0 B5R0.5 BrC(=C)C(=O)N 1P00ICIE [0,0,0,0,0,0|2,0,2]=4 1 B5R0.5 BrC(=C)C(=O)O 1P003H7Y [0,0,0,0,0,0|1,0,2]=3 2 B5R0.5 BrC(=O)C(Br)C 1P003H9L [0,0,0,0,0,0|2,0,0]=2 3 B5R0.5 BrC(C(=O)C)Br 1P008FOH [0,0,0,0,0,0|3,0,0]=3 4 B5R0.5 CC(=C(C)C)Br 1P003H3O [0,0,0,0,0,0|3,0,1]=4 5 B5R0.5 CC(=C(C)C)C 1P003656 [0,0,0,0,0,0|3,0,1]=4 6 B5R0.5 CC(=C)C(=C)C 1P003G0E [0,0,0,0,0,0|3,0,1]=4 7 B5R0.5 CC(=C)C(=O)N 1P003RY9 [0,0,0,0,0,0|2,0,1]=3 8 B5R0.5 CC(=C)C(=O)O 1P0036XE [0,0,0,0,0,0|1,0,1]=2 9 B5R0.5 CC(=C)C(=O)[O-] 1P0010CG [0,0,0,0,0,0|1,0,2]=3 10 B5R0.5 CC(=C)C(=O)[O-] 1P00111N [0,0,0,0,0,0|1,0,2]=3 11 B5R0.5 CC(=C)C(=O)[O-] 1P001Y9T [0,0,0,0,0,0|1,0,2]=3 12 B5R0.5 CC(=C)C(=O)[O-] 1P003UTP [0,0,0,0,0,0|1,0,2]=3 13 B5R0.5 CC(=C)C(=O)[O-] 1P005QHJ [0,0,0,0,0,0|1,0,2]=3 14 B5R0.5 CC(=C)C(=O)[O-] 1P005ZNF [0,0,0,0,0,0|1,0,2]=3 15 B5R0.5 CC(=C)C(C)C 1P003G0F [0,0,0,0,0,0|3,0,0]=3 16 B5R0.5 CC(=C)C(O)C 1P007H42 [0,0,0,0,0,0|3,0,0]=3 17 B5R0.5 CC(=N)N(C)C 1P01A0N1 [0,0,0,0,0,0|4,0,0]=4 18 B5R0.5 CC(=O)C(=C)C 1P003K68 [0,0,0,0,0,0|2,0,1]=3 19 B5R0.5 CC(=O)C(=O)[O-] 1P002Y88 [0,0,0,0,0,0|1,0,2]=3 20 B5R0.5 CC(=O)C(=O)[O-] 1P003P54 [0,0,0,0,0,0|1,0,2]=3 21 B5R0.5 CC(=O)C(=O)[O-] 1P003UJW [0,0,0,0,0,0|1,0,2]=3 22 B5R0.5 CC(=O)C(=S)N 1P01A3YH [0,0,0,0,0,0|2,0,1]=3 23 B5R0.5 CC(=O)C(Br)C 1P003JKY [0,0,0,0,0,0|2,0,0]=2 24 B5R0.5 CC(=O)C(C)C 1P0037OJ [0,0,0,0,0,0|2,0,0]=2 25 B5R0.5 CC(=O)C(Cl)C 1P003ECT [0,0,0,0,0,0|2,0,0]=2 26 B5R0.5 CC(=O)C(O)C 1P00DMTO [0,0,0,0,0,0|2,0,0]=2 27 B5R0.5 CC(=O)C(S)C 1P00BXSU [0,0,0,0,0,0|2,0,0]=2 28 B5R0.5 CC(=O)N(C)C 1P000WZ3 [0,0,0,0,0,0|3,0,0]=3 29 B5R0.5 CC(=O)N(N)C 1P01B894 [0,0,0,0,0,0|2,0,0]=2 30 B5R0.5 CC(=O)N(O)C 1P000W3Q [0,0,0,0,0,0|3,0,0]=3 31 B5R0.5 CC(=O)[C@@H](N)C 1P00IA8G [0,0,0,0,0,0|1,0,0]=1 32 B5R0.5 CC(=O)[NH+](C)C 1P003OS1 [0,0,0,0,0,0|3,0,0]=3 33 B5R0.5 CC(=S)N(C)C 1P003T2C [0,0,0,0,0,0|3,1,0]=4 34 B5R0.5 CC(C(=C)Br)O 1P027Y79 [0,0,0,0,0,0|3,0,0]=3 35 B5R0.5 CC(C(=N)N)C 1P00BDNQ [0,0,0,0,0,0|3,0,0]=3 36 B5R0.5 CC(C(=N)N)Cl 1P018SQA [0,0,0,0,0,0|3,0,0]=3 37 B5R0.5 CC(C(=N)N)O 1P00H5D2 [0,0,0,0,0,0|3,0,0]=3 38 B5R0.5 CC(C(=N)N)O 1P00J38B [0,0,0,0,0,0|3,0,0]=3 39 B5R0.5 CC(C(=O)Br)C 1P003RK5 [0,0,0,0,0,0|2,0,0]=2 40 B5R0.5 CC(C(=O)Cl)Br 1P003BND [0,0,0,0,0,0|2,0,0]=2 41 B5R0.5 CC(C(=O)Cl)C 1P003RK6 [0,0,0,0,0,0|2,0,0]=2 42 B5R0.5 CC(C(=O)N)Br 1P003H9I [0,0,0,0,0,0|2,0,0]=2 43 B5R0.5 CC(C(=O)N)C 1P003RJZ [0,0,0,0,0,0|2,0,0]=2 44 B5R0.5 CC(C(=O)N)Cl 1P002V9S [0,0,0,0,0,0|2,0,0]=2 45 B5R0.5 CC(C(=O)N)I 1P002G87 [0,0,0,0,0,0|2,0,0]=2 46 B5R0.5 CC(C(=O)N)O 1P0029VL [0,0,0,0,0,0|2,0,0]=2 47 B5R0.5 CC(C(=O)O)Br 1P003H9J [0,0,0,0,0,0|1,0,0]=1 48 B5R0.5 CC(C(=O)O)C 1P003729 [0,0,0,0,0,0|1,0,0]=1 49 B5R0.5 CC(C(=O)O)C 1P01D9JB [0,0,0,0,0,0|1,0,0]=1 50 B5R0.5 CC(C(=O)O)F 1P0032QG [0,0,0,0,0,0|1,0,0]=1 51 B5R0.5 CC(C(=O)O)N 1P01ELSY [0,0,0,0,0,0|0,0,0]=0 52 B5R0.5 CC(C(=O)S)C 1P00E3N5 [0,0,0,0,0,0|1,1,0]=2 53 B5R0.5 CC(C(=O)[O-])C 1P002R83 [0,0,0,0,0,0|1,0,1]=2 54 B5R0.5 CC(C(=O)[O-])C 1P003RK3 [0,0,0,0,0,0|1,0,1]=2 55 B5R0.5 CC(C(=O)[O-])O 1P001SCZ [0,0,0,0,0,0|1,0,1]=2 56 B5R0.5 CC(C(=O)[O-])O 1P002IGC [0,0,0,0,0,0|1,0,1]=2 57 B5R0.5 CC(C(=O)[O-])O 1P002IGD [0,0,0,0,0,0|1,0,1]=2 58 B5R0.5 CC(C(=O)[O-])O 1P003P4S [0,0,0,0,0,0|1,0,1]=2 59 B5R0.5 CC(C(=O)[O-])O 1P00IAYP [0,0,0,0,0,0|1,0,1]=2 60 B5R0.5 CC(C(=O)[O-])O 1P01KKX9 [0,0,0,0,0,0|1,0,1]=2 61 B5R0.5 CC(C(=S)N)C 1P0033V4 [0,0,0,0,0,0|2,1,0]=3 62 B5R0.5 CC(C(=S)N)O 1P028CIM [0,0,0,0,0,0|2,1,0]=3 63 B5R0.5 CC(C(Br)C)Br 1P003FXK [0,0,0,0,0,0|3,0,1]=4 64 B5R0.5 CC(C(C)C)Br 1P0024QT [0,0,0,0,0,0|3,0,1]=4 65 B5R0.5 CC(C(C)C)Cl 1P00ERNM [0,0,0,0,0,0|3,0,1]=4 66 B5R0.5 CC(C(C)C)I 1P0024QS [0,0,0,0,0,0|3,0,1]=4 67 B5R0.5 CC(C(C)C)N 1P003DVC [0,0,0,0,0,0|2,0,1]=3 68 B5R0.5 CC(C(C)C)O 1P00E9KB [0,0,0,0,0,0|2,0,1]=3 69 B5R0.5 CC(C(C)C)S 1P002K5G [0,0,0,0,0,0|2,1,1]=4 70 B5R0.5 CC(C(Cl)C)Cl 1P003FY9 [0,0,0,0,0,0|3,0,1]=4 71 B5R0.5 CC(C(F)F)N 1P019UJV [0,0,0,0,0,0|2,0,1]=3 72 B5R0.5 CC(C(F)F)O 1P01B1S8 [0,0,0,0,0,0|3,0,1]=4 73 B5R0.5 CC(C(N)C)Br 1P01B79U [0,0,0,0,0,0|2,0,1]=3 74 B5R0.5 CC(C(N)C)Br 1P028TZD [0,0,0,0,0,0|2,0,1]=3 75 B5R0.5 CC(C(N)C)F 1P0280UG [0,0,0,0,0,0|2,0,1]=3 76 B5R0.5 CC(C(N)C)N 1P01BE8I [0,0,0,0,0,0|2,0,1]=3 77 B5R0.5 CC(C(N)C)O 1P0072BN [0,0,0,0,0,0|1,0,1]=2 78 B5R0.5 CC(C(O)C)Br 1P00ER4N [0,0,0,0,0,0|2,0,1]=3 79 B5R0.5 CC(C(O)C)O 1P0032PK [0,0,0,0,0,0|2,0,1]=3 80 B5R0.5 CC(C(O)C)S 1P003K2Y [0,0,0,0,0,0|2,0,1]=3 81 B5R0.5 CC(C(S)C)S 1P003G00 [0,0,0,0,0,0|2,1,1]=4 82 B5R0.5 CC(N(=O)=O)C 1P003I9T [0,0,0,0,0,0|2,0,1]=3 83 B5R0.5 CC(S(=O)Cl)C 1P00CMZT [0,0,0,0,0,0|3,0,0]=3 84 B5R0.5 CC(S(=O)N)C 1P01BFW0 [0,0,0,0,0,0|3,0,0]=3 85 B5R0.5 CC(S(=O)[O-])C 1P00C6Z1 [0,0,0,0,0,0|2,0,1]=3 86 B5R0.5 CN(C(=N)N)C 1P00BRW7 [0,0,0,0,0,0|4,0,0]=4 87 B5R0.5 CN(C(=N)N)C 1P00E994 [0,0,0,0,0,0|4,0,0]=4 88 B5R0.5 CN(C(=N)N)C 1P00E9AV [0,0,0,0,0,0|4,0,0]=4 89 B5R0.5 CN(C(=O)Cl)C 1P003Q3S [0,0,0,0,0,0|3,0,0]=3 90 B5R0.5 CN(C(=O)N)C 1P0032OO [0,0,0,0,0,0|3,0,0]=3 91 B5R0.5 CN(C(=O)O)C 1P003Q0Z [0,0,0,0,0,0|2,0,0]=2 92 B5R0.5 CN(C(=S)Cl)C 1P007C88 [0,0,0,0,0,0|3,1,0]=4 93 B5R0.5 CN(C(=S)N)C 1P00371O [0,0,0,0,0,0|3,1,0]=4 94 B5R0.5 CN(C(=S)S)C 1P003Q3W [0,0,0,0,0,0|2,2,0]=4 95 B5R0.5 CN(C(=S)[S-])C 1P000Y4S [0,0,0,0,0,0|2,2,0]=4 96 B5R0.5 CN(C(=S)[S-])C 1P002JDK [0,0,0,0,0,0|2,2,0]=4 97 B5R0.5 CN(C(=S)[S-])C 1P00811L [0,0,0,0,0,0|2,2,0]=4 98 B5R0.5 CN(C(C)C)C 1P003T1Y [0,0,0,0,0,0|4,0,0]=4 99 B5R0.5 CP(=O)C(C)C 1P02886T [0,0,0,0,0,0|3,0,0]=3 100 B5R0.5 C[C@@H](C(=N)N)O 1P009I1C [0,0,0,0,0,0|3,0,0]=3 101 B5R0.5 C[C@@H](C(=O)N)O 1P003CUT [0,0,0,0,0,0|2,0,0]=2 102 B5R0.5 C[C@@H](C(=O)O)Br 1P003CU9 [0,0,0,0,0,0|1,0,0]=1 103 B5R0.5 C[C@@H](C(=O)O)Cl 1P002ZDF [0,0,0,0,0,0|1,0,0]=1 104 B5R0.5 C[C@@H](C(=O)O)F 1P00F1Z5 [0,0,0,0,0,0|1,0,0]=1 105 B5R0.5 C[C@@H](C(=O)O)N 1P003RNW [0,0,0,0,0,0|0,0,0]=0 106 B5R0.5 C[C@@H](C(=O)O)N 1P00E9HQ [0,0,0,0,0,0|0,0,0]=0 107 B5R0.5 C[C@@H](C(C)C)N 1P00J87H [0,0,0,0,0,0|2,0,1]=3 108 B5R0.5 C[C@@H](C(C)C)O 1P003CXX [0,0,0,0,0,0|2,0,1]=3 109 B5R0.5 C[C@@H](C(F)F)N 1P028N2I [0,0,0,0,0,0|2,0,1]=3 110 B5R0.5 C[C@@H](O)[C@@H](N)C 1P01FWSW [0,0,0,0,0,0|1,0,1]=2 111 B5R0.5 C[C@@H]([C@@H](N)C)O 1P01OML7 [0,0,0,0,0,0|1,0,1]=2 112 B5R0.5 C[C@@H]([C@@H](O)C)O 1P0032YC [0,0,0,0,0,0|2,0,1]=3 113 B5R0.5 C[C@@H]([C@H](N)C)O 1P024HCX [0,0,0,0,0,0|1,0,1]=2 114 B5R0.5 C[C@H](C(=N)N)O 1P00CJEK [0,0,0,0,0,0|3,0,0]=3 115 B5R0.5 C[C@H](C(=O)N)O 1P003CML [0,0,0,0,0,0|2,0,0]=2 116 B5R0.5 C[C@H](C(=O)O)Br 1P0001CR [0,0,0,0,0,0|1,0,0]=1 117 B5R0.5 C[C@H](C(=O)O)Cl 1P003BFE [0,0,0,0,0,0|1,0,0]=1 118 B5R0.5 C[C@H](C(=O)O)N 1P003559 [0,0,0,0,0,0|0,0,0]=0 119 B5R0.5 C[C@H](C(=O)O)S 1P007HM9 [0,0,0,0,0,0|1,0,0]=1 120 B5R0.5 C[C@H](C(C)C)N 1P01DH3B [0,0,0,0,0,0|2,0,1]=3 121 B5R0.5 C[C@H](C(C)C)O 1P001PQR [0,0,0,0,0,0|2,0,1]=3 122 B5R0.5 C[C@H](C(F)F)N 1P01XBK2 [0,0,0,0,0,0|2,0,1]=3 123 B5R0.5 C[C@H]([C@@H](Br)C)Br 1P003RXY [0,0,0,0,0,0|3,0,1]=4 124 B5R0.5 C[C@H]([C@H](O)C)O 1P0032W8 [0,0,0,0,0,0|2,0,1]=3 125 B5R0.5 C[N+](=C(N)N)N 1P01BFXM [0,0,0,0,0,0|3,0,0]=3 126 B5R0.5 ClC(=C(Cl)C)Cl 1P00BE4M [0,0,0,0,0,0|3,0,1]=4 127 B5R0.5 ClC(=C)C(=O)O 1P003HI1 [0,0,0,0,0,0|1,0,2]=3 128 B5R0.5 ClC(=O)C(=O)C 1P00EL7R [0,0,0,0,0,0|2,0,1]=3 129 B5R0.5 ClC(=O)C(=O)Cl 1P0035WI [0,0,0,0,0,0|3,0,1]=4 130 B5R0.5 ClC(=O)C(Cl)C 1P003BO8 [0,0,0,0,0,0|2,0,0]=2 131 B5R0.5 ClC(=O)C(Cl)Cl 1P003PU4 [0,0,0,0,0,0|3,0,0]=3 132 B5R0.5 ClC(=O)C(Cl)F 1P00C9D4 [0,0,0,0,0,0|3,0,0]=3 133 B5R0.5 ClC(=O)[C@@H](Cl)C 1P01BY6S [0,0,0,0,0,0|2,0,0]=2 134 B5R0.5 ClC(=O)[C@H](Cl)C 1P006CQL [0,0,0,0,0,0|2,0,0]=2 135 B5R0.5 ClC(C(=O)N)Cl 1P003PTZ [0,0,0,0,0,0|3,0,0]=3 136 B5R0.5 ClC(C(=O)[O-])Cl 1P003USX [0,0,0,0,0,0|2,0,1]=3 137 B5R0.5 FC(=C)C(=O)Cl 1P001WGS [0,0,0,0,0,0|2,0,2]=4 138 B5R0.5 FC(=C)C(=O)O 1P0039KQ [0,0,0,0,0,0|1,0,2]=3 139 B5R0.5 FC(C(=N)N)F 1P01EM4K [0,0,0,0,0,0|4,0,0]=4 140 B5R0.5 FC(C(=O)C)F 1P00396G [0,0,0,0,0,0|3,0,0]=3 141 B5R0.5 FC(C(=O)N)F 1P00C7PN [0,0,0,0,0,0|3,0,0]=3 142 B5R0.5 FC(C(=O)O)F 1P003PZ6 [0,0,0,0,0,0|2,0,0]=2 143 B5R0.5 FC(C(=O)[O-])F 1P005S6T [0,0,0,0,0,0|2,0,1]=3 144 B5R0.5 FC(C(=O)[O-])F 1P00C5BF [0,0,0,0,0,0|2,0,1]=3 145 B5R0.5 FC(S(=O)[O-])F 1P00I5OF [0,0,0,0,0,0|3,0,1]=4 146 B5R0.5 NC(=N)C(N)C 1P028QKH [0,0,0,0,0,0|2,0,0]=2 147 B5R0.5 NC(=N)S(=O)O 1P0021O6 [0,0,0,0,0,0|2,0,1]=3 148 B5R0.5 NC(=O)C(=O)C 1P00F3KY [0,0,0,0,0,0|2,0,1]=3 149 B5R0.5 NC(=O)C(=O)N 1P0035WJ [0,0,0,0,0,0|2,0,1]=3 150 B5R0.5 NC(=O)C(=O)[O-] 1P002LS9 [0,0,0,0,0,0|1,0,2]=3 151 B5R0.5 NC(=O)C(=O)[O-] 1P003TZ9 [0,0,0,0,0,0|1,0,2]=3 152 B5R0.5 NC(=O)C(Br)Cl 1P01IDGP [0,0,0,0,0,0|3,0,0]=3 153 B5R0.5 NC(=O)C(Br)F 1P00C8R4 [0,0,0,0,0,0|3,0,0]=3 154 B5R0.5 NC(=O)C(N)C 1P003H0J [0,0,0,0,0,0|1,0,0]=1 155 B5R0.5 NC(=O)C(N)C 1P003H0K [0,0,0,0,0,0|1,0,0]=1 156 B5R0.5 NC(=O)N(N)C 1P00I4XN [0,0,0,0,0,0|2,0,0]=2 157 B5R0.5 NC(=O)[C@@H](N)C 1P0006VF [0,0,0,0,0,0|1,0,0]=1 158 B5R0.5 NC(=O)[C@@H](N)C 1P0036JB [0,0,0,0,0,0|1,0,0]=1 159 B5R0.5 NC(=O)[C@@H](N)C 1P00ICUD [0,0,0,0,0,0|1,0,0]=1 160 B5R0.5 NC(=O)[C@H](N)C 1P00382K [0,0,0,0,0,0|1,0,0]=1 161 B5R0.5 NC(=O)[C@H](N)C 1P003C4R [0,0,0,0,0,0|1,0,0]=1 162 B5R0.5 NC(=S)C(=S)N 1P003Q8T [0,0,0,0,0,0|2,1,1]=4 163 B5R0.5 NC(=S)C(N)C 1P01C5RS [0,0,0,0,0,0|1,1,0]=2 164 B5R0.5 NC(=S)N(N)C 1P003I3K [0,0,0,0,0,0|2,1,0]=3 165 B5R0.5 N[C@@H]([C@@H](C)O)C 1P01FWSS [0,0,0,0,0,0|1,0,1]=2 166 B5R0.5 O=C([O-])C([O-])=O 1P01K949 [0,0,0,0,0,0|2,0,2]=4 167 B5R0.5 OB(C(=C)C)O 1P001DO9 [0,0,0,0,0,0|2,0,2]=4 168 B5R0.5 OB(C(C)C)O 1P0036Y4 [0,0,0,0,0,0|2,0,1]=3 169 B5R0.5 OC(=O)C(=O)C 1P000WZ4 [0,0,0,0,0,0|1,0,1]=2 170 B5R0.5 OC(=O)C(=O)C 1P00I8KL [0,0,0,0,0,0|1,0,1]=2 171 B5R0.5 OC(=O)C(=O)N 1P007228 [0,0,0,0,0,0|1,0,1]=2 172 B5R0.5 OC(=O)C(=O)O 1P001HGU [0,0,0,0,0,0|2,0,1]=3 173 B5R0.5 OC(=O)C(=O)O 1P001J7Q [0,0,0,0,0,0|2,0,1]=3 174 B5R0.5 OC(=O)C(=O)O 1P001YL3 [0,0,0,0,0,0|2,0,1]=3 175 B5R0.5 OC(=O)C(=O)O 1P0035WH [0,0,0,0,0,0|2,0,1]=3 176 B5R0.5 OC(=O)C(=O)O 1P00365O [0,0,0,0,0,0|2,0,1]=3 177 B5R0.5 OC(=O)C(=O)O 1P003UGT [0,0,0,0,0,0|2,0,1]=3 178 B5R0.5 OC(=O)C(=O)O 1P006O51 [0,0,0,0,0,0|2,0,1]=3 179 B5R0.5 OC(=O)C(=O)O 1P00C1U2 [0,0,0,0,0,0|2,0,1]=3 180 B5R0.5 OC(=O)C(=O)O 1P00IL71 [0,0,0,0,0,0|2,0,1]=3 181 B5R0.5 OC(=O)C(=O)O 1P00ILQM [0,0,0,0,0,0|2,0,1]=3 182 B5R0.5 OC(=O)C(=O)O 1P01DLJI [0,0,0,0,0,0|2,0,1]=3 183 B5R0.5 OC(=O)C(=O)O 1P01DWOZ [0,0,0,0,0,0|2,0,1]=3 184 B5R0.5 OC(=O)C(=O)O 1P01EIQX [0,0,0,0,0,0|2,0,1]=3 185 B5R0.5 OC(=O)C(=O)O 1P01FLFT [0,0,0,0,0,0|2,0,1]=3 186 B5R0.5 OC(=O)C(=O)O 1P01XAIW [0,0,0,0,0,0|2,0,1]=3 187 B5R0.5 OC(=O)C(=O)O 1P028VBK [0,0,0,0,0,0|2,0,1]=3 188 B5R0.5 OC(=O)C(=O)[O-] 1P000X03 [0,0,0,0,0,0|2,0,1]=3 189 B5R0.5 OC(=O)C(=O)[O-] 1P003231 [0,0,0,0,0,0|2,0,1]=3 190 B5R0.5 OC(=O)C(Br)Cl 1P003P0Z [0,0,0,0,0,0|2,0,0]=2 191 B5R0.5 OC(=O)C(Br)F 1P00BY5B [0,0,0,0,0,0|2,0,0]=2 192 B5R0.5 OC(=O)C(Cl)F 1P00DD1L [0,0,0,0,0,0|2,0,0]=2 193 B5R0.5 OC(=O)C(O)C 1P00388A [0,0,0,0,0,0|1,0,0]=1 194 B5R0.5 OC(=O)C(O)C 1P003P5C [0,0,0,0,0,0|1,0,0]=1 195 B5R0.5 OC(=O)C(O)N 1P0070X0 [0,0,0,0,0,0|1,0,0]=1 196 B5R0.5 OC(=O)C(O)O 1P0037OI [0,0,0,0,0,0|2,0,0]=2 197 B5R0.5 OC(=O)[C@@H](O)C 1P003AT9 [0,0,0,0,0,0|1,0,0]=1 198 B5R0.5 OC(=O)[C@H](O)C 1P003PO7 [0,0,0,0,0,0|1,0,0]=1 199 B5R0.5 OC(C(Cl)Cl)O 1P001VWN [0,0,0,0,0,0|2,0,2]=4 200 B5R0.5 [O-]C(=O)C(=O)[O-] 1P00031C [0,0,0,0,0,0|2,0,2]=4 201 B5R0.5 [O-]C(=O)C(=O)[O-] 1P0011FV [0,0,0,0,0,0|2,0,2]=4 202 B5R0.5 [O-]C(=O)C(=O)[O-] 1P001KO1 [0,0,0,0,0,0|2,0,2]=4 203 B5R0.5 [O-]C(=O)C(=O)[O-] 1P001XGC [0,0,0,0,0,0|2,0,2]=4 204 B5R0.5 [O-]C(=O)C(=O)[O-] 1P002PYS [0,0,0,0,0,0|2,0,2]=4 205 B5R0.5 [O-]C(=O)C(=O)[O-] 1P0037M0 [0,0,0,0,0,0|2,0,2]=4 206 B5R0.5 [O-]C(=O)C(=O)[O-] 1P003948 [0,0,0,0,0,0|2,0,2]=4 207 B5R0.5 [O-]C(=O)C(=O)[O-] 1P0039MJ [0,0,0,0,0,0|2,0,2]=4 208 B5R0.5 [O-]C(=O)C(=O)[O-] 1P003A9Z [0,0,0,0,0,0|2,0,2]=4 209 B5R0.5 [O-]C(=O)C(=O)[O-] 1P003OBZ [0,0,0,0,0,0|2,0,2]=4 210 B5R0.5 [O-]C(=O)C(=O)[O-] 1P003P50 [0,0,0,0,0,0|2,0,2]=4 211 B5R0.5 [O-]C(=O)C(=O)[O-] 1P003PHX [0,0,0,0,0,0|2,0,2]=4 212 B5R0.5 [O-]C(=O)C(=O)[O-] 1P003ROH [0,0,0,0,0,0|2,0,2]=4 213 B5R0.5 [O-]C(=O)C(=O)[O-] 1P003TK4 [0,0,0,0,0,0|2,0,2]=4 214 B5R0.5 [O-]C(=O)C(=O)[O-] 1P003UDL [0,0,0,0,0,0|2,0,2]=4 215 B5R0.5 [O-]C(=O)C(=O)[O-] 1P003UWJ [0,0,0,0,0,0|2,0,2]=4 216 B5R0.5 [O-]C(=O)C(=O)[O-] 1P0052S0 [0,0,0,0,0,0|2,0,2]=4 217 B5R0.5 [O-]C(=O)C(=O)[O-] 1P006UZV [0,0,0,0,0,0|2,0,2]=4 218 B5R0.5 [O-]C(=O)C(=O)[O-] 1P007C28 [0,0,0,0,0,0|2,0,2]=4 219 B5R0.5 [O-]C(=O)C(=O)[O-] 1P008MSE [0,0,0,0,0,0|2,0,2]=4 220 B5R0.5 [O-]C(=O)C(=O)[O-] 1P00DMGT [0,0,0,0,0,0|2,0,2]=4 221 B5R0.5 [O-]C(=O)C(=O)[O-] 1P00E0U8 [0,0,0,0,0,0|2,0,2]=4 222 B5R0.5 [O-]C(=O)C(=O)[O-] 1P00I9OV [0,0,0,0,0,0|2,0,2]=4 223 B5R0.5 [O-]C(=O)C(=O)[O-] 1P00IB92 [0,0,0,0,0,0|2,0,2]=4 224 B5R0.5 [O-]C(=O)C(=O)[O-] 1P00IBCE [0,0,0,0,0,0|2,0,2]=4 225 B5R0.5 [O-]C(=O)C(=O)[O-] 1P01KKUY [0,0,0,0,0,0|2,0,2]=4 226 B5R0.5 [O-]C(=O)C(Cl)F 1P005VN8 [0,0,0,0,0,0|2,0,1]=3 227 B5R0.5 [O-]C(=O)C(O)C 1P005SQF [0,0,0,0,0,0|1,0,1]=2 228 B5R0.5 [O-]C(=O)C(O)C 1P0069SJ [0,0,0,0,0,0|1,0,1]=2 229 B5R0.5 [O-]C(=O)C(O)C 1P008FOG [0,0,0,0,0,0|1,0,1]=2 230 B5R0.5 [O-]C(=O)[C@@H](O)C 1P002VDW [0,0,0,0,0,0|1,0,1]=2 231 B5R0.5 [O-]C(=O)[C@@H](O)C 1P004KNK [0,0,0,0,0,0|1,0,1]=2 232 B5R0.5 [O-]C(=O)[C@@H](O)C 1P00IM0T [0,0,0,0,0,0|1,0,1]=2 233 B5R0.5 [O-]C(=O)[C@H](F)C 1P02809N [0,0,0,0,0,0|1,0,1]=2 234 B5R0.5 [O-]C(=O)[C@H](O)C 1P002VDV [0,0,0,0,0,0|1,0,1]=2 235 B5R0.5 [O-]C(=O)[C@H](O)C 1P003USZ [0,0,0,0,0,0|1,0,1]=2 236 B4R0.1 *CC(C)* 1P006XYD [1,0,0,0,0,0|2,0,1]=4 237 B4R0.1 *CC(O)* 1P003A56 [1,0,0,0,0,0|2,0,1]=4 238 B4R0.1 BrC(=C)C=O 1P001LZP [1,0,0,0,0,0|1,0,2]=4 239 B4R0.1 BrC(=C)CI 1P028XX9 [1,0,0,0,0,0|3,0,0]=4 240 B4R0.1 BrC=C(C)C 1P003367 [1,0,0,0,0,0|2,0,1]=4 241 B4R0.1 BrC=[N+](C)C 1P002PVD [1,0,0,0,0,0|3,0,0]=4 242 B4R0.1 BrCC(=C)Br 1P0033E7 [1,0,0,0,0,0|3,0,0]=4 243 B4R0.1 BrCC(=C)I 1P004W4Z [1,0,0,0,0,0|3,0,0]=4 244 B4R0.1 BrCC(=O)Br 1P003P0X [1,0,0,0,0,0|2,0,0]=3 245 B4R0.1 BrCC(Br)C 1P003DUK [1,0,0,0,0,0|2,0,1]=4 246 B4R0.1 BrCC(C)C 1P003366 [1,0,0,0,0,0|2,0,1]=4 247 B4R0.1 BrCN(=O)=O 1P003516 [1,0,0,0,0,0|2,0,1]=4 248 B4R0.1 Br[Mg]C(C)C 1P0035IZ [1,0,0,0,0,0|3,0,0]=4 249 B4R0.1 C=CC(=C)C 1P003RL1 [1,0,0,0,0,0|2,0,1]=4 250 B4R0.1 C=CC(=O)N 1P00E9WL [1,0,0,0,0,0|1,0,2]=4 251 B4R0.1 C=CC(=O)O 1P01FLHQ [1,0,0,0,0,0|0,0,2]=3 252 B4R0.1 C=CC(=O)O 1P01FLJA [1,0,0,0,0,0|0,0,2]=3 253 B4R0.1 C=CC(=O)[O-] 1P001EHX [1,0,0,0,0,0|0,0,3]=4 254 B4R0.1 C=CC(=O)[O-] 1P0027SQ [1,0,0,0,0,0|0,0,3]=4 255 B4R0.1 C=CC(=O)[O-] 1P002DEV [1,0,0,0,0,0|0,0,3]=4 256 B4R0.1 C=CC(=O)[O-] 1P003RV3 [1,0,0,0,0,0|0,0,3]=4 257 B4R0.1 CC(=C)C=O 1P0035LF [1,0,0,0,0,0|1,0,1]=3 258 B4R0.1 CC(=C)CBr 1P001DW1 [1,0,0,0,0,0|3,0,0]=4 259 B4R0.1 CC(=C)CCl 1P0037OP [1,0,0,0,0,0|3,0,0]=4 260 B4R0.1 CC(=C)CI 1P00CNG6 [1,0,0,0,0,0|3,0,0]=4 261 B4R0.1 CC(=C)CN 1P002WWW [1,0,0,0,0,0|2,0,0]=3 262 B4R0.1 CC(=C)CN 1P003I52 [1,0,0,0,0,0|2,0,0]=3 263 B4R0.1 CC(=N)NN 1P00BYO7 [1,0,0,0,0,0|3,0,0]=4 264 B4R0.1 CC(=NO)N 1P00DDO0 [1,0,0,0,0,0|1,0,1]=3 265 B4R0.1 CC(=NO)N 1P01EIQU [1,0,0,0,0,0|1,0,1]=3 266 B4R0.1 CC(=O)C#C 1P001IM3 [1,0,0,0,0,0|1,0,2]=4 267 B4R0.1 CC(=O)C#N 1P003UJX [1,0,0,0,0,0|1,0,2]=4 268 B4R0.1 CC(=O)CN 1P0034X5 [1,0,0,0,0,0|1,0,0]=2 269 B4R0.1 CC(=O)CO 1P000HWA [1,0,0,0,0,0|2,0,0]=3 270 B4R0.1 CC(=O)NBr 1P005BDP [1,0,0,0,0,0|3,0,0]=4 271 B4R0.1 CC(=O)NN 1P003O4C [1,0,0,0,0,0|2,0,0]=3 272 B4R0.1 CC(=O)NO 1P00394C [1,0,0,0,0,0|2,0,1]=4 273 B4R0.1 CC(=O)O[Rh] 1P003614 [1,0,0,0,0,0|3,0,0]=4 274 B4R0.1 CC(=S)NN 1P01GSMY [1,0,0,0,0,0|2,1,0]=4 275 B4R0.1 CC(C#C)Cl 1P002L47 [1,0,0,0,0,0|2,0,1]=4 276 B4R0.1 CC(C#C)N 1P0030F7 [1,0,0,0,0,0|1,0,1]=3 277 B4R0.1 CC(C#C)N 1P00BYZW [1,0,0,0,0,0|1,0,1]=3 278 B4R0.1 CC(C#C)O 1P0028WL [1,0,0,0,0,0|2,0,1]=4 279 B4R0.1 CC(C#N)Br 1P0033NK [1,0,0,0,0,0|2,0,1]=4 280 B4R0.1 CC(C#N)C 1P0038WA [1,0,0,0,0,0|2,0,1]=4 281 B4R0.1 CC(C#N)Cl 1P001WAB [1,0,0,0,0,0|2,0,1]=4 282 B4R0.1 CC(C#N)I 1P0085M8 [1,0,0,0,0,0|2,0,1]=4 283 B4R0.1 CC(C#N)N 1P003AP2 [1,0,0,0,0,0|1,0,1]=3 284 B4R0.1 CC(C=C)Cl 1P00343Y [1,0,0,0,0,0|2,0,0]=3 285 B4R0.1 CC(C=C)N 1P01A1MZ [1,0,0,0,0,0|1,0,0]=2 286 B4R0.1 CC(C=C)N 1P01AL0X [1,0,0,0,0,0|1,0,0]=2 287 B4R0.1 CC(C=C)O 1P003JM7 [1,0,0,0,0,0|2,0,0]=3 288 B4R0.1 CC(C=O)Br 1P002CQO [1,0,0,0,0,0|1,0,0]=2 289 B4R0.1 CC(C=O)Cl 1P006MCM [1,0,0,0,0,0|1,0,0]=2 290 B4R0.1 CC(CBr)N 1P01S4HF [1,0,0,0,0,0|1,0,1]=3 291 B4R0.1 CC(CBr)O 1P003EK9 [1,0,0,0,0,0|2,0,1]=4 292 B4R0.1 CC(CCl)Br 1P0037V7 [1,0,0,0,0,0|2,0,1]=4 293 B4R0.1 CC(CCl)N 1P01ACHD [1,0,0,0,0,0|1,0,1]=3 294 B4R0.1 CC(CCl)O 1P000WZ9 [1,0,0,0,0,0|2,0,1]=4 295 B4R0.1 CC(CF)I 1P028LP7 [1,0,0,0,0,0|2,0,1]=4 296 B4R0.1 CC(CF)N 1P01BBXX [1,0,0,0,0,0|1,0,1]=3 297 B4R0.1 CC(CF)O 1P00705J [1,0,0,0,0,0|2,0,1]=4 298 B4R0.1 CC(CI)F 1P0278ZD [1,0,0,0,0,0|2,0,1]=4 299 B4R0.1 CC(CI)N 1P0286IZ [1,0,0,0,0,0|1,0,1]=3 300 B4R0.1 CC(CI)O 1P01BFNN [1,0,0,0,0,0|2,0,1]=4 301 B4R0.1 CC(CN)Br 1P01DMAL [1,0,0,0,0,0|2,0,1]=4 302 B4R0.1 CC(CN)Cl 1P01B9EP [1,0,0,0,0,0|2,0,1]=4 303 B4R0.1 CC(CN)F 1P01EIGV [1,0,0,0,0,0|2,0,1]=4 304 B4R0.1 CC(CN)O 1P0039OT [1,0,0,0,0,0|1,0,1]=3 305 B4R0.1 CC(CN)O 1P003RL3 [1,0,0,0,0,0|1,0,1]=3 306 B4R0.1 CC(CN)S 1P00COSD [1,0,0,0,0,0|1,1,1]=4 307 B4R0.1 CC(CO)Br 1P00EKKP [1,0,0,0,0,0|1,0,1]=3 308 B4R0.1 CC(CO)Cl 1P005PDW [1,0,0,0,0,0|1,0,1]=3 309 B4R0.1 CC(CO)F 1P00C1AE [1,0,0,0,0,0|1,0,1]=3 310 B4R0.1 CC(CO)N 1P003Q9X [1,0,0,0,0,0|0,0,1]=2 311 B4R0.1 CC(CO)S 1P00C5FE [1,0,0,0,0,0|1,0,1]=3 312 B4R0.1 CC(CS)N 1P01A3A6 [1,0,0,0,0,0|0,1,1]=3 313 B4R0.1 CC(CS)O 1P003EX2 [1,0,0,0,0,0|1,1,1]=4 314 B4R0.1 CC([N+]#[C-])C 1P003RLN [1,0,0,0,0,0|3,0,0]=4 315 B4R0.1 CC=C(Br)C 1P0011W9 [1,0,0,0,0,0|2,0,1]=4 316 B4R0.1 CC=C(C)C 1P003I2C [1,0,0,0,0,0|2,0,1]=4 317 B4R0.1 CCB(O)O 1P003QYO [1,0,0,0,0,0|1,0,1]=3 318 B4R0.1 CCC(=N)N 1P00BYO6 [1,0,0,0,0,0|2,0,0]=3 319 B4R0.1 CCC(=N)N 1P00I7LL [1,0,0,0,0,0|2,0,0]=3 320 B4R0.1 CCC(=O)Cl 1P003UG7 [1,0,0,0,0,0|1,0,0]=2 321 B4R0.1 CCC(=O)N 1P003UG1 [1,0,0,0,0,0|1,0,0]=2 322 B4R0.1 CCC(=O)O 1P0035ZO [1,0,0,0,0,0|0,0,0]=1 323 B4R0.1 CCC(=O)[O-] 1P003P52 [1,0,0,0,0,0|0,0,1]=2 324 B4R0.1 CCC(=O)[O-] 1P003VUU [1,0,0,0,0,0|0,0,1]=2 325 B4R0.1 CCC(=S)N 1P00365Q [1,0,0,0,0,0|1,1,0]=3 326 B4R0.1 CCC(=S)O 1P002IJ9 [1,0,0,0,0,0|0,1,0]=2 327 B4R0.1 CCC(Br)C 1P0033MU [1,0,0,0,0,0|2,0,1]=4 328 B4R0.1 CCC(C)[O-] 1P003OA3 [1,0,0,0,0,0|1,0,2]=4 329 B4R0.1 CCC(Cl)C 1P003HIL [1,0,0,0,0,0|2,0,1]=4 330 B4R0.1 CCC(Cl)Cl 1P003DOZ [1,0,0,0,0,0|2,0,1]=4 331 B4R0.1 CCC(I)C 1P003UOW [1,0,0,0,0,0|2,0,1]=4 332 B4R0.1 CCC(N)C 1P001BNN [1,0,0,0,0,0|1,0,1]=3 333 B4R0.1 CCC(O)C 1P003H9W [1,0,0,0,0,0|1,0,1]=3 334 B4R0.1 CCC(O)O 1P002SZH [1,0,0,0,0,0|0,0,2]=3 335 B4R0.1 CCC(S)C 1P003H9V [1,0,0,0,0,0|1,1,1]=4 336 B4R0.1 CCC([Mg+])C 1P003UP2 [1,0,0,0,0,0|2,0,1]=4 337 B4R0.1 CCC([NH3+])C 1P00I9XG [1,0,0,0,0,0|1,0,2]=4 338 B4R0.1 CCN(N)C 1P01BBPA [1,0,0,0,0,0|2,0,1]=4 339 B4R0.1 CCP(=O)C 1P027S1I [1,0,0,0,0,0|2,0,0]=3 340 B4R0.1 CCS(=O)Cl 1P01BF60 [1,0,0,0,0,0|2,0,0]=3 341 B4R0.1 CCS(=O)N 1P01BFNU [1,0,0,0,0,0|2,0,0]=3 342 B4R0.1 CC[C@@H](N)C 1P0032WO [1,0,0,0,0,0|1,0,1]=3 343 B4R0.1 CC[C@@H](N)C 1P00I6FG [1,0,0,0,0,0|1,0,1]=3 344 B4R0.1 CC[C@@H](O)C 1P003CX5 [1,0,0,0,0,0|1,0,1]=3 345 B4R0.1 CC[C@H](N)C 1P00118A [1,0,0,0,0,0|1,0,1]=3 346 B4R0.1 CC[C@H](N)C 1P00I6FH [1,0,0,0,0,0|1,0,1]=3 347 B4R0.1 CC[C@H](O)C 1P001LSA [1,0,0,0,0,0|1,0,1]=3 348 B4R0.1 CC[SiH](C)C 1P008POW [1,0,0,0,0,0|2,1,0]=4 349 B4R0.1 CN(C=O)N 1P00G5EA [1,0,0,0,0,0|1,0,0]=2 350 B4R0.1 CN=C(N)C 1P01BBXW [1,0,0,0,0,0|2,0,1]=4 351 B4R0.1 CN=C(N)N 1P00BC71 [1,0,0,0,0,0|3,0,0]=4 352 B4R0.1 CNC(=N)N 1P00339W [1,0,0,0,0,0|3,0,0]=4 353 B4R0.1 CNC(=O)C 1P0035SQ [1,0,0,0,0,0|2,0,0]=3 354 B4R0.1 CNC(=O)Cl 1P00IBUF [1,0,0,0,0,0|2,0,0]=3 355 B4R0.1 CNC(=O)N 1P0035QD [1,0,0,0,0,0|2,0,0]=3 356 B4R0.1 CNC(=S)N 1P003TPB [1,0,0,0,0,0|2,1,0]=4 357 B4R0.1 COC(=C)C 1P000HW9 [1,0,0,0,0,0|3,0,0]=4 358 B4R0.1 COC(=N)C 1P001FNK [1,0,0,0,0,0|3,0,0]=4 359 B4R0.1 COC(=N)N 1P00DENI [1,0,0,0,0,0|3,0,0]=4 360 B4R0.1 COC(=O)C 1P0053LN [1,0,0,0,0,0|2,0,0]=3 361 B4R0.1 COC(=O)N 1P003SGG [1,0,0,0,0,0|2,0,0]=3 362 B4R0.1 COC(=S)N 1P005ROA [1,0,0,0,0,0|2,1,0]=4 363 B4R0.1 COC(Cl)C 1P00JO5S [1,0,0,0,0,0|3,0,0]=4 364 B4R0.1 COS(=O)C 1P00H8DU [1,0,0,0,0,0|3,0,0]=4 365 B4R0.1 CSC(=N)N 1P00361U [1,0,0,0,0,0|3,0,0]=4 366 B4R0.1 CSC(=N)N 1P00DA51 [1,0,0,0,0,0|3,0,0]=4 367 B4R0.1 CSC(=O)C 1P003UQP [1,0,0,0,0,0|2,0,0]=3 368 B4R0.1 CSC(=O)N 1P01PZH2 [1,0,0,0,0,0|2,0,0]=3 369 B4R0.1 CSC(=S)C 1P00BVKS [1,0,0,0,0,0|2,1,0]=4 370 B4R0.1 CSC(=S)N 1P0292HS [1,0,0,0,0,0|2,1,0]=4 371 B4R0.1 CSC(Cl)C 1P028L6G [1,0,0,0,0,0|3,0,0]=4 372 B4R0.1 C[C@@H](C#C)N 1P001GYG [1,0,0,0,0,0|1,0,1]=3 373 B4R0.1 C[C@@H](C#C)O 1P002XXJ [1,0,0,0,0,0|2,0,1]=4 374 B4R0.1 C[C@@H](C=C)N 1P00AO6Z [1,0,0,0,0,0|1,0,0]=2 375 B4R0.1 C[C@@H](C=C)N 1P024UN5 [1,0,0,0,0,0|1,0,0]=2 376 B4R0.1 C[C@@H](CCl)O 1P00I7UO [1,0,0,0,0,0|2,0,1]=4 377 B4R0.1 C[C@@H](CF)N 1P019Z53 [1,0,0,0,0,0|1,0,1]=3 378 B4R0.1 C[C@@H](CN)O 1P003CWC [1,0,0,0,0,0|1,0,1]=3 379 B4R0.1 C[C@@H](CN)S 1P028700 [1,0,0,0,0,0|1,1,1]=4 380 B4R0.1 C[C@@H](CO)Cl 1P002G3X [1,0,0,0,0,0|1,0,1]=3 381 B4R0.1 C[C@@H](CO)F 1P00IF81 [1,0,0,0,0,0|1,0,1]=3 382 B4R0.1 C[C@@H](CO)N 1P0035JO [1,0,0,0,0,0|0,0,1]=2 383 B4R0.1 C[C@@H](CS)N 1P01DVGH [1,0,0,0,0,0|0,1,1]=3 384 B4R0.1 C[C@@H](CS)O 1P01BUOA [1,0,0,0,0,0|1,1,1]=4 385 B4R0.1 C[C@H](C#C)N 1P00H3GB [1,0,0,0,0,0|1,0,1]=3 386 B4R0.1 C[C@H](C#C)O 1P003CM6 [1,0,0,0,0,0|2,0,1]=4 387 B4R0.1 C[C@H](C#N)N 1P01A3JV [1,0,0,0,0,0|1,0,1]=3 388 B4R0.1 C[C@H](C=C)N 1P01EMC7 [1,0,0,0,0,0|1,0,0]=2 389 B4R0.1 C[C@H](C=C)O 1P00CLJ5 [1,0,0,0,0,0|2,0,0]=3 390 B4R0.1 C[C@H](CBr)O 1P00090L [1,0,0,0,0,0|2,0,1]=4 391 B4R0.1 C[C@H](CCl)O 1P002FO6 [1,0,0,0,0,0|2,0,1]=4 392 B4R0.1 C[C@H](CF)N 1P00IMQL [1,0,0,0,0,0|1,0,1]=3 393 B4R0.1 C[C@H](CN)F 1P027VQ9 [1,0,0,0,0,0|2,0,1]=4 394 B4R0.1 C[C@H](CN)O 1P003CIX [1,0,0,0,0,0|1,0,1]=3 395 B4R0.1 C[C@H](CN)S 1P028MOY [1,0,0,0,0,0|1,1,1]=4 396 B4R0.1 C[C@H](CO)Cl 1P00BXSZ [1,0,0,0,0,0|1,0,1]=3 397 B4R0.1 C[C@H](CO)F 1P004OGA [1,0,0,0,0,0|1,0,1]=3 398 B4R0.1 C[C@H](CO)N 1P00355B [1,0,0,0,0,0|0,0,1]=2 399 B4R0.1 C[C@H](CO)S 1P02820Z [1,0,0,0,0,0|1,0,1]=3 400 B4R0.1 C[C@H](CS)N 1P01DVGI [1,0,0,0,0,0|0,1,1]=3 401 B4R0.1 C[C@H](CS)O 1P01BUO6 [1,0,0,0,0,0|1,1,1]=4 402 B4R0.1 C\C(=N/O)\N 1P01FT21 [1,0,0,0,0,0|1,0,1]=3 403 B4R0.1 C\C(=N\O)\N 1P007QF8 [1,0,0,0,0,0|1,0,1]=3 404 B4R0.1 C\C=C(/Br)\C 1P003D6B [1,0,0,0,0,0|2,0,1]=4 405 B4R0.1 ClC(=C)CBr 1P01B61X [1,0,0,0,0,0|3,0,0]=4 406 B4R0.1 ClC(=C)CI 1P01C9T0 [1,0,0,0,0,0|3,0,0]=4 407 B4R0.1 ClC(=O)CBr 1P003P0Y [1,0,0,0,0,0|2,0,0]=3 408 B4R0.1 ClC=C(C)C 1P003EOC [1,0,0,0,0,0|2,0,1]=4 409 B4R0.1 ClC=[N+](C)C 1P0032TX [1,0,0,0,0,0|3,0,0]=4 410 B4R0.1 ClCC(=C)Cl 1P00GPPU [1,0,0,0,0,0|3,0,0]=4 411 B4R0.1 ClCC(C)C 1P0036A5 [1,0,0,0,0,0|2,0,1]=4 412 B4R0.1 ClCC(Cl)C 1P003DUW [1,0,0,0,0,0|2,0,1]=4 413 B4R0.1 ClSC(=O)Cl 1P002UKK [1,0,0,0,0,0|3,0,0]=4 414 B4R0.1 FC(=C)CBr 1P00I7HP [1,0,0,0,0,0|3,0,0]=4 415 B4R0.1 FC(=C)CCl 1P00IBE6 [1,0,0,0,0,0|3,0,0]=4 416 B4R0.1 FC(=C)CI 1P0281SZ [1,0,0,0,0,0|3,0,0]=4 417 B4R0.1 FCC(=C)Br 1P028P9P [1,0,0,0,0,0|3,0,0]=4 418 B4R0.1 ICC(C)C 1P003RJE [1,0,0,0,0,0|2,0,1]=4 419 B4R0.1 NC(=N)CCl 1P003P9P [1,0,0,0,0,0|3,0,0]=4 420 B4R0.1 NC(=N)CCl 1P00BFLZ [1,0,0,0,0,0|3,0,0]=4 421 B4R0.1 NC(=N)CF 1P00J2CQ [1,0,0,0,0,0|3,0,0]=4 422 B4R0.1 NC(=N)CO 1P003A09 [1,0,0,0,0,0|1,0,2]=4 423 B4R0.1 NC(=N)CO 1P00DJH7 [1,0,0,0,0,0|1,0,2]=4 424 B4R0.1 NC(=O)C#C 1P0035ZN [1,0,0,0,0,0|1,0,2]=4 425 B4R0.1 NC(=O)C=C 1P0034W9 [1,0,0,0,0,0|1,0,2]=4 426 B4R0.1 NC(=O)CBr 1P0033MO [1,0,0,0,0,0|2,0,0]=3 427 B4R0.1 NC(=O)CCl 1P003HHZ [1,0,0,0,0,0|2,0,0]=3 428 B4R0.1 NC(=O)CF 1P00JTCL [1,0,0,0,0,0|2,0,0]=3 429 B4R0.1 NC(=O)CI 1P001J7S [1,0,0,0,0,0|2,0,0]=3 430 B4R0.1 NC(=O)CO 1P003HVT [1,0,0,0,0,0|2,0,0]=3 431 B4R0.1 NC(=O)CS 1P005IT7 [1,0,0,0,0,0|2,0,0]=3 432 B4R0.1 NC(=O)NO 