0 B8R0.5 CC(Br)CC(OCC)=O PI-40060 [0,0,0,0,0,0|1,0,0]=1 1 B8R0.5 CC(C)OC(=O)CC#N PI-32783 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.5 CCOC(=O)C=C(C)N PI-42740 [0,0,0,0,0,0|1,0,2]=3 3 B8R0.5 CCOC(=O)CC(=O)Cl PI-39034 [0,0,0,0,0,0|2,0,1]=3 4 B8R0.5 CCOC(=O)CC(=O)N PI-18885 [0,0,0,0,0,0|2,0,1]=3 5 B8R0.5 CCOC(=O)CC(=O)O PI-15251 [0,0,0,0,0,0|2,0,1]=3 6 B8R0.5 CCOC(=O)CC(C)O PI-12942 [0,0,0,0,0,0|1,0,0]=1 7 B8R0.5 CCOC(=O)CN(C)C PI-15686 [0,0,0,0,0,0|1,0,0]=1 8 B8R0.5 CCOC(=O)NC(=O)N PI-47058 [0,0,0,0,0,0|3,0,1]=4 9 B8R0.5 CCOC(=O)OC(C)Cl PI-13414 [0,0,0,0,0,0|2,0,0]=2 10 B8R0.5 CCOC(=O)\C=C(\C)/N PI-11270 [0,0,0,0,0,0|1,0,2]=3 11 B8R0.5 C[C@H](O)CC(OCC)=O PI-37307 [0,0,0,0,0,0|1,0,0]=1 12 B8R0.5 ClCOC(=O)OC(C)C PI-24348 [0,0,0,0,0,0|2,0,0]=2 13 B8R0.5 O=C([O-])CC(OCC)=O PI-18759 [0,0,0,0,0,0|2,0,1]=3 14 B8R0.5 [O-][N+](=O)CC(=O)OCC PI-22110 [0,0,0,0,0,0|3,0,0]=3 15 B7R0.2 CC(=CC(=O)OC)C PI-13263 [1,0,0,0,0,0|0,0,2]=3 16 B7R0.2 CC(=CC(=O)OC)N PI-13659 [1,0,0,0,0,0|1,0,2]=4 17 B7R0.2 CC(C)CC(CO)N PI-35868 [1,0,0,0,0,0|2,0,1]=4 18 B7R0.2 CC(C)NC(=O)NN PI-50450 [1,0,0,0,0,0|3,0,0]=4 19 B7R0.2 CC(C)OC(=O)CO PI-35449 [1,0,0,0,0,0|2,0,0]=3 20 B7R0.2 CC(CC(=O)OC)N PI-42254 [1,0,0,0,0,0|1,0,0]=2 21 B7R0.2 CC(CC(=O)OC)O PI-42249 [1,0,0,0,0,0|1,0,0]=2 22 B7R0.2 CC(CC(=O)OC)O PI-42250 [1,0,0,0,0,0|1,0,0]=2 23 B7R0.2 CC(OC(=O)OC)Cl PI-49210 [1,0,0,0,0,0|2,0,0]=3 24 B7R0.2 CN(C)CC(=O)NN PI-50370 [1,0,0,0,0,0|3,0,0]=4 25 B7R0.2 COC(=O)CC(C)N PI-42155 [1,0,0,0,0,0|1,0,0]=2 26 B7R0.2 COC(=O)C[N+](=O)[O-] PI-40485 [1,0,0,0,0,0|3,0,0]=4 27 B7R0.2 C[C@@H](N)CC(OC)=O PI-42154 [1,0,0,0,0,0|1,0,0]=2 28 B7R0.2 C[C@H](N)CC(OC)=O PI-42253 [1,0,0,0,0,0|1,0,0]=2 29 B7R0.2 NC(C)CC(C)CC PI-36995 [1,0,0,0,0,0|2,0,1]=4 30 B7R0.2 O=C(OC(C)C)CN PI-46621 [1,0,0,0,0,0|2,0,0]=3 31 B7R0.2 O=C([O-])CC(OC)=O PI-18514 [1,0,0,0,0,0|2,0,1]=4 32 B7R0.2 OC[C@@H](CC(C)C)N PI-35776 [1,0,0,0,0,0|2,0,1]=4 33 B7R0.4 CCCCC[C@@H](C)O PI-49829 [1,0,0,0,0,0|2,0,1]=4 34 B7R0.7 C(CCl)C(=O)CCCl PI-12892 [1,0,0,0,0,0|3,0,0]=4 35 B7R0.7 CCCC(=O)OCCl PI-36667 [1,0,0,0,0,0|1,0,0]=2 36 B7R0.7 CCCC(CCC)N PI-15988 [1,0,0,0,0,0|2,0,1]=4 37 B7R0.7 CCOC(=O)C#CC PI-22064 [1,0,0,0,0,0|0,0,2]=3 38 B7R0.7 CCOC(=O)COC PI-50353 [1,0,0,0,0,0|1,0,0]=2 39 B7R0.7 CCOC(=O)CSC PI-39857 [1,0,0,0,0,0|1,0,0]=2 40 B7R0.7 CCOC(=O)C[N+]#[C-] PI-50608 [1,0,0,0,0,0|1,0,1]=3 41 B7R0.7 CCOC(=O)N=C=S PI-36556 [1,0,0,0,0,0|2,0,1]=4 42 B7R0.7 CNCC(=O)OCC PI-30682 [1,0,0,0,0,0|1,0,0]=2 43 B7R0.7 NCCC(=O)OCC PI-33213 [1,0,0,0,0,0|1,0,0]=2 44 B7R0.7 OCCC(=O)OCC PI-39562 [1,0,0,0,0,0|1,0,0]=2 45 B9R0.4 CCCCC(=O)CC(=O)C PI-36799 [0,1,0,0,0,0|2,0,1]=4 46 B9R0.6 CCOC(=O)C(C(C)C)Br PI-11269 [0,1,0,0,0,0|0,0,0]=1 47 B9R0.6 CCOC(=O)C(C(C)C)N PI-31091 [0,1,0,0,0,0|0,0,0]=1 48 B9R0.6 CCOC(=O)C(C(C)O)N PI-33222 [0,1,0,0,0,0|1,0,0]=2 49 B9R0.6 CCOC(=O)C(C)C(=O)C PI-33892 [0,1,0,0,0,0|1,0,1]=3 50 B9R0.23 CC(C)OC(=O)C(CS)N PI-33219 [0,1,0,0,0,0|3,0,0]=4 51 B9R0.34 C(C)OC(CC(CBr)=O)=O PI-40019 [0,1,0,0,0,0|1,0,1]=3 52 B9R0.34 CCCC(=O)CC(=O)OC PI-45791 [0,1,0,0,0,0|2,0,1]=4 53 B9R0.34 CCOC(=O)CC(=O)NN PI-40382 [0,1,0,0,0,0|2,0,1]=4 54 B9R0.34 CCOC(=O)CC(CBr)O PI-10817 [0,1,0,0,0,0|1,0,0]=2 55 B9R0.34 CCOC(=O)CC(CCl)O PI-38020 [0,1,0,0,0,0|1,0,0]=2 56 B9R0.34 CCOC(=O)C[C@@H](O)CCl PI-11565 [0,1,0,0,0,0|1,0,0]=2 57 B9R0.34 CCOC(=O)C[C@H](O)CCl PI-11564 [0,1,0,0,0,0|1,0,0]=2 58 B9R0.34 CCOC(=O)NC(=O)CCl PI-23124 [0,1,0,0,0,0|2,0,1]=4 59 B9R0.44 CCOC(=O)CC(C)(C)C PI-50549 [0,1,0,0,0,0|0,0,0]=1 60 B9R0.44 CCOC(=O)CC(C)(C)N PI-45592 [0,1,0,0,0,0|0,0,0]=1 61 B9R0.44 CCOC(=O)CS(=O)(=O)C PI-22100 [0,1,0,0,0,0|2,0,0]=3 62 B9R0.44 CCOC(=O)C[Si](C)(C)C PI-35339 [0,1,0,0,0,0|0,1,0]=2 63 B9R0.44 C\C=C\C(=O)OC(C)(C)C PI-22910 [0,1,0,0,0,0|2,0,1]=4 64 B9R0.44 NCCC(=O)OC(C)(C)C PI-37611 [0,1,0,0,0,0|3,0,0]=4 65 B9R0.53 CC(C)OC(=O)\C=C(\C)/N PI-11272 [0,1,0,0,0,0|1,0,2]=4 66 B9R1.34 CC1CC(=O)CC(=O)C1 PI-30620 [0,0,0,1,0,0|2,0,1]=4 67 