0 B8R0.16 CCN(CC)CC(=O)C TS36425 [0,0,0,0,0,0|3,0,0]=3 1 B8R0.16 CN(C)CC(OC)OC TS05841 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.2 C([C@H](CN)O)C(=O)O TS32382 [1,0,0,0,0,0|3,0,0]=4 3 B7R0.2 CC(=CC(=O)C)NC TS04388 [1,0,0,0,0,0|1,0,2]=4 4 B7R0.2 CC(=CC(=O)C)O[Ir] TS78858 [1,0,0,0,0,0|1,0,2]=4 5 B7R0.2 CC(=CC(=O)C)O[Tl] TS74884 [1,0,0,0,0,0|1,0,2]=4 6 B7R0.2 CC(=O)CC(=O)NC TS04520 [1,0,0,0,0,0|1,0,2]=4 7 B7R0.2 CC(=O)CC(=O)OC TS32187 [1,0,0,0,0,0|0,0,2]=3 8 B7R0.2 CCC(=O)CC(=O)C TS00653 [1,0,0,0,0,0|1,0,2]=4 9 B7R0.2 CCC(C)CC(=C)C TS04345 [1,0,0,0,0,0|2,0,0]=3 10 B7R0.2 CCC(C)CC(=O)C TS04467 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.2 CCC(C)CC(=O)Cl TS05950 [1,0,0,0,0,0|2,0,0]=3 12 B7R0.2 CCC(C)CC(=O)O TS04597 [1,0,0,0,0,0|2,0,0]=3 13 B7R0.2 CCC(C)CC(C)C TS04502 [1,0,0,0,0,0|2,0,1]=4 14 B7R0.2 CCC(C)CC(C)N TS04563 [1,0,0,0,0,0|2,0,1]=4 15 B7R0.2 CCC(C)CC(C)N TS10102 [1,0,0,0,0,0|2,0,1]=4 16 B7R0.2 CCC(C)CC(C)O TS32253 [1,0,0,0,0,0|1,0,2]=4 17 B7R0.2 CCC(C)NC(=O)N TS04603 [1,0,0,0,0,0|3,0,0]=4 18 B7R0.2 CCC(C)OC(=O)C TS32210 [1,0,0,0,0,0|2,0,0]=3 19 B7R0.2 CCC(C)OC(=O)Cl TS06133 [1,0,0,0,0,0|3,0,0]=4 20 B7R0.2 CCC(CC(=C)C)O TS32110 [1,0,0,0,0,0|2,0,0]=3 21 B7R0.2 CCC(CC(=O)O)N TS04672 [1,0,0,0,0,0|3,0,0]=4 22 B7R0.2 CCC(CC(=O)O)O TS32318 [1,0,0,0,0,0|2,0,0]=3 23 B7R0.2 CCC(CC(C)C)O TS32246 [1,0,0,0,0,0|2,0,1]=4 24 B7R0.2 CCC(CC(C)O)O TS32344 [1,0,0,0,0,0|1,0,2]=4 25 B7R0.2 CC[C@@H](C)CC(=O)O TS04583 [1,0,0,0,0,0|2,0,0]=3 26 B7R0.2 CC[C@@H](CC(=O)O)N TS32279 [1,0,0,0,0,0|3,0,0]=4 27 B7R0.2 CC[C@H](C)CC(=O)O TS04594 [1,0,0,0,0,0|2,0,0]=3 28 B7R0.2 CC[C@H](CC(=O)O)N TS04666 [1,0,0,0,0,0|3,0,0]=4 29 B7R0.2 COC(=O)CC(=O)[O-] TS04695 [1,0,0,0,0,0|1,0,2]=4 30 B7R0.12 CCC(CC)OC=O TS32223 [1,0,0,0,0,0|3,0,0]=4 31 B7R0.12 CCCC(CC)CC TS04503 [1,0,0,0,0,0|2,0,1]=4 32 B7R0.12 COC(CC#N)OC TS04523 [1,0,0,0,0,0|1,0,1]=3 33 B7R0.12 COC(CCBr)OC TS09492 [1,0,0,0,0,0|1,0,1]=3 34 B7R0.12 COC(CSC)OC TS06112 [1,0,0,0,0,0|1,0,0]=2 35 B7R0.12 COCC(OC)OC TS16403 [1,0,0,0,0,0|1,0,0]=2 36 B7R0.12 CO[SiH](CC=C)OC TS05785 [1,0,0,0,0,0|0,1,1]=3 37 B7R0.12 CO[SiH](CC=C)OC TS05786 [1,0,0,0,0,0|0,1,1]=3 38 B9R0.14 CCCC(CC)CC(=O)O TS40205 [0,1,0,0,0,0|3,0,0]=4 39 B9R0.26 CC(CC(OC)OC)OC TS40634 [0,1,0,0,0,0|0,0,2]=3 40 B9R0.26 CCC(=CC(=O)OC)OC TS06937 [0,1,0,0,0,0|1,0,2]=4 41 B9R0.26 CCN(CC)CC(=O)OC TS07111 [0,1,0,0,0,0|3,0,0]=4 42 B9R0.41 CN(C)C(=O)C(OC)OC TS40511 [0,1,0,0,0,0|2,0,1]=4 43 B9R0.52 COC(CC(F)(F)F)OC TS41857 [0,1,0,0,0,0|2,0,1]=4 44 B9R0.63 CC(=O)CP(=O)(OC)OC TS01453 [0,1,0,0,0,0|1,0,0]=2 45 B9R0.63 CC(=O)NP(=O)(OC)SC TS48407 [0,1,0,0,0,0|2,1,0]=4 46 B9R0.63 CC(C)C[Si](C)(OC)OC TS42517 [0,1,0,0,0,0|1,1,1]=4 47 B9R0.63 COP(=O)(CC(=O)[O-])OC TS38948 [0,1,0,0,0,0|2,0,0]=3 48 B9R1.2 CCN1CCCC(=O)C1 TS11774 [0,0,0,1,0,0|3,0,0]=4 49 B9R1.2 CCN1CCCC(=O)C1 TS36243 [0,0,0,1,0,0|3,0,0]=4 50 B9R1.2 COC1=CC(=O)CCC1 TS05158 [0,0,0,1,0,0|1,0,2]=4 51 B9R1.13 C1CCC(C1)CC(=O)Cl TS07289 [0,0,0,1,0,0|3,0,0]=4 52 B9R1.13 C1CCC(C1)CC(=O)O TS27085 [0,0,0,1,0,0|3,0,0]=4 53 B9R1.13 C1C[C@@H](NC1)CC(=O)O TS91258 [0,0,0,1,0,0|3,0,0]=4 54 B9R1.13 C1C[C@H](NC1)CC(=O)O TS36411 [0,0,0,1,0,0|3,0,0]=4 55 B9R1.13 CC(=O)CC1CCC=C1 TS36006 [0,0,0,1,0,0|2,0,1]=4 56 B9R1.13 CC(=O)CC1CCCC1 TS05185 [0,0,0,1,0,0|2,0,0]=3 57 B7R0.15 CC(=O)C(OC)OC TS01675 [0,0,0,0,1,0|0,0,0]=1 58 B7R0.15 CCC(CC)C(=C)C TS31969 [0,0,0,0,1,0|3,0,0]=4 59 B7R0.15 CCC(CC)C(=O)C TS04458 [0,0,0,0,1,0|2,0,0]=3 60 B7R0.15 CCC(CC)C(=O)Cl TS05951 [0,0,0,0,1,0|3,0,0]=4 61 B7R0.15 CCC(CC)C(=O)O TS04596 [0,0,0,0,1,0|3,0,0]=4 62 B7R0.15 CCC(CC)C(=O)[O-] TS28700 [0,0,0,0,1,0|3,0,0]=4 63 