1P000WZ7 [1,0,0,0,0,0|2,0,1]=4 433 B4R0.1 NC(=S)CF 1P00IDTZ [1,0,0,0,0,0|2,1,0]=4 434 B4R0.1 NC(=S)CO 1P019U8H [1,0,0,0,0,0|1,0,2]=4 435 B4R0.1 NC(=[NH2+])CS 1P00755V [1,0,0,0,0,0|3,0,0]=4 436 B4R0.1 NCC(=C)Br 1P00ICEF [1,0,0,0,0,0|2,0,0]=3 437 B4R0.1 NCC(=C)Cl 1P0002P5 [1,0,0,0,0,0|2,0,0]=3 438 B4R0.1 NCC(=C)F 1P01X2H7 [1,0,0,0,0,0|2,0,0]=3 439 B4R0.1 NCC(=N)N 1P003GZP [1,0,0,0,0,0|2,0,0]=3 440 B4R0.1 NCC(=N)N 1P027RGW [1,0,0,0,0,0|2,0,0]=3 441 B4R0.1 NCC(=O)N 1P001XFF [1,0,0,0,0,0|1,0,0]=2 442 B4R0.1 NCC(=O)N 1P007FBC [1,0,0,0,0,0|1,0,0]=2 443 B4R0.1 NCC(=O)N 1P00E9KZ [1,0,0,0,0,0|1,0,0]=2 444 B4R0.1 NCC(=O)O 1P0035FO [1,0,0,0,0,0|0,0,0]=1 445 B4R0.1 NCC(=O)O 1P00392S [1,0,0,0,0,0|0,0,0]=1 446 B4R0.1 NCC(=O)O 1P003GZQ [1,0,0,0,0,0|0,0,0]=1 447 B4R0.1 NCC(=O)O 1P003R91 [1,0,0,0,0,0|0,0,0]=1 448 B4R0.1 NCC(=O)[O-] 1P001FPG [1,0,0,0,0,0|0,0,1]=2 449 B4R0.1 NCC(=O)[O-] 1P003VUO [1,0,0,0,0,0|0,0,1]=2 450 B4R0.1 NCC(=O)[O-] 1P007GEQ [1,0,0,0,0,0|0,0,1]=2 451 B4R0.1 NCC(=O)[O-] 1P01CD7L [1,0,0,0,0,0|0,0,1]=2 452 B4R0.1 NCC(=S)N 1P01A4KW [1,0,0,0,0,0|1,1,0]=3 453 B4R0.1 NCC(Br)Br 1P027VS0 [1,0,0,0,0,0|2,0,1]=4 454 B4R0.1 NCC(Br)F 1P027W07 [1,0,0,0,0,0|2,0,1]=4 455 B4R0.1 NCC(C)C 1P003RJP [1,0,0,0,0,0|2,0,1]=4 456 B4R0.1 NCC(C)C 1P003RJQ [1,0,0,0,0,0|2,0,1]=4 457 B4R0.1 NCC(C)C 1P00C4UX [1,0,0,0,0,0|2,0,1]=4 458 B4R0.1 NCC(C)C 1P00ICXR [1,0,0,0,0,0|2,0,1]=4 459 B4R0.1 NCC(Cl)Cl 1P01BBHV [1,0,0,0,0,0|2,0,1]=4 460 B4R0.1 NCC(Cl)F 1P0291M5 [1,0,0,0,0,0|2,0,1]=4 461 B4R0.1 NCC(F)F 1P008M4M [1,0,0,0,0,0|2,0,1]=4 462 B4R0.1 NCC(N)C 1P003318 [1,0,0,0,0,0|1,0,1]=3 463 B4R0.1 NC[C@@H](N)C 1P002BGH [1,0,0,0,0,0|1,0,1]=3 464 B4R0.1 NC[C@H](N)C 1P002BHK [1,0,0,0,0,0|1,0,1]=3 465 B4R0.1 NN=C(C)C 1P00DMU1 [1,0,0,0,0,0|3,0,0]=4 466 B4R0.1 NN=C(N)N 1P00IKUL [1,0,0,0,0,0|3,0,0]=4 467 B4R0.1 NNC(=N)N 1P001SW7 [1,0,0,0,0,0|3,0,0]=4 468 B4R0.1 NNC(=N)N 1P0039BN [1,0,0,0,0,0|3,0,0]=4 469 B4R0.1 NNC(=N)N 1P003OAO [1,0,0,0,0,0|3,0,0]=4 470 B4R0.1 NNC(=O)N 1P00361L [1,0,0,0,0,0|2,0,0]=3 471 B4R0.1 NNC(=O)N 1P0037II [1,0,0,0,0,0|2,0,0]=3 472 B4R0.1 NNC(=S)C 1P028L1B [1,0,0,0,0,0|2,1,0]=4 473 B4R0.1 NNC(=S)N 1P00365S [1,0,0,0,0,0|2,1,0]=4 474 B4R0.1 NNC(C)C 1P0035IX [1,0,0,0,0,0|3,0,0]=4 475 B4R0.1 NOC(C)C 1P00396P [1,0,0,0,0,0|3,0,0]=4 476 B4R0.1 N[13CH2]C(=O)O 1P00C26O [1,0,0,0,0,0|0,0,0]=1 477 B4R0.1 N[13C](=O)[13CH]=[13CH2] 1P00C2PS [1,0,0,0,0,0|1,0,2]=4 478 B4R0.1 O=CC(=O)C 1P00360Q [1,0,0,0,0,0|1,0,1]=3 479 B4R0.1 O=CC(=O)O 1P0035FV [1,0,0,0,0,0|1,0,1]=3 480 B4R0.1 O=CC(=O)O 1P009AKD [1,0,0,0,0,0|1,0,1]=3 481 B4R0.1 O=CC(=O)[O-] 1P003UT9 [1,0,0,0,0,0|1,0,2]=4 482 B4R0.1 O=CC(C)C 1P0035IE [1,0,0,0,0,0|1,0,0]=2 483 B4R0.1 OC(=O)C#C 1P003UFX [1,0,0,0,0,0|0,0,2]=3 484 B4R0.1 OC(=O)C=C 1P0036OH [1,0,0,0,0,0|0,0,2]=3 485 B4R0.1 OC(=O)C=C 1P01O7IB [1,0,0,0,0,0|0,0,2]=3 486 B4R0.1 OC(=O)CBr 1P003511 [1,0,0,0,0,0|1,0,0]=2 487 B4R0.1 OC(=O)CCl 1P003B9S [1,0,0,0,0,0|1,0,0]=2 488 B4R0.1 OC(=O)CI 1P003RH9 [1,0,0,0,0,0|1,0,0]=2 489 B4R0.1 OC(=O)CS 1P0039SY [1,0,0,0,0,0|1,0,0]=2 490 B4R0.1 OC(=O)CS 1P003P58 [1,0,0,0,0,0|1,0,0]=2 491 B4R0.1 OCC(=C)Br 1P0032Q5 [1,0,0,0,0,0|3,0,0]=4 492 B4R0.1 OCC(=C)Cl 1P003HBH [1,0,0,0,0,0|3,0,0]=4 493 B4R0.1 OCC(=C)F 1P00EW6X [1,0,0,0,0,0|3,0,0]=4 494 B4R0.1 OCC(=C)I 1P004YYW [1,0,0,0,0,0|3,0,0]=4 495 B4R0.1 OCC(=O)O 1P002RQ6 [1,0,0,0,0,0|1,0,0]=2 496 B4R0.1 OCC(=O)O 1P005YTG [1,0,0,0,0,0|1,0,0]=2 497 B4R0.1 OCC(=O)O 1P00BZ1F [1,0,0,0,0,0|1,0,0]=2 498 B4R0.1 OCC(=O)[O-] 1P002SYD [1,0,0,0,0,0|1,0,1]=3 499 B4R0.1 OCC(Br)Br 1P008JTC [1,0,0,0,0,0|2,0,1]=4 500 B4R0.1 OCC(Br)F 1P0037N0 [1,0,0,0,0,0|2,0,1]=4 501 B4R0.1 OCC(C)C 1P0035IA [1,0,0,0,0,0|1,0,1]=3 502 B4R0.1 OCC(Cl)Cl 1P003FR9 [1,0,0,0,0,0|2,0,1]=4 503 B4R0.1 OCC(Cl)F 1P001AAA [1,0,0,0,0,0|2,0,1]=4 504 B4R0.1 OCC(F)F 1P0033DK [1,0,0,0,0,0|2,0,1]=4 505 B4R0.1 OCC(O)C 1P00331M [1,0,0,0,0,0|1,0,1]=3 506 B4R0.1 OCC(O)C 1P006EY7 [1,0,0,0,0,0|1,0,1]=3 507 B4R0.1 OCC(O)C 1P00GT0R [1,0,0,0,0,0|1,0,1]=3 508 B4R0.1 OC[C@@H](O)C 1P0032WJ [1,0,0,0,0,0|1,0,1]=3 509 B4R0.1 OC[C@H](O)C 1P0032U3 [1,0,0,0,0,0|1,0,1]=3 510 B4R0.1 ON=C(C)C 1P000WZ8 [1,0,0,0,0,0|2,0,1]=4 511 B4R0.1 ON=C(N)N 1P00JECT [1,0,0,0,0,0|2,0,1]=4 512 B4R0.1 ONC(C)C 1P00DES9 [1,0,0,0,0,0|2,0,0]=3 513 B4R0.1 ONC(C)C 1P00DF6Q [1,0,0,0,0,0|2,0,0]=3 514 B4R0.1 OOC(=O)[O-] 1P007UDG [1,0,0,0,0,0|2,0,1]=4 515 B4R0.1 PCC(C)C 1P0074H8 [1,0,0,0,0,0|2,0,1]=4 516 B4R0.1 S=CN(C)C 1P003T2D [1,0,0,0,0,0|2,1,0]=4 517 B4R0.1 SCC(=C)Br 1P027YII [1,0,0,0,0,0|3,0,0]=4 518 B4R0.1 SCC(=C)Cl 1P007SWN [1,0,0,0,0,0|3,0,0]=4 519 B4R0.1 SCC(=O)O 1P000KEI [1,0,0,0,0,0|1,0,0]=2 520 B4R0.1 SCC(=O)O 1P000R53 [1,0,0,0,0,0|1,0,0]=2 521 B4R0.1 SCC(=O)[O-] 1P01DNXZ [1,0,0,0,0,0|1,0,1]=3 522 B4R0.1 SCC(C)C 1P003RJW [1,0,0,0,0,0|1,1,1]=4 523 B4R0.1 [15NH2]CC(=O)O 1P00FCSE [1,0,0,0,0,0|0,0,0]=1 524 B4R0.1 [15NH2][13CH2][13C](=O)O 1P00C26A [1,0,0,0,0,0|0,0,0]=1 525 B4R0.1 [O-]C(=O)C#C 1P00GY5Z [1,0,0,0,0,0|0,0,3]=4 526 B4R0.1 [O-]C(=O)C=C 1P0006FB [1,0,0,0,0,0|0,0,3]=4 527 B4R0.1 [O-]C(=O)C=C 1P0011HV [1,0,0,0,0,0|0,0,3]=4 528 B4R0.1 [O-]C(=O)C=C 1P00ICZK [1,0,0,0,0,0|0,0,3]=4 529 B4R0.1 [O-]C(=O)CBr 1P003USJ [1,0,0,0,0,0|1,0,1]=3 530 B4R0.1 [O-]C(=O)CC 1P001350 [1,0,0,0,0,0|0,0,1]=2 531 B4R0.1 [O-]C(=O)CC 1P0035ZP [1,0,0,0,0,0|0,0,1]=2 532 B4R0.1 [O-]C(=O)CCl 1P003625 [1,0,0,0,0,0|1,0,1]=3 533 B4R0.1 [O-]C(=O)CI 1P0030UG [1,0,0,0,0,0|1,0,1]=3 534 B4R0.1 [O-]C(=O)CN 1P002JEZ [1,0,0,0,0,0|0,0,1]=2 535 B4R0.1 [O-]C(=O)CO 1P00BC47 [1,0,0,0,0,0|1,0,1]=3 536 B4R0.1 [O-]C(=O)CS 1P003OCD [1,0,0,0,0,0|1,0,1]=3 537 B4R0.1 [O-]C(=O)CS 1P0078SY [1,0,0,0,0,0|1,0,1]=3 538 B4R0.1 [O-]C(=O)[O-][Ni+2] 1P01XCWZ [1,0,0,0,0,0|2,0,1]=4 539 B4R0.1 [O-]CC(C)C 1P003V60 [1,0,0,0,0,0|1,0,2]=4 540 B4R0.1 [O-]CS(=O)O 1P005AEE [1,0,0,0,0,0|2,0,0]=3 541 B4R0.1 [O-]P(=O)OC 1P028RM0 [1,0,0,0,0,0|2,0,1]=4 542 B4R0.1 [O-]S(=O)CC 1P002D65 [1,0,0,0,0,0|1,0,1]=3 543 B4R0.1 [O-]S(=O)CO 1P00362A [1,0,0,0,0,0|2,0,1]=4 544 B4R0.1 [O-]S(=O)CO 1P00E91X [1,0,0,0,0,0|2,0,1]=4 545 B6R0.3 *C(C(=O)N)C* 1P00IM2A [0,1,0,0,0,0|2,0,0]=3 546 B6R0.3 *C(C(=O)O)C* 1P00IGFS [0,1,0,0,0,0|1,0,0]=2 547 B6R0.3 BrCC(=O)C(Br)C 1P0059GU [0,1,0,0,0,0|2,0,0]=3 548 B6R0.3 BrCC(=O)C(C)C 1P002CQP [0,1,0,0,0,0|2,0,0]=3 549 B6R0.3 BrCC(=O)C(F)F 1P01B923 [0,1,0,0,0,0|3,0,0]=4 550 B6R0.3 BrCC(=O)N(C)C 1P0037QR [0,1,0,0,0,0|3,0,0]=4 551 B6R0.3 BrCC(C(C)C)N 1P0286OE [0,1,0,0,0,0|2,0,1]=4 552 B6R0.3 BrCC(C(C)C)O 1P00AENS [0,1,0,0,0,0|2,0,1]=4 553 B6R0.3 C=CC(=O)C(C)C 1P001SJ3 [0,1,0,0,0,0|2,0,0]=3 554 B6R0.3 C=CC(=O)N(C)C 1P003T1H [0,1,0,0,0,0|3,0,0]=4 555 B6R0.3 C=CC(C(C)C)O 1P00DBHA [0,1,0,0,0,0|2,0,1]=4 556 B6R0.3 CC(=C)C(=NO)N 1P01BVAM [0,1,0,0,0,0|2,0,1]=4 557 B6R0.3 CC(=C)C(CO)Br 1P01A2R0 [0,1,0,0,0,0|3,0,0]=4 558 B6R0.3 CC(=C)[C@@H](CO)N 1P027TTE [0,1,0,0,0,0|2,0,0]=3 559 B6R0.3 CC(=CC)C(=O)O 1P0010JQ [0,1,0,0,0,0|1,0,1]=3 560 B6R0.3 CC(=O)C(=O)CBr 1P00DFOD [0,1,0,0,0,0|2,0,1]=4 561 B6R0.3 CC(=O)C(=O)CCl 1P00DLOO [0,1,0,0,0,0|2,0,1]=4 562 B6R0.3 CC(=O)C(CO)O 1P01DWYU [0,1,0,0,0,0|2,0,0]=3 563 B6R0.3 CC(C(=C)C#N)C 1P007LPI [0,1,0,0,0,0|3,0,0]=4 564 B6R0.3 CC(C(=C)C)CBr 1P01IN35 [0,1,0,0,0,0|3,0,0]=4 565 B6R0.3 CC(C(=C)C)CO 1P01BSQ5 [0,1,0,0,0,0|3,0,0]=4 566 B6R0.3 CC(C(=N)N)CC 1P019XUO [0,1,0,0,0,0|3,0,0]=4 567 B6R0.3 CC(C(=N)N)OC 1P019Z90 [0,1,0,0,0,0|3,0,0]=4 568 B6R0.3 CC(C(=N)N)SC 1P0286CT [0,1,0,0,0,0|3,0,0]=4 569 B6R0.3 CC(C(=NN)N)C 1P027V3Z [0,1,0,0,0,0|3,0,0]=4 570 B6R0.3 CC(C(=O)C)C#N 1P00DEQK [0,1,0,0,0,0|1,0,1]=3 571 B6R0.3 CC(C(=O)C)CO 1P003LYQ [0,1,0,0,0,0|2,0,0]=3 572 B6R0.3 CC(C(=O)CCl)N 1P01C1VM [0,1,0,0,0,0|1,0,0]=2 573 B6R0.3 CC(C(=O)N)C#N 1P005SOR [0,1,0,0,0,0|1,0,1]=3 574 B6R0.3 CC(C(=O)N)CC 1P0082Z0 [0,1,0,0,0,0|2,0,0]=3 575 B6R0.3 CC(C(=O)N)NC 1P00C8TM [0,1,0,0,0,0|1,0,0]=2 576 B6R0.3 CC(C(=O)N)NC 1P01A4VK [0,1,0,0,0,0|1,0,0]=2 577 B6R0.3 CC(C(=O)N)OC 1P01AKMI [0,1,0,0,0,0|2,0,0]=3 578 B6R0.3 CC(C(=O)N)SC 1P028ALZ [0,1,0,0,0,0|2,0,0]=3 579 B6R0.3 CC(C(=O)NN)O 1P002TZE [0,1,0,0,0,0|2,0,0]=3 580 B6R0.3 CC(C(=O)NN)S 1P0286RQ [0,1,0,0,0,0|2,0,0]=3 581 B6R0.3 CC(C(=O)O)C#N 1P00EBJM [0,1,0,0,0,0|0,0,1]=2 582 B6R0.3 CC(C(=O)O)C=C 1P00DA69 [0,1,0,0,0,0|1,0,0]=2 583 B6R0.3 CC(C(=O)O)CBr 1P00342O [0,1,0,0,0,0|1,0,0]=2 584 B6R0.3 CC(C(=O)O)CC 1P000BT8 [0,1,0,0,0,0|1,0,0]=2 585 B6R0.3 CC(C(=O)O)CF 1P01B7CT [0,1,0,0,0,0|1,0,0]=2 586 B6R0.3 CC(C(=O)O)CN 1P001J7M [0,1,0,0,0,0|0,0,0]=1 587 B6R0.3 CC(C(=O)O)CN 1P00381Y [0,1,0,0,0,0|0,0,0]=1 588 B6R0.3 CC(C(=O)O)CN 1P00C2SB [0,1,0,0,0,0|0,0,0]=1 589 B6R0.3 CC(C(=O)O)CS 1P002TTJ [0,1,0,0,0,0|1,0,0]=2 590 B6R0.3 CC(C(=O)O)NC 1P003BEG [0,1,0,0,0,0|0,0,0]=1 591 B6R0.3 CC(C(=O)O)NC 1P00CLMV [0,1,0,0,0,0|0,0,0]=1 592 B6R0.3 CC(C(=O)O)OC 1P0037PR [0,1,0,0,0,0|1,0,0]=2 593 B6R0.3 CC(C(=O)O)ON 1P003AZJ [0,1,0,0,0,0|0,0,0]=1 594 B6R0.3 CC(C(=O)O)SC 1P00EEEC [0,1,0,0,0,0|1,0,0]=2 595 B6R0.3 CC(C(=S)N)CC 1P01AD68 [0,1,0,0,0,0|2,1,0]=4 596 B6R0.3 CC(C(=S)N)OC 1P019YTS [0,1,0,0,0,0|2,1,0]=4 597 B6R0.3 CC(C(CN)O)F 1P028GWI [0,1,0,0,0,0|2,0,1]=4 598 B6R0.3 CC(C(CN)O)O 1P01BSAX [0,1,0,0,0,0|2,0,1]=4 599 B6R0.3 CC(C(CO)O)N 1P01B7GK [0,1,0,0,0,0|0,0,2]=3 600 B6R0.3 CC(C(N)C)CO 1P01AKSV [0,1,0,0,0,0|1,0,1]=3 601 B6R0.3 CC(C(O)C)CN 1P01BN8Y [0,1,0,0,0,0|1,0,1]=3 602 B6R0.3 CC(C(S)C)CO 1P00347B [0,1,0,0,0,0|2,0,1]=4 603 B6R0.3 CC(N(N)C)CO 1P01C4O6 [0,1,0,0,0,0|2,0,1]=4 604 B6R0.3 CC(N(N=O)C)C 1P00BX3Z [0,1,0,0,0,0|3,0,0]=4 605 B6R0.3 CC(S(=O)C)CN 1P01A2LM [0,1,0,0,0,0|2,0,0]=3 606 B6R0.3 CC(S(=O)Cl)CC 1P01C8L7 [0,1,0,0,0,0|3,0,0]=4 607 B6R0.3 CC(\C(=N\O)\N)C 1P004QVA [0,1,0,0,0,0|2,0,0]=3 608 B6R0.3 CC=C(C(=O)C)C 1P00EA6O [0,1,0,0,0,0|2,0,1]=4 609 B6R0.3 CC=C(C(=O)O)Cl 1P01HMWU [0,1,0,0,0,0|1,0,1]=3 610 B6R0.3 CCC(=C)C(=O)Cl 1P0073CG [0,1,0,0,0,0|2,0,1]=4 611 B6R0.3 CCC(=C)C(=O)O 1P00CJ69 [0,1,0,0,0,0|1,0,1]=3 612 B6R0.3 CCC(=O)C(=C)C 1P00CDIA [0,1,0,0,0,0|2,0,1]=4 613 B6R0.3 CCC(=O)C(=O)O 1P003HYL [0,1,0,0,0,0|1,0,1]=3 614 B6R0.3 CCC(=O)C(Br)C 1P0052P7 [0,1,0,0,0,0|2,0,0]=3 615 B6R0.3 CCC(=O)C(C)C 1P00E9N8 [0,1,0,0,0,0|2,0,0]=3 616 B6R0.3 CCC(=O)C(Cl)C 1P007UU5 [0,1,0,0,0,0|2,0,0]=3 617 B6R0.3 CCC(=O)C(F)F 1P01XBYL [0,1,0,0,0,0|3,0,0]=4 618 B6R0.3 CCC(=O)C(N)C 1P024M3X [0,1,0,0,0,0|1,0,0]=2 619 B6R0.3 CCC(=O)C(O)C 1P00EZCO [0,1,0,0,0,0|2,0,0]=3 620 B6R0.3 CCC(=O)C(S)C 1P00AE60 [0,1,0,0,0,0|2,0,0]=3 621 B6R0.3 CCC(=O)N(C)C 1P003T2A [0,1,0,0,0,0|3,0,0]=4 622 B6R0.3 CCC(B(O)O)C 1P003518 [0,1,0,0,0,0|2,0,1]=4 623 B6R0.3 CCC(C(=N)N)O 1P01BFO4 [0,1,0,0,0,0|3,0,0]=4 624 B6R0.3 CCC(C(=O)Br)Br 1P002S1O [0,1,0,0,0,0|2,0,0]=3 625 B6R0.3 CCC(C(=O)C)Br 1P008MK8 [0,1,0,0,0,0|2,0,0]=3 626 B6R0.3 CCC(C(=O)C)C 1P0037NS [0,1,0,0,0,0|2,0,0]=3 627 B6R0.3 CCC(C(=O)C)S 1P003K2Z [0,1,0,0,0,0|2,0,0]=3 628 B6R0.3 CCC(C(=O)Cl)Br 1P007Q0D [0,1,0,0,0,0|2,0,0]=3 629 B6R0.3 CCC(C(=O)Cl)Cl 1P003HIO [0,1,0,0,0,0|2,0,0]=3 630 B6R0.3 CCC(C(=O)N)Br 1P00394S [0,1,0,0,0,0|2,0,0]=3 631 B6R0.3 CCC(C(=O)N)Cl 1P003HIM [0,1,0,0,0,0|2,0,0]=3 632 B6R0.3 CCC(C(=O)N)N 1P00DIK4 [0,1,0,0,0,0|1,0,0]=2 633 B6R0.3 CCC(C(=O)N)N 1P01ALHP [0,1,0,0,0,0|1,0,0]=2 634 B6R0.3 CCC(C(=O)N)O 1P01A5K5 [0,1,0,0,0,0|2,0,0]=3 635 B6R0.3 CCC(C(=O)O)Br 1P003720 [0,1,0,0,0,0|1,0,0]=2 636 B6R0.3 CCC(C(=O)O)Cl 1P003HIN [0,1,0,0,0,0|1,0,0]=2 637 B6R0.3 CCC(C(=O)O)O 1P003Q9H [0,1,0,0,0,0|1,0,0]=2 638 B6R0.3 CCC(C(=O)O)S 1P002TTI [0,1,0,0,0,0|1,0,0]=2 639 B6R0.3 CCC(C(C)C)N 1P019XTU [0,1,0,0,0,0|2,0,1]=4 640 B6R0.3 CCC(C(C)C)O 1P003I6Q [0,1,0,0,0,0|2,0,1]=4 641 B6R0.3 CCC(C(F)F)N 1P01ANFW [0,1,0,0,0,0|2,0,1]=4 642 B6R0.3 CCC(C(N)C)C 1P007CWD [0,1,0,0,0,0|2,0,1]=4 643 B6R0.3 CCC(C(N)C)C 1P01AKCI [0,1,0,0,0,0|2,0,1]=4 644 B6R0.3 CCC(C(N)C)O 1P01A9UN [0,1,0,0,0,0|1,0,1]=3 645 B6R0.3 CCC(C(O)C)C 1P003K61 [0,1,0,0,0,0|2,0,1]=4 646 B6R0.3 CCC(C(O)C)N 1P01AVCT [0,1,0,0,0,0|1,0,1]=3 647 B6R0.3 CCC(C(O)C)O 1P00397E [0,1,0,0,0,0|2,0,1]=4 648 B6R0.3 CCN(C(=O)C)C 1P00D490 [0,1,0,0,0,0|3,0,0]=4 649 B6R0.3 CCN(C(=O)N)N 1P01DGMT [0,1,0,0,0,0|2,0,0]=3 650 B6R0.3 CC[C@@H](C(=O)N)N 1P003RNL [0,1,0,0,0,0|1,0,0]=2 651 B6R0.3 CC[C@@H](C(=O)N)N 1P00FCWE [0,1,0,0,0,0|1,0,0]=2 652 B6R0.3 CC[C@@H](C(=O)O)Br 1P00C7MK [0,1,0,0,0,0|1,0,0]=2 653 B6R0.3 CC[C@@H](C(=O)O)N 1P001LWU [0,1,0,0,0,0|0,0,0]=1 654 B6R0.3 CC[C@@H](C(=O)O)N 1P003REQ [0,1,0,0,0,0|0,0,0]=1 655 B6R0.3 CC[C@@H](C(=O)O)O 1P00382V [0,1,0,0,0,0|1,0,0]=2 656 B6R0.3 CC[C@@H](C(=O)O)S 1P00HI32 [0,1,0,0,0,0|1,0,0]=2 657 B6R0.3 CC[C@@H](C(=[Se])O)N 1P004JBG [0,1,0,0,0,0|0,1,0]=2 658 B6R0.3 CC[C@@H](C(C)C)N 1P01B2L1 [0,1,0,0,0,0|2,0,1]=4 659 B6R0.3 CC[C@@H](C(C)C)O 1P01DX2T [0,1,0,0,0,0|2,0,1]=4 660 B6R0.3 CC[C@@H](C(F)F)N 1P028DRX [0,1,0,0,0,0|2,0,1]=4 661 B6R0.3 CC[C@@H]([C@@H](O)C)N 1P01XDIC [0,1,0,0,0,0|1,0,1]=3 662 B6R0.3 CC[C@@H]([C@H](N)C)C 1P01FJYA [0,1,0,0,0,0|2,0,1]=4 663 B6R0.3 CC[C@@H]([C@H](O)C)N 1P01EFZM [0,1,0,0,0,0|1,0,1]=3 664 B6R0.3 CC[C@H](C(=O)N)N 1P0032U6 [0,1,0,0,0,0|1,0,0]=2 665 B6R0.3 CC[C@H](C(=O)O)Br 1P006UE3 [0,1,0,0,0,0|1,0,0]=2 666 B6R0.3 CC[C@H](C(=O)O)Cl 1P003CM0 [0,1,0,0,0,0|1,0,0]=2 667 B6R0.3 CC[C@H](C(=O)O)N 1P002SV0 [0,1,0,0,0,0|0,0,0]=1 668 B6R0.3 CC[C@H](C(=O)O)O 1P002D2A [0,1,0,0,0,0|1,0,0]=2 669 B6R0.3 CC[C@H](C(C)C)N 1P01B2L3 [0,1,0,0,0,0|2,0,1]=4 670 B6R0.3 CC[C@H](C(C)C)O 1P01DX0X [0,1,0,0,0,0|2,0,1]=4 671 B6R0.3 CC[C@H](C(F)F)N 1P028K7T [0,1,0,0,0,0|2,0,1]=4 672 B6R0.3 CC[C@H]([C@@H](O)C)N 1P01JUYU [0,1,0,0,0,0|1,0,1]=3 673 B6R0.3 CC[C@H]([C@@H](O)C)N 1P01K8CX [0,1,0,0,0,0|1,0,1]=3 674 B6R0.3 CC[C@H]([C@H](O)C)N 1P00K8Q8 [0,1,0,0,0,0|1,0,1]=3 675 B6R0.3 CC[C@H]([C@H](O)C)N 1P024U1N [0,1,0,0,0,0|1,0,1]=3 676 B6R0.3 CN(C(=O)C#C)C 1P00BW4W [0,1,0,0,0,0|3,0,0]=4 677 B6R0.3 CN(C(=O)C)C=C 1P003TOY [0,1,0,0,0,0|3,0,0]=4 678 B6R0.3 CN(C(=O)CN)O 1P01DWSB [0,1,0,0,0,0|3,0,0]=4 679 B6R0.3 CN(C(=O)Cl)C=C 1P028KS9 [0,1,0,0,0,0|3,0,0]=4 680 B6R0.3 CN(C(=O)Cl)CC 1P003THC [0,1,0,0,0,0|3,0,0]=4 681 B6R0.3 CN(C(=O)Cl)OC 1P002ZXO [0,1,0,0,0,0|3,0,0]=4 682 B6R0.3 CNC(=O)C(=C)C 1P003TMG [0,1,0,0,0,0|2,0,1]=4 683 B6R0.3 CNC(=O)C(=O)O 1P002YCG [0,1,0,0,0,0|1,0,1]=3 684 B6R0.3 CNC(=O)C(Br)C 1P00J7KD [0,1,0,0,0,0|2,0,0]=3 685 B6R0.3 CNC(=O)C(Br)F 1P00DD6M [0,1,0,0,0,0|3,0,0]=4 686 B6R0.3 CNC(=O)C(Cl)C 1P003HJL [0,1,0,0,0,0|2,0,0]=3 687 B6R0.3 CNC(=O)C(N)C 1P00C945 [0,1,0,0,0,0|1,0,0]=2 688 B6R0.3 CNC(=O)C(N)C 1P00D3XQ [0,1,0,0,0,0|1,0,0]=2 689 B6R0.3 CNC(=O)C(O)C 1P01BGYW [0,1,0,0,0,0|2,0,0]=3 690 B6R0.3 CNC(=O)N(C)C 1P003VLG [0,1,0,0,0,0|3,0,0]=4 691 B6R0.3 CNC(=O)[C@@H](N)C 1P00E9L3 [0,1,0,0,0,0|1,0,0]=2 692 B6R0.3 CNC(=O)[C@@H](O)C 1P01DT9Q [0,1,0,0,0,0|2,0,0]=3 693 B6R0.3 CNC(=O)[C@H](N)C 1P00A8IQ [0,1,0,0,0,0|1,0,0]=2 694 B6R0.3 CNC(=O)[C@H](O)C 1P01DT9E [0,1,0,0,0,0|2,0,0]=3 695 B6R0.3 CNC(=S)N(N)C 1P006PT1 [0,1,0,0,0,0|2,1,0]=4 696 B6R0.3 CNC(C(C)C)C 1P00C9CD [0,1,0,0,0,0|2,0,1]=4 697 B6R0.3 CNC(C(C)C)C 1P019F0U [0,1,0,0,0,0|2,0,1]=4 698 B6R0.3 CNC(C(F)F)C 1P02937U [0,1,0,0,0,0|2,0,1]=4 699 B6R0.3 COC(=C)C(=O)O 1P00D1D1 [0,1,0,0,0,0|1,0,1]=3 700 B6R0.3 COC(=N)C(C)C 1P00I89Q [0,1,0,0,0,0|2,0,0]=3 701 B6R0.3 COC(=O)C(=C)Br 1P0035PZ [0,1,0,0,0,0|1,0,2]=4 702 B6R0.3 COC(=O)C(=C)C 1P003SHL [0,1,0,0,0,0|1,0,1]=3 703 B6R0.3 COC(=O)C(=C)F 1P002NO2 [0,1,0,0,0,0|1,0,2]=4 704 B6R0.3 COC(=O)C(=N)N 1P00EBRL [0,1,0,0,0,0|1,0,1]=3 705 B6R0.3 COC(=O)C(=O)C 1P003SJ7 [0,1,0,0,0,0|1,0,1]=3 706 B6R0.3 COC(=O)C(=O)Cl 1P003936 [0,1,0,0,0,0|2,0,1]=4 707 B6R0.3 COC(=O)C(=O)O 1P00F3G0 [0,1,0,0,0,0|1,0,1]=3 708 B6R0.3 COC(=O)C(=S)N 1P004LWC [0,1,0,0,0,0|1,0,1]=3 709 B6R0.3 COC(=O)C(Br)Br 1P00EA1P [0,1,0,0,0,0|2,0,0]=3 710 B6R0.3 COC(=O)C(Br)C 1P0035MN [0,1,0,0,0,0|1,0,0]=2 711 B6R0.3 COC(=O)C(C)C 1P0035PL [0,1,0,0,0,0|1,0,0]=2 712 B6R0.3 COC(=O)C(Cl)C 1P00254C [0,1,0,0,0,0|1,0,0]=2 713 B6R0.3 COC(=O)C(Cl)Cl 1P000BT7 [0,1,0,0,0,0|2,0,0]=3 714 B6R0.3 COC(=O)C(F)C 1P002OJG [0,1,0,0,0,0|1,0,0]=2 715 B6R0.3 COC(=O)C(F)F 1P0035PE [0,1,0,0,0,0|2,0,0]=3 716 B6R0.3 COC(=O)C(N)C 1P00359D [0,1,0,0,0,0|0,0,0]=1 717 B6R0.3 COC(=O)C(O)C 1P003SGS [0,1,0,0,0,0|1,0,0]=2 718 B6R0.3 COC(=O)C(S)C 1P00DE8J [0,1,0,0,0,0|1,0,0]=2 719 B6R0.3 COC(=O)N(C)C 1P01EIEX [0,1,0,0,0,0|2,0,0]=3 720 B6R0.3 COC(=O)N(N)C 1P002IVE [0,1,0,0,0,0|1,0,0]=2 721 B6R0.3 COC(=O)[C@@H](Cl)C 1P003BSC [0,1,0,0,0,0|1,0,0]=2 722 B6R0.3 COC(=O)[C@@H](N)C 1P002QBA [0,1,0,0,0,0|0,0,0]=1 723 B6R0.3 COC(=O)[C@@H](O)C 1P0035LT [0,1,0,0,0,0|1,0,0]=2 724 B6R0.3 COC(=O)[C@H](Br)C 1P002D9M [0,1,0,0,0,0|1,0,0]=2 725 B6R0.3 COC(=O)[C@H](N)C 1P0038KG [0,1,0,0,0,0|0,0,0]=1 726 B6R0.3 COC(=O)[C@H](O)C 1P0032RK [0,1,0,0,0,0|1,0,0]=2 727 B6R0.3 COC(C(=O)C)C 1P01A0W5 [0,1,0,0,0,0|2,0,0]=3 728 B6R0.3 COC(C(Br)C)C 1P01BYDF [0,1,0,0,0,0|2,0,1]=4 729 B6R0.3 COC(C(N)C)C 1P01ALIL [0,1,0,0,0,0|1,0,1]=3 730 B6R0.3 COC(C(O)C)C 1P00DK0D [0,1,0,0,0,0|2,0,1]=4 731 B6R0.3 COC(C(S)C)C 1P0289S0 [0,1,0,0,0,0|2,0,1]=4 732 B6R0.3 COC([C@@H](N)C)C 1P01B1OR [0,1,0,0,0,0|1,0,1]=3 733 B6R0.3 COC([C@H](N)C)C 1P00AO5T [0,1,0,0,0,0|1,0,1]=3 734 B6R0.3 CON(C(=O)C)C 1P0035UT [0,1,0,0,0,0|3,0,0]=4 735 B6R0.3 CO[C@@H]([C@H](N)C)C 1P02870Y [0,1,0,0,0,0|1,0,1]=3 736 B6R0.3 CO[C@H]([C@@H](N)C)C 1P028NAF [0,1,0,0,0,0|1,0,1]=3 737 B6R0.3 CSC(C(N)C)C 1P028FBV [0,1,0,0,0,0|1,1,1]=4 738 B6R0.3 CSC(C(O)C)C 1P001W4K [0,1,0,0,0,0|2,0,1]=4 739 B6R0.3 C[C@@H](C(=C)CBr)O 1P01BU6X [0,1,0,0,0,0|3,0,0]=4 740 B6R0.3 C[C@@H](C(=O)CBr)N 1P028022 [0,1,0,0,0,0|1,0,0]=2 741 B6R0.3 C[C@@H](C(=O)N)NC 1P00J3DG [0,1,0,0,0,0|1,0,0]=2 742 B6R0.3 C[C@@H](C(=O)O)CC 1P0032VK [0,1,0,0,0,0|1,0,0]=2 743 B6R0.3 C[C@@H](C(=O)O)CN 1P00BI27 [0,1,0,0,0,0|0,0,0]=1 744 B6R0.3 C[C@@H](C(=O)O)NC 1P00I86T [0,1,0,0,0,0|0,0,0]=1 745 B6R0.3 C[C@@H](C(=O)O)OC 1P0039C4 [0,1,0,0,0,0|1,0,0]=2 746 B6R0.3 C[C@@H](C(=O)O)ON 1P01XFJR [0,1,0,0,0,0|0,0,0]=1 747 B6R0.3 C[C@@H](O)[C@@H](N)CC 1P01FWTF [0,1,0,0,0,0|1,0,1]=3 748 B6R0.3 C[C@@H]([C@H](O)C)C=C 1P01XCHP [0,1,0,0,0,0|2,0,1]=4 749 B6R0.3 C[C@H](C(=O)N)NC 1P00J3CW [0,1,0,0,0,0|1,0,0]=2 750 B6R0.3 C[C@H](C(=O)NO)N 1P01DWTY [0,1,0,0,0,0|0,0,0]=1 751 B6R0.3 C[C@H](C(=O)O)CC 1P0032WP [0,1,0,0,0,0|1,0,0]=2 752 B6R0.3 C[C@H](C(=O)O)CN 1P00CJ9Y [0,1,0,0,0,0|0,0,0]=1 753 B6R0.3 C[C@H](C(=O)O)CN 1P00H3B0 [0,1,0,0,0,0|0,0,0]=1 754 B6R0.3 C[C@H](C(=O)O)NC 1P002YZ5 [0,1,0,0,0,0|0,0,0]=1 755 B6R0.3 C[C@H](C(=O)O)OC 1P0032UO [0,1,0,0,0,0|1,0,0]=2 756 B6R0.3 C[C@H](C(=O)O)ON 1P01XFIY [0,1,0,0,0,0|0,0,0]=1 757 B6R0.3 C[C@H]([C@@H](O)C)C=C 1P01H7DW [0,1,0,0,0,0|2,0,1]=4 758 B6R0.3 C[C@H]([C@H](O)C)C=C 1P02031P [0,1,0,0,0,0|2,0,1]=4 759 B6R0.3 C\C(=C/C)\C(=O)O 1P00365V [0,1,0,0,0,0|1,0,1]=3 760 B6R0.3 C\C(=C\C)\C(=O)O 1P00EARA [0,1,0,0,0,0|1,0,1]=3 761 B6R0.3 C\C(=N/O)\C(=O)C 1P00IAMV [0,1,0,0,0,0|1,0,2]=4 762 B6R0.3 C\C=C(\C(=O)C)/C 1P027W3W [0,1,0,0,0,0|2,0,1]=4 763 B6R0.3 ClC(=O)C(CBr)Br 1P002H1M [0,1,0,0,0,0|2,0,0]=3 764 B6R0.3 ClCC(=O)C(C)C 1P0025F5 [0,1,0,0,0,0|2,0,0]=3 765 B6R0.3 ClCC(=O)C(Cl)C 1P001XMQ [0,1,0,0,0,0|2,0,0]=3 766 B6R0.3 ClCC(=O)C(Cl)Cl 1P003DNA [0,1,0,0,0,0|3,0,0]=4 767 B6R0.3 ClCC(=O)N(C)C 1P003HJI [0,1,0,0,0,0|3,0,0]=4 768 B6R0.3 ClCC(C(=O)Cl)Cl 1P005RZV [0,1,0,0,0,0|2,0,0]=3 769 B6R0.3 ClCC(C(C)C)N 1P028V4U [0,1,0,0,0,0|2,0,1]=4 770 B6R0.3 ClCC(C(C)C)O 1P01B8ZZ [0,1,0,0,0,0|2,0,1]=4 771 B6R0.3 ClCC(C(Cl)C)O 1P01DVHD [0,1,0,0,0,0|2,0,1]=4 772 B6R0.3 ClCN(C(=O)Cl)C 1P01BSLX [0,1,0,0,0,0|3,0,0]=4 773 B6R0.3 FC(C(=NO)N)F 1P01C2K9 [0,1,0,0,0,0|3,0,0]=4 774 B6R0.3 ICC(=O)N(C)C 1P008QTC [0,1,0,0,0,0|3,0,0]=4 775 B6R0.3 IC[C@H](C(=C)I)C 1P00I984 [0,1,0,0,0,0|3,0,0]=4 776 B6R0.3 NC(=O)C(C#N)Br 1P0082Z1 [0,1,0,0,0,0|2,0,1]=4 777 B6R0.3 NC(=O)C(CBr)Br 1P001NI4 [0,1,0,0,0,0|2,0,0]=3 778 B6R0.3 NC(=O)C(CCl)Cl 1P003FYF [0,1,0,0,0,0|2,0,0]=3 779 B6R0.3 NC(C(=O)N)C#N 1P00649H [0,1,0,0,0,0|1,0,1]=3 780 B6R0.3 NC(C(=O)N)CO 1P01B58Z [0,1,0,0,0,0|1,0,0]=2 781 B6R0.3 NC(C(=O)N)CS 1P01DX7L [0,1,0,0,0,0|1,0,0]=2 782 B6R0.3 NC(C(=O)O)C=C 1P003XPM [0,1,0,0,0,0|0,0,1]=2 783 B6R0.3 NC(C(=O)O)CCl 1P00CA7T [0,1,0,0,0,0|0,0,0]=1 784 B6R0.3 NC(C(=O)O)CF 1P00DGN8 [0,1,0,0,0,0|0,0,0]=1 785 B6R0.3 NC(C(=O)O)CN 1P003943 [0,1,0,0,0,0|0,0,0]=1 786 B6R0.3 NC(C(=O)O)CN 1P003FXC [0,1,0,0,0,0|0,0,0]=1 787 B6R0.3 NC(C(=O)O)CS 1P0035K1 [0,1,0,0,0,0|0,0,0]=1 788 B6R0.3 NC(C(=O)O)CS 1P003QAD [0,1,0,0,0,0|0,0,0]=1 789 B6R0.3 NC(C(=O)O)CS 1P003QAE [0,1,0,0,0,0|0,0,0]=1 790 B6R0.3 NC(C(=O)O)CS 1P006OTU [0,1,0,0,0,0|0,0,0]=1 791 B6R0.3 NCC(=O)C(C)C 1P01AI3X [0,1,0,0,0,0|2,0,0]=3 792 B6R0.3 NCC(=O)N(C)C 1P002DCJ [0,1,0,0,0,0|3,0,0]=4 793 B6R0.3 NCC(=O)N(C)C 1P00374V [0,1,0,0,0,0|3,0,0]=4 794 B6R0.3 NCC(=O)N(C)C 1P00774H [0,1,0,0,0,0|3,0,0]=4 795 B6R0.3 NCC(C(=O)N)O 1P01BFL9 [0,1,0,0,0,0|2,0,0]=3 796 B6R0.3 NCC(C(=O)O)F 1P003HSD [0,1,0,0,0,0|1,0,0]=2 797 B6R0.3 NCC(C(=O)O)F 1P003Q9F [0,1,0,0,0,0|1,0,0]=2 798 B6R0.3 NCC(C(=O)O)O 1P00IAJH [0,1,0,0,0,0|1,0,0]=2 799 B6R0.3 NCC(C(C)C)C 1P006L5N [0,1,0,0,0,0|2,0,1]=4 800 B6R0.3 NCC(C(C)C)C 1P01EII4 [0,1,0,0,0,0|2,0,1]=4 801 B6R0.3 NCC(C(C)C)N 1P01AHZS [0,1,0,0,0,0|2,0,1]=4 802 B6R0.3 NCC(C(C)C)O 1P00AMTI [0,1,0,0,0,0|2,0,1]=4 803 B6R0.3 NCC(C(C)C)O 1P01AKSJ [0,1,0,0,0,0|2,0,1]=4 804 B6R0.3 NCC(C(F)F)C 1P01EJRH [0,1,0,0,0,0|2,0,1]=4 805 B6R0.3 NCC(C(O)C)N 1P01AKOA [0,1,0,0,0,0|1,0,1]=3 806 B6R0.3 NCC(N(C)C)C 1P002BEP [0,1,0,0,0,0|3,0,0]=4 807 B6R0.3 NCC(N(C)C)C 1P00HEMK [0,1,0,0,0,0|3,0,0]=4 808 B6R0.3 NC[C@@H](C(=O)O)N 1P002BHJ [0,1,0,0,0,0|0,0,0]=1 809 B6R0.3 NC[C@@H](C(=O)O)O 1P00IBMO [0,1,0,0,0,0|1,0,0]=2 810 B6R0.3 NC[C@@H](N(C)C)C 1P01C1QS [0,1,0,0,0,0|3,0,0]=4 811 B6R0.3 NC[C@H](C(=O)O)F 1P01C2S9 [0,1,0,0,0,0|1,0,0]=2 812 B6R0.3 NC[C@H](C(=O)O)O 1P00IBMN [0,1,0,0,0,0|1,0,0]=2 813 B6R0.3 NC[C@H](C(C)C)O 1P00J2SF [0,1,0,0,0,0|2,0,1]=4 814 B6R0.3 NC[C@H](N(C)C)C 1P00J3CB [0,1,0,0,0,0|3,0,0]=4 815 B6R0.3 NNC(=O)C(=O)N 1P003TZA [0,1,0,0,0,0|2,0,1]=4 816 B6R0.3 NNC(=O)C(C)C 1P00I7MY [0,1,0,0,0,0|2,0,0]=3 817 B6R0.3 NNC(=O)C(F)F 1P003FN1 [0,1,0,0,0,0|3,0,0]=4 818 B6R0.3 NNC(=O)N(C)C 1P00J7PZ [0,1,0,0,0,0|3,0,0]=4 819 B6R0.3 NNC(C(C)C)C 1P019UTH [0,1,0,0,0,0|2,0,1]=4 820 B6R0.3 NNC(C(F)F)C 1P01B1YP [0,1,0,0,0,0|2,0,1]=4 821 B6R0.3 N[C@@H](C(=O)N)CO 1P000JHQ [0,1,0,0,0,0|1,0,0]=2 822 B6R0.3 N[C@@H](C(=O)O)C=C 1P0097X9 [0,1,0,0,0,0|0,0,1]=2 823 B6R0.3 N[C@@H](C(=O)O)CBr 1P0285EG [0,1,0,0,0,0|0,0,0]=1 824 B6R0.3 N[C@@H](C(=O)O)CCl 1P00C7GL [0,1,0,0,0,0|0,0,0]=1 825 B6R0.3 N[C@@H](C(=O)O)CCl 1P00DFAR [0,1,0,0,0,0|0,0,0]=1 826 B6R0.3 N[C@@H](C(=O)O)CF 1P0078KD [0,1,0,0,0,0|0,0,0]=1 827 B6R0.3 N[C@@H](C(=O)O)CN 1P002FR4 [0,1,0,0,0,0|0,0,0]=1 828 B6R0.3 N[C@@H](C(=O)O)CN 1P003422 [0,1,0,0,0,0|0,0,0]=1 829 B6R0.3 N[C@@H](C(=O)O)CS 1P002JBZ [0,1,0,0,0,0|0,0,0]=1 830 B6R0.3 N[C@@H](C(=O)O)CS 1P00I6LW [0,1,0,0,0,0|0,0,0]=1 831 B6R0.3 N[C@@H](C(=O)O)CS 1P00IHHG [0,1,0,0,0,0|0,0,0]=1 832 B6R0.3 N[C@H](C(=O)N)CO 1P003RU0 [0,1,0,0,0,0|1,0,0]=2 833 B6R0.3 N[C@H](C(=O)O)C=C 1P003AKV [0,1,0,0,0,0|0,0,1]=2 834 B6R0.3 N[C@H](C(=O)O)CBr 1P028ADI [0,1,0,0,0,0|0,0,0]=1 835 B6R0.3 N[C@H](C(=O)O)CCl 1P00344Z [0,1,0,0,0,0|0,0,0]=1 836 B6R0.3 N[C@H](C(=O)O)CF 1P028KPH [0,1,0,0,0,0|0,0,0]=1 837 B6R0.3 N[C@H](C(=O)O)CN 1P001FZQ [0,1,0,0,0,0|0,0,0]=1 838 B6R0.3 N[C@H](C(=O)O)CN 1P00C7HL [0,1,0,0,0,0|0,0,0]=1 839 B6R0.3 N[C@H](C(=O)O)CS 1P000DOJ [0,1,0,0,0,0|0,0,0]=1 840 B6R0.3 N[C@H](C(=O)O)CS 1P0035JZ [0,1,0,0,0,0|0,0,0]=1 841 B6R0.3 N[C@H](C(=O)O)CS 1P003RPD [0,1,0,0,0,0|0,0,0]=1 842 B6R0.3 N[C@H](C(=O)O)C[SeH] 1P0007PW [0,1,0,0,0,0|0,0,0]=1 843 B6R0.3 N\C(=N/O)\C(=O)N 1P00AU5J [0,1,0,0,0,0|2,0,1]=4 844 B6R0.3 O=CC(C(=O)C)Br 1P008EEH [0,1,0,0,0,0|2,0,1]=4 845 B6R0.3 O=CC(C(C)C)Br 1P01A6VL [0,1,0,0,0,0|2,0,1]=4 846 B6R0.3 O=CC(C(C)C)C 1P002LJ1 [0,1,0,0,0,0|2,0,1]=4 847 B6R0.3 OC(=O)C(=C)CBr 1P003FGN [0,1,0,0,0,0|1,0,1]=3 848 B6R0.3 OC(=O)C(=O)C=C 1P00F11D [0,1,0,0,0,0|1,0,2]=4 849 B6R0.3 OC(=O)C(=O)CBr 1P002J71 [0,1,0,0,0,0|1,0,1]=3 850 B6R0.3 OC(=O)C(=O)CBr 1P0036BQ [0,1,0,0,0,0|1,0,1]=3 851 B6R0.3 OC(=O)C(=O)CCl 1P00CAPJ [0,1,0,0,0,0|1,0,1]=3 852 B6R0.3 OC(=O)C(C=C)Cl 1P01B91R [0,1,0,0,0,0|1,0,1]=3 853 B6R0.3 OC(=O)C(CBr)Br 1P00392R [0,1,0,0,0,0|1,0,0]=2 854 B6R0.3 OC(=O)C(CCl)Cl 1P003FYG [0,1,0,0,0,0|1,0,0]=2 855 B6R0.3 OC(=O)C(CF)Br 1P001X8V [0,1,0,0,0,0|1,0,0]=2 856 B6R0.3 OC(=O)\C(=C\Cl)\Cl 1P00D040 [0,1,0,0,0,0|1,0,2]=4 857 B6R0.3 OC(C(=O)O)C#C 1P003HUH [0,1,0,0,0,0|1,0,1]=3 858 B6R0.3 OC(C(=O)O)C=C 1P00F3FZ [0,1,0,0,0,0|1,0,1]=3 859 B6R0.3 OC(C(=O)O)CBr 1P00CRVV [0,1,0,0,0,0|1,0,0]=2 860 B6R0.3 OC(C(=O)O)CCl 1P00369Z [0,1,0,0,0,0|1,0,0]=2 861 B6R0.3 OC(C(C)C)C#N 1P00ACOK [0,1,0,0,0,0|2,0,1]=4 862 B6R0.3 OCC(=C(C)C)Br 1P01EMPR [0,1,0,0,0,0|2,0,1]=4 863 B6R0.3 OCC(=C(C)C)C 1P01ANFK [0,1,0,0,0,0|2,0,1]=4 864 B6R0.3 OCC(=C(C)C)F 1P028XLO [0,1,0,0,0,0|2,0,1]=4 865 B6R0.3 OCC(=C)C(=O)O 1P01AEEH [0,1,0,0,0,0|1,0,1]=3 866 B6R0.3 OCC(=O)C(=O)O 1P0092L4 [0,1,0,0,0,0|1,0,1]=3 867 B6R0.3 OCC(=O)C(C)C 1P00CYUK [0,1,0,0,0,0|1,0,0]=2 868 B6R0.3 OCC(=O)N(C)C 1P001EMJ [0,1,0,0,0,0|2,0,0]=3 869 B6R0.3 OCC(C(=O)O)Br 1P001VQN [0,1,0,0,0,0|1,0,0]=2 870 B6R0.3 OCC(C(=O)O)C 1P002J5U [0,1,0,0,0,0|1,0,0]=2 871 B6R0.3 OCC(C(=O)O)N 1P003QB8 [0,1,0,0,0,0|0,0,0]=1 872 B6R0.3 OCC(C(=O)O)O 1P003P4H [0,1,0,0,0,0|1,0,0]=2 873 B6R0.3 OCC(C(=O)O)O 1P003R8N [0,1,0,0,0,0|1,0,0]=2 874 B6R0.3 OCC(C(=O)[O-])O 1P024HGG [0,1,0,0,0,0|1,0,1]=3 875 B6R0.3 OCC(C(C)C)C 1P00B0NI [0,1,0,0,0,0|2,0,1]=4 876 B6R0.3 OCC(C(C)C)F 1P028GKG [0,1,0,0,0,0|2,0,1]=4 877 B6R0.3 OCC(C(C)C)N 1P001US2 [0,1,0,0,0,0|2,0,1]=4 878 B6R0.3 OCC(C(C)C)O 1P006Z3A [0,1,0,0,0,0|1,0,2]=4 879 B6R0.3 OCC(C(C)C)S 1P000CGY [0,1,0,0,0,0|1,1,1]=4 880 B6R0.3 OCC(C(F)F)N 1P028HOT [0,1,0,0,0,0|2,0,1]=4 881 B6R0.3 OCC(C(O)C)C 1P0063UD [0,1,0,0,0,0|2,0,1]=4 882 B6R0.3 OCC(C(O)C)O 1P003DR9 [0,1,0,0,0,0|1,0,2]=4 883 B6R0.3 OC[C@@H](C(=O)O)Br 1P005HBV [0,1,0,0,0,0|1,0,0]=2 884 B6R0.3 OC[C@@H](C(=O)O)N 1P003RTZ [0,1,0,0,0,0|0,0,0]=1 885 B6R0.3 OC[C@@H](C(C)C)N 1P00I8PU [0,1,0,0,0,0|2,0,1]=4 886 B6R0.3 OC[C@@H](C(F)F)N 1P028RUA [0,1,0,0,0,0|2,0,1]=4 887 B6R0.3 OC[C@@H]([C@@H](O)C)N 1P003QCZ [0,1,0,0,0,0|1,0,1]=3 888 B6R0.3 OC[C@@H]([C@H](O)C)N 1P00DBEP [0,1,0,0,0,0|1,0,1]=3 889 B6R0.3 OC[C@H](C(=O)O)Br 1P023N89 [0,1,0,0,0,0|1,0,0]=2 890 B6R0.3 OC[C@H](C(=O)O)C 1P002FFU [0,1,0,0,0,0|1,0,0]=2 891 B6R0.3 OC[C@H](C(=O)O)N 1P00I6B9 [0,1,0,0,0,0|0,0,0]=1 892 B6R0.3 OC[C@H](C(C)C)N 1P0028T6 [0,1,0,0,0,0|2,0,1]=4 893 B6R0.3 OC[C@H](C(C)C)N 1P007UVD [0,1,0,0,0,0|2,0,1]=4 894 B6R0.3 OC[C@H](C(F)F)N 1P0283QO [0,1,0,0,0,0|2,0,1]=4 895 B6R0.3 OC[C@H]([C@@H](O)C)N 1P0084EN [0,1,0,0,0,0|1,0,1]=3 896 B6R0.3 OC[C@H]([C@H](O)C)N 1P0035KQ [0,1,0,0,0,0|1,0,1]=3 897 B6R0.3 OC[C@H]([C@H](O)C)N 1P01ANMR [0,1,0,0,0,0|1,0,1]=3 898 B6R0.3 ON=C(N(C)C)N 1P01A0R4 [0,1,0,0,0,0|3,0,0]=4 899 B6R0.3 ON=C(N(C)C)N 1P01AFYR [0,1,0,0,0,0|3,0,0]=4 900 B6R0.3 ONC(=N)C(C)C 1P003RJ2 [0,1,0,0,0,0|2,0,0]=3 901 B6R0.3 ONC(=N)C(C)C 1P01DDTD [0,1,0,0,0,0|2,0,0]=3 902 B6R0.3 ONC(=N)C(Cl)Cl 1P005QH8 [0,1,0,0,0,0|3,0,0]=4 903 B6R0.3 ONC(=O)N(C)C 1P006VXQ [0,1,0,0,0,0|2,0,0]=3 904 B6R0.3 O[13CH2][13C@@H]([13C](=O)O)N 1P01CCY3 [0,1,0,0,0,0|0,0,0]=1 905 B6R0.3 O[C@@H](C(=O)O)CF 1P01DXE8 [0,1,0,0,0,0|1,0,0]=2 906 B6R0.3 O[C@@H](C(C)C)C#C 1P005QT9 [0,1,0,0,0,0|2,0,1]=4 907 B6R0.3 O[C@H](C(=O)O)CF 1P01G9M1 [0,1,0,0,0,0|1,0,0]=2 908 B6R0.3 O[C@H](C(C)C)C#C 1P005NS0 [0,1,0,0,0,0|2,0,1]=4 909 B6R0.3 [O-]C(=O)C(=O)CC 1P002DSR [0,1,0,0,0,0|1,0,2]=4 910 B6R0.3 [O-]C(=O)C(=O)CO 1P00C02U [0,1,0,0,0,0|1,0,2]=4 911 B6R0.3 [O-]C(=O)C(=O)CS 1P00086M [0,1,0,0,0,0|1,0,2]=4 912 B6R0.3 [O-]C(=O)C(=O)OC 1P00HADN [0,1,0,0,0,0|1,0,2]=4 913 B6R0.3 [O-]C(=O)C(CC)O 1P00DA6V [0,1,0,0,0,0|1,0,1]=3 914 B6R0.3 [O-]C(=O)C(CF)O 1P027W8B [0,1,0,0,0,0|1,0,1]=3 915 B6R0.3 [O-]C(=O)C(CO)C 1P00HH01 [0,1,0,0,0,0|1,0,1]=3 916 B6R0.3 [O-]C(=O)C(OC)F 1P01BFBH [0,1,0,0,0,0|1,0,1]=3 917 B6R0.3 [O-]S(=O)C(CC)C 1P01BCHM [0,1,0,0,0,0|2,0,1]=4 918 B6R0.3 [O-][N+](=O)C(CO)Br 1P00DR7G [0,1,0,0,0,0|2,0,1]=4 919 B6R0.3 [O-][N+](=O)C(CO)C 1P002VOQ [0,1,0,0,0,0|2,0,1]=4 920 B6R0.7 BrC(=C)C(C)(C)C 1P01EMLK [0,1,0,0,0,0|3,0,0]=4 921 B6R0.7 BrC(=O)C(Br)(C)C 1P002JOT [0,1,0,0,0,0|2,0,0]=3 922 B6R0.7 BrC(=O)C(Br)([2H])[2H] 1P01E4WI [0,1,0,0,0,0|3,0,0]=4 923 B6R0.7 C([2H])(C(=O)O)(N)[2H] 1P00DE7D [0,1,0,0,0,0|1,0,0]=2 924 B6R0.7 C([2H])(C(=O)[O-])([2H])[2H] 1P00BYPD [0,1,0,0,0,0|2,0,1]=4 925 B6R0.7 CC(=C)C(O)(C)C 1P007H43 [0,1,0,0,0,0|3,0,0]=4 926 B6R0.7 CC(=O)C(Br)(C)C 1P002TV2 [0,1,0,0,0,0|2,0,0]=3 927 B6R0.7 CC(=O)C(Br)(F)F 1P01EMCG [0,1,0,0,0,0|3,0,0]=4 928 B6R0.7 CC(=O)C(Cl)(C)C 1P00EDWH [0,1,0,0,0,0|2,0,0]=3 929 B6R0.7 CC(=O)C(Cl)(Cl)C 1P002TV6 [0,1,0,0,0,0|2,0,0]=3 930 B6R0.7 CC(=O)C(Cl)(F)F 1P008BD0 [0,1,0,0,0,0|3,0,0]=4 931 B6R0.7 CC(=O)C(F)(C)C 1P01DW0X [0,1,0,0,0,0|2,0,0]=3 932 B6R0.7 CC(=O)C(F)(F)C 1P008JA8 [0,1,0,0,0,0|2,0,0]=3 933 B6R0.7 CC(=O)C(N)(C)C 1P0006SC [0,1,0,0,0,0|1,0,0]=2 934 B6R0.7 CC(=O)C(O)(C)C 1P000G0I [0,1,0,0,0,0|2,0,0]=3 935 B6R0.7 CC(=O)[Si](C)(C)C 1P007N0S [0,1,0,0,0,0|2,1,0]=4 936 B6R0.7 CC(C(C)(C)C)N 1P003GTJ [0,1,0,0,0,0|2,0,1]=4 937 B6R0.7 CC(C(C)(C)C)N 1P01BKPV [0,1,0,0,0,0|2,0,1]=4 938 B6R0.7 CC(C(C)(C)C)O 1P003ITX [0,1,0,0,0,0|2,0,1]=4 939 B6R0.7 CC(C(Cl)(C)C)N 1P02857C [0,1,0,0,0,0|2,0,1]=4 940 B6R0.7 CC(C(F)(C)C)N 1P02866Y [0,1,0,0,0,0|2,0,1]=4 941 B6R0.7 CC(C(F)(F)C)N 1P01BBLH [0,1,0,0,0,0|2,0,1]=4 942 B6R0.7 CC(C(F)(F)C)O 1P027PCM [0,1,0,0,0,0|2,0,1]=4 943 B6R0.7 CC(C(F)(F)F)N 1P002ZJQ [0,1,0,0,0,0|2,0,1]=4 944 B6R0.7 CC(C(F)(F)F)N 1P0038CB [0,1,0,0,0,0|2,0,1]=4 945 B6R0.7 CC(C(N)(C)C)Br 1P0287WE [0,1,0,0,0,0|2,0,1]=4 946 B6R0.7 CC(C(N)(C)C)C 1P00DK49 [0,1,0,0,0,0|2,0,1]=4 947 B6R0.7 CC(C(N)(C)C)C 1P00J36P [0,1,0,0,0,0|2,0,1]=4 948 B6R0.7 CC(C(N)(C)C)N 1P01AV1B [0,1,0,0,0,0|2,0,1]=4 949 B6R0.7 CC(C(N)(C)C)O 1P00A6GF [0,1,0,0,0,0|1,0,1]=3 950 B6R0.7 CC(C(N)(C)C)O 1P028MA2 [0,1,0,0,0,0|1,0,1]=3 951 B6R0.7 CC(C(O)(C)C)C 1P003G0K [0,1,0,0,0,0|2,0,1]=4 952 B6R0.7 CC(C(O)(C)C)N 1P00EES1 [0,1,0,0,0,0|1,0,1]=3 953 B6R0.7 CC(C(O)(C)C)O 1P00E19W [0,1,0,0,0,0|2,0,1]=4 954 B6R0.7 CC(P(=O)(O)O)O 1P007REW [0,1,0,0,0,0|2,0,0]=3 955 B6R0.7 CC(S(=O)(=N)C)C 1P01BS81 [0,1,0,0,0,0|3,0,0]=4 956 B6R0.7 CC(S(=O)(=O)Br)C 1P02869Z [0,1,0,0,0,0|2,0,1]=4 957 B6R0.7 CC(S(=O)(=O)C)C 1P003RLR [0,1,0,0,0,0|2,0,1]=4 958 B6R0.7 CC(S(=O)(=O)Cl)C 1P000513 [0,1,0,0,0,0|2,0,1]=4 959 B6R0.7 CC(S(=O)(=O)Cl)Cl 1P01ACAC [0,1,0,0,0,0|2,0,1]=4 960 B6R0.7 CC(S(=O)(=O)Cl)F 1P028TXG [0,1,0,0,0,0|2,0,1]=4 961 B6R0.7 CC(S(=O)(=O)F)C 1P019XAL [0,1,0,0,0,0|2,0,1]=4 962 B6R0.7 CC(S(=O)(=O)N)C 1P0035IV [0,1,0,0,0,0|2,0,1]=4 963 B6R0.7 CC(S(=O)(=O)N)F 1P027YBF [0,1,0,0,0,0|2,0,1]=4 964 B6R0.7 CC(S(=O)(=O)[O-])Cl 1P01BCQW [0,1,0,0,0,0|2,0,1]=4 965 B6R0.7 CC(S(=O)Cl)(C)C 1P003V2P [0,1,0,0,0,0|3,0,0]=4 966 B6R0.7 CC(S(=O)N)(C)C 1P00HXYB [0,1,0,0,0,0|3,0,0]=4 967 B6R0.7 CC(S(=O)[O-])(C)C 1P01BCHQ [0,1,0,0,0,0|2,0,1]=4 968 B6R0.7 CC(S(=O)[O-])(F)F 1P00A0EE [0,1,0,0,0,0|2,0,1]=4 969 B6R0.7 CC([N+](=O)[O-])(C)C 1P003I2M [0,1,0,0,0,0|2,0,1]=4 970 B6R0.7 CC([S@@](=O)N)(C)C 1P0032UP [0,1,0,0,0,0|3,0,0]=4 971 B6R0.7 CC([S@](=O)N)(C)C 1P0032WC [0,1,0,0,0,0|3,0,0]=4 972 B6R0.7 CS(=O)C(C)(C)C 1P001G4M [0,1,0,0,0,0|3,0,0]=4 973 B6R0.7 C[C@@H](C(C)(C)C)N 1P003AIX [0,1,0,0,0,0|2,0,1]=4 974 B6R0.7 C[C@@H](C(C)(C)C)N 1P003CXS [0,1,0,0,0,0|2,0,1]=4 975 B6R0.7 C[C@@H](C(C)(C)C)O 1P007EHC [0,1,0,0,0,0|2,0,1]=4 976 B6R0.7 C[C@@H](C(F)(C)C)N 1P028K6G [0,1,0,0,0,0|2,0,1]=4 977 B6R0.7 C[C@@H](C(F)(F)F)N 1P000NZF [0,1,0,0,0,0|2,0,1]=4 978 B6R0.7 C[C@@H](C(O)(C)C)N 1P00HZOX [0,1,0,0,0,0|1,0,1]=3 979 B6R0.7 C[C@@H](C(O)(C)C)O 1P01HMJM [0,1,0,0,0,0|2,0,1]=4 980 B6R0.7 C[C@@H](P(=O)(C)C)N 1P028FGT [0,1,0,0,0,0|2,0,0]=3 981 B6R0.7 C[C@H](C(C)(C)C)N 1P003CJP [0,1,0,0,0,0|2,0,1]=4 982 B6R0.7 C[C@H](C(C)(C)C)N 1P01DWSI [0,1,0,0,0,0|2,0,1]=4 983 B6R0.7 C[C@H](C(C)(C)C)O 1P001PQP [0,1,0,0,0,0|2,0,1]=4 984 B6R0.7 C[C@H](C(F)(C)C)N 1P028BO8 [0,1,0,0,0,0|2,0,1]=4 985 B6R0.7 C[C@H](C(F)(F)F)N 1P0025SG [0,1,0,0,0,0|2,0,1]=4 986 B6R0.7 C[C@H](C(O)(C)C)O 1P01EAR8 [0,1,0,0,0,0|2,0,1]=4 987 B6R0.7 C[C@H](P(=O)(C)C)N 1P0289TS [0,1,0,0,0,0|2,0,0]=3 988 B6R0.7 ClC(=C)C(C)(C)C 1P024KXH [0,1,0,0,0,0|3,0,0]=4 989 B6R0.7 ClC(=O)C(Br)(C)C 1P002A40 [0,1,0,0,0,0|2,0,0]=3 990 B6R0.7 ClC(=O)C(Br)(F)F 1P00C0ZW [0,1,0,0,0,0|3,0,0]=4 991 B6R0.7 ClC(=O)C(Cl)(C)C 1P0010VD [0,1,0,0,0,0|2,0,0]=3 992 B6R0.7 ClC(=O)C(F)(C)C 1P01UOTK [0,1,0,0,0,0|2,0,0]=3 993 B6R0.7 ClC(=O)C(F)(F)C 1P027J0I [0,1,0,0,0,0|2,0,0]=3 994 B6R0.7 FC(C(N)(C)C)F 1P018SO3 [0,1,0,0,0,0|2,0,1]=4 995 B6R0.7 NC(=N)C(C)(C)C 1P0023R9 [0,1,0,0,0,0|3,0,0]=4 996 B6R0.7 NC(=N)C(F)(C)C 1P028Y78 [0,1,0,0,0,0|3,0,0]=4 997 B6R0.7 NC(=N)C(N)(C)C 1P01AD9F [0,1,0,0,0,0|2,0,0]=3 998 B6R0.7 NC(=N)C(O)(C)C 1P00CZ51 [0,1,0,0,0,0|3,0,0]=4 999 B6R0.7 NC(=N)S(=O)(=O)O 1P008XFW [0,1,0,0,0,0|2,0,1]=4 1000 B6R0.7 NC(=O)C(Br)(C)C 1P005B2L [0,1,0,0,0,0|2,0,0]=3 1001 B6R0.7 NC(=O)C(Br)(F)F 1P0070G6 [0,1,0,0,0,0|3,0,0]=4 1002 B6R0.7 NC(=O)C(C)(C)C 1P0035YI [0,1,0,0,0,0|2,0,0]=3 1003 B6R0.7 NC(=O)C(Cl)(C)C 1P01A2I6 [0,1,0,0,0,0|2,0,0]=3 1004 B6R0.7 NC(=O)C(Cl)(Cl)Cl 1P0033CS [0,1,0,0,0,0|3,0,0]=4 1005 B6R0.7 NC(=O)C(Cl)(F)F 1P003PA5 [0,1,0,0,0,0|3,0,0]=4 1006 B6R0.7 NC(=O)C(F)(F)C 1P00DBUC [0,1,0,0,0,0|2,0,0]=3 1007 B6R0.7 NC(=O)C(F)(F)F 1P003FNQ [0,1,0,0,0,0|3,0,0]=4 1008 B6R0.7 NC(=O)C(N)(C)C 1P001TOY [0,1,0,0,0,0|1,0,0]=2 1009 B6R0.7 NC(=O)C(N)(C)C 1P00AUNH [0,1,0,0,0,0|1,0,0]=2 1010 B6R0.7 NC(=O)C(O)(C)C 1P000UO8 [0,1,0,0,0,0|2,0,0]=3 1011 B6R0.7 NC(=S)C(C)(C)C 1P0037DV [0,1,0,0,0,0|2,1,0]=4 1012 B6R0.7 NC(=S)C(F)(F)C 1P01HJRO [0,1,0,0,0,0|2,1,0]=4 1013 B6R0.7 NC(=S)C(N)(C)C 1P027W11 [0,1,0,0,0,0|1,1,0]=3 1014 B6R0.7 OB(C(C)(C)C)O 1P00IEFV [0,1,0,0,0,0|2,0,1]=4 1015 B6R0.7 OC(=O)C(Br)(Br)Br 1P003VGK [0,1,0,0,0,0|2,0,0]=3 1016 B6R0.7 OC(=O)C(Br)(Br)Cl 1P00DF9D [0,1,0,0,0,0|2,0,0]=3 1017 B6R0.7 OC(=O)C(Br)(C)C 1P002AEN [0,1,0,0,0,0|1,0,0]=2 1018 B6R0.7 OC(=O)C(Br)(F)F 1P007CU0 [0,1,0,0,0,0|2,0,0]=3 1019 B6R0.7 OC(=O)C(C)(C)C 1P0035YJ [0,1,0,0,0,0|1,0,0]=2 1020 B6R0.7 OC(=O)C(Cl)(C)C 1P00EI2W [0,1,0,0,0,0|1,0,0]=2 1021 B6R0.7 OC(=O)C(Cl)(Cl)C 1P003FRB [0,1,0,0,0,0|1,0,0]=2 1022 B6R0.7 OC(=O)C(Cl)(Cl)Cl 1P003A67 [0,1,0,0,0,0|2,0,0]=3 1023 B6R0.7 OC(=O)C(Cl)(Cl)F 1P00CTU1 [0,1,0,0,0,0|2,0,0]=3 1024 B6R0.7 OC(=O)C(Cl)(F)F 1P003PA6 [0,1,0,0,0,0|2,0,0]=3 1025 B6R0.7 OC(=O)C(F)(C)C 1P00EBJZ [0,1,0,0,0,0|1,0,0]=2 1026 B6R0.7 OC(=O)C(F)(F)C 1P0033DM [0,1,0,0,0,0|1,0,0]=2 1027 B6R0.7 OC(=O)C(F)(F)F 1P000K0R [0,1,0,0,0,0|2,0,0]=3 1028 B6R0.7 OC(=O)C(F)(F)F 1P001DB6 [0,1,0,0,0,0|2,0,0]=3 1029 B6R0.7 OC(=O)C(F)(F)F 1P001U7A [0,1,0,0,0,0|2,0,0]=3 1030 B6R0.7 OC(=O)C(F)(F)F 1P001U7P [0,1,0,0,0,0|2,0,0]=3 1031 B6R0.7 OC(=O)C(F)(F)F 1P003OCG [0,1,0,0,0,0|2,0,0]=3 1032 B6R0.7 OC(=O)C(F)(F)F 1P0072W3 [0,1,0,0,0,0|2,0,0]=3 1033 B6R0.7 OC(=O)C(F)(F)F 1P00DZTR [0,1,0,0,0,0|2,0,0]=3 1034 B6R0.7 OC(=O)C(F)(F)F 1P00HYFD [0,1,0,0,0,0|2,0,0]=3 1035 B6R0.7 OC(=O)C(F)(F)F 1P00HYH8 [0,1,0,0,0,0|2,0,0]=3 1036 B6R0.7 OC(=O)C(F)(F)F 1P00I93N [0,1,0,0,0,0|2,0,0]=3 1037 B6R0.7 OC(=O)C(F)(F)F 1P00ILTB [0,1,0,0,0,0|2,0,0]=3 1038 B6R0.7 OC(=O)C(F)(F)F 1P00VVTW [0,1,0,0,0,0|2,0,0]=3 1039 B6R0.7 OC(=O)C(F)(F)F 1P01ACTM [0,1,0,0,0,0|2,0,0]=3 1040 B6R0.7 OC(=O)C(F)(F)F 1P01AGC2 [0,1,0,0,0,0|2,0,0]=3 1041 B6R0.7 OC(=O)C(F)(F)F 1P01AMJE [0,1,0,0,0,0|2,0,0]=3 1042 B6R0.7 OC(=O)C(F)(F)F 1P01ANM0 [0,1,0,0,0,0|2,0,0]=3 1043 B6R0.7 OC(=O)C(F)(F)F 1P01ANON [0,1,0,0,0,0|2,0,0]=3 1044 B6R0.7 OC(=O)C(F)(F)F 1P01AUYG [0,1,0,0,0,0|2,0,0]=3 1045 B6R0.7 OC(=O)C(F)(F)F 1P01B65F [0,1,0,0,0,0|2,0,0]=3 1046 B6R0.7 OC(=O)C(F)(F)F 1P01BBQR [0,1,0,0,0,0|2,0,0]=3 1047 B6R0.7 OC(=O)C(F)(F)F 1P01BI36 [0,1,0,0,0,0|2,0,0]=3 1048 B6R0.7 OC(=O)C(F)(F)F 1P01BUQF [0,1,0,0,0,0|2,0,0]=3 1049 B6R0.7 OC(=O)C(F)(F)F 1P01C2UC [0,1,0,0,0,0|2,0,0]=3 1050 B6R0.7 OC(=O)C(F)(F)F 1P01C39J [0,1,0,0,0,0|2,0,0]=3 1051 B6R0.7 OC(=O)C(F)(F)F 1P01C48H [0,1,0,0,0,0|2,0,0]=3 1052 B6R0.7 OC(=O)C(F)(F)F 1P01JL4V [0,1,0,0,0,0|2,0,0]=3 1053 B6R0.7 OC(=O)C(F)(F)F 1P01JL57 [0,1,0,0,0,0|2,0,0]=3 1054 B6R0.7 OC(=O)C(F)(F)F 1P01JURA [0,1,0,0,0,0|2,0,0]=3 1055 B6R0.7 OC(=O)C(F)(F)F 1P0208LE [0,1,0,0,0,0|2,0,0]=3 1056 B6R0.7 OC(=O)C(F)(F)F 1P027ULJ [0,1,0,0,0,0|2,0,0]=3 1057 B6R0.7 OC(=O)C(F)(F)F 1P0280RQ [0,1,0,0,0,0|2,0,0]=3 1058 B6R0.7 OC(=O)C(F)(F)F 1P0280SQ [0,1,0,0,0,0|2,0,0]=3 1059 B6R0.7 OC(=O)C(F)(F)F 1P0282DW [0,1,0,0,0,0|2,0,0]=3 1060 B6R0.7 OC(=O)C(F)(F)F 1P0282G1 [0,1,0,0,0,0|2,0,0]=3 1061 B6R0.7 OC(=O)C(F)(F)F 1P02846K [0,1,0,0,0,0|2,0,0]=3 1062 B6R0.7 OC(=O)C(F)(F)F 1P0284C4 [0,1,0,0,0,0|2,0,0]=3 1063 B6R0.7 OC(=O)C(F)(F)F 1P0284JG [0,1,0,0,0,0|2,0,0]=3 1064 B6R0.7 OC(=O)C(F)(F)F 1P0284L8 [0,1,0,0,0,0|2,0,0]=3 1065 B6R0.7 OC(=O)C(F)(F)F 1P0285CM [0,1,0,0,0,0|2,0,0]=3 1066 B6R0.7 OC(=O)C(F)(F)F 1P028BRY [0,1,0,0,0,0|2,0,0]=3 1067 B6R0.7 OC(=O)C(F)(F)F 1P028EAS [0,1,0,0,0,0|2,0,0]=3 1068 B6R0.7 OC(=O)C(F)(F)F 1P028ITN [0,1,0,0,0,0|2,0,0]=3 1069 B6R0.7 OC(=O)C(F)(F)F 1P028KBM [0,1,0,0,0,0|2,0,0]=3 1070 B6R0.7 OC(=O)C(F)(F)F 1P028KZ5 [0,1,0,0,0,0|2,0,0]=3 1071 B6R0.7 OC(=O)C(F)(F)F 1P028MET [0,1,0,0,0,0|2,0,0]=3 1072 B6R0.7 OC(=O)C(F)(F)F 1P028NK6 [0,1,0,0,0,0|2,0,0]=3 1073 B6R0.7 OC(=O)C(F)(F)F 1P028UPW [0,1,0,0,0,0|2,0,0]=3 1074 B6R0.7 OC(=O)C(F)(F)F 1P028VBP [0,1,0,0,0,0|2,0,0]=3 1075 B6R0.7 OC(=O)C(F)(F)F 1P028XLH [0,1,0,0,0,0|2,0,0]=3 1076 B6R0.7 OC(=O)C(F)(F)F 1P028YI3 [0,1,0,0,0,0|2,0,0]=3 1077 B6R0.7 OC(=O)C(N)(C)C 1P003GTA [0,1,0,0,0,0|0,0,0]=1 1078 B6R0.7 OC(=O)C(O)(C)C 1P00369V [0,1,0,0,0,0|1,0,0]=2 1079 B6R0.7 OC(=O)C(S)(C)C 1P00DE8V [0,1,0,0,0,0|1,0,0]=2 1080 B6R0.7 [O-]C(=O)C(Br)(F)F 1P0036WB [0,1,0,0,0,0|2,0,1]=4 1081 B6R0.7 [O-]C(=O)C(Br)(F)F 1P008FN9 [0,1,0,0,0,0|2,0,1]=4 1082 B6R0.7 [O-]C(=O)C(C)(C)C 1P001QJO [0,1,0,0,0,0|1,0,1]=3 1083 B6R0.7 [O-]C(=O)C(C)(C)C 1P00362K [0,1,0,0,0,0|1,0,1]=3 1084 B6R0.7 [O-]C(=O)C(C)(C)C 1P003P88 [0,1,0,0,0,0|1,0,1]=3 1085 B6R0.7 [O-]C(=O)C(C)(C)C 1P003TZZ [0,1,0,0,0,0|1,0,1]=3 1086 B6R0.7 [O-]C(=O)C(C)(C)C 1P003UV1 [0,1,0,0,0,0|1,0,1]=3 1087 B6R0.7 [O-]C(=O)C(C)(C)C 1P00AN4U [0,1,0,0,0,0|1,0,1]=3 1088 B6R0.7 [O-]C(=O)C(C)(C)C 1P01XD1A [0,1,0,0,0,0|1,0,1]=3 1089 B6R0.7 [O-]C(=O)C(Cl)(Cl)Cl 1P003UV0 [0,1,0,0,0,0|2,0,1]=4 1090 B6R0.7 [O-]C(=O)C(Cl)(Cl)F 1P00I5SC [0,1,0,0,0,0|2,0,1]=4 1091 B6R0.7 [O-]C(=O)C(Cl)(F)F 1P002E6G [0,1,0,0,0,0|2,0,1]=4 1092 B6R0.7 [O-]C(=O)C(F)(F)C 1P00HS8I [0,1,0,0,0,0|1,0,1]=3 1093 B6R0.7 [O-]C(=O)C(F)(F)F 1P000KUA [0,1,0,0,0,0|2,0,1]=4 1094 B6R0.7 [O-]C(=O)C(F)(F)F 1P001VV1 [0,1,0,0,0,0|2,0,1]=4 1095 B6R0.7 [O-]C(=O)C(F)(F)F 1P002JR6 [0,1,0,0,0,0|2,0,1]=4 1096 B6R0.7 [O-]C(=O)C(F)(F)F 1P002O84 [0,1,0,0,0,0|2,0,1]=4 1097 B6R0.7 [O-]C(=O)C(F)(F)F 1P002Y93 [0,1,0,0,0,0|2,0,1]=4 1098 B6R0.7 [O-]C(=O)C(F)(F)F 1P002Y94 [0,1,0,0,0,0|2,0,1]=4 1099 B6R0.7 [O-]C(=O)C(F)(F)F 1P002Y95 [0,1,0,0,0,0|2,0,1]=4 1100 B6R0.7 [O-]C(=O)C(F)(F)F 1P002ZHM [0,1,0,0,0,0|2,0,1]=4 1101 B6R0.7 [O-]C(=O)C(F)(F)F 1P003RPW [0,1,0,0,0,0|2,0,1]=4 1102 B6R0.7 [O-]C(=O)C(F)(F)F 1P003U04 [0,1,0,0,0,0|2,0,1]=4 1103 B6R0.7 [O-]C(=O)C(F)(F)F 1P00BCW7 [0,1,0,0,0,0|2,0,1]=4 1104 B6R0.7 [O-]C(=O)C(F)(F)F 1P00BI0R [0,1,0,0,0,0|2,0,1]=4 1105 B6R0.7 [O-]C(=O)C(F)(F)F 1P01XD1S [0,1,0,0,0,0|2,0,1]=4 1106 B6R1.4 Br[C@H]1CC[C@H]1O 1P0284RU [0,0,0,1,0,0|2,0,1]=4 1107 B6R1.4 CC1CNC1=O 1P01DXX0 [0,0,0,1,0,0|2,0,0]=3 1108 B6R1.4 CC1NCC1C 1P01AMSK [0,0,0,1,0,0|2,0,1]=4 1109 B6R1.4 CC1OCC1=O 1P00IL5Y [0,0,0,1,0,0|2,0,0]=3 1110 B6R1.4 C[C@H]1NC[C@H]1C 1P024HDJ [0,0,0,1,0,0|2,0,1]=4 1111 B6R1.4 FC1CCC1N 1P01JUSG [0,0,0,1,0,0|2,0,1]=4 1112 B6R1.4 FC1CNC1C 1P01JV2O [0,0,0,1,0,0|2,0,1]=4 1113 B6R1.4 F[C@@H]1CN[C@@H]1C 1P01KADB [0,0,0,1,0,0|2,0,1]=4 1114 B6R1.4 F[C@@H]1CN[C@H]1C 1P01JVJL [0,0,0,1,0,0|2,0,1]=4 1115 B6R1.4 F[C@H]1CC[C@H]1N 1P028OSK [0,0,0,1,0,0|2,0,1]=4 1116 B6R1.4 F[C@H]1CN[C@@H]1C 1P01KACA [0,0,0,1,0,0|2,0,1]=4 1117 B6R1.4 F[C@H]1CN[C@H]1C 1P01KAB8 [0,0,0,1,0,0|2,0,1]=4 1118 B6R1.4 NC1CCC1C 1P01BB58 [0,0,0,1,0,0|2,0,1]=4 1119 B6R1.4 NC1CNC1=O 1P01BSOU [0,0,0,1,0,0|1,0,0]=2 1120 B6R1.4 N[C@@H]1CC[C@H]1C 1P027WJ7 [0,0,0,1,0,0|2,0,1]=4 1121 B6R1.4 N[C@@H]1CNC1=O 1P01KAB4 [0,0,0,1,0,0|1,0,0]=2 1122 B6R1.4 N[C@@H]1CNC1=O 1P027UE8 [0,0,0,1,0,0|1,0,0]=2 1123 B6R1.4 N[C@H]1CNC1=O 1P000A5J [0,0,0,1,0,0|1,0,0]=2 1124 B6R1.4 N[C@H]1CNC1=O 1P0029Z1 [0,0,0,1,0,0|1,0,0]=2 1125 B6R1.4 O=C1CCC1Br 1P000ISS [0,0,0,1,0,0|2,0,0]=3 1126 B6R1.4 O=C1CCC1C 1P00B4N2 [0,0,0,1,0,0|2,0,0]=3 1127 B6R1.4 O=C1CCC1N 1P01EIQW [0,0,0,1,0,0|1,0,0]=2 1128 B6R1.4 O=C1CCN1N 1P01A4RJ [0,0,0,1,0,0|2,0,0]=3 1129 B6R1.4 OC1CCC1C 1P001R53 [0,0,0,1,0,0|2,0,1]=4 1130 B6R1.4 OC1CCC1N 1P01A63L [0,0,0,1,0,0|1,0,1]=3 1131 B6R1.4 OC1CCC1O 1P01JV1P [0,0,0,1,0,0|2,0,1]=4 1132 B6R1.4 OC1CNC1=O 1P01A6LV [0,0,0,1,0,0|2,0,0]=3 1133 B6R1.4 OC1CNC1C 1P00IHGO [0,0,0,1,0,0|1,0,1]=3 1134 B6R1.4 OC1COC1C 1P00A0PR [0,0,0,1,0,0|2,0,1]=4 1135 B6R1.4 O[C@@H]1CC[C@@H]1N 1P002JA3 [0,0,0,1,0,0|1,0,1]=3 1136 B6R1.4 O[C@@H]1CC[C@@H]1O 1P00MDX3 [0,0,0,1,0,0|2,0,1]=4 1137 B6R1.4 O[C@@H]1CC[C@H]1N 1P00I3AC [0,0,0,1,0,0|1,0,1]=3 1138 B6R1.4 O[C@@H]1CC[C@H]1O 1P01JUJU [0,0,0,1,0,0|2,0,1]=4 1139 B6R1.4 O[C@@H]1CN[C@@H]1C 1P01JVJG [0,0,0,1,0,0|1,0,1]=3 1140 B6R1.4 O[C@@H]1CN[C@H]1C 1P01DXVT [0,0,0,1,0,0|1,0,1]=3 1141 B6R1.4 O[C@H]1CC[C@@H]1N 1P00J3BR [0,0,0,1,0,0|1,0,1]=3 1142 B6R1.4 O[C@H]1CC[C@H]1N 1P01E45Q [0,0,0,1,0,0|1,0,1]=3 1143 B6R1.4 O[C@H]1CN[C@@H]1C 1P01X8JQ [0,0,0,1,0,0|1,0,1]=3 1144 B6R1.4 O[C@H]1CN[C@H]1C 1P01JUT3 [0,0,0,1,0,0|1,0,1]=3 1145 B6R1.4 SC1CCC1O 1P028C1D [0,0,0,1,0,0|2,0,1]=4 1146 B6R1.4 S[C@@H]1CC[C@H]1N 1P028B7V [0,0,0,1,0,0|1,1,1]=4 1147 B6R1.4 S[C@@H]1CC[C@H]1O 1P02847Y [0,0,0,1,0,0|2,0,1]=4 1148 B6R1.4 S[C@H]1CC[C@H]1O 1P028AGK [0,0,0,1,0,0|2,0,1]=4 1149 B6R1.9 CC1CC1(C)N 1P01BVB7 [0,0,0,1,0,0|2,0,1]=4 1150 B6R1.9 CC1CC1(C)O 1P01A4J7 [0,0,0,1,0,0|2,0,1]=4 1151 B6R1.9 C[C@@H]1C[C@@]1(C)N 1P0291YD [0,0,0,1,0,0|2,0,1]=4 1152 B6R1.9 C[C@H]1C[C@]1(C)N 1P027XYQ [0,0,0,1,0,0|2,0,1]=4 1153 B6R1.9 NC1CC1(C)C 1P00IC6A [0,0,0,1,0,0|2,0,1]=4 1154 B6R1.9 NC1CC1(F)F 1P0038SQ [0,0,0,1,0,0|2,0,1]=4 1155 B6R1.9 N[C@@H]1CC1(F)F 1P01KB93 [0,0,0,1,0,0|2,0,1]=4 1156 B6R1.9 N[C@H]1CC1(C)C 1P01C36M [0,0,0,1,0,0|2,0,1]=4 1157 B6R1.9 N[C@H]1CC1(F)F 1P01JUIR [0,0,0,1,0,0|2,0,1]=4 1158 B6R1.9 OC1CC1(C)C 1P01JJII [0,0,0,1,0,0|2,0,1]=4 1159 B6R1.11 BrC(=C)C1CC1 1P0279S7 [0,0,0,1,0,0|3,0,0]=4 1160 B6R1.11 CC(=C)C1CC1 1P00DBGP [0,0,0,1,0,0|3,0,0]=4 1161 B6R1.11 CC(=O)C1CC1 1P00337Q [0,0,0,1,0,0|2,0,0]=3 1162 B6R1.11 CC(=O)C1CO1 1P00DG4I [0,0,0,1,0,0|2,0,0]=3 1163 B6R1.11 CC(C1CC1)N 1P003EQ8 [0,0,0,1,0,0|2,0,1]=4 1164 B6R1.11 CC(C1CC1)O 1P003EQ7 [0,0,0,1,0,0|2,0,1]=4 1165 B6R1.11 CC(C1CO1)Br 1P00K7EQ [0,0,0,1,0,0|2,0,1]=4 1166 B6R1.11 CC(C1CO1)O 1P01ACSU [0,0,0,1,0,0|2,0,1]=4 1167 B6R1.11 CC(C1OC1)C 1P00331K [0,0,0,1,0,0|2,0,1]=4 1168 B6R1.11 CC([C@@H]1NC1)C 1P028Z6M [0,0,0,1,0,0|2,0,1]=4 1169 B6R1.11 CC([C@H]1NC1)C 1P028JDK [0,0,0,1,0,0|2,0,1]=4 1170 B6R1.11 C[C@@H](C1CC1)N 1P003AG5 [0,0,0,1,0,0|2,0,1]=4 1171 B6R1.11 C[C@@H](C1CC1)O 1P00DG11 [0,0,0,1,0,0|2,0,1]=4 1172 B6R1.11 C[C@H](C1CC1)N 1P0032UZ [0,0,0,1,0,0|2,0,1]=4 1173 B6R1.11 C[C@H](C1CC1)N 1P00AMHW [0,0,0,1,0,0|2,0,1]=4 1174 B6R1.11 C[C@H](C1CC1)O 1P00EFW5 [0,0,0,1,0,0|2,0,1]=4 1175 B6R1.11 ClC(=C)C1CO1 1P007I10 [0,0,0,1,0,0|3,0,0]=4 1176 B6R1.11 ClC(=O)C1CC1 1P003PNF [0,0,0,1,0,0|2,0,0]=3 1177 B6R1.11 ClS(=O)C1CC1 1P01C7TR [0,0,0,1,0,0|3,0,0]=4 1178 B6R1.11 NC(=N)C1CC1 1P00393B [0,0,0,1,0,0|3,0,0]=4 1179 B6R1.11 NC(=O)C1CC1 1P003PNG [0,0,0,1,0,0|2,0,0]=3 1180 B6R1.11 NC(=S)C1CC1 1P00291O [0,0,0,1,0,0|2,1,0]=4 1181 B6R1.11 NS(=O)C1CC1 1P0221LR [0,0,0,1,0,0|3,0,0]=4 1182 B6R1.11 OB(C1CC1)O 1P00354W [0,0,0,1,0,0|2,0,1]=4 1183 B6R1.11 OC(=O)C1CC1 1P0021R4 [0,0,0,1,0,0|1,0,0]=2 1184 B6R1.11 OC(=O)C1CO1 1P003TZG [0,0,0,1,0,0|1,0,0]=2 1185 B6R1.11 [O-]C(=O)C1CO1 1P0035ZB [0,0,0,1,0,0|1,0,1]=3 1186 B6R1.11 [O-]C(=O)[C@@H]1CO1 1P0038VO [0,0,0,1,0,0|1,0,1]=3 1187 B6R1.11 [O-]C(=O)[C@H]1CO1 1P004XZC [0,0,0,1,0,0|1,0,1]=3 1188 B6R1.11 [O-]S(=O)C1CC1 1P003USU [0,0,0,1,0,0|2,0,1]=4 1189 B6R1.11 [O-][N+](=O)C1CC1 1P000UMD [0,0,0,1,0,0|2,0,1]=4 1190 B6R0.2 BrC(=C)CC(=O)O 1P028J9X [0,0,0,0,0,1|1,0,2]=4 1191 B6R0.2 BrC(=CC(=O)O)Br 1P00AZTD [0,0,0,0,0,1|2,0,1]=4 1192 B6R0.2 CC(=C)CC(=O)C 1P00CLKE [0,0,0,0,0,1|2,0,1]=4 1193 B6R0.2 CC(=C)CC(=O)O 1P001WA5 [0,0,0,0,0,1|1,0,1]=3 1194 B6R0.2 CC(=C)OC(=O)C 1P0035IQ [0,0,0,0,0,1|2,0,1]=4 1195 B6R0.2 CC(=CC(=O)C)C 1P001G6Y [0,0,0,0,0,1|2,0,1]=4 1196 B6R0.2 CC(=CC(=O)C)O 1P001CNO [0,0,0,0,0,1|2,0,1]=4 1197 B6R0.2 CC(=CC(=O)Cl)C 1P003K7P [0,0,0,0,0,1|2,0,1]=4 1198 B6R0.2 CC(=CC(=O)N)C 1P01BER2 [0,0,0,0,0,1|2,0,1]=4 1199 B6R0.2 CC(=CC(=O)O)C 1P0033YA [0,0,0,0,0,1|1,0,1]=3 1200 B6R0.2 CC(=CC(=O)O)Cl 1P00DGVA [0,0,0,0,0,1|1,0,1]=3 1201 B6R0.2 CC(=CC(=O)O)I 1P01JX6Y [0,0,0,0,0,1|1,0,1]=3 1202 B6R0.2 CC(=CC(O)C)C 1P0074MI [0,0,0,0,0,1|3,0,0]=4 1203 B6R0.2 CC(=O)CC(=O)C 1P000KDQ [0,0,0,0,0,1|2,0,1]=4 1204 B6R0.2 CC(=O)CC(=O)C 1P003VUE [0,0,0,0,0,1|2,0,1]=4 1205 B6R0.2 CC(=O)CC(=O)N 1P0034W3 [0,0,0,0,0,1|2,0,1]=4 1206 B6R0.2 CC(=O)NC(=O)C 1P00355U [0,0,0,0,0,1|2,0,1]=4 1207 B6R0.2 CC(=O)NC(=O)N 1P003O4P [0,0,0,0,0,1|2,0,1]=4 1208 B6R0.2 CC(=O)NC(=S)N 1P00E9ZO [0,0,0,0,0,1|2,0,1]=4 1209 B6R0.2 CC(=O)SC(=O)C 1P003O4E [0,0,0,0,0,1|2,0,1]=4 1210 B6R0.2 CC(=O)[C-]C(=O)C 1P00236S [0,0,0,0,0,1|2,0,1]=4 1211 B6R0.2 CC(=O)[CH-]C(=O)C 1P0016VZ [0,0,0,0,0,1|2,0,1]=4 1212 B6R0.2 CC(=O)[CH-]C(=O)C 1P003OFD [0,0,0,0,0,1|2,0,1]=4 1213 B6R0.2 CC(=O)[CH-]C(=O)C 1P003OGH [0,0,0,0,0,1|2,0,1]=4 1214 B6R0.2 CC(=O)[CH-]C(=O)C 1P003UNO [0,0,0,0,0,1|2,0,1]=4 1215 B6R0.2 CC(=O)[CH-]C(=O)C 1P00AQOO [0,0,0,0,0,1|2,0,1]=4 1216 B6R0.2 CC(=O)[CH-]C(=O)C 1P00HU8W [0,0,0,0,0,1|2,0,1]=4 1217 B6R0.2 CC(=O)[CH-]C(=O)C 1P00HW92 [0,0,0,0,0,1|2,0,1]=4 1218 B6R0.2 CC(=O)[CH-]C(=O)C 1P00HYD8 [0,0,0,0,0,1|2,0,1]=4 1219 B6R0.2 CC(=O)[CH-]C(=O)C 1P00IKXP [0,0,0,0,0,1|2,0,1]=4 1220 B6R0.2 CC(C=C(C)C)C 1P003GAP [0,0,0,0,0,1|3,0,0]=4 1221 B6R0.2 CC(CC(=C)Br)C 1P0279S8 [0,0,0,0,0,1|3,0,0]=4 1222 B6R0.2 CC(CC(=C)C)C 1P003GAN [0,0,0,0,0,1|3,0,0]=4 1223 B6R0.2 CC(CC(=N)N)C 1P00EK2S [0,0,0,0,0,1|3,0,0]=4 1224 B6R0.2 CC(CC(=O)C)N 1P00J23J [0,0,0,0,0,1|1,0,0]=2 1225 B6R0.2 CC(CC(=O)C)O 1P00723Y [0,0,0,0,0,1|2,0,0]=3 1226 B6R0.2 CC(CC(=O)Cl)C 1P0035J3 [0,0,0,0,0,1|2,0,0]=3 1227 B6R0.2 CC(CC(=O)Cl)Cl 1P01BTXW [0,0,0,0,0,1|2,0,0]=3 1228 B6R0.2 CC(CC(=O)F)C 1P01B7CV [0,0,0,0,0,1|2,0,0]=3 1229 B6R0.2 CC(CC(=O)N)C 1P003RMF [0,0,0,0,0,1|2,0,0]=3 1230 B6R0.2 CC(CC(=O)N)Cl 1P028G15 [0,0,0,0,0,1|2,0,0]=3 1231 B6R0.2 CC(CC(=O)N)N 1P01C1RK [0,0,0,0,0,1|1,0,0]=2 1232 B6R0.2 CC(CC(=O)N)O 1P007O9T [0,0,0,0,0,1|2,0,0]=3 1233 B6R0.2 CC(CC(=O)O)Br 1P002SV2 [0,0,0,0,0,1|1,0,0]=2 1234 B6R0.2 CC(CC(=O)O)C 1P003RMG [0,0,0,0,0,1|1,0,0]=2 1235 B6R0.2 CC(CC(=O)O)Cl 1P003JRA [0,0,0,0,0,1|1,0,0]=2 1236 B6R0.2 CC(CC(=O)O)F 1P028OF4 [0,0,0,0,0,1|1,0,0]=2 1237 B6R0.2 CC(CC(=O)O)N 1P003JE2 [0,0,0,0,0,1|0,0,0]=1 1238 B6R0.2 CC(CC(=O)O)O 1P003K12 [0,0,0,0,0,1|1,0,0]=2 1239 B6R0.2 CC(CC(=O)O)S 1P002TTH [0,0,0,0,0,1|1,0,0]=2 1240 B6R0.2 CC(CC(=S)N)C 1P00AR7D [0,0,0,0,0,1|2,1,0]=4 1241 B6R0.2 CC(CC(F)F)N 1P01BCJV [0,0,0,0,0,1|2,0,1]=4 1242 B6R0.2 CC(CC(N)C)C 1P00FBMB [0,0,0,0,0,1|2,0,1]=4 1243 B6R0.2 CC(CC(N)C)N 1P01INJP [0,0,0,0,0,1|2,0,1]=4 1244 B6R0.2 CC(CC(N)C)N 1P0287MU [0,0,0,0,0,1|2,0,1]=4 1245 B6R0.2 CC(CC(O)C)C 1P0038GQ [0,0,0,0,0,1|2,0,1]=4 1246 B6R0.2 CC(CC(O)C)N 1P0014XP [0,0,0,0,0,1|1,0,1]=3 1247 B6R0.2 CC(CC(O)C)O 1P003GCB [0,0,0,0,0,1|2,0,1]=4 1248 B6R0.2 CC(CS(=O)C)N 1P01A734 [0,0,0,0,0,1|2,0,0]=3 1249 B6R0.2 CC(CS(=O)C)O 1P02879G [0,0,0,0,0,1|3,0,0]=4 1250 B6R0.2 CC(CS(=O)Cl)C 1P01C9KJ [0,0,0,0,0,1|3,0,0]=4 1251 B6R0.2 CC(CS(=O)[O-])C 1P01BCHN [0,0,0,0,0,1|2,0,1]=4 1252 B6R0.2 CC(C[C@@H](N)C)C 1P01EIIX [0,0,0,0,0,1|2,0,1]=4 1253 B6R0.2 CC(C[C@@H](N)C)C 1P02898S [0,0,0,0,0,1|2,0,1]=4 1254 B6R0.2 CC(C[C@@H](O)C)C 1P001LS9 [0,0,0,0,0,1|2,0,1]=4 1255 B6R0.2 CC(C[C@H](N)C)C 1P01EIHB [0,0,0,0,0,1|2,0,1]=4 1256 B6R0.2 CC(C[C@H](O)C)C 1P001V2I [0,0,0,0,0,1|2,0,1]=4 1257 B6R0.2 CC(C[N+](=O)[O-])C 1P00F3HC [0,0,0,0,0,1|2,0,1]=4 1258 B6R0.2 CC(N=C(C)C)C 1P00CKF9 [0,0,0,0,0,1|3,0,0]=4 1259 B6R0.2 CC(NC(=N)N)C 