B9R1.34 CC1CC(CC(=O)C1)C PI-47230 [0,0,0,1,0,0|1,0,0]=2 68 B9R1.38 CC1(CC(=O)OC1=C)C PI-27827 [0,0,0,1,0,0|0,0,2]=3 69 B9R1.41 CC(C)N1CCCC1=O PI-50152 [0,0,0,1,0,0|2,0,0]=3 70 B9R1.48 C1CCC(=O)CC(=O)C1 PI-35810 [0,0,0,1,0,0|2,0,1]=4 71 B9R1.66 O=C1CC(C)(C)CCC1 PI-42382 [0,0,0,1,0,0|1,0,0]=2 72 B7R0.5 CCOC(=O)C(=C)Br PI-35460 [0,0,0,0,1,0|1,0,2]=4 73 B7R0.5 CCOC(=O)C(=S)N PI-34781 [0,0,0,0,1,0|2,0,1]=4 74 B7R0.5 CCOC(=O)C(Br)F PI-13394 [0,0,0,0,1,0|2,0,0]=3 75 B7R0.5 CCOC(=O)C(C)Br PI-44612 [0,0,0,0,1,0|1,0,0]=2 76 B7R0.5 CCOC(=O)C(C)Cl PI-21896 [0,0,0,0,1,0|1,0,0]=2 77 B7R0.5 CCOC(=O)C(C)F PI-12305 [0,0,0,0,1,0|1,0,0]=2 78 B7R0.5 CCOC(=O)C(F)Cl PI-49444 [0,0,0,0,1,0|2,0,0]=3 79 B7R0.5 CCOC(=O)C(F)F PI-24421 [0,0,0,0,1,0|2,0,0]=3 80 B7R0.5 CCOC(=O)C(F)I PI-49445 [0,0,0,0,1,0|2,0,0]=3 81 B7R0.5 CCOC(=O)C(N)C PI-10064 [0,0,0,0,1,0|1,0,0]=2 82 B7R0.5 CCOC(=O)[C@@H](N)C PI-31019 [0,0,0,0,1,0|1,0,0]=2 83 B9R0.48 CC(C)COC(=O)CC#N PI-32786 [0,0,0,0,0,1|2,0,1]=4 84 B9R0.48 CC(C)COC(=O)CC=C PI-50678 [0,0,0,0,0,1|1,0,2]=4 85 B9R0.48 CCOC(=O)C=CN(C)C PI-13247 [0,0,0,0,0,1|1,0,1]=3 86 B9R0.48 CCOC(=O)CCC(=O)Cl PI-12811 [0,0,0,0,0,1|2,0,1]=4 87 B9R0.48 CCOC(=O)CNC(=O)C PI-33248 [0,0,0,0,0,1|1,0,1]=3 88 B6R0.1 CC#CC(=O)OC PI-48956 [2,0,0,0,0,0|0,0,2]=4 89 B6R0.1 CCCC(=O)NN PI-23070 [2,0,0,0,0,0|2,0,0]=4 90 B6R0.1 CCCC(=O)SC PI-48512 [2,0,0,0,0,0|0,1,0]=3 91 B6R0.1 CCCC(CC)Cl PI-46859 [2,0,0,0,0,0|1,0,1]=4 92 B6R0.1 CCOC(=O)C#C PI-35147 [2,0,0,0,0,0|0,0,2]=4 93 B6R0.1 CCOC(=O)CBr PI-15815 [2,0,0,0,0,0|1,0,0]=3 94 B6R0.1 CCOC(=O)NC PI-50343 [2,0,0,0,0,0|1,0,0]=3 95 B6R0.1 CNCC(=O)OC PI-45586 [2,0,0,0,0,0|1,0,0]=3 96 B6R0.1 COC(=O)CCN PI-31148 [2,0,0,0,0,0|1,0,0]=3 97 B6R0.1 NNC(OCC)=O PI-28515 [2,0,0,0,0,0|2,0,0]=4 98 B6R0.1 O=C(OC)CCO PI-41038 [2,0,0,0,0,0|1,0,0]=3 99 B6R0.2 CC(=CC(=O)O)C PI-42632 [2,0,0,0,0,0|0,0,2]=4 100 B6R0.2 CC(=O)O[Si](C)C PI-23366 [2,0,0,0,0,0|1,1,0]=4 101 B6R0.2 CC(Br)OC(=O)C PI-36668 [2,0,0,0,0,0|2,0,0]=4 