B7R0.15 CCN(CC)C(=O)C TS32172 [0,0,0,0,1,0|3,0,0]=4 64 B7R0.15 CN(C)C(OC)OC TS01575 [0,0,0,0,1,0|2,0,0]=3 65 B9R0.43 CCC(CC)COC(=O)C TS40199 [0,0,0,0,0,1|2,0,0]=3 66 B9R0.43 CCN(CC)CCC(=O)C TS40103 [0,0,0,0,0,1|3,0,0]=4 67 B9R0.43 COC(CC[N+](=O)[O-])OC TS85269 [0,0,0,0,0,1|2,0,0]=3 68 B6R0.1 CC(CC=O)SC TS32354 [2,0,0,0,0,0|0,1,0]=3 69 B6R0.1 CC(CCO)OC TS04039 [2,0,0,0,0,0|0,0,2]=4 70 B6R0.1 CC(COC)OC TS94098 [2,0,0,0,0,0|1,0,0]=3 71 B6R0.1 CCC(C)C=CC TS03791 [2,0,0,0,0,0|1,0,1]=4 72 B6R0.1 CCC(C)CC=C TS03804 [2,0,0,0,0,0|1,0,1]=4 73 B6R0.1 CCC(C)CC=O TS31513 [2,0,0,0,0,0|1,0,0]=3 74 B6R0.1 CCC(C=CC)O TS03868 [2,0,0,0,0,0|1,0,1]=4 75 B6R0.1 CCC(CC=C)O TS31532 [2,0,0,0,0,0|1,0,1]=4 76 B6R0.1 CCC(COC)O TS04038 [2,0,0,0,0,0|2,0,0]=4 77 B6R0.1 CCCC(C)CC TS03886 [2,0,0,0,0,0|1,0,1]=4 78 B6R0.1 CCCC(C)NC TS03920 [2,0,0,0,0,0|1,0,1]=4 79 B6R0.1 CCCC(CC)O TS31611 [2,0,0,0,0,0|1,0,1]=4 80 B6R0.2 CC(=CC(=O)C)C TS31432 [2,0,0,0,0,0|0,0,2]=4 81 B6R0.2 CC(=O)CC(=O)C TS03846 [2,0,0,0,0,0|0,0,2]=4 82 B6R0.2 CC(=O)CC(=O)O TS31585 [2,0,0,0,0,0|0,0,2]=4 83 B6R0.2 CC(=O)CN(C)C TS31555 [2,0,0,0,0,0|1,0,0]=3 84 B6R0.2 CC(=SC(=O)C)O TS05893 [2,0,0,0,0,0|1,0,1]=4 85 B6R0.2 CC(C)CC(=C)C TS31451 [2,0,0,0,0,0|1,0,0]=3 86 B6R0.2 CC(C)CC(=O)C TS31526 [2,0,0,0,0,0|0,0,0]=2 87 B6R0.2 CC(C)CC(=O)Cl TS32446 [2,0,0,0,0,0|1,0,0]=3 88 B6R0.2 CC(C)CC(=O)N TS31557 [2,0,0,0,0,0|1,0,0]=3 89 B6R0.2 CC(C)CC(=O)O TS03936 [2,0,0,0,0,0|1,0,0]=3 90 B6R0.2 CC(C)CC(=O)[O-] TS32589 [2,0,0,0,0,0|1,0,0]=3 91 B6R0.2 CC(C)CC(C)Br TS42854 [2,0,0,0,0,0|1,0,1]=4 92 B6R0.2 CC(C)CC(C)C TS03884 [2,0,0,0,0,0|1,0,1]=4 93 B6R0.2 CC(C)CC(C)Cl TS04844 [2,0,0,0,0,0|1,0,1]=4 94 B6R0.2 CC(C)CC(C)N TS31566 [2,0,0,0,0,0|1,0,1]=4 95 B6R0.2 CC(C)CC(C)N TS94386 [2,0,0,0,0,0|1,0,1]=4 96 B6R0.2 CC(C)CC(C)O TS31610 [2,0,0,0,0,0|0,0,2]=4 