1P0055O6 [0,0,0,0,0,1|3,0,0]=4 1260 B6R0.2 CC(NC(=O)C)C 1P0084JZ [0,0,0,0,0,1|2,0,0]=3 1261 B6R0.2 CC(NC(=O)Cl)C 1P01B38E [0,0,0,0,0,1|2,0,0]=3 1262 B6R0.2 CC(NC(=O)N)C 1P005LHL [0,0,0,0,0,1|2,0,0]=3 1263 B6R0.2 CC(NC(=S)C)C 1P01A5JR [0,0,0,0,0,1|2,1,0]=4 1264 B6R0.2 CC(NC(=S)N)C 1P00APGI [0,0,0,0,0,1|2,1,0]=4 1265 B6R0.2 CC(OC(=O)C)Br 1P00336T [0,0,0,0,0,1|2,0,0]=3 1266 B6R0.2 CC(OC(=O)C)C 1P0036E9 [0,0,0,0,0,1|2,0,0]=3 1267 B6R0.2 CC(OC(=O)C)Cl 1P00EN9H [0,0,0,0,0,1|2,0,0]=3 1268 B6R0.2 CC(OC(=O)Cl)Cl 1P003528 [0,0,0,0,0,1|2,0,0]=3 1269 B6R0.2 CC(OC(=O)N)C 1P00209N [0,0,0,0,0,1|2,0,0]=3 1270 B6R0.2 CC(OC(=S)[S-])C 1P001CEW [0,0,0,0,0,1|1,2,0]=4 1271 B6R0.2 CC(OC(=S)[S-])C 1P001CEX [0,0,0,0,0,1|1,2,0]=4 1272 B6R0.2 CC(O[N+](=O)[O-])C 1P0039DL [0,0,0,0,0,1|2,0,1]=4 1273 B6R0.2 CC(SC(=N)N)C 1P00BYWC [0,0,0,0,0,1|3,0,0]=4 1274 B6R0.2 CC(SC(=O)Cl)C 1P001A85 [0,0,0,0,0,1|2,0,0]=3 1275 B6R0.2 CN(CC(=O)C)C 1P003DJS [0,0,0,0,0,1|3,0,0]=4 1276 B6R0.2 CN(CC(=O)Cl)C 1P003Q3N [0,0,0,0,0,1|3,0,0]=4 1277 B6R0.2 CN(CC(=O)N)C 1P01BFB9 [0,0,0,0,0,1|3,0,0]=4 1278 B6R0.2 CN(CC(=O)O)C 1P002QBC [0,0,0,0,0,1|2,0,0]=3 1279 B6R0.2 CN(CC(=O)O)C 1P003T1T [0,0,0,0,0,1|2,0,0]=3 1280 B6R0.2 CN(CC(N)C)C 1P00G836 [0,0,0,0,0,1|3,0,0]=4 1281 B6R0.2 CN(C[C@@H](N)C)C 1P01AL6X [0,0,0,0,0,1|3,0,0]=4 1282 B6R0.2 CN(C[C@@H](N)C)C 1P01BBNK [0,0,0,0,0,1|3,0,0]=4 1283 B6R0.2 CN(C[C@H](N)C)C 1P00CL9K [0,0,0,0,0,1|3,0,0]=4 1284 B6R0.2 CN(C[C@H](N)C)C 1P01JKRO [0,0,0,0,0,1|3,0,0]=4 1285 B6R0.2 CS(=O)CC(=O)N 1P028O27 [0,0,0,0,0,1|3,0,0]=4 1286 B6R0.2 C[C@@H](CC(=O)N)O 1P028625 [0,0,0,0,0,1|2,0,0]=3 1287 B6R0.2 C[C@@H](CC(=O)O)F 1P028OKF [0,0,0,0,0,1|1,0,0]=2 1288 B6R0.2 C[C@@H](CC(=O)O)N 1P0036AK [0,0,0,0,0,1|0,0,0]=1 1289 B6R0.2 C[C@@H](CC(=O)O)N 1P00IAVS [0,0,0,0,0,1|0,0,0]=1 1290 B6R0.2 C[C@@H](CC(=O)O)O 1P003ANQ [0,0,0,0,0,1|1,0,0]=2 1291 B6R0.2 C[C@@H](C[C@@H](O)C)O 1P003C68 [0,0,0,0,0,1|2,0,1]=4 1292 B6R0.2 C[C@H](CC(=O)N)O 1P027UQQ [0,0,0,0,0,1|2,0,0]=3 1293 B6R0.2 C[C@H](CC(=O)O)N 1P003CQA [0,0,0,0,0,1|0,0,0]=1 1294 B6R0.2 C[C@H](CC(=O)O)N 1P00EB6J [0,0,0,0,0,1|0,0,0]=1 1295 B6R0.2 C[C@H](C[C@@H](O)C)N 1P0283G5 [0,0,0,0,0,1|1,0,1]=3 1296 B6R0.2 C[C@H](C[C@H](O)C)O 1P003C54 [0,0,0,0,0,1|2,0,1]=4 1297 B6R0.2 C\C(=C/C(=O)C)\N 1P008UX7 [0,0,0,0,0,1|1,0,1]=3 1298 B6R0.2 C\C(=C/C(=O)C)\O 1P003CFY [0,0,0,0,0,1|2,0,1]=4 1299 B6R0.2 C\C(=C\C(=O)O)\I 1P00CS58 [0,0,0,0,0,1|1,0,1]=3 1300 B6R0.2 C\C(=C\C(=S)N)\N 1P01S7W5 [0,0,0,0,0,1|1,1,1]=4 1301 B6R0.2 ClC(=CC(=O)O)Cl 1P00AZBK [0,0,0,0,0,1|2,0,1]=4 1302 B6R0.2 ClC(CC(=O)O)Cl 1P027TVM [0,0,0,0,0,1|2,0,0]=3 1303 B6R0.2 FC(CC(=O)N)F 1P02856V [0,0,0,0,0,1|3,0,0]=4 1304 B6R0.2 FC(CC(=O)O)F 1P001O4C [0,0,0,0,0,1|2,0,0]=3 1305 B6R0.2 IC(=C)CC(=O)O 1P028XTD [0,0,0,0,0,1|1,0,2]=4 1306 B6R0.2 NC(=N)CC(=O)N 1P0035L1 [0,0,0,0,0,1|2,0,1]=4 1307 B6R0.2 NC(=N)NC(=O)C 1P0032OW [0,0,0,0,0,1|2,0,1]=4 1308 B6R0.2 NC(=N)NC(=O)N 1P003OAL [0,0,0,0,0,1|2,0,1]=4 1309 B6R0.2 NC(=N)NC(=O)N 1P003RAF [0,0,0,0,0,1|2,0,1]=4 1310 B6R0.2 NC(=N)NC(=O)N 1P006FEH [0,0,0,0,0,1|2,0,1]=4 1311 B6R0.2 NC(=O)CC(=O)N 1P0035L2 [0,0,0,0,0,1|2,0,1]=4 1312 B6R0.2 NC(=O)CC(=O)O 1P002NQP [0,0,0,0,0,1|1,0,1]=3 1313 B6R0.2 NC(=O)CC(=S)N 1P0066II [0,0,0,0,0,1|2,0,1]=4 1314 B6R0.2 NC(=O)NC(=O)N 1P003OV4 [0,0,0,0,0,1|2,0,1]=4 1315 B6R0.2 OB(CC(C)C)O 1P0035I8 [0,0,0,0,0,1|2,0,1]=4 1316 B6R0.2 [O-]C(=CC(=O)C)C 1P001DMI [0,0,0,0,0,1|2,0,1]=4 1317 B6R0.2 [O-]C(=CC(=O)C)C 1P007K19 [0,0,0,0,0,1|2,0,1]=4 1318 B6R0.2 [O-]C(=O)CC(=O)C 1P003B7E [0,0,0,0,0,1|1,0,2]=4 1319 B6R0.2 [O-]C(=O)CC(=O)C 1P003RRI [0,0,0,0,0,1|1,0,2]=4 1320 B6R0.2 [O-]C(=O)CC(=O)N 1P028GWT [0,0,0,0,0,1|1,0,2]=4 1321 B6R0.2 [O-]C(=O)CC(O)C 1P001MOO [0,0,0,0,0,1|1,0,1]=3 1322 B6R0.2 [O-]C(=O)C[C@@H](O)C 1P000XO5 [0,0,0,0,0,1|1,0,1]=3 1323 B6R0.2 [O-]C(=O)C[C@H](O)C 1P0032U9 [0,0,0,0,0,1|1,0,1]=3 1324 B6R0.2 [O-]C(=O)C[S+](C)C 1P00I931 [0,0,0,0,0,1|2,0,1]=4 1325 B6R0.2 [O-][N+](=O)CC(O)C 1P01AM6O [0,0,0,0,0,1|2,0,1]=4 1326 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P000730 [0,0,0,0,0,1|2,0,1]=4 1327 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P000KUZ [0,0,0,0,0,1|2,0,1]=4 1328 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P001JBG [0,0,0,0,0,1|2,0,1]=4 1329 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P001O7Y [0,0,0,0,0,1|2,0,1]=4 1330 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P001P65 [0,0,0,0,0,1|2,0,1]=4 1331 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P0034ZO [0,0,0,0,0,1|2,0,1]=4 1332 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P0035I1 [0,0,0,0,0,1|2,0,1]=4 1333 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P003A2R [0,0,0,0,0,1|2,0,1]=4 1334 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P003RWL [0,0,0,0,0,1|2,0,1]=4 1335 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P00AP2Z [0,0,0,0,0,1|2,0,1]=4 1336 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P00HXES [0,0,0,0,0,1|2,0,1]=4 1337 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P00I3HS [0,0,0,0,0,1|2,0,1]=4 1338 B6R0.2 [O-]\C(=C/C(=O)C)\C 1P00IKWB [0,0,0,0,0,1|2,0,1]=4 1339 B6R0.2 [O-]\C(=C\C(=O)C)\C 1P001CNL [0,0,0,0,0,1|2,0,1]=4 1340 B6R0.2 [O-]\C(=C\C(=O)C)\C 1P00IM16 [0,0,0,0,0,1|2,0,1]=4 1341 B3R0.1 BrCC=O 1P00AOKP [2,0,0,0,0,0|1,0,0]=3 1342 B3R0.1 CC=CBr 1P003EJ6 [2,0,0,0,0,0|1,0,1]=4 1343 B3R0.1 CCC=O 1P000KDZ [2,0,0,0,0,0|0,0,0]=2 1344 B3R0.1 CCCBr 1P003370 [2,0,0,0,0,0|1,0,1]=4 1345 B3R0.1 CCCI 1P003EWL [2,0,0,0,0,0|1,0,1]=4 1346 B3R0.1 CCCN 1P003TSK [2,0,0,0,0,0|1,0,1]=4 1347 B3R0.1 CCCN 1P00AQWV [2,0,0,0,0,0|1,0,1]=4 1348 B3R0.1 CCCN 1P00E0IW [2,0,0,0,0,0|1,0,1]=4 1349 B3R0.1 CCCO 1P0033AN [2,0,0,0,0,0|0,0,1]=3 1350 B3R0.1 CCC[CH2] 1P003OTI [2,0,0,0,0,0|1,0,1]=4 1351 B3R0.1 CCC[CH2] 1P00C3KK [2,0,0,0,0,0|1,0,1]=4 1352 B3R0.1 CCNN 1P0037OA [2,0,0,0,0,0|2,0,0]=4 1353 B3R0.1 CCNN 1P00ACTJ [2,0,0,0,0,0|2,0,0]=4 1354 B3R0.1 CCNN 1P019LMQ [2,0,0,0,0,0|2,0,0]=4 1355 B3R0.1 CCNO 1P0035UF [2,0,0,0,0,0|1,0,0]=3 1356 B3R0.1 CCON 1P003QFJ [2,0,0,0,0,0|2,0,0]=4 1357 B3R0.1 CCON 1P00EJ20 [2,0,0,0,0,0|2,0,0]=4 1358 B3R0.1 CC[Mg]Br 1P0035DY [2,0,0,0,0,0|2,0,0]=4 1359 B3R0.1 CC[Mg]Cl 1P003R04 [2,0,0,0,0,0|2,0,0]=4 1360 B3R0.1 CC[N-]C 1P0021R9 [2,0,0,0,0,0|2,0,0]=4 1361 B3R0.1 CNC=O 1P000KDY [2,0,0,0,0,0|1,0,0]=3 1362 B3R0.1 CNC=S 1P002E6Y [2,0,0,0,0,0|1,1,0]=4 1363 B3R0.1 CNCC 1P003TOC [2,0,0,0,0,0|2,0,0]=4 1364 B3R0.1 CNCC 1P00IBHJ [2,0,0,0,0,0|2,0,0]=4 1365 B3R0.1 CSC=C 1P0023XT [2,0,0,0,0,0|2,0,0]=4 1366 B3R0.1 CSCC 1P003SL2 [2,0,0,0,0,0|2,0,0]=4 1367 B3R0.1 C\C=C/Br 1P003PEF [2,0,0,0,0,0|1,0,1]=4 1368 B3R0.1 ICC=C 1P0034WJ [2,0,0,0,0,0|2,0,0]=4 1369 B3R0.1 NCC#C 1P002OTK [2,0,0,0,0,0|1,0,1]=4 1370 B3R0.1 NCC#C 1P003UFR [2,0,0,0,0,0|1,0,1]=4 1371 B3R0.1 NCC#N 1P0034X6 [2,0,0,0,0,0|1,0,1]=4 1372 B3R0.1 NCC#N 1P00IA89 [2,0,0,0,0,0|1,0,1]=4 1373 B3R0.1 NCC=C 1P0001ME [2,0,0,0,0,0|1,0,0]=3 1374 B3R0.1 NCCBr 1P0033N4 [2,0,0,0,0,0|1,0,1]=4 1375 B3R0.1 NCCCl 1P0033Q0 [2,0,0,0,0,0|1,0,1]=4 1376 B3R0.1 NCCF 1P0033SF [2,0,0,0,0,0|1,0,1]=4 1377 B3R0.1 NCCI 1P01ADFO [2,0,0,0,0,0|1,0,1]=4 1378 B3R0.1 NCCI 1P01AFKG [2,0,0,0,0,0|1,0,1]=4 1379 B3R0.1 NCCN 1P003ORO [2,0,0,0,0,0|1,0,1]=4 1380 B3R0.1 NCCN 1P003PTM [2,0,0,0,0,0|1,0,1]=4 1381 B3R0.1 NCCN 1P003PTN [2,0,0,0,0,0|1,0,1]=4 1382 B3R0.1 NCCN 1P003QZJ [2,0,0,0,0,0|1,0,1]=4 1383 B3R0.1 NCCN 1P003QZM [2,0,0,0,0,0|1,0,1]=4 1384 B3R0.1 NCCN 1P003QZN [2,0,0,0,0,0|1,0,1]=4 1385 B3R0.1 NCCN 1P00IMXZ [2,0,0,0,0,0|1,0,1]=4 1386 B3R0.1 NCCO 1P001G7D [2,0,0,0,0,0|0,0,1]=3 1387 B3R0.1 NCCO 1P002D2T [2,0,0,0,0,0|0,0,1]=3 1388 B3R0.1 NCCS 1P0033KV [2,0,0,0,0,0|0,1,1]=4 1389 B3R0.1 NCCS 1P0037H5 [2,0,0,0,0,0|0,1,1]=4 1390 B3R0.1 NNC=O 1P0035F5 [2,0,0,0,0,0|1,0,0]=3 1391 B3R0.1 N\C=N/O 1P003TJ5 [2,0,0,0,0,0|1,0,1]=4 1392 B3R0.1 O=CC#C 1P00EADX [2,0,0,0,0,0|0,0,2]=4 1393 B3R0.1 O=CC=O 1P007TP3 [2,0,0,0,0,0|1,0,1]=4 1394 B3R0.1 OCCBr 1P0033N1 [2,0,0,0,0,0|1,0,1]=4 1395 B3R0.1 OCCI 1P0037GU [2,0,0,0,0,0|1,0,1]=4 1396 B3R0.1 OCCO 1P0036BL [2,0,0,0,0,0|1,0,1]=4 1397 B3R0.1 OCCO 1P007OVX [2,0,0,0,0,0|1,0,1]=4 1398 B3R0.1 OCCS 1P0037WO [2,0,0,0,0,0|1,0,1]=4 1399 B3R0.1 SCC=C 1P003ID2 [2,0,0,0,0,0|2,0,0]=4 1400 B3R0.1 [C-]#[N+]CC 1P00EBTM [2,0,0,0,0,0|2,0,0]=4 1401 B3R0.1 [CH2-]CCC 1P003VLM [2,0,0,0,0,0|1,0,1]=4 1402 B3R0.1 [O-]CCC 1P00375V [2,0,0,0,0,0|0,0,2]=4 1403 B3R0.1 [O-]CCC 1P006XBD [2,0,0,0,0,0|0,0,2]=4 1404 B3R0.2 C(=O)([2H])[2H] 1P001X6E [2,0,0,0,0,0|2,0,0]=4 1405 B3R0.2 CB(O)O 1P000V65 [2,0,0,0,0,0|1,0,1]=4 1406 B3R0.2 CC(=C)Br 1P003H9H [2,0,0,0,0,0|1,0,1]=4 1407 B3R0.2 CC(=N)N 1P000LTV [2,0,0,0,0,0|1,0,1]=4 1408 B3R0.2 CC(=N)N 1P00AQWL [2,0,0,0,0,0|1,0,1]=4 1409 B3R0.2 CC(=N)N 1P00C7IS [2,0,0,0,0,0|1,0,1]=4 1410 B3R0.2 CC(=N)N 1P01FNSE [2,0,0,0,0,0|1,0,1]=4 1411 B3R0.2 CC(=O)Br 1P003O4B [2,0,0,0,0,0|1,0,0]=3 1412 B3R0.2 CC(=O)I 1P003O4D [2,0,0,0,0,0|1,0,0]=3 1413 B3R0.2 CC(=O)N 1P003O32 [2,0,0,0,0,0|0,0,1]=3 1414 B3R0.2 CC(=O)N 1P007M0A [2,0,0,0,0,0|0,0,1]=3 1415 B3R0.2 CC(=O)O 1P000R54 [2,0,0,0,0,0|0,0,0]=2 1416 B3R0.2 CC(=O)O 1P0011AC [2,0,0,0,0,0|0,0,0]=2 1417 B3R0.2 CC(=O)O 1P001AGE [2,0,0,0,0,0|0,0,0]=2 1418 B3R0.2 CC(=O)O 1P002JJY [2,0,0,0,0,0|0,0,0]=2 1419 B3R0.2 CC(=O)O 1P0035F2 [2,0,0,0,0,0|0,0,0]=2 1420 B3R0.2 CC(=O)O 1P0036MT [2,0,0,0,0,0|0,0,0]=2 1421 B3R0.2 CC(=O)O 1P003PIJ [2,0,0,0,0,0|0,0,0]=2 1422 B3R0.2 CC(=O)O 1P003QZL [2,0,0,0,0,0|0,0,0]=2 1423 B3R0.2 CC(=O)O 1P00BXZ6 [2,0,0,0,0,0|0,0,0]=2 1424 B3R0.2 CC(=O)O 1P00D56H [2,0,0,0,0,0|0,0,0]=2 1425 B3R0.2 CC(=O)O 1P00ILYO [2,0,0,0,0,0|0,0,0]=2 1426 B3R0.2 CC(=O)O 1P00JKYL [2,0,0,0,0,0|0,0,0]=2 1427 B3R0.2 CC(=O)O 1P01DOOL [2,0,0,0,0,0|0,0,0]=2 1428 B3R0.2 CC(=S)N 1P00365G [2,0,0,0,0,0|0,1,1]=4 1429 B3R0.2 CC(=S)O 1P00365H [2,0,0,0,0,0|0,1,0]=3 1430 B3R0.2 CC(Br)Br 1P003DOU [2,0,0,0,0,0|2,0,0]=4 1431 B3R0.2 CC(Br)C 1P0035IR [2,0,0,0,0,0|1,0,1]=4 1432 B3R0.2 CC(Br)Cl 1P003EJ5 [2,0,0,0,0,0|2,0,0]=4 1433 B3R0.2 CC(N)C 1P001OLC [2,0,0,0,0,0|0,0,1]=3 1434 B3R0.2 CC(N)C 1P00IMYX [2,0,0,0,0,0|0,0,1]=3 1435 B3R0.2 CC(O)C 1P001MMY [2,0,0,0,0,0|1,0,0]=3 1436 B3R0.2 CC(O)C 1P003OFY [2,0,0,0,0,0|1,0,0]=3 1437 B3R0.2 CC(O)C 1P007YD2 [2,0,0,0,0,0|1,0,0]=3 1438 B3R0.2 CC(O)C 1P00BEMS [2,0,0,0,0,0|1,0,0]=3 1439 B3R0.2 CC(S)C 1P003ICZ [2,0,0,0,0,0|1,0,1]=4 1440 B3R0.2 CN(N)C 1P003DPD [2,0,0,0,0,0|1,0,1]=4 1441 B3R0.2 CN(O)C 1P001X7Y [2,0,0,0,0,0|2,0,0]=4 1442 B3R0.2 CP(=O)C 1P00371X [2,0,0,0,0,0|2,0,0]=4 1443 B3R0.2 CS(=O)C 1P0037AO [2,0,0,0,0,0|2,0,0]=4 1444 B3R0.2 CS(=O)Cl 1P005R2U [2,0,0,0,0,0|2,0,0]=4 1445 B3R0.2 CS(=O)N 1P0035LH [2,0,0,0,0,0|1,0,0]=3 1446 B3R0.2 C[N+](=C)C 1P003QEY [2,0,0,0,0,0|2,0,0]=4 1447 B3R0.2 C[Se](=O)C 1P00DVQU [2,0,0,0,0,0|2,0,0]=4 1448 B3R0.2 C[Sn](=O)C 1P007OFO [2,0,0,0,0,0|2,0,0]=4 1449 B3R0.2 ClC(=O)Cl 1P006VD2 [2,0,0,0,0,0|2,0,0]=4 1450 B3R0.2 ClC(=O)[Au] 1P003PA1 [2,0,0,0,0,0|2,0,0]=4 1451 B3R0.2 NC(=N)Cl 1P002ZIX [2,0,0,0,0,0|2,0,0]=4 1452 B3R0.2 NC(=N)N 1P002GFN [2,0,0,0,0,0|2,0,0]=4 1453 B3R0.2 NC(=N)N 1P0035FZ [2,0,0,0,0,0|2,0,0]=4 1454 B3R0.2 NC(=N)N 1P00AL3A [2,0,0,0,0,0|2,0,0]=4 1455 B3R0.2 NC(=N)N 1P00IB06 [2,0,0,0,0,0|2,0,0]=4 1456 B3R0.2 NC(=O)N 1P003690 [2,0,0,0,0,0|1,0,0]=3 1457 B3R0.2 NC(=S)N 1P00365T [2,0,0,0,0,0|1,1,0]=4 1458 B3R0.2 NC(=[Se])N 1P003UP8 [2,0,0,0,0,0|1,1,0]=4 1459 B3R0.2 N[13C](=O)N 1P00IASO [2,0,0,0,0,0|1,0,0]=3 1460 B3R0.2 OC(=O)O 1P0013DE [2,0,0,0,0,0|1,0,0]=3 1461 B3R0.2 OC(=O)O 1P001M71 [2,0,0,0,0,0|1,0,0]=3 1462 B3R0.2 OC(=O)O 1P002KHE [2,0,0,0,0,0|1,0,0]=3 1463 B3R0.2 OC(=O)O 1P003P80 [2,0,0,0,0,0|1,0,0]=3 1464 B3R0.2 OC(=O)O 1P00IKVL [2,0,0,0,0,0|1,0,0]=3 1465 B3R0.2 ON(=O)=O 1P001PP0 [2,0,0,0,0,0|2,0,0]=4 1466 B3R0.2 OP(=O)=O 1P001444 [2,0,0,0,0,0|2,0,0]=4 1467 B3R0.2 OP(=O)=O 1P0014AD [2,0,0,0,0,0|2,0,0]=4 1468 B3R0.2 OP(=O)=O 1P00IM6X [2,0,0,0,0,0|2,0,0]=4 1469 B3R0.2 OP(=O)=O 1P01R1QT [2,0,0,0,0,0|2,0,0]=4 1470 B3R0.2 OP(=O)O 1P003VGE [2,0,0,0,0,0|2,0,0]=4 1471 B3R0.2 OP(=O)O 1P009DQY [2,0,0,0,0,0|2,0,0]=4 1472 B3R0.2 OS(=O)O 1P00IDCS [2,0,0,0,0,0|2,0,0]=4 1473 B3R0.2 O[13C](=O)O 1P004M1T [2,0,0,0,0,0|1,0,0]=3 1474 B3R0.2 O[I](=O)=O 1P0035HP [2,0,0,0,0,0|2,0,0]=4 1475 B3R0.2 O[I](=O)=O 1P008YG5 [2,0,0,0,0,0|2,0,0]=4 1476 B3R0.2 O[Se](=O)O 1P0057W7 [2,0,0,0,0,0|2,0,0]=4 1477 B3R0.2 O[Si](=O)O 1P00040Q [2,0,0,0,0,0|1,1,0]=4 1478 B3R0.2 [13CH3]C(=O)O 1P001P4Q [2,0,0,0,0,0|0,0,0]=2 1479 B3R0.2 [15NH2]C(=O)[15NH2] 1P002J3S [2,0,0,0,0,0|1,0,0]=3 1480 B3R0.2 [15NH2][13C](=O)[15NH2] 1P00EE58 [2,0,0,0,0,0|1,0,0]=3 1481 B3R0.2 [BH3-]C(=O)[O-] 1P00JO85 [2,0,0,0,0,0|1,0,1]=4 1482 B3R0.2 [CH-]=C(C)C 1P00FGTR [2,0,0,0,0,0|2,0,0]=4 1483 B3R0.2 [CH2-]C(=C)C 1P009ECO [2,0,0,0,0,0|1,0,1]=4 1484 B3R0.2 [O-]C(=O)C 1P000EWY [2,0,0,0,0,0|0,0,1]=3 1485 B3R0.2 [O-]C(=O)C 1P000WZ6 [2,0,0,0,0,0|0,0,1]=3 1486 B3R0.2 [O-]C(=O)C 1P001QE8 [2,0,0,0,0,0|0,0,1]=3 1487 B3R0.2 [O-]C(=O)C 1P001T3R [2,0,0,0,0,0|0,0,1]=3 1488 B3R0.2 [O-]C(=O)C 1P002JR8 [2,0,0,0,0,0|0,0,1]=3 1489 B3R0.2 [O-]C(=O)C 1P002R03 [2,0,0,0,0,0|0,0,1]=3 1490 B3R0.2 [O-]C(=O)C 1P0030OU [2,0,0,0,0,0|0,0,1]=3 1491 B3R0.2 [O-]C(=O)C 1P00326R [2,0,0,0,0,0|0,0,1]=3 1492 B3R0.2 [O-]C(=O)C 1P00351R [2,0,0,0,0,0|0,0,1]=3 1493 B3R0.2 [O-]C(=O)C 1P00353M [2,0,0,0,0,0|0,0,1]=3 1494 B3R0.2 [O-]C(=O)C 1P0035L7 [2,0,0,0,0,0|0,0,1]=3 1495 B3R0.2 [O-]C(=O)C 1P0035L9 [2,0,0,0,0,0|0,0,1]=3 1496 B3R0.2 [O-]C(=O)C 1P0035LA [2,0,0,0,0,0|0,0,1]=3 1497 B3R0.2 [O-]C(=O)C 1P0035WS [2,0,0,0,0,0|0,0,1]=3 1498 B3R0.2 [O-]C(=O)C 1P00361O [2,0,0,0,0,0|0,0,1]=3 1499 B3R0.2 [O-]C(=O)C 1P00369N [2,0,0,0,0,0|0,0,1]=3 1500 B3R0.2 [O-]C(=O)C 1P003784 [2,0,0,0,0,0|0,0,1]=3 1501 B3R0.2 [O-]C(=O)C 1P0037JI [2,0,0,0,0,0|0,0,1]=3 1502 B3R0.2 [O-]C(=O)C 1P0037KC [2,0,0,0,0,0|0,0,1]=3 1503 B3R0.2 [O-]C(=O)C 1P0037P4 [2,0,0,0,0,0|0,0,1]=3 1504 B3R0.2 [O-]C(=O)C 1P003ODR [2,0,0,0,0,0|0,0,1]=3 1505 B3R0.2 [O-]C(=O)C 1P003OFF [2,0,0,0,0,0|0,0,1]=3 1506 B3R0.2 [O-]C(=O)C 1P003OUB [2,0,0,0,0,0|0,0,1]=3 1507 B3R0.2 [O-]C(=O)C 1P003PHP [2,0,0,0,0,0|0,0,1]=3 1508 B3R0.2 [O-]C(=O)C 1P003PHQ [2,0,0,0,0,0|0,0,1]=3 1509 B3R0.2 [O-]C(=O)C 1P003REN [2,0,0,0,0,0|0,0,1]=3 1510 B3R0.2 [O-]C(=O)C 1P003RPL [2,0,0,0,0,0|0,0,1]=3 1511 B3R0.2 [O-]C(=O)C 1P003RRG [2,0,0,0,0,0|0,0,1]=3 1512 B3R0.2 [O-]C(=O)C 1P003RRH [2,0,0,0,0,0|0,0,1]=3 1513 B3R0.2 [O-]C(=O)C 1P003RV2 [2,0,0,0,0,0|0,0,1]=3 1514 B3R0.2 [O-]C(=O)C 1P003TJZ [2,0,0,0,0,0|0,0,1]=3 1515 B3R0.2 [O-]C(=O)C 1P003ULV [2,0,0,0,0,0|0,0,1]=3 1516 B3R0.2 [O-]C(=O)C 1P003UVW [2,0,0,0,0,0|0,0,1]=3 1517 B3R0.2 [O-]C(=O)C 1P003UW9 [2,0,0,0,0,0|0,0,1]=3 1518 B3R0.2 [O-]C(=O)C 1P003V2Z [2,0,0,0,0,0|0,0,1]=3 1519 B3R0.2 [O-]C(=O)C 1P003VA8 [2,0,0,0,0,0|0,0,1]=3 1520 B3R0.2 [O-]C(=O)C 1P005IJZ [2,0,0,0,0,0|0,0,1]=3 1521 B3R0.2 [O-]C(=O)C 1P005T7L [2,0,0,0,0,0|0,0,1]=3 1522 B3R0.2 [O-]C(=O)C 1P008UKT [2,0,0,0,0,0|0,0,1]=3 1523 B3R0.2 [O-]C(=O)C 1P00HY06 [2,0,0,0,0,0|0,0,1]=3 1524 B3R0.2 [O-]C(=O)C 1P00IAP7 [2,0,0,0,0,0|0,0,1]=3 1525 B3R0.2 [O-]C(=O)C 1P00IB5Y [2,0,0,0,0,0|0,0,1]=3 1526 B3R0.2 [O-]C(=O)C 1P00IBAT [2,0,0,0,0,0|0,0,1]=3 1527 B3R0.2 [O-]C(=O)C 1P00IKWW [2,0,0,0,0,0|0,0,1]=3 1528 B3R0.2 [O-]C(=O)C 1P01DOOH [2,0,0,0,0,0|0,0,1]=3 1529 B3R0.2 [O-]C(=O)C 1P01WTSB [2,0,0,0,0,0|0,0,1]=3 1530 B3R0.2 [O-]C(=O)N 1P007BXH [2,0,0,0,0,0|0,0,1]=3 1531 B3R0.2 [O-]C(=O)O 1P0035YU [2,0,0,0,0,0|1,0,0]=3 1532 B3R0.2 [O-]C(=O)O 1P00388R [2,0,0,0,0,0|1,0,0]=3 1533 B3R0.2 [O-]C(=O)O 1P0039FX [2,0,0,0,0,0|1,0,0]=3 1534 B3R0.2 [O-]C(=O)O 1P003RVA [2,0,0,0,0,0|1,0,0]=3 1535 B3R0.2 [O-]C(=O)O 1P0077K1 [2,0,0,0,0,0|1,0,0]=3 1536 B3R0.2 [O-]C(=O)[2H] 1P00C5WO [2,0,0,0,0,0|1,0,1]=4 1537 B3R0.2 [O-]C(=O)[O-] 1P0002V3 [2,0,0,0,0,0|1,0,1]=4 1538 B3R0.2 [O-]C(=O)[O-] 1P000RK5 [2,0,0,0,0,0|1,0,1]=4 1539 B3R0.2 [O-]C(=O)[O-] 1P001UH8 [2,0,0,0,0,0|1,0,1]=4 1540 B3R0.2 [O-]C(=O)[O-] 1P002M9Q [2,0,0,0,0,0|1,0,1]=4 1541 B3R0.2 [O-]C(=O)[O-] 1P002NIZ [2,0,0,0,0,0|1,0,1]=4 1542 B3R0.2 [O-]C(=O)[O-] 1P002ZMC [2,0,0,0,0,0|1,0,1]=4 1543 B3R0.2 [O-]C(=O)[O-] 1P0034Y4 [2,0,0,0,0,0|1,0,1]=4 1544 B3R0.2 [O-]C(=O)[O-] 1P00351I [2,0,0,0,0,0|1,0,1]=4 1545 B3R0.2 [O-]C(=O)[O-] 1P0035L8 [2,0,0,0,0,0|1,0,1]=4 1546 B3R0.2 [O-]C(=O)[O-] 1P0035YY [2,0,0,0,0,0|1,0,1]=4 1547 B3R0.2 [O-]C(=O)[O-] 1P00362H [2,0,0,0,0,0|1,0,1]=4 1548 B3R0.2 [O-]C(=O)[O-] 1P00369O [2,0,0,0,0,0|1,0,1]=4 1549 B3R0.2 [O-]C(=O)[O-] 1P0036F5 [2,0,0,0,0,0|1,0,1]=4 1550 B3R0.2 [O-]C(=O)[O-] 1P0037S2 [2,0,0,0,0,0|1,0,1]=4 1551 B3R0.2 [O-]C(=O)[O-] 1P003B00 [2,0,0,0,0,0|1,0,1]=4 1552 B3R0.2 [O-]C(=O)[O-] 1P003OB3 [2,0,0,0,0,0|1,0,1]=4 1553 B3R0.2 [O-]C(=O)[O-] 1P003P3N [2,0,0,0,0,0|1,0,1]=4 1554 B3R0.2 [O-]C(=O)[O-] 1P003PHJ [2,0,0,0,0,0|1,0,1]=4 1555 B3R0.2 [O-]C(=O)[O-] 1P003PHK [2,0,0,0,0,0|1,0,1]=4 1556 B3R0.2 [O-]C(=O)[O-] 1P003PJX [2,0,0,0,0,0|1,0,1]=4 1557 B3R0.2 [O-]C(=O)[O-] 1P003R0X [2,0,0,0,0,0|1,0,1]=4 1558 B3R0.2 [O-]C(=O)[O-] 1P003R6D [2,0,0,0,0,0|1,0,1]=4 1559 B3R0.2 [O-]C(=O)[O-] 1P003RRQ [2,0,0,0,0,0|1,0,1]=4 1560 B3R0.2 [O-]C(=O)[O-] 1P003TF3 [2,0,0,0,0,0|1,0,1]=4 1561 B3R0.2 [O-]C(=O)[O-] 1P003ULX [2,0,0,0,0,0|1,0,1]=4 1562 B3R0.2 [O-]C(=O)[O-] 1P003USM [2,0,0,0,0,0|1,0,1]=4 1563 B3R0.2 [O-]C(=O)[O-] 1P003USN [2,0,0,0,0,0|1,0,1]=4 1564 B3R0.2 [O-]C(=O)[O-] 1P003VT9 [2,0,0,0,0,0|1,0,1]=4 1565 B3R0.2 [O-]C(=O)[O-] 1P003VTP [2,0,0,0,0,0|1,0,1]=4 1566 B3R0.2 [O-]C(=O)[O-] 1P004KF2 [2,0,0,0,0,0|1,0,1]=4 1567 B3R0.2 [O-]C(=O)[O-] 1P0065CX [2,0,0,0,0,0|1,0,1]=4 1568 B3R0.2 [O-]C(=O)[O-] 1P0079KL [2,0,0,0,0,0|1,0,1]=4 1569 B3R0.2 [O-]C(=O)[O-] 1P0081LU [2,0,0,0,0,0|1,0,1]=4 1570 B3R0.2 [O-]C(=O)[O-] 1P0086OD [2,0,0,0,0,0|1,0,1]=4 1571 B3R0.2 [O-]C(=O)[O-] 1P00BDMM [2,0,0,0,0,0|1,0,1]=4 1572 B3R0.2 [O-]C(=O)[O-] 1P00D01T [2,0,0,0,0,0|1,0,1]=4 1573 B3R0.2 [O-]C(=O)[O-] 1P00DCSY [2,0,0,0,0,0|1,0,1]=4 1574 B3R0.2 [O-]C(=O)[O-] 1P00EB2M [2,0,0,0,0,0|1,0,1]=4 1575 B3R0.2 [O-]C(=O)[O-] 1P00EDW8 [2,0,0,0,0,0|1,0,1]=4 1576 B3R0.2 [O-]C(=O)[O-] 1P00EDW9 [2,0,0,0,0,0|1,0,1]=4 1577 B3R0.2 [O-]C(=O)[O-] 1P00G9SD [2,0,0,0,0,0|1,0,1]=4 1578 B3R0.2 [O-]C(=O)[O-] 1P00IBQQ [2,0,0,0,0,0|1,0,1]=4 1579 B3R0.2 [O-]C(=O)[O-] 1P00IM29 [2,0,0,0,0,0|1,0,1]=4 1580 B3R0.2 [O-]C(=O)[O-] 1P00JN1H [2,0,0,0,0,0|1,0,1]=4 1581 B3R0.2 [O-]C(C)C 1P002KTZ [2,0,0,0,0,0|1,0,1]=4 1582 B3R0.2 [O-]C(C)C 1P0034X0 [2,0,0,0,0,0|1,0,1]=4 1583 B3R0.2 [O-]C(C)C 1P0036DB [2,0,0,0,0,0|1,0,1]=4 1584 B3R0.2 [O-]C(C)C 1P003PUL [2,0,0,0,0,0|1,0,1]=4 1585 B3R0.2 [O-]C(C)C 1P003VJH [2,0,0,0,0,0|1,0,1]=4 1586 B3R0.2 [O-]C(C)C 1P00I4OE [2,0,0,0,0,0|1,0,1]=4 1587 B3R0.2 [O-]P(=O)O 1P001C6A [2,0,0,0,0,0|2,0,0]=4 1588 B3R0.2 [O-]P(=O)O 1P0059FV [2,0,0,0,0,0|2,0,0]=4 1589 B3R0.2 [O-]S(=O)C 1P0028VY [2,0,0,0,0,0|1,0,1]=4 1590 B3R0.2 [O-]S(=O)O 1P003USH [2,0,0,0,0,0|2,0,0]=4 1591 B3R0.2 [O-][13C](=O)C 1P002NN0 [2,0,0,0,0,0|0,0,1]=3 1592 B3R0.2 [O-][13C](=O)[13CH3] 1P00EB1X [2,0,0,0,0,0|0,0,1]=3 1593 B3R0.2 [O-][13C](=O)[O-] 1P003OFJ [2,0,0,0,0,0|1,0,1]=4 1594 B3R0.2 [O-][13C](=O)[O-] 1P00GVQ7 [2,0,0,0,0,0|1,0,1]=4 1595 B3R0.2 [O-][Si](=O)O 1P0039YQ [2,0,0,0,0,0|1,1,0]=4 1596 B3R0.2 [S-]C(=O)C 1P0035Z4 [2,0,0,0,0,0|0,1,0]=3 1597 B3R0.2 [S-]C(=S)C 1P027XF9 [2,0,0,0,0,0|0,2,0]=4 1598 B3R0.2 [S-]C(=S)N 1P0034XC [2,0,0,0,0,0|0,2,0]=4 1599 B5R0.1 C=COC(C)C 1P00369A [1,1,0,0,0,0|2,0,0]=4 1600 B5R0.1 CC#CC(=O)C 1P008R9O [1,1,0,0,0,0|1,0,1]=4 1601 B5R0.1 CC#CC(=O)Cl 1P01GBON [1,1,0,0,0,0|1,0,1]=4 1602 B5R0.1 CC#CC(=O)N 1P0284HG [1,1,0,0,0,0|1,0,1]=4 1603 B5R0.1 CC#CC(=O)O 1P0037I0 [1,1,0,0,0,0|0,0,1]=3 1604 B5R0.1 CC#CC(N)C 1P01EBZN [1,1,0,0,0,0|1,0,1]=4 1605 B5R0.1 CC(=C)CCBr 1P002D6V [1,1,0,0,0,0|2,0,0]=4 1606 B5R0.1 CC(=C)CCI 1P01BBJI [1,1,0,0,0,0|2,0,0]=4 1607 B5R0.1 CC(=C)CCN 1P01AVCN [1,1,0,0,0,0|2,0,0]=4 1608 B5R0.1 CC(=C)CCO 1P003K67 [1,1,0,0,0,0|2,0,0]=4 1609 B5R0.1 CC(=C)CNN 1P001E50 [1,1,0,0,0,0|2,0,0]=4 1610 B5R0.1 CC(=C)CON 1P00DCMU [1,1,0,0,0,0|2,0,0]=4 1611 B5R0.1 CC(=CC#N)N 1P003JE4 [1,1,0,0,0,0|1,0,1]=4 1612 B5R0.1 CC(=O)C=NO 1P00314I [1,1,0,0,0,0|1,0,1]=4 1613 B5R0.1 CC(=O)CC#N 1P002PIW [1,1,0,0,0,0|1,0,1]=4 1614 B5R0.1 CC(=O)CC=C 1P001AA7 [1,1,0,0,0,0|1,0,1]=4 1615 B5R0.1 CC(=O)CCBr 1P002W1I [1,1,0,0,0,0|1,0,0]=3 1616 B5R0.1 CC(=O)CCCl 1P0036JS [1,1,0,0,0,0|1,0,0]=3 1617 B5R0.1 CC(=O)CCI 1P028RF9 [1,1,0,0,0,0|1,0,0]=3 1618 B5R0.1 CC(=O)CCN 1P00I4LI [1,1,0,0,0,0|1,0,0]=3 1619 B5R0.1 CC(=O)CCO 1P0034IJ [1,1,0,0,0,0|1,0,0]=3 1620 B5R0.1 CC(=O)NCO 1P0037Q6 [1,1,0,0,0,0|2,0,0]=4 1621 B5R0.1 CC(=O)OCBr 1P003P1B [1,1,0,0,0,0|2,0,0]=4 1622 B5R0.1 CC(=O)OCCl 1P0037HI [1,1,0,0,0,0|2,0,0]=4 1623 B5R0.1 CC(=O)OCI 1P01BE17 [1,1,0,0,0,0|2,0,0]=4 1624 B5R0.1 CC(=O)SCBr 1P01BIB9 [1,1,0,0,0,0|2,0,0]=4 1625 B5R0.1 CC(=O)SCI 1P01EMD1 [1,1,0,0,0,0|2,0,0]=4 1626 B5R0.1 CC(C=NO)C 1P00AOPK [1,1,0,0,0,0|1,0,0]=3 1627 B5R0.1 CC(CC#C)N 1P024W9R [1,1,0,0,0,0|1,0,1]=4 1628 B5R0.1 CC(CC#N)N 1P00DM06 [1,1,0,0,0,0|1,0,1]=4 1629 B5R0.1 CC(CC=C)Br 1P00CRRM [1,1,0,0,0,0|2,0,0]=4 1630 B5R0.1 CC(CC=C)I 1P027V5I [1,1,0,0,0,0|2,0,0]=4 1631 B5R0.1 CC(CC=C)N 1P01AJI0 [1,1,0,0,0,0|1,0,0]=3 1632 B5R0.1 CC(CC=C)O 1P003MEX [1,1,0,0,0,0|2,0,0]=4 1633 B5R0.1 CC(CCBr)O 1P00EBF3 [1,1,0,0,0,0|1,0,1]=4 1634 B5R0.1 CC(CCCl)N 1P01BYC3 [1,1,0,0,0,0|1,0,1]=4 1635 B5R0.1 CC(CCCl)O 1P01B263 [1,1,0,0,0,0|1,0,1]=4 1636 B5R0.1 CC(CCN)O 1P00C8Q0 [1,1,0,0,0,0|1,0,1]=4 1637 B5R0.1 CC(CCO)Cl 1P01AV14 [1,1,0,0,0,0|1,0,1]=4 1638 B5R0.1 CC(CCO)F 1P0280HC [1,1,0,0,0,0|1,0,1]=4 1639 B5R0.1 CC(CCO)N 1P002WI2 [1,1,0,0,0,0|0,0,1]=3 1640 B5R0.1 CC(CCO)S 1P019RAT [1,1,0,0,0,0|1,0,1]=4 1641 B5R0.1 CC(CCS)N 1P028S04 [1,1,0,0,0,0|0,1,1]=4 1642 B5R0.1 CC(CNN)O 1P00757H [1,1,0,0,0,0|1,0,1]=4 1643 B5R0.1 CC(CON)O 1P00CNOF [1,1,0,0,0,0|1,0,1]=4 1644 B5R0.1 CC(CON)O 1P00IJ60 [1,1,0,0,0,0|1,0,1]=4 1645 B5R0.1 CC(N=C=O)C 1P0027IJ [1,1,0,0,0,0|1,0,1]=4 1646 B5R0.1 CC(\C=N\O)C 1P01GJ99 [1,1,0,0,0,0|1,0,0]=3 1647 B5R0.1 CC=CC(=O)C 1P0039SF [1,1,0,0,0,0|1,0,1]=4 1648 B5R0.1 CC=CC(=O)N 1P002NE7 [1,1,0,0,0,0|1,0,1]=4 1649 B5R0.1 CCCB(O)O 1P0025SU [1,1,0,0,0,0|1,0,1]=4 1650 B5R0.1 CCCC(=C)C 1P003I23 [1,1,0,0,0,0|2,0,0]=4 1651 B5R0.1 CCCC(=N)N 1P003ABQ [1,1,0,0,0,0|2,0,0]=4 1652 B5R0.1 CCCC(=O)C 1P0038PH [1,1,0,0,0,0|1,0,0]=3 1653 B5R0.1 CCCC(=O)N 1P003P36 [1,1,0,0,0,0|1,0,0]=3 1654 B5R0.1 CCCC(=O)O 1P0038GU [1,1,0,0,0,0|0,0,0]=2 1655 B5R0.1 CCCC(=O)[O-] 1P00EBJ7 [1,1,0,0,0,0|0,0,1]=3 1656 B5R0.1 CCCC(=O)[O-] 1P01XCJO [1,1,0,0,0,0|0,0,1]=3 1657 B5R0.1 CCCC(=S)N 1P001WK6 [1,1,0,0,0,0|1,1,0]=4 1658 B5R0.1 CCCC(=S)O 1P003K88 [1,1,0,0,0,0|0,1,0]=3 1659 B5R0.1 CCCC(N)C 1P003H0I [1,1,0,0,0,0|1,0,1]=4 1660 B5R0.1 CCCC(N)C 1P019VIM [1,1,0,0,0,0|1,0,1]=4 1661 B5R0.1 CCCC(O)C 1P00F3M1 [1,1,0,0,0,0|1,0,1]=4 1662 B5R0.1 CCCN(=O)=O 1P003F15 [1,1,0,0,0,0|1,0,1]=4 1663 B5R0.1 CCCS(=O)Cl 1P002N6R [1,1,0,0,0,0|2,0,0]=4 1664 B5R0.1 CCCS(=O)N 1P01BFYB [1,1,0,0,0,0|2,0,0]=4 1665 B5R0.1 CCC[C@@H](N)C 1P003AOE [1,1,0,0,0,0|1,0,1]=4 1666 B5R0.1 CCC[C@@H](O)C 1P002SLB [1,1,0,0,0,0|1,0,1]=4 1667 B5R0.1 CCC[C@H](N)C 1P01DUMC [1,1,0,0,0,0|1,0,1]=4 1668 B5R0.1 CCC[C@H](O)C 1P0032K0 [1,1,0,0,0,0|1,0,1]=4 1669 B5R0.1 CCNC(=N)N 1P003TH2 [1,1,0,0,0,0|2,0,0]=4 1670 B5R0.1 CCNC(=O)C 1P003TGP [1,1,0,0,0,0|1,0,0]=3 1671 B5R0.1 CCNC(=O)N 1P0035E0 [1,1,0,0,0,0|1,0,0]=3 1672 B5R0.1 CCNC(=S)N 1P003R0B [1,1,0,0,0,0|1,1,0]=4 1673 B5R0.1 CCOC(=N)C 1P0035CH [1,1,0,0,0,0|2,0,0]=4 1674 B5R0.1 CCOC(=O)C 1P001G6Z [1,1,0,0,0,0|1,0,0]=3 1675 B5R0.1 CCOC(=O)N 1P003691 [1,1,0,0,0,0|1,0,0]=3 1676 B5R0.1 CCOC(=S)C 1P003QF6 [1,1,0,0,0,0|1,1,0]=4 1677 B5R0.1 CCOC(=S)Cl 1P007LT2 [1,1,0,0,0,0|1,1,0]=4 1678 B5R0.1 CCOC(=S)N 1P00391U [1,1,0,0,0,0|1,1,0]=4 1679 B5R0.1 CCOP(=O)C 1P001V0C [1,1,0,0,0,0|2,0,0]=4 1680 B5R0.1 CCSC(=N)N 1P003UPH [1,1,0,0,0,0|2,0,0]=4 1681 B5R0.1 CC[O+]=C(N)N 1P00BZYF [1,1,0,0,0,0|2,0,0]=4 1682 B5R0.1 CN(CCO)N 1P028MN5 [1,1,0,0,0,0|1,0,1]=4 1683 B5R0.1 CNCC(=C)Br 1P02823C [1,1,0,0,0,0|2,0,0]=4 1684 B5R0.1 CNCC(=C)C 1P01BV54 [1,1,0,0,0,0|2,0,0]=4 1685 B5R0.1 CNCC(=C)F 1P028F1V [1,1,0,0,0,0|2,0,0]=4 1686 B5R0.1 CNCC(=O)N 1P0033CB [1,1,0,0,0,0|1,0,0]=3 1687 B5R0.1 