102 B6R0.2 CC(C)CB(O)O PI-37377 [2,0,0,0,0,0|1,0,1]=4 103 B6R0.2 CC(C)CC(=O)[O-] PI-18660 [2,0,0,0,0,0|0,0,1]=3 104 B6R0.2 CC(CC(=O)O)N PI-35438 [2,0,0,0,0,0|1,0,0]=3 105 B6R0.2 CC(CC(=O)O)N PI-35481 [2,0,0,0,0,0|1,0,0]=3 106 B6R0.2 CC(CC(=O)O)N PI-43821 [2,0,0,0,0,0|1,0,0]=3 107 B6R0.2 CC(CC(=O)O)O PI-47070 [2,0,0,0,0,0|1,0,0]=3 108 B6R0.2 CC(OC(=O)C)Cl PI-36669 [2,0,0,0,0,0|2,0,0]=4 109 B6R0.2 CN(C)CC(=O)O PI-15416 [2,0,0,0,0,0|1,0,0]=3 110 B6R0.2 C[C@@H](N)CC(O)=O PI-42153 [2,0,0,0,0,0|1,0,0]=3 111 B6R0.2 C[C@H](N)CC(O)=O PI-35439 [2,0,0,0,0,0|1,0,0]=3 112 B6R0.2 C[S+](C)CC(=O)[O-] PI-45960 [2,0,0,0,0,0|1,0,1]=4 113 B6R0.4 CCCCC(C)O PI-42555 [2,0,0,0,0,0|1,0,1]=4 114 B6R0.4 CCCC[C@@H](C)O PI-49839 [2,0,0,0,0,0|1,0,1]=4 115 B6R0.6 CCCSCCC PI-48482 [2,0,0,0,0,0|2,0,0]=4 116 B8R0.2 CC(C(C(=O)OC)N)O PI-14289 [1,1,0,0,0,0|1,0,0]=3 117 B8R0.2 CC(C(C(=O)OC)N)O PI-27802 [1,1,0,0,0,0|1,0,0]=3 118 B8R0.2 CC(C(C(=O)OC)N)O PI-42156 [1,1,0,0,0,0|1,0,0]=3 119 B8R0.2 CC(C(C(=O)OC)N)O PI-42158 [1,1,0,0,0,0|1,0,0]=3 120 B8R0.2 CC(C(C(OC)=O)N)C PI-42147 [1,1,0,0,0,0|0,0,0]=2 121 B8R0.2 CC(C)C(C(=O)OC)N PI-50332 [1,1,0,0,0,0|0,0,0]=2 122 B8R0.2 COC(=O)C(=O)C(Br)C PI-39184 [1,1,0,0,0,0|1,0,1]=4 123 B8R0.2 COC(=O)[C@@H](N)C(C)C PI-31250 [1,1,0,0,0,0|0,0,0]=2 124 B8R0.2 C[C@@H](O)[C@H](N)C(OC)=O PI-27495 [1,1,0,0,0,0|1,0,0]=3 125 B8R0.19 CC(=CC(=O)OC)NC PI-30121 [1,1,0,0,0,0|0,0,2]=4 126 B8R0.19 CCC(=O)CC(=O)CC PI-15985 [1,1,0,0,0,0|1,0,1]=4 127 B8R0.19 CCC(=O)CC(=O)OC PI-10902 [1,1,0,0,0,0|1,0,1]=4 128 B8R0.19 CCC(CC(=O)OC)O PI-42251 [1,1,0,0,0,0|1,0,0]=3 129 B8R0.19 CC[C@H](O)CC(OC)=O PI-42252 [1,1,0,0,0,0|1,0,0]=3 130 B8R0.19 COC(=O)CC(=O)CCl PI-18464 [1,1,0,0,0,0|1,0,1]=4 131 B8R0.19 COC(=O)CC(CCl)O PI-24655 [1,1,0,0,0,0|1,0,0]=3 132 B8R0.19 COC(=O)C[C@H](CCl)O PI-24658 [1,1,0,0,0,0|1,0,0]=3 133 B8R0.23 CC(C)CC(=O)C(=O)O PI-14719 [1,1,0,0,0,0|1,0,1]=4 134 B8R0.23 CC(C)CC(=O)C(=O)[O-] PI-13111 [1,1,0,0,0,0|1,0,1]=4 135 