O)C(F)Cl Amb10838714 [0,0,0,0,2,0|2,0,0]=4 4124 B5R0.5 O=C(O)C(F)F Amb1953492 [0,0,0,0,2,0|2,0,0]=4 4125 B5R0.5 O=C(O)C(F)I Amb10838458 [0,0,0,0,2,0|2,0,0]=4 4126 B5R0.5 O=C(O)C(I)I Amb17612865 [0,0,0,0,2,0|2,0,0]=4 4127 B5R0.5 O=C(O)C(O)O Amb6608986 [0,0,0,0,2,0|2,0,0]=4 4128 B5R0.5 O=C(O)[C@@H](F)Cl Amb26559563 [0,0,0,0,2,0|2,0,0]=4 4129 B5R0.5 O=C(O)[C@@H](F)I Amb27827825 [0,0,0,0,2,0|2,0,0]=4 4130 B5R0.5 O=C(O)[C@H](F)Br Amb28200717 [0,0,0,0,2,0|2,0,0]=4 4131 B9R0.55 C=C(C)C#C\C=C/C(=O)O Amb27630707 [0,0,0,0,0,2|0,0,2]=4 4132 B9R0.55 C=C(C)CC\C=C\C(=O)O Amb27253611 [0,0,0,0,0,2|0,0,2]=4 4133 B9R0.55 C=C(C)CO\C=C\C(=O)O Amb18643826 [0,0,0,0,0,2|0,0,2]=4 4134 B9R0.55 CC(=O)CC\C=C\C(=O)O Amb17593589 [0,0,0,0,0,2|1,0,1]=4 4135 B9R0.55 CC(=O)C\C=C\C=C(C)C Amb24646499 [0,0,0,0,0,2|1,0,1]=4 4136 B9R0.55 CC(=O)NC\C=C\C(=O)O Amb27259093 [0,0,0,0,0,2|1,0,1]=4 4137 B9R0.55 CC(=O)OC\C=C\C(=O)O Amb24454652 [0,0,0,0,0,2|1,0,1]=4 4138 B9R0.55 CC(=O)\C=C/NCC(C)C Amb26887251 [0,0,0,0,0,2|1,0,0]=3 4139 B9R0.55 CC(=O)\C=C\C#CN(C)C Amb24594764 [0,0,0,0,0,2|2,0,0]=4 4140 B9R0.55 CC(=O)\C=C\C=C\C(=O)O Amb27205327 [0,0,0,0,0,2|1,0,1]=4 4141 B9R0.55 CC(=O)\C=C\C=C\C(C)C Amb27615126 [0,0,0,0,0,2|1,0,0]=3 4142 B9R0.55 CC(=O)\C=C\CCC(C)C Amb25111718 [0,0,0,0,0,2|1,0,0]=3 4143 B9R0.55 CC(=O)\C=C\CCN(C)C Amb33271941 [0,0,0,0,0,2|2,0,0]=4 4144 B9R0.55 CC(=O)\C=C\COC(C)C Amb33274083 [0,0,0,0,0,2|1,0,0]=3 4145 B9R0.55 CC(=O)\C=C\NCC(C)C Amb25961808 [0,0,0,0,0,2|1,0,0]=3 4146 B9R0.55 CC(C)=CCOCC(=O)O Amb18644115 [0,0,0,0,0,2|0,0,2]=4 4147 B9R0.55 CC(C)=C\C=C\CC(=O)O Amb27473342 [0,0,0,0,0,2|0,0,1]=3 4148 B9R0.55 CC(C)C#C\C=C/C(=O)O Amb27392234 [0,0,0,0,0,2|0,0,0]=2 4149 B9R0.55 CC(C)C=C=CCC(=O)O Amb27952365 [0,0,0,0,0,2|0,0,0]=2 4150 B9R0.55 CC(C)CC#CCC(=O)O Amb27754079 [0,0,0,0,0,2|0,0,2]=4 4151 B9R0.55 CC(C)CCC#CC(=O)O Amb27494024 [0,0,0,0,0,2|0,0,2]=4 4152 B9R0.55 CC(C)CCCCC(=O)O Amb10576144 [0,0,0,0,0,2|0,0,2]=4 4153 