0 B9R0.19 CCOC(=O)C(C)(C)C#N TS06599 [0,0,0,0,0,0|2,0,1]=3 1 B9R0.19 CCOC(=O)C(C)(C)CCl TS11951 [0,0,0,0,0,0|2,0,0]=2 2 B9R0.19 CCOC(=O)C(C)(CBr)Br TS74393 [0,0,0,0,0,0|2,0,0]=2 3 B8R0.3 CCC(C(=O)OCC)Br TS51943 [1,0,0,0,0,0|1,0,0]=2 4 B8R0.3 CCC(C(=O)OCC)N TS05659 [1,0,0,0,0,0|1,0,0]=2 5 B8R0.3 CCC(C(=O)OCC)O TS05723 [1,0,0,0,0,0|0,0,0]=1 6 B8R0.3 CCC(C)C(=O)C=CC TS05192 [1,0,0,0,0,0|1,0,1]=3 7 B8R0.3 CCC(C)C(=O)OCC TS36496 [1,0,0,0,0,0|0,0,0]=1 8 B8R0.3 CCC=C(C)C(CC)O TS36335 [1,0,0,0,0,0|2,0,0]=3 9 B8R0.3 CCCC(=O)C(C)CC TS36333 [1,0,0,0,0,0|1,0,0]=2 10 B8R0.3 CCCC(C(C)CC)O TS36557 [1,0,0,0,0,0|1,0,2]=4 11 B8R0.3 CCCC(C)C(C)CC TS05420 [1,0,0,0,0,0|2,0,1]=4 12 B8R0.3 CCCC(C)C(CC)O TS36549 [1,0,0,0,0,0|2,0,1]=4 13 B8R0.3 CCOC(=O)C(=C)CBr TS00209 [1,0,0,0,0,0|1,0,2]=4 14 B8R0.3 CCOC(=O)C(=C)CCl TS40705 [1,0,0,0,0,0|1,0,2]=4 15 B8R0.3 CCOC(=O)C(=C)CO TS08483 [1,0,0,0,0,0|1,0,2]=4 16 B8R0.3 CCOC(=O)C(=CC)C TS05350 [1,0,0,0,0,0|0,0,2]=3 17 B8R0.3 CCOC(=O)C(=O)CBr TS56142 [1,0,0,0,0,0|1,0,2]=4 18 B8R0.3 CCOC(=O)C(C#C)O TS36268 [1,0,0,0,0,0|0,0,2]=3 19 B8R0.3 CCOC(=O)C(C)C#N TS55919 [1,0,0,0,0,0|1,0,1]=3 20 B8R0.3 CCOC(=O)C(CBr)Br TS08484 [1,0,0,0,0,0|2,0,0]=3 21 B8R0.3 CCOC(=O)C(CCl)Cl TS12952 [1,0,0,0,0,0|2,0,0]=3 22 B8R0.3 CCOC(=O)N(C)N=O TS36643 [1,0,0,0,0,0|3,0,0]=4 23 B8R0.3 CCOC(=O)[C@@H](CO)N TS45049 [1,0,0,0,0,0|2,0,0]=3 24 B8R0.3 CCOC(=O)[C@H](C)OC TS05726 [1,0,0,0,0,0|1,0,0]=2 25 B8R0.3 CCOC(=O)[C@H](CO)N TS45053 [1,0,0,0,0,0|2,0,0]=3 26 B8R0.3 CCOC(=O)[C@H](CS)N TS15539 [1,0,0,0,0,0|2,0,0]=3 27 B8R0.13 CC(C)(CO)C(=O)OC TS36661 [1,0,0,0,0,0|2,0,0]=3 28 B8R0.13 CCC(=O)C(C)(C)CC TS36331 [1,0,0,0,0,0|1,0,0]=2 29 B8R0.13 CCC(C)(C(=O)OC)N TS43282 [1,0,0,0,0,0|1,0,0]=2 30 B8R0.13 CCC(C)C(C)(C)CC TS05426 [1,0,0,0,0,0|2,0,1]=4 31 B8R0.13 CCC(C)C(C)(CC)O TS05601 [1,0,0,0,0,0|1,0,1]=3 32 B8R0.13 CC[C@@](C)(C(=O)OC)N TS12445 [1,0,0,0,0,0|1,0,0]=2 33 B8R0.13 CC[C@](C)(C(=O)OC)N TS12450 [1,0,0,0,0,0|1,0,0]=2 34 B8R0.14 CC(C)(C)C(=O)OC=C TS05340 [1,0,0,0,0,0|1,0,2]=4 35 B8R0.14 CC(C)(C)C(=O)OCCl TS39622 [1,0,0,0,0,0|2,0,0]=3 36 B8R0.14 CC(C)(C)C(=O)OCI TS26785 [1,0,0,0,0,0|2,0,0]=3 37 B8R0.14 CCCC(=O)C(C)(C)C TS05378 [1,0,0,0,0,0|2,0,0]=3 38 B8R0.14 CCCC(C)C(C)(C)O TS36543 [1,0,0,0,0,0|2,0,1]=4 39 B8R0.14 CCOC(=C)[Si](C)(C)C TS07041 [1,0,0,0,0,0|2,1,0]=4 40 B8R0.14 CCOC(=C)[Sn](C)(C)C TS56588 [1,0,0,0,0,0|3,0,0]=4 41 B8R0.14 CCOC(=O)C(C)(C)Br TS55167 [1,0,0,0,0,0|1,0,0]=2 42 B8R0.14 CCOC(=O)C(C)(C)C TS36504 [1,0,0,0,0,0|1,0,0]=2 43 B8R0.14 CCOC(=O)C(C)(C)N TS43281 [1,0,0,0,0,0|1,0,0]=2 44 B8R0.14 CCOC(=O)C(C)(C)O TS36659 [1,0,0,0,0,0|0,0,0]=1 45 B8R0.14 CCOC(=O)C(C)(F)F TS06224 [1,0,0,0,0,0|2,0,0]=3 46 B8R0.14 CCOC(=O)C(Cl)(Cl)Cl TS00286 [1,0,0,0,0,0|3,0,0]=4 47 B8R0.14 CCOC(=O)C(F)(Br)Br TS29977 [1,0,0,0,0,0|3,0,0]=4 48 B8R0.14 CCOC(=O)C(F)(Cl)Cl TS45893 [1,0,0,0,0,0|3,0,0]=4 49 B8R0.14 CCOC(=O)C(F)(F)Br TS77132 [1,0,0,0,0,0|3,0,0]=4 50 B8R0.14 CCOC(=O)C(F)(F)Cl TS59751 [1,0,0,0,0,0|3,0,0]=4 51 B8R0.14 CCOC(=O)C(F)(F)F TS01482 [1,0,0,0,0,0|3,0,0]=4 52 B8R0.14 CCOC(=O)C(F)(F)I TS27978 [1,0,0,0,0,0|3,0,0]=4 53 B8R0.25 CCC#CC(C)(CC)O TS05186 [1,0,0,0,0,0|1,0,1]=3 54 B8R0.25 CCCCC(C)(C)CC TS36368 [1,0,0,0,0,0|2,0,1]=4 55 B8R0.25 CCCCC(C)(CC)O TS36532 [1,0,0,0,0,0|1,0,1]=3 56 B10R0.36 CCOC(=O)C(C(=O)C)(F)F TS12131 [0,1,0,0,0,0|2,0,1]=4 57 B10R0.36 CCOC(=O)C(C)(C)C(=O)C TS60119 [0,1,0,0,0,0|1,0,1]=3 58 B10R0.36 CCOC(=O)C(C)(C)C(=O)Cl TS47625 [0,1,0,0,0,0|2,0,1]=4 59 B10R0.36 CCOC(=O)C(C)(C)C(=O)O TS02740 [0,1,0,0,0,0|2,0,1]=4 60 B10R0.129 CCCC(C)(C(=O)OCC)N TS11171 [0,1,0,0,0,0|1,0,0]=2 61 B10R1.63 CC1(CCC(=O)OC1=O)C TS37559 [0,0,0,1,0,0|2,0,1]=4 62 B10R1.230 CCC1(CCCCC1C)O TS06763 [0,0,0,1,0,0|2,0,1]=4 63 B10R1.401 CCOC(=O)C1(CCC1)N TS06862 [0,0,0,1,0,0|1,0,0]=2 64 B10R1.401 CCOC(=O)C1(CCC1)N TS47801 [0,0,0,1,0,0|1,0,0]=2 65 B10R1.405 CCOC(=O)C1(CC1)C#N TS55894 [0,0,0,1,0,0|2,0,1]=4 66 B10R1.405 CCOC(=O)C1(CC1)CN TS40087 [0,0,0,1,0,0|2,0,0]=3 67 B7R0.3 CCC#CC(CC)O TS31952 [2,0,0,0,0,0|1,0,1]=4 68 B7R0.3 CCC=CC(C)CC TS31968 [2,0,0,0,0,0|1,0,0]=3 69 B7R0.3 CCCCC(C)CC TS32121 [2,0,0,0,0,0|1,0,1]=4 70 B7R0.3 CCCCC(CC)O TS04628 [2,0,0,0,0,0|1,0,1]=4 71 B7R0.3 CCCNC(C)CC TS04555 [2,0,0,0,0,0|2,0,0]=4 72 B7R0.3 CCOCC(CO)O TS04807 [2,0,0,0,0,0|1,0,1]=4 73 B7R0.5 CCC=C(C)C(C)C TS31953 [2,0,0,0,0,0|2,0,0]=4 74 B7R0.5 CCC=C(C)C(C)O TS04482 [2,0,0,0,0,0|2,0,0]=4 75 B7R0.5 CCCC(=C)C(C)C TS04341 [2,0,0,0,0,0|2,0,0]=4 76 B7R0.5 CCCC(=O)C(C)C TS32114 [2,0,0,0,0,0|1,0,0]=3 77 B7R0.5 CCCC(=O)N(C)C