0 B7R0.9 BrC(=C)C[Si](C)(C)C 1P003C2P [0,0,0,0,0,0|3,0,0]=3 1 B7R0.9 CC(=C)C[Si](C)(C)C 1P0024QB [0,0,0,0,0,0|3,0,0]=3 2 B7R0.9 CC(=C)O[Si](C)(C)C 1P0027Y7 [0,0,0,0,0,0|4,0,0]=4 3 B7R0.9 CC(=O)CC(C)(C)C 1P003KWI [0,0,0,0,0,0|2,0,0]=2 4 B7R0.9 CC(=O)CC(Cl)(C)C 1P001DU3 [0,0,0,0,0,0|3,0,0]=3 5 B7R0.9 CC(=O)CC(N)(C)C 1P003L6K [0,0,0,0,0,0|3,0,0]=3 6 B7R0.9 CC(=O)CC(O)(C)C 1P000KDW [0,0,0,0,0,0|3,0,0]=3 7 B7R0.9 CC(=O)CC(S)(C)C 1P002C5Z [0,0,0,0,0,0|3,0,0]=3 8 B7R0.9 CC(=O)CS(=O)(=O)C 1P003DKB [0,0,0,0,0,0|4,0,0]=4 9 B7R0.9 CC(=O)C[N+](C)(C)C 1P01APWQ [0,0,0,0,0,0|1,0,0]=1 10 B7R0.9 CC(=O)NC(C)(C)C 1P003TTT [0,0,0,0,0,0|3,0,0]=3 11 B7R0.9 CC(=O)N[Si](C)(C)C 1P003SWG [0,0,0,0,0,0|3,0,0]=3 12 B7R0.9 CC(=O)OC(C)(C)C 1P0036K8 [0,0,0,0,0,0|3,0,0]=3 13 B7R0.9 CC(=O)O[Si](C)(C)C 1P002UHX [0,0,0,0,0,0|3,0,0]=3 14 B7R0.9 CC(CC(C)(C)C)N 1P01AV83 [0,0,0,0,0,0|3,0,1]=4 15 B7R0.9 CC(CC(C)(C)C)O 1P003KWH [0,0,0,0,0,0|2,0,2]=4 16 B7R0.9 CC(CS(=O)[O-])(C)C 1P01C8UK [0,0,0,0,0,0|2,0,0]=2 17 B7R0.9 CC(C[N+](C)(C)C)O 1P002S6A [0,0,0,0,0,0|1,0,2]=3 18 B7R0.9 CC(C[N+](C)(C)C)O 1P003ON0 [0,0,0,0,0,0|1,0,2]=3 19 B7R0.9 C[C@@H](CC(C)(C)C)N 1P024HCS [0,0,0,0,0,0|3,0,1]=4 20 B7R0.9 C[C@H](CC(C)(C)C)N 1P027VV2 [0,0,0,0,0,0|3,0,1]=4 21 B7R0.9 ClC(=NC(C)(C)C)Cl 1P028MDN [0,0,0,0,0,0|4,0,0]=4 22 B7R0.9 ClC(=O)CC(Br)(C)C 1P01B380 [0,0,0,0,0,0|3,0,0]=3 23 B7R0.9 ClC(=O)CC(C)(C)C 1P003IU3 [0,0,0,0,0,0|2,0,0]=2 24 B7R0.9 ClC(=O)N=S(=O)(C)C 1P01AM5S [0,0,0,0,0,0|4,0,0]=4 25 B7R0.9 NC(=N)CC(C)(C)C 1P00EMEC [0,0,0,0,0,0|3,0,0]=3 26 B7R0.9 NC(=N)CC(O)(C)C 1P028JC1 [0,0,0,0,0,0|4,0,0]=4 27 B7R0.9 NC(=N)SC(C)(C)C 1P01XGC8 [0,0,0,0,0,0|4,0,0]=4 28 B7R0.9 NC(=O)CC(C)(C)C 1P00H1ZB [0,0,0,0,0,0|2,0,0]=2 29 B7R0.9 NC(=O)CC(N)(C)C 1P019SGU [0,0,0,0,0,0|3,0,0]=3 30 B7R0.9 NC(=O)CC(N)(C)C 1P01A7J8 [0,0,0,0,0,0|3,0,0]=3 31 B7R0.9 NC(=O)C[N+](C)(C)C 1P001XEU [0,0,0,0,0,0|1,0,0]=1 32 B7R0.9 NC(=O)N=S(=O)(C)C 1P01CAS5 [0,0,0,0,0,0|4,0,0]=4 33 B7R0.9 NC(=O)NC(C)(C)C 1P003V2Q [0,0,0,0,0,0|3,0,0]=3 34 B7R0.9 NC(=O)OC(C)(C)C 1P00363R [0,0,0,0,0,0|3,0,0]=3 35 B7R0.9 NC(=S)NC(C)(C)C 1P003SWC [0,0,0,0,0,0|3,1,0]=4 36 B7R0.9 OB(CC(C)(C)C)O 1P003TFL [0,0,0,0,0,0|2,0,2]=4 37 B7R0.9 OC(=O)CC(Br)(C)C 1P00EPM1 [0,0,0,0,0,0|2,0,1]=3 38 B7R0.9 OC(=O)CC(C)(C)C 1P003IU4 [0,0,0,0,0,0|1,0,1]=2 39 B7R0.9 OC(=O)CC(Cl)(C)C 1P027U6R [0,0,0,0,0,0|2,0,1]=3 40 B7R0.9 OC(=O)CC(F)(C)C 1P01BUPJ [0,0,0,0,0,0|2,0,1]=3 41 B7R0.9 OC(=O)CC(F)(F)C 1P01AE6R [0,0,0,0,0,0|3,0,1]=4 42 B7R0.9 OC(=O)CC(N)(C)C 1P0037NO [0,0,0,0,0,0|2,0,1]=3 43 B7R0.9 OC(=O)CC(N)(C)C 1P003JBN [0,0,0,0,0,0|2,0,1]=3 44 B7R0.9 OC(=O)CC(N)(C)C 1P01AGEV [0,0,0,0,0,0|2,0,1]=3 45 B7R0.9 OC(=O)CC(O)(C)C 1P0039UT [0,0,0,0,0,0|2,0,1]=3 46 B7R0.9 OC(=O)CC(S)(C)C 1P00392I [0,0,0,0,0,0|2,0,1]=3 47 B7R0.9 OC(=O)CP(=O)(C)C 1P028MVP [0,0,0,0,0,0|1,1,1]=3 48 B7R0.9 OC(=O)CS(=O)(=O)C 1P002R5P [0,0,0,0,0,0|3,0,1]=4 49 B7R0.9 OC(=O)C[N+](C)(C)C 1P00IAY4 [0,0,0,0,0,0|0,0,1]=1 50 B7R0.9 OC(=O)C[Si](C)(C)C 1P002NQR [0,0,0,0,0,0|1,0,1]=2 51 B7R0.9 [O-]C(=O)CC(O)(C)C 1P003P49 [0,0,0,0,0,0|2,0,0]=2 52 B7R0.9 [O-]C(=O)C[As+](C)(C)C 1P01E6PJ [0,0,0,0,0,0|0,1,0]=1 53 B7R0.9 [O-]C(=O)C[N+](C)(C)C 1P00HBD2 [0,0,0,0,0,0|0,0,0]=0 54 B7R0.9 [O-]C(=O)C[N+](C)(C)C 1P00IAY3 [0,0,0,0,0,0|0,0,0]=0 55 B7R0.9 [O-]S(=O)CS(=O)(=O)C 1P01C8UY [0,0,0,0,0,0|4,0,0]=4 56 B7R0.9 [S-]C(=S)NC(C)(C)C 1P01DTRQ [0,0,0,0,0,0|2,2,0]=4 57 B6R0.2 CC(=C)CC(=O)C 1P00CLKE [1,0,0,0,0,0|2,0,1]=4 58 B6R0.2 CC(=C)CC(=O)O 1P001WA5 [1,0,0,0,0,0|1,0,2]=4 59 B6R0.2 CC(=CC(=O)C)C 1P001G6Y [1,0,0,0,0,0|2,0,1]=4 60 B6R0.2 CC(=CC(=O)Cl)C 1P003K7P [1,0,0,0,0,0|2,0,1]=4 61 B6R0.2 CC(=CC(=O)N)C 1P01BER2 [1,0,0,0,0,0|2,0,1]=4 62 B6R0.2 CC(=CC(=O)O)C 1P0033YA [1,0,0,0,0,0|1,0,2]=4 63 B6R0.2 CC(=C[N+](=O)[O-])C 1P00HZ2E [1,0,0,0,0,0|2,0,1]=4 64 B6R0.2 CC(=O)CC(=O)C 1P000KDQ [1,0,0,0,0,0|3,0,0]=4 65 B6R0.2 CC(=O)CC(=O)C 1P003VUE [1,0,0,0,0,0|3,0,0]=4 66 B6R0.2 CC(=O)CC(=O)N 1P0034W3 [1,0,0,0,0,0|3,0,0]=4 67 B6R0.2 CC(CC(=C)Br)C 1P0279S8 [1,0,0,0,0,0|3,0,0]=4 68 B6R0.2 CC(CC(=C)C)C 1P003GAN [1,0,0,0,0,0|3,0,0]=4 69 B6R0.2 CC(CC(=N)N)C 1P00EK2S [1,0,0,0,0,0|3,0,0]=4 70 B6R0.2 CC(CC(=O)C)N 1P00J23J [1,0,0,0,0,0|3,0,0]=4 71 B6R0.2 CC(CC(=O)C)O 1P00723Y [1,0,0,0,0,0|3,0,0]=4 72 B6R0.2 CC(CC(=O)Cl)C 1P0035J3 [1,0,0,0,0,0|2,0,0]=3 73 B6R0.2 CC(CC(=O)Cl)Cl 1P01BTXW [1,0,0,0,0,0|3,0,0]=4 74 B6R0.2 CC(CC(=O)F)C 1P01B7CV [1,0,0,0,0,0|2,0,0]=3 75 B6R0.2 CC(CC(=O)N)C 1P003RMF [1,0,0,0,0,0|2,0,0]=3 76 B6R0.2 CC(CC(=O)N)Cl 1P028G15 [1,0,0,0,0,0|3,0,0]=4 77 B6R0.2 CC(CC(=O)N)N 1P01C1RK [1,0,0,0,0,0|3,0,0]=4 78 B6R0.2 CC(CC(=O)N)O 1P007O9T [1,0,0,0,0,0|3,0,0]=4 79 B6R0.2 CC(CC(=O)O)Br 1P002SV2 [1,0,0,0,0,0|2,0,1]=4 80 B6R0.2 CC(CC(=O)O)C 1P003RMG [1,0,0,0,0,0|1,0,1]=3 81 B6R0.2 CC(CC(=O)O)Cl 1P003JRA [1,0,0,0,0,0|2,0,1]=4 82 B6R0.2 CC(CC(=O)O)F 1P028OF4 [1,0,0,0,0,0|2,0,1]=4 83 B6R0.2 CC(CC(=O)O)N 1P003JE2 [1,0,0,0,0,0|2,0,1]=4 84 B6R0.2 CC(CC(=O)O)O 1P003K12 [1,0,0,0,0,0|2,0,1]=4 85 B6R0.2 CC(CC(=O)O)S 1P002TTH [1,0,0,0,0,0|2,0,1]=4 86 B6R0.2 CC(CC(=S)N)C 1P00AR7D [1,0,0,0,0,0|2,1,0]=4 87 B6R0.2 CC(CS(=O)Cl)C 1P01C9KJ [1,0,0,0,0,0|3,0,0]=4 88 B6R0.2 CC(CS(=O)[O-])C 1P01BCHN [1,0,0,0,0,0|2,0,0]=3 89 B6R0.2 CC(C[N+](=O)[O-])C 1P00F3HC [1,0,0,0,0,0|2,0,0]=3 90 B6R0.2 CC(NC(=O)C)C 1P0084JZ [1,0,0,0,0,0|3,0,0]=4 91 B6R0.2 CC(NC(=O)Cl)C 1P01B38E [1,0,0,0,0,0|3,0,0]=4 92 B6R0.2 CC(NC(=O)N)C 1P005LHL [1,0,0,0,0,0|3,0,0]=4 93 B6R0.2 CC(OC(=O)C)C 1P0036E9 [1,0,0,0,0,0|3,0,0]=4 94 B6R0.2 CC(OC(=O)N)C 1P00209N [1,0,0,0,0,0|3,0,0]=4 95 B6R0.2 CC(O[N+](=O)[O-])C 1P0039DL [1,0,0,0,0,0|3,0,0]=4 96 B6R0.2 CC(SC(=O)Cl)C 1P001A85 [1,0,0,0,0,0|3,0,0]=4 97 B6R0.2 CN(CC(=N)N)C 1P019YB1 [1,0,0,0,0,0|2,0,1]=4 98 B6R0.2 CN(CC(=N)N)C 1P0281FI [1,0,0,0,0,0|2,0,1]=4 99 B6R0.2 CN(CC(=O)C)C 1P003DJS [1,0,0,0,0,0|1,0,1]=3 100 B6R0.2 CN(CC(=O)Cl)C 1P003Q3N [1,0,0,0,0,0|1,0,1]=3 101 B6R0.2 CN(CC(=O)N)C 1P01BFB9 [1,0,0,0,0,0|1,0,1]=3 102 B6R0.2 CN(CC(=O)O)C 1P002QBC [1,0,0,0,0,0|0,0,2]=3 103 B6R0.2 CN(CC(=O)O)C 1P003T1T [1,0,0,0,0,0|0,0,2]=3 104 B6R0.2 CN(CC(=S)N)C 1P00I5NF [1,0,0,0,0,0|1,1,1]=4 105 B6R0.2 CN(CC(=S)N)C 1P01AANC [1,0,0,0,0,0|1,1,1]=4 106 B6R0.2 CS(=O)CC(=O)N 1P028O27 [1,0,0,0,0,0|3,0,0]=4 107 B6R0.2 C[C@@H](CC(=O)N)O 1P028625 [1,0,0,0,0,0|3,0,0]=4 108 B6R0.2 C[C@@H](CC(=O)O)F 1P028OKF [1,0,0,0,0,0|2,0,1]=4 109 B6R0.2 C[C@@H](CC(=O)O)N 1P0036AK [1,0,0,0,0,0|2,0,1]=4 110 B6R0.2 C[C@@H](CC(=O)O)N 1P00IAVS [1,0,0,0,0,0|2,0,1]=4 111 B6R0.2 C[C@@H](CC(=O)O)O 1P003ANQ [1,0,0,0,0,0|2,0,1]=4 112 B6R0.2 C[C@H](CC(=O)N)O 1P027UQQ [1,0,0,0,0,0|3,0,0]=4 113 B6R0.2 C[C@H](CC(=O)O)N 1P003CQA [1,0,0,0,0,0|2,0,1]=4 114 B6R0.2 C[C@H](CC(=O)O)N 1P00EB6J [1,0,0,0,0,0|2,0,1]=4 115 B6R0.2 [O-]C(=O)CC(=O)C 1P003B7E [1,0,0,0,0,0|2,0,0]=3 116 B6R0.2 [O-]C(=O)CC(=O)C 1P003RRI [1,0,0,0,0,0|2,0,0]=3 117 B6R0.2 [O-]C(=O)CC(=O)N 1P028GWT [1,0,0,0,0,0|3,0,0]=4 118 B6R0.2 [O-]C(=O)CC(=O)[O-] 1P000VMG [1,0,0,0,0,0|3,0,0]=4 119 B6R0.2 [O-]C(=O)CC(=O)[O-] 1P001G81 [1,0,0,0,0,0|3,0,0]=4 120 B6R0.2 [O-]C(=O)CC(=O)[O-] 1P002U04 [1,0,0,0,0,0|3,0,0]=4 121 B6R0.2 [O-]C(=O)CC(O)C 1P001MOO [1,0,0,0,0,0|2,0,0]=3 122 B6R0.2 [O-]C(=O)C[C@@H](O)C 1P000XO5 [1,0,0,0,0,0|2,0,0]=3 123 B6R0.2 [O-]C(=O)C[C@H](O)C 1P0032U9 [1,0,0,0,0,0|2,0,0]=3 124 B6R0.2 [O-]C(=O)C[S+](C)C 1P00I931 [1,0,0,0,0,0|1,0,0]=2 125 B6R0.2 [O-][N+](=O)CC(=O)C 1P0007M7 [1,0,0,0,0,0|3,0,0]=4 126 B6R0.2 [O-][N+](=O)CC(O)C 1P01AM6O [1,0,0,0,0,0|3,0,0]=4 127 B6R0.5 BrC=C[Si](C)(C)C 1P0012VK [1,0,0,0,0,0|2,0,1]=4 128 B6R0.5 BrCCC(C)(C)C 1P001VIS [1,0,0,0,0,0|2,0,1]=4 129 B6R0.5 BrCC[N+](C)(C)C 1P002ULB [1,0,0,0,0,0|1,0,1]=3 130 B6R0.5 BrCC[Si](C)(C)C 1P0032SP [1,0,0,0,0,0|2,0,1]=4 131 B6R0.5 C#CCC(C)(C)C 1P01C3DB [1,0,0,0,0,0|2,0,1]=4 132 B6R0.5 C#CC[N+](C)(C)C 1P005BFT [1,0,0,0,0,0|1,0,1]=3 133 B6R0.5 C=CCC(C)(C)C 1P003KWD [1,0,0,0,0,0|2,0,0]=3 134 B6R0.5 C=CCC(O)(C)C 1P00ECQ0 [1,0,0,0,0,0|3,0,0]=4 135 B6R0.5 C=CCP(=O)(C)C 1P028TVF [1,0,0,0,0,0|2,1,0]=4 136 B6R0.5 C=CC[N+](C)(C)C 1P001NWH [1,0,0,0,0,0|1,0,0]=2 137 B6R0.5 C=CC[Si](C)(C)C 1P0034WR [1,0,0,0,0,0|2,0,0]=3 138 B6R0.5 C=COC(C)(C)C 1P003V22 [1,0,0,0,0,0|3,0,0]=4 139 B6R0.5 C=CO[Si](C)(C)C 1P003VS9 [1,0,0,0,0,0|3,0,0]=4 140 B6R0.5 CC=NC(C)(C)C 1P005XIA [1,0,0,0,0,0|3,0,0]=4 141 B6R0.5 CCCC(C)(C)C 1P003FSG [1,0,0,0,0,0|2,0,1]=4 142 B6R0.5 CCC[N+](C)(C)C 1P002TXN [1,0,0,0,0,0|1,0,1]=3 143 B6R0.5 CNCC(C)(C)C 1P00CN3Z [1,0,0,0,0,0|3,0,0]=4 144 B6R0.5 CNC[Si](C)(C)C 1P01C60M [1,0,0,0,0,0|3,0,0]=4 145 B6R0.5 COC[Si](C)(C)C 1P001F14 [1,0,0,0,0,0|3,0,0]=4 146 B6R0.5 ClCCC(C)(C)C 1P002W5Y [1,0,0,0,0,0|2,0,1]=4 147 B6R0.5 ClCC[N+](C)(C)C 1P0036PT [1,0,0,0,0,0|1,0,1]=3 148 B6R0.5 ClCC[Si](C)(C)C 1P00ARMW [1,0,0,0,0,0|2,0,1]=4 149 B6R0.5 FCC[N+](C)(C)C 1P01GJGK [1,0,0,0,0,0|1,0,1]=3 150 B6R0.5 FCC[N+](C)(C)C 1P028A75 [1,0,0,0,0,0|1,0,1]=3 151 B6R0.5 ICCC(C)(C)C 1P001PE7 [1,0,0,0,0,0|2,0,1]=4 152 B6R0.5 I\C=C\[Si](C)(C)C 1P00ICK5 [1,0,0,0,0,0|2,0,1]=4 153 B6R0.5 N#CCC(C)(C)C 1P00C983 [1,0,0,0,0,0|2,0,1]=4 154 B6R0.5 N#CC[Si](C)(C)C 1P0024Q6 [1,0,0,0,0,0|2,0,1]=4 155 B6R0.5 NCCC(C)(C)C 1P001PEZ [1,0,0,0,0,0|2,0,1]=4 156 B6R0.5 NCCC(C)(C)C 1P003112 [1,0,0,0,0,0|2,0,1]=4 157 B6R0.5 NCC[N+](C)(C)C 1P003C29 [1,0,0,0,0,0|1,0,1]=3 158 B6R0.5 NCC[Si](C)(C)C 1P0023BF [1,0,0,0,0,0|2,0,1]=4 159 B6R0.5 NNCC(C)(C)C 1P00J2YO [1,0,0,0,0,0|3,0,0]=4 160 B6R0.5 NOCC(C)(C)C 1P00AKVL [1,0,0,0,0,0|3,0,0]=4 161 B6R0.5 NOCC(C)(C)C 1P028JVC [1,0,0,0,0,0|3,0,0]=4 162 B6R0.5 O=C=N[Si](C)(C)C 1P003VL5 [1,0,0,0,0,0|2,0,1]=4 163 B6R0.5 O=CCC(C)(C)C 1P0033YD [1,0,0,0,0,0|1,0,0]=2 164 B6R0.5 O=CCC(F)(F)C 1P027N7J [1,0,0,0,0,0|3,0,0]=4 165 B6R0.5 O=CC[N+](C)(C)C 1P005H63 [1,0,0,0,0,0|0,0,0]=1 166 B6R0.5 O=CC[N+](C)(C)C 1P006738 [1,0,0,0,0,0|0,0,0]=1 167 B6R0.5 O=CNC(C)(C)C 1P003TU0 [1,0,0,0,0,0|2,0,0]=3 168 B6R0.5 OCCC(C)(C)C 1P003BRC [1,0,0,0,0,0|1,0,2]=4 169 B6R0.5 OCC[N+](C)(C)C 1P001DY8 [1,0,0,0,0,0|0,0,2]=3 170 B6R0.5 OCC[N+](C)(C)C 1P0025YK [1,0,0,0,0,0|0,0,2]=3 171 B6R0.5 OCC[N+](C)(C)C 1P002GOO [1,0,0,0,0,0|0,0,2]=3 172 B6R0.5 OCC[N+](C)(C)C 1P0038VZ [1,0,0,0,0,0|0,0,2]=3 173 B6R0.5 OCC[N+](C)(C)C 1P0061KU [1,0,0,0,0,0|0,0,2]=3 174 B6R0.5 OCC[N+](C)(C)C 1P00EMAQ [1,0,0,0,0,0|0,0,2]=3 175 B6R0.5 OCC[N+](C)(C)C 1P01BURL [1,0,0,0,0,0|0,0,2]=3 176 B6R0.5 OCC[Si](C)(C)C 1P002XZI [1,0,0,0,0,0|1,0,2]=4 177 B6R0.5 SCCC(C)(C)C 1P0291H4 [1,0,0,0,0,0|1,1,1]=4 178 B6R0.5 SCC[N+](C)(C)C 1P005RWL [1,0,0,0,0,0|0,1,1]=3 179 B6R0.5 SCC[Si](C)(C)C 1P0023C0 [1,0,0,0,0,0|1,1,1]=4 180 B8R0.24 BrCC(=O)CC(C)(C)C 1P01BBPW [0,1,0,0,0,0|2,0,0]=3 181 B8R0.24 BrCC(=O)NC(C)(C)C 1P01DJ1X [0,1,0,0,0,0|3,0,0]=4 182 B8R0.24 C#CC(=O)OC(C)(C)C 1P0018ZF [0,1,0,0,0,0|3,0,0]=4 183 B8R0.24 C=CC(=O)NC(C)(C)C 1P003TTU [0,1,0,0,0,0|3,0,0]=4 184 B8R0.24 C=CC(=O)OC(C)(C)C 1P00ASVA [0,1,0,0,0,0|3,0,0]=4 185 B8R0.24 C=CC(=O)O[Si](C)(C)C 1P0012ZW [0,1,0,0,0,0|3,0,0]=4 186 B8R0.24 CCC(=O)OC(C)(C)C 1P003V1Y [0,1,0,0,0,0|3,0,0]=4 187 B8R0.24 CNC(=O)CC(N)(C)C 1P0292GM [0,1,0,0,0,0|3,0,0]=4 188 B8R0.24 CNC(=O)OC(C)(C)C 1P001SKA [0,1,0,0,0,0|3,0,0]=4 189 B8R0.24 COC(=O)CC(Br)(C)C 1P000VO0 [0,1,0,0,0,0|2,0,1]=4 190 B8R0.24 COC(=O)CC(C)(C)C 1P000826 [0,1,0,0,0,0|1,0,1]=3 191 B8R0.24 COC(=O)CC(N)(C)C 1P002ZF7 [0,1,0,0,0,0|2,0,1]=4 192 B8R0.24 COC(=O)CC(N)(C)C 1P01AFOA [0,1,0,0,0,0|2,0,1]=4 193 B8R0.24 COC(=O)CC(O)(C)C 1P00EZ0H [0,1,0,0,0,0|2,0,1]=4 194 B8R0.24 COC(=O)NC(C)(C)C 1P01DU6Z [0,1,0,0,0,0|2,0,1]=4 195 B8R0.24 ClCC(=C)C[Si](C)(C)C 1P003FH5 [0,1,0,0,0,0|3,0,0]=4 196 B8R0.24 ClCC(=O)CC(Cl)(C)C 1P027VIV [0,1,0,0,0,0|3,0,0]=4 197 B8R0.24 ClCC(=O)NC(C)(C)C 1P001PGV [0,1,0,0,0,0|3,0,0]=4 198 B8R0.24 ClCC(=O)OC(C)(C)C 1P003V02 [0,1,0,0,0,0|3,0,0]=4 199 B8R0.24 ClCC(C[N+](C)(C)C)O 1P003446 [0,1,0,0,0,0|1,0,2]=4 200 B8R0.24 ClC[C@@H](C[N+](C)(C)C)O 1P007823 [0,1,0,0,0,0|1,0,2]=4 201 B8R0.24 ClC[C@H](C[N+](C)(C)C)O 1P0004UU [0,1,0,0,0,0|1,0,2]=4 202 B8R0.24 ICC(=O)OC(C)(C)C 1P006YDV [0,1,0,0,0,0|3,0,0]=4 203 B8R0.24 N#CC(=O)OC(C)(C)C 1P01AGIB [0,1,0,0,0,0|3,0,0]=4 204 B8R0.24 NCC(=O)NC(C)(C)C 1P00FCYH [0,1,0,0,0,0|3,0,0]=4 205 B8R0.24 NCC(=O)NC(C)(C)C 1P00J2CP [0,1,0,0,0,0|3,0,0]=4 206 B8R0.24 NCC(=O)OC(C)(C)C 1P0035FR [0,1,0,0,0,0|3,0,0]=4 207 B8R0.24 NCC(=O)OC(C)(C)C 1P003910 [0,1,0,0,0,0|3,0,0]=4 208 B8R0.24 NCC(=O)OC(C)(C)C 1P00CJXG [0,1,0,0,0,0|3,0,0]=4 209 B8R0.24 NNC(=O)CC(C)(C)C 1P00FQ5L [0,1,0,0,0,0|2,0,0]=3 210 B8R0.24 NNC(=O)OC(C)(C)C 1P003V16 [0,1,0,0,0,0|3,0,0]=4 211 B8R0.24 O=CC(CC(C)(C)C)C 1P001ZXY [0,1,0,0,0,0|2,0,1]=4 212 B8R0.24 OCC(=O)NC(C)(C)C 1P01DWAA [0,1,0,0,0,0|2,0,1]=4 213 B8R0.24 OCC(=O)OC(C)(C)C 1P00363L [0,1,0,0,0,0|2,0,1]=4 214 B8R0.24 OCC(C[N+](C)(C)C)O 1P0039IA [0,1,0,0,0,0|0,0,3]=4 215 B8R0.24 ONC(=O)CC(C)(C)C 1P01AMRP [0,1,0,0,0,0|1,0,1]=3 216 B8R0.24 ONC(=O)OC(C)(C)C 1P003641 [0,1,0,0,0,0|2,0,1]=4 217 B8R0.24 SCC(=O)OC(C)(C)C 1P01ACXE [0,1,0,0,0,0|2,1,0]=4 218 B8R0.27 BrC(C(Br)(C)C)C(=O)O 1P008MR6 [0,1,0,0,0,0|2,0,1]=4 219 B8R0.27 BrC(C(C)(C)C)C(=O)N 1P01A687 [0,1,0,0,0,0|2,0,0]=3 220 B8R0.27 BrC(C(C)(C)C)C(=O)O 1P019KNC [0,1,0,0,0,0|1,0,1]=3 221 B8R0.27 Br[C@H](C(C)(C)C)C(=O)O 1P028AQ6 [0,1,0,0,0,0|1,0,1]=3 