97 B6R0.2 CC(C)CN(C)C TS03921 [2,0,0,0,0,0|2,0,0]=4 98 B6R0.2 CC(C)NC(=O)N TS31602 [2,0,0,0,0,0|2,0,0]=4 99 B6R0.2 CC(C)OC(=O)C TS01509 [2,0,0,0,0,0|1,0,0]=3 100 B6R0.2 CC(C)OC(=O)Cl TS59649 [2,0,0,0,0,0|2,0,0]=4 101 B6R0.2 CC(C)OC(=O)N TS03993 [2,0,0,0,0,0|2,0,0]=4 102 B6R0.2 CC(C=C(C)C)O TS03862 [2,0,0,0,0,0|1,0,1]=4 103 B6R0.2 CC(CC(=C)C)O TS31505 [2,0,0,0,0,0|1,0,0]=3 104 B6R0.2 CC(CC(=O)O)Cl TS04943 [2,0,0,0,0,0|2,0,0]=4 105 B6R0.2 CC(CC(=O)O)O TS31666 [2,0,0,0,0,0|1,0,0]=3 106 B6R0.2 CC(CC(=O)[O-])O TS94900 [2,0,0,0,0,0|1,0,0]=3 107 B6R0.2 CC(CC(C)O)O TS04029 [2,0,0,0,0,0|0,0,2]=4 108 B6R0.2 CC(CN(C)C)O TS04008 [2,0,0,0,0,0|2,0,0]=4 109 B6R0.2 CN(C)CC(=O)O TS08905 [2,0,0,0,0,0|2,0,0]=4 110 B6R0.2 CN(C)CC(=O)O TS37315 [2,0,0,0,0,0|2,0,0]=4 111 B6R0.2 CN(C)CC(=O)[O-] TS36048 [2,0,0,0,0,0|2,0,0]=4 112 B6R0.2 CN(C)CC(=O)[O-] TS37510 [2,0,0,0,0,0|2,0,0]=4 113 B6R0.2 C[C@@H](CC(=O)O)N TS33131 [2,0,0,0,0,0|2,0,0]=4 114 B6R0.2 C[C@@H](CC(=O)O)N TS37311 [2,0,0,0,0,0|2,0,0]=4 115 B6R0.2 C[C@@H](CC(=O)O)O TS31673 [2,0,0,0,0,0|1,0,0]=3 116 B6R0.2 C[C@@H](CC(=O)[O-])O TS05129 [2,0,0,0,0,0|1,0,0]=3 117 B6R0.2 C[C@@H](CN(C)C)O TS04004 [2,0,0,0,0,0|2,0,0]=4 118 B6R0.2 C[C@@H](C[C@H](C)O)O TS04035 [2,0,0,0,0,0|0,0,2]=4 119 B6R0.2 C[C@H](CC(=O)O)N TS00214 [2,0,0,0,0,0|2,0,0]=4 120 B6R0.2 C[C@H](CC(=O)[O-])O TS05130 [2,0,0,0,0,0|1,0,0]=3 121 B6R0.2 C[C@H](C[C@@H](C)O)O TS04043 [2,0,0,0,0,0|0,0,2]=4 122 B6R0.4 CC(=O)C=COC TS03850 [2,0,0,0,0,0|0,0,2]=4 123 B6R0.4 CC(=O)CCC=C TS31440 [2,0,0,0,0,0|1,0,1]=4 124 B6R0.4 CC(=O)CCCCl TS03260 [2,0,0,0,0,0|2,0,0]=4 125 B6R0.4 CC(=O)CCCO TS39779 [2,0,0,0,0,0|2,0,0]=4 126 B6R0.4 CC(=O)CCSC TS32359 [2,0,0,0,0,0|0,1,0]=3 127 B6R0.4 CCCCC(=C)C TS31452 [2,0,0,0,0,0|2,0,0]=4 128 B6R0.4 CCCCC(=O)Br TS42846 [2,0,0,0,0,0|2,0,0]=4 