B8R0.23 CC(C)CC(=O)C(=O)[O-] PI-19628 [1,1,0,0,0,0|1,0,1]=4 136 B8R0.23 CC(C)OC(=O)[C@@H](C)N PI-33214 [1,1,0,0,0,0|1,0,0]=3 137 B8R0.24 CC(C)(C)OC(=O)CN PI-31136 [1,1,0,0,0,0|2,0,0]=4 138 B8R0.24 CC(C)(C)OC(=O)CS PI-48134 [1,1,0,0,0,0|2,0,0]=4 139 B8R0.24 CCC(=O)OC(C)(C)C PI-47052 [1,1,0,0,0,0|1,0,0]=3 140 B8R0.24 NCC(=O)OC(C)(C)C PI-37610 [1,1,0,0,0,0|2,0,0]=4 141 B8R0.1 CCCOC(=O)CC#N PI-32784 [1,1,0,0,0,0|1,0,1]=4 142 B8R0.1 CCOC(=O)C=CCBr PI-11271 [1,1,0,0,0,0|0,0,2]=4 143 B8R0.1 CCOC(=O)CCC#C PI-40902 [1,1,0,0,0,0|0,0,1]=3 144 B8R0.1 CCOC(=O)CCCBr PI-45007 [1,1,0,0,0,0|0,0,0]=2 145 B8R0.1 CCOC(=O)CCCN PI-42166 [1,1,0,0,0,0|0,0,0]=2 146 B8R0.1 CCOC(=O)CCSC PI-48514 [1,1,0,0,0,0|0,0,0]=2 147 B8R0.1 CCOC(=O)CNC=O PI-33233 [1,1,0,0,0,0|1,0,1]=4 148 B8R0.1 CCOCC(C)OCC PI-44418 [1,1,0,0,0,0|1,0,1]=4 149 B8R0.1 O=C(OCC)CCNC PI-40053 [1,1,0,0,0,0|0,0,0]=2 150 B8R0.1 [N-]=[N+]=NCC(=O)OCC PI-22050 [1,1,0,0,0,0|2,0,0]=4 151 B8R0.3 CC(C(=O)OCC)C#N PI-38920 [1,1,0,0,0,0|1,0,1]=4 152 B8R0.3 CCC(=O)C(=O)OCC PI-50191 [1,1,0,0,0,0|0,0,1]=3 153 B8R0.3 CCOC(=O)C(C=O)Cl PI-40054 [1,1,0,0,0,0|1,0,1]=4 154 B8R0.3 CCOC(=O)C(CO)N PI-30400 [1,1,0,0,0,0|1,0,0]=3 155 B8R0.3 CCOC(=O)C(CS)N PI-15749 [1,1,0,0,0,0|1,0,0]=3 156 B8R0.3 CCOC(=O)C(N)CO PI-42130 [1,1,0,0,0,0|1,0,0]=3 157 B8R0.3 CCOC([C@@H](CO)N)=O PI-42157 [1,1,0,0,0,0|1,0,0]=3 158 B8R0.22 CCCN(CCC)N=O PI-47047 [1,1,0,0,0,0|2,0,0]=4 159 B8R0.30 CCOP(=O)(O)OCC PI-41602 [1,1,0,0,0,0|2,0,0]=4 160 B8R0.14 CCOC(=O)C(Br)(Br)F PI-13395 [0,1,0,0,1,0|2,0,0]=4 161 B8R0.14 CCOC(=O)C(Br)(F)F PI-12726 [0,1,0,0,1,0|2,0,0]=4 162 B8R0.14 CCOC(=O)C(C)(C)Br PI-45894 [0,1,0,0,1,0|0,0,0]=2 163 B8R0.14 CCOC(=O)C(C)(C)O PI-39682 [0,1,0,0,1,0|0,0,0]=2 164 B8R0.14 CCOC(=O)C(C)(F)F PI-42687 [0,1,0,0,1,0|1,0,0]=3 165 B8R0.14 CCOC(=O)C(F)(Cl)Cl PI-19520 [0,1,0,0,1,0|2,0,0]=4 166 B8R0.14 CCOC(=O)C(F)(F)Cl PI-24381 [0,1,0,0,1,0|2,0,0]=4 167 B8R0.14 CCOC(=O)C(F)(F)F PI-15293 [0,1,0,0,1,0|2,0,0]=4 168 B8R0.14 