222 B8R0.27 C=C(C(C)(C)C)C(=O)O 1P01E9II [0,1,0,0,0,0|1,0,2]=4 223 B8R0.27 CC(=O)C(=C)[Si](C)(C)C 1P0074SW [0,1,0,0,0,0|2,0,1]=4 224 B8R0.27 CC(=O)C(C(C)(C)C)Br 1P01BAQD [0,1,0,0,0,0|2,0,0]=3 225 B8R0.27 CC(C(C)(C)C)C(=O)Cl 1P01BUD6 [0,1,0,0,0,0|2,0,0]=3 226 B8R0.27 CC(C(C)(C)C)C(=O)O 1P002CDO [0,1,0,0,0,0|1,0,1]=3 227 B8R0.27 CN(C(C)(C)C)C(=O)Cl 1P01X9UZ [0,1,0,0,0,0|3,0,0]=4 228 B8R0.27 C[C@@H](C(C)(C)C)C(=O)O 1P001535 [0,1,0,0,0,0|1,0,1]=3 229 B8R0.27 C[C@H](C(C)(C)C)C(=O)O 1P028P1F [0,1,0,0,0,0|1,0,1]=3 230 B8R0.27 NC(C(C)(C)C)C(=O)N 1P01ABOW [0,1,0,0,0,0|2,0,0]=3 231 B8R0.27 NC(C(C)(C)C)C(=O)O 1P003QB9 [0,1,0,0,0,0|1,0,1]=3 232 B8R0.27 NC(C(C)(C)C)C(=O)O 1P019KND [0,1,0,0,0,0|1,0,1]=3 233 B8R0.27 NC(C(F)(C)C)C(=O)O 1P003JY0 [0,1,0,0,0,0|2,0,1]=4 234 B8R0.27 NC(C(N)(C)C)C(=O)O 1P027WBG [0,1,0,0,0,0|2,0,1]=4 235 B8R0.27 NC(C(S)(C)C)C(=O)O 1P00DF49 [0,1,0,0,0,0|2,0,1]=4 236 B8R0.27 N[C@@H](C(C)(C)C)C(=O)N 1P00G6LE [0,1,0,0,0,0|2,0,0]=3 237 B8R0.27 N[C@@H](C(C)(C)C)C(=O)O 1P002K9B [0,1,0,0,0,0|1,0,1]=3 238 B8R0.27 N[C@@H](C(C)(C)C)C(=O)O 1P009DP5 [0,1,0,0,0,0|1,0,1]=3 239 B8R0.27 N[C@@H](C(S)(C)C)C(=O)O 1P0035KM [0,1,0,0,0,0|2,0,1]=4 240 B8R0.27 N[C@H](C(C)(C)C)C(=O)N 1P028TIH [0,1,0,0,0,0|2,0,0]=3 241 B8R0.27 N[C@H](C(C)(C)C)C(=O)O 1P003QCY [0,1,0,0,0,0|1,0,1]=3 242 B8R0.27 N[C@H](C(S)(C)C)C(=O)O 1P003952 [0,1,0,0,0,0|2,0,1]=4 243 B8R0.27 O=C(C(C)(C)C)C(=O)O 1P0033Y9 [0,1,0,0,0,0|1,0,2]=4 244 B8R0.27 OC(=O)C(C(O)(C)C)N 1P0033JN [0,1,0,0,0,0|2,0,1]=4 245 B8R0.27 OC(=O)C(C(O)(C)C)O 1P0021IY [0,1,0,0,0,0|2,0,1]=4 246 B8R0.27 OC(=O)C(P(=O)(C)C)C 1P028O0L [0,1,0,0,0,0|1,1,1]=4 247 B8R0.27 OC(=O)[C@@H](C(O)(C)C)C 1P028OUK [0,1,0,0,0,0|2,0,1]=4 248 B8R0.27 OC(=O)[C@@H](C(O)(C)C)N 1P00I4Y9 [0,1,0,0,0,0|2,0,1]=4 249 B8R0.27 OC(=O)[C@H](C(O)(C)C)N 1P003A76 [0,1,0,0,0,0|2,0,1]=4 250 B8R0.27 OC(C(C)(C)C)C(=O)O 1P00D6E9 [0,1,0,0,0,0|1,0,1]=3 251 B8R0.27 O[C@@H](C(C)(C)C)C(=O)O 1P003CUB [0,1,0,0,0,0|1,0,1]=3 252 B8R0.27 O[C@H](C(C)(C)C)C(=O)O 1P0070AJ [0,1,0,0,0,0|1,0,1]=3 253 B8R0.33 CC(CS(=O)(=O)Cl)(C)C 1P00DC31 [0,1,0,0,0,0|2,0,1]=4 254 B8R0.33 CC(CS(=O)(=O)N)(C)C 1P00C3BA [0,1,0,0,0,0|2,0,1]=4 255 B8R0.33 CC(CS(=O)(=O)[O-])(N)C 1P01ACYP [0,1,0,0,0,0|3,0,0]=4 256 B8R0.34 BrCC(CC(=C)Br)(C)C 1P028NFW [0,1,0,0,0,0|3,0,0]=4 257 B8R0.34 BrCC(CC(=O)O)(C)C 1P01ACNU [0,1,0,0,0,0|1,0,1]=3 258 B8R0.34 BrCC(OC(=O)C)(C)C 1P01ADOX [0,1,0,0,0,0|3,0,0]=4 259 B8R0.34 C=CC(CC(=O)N)(C)C 1P01B6U9 [0,1,0,0,0,0|2,0,1]=4 260 B8R0.34 C=CC(CC(=O)O)(C)C 1P005EPY [0,1,0,0,0,0|1,0,2]=4 261 B8R0.34 CC(CC)(CC(=O)O)O 1P001MOK [0,1,0,0,0,0|2,0,1]=4 262 B8R0.34 CC(CN)(CC(=O)O)O 1P01C2EI [0,1,0,0,0,0|2,0,1]=4 263 B8R0.34 CCC(CC(=O)Cl)(C)C 1P01B7B9 [0,1,0,0,0,0|2,0,0]=3 264 B8R0.34 CCC(CC(=O)O)(C)C 1P00C0N1 [0,1,0,0,0,0|1,0,1]=3 265 B8R0.34 CCC(OC(=O)C)(C)C 1P00EIYT [0,1,0,0,0,0|3,0,0]=4 266 B8R0.34 CNC(CC(=O)O)(C)C 1P028UEW [0,1,0,0,0,0|1,0,1]=3 267 B8R0.34 COC(CC(=O)C)(C)C 1P003M3N [0,1,0,0,0,0|2,0,0]=3 268 B8R0.34 CSC(CC(=O)C)(C)C 1P002O47 [0,1,0,0,0,0|2,0,0]=3 269 B8R0.34 CSC(CC(=O)O)(C)C 1P028GQO [0,1,0,0,0,0|1,0,1]=3 270 B8R0.34 ClCC(CC(=O)Cl)(C)C 1P027UDI [0,1,0,0,0,0|2,0,0]=3 271 B8R0.34 ClCC(OC(=O)Cl)(C)C 1P0287AC [0,1,0,0,0,0|3,0,0]=4 272 B8R0.34 ClC[Si](CC(=O)O)(C)C 1P01BJ4O [0,1,0,0,0,0|1,0,1]=3 273 B8R0.34 ICC(CC(=O)Cl)(C)C 1P01FI2H [0,1,0,0,0,0|2,0,0]=3 274 B8R0.34 ICC(CC(=O)O)(C)C 1P01FL60 [0,1,0,0,0,0|1,0,1]=3 275 B8R0.34 N#CC(CC(=O)C)(C)C 1P01B5HZ [0,1,0,0,0,0|2,0,1]=4 276 B8R0.34 N#CC(CC(=O)O)(C)C 1P01A3UF [0,1,0,0,0,0|1,0,2]=4 277 B8R0.34 NCC(CC(=O)O)(C)C 1P00GURE [0,1,0,0,0,0|1,0,1]=3 278 B8R0.34 OCC(CC(=C)Br)(C)C 1P028MOM [0,1,0,0,0,0|3,0,0]=4 279 B8R0.34 OCC(CC(=N)N)(C)C 1P028VSB [0,1,0,0,0,0|3,0,0]=4 280 B8R0.34 OCC(NC(=O)C)(C)C 1P01BIKY [0,1,0,0,0,0|3,0,0]=4 281 B8R0.34 SCC(NC(=O)C)(C)C 1P01B6XH [0,1,0,0,0,0|3,0,0]=4 282 B8R1.42 CC(=O)CC1(C)CC1 1P001AJS [0,0,0,1,0,0|2,0,0]=3 283 B8R1.42 NC(=N)CC1(C)CC1 1P027WY2 [0,0,0,1,0,0|3,0,0]=4 284 B8R1.42 NC(=O)CC1(N)CC1 1P028H0S [0,0,0,1,0,0|3,0,0]=4 285 B8R1.42 OC(=O)CC1(C)CC1 1P00FH9D [0,0,0,1,0,0|1,0,1]=3 286 B8R1.42 OC(=O)CC1(N)CC1 1P01A4QZ [0,0,0,1,0,0|2,0,1]=4 287 B8R1.42 OC(=O)CC1(O)CC1 1P01BAKB [0,0,0,1,0,0|2,0,1]=4 288 B8R1.51 C=C1CCC(C1)(C)C 1P008NCX [0,0,0,1,0,0|3,0,0]=4 289 B8R1.51 CC1(O)CC(=O)NC1 1P00D8NX [0,0,0,1,0,0|3,0,0]=4 290 B8R1.51 NC1=NCC(C1)(C)C 1P01JV23 [0,0,0,1,0,0|3,0,0]=4 291 B8R1.51 O=C1C=CC(C1)(C)C 1P003KWE [0,0,0,1,0,0|2,0,1]=4 292 B8R1.51 O=C1CCC(C1)(C)C 1P002AAG [0,0,0,1,0,0|2,0,0]=3 293 B8R1.51 O=C1CCC(N1)(C)C 1P0034MN [0,0,0,1,0,0|3,0,0]=4 294 B8R1.51 O=C1CCC(O1)(C)C 1P007IPY [0,0,0,1,0,0|3,0,0]=4 295 B8R1.51 O=C1CNC(C1)(C)C 1P01A3P4 [0,0,0,1,0,0|3,0,0]=4 296 B8R1.51 O=C1COC(C1)(C)C 1P0039TO [0,0,0,1,0,0|3,0,0]=4 297 B8R1.51 O=C1NCC(C1)(C)C 1P003KWL [0,0,0,1,0,0|2,0,0]=3 298 B8R1.51 O=C1NCC(N1)(C)C 1P002P2W [0,0,0,1,0,0|3,0,0]=4 299 B8R1.51 O=C1NCC(O1)(C)C 1P00HCTB [0,0,0,1,0,0|3,0,0]=4 300 B8R1.51 O=C1NOC(C1)(C)C 1P01DX07 [0,0,0,1,0,0|3,0,0]=4 301 B8R1.51 O=C1OCC(C1)(C)C 1P0019BQ [0,0,0,1,0,0|1,0,1]=3 302 B8R1.51 O=C1OCC(N1)(C)C 1P003KWQ [0,0,0,1,0,0|2,0,1]=4 303 B8R1.51 O=C1SCC(N1)(C)C 1P028YXF [0,0,0,1,0,0|2,1,0]=4 304 B8R1.56 C[N+](CC1OC1)(C)C 1P0038KJ [0,0,0,1,0,0|1,0,2]=4 305 B8R1.77 CC(=O)C1CC1(C)C 1P004M9O [0,0,0,1,0,0|2,0,0]=3 306 B8R1.77 CC1(Br)CC1C(=O)O 1P01B290 [0,0,0,1,0,0|2,0,1]=4 307 B8R1.77 ClC(=O)C1CC1(C)C 1P00DVL5 [0,0,0,1,0,0|2,0,0]=3 308 B8R1.77 NC(=N)C1CC1(C)C 1P01B5FY [0,0,0,1,0,0|3,0,0]=4 309 B8R1.77 NC(=O)C1CC1(C)C 1P0021R3 [0,0,0,1,0,0|2,0,0]=3 310 B8R1.77 NC(=O)[C@@H]1CC1(C)C 1P003CKE [0,0,0,1,0,0|2,0,0]=3 311 B8R1.77 NC(=O)[C@H]1CC1(C)C 1P003CWT [0,0,0,1,0,0|2,0,0]=3 312 B8R1.77 NC(=S)C1CC1(C)C 1P01DVY6 [0,0,0,1,0,0|2,1,0]=4 313 B8R1.77 OC(=O)C1CC1(C)C 1P00371E [0,0,0,1,0,0|1,0,1]=3 314 B8R1.77 OC(=O)[C@H]1CC1(C)C 1P001DYP [0,0,0,1,0,0|1,0,1]=3 315 B6R0.7 BrC(=C)C(C)(C)C 1P01EMLK [0,0,0,0,1,0|3,0,0]=4 316 B6R0.7 BrC(=C)[Si](C)(C)C 1P0012VH [0,0,0,0,1,0|3,0,0]=4 317 B6R0.7 BrC(=O)C(Br)(C)C 1P002JOT [0,0,0,0,1,0|3,0,0]=4 318 B6R0.7 CC(=O)C(Br)(C)C 1P002TV2 [0,0,0,0,1,0|3,0,0]=4 319 B6R0.7 CC(=O)C(Cl)(C)C 1P00EDWH [0,0,0,0,1,0|3,0,0]=4 320 B6R0.7 CC(=O)C(F)(C)C 1P01DW0X [0,0,0,0,1,0|3,0,0]=4 321 B6R0.7 CC(=O)C(N)(C)C 1P0006SC [0,0,0,0,1,0|3,0,0]=4 322 B6R0.7 CC(=O)C(O)(C)C 1P000G0I [0,0,0,0,1,0|3,0,0]=4 323 B6R0.7 CC(=O)[Si](C)(C)C 1P007N0S [0,0,0,0,1,0|2,0,0]=3 324 B6R0.7 CC(S(=O)Cl)(C)C 1P003V2P [0,0,0,0,1,0|3,0,0]=4 325 B6R0.7 CC(S(=O)N)(C)C 1P00HXYB [0,0,0,0,1,0|3,0,0]=4 326 B6R0.7 CC(S(=O)[O-])(C)C 1P01BCHQ [0,0,0,0,1,0|2,0,0]=3 