129 B6R0.4 CCCCC(=O)C TS31529 [2,0,0,0,0,0|1,0,0]=3 130 B6R0.4 CCCCC(=O)Cl TS32451 [2,0,0,0,0,0|2,0,0]=4 131 B6R0.4 CCCCC(=O)N TS31554 [2,0,0,0,0,0|2,0,0]=4 132 B6R0.4 CCCCC(=O)O TS03958 [2,0,0,0,0,0|2,0,0]=4 133 B6R0.4 CCCCC(=O)[O-] TS04789 [2,0,0,0,0,0|2,0,0]=4 134 B6R0.4 CCCCC(=O)[O-] TS30457 [2,0,0,0,0,0|2,0,0]=4 135 B6R0.4 CCCOC(=O)C TS03949 [2,0,0,0,0,0|2,0,0]=4 136 B6R0.4 CCCSC(=O)C TS32364 [2,0,0,0,0,0|2,0,0]=4 137 B6R0.4 CCSCC(=O)C TS32360 [2,0,0,0,0,0|2,0,0]=4 138 B6R0.4 CNCCC(=O)O TS03990 [2,0,0,0,0,0|2,0,0]=4 139 B6R0.4 COCCC(=O)O TS31660 [2,0,0,0,0,0|1,0,0]=3 140 B6R0.9 B(CC)(CC)OC TS31480 [2,0,0,0,0,0|2,0,0]=4 141 B6R0.9 B(OC)(OC)OC TS31651 [2,0,0,0,0,0|2,0,0]=4 142 B6R0.9 CCC(OC)OC TS04030 [2,0,0,0,0,0|0,0,0]=2 143 B6R0.9 CCP(OC)OC TS32484 [2,0,0,0,0,0|1,0,0]=3 144 B6R0.9 COC(C=C)OC TS31593 [2,0,0,0,0,0|0,0,1]=3 145 B6R0.9 COC(C=O)OC TS31669 [2,0,0,0,0,0|0,0,0]=2 146 B6R0.9 COC(CBr)OC TS00844 [2,0,0,0,0,0|1,0,0]=3 147 B6R0.9 COC(CCl)OC TS36029 [2,0,0,0,0,0|1,0,0]=3 148 B6R0.9 COC(CN)OC TS34632 [2,0,0,0,0,0|1,0,0]=3 149 B6R0.9 COC(OC)OC TS00293 [2,0,0,0,0,0|1,0,0]=3 150 B6R0.9 COP(OC)OC TS05002 [2,0,0,0,0,0|2,0,0]=4 151 B6R0.9 CO[SiH](OC)OC TS32526 [2,0,0,0,0,0|1,1,0]=4 152 B6R0.9 [BH-](OC)(OC)OC TS05296 [2,0,0,0,0,0|2,0,0]=4 153 B8R0.2 CC(=O)C(C(=O)OC)Cl TS09961 [1,1,0,0,0,0|0,0,2]=4 154 B8R0.2 CC(=O)C(C(=O)OC)Cl TS93822 [1,1,0,0,0,0|0,0,2]=4 155 B8R0.2 CC(=O)C(C(=O)OC)N TS05637 [1,1,0,0,0,0|0,0,2]=4 156 B8R0.2 CC(C(C(=O)O)Br)OC TS53798 [1,1,0,0,0,0|1,0,0]=3 157 B8R0.2 CC(C(C(=O)O)N)SC TS07582 [1,1,0,0,0,0|1,1,0]=4 158 B8R0.2 CCC(C(C(=O)O)N)O TS05812 [1,1,0,0,0,0|2,0,0]=4 159 B8R0.2 CCC(C)C(C(=O)O)Br TS51945 [1,1,0,0,0,0|2,0,0]=4 160 B8R0.2 CCC(C)C(C(=O)O)N TS05653 [1,1,0,0,0,0|2,0,0]=4 161 B8R0.2 CCC(C)C(C(=O)O)N TS36597 [1,1,0,0,0,0|2,0,0]=4 