TS32149 [2,0,0,0,0,0|2,0,0]=4 78 B7R0.5 CCOC(=O)C(=C)C TS00098 [2,0,0,0,0,0|0,0,2]=4 79 B7R0.5 CCOC(=O)C(=O)C TS01478 [2,0,0,0,0,0|0,0,2]=4 80 B7R0.5 CCOC(=O)C(Br)Br TS27397 [2,0,0,0,0,0|2,0,0]=4 81 B7R0.5 CCOC(=O)C(C)Br TS55906 [2,0,0,0,0,0|1,0,0]=3 82 B7R0.5 CCOC(=O)C(C)C TS32217 [2,0,0,0,0,0|0,0,0]=2 83 B7R0.5 CCOC(=O)C(C)Cl TS55916 [2,0,0,0,0,0|1,0,0]=3 84 B7R0.5 CCOC(=O)C(C)F TS32420 [2,0,0,0,0,0|1,0,0]=3 85 B7R0.5 CCOC(=O)C(C)N TS55877 [2,0,0,0,0,0|1,0,0]=3 86 B7R0.5 CCOC(=O)C(C)O TS04714 [2,0,0,0,0,0|0,0,0]=2 87 B7R0.5 CCOC(=O)C(C)S TS05920 [2,0,0,0,0,0|0,1,0]=3 88 B7R0.5 CCOC(=O)C(Cl)Cl TS10814 [2,0,0,0,0,0|2,0,0]=4 89 B7R0.5 CCOC(=O)C(F)Br TS15410 [2,0,0,0,0,0|2,0,0]=4 90 B7R0.5 CCOC(=O)C(F)Cl TS37443 [2,0,0,0,0,0|2,0,0]=4 91 B7R0.5 CCOC(=O)C(F)F TS39847 [2,0,0,0,0,0|2,0,0]=4 92 B7R0.5 CCOC(=O)C(F)I TS53245 [2,0,0,0,0,0|2,0,0]=4 93 B7R0.5 CCOC(=O)[C@@H](C)N TS41313 [2,0,0,0,0,0|1,0,0]=3 94 B7R0.5 CCOC(=O)[C@@H](C)O TS08773 [2,0,0,0,0,0|0,0,0]=2 95 B7R0.5 CCOC(=O)[C@H](C)Cl TS06132 [2,0,0,0,0,0|1,0,0]=3 96 B7R0.5 CCOC(=O)[C@H](C)N TS02287 [2,0,0,0,0,0|1,0,0]=3 97 B7R0.5 CCOC(=O)[C@H](C)O TS04715 [2,0,0,0,0,0|0,0,0]=2 98 B7R0.7 CCCC(=CCC)C TS31954 [2,0,0,0,0,0|2,0,0]=4 99 B7R0.7 CCCC(=O)CCC TS32100 [2,0,0,0,0,0|1,0,0]=3 100 B7R0.7 CCCC(=O)OC=C TS04453 [2,0,0,0,0,0|0,0,2]=4 101 B7R0.7 CCCC(=O)OCC TS32219 [2,0,0,0,0,0|0,0,0]=2 102 B7R0.7 CCCC(=O)OCCl TS55810 [2,0,0,0,0,0|1,0,0]=3 103 B7R0.7 CCCC(=S)OCC TS05779 [2,0,0,0,0,0|0,1,0]=3 104 B7R0.7 CCCC(=S)OCC TS07488 [2,0,0,0,0,0|0,1,0]=3 105 B7R0.7 CCCC(C)OCC TS32250 [2,0,0,0,0,0|1,0,1]=4 106 B7R0.7 CCCS(=O)CCC TS36875 [2,0,0,0,0,0|2,0,0]=4 107 B7R0.7 CCNC(=O)NCC TS04609 [2,0,0,0,0,0|2,0,0]=4 108 B7R0.7 CCNC(=O)OCC TS04671 [2,0,0,0,0,0|1,0,0]=3 109 B7R0.7 CCOC(=C)OCC TS56207 [2,0,0,0,0,0|2,0,0]=4 110 B7R0.7 CCOC(=O)C#CC TS08727 [2,0,0,0,0,0|0,0,2]=4 111 B7R0.7 CCOC(=O)C=CC TS04436 [2,0,0,0,0,0|0,0,2]=4 112 B7R0.7 CCOC(=O)CC#C TS31911 [2,0,0,0,0,0|0,0,2]=4 113 B7R0.7 CCOC(=O)CC#N TS32007 [2,0,0,0,0,0|1,0,1]=4 114 B7R0.7 CCOC(=O)CC=C TS04444 [2,0,0,0,0,0|0,0,2]=4 115 B7R0.7 CCOC(=O)CCBr TS08511 [2,0,0,0,0,0|1,0,0]=3 116 B7R0.7 CCOC(=O)CCCl TS66003 [2,0,0,0,0,0|1,0,0]=3 117 B7R0.7 CCOC(=O)CCI TS56139 [2,0,0,0,0,0|1,0,0]=3 118 B7R0.7 