327 B6R0.7 CC([N+](=O)[O-])(C)C 1P003I2M [0,0,0,0,1,0|2,0,0]=3 328 B6R0.7 CC([S@@](=O)N)(C)C 1P0032UP [0,0,0,0,1,0|3,0,0]=4 329 B6R0.7 CC([S@](=O)N)(C)C 1P0032WC [0,0,0,0,1,0|3,0,0]=4 330 B6R0.7 CS(=O)C(C)(C)C 1P001G4M [0,0,0,0,1,0|3,0,0]=4 331 B6R0.7 ClC(=C)C(C)(C)C 1P024KXH [0,0,0,0,1,0|3,0,0]=4 332 B6R0.7 ClC(=O)C(Br)(C)C 1P002A40 [0,0,0,0,1,0|3,0,0]=4 333 B6R0.7 ClC(=O)C(Cl)(C)C 1P0010VD [0,0,0,0,1,0|3,0,0]=4 334 B6R0.7 ClC(=O)C(F)(C)C 1P01UOTK [0,0,0,0,1,0|3,0,0]=4 335 B6R0.7 NC(=N)C(C)(C)C 1P0023R9 [0,0,0,0,1,0|3,0,0]=4 336 B6R0.7 NC(=O)C(Br)(C)C 1P005B2L [0,0,0,0,1,0|3,0,0]=4 337 B6R0.7 NC(=O)C(C)(C)C 1P0035YI [0,0,0,0,1,0|2,0,0]=3 338 B6R0.7 NC(=O)C(Cl)(C)C 1P01A2I6 [0,0,0,0,1,0|3,0,0]=4 339 B6R0.7 NC(=O)C(N)(C)C 1P001TOY [0,0,0,0,1,0|3,0,0]=4 340 B6R0.7 NC(=O)C(N)(C)C 1P00AUNH [0,0,0,0,1,0|3,0,0]=4 341 B6R0.7 NC(=O)C(O)(C)C 1P000UO8 [0,0,0,0,1,0|3,0,0]=4 342 B6R0.7 NC(=S)C(C)(C)C 1P0037DV [0,0,0,0,1,0|2,1,0]=4 343 B6R0.7 OC(=O)C(Br)(C)C 1P002AEN [0,0,0,0,1,0|2,0,1]=4 344 B6R0.7 OC(=O)C(C)(C)C 1P0035YJ [0,0,0,0,1,0|1,0,1]=3 345 B6R0.7 OC(=O)C(Cl)(C)C 1P00EI2W [0,0,0,0,1,0|2,0,1]=4 346 B6R0.7 OC(=O)C(F)(C)C 1P00EBJZ [0,0,0,0,1,0|2,0,1]=4 347 B6R0.7 OC(=O)C(N)(C)C 1P003GTA [0,0,0,0,1,0|2,0,1]=4 348 B6R0.7 OC(=O)C(O)(C)C 1P00369V [0,0,0,0,1,0|2,0,1]=4 349 B6R0.7 OC(=O)C(S)(C)C 1P00DE8V [0,0,0,0,1,0|2,0,1]=4 350 B6R0.7 [O-]C(=O)C(C)(C)C 1P001QJO [0,0,0,0,1,0|1,0,0]=2 351 B6R0.7 [O-]C(=O)C(C)(C)C 1P00362K [0,0,0,0,1,0|1,0,0]=2 352 B6R0.7 [O-]C(=O)C(C)(C)C 1P003P88 [0,0,0,0,1,0|1,0,0]=2 353 B6R0.7 [O-]C(=O)C(C)(C)C 1P003TZZ [0,0,0,0,1,0|1,0,0]=2 354 B6R0.7 [O-]C(=O)C(C)(C)C 1P003UV1 [0,0,0,0,1,0|1,0,0]=2 355 B6R0.7 [O-]C(=O)C(C)(C)C 1P00AN4U [0,0,0,0,1,0|1,0,0]=2 356 B6R0.7 [O-]C(=O)C(C)(C)C 1P01XD1A [0,0,0,0,1,0|1,0,0]=2 357 B6R0.7 [O-]C(=O)C(F)(F)C 1P00HS8I [0,0,0,0,1,0|3,0,0]=4 358 B8R0.29 CC(=CCC(C)(C)C)C 1P0039LQ [0,0,0,0,0,1|3,0,0]=4 359 B8R0.29 CC(=CC[Si](C)(C)C)C 1P0024R2 [0,0,0,0,0,1|3,0,0]=4 360 B8R0.29 CC(=O)C#C[Si](C)(C)C 1P003KT1 [0,0,0,0,0,1|2,0,1]=4 361 B8R0.29 CC(=O)CCC(C)(C)C 1P007L85 [0,0,0,0,0,1|2,0,0]=3 362 B8R0.29 CC(=O)CCC(O)(C)C 1P00743F [0,0,0,0,0,1|3,0,0]=4 363 B8R0.29 CC(=O)CCP(=O)(C)C 1P028OE3 [0,0,0,0,0,1|2,1,0]=4 364 B8R0.29 CC(=O)COC(C)(C)C 1P01HOW4 [0,0,0,0,0,1|2,0,0]=3 365 B8R0.29 CC(=O)CSC(C)(C)C 1P01ABIT [0,0,0,0,0,1|2,0,0]=3 366 B8R0.29 CC(=O)NCC(O)(C)C 1P01BBLR [0,0,0,0,0,1|3,0,0]=4 367 B8R0.29 CC(=O)OC[Si](C)(C)C 1P002Y0U [0,0,0,0,0,1|2,0,0]=3 368 B8R0.29 CC(=O)ONC(C)(C)C 1P003TW7 [0,0,0,0,0,1|3,0,0]=4 369 B8R0.29 CC(=O)SCC(C)(C)C 1P01BGOZ [0,0,0,0,0,1|2,0,0]=3 370 B8R0.29 ClC(=O)C#C[Si](C)(C)C 1P01BRI6 [0,0,0,0,0,1|2,0,1]=4 371 B8R0.29 ClC(=O)COC(C)(C)C 1P01BARD [0,0,0,0,0,1|2,0,0]=3 372 B8R0.29 ClC(=O)OCC(C)(C)C 1P0029RG [0,0,0,0,0,1|2,0,0]=3 373 B8R0.29 NC(=N)CCC(C)(C)C 1P028NFX [0,0,0,0,0,1|3,0,0]=4 374 B8R0.29 NC(=N)COC(C)(C)C 1P01ADAB [0,0,0,0,0,1|3,0,0]=4 375 B8R0.29 NC(=O)CNC(C)(C)C 1P019ZGZ [0,0,0,0,0,1|2,0,0]=3 376 B8R0.29 NC(=O)NCC(C)(C)C 1P019U5E [0,0,0,0,0,1|2,0,0]=3 377 B8R0.29 NC(=O)NCC(N)(C)C 1P000HSP [0,0,0,0,0,1|3,0,0]=4 378 B8R0.29 NC(=S)COC(C)(C)C 1P01CARR [0,0,0,0,0,1|2,1,0]=4 379 B8R0.29 OC(=O)C#CC(C)(C)C 1P00E2YJ [0,0,0,0,0,1|1,0,2]=4 380 B8R0.29 OC(=O)C#C[Si](C)(C)C 1P003IS1 [0,0,0,0,0,1|1,0,2]=4 381 B8R0.29 OC(=O)CCC(C)(C)C 1P008SUK [0,0,0,0,0,1|1,0,1]=3 382 B8R0.29 OC(=O)CCC(F)(C)C 1P028N2G [0,0,0,0,0,1|2,0,1]=4 383 B8R0.29 OC(=O)CCC(N)(C)C 1P00J22H [0,0,0,0,0,1|2,0,1]=4 384 B8R0.29 OC(=O)CCC(S)(C)C 1P009D4O [0,0,0,0,0,1|2,0,1]=4 385 B8R0.29 OC(=O)CCP(=O)(C)C 1P028OK0 [0,0,0,0,0,1|1,1,1]=4 386 B8R0.29 OC(=O)CC[N+](C)(C)C 1P007RMM [0,0,0,0,0,1|0,0,1]=2 387 B8R0.29 OC(=O)CC[Si](C)(C)C 1P00EB1H [0,0,0,0,0,1|1,0,1]=3 388 B8R0.29 OC(=O)CN=S(=O)(C)C 1P00IWDT [0,0,0,0,0,1|2,0,1]=4 389 B8R0.29 OC(=O)CNC(C)(C)C 1P003TTH [0,0,0,0,0,1|1,0,1]=3 390 B8R0.29 OC(=O)CNC(C)(C)C 1P00E9LM [0,0,0,0,0,1|1,0,1]=3 391 B8R0.29 OC(=O)COC(C)(C)C 1P0010OW [0,0,0,0,0,1|1,0,1]=3 392 B8R0.29 OC(=O)COP(=O)(C)C 1P028VD5 [0,0,0,0,0,1|1,1,1]=4 393 B8R0.29 OC(=O)CSC(C)(C)C 1P00BFTV [0,0,0,0,0,1|1,0,1]=3 394 B8R0.29 OC(=O)\C=C\C(C)(C)C 1P001XCT [0,0,0,0,0,1|1,0,2]=4 395 B8R0.29 [O-]C(=O)C#CC(F)(C)C 1P027V1L [0,0,0,0,0,1|2,0,1]=4 396 B8R0.29 [O-]C(=O)CCC(O)(C)C 1P01ADH8 [0,0,0,0,0,1|2,0,0]=3 397 B8R0.29 [O-]C(=O)CNS(=O)(=O)C 1P019M31 [0,0,0,0,0,1|3,0,0]=4 398 B8R0.29 [O-][N+](=O)C=CC(C)(C)C 1P00B0MF [0,0,0,0,0,1|2,0,1]=4 399 B8R0.29 [O-][N+](=O)CCC(C)(C)C 1P01EJ2M [0,0,0,0,0,1|2,0,0]=3 400 B5R0.1 C=CCN(C)C 1P003T1I [2,0,0,0,0,0|1,0,1]=4 401 B5R0.1 CCCC(=O)C 1P0038PH [2,0,0,0,0,0|2,0,0]=4 402 B5R0.1 CCCC(=O)N 1P003P36 [2,0,0,0,0,0|2,0,0]=4 403 B5R0.1 CCCC(=O)O 1P0038GU [2,0,0,0,0,0|1,0,1]=4 404 B5R0.1 CCCC(=O)[O-] 1P00EBJ7 [2,0,0,0,0,0|1,0,0]=3 405 B5R0.1 CCCC(=O)[O-] 1P01XCJO [2,0,0,0,0,0|1,0,0]=3 406 B5R0.1 CNCC(=O)N 1P0033CB [2,0,0,0,0,0|1,0,1]=4 407 B5R0.1 CNCC(=O)O 1P003UNZ [2,0,0,0,0,0|0,0,2]=4 408 B5R0.1 CNCC(=O)O 1P003UO1 [2,0,0,0,0,0|0,0,2]=4 409 B5R0.1 COCC(=O)C 1P0035LL [2,0,0,0,0,0|2,0,0]=4 410 B5R0.1 COCC(=O)Cl 1P003RYU [2,0,0,0,0,0|2,0,0]=4 411 B5R0.1 COCC(=O)N 1P001UIN [2,0,0,0,0,0|2,0,0]=4 412 B5R0.1 COCC(=O)O 1P0035LK [2,0,0,0,0,0|1,0,1]=4 413 B5R0.1 CSCC(=O)C 1P001GCU [2,0,0,0,0,0|2,0,0]=4 414 B5R0.1 CSCC(=O)Cl 1P007DQ1 [2,0,0,0,0,0|2,0,0]=4 415 B5R0.1 CSCC(=O)N 1P0039C2 [2,0,0,0,0,0|2,0,0]=4 416 B5R0.1 CSCC(=O)O 1P003CI8 [2,0,0,0,0,0|1,0,1]=4 417 B5R0.1 O=CC=C(C)C 1P00347P [2,0,0,0,0,0|1,0,1]=4 418 B5R0.1 O=CCC(C)C 1P003938 [2,0,0,0,0,0|1,0,0]=3 419 B5R0.1 O=CCN(C)C 1P000R2Q [2,0,0,0,0,0|0,0,1]=3 420 B5R0.1 O=CCN(C)C 1P001GSU [2,0,0,0,0,0|0,0,1]=3 421 B5R0.1 O=CNC(C)C 1P00BBY6 [2,0,0,0,0,0|2,0,0]=4 422 B5R0.1 O=CNN(C)C 1P00C6WA [2,0,0,0,0,0|1,0,1]=4 423 B5R0.1 [O-]C(=O)CC#N 1P00ICJS [2,0,0,0,0,0|2,0,0]=4 424 B5R0.1 [O-]C(=O)CCC 1P001OVQ [2,0,0,0,0,0|1,0,0]=3 425 B5R0.1 [O-]C(=O)CCN 1P001XGH [2,0,0,0,0,0|2,0,0]=4 426 B5R0.1 [O-]C(=O)CCO 1P00EFHM [2,0,0,0,0,0|2,0,0]=4 427 B5R0.1 [O-]C(=O)CNC 1P003UUQ [2,0,0,0,0,0|0,0,1]=3 428 B5R0.1 [O-]C(=O)C[N+]#[C-] 1P00EM2K [2,0,0,0,0,0|0,0,2]=4 429 B5R0.1 [O-]S(=O)CCC 1P01BCHD [2,0,0,0,0,0|2,0,0]=4 430 B5R0.4 BrCC(C)(C)C 1P003EJC [2,0,0,0,0,0|2,0,0]=4 431 B5R0.4 BrC[Si](C)(C)C 1P0024CF [2,0,0,0,0,0|2,0,0]=4 432 B5R0.4 C=CC(C)(C)C 1P003ITT [2,0,0,0,0,0|1,0,1]=4 433 B5R0.4 C=C[N+](C)(C)C 1P003VLH [2,0,0,0,0,0|0,0,1]=3 434 B5R0.4 C=C[Si](C)(C)C 1P00369C [2,0,0,0,0,0|1,0,1]=4 435 B5R0.4 CC[N+](C)(C)C 1P002TYK [2,0,0,0,0,0|0,0,1]=3 436 B5R0.4 CC[N+](C)(C)C 1P00DDMU [2,0,0,0,0,0|0,0,1]=3 437 B5R0.4 ClCC(C)(C)C 1P003TFH [2,0,0,0,0,0|2,0,0]=4 438 B5R0.4 ClC[Si](C)(C)C 1P002NPG [2,0,0,0,0,0|2,0,0]=4 439 B5R0.4 ICC(C)(C)C 1P001O15 [2,0,0,0,0,0|2,0,0]=4 440 B5R0.4 IC[N+](C)(C)C 1P003RHH [2,0,0,0,0,0|1,0,0]=3 441 B5R0.4 IC[Si](C)(C)C 1P003CI4 [2,0,0,0,0,0|2,0,0]=4 442 B5R0.4 NCC(C)(C)C 1P001R1E [2,0,0,0,0,0|2,0,0]=4 443 B5R0.4 NCC(C)(C)C 1P003TFK [2,0,0,0,0,0|2,0,0]=4 444 B5R0.4 NC[Si](C)(C)C 1P01JVPE [2,0,0,0,0,0|2,0,0]=4 445 B5R0.4 O=CC(Br)(C)C 1P0010LR [2,0,0,0,0,0|2,0,0]=4 446 B5R0.4 O=CC(C)(C)C 1P00367Z [2,0,0,0,0,0|1,0,0]=3 447 B5R0.4 O=NC(C)(C)C 1P003V2S [2,0,0,0,0,0|2,0,0]=4 448 B5R0.4 OCC(C)(C)C 1P003TFF [2,0,0,0,0,0|1,0,1]=4 449 B5R0.4 OC[Si](C)(C)C 1P00BZAP [2,0,0,0,0,0|1,0,1]=4 450 B5R0.4 SCC(C)(C)C 1P007W5C [2,0,0,0,0,0|1,1,0]=4 451 B5R0.4 SC[Si](C)(C)C 1P0023HM [2,0,0,0,0,0|1,1,0]=4 452 B7R0.2 CC(CC)CC(=O)O 1P00359B [1,1,0,0,0,0|1,0,1]=4 453 B7R0.2 CC(CF)CC(=O)O 1P01SVBB [1,1,0,0,0,0|1,0,1]=4 454 B7R0.2 CC(CN)CC(=O)O 1P01A0Y2 [1,1,0,0,0,0|1,0,1]=4 455 B7R0.2 CC(NC)CC(=O)N 1P00J30L [1,1,0,0,0,0|2,0,0]=4 456 B7R0.2 CC(NC)CC(=O)O 1P001XOH [1,1,0,0,0,0|1,0,1]=4 457 B7R0.2 CC(OC)CC(=O)O 1P0001T2 [1,1,0,0,0,0|1,0,1]=4 458 B7R0.2 CC(SC)CC(=O)O 1P00B61I [1,1,0,0,0,0|1,0,1]=4 459 B7R0.2 CCC(=O)CC(C)C 1P003NCQ [1,1,0,0,0,0|2,0,0]=4 460 B7R0.2 CCC(CC(=O)C)C 1P0038PR [1,1,0,0,0,0|2,0,0]=4 461 B7R0.2 CCN(CC(=O)C)C 1P0091DD [1,1,0,0,0,0|1,0,1]=4 462 B7R0.2 CN(CC)CC(=O)O 1P003AQF [1,1,0,0,0,0|0,0,2]=4 463 B7R0.2 CN(CC)CC(=O)O 1P028PG4 [1,1,0,0,0,0|0,0,2]=4 464 B7R0.2 CNC(=O)CN(C)C 1P0059D4 [1,1,0,0,0,0|1,0,1]=4 465 B7R0.2 COC(=O)CC(C)C 1P0035PM [1,1,0,0,0,0|1,0,1]=4 466 B7R0.2 COC(=O)CN(C)C 1P003T1V [1,1,0,0,0,0|0,0,2]=4 467 B7R0.2 C[C@@H](CC)CC(=O)O 1P007CFN [1,1,0,0,0,0|1,0,1]=4 468 B7R0.2 C[C@H](CC)CC(=O)O 1P00AQ4A [1,1,0,0,0,0|1,0,1]=4 469 B7R0.2 C[C@H](CN)CC(=O)O 1P01BS0C [1,1,0,0,0,0|1,0,1]=4 470 B7R0.2 ClCC(=O)CC(C)C 1P00CLO7 [1,1,0,0,0,0|2,0,0]=4 471 B7R0.2 ClCC(CC(=O)Cl)C 1P00IBOT [1,1,0,0,0,0|2,0,0]=4 472 B7R0.2 NCC(=O)CC(C)C 1P007R1H [1,1,0,0,0,0|2,0,0]=4 473 B7R0.2 NC[C@@H](CC(=O)O)C 1P01C10F [1,1,0,0,0,0|1,0,1]=4 474 B7R0.2 NNC(=O)CC(C)C 1P007O9X [1,1,0,0,0,0|2,0,0]=4 475 B7R0.2 NNC(=O)CN(C)C 1P00DA0I [1,1,0,0,0,0|1,0,1]=4 476 B7R0.2 NNC(=O)CN(C)C 1P00EEQJ [1,1,0,0,0,0|1,0,1]=4 477 B7R0.2 [O-]C(=O)CC(=O)NC 1P028NHN [1,1,0,0,0,0|2,0,0]=4 478 B7R0.2 [O-]C(=O)CC(=O)OC 1P001XI6 [1,1,0,0,0,0|2,0,0]=4 479 B7R0.2 [O-]C(=O)CC(=O)OC 1P0035YT [1,1,0,0,0,0|2,0,0]=4 480 B7R0.2 [O-]C(=O)CC(C#N)C 1P01B8MC [1,1,0,0,0,0|1,0,1]=4 481 B7R0.2 [O-]C(=O)CC(CO)C 1P01EMTK [1,1,0,0,0,0|1,0,0]=3 482 B7R0.2 [O-]C(=O)\C=C(\CO)/C 1P02842A [1,1,0,0,0,0|1,0,1]=4 483 B7R0.16 BrC(C(=O)Cl)C(C)C 1P00DNAU [1,1,0,0,0,0|2,0,0]=4 484 B7R0.16 BrC(C(=O)N)C(C)C 1P019PO7 [1,1,0,0,0,0|2,0,0]=4 485 B7R0.16 BrC(C(=O)O)C(C)C 1P0036DQ [1,1,0,0,0,0|1,0,1]=4 486 B7R0.16 Br[C@@H](C(=O)O)C(C)C 1P00G3NN [1,1,0,0,0,0|1,0,1]=4 487 B7R0.16 Br[C@H](C(=O)O)C(C)C 1P003CVL [1,1,0,0,0,0|1,0,1]=4 488 B7R0.16 CC(C(=O)C(=O)[O-])C 1P003URT [1,1,0,0,0,0|1,0,1]=4 489 B7R0.16 CC(C(=O)C(=O)[O-])C 1P00I9QK [1,1,0,0,0,0|1,0,1]=4 490 B7R0.16 CC(C(=O)C(=O)[O-])C 1P02841O [1,1,0,0,0,0|1,0,1]=4 491 B7R0.16 CC(C(=O)Cl)C(C)C 1P00DRED [1,1,0,0,0,0|2,0,0]=4 492 B7R0.16 CC(C(=O)N)N(C)C 1P0285J8 [1,1,0,0,0,0|1,0,1]=4 493 B7R0.16 CC(C(=O)O)C(C)C 1P007ZPC [1,1,0,0,0,0|1,0,1]=4 494 B7R0.16 CC(C(=O)O)N(C)C 1P00ADBV [1,1,0,0,0,0|0,0,2]=4 495 B7R0.16 CC(C(C(=O)C)C)C 1P01HJ3E [1,1,0,0,0,0|2,0,0]=4 496 B7R0.16 CC(C(C(=O)C)S)C 1P005IKG [1,1,0,0,0,0|2,0,0]=4 497 B7R0.16 C[C@@H](C(=O)N)N(C)C 1P02801D [1,1,0,0,0,0|1,0,1]=4 498 B7R0.16 C[C@@H](C(=O)O)C(C)C 1P002VES [1,1,0,0,0,0|1,0,1]=4 499 B7R0.16 C[C@@H](C(=O)O)N(C)C 1P001XKS [1,1,0,0,0,0|0,0,2]=4 500 B7R0.16 C[C@@H](C(=O)O)N(C)C 1P00BHJU [1,1,0,0,0,0|0,0,2]=4 501 B7R0.16 C[C@H](C(=O)N)N(C)C 1P024HWJ [1,1,0,0,0,0|1,0,1]=4 502 B7R0.16 C[C@H](C(=O)O)C(C)C 1P001N9S [1,1,0,0,0,0|1,0,1]=4 503 B7R0.16 C[C@H](C(=O)O)N(C)C 1P001PX5 [1,1,0,0,0,0|0,0,2]=4 504 B7R0.16 C[C@H](C(=O)O)N(C)C 1P00J3DF [1,1,0,0,0,0|0,0,2]=4 505 B7R0.16 ClC(C(=O)O)C(C)C 1P019W9W [1,1,0,0,0,0|1,0,1]=4 506 B7R0.16 Cl[C@H](C(=O)O)C(C)C 1P003D1T [1,1,0,0,0,0|1,0,1]=4 507 B7R0.16 FC(C(=O)O)C(C)C 1P001Q6L [1,1,0,0,0,0|1,0,1]=4 508 B7R0.16 NC(C(=O)N)C(C)C 1P00IMQN [1,1,0,0,0,0|2,0,0]=4 509 B7R0.16 NC(C(=O)O)C(C)C 1P0035KT [1,1,0,0,0,0|1,0,1]=4 510 B7R0.16 N[C@@H](C(=O)N)C(C)C 1P0014U9 [1,1,0,0,0,0|2,0,0]=4 511 B7R0.16 N[C@@H](C(=O)O)C(C)C 1P0037JS [1,1,0,0,0,0|1,0,1]=4 512 B7R0.16 N[C@H](C(=O)N)C(C)C 1P00I645 [1,1,0,0,0,0|2,0,0]=4 513 B7R0.16 N[C@H](C(=O)O)C(C)C 1P00I9OW [1,1,0,0,0,0|1,0,1]=4 514 B7R0.16 OC(C(=O)O)C(C)C 1P003HUP [1,1,0,0,0,0|1,0,1]=4 515 B7R0.16 O[C@@H](C(=O)O)C(C)C 1P001ZWR [1,1,0,0,0,0|1,0,1]=4 516 B7R0.16 O[C@H](C(=O)O)C(C)C 1P007V6T [1,1,0,0,0,0|1,0,1]=4 517 B7R0.16 SC(C(=O)O)C(C)C 1P0019CW [1,1,0,0,0,0|1,0,1]=4 518 B7R0.16 [15NH2][13C@H]([13C](=O)O)[13CH]([13CH3])[13CH3] 1P00C25L [1,1,0,0,0,0|1,0,1]=4 519 B7R0.8 BrCCC[N+](C)(C)C 1P003C89 [1,1,0,0,0,0|1,0,1]=4 520 B7R0.8 C=CCC[Si](C)(C)C 1P0056V9 [1,1,0,0,0,0|2,0,0]=4 521 B7R0.8 C=CCNC(C)(C)C 1P001VKT [1,1,0,0,0,0|2,0,0]=4 522 B7R0.8 C=CCNC(C)(C)C 1P01B79Y [1,1,0,0,0,0|2,0,0]=4 523 B7R0.8 C=CCO[Si](C)(C)C 1P0023CG [1,1,0,0,0,0|2,0,0]=4 524 B7R0.8 CCCC[N+](C)(C)C 1P002TXM [1,1,0,0,0,0|1,0,1]=4 525 B7R0.8 CCCC[N+](C)(C)C 1P003P33 [1,1,0,0,0,0|1,0,1]=4 526 B7R0.8 C[N+](C)(\C=C\CO)C 1P01FWQ9 [1,1,0,0,0,0|0,0,2]=4 527 B7R0.8 NCCC[N+](C)(C)C 1P01AGHP [1,1,0,0,0,0|1,0,1]=4 528 B7R0.8 NCCC[N+](C)(C)C 1P01AGKP [1,1,0,0,0,0|1,0,1]=4 529 B7R0.8 O=C=NCC(C)(C)C 1P001OTY [1,1,0,0,0,0|1,0,1]=4 530 B7R0.8 O=C=NC[Si](C)(C)C 1P007ZPQ [1,1,0,0,0,0|1,0,1]=4 531 B7R0.8 O=CC#C[Si](C)(C)C 1P002ZR7 [1,1,0,0,0,0|1,0,1]=4 532 B7R0.8 O=CCCC(C)(C)C 1P01BEEG [1,1,0,0,0,0|1,0,0]=3 533 B7R0.8 O=CCOC(C)(C)C 1P020L8E [1,1,0,0,0,0|1,0,0]=3 534 B7R0.8 O=CCSC(C)(C)C 1P0052GW [1,1,0,0,0,0|1,0,0]=3 535 B7R0.11 BrCC(CC=C)(C)C 1P01BL6Z [1,1,0,0,0,0|2,0,0]=4 536 B7R0.11 CCC(CC=O)(C)C 1P00967X [1,1,0,0,0,0|1,0,0]=3 537 B7R0.11 COC(CC=O)(C)C 1P00235F [1,1,0,0,0,0|1,0,0]=3 538 B7R0.11 CSC(CC=O)(C)C 1P01AMC2 [1,1,0,0,0,0|1,0,0]=3 539 B7R0.11 ClC[Si](CC=C)(C)C 1P003O6T [1,1,0,0,0,0|2,0,0]=4 540 B7R0.11 NCC(CC=C)(C)C 1P01AMEW [1,1,0,0,0,0|2,0,0]=4 541 B7R0.11 O=CCC(C#N)(C)C 1P0024AY [1,1,0,0,0,0|1,0,1]=4 542 B7R0.11 OCC(CC=C)(C)C 1P00CMKH [1,1,0,0,0,0|2,0,0]=4 543 B7R0.11 OCC(NC=O)(C)C 1P005XV0 [1,1,0,0,0,0|2,0,0]=4 544 B7R0.11 OCC[N+](CF)(C)C 1P00I90I [1,1,0,0,0,0|0,0,2]=4 545 B7R0.11 OCC[N+](CI)(C)C 1P002W1N [1,1,0,0,0,0|0,0,2]=4 546 B7R0.14 C=CC(C(C)(C)C)O 1P01BHLS [1,1,0,0,0,0|2,0,0]=4 547 B7R0.14 O=CC(=C)C(C)(C)C 1P005Z0B [1,1,0,0,0,0|1,0,1]=4 548 B7R0.14 O=CC(=O)C(C)(C)C 1P00DGS3 [1,1,0,0,0,0|1,0,1]=4 549 B7R0.14 O=CC(C(C)(C)C)C 1P001ZWI [1,1,0,0,0,0|1,0,0]=3 550 B7R0.13 BrCC(C(=O)N)(C)C 1P01F42I [0,1,0,0,1,0|2,0,0]=4 551 B7R0.13 BrCC(C(=O)O)(C)C 1P00I5SQ [0,1,0,0,1,0|1,0,1]=4 552 B7R0.13 CCC(C(=O)C)(C)C 1P002J2S [0,1,0,0,1,0|2,0,0]=4 553 B7R0.13 CCC(C(=O)Cl)(C)C 1P003BJY [0,1,0,0,1,0|2,0,0]=4 554 B7R0.13 CCC(C(=O)N)(C)C 1P0006RV [0,1,0,0,1,0|2,0,0]=4 555 B7R0.13 CCC(C(=O)O)(C)C 1P003FSB [0,1,0,0,1,0|1,0,1]=4 556 B7R0.13 CNC(C(=O)N)(C)C 1P01BBOR [0,1,0,0,1,0|2,0,0]=4 557 B7R0.13 CNC(C(=O)N)(C)C 1P01BCN5 [0,1,0,0,1,0|2,0,0]=4 558 B7R0.13 CNC(C(=O)O)(C)C 1P0017L1 [0,1,0,0,1,0|1,0,1]=4 559 B7R0.13 CNC(C(=O)O)(C)C 1P003TM2 [0,1,0,0,1,0|1,0,1]=4 560 B7R0.13 COC(C(=O)C)(C)C 1P00CS4C [0,1,0,0,1,0|2,0,0]=4 561 B7R0.13 COC(C(=O)N)(C)C 1P008K10 [0,1,0,0,1,0|2,0,0]=4 562 B7R0.13 COC(C(=O)O)(C)C 1P00194A [0,1,0,0,1,0|1,0,1]=4 563 B7R0.13 CSC(C(=O)O)(C)C 1P01B62J [0,1,0,0,1,0|1,0,1]=4 564 B7R0.13 ClCC(C(=O)C)(C)C 1P01C2Z1 [0,1,0,0,1,0|2,0,0]=4 565 B7R0.13 ClCC(C(=O)O)(C)C 1P003441 [0,1,0,0,1,0|1,0,1]=4 566 B7R0.13 FCC(C(=O)O)(C)C 1P0037D5 [0,1,0,0,1,0|1,0,1]=4 567 B7R0.13 NCC(C(=O)N)(C)C 1P003JAS [0,1,0,0,1,0|2,0,0]=4 568 B7R0.13 NCC(C(=O)O)(C)C 1P002EZ9 [0,1,0,0,1,0|1,0,1]=4 569 B7R0.13 NCC(C(=O)O)(C)C 1P003JAT [0,1,0,0,1,0|1,0,1]=4 570 B7R0.13 OCC(C(=O)C)(C)C 1P00AXPU [0,1,0,0,1,0|2,0,0]=4 571 B7R0.13 OCC(C(=O)O)(C)C 1P003K1K [0,1,0,0,1,0|1,0,1]=4 572 B7R0.13 OCC([N+](=O)[O-])(C)C 1P005CSN [0,1,0,0,1,0|2,0,0]=4 573 B9R0.10 CC(=O)CC(=O)C(C)(C)C 1P003FS1 [0,1,0,0,0,1|2,0,0]=4 574 B9R0.10 CC(C(C)(C)C)CC(=O)O 1P005EAO [0,1,0,0,0,1|1,0,1]=4 575 B9R0.10 NC(C(C)(C)C)CC(=O)O 1P0029SO [0,1,0,0,0,1|1,0,1]=4 576 B9R0.10 N[C@@H](C(C)(C)C)CC(=O)O 1P00398I [0,1,0,0,0,1|1,0,1]=4 577 B9R0.10 N[C@@H](C(C)(C)C)CC(=O)O 1P01FIWX [0,1,0,0,0,1|1,0,1]=4 578 B9R0.10 N[C@H](C(C)(C)C)CC(=O)O 1P0037RQ [0,1,0,0,0,1|1,0,1]=4 579 B9R0.10 O=C(C(C)(C)C)C[N+](=O)[O-] 1P01C35Z [0,1,0,0,0,1|2,0,0]=4 580 B9R0.10 O[C@@H](C(C)(C)C)CC(=O)O 1P004KC6 [0,1,0,0,0,1|1,0,1]=4 581 B9R0.10 O[C@H](C(C)(C)C)CC(=O)O 1P028MFQ [0,1,0,0,0,1|1,0,1]=4 582 B9R0.21 BrCC(=O)NCC(C)(C)C 1P01DVQQ [0,1,0,0,0,1|2,0,0]=4 583 B9R0.21 BrCC(=O)OCC(C)(C)C 1P0003XS [0,1,0,0,0,1|2,0,0]=4 584 B9R0.21 CCC(=O)COC(C)(C)C 1P0290GY [0,1,0,0,0,1|2,0,0]=4 585 B9R0.21 COC(=O)CNC(C)(C)C 1P019XUT [0,1,0,0,0,1|1,0,1]=4 586 B9R0.21 COC(=O)COC(C)(C)C 1P01AD20 [0,1,0,0,0,1|1,0,1]=4 587 B9R0.21 COC(=O)CSC(C)(C)C 1P00DLOI [0,1,0,0,0,1|1,0,1]=4 588 B9R0.21 ClCC(=O)NCC(C)(C)C 1P01BY8A [0,1,0,0,0,1|2,0,0]=4 589 B9R0.21 FCC(=O)COC(C)(C)C 1P028J51 [0,1,0,0,0,1|2,0,0]=4 590 B9R0.57 CC(C(=O)O)CC(C)(C)C 1P01ADOK [0,1,0,0,0,1|1,0,1]=4 591 B9R0.57 CC(C(=O)O)NC(C)(C)C 1P023JD4 [0,1,0,0,0,1|1,0,1]=4 592 B9R0.57 CC(C(=O)O)OC(C)(C)C 1P01ZYQ1 [0,1,0,0,0,1|1,0,1]=4 593 B9R0.57 CC(C(=O)[O-])CC(O)(C)C 1P028BG7 [0,1,0,0,0,1|2,0,0]=4 594 B9R0.57 CN(C(=O)Cl)CC(C)(C)C 1P01B9MO [0,1,0,0,0,1|2,0,0]=4 595 B9R0.57 C[C@@H](C(=O)O)OC(C)(C)C 1P028YEC [0,1,0,0,0,1|1,0,1]=4 596 B9R0.57 C[C@H](C(=O)O)OC(C)(C)C 1P028YR9 [0,1,0,0,0,1|1,0,1]=4 597 B9R0.57 FC(C(=O)O)CC(C)(C)C 1P027UGQ [0,1,0,0,0,1|1,0,1]=4 598 B9R0.57 NC(C(=O)O)CC(C)(C)C 1P00E9L2 [0,1,0,0,0,1|1,0,1]=4 599 B9R0.57 NC(C(=O)O)CC(C)(C)C 1P01A2A3 [0,1,0,0,0,1|1,0,1]=4 600 B9R0.57 NC(C(=O)O)C[Si](C)(C)C 1P028409 [0,1,0,0,0,1|1,0,1]=4 601 B9R0.57 NC(C(=O)[O-])CC(O)(C)C 1P01AGGU [0,1,0,0,0,1|2,0,0]=4 602 B9R0.57 N[C@@H](C(=O)O)CC(C)(C)C 1P0032VI [0,1,0,0,0,1|1,0,1]=4 603 B9R0.57 N[C@H](C(=O)O)CC(C)(C)C 1P003D1J [0,1,0,0,0,1|1,0,1]=4 604 B9R0.57 N[C@H](C(=O)O)CC(C)(C)C 1P0286IT [0,1,0,0,0,1|1,0,1]=4 605 B9R0.57 O=C(C(=O)O)CC(C)(C)C 1P00C035 [0,1,0,0,0,1|1,0,1]=4 606 B9R0.57 O=C(O)[C@@H](N)C[Si](C)(C)C 1P01KHLD [0,1,0,0,0,1|1,0,1]=4 607 B9R0.57 OC(C(=O)O)CC(C)(C)C 1P006TTC [0,1,0,0,0,1|1,0,1]=4 608 B9R0.64 BrCC(CCC(=O)O)(C)C 1P0281H6 [0,1,0,0,0,1|1,0,1]=4 609 B9R0.64 CCC(OCC(=O)O)(C)C 1P01C2OG [0,1,0,0,0,1|1,0,1]=4 610 B9R0.64 COC(CCC(=O)O)(C)C 1P0288Q5 [0,1,0,0,0,1|1,0,1]=4 611 B9R0.64 NCC(OCC(=O)O)(C)C 1P02819L [0,1,0,0,0,1|1,0,1]=4 612 B9R0.64 OCC(CCC(=O)[O-])(C)C 1P028FHB [0,1,0,0,0,1|1,0,0]=3 613 B9R0.22 COC(=O)CC(CC)(C)C 1P008U6C [0,2,0,0,0,0|1,0,1]=4 614 B9R0.22 COC(=O)CC(NC)(C)C 1P01A2DN [0,2,0,0,0,0|1,0,1]=4 615 B9R0.22 COC(=O)CC(OC)(C)C 1P01I2YI [0,2,0,0,0,0|1,0,1]=4 616 B9R0.22 NCC(CC(=O)OC)(C)C 1P01E93B [0,2,0,0,0,0|1,0,1]=4 617 B9R0.25 CNC(=O)C(C(C)(C)C)N 1P028TPY [0,2,0,0,0,0|2,0,0]=4 618 B9R0.25 CNC(=O)[C@@H](C(C)(C)C)N 1P02900Z [0,2,0,0,0,0|2,0,0]=4 619 B9R0.25 CNC(=O)[C@H](C(C)(C)C)N 1P003RU5 [0,2,0,0,0,0|2,0,0]=4 620 B9R0.25 CNC(=O)[C@H](C(C)(C)C)N 1P0289BF [0,2,0,0,0,0|2,0,0]=4 621 B9R0.25 COC(=O)C(C(C)(C)C)Br 1P001VND [0,2,0,0,0,0|1,0,1]=4 622 B9R0.25 COC(=O)C(C(C)(C)C)N 1P00BPK5 [0,2,0,0,0,0|1,0,1]=4 623 B9R0.25 COC(=O)C(C(C)(C)C)N 1P00CJTW [0,2,0,0,0,0|1,0,1]=4 624 B9R0.25 COC(=O)C(C(C)(C)C)O 1P01A6C8 [0,2,0,0,0,0|1,0,1]=4 625 B9R0.25 COC(=O)[C@@H](C(C)(C)C)N 1P001XOG [0,2,0,0,0,0|1,0,1]=4 626 B9R0.25 COC(=O)[C@@H](C(C)(C)C)O 1P02939S [0,2,0,0,0,0|1,0,1]=4 627 B9R0.25 COC(=O)[C@H](C(C)(C)C)N 1P00EEKY [0,2,0,0,0,0|1,0,1]=4 628 B9R0.25 COC(=O)[C@H](C(C)(C)C)N 1P00IBLG [0,2,0,0,0,0|1,0,1]=4 629 B9R0.44 CCOC(=O)CC(C)(C)C 1P003QXN [0,2,0,0,0,0|1,0,1]=4 630 B9R0.44 CCOC(=O)C[Si](C)(C)C 1P00BYPL [0,2,0,0,0,0|1,0,1]=4 631 B9R0.44 COCC(=O)CC(C)(C)C 1P01C4BF [0,2,0,0,0,0|1,0,1]=4 632 B9R0.44 ClCOC(=O)CC(C)(C)C 1P000FGX [0,2,0,0,0,0|1,0,1]=4 633 B9R0.44 N#CCC(=O)CC(C)(C)C 1P019X1N [0,2,0,0,0,0|2,0,0]=4 634 B9R0.44 O=C=NC(=O)CC(C)(C)C 1P019KSI [0,2,0,0,0,0|1,0,1]=4 635 B9R0.32 CCC(C(C(=O)O)O)(C)C 1P01B2XZ [0,2,0,0,0,0|1,0,1]=4 636 B9R0.32 CCC([C@@H](C(=O)O)N)(C)C 1P007ZOD [0,2,0,0,0,0|1,0,1]=4 637 B9R0.32 COC(C(C(=O)O)Br)(C)C 1P003H3M [0,2,0,0,0,0|1,0,1]=4 638 B9R0.32 CSC([C@H](C(=O)O)N)(C)C 1P00C3HZ [0,2,0,0,0,0|1,0,1]=4 639 B9R0.32 OCC(C(=O)C(=O)[O-])(C)C 1P02026O [0,2,0,0,0,0|1,0,1]=4 640 B9R0.32 OCC([C@H](C(=O)O)O)(C)C 1P0092CI [0,2,0,0,0,0|1,0,1]=4 641 B9R0.32 OCC([C@H](C(=O)[O-])O)(C)C 1P00EF72 [0,2,0,0,0,0|1,0,0]=3 642 B9R0.72 COC(C(C)(C)C)C(=O)O 1P01JMJM [0,2,0,0,0,0|1,0,1]=4 643 B9R0.72 CSC(C(C)(C)C)C(=O)O 1P01A6VG [0,2,0,0,0,0|1,0,1]=4 644 B9R0.72 N#CC(C(C)(C)C)C(=O)O 1P02903W [0,2,0,0,0,0|1,0,1]=4 645 B9R0.72 NCC(C(C)(C)C)C(=O)O 1P01JN2Z [0,2,0,0,0,0|1,0,1]=4 646 B9R0.72 OCC(C(C)(C)C)C(=O)O 1P01AD5V [0,2,0,0,0,0|1,0,1]=4 647 B9R0.80 OC(=O)C(C(C)(C)C)(C)C 1P0030I4 [0,2,0,0,0,0|1,0,1]=4 648 B9R0.80 OC(=O)C(C(C)(C)C)(N)C 