CNCC(=O)O 1P003UNZ [1,1,0,0,0,0|0,0,0]=2 1688 B5R0.1 CNCC(=O)O 1P003UO1 [1,1,0,0,0,0|0,0,0]=2 1689 B5R0.1 CNCC(N)C 1P019ZXS [1,1,0,0,0,0|1,0,1]=4 1690 B5R0.1 CNCC(O)C 1P001XCL [1,1,0,0,0,0|1,0,1]=4 1691 B5R0.1 CNC[C@@H](O)C 1P00FID0 [1,1,0,0,0,0|1,0,1]=4 1692 B5R0.1 CNC[C@@H](O)C 1P01BB67 [1,1,0,0,0,0|1,0,1]=4 1693 B5R0.1 CNC[C@H](O)C 1P00A1NI [1,1,0,0,0,0|1,0,1]=4 1694 B5R0.1 CNC[C@H](O)C 1P01BAVA [1,1,0,0,0,0|1,0,1]=4 1695 B5R0.1 CNNC(=O)C 1P0284CW [1,1,0,0,0,0|2,0,0]=4 1696 B5R0.1 CNOC(=O)C 1P003TW6 [1,1,0,0,0,0|2,0,0]=4 1697 B5R0.1 COCC(=C)Br 1P003ZIJ [1,1,0,0,0,0|2,0,0]=4 1698 B5R0.1 COCC(=C)C 1P00CC6P [1,1,0,0,0,0|2,0,0]=4 1699 B5R0.1 COCC(=N)N 1P002EXM [1,1,0,0,0,0|2,0,0]=4 1700 B5R0.1 COCC(=O)C 1P0035LL [1,1,0,0,0,0|1,0,0]=3 1701 B5R0.1 COCC(=O)Cl 1P003RYU [1,1,0,0,0,0|1,0,0]=3 1702 B5R0.1 COCC(=O)N 1P001UIN [1,1,0,0,0,0|1,0,0]=3 1703 B5R0.1 COCC(=O)O 1P0035LK [1,1,0,0,0,0|0,0,0]=2 1704 B5R0.1 COCC(=S)N 1P00PGHJ [1,1,0,0,0,0|1,1,0]=4 1705 B5R0.1 COCC(Br)C 1P007OXE [1,1,0,0,0,0|1,0,1]=4 1706 B5R0.1 COCC(I)C 1P01C0MQ [1,1,0,0,0,0|1,0,1]=4 1707 B5R0.1 COCC(N)C 1P00IC7T [1,1,0,0,0,0|0,0,1]=3 1708 B5R0.1 COCC(O)C 1P003399 [1,1,0,0,0,0|1,0,1]=4 1709 B5R0.1 COCC(S)C 1P0289F0 [1,1,0,0,0,0|1,0,1]=4 1710 B5R0.1 COC[C@@H](N)C 1P019T8E [1,1,0,0,0,0|0,0,1]=3 1711 B5R0.1 COC[C@@H](O)C 1P002U54 [1,1,0,0,0,0|1,0,1]=4 1712 B5R0.1 COC[C@H](N)C 1P003741 [1,1,0,0,0,0|0,0,1]=3 1713 B5R0.1 COC[C@H](N)C 1P003CJ4 [1,1,0,0,0,0|0,0,1]=3 1714 B5R0.1 COC[C@H](O)C 1P003960 [1,1,0,0,0,0|1,0,1]=4 1715 B5R0.1 CONC(=O)C 1P0037YO [1,1,0,0,0,0|2,0,0]=4 1716 B5R0.1 CONC(=O)N 1P00CZW1 [1,1,0,0,0,0|2,0,0]=4 1717 B5R0.1 CONC(C)C 1P01A1JI [1,1,0,0,0,0|2,0,0]=4 1718 B5R0.1 CS(=O)CCCl 1P01C4QD [1,1,0,0,0,0|2,0,0]=4 1719 B5R0.1 CS(=O)CCN 1P00DGD5 [1,1,0,0,0,0|2,0,0]=4 1720 B5R0.1 CSCC(=N)N 1P00VW0I [1,1,0,0,0,0|2,0,0]=4 1721 B5R0.1 CSCC(=O)C 1P001GCU [1,1,0,0,0,0|1,0,0]=3 1722 B5R0.1 CSCC(=O)Cl 1P007DQ1 [1,1,0,0,0,0|1,0,0]=3 1723 B5R0.1 CSCC(=O)N 1P0039C2 [1,1,0,0,0,0|1,0,0]=3 1724 B5R0.1 CSCC(=O)O 1P003CI8 [1,1,0,0,0,0|0,0,0]=2 1725 B5R0.1 CSCC(=S)N 1P001EKS [1,1,0,0,0,0|1,1,0]=4 1726 B5R0.1 CSCC(N)C 1P018SKQ [1,1,0,0,0,0|0,1,1]=4 1727 B5R0.1 CSCC(O)C 1P00FVJJ [1,1,0,0,0,0|1,0,1]=4 1728 B5R0.1 CSCS(=O)C 1P003SLK [1,1,0,0,0,0|2,0,0]=4 1729 B5R0.1 CSC[C@@H](N)C 1P024Q9Z [1,1,0,0,0,0|0,1,1]=4 1730 B5R0.1 CSC[C@H](N)C 1P028CDR [1,1,0,0,0,0|0,1,1]=4 1731 B5R0.1 C[C@@H](CC#C)N 1P0285ZD [1,1,0,0,0,0|1,0,1]=4 1732 B5R0.1 C[C@@H](CC#N)N 1P003ASH [1,1,0,0,0,0|1,0,1]=4 1733 B5R0.1 C[C@@H](CC=C)O 1P003CY3 [1,1,0,0,0,0|2,0,0]=4 1734 B5R0.1 C[C@@H](CCBr)N 1P028GC5 [1,1,0,0,0,0|1,0,1]=4 1735 B5R0.1 C[C@@H](CCCl)N 1P027XJN [1,1,0,0,0,0|1,0,1]=4 1736 B5R0.1 C[C@@H](CCF)O 1P027YW7 [1,1,0,0,0,0|1,0,1]=4 1737 B5R0.1 C[C@@H](CCN)O 1P01A1MV [1,1,0,0,0,0|1,0,1]=4 1738 B5R0.1 C[C@@H](CCO)F 1P027U2B [1,1,0,0,0,0|1,0,1]=4 1739 B5R0.1 C[C@@H](CCO)N 1P00392C [1,1,0,0,0,0|0,0,1]=3 1740 B5R0.1 C[C@H](CC#C)N 1P0283BU [1,1,0,0,0,0|1,0,1]=4 1741 B5R0.1 C[C@H](CC#N)N 1P0096SL [1,1,0,0,0,0|1,0,1]=4 1742 B5R0.1 C[C@H](CC=C)O 1P0032UG [1,1,0,0,0,0|2,0,0]=4 1743 B5R0.1 C[C@H](CCBr)N 1P028G9E [1,1,0,0,0,0|1,0,1]=4 1744 B5R0.1 C[C@H](CCCl)N 1P028D19 [1,1,0,0,0,0|1,0,1]=4 1745 B5R0.1 C[C@H](CCF)N 1P0285P3 [1,1,0,0,0,0|1,0,1]=4 1746 B5R0.1 C[C@H](CCF)O 1P027YXB [1,1,0,0,0,0|1,0,1]=4 1747 B5R0.1 C[C@H](CCN)O 1P00I0QG [1,1,0,0,0,0|1,0,1]=4 1748 B5R0.1 C[C@H](CCN)O 1P01A1MU [1,1,0,0,0,0|1,0,1]=4 1749 B5R0.1 C[C@H](CCO)F 1P0280GN [1,1,0,0,0,0|1,0,1]=4 1750 B5R0.1 C[C@H](CCO)N 1P003CQ7 [1,1,0,0,0,0|0,0,1]=3 1751 B5R0.1 C\C=C\C(=O)C 1P0032ET [1,1,0,0,0,0|1,0,1]=4 1752 B5R0.1 C\C=C\C(=O)Cl 1P00359Z [1,1,0,0,0,0|1,0,1]=4 1753 B5R0.1 C\C=C\C(=O)N 1P00EF6M [1,1,0,0,0,0|1,0,1]=4 1754 B5R0.1 C\C=C\C(=O)O 1P00353L [1,1,0,0,0,0|0,0,1]=3 1755 B5R0.1 C\C=C\C(O)C 1P003KBH [1,1,0,0,0,0|2,0,0]=4 1756 B5R0.1 ClC(=O)CC#N 1P001SSB [1,1,0,0,0,0|1,0,1]=4 1757 B5R0.1 ClC(=O)CC=C 1P001EYT [1,1,0,0,0,0|1,0,1]=4 1758 B5R0.1 ClC(=O)CCBr 1P003JLT [1,1,0,0,0,0|1,0,0]=3 1759 B5R0.1 ClCCS(=O)Cl 1P01C9JU [1,1,0,0,0,0|2,0,0]=4 1760 B5R0.1 ClCOC(=O)Cl 1P0038AL [1,1,0,0,0,0|2,0,0]=4 1761 B5R0.1 FCCC(=O)Cl 1P006UO9 [1,1,0,0,0,0|1,0,0]=3 1762 B5R0.1 NC(=N)CCO 1P000YQA [1,1,0,0,0,0|2,0,0]=4 1763 B5R0.1 NC(=N)CCO 1P00DC0R [1,1,0,0,0,0|2,0,0]=4 1764 B5R0.1 NC(=N)NC=O 1P0071Y3 [1,1,0,0,0,0|1,0,1]=4 1765 B5R0.1 NC(=O)CC#N 1P0033QM [1,1,0,0,0,0|1,0,1]=4 1766 B5R0.1 NC(=O)CCBr 1P003919 [1,1,0,0,0,0|1,0,0]=3 1767 B5R0.1 NC(=O)CCCl 1P003JS0 [1,1,0,0,0,0|1,0,0]=3 1768 B5R0.1 NC(=O)CCO 1P002TZD [1,1,0,0,0,0|1,0,0]=3 1769 B5R0.1 NC(=O)CCS 1P0038WG [1,1,0,0,0,0|1,0,0]=3 1770 B5R0.1 NC(=O)CN=C 1P003SKE [1,1,0,0,0,0|1,0,1]=4 1771 B5R0.1 NC(=O)CNO 1P0281CX [1,1,0,0,0,0|1,0,0]=3 1772 B5R0.1 NC(=S)CCO 1P0291FG [1,1,0,0,0,0|1,1,0]=4 1773 B5R0.1 NCC=C(C)C 1P0018SM [1,1,0,0,0,0|2,0,0]=4 1774 B5R0.1 NCC=C(C)C 1P00BCD3 [1,1,0,0,0,0|2,0,0]=4 1775 B5R0.1 NCC=C(Cl)Cl 1P01B2AE [1,1,0,0,0,0|2,0,0]=4 1776 B5R0.1 NCC=C(F)F 1P0286I6 [1,1,0,0,0,0|2,0,0]=4 1777 B5R0.1 NCCC(=N)N 1P01ACE1 [1,1,0,0,0,0|2,0,0]=4 1778 B5R0.1 NCCC(=O)N 1P00E94U [1,1,0,0,0,0|1,0,0]=3 1779 B5R0.1 NCCC(=O)O 1P00369Y [1,1,0,0,0,0|0,0,0]=2 1780 B5R0.1 NCCC(=S)N 1P01EIHU [1,1,0,0,0,0|1,1,0]=4 1781 B5R0.1 NCCC(N)C 1P01AKTL [1,1,0,0,0,0|1,0,1]=4 1782 B5R0.1 NCCP(=O)O 1P028LEE [1,1,0,0,0,0|1,0,0]=3 1783 B5R0.1 NCCS(=O)O 1P0035H1 [1,1,0,0,0,0|1,0,0]=3 1784 B5R0.1 NNCC(=O)N 1P00E0F3 [1,1,0,0,0,0|1,0,0]=3 1785 B5R0.1 NNCC(=O)O 1P001GYX [1,1,0,0,0,0|0,0,0]=2 1786 B5R0.1 NNCC(=O)O 1P01A6IH [1,1,0,0,0,0|0,0,0]=2 1787 B5R0.1 NNCC(N)C 1P01B8TM [1,1,0,0,0,0|1,0,1]=4 1788 B5R0.1 NOCC(=C)Cl 1P028BSS [1,1,0,0,0,0|2,0,0]=4 1789 B5R0.1 NOCC(=O)N 1P007ETV [1,1,0,0,0,0|1,0,0]=3 1790 B5R0.1 NOCC(=O)N 1P01A4U9 [1,1,0,0,0,0|1,0,0]=3 1791 B5R0.1 NOCC(=O)O 1P00291K [1,1,0,0,0,0|0,0,0]=2 1792 B5R0.1 NOCC(=O)O 1P002Y6G [1,1,0,0,0,0|0,0,0]=2 1793 B5R0.1 NOCC(=O)O 1P006TUD [1,1,0,0,0,0|0,0,0]=2 1794 B5R0.1 NOCC(C)C 1P003TXW [1,1,0,0,0,0|1,0,1]=4 1795 B5R0.1 NS(=O)CCCl 1P01C9JV [1,1,0,0,0,0|2,0,0]=4 1796 B5R0.1 O=CC=C(C)C 1P00347P [1,1,0,0,0,0|1,0,1]=4 1797 B5R0.1 O=CCC(C)C 1P003938 [1,1,0,0,0,0|1,0,0]=3 1798 B5R0.1 O=CCN(C)C 1P000R2Q [1,1,0,0,0,0|2,0,0]=4 1799 B5R0.1 O=CCN(C)C 1P001GSU [1,1,0,0,0,0|2,0,0]=4 1800 B5R0.1 O=CNC(C)C 1P00BBY6 [1,1,0,0,0,0|1,0,0]=3 1801 B5R0.1 O=CNN(C)C 1P00C6WA [1,1,0,0,0,0|2,0,0]=4 1802 B5R0.1 OC(=O)C#CBr 1P001YWD [1,1,0,0,0,0|0,0,2]=4 1803 B5R0.1 OC(=O)C=C=C 1P028O5X [1,1,0,0,0,0|0,0,2]=4 1804 B5R0.1 OC(=O)CC#C 1P002NQQ [1,1,0,0,0,0|0,0,1]=3 1805 B5R0.1 OC(=O)CC#N 1P00353R [1,1,0,0,0,0|0,0,1]=3 1806 B5R0.1 OC(=O)CC#N 1P008VPM [1,1,0,0,0,0|0,0,1]=3 1807 B5R0.1 OC(=O)CC=C 1P00369B [1,1,0,0,0,0|0,0,1]=3 1808 B5R0.1 OC(=O)CCBr 1P003JLR [1,1,0,0,0,0|0,0,0]=2 1809 B5R0.1 OC(=O)CCCl 1P003JS1 [1,1,0,0,0,0|0,0,0]=2 1810 B5R0.1 OC(=O)CCF 1P00DG5V [1,1,0,0,0,0|0,0,0]=2 1811 B5R0.1 OC(=O)CCI 1P001G70 [1,1,0,0,0,0|0,0,0]=2 1812 B5R0.1 OC(=O)CCS 1P00347D [1,1,0,0,0,0|0,0,0]=2 1813 B5R0.1 OC(=O)\C=C/Br 1P001VXS [1,1,0,0,0,0|0,0,2]=4 1814 B5R0.1 OC(=O)\C=C/Cl 1P001VXR [1,1,0,0,0,0|0,0,2]=4 1815 B5R0.1 OC(=O)\C=C/I 1P00E99X [1,1,0,0,0,0|0,0,2]=4 1816 B5R0.1 OC(=O)\C=C\Br 1P003CH9 [1,1,0,0,0,0|0,0,2]=4 1817 B5R0.1 OC(=O)\C=C\I 1P003CHA [1,1,0,0,0,0|0,0,2]=4 1818 B5R0.1 OCC=C(C)C 1P003K5R [1,1,0,0,0,0|1,0,1]=4 1819 B5R0.1 OCCC(=C)Br 1P003JHK [1,1,0,0,0,0|2,0,0]=4 1820 B5R0.1 OCCC(=C)C 1P008NDS [1,1,0,0,0,0|2,0,0]=4 1821 B5R0.1 OCCC(=C)F 1P027XC4 [1,1,0,0,0,0|2,0,0]=4 1822 B5R0.1 OCCC(=O)O 1P00387S [1,1,0,0,0,0|0,0,0]=2 1823 B5R0.1 OCCC(C)C 1P000KDR [1,1,0,0,0,0|1,0,1]=4 1824 B5R0.1 OCCC(O)C 1P003BUN [1,1,0,0,0,0|1,0,1]=4 1825 B5R0.1 OCCN(=O)=O 1P0033VL [1,1,0,0,0,0|1,0,1]=4 1826 B5R0.1 OCC[C@@H](O)C 1P002PAL [1,1,0,0,0,0|1,0,1]=4 1827 B5R0.1 OCC[C@H](O)C 1P0032U4 [1,1,0,0,0,0|1,0,1]=4 1828 B5R0.1 ONCC(=C)Br 1P0289B9 [1,1,0,0,0,0|2,0,0]=4 1829 B5R0.1 ONCC(=O)O 1P007CCU [1,1,0,0,0,0|0,0,0]=2 1830 B5R0.1 SCCC(=O)O 1P007OUY [1,1,0,0,0,0|0,0,0]=2 1831 B5R0.1 [O-]C(=O)CC#N 1P00ICJS [1,1,0,0,0,0|0,0,2]=4 1832 B5R0.1 [O-]C(=O)CCC 1P001OVQ [1,1,0,0,0,0|0,0,1]=3 1833 B5R0.1 [O-]C(=O)CCN 1P001XGH [1,1,0,0,0,0|0,0,1]=3 1834 B5R0.1 [O-]C(=O)CCO 1P00EFHM [1,1,0,0,0,0|0,0,1]=3 1835 B5R0.1 [O-]C(=O)CNC 1P003UUQ [1,1,0,0,0,0|0,0,1]=3 1836 B5R0.1 [O-]C(=O)C[N+]#[C-] 1P00EM2K [1,1,0,0,0,0|0,0,2]=4 1837 B5R0.1 [O-]S(=O)CCC 1P01BCHD [1,1,0,0,0,0|1,0,1]=4 1838 B5R0.1 [O-]S(=O)CCCl 1P01C8MB [1,1,0,0,0,0|1,0,1]=4 1839 B5R0.1 [O-]S(=O)CCF 1P01C8Q9 [1,1,0,0,0,0|1,0,1]=4 1840 B5R0.1 [O-]S(=O)CCO 1P02922D [1,1,0,0,0,0|1,0,1]=4 1841 B5R0.1 [O-][N+](=O)CCBr 1P01BGOF [1,1,0,0,0,0|1,0,1]=4 1842 B5R0.1 [S-]C(=S)OCC 1P001CEY [1,1,0,0,0,0|0,2,0]=4 1843 B5R0.1 [S-]C(=S)OCC 1P0038R8 [1,1,0,0,0,0|0,2,0]=4 1844 B5R0.3 *CC(=O)O* 1P007NAW [1,1,0,0,0,0|1,0,0]=3 1845 B5R0.3 BrCC(=O)CBr 1P00521Z [1,1,0,0,0,0|2,0,0]=4 1846 B5R0.3 CC(=NO)SC 1P0013UL [1,1,0,0,0,0|2,0,0]=4 1847 B5R0.3 CC(C#C)CN 1P028SK5 [1,1,0,0,0,0|1,0,1]=4 1848 B5R0.3 CC(C#C)NC 1P00C86Q [1,1,0,0,0,0|1,0,1]=4 1849 B5R0.3 CC(C#C)NC 1P028OBM [1,1,0,0,0,0|1,0,1]=4 1850 B5R0.3 CC(C#N)C=C 1P001WIT [1,1,0,0,0,0|1,0,1]=4 1851 B5R0.3 CC(C#N)CN 1P01A9SN [1,1,0,0,0,0|1,0,1]=4 1852 B5R0.3 CC(C#N)NC 1P001XW4 [1,1,0,0,0,0|1,0,1]=4 1853 B5R0.3 CC(C#N)NC 1P00G2P6 [1,1,0,0,0,0|1,0,1]=4 1854 B5R0.3 CC(C#N)ON 1P01DVX6 [1,1,0,0,0,0|1,0,1]=4 1855 B5R0.3 CC(C=C)CBr 1P00CN82 [1,1,0,0,0,0|2,0,0]=4 1856 B5R0.3 CC(C=C)CN 1P028SHC [1,1,0,0,0,0|1,0,0]=3 1857 B5R0.3 CC(C=C)CO 1P003I34 [1,1,0,0,0,0|1,0,1]=4 1858 B5R0.3 CC(C=C)NC 1P01AGSD [1,1,0,0,0,0|1,0,0]=3 1859 B5R0.3 CC(C=C)ON 1P00FD3J [1,1,0,0,0,0|1,0,0]=3 1860 B5R0.3 CC(C=O)OC 1P00F3OH [1,1,0,0,0,0|1,0,0]=3 1861 B5R0.3 CC(NC)CF 1P028W2G [1,1,0,0,0,0|1,0,1]=4 1862 B5R0.3 CC(NC)CN 1P01AHQE [1,1,0,0,0,0|1,0,1]=4 1863 B5R0.3 CC(NC)CO 1P002USE [1,1,0,0,0,0|0,0,1]=3 1864 B5R0.3 CC(OC)CN 1P00FGE1 [1,1,0,0,0,0|1,0,1]=4 1865 B5R0.3 CC(OC)CO 1P001RGP [1,1,0,0,0,0|1,0,1]=4 1866 B5R0.3 CC(ON)CC 1P01A559 [1,1,0,0,0,0|1,0,1]=4 1867 B5R0.3 CC(SC)CO 1P002A2F [1,1,0,0,0,0|1,0,1]=4 1868 B5R0.3 CCC(=C)C#N 1P00AZFX [1,1,0,0,0,0|2,0,0]=4 1869 B5R0.3 CCC(=C)C=O 1P0033RD [1,1,0,0,0,0|1,0,0]=3 1870 B5R0.3 CCC(=C)CBr 1P00ERJN [1,1,0,0,0,0|2,0,0]=4 1871 B5R0.3 CCC(=C)CC 1P003HND [1,1,0,0,0,0|2,0,0]=4 1872 B5R0.3 CCC(=C)CN 1P00J3CC [1,1,0,0,0,0|2,0,0]=4 1873 B5R0.3 CCC(=C)CO 1P019TC3 [1,1,0,0,0,0|1,0,0]=3 1874 B5R0.3 CCC(=N)NC 1P0281D2 [1,1,0,0,0,0|2,0,0]=4 1875 B5R0.3 CCC(=N)NO 1P002YKL [1,1,0,0,0,0|1,0,0]=3 1876 B5R0.3 CCC(=NO)N 1P00J3M4 [1,1,0,0,0,0|1,0,0]=3 1877 B5R0.3 CCC(=O)C#C 1P001VIE [1,1,0,0,0,0|1,0,0]=3 1878 B5R0.3 CCC(=O)C=C 1P001TZW [1,1,0,0,0,0|1,0,0]=3 1879 B5R0.3 CCC(=O)CC 1P003KBG [1,1,0,0,0,0|1,0,0]=3 1880 B5R0.3 CCC(=O)CCl 1P00E9KQ [1,1,0,0,0,0|1,0,0]=3 1881 B5R0.3 CCC(=O)CN 1P007UM4 [1,1,0,0,0,0|1,0,0]=3 1882 B5R0.3 CCC(=O)CO 1P00DBTG [1,1,0,0,0,0|0,0,0]=2 1883 B5R0.3 CCC(=O)NC 1P003TP5 [1,1,0,0,0,0|1,0,0]=3 1884 B5R0.3 CCC(=O)NN 1P0035ZK [1,1,0,0,0,0|1,0,0]=3 1885 B5R0.3 CCC(=O)NO 1P00BVXV [1,1,0,0,0,0|0,0,0]=2 1886 B5R0.3 CCC(=O)OC 1P0035PP [1,1,0,0,0,0|0,0,0]=2 1887 B5R0.3 CCC(=S)OC 1P002TUB [1,1,0,0,0,0|0,1,0]=3 1888 B5R0.3 CCC(C#C)N 1P018SNI [1,1,0,0,0,0|1,0,1]=4 1889 B5R0.3 CCC(C#C)O 1P003F22 [1,1,0,0,0,0|1,0,1]=4 1890 B5R0.3 CCC(C#N)N 1P0062H1 [1,1,0,0,0,0|1,0,1]=4 1891 B5R0.3 CCC(C#N)O 1P00DEE8 [1,1,0,0,0,0|1,0,1]=4 1892 B5R0.3 CCC(CBr)N 1P028IUT [1,1,0,0,0,0|1,0,1]=4 1893 B5R0.3 CCC(CBr)O 1P002Q0C [1,1,0,0,0,0|1,0,1]=4 1894 B5R0.3 CCC(CC)N 1P003JEI [1,1,0,0,0,0|1,0,1]=4 1895 B5R0.3 CCC(CC)O 1P003KBF [1,1,0,0,0,0|1,0,1]=4 1896 B5R0.3 CCC(CCl)O 1P00AYVS [1,1,0,0,0,0|1,0,1]=4 1897 B5R0.3 CCC(CF)N 1P01BA0M [1,1,0,0,0,0|1,0,1]=4 1898 B5R0.3 CCC(CI)N 1P028G3P [1,1,0,0,0,0|1,0,1]=4 1899 B5R0.3 CCC(CI)O 1P000N6V [1,1,0,0,0,0|1,0,1]=4 1900 B5R0.3 CCC(CN)C 1P00IK6S [1,1,0,0,0,0|1,0,1]=4 1901 B5R0.3 CCC(CN)C 1P01C477 [1,1,0,0,0,0|1,0,1]=4 1902 B5R0.3 CCC(CN)N 1P01AB6T [1,1,0,0,0,0|1,0,1]=4 1903 B5R0.3 CCC(CN)O 1P003EEI [1,1,0,0,0,0|1,0,1]=4 1904 B5R0.3 CCC(CO)Br 1P006XVW [1,1,0,0,0,0|1,0,1]=4 1905 B5R0.3 CCC(CO)C 1P001351 [1,1,0,0,0,0|1,0,1]=4 1906 B5R0.3 CCC(CO)Cl 1P01AMF6 [1,1,0,0,0,0|1,0,1]=4 1907 B5R0.3 CCC(CO)N 1P003GSS [1,1,0,0,0,0|0,0,1]=3 1908 B5R0.3 CCC(CO)O 1P003BGJ [1,1,0,0,0,0|0,0,2]=4 1909 B5R0.3 CCC(CS)N 1P01A3ND [1,1,0,0,0,0|0,1,1]=4 1910 B5R0.3 CCC(CS)O 1P01BIJJ [1,1,0,0,0,0|0,1,1]=4 1911 B5R0.3 CCC(NC)C 1P003FJM [1,1,0,0,0,0|1,0,1]=4 1912 B5R0.3 CCC(NC)C 1P005R74 [1,1,0,0,0,0|1,0,1]=4 1913 B5R0.3 CCC(NN)C 1P009A22 [1,1,0,0,0,0|1,0,1]=4 1914 B5R0.3 CCC(OC)C 1P003UOY [1,1,0,0,0,0|1,0,1]=4 1915 B5R0.3 CCN(CC)O 1P0035RT [1,1,0,0,0,0|2,0,0]=4 1916 B5R0.3 CCP(=O)CC 1P00357C [1,1,0,0,0,0|2,0,0]=4 1917 B5R0.3 CCS(=O)CC 1P006ANF [1,1,0,0,0,0|2,0,0]=4 1918 B5R0.3 CC[C@@H](C#N)N 1P01ADHP [1,1,0,0,0,0|1,0,1]=4 1919 B5R0.3 CC[C@@H](CCl)N 1P028G0F [1,1,0,0,0,0|1,0,1]=4 1920 B5R0.3 CC[C@@H](CN)C 1P002IUT [1,1,0,0,0,0|1,0,1]=4 1921 B5R0.3 CC[C@@H](CN)C 1P0201XK [1,1,0,0,0,0|1,0,1]=4 1922 B5R0.3 CC[C@@H](CN)O 1P01B9RT [1,1,0,0,0,0|1,0,1]=4 1923 B5R0.3 CC[C@@H](CO)C 1P001P8L [1,1,0,0,0,0|1,0,1]=4 1924 B5R0.3 CC[C@@H](CO)N 1P003CWW [1,1,0,0,0,0|0,0,1]=3 1925 B5R0.3 CC[C@@H](CO)O 1P003709 [1,1,0,0,0,0|0,0,2]=4 1926 B5R0.3 CC[C@@H](CS)N 1P028FQI [1,1,0,0,0,0|0,1,1]=4 1927 B5R0.3 CC[C@@H](NC)C 1P02859U [1,1,0,0,0,0|1,0,1]=4 1928 B5R0.3 CC[C@H](C#N)N 1P01ACU7 [1,1,0,0,0,0|1,0,1]=4 1929 B5R0.3 CC[C@H](CBr)O 1P0292ZO [1,1,0,0,0,0|1,0,1]=4 1930 B5R0.3 CC[C@H](CCl)N 1P028FOW [1,1,0,0,0,0|1,0,1]=4 1931 B5R0.3 CC[C@H](CN)O 1P00J2QC [1,1,0,0,0,0|1,0,1]=4 1932 B5R0.3 CC[C@H](CO)C 1P00EBJG [1,1,0,0,0,0|1,0,1]=4 1933 B5R0.3 CC[C@H](CO)N 1P0032U5 [1,1,0,0,0,0|0,0,1]=3 1934 B5R0.3 CC[C@H](CO)O 1P00I8DI [1,1,0,0,0,0|0,0,2]=4 1935 B5R0.3 CC[C@H](CS)N 1P028YXX [1,1,0,0,0,0|0,1,1]=4 1936 B5R0.3 CC[C@H](NC)C 1P01R96I [1,1,0,0,0,0|1,0,1]=4 1937 B5R0.3 CC\C(=C\C)\Br 1P028YNB [1,1,0,0,0,0|2,0,0]=4 1938 B5R0.3 CC\C(=N\O)\N 1P00J2ED [1,1,0,0,0,0|1,0,0]=3 1939 B5R0.3 CN(C=O)CC 1P002XCI [1,1,0,0,0,0|2,0,0]=4 1940 B5R0.3 CN(C=O)OC 1P00CLC1 [1,1,0,0,0,0|2,0,0]=4 1941 B5R0.3 CNC(=O)C#C 1P00K7GW [1,1,0,0,0,0|2,0,0]=4 1942 B5R0.3 CNC(=O)C=C 1P00HF69 [1,1,0,0,0,0|2,0,0]=4 1943 B5R0.3 CNC(=O)CBr 1P007DCA [1,1,0,0,0,0|2,0,0]=4 1944 B5R0.3 CNC(=O)CCl 1P0033Q7 [1,1,0,0,0,0|2,0,0]=4 1945 B5R0.3 CNC(=O)CI 1P028JQB [1,1,0,0,0,0|2,0,0]=4 1946 B5R0.3 CNC(=O)CN 1P0037VQ [1,1,0,0,0,0|1,0,0]=3 1947 B5R0.3 CNC(=O)CN 1P0039JP [1,1,0,0,0,0|1,0,0]=3 1948 B5R0.3 CNC(=O)CO 1P00DD9R [1,1,0,0,0,0|1,0,0]=3 1949 B5R0.3 CNC(=O)CS 1P002KO6 [1,1,0,0,0,0|1,1,0]=4 1950 B5R0.3 CNC(=O)NN 1P0025HY [1,1,0,0,0,0|2,0,0]=4 1951 B5R0.3 CNC(=O)OC 1P00FAMH [1,1,0,0,0,0|1,0,0]=3 1952 B5R0.3 COC(=N)CCl 1P003S44 [1,1,0,0,0,0|2,0,0]=4 1953 B5R0.3 COC(=O)C#C 1P0035ZM [1,1,0,0,0,0|0,0,2]=4 1954 B5R0.3 COC(=O)C#N 1P002549 [1,1,0,0,0,0|0,0,2]=4 1955 B5R0.3 COC(=O)C=C 1P0038Z5 [1,1,0,0,0,0|0,0,2]=4 1956 B5R0.3 COC(=O)C=O 1P019DOT [1,1,0,0,0,0|1,0,1]=4 1957 B5R0.3 COC(=O)CBr 1P0035PA [1,1,0,0,0,0|1,0,0]=3 1958 B5R0.3 COC(=O)CI 1P00VVO6 [1,1,0,0,0,0|1,0,0]=3 1959 B5R0.3 COC(=O)CN 1P0035FQ [1,1,0,0,0,0|0,0,0]=2 1960 B5R0.3 COC(=O)CO 1P0035PJ [1,1,0,0,0,0|1,0,0]=3 1961 B5R0.3 COC(=O)CS 1P002OI0 [1,1,0,0,0,0|1,0,0]=3 1962 B5R0.3 COC(=O)NN 1P003P5S [1,1,0,0,0,0|1,0,0]=3 1963 B5R0.3 COC(=O)OC 1P00357R [1,1,0,0,0,0|1,0,0]=3 1964 B5R0.3 COC(=O)SCl 1P002U4T [1,1,0,0,0,0|1,1,0]=4 1965 B5R0.3 COC(=S)SC 1P00ASGB [1,1,0,0,0,0|1,1,0]=4 1966 B5R0.3 COS(=O)OC 1P00IKXI [1,1,0,0,0,0|2,0,0]=4 1967 B5R0.3 CSC(=O)CCl 1P028VR9 [1,1,0,0,0,0|1,1,0]=4 1968 B5R0.3 CSC(=O)SC 1P003UMZ [1,1,0,0,0,0|1,1,0]=4 1969 B5R0.3 C[C@@H](C#N)CN 1P0280ES [1,1,0,0,0,0|1,0,1]=4 1970 B5R0.3 C[C@@H](NC)CF 1P0287PK [1,1,0,0,0,0|1,0,1]=4 1971 B5R0.3 C[C@@H](NC)CO 1P01B9ZG [1,1,0,0,0,0|0,0,1]=3 1972 B5R0.3 C[C@@H](NC)CO 1P01BA5X [1,1,0,0,0,0|0,0,1]=3 1973 B5R0.3 C[C@@H](OC)CN 1P00ACLI [1,1,0,0,0,0|1,0,1]=4 1974 B5R0.3 C[C@@H](OC)CN 1P00GV5Q [1,1,0,0,0,0|1,0,1]=4 1975 B5R0.3 C[C@@H](OC)CO 1P0037UW [1,1,0,0,0,0|1,0,1]=4 1976 B5R0.3 C[C@H](C#N)CN 1P0280D9 [1,1,0,0,0,0|1,0,1]=4 1977 B5R0.3 C[C@H](NC)CF 1P028DN7 [1,1,0,0,0,0|1,0,1]=4 1978 B5R0.3 C[C@H](NC)CN 1P028HC6 [1,1,0,0,0,0|1,0,1]=4 1979 B5R0.3 C[C@H](NC)CO 1P01B9S4 [1,1,0,0,0,0|0,0,1]=3 1980 B5R0.3 C[C@H](NC)CO 1P01B9VN [1,1,0,0,0,0|0,0,1]=3 1981 B5R0.3 C[C@H](OC)CN 1P00GV5R [1,1,0,0,0,0|1,0,1]=4 1982 B5R0.3 C[C@H](OC)CN 1P00GV5S [1,1,0,0,0,0|1,0,1]=4 1983 B5R0.3 C[C@H](OC)CO 1P000CX7 [1,1,0,0,0,0|1,0,1]=4 1984 B5R0.3 C\C=C(\C=O)/Br 1P01G991 [1,1,0,0,0,0|1,0,1]=4 1985 B5R0.3 C\C=C(\C=O)/C 1P00366D [1,1,0,0,0,0|1,0,1]=4 1986 B5R0.3 C\C=C(\C=O)/Cl 1P002R15 [1,1,0,0,0,0|1,0,1]=4 1987 B5R0.3 ClC(C=C)CCl 1P003IWJ [1,1,0,0,0,0|2,0,0]=4 1988 B5R0.3 ClCC(=O)C=C 1P006UR2 [1,1,0,0,0,0|2,0,0]=4 1989 B5R0.3 ClCC(=O)CCl 1P00DTUY [1,1,0,0,0,0|2,0,0]=4 1990 B5R0.3 FCC(CF)N 1P00ID5D [1,1,0,0,0,0|1,0,1]=4 1991 B5R0.3 NC(=NO)CCl 1P007JEW [1,1,0,0,0,0|1,0,1]=4 1992 B5R0.3 NC(C#C)CO 1P01API1 [1,1,0,0,0,0|0,0,2]=4 1993 B5R0.3 NC(C#N)CO 1P01ACIC [1,1,0,0,0,0|0,0,2]=4 1994 B5R0.3 NC(C=C)CO 1P01BCLD [1,1,0,0,0,0|1,0,0]=3 1995 B5R0.3 NC=C(C=O)C 1P0032BD [1,1,0,0,0,0|0,0,1]=3 1996 B5R0.3 NCC(=C)CN 1P01AVAM [1,1,0,0,0,0|2,0,0]=4 1997 B5R0.3 NCC(=C)CO 1P01B38X [1,1,0,0,0,0|1,0,0]=3 1998 B5R0.3 NCC(=CCl)Cl 1P0284WP [1,1,0,0,0,0|2,0,0]=4 1999 B5R0.3 NCC(=NO)N 1P0285PB [1,1,0,0,0,0|1,0,0]=3 2000 B5R0.3 NCC(=O)CCl 1P027VFF [1,1,0,0,0,0|1,0,0]=3 2001 B5R0.3 NCC(=O)CN 1P00EE76 [1,1,0,0,0,0|1,0,0]=3 2002 B5R0.3 NCC(=O)NN 1P028IE3 [1,1,0,0,0,0|1,0,0]=3 2003 B5R0.3 NCC(=O)NO 1P00DG4H [1,1,0,0,0,0|0,0,0]=2 2004 B5R0.3 NCC(C#C)O 1P02894Y [1,1,0,0,0,0|1,0,1]=4 2005 B5R0.3 NCC(C#N)N 1P01A4SU [1,1,0,0,0,0|1,0,1]=4 2006 B5R0.3 NCC(C=C)F 1P028UOK [1,1,0,0,0,0|2,0,0]=4 2007 B5R0.3 NCC(C=C)O 1P0011H6 [1,1,0,0,0,0|1,0,1]=4 2008 B5R0.3 NCC(C=C)O 1P027VLI [1,1,0,0,0,0|1,0,1]=4 2009 B5R0.3 NCC(CCl)C 1P00IKCJ [1,1,0,0,0,0|1,0,1]=4 2010 B5R0.3 NCC(CCl)O 1P0037I9 [1,1,0,0,0,0|1,0,1]=4 2011 B5R0.3 NCC(CF)O 1P019GLG [1,1,0,0,0,0|1,0,1]=4 2012 B5R0.3 NCC(CN)C 1P003I1P [1,1,0,0,0,0|1,0,1]=4 2013 B5R0.3 NCC(CN)N 1P019TGA [1,1,0,0,0,0|1,0,1]=4 2014 B5R0.3 NCC(CN)O 1P00IBCX [1,1,0,0,0,0|1,0,1]=4 2015 B5R0.3 NCC(CO)C 1P001O5X [1,1,0,0,0,0|0,0,1]=3 2016 B5R0.3 NCC(CO)C 1P006JX9 [1,1,0,0,0,0|0,0,1]=3 2017 B5R0.3 NCC(CO)F 1P0053A7 [1,1,0,0,0,0|1,0,1]=4 2018 B5R0.3 NCC(CO)F 1P021X21 [1,1,0,0,0,0|1,0,1]=4 2019 B5R0.3 NCC(CO)N 1P01AG38 [1,1,0,0,0,0|0,0,1]=3 2020 B5R0.3 NCC(CO)O 1P0032RQ [1,1,0,0,0,0|0,0,2]=4 2021 B5R0.3 NCC(NC)C 1P01BEK5 [1,1,0,0,0,0|1,0,1]=4 2022 B5R0.3 NC[C@@H](CCl)O 1P00BY10 [1,1,0,0,0,0|1,0,1]=4 2023 B5R0.3 NC[C@@H](CO)C 1P00IFOF [1,1,0,0,0,0|0,0,1]=3 2024 B5R0.3 NC[C@@H](CO)F 1P00ILF4 [1,1,0,0,0,0|1,0,1]=4 2025 B5R0.3 NC[C@@H](CO)F 1P023OS0 [1,1,0,0,0,0|1,0,1]=4 2026 B5R0.3 NC[C@@H](CO)N 1P01A5TP [1,1,0,0,0,0|0,0,1]=3 2027 B5R0.3 NC[C@@H](CO)O 1P002KW4 [1,1,0,0,0,0|0,0,2]=4 2028 B5R0.3 NC[C@@H](CO)O 1P003VXC [1,1,0,0,0,0|0,0,2]=4 2029 B5R0.3 NC[C@H](CCl)O 1P00CNP3 [1,1,0,0,0,0|1,0,1]=4 2030 B5R0.3 NC[C@H](CO)C 1P007F3A [1,1,0,0,0,0|0,0,1]=3 2031 B5R0.3 NC[C@H](CO)C 1P028ZRU [1,1,0,0,0,0|0,0,1]=3 2032 B5R0.3 NC[C@H](CO)F 1P00ILHM [1,1,0,0,0,0|1,0,1]=4 2033 B5R0.3 NC[C@H](CO)N 1P01A7EX [1,1,0,0,0,0|0,0,1]=3 2034 B5R0.3 NC[C@H](CO)O 1P003CQ6 [1,1,0,0,0,0|0,0,2]=4 2035 B5R0.3 NNC(=O)C=C 1P01EMC9 [1,1,0,0,0,0|2,0,0]=4 2036 B5R0.3 NNC(=O)CCl 1P004ISM [1,1,0,0,0,0|2,0,0]=4 2037 B5R0.3 NNC(=O)CO 1P007E6R [1,1,0,0,0,0|1,0,0]=3 2038 B5R0.3 NNC(=O)CS 1P008P7E [1,1,0,0,0,0|1,1,0]=4 2039 B5R0.3 NNC(=O)NN 1P003P5Z [1,1,0,0,0,0|2,0,0]=4 2040 B5R0.3 NNC(=O)NO 1P00BDMA [1,1,0,0,0,0|1,0,0]=3 2041 B5R0.3 NNC(C=C)C 1P02829N [1,1,0,0,0,0|1,0,0]=3 2042 B5R0.3 N[C@@H](C=C)CO 1P00BDW2 [1,1,0,0,0,0|1,0,0]=3 2043 B5R0.3 N[C@H](C=C)CO 1P00C07G [1,1,0,0,0,0|1,0,0]=3 2044 B5R0.3 O=CC(C=O)Br 1P0033N9 [1,1,0,0,0,0|1,0,1]=4 2045 B5R0.3 O=CC(C=O)Cl 1P0033Q1 [1,1,0,0,0,0|1,0,1]=4 2046 B5R0.3 O=CC(C=O)I 1P01B7DY [1,1,0,0,0,0|1,0,1]=4 2047 B5R0.3 O=CN(C=O)C 1P0023PU [1,1,0,0,0,0|2,0,0]=4 2048 B5R0.3 OC(C=C)CBr 1P00EDOK [1,1,0,0,0,0|2,0,0]=4 2049 B5R0.3 OC(C=C)CO 1P003374 [1,1,0,0,0,0|2,0,0]=4 2050 B5R0.3 OCC(=C)CBr 1P01ADNH [1,1,0,0,0,0|2,0,0]=4 2051 B5R0.3 OCC(=C)CF 1P028BX1 [1,1,0,0,0,0|2,0,0]=4 2052 B5R0.3 OCC(=C)CO 1P0036EB [1,1,0,0,0,0|2,0,0]=4 2053 B5R0.3 OCC(=N)NO 1P005CBZ [1,1,0,0,0,0|2,0,0]=4 2054 B5R0.3 OCC(=O)CO 1P00332C [1,1,0,0,0,0|1,0,0]=3 2055 B5R0.3 OCC(C=C)F 1P0283T0 [1,1,0,0,0,0|2,0,0]=4 2056 B5R0.3 OCC(C=O)O 1P00BEK0 [1,1,0,0,0,0|1,0,0]=3 2057 B5R0.3 OCC(CBr)Br 1P006T5M [1,1,0,0,0,0|1,0,1]=4 2058 B5R0.3 OCC(CBr)C 1P0075IM [1,1,0,0,0,0|1,0,1]=4 2059 B5R0.3 OCC(CBr)F 1P01E7KF [1,1,0,0,0,0|1,0,1]=4 2060 B5R0.3 OCC(CBr)O 1P00DF5A [1,1,0,0,0,0|1,0,1]=4 2061 B5R0.3 OCC(CCl)Cl 1P003FXP [1,1,0,0,0,0|1,0,1]=4 2062 B5R0.3 OCC(CCl)O 1P0036LI [1,1,0,0,0,0|1,0,1]=4 2063 B5R0.3 OCC(CF)F 1P01PCWA [1,1,0,0,0,0|1,0,1]=4 2064 B5R0.3 OCC(CO)C 1P003I1Q [1,1,0,0,0,0|1,0,1]=4 2065 B5R0.3 OCC(CO)Cl 1P00DFIC [1,1,0,0,0,0|1,0,1]=4 2066 B5R0.3 OCC(CO)N 1P0033JG [1,1,0,0,0,0|0,0,1]=3 2067 B5R0.3 OCC(CO)N 1P003UPC [1,1,0,0,0,0|0,0,1]=3 2068 B5R0.3 OCC(CO)O 1P002TPL [1,1,0,0,0,0|1,0,1]=4 2069 B5R0.3 OCC(CO)O 1P0035FJ [1,1,0,0,0,0|1,0,1]=4 2070 B5R0.3 OCC(CO)O 1P00GV8Q [1,1,0,0,0,0|1,0,1]=4 2071 B5R0.3 OCC(CS)C 1P019SMR [1,1,0,0,0,0|1,0,1]=4 2072 B5R0.3 OCC(CS)O 1P006SH0 [1,1,0,0,0,0|1,0,1]=4 2073 B5R0.3 OCC(CS)S 1P003FZZ [1,1,0,0,0,0|1,0,1]=4 2074 B5R0.3 OCC(NN)C 1P00J08R [1,1,0,0,0,0|0,0,1]=3 2075 B5R0.3 OC[C@@H](CBr)C 1P003CXU [1,1,0,0,0,0|1,0,1]=4 2076 B5R0.3 OC[C@@H](CBr)O 1P0013UE [1,1,0,0,0,0|1,0,1]=4 2077 B5R0.3 OC[C@@H](CCl)O 1P00IB7Z [1,1,0,0,0,0|1,0,1]=4 2078 B5R0.3 OC[C@@H](CF)N 1P02032H [1,1,0,0,0,0|0,0,1]=3 2079 B5R0.3 OC[C@@H](CF)O 1P00I73B [1,1,0,0,0,0|1,0,1]=4 2080 B5R0.3 OC[C@@H](CS)O 1P008RHS [1,1,0,0,0,0|1,0,1]=4 2081 B5R0.3 OC[C@H](CBr)C 1P003CKN [1,1,0,0,0,0|1,0,1]=4 2082 B5R0.3 OC[C@H](CBr)O 1P001JW1 [1,1,0,0,0,0|1,0,1]=4 2083 B5R0.3 OC[C@H](CCl)O 1P003CJQ [1,1,0,0,0,0|1,0,1]=4 2084 B5R0.3 OC[C@H](CF)N 1P02032G [1,1,0,0,0,0|0,0,1]=3 2085 B5R0.3 OC[C@H](CF)O 1P00D1EW [1,1,0,0,0,0|1,0,1]=4 2086 B5R0.3 OC[C@H](CS)O 1P001VNE [1,1,0,0,0,0|1,0,1]=4 2087 B5R0.3 OC\C(=N\O)\N 1P00J374 [1,1,0,0,0,0|1,0,1]=4 2088 B5R0.3 ONC(=O)C=C 1P001VY0 [1,1,0,0,0,0|0,0,2]=4 2089 B5R0.3 O[C@@H](C=C)CO 1P0032XQ [1,1,0,0,0,0|2,0,0]=4 2090 B5R0.3 O[C@@H](C=O)CO 1P003POB [1,1,0,0,0,0|1,0,0]=3 2091 B5R0.3 O[C@H](C=O)CO 1P00DEET [1,1,0,0,0,0|1,0,0]=3 2092 B5R0.3 SCC(CS)N 1P01QN6R [1,1,0,0,0,0|0,1,1]=4 2093 B5R0.3 [Na]OC(=O)C=C 1P003A2G [1,1,0,0,0,0|0,0,2]=4 2094 B5R0.4 BrCC(N)(C)C 1P01A4SE [1,1,0,0,0,0|1,0,1]=4 2095 B5R0.4 BrCP(=O)(O)O 1P01BBGE [1,1,0,0,0,0|2,0,0]=4 2096 B5R0.4 C#CC(N)(C)C 1P007KSA [1,1,0,0,0,0|1,0,1]=4 2097 B5R0.4 C=CC(C)(C)C 1P003ITT [1,1,0,0,0,0|2,0,0]=4 2098 B5R0.4 C=CC(N)(C)C 1P01EMG2 [1,1,0,0,0,0|1,0,0]=3 2099 B5R0.4 C=CC(O)(C)C 1P000G0L [1,1,0,0,0,0|2,0,0]=4 2100 B5R0.4 CCC(N)(C)C 1P003UZC [1,1,0,0,0,0|1,0,1]=4 2101 B5R0.4 CCC(O)(C)C 1P001DZE [1,1,0,0,0,0|1,0,1]=4 2102 B5R0.4 CCC(O)(C)C 1P0033UL [1,1,0,0,0,0|1,0,1]=4 2103 B5R0.4 CCP(=O)(O)O 1P003R06 [1,1,0,0,0,0|1,0,0]=3 2104 B5R0.4 CCS(=O)(=N)C 1P00J0QH [1,1,0,0,0,0|2,0,0]=4 2105 B5R0.4 CCS(=O)(=N)N 1P020KM8 [1,1,0,0,0,0|2,0,0]=4 2106 B5R0.4 CCS(=O)(=N)N 1P028125 [1,1,0,0,0,0|2,0,0]=4 2107 B5R0.4 CCS(=O)(=O)Br 1P028ALL [1,1,0,0,0,0|1,0,1]=4 2108 B5R0.4 CCS(=O)(=O)C 1P0035D6 [1,1,0,0,0,0|1,0,1]=4 2109 B5R0.4 CCS(=O)(=O)Cl 1P0035DZ [1,1,0,0,0,0|1,0,1]=4 2110 B5R0.4 CCS(=O)(=O)F 1P005CD0 [1,1,0,0,0,0|1,0,1]=4 2111 B5R0.4 CCS(=O)(=O)N 1P0035A7 [1,1,0,0,0,0|1,0,1]=4 2112 B5R0.4 CCS(=O)(=O)O 1P0035A8 [1,1,0,0,0,0|1,0,0]=3 2113 B5R0.4 CCS(=O)(=O)[O-] 1P003QF5 [1,1,0,0,0,0|1,0,1]=4 2114 B5R0.4 CNS(=O)(=O)O 1P003SL1 [1,1,0,0,0,0|2,0,0]=4 2115 B5R0.4 COS(=O)(=O)O 1P00DAB2 [1,1,0,0,0,0|2,0,0]=4 2116 B5R0.4 ClCC(N)(C)C 1P01BVY9 [1,1,0,0,0,0|1,0,1]=4 2117 B5R0.4 ClCP(=O)(O)O 1P00387A [1,1,0,0,0,0|2,0,0]=4 2118 B5R0.4 FCC(N)(C)C 1P003BDH [1,1,0,0,0,0|1,0,1]=4 2119 B5R0.4 N#CC(N)(C)C 1P0036JL [1,1,0,0,0,0|1,0,1]=4 