ICOC(=O)C(C)(C)C PI-35168 [0,1,0,0,1,0|1,0,0]=3 169 B10R0.26 CCOC(=O)CC(=O)C(C)C PI-24578 [0,1,0,0,0,1|0,0,0]=2 170 B10R0.32 CCOC(=O)C(=O)CC(=O)C PI-37755 [0,1,0,0,0,1|1,0,1]=4 171 B10R0.32 CCOC(=O)C(CC(C)C)N PI-33215 [0,1,0,0,0,1|0,0,0]=2 172 B10R0.28 BrCCNC(=O)OC(C)(C)C PI-38176 [0,2,0,0,0,0|2,0,0]=4 173 B10R0.28 CC(C)(C)OC(=O)CCCBr PI-22889 [0,2,0,0,0,0|2,0,0]=4 174 B10R0.28 CC(C)(C)OC(=O)CCCBr PI-48356 [0,2,0,0,0,0|2,0,0]=4 175 B10R0.28 CC(C)(C)OC(=O)NCCO PI-28323 [0,2,0,0,0,0|2,0,0]=4 176 B10R0.28 CC(C)(C)OC(=O)OCC=C PI-24570 [0,2,0,0,0,0|1,0,1]=4 177 B10R0.28 NCCCC(=O)OC(C)(C)C PI-37612 [0,2,0,0,0,0|2,0,0]=4 178 B10R0.28 NCCNC(=O)OC(C)(C)C PI-28658 [0,2,0,0,0,0|2,0,0]=4 179 B10R0.44 CC(C)OC(=O)CC(=O)CCl PI-50170 [0,2,0,0,0,0|1,0,1]=4 180 B10R0.35 CCC(=O)C(C(=O)OCC)F PI-33674 [0,2,0,0,0,0|1,0,1]=4 181 B10R0.35 CCC(C)C(C(=O)OCC)N PI-45797 [0,2,0,0,0,0|0,0,0]=2 182 B10R0.35 CCOC(=O)[C@@H](N)[C@@H](C)CC PI-33217 [0,2,0,0,0,0|0,0,0]=2 183 B10R0.36 CCOC(=O)C(C(=O)C)(F)F PI-22082 [0,2,0,0,0,0|1,0,1]=4 184 B10R0.101 CCC(C(=O)C)C(=O)OCC PI-11567 [0,2,0,0,0,0|1,0,1]=4 185 B10R0.101 CCOC(=O)C(=C(C)C)C#N PI-19891 [0,2,0,0,0,0|0,0,2]=4 186 B10R0.101 CCOC(=O)C(C#N)C(=O)C PI-19795 [0,2,0,0,0,0|1,0,1]=4 187 B10R0.70 CC(C)CN(CC(C)C)C=O PI-42269 [0,2,0,0,0,0|2,0,0]=4 188 B10R0.2 CCCC(=O)CC(=O)OCC PI-45789 [0,2,0,0,0,0|1,0,1]=4 189 B10R0.2 CCCC(CC(=O)OCC)O PI-45930 [0,2,0,0,0,0|1,0,0]=3 190 B10R0.2 CCOC(=N)CC(=O)OCC PI-18369 [0,2,0,0,0,0|1,0,1]=4 191 B10R0.2 CCOC(=O)C[C@H](CC#N)O PI-13566 [0,2,0,0,0,0|1,0,0]=3 192 B10R0.2 CCOC(=O)C[C@H](O)CC#N PI-16779 [0,2,0,0,0,0|1,0,0]=3 193 B10R0.31 C[C@@H](CC(=O)OC(C)(C)C)N PI-49009 [0,2,0,0,0,0|1,0,0]=3 194 B8R1.4 CC1CCCC(=O)N1 PI-35204 [1,0,0,1,0,0|1,0,0]=3 195 B8R1.4 O=C1CCCC(=O)C1 PI-32070 [1,0,0,1,0,0|1,0,1]=4 196 B8R1.4 O=C1CCC[C@@H](C)O1 PI-27587 [1,0,0,1,0,0|1,0,0]=3 197 B8R1.4 O=C1CCOC(C1)C PI-40554 [1,0,0,1,0,0|1,0,0]=3 198 B8R1.4 O=C1NCCC(O)C1 PI-37263 [1,0,0,1,0,0|2,0,0]=4 