1P00IFY9 [0,2,0,0,0,0|1,0,1]=4 649 B9R0.80 OC(=O)C(C(C)(C)C)(O)C 1P01DWVD [0,2,0,0,0,0|1,0,1]=4 650 B9R0.11 CC(C(CC(=O)O)(C)C)N 1P0287TU [0,2,0,0,0,0|1,0,1]=4 651 B9R0.11 CN(C(CC(=O)O)(C)C)C 1P0291U7 [0,2,0,0,0,0|1,0,1]=4 652 B9R0.11 FC(C(CC(=O)O)(C)C)F 1P01BGYR [0,2,0,0,0,0|1,0,1]=4 653 B9R0.11 OC(=O)CC(C(=O)C)(C)C 1P002NSR [0,2,0,0,0,0|1,0,1]=4 654 B9R0.58 C=CCC(CC(=O)O)(C)C 1P01DX4K [0,2,0,0,0,0|1,0,1]=4 655 B9R0.58 CCCC(CC(=O)O)(C)C 1P006AU5 [0,2,0,0,0,0|1,0,1]=4 656 B9R0.58 COCC(CC(=O)O)(C)C 1P01ANOP [0,2,0,0,0,0|1,0,1]=4 657 B9R0.63 NCC(CC(=O)O)(CO)C 1P00VW4W [0,2,0,0,0,0|1,0,1]=4 658 B7R1.2 CC1CC(=O)NC1 1P0039AR [1,0,0,1,0,0|2,0,0]=4 659 B7R1.2 CC1CC(=O)OC1 1P00ARBT [1,0,0,1,0,0|1,0,1]=4 660 B7R1.2 CC1CCC(=O)C1 1P0021LM [1,0,0,1,0,0|2,0,0]=4 661 B7R1.2 CN1CCC(=O)C1 1P00G7GN [1,0,0,1,0,0|1,0,1]=4 662 B7R1.2 CN1CCC(=O)C1 1P00IC9G [1,0,0,1,0,0|1,0,1]=4 663 B7R1.2 C[C@@H]1CC(=O)NC1 1P002RUA [1,0,0,1,0,0|2,0,0]=4 664 B7R1.2 C[C@@H]1CCC(=O)C1 1P003CMA [1,0,0,1,0,0|2,0,0]=4 665 B7R1.2 C[C@H]1CC(=O)NC1 1P00I6FM [1,0,0,1,0,0|2,0,0]=4 666 B7R1.2 C[C@H]1CC(=O)OC1 1P00EB7B [1,0,0,1,0,0|1,0,1]=4 667 B7R1.2 C[C@H]1CCC(=O)C1 1P00H79H [1,0,0,1,0,0|2,0,0]=4 668 B7R1.12 CC1CC1C(=O)C 1P01ALPC [1,0,0,1,0,0|2,0,0]=4 669 B7R1.12 CC1CC1C(=O)Cl 1P00EII7 [1,0,0,1,0,0|2,0,0]=4 670 B7R1.12 CC1CC1C(=O)N 1P00GA8W [1,0,0,1,0,0|2,0,0]=4 671 B7R1.12 CC1CC1C(=O)O 1P002Z71 [1,0,0,1,0,0|1,0,1]=4 672 B7R1.12 CC1CC1C(=O)O 1P00EK9C [1,0,0,1,0,0|1,0,1]=4 673 B7R1.12 C[C@@H]1C[C@@H]1C(=O)C 1P028NP2 [1,0,0,1,0,0|2,0,0]=4 674 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O 1P00BJDC [1,0,0,1,0,0|1,0,1]=4 675 B7R1.12 C[C@@H]1C[C@H]1C(=O)C 1P028MO8 [1,0,0,1,0,0|2,0,0]=4 676 B7R1.12 C[C@@H]1C[C@H]1C(=O)O 1P00ELZP [1,0,0,1,0,0|1,0,1]=4 677 B7R1.12 C[C@H]1C[C@@H]1C(=O)C 1P028O3I [1,0,0,1,0,0|2,0,0]=4 678 B7R1.12 C[C@H]1C[C@@H]1C(=O)O 1P00ARLC [1,0,0,1,0,0|1,0,1]=4 679 B7R1.12 C[C@H]1C[C@H]1C(=O)C 1P028FLW [1,0,0,1,0,0|2,0,0]=4 680 B7R1.12 C[C@H]1C[C@H]1C(=O)O 1P002ZI0 [1,0,0,1,0,0|1,0,1]=4 681 B7R1.16 O=C1CC(C1)(C)C 1P000ITC [1,0,0,1,0,0|2,0,0]=4 682 B7R1.16 O=C1CC(N1)(C)C 1P00DP7Y [1,0,0,1,0,0|2,0,0]=4 683 B7R1.20 CC(=O)CC1CC1 1P0037WP [1,0,0,1,0,0|2,0,0]=4 684 B7R1.20 ClC(=O)CC1CC1 1P00DCW4 [1,0,0,1,0,0|2,0,0]=4 685 B7R1.20 NC(=O)CC1CC1 1P0086XZ [1,0,0,1,0,0|2,0,0]=4 686 B7R1.20 OC(=O)CC1CC1 1P00395B [1,0,0,1,0,0|1,0,1]=4 687 B7R1.20 [O-]S(=O)CC1CC1 1P01C8RA [1,0,0,1,0,0|2,0,0]=4 688 B7R1.20 [O-][N+](=O)CC1CC1 1P028ITG [1,0,0,1,0,0|2,0,0]=4 689 B7R1.14 C[Si]1(C)CC=CC1 1P001SHS [1,0,0,1,0,0|2,0,0]=4 690 B7R1.23 CC1(Br)CC1C=O 1P01BW75 [1,0,0,1,0,0|2,0,0]=4 691 B7R1.23 O=CC1CC1(C)C 1P002S7I [1,0,0,1,0,0|1,0,0]=3 692 B7R1.23 O=CC1OC1(C)C 1P01B68F [1,0,0,1,0,0|2,0,0]=4 693 B7R1.23 O=C[C@H]1CC1(C)C 1P01C9FL [1,0,0,1,0,0|1,0,0]=3 694 B7R1.17 O=C1CCC1(C)C 1P000PMW [0,0,0,1,1,0|2,0,0]=4 695 B7R1.17 O=C1NCC1(C)C 1P005SY2 [0,0,0,1,1,0|2,0,0]=4 696 B7R1.17 O=C1OCC1(C)C 1P00AEIM [0,0,0,1,1,0|1,0,1]=4 697 B7R1.19 CC(=O)C1(C)CC1 1P001PDI [0,0,0,1,1,0|2,0,0]=4 698 B7R1.19 ClC(=O)C1(C)CC1 1P0038FK [0,0,0,1,1,0|2,0,0]=4 699 B7R1.19 NC(=O)C1(C)CC1 1P001QXO [0,0,0,1,1,0|2,0,0]=4 700 B7R1.19 OC(=O)C1(C)CC1 1P003793 [0,0,0,1,1,0|1,0,1]=4 701 B9R1.10 O=C1CCC(CC1)(C)C 1P00C0Q5 [0,0,0,1,0,1|2,0,0]=4 702 B9R1.10 O=C1CCC(CN1)(C)C 1P00I8BC [0,0,0,1,0,1|2,0,0]=4 703 B9R1.10 O=C1CC[N+](CC1)(C)C 1P007N2V [0,0,0,1,0,1|1,0,0]=3 704 B9R1.10 O=C1CNC(CN1)(C)C 1P00IDEZ [0,0,0,1,0,1|2,0,0]=4 705 B9R1.10 O=C1COC(CN1)(C)C 1P00HSV4 [0,0,0,1,0,1|2,0,0]=4 706 B9R1.10 O=C1OCC(CO1)(C)C 1P0034ML [0,0,0,1,0,1|1,0,1]=4 707 B9R1.51 CC(C1=CC(=O)C1)(C)C 1P027UFW [0,0,0,1,0,1|2,0,0]=4 708 B9R1.51 CC(C1CC(=O)C1)(C)C 1P00ILN8 [0,0,0,1,0,1|2,0,0]=4 709 B9R1.51 O=C1CC(C1)[Si](C)(C)C 1P01IOIX [0,0,0,1,0,1|2,0,0]=4 710 B9R1.147 OC(=O)CCC1(C)CC1 1P004JGG [0,0,0,1,0,1|1,0,1]=4 711 B9R1.147 OC(=O)COC1(C)CC1 1P028MOQ [0,0,0,1,0,1|1,0,1]=4 712 B9R1.164 CC(=O)C1CC(C1)(C)C 1P018I1Z [0,0,0,1,0,1|2,0,0]=4 713 B9R1.164 NC(=O)N1CC(C1)(C)C 1P028LT1 [0,0,0,1,0,1|2,0,0]=4 714 B9R1.164 OC(=O)C1CC(C1)(C)C 1P0038ID [0,0,0,1,0,1|1,0,1]=4 715 B9R1.164 [O-]C(=O)C1CC(O1)(C)C 1P028HDI [0,0,0,1,0,1|1,0,0]=3 716 B9R1.36 O=C1CC(CC1C)(C)C 1P003G21 [0,1,0,1,0,0|2,0,0]=4 717 B9R1.36 O=C1CC(CC1O)(C)C 1P027XD4 [0,1,0,1,0,0|1,0,1]=4 718 B9R1.66 O=C1CCCC(C1)(C)C 1P0032R4 [0,1,0,1,0,0|2,0,0]=4 719 B9R1.66 O=C1CCNC(C1)(C)C 1P000UTI [0,1,0,1,0,0|2,0,0]=4 720 B9R1.66 O=C1CCOC(C1)(C)C 1P000J5L [0,1,0,1,0,0|2,0,0]=4 721 B9R1.66 O=C1COCC(C1)(C)C 1P008274 [0,1,0,1,0,0|1,0,1]=4 722 B9R1.66 O=C1NCCC(C1)(C)C 1P00E59D [0,1,0,1,0,0|2,0,0]=4 723 B9R1.68 CC(C1CCC1=O)(C)C 1P00E09F [0,1,0,1,0,0|2,0,0]=4 724 B9R1.113 ClCC(=O)CC1(C)CC1 1P028TLA [0,1,0,1,0,0|2,0,0]=4 725 B9R1.185 CCC(=O)C1CC1(C)C 1P00DDMQ [0,1,0,1,0,0|2,0,0]=4 726 B9R1.185 COC(=O)C1CC1(C)C 1P00IHYQ [0,1,0,1,0,0|1,0,1]=4 727 B9R1.185 ClCC(=O)C1CC1(C)C 1P028FZB [0,1,0,1,0,0|2,0,0]=4 728 B9R1.185 NNC(=O)C1CC1(C)C 1P00J2K4 [0,1,0,1,0,0|2,0,0]=4 729 B9R1.111 NC(C1(C)CC1)C(=O)O 1P00IL8U [0,1,0,1,0,0|1,0,1]=4 730 B9R1.138 NC1C(=O)NCC1(C)C 1P01B7N6 [0,1,0,1,0,0|2,0,0]=4 731 B9R1.138 NC1C(=O)OCC1(C)C 1P01BBED [0,1,0,1,0,0|1,0,1]=4 732 B9R1.138 N[C@@H]1C(=O)OCC1(C)C 1P01DW10 [0,1,0,1,0,0|1,0,1]=4 733 B9R1.138 N[C@H]1C(=O)OCC1(C)C 1P01EIIY [0,1,0,1,0,0|1,0,1]=4 734 B9R1.138 OC1C(=O)NCC1(C)C 1P0065JS [0,1,0,1,0,0|2,0,0]=4 735 B9R1.138 OC1C(=O)OCC1(C)C 1P00IDG4 [0,1,0,1,0,0|1,0,1]=4 736 B9R1.138 O[C@@H]1C(=O)OCC1(C)C 1P003D2N [0,1,0,1,0,0|1,0,1]=4 737 B9R1.138 O[C@H]1C(=O)OCC1(C)C 1P003554 [0,1,0,1,0,0|1,0,1]=4 738 B9R1.166 OC(=O)C1CCC1(C)C 1P01A2E9 [0,1,0,1,0,0|1,0,1]=4 739 B9R1.166 OC(=O)C1NCC1(C)C 1P01C0IV [0,1,0,1,0,0|1,0,1]=4 740 B9R1.166 OC(=O)C1OCC1(C)C 1P028PS1 [0,1,0,1,0,0|1,0,1]=4 741 B9R1.166 OC(=O)[C@@H]1NCC1(C)C 1P01JURD [0,1,0,1,0,0|1,0,1]=4 742 B9R1.166 OC(=O)[C@H]1NCC1(C)C 1P00ILKZ [0,1,0,1,0,0|1,0,1]=4 743 B9R1.169 OC(=O)C1(Br)CC1(C)C 1P028U3O [0,1,0,1,0,0|1,0,1]=4 744 B9R1.169 OC(=O)C1(C)CC1(C)C 1P029191 [0,1,0,1,0,0|1,0,1]=4 745 B9R1.169 OC(=O)C1(Cl)CC1(C)C 1P028WQS [0,1,0,1,0,0|1,0,1]=4 746 B9R1.169 OC(=O)C1(N)CC1(C)C 1P028LAI [0,1,0,1,0,0|1,0,1]=4 747 B9R1.169 OC(=O)C1(O)CC1(C)C 1P028OO3 [0,1,0,1,0,0|1,0,1]=4 748 B9R1.38 O=C1CN(C(C1)(C)C)C 1P01B7AT [0,1,0,1,0,0|2,0,0]=4 749 B9R1.38 O=C1NC(C(C1)(C)C)C 1P01DWPX [0,1,0,1,0,0|2,0,0]=4 750 B9R1.44 CC1(CC(=O)O)CC1F 1P01C5FL [0,1,0,1,0,0|1,0,1]=4 751 B9R1.125 BrCC1(C)CNC(=O)C1 1P01B5VB [0,1,0,1,0,0|2,0,0]=4 752 B9R1.125 CCC1(C)CNC(=O)C1 1P01BC1S [0,1,0,1,0,0|2,0,0]=4 753 B9R1.125 NCC1(C)COC(=O)C1 1P028BXR [0,1,0,1,0,0|1,0,1]=4 754 B9R1.125 OCC1(C)CNC(=O)C1 1P00VW4X [0,1,0,1,0,0|2,0,0]=4 755 B9R1.125 OCC1(C)COC(=O)C1 1P0291OR [0,1,0,1,0,0|1,0,1]=4 756 B9R1.127 CC1(CC)CC1C(=O)O 1P01A00M [0,1,0,1,0,0|1,0,1]=4 757 B9R1.128 COC1(CC1)CC(=O)O 1P01DW2M [0,1,0,1,0,0|1,0,1]=4 758 B9R1.128 NCC1(CC1)CC(=O)N 1P01C475 [0,1,0,1,0,0|2,0,0]=4 759 B9R1.128 NCC1(CC1)CC(=O)O 1P00J2SY [0,1,0,1,0,0|1,0,1]=4 760 B9R1.128 OCC1(CC1)CC(=O)O 1P004MAN [0,1,0,1,0,0|1,0,1]=4 761 B9R1.128 SCC1(CC1)CC(=O)O 1P001TOP [0,1,0,1,0,0|1,0,1]=4 762 B9R1.139 F[C@H]1[C@@H](C1(C)C)C(=O)O 1P027WEU [0,1,0,1,0,0|1,0,1]=4 763 B9R1.139 F[C@H]1[C@H](C1(C)C)C(=O)O 1P027YST [0,1,0,1,0,0|1,0,1]=4 764 B9R1.171 CC1(CC(=O)O)CCN1 1P028HDQ [0,1,0,1,0,0|1,0,1]=4 765 B9R1.171 OC(=O)CC1(C)CCC1 1P01FEY7 [0,1,0,1,0,0|1,0,1]=4 766 B9R1.171 [O-]C(=O)CC1(F)CCC1 1P028PHZ [0,1,0,1,0,0|2,0,0]=4 767 B9R2.139 O=C1CCC2(C1)CC2 1P01JUO6 [0,0,0,2,0,0|2,0,0]=4 768 B9R2.139 O=C1NCC2(C1)CC2 1P00I0A7 [0,0,0,2,0,0|2,0,0]=4 769 B9R2.139 O=C1OCC2(C1)CC2 1P00CLIQ [0,0,0,2,0,0|1,0,1]=4 770 B9R2.143 CC(=O)C1CC12CC2 1P00BQH3 [0,0,0,2,0,0|2,0,0]=4 771 B9R2.143 OC(=O)C1CC12CC2 1P00ABGH [0,0,0,2,0,0|1,0,1]=4 772 B9R2.40 O=C1CC[C@@]2([C@H]1C2)C 1P028UJL [0,0,0,2,0,0|2,0,0]=4 773 B5R0.5 CC(=C)C(=O)[O-] 1P0010CG [1,0,0,0,1,0|1,0,1]=4 774 B5R0.5 CC(=C)C(=O)[O-] 1P00111N [1,0,0,0,1,0|1,0,1]=4 775 B5R0.5 CC(=C)C(=O)[O-] 1P001Y9T [1,0,0,0,1,0|1,0,1]=4 776 B5R0.5 CC(=C)C(=O)[O-] 1P003UTP [1,0,0,0,1,0|1,0,1]=4 777 B5R0.5 CC(=C)C(=O)[O-] 1P005QHJ [1,0,0,0,1,0|1,0,1]=4 778 B5R0.5 CC(=C)C(=O)[O-] 1P005ZNF [1,0,0,0,1,0|1,0,1]=4 779 B5R0.5 CC(=O)C(=O)[O-] 1P002Y88 [1,0,0,0,1,0|2,0,0]=4 780 B5R0.5 CC(=O)C(=O)[O-] 1P003P54 [1,0,0,0,1,0|2,0,0]=4 781 B5R0.5 CC(=O)C(=O)[O-] 1P003UJW [1,0,0,0,1,0|2,0,0]=4 782 B5R0.5 CC(=O)C(C)C 1P0037OJ [1,0,0,0,1,0|2,0,0]=4 783 B5R0.5 CC(=O)N(C)C 1P000WZ3 [1,0,0,0,1,0|1,0,1]=4 784 B5R0.5 CC(=O)[NH+](C)C 1P003OS1 [1,0,0,0,1,0|1,0,0]=3 785 B5R0.5 CC(C(=O)Br)C 1P003RK5 [1,0,0,0,1,0|2,0,0]=4 786 B5R0.5 CC(C(=O)Cl)C 1P003RK6 [1,0,0,0,1,0|2,0,0]=4 787 B5R0.5 CC(C(=O)N)C 1P003RJZ [1,0,0,0,1,0|2,0,0]=4 788 B5R0.5 CC(C(=O)O)C 1P003729 [1,0,0,0,1,0|1,0,1]=4 789 B5R0.5 CC(C(=O)O)C 1P01D9JB [1,0,0,0,1,0|1,0,1]=4 790 B5R0.5 CC(C(=O)S)C 1P00E3N5 [1,0,0,0,1,0|1,1,0]=4 791 B5R0.5 CC(C(=O)[O-])C 1P002R83 [1,0,0,0,1,0|1,0,0]=3 792 B5R0.5 CC(C(=O)[O-])C 1P003RK3 [1,0,0,0,1,0|1,0,0]=3 793 B5R0.5 CC(C(=O)[O-])O 1P001SCZ [1,0,0,0,1,0|2,0,0]=4 794 B5R0.5 CC(C(=O)[O-])O 1P002IGC [1,0,0,0,1,0|2,0,0]=4 795 B5R0.5 CC(C(=O)[O-])O 1P002IGD [1,0,0,0,1,0|2,0,0]=4 796 B5R0.5 CC(C(=O)[O-])O 1P003P4S [1,0,0,0,1,0|2,0,0]=4 797 B5R0.5 CC(C(=O)[O-])O 1P00IAYP [1,0,0,0,1,0|2,0,0]=4 798 B5R0.5 CC(C(=O)[O-])O 1P01KKX9 [1,0,0,0,1,0|2,0,0]=4 799 B5R0.5 CC(S(=O)[O-])C 1P00C6Z1 [1,0,0,0,1,0|2,0,0]=4 800 B5R0.5 CN(C(=O)Cl)C 1P003Q3S [1,0,0,0,1,0|1,0,1]=4 801 B5R0.5 CN(C(=O)N)C 1P0032OO [1,0,0,0,1,0|1,0,1]=4 802 B5R0.5 CN(C(=O)O)C 1P003Q0Z [1,0,0,0,1,0|0,0,2]=4 803 B5R0.5 [O-]C(=O)C(O)C 1P005SQF [1,0,0,0,1,0|2,0,0]=4 804 B5R0.5 [O-]C(=O)C(O)C 1P0069SJ [1,0,0,0,1,0|2,0,0]=4 805 B5R0.5 [O-]C(=O)C(O)C 1P008FOG [1,0,0,0,1,0|2,0,0]=4 806 B5R0.5 [O-]C(=O)[C@@H](O)C 1P002VDW [1,0,0,0,1,0|2,0,0]=4 807 B5R0.5 [O-]C(=O)[C@@H](O)C 1P004KNK [1,0,0,0,1,0|2,0,0]=4 808 B5R0.5 [O-]C(=O)[C@@H](O)C 1P00IM0T [1,0,0,0,1,0|2,0,0]=4 809 B5R0.5 [O-]C(=O)[C@H](F)C 1P02809N [1,0,0,0,1,0|2,0,0]=4 810 B5R0.5 [O-]C(=O)[C@H](O)C 1P002VDV [1,0,0,0,1,0|2,0,0]=4 811 B5R0.5 [O-]C(=O)[C@H](O)C 1P003USZ [1,0,0,0,1,0|2,0,0]=4 812 B7R0.6 CC(=O)COC(C)C 1P0071XC [1,0,0,0,0,1|2,0,0]=4 813 B7R0.6 CC(CCC(=O)C)C 1P003NBT [1,0,0,0,0,1|2,0,0]=4 814 B7R0.6 CC(CCC(=O)Cl)C 1P003M9S [1,0,0,0,0,1|2,0,0]=4 815 B7R0.6 CC(CCC(=O)N)C 1P007DVM [1,0,0,0,0,1|2,0,0]=4 816 B7R0.6 CC(CCC(=O)O)C 1P003M9R [1,0,0,0,0,1|1,0,1]=4 817 B7R0.6 CC(CCC(=O)[O-])O 1P003BDK [1,0,0,0,0,1|2,0,0]=4 818 B7R0.6 CC(CC[N+](=O)[O-])C 1P00F3IP [1,0,0,0,0,1|2,0,0]=4 819 B7R0.6 CC(CNC(=O)N)C 1P003RJM [1,0,0,0,0,1|2,0,0]=4 820 B7R0.6 CC(NCC(=O)C)C 1P01ANL3 [1,0,0,0,0,1|2,0,0]=4 821 B7R0.6 CC(NCC(=O)N)C 1P00G7RH [1,0,0,0,0,1|2,0,0]=4 822 B7R0.6 CC(NCC(=O)N)C 1P019JUE [1,0,0,0,0,1|2,0,0]=4 823 B7R0.6 CC(NCC(=O)O)C 1P00C901 [1,0,0,0,0,1|1,0,1]=4 824 B7R0.6 CC(NCC(=O)O)C 1P019MFH [1,0,0,0,0,1|1,0,1]=4 825 B7R0.6 CC(OCC(=O)Cl)C 1P01E7J0 [1,0,0,0,0,1|2,0,0]=4 826 B7R0.6 CC(OCC(=O)O)C 1P007FU5 [1,0,0,0,0,1|1,0,1]=4 827 B7R0.6 CC(SCC(=O)O)C 1P006WX6 [1,0,0,0,0,1|1,0,1]=4 828 B7R0.6 CN(CCC(=O)C)C 1P00C2GG [1,0,0,0,0,1|1,0,1]=4 829 B7R0.6 CN(CCC(=O)C)C 1P00J3Y6 [1,0,0,0,0,1|1,0,1]=4 830 B7R0.6 CN(CCC(=O)Cl)C 1P00GYU2 [1,0,0,0,0,1|1,0,1]=4 831 B7R0.6 CN(CCC(=O)N)C 1P002DMK [1,0,0,0,0,1|1,0,1]=4 832 B7R0.6 CN(CCC(=O)O)C 1P001FQ6 [1,0,0,0,0,1|0,0,2]=4 833 B7R0.6 CN(CCC(=O)O)C 1P00E97T [1,0,0,0,0,1|0,0,2]=4 834 B7R0.6 C[S+](CCC(=O)O)C 1P002KXE [1,0,0,0,0,1|1,0,1]=4 835 B7R0.6 C[S+](CCC(=O)O)C 1P003C35 [1,0,0,0,0,1|1,0,1]=4 836 B7R0.6 C[S+](CCC(=O)[O-])C 1P003Q49 [1,0,0,0,0,1|1,0,0]=3 837 B7R0.6 OC(=O)CC=C(C)C 1P00389R [1,0,0,0,0,1|1,0,1]=4 838 B7R0.6 [O-]C(=O)CCC(=O)C 1P002C2S [1,0,0,0,0,1|2,0,0]=4 839 B7R0.6 [O-]C(=O)CCC(=O)C 1P003P4T [1,0,0,0,0,1|2,0,0]=4 840 B7R0.6 [O-]C(=O)CCC(=O)C 1P00IMYY [1,0,0,0,0,1|2,0,0]=4 841 B9R0.56 CC(=O)OCC[N+](C)(C)C 1P006P51 [0,0,0,0,0,2|1,0,0]=3 842 B9R0.56 CC(=O)OCC[N+](C)(C)C 1P00BCV3 [0,0,0,0,0,2|1,0,0]=3 843 B9R0.56 CC(=O)OCC[N+](C)(C)C 1P00E92J [0,0,0,0,0,2|1,0,0]=3 844 B9R0.56 CC(=O)SCC[N+](C)(C)C 1P00E9Y1 [0,0,0,0,0,2|1,0,0]=3 845 B9R0.56 CC(=O)SCC[N+](C)(C)C 1P00I2AL [0,0,0,0,0,2|1,0,0]=3 846 B9R0.56 ClC(=O)OCC[Si](C)(C)C 1P002E00 [0,0,0,0,0,2|2,0,0]=4 847 B9R0.56 NC(=O)CCNC(C)(C)C 1P01A0I8 [0,0,0,0,0,2|2,0,0]=4 848 B9R0.56 NC(=O)OCC[N+](C)(C)C 1P00DELC [0,0,0,0,0,2|1,0,0]=3 849 B9R0.56 NC(=[NH2+])NCC[N+](C)(C)C 1P01EZK1 [0,0,0,0,0,2|2,0,0]=4 850 B9R0.56 OC(=O)C#CCC(C)(C)C 1P01C47S [0,0,0,0,0,2|1,0,1]=4 851 B9R0.56 OC(=O)CC#C[Si](C)(C)C 1P01BHTI [0,0,0,0,0,2|1,0,1]=4 852 B9R0.56 OC(=O)CCCC(C)(C)C 1P002OSG [0,0,0,0,0,2|1,0,1]=4 853 B9R0.56 OC(=O)CCC[N+](C)(C)C 1P00EEZK [0,0,0,0,0,2|0,0,1]=3 854 B9R0.56 OC(=O)CCC[Si](C)(C)C 1P00BVS7 [0,0,0,0,0,2|1,0,1]=4 855 B9R0.56 OC(=O)CCNC(C)(C)C 1P019L1G [0,0,0,0,0,2|1,0,1]=4 856 B9R0.56 OC(=O)CCN[N+](C)(C)C 1P00IKXR [0,0,0,0,0,2|0,0,1]=3 857 B9R0.56 OC(=O)CNCC(C)(C)C 1P01B6TR [0,0,0,0,0,2|1,0,1]=4 858 B9R0.56 OC(=O)COCC(C)(C)C 1P028VIS [0,0,0,0,0,2|1,0,1]=4 859 B9R0.56 OC(=O)C\C=C\C(C)(C)C 1P0284ED [0,0,0,0,0,2|1,0,1]=4 860 B9R0.56 [O-]C(=O)CCCC(O)(C)C 1P01BBKM [0,0,0,0,0,2|2,0,0]=4 861 B9R0.56 [O-]C(=O)CCN[N+](C)(C)C 1P00GTSJ [0,0,0,0,0,2|0,0,0]=2