2120 B5R0.4 N#CC(N)(C)C 1P00AP57 [1,1,0,0,0,0|1,0,1]=4 2121 B5R0.4 NCC(N)(C)C 1P003316 [1,1,0,0,0,0|1,0,1]=4 2122 B5R0.4 NCC(N)(C)C 1P00ASB1 [1,1,0,0,0,0|1,0,1]=4 2123 B5R0.4 NCC(O)(C)C 1P002W4M [1,1,0,0,0,0|1,0,1]=4 2124 B5R0.4 NCP(=O)(C)C 1P028Z6T [1,1,0,0,0,0|2,0,0]=4 2125 B5R0.4 NCP(=O)(O)O 1P003CG3 [1,1,0,0,0,0|1,0,0]=3 2126 B5R0.4 NCS(=O)(=O)O 1P001A3A [1,1,0,0,0,0|1,0,0]=3 2127 B5R0.4 O=CC(Br)(Br)Br 1P000G0M [1,1,0,0,0,0|2,0,0]=4 2128 B5R0.4 O=CC(Br)(C)C 1P0010LR [1,1,0,0,0,0|1,0,0]=3 2129 B5R0.4 O=CC(C)(C)C 1P00367Z [1,1,0,0,0,0|1,0,0]=3 2130 B5R0.4 O=CC(F)(F)F 1P00C7W8 [1,1,0,0,0,0|2,0,0]=4 2131 B5R0.4 O=NC(C)(C)C 1P003V2S [1,1,0,0,0,0|2,0,0]=4 2132 B5R0.4 OCC(Br)(C)C 1P01ANW5 [1,1,0,0,0,0|1,0,1]=4 2133 B5R0.4 OCC(C)(C)C 1P003TFF [1,1,0,0,0,0|1,0,1]=4 2134 B5R0.4 OCC(F)(C)C 1P0032KV [1,1,0,0,0,0|1,0,1]=4 2135 B5R0.4 OCC(F)(F)C 1P003FRM [1,1,0,0,0,0|1,0,1]=4 2136 B5R0.4 OCC(N)(C)C 1P0033JI [1,1,0,0,0,0|0,0,1]=3 2137 B5R0.4 OCC(N)(C)C 1P003ABP [1,1,0,0,0,0|0,0,1]=3 2138 B5R0.4 OCC(O)(C)C 1P0033V2 [1,1,0,0,0,0|1,0,1]=4 2139 B5R0.4 OCC(S)(C)C 1P00FI08 [1,1,0,0,0,0|1,0,1]=4 2140 B5R0.4 ONC(C)(C)C 1P001X84 [1,1,0,0,0,0|2,0,0]=4 2141 B5R0.4 ONC(C)(C)C 1P0035VQ [1,1,0,0,0,0|2,0,0]=4 2142 B5R0.4 ONC(C)(C)C 1P003SWA [1,1,0,0,0,0|2,0,0]=4 2143 B5R0.4 OOC(C)(C)C 1P0059OU [1,1,0,0,0,0|2,0,0]=4 2144 B5R0.4 SCC(N)(C)C 1P01I4GG [1,1,0,0,0,0|0,1,1]=4 2145 B5R0.4 [O-]S(=S)(=O)CC 1P003UVU [1,1,0,0,0,0|1,0,1]=4 2146 B7R0.2 *C(OC(=O)C)C* 1P003UAU [0,1,0,0,0,1|2,0,0]=4 2147 B7R0.2 BrCC(=O)NC(C)C 1P0038WV [0,1,0,0,0,1|2,0,0]=4 2148 B7R0.2 BrCC(=O)OC(C)C 1P003RLF [0,1,0,0,0,1|2,0,0]=4 2149 B7R0.2 C=CC(=O)NC(C)C 1P003TLD [0,1,0,0,0,1|2,0,0]=4 2150 B7R0.2 C=CC(=O)OC(C)C 1P00FCDR [0,1,0,0,0,1|2,0,0]=4 2151 B7R0.2 CC(=C)CC(CO)N 1P01BIQ2 [0,1,0,0,0,1|2,0,0]=4 2152 B7R0.2 CC(=C=C)CC(=O)O 1P028EHI [0,1,0,0,0,1|1,0,1]=4 2153 B7R0.2 CC(=O)OC(CBr)Br 1P007NQ4 [0,1,0,0,0,1|2,0,0]=4 2154 B7R0.2 CC(C#N)CC(=O)C 1P00D1CU [0,1,0,0,0,1|1,0,1]=4 2155 B7R0.2 CC(C#N)CC(=O)O 1P01B8RV [0,1,0,0,0,1|0,0,1]=3 2156 B7R0.2 CC(C#N)NC(=O)N 1P01BAS1 [0,1,0,0,0,1|1,0,1]=4 2157 B7R0.2 CC(C=C)CC(=O)O 1P002H0Z [0,1,0,0,0,1|1,0,0]=3 2158 B7R0.2 CC(C=C)OC(=O)C 1P003JM8 [0,1,0,0,0,1|2,0,0]=4 2159 B7R0.2 CC(CC(=NO)N)C 1P019XUL [0,1,0,0,0,1|2,0,0]=4 2160 B7R0.2 CC(CC(=O)CN)Cl 1P01BI4J [0,1,0,0,0,1|2,0,0]=4 2161 B7R0.2 CC(CC(=O)NN)O 1P002OWV [0,1,0,0,0,1|2,0,0]=4 2162 B7R0.2 CC(CC)CC(=O)O 1P00359B [0,1,0,0,0,1|1,0,0]=3 2163 B7R0.2 CC(CF)CC(=O)O 1P01SVBB [0,1,0,0,0,1|1,0,0]=3 2164 B7R0.2 CC(CN)CC(=O)O 1P01A0Y2 [0,1,0,0,0,1|0,0,0]=2 2165 B7R0.2 CC(CN)CC(O)C 1P01AKSU [0,1,0,0,0,1|1,0,1]=4 2166 B7R0.2 CC(NC(=O)C)CCl 1P01C49W [0,1,0,0,0,1|2,0,0]=4 2167 B7R0.2 CC(NC(=O)N)CC 1P00ICCE [0,1,0,0,0,1|2,0,0]=4 2168 B7R0.2 CC(NC)CC(=O)N 1P00J30L [0,1,0,0,0,1|1,0,0]=3 2169 B7R0.2 CC(NC)CC(=O)O 1P001XOH [0,1,0,0,0,1|0,0,0]=2 2170 B7R0.2 CC(OC(=O)C#C)C 1P005W1X [0,1,0,0,0,1|2,0,0]=4 2171 B7R0.2 CC(OC(=O)Cl)CC 1P0020AG [0,1,0,0,0,1|2,0,0]=4 2172 B7R0.2 CC(OC)CC(=O)O 1P0001T2 [0,1,0,0,0,1|1,0,0]=3 2173 B7R0.2 CC(SC)CC(=O)O 1P00B61I [0,1,0,0,0,1|1,0,0]=3 2174 B7R0.2 CCC(=O)CC(C)C 1P003NCQ [0,1,0,0,0,1|2,0,0]=4 2175 B7R0.2 CCC(CC(=O)C)C 1P0038PR [0,1,0,0,0,1|2,0,0]=4 2176 B7R0.2 CCC(CC(=O)O)N 1P003ANY [0,1,0,0,0,1|0,0,0]=2 2177 B7R0.2 CCC(CC(=O)O)N 1P00AQ4O [0,1,0,0,0,1|0,0,0]=2 2178 B7R0.2 CCC(CC(=O)O)O 1P0007RC [0,1,0,0,0,1|1,0,0]=3 2179 B7R0.2 CCC(CC(O)C)N 1P01BRXC [0,1,0,0,0,1|1,0,1]=4 2180 B7R0.2 CCS(=O)CC(=O)O 1P00EEBB [0,1,0,0,0,1|2,0,0]=4 2181 B7R0.2 CC[C@@H](CC(=O)O)N 1P001J1T [0,1,0,0,0,1|0,0,0]=2 2182 B7R0.2 CC[C@@H](CC(=O)O)N 1P01DTYS [0,1,0,0,0,1|0,0,0]=2 2183 B7R0.2 CC[C@@H](CC(=O)O)O 1P01EKL5 [0,1,0,0,0,1|1,0,0]=3 2184 B7R0.2 CC[C@H](CC(=O)O)N 1P00IJD7 [0,1,0,0,0,1|0,0,0]=2 2185 B7R0.2 CC[C@H](CC(=O)O)O 1P01EKMU [0,1,0,0,0,1|1,0,0]=3 2186 B7R0.2 CN(CC)CC(=O)O 1P003AQF [0,1,0,0,0,1|2,0,0]=4 2187 B7R0.2 CN(CC)CC(=O)O 1P028PG4 [0,1,0,0,0,1|2,0,0]=4 2188 B7R0.2 CNC(=O)CC(=O)O 1P00C9G5 [0,1,0,0,0,1|1,0,1]=4 2189 B7R0.2 CNC(=O)CC(N)C 1P01C1RO [0,1,0,0,0,1|1,0,0]=3 2190 B7R0.2 CNC(=O)C[C@H](O)C 1P027V34 [0,1,0,0,0,1|2,0,0]=4 2191 B7R0.2 CNC(CC(O)C)C 1P023Q4W [0,1,0,0,0,1|1,0,1]=4 2192 B7R0.2 CNC(CS(=O)C)C 1P01A733 [0,1,0,0,0,1|2,0,0]=4 2193 B7R0.2 COC(=N)CC(C)C 1P01BS5V [0,1,0,0,0,1|2,0,0]=4 2194 B7R0.2 COC(=O)C=C(C)C 1P003IU0 [0,1,0,0,0,1|1,0,1]=4 2195 B7R0.2 COC(=O)C=C(N)C 1P001I49 [0,1,0,0,0,1|0,0,1]=3 2196 B7R0.2 COC(=O)CC(=C)C 1P00BOHX [0,1,0,0,0,1|1,0,1]=4 2197 B7R0.2 COC(=O)CC(=N)N 1P00J2XS [0,1,0,0,0,1|1,0,1]=4 2198 B7R0.2 COC(=O)CC(=O)C 1P003SFS [0,1,0,0,0,1|1,0,1]=4 2199 B7R0.2 COC(=O)CC(=O)N 1P00DBY3 [0,1,0,0,0,1|1,0,1]=4 2200 B7R0.2 COC(=O)CC(=S)N 1P003S7N [0,1,0,0,0,1|1,0,1]=4 2201 B7R0.2 COC(=O)CC(Br)C 1P007P3N [0,1,0,0,0,1|1,0,0]=3 2202 B7R0.2 COC(=O)CC(C)C 1P0035PM [0,1,0,0,0,1|1,0,0]=3 2203 B7R0.2 COC(=O)CC(F)C 1P028RKB [0,1,0,0,0,1|1,0,0]=3 2204 B7R0.2 COC(=O)CC(N)C 1P009Z7X [0,1,0,0,0,1|0,0,0]=2 2205 B7R0.2 COC(=O)CC(O)C 1P001LLF [0,1,0,0,0,1|1,0,0]=3 2206 B7R0.2 COC(=O)CC(S)C 1P00DGF5 [0,1,0,0,0,1|1,0,0]=3 2207 B7R0.2 COC(=O)CN(C)C 1P003T1V [0,1,0,0,0,1|2,0,0]=4 2208 B7R0.2 COC(=O)CS(=O)C 1P00E2WS [0,1,0,0,0,1|2,0,0]=4 2209 B7R0.2 COC(=O)C[C@@H](N)C 1P001B0R [0,1,0,0,0,1|0,0,0]=2 2210 B7R0.2 COC(=O)C[C@@H](O)C 1P003D49 [0,1,0,0,0,1|1,0,0]=3 2211 B7R0.2 COC(=O)C[C@H](F)C 1P01G18M [0,1,0,0,0,1|1,0,0]=3 2212 B7R0.2 COC(=O)C[C@H](N)C 1P001B0S [0,1,0,0,0,1|0,0,0]=2 2213 B7R0.2 COC(=O)C[C@H](N)C 1P008Y0A [0,1,0,0,0,1|0,0,0]=2 2214 B7R0.2 COC(=O)C[C@H](O)C 1P003RZI [0,1,0,0,0,1|1,0,0]=3 2215 B7R0.2 COC(=O)OC(Cl)C 1P01A6C2 [0,1,0,0,0,1|1,0,0]=3 2216 B7R0.2 COC(=O)SC(C)C 1P01XBN3 [0,1,0,0,0,1|1,0,0]=3 2217 B7R0.2 COC(=O)\C=C(\C)/[O-] 1P007HC6 [0,1,0,0,0,1|1,0,1]=4 2218 B7R0.2 C[C@@H](C=C)CC(=O)O 1P005CDB [0,1,0,0,0,1|1,0,0]=3 2219 B7R0.2 C[C@@H](CC)CC(=O)O 1P007CFN [0,1,0,0,0,1|1,0,0]=3 2220 B7R0.2 C[C@H](CC)CC(=O)O 1P00AQ4A [0,1,0,0,0,1|1,0,0]=3 2221 B7R0.2 C[C@H](CN)CC(=O)O 1P01BS0C [0,1,0,0,0,1|0,0,0]=2 2222 B7R0.2 C\C(=C/C(=O)O)\CC 1P002C5I [0,1,0,0,0,1|1,0,1]=4 2223 B7R0.2 C\C(=C/C(=O)O)\CN 1P028ZWZ [0,1,0,0,0,1|0,0,1]=3 2224 B7R0.2 C\C(=C\C(=O)O)\C=C 1P01EMNE [0,1,0,0,0,1|1,0,1]=4 2225 B7R0.2 ClCC(=O)CC(C)C 1P00CLO7 [0,1,0,0,0,1|2,0,0]=4 2226 B7R0.2 ClCC(=O)NC(C)C 1P002XNF [0,1,0,0,0,1|2,0,0]=4 2227 B7R0.2 ClCC(=O)OC(C)C 1P003RLH [0,1,0,0,0,1|2,0,0]=4 2228 B7R0.2 ClCC(CC(=O)Cl)C 1P00IBOT [0,1,0,0,0,1|2,0,0]=4 2229 B7R0.2 ICC(=O)NC(C)C 1P003TLG [0,1,0,0,0,1|2,0,0]=4 2230 B7R0.2 NC(=O)NC(=O)CO 1P028BC8 [0,1,0,0,0,1|1,0,1]=4 2231 B7R0.2 NCC(=O)CC(C)C 1P007R1H [0,1,0,0,0,1|2,0,0]=4 2232 B7R0.2 NCC(=O)NC(C)C 1P00FDGN [0,1,0,0,0,1|2,0,0]=4 2233 B7R0.2 NCC(=O)NC(C)C 1P00IBC3 [0,1,0,0,0,1|2,0,0]=4 2234 B7R0.2 NCC(=O)OC(C)C 1P003REC [0,1,0,0,0,1|2,0,0]=4 2235 B7R0.2 NCC(C=C(F)F)C 1P028X5H [0,1,0,0,0,1|2,0,0]=4 2236 B7R0.2 NCC(CC(=O)O)N 1P01AIHR [0,1,0,0,0,1|0,0,0]=2 2237 B7R0.2 NCC(CC(=O)O)O 1P0036KT [0,1,0,0,0,1|1,0,0]=3 2238 B7R0.2 NC[C@@H](CC(=O)O)C 1P01C10F [0,1,0,0,0,1|0,0,0]=2 2239 B7R0.2 NC[C@@H](CC(=O)O)O 1P00FBR6 [0,1,0,0,0,1|1,0,0]=3 2240 B7R0.2 NC[C@H](CC(=O)O)O 1P0032WR [0,1,0,0,0,1|1,0,0]=3 2241 B7R0.2 NNC(=O)CC(C)C 1P007O9X [0,1,0,0,0,1|2,0,0]=4 2242 B7R0.2 NNC(=O)NC(C)C 1P00F225 [0,1,0,0,0,1|2,0,0]=4 2243 B7R0.2 NNC(=O)OC(C)C 1P003UFH [0,1,0,0,0,1|2,0,0]=4 2244 B7R0.2 NNC(CC(=O)O)C 1P01BE2H [0,1,0,0,0,1|0,0,0]=2 2245 B7R0.2 O=NN(CC(=O)O)C 1P0011AW [0,1,0,0,0,1|1,0,1]=4 2246 B7R0.2 OC(=O)CC(=O)CCl 1P002V93 [0,1,0,0,0,1|1,0,1]=4 2247 B7R0.2 OCC(=O)NC(C)C 1P01AHTP [0,1,0,0,0,1|1,0,0]=3 2248 B7R0.2 OCC(=O)OC(C)C 1P003RLM [0,1,0,0,0,1|1,0,0]=3 2249 B7R0.2 OCC(CC(=O)O)N 1P00EDPJ [0,1,0,0,0,1|0,0,0]=2 2250 B7R0.2 OC[C@@H](CC(=O)O)N 1P001VOE [0,1,0,0,0,1|0,0,0]=2 2251 B7R0.2 OC[C@H](CC(=O)O)N 1P001VOD [0,1,0,0,0,1|0,0,0]=2 2252 B7R0.2 O[C@H](CF)CC(=O)O 1P029037 [0,1,0,0,0,1|1,0,0]=3 2253 B7R0.2 SCC(=O)OC(C)C 1P008QDW [0,1,0,0,0,1|1,1,0]=4 2254 B7R0.2 [O-]C(=O)CC(C#N)C 1P01B8MC [0,1,0,0,0,1|0,0,2]=4 2255 B7R0.2 [O-]C(=O)CC(CO)C 1P01EMTK [0,1,0,0,0,1|1,0,1]=4 2256 B7R0.9 CC(=O)CC(C)(C)C 1P003KWI [0,1,0,0,0,1|2,0,0]=4 2257 B7R0.9 CC(=O)CC(Cl)(C)C 1P001DU3 [0,1,0,0,0,1|2,0,0]=4 2258 B7R0.9 CC(=O)CC(N)(C)C 1P003L6K [0,1,0,0,0,1|1,0,0]=3 2259 B7R0.9 CC(=O)CC(O)(C)C 1P000KDW [0,1,0,0,0,1|2,0,0]=4 2260 B7R0.9 CC(=O)CC(S)(C)C 1P002C5Z [0,1,0,0,0,1|2,0,0]=4 2261 B7R0.9 CC(=O)NC(C)(C)C 1P003TTT [0,1,0,0,0,1|2,0,0]=4 2262 B7R0.9 CC(=O)OC(C)(C)C 1P0036K8 [0,1,0,0,0,1|2,0,0]=4 2263 B7R0.9 CC(CC(O)(C)C)N 1P01AUW8 [0,1,0,0,0,1|1,0,1]=4 2264 B7R0.9 CC(CS(=O)(=O)C)N 1P01AIJJ [0,1,0,0,0,1|1,0,1]=4 2265 B7R0.9 CC(CS(=O)(=O)F)N 1P028DHF [0,1,0,0,0,1|1,0,1]=4 2266 B7R0.9 CC(CS(=O)(=O)O)O 1P01QMMS [0,1,0,0,0,1|2,0,0]=4 2267 B7R0.9 CC(OS(=O)(=O)O)C 1P01PHLU [0,1,0,0,0,1|2,0,0]=4 2268 B7R0.9 C[C@@H](CS(=O)(=O)C)N 1P0281PD [0,1,0,0,0,1|1,0,1]=4 2269 B7R0.9 C[C@@H](CS(=O)(=O)N)N 1P01EK7M [0,1,0,0,0,1|1,0,1]=4 2270 B7R0.9 C[C@H](CS(=O)(=O)C)N 1P0280D0 [0,1,0,0,0,1|1,0,1]=4 2271 B7R0.9 C[C@H](CS(=O)(=O)N)N 1P01FK99 [0,1,0,0,0,1|1,0,1]=4 2272 B7R0.9 ClC(=O)CC(Br)(C)C 1P01B380 [0,1,0,0,0,1|2,0,0]=4 2273 B7R0.9 ClC(=O)CC(C)(C)C 1P003IU3 [0,1,0,0,0,1|2,0,0]=4 2274 B7R0.9 NC(=O)CC(C)(C)C 1P00H1ZB [0,1,0,0,0,1|2,0,0]=4 2275 B7R0.9 NC(=O)CC(N)(C)C 1P019SGU [0,1,0,0,0,1|1,0,0]=3 2276 B7R0.9 NC(=O)CC(N)(C)C 1P01A7J8 [0,1,0,0,0,1|1,0,0]=3 2277 B7R0.9 NC(=O)NC(C)(C)C 1P003V2Q [0,1,0,0,0,1|2,0,0]=4 2278 B7R0.9 NC(=O)OC(C)(C)C 1P00363R [0,1,0,0,0,1|2,0,0]=4 2279 B7R0.9 OC(=O)CC(Br)(C)C 1P00EPM1 [0,1,0,0,0,1|1,0,0]=3 2280 B7R0.9 OC(=O)CC(Br)(F)F 1P000UQS [0,1,0,0,0,1|2,0,0]=4 2281 B7R0.9 OC(=O)CC(C)(C)C 1P003IU4 [0,1,0,0,0,1|1,0,0]=3 2282 B7R0.9 OC(=O)CC(Cl)(C)C 1P027U6R [0,1,0,0,0,1|1,0,0]=3 2283 B7R0.9 OC(=O)CC(Cl)(F)F 1P0289J5 [0,1,0,0,0,1|2,0,0]=4 2284 B7R0.9 OC(=O)CC(F)(C)C 1P01BUPJ [0,1,0,0,0,1|1,0,0]=3 2285 B7R0.9 OC(=O)CC(F)(F)C 1P01AE6R [0,1,0,0,0,1|1,0,0]=3 2286 B7R0.9 OC(=O)CC(F)(F)F 1P002R5O [0,1,0,0,0,1|2,0,0]=4 2287 B7R0.9 OC(=O)CC(N)(C)C 1P0037NO [0,1,0,0,0,1|0,0,0]=2 2288 B7R0.9 OC(=O)CC(N)(C)C 1P003JBN [0,1,0,0,0,1|0,0,0]=2 2289 B7R0.9 OC(=O)CC(N)(C)C 1P01AGEV [0,1,0,0,0,1|0,0,0]=2 2290 B7R0.9 OC(=O)CC(O)(C)C 1P0039UT [0,1,0,0,0,1|1,0,0]=3 2291 B7R0.9 OC(=O)CC(S)(C)C 1P00392I [0,1,0,0,0,1|1,0,0]=3 2292 B7R0.9 OC(=O)CP(=O)(C)C 1P028MVP [0,1,0,0,0,1|2,0,0]=4 2293 B7R0.9 OC(=O)CS(=O)(=O)C 1P002R5P [0,1,0,0,0,1|2,0,0]=4 2294 B7R0.9 OC(=O)CS(=O)(=O)N 1P019M26 [0,1,0,0,0,1|2,0,0]=4 2295 B7R0.9 OC(=O)C[N+](C)(C)C 1P00IAY4 [0,1,0,0,0,1|2,0,0]=4 2296 B7R0.9 OC(=O)C[Si](C)(C)C 1P002NQR [0,1,0,0,0,1|1,1,0]=4 2297 B7R0.9 [O-]C(=O)CC(O)(C)C 1P003P49 [0,1,0,0,0,1|1,0,1]=4 2298 B7R0.16 BrC(C(=O)C(=O)O)Br 1P00EIWF [0,1,0,0,0,1|2,0,0]=4 2299 B7R0.16 BrC(C(=O)Cl)C(C)C 1P00DNAU [0,1,0,0,0,1|2,0,0]=4 2300 B7R0.16 BrC(C(=O)N)C(C)C 1P019PO7 [0,1,0,0,0,1|2,0,0]=4 2301 B7R0.16 BrC(C(=O)O)C(C)C 1P0036DQ [0,1,0,0,0,1|1,0,0]=3 2302 B7R0.16 Br[C@@H](C(=O)O)C(C)C 1P00G3NN [0,1,0,0,0,1|1,0,0]=3 2303 B7R0.16 Br[C@H](C(=O)O)C(C)C 1P003CVL [0,1,0,0,0,1|1,0,0]=3 2304 B7R0.16 CC(=C(C(=O)O)Br)C 1P001Q6W [0,1,0,0,0,1|1,0,1]=4 2305 B7R0.16 CC(=C(C(=O)O)C)C 1P019YZ2 [0,1,0,0,0,1|1,0,1]=4 2306 B7R0.16 CC(=C(C(=O)O)Cl)C 1P01QZ77 [0,1,0,0,0,1|1,0,1]=4 2307 B7R0.16 CC(=C(C(=O)O)F)C 1P01A0CN [0,1,0,0,0,1|1,0,1]=4 2308 B7R0.16 CC(C(=C)C(=O)Cl)C 1P005OL8 [0,1,0,0,0,1|2,0,0]=4 2309 B7R0.16 CC(C(=C)C(=O)O)C 1P00DRDO [0,1,0,0,0,1|1,0,0]=3 2310 B7R0.16 CC(C(=O)C(=O)C)Br 1P0034FA [0,1,0,0,0,1|2,0,0]=4 2311 B7R0.16 CC(C(=O)C(=O)O)C 1P00347Q [0,1,0,0,0,1|1,0,0]=3 2312 B7R0.16 CC(C(=O)C(=O)[O-])C 1P003URT [0,1,0,0,0,1|1,0,1]=4 2313 B7R0.16 CC(C(=O)C(=O)[O-])C 1P00I9QK [0,1,0,0,0,1|1,0,1]=4 2314 B7R0.16 CC(C(=O)C(=O)[O-])C 1P02841O [0,1,0,0,0,1|1,0,1]=4 2315 B7R0.16 CC(C(=O)Cl)C(C)C 1P00DRED [0,1,0,0,0,1|2,0,0]=4 2316 B7R0.16 CC(C(=O)O)C(C)C 1P007ZPC [0,1,0,0,0,1|1,0,0]=3 2317 B7R0.16 CC(C(=O)O)C(F)F 1P0286NJ [0,1,0,0,0,1|2,0,0]=4 2318 B7R0.16 CC(C(=O)O)C(N)C 1P01AV78 [0,1,0,0,0,1|0,0,0]=2 2319 B7R0.16 CC(C(=O)O)N(C)C 1P00ADBV [0,1,0,0,0,1|2,0,0]=4 2320 B7R0.16 CC(C(C(=O)C)C)C 1P01HJ3E [0,1,0,0,0,1|2,0,0]=4 2321 B7R0.16 CC(C(C(=O)C)S)C 1P005IKG [0,1,0,0,0,1|2,0,0]=4 2322 B7R0.16 CC(C(C(=O)O)C)O 1P00DDYP [0,1,0,0,0,1|1,0,0]=3 2323 B7R0.16 CC(C(C(=O)O)F)O 1P01BGEK [0,1,0,0,0,1|1,0,0]=3 2324 B7R0.16 CC(C(C(=O)O)N)O 1P01DL1Y [0,1,0,0,0,1|1,0,0]=3 2325 B7R0.16 CC(C(C(=O)O)O)N 1P028U2M [0,1,0,0,0,1|0,0,0]=2 2326 B7R0.16 CC(N(C(=O)Cl)C)C 1P00D8AG [0,1,0,0,0,1|2,0,0]=4 2327 B7R0.16 CN(C(=O)C(=O)O)C 1P007J6I [0,1,0,0,0,1|2,0,0]=4 2328 B7R0.16 CP(=O)C(C(=O)O)O 1P006ECW [0,1,0,0,0,1|2,0,0]=4 2329 B7R0.16 C[C@@H](C(=O)O)C(C)C 1P002VES [0,1,0,0,0,1|1,0,0]=3 2330 B7R0.16 C[C@@H](C(=O)O)N(C)C 1P001XKS [0,1,0,0,0,1|2,0,0]=4 2331 B7R0.16 C[C@@H](C(=O)O)N(C)C 1P00BHJU [0,1,0,0,0,1|2,0,0]=4 2332 B7R0.16 C[C@@H]([C@@H](C(=O)O)N)O 1P001J7L [0,1,0,0,0,1|1,0,0]=3 2333 B7R0.16 C[C@@H]([C@H](C(=O)O)N)O 1P00IBMP [0,1,0,0,0,1|1,0,0]=3 2334 B7R0.16 C[C@@H]([C@H](C(=O)O)O)N 1P003B1L [0,1,0,0,0,1|0,0,0]=2 2335 B7R0.16 C[C@H](C(=O)O)C(C)C 1P001N9S [0,1,0,0,0,1|1,0,0]=3 2336 B7R0.16 C[C@H](C(=O)O)N(C)C 1P001PX5 [0,1,0,0,0,1|2,0,0]=4 2337 B7R0.16 C[C@H](C(=O)O)N(C)C 1P00J3DF [0,1,0,0,0,1|2,0,0]=4 2338 B7R0.16 C[C@H]([C@@H](C(=O)N)N)O 1P00BY9J [0,1,0,0,0,1|2,0,0]=4 2339 B7R0.16 C[C@H]([C@@H](C(=O)O)N)Br 1P028AO9 [0,1,0,0,0,1|1,0,0]=3 2340 B7R0.16 C[C@H]([C@@H](C(=O)O)N)O 1P00359M [0,1,0,0,0,1|1,0,0]=3 2341 B7R0.16 C[C@H]([C@@H](C(=O)O)N)O 1P00IB51 [0,1,0,0,0,1|1,0,0]=3 2342 B7R0.16 C[C@H]([C@H](C(=O)O)N)F 1P01BVN1 [0,1,0,0,0,1|1,0,0]=3 2343 B7R0.16 C[C@H]([C@H](C(=O)O)N)O 1P002Q2X [0,1,0,0,0,1|1,0,0]=3 2344 B7R0.16 ClC(C(=O)O)C(C)C 1P019W9W [0,1,0,0,0,1|1,0,0]=3 2345 B7R0.16 Cl[C@H](C(=O)O)C(C)C 1P003D1T [0,1,0,0,0,1|1,0,0]=3 2346 B7R0.16 FC(C(=O)O)C(C)C 1P001Q6L [0,1,0,0,0,1|1,0,0]=3 2347 B7R0.16 NC(C(=O)N)C(C)C 1P00IMQN [0,1,0,0,0,1|2,0,0]=4 2348 B7R0.16 NC(C(=O)O)C(C)C 1P0035KT [0,1,0,0,0,1|1,0,0]=3 2349 B7R0.16 N[C@@H](C(=O)N)C(C)C 1P0014U9 [0,1,0,0,0,1|2,0,0]=4 2350 B7R0.16 N[C@@H](C(=O)O)C(C)C 1P0037JS [0,1,0,0,0,1|1,0,0]=3 2351 B7R0.16 N[C@H](C(=O)N)C(C)C 1P00I645 [0,1,0,0,0,1|2,0,0]=4 2352 B7R0.16 N[C@H](C(=O)O)C(C)C 1P00I9OW [0,1,0,0,0,1|1,0,0]=3 2353 B7R0.16 N[C@H](C(=O)O)C(F)F 1P01G31Q [0,1,0,0,0,1|2,0,0]=4 2354 B7R0.16 N[C@H](C(=O)O)[C@@H](N)C 1P028L4U [0,1,0,0,0,1|0,0,0]=2 2355 B7R0.16 N[C@H](C(=O)O)[C@H](N)C 1P00C212 [0,1,0,0,0,1|0,0,0]=2 2356 B7R0.16 OC(C(=O)O)C(C)C 1P003HUP [0,1,0,0,0,1|1,0,0]=3 2357 B7R0.16 OC(C(=O)O)C(F)F 1P027ABM [0,1,0,0,0,1|2,0,0]=4 2358 B7R0.16 O[C@@H](C(=O)O)C(C)C 1P001ZWR [0,1,0,0,0,1|1,0,0]=3 2359 B7R0.16 O[C@@H](C(=O)O)C(F)F 1P028XNQ [0,1,0,0,0,1|2,0,0]=4 2360 B7R0.16 O[C@H](C(=O)O)C(C)C 1P007V6T [0,1,0,0,0,1|1,0,0]=3 2361 B7R0.16 SC(C(=O)O)C(C)C 1P0019CW [0,1,0,0,0,1|1,0,0]=3 2362 B7R0.16 [15NH2][13C@H]([13C](=O)O)[13CH]([13CH3])[13CH3] 1P00C25L [0,1,0,0,0,1|1,0,0]=3 2363 B7R0.5 C(C(C)C)(=O)OCBr 1P01FWOF [0,2,0,0,0,0|1,0,0]=3 2364 B7R0.5 C=COC(=O)C(=C)C 1P003VRS [0,2,0,0,0,0|1,0,1]=4 2365 B7R0.5 CC(=C)C(=O)NCO 1P006LO4 [0,2,0,0,0,0|1,0,1]=4 2366 B7R0.5 CC(=O)C(CCBr)Br 1P01DX0N [0,2,0,0,0,0|2,0,0]=4 2367 B7R0.5 CC(=O)C(CCBr)F 1P00ELFB [0,2,0,0,0,0|2,0,0]=4 2368 B7R0.5 CC(=O)C(CCCl)Cl 1P00EM1D [0,2,0,0,0,0|2,0,0]=4 2369 B7R0.5 CC(=O)C(CCO)Cl 1P000UWG [0,2,0,0,0,0|2,0,0]=4 2370 B7R0.5 CC(C(=O)C)CC=C 1P01AAP2 [0,2,0,0,0,0|2,0,0]=4 2371 B7R0.5 CC(C(=O)C)CCCl 1P007Q7I [0,2,0,0,0,0|2,0,0]=4 2372 B7R0.5 CC(C(=O)C)SC#N 1P00F1MD [0,2,0,0,0,0|1,0,1]=4 2373 B7R0.5 CC(C(=O)CC#N)C 1P002Z2H [0,2,0,0,0,0|2,0,0]=4 2374 B7R0.5 CC(C(=O)Cl)CCC 1P003I7K [0,2,0,0,0,0|2,0,0]=4 2375 B7R0.5 CC(C(=O)N)CCC 1P00607Q [0,2,0,0,0,0|2,0,0]=4 2376 B7R0.5 CC(C(=O)N)CCO 1P0077PI [0,2,0,0,0,0|2,0,0]=4 2377 B7R0.5 CC(C(=O)N)N=C=S 1P028I1S [0,2,0,0,0,0|1,0,1]=4 2378 B7R0.5 CC(C(=O)N)NCC 1P00J2EF [0,2,0,0,0,0|1,0,0]=3 2379 B7R0.5 CC(C(=O)N=C=O)C 1P01A2AN [0,2,0,0,0,0|1,0,1]=4 2380 B7R0.5 CC(C(=O)N=C=S)C 1P019WXD [0,2,0,0,0,0|1,1,0]=4 2381 B7R0.5 CC(C(=O)O)C=C=C 1P028O41 [0,2,0,0,0,0|1,0,0]=3 2382 B7R0.5 CC(C(=O)O)CC#C 1P008PN0 [0,2,0,0,0,0|1,0,0]=3 2383 B7R0.5 CC(C(=O)O)CC#N 1P01BGKK [0,2,0,0,0,0|0,0,1]=3 2384 B7R0.5 CC(C(=O)O)CC=C 1P001PYS [0,2,0,0,0,0|1,0,0]=3 2385 B7R0.5 CC(C(=O)O)CCC 1P0033V6 [0,2,0,0,0,0|1,0,0]=3 2386 B7R0.5 CC(C(=O)O)CCN 1P007QFU [0,2,0,0,0,0|0,0,0]=2 2387 B7R0.5 CC(C(=O)O)CNC 1P00J2Y9 [0,2,0,0,0,0|0,0,0]=2 2388 B7R0.5 CC(C(=O)O)COC 1P007XM3 [0,2,0,0,0,0|1,0,0]=3 2389 B7R0.5 CC(C(=O)O)CSC 1P00EFBG [0,2,0,0,0,0|1,0,0]=3 2390 B7R0.5 CC(C(=O)O)NCC 1P01DZ09 [0,2,0,0,0,0|0,0,0]=2 2391 B7R0.5 CC(C(=O)O)OCC 1P00I9Y6 [0,2,0,0,0,0|1,0,0]=3 2392 B7R0.5 CC(C(=O)O)SCC 1P002A2O [0,2,0,0,0,0|1,0,0]=3 2393 B7R0.5 CC(S(=O)C)CCN 1P01A1CY [0,2,0,0,0,0|2,0,0]=4 2394 B7R0.5 CCC=C(C(=O)O)F 1P01C40M [0,2,0,0,0,0|1,0,1]=4 2395 B7R0.5 CCCC(=C)C(=O)O 1P00EIR9 [0,2,0,0,0,0|1,0,1]=4 2396 B7R0.5 CCCC(=O)C(=O)O 1P0023U2 [0,2,0,0,0,0|1,0,1]=4 2397 B7R0.5 CCCC(=O)C(C)C 1P003I37 [0,2,0,0,0,0|2,0,0]=4 2398 B7R0.5 CCCC(C(=O)C)Br 1P002ZAM [0,2,0,0,0,0|2,0,0]=4 2399 B7R0.5 CCCC(C(=O)N)Br 1P02852A [0,2,0,0,0,0|2,0,0]=4 2400 B7R0.5 CCCC(C(=O)N)N 1P01B51A [0,2,0,0,0,0|1,0,0]=3 2401 B7R0.5 CCCC(C(=O)O)Br 1P003H9U [0,2,0,0,0,0|1,0,0]=3 2402 B7R0.5 CCCC(C(=O)O)F 1P00B18T [0,2,0,0,0,0|1,0,0]=3 2403 B7R0.5 CCCC(C(=O)O)N 1P0036YR [0,2,0,0,0,0|0,0,0]=2 2404 B7R0.5 CCCC(C(=O)O)O 1P00EBYM [0,2,0,0,0,0|1,0,0]=3 2405 B7R0.5 CCCC(C(=O)O)S 1P00KF9S [0,2,0,0,0,0|1,0,0]=3 2406 B7R0.5 CCC[C@@H](C(=O)N)N 1P0006EZ [0,2,0,0,0,0|1,0,0]=3 2407 B7R0.5 CCC[C@@H](C(=O)O)Br 1P00C8EN [0,2,0,0,0,0|1,0,0]=3 2408 B7R0.5 CCC[C@@H](C(=O)O)N 1P003RTO [0,2,0,0,0,0|0,0,0]=2 2409 B7R0.5 CCC[C@@H](C(=O)O)O 1P00C8CR [0,2,0,0,0,0|1,0,0]=3 2410 B7R0.5 CCC[C@H](C(=O)O)Br 1P01HPLB [0,2,0,0,0,0|1,0,0]=3 2411 B7R0.5 CCC[C@H](C(=O)O)N 1P002DST [0,2,0,0,0,0|0,0,0]=2 2412 B7R0.5 CCC[C@H](C(=O)O)O 1P00CDG2 [0,2,0,0,0,0|1,0,0]=3 2413 B7R0.5 CCNC(=O)C(=O)O 1P00JEDA [0,2,0,0,0,0|1,0,1]=4 2414 B7R0.5 CCNC(=O)C(Cl)C 1P0063NN [0,2,0,0,0,0|2,0,0]=4 2415 B7R0.5 CCNC(=O)C(N)C 1P008VMH [0,2,0,0,0,0|1,0,0]=3 2416 B7R0.5 CCNC(=O)C(N)C 1P0098LW [0,2,0,0,0,0|1,0,0]=3 2417 B7R0.5 CCNC(=O)N(N)C 1P01A4FK [0,2,0,0,0,0|2,0,0]=4 2418 B7R0.5 CCNC(=O)[C@@H](N)C 1P005QE2 [0,2,0,0,0,0|1,0,0]=3 2419 B7R0.5 CCNC(=O)[C@@H](O)C 1P00BBOD [0,2,0,0,0,0|2,0,0]=4 2420 B7R0.5 CCOC(=C)C(=O)O 1P01Q8PF [0,2,0,0,0,0|1,0,1]=4 2421 B7R0.5 CCOC(=N)C(C)C 1P003866 [0,2,0,0,0,0|2,0,0]=4 2422 B7R0.5 CCOC(=O)C(=C)C 1P003QWF [0,2,0,0,0,0|1,0,1]=4 2423 B7R0.5 CCOC(=O)C(=N)N 1P00GBD7 [0,2,0,0,0,0|1,0,1]=4 2424 B7R0.5 CCOC(=O)C(=O)C 1P0035DH [0,2,0,0,0,0|1,0,1]=4 2425 B7R0.5 CCOC(=O)C(=O)N 1P003QWZ [0,2,0,0,0,0|1,0,1]=4 2426 B7R0.5 CCOC(=O)C(=O)O 1P003QF4 [0,2,0,0,0,0|1,0,1]=4 2427 B7R0.5 CCOC(=O)C(=S)N 1P0035DL [0,2,0,0,0,0|1,0,1]=4 2428 B7R0.5 CCOC(=O)C(Br)Br 1P003QVF [0,2,0,0,0,0|2,0,0]=4 2429 B7R0.5 CCOC(=O)C(Br)C 1P0035B0 [0,2,0,0,0,0|1,0,0]=3 2430 B7R0.5 CCOC(=O)C(Br)F 1P0035CL [0,2,0,0,0,0|2,0,0]=4 2431 B7R0.5 CCOC(=O)C(C)C 1P005ZBF [0,2,0,0,0,0|1,0,0]=3 2432 B7R0.5 CCOC(=O)C(Cl)C 1P003QKG [0,2,0,0,0,0|1,0,0]=3 2433 B7R0.5 CCOC(=O)C(Cl)Cl 1P003QVG [0,2,0,0,0,0|2,0,0]=4 2434 B7R0.5 CCOC(=O)C(Cl)F 1P003QV7 [0,2,0,0,0,0|2,0,0]=4 2435 B7R0.5 CCOC(=O)C(F)C 1P000XDF [0,2,0,0,0,0|1,0,0]=3 2436 B7R0.5 CCOC(=O)C(F)F 1P0035DT [0,2,0,0,0,0|2,0,0]=4 2437 B7R0.5 CCOC(=O)C(I)C 1P00BE4W [0,2,0,0,0,0|1,0,0]=3 2438 B7R0.5 CCOC(=O)C(I)F 1P00I8BT [0,2,0,0,0,0|2,0,0]=4 2439 B7R0.5 CCOC(=O)C(I)I 1P028IJU [0,2,0,0,0,0|2,0,0]=4 2440 B7R0.5 CCOC(=O)C(N)C 1P0037FG [0,2,0,0,0,0|0,0,0]=2 2441 B7R0.5 CCOC(=O)C(S)C 1P002BLG [0,2,0,0,0,0|1,0,0]=3 2442 B7R0.5 CCOC(=O)N(C)C 1P003QVJ [0,2,0,0,0,0|2,0,0]=4 2443 B7R0.5 CCOC(=O)N(N)C 1P005GO9 [0,2,0,0,0,0|1,0,0]=3 2444 B7R0.5 CCOC(=O)[C@@H](Br)C 1P0030CM [0,2,0,0,0,0|1,0,0]=3 2445 B7R0.5 CCOC(=O)[C@@H](F)C 1P028T69 [0,2,0,0,0,0|1,0,0]=3 2446 B7R0.5 CCOC(=O)[C@@H](N)C 1P0035JM [0,2,0,0,0,0|0,0,0]=2 2447 B7R0.5 CCOC(=O)[C@@H](O)C 1P0037A3 [0,2,0,0,0,0|1,0,0]=3 2448 B7R0.5 CCOC(=O)[C@H](F)C 1P005NLB [0,2,0,0,0,0|1,0,0]=3 2449 B7R0.5 CCOC(=O)[C@H](N)C 1P003POW [0,2,0,0,0,0|0,0,0]=2 2450 B7R0.5 CCOC(=O)[C@H](O)C 1P0035CT [0,2,0,0,0,0|1,0,0]=3 2451 B7R0.5 CCSC(=O)[C@@H](N)C 1P01KKNJ [0,2,0,0,0,0|0,1,0]=3 2452 B7R0.5 CN(C(=O)C)CCN 1P00H55D [0,2,0,0,0,0|2,0,0]=4 2453 B7R0.5 CNC[C@@H](C(=O)O)N 1P001S54 [0,2,0,0,0,0|0,0,0]=2 2454 B7R0.5 CNC[C@@H](C(=O)O)N 1P0290I6 [0,2,0,0,0,0|0,0,0]=2 2455 B7R0.5 COCC(=C)C(=O)O 1P01BF18 [0,2,0,0,0,0|1,0,1]=4 2456 B7R0.5 COCC(=O)C(C)C 1P01ALE6 [0,2,0,0,0,0|1,0,0]=3 2457 B7R0.5 COCC(=O)N(C)C 1P00BZX1 [0,2,0,0,0,0|2,0,0]=4 2458 B7R0.5 COCC(=O)N(N)C 1P0291GK [0,2,0,0,0,0|1,0,0]=3 2459 B7R0.5 COCC(C(=O)C)C 1P00AXOM [0,2,0,0,0,0|2,0,0]=4 2460 B7R0.5 COCC(C(=O)N)N 1P01A3LI [0,2,0,0,0,0|1,0,0]=3 2461 B7R0.5 COCC(C(=O)O)Br 1P00ED9O [0,2,0,0,0,0|1,0,0]=3 2462 B7R0.5 COCC(C(=O)O)Cl 1P003BNM [0,2,0,0,0,0|1,0,0]=3 2463 B7R0.5 COCC(C(=O)O)N 1P00I6NY [0,2,0,0,0,0|0,0,0]=2 2464 B7R0.5 COCC(C(=O)O)N 1P01A5C9 [0,2,0,0,0,0|0,0,0]=2 2465 B7R0.5 COCC(C(N)C)C 1P01BCYE [0,2,0,0,0,0|1,0,1]=4 2466 B7R0.5 COC[C@@H](C(=O)O)N 1P002BNL [0,2,0,0,0,0|0,0,0]=2 2467 B7R0.5 COC[C@@H](C(=O)O)N 1P0037T9 [0,2,0,0,0,0|0,0,0]=2 2468 B7R0.5 COC[C@H](C(=O)O)N 1P0032VH [0,2,0,0,0,0|0,0,0]=2 2469 B7R0.5 COC[C@H](C(=O)O)N 1P004LJ9 [0,2,0,0,0,0|0,0,0]=2 2470 B7R0.5 CONC(=O)C(=O)O 1P028PC4 [0,2,0,0,0,0|1,0,1]=4 2471 B7R0.5 CSCC(C(=O)O)O 1P001OTX [0,2,0,0,0,0|1,0,0]=3 2472 B7R0.5 CSC[C@@H](C(=O)O)N 1P003UQQ [0,2,0,0,0,0|0,0,0]=2 2473 B7R0.5 C[C@@H](C(=O)O)CC#C 1P028WDU [0,2,0,0,0,0|1,0,0]=3 2474 B7R0.5 C[C@@H](C(=O)O)CC=C 1P01GUL6 [0,2,0,0,0,0|1,0,0]=3 2475 B7R0.5 C[C@@H](C(=O)O)COC 1P027VIC [0,2,0,0,0,0|1,0,0]=3 2476 B7R0.5 C[C@@H](C(=O)O)NCC 1P00ENDL [0,2,0,0,0,0|0,0,0]=2 2477 B7R0.5 C[C@@H]([C@@H](N)C)CCO 1P0284LV [0,2,0,0,0,0|1,0,1]=4 2478 B7R0.5 C[C@H](C(=O)O)CC#C 1P028ZLH [0,2,0,0,0,0|1,0,0]=3 2479 B7R0.5 C[C@H](C(=O)O)COC 1P01AG1F [0,2,0,0,0,0|1,0,0]=3 2480 B7R0.5 C[C@H](C(=O)O)NCC 1P01J7GU [0,2,0,0,0,0|0,0,0]=2 2481 B7R0.5 C[Se]C[C@@H](C(=O)O)N 1P002RYO [0,2,0,0,0,0|0,0,0]=2 2482 B7R0.5 C\C(=C/C=C)\C(=O)O 1P028VMJ [0,2,0,0,0,0|1,0,1]=4 2483 B7R0.5 C\C(=C/CC)\C(=O)O 1P003I2Q [0,2,0,0,0,0|1,0,1]=4 2484 B7R0.5 C\C(=C/CCl)\C(=O)O 1P01I3DR [0,2,0,0,0,0|1,0,1]=4 2485 B7R0.5 C\C(=N/OC)\C(=O)O 1P01KKJY [0,2,0,0,0,0|0,0,2]=4 2486 B7R0.5 ClC(=O)C(CCBr)Br 1P003G6I [0,2,0,0,0,0|2,0,0]=4 2487 B7R0.5 ClCCC(C(=O)Cl)C 1P00I9PJ [0,2,0,0,0,0|2,0,0]=4 2488 B7R0.5 ClCOC(=O)C(C)C 1P0037G1 [0,2,0,0,0,0|1,0,0]=3 2489 B7R0.5 ClCOC(=O)N(C)C 1P01B6YX [0,2,0,0,0,0|2,0,0]=4 2490 B7R0.5 Cl\C=C\C(=O)C(C)C 1P01B79F [0,2,0,0,0,0|2,0,0]=4 2491 B7R0.5 ICOC(=O)C(C)C 1P00ELWR [0,2,0,0,0,0|1,0,0]=3 2492 B7R0.5 NC(=O)C(CCO)O 1P0286EP [0,2,0,0,0,0|2,0,0]=4 2493 B7R0.5 NC(C(=O)N)CC#C 1P01A3AH [0,2,0,0,0,0|1,0,0]=3 2494 B7R0.5 NC(C(=O)O)CC#C 1P001YWB [0,2,0,0,0,0|0,0,0]=2 2495 B7R0.5 NC(C(=O)O)CC#C 1P0037TV [0,2,0,0,0,0|0,0,0]=2 2496 B7R0.5 NC(C(=O)O)CC=C 1P00ID8H [0,2,0,0,0,0|0,0,0]=2 2497 B7R0.5 NC(C(=O)O)CCCl 1P028VVG [0,2,0,0,0,0|0,0,0]=2 2498 B7R0.5 NC(C(=O)O)CCF 1P01B2JO [0,2,0,0,0,0|0,0,0]=2 2499 B7R0.5 NC(C(=O)O)CCN 1P0030UF [0,2,0,0,0,0|0,0,0]=2 2500 B7R0.5 NC(C(=O)O)CCS 1P00396E [0,2,0,0,0,0|0,0,0]=2 2501 B7R0.5 NCCC(C(=O)O)F 1P002TO1 [0,2,0,0,0,0|1,0,0]=3 2502 B7R0.5 NCCC(C(=O)O)N 1P003598 [0,2,0,0,0,0|0,0,0]=2 2503 B7R0.5 NCCC(C(=O)O)O 1P0039EQ [0,2,0,0,0,0|1,0,0]=3 2504 B7R0.5 NCC[C@@H](C(=O)O)N 1P002H9V [0,2,0,0,0,0|0,0,0]=2 2505 B7R0.5 NCC[C@@H](C(=O)O)O 1P003CUM [0,2,0,0,0,0|1,0,0]=3 2506 B7R0.5 NCC[C@H](C(=O)O)N 1P000XM3 [0,2,0,0,0,0|0,0,0]=2 2507 B7R0.5 NCC[C@H](C(=O)O)O 1P000EBP [0,2,0,0,0,0|1,0,0]=3 2508 B7R0.5 NOCC(=O)N(C)C 1P02883Z [0,2,0,0,0,0|2,0,0]=4 2509 B7R0.5 N[C@@H](C(=O)O)CC#C 1P002N2N [0,2,0,0,0,0|0,0,0]=2 2510 B7R0.5 N[C@@H](C(=O)O)CC#C 1P00GROI [0,2,0,0,0,0|0,0,0]=2 2511 B7R0.5 N[C@@H](C(=O)O)CC=C 1P003POY [0,2,0,0,0,0|0,0,0]=2 2512 B7R0.5 N[C@@H](C(=O)O)CC=C 1P007D56 [0,2,0,0,0,0|0,0,0]=2 2513 B7R0.5 N[C@@H](C(=O)O)CCN 1P007MVB [0,2,0,0,0,0|0,0,0]=2 2514 B7R0.5 N[C@@H](C(=O)O)CCS 1P00ECTR [0,2,0,0,0,0|0,0,0]=2 2515 B7R0.5 