CCOC(=O)CCN TS01886 [2,0,0,0,0,0|1,0,0]=3 119 B7R0.7 CCOC(=O)CCN TS04667 [2,0,0,0,0,0|1,0,0]=3 120 B7R0.7 CCOC(=O)CCS TS05923 [2,0,0,0,0,0|1,0,0]=3 121 B7R0.7 CCOC(=O)CC[Zn+] TS62340 [2,0,0,0,0,0|1,0,0]=3 122 B7R0.7 CCOC(=O)CNC TS01479 [2,0,0,0,0,0|1,0,0]=3 123 B7R0.7 CCOC(=O)CNN TS56149 [2,0,0,0,0,0|2,0,0]=4 124 B7R0.7 CCOC(=O)COC TS32327 [2,0,0,0,0,0|1,0,0]=3 125 B7R0.7 CCOC(=O)CSC TS05917 [2,0,0,0,0,0|1,0,0]=3 126 B7R0.7 CCOC(=O)C[N+]#[C-] TS01459 [2,0,0,0,0,0|1,0,1]=4 127 B7R0.7 CCOC(=O)NOC TS32378 [2,0,0,0,0,0|2,0,0]=4 128 B7R0.7 CCOC(=O)OCC TS32315 [2,0,0,0,0,0|1,0,0]=3 129 B7R0.7 CCOC(=O)OCCl TS37245 [2,0,0,0,0,0|2,0,0]=4 130 B7R0.7 CCOS(=O)OCC TS06288 [2,0,0,0,0,0|2,0,0]=4 131 B7R0.7 CCSC(=O)SCC TS40933 [2,0,0,0,0,0|1,1,0]=4 132 B7R0.10 CC(C(=O)OC)OC TS32317 [2,0,0,0,0,0|1,0,0]=3 133 B7R0.10 CC(C(=O)OC)SC TS05922 [2,0,0,0,0,0|1,0,0]=3 134 B7R0.10 CC=C(C)C(=O)OC TS32064 [2,0,0,0,0,0|0,0,2]=4 135 B7R0.10 CC=C(C)C(=O)OC TS32066 [2,0,0,0,0,0|0,0,2]=4 136 B7R0.10 CCC(=C(C)CC)C TS04354 [2,0,0,0,0,0|1,0,1]=4 137 B7R0.10 CCC(=C(C)CC)C TS31959 [2,0,0,0,0,0|1,0,1]=4 138 B7R0.10 CCC(C(=O)CC)O TS32221 [2,0,0,0,0,0|0,0,0]=2 139 B7R0.10 CCC(C(=O)OC)Br TS65236 [2,0,0,0,0,0|1,0,0]=3 140 B7R0.10 CCC(C(=O)OC)Cl TS06135 [2,0,0,0,0,0|1,0,0]=3 141 B7R0.10 CCC(C(=O)OC)N TS41307 [2,0,0,0,0,0|1,0,0]=3 142 B7R0.10 CCC(C)C(=C)CC TS04351 [2,0,0,0,0,0|1,0,0]=3 143 B7R0.10 CCC(C)C(=CC)C TS04350 [2,0,0,0,0,0|1,0,1]=4 144 B7R0.10 CCC(C)C(=O)CC TS04477 [2,0,0,0,0,0|0,0,0]=2 145 B7R0.10 CCC(C)C(=O)OC TS04590 [2,0,0,0,0,0|0,0,0]=2 146 B7R0.10 CCC(C)C(=O)SC TS05776 [2,0,0,0,0,0|0,1,0]=3 147 B7R0.10 CCC(C)C(C)CC TS04508 [2,0,0,0,0,0|1,0,1]=4 148 B7R0.10 CCC(C)C(CC)O TS04626 [2,0,0,0,0,0|0,0,2]=4 149 B7R0.10 COC(=O)C(C=C)O TS32185 [2,0,0,0,0,0|0,0,2]=4 150 B7R0.10 COC(=O)C(CBr)Br TS27392 [2,0,0,0,0,0|2,0,0]=4 151 B7R0.10 COC(=O)C(CCl)Cl TS10813 [2,0,0,0,0,0|2,0,0]=4 152 B7R0.10 COC(=O)C(CCl)N TS08717 [2,0,0,0,0,0|2,0,0]=4 153 B7R0.10 COC(=O)C(CO)Cl TS37246 [2,0,0,0,0,0|2,0,0]=4 154 B7R0.10 COC(=O)C(CO)N TS47365 [2,0,0,0,0,0|2,0,0]=4 155 B7R0.10 COC(=O)[C@@H](CCl)N TS45716 [2,0,0,0,0,0|2,0,0]=4 156 B7R0.10 COC(=O)[C@@H](CO)N TS55886 [2,0,0,0,0,0|2,0,0]=4 157 B7R0.10 COC(=O)[C@H](CCl)N TS06211 [2,0,0,0,0,0|2,0,0]=4 