162 B8R0.2 CCC(C)C(C)C(=O)C TS05380 [1,1,0,0,0,0|1,0,0]=3 163 B8R0.2 CC[C@@H](C)[C@@H](C(=O)O)N TS05657 [1,1,0,0,0,0|2,0,0]=4 164 B8R0.2 CC[C@@H](C)[C@H](C(=O)O)N TS36608 [1,1,0,0,0,0|2,0,0]=4 165 B8R0.2 CC[C@@H]([C@@H](C(=O)O)N)O TS05821 [1,1,0,0,0,0|2,0,0]=4 166 B8R0.2 CC[C@H](C)[C@@H](C(=O)N)N TS43164 [1,1,0,0,0,0|2,0,0]=4 167 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)Cl TS09971 [1,1,0,0,0,0|2,0,0]=4 168 B8R0.2 CC[C@H](C)[C@@H](C(=O)O)N TS09198 [1,1,0,0,0,0|2,0,0]=4 169 B8R0.2 CC[C@H](C)[C@H](C(=O)O)N TS01766 [1,1,0,0,0,0|2,0,0]=4 170 B8R0.2 CC[C@H]([C@H](C(=O)O)N)O TS05820 [1,1,0,0,0,0|2,0,0]=4 171 B8R0.2 C[C@@H]([C@@H](C(=O)O)N)OC TS22900 [1,1,0,0,0,0|1,0,0]=3 172 B8R0.2 C[C@H]([C@@H](C(=O)O)N)OC TS05815 [1,1,0,0,0,0|1,0,0]=3 173 B8R0.2 C[C@H]([C@H](C(=O)O)N)OC TS05816 [1,1,0,0,0,0|1,0,0]=3 174 B8R0.5 CC(COC)OC(=O)C TS05714 [1,1,0,0,0,0|1,0,0]=3 175 B8R0.5 CCCC(C)CC(=C)C TS36185 [1,1,0,0,0,0|2,0,0]=4 176 B8R0.5 CCCC(C)CC(=O)C TS05394 [1,1,0,0,0,0|1,0,0]=3 177 B8R0.5 CCCC(C)CC(=O)O TS05545 [1,1,0,0,0,0|2,0,0]=4 178 B8R0.5 CCCC(C)OC(=O)C TS05542 [1,1,0,0,0,0|2,0,0]=4 179 B8R0.5 CCC[C@H](C)CC(=O)O TS36494 [1,1,0,0,0,0|2,0,0]=4 180 B8R0.5 CCOC(=O)CC(=O)C TS41089 [1,1,0,0,0,0|0,0,2]=4 181 B8R0.5 CCOC(=O)CC(=O)C TS59779 [1,1,0,0,0,0|0,0,2]=4 182 B8R0.19 CCC(=O)CC(=O)OC TS02305 [1,1,0,0,0,0|0,0,2]=4 183 B8R0.19 CCC(C)CC(=O)CC TS36340 [1,1,0,0,0,0|1,0,0]=3 184 B8R0.19 CCC(C)CC(=O)OC TS36498 [1,1,0,0,0,0|1,0,0]=3 185 B8R0.19 CCC(C)NC(=O)CCl TS40798 [1,1,0,0,0,0|2,0,0]=4 186 B8R0.19 CC[C@@H](CC(=O)OC)O TS64924 [1,1,0,0,0,0|1,0,0]=3 187 B8R0.19 CC[C@H](CC(=O)OC)O TS05724 [1,1,0,0,0,0|1,0,0]=3 188 B8R0.19 COC(=O)CC(=O)CCl TS56294 [1,1,0,0,0,0|0,0,2]=4 189 B8R0.19 COC(=O)CC(=O)OC TS22955 [1,1,0,0,0,0|0,0,2]=4 190 B8R0.19 COC(=O)CC(CCl)O TS22838 [1,1,0,0,0,0|2,0,0]=4 191 B8R0.19 COC(=O)C[C@@H](CCl)O TS10244 [1,1,0,0,0,0|2,0,0]=4 192 B8R0.19 COC(=O)C[C@@H](CO)O TS05870 [1,1,0,0,0,0|2,0,0]=4 193 B8R0.19 COC(=O)C[C@H](CCl)O TS10243 [1,1,0,0,0,0|2,0,0]=4 194 B8R0.23 CC(=C)CC(C(=C)C)O TS05198 [1,1,0,0,0,0|2,0,0]=4 195 B8R0.23 CC(C(=O)C)NC(=O)C TS36395 [1,1,0,0,0,0|2,0,0]=4 196 B8R0.23 CC(C(=O)C)OC(=O)C TS05530 [1,1,0,0,0,0|2,0,0]=4 197 B8R0.23 CC(C)C(CC(=C)C)O TS05395 [1,1,0,0,0,0|2,0,0]=4 198 B8R0.23 CC(CC(=O)C)C(=O)O TS05533 [1,1,0,0,0,0|2,0,0]=4 199 B8R0.23 CC(CC(=O)O)C(=O)C TS05531 [1,1,0,0,0,0|2,0,0]=4 200 B8R0.34 CC(=O)CC(C)(C)OC TS05560 [1,1,0,0,0,0|0,0,0]=2 201 B8R0.34 CC(=O)CC(C)(C)SC TS40467 [1,1,0,0,0,0|0,1,0]=3 202 B8R0.34 CC(CC(C)(C)OC)O TS36693 [1,1,0,0,0,0|0,0,2]=4 203 B8R0.34 CCC(C)(C)CC(=C)C TS05226 [1,1,0,0,0,0|2,0,0]=4 204 B8R0.34 CCC(C)(C)OC(=O)C TS05562 [1,1,0,0,0,0|2,0,0]=4 205 B8R0.34 CCC(C)(CC(=C)C)O TS36342 [1,1,0,0,0,0|2,0,0]=4 206 B8R0.34 CCC(C)(CC(=O)O)O TS05719 [1,1,0,0,0,0|2,0,0]=4 207 B8R0.11 COC(C=CC=O)OC TS05515 [1,1,0,0,0,0|0,0,1]=3 208 B8R0.11 COC(CCC#N)OC TS02036 [1,1,0,0,0,0|0,0,2]=4 209 B8R0.11 COC(CCCBr)OC TS39743 [1,1,0,0,0,0|0,0,1]=3 210 B8R0.11 COC(CCCCl)OC TS71066 [1,1,0,0,0,0|0,0,1]=3 211 B8R0.11 COC(CCCN)OC TS05836 [1,1,0,0,0,0|0,0,1]=3 212 B8R0.11 COC(CN=C=O)OC TS05639 [1,1,0,0,0,0|0,0,1]=3 213 B8R0.11 COC(CN=C=S)OC TS07363 [1,1,0,0,0,0|0,1,1]=4 214 B8R0.11 COC=CC(OC)OC TS05721 [1,1,0,0,0,0|0,0,1]=3 215 B8R0.11 COCCC(OC)OC TS05904 [1,1,0,0,0,0|0,0,1]=3 216 B8R0.20 COC(C(=O)OC)OC TS05874 [1,1,0,0,0,0|1,0,1]=4 217 B8R0.22 CCCC(CC=O)SC TS40466 [1,1,0,0,0,0|1,1,0]=4 218 B8R0.22 COC(CSC)CSC TS43150 [1,1,0,0,0,0|1,1,0]=4 219 B8R0.31 COP(=O)(CC=C)OC TS07633 [1,1,0,0,0,0|1,0,1]=4 220 B8R0.18 CC(=O)N(C(=O)C)OC TS05649 [0,1,0,0,1,0|2,0,0]=4 221 B8R0.18 CCC(C(=O)C)C(=O)C