N[C@H](C(=O)O)CC#C 1P002C6G [0,2,0,0,0,0|0,0,0]=2 2516 B7R0.5 N[C@H](C(=O)O)CC#C 1P002N2O [0,2,0,0,0,0|0,0,0]=2 2517 B7R0.5 N[C@H](C(=O)O)CC=C 1P001UJ3 [0,2,0,0,0,0|0,0,0]=2 2518 B7R0.5 N[C@H](C(=O)O)CC=C 1P003CU8 [0,2,0,0,0,0|0,0,0]=2 2519 B7R0.5 N[C@H](C(=O)O)CCBr 1P003CX0 [0,2,0,0,0,0|0,0,0]=2 2520 B7R0.5 N[C@H](C(=O)O)CCN 1P0021O4 [0,2,0,0,0,0|0,0,0]=2 2521 B7R0.5 N[C@H](C(=O)O)CCN 1P005GDQ [0,2,0,0,0,0|0,0,0]=2 2522 B7R0.5 N[C@H](C(=O)O)CCN 1P00AKKB [0,2,0,0,0,0|0,0,0]=2 2523 B7R0.5 N[C@H](C(=O)O)CCS 1P0037WB [0,2,0,0,0,0|0,0,0]=2 2524 B7R0.5 O=CNC(C(=O)O)C 1P003THZ [0,2,0,0,0,0|0,0,0]=2 2525 B7R0.5 O=CN[C@H](C(=O)O)C 1P003TI4 [0,2,0,0,0,0|0,0,0]=2 2526 B7R0.5 OC(=O)C(=C)CC=C 1P028JZR [0,2,0,0,0,0|1,0,1]=4 2527 B7R0.5 OC(=O)C(CC=C)Cl 1P01BIF8 [0,2,0,0,0,0|1,0,0]=3 2528 B7R0.5 OC(=O)C(CCBr)Br 1P00IBMF [0,2,0,0,0,0|1,0,0]=3 2529 B7R0.5 OC(=O)C(CCF)Br 1P0291J0 [0,2,0,0,0,0|1,0,0]=3 2530 B7R0.5 OC(C(=O)O)CC#C 1P01BEDA [0,2,0,0,0,0|1,0,0]=3 2531 B7R0.5 OCC=C(C(C)C)C 1P01BTWJ [0,2,0,0,0,0|2,0,0]=4 2532 B7R0.5 OCCC(=C)C(C)C 1P028T6A [0,2,0,0,0,0|2,0,0]=4 2533 B7R0.5 OCCC(=O)C(C)C 1P009DD1 [0,2,0,0,0,0|1,0,0]=3 2534 B7R0.5 OCCC(=O)N(C)C 1P002XZ7 [0,2,0,0,0,0|2,0,0]=4 2535 B7R0.5 OCC[C@@H](C(=O)O)N 1P002GON [0,2,0,0,0,0|0,0,0]=2 2536 B7R0.5 OCC[C@H](C(=O)O)N 1P00355P [0,2,0,0,0,0|0,0,0]=2 2537 B7R0.5 OCNC(=O)C(C)C 1P01DL1W [0,2,0,0,0,0|1,0,0]=3 2538 B7R0.5 OC\C=C(\C(=O)O)/C 1P028VCA [0,2,0,0,0,0|1,0,1]=4 2539 B7R0.5 [N-]=[N+]=NC(C(=O)O)C 1P027QIJ [0,2,0,0,0,0|0,0,1]=3 2540 B7R0.5 [N-]=[N+]=N[C@H](C(=O)O)C 1P001659 [0,2,0,0,0,0|0,0,1]=3 2541 B7R0.5 [O-]C(=O)C(CCO)C 1P01EMT0 [0,2,0,0,0,0|1,0,1]=4 2542 B7R0.5 [O-]C(=O)C(COC)O 1P0285SZ [0,2,0,0,0,0|1,0,1]=4 2543 B7R0.10 BrCC(=O)C(=O)OC 1P008R54 [0,2,0,0,0,0|1,0,1]=4 2544 B7R0.10 CC(C(=NO)N)CC 1P019Y5R [0,2,0,0,0,0|2,0,0]=4 2545 B7R0.10 CC(C(=O)CC)C#N 1P019VUI [0,2,0,0,0,0|1,0,1]=4 2546 B7R0.10 CC(C(=O)CCl)OC 1P028XWI [0,2,0,0,0,0|2,0,0]=4 2547 B7R0.10 CC(C(=O)NC)CN 1P00J2NA [0,2,0,0,0,0|1,0,0]=3 2548 B7R0.10 CC(C(=O)NN)CC 1P00FUHT [0,2,0,0,0,0|2,0,0]=4 2549 B7R0.10 CC(C(=O)NN)OC 1P0046XB [0,2,0,0,0,0|2,0,0]=4 2550 B7R0.10 CC(C(=O)OC)C#N 1P001E8T [0,2,0,0,0,0|0,0,1]=3 2551 B7R0.10 CC(C(=O)OC)C=O 1P00DM2O [0,2,0,0,0,0|1,0,0]=3 2552 B7R0.10 CC(C(=O)OC)CBr 1P002AZJ [0,2,0,0,0,0|1,0,0]=3 2553 B7R0.10 CC(C(=O)OC)CF 1P028N17 [0,2,0,0,0,0|1,0,0]=3 2554 B7R0.10 CC(C(=O)OC)CN 1P00490T [0,2,0,0,0,0|0,0,0]=2 2555 B7R0.10 CC(C(=O)OC)CO 1P01A9LL [0,2,0,0,0,0|1,0,0]=3 2556 B7R0.10 CC(C(=O)OC)CS 1P00D6G2 [0,2,0,0,0,0|1,0,0]=3 2557 B7R0.10 CC(\C(=N\O)\N)CC 1P00J2ZV [0,2,0,0,0,0|2,0,0]=4 2558 B7R0.10 CC(\C(=N\O)\N)OC 1P00HIKU [0,2,0,0,0,0|2,0,0]=4 2559 B7R0.10 CCC(=C)C(=O)OC 1P00BVKE [0,2,0,0,0,0|1,0,1]=4 2560 B7R0.10 CCC(=O)C(=O)OC 1P003S5Q [0,2,0,0,0,0|1,0,1]=4 2561 B7R0.10 CCC(=O)C(CC)O 1P003UFW [0,2,0,0,0,0|2,0,0]=4 2562 B7R0.10 CCC(C(=N)OC)C 1P028DNL [0,2,0,0,0,0|2,0,0]=4 2563 B7R0.10 CCC(C(=O)CN)C 1P028VDR [0,2,0,0,0,0|2,0,0]=4 2564 B7R0.10 CCC(C(=O)NN)N 1P027VHN [0,2,0,0,0,0|1,0,0]=3 2565 B7R0.10 CCC(C(=O)NO)N 1P00J375 [0,2,0,0,0,0|0,0,0]=2 2566 B7R0.10 CCC(C(=O)OC)Br 1P003763 [0,2,0,0,0,0|1,0,0]=3 2567 B7R0.10 CCC(C(=O)OC)C 1P003S5F [0,2,0,0,0,0|1,0,0]=3 2568 B7R0.10 CCC(C(=O)OC)Cl 1P002TT6 [0,2,0,0,0,0|1,0,0]=3 2569 B7R0.10 CCC(C(=O)OC)N 1P003599 [0,2,0,0,0,0|0,0,0]=2 2570 B7R0.10 CCC(C(=O)OC)O 1P002ZIT [0,2,0,0,0,0|1,0,0]=3 2571 B7R0.10 CCC(C(=O)OC)S 1P0289SO [0,2,0,0,0,0|1,0,0]=3 2572 B7R0.10 CCC(C(CC)N)O 1P01C22W [0,2,0,0,0,0|1,0,1]=4 2573 B7R0.10 CCN(C(=O)OC)C 1P027UV2 [0,2,0,0,0,0|2,0,0]=4 2574 B7R0.10 CC[C@@H](C(=O)CBr)N 1P0292PL [0,2,0,0,0,0|1,0,0]=3 2575 B7R0.10 CC[C@@H](C(=O)NC)N 1P0290BF [0,2,0,0,0,0|1,0,0]=3 2576 B7R0.10 CC[C@@H](C(=O)OC)Br 1P02848G [0,2,0,0,0,0|1,0,0]=3 2577 B7R0.10 CC[C@@H](C(=O)OC)N 1P0039SD [0,2,0,0,0,0|0,0,0]=2 2578 B7R0.10 CC[C@@H](C(=O)OC)N 1P00AND3 [0,2,0,0,0,0|0,0,0]=2 2579 B7R0.10 CC[C@@H](C(=O)OC)O 1P0036DS [0,2,0,0,0,0|1,0,0]=3 2580 B7R0.10 CC[C@H](C(=O)CBr)N 1P02804I [0,2,0,0,0,0|1,0,0]=3 2581 B7R0.10 CC[C@H](C(=O)NC)N 1P02917U [0,2,0,0,0,0|1,0,0]=3 2582 B7R0.10 CC[C@H](C(=O)OC)Br 1P01DFTB [0,2,0,0,0,0|1,0,0]=3 2583 B7R0.10 CC[C@H](C(=O)OC)N 1P0036WD [0,2,0,0,0,0|0,0,0]=2 2584 B7R0.10 CC[C@H](C(=O)OC)O 1P0036DY [0,2,0,0,0,0|1,0,0]=3 2585 B7R0.10 CN(C(=O)OC)CCl 1P01DX21 [0,2,0,0,0,0|2,0,0]=4 2586 B7R0.10 CNC(=O)C(=O)OC 1P00IA4U [0,2,0,0,0,0|1,0,1]=4 2587 B7R0.10 CNC(=O)C(CN)O 1P01BEER [0,2,0,0,0,0|2,0,0]=4 2588 B7R0.10 CNC(=O)C(CO)N 1P01A7H4 [0,2,0,0,0,0|1,0,0]=3 2589 B7R0.10 CNC(=O)C(CO)N 1P027TPQ [0,2,0,0,0,0|1,0,0]=3 2590 B7R0.10 CNC(=O)C(NC)C 1P00EEAJ [0,2,0,0,0,0|1,0,0]=3 2591 B7R0.10 CNC(=O)[C@@H](NC)C 1P00J38P [0,2,0,0,0,0|1,0,0]=3 2592 B7R0.10 CNC(C(=O)OC)C 1P0092WO [0,2,0,0,0,0|0,0,0]=2 2593 B7R0.10 CNC(C(=O)OC)C 1P00DK8K [0,2,0,0,0,0|0,0,0]=2 2594 B7R0.10 CN[C@@H](C(=O)OC)C 1P002CEB [0,2,0,0,0,0|0,0,0]=2 2595 B7R0.10 CN[C@H](C(=O)OC)C 1P002D9O [0,2,0,0,0,0|0,0,0]=2 2596 B7R0.10 CN[C@H](C(=O)OC)C 1P00C8GB [0,2,0,0,0,0|0,0,0]=2 2597 B7R0.10 COC(=N)C(OC)C 1P027UXQ [0,2,0,0,0,0|2,0,0]=4 2598 B7R0.10 COC(=O)C(=C)CBr 1P0037P1 [0,2,0,0,0,0|1,0,1]=4 2599 B7R0.10 COC(=O)C(=C)CCl 1P00GV0X [0,2,0,0,0,0|1,0,1]=4 2600 B7R0.10 COC(=O)C(=C)CN 1P0289CD [0,2,0,0,0,0|0,0,2]=4 2601 B7R0.10 COC(=O)C(=C)CO 1P0039DX [0,2,0,0,0,0|1,0,1]=4 2602 B7R0.10 COC(=O)C(=C)OC 1P005RYU [0,2,0,0,0,0|1,0,1]=4 2603 B7R0.10 COC(=O)C(=CC)Br 1P002559 [0,2,0,0,0,0|1,0,1]=4 2604 B7R0.10 COC(=O)C(=CC)C 1P003SJI [0,2,0,0,0,0|1,0,1]=4 2605 B7R0.10 COC(=O)C(=O)OC 1P00357V [0,2,0,0,0,0|1,0,1]=4 2606 B7R0.10 COC(=O)C(C=C)N 1P027OVZ [0,2,0,0,0,0|0,0,1]=3 2607 B7R0.10 COC(=O)C(C=C)O 1P003Q9G [0,2,0,0,0,0|1,0,1]=4 2608 B7R0.10 COC(=O)C(C=O)Cl 1P002J2G [0,2,0,0,0,0|1,0,1]=4 2609 B7R0.10 COC(=O)C(CBr)Br 1P003S26 [0,2,0,0,0,0|1,0,0]=3 2610 B7R0.10 COC(=O)C(CCl)Cl 1P00BXT1 [0,2,0,0,0,0|1,0,0]=3 2611 B7R0.10 COC(=O)C(CCl)N 1P007DBD [0,2,0,0,0,0|0,0,0]=2 2612 B7R0.10 COC(=O)C(CCl)O 1P00CN6U [0,2,0,0,0,0|1,0,0]=3 2613 B7R0.10 COC(=O)C(CF)N 1P009GSZ [0,2,0,0,0,0|0,0,0]=2 2614 B7R0.10 COC(=O)C(CF)O 1P028ZOR [0,2,0,0,0,0|1,0,0]=3 2615 B7R0.10 COC(=O)C(CN)F 1P01ALX5 [0,2,0,0,0,0|1,0,0]=3 2616 B7R0.10 COC(=O)C(CN)O 1P01A438 [0,2,0,0,0,0|1,0,0]=3 2617 B7R0.10 COC(=O)C(CO)Br 1P00G8R7 [0,2,0,0,0,0|1,0,0]=3 2618 B7R0.10 COC(=O)C(CO)F 1P006LWG [0,2,0,0,0,0|1,0,0]=3 2619 B7R0.10 COC(=O)C(CO)N 1P0035KP [0,2,0,0,0,0|0,0,0]=2 2620 B7R0.10 COC(=O)C(CO)N 1P00IAHU [0,2,0,0,0,0|0,0,0]=2 2621 B7R0.10 COC(=O)C(CO)O 1P01GNO2 [0,2,0,0,0,0|1,0,0]=3 2622 B7R0.10 COC(=O)C(CS)N 1P00E3PB [0,2,0,0,0,0|0,0,0]=2 2623 B7R0.10 COC(=O)C(OC)C 1P00254D [0,2,0,0,0,0|1,0,0]=3 2624 B7R0.10 COC(=O)C(OC)Cl 1P009WZC [0,2,0,0,0,0|1,0,0]=3 2625 B7R0.10 COC(=O)C(OC)O 1P002BDD [0,2,0,0,0,0|1,0,0]=3 2626 B7R0.10 COC(=O)[C@@H](CBr)N 1P028ABJ [0,2,0,0,0,0|0,0,0]=2 2627 B7R0.10 COC(=O)[C@@H](CCl)N 1P003D48 [0,2,0,0,0,0|0,0,0]=2 2628 B7R0.10 COC(=O)[C@@H](CO)Br 1P023OOG [0,2,0,0,0,0|1,0,0]=3 2629 B7R0.10 COC(=O)[C@@H](CO)N 1P00359W [0,2,0,0,0,0|0,0,0]=2 2630 B7R0.10 COC(=O)[C@@H](CO)O 1P0024OK [0,2,0,0,0,0|1,0,0]=3 2631 B7R0.10 COC(=O)[C@@H](CS)N 1P003PPN [0,2,0,0,0,0|0,0,0]=2 2632 B7R0.10 COC(=O)[C@@H](OC)C 1P01IG4T [0,2,0,0,0,0|1,0,0]=3 2633 B7R0.10 COC(=O)[C@H](CBr)N 1P028AUV [0,2,0,0,0,0|0,0,0]=2 2634 B7R0.10 COC(=O)[C@H](CCl)N 1P007UNW [0,2,0,0,0,0|0,0,0]=2 2635 B7R0.10 COC(=O)[C@H](CN)F 1P01BIWZ [0,2,0,0,0,0|1,0,0]=3 2636 B7R0.10 COC(=O)[C@H](CN)O 1P01A3MB [0,2,0,0,0,0|1,0,0]=3 2637 B7R0.10 COC(=O)[C@H](CO)Br 1P01XFPL [0,2,0,0,0,0|1,0,0]=3 2638 B7R0.10 COC(=O)[C@H](CO)O 1P007IRI [0,2,0,0,0,0|1,0,0]=3 2639 B7R0.10 COC(=O)[C@H](CS)N 1P0039K7 [0,2,0,0,0,0|0,0,0]=2 2640 B7R0.10 COC(=O)[C@H](CS)N 1P003RPE [0,2,0,0,0,0|0,0,0]=2 2641 B7R0.10 COC(=O)\C(=C/C)\C 1P003OCY [0,2,0,0,0,0|1,0,1]=4 2642 B7R0.10 COC(=O)\C(=C\Br)\C 1P00BZQR [0,2,0,0,0,0|1,0,1]=4 2643 B7R0.10 CO[C@@H]([C@@H](CO)N)C 1P01C9Z0 [0,2,0,0,0,0|1,0,1]=4 2644 B7R0.10 CSC(C(=O)OC)Br 1P01AMBH [0,2,0,0,0,0|1,0,0]=3 2645 B7R0.10 CSC(C(=O)OC)C 1P003S5J [0,2,0,0,0,0|1,0,0]=3 2646 B7R0.10 C[C@@H](C(=O)NN)CO 1P027U9Z [0,2,0,0,0,0|2,0,0]=4 2647 B7R0.10 C[C@@H](C(=O)OC)CBr 1P003RZT [0,2,0,0,0,0|1,0,0]=3 2648 B7R0.10 C[C@@H](C(=O)OC)CN 1P028GC7 [0,2,0,0,0,0|0,0,0]=2 2649 B7R0.10 C[C@@H](C(=O)OC)CO 1P0035LR [0,2,0,0,0,0|1,0,0]=3 2650 B7R0.10 C[C@H](C(=O)NN)CO 1P027X75 [0,2,0,0,0,0|2,0,0]=4 2651 B7R0.10 C[C@H](C(=O)OC)CBr 1P003RZM [0,2,0,0,0,0|1,0,0]=3 2652 B7R0.10 C[C@H](C(=O)OC)CN 1P01RNEO [0,2,0,0,0,0|0,0,0]=2 2653 B7R0.10 C[C@H](C(=O)OC)CO 1P0035LU [0,2,0,0,0,0|1,0,0]=3 2654 B7R0.10 NC(C(=O)NN)CO 1P0036LD [0,2,0,0,0,0|1,0,0]=3 2655 B7R0.10 NC[C@@H](C(=O)OC)N 1P00AOD5 [0,2,0,0,0,0|0,0,0]=2 2656 B7R0.10 NNC(=O)C(=O)OC 1P00EEU0 [0,2,0,0,0,0|1,0,1]=4 2657 B7R0.10 NOC(C(=O)OC)C 1P01DIAE [0,2,0,0,0,0|0,0,0]=2 2658 B7R0.10 NO[C@@H](C(=O)OC)C 1P028Q1H [0,2,0,0,0,0|0,0,0]=2 2659 B7R0.10 NO[C@H](C(=O)OC)C 1P028Q1U [0,2,0,0,0,0|0,0,0]=2 2660 B7R0.10 OCC(=O)[C@H](CO)O 1P00DDQ7 [0,2,0,0,0,0|1,0,0]=3 2661 B7R0.10 OCC(C(=O)CC)C 1P01HOP8 [0,2,0,0,0,0|2,0,0]=4 2662 B7R0.10 OCC(C(=O)NO)N 1P01FLIC [0,2,0,0,0,0|0,0,0]=2 2663 B7R0.10 OC[C@@H]([C@@H](C=O)O)O 1P00I9Z8 [0,2,0,0,0,0|1,0,1]=4 2664 B7R0.10 OC[C@H]([C@@H](C=O)O)O 1P00IJ56 [0,2,0,0,0,0|1,0,1]=4 2665 B7R0.10 [C-]#[N+]C(C(=O)OC)C 1P00C94O [0,2,0,0,0,0|0,0,1]=3 2666 B7R0.13 BrCC(C(=O)C)(F)F 1P01DZ6I [0,2,0,0,0,0|2,0,0]=4 2667 B7R0.13 BrCC(C(=O)N)(C)C 1P01F42I [0,2,0,0,0,0|2,0,0]=4 2668 B7R0.13 BrCC(C(=O)O)(C)C 1P00I5SQ [0,2,0,0,0,0|1,0,0]=3 2669 B7R0.13 BrCC(C(=O)O)(F)F 1P001507 [0,2,0,0,0,0|1,0,0]=3 2670 B7R0.13 C#CC(C(=O)Cl)(C)C 1P008UIG [0,2,0,0,0,0|2,0,0]=4 2671 B7R0.13 C#CC(C(=O)O)(C)C 1P00380P [0,2,0,0,0,0|1,0,0]=3 2672 B7R0.13 C=CC(C(=O)O)(C)C 1P0008RY [0,2,0,0,0,0|1,0,0]=3 2673 B7R0.13 C=CC(C(=O)O)(F)F 1P01IXT6 [0,2,0,0,0,0|1,0,1]=4 2674 B7R0.13 CC(C(=O)N)(CC)N 1P01A94H [0,2,0,0,0,0|1,0,0]=3 2675 B7R0.13 CC(C(=O)N)(CC)N 1P01ADWL [0,2,0,0,0,0|1,0,0]=3 2676 B7R0.13 CC(C(=O)O)(C=C)O 1P007JFU [0,2,0,0,0,0|1,0,0]=3 2677 B7R0.13 CC(C(=O)O)(CBr)Br 1P00CNNH [0,2,0,0,0,0|1,0,0]=3 2678 B7R0.13 CC(C(=O)O)(CBr)F 1P0292LL [0,2,0,0,0,0|1,0,0]=3 2679 B7R0.13 CC(C(=O)O)(CC)Br 1P00BY6X [0,2,0,0,0,0|1,0,0]=3 2680 B7R0.13 CC(C(=O)O)(CC)F 1P028RFD [0,2,0,0,0,0|1,0,0]=3 2681 B7R0.13 CC(C(=O)O)(CC)N 1P0072LM [0,2,0,0,0,0|0,0,0]=2 2682 B7R0.13 CC(C(=O)O)(CC)N 1P00FJ8C [0,2,0,0,0,0|0,0,0]=2 2683 B7R0.13 CC(C(=O)O)(CC)O 1P0033ST [0,2,0,0,0,0|1,0,0]=3 2684 B7R0.13 CC(C(=O)O)(CCl)Cl 1P003FYA [0,2,0,0,0,0|1,0,0]=3 2685 B7R0.13 CCC(C(=O)C)(C)C 1P002J2S [0,2,0,0,0,0|2,0,0]=4 2686 B7R0.13 CCC(C(=O)Cl)(C)C 1P003BJY [0,2,0,0,0,0|2,0,0]=4 2687 B7R0.13 CCC(C(=O)N)(C)C 1P0006RV [0,2,0,0,0,0|2,0,0]=4 2688 B7R0.13 CCC(C(=O)O)(C)C 1P003FSB [0,2,0,0,0,0|1,0,0]=3 2689 B7R0.13 CCC(C(=O)O)(F)F 1P002OJF [0,2,0,0,0,0|1,0,0]=3 2690 B7R0.13 CNC(C(=O)N)(C)C 1P01BBOR [0,2,0,0,0,0|1,0,0]=3 2691 B7R0.13 CNC(C(=O)N)(C)C 1P01BCN5 [0,2,0,0,0,0|1,0,0]=3 2692 B7R0.13 CNC(C(=O)O)(C)C 1P0017L1 [0,2,0,0,0,0|0,0,0]=2 2693 B7R0.13 CNC(C(=O)O)(C)C 1P003TM2 [0,2,0,0,0,0|0,0,0]=2 2694 B7R0.13 COC(C(=O)C)(C)C 1P00CS4C [0,2,0,0,0,0|2,0,0]=4 2695 B7R0.13 COC(C(=O)N)(C)C 1P008K10 [0,2,0,0,0,0|2,0,0]=4 2696 B7R0.13 COC(C(=O)O)(C)C 1P00194A [0,2,0,0,0,0|1,0,0]=3 2697 B7R0.13 CSC(C(=O)O)(C)C 1P01B62J [0,2,0,0,0,0|1,0,0]=3 2698 B7R0.13 C[C@@](C(=O)O)(CBr)O 1P002SLL [0,2,0,0,0,0|1,0,0]=3 2699 B7R0.13 C[C@@](C(=O)O)(CC)N 1P00E3LH [0,2,0,0,0,0|0,0,0]=2 2700 B7R0.13 C[C@@](C(=O)O)(CC)O 1P01GB7L [0,2,0,0,0,0|1,0,0]=3 2701 B7R0.13 C[C@@](C(=O)O)(CS)N 1P001LN9 [0,2,0,0,0,0|0,0,0]=2 2702 B7R0.13 C[C@](C(=O)O)(CBr)O 1P003C5H [0,2,0,0,0,0|1,0,0]=3 2703 B7R0.13 C[C@](C(=O)O)(CC)N 1P00313O [0,2,0,0,0,0|0,0,0]=2 2704 B7R0.13 C[C@](C(=O)O)(CS)N 1P001NIA [0,2,0,0,0,0|0,0,0]=2 2705 B7R0.13 ClCC(C(=O)C)(C)C 1P01C2Z1 [0,2,0,0,0,0|2,0,0]=4 2706 B7R0.13 ClCC(C(=O)O)(C)C 1P003441 [0,2,0,0,0,0|1,0,0]=3 2707 B7R0.13 FCC(C(=O)O)(C)C 1P0037D5 [0,2,0,0,0,0|1,0,0]=3 2708 B7R0.13 FCC(C(=O)O)(F)F 1P01EKKU [0,2,0,0,0,0|1,0,0]=3 2709 B7R0.13 N#CC(C(=O)C)(C)C 1P00CL9C [0,2,0,0,0,0|1,0,1]=4 2710 B7R0.13 N#CC(C(=O)Cl)(C)C 1P006X5E [0,2,0,0,0,0|1,0,1]=4 2711 B7R0.13 N#CC(C(=O)N)(C)C 1P0057R4 [0,2,0,0,0,0|1,0,1]=4 2712 B7R0.13 N#CC(C(=O)O)(C)C 1P007OYG [0,2,0,0,0,0|0,0,1]=3 2713 B7R0.13 NCC(C(=O)N)(C)C 1P003JAS [0,2,0,0,0,0|1,0,0]=3 2714 B7R0.13 NCC(C(=O)N)(F)F 1P01EIHS [0,2,0,0,0,0|2,0,0]=4 2715 B7R0.13 NCC(C(=O)O)(C)C 1P002EZ9 [0,2,0,0,0,0|0,0,0]=2 2716 B7R0.13 NCC(C(=O)O)(C)C 1P003JAT [0,2,0,0,0,0|0,0,0]=2 2717 B7R0.13 NCC(C(=O)O)(F)F 1P000HSK [0,2,0,0,0,0|1,0,0]=3 2718 B7R0.13 NCC(C(=O)O)(F)F 1P00CI0Y [0,2,0,0,0,0|1,0,0]=3 2719 B7R0.13 NCC(C(=O)O)(N)C 1P01BAYD [0,2,0,0,0,0|0,0,0]=2 2720 B7R0.13 NCC(C(O)C)(C)C 1P01BMVC [0,2,0,0,0,0|1,0,1]=4 2721 B7R0.13 NC[C@@](C(=O)O)(N)C 1P027XE1 [0,2,0,0,0,0|0,0,0]=2 2722 B7R0.13 NNC(C(=O)O)(C)C 1P028RCH [0,2,0,0,0,0|0,0,0]=2 2723 B7R0.13 NOC(C(=O)O)(C)C 1P004064 [0,2,0,0,0,0|0,0,0]=2 2724 B7R0.13 OCC(C(=O)C)(C)C 1P00AXPU [0,2,0,0,0,0|2,0,0]=4 2725 B7R0.13 OCC(C(=O)O)(C)C 1P003K1K [0,2,0,0,0,0|1,0,0]=3 2726 B7R0.13 OCC(C(=O)O)(F)F 1P01A4AF [0,2,0,0,0,0|1,0,0]=3 2727 B7R0.13 OCC(C(=O)O)(N)C 1P003GUB [0,2,0,0,0,0|0,0,0]=2 2728 B7R0.13 OCC(C(=O)O)(N)C 1P01C1TD [0,2,0,0,0,0|0,0,0]=2 2729 B7R0.13 OCC(C(=O)O)(O)C 1P0033EN [0,2,0,0,0,0|1,0,0]=3 2730 B7R0.13 OCC(C(N)C)(C)C 1P01FIC8 [0,2,0,0,0,0|1,0,1]=4 2731 B7R0.13 OC[C@@](C(=O)O)(N)C 1P001YE4 [0,2,0,0,0,0|0,0,0]=2 2732 B7R0.13 OC[C@](C(=O)O)(N)C 1P0055UM [0,2,0,0,0,0|0,0,0]=2 2733 B7R0.14 BrCC(=O)C(Br)(C)C 1P019TRT [0,2,0,0,0,0|2,0,0]=4 2734 B7R0.14 BrCC(=O)C(C)(C)C 1P003EMF [0,2,0,0,0,0|2,0,0]=4 2735 B7R0.14 BrCC(=O)C(Cl)(C)C 1P028VT6 [0,2,0,0,0,0|2,0,0]=4 2736 B7R0.14 BrCC(=O)C(F)(C)C 1P027W7H [0,2,0,0,0,0|2,0,0]=4 2737 B7R0.14 BrCC(=O)C(F)(F)C 1P028VHC [0,2,0,0,0,0|2,0,0]=4 2738 B7R0.14 BrCC(=O)C(O)(C)C 1P028O9L [0,2,0,0,0,0|2,0,0]=4 2739 B7R0.14 C=CC(=O)C(C)(C)C 1P00BJ3E [0,2,0,0,0,0|2,0,0]=4 2740 B7R0.14 CCC(=O)C(C)(C)C 1P00ECPR [0,2,0,0,0,0|2,0,0]=4 2741 B7R0.14 CCC(=O)C(S)(C)C 1P027U3A [0,2,0,0,0,0|2,0,0]=4 2742 B7R0.14 CCC(C(N)(C)C)O 1P028RK0 [0,2,0,0,0,0|1,0,1]=4 2743 B7R0.14 CCC(C(O)(C)C)N 1P01AMRQ [0,2,0,0,0,0|1,0,1]=4 2744 B7R0.14 CCC(S(=O)(=O)O)C 1P001Y6O [0,2,0,0,0,0|2,0,0]=4 2745 B7R0.14 CNC(=O)C(Br)(C)C 1P005THQ [0,2,0,0,0,0|2,0,0]=4 2746 B7R0.14 CNC(=O)C(C)(C)C 1P003TPC [0,2,0,0,0,0|2,0,0]=4 2747 B7R0.14 CNC(=O)C(N)(C)C 1P00GBU9 [0,2,0,0,0,0|1,0,0]=3 2748 B7R0.14 CNC(C(O)(C)C)C 1P01AUUH [0,2,0,0,0,0|1,0,1]=4 2749 B7R0.14 COC(=N)C(C)(C)C 1P01A71Y [0,2,0,0,0,0|2,0,0]=4 2750 B7R0.14 COC(=O)C(Br)(Br)Br 1P00BYTH [0,2,0,0,0,0|2,0,0]=4 2751 B7R0.14 COC(=O)C(Br)(C)C 1P0035ML [0,2,0,0,0,0|1,0,0]=3 2752 B7R0.14 COC(=O)C(Br)(F)F 1P003SGD [0,2,0,0,0,0|2,0,0]=4 2753 B7R0.14 COC(=O)C(C)(C)C 1P00E9VV [0,2,0,0,0,0|1,0,0]=3 2754 B7R0.14 COC(=O)C(Cl)(C)C 1P01BDCB [0,2,0,0,0,0|1,0,0]=3 2755 B7R0.14 COC(=O)C(Cl)(Cl)C 1P01E39A [0,2,0,0,0,0|1,0,0]=3 2756 B7R0.14 COC(=O)C(Cl)(Cl)F 1P01GDKX [0,2,0,0,0,0|2,0,0]=4 2757 B7R0.14 COC(=O)C(Cl)(F)F 1P001NSC [0,2,0,0,0,0|2,0,0]=4 2758 B7R0.14 COC(=O)C(F)(C)C 1P003S4H [0,2,0,0,0,0|1,0,0]=3 2759 B7R0.14 COC(=O)C(F)(F)C 1P00C74S [0,2,0,0,0,0|1,0,0]=3 2760 B7R0.14 COC(=O)C(F)(F)F 1P00I8RB [0,2,0,0,0,0|2,0,0]=4 2761 B7R0.14 COC(=O)C(N)(C)C 1P00A2K0 [0,2,0,0,0,0|0,0,0]=2 2762 B7R0.14 COC(=O)C(N)(C)C 1P00APYY [0,2,0,0,0,0|0,0,0]=2 2763 B7R0.14 COC(=O)C(O)(C)C 1P002LKW [0,2,0,0,0,0|1,0,0]=3 2764 B7R0.14 COC(=O)C(S)(C)C 1P004PAF [0,2,0,0,0,0|1,0,0]=3 2765 B7R0.14 ClCC(=O)C(C)(C)C 1P003BI7 [0,2,0,0,0,0|2,0,0]=4 2766 B7R0.14 ClCC(=O)C(F)(C)C 1P01BDCF [0,2,0,0,0,0|2,0,0]=4 2767 B7R0.14 ClCC(=O)C(F)(F)C 1P02902D [0,2,0,0,0,0|2,0,0]=4 2768 B7R0.14 FCC(C(N)(C)C)O 1P027W6O [0,2,0,0,0,0|1,0,1]=4 2769 B7R0.14 N#CC(=O)C(C)(C)C 1P0071Q8 [0,2,0,0,0,0|2,0,0]=4 2770 B7R0.14 NCC(=O)C(C)(C)C 1P005EY2 [0,2,0,0,0,0|2,0,0]=4 2771 B7R0.14 NCC(=O)C(C)(C)C 1P00BZ0N [0,2,0,0,0,0|2,0,0]=4 2772 B7R0.14 NCC(=O)C(O)(C)C 1P01BUOU [0,2,0,0,0,0|2,0,0]=4 2773 B7R0.14 NCC(S(=O)(=O)C)C 1P01A2WS [0,2,0,0,0,0|1,0,1]=4 2774 B7R0.14 NCC(S(=O)(=O)C)C 1P01B7N0 [0,2,0,0,0,0|1,0,1]=4 2775 B7R0.14 NCC(S(=O)(=O)F)C 1P028EC6 [0,2,0,0,0,0|1,0,1]=4 2776 B7R0.14 NCC(S(=O)(=O)N)C 1P01A4BM [0,2,0,0,0,0|1,0,1]=4 2777 B7R0.14 NC[C@@H](S(=O)(=O)N)C 1P0290ZZ [0,2,0,0,0,0|1,0,1]=4 2778 B7R0.14 NC[C@H](S(=O)(=O)N)C 1P0290T4 [0,2,0,0,0,0|1,0,1]=4 2779 B7R0.14 NNC(=O)C(C)(C)C 1P00I8Q3 [0,2,0,0,0,0|2,0,0]=4 2780 B7R0.14 NNC(=O)C(F)(F)C 1P01BUOT [0,2,0,0,0,0|2,0,0]=4 2781 B7R0.14 NNC(=O)C(O)(C)C 1P00BZKC [0,2,0,0,0,0|2,0,0]=4 2782 B7R0.14 O([2H])C(=O)C([2H])([2H])[2H] 1P003O3O [0,2,0,0,0,0|2,0,0]=4 2783 B7R0.14 O([2H])C(=O)C([2H])([2H])[2H] 1P003OAX [0,2,0,0,0,0|2,0,0]=4 2784 B7R0.14 O([2H])[13C](=O)C([2H])([2H])[2H] 1P00EEY4 [0,2,0,0,0,0|2,0,0]=4 2785 B7R0.14 O=CC(=C)C(C)(C)C 1P005Z0B [0,2,0,0,0,0|2,0,0]=4 2786 B7R0.14 O=CC(=O)C(C)(C)C 1P00DGS3 [0,2,0,0,0,0|1,0,1]=4 2787 B7R0.14 OCC(=O)C(C)(C)C 1P00D4CO [0,2,0,0,0,0|1,0,0]=3 2788 B7R0.14 OCC(C(N)(C)C)O 1P02808R [0,2,0,0,0,0|0,0,2]=4 2789 B7R0.14 OCC(P(=O)(O)O)C 1P028PE5 [0,2,0,0,0,0|2,0,0]=4 2790 B7R0.14 ON=C(C(C)(C)C)C 1P002PS3 [0,2,0,0,0,0|2,0,0]=4 2791 B7R0.14 ONC(=O)C(C)(C)C 1P01AB33 [0,2,0,0,0,0|1,0,0]=3 2792 B7R0.14 ONC(=O)C(N)(C)C 1P01A4A3 [0,2,0,0,0,0|0,0,0]=2 2793 B7R0.14 O\N=C(\C(C)(C)C)/N 1P00C804 [0,2,0,0,0,0|2,0,0]=4 2794 B7R0.14 O\N=C(\C(O)(C)C)/C 1P003K05 [0,2,0,0,0,0|2,0,0]=4 2795 B7R0.14 SCC(=O)C(C)(C)C 1P0089HX [0,2,0,0,0,0|1,1,0]=4 2796 B7R0.15 BrCC(C(=O)O)CBr 1P00342E [0,2,0,0,0,0|1,0,0]=3 2797 B7R0.15 CCC(C(=O)C)C#N 1P01BF2U [0,2,0,0,0,0|1,0,1]=4 2798 B7R0.15 CCC(C(=O)C)CC 1P00ECA8 [0,2,0,0,0,0|2,0,0]=4 2799 B7R0.15 CCC(C(=O)Cl)CC 1P0033RE [0,2,0,0,0,0|2,0,0]=4 2800 B7R0.15 CCC(C(=O)N)CC 1P007TDC [0,2,0,0,0,0|2,0,0]=4 2801 B7R0.15 CCC(C(=O)N)NC 1P009E93 [0,2,0,0,0,0|1,0,0]=3 2802 B7R0.15 CCC(C(=O)O)C#N 1P00DUKD [0,2,0,0,0,0|0,0,1]=3 2803 B7R0.15 CCC(C(=O)O)C=C 1P0280ZW [0,2,0,0,0,0|1,0,0]=3 2804 B7R0.15 CCC(C(=O)O)CC 1P003HO8 [0,2,0,0,0,0|1,0,0]=3 2805 B7R0.15 CCC(C(=O)O)CN 1P01AH6Z [0,2,0,0,0,0|0,0,0]=2 2806 B7R0.15 CCC(C(=O)O)NC 1P019XQL [0,2,0,0,0,0|0,0,0]=2 2807 B7R0.15 CCC(C(=O)O)NN 1P001ROF [0,2,0,0,0,0|0,0,0]=2 2808 B7R0.15 CCC(C(=O)O)OC 1P00EE8W [0,2,0,0,0,0|1,0,0]=3 2809 B7R0.15 CCC(C(=O)O)SC 1P01A281 [0,2,0,0,0,0|1,0,0]=3 2810 B7R0.15 CCC(C(=O)[O-])CC 1P003RV0 [0,2,0,0,0,0|1,0,1]=4 2811 B7R0.15 CCC(C(=O)[O-])CO 1P01C65A [0,2,0,0,0,0|1,0,1]=4 2812 B7R0.15 CC[C@@H](C(=O)N)NC 1P01XC7N [0,2,0,0,0,0|1,0,0]=3 2813 B7R0.15 CC[C@@H](C(=O)O)NC 1P0048OD [0,2,0,0,0,0|0,0,0]=2 2814 B7R0.15 CC[C@H](C(=O)O)CN 1P00IV03 [0,2,0,0,0,0|0,0,0]=2 2815 B7R0.15 CC[C@H](C(=O)O)NC 1P028GU2 [0,2,0,0,0,0|0,0,0]=2 2816 B7R0.15 CN[C@@H](C(=O)O)CO 1P006LN1 [0,2,0,0,0,0|0,0,0]=2 2817 B7R0.15 CN[C@H](C(=O)O)CO 1P009WAM [0,2,0,0,0,0|0,0,0]=2 2818 B7R0.15 CN[C@H](C(=O)O)CS 1P009BLQ [0,2,0,0,0,0|0,0,0]=2 2819 B7R0.15 COC(C(=O)C)OC 1P003SKQ [0,2,0,0,0,0|2,0,0]=4 2820 B7R0.15 COC(C(=O)N)OC 1P005COP [0,2,0,0,0,0|2,0,0]=4 2821 B7R0.15 COC(C(=O)O)C=C 1P0276L0 [0,2,0,0,0,0|1,0,0]=3 2822 B7R0.15 COC(C(=O)O)CN 1P01A4AE [0,2,0,0,0,0|0,0,0]=2 2823 B7R0.15 COC(C(=O)O)CO 1P0287BD [0,2,0,0,0,0|1,0,0]=3 2824 B7R0.15 COC(C(=O)O)OC 1P00ICVO [0,2,0,0,0,0|1,0,0]=3 2825 B7R0.15 COC(C(C)C)C=O 1P01AN81 [0,2,0,0,0,0|1,0,1]=4 2826 B7R0.15 COC(C(N)C)OC 1P00EF8W [0,2,0,0,0,0|0,0,2]=4 2827 B7R0.15 CSC(C(=O)O)CCl 1P028MYD [0,2,0,0,0,0|1,0,0]=3 2828 B7R0.15 CSC(C(=O)O)SC 1P028OBG [0,2,0,0,0,0|1,0,0]=3 2829 B7R0.15 CSC(C(N)C)CO 1P01AKKC [0,2,0,0,0,0|0,1,1]=4 2830 B7R0.15 C\C=C(\C(=O)O)/C#N 1P019GTI [0,2,0,0,0,0|0,0,2]=4 2831 B7R0.15 NCC(C(=O)O)C#N 1P0098SH [0,2,0,0,0,0|0,0,1]=3 2832 B7R0.15 NCC(C(=O)O)CN 1P02918B [0,2,0,0,0,0|0,0,0]=2 2833 B7R0.15 NCC(C(=O)O)NC 1P01BI8O [0,2,0,0,0,0|0,0,0]=2 2834 B7R0.15 NC[C@@H](C(=O)O)CO 1P0016D0 [0,2,0,0,0,0|0,0,0]=2 2835 B7R0.15 OCC(C(=O)O)CO 1P006JAW [0,2,0,0,0,0|1,0,0]=3 2836 B7R0.17 CC(C(N)(C)C)(O)C 1P00IG8B [0,2,0,0,0,0|1,0,1]=4 2837 B7R0.17 CC(C(N)(C)C)(O)C 1P01BS0T [0,2,0,0,0,0|1,0,1]=4 2838 B7R0.17 CC(P(=O)(O)O)(C)C 1P003V2N [0,2,0,0,0,0|2,0,0]=4 2839 B7R0.17 CC(S(=O)(=O)O)(C)C 1P001Y6N [0,2,0,0,0,0|2,0,0]=4 2840 B5R1.2 BrC1=CCC1 1P028I74 [1,0,0,1,0,0|2,0,0]=4 2841 B5R1.2 BrC1COC1 1P00C0QO [1,0,0,1,0,0|1,0,1]=4 2842 B5R1.2 C1CNC1=O 1P0033LA [1,0,0,1,0,0|1,0,0]=3 2843 B5R1.2 C1COC1=O 1P0037NQ [1,0,0,1,0,0|0,0,0]=2 2844 B5R1.2 C=C1CCC1 1P003SKK [1,0,0,1,0,0|2,0,0]=4 2845 B5R1.2 C=C1CNC1 1P01B63I [1,0,0,1,0,0|2,0,0]=4 2846 B5R1.2 CC1CCN1 1P000GWL [1,0,0,1,0,0|1,0,1]=4 2847 B5R1.2 C[C@@H]1CCN1 1P01KAC0 [1,0,0,1,0,0|1,0,1]=4 2848 B5R1.2 C[C@H]1CCN1 1P01K3QZ [1,0,0,1,0,0|1,0,1]=4 2849 B5R1.2 ClC1COC1 1P00DIIS [1,0,0,1,0,0|1,0,1]=4 2850 B5R1.2 IC1COC1 1P002T0O [1,0,0,1,0,0|1,0,1]=4 2851 B5R1.2 NC1CCC1 1P002R5Z [1,0,0,1,0,0|1,0,1]=4 2852 B5R1.2 NC1CCC1 1P003PKK [1,0,0,1,0,0|1,0,1]=4 2853 B5R1.2 NC1CNC1 1P0006Y7 [1,0,0,1,0,0|1,0,1]=4 2854 B5R1.2 NC1COC1 1P0035WN [1,0,0,1,0,0|0,0,1]=3 2855 B5R1.2 NC1COC1 1P00DA6A [1,0,0,1,0,0|0,0,1]=3 2856 B5R1.2 NC1CSC1 1P000YWC [1,0,0,1,0,0|0,1,1]=4 2857 B5R1.2 O=C1CCC1 1P000INX [1,0,0,1,0,0|1,0,0]=3 2858 B5R1.2 O=C1CNC1 1P0021IQ [1,0,0,1,0,0|1,0,0]=3 2859 B5R1.2 O=C1COC1 1P0036MN [1,0,0,1,0,0|2,0,0]=4 2860 B5R1.2 O=C1CSC1 1P003V8S [1,0,0,1,0,0|2,0,0]=4 2861 B5R1.2 O=S1CCC1 1P000ZTK [1,0,0,1,0,0|2,0,0]=4 2862 B5R1.2 OC1CCC1 1P002Y3Q [1,0,0,1,0,0|1,0,1]=4 2863 B5R1.2 OC1CNC1 1P00346P [1,0,0,1,0,0|1,0,1]=4 2864 B5R1.2 OC1CNC1 1P00704V [1,0,0,1,0,0|1,0,1]=4 2865 B5R1.2 OC1COC1 1P0035WM [1,0,0,1,0,0|1,0,1]=4 2866 B5R1.2 SC1COC1 1P003ANX [1,0,0,1,0,0|1,0,1]=4 2867 B5R1.3 C1OC1C=O 1P005XGG [1,0,0,1,0,0|1,0,0]=3 2868 B5R1.3 C=CC1CC1 1P0060GV [1,0,0,1,0,0|2,0,0]=4 2869 B5R1.3 C=CC1CO1 1P0033ZJ [1,0,0,1,0,0|2,0,0]=4 2870 B5R1.3 C=C[C@@H]1CO1 1P00EI3M [1,0,0,1,0,0|2,0,0]=4 2871 B5R1.3 C=C[C@H]1CO1 1P003D20 [1,0,0,1,0,0|2,0,0]=4 2872 B5R1.3 CCC1CO1 1P0083BM [1,0,0,1,0,0|1,0,1]=4 2873 B5R1.3 CC[C@@H]1CN1 1P01GOIJ [1,0,0,1,0,0|1,0,1]=4 2874 B5R1.3 CC[C@@H]1CO1 1P0032UL [1,0,0,1,0,0|1,0,1]=4 2875 B5R1.3 CC[C@H]1CN1 1P01R331 [1,0,0,1,0,0|1,0,1]=4 2876 B5R1.3 CC[C@H]1CO1 1P003150 [1,0,0,1,0,0|1,0,1]=4 2877 B5R1.3 NCC1CN1 1P01HYVN [1,0,0,1,0,0|1,0,1]=4 2878 B5R1.3 O=CC1CC1 1P001LR1 [1,0,0,1,0,0|1,0,0]=3 2879 B5R1.3 OCC1CC1 1P002R60 [1,0,0,1,0,0|1,0,1]=4 2880 B5R1.3 OCC1CO1 1P0037PU [1,0,0,1,0,0|1,0,1]=4 2881 B5R1.3 OC[C@@H]1CO1 1P00393P [1,0,0,1,0,0|1,0,1]=4 2882 B5R1.3 ONC1CC1 1P028DAK [1,0,0,1,0,0|2,0,0]=4 2883 B5R1.4 CC1CC1N 1P00ICCM [1,0,0,1,0,0|1,0,1]=4 2884 B5R1.4 CC1CC1O 1P01E0DQ [1,0,0,1,0,0|1,0,1]=4 2885 B5R1.4 C[C@@H]1C[C@@H]1N 1P024TSQ [1,0,0,1,0,0|1,0,1]=4 2886 B5R1.4 C[C@@H]1C[C@H]1N 1P00IKE0 [1,0,0,1,0,0|1,0,1]=4 2887 B5R1.4 C[C@@H]1C[C@H]1O 1P028IRA [1,0,0,1,0,0|1,0,1]=4 2888 B5R1.4 C[C@@H]1O[C@@H]1C 1P0021OE [1,0,0,1,0,0|1,0,1]=4 2889 B5R1.4 C[C@@H]1O[C@H]1C 1P003669 [1,0,0,1,0,0|1,0,1]=4 2890 B5R1.4 NC1CC1F 1P01JO45 [1,0,0,1,0,0|1,0,1]=4 2891 B5R1.4 N[C@@H]1C[C@@H]1F 1P001G96 [1,0,0,1,0,0|1,0,1]=4 2892 B5R1.4 N[C@@H]1C[C@@H]1N 1P00F6FM [1,0,0,1,0,0|1,0,1]=4 2893 B5R1.4 N[C@@H]1C[C@@H]1O 1P027UM8 [1,0,0,1,0,0|0,0,1]=3 2894 B5R1.4 N[C@@H]1C[C@H]1F 1P00HD8J [1,0,0,1,0,0|1,0,1]=4 2895 B5R1.4 N[C@@H]1C[C@H]1O 1P027VA4 [1,0,0,1,0,0|0,0,1]=3 2896 B5R1.4 N[C@H]1C[C@@H]1F 1P01JVEE [1,0,0,1,0,0|1,0,1]=4 2897 B5R1.4 N[C@H]1C[C@H]1F 1P01JVEQ [1,0,0,1,0,0|1,0,1]=4 2898 B5R1.4 O[C@@H]1C[C@@H]1Cl 1P01DQSZ [1,0,0,1,0,0|1,0,1]=4 2899 B5R1.5 CC1(C)OC1 1P003RJS [1,0,0,1,0,0|1,0,1]=4 2900 B5R1.5 CC1(N)CC1 1P00339U [1,0,0,1,0,0|1,0,1]=4 2901 B5R1.5 CC1(O)CC1 1P002Z3W [1,0,0,1,0,0|1,0,1]=4 2902 B5R1.5 NC1(O)CC1 1P01I9LK [1,0,0,1,0,0|1,0,1]=4 2903 B7R1.2 BrC1=CC(=O)OC1 1P00EL61 [0,0,0,1,0,1|1,0,1]=4 2904 B7R1.2 CC1=CC(=O)OC1 1P003M8M [0,0,0,1,0,1|1,0,1]=4 2905 B7R1.2 CC1C=CC(=O)O1 1P0034RE [0,0,0,1,0,1|2,0,0]=4 2906 B7R1.2 CC1C=CC(=O)S1 1P006AW5 [0,0,0,1,0,1|2,0,0]=4 2907 B7R1.2 CC1CC(=O)CN1 1P021X75 [0,0,0,1,0,1|1,0,0]=3 2908 B7R1.2 CC1CC(=O)CS1 1P019UCN [0,0,0,1,0,1|2,0,0]=4 2909 B7R1.2 CC1CC(=O)NC1 1P0039AR [0,0,0,1,0,1|2,0,0]=4 2910 B7R1.2 CC1CC(=O)OC1 1P00ARBT [0,0,0,1,0,1|1,0,0]=3 2911 B7R1.2 CC1CCC(=O)C1 1P0021LM [0,0,0,1,0,1|2,0,0]=4 2912 B7R1.2 CC1CCC(=O)N1 1P0034RL [0,0,0,1,0,1|2,0,0]=4 2913 B7R1.2 CC1CCC(=O)O1 1P0035FE [0,0,0,1,0,1|2,0,0]=4 2914 B7R1.2 CC1CNC(=O)O1 1P007BAB [0,0,0,1,0,1|2,0,0]=4 2915 B7R1.2 CC1COC(=N1)N 1P00G05P [0,0,0,1,0,1|2,0,0]=4 2916 B7R1.2 CC1COC(=O)N1 1P001SNQ [0,0,0,1,0,1|1,0,0]=3 2917 B7R1.2 CC1COC(=O)O1 1P0035ZW [0,0,0,1,0,1|1,0,0]=3 2918 B7R1.2 CC1COS(=O)O1 1P001EW7 [0,0,0,1,0,1|2,0,0]=4 2919 B7R1.2 CC1NNC(=O)C1 1P008YFX [0,0,0,1,0,1|1,0,0]=3 2920 B7R1.2 C[C@@H]1CC(=O)CN1 1P024WZB [0,0,0,1,0,1|1,0,0]=3 2921 B7R1.2 C[C@@H]1CC(=O)CN1 1P028JFG [0,0,0,1,0,1|1,0,0]=3 2922 B7R1.2 C[C@@H]1CC(=O)NC1 1P002RUA [0,0,0,1,0,1|2,0,0]=4 2923 B7R1.2 C[C@@H]1CCC(=O)C1 1P003CMA [0,0,0,1,0,1|2,0,0]=4 2924 B7R1.2 C[C@@H]1CCC(=O)N1 1P00731A [0,0,0,1,0,1|2,0,0]=4 2925 B7R1.2 C[C@@H]1CCC(=O)O1 1P00IAXM [0,0,0,1,0,1|2,0,0]=4 2926 B7R1.2 C[C@@H]1CNC(=O)O1 1P00HCN8 [0,0,0,1,0,1|2,0,0]=4 2927 B7R1.2 C[C@@H]1COC(=O)N1 1P0073E0 [0,0,0,1,0,1|1,0,0]=3 2928 B7R1.2 C[C@@H]1COC(=O)O1 1P001WYA [0,0,0,1,0,1|1,0,0]=3 2929 B7R1.2 C[C@H]1CC(=O)CN1 1P024HQB [0,0,0,1,0,1|1,0,0]=3 2930 B7R1.2 C[C@H]1CC(=O)NC1 1P00I6FM [0,0,0,1,0,1|2,0,0]=4 2931 B7R1.2 C[C@H]1CC(=O)OC1 1P00EB7B [0,0,0,1,0,1|1,0,0]=3 2932 B7R1.2 C[C@H]1CCC(=O)C1 1P00H79H [0,0,0,1,0,1|2,0,0]=4 2933 B7R1.2 C[C@H]1CCC(=O)N1 1P001OOA [0,0,0,1,0,1|2,0,0]=4 2934 B7R1.2 C[C@H]1CCC(=O)O1 1P01A6OX [0,0,0,1,0,1|2,0,0]=4 2935 B7R1.2 C[C@H]1COC(=O)N1 1P00BYK8 [0,0,0,1,0,1|1,0,0]=3 2936 B7R1.2 C[C@H]1COC(=O)O1 1P0032OB [0,0,0,1,0,1|1,0,0]=3 2937 B7R1.2 Cc1[nH][nH]c(=O)c1 1P0011IO [0,0,0,1,0,1|1,0,1]=4 2938 B7R1.2 ClC1COC(=O)O1 1P003PAC [0,0,0,1,0,1|1,0,0]=3 2939 B7R1.2 FC1COC(=O)O1 1P000BSD [0,0,0,1,0,1|1,0,0]=3 2940 B7R1.2 NC1=CC(=O)CC1 1P002W78 [0,0,0,1,0,1|1,0,1]=4 2941 B7R1.2 NC1=NC(=O)NC1 1P01A4K9 [0,0,0,1,0,1|1,0,1]=4 2942 B7R1.2 NC1CC(=O)NC1 1P003AG1 [0,0,0,1,0,1|1,0,0]=3 2943 B7R1.2 NC1CC(=O)NC1 1P00H05Z [0,0,0,1,0,1|1,0,0]=3 2944 B7R1.2 NC1CC(=O)OC1 1P00A9OT [0,0,0,1,0,1|0,0,0]=2 2945 B7R1.2 NC1CCC(C1)O 1P0013HI [0,0,0,1,0,1|1,0,1]=4 2946 B7R1.2 NC1CCC(C1)O 1P003ATO [0,0,0,1,0,1|1,0,1]=4 2947 B7R1.2 NC1CCS(=O)C1 1P019SXH [0,0,0,1,0,1|2,0,0]=4 2948 B7R1.2 NC1COC(C1)C 1P00BBVZ [0,0,0,1,0,1|1,0,1]=4 2949 B7R1.2 NC1COC(C1)C 1P01C3CB [0,0,0,1,0,1|1,0,1]=4 2950 B7R1.2 N[C@@H]1CC(=O)NC1 1P0026U9 [0,0,0,1,0,1|1,0,0]=3 2951 B7R1.2 N[C@@H]1CC(=O)OC1 1P000I8A [0,0,0,1,0,1|0,0,0]=2 2952 B7R1.2 N[C@@H]1CC[C@@H](C1)O 1P000YJ2 [0,0,0,1,0,1|1,0,1]=4 2953 B7R1.2 N[C@@H]1CC[C@@H](C1)O 1P007XRF [0,0,0,1,0,1|1,0,1]=4 2954 B7R1.2 N[C@@H]1CC[C@H](C1)O 1P000MNR [0,0,0,1,0,1|1,0,1]=4 2955 B7R1.2 N[C@H]1CC(=O)NC1 1P00IL5T [0,0,0,1,0,1|1,0,0]=3 2956 B7R1.2 N[C@H]1CC(=O)OC1 1P000I8B [0,0,0,1,0,1|0,0,0]=2 2957 B7R1.2 N[C@H]1CC[C@@H](C1)O 1P0032SH [0,0,0,1,0,1|1,0,1]=4 2958 B7R1.2 N[C@H]1CC[C@@H](C1)O 1P0039LP [0,0,0,1,0,1|1,0,1]=4 2959 B7R1.2 N[C@H]1CC[C@H](C1)O 1P000XZL [0,0,0,1,0,1|1,0,1]=4 2960 B7R1.2 Nc1noc(=O)[nH]1 1P00B986 [0,0,0,1,0,1|1,0,1]=4 2961 B7R1.2 O=C1OCC(=O)C1 1P003V89 [0,0,0,1,0,1|1,0,1]=4 2962 B7R1.2 O=C1OCC(=O)O1 1P01HE65 [0,0,0,1,0,1|1,0,1]=4 2963 B7R1.2 O=C1OCC(=O)[N-]1 1P01C0SH [0,0,0,1,0,1|1,0,1]=4 2964 B7R1.2 O=c1[nH]oc(=O)[nH]1 1P002P78 [0,0,0,1,0,1|1,0,1]=4 2965 B7R1.2 OC1=CC(=O)OC1 1P0034IY [0,0,0,1,0,1|1,0,1]=4 2966 B7R1.2 OC1CC(=O)NC1 1P00BFR9 [0,0,0,1,0,1|2,0,0]=4 2967 B7R1.2 OC1CC(=O)OC1 1P003BUD [0,0,0,1,0,1|1,0,0]=3 2968 B7R1.2 OC1CCC(=O)C1 1P0038LJ [0,0,0,1,0,1|2,0,0]=4 2969 B7R1.2 OC1CCC(=O)O1 1P01HSO8 [0,0,0,1,0,1|2,0,0]=4 2970 B7R1.2 OC1CNC(C1)C 1P01A1FZ [0,0,0,1,0,1|1,0,1]=4 2971 B7R1.2 OC1CNC(C1)C 1P01BD6F [0,0,0,1,0,1|1,0,1]=4 2972 B7R1.2 O[C@@H]1CC(=O)NC1 1P003BFG [0,0,0,1,0,1|2,0,0]=4 2973 B7R1.2 O[C@@H]1CC(=O)OC1 1P003CQZ [0,0,0,1,0,1|1,0,0]=3 2974 B7R1.2 O[C@@H]1CN[C@@H](C1)C 1P00HC8F [0,0,0,1,0,1|1,0,1]=4 2975 B7R1.2 O[C@@H]1CN[C@H](C1)C 1P008ZIO [0,0,0,1,0,1|1,0,1]=4 2976 B7R1.2 O[C@H]1CC(=O)NC1 1P0032XY [0,0,0,1,0,1|2,0,0]=4 2977 B7R1.2 O[C@H]1CC(=O)OC1 1P005F8J [0,0,0,1,0,1|1,0,0]=3 2978 B7R1.2 O[C@H]1CN[C@@H](C1)C 1P00GAJW [0,0,0,1,0,1|1,0,1]=4 2979 B7R1.2 O[C@H]1CN[C@H](C1)C 1P00ILSC [0,0,0,1,0,1|1,0,1]=4 2980 B7R1.2 Oc1c[nH]c(n1)C 1P0292BX [0,0,0,1,0,1|1,0,1]=4 2981 B7R1.2 Oc1n[nH]c(c1)C 1P001L0T [0,0,0,1,0,1|1,0,1]=4 2982 B7R1.12 CC(=O)[C@@H]1C[C@@H]1F 1P0286F6 [0,0,0,1,0,1|2,0,0]=4 2983 B7R1.12 CC([C@@H]1C[C@H]1N)O 1P028FNT [0,0,0,1,0,1|1,0,1]=4 2984 B7R1.12 CC1=CC1C(=O)O 1P01A35R [0,0,0,1,0,1|1,0,1]=4 2985 B7R1.12 CC1CC1C(=O)C 1P01ALPC [0,0,0,1,0,1|2,0,0]=4 2986 B7R1.12 CC1CC1C(=O)Cl 1P00EII7 [0,0,0,1,0,1|2,0,0]=4 2987 B7R1.12 CC1CC1C(=O)N 1P00GA8W [0,0,0,1,0,1|2,0,0]=4 2988 B7R1.12 CC1CC1C(=O)O 1P002Z71 [0,0,0,1,0,1|1,0,0]=3 2989 B7R1.12 CC1CC1C(=O)O 1P00EK9C [0,0,0,1,0,1|1,0,0]=3 2990 B7R1.12 C[C@@H]1C[C@@H]1C(=O)C 1P028NP2 [0,0,0,1,0,1|2,0,0]=4 2991 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O 1P00BJDC [0,0,0,1,0,1|1,0,0]=3 2992 B7R1.12 C[C@@H]1C[C@H]1C(=O)C 1P028MO8 [0,0,0,1,0,1|2,0,0]=4 2993 B7R1.12 C[C@@H]1C[C@H]1C(=O)O 1P00ELZP [0,0,0,1,0,1|1,0,0]=3 2994 B7R1.12 C[C@@H]1O[C@H]1C(=O)O 1P01B6TE [0,0,0,1,0,1|1,0,0]=3 2995 B7R1.12 C[C@H]1C[C@@H]1C(=O)C 1P028O3I [0,0,0,1,0,1|2,0,0]=4 2996 B7R1.12 C[C@H]1C[C@@H]1C(=O)O 1P00ARLC [0,0,0,1,0,1|1,0,0]=3 2997 B7R1.12 C[C@H]1C[C@H]1C(=O)C 1P028FLW [0,0,0,1,0,1|2,0,0]=4 2998 B7R1.12 C[C@H]1C[C@H]1C(=O)O 1P002ZI0 [0,0,0,1,0,1|1,0,0]=3 2999 B7R1.12 F[C@H]1C[C@@H]1C(=O)O 1P009DKG [0,0,0,1,0,1|1,0,0]=3 3000 B7R1.12 F[C@H]1C[C@H]1C(=O)O 1P00HB72 [0,0,0,1,0,1|1,0,0]=3 3001 B7R1.12 NC(=O)[C@H]1C[C@H]1F 1P000PAK [0,0,0,1,0,1|2,0,0]=4 3002 B7R1.12 OC(=O)C1CC1=C 1P01AELS [0,0,0,1,0,1|1,0,1]=4 3003 B7R1.12 OC(=O)C1CC1F 1P001PI5 [0,0,0,1,0,1|1,0,0]=3 3004 B7R1.12 OC(=O)[C@@H]1C[C@@H]1F 1P000X7B [0,0,0,1,0,1|1,0,0]=3 3005 B7R1.12 OC(=O)[C@@H]1C[C@@H]1I 1P01JUSO [0,0,0,1,0,1|1,0,0]=3 3006 B7R1.12 OC(=O)[C@@H]1C[C@H]1Cl 1P028JBO [0,0,0,1,0,1|1,0,0]=3 3007 B7R1.12 OC(=O)[C@@H]1C[C@H]1F 1P001XKM [0,0,0,1,0,1|1,0,0]=3 3008 B7R1.12 OC(=O)[C@H]1C[C@@H]1Br 1P028QME [0,0,0,1,0,1|1,0,0]=3 3009 B7R1.12 OC(=O)[C@H]1C[C@@H]1F 1P001XKL [0,0,0,1,0,1|1,0,0]=3 3010 B7R1.12 OC(=O)[C@H]1C[C@H]1F 1P000X7C [0,0,0,1,0,1|1,0,0]=3 3011 B7R1.12 OC(=O)[C@H]1C[C@H]1I 1P00182G [0,0,0,1,0,1|1,0,0]=3 3012 B7R1.16 C=C1CC(C1)(C)N 1P027WAS [0,0,0,1,0,1|2,0,0]=4 3013 B7R1.16 NC1CC(C1)(C)O 1P01BD2U [0,0,0,1,0,1|1,0,1]=4 3014 B7R1.16 NC1CS(=O)(=O)C1 1P00HWVI [0,0,0,1,0,1|1,0,1]=4 3015 B7R1.16 NC1CS(=O)(=O)C1 1P00IFL3 [0,0,0,1,0,1|1,0,1]=4 3016 B7R1.16 N[C@@H]1C[C@@](C1)(C)O 1P00IL3T [0,0,0,1,0,1|1,0,1]=4 3017 B7R1.16 N[C@@H]1C[C@](C1)(C)O 1P00HYH2 [0,0,0,1,0,1|1,0,1]=4 3018 B7R1.16 O=C1CC(C1)(C)C 1P000ITC [0,0,0,1,0,1|2,0,0]=4 3019 B7R1.16 O=C1CC(C1)(C)N 1P00ILOR [0,0,0,1,0,1|1,0,0]=3 3020 B7R1.16 O=C1CC(N1)(C)C 1P00DP7Y [0,0,0,1,0,1|2,0,0]=4 3021 B7R1.16 OC1CC(C1)(C)N 1P0039VQ [0,0,0,1,0,1|1,0,1]=4 3022 B7R1.16 O[C@@H]1C[C@@](C1)(C)N 1P001CRF [0,0,0,1,0,1|1,0,1]=4 3023 B7R1.16 O[C@@H]1C[C@](C1)(C)N 1P001CRY [0,0,0,1,0,1|1,0,1]=4 3024 B7R1.20 CC(=O)CC1CC1 1P0037WP [0,0,0,1,0,1|2,0,0]=4 3025 B7R1.20 ClC(=O)CC1CC1 1P00DCW4 [0,0,0,1,0,1|2,0,0]=4 3026 B7R1.20 ClC(=O)NC1CC1 1P01DX1E [0,0,0,1,0,1|2,0,0]=4 3027 B7R1.20 ClC(=O)OC1CC1 1P00E2V3 [0,0,0,1,0,1|2,0,0]=4 3028 B7R1.20 NC(=O)CC1CC1 1P0086XZ [0,0,0,1,0,1|2,0,0]=4 3029 B7R1.20 NC(=O)NC1CC1 1P002BDF [0,0,0,1,0,1|2,0,0]=4 3030 B7R1.20 OC(=O)C=C1CC1 1P00F046 [0,0,0,1,0,1|1,0,1]=4 3031 B7R1.20 OC(=O)CC1CC1 1P00395B [0,0,0,1,0,1|1,0,0]=3 3032 B7R1.20 OC(=O)CC1CO1 1P01DYAP [0,0,0,1,0,1|1,0,0]=3 3033 B7R1.4 BrC1=CCCC1N 1P028PKZ [0,1,0,1,0,0|2,0,0]=4 3034 B7R1.4 C=C1CCOC1=O 1P003O91 [0,1,0,1,0,0|1,0,1]=4 3035 B7R1.4 C=C1COCC1N 1P01FIHO [0,1,0,1,0,0|1,0,0]=3 3036 B7R1.4 C=C1COCC1N 1P01FIHP [0,1,0,1,0,0|1,0,0]=3 3037 B7R1.4 C=C1COCC1O 1P028FM7 [0,1,0,1,0,0|2,0,0]=4 3038 B7R1.4 CC1C=NNC1=O 1P0014T0 [0,1,0,1,0,0|1,0,1]=4 3039 B7R1.4 Cc1c[nH]nc1O 1P00J2YC [0,1,0,1,0,0|1,0,1]=4 3040 B7R1.4 Cn1[nH]ccc1=O 1P00CJF7 [0,1,0,1,0,0|2,0,0]=4 3041 B7R1.4 Cn1ccoc1=O 1P0283EE [0,1,0,1,0,0|2,0,0]=4 3042 B7R1.4 F[C@@H]1COC[C@H]1N 1P028EHH [0,1,0,1,0,0|1,0,1]=4 3043 B7R1.4 F[C@H]1COC[C@@H]1N 1P01DHWS [0,1,0,1,0,0|1,0,1]=4 3044 B7R1.4 F[C@H]1COC[C@H]1N 1P01EK0H [0,1,0,1,0,0|1,0,1]=4 3045 B7R1.4 NC1COCC1C 1P01B6KT [0,1,0,1,0,0|1,0,1]=4 3046 B7R1.4 NC1CONC1=O 1P00359G [0,1,0,1,0,0|0,0,0]=2 3047 B7R1.4 N[C@@H]1CCO[C@@H]1C 1P00I0QF [0,1,0,1,0,0|1,0,1]=4 3048 B7R1.4 N[C@@H]1COC[C@@H]1N 1P0013IL [0,1,0,1,0,0|1,0,1]=4 3049 B7R1.4 N[C@@H]1COC[C@@H]1N 1P00AHE0 [0,1,0,1,0,0|1,0,1]=4 3050 B7R1.4 N[C@@H]1COC[C@H]1N 1P000EB7 [0,1,0,1,0,0|1,0,1]=4 3051 B7R1.4 N[C@@H]1COC[C@H]1N 1P0013II [0,1,0,1,0,0|1,0,1]=4 3052 B7R1.4 N[C@@H]1CONC1=O 1P00IC8N [0,1,0,1,0,0|0,0,0]=2 3053 B7R1.4 N[C@H]1COC[C@@H]1N 1P00DWQL [0,1,0,1,0,0|1,0,1]=4 3054 B7R1.4 N[C@H]1COC[C@H]1C 1P0280JR [0,1,0,1,0,0|1,0,1]=4 3055 B7R1.4 N[C@H]1CONC1=O 1P0035JY [0,1,0,1,0,0|0,0,0]=2 3056 B7R1.4 Nc1no[nH]c1=O 1P00B9RB [0,1,0,1,0,0|1,0,1]=4 3057 B7R1.4 O=C1CCCC1Br 1P006YX5 [0,1,0,1,0,0|2,0,0]=4 3058 B7R1.4 O=C1CCCC1C 1P008SEF [0,1,0,1,0,0|2,0,0]=4 3059 B7R1.4 O=C1CCCC1Cl 1P005MKG [0,1,0,1,0,0|2,0,0]=4 3060 B7R1.4 O=C1CCCC1N 1P00J8QM [0,1,0,1,0,0|1,0,0]=3 3061 B7R1.4 O=C1CCCC1O 1P00DLEF [0,1,0,1,0,0|2,0,0]=4 3062 B7R1.4 O=C1CCCN1N 1P0029LU [0,1,0,1,0,0|2,0,0]=4 3063 B7R1.4 O=C1CCCN1N 1P005RO5 [0,1,0,1,0,0|2,0,0]=4 3064 B7R1.4 O=C1CCC[C@H]1F 1P028FZZ [0,1,0,1,0,0|2,0,0]=4 3065 B7R1.4 O=C1CCNC1C 1P02877G [0,1,0,1,0,0|1,0,0]=3 3066 B7R1.4 O=C1CCOC1C 1P003V5J [0,1,0,1,0,0|2,0,0]=4 3067 B7R1.4 O=C1CCSC1C 1P0012U4 [0,1,0,1,0,0|2,0,0]=4 3068 B7R1.4 O=C1CNCN1C 1P01A57S [0,1,0,1,0,0|2,0,0]=4 3069 B7R1.4 O=C1CNCN1C 1P01AF87 [0,1,0,1,0,0|2,0,0]=4 3070 B7R1.4 O=C1COCC1C 1P01B6KD [0,1,0,1,0,0|1,0,0]=3 3071 B7R1.4 O=C1CSCC1C 1P006YBW [0,1,0,1,0,0|1,1,0]=4 3072 B7R1.4 O=C1NCCC1Br 1P00C7B0 [0,1,0,1,0,0|2,0,0]=4 3073 B7R1.4 O=C1NCCC1C 1P00BDOY [0,1,0,1,0,0|2,0,0]=4 3074 B7R1.4 O=C1NCCC1Cl 1P00KB6W [0,1,0,1,0,0|2,0,0]=4 3075 B7R1.4 O=C1NCCC1F 1P024NNW [0,1,0,1,0,0|2,0,0]=4 3076 B7R1.4 O=C1NCCC1N 1P000IFA [0,1,0,1,0,0|1,0,0]=3 3077 B7R1.4 O=C1NCCC1O 1P00ACH1 [0,1,0,1,0,0|2,0,0]=4 3078 B7R1.4 O=C1NCCN1N 1P00C7B3 [0,1,0,1,0,0|2,0,0]=4 3079 B7R1.4 O=C1NCC[C@@H]1F 1P0204HG [0,1,0,1,0,0|2,0,0]=4 3080 B7R1.4 O=C1NCC[C@@H]1N 1P0037IQ [0,1,0,1,0,0|1,0,0]=3 3081 B7R1.4 O=C1NCC[C@@H]1N 1P00737U [0,1,0,1,0,0|1,0,0]=3 3082 B7R1.4 O=C1NCC[C@@H]1O 1P003D2P [0,1,0,1,0,0|2,0,0]=4 3083 B7R1.4 O=C1NCC[C@H]1C 1P01DXX5 [0,1,0,1,0,0|2,0,0]=4 3084 B7R1.4 O=C1NCC[C@H]1F 1P00K9Y2 [0,1,0,1,0,0|2,0,0]=4 3085 B7R1.4 O=C1NCC[C@H]1N 1P0036IE [0,1,0,1,0,0|1,0,0]=3 3086 B7R1.4 O=C1NCC[C@H]1N 1P006Z7M [0,1,0,1,0,0|1,0,0]=3 3087 B7R1.4 O=C1NCC[C@H]1O 1P003717 [0,1,0,1,0,0|2,0,0]=4 3088 B7R1.4 O=C1OC=CC1Br 1P0056VE [0,1,0,1,0,0|1,0,1]=4 3089 B7R1.4 O=C1OCC=C1C 1P003K5L [0,1,0,1,0,0|1,0,1]=4 3090 B7R1.4 O=C1OCC=C1Cl 1P0032D1 [0,1,0,1,0,0|1,0,1]=4 3091 B7R1.4 O=C1OCC=C1N 1P00I73J [0,1,0,1,0,0|0,0,1]=3 3092 B7R1.4 O=C1OCCC1Br 1P003VWE [0,1,0,1,0,0|1,0,0]=3 3093 B7R1.4 O=C1OCCC1C 1P0039WP [0,1,0,1,0,0|1,0,0]=3 3094 B7R1.4 O=C1OCCC1N 1P000ISK [0,1,0,1,0,0|0,0,0]=2 3095 B7R1.4 O=C1OCCC1N 1P0039XO [0,1,0,1,0,0|0,0,0]=2 3096 B7R1.4 O=C1OCCC1N 1P003O8H [0,1,0,1,0,0|0,0,0]=2 3097 B7R1.4 O=C1OCCC1O 1P00I3IV [0,1,0,1,0,0|1,0,0]=3 3098 B7R1.4 O=C1OCCC1S 1P001CQF [0,1,0,1,0,0|1,0,0]=3 3099 B7R1.4 O=C1OCCN1C 1P002BY1 [0,1,0,1,0,0|2,0,0]=4 3100 B7R1.4 O=C1OCCN1N 1P00341H [0,1,0,1,0,0|1,0,0]=3 3101 B7R1.4 O=C1OCC[C@@H]1N 1P003CUP [0,1,0,1,0,0|0,0,0]=2 3102 B7R1.4 O=C1OCC[C@@H]1N 1P00I4P8 [0,1,0,1,0,0|0,0,0]=2 3103 B7R1.4 O=C1OCC[C@@H]1O 1P00DEAA [0,1,0,1,0,0|1,0,0]=3 3104 B7R1.4 O=C1OCC[C@H]1N 1P00355Q [0,1,0,1,0,0|0,0,0]=2 3105 B7R1.4 O=C1OCC[C@H]1N 1P00DJY6 [0,1,0,1,0,0|0,0,0]=2 3106 B7R1.4 O=C1OCC[C@H]1O 1P0032VV [0,1,0,1,0,0|1,0,0]=3 3107 B7R1.4 O=C1SCCC1N 1P003A2J [0,1,0,1,0,0|0,1,0]=3 3108 B7R1.4 O=C1SCC[C@@H]1N 1P00BYQS [0,1,0,1,0,0|0,1,0]=3 3109 B7R1.4 OC1CCCC1N 1P0063PU [0,1,0,1,0,0|1,0,1]=4 3110 B7R1.4 OC1CNCC1C 1P00B7NZ [0,1,0,1,0,0|1,0,1]=4 3111 B7R1.4 OC1CNCC1N 1P00GAL6 [0,1,0,1,0,0|1,0,1]=4 3112 B7R1.4 OC1COCC1N 1P000W1Z [0,1,0,1,0,0|0,0,2]=4 3113 B7R1.4 OC1COCC1N 1P001KPS [0,1,0,1,0,0|0,0,2]=4 3114 B7R1.4 O[C@@H]1CCC[C@@H]1N 1P0013H6 [0,1,0,1,0,0|1,0,1]=4 3115 B7R1.4 O[C@@H]1CCC[C@H]1N 1P003662 [0,1,0,1,0,0|1,0,1]=4 3116 B7R1.4 O[C@@H]1CCN[C@H]1C 1P01B8DB [0,1,0,1,0,0|1,0,1]=4 3117 B7R1.4 O[C@@H]1CNC[C@H]1C 1P028P0R [0,1,0,1,0,0|1,0,1]=4 3118 B7R1.4 O[C@@H]1CNC[C@H]1N 1P028GSI [0,1,0,1,0,0|1,0,1]=4 3119 B7R1.4 O[C@@H]1COC[C@@H]1N 1P00DWPL [0,1,0,1,0,0|0,0,2]=4 3120 B7R1.4 O[C@@H]1COC[C@@H]1N 1P00ILJZ [0,1,0,1,0,0|0,0,2]=4 3121 B7R1.4 O[C@@H]1COC[C@H]1N 1P003AXA [0,1,0,1,0,0|0,0,2]=4 3122 B7R1.4 O[C@@H]1COC[C@H]1N 1P01BD0K [0,1,0,1,0,0|0,0,2]=4 3123 B7R1.4 O[C@H]1CCC[C@@H]1N 1P003663 [0,1,0,1,0,0|1,0,1]=4 3124 B7R1.4 O[C@H]1CCC[C@@H]1N 1P00EI3F [0,1,0,1,0,0|1,0,1]=4 3125 B7R1.4 O[C@H]1CCC[C@@H]1N 1P00I6HD [0,1,0,1,0,0|1,0,1]=4 3126 B7R1.4 O[C@H]1CCC[C@H]1N 1P00352Q [0,1,0,1,0,0|1,0,1]=4 3127 B7R1.4 O[C@H]1CCN[C@@H]1C 1P01PAQL [0,1,0,1,0,0|1,0,1]=4 3128 B7R1.4 O[C@H]1CCN[C@H]1C 1P01E88W [0,1,0,1,0,0|1,0,1]=4 3129 B7R1.4 O[C@H]1CNC[C@@H]1C 1P002TYQ [0,1,0,1,0,0|1,0,1]=4 3130 B7R1.4 O[C@H]1CNC[C@H]1C 1P002TZU [0,1,0,1,0,0|1,0,1]=4 3131 B7R1.4 O[C@H]1CNC[C@H]1C 1P01K8GK [0,1,0,1,0,0|1,0,1]=4 3132 B7R1.4 O[C@H]1COC[C@@H]1N 1P002FAF [0,1,0,1,0,0|0,0,2]=4 3133 B7R1.4 O[C@H]1COC[C@@H]1N 1P00BFVI [0,1,0,1,0,0|0,0,2]=4 3134 B7R1.4 O[C@H]1COC[C@@H]1N 1P00C780 [0,1,0,1,0,0|0,0,2]=4 3135 B7R1.4 O[C@H]1COC[C@H]1N 1P00AEA6 [0,1,0,1,0,0|0,0,2]=4 3136 B7R1.8 CCC1CCC1=O 1P008TOV [0,1,0,1,0,0|2,0,0]=4 3137 B7R1.8 CNC1CNC1=O 1P028A60 [0,1,0,1,0,0|1,0,0]=3 3138 B7R1.8 CN[C@@H]1CC[C@H]1O 1P024O8G [0,1,0,1,0,0|1,0,1]=4 3139 B7R1.8 COC1CCC1=O 1P01JVE1 [0,1,0,1,0,0|2,0,0]=4 3140 B7R1.8 CO[C@H]1CC[C@@H]1N 1P01KAEY [0,1,0,1,0,0|1,0,1]=4 3141 B7R1.8 CO[C@H]1CC[C@H]1N 1P01KAG0 [0,1,0,1,0,0|1,0,1]=4 3142 B7R1.8 CSC1CCC1=O 1P01C4DE [0,1,0,1,0,0|2,0,0]=4 3143 B7R1.8 NC[C@@H]1CC[C@@H]1O 1P028HUW [0,1,0,1,0,0|1,0,1]=4 3144 B7R1.8 NC[C@@H]1CC[C@H]1O 1P028W6T [0,1,0,1,0,0|1,0,1]=4 3145 B7R1.8 NC[C@H]1CC[C@@H]1O 1P027WNT [0,1,0,1,0,0|1,0,1]=4 3146 B7R1.8 NC[C@H]1CC[C@H]1O 1P027WVA [0,1,0,1,0,0|1,0,1]=4 3147 B7R1.8 N[C@@H]1CC[C@@H]1CO 1P028PD3 [0,1,0,1,0,0|1,0,1]=4 3148 B7R1.8 N[C@@H]1CC[C@H]1CO 1P028FJ7 [0,1,0,1,0,0|1,0,1]=4 3149 B7R1.8 OCC1CCC1=O 1P00I4ZH [0,1,0,1,0,0|2,0,0]=4 3150 B7R1.8 OC[C@@H]1NC[C@H]1O 1P028XO4 [0,1,0,1,0,0|1,0,1]=4 3151 B7R1.15 CC1C(=O)CC1=O 1P01EIR4 [0,1,0,1,0,0|2,0,0]=4 3152 B7R1.15 CC1C(C)CC1=O 1P00CVG5 [0,1,0,1,0,0|2,0,0]=4 3153 B7R1.15 C[C@@H]1NC(=O)[C@H]1N 1P01KA9U [0,1,0,1,0,0|1,0,0]=3 3154 B7R1.15 NC1C(O)CC1O 1P028T5Q [0,1,0,1,0,0|1,0,1]=4 3155 B7R1.15 NC1CC(C1C)O 1P029168 [0,1,0,1,0,0|1,0,1]=4 3156 B7R1.15 N[C@@H]1C[C@H]([C@@H]1O)O 1P0293V6 [0,1,0,1,0,0|0,0,2]=4 3157 B7R1.15 N[C@@H]1[C@@H](O)C[C@H]1O 1P027XXU [0,1,0,1,0,0|1,0,1]=4 3158 B7R1.17 CC1CNS1(=O)=O 1P023OO8 [0,1,0,1,0,0|1,0,1]=4 3159 B7R1.17 NC1COC1(C)C 1P01DXS6 [0,1,0,1,0,0|1,0,1]=4 3160 B7R1.17 N[C@@H]1CC[C@@]1(C)O 1P01C5KV [0,1,0,1,0,0|1,0,1]=4 3161 B7R1.17 O=C1CCC1(Br)Br 1P01XFO2 [0,1,0,1,0,0|2,0,0]=4 3162 B7R1.17 O=C1CCC1(C)C 1P000PMW [0,1,0,1,0,0|2,0,0]=4 3163 B7R1.17 O=C1COC1(C)C 1P00ILW0 [0,1,0,1,0,0|1,0,0]=3 3164 B7R1.17 O=C1NCC1(C)C 1P005SY2 [0,1,0,1,0,0|2,0,0]=4 3165 B7R1.17 O=C1OCC1(C)C 1P00AEIM [0,1,0,1,0,0|1,0,0]=3 3166 B7R1.17 OC1CNC1(C)C 1P01XA41 [0,1,0,1,0,0|1,0,1]=4 3167 B7R1.18 CC(=O)C1CCC1 1P003PKG [0,1,0,1,0,0|2,0,0]=4 3168 B7R1.18 CC(=O)C1CNC1 1P00A20O [0,1,0,1,0,0|1,0,0]=3 3169 B7R1.18 CC(=O)C1COC1 1P01DY8T [0,1,0,1,0,0|2,0,0]=4 3170 B7R1.18 CC(=O)C1CSC1 1P01E9GS [0,1,0,1,0,0|2,0,0]=4 3171 B7R1.18 CC(C1CCN1)O 1P027YMT [0,1,0,1,0,0|1,0,1]=4 3172 B7R1.18 CC(C1CCO1)N 1P0291KJ [0,1,0,1,0,0|1,0,1]=4 3173 B7R1.18 CC(C1CNC1)O 1P002J5Z [0,1,0,1,0,0|1,0,1]=4 3174 B7R1.18 CC(C1COC1)N 1P00HYPF [0,1,0,1,0,0|1,0,1]=4 3175 B7R1.18 CS(=O)C1CNC1 1P01JM6Y [0,1,0,1,0,0|2,0,0]=4 3176 B7R1.18 CS(=O)C1CNC1 1P028LF7 [0,1,0,1,0,0|2,0,0]=4 3177 B7R1.18 C[C@@H](C1COC1)N 1P01XA8F [0,1,0,1,0,0|1,0,1]=4 3178 B7R1.18 C[C@H](C1COC1)N 1P00K9YQ [0,1,0,1,0,0|1,0,1]=4 3179 B7R1.18 ClC(=O)C1CCC1 1P00353Y [0,1,0,1,0,0|2,0,0]=4 3180 B7R1.18 NC(=O)C1CCC1 1P001MYW [0,1,0,1,0,0|2,0,0]=4 3181 B7R1.18 NC(=O)C1CCN1 1P000VNK [0,1,0,1,0,0|1,0,0]=3 3182 B7R1.18 NC(=O)C1CNC1 1P000N1N [0,1,0,1,0,0|1,0,0]=3 3183 B7R1.18 NC(=O)C1CNC1 1P008PMO [0,1,0,1,0,0|1,0,0]=3 3184 B7R1.18 NC(=O)C1COC1 1P01DGLG [0,1,0,1,0,0|2,0,0]=4 3185 B7R1.18 NC(=O)[C@@H]1CCN1 1P01G17Q [0,1,0,1,0,0|1,0,0]=3 3186 B7R1.18 OC(=O)C1=CCC1 1P00BJ3Y [0,1,0,1,0,0|1,0,1]=4 3187 B7R1.18 OC(=O)C1CCC1 1P00353Z [0,1,0,1,0,0|1,0,0]=3 3188 B7R1.18 OC(=O)C1CCN1 1P002R80 [0,1,0,1,0,0|0,0,0]=2 3189 B7R1.18 OC(=O)C1CCO1 1P0036EM [0,1,0,1,0,0|1,0,0]=3 3190 B7R1.18 OC(=O)C1CNC1 1P0008FD [0,1,0,1,0,0|0,0,0]=2 3191 B7R1.18 OC(=O)C1CNC1 1P003429 [0,1,0,1,0,0|0,0,0]=2 3192 B7R1.18 OC(=O)C1COC1 1P000AR0 [0,1,0,1,0,0|1,0,0]=3 3193 B7R1.18 OC(=O)C1CSC1 1P005KXP [0,1,0,1,0,0|1,0,0]=3 3194 B7R1.18 OC(=O)[C@@H]1CCN1 1P003827 [0,1,0,1,0,0|0,0,0]=2 3195 B7R1.18 OC(=O)[C@@H]1CCO1 1P01JUQJ [0,1,0,1,0,0|1,0,0]=3 3196 B7R1.18 OC(=O)[C@H]1CCN1 1P005DGN [0,1,0,1,0,0|0,0,0]=2 3197 B7R1.18 OC(=O)[C@H]1CCN1 1P00EIWE [0,1,0,1,0,0|0,0,0]=2 3198 B7R1.18 OC(=O)[C@H]1CCO1 1P01JUNT [0,1,0,1,0,0|1,0,0]=3 3199 B7R1.18 [O-][N+](=O)C1CNC1 1P0208NH [0,1,0,1,0,0|1,0,1]=4 3200 B7R1.19 CC(=O)C1(Br)CC1 1P00EIF5 [0,1,0,1,0,0|2,0,0]=4 3201 B7R1.19 CC(=O)C1(C)CC1 1P001PDI [0,1,0,1,0,0|2,0,0]=4 3202 B7R1.19 CC(=O)C1(C)CO1 1P00DD7J [0,1,0,1,0,0|2,0,0]=4 3203 B7R1.19 CC(=O)C1(Cl)CC1 1P0039TS [0,1,0,1,0,0|2,0,0]=4 3204 B7R1.19 CC(=O)C1(F)CC1 1P00ELCH [0,1,0,1,0,0|2,0,0]=4 3205 B7R1.19 CC(=O)C1(N)CC1 1P01C30Z [0,1,0,1,0,0|1,0,0]=3 3206 B7R1.19 CC(C1(N)CC1)O 1P028QMQ [0,1,0,1,0,0|1,0,1]=4 3207 B7R1.19 CC(C1(O)CC1)N 1P02805M [0,1,0,1,0,0|1,0,1]=4 3208 B7R1.19 CC1(CO1)C(=O)O 1P003B26 [0,1,0,1,0,0|1,0,0]=3 3209 B7R1.19 C[C@H](C1(O)CC1)N 1P0291C5 [0,1,0,1,0,0|1,0,1]=4 3210 B7R1.19 ClC(=O)C1(C)CC1 1P0038FK [0,1,0,1,0,0|2,0,0]=4 3211 B7R1.19 ClC(=O)C1(F)CC1 1P01OO89 [0,1,0,1,0,0|2,0,0]=4 3212 B7R1.19 FC1(CC1)S(=O)O 1P027OFQ [0,1,0,1,0,0|2,0,0]=4 3213 B7R1.19 NC(=N)C1(N)CC1 1P028AZE [0,1,0,1,0,0|2,0,0]=4 3214 B7R1.19 NC(=O)C1(Br)CC1 1P002C6O [0,1,0,1,0,0|2,0,0]=4 3215 B7R1.19 NC(=O)C1(C)CC1 1P001QXO [0,1,0,1,0,0|2,0,0]=4 3216 B7R1.19 NC(=O)C1(F)CC1 1P024TSB [0,1,0,1,0,0|2,0,0]=4 3217 B7R1.19 NC(=O)C1(N)CC1 1P0013ML [0,1,0,1,0,0|1,0,0]=3 3218 B7R1.19 NC(=O)C1(N)CC1 1P00I6M9 [0,1,0,1,0,0|1,0,0]=3 3219 B7R1.19 NC(=S)C1(N)CC1 1P01PJ2T [0,1,0,1,0,0|1,1,0]=4 3220 B7R1.19 OC(=O)C1(Br)CC1 1P0087LA [0,1,0,1,0,0|1,0,0]=3 3221 B7R1.19 OC(=O)C1(C)CC1 1P003793 [0,1,0,1,0,0|1,0,0]=3 3222 B7R1.19 OC(=O)C1(Cl)CC1 1P01ALB2 [0,1,0,1,0,0|1,0,0]=3 3223 B7R1.19 OC(=O)C1(F)CC1 1P0013A5 [0,1,0,1,0,0|1,0,0]=3 3224 B7R1.19 OC(=O)C1(I)CC1 1P028GK9 [0,1,0,1,0,0|1,0,0]=3 3225 B7R1.19 OC(=O)C1(N)CC1 1P003350 [0,1,0,1,0,0|0,0,0]=2 3226 B7R1.19 OC(=O)C1(N)CC1 1P006HMC [0,1,0,1,0,0|0,0,0]=2 3227 B7R1.19 OC(=O)C1(O)CC1 1P0021XR [0,1,0,1,0,0|1,0,0]=3 3228 B7R1.22 BrCC(=O)C1CC1 1P0033LH [0,1,0,1,0,0|2,0,0]=4 3229 B7R1.22 C#CC(=O)C1CC1 1P027Y5N [0,1,0,1,0,0|2,0,0]=4 3230 B7R1.22 C=CC(=O)C1CC1 1P00ESOF [0,1,0,1,0,0|2,0,0]=4 3231 B7R1.22 CCC(=O)C1CC1 1P00FHR5 [0,1,0,1,0,0|2,0,0]=4 3232 B7R1.22 CNC(=O)C1CC1 1P0060X3 [0,1,0,1,0,0|2,0,0]=4 3233 B7R1.22 COC(=N)C1CC1 1P005T3M [0,1,0,1,0,0|2,0,0]=4 3234 B7R1.22 COC(=O)C1CC1 1P002WJH [0,1,0,1,0,0|1,0,0]=3 3235 B7R1.22 COC(=O)C1CN1 1P003SFZ [0,1,0,1,0,0|0,0,0]=2 3236 B7R1.22 COC(=O)C1CO1 1P0036AI [0,1,0,1,0,0|1,0,0]=3 3237 B7R1.22 COC(=O)[C@@H]1CO1 1P0035LP [0,1,0,1,0,0|1,0,0]=3 3238 B7R1.22 COC(=O)[C@H]1CO1 1P0035LN [0,1,0,1,0,0|1,0,0]=3 3239 B7R1.22 COC(=S)C1CC1 1P01FL50 [0,1,0,1,0,0|1,1,0]=4 3240 B7R1.22 ClCC(=O)C1CC1 1P005KYK [0,1,0,1,0,0|2,0,0]=4 3241 B7R1.22 FCC(=O)C1CC1 1P00CZHZ [0,1,0,1,0,0|2,0,0]=4 3242 B7R1.22 NCC(=O)C1CC1 1P01A4QP [0,1,0,1,0,0|2,0,0]=4 3243 B7R1.22 NNC(=O)C1CC1 1P005XS9 [0,1,0,1,0,0|2,0,0]=4 3244 B7R1.22 OCC(=O)C1CC1 1P019ZQ5 [0,1,0,1,0,0|1,0,0]=3 3245 B7R1.22 ONC(=N)C1CC1 1P002M00 [0,1,0,1,0,0|2,0,0]=4 3246 B7R1.22 ONC(=N)C1CC1 1P003PNI [0,1,0,1,0,0|2,0,0]=4 3247 B7R1.22 ONC(=O)C1CC1 1P019U87 [0,1,0,1,0,0|1,0,0]=3 3248 B7R1.23 O=CC1OC1(C)C 1P01B68F [0,1,0,1,0,0|1,0,1]=4 3249 B7R1.27 C[C@]1(C[C@@H]1N)OC 1P024RTJ [0,1,0,1,0,0|1,0,1]=4 3250 B7R0.6 CC(=C)CCC(=O)O 1P0001EL [0,0,0,0,0,2|1,0,1]=4 3251 B7R0.6 CC(=O)C=CC(=O)O 1P003414 [0,0,0,0,0,2|1,0,1]=4 3252 B7R0.6 CC(=O)CCC(=O)O 1P000KEL [0,0,0,0,0,2|1,0,1]=4 3253 B7R0.6 CC(=O)COC(C)C 1P0071XC [0,0,0,0,0,2|2,0,0]=4 3254 B7R0.6 CC(=O)NCC(=O)O 1P0033J8 [0,0,0,0,0,2|1,0,1]=4 3255 B7R0.6 CC(=O)OCC(=O)O 1P0018ZE [0,0,0,0,0,2|1,0,1]=4 3256 B7R0.6 CC(=O)SCC(=O)O 1P000PI2 [0,0,0,0,0,2|1,0,1]=4 3257 B7R0.6 CC(C#CC(=O)O)C 1P01ANWI [0,0,0,0,0,2|1,0,0]=3 3258 B7R0.6 CC(C#CC(=O)O)N 1P0284K5 [0,0,0,0,0,2|0,0,0]=2 3259 B7R0.6 CC(C=CC(=O)C)C 1P003NC7 [0,0,0,0,0,2|2,0,0]=4 3260 B7R0.6 CC(C=CC(=O)O)C 1P003M70 [0,0,0,0,0,2|1,0,0]=3 3261 B7R0.6 CC(CCC(=C)C)N 1P01DVQ0 [0,0,0,0,0,2|2,0,0]=4 3262 B7R0.6 CC(CCC(=O)C)C 1P003NBT [0,0,0,0,0,2|2,0,0]=4 3263 B7R0.6 CC(CCC(=O)C)Cl 1P0007YL [0,0,0,0,0,2|2,0,0]=4 3264 B7R0.6 CC(CCC(=O)Cl)C 1P003M9S [0,0,0,0,0,2|2,0,0]=4 3265 B7R0.6 CC(CCC(=O)Cl)Cl 1P00IBOS [0,0,0,0,0,2|2,0,0]=4 3266 B7R0.6 CC(CCC(=O)N)C 1P007DVM [0,0,0,0,0,2|2,0,0]=4 3267 B7R0.6 CC(CCC(=O)O)Br 1P01A4B3 [0,0,0,0,0,2|1,0,0]=3 3268 B7R0.6 CC(CCC(=O)O)C 1P003M9R [0,0,0,0,0,2|1,0,0]=3 3269 B7R0.6 CC(CCC(=O)O)N 1P001A2N [0,0,0,0,0,2|0,0,0]=2 3270 B7R0.6 CC(CCC(=O)O)N 1P01AKAQ [0,0,0,0,0,2|0,0,0]=2 3271 B7R0.6 CC(CCC(=O)O)O 1P0038KW [0,0,0,0,0,2|1,0,0]=3 3272 B7R0.6 CC(CCC(=O)O)S 1P000P7Q [0,0,0,0,0,2|1,0,0]=3 3273 B7R0.6 CC(CCC(=O)[O-])O 1P003BDK [0,0,0,0,0,2|1,0,1]=4 3274 B7R0.6 CC(CCS(=O)C)N 1P019S9Q [0,0,0,0,0,2|2,0,0]=4 3275 B7R0.6 CC(CNC(=O)C)O 1P00719V [0,0,0,0,0,2|2,0,0]=4 3276 B7R0.6 CC(CNC(=O)N)C 1P003RJM [0,0,0,0,0,2|2,0,0]=4 3277 B7R0.6 CC(NCC(=O)C)C 1P01ANL3 [0,0,0,0,0,2|2,0,0]=4 3278 B7R0.6 CC(NCC(=O)N)C 1P00G7RH [0,0,0,0,0,2|2,0,0]=4 3279 B7R0.6 CC(NCC(=O)N)C 1P019JUE [0,0,0,0,0,2|2,0,0]=4 3280 B7R0.6 CC(NCC(=O)O)C 1P00C901 [0,0,0,0,0,2|1,0,0]=3 3281 B7R0.6 CC(NCC(=O)O)C 1P019MFH [0,0,0,0,0,2|1,0,0]=3 3282 B7R0.6 CC(NNC(=O)C)C 1P00DBJA [0,0,0,0,0,2|2,0,0]=4 3283 B7R0.6 CC(OCC(=O)Cl)C 1P01E7J0 [0,0,0,0,0,2|2,0,0]=4 3284 B7R0.6 CC(OCC(=O)O)C 1P007FU5 [0,0,0,0,0,2|1,0,0]=3 3285 B7R0.6 CC(SCC(=O)O)C 1P006WX6 [0,0,0,0,0,2|1,0,0]=3 3286 B7R0.6 CC(\C=C\C(=O)O)C 1P001XCU [0,0,0,0,0,2|1,0,0]=3 3287 B7R0.6 CN(CCC(=O)O)C 1P001FQ6 [0,0,0,0,0,2|2,0,0]=4 3288 B7R0.6 CN(CCC(=O)O)C 1P00E97T [0,0,0,0,0,2|2,0,0]=4 3289 B7R0.6 CS(=O)CCC(=O)O 1P001DGF [0,0,0,0,0,2|2,0,0]=4 3290 B7R0.6 C[C@@H](CCC(=O)O)N 1P028SQ6 [0,0,0,0,0,2|0,0,0]=2 3291 B7R0.6 C[C@H](CCC(=O)O)N 1P01P6YP [0,0,0,0,0,2|0,0,0]=2 3292 B7R0.6 C[C@H](CCC(=O)O)S 1P028IQP [0,0,0,0,0,2|1,0,0]=3 3293 B7R0.6 C[S+](CCC(=O)O)C 1P002KXE [0,0,0,0,0,2|2,0,0]=4 3294 B7R0.6 C[S+](CCC(=O)O)C 1P003C35 [0,0,0,0,0,2|2,0,0]=4 3295 B7R0.6 ClC(CCC(=O)O)Cl 1P01BSXU [0,0,0,0,0,2|2,0,0]=4 3296 B7R0.6 FC(C#CC(=O)O)F 1P01DRX5 [0,0,0,0,0,2|2,0,0]=4 3297 B7R0.6 FC(CCC(=O)O)F 1P006BJ8 [0,0,0,0,0,2|2,0,0]=4 3298 B7R0.6 FC(OCC(=O)O)F 1P01BECR [0,0,0,0,0,2|2,0,0]=4 3299 B7R0.6 FC(SCC(=O)O)F 1P01DXRY [0,0,0,0,0,2|2,0,0]=4 3300 B7R0.6 FC(\C=C\C(=O)O)F 1P01DN4R [0,0,0,0,0,2|2,0,0]=4 3301 B7R0.6 NC(=N)NCC(=O)O 1P003RAC [0,0,0,0,0,2|1,0,1]=4 3302 B7R0.6 NC(=O)CCC(=O)O 1P003UWV [0,0,0,0,0,2|1,0,1]=4 3303 B7R0.6 NC(=O)NCC(=O)O 1P00D8YO [0,0,0,0,0,2|1,0,1]=4 3304 B7R0.6 NC(=O)\C=C/C(=O)O 1P0035KY [0,0,0,0,0,2|1,0,1]=4 3305 B7R0.6 OC(=O)C=C=C(C)C 1P01GKTU [0,0,0,0,0,2|1,0,1]=4 3306 B7R0.6 OC(=O)CC=C(C)C 1P00389R [0,0,0,0,0,2|1,0,1]=4 3307 B7R0.6 OC(=O)CNC(=S)C 1P00IN1C [0,0,0,0,0,2|1,0,1]=4 3308 B7R0.6 OC(=O)CSC(=N)N 1P005IKU [0,0,0,0,0,2|1,0,1]=4 3309 B7R0.6 OC(=O)CSC(=N)N 1P019G9E [0,0,0,0,0,2|1,0,1]=4