B9R0.55 CC(C)CCNCC(=O)O Amb1111021 [0,0,0,0,0,2|0,0,2]=4 4154 B9R0.55 CC(C)CCOCC(=O)O Amb6268007 [0,0,0,0,0,2|0,0,2]=4 4155 B9R0.55 CC(C)CCSCC(=O)O Amb1137397 [0,0,0,0,0,2|0,0,2]=4 4156 B9R0.55 CC(C)CC\C=C\B(O)O Amb22168996 [0,0,0,0,0,2|1,0,1]=4 4157 B9R0.55 CC(C)CC\C=C\C(=O)O Amb17593603 [0,0,0,0,0,2|0,0,0]=2 4158 B9R0.55 CC(C)CNCCC(=O)O Amb10609230 [0,0,0,0,0,2|0,0,2]=4 4159 B9R0.55 CC(C)CNCCC(=O)O Amb2372367 [0,0,0,0,0,2|0,0,2]=4 4160 B9R0.55 CC(C)COCCC(=O)O Amb6280020 [0,0,0,0,0,2|0,0,2]=4 4161 B9R0.55 CC(C)CSCCC(=O)O Amb6278798 [0,0,0,0,0,2|0,0,2]=4 4162 B9R0.55 CC(C)CSSCC(=O)O Amb27865411 [0,0,0,0,0,2|0,0,2]=4 4163 B9R0.55 CC(C)C\C=C\CC(C)O Amb27968433 [0,0,0,0,0,2|1,0,1]=4 4164 B9R0.55 CC(C)NCCCC(=O)O Amb1111231 [0,0,0,0,0,2|0,0,2]=4 4165 B9R0.55 CC(C)NCCCC(=O)O Amb528115 [0,0,0,0,0,2|0,0,2]=4 4166 B9R0.55 CC(C)NC\C=C\C(=O)O Amb27601688 [0,0,0,0,0,2|0,0,0]=2 4167 B9R0.55 CC(C)OCCCC(=O)O Amb6274334 [0,0,0,0,0,2|0,0,2]=4 4168 B9R0.55 CC(C)OCOCC(=O)O Amb26370232 [0,0,0,0,0,2|0,0,2]=4 4169 B9R0.55 CC(C)OCSCC(=O)O Amb28241661 [0,0,0,0,0,2|0,0,2]=4 4170 B9R0.55 CC(C)OC\C=C\C(=O)O Amb33475206 [0,0,0,0,0,2|0,0,0]=2 4171 B9R0.55 CC(C)OC\C=C\[N+](=O)[O-] Amb33274087 [0,0,0,0,0,2|1,0,1]=4 4172 B9R0.55 CC(C)SCCCC(=O)O Amb17503621 [0,0,0,0,0,2|0,0,2]=4 4173 B9R0.55 CC(C)SC\C=C\C(=O)O Amb19020662 [0,0,0,0,0,2|0,0,0]=2 4174 B9R0.55 CC(C)\C=C\C=C\C(=O)O Amb25367977 [0,0,0,0,0,2|0,0,0]=2 4175 B9R0.55 CC(C)\C=C\C=C\C(N)=O Amb28435289 [0,0,0,0,0,2|1,0,0]=3 4176 B9R0.55 CC(C)\C=N\CCC(=O)O Amb27759498 [0,0,0,0,0,2|0,0,1]=3 4177 B9R0.55 CC(N)CS\C=C\C(=O)O Amb27772740 [0,0,0,0,0,2|1,0,0]=3 4178 B9R0.55 CC(O)C#C\C=C\C(=O)O Amb27961415 [0,0,0,0,0,2|1,0,0]=3 4179 B9R0.55 CC(O)\C=C\CCC(=O)O Amb24453133 [0,0,0,0,0,2|1,0,0]=3 4180 B9R0.55 CN(C)CC\C=C/C(=O)O Amb27815066 [0,0,0,0,0,2|1,0,0]=3 4181 B9R0.55 CN(C)CC\C=C\C(=O)O Amb32954654 [0,0,0,0,0,2|1,0,0]=3 4182 B9R0.55 CS(=O)NC\C=C\C(=O)O Amb28195221 [0,0,0,0,0,2|2,0,0]=4