158 B7R0.10 COC(=O)[C@H](CO)N TS46686 [2,0,0,0,0,0|2,0,0]=4 159 B7R0.10 COC(=O)[C@H](CS)N TS64915 [2,0,0,0,0,0|2,0,0]=4 160 B7R0.10 COC(C(=O)OC)O TS01782 [2,0,0,0,0,0|1,0,0]=3 161 B7R0.10 C[C@@H](C(=O)OC)NC TS41312 [2,0,0,0,0,0|1,0,0]=3 162 B7R0.10 C[C@@H](CBr)C(=O)OC TS14724 [2,0,0,0,0,0|1,0,0]=3 163 B7R0.10 C[C@@H](CO)C(=O)OC TS59397 [2,0,0,0,0,0|1,0,0]=3 164 B7R0.10 C[C@H](CBr)C(=O)OC TS14720 [2,0,0,0,0,0|1,0,0]=3 165 B7R0.10 C[C@H](CO)C(=O)OC TS32320 [2,0,0,0,0,0|1,0,0]=3 166 B7R0.11 CCC(C)(C)OCC TS32244 [2,0,0,0,0,0|1,0,0]=3 167 B7R0.11 CCCC(C)(C)CC TS32122 [2,0,0,0,0,0|1,0,1]=4 168 B7R0.11 CCCC(C)(CC)Cl TS36886 [2,0,0,0,0,0|1,0,1]=4 169 B7R0.11 CCCC(C)(CC)O TS04623 [2,0,0,0,0,0|0,0,1]=3 170 B7R0.11 CCO[C@@](C)(CO)O TS94520 [2,0,0,0,0,0|1,0,0]=3 171 B7R0.13 CC(C)(C(=O)O)NC TS32286 [2,0,0,0,0,0|2,0,0]=4 172 B7R0.13 CC(C)(CCl)C(=O)O TS37072 [2,0,0,0,0,0|2,0,0]=4 173 B7R0.13 CC(C)(CO)C(=O)O TS47115 [2,0,0,0,0,0|2,0,0]=4 174 B7R0.13 CC(CBr)(C(=O)O)Br TS85189 [2,0,0,0,0,0|2,0,0]=4 175 B7R0.13 CC(CCl)(C(=O)O)Cl TS10812 [2,0,0,0,0,0|2,0,0]=4 176 B7R0.13 CC(CO)(C(=O)O)N TS32390 [2,0,0,0,0,0|2,0,0]=4 177 B7R0.13 CCC(C)(C(=O)O)Br TS14722 [2,0,0,0,0,0|1,0,0]=3 178 B7R0.13 CCC(C)(C(=O)O)N TS04668 [2,0,0,0,0,0|1,0,0]=3 179 B7R0.13 CCC(C)(C(=O)O)N TS41309 [2,0,0,0,0,0|1,0,0]=3 180 B7R0.13 CCC(C)(C(=O)O)O TS04711 [2,0,0,0,0,0|0,0,0]=2 181 B7R0.13 CCC(C)(C(C)C)O TS32233 [2,0,0,0,0,0|1,0,1]=4 182 B7R0.13 CCC(C)(C)C(=O)Cl TS39250 [2,0,0,0,0,0|2,0,0]=4 183 B7R0.13 CCC(C)(C)C(=O)O TS32225 [2,0,0,0,0,0|1,0,0]=3 184 B7R0.13 CC[C@](C)(C(=O)O)N TS08724 [2,0,0,0,0,0|1,0,0]=3 185 B7R0.13 CC[C@](C)(C(=O)O)N TS10365 [2,0,0,0,0,0|1,0,0]=3 186 B7R0.13 CC[C@](C)(C(=O)O)O TS32316 [2,0,0,0,0,0|0,0,0]=2 187 B7R0.13 C[C@@](CBr)(C(=O)O)O TS15088 [2,0,0,0,0,0|1,0,0]=3 188 B7R0.13 C[C@](CBr)(C(=O)O)O TS59847 [2,0,0,0,0,0|1,0,0]=3 189 B7R0.14 CC(C)(C(=O)NN)O TS32334 [2,0,0,0,0,0|2,0,0]=4 190 B7R0.14 CC(C)(C(=O)OC)Br TS60142 [2,0,0,0,0,0|1,0,0]=3 191 B7R0.14 CC(C)(C(=O)OC)F TS56254 [2,0,0,0,0,0|1,0,0]=3 192 B7R0.14 CC(C)(C(=O)OC)N TS01337 [2,0,0,0,0,0|1,0,0]=3 193 B7R0.14 CC(C)(C(=O)OC)O TS04713 [2,0,0,0,0,0|0,0,0]=2 194 B7R0.14 CC(C)(C)C(=O)CBr TS47672 [2,0,0,0,0,0|2,0,0]=4 195 B7R0.14 CC(C)(C)C(=O)CCl TS00046 [2,0,0,0,0,0|2,0,0]=4 196 B7R0.14 CC(C)(C)C(=O)NC TS32150 [2,0,0,0,0,0|2,0,0]=4 197 B7R0.14 CC(C)(C)C(=O)OC TS32211 [2,0,0,0,0,0|1,0,0]=3 198 B7R0.14 CCC(=O)C(C)(C)C TS04479 [2,0,0,0,0,0|1,0,0]=3 199 B7R0.8 CCC#CC(C)(C)O TS31932 [2,0,0,0,0,0|1,0,1]=4 200 B7R0.8 CCC=CC(C)(C)C TS04367 [2,0,0,0,0,0|2,0,0]=4 201 B7R0.8 CCC=CC(C)(C)C TS04368 [2,0,0,0,0,0|2,0,0]=4 202 B7R0.8 CCCCC(C)(C)O TS04619 [2,0,0,0,0,0|1,0,1]=4 203 B9R0.6 CCOC(=O)C(=O)C(C)C TS06953 [1,1,0,0,0,0|0,0,2]=4 204 B9R0.6 CCOC(=O)C(C(=O)C)Cl TS00067 [1,1,0,0,0,0|1,0,1]=4 205 B9R0.6 CCOC(=O)C(C(=O)C)F TS40607 [1,1,0,0,0,0|1,0,1]=4 206 B9R0.6 CCOC(=O)C(C(C)Br)Br TS74395 [1,1,0,0,0,0|1,0,0]=3 207 B9R0.6 CCOC(=O)C(C(C)C)Br TS55905 [1,1,0,0,0,0|1,0,0]=3 208 B9R0.6 CCOC(=O)C(C(C)C)N TS48167 [1,1,0,0,0,0|1,0,0]=3 209 B9R0.6 CCOC(=O)C(C)C(=O)C TS00094 [1,1,0,0,0,0|0,0,1]=3 210 B9R0.6 CCOC(=O)C(C)[N+](=O)[O-] TS40494 [1,1,0,0,0,0|2,0,0]=4 211 B9R0.6 CCOC(=O)[C@@H](C(C)C)N TS48159 [1,1,0,0,0,0|1,0,0]=3 212 B9R0.6 CCOC(=O)[C@H](C(C)C)N TS48151 [1,1,0,0,0,0|1,0,0]=3 213 B9R0.6 CCOC(=O)[C@H]([C@@H](C)O)N TS48480 [1,1,0,0,0,0|1,0,0]=3 214 B9R0.8 CCCCC(=O)C(C)CC TS37636 [1,1,0,0,0,0|1,0,0]=3 215 B9R0.8 CCCOC(=O)C(=CC)C TS06700 [1,1,0,0,0,0|0,0,2]=4 216 B9R0.8 CCCOC(=O)C(C)CC TS40216 [1,1,0,0,0,0|0,0,0]=2 217 B9R0.23 CC(C)OC(=O)[C@H](CS)N TS37821 [1,1,0,0,0,0|2,0,0]=4 218 B9R0.23 CC=C(C)C(=O)OC(C)C TS06716 [1,1,0,0,0,0|0,0,2]=4 219 B9R0.23 CCC(C)C(=O)OC(C)C TS40221 [1,1,0,0,0,0|0,0,0]=2 220 B9R0.27 CCC(C)C(=O)C(C)CC TS06741 [1,1,0,0,0,0|1,0,0]=3 221 B9R0.35 CCC=C(C)C(=O)OCC TS37603 [1,1,0,0,0,0|0,0,1]=3 222 B9R0.35 CCCC(=O)C(=O)OCC TS85095 [1,1,0,0,0,0|0,0,2]=4 223 B9R0.35 CCCC(C(=O)CCC)O TS40202 [1,1,0,0,0,0|1,0,0]=3 224 B9R0.35 CCCC(C(=O)OCC)Br TS20692 [1,1,0,0,0,0|1,0,0]=3 225 B9R0.35 CCCC(C(=O)OCC)O TS40414 [1,1,0,0,0,0|0,0,0]=2 226 B9R0.35 CCCC(C)C(=O)CCC TS06752 [1,1,0,0,0,0|1,0,0]=3 227 B9R0.35 CCCC(C)C(=O)OCC TS06992 [1,1,0,0,0,0|0,0,0]=2 228 B9R0.35 CCC[C@@H](C(=O)OCC)N TS48149 [1,1,0,0,0,0|1,0,0]=3 229 B9R0.35 CCOC(=O)C(=O)OCC TS01436 [1,1,0,0,0,0|0,0,2]=4 230 B9R0.35 CCOC(=O)C(C)C=C=C TS06463 [1,1,0,0,0,0|0,0,2]=4 231 B9R0.35 CCOC(=O)C(C)C=CC TS37595 [1,1,0,0,0,0|0,0,1]=3 232 B9R0.35 CCOC(=O)C(C)N=C=O TS06825 [1,1,0,0,0,0|1,0,1]=4 233 