199 B8R1.4 O=C1NCCN(C)C1 PI-41916 [1,0,0,1,0,0|2,0,0]=4 200 B8R1.18 CC1CC(=O)N(C)N1 PI-32451 [1,0,0,1,0,0|2,0,0]=4 201 B8R1.18 CC1OC(=O)C(Br)C1 PI-27399 [1,0,0,1,0,0|2,0,0]=4 202 B8R1.40 COC(=O)NC1CC1 PI-17914 [1,0,0,1,0,0|1,0,0]=3 203 B8R1.51 CC1=NC(CO1)(C)C PI-46988 [1,0,0,1,0,0|2,0,0]=4 204 B8R1.36 CCCNCC1CC1 PI-13558 [1,0,0,1,0,0|2,0,0]=4 205 B8R1.72 C1CCNCC1(C)C PI-38949 [1,0,0,1,0,0|2,0,0]=4 206 B8R1.72 CC1(C)CCNCC1 PI-40549 [1,0,0,1,0,0|1,0,1]=4 207 B8R1.72 NC1(C)CCOCC1 PI-40814 [1,0,0,1,0,0|1,0,1]=4 208 B8R1.11 CCN1CCCC1=O PI-12779 [1,0,0,1,0,0|1,0,0]=3 209 B8R1.5 C1CCC(=O)C(C1)O PI-29668 [0,0,0,1,1,0|2,0,0]=4 210 B8R1.5 CC1CNCCC1=O PI-43304 [0,0,0,1,1,0|2,0,0]=4 211 B8R1.5 O=C1NCCCC1O PI-41426 [0,0,0,1,1,0|2,0,0]=4 212 B10R1.59 CC([C@@H]1NC(=O)OC1=O)C PI-37651 [0,0,0,1,0,1|1,0,1]=4 213 B10R1.138 CCCC(=O)OCC1CO1 PI-16670 [0,0,0,1,0,1|2,0,0]=4 214 B10R1.138 CCCC(=O)OC[C@@H]1CO1 PI-16664 [0,0,0,1,0,1|2,0,0]=4 215 B10R1.140 CCOC(=O)C1CC(=O)C1 PI-38970 [0,0,0,1,0,1|1,0,1]=4 216 B10R1.135 CCOC(=O)C1CC1C=O PI-17872 [0,1,0,1,0,0|0,0,1]=3 217 B10R1.329 CC1(CC(=CC(=O)C1)Cl)C PI-17457 [0,1,0,1,0,0|1,0,1]=4 218 B10R1.329 CC1(CC(=CC(=O)C1)N)C PI-14082 [0,1,0,1,0,0|1,0,1]=4 219 B10R1.329 CC1CC(=O)CC(C1)(C)C PI-49082 [0,1,0,1,0,0|1,0,0]=3 220 B10R1.329 O=C1CC(=O)CC(C)(C)C1 PI-15341 [0,1,0,1,0,0|1,0,1]=4 221 B10R2.61 C1CC2CC(C1)OC2=O PI-34881 [0,0,0,2,0,0|2,0,0]=4 222 B6R0.3 BrCC(=O)C(C)C PI-34836 [1,0,0,0,1,0|1,0,0]=3 223 B6R0.3 CC(C(=O)OC)Cl PI-13042 [1,0,0,0,1,0|1,0,0]=3 224 B6R0.3 CC(C(=O)OC)N PI-31127 [1,0,0,0,1,0|1,0,0]=3 225 B6R0.3 CCC(=O)C(C)Br PI-47067 [1,0,0,0,1,0|1,0,0]=3 226 B6R0.3 CCC(=O)C(C)C PI-39171 [1,0,0,0,1,0|0,0,0]=2 227 B6R0.3 CN(C)C(=O)CBr PI-40959 [1,0,0,0,1,0|2,0,0]=4 228 B6R0.3 COC(=O)C(N)C PI-10065 [1,0,0,0,1,0|1,0,0]=3 229 B6R0.3 COC(=O)[C@@H](C)O PI-15307 [1,0,0,0,1,0|1,0,0]=3 230 B6R0.3 COC(=O)[C@H](N)C PI-18185 [1,0,0,0,1,0|1,0,0]=3 231 B6R0.3 NCC(=O)N(C)C PI-34626 [1,0,0,0,1,0|2,0,0]=4