B9R0.35 CCOC(=O)C(C)N=C=S TS42067 [1,1,0,0,0,0|1,0,1]=4 234 B9R0.35 CCOC(=O)C(C)SSC TS14672 [1,1,0,0,0,0|1,0,0]=3 235 B9R0.35 CCOC(=O)C(CCBr)Br TS64882 [1,1,0,0,0,0|1,0,0]=3 236 B9R0.35 CCOC(C(=O)OCC)Cl TS12302 [1,1,0,0,0,0|1,0,0]=3 237 B9R0.35 CCOC(C(=O)OCC)O TS07404 [1,1,0,0,0,0|0,0,0]=2 238 B9R0.35 CCOC(C)C(=O)OCC TS40412 [1,1,0,0,0,0|0,0,0]=2 239 B9R0.37 CCC(CC)C(=O)OCC TS40212 [1,1,0,0,0,0|0,0,0]=2 240 B9R0.37 CCCC(=O)C(CC)CC TS06749 [1,1,0,0,0,0|1,0,0]=3 241 B9R0.37 CCCC(=O)N(CC)CC TS40109 [1,1,0,0,0,0|2,0,0]=4 242 B9R0.37 CCOC(=O)C(CBr)CBr TS74396 [1,1,0,0,0,0|1,0,0]=3 243 B9R0.28 CC(=O)C(C)(C(=O)OC)O TS07167 [1,1,0,0,0,0|0,0,1]=3 244 B9R0.28 CC(=O)C(C)(C)C(=O)OC TS39249 [1,1,0,0,0,0|1,0,1]=4 245 B9R0.69 CC(C(=O)OC)(OC)OC TS07407 [1,1,0,0,0,0|1,0,0]=3 246 B9R0.3 CC(C)(C(=O)OCC=C)Br TS20308 [1,1,0,0,0,0|1,0,1]=4 247 B9R0.3 CCCCC(=O)C(C)(C)C TS06742 [1,1,0,0,0,0|2,0,0]=4 248 B9R0.10 CC(C)OC(=O)C(C)(C)Br TS20691 [1,1,0,0,0,0|1,0,0]=3 249 B9R0.20 CCCCCC(C)(CC)O TS40235 [1,1,0,0,0,0|1,0,1]=4 250 B9R0.22 CCC(C)CC(C)(CC)O TS07025 [1,1,0,0,0,0|1,0,1]=4 251 B9R0.51 CCCCC(C)(C(C)C)O TS07023 [1,1,0,0,0,0|1,0,1]=4 252 B9R0.64 CCC(C)(CCC(C)C)O TS07021 [1,1,0,0,0,0|1,0,1]=4 253 B9R0.66 CCCCC(C)(CCC)O TS07022 [1,1,0,0,0,0|1,0,1]=4 254 B9R0.67 CCCCC(CC)(CC)O TS40241 [1,1,0,0,0,0|1,0,1]=4 255 B11R0.349 CCC(C)(C(=O)C)C(=O)OCC TS13185 [0,2,0,0,0,0|0,0,1]=3 256 B11R0.247 CCCCC(C(=O)OCC)(F)F TS47881 [0,2,0,0,0,0|2,0,0]=4 257 B11R0.252 CCC(CC)(CC)C(=O)OCC TS45517 [0,2,0,0,0,0|1,0,0]=3 258 B9R1.5 C1CCNC(=O)C(C1)N TS05359 [1,0,0,1,0,0|2,0,0]=4 259 B9R1.5 C1CCNC(=O)[C@@H](C1)N TS59665 [1,0,0,1,0,0|2,0,0]=4 260 B9R1.5 C1CCNC(=O)[C@H](C1)N TS05365 [1,0,0,1,0,0|2,0,0]=4 261 B9R1.5 CN1CCCCCC1=O TS36239 [1,0,0,1,0,0|2,0,0]=4 262 B9R1.15 CCC1C(=O)NCCN1 TS05358 [1,0,0,1,0,0|2,0,0]=4 263 B9R1.15 COC1CCCCC1=O TS05343 [1,0,0,1,0,0|2,0,0]=4 264 B9R1.15 COC1CCCNC1=O TS00160 [1,0,0,1,0,0|2,0,0]=4 265 B9R1.15 CO[C@H]1CCCCC1=O TS36300 [1,0,0,1,0,0|2,0,0]=4 266 B9R1.15 CSC1CCCCC1=O TS40228 [1,0,0,1,0,0|2,0,0]=4 267 B9R1.37 CC1C(=C(C(=O)O1)O)C TS36275 [1,0,0,1,0,0|0,0,2]=4 268 B9R1.69 CC1CCC(C(=O)C1)C TS05183 [1,0,0,1,0,0|1,0,0]=3 269 B9R1.73 CCOC(=O)C1CCC1 TS59781 [1,0,0,1,0,0|0,0,0]=2 270 B9R1.73 CCOC(=O)C1CNC1 TS42980 [1,0,0,1,0,0|1,0,0]=3 271 B9R1.74 CCOC(=O)C1(CC1)C TS77135 [1,0,0,1,0,0|0,0,0]=2 272 B9R1.74 CCOC(=O)C1(CC1)N TS00390 [1,0,0,1,0,0|1,0,0]=3 273 B9R1.183 CCOC(=O)C1CC1C TS32692 [1,0,0,1,0,0|0,0,0]=2 274 B9R1.183 CCOC(=O)[C@@H]1C[C@H]1F TS36653 [1,0,0,1,0,0|1,0,0]=3 275 B9R1.183 CCOC(=O)[C@@H]1[C@@H](O1)C TS05523 [1,0,0,1,0,0|0,0,0]=2 276 B9R1.40 CC1(CCCCC1=O)C TS05203 [1,0,0,1,0,0|1,0,0]=3 277 B9R1.40 CC1(CCCCC1=O)Cl TS07287 [1,0,0,1,0,0|1,0,0]=3 278 B9R1.40 CC1(CCCOC1=O)C TS36287 [1,0,0,1,0,0|1,0,0]=3 279 B9R1.40 CC1(CNCCC1=O)C TS90878 [1,0,0,1,0,0|2,0,0]=4 280 B9R1.138 CC1CCC(C1=O)(C)C TS05175 [1,0,0,1,0,0|1,0,0]=3 281 B9R1.38 CC1CC(=O)C(C1)(C)C TS05199 [1,0,0,1,0,0|2,0,0]=4 282 B9R1.118 CCC1(CCCCC1)O TS77179 [1,0,0,1,0,0|1,0,1]=4 283 B9R1.148 CC1(CCCCCC1)O TS05376 [1,0,0,1,0,0|1,0,1]=4 284 B11R1.840 CCOC(=O)CC1(COC1)N TS92183 [0,0,0,1,0,1|2,0,0]=4 285 B11R1.979 C[C@]1([C@@H]([C@H](OC1=O)CO)O)F TS92384 [0,1,0,1,0,0|2,0,0]=4 286 B11R1.819 CCOC(=O)C1(CCCC1)O TS10981 [0,1,0,1,0,0|0,0,0]=2 287 B11R1.833 CCOC(=O)C1(CC(=O)C1)C TS92127 [0,1,0,1,0,0|1,0,1]=4 288 B11R1.833 CCOC(=O)[C@]1(C[C@@H](C1)N)C TS92211 [0,1,0,1,0,0|1,0,0]=3 289 B11R1.833 CCOC(=O)[C@]1(C[C@@H](C1)O)C TS92623 [0,1,0,1,0,0|1,0,0]=3 290 B11R1.833 CCOC(=O)[C@]1(C[C@H](C1)N)C TS91893 [0,1,0,1,0,0|1,0,0]=3 291 B11R1.833 CCOC(=O)[C@]1(C[C@H](C1)O)C TS91815 [0,1,0,1,0,0|1,0,0]=3 292 B11R1.834 CCOC(=O)C1(CC1C=C)N TS41517 [0,1,0,1,0,0|1,0,1]=4 293 B11R1.831 CCC1(CCC1)C(=O)OCC TS41652 [0,1,0,1,0,0|1,0,0]=3 294 B11R1.831 CCOC(=O)C1(CCC1)C#N TS41270 [0,1,0,1,0,0|1,0,0]=3 295 B9R0.34 CCC(=O)CC(=O)OCC TS01475 [1,0,0,0,0,1|0,0,2]=4 296 B9R0.34 CCC(C)OC(=O)C=CC TS37594 [1,0,0,0,0,1|1,0,1]=4 297 B9R0.34 CCOC(=O)C=C(C)CBr TS20309 [1,0,0,0,0,1|1,0,1]=4 298 B9R0.34 CCOC(=O)C=C(C)NC TS02839 [1,0,0,0,0,1|1,0,1]=4 299 B9R0.34 CCOC(=O)CC(C)SC TS11613 [1,0,0,0,0,1|1,0,0]=3 300 B9R0.34 CCOC(=O)C[C@@H](CBr)O TS21056 [1,0,0,0,0,1|1,0,0]=3 301 B9R0.34 CCOC(=O)C[C@@H](CCl)O TS08648 [1,0,0,0,0,1|1,0,0]=3 302 B9R0.34 CCOC(=O)C[C@H](CBr)O TS21055 [1,0,0,0,0,1|1,0,0]=3 303 B9R0.34 CCOC(=O)C[C@H](CCl)O TS39748 [1,0,0,0,0,1|1,0,0]=3 304 B9R0.44 CCOC(=O)CC(C)(C)C TS06982 [1,0,0,0,0,1|1,0,0]=3 305 B9R0.44 CCOC(=O)C[Si](C)(C)C TS11315 [1,0,0,0,0,1|1,1,0]=4