TS36296 [0,1,0,0,1,0|2,0,0]=4 222 B8R0.36 CC(N(C)C)(OC)OC TS05832 [0,1,0,0,1,0|2,0,0]=4 223 B8R0.36 CCC(C)(CC)C(=O)C TS05387 [0,1,0,0,1,0|2,0,0]=4 224 B10R0.79 CCOC(CC(=O)O)OCC TS11530 [0,2,0,0,0,0|1,0,0]=3 225 B10R0.79 CCOC(CN(C)C)OCC TS42341 [0,2,0,0,0,0|2,0,0]=4 226 B10R0.79 CCOC(OCC)OC(=O)C TS32685 [0,2,0,0,0,0|1,0,0]=3 227 B10R0.134 COC(=O)CP(=O)(OC)OC TS48187 [0,2,0,0,0,0|1,0,0]=3 228 B10R0.145 COC(CC(OC)OC)OC TS16404 [0,2,0,0,0,0|0,0,2]=4 229 B8R1.1 CCC1CCC(=O)C1 TS31941 [1,0,0,1,0,0|1,0,0]=3 230 B8R1.1 CCC1CCC(=O)O1 TS04438 [1,0,0,1,0,0|2,0,0]=4 231 B8R1.4 C1CNC(=O)CC1O TS03134 [1,0,0,1,0,0|2,0,0]=4 232 B8R1.4 C1CNC(=O)C[C@@H]1O TS04536 [1,0,0,1,0,0|2,0,0]=4 233 B8R1.4 CC1CC(=O)CCN1 TS59976 [1,0,0,1,0,0|1,0,0]=3 234 B8R1.4 CC1CC(=O)CCO1 TS87534 [1,0,0,1,0,0|0,0,0]=2 235 B8R1.4 CC1CC(CCO1)O TS88683 [1,0,0,1,0,0|0,0,2]=4 236 B8R1.4 CC1CCCC(=O)O1 TS04447 [1,0,0,1,0,0|2,0,0]=4 237 B8R1.4 CC1CCOC(=O)C1 TS32063 [1,0,0,1,0,0|2,0,0]=4 238 B8R1.4 CN1CCCC(=O)C1 TS46998 [1,0,0,1,0,0|2,0,0]=4 239 B8R1.4 C[C@@H]1CC(=O)CCO1 TS91794 [1,0,0,1,0,0|0,0,0]=2 240 B8R1.4 C[C@@H]1CCCC(=O)C1 TS31940 [1,0,0,1,0,0|1,0,0]=3 241 B8R1.4 C[C@@H]1CCCC(=O)O1 TS04430 [1,0,0,1,0,0|2,0,0]=4 242 B8R1.4 C[C@H]1CC(=O)CCO1 TS86799 [1,0,0,1,0,0|0,0,0]=2 243 B8R1.18 CC1CC(=O)CC1C TS31939 [1,0,0,1,0,0|1,0,0]=3 244 B8R1.18 C[C@@H]1CC(=O)C[C@@H]1C TS04316 [1,0,0,1,0,0|1,0,0]=3 245 B8R1.34 C1CC(C1)CC(=O)O TS32065 [1,0,0,1,0,0|2,0,0]=4 246 B8R1.2 C1CCOC(C1)ON TS59328 [1,0,0,1,0,0|1,0,1]=4 247 B8R1.2 COC1CCCC=C1 TS31935 [1,0,0,1,0,0|1,0,1]=4 248 B8R1.2 COC1CCCCC1 TS32092 [1,0,0,1,0,0|1,0,1]=4 249 B8R1.2 COC1CCCNC1 TS86602 [1,0,0,1,0,0|2,0,0]=4 250 B8R1.2 CO[C@@H]1CCCNC1 TS90956 [1,0,0,1,0,0|2,0,0]=4 251 B8R1.2 CO[C@@H]1CCCNC1 TS90967 [1,0,0,1,0,0|2,0,0]=4 252 B8R1.2 CO[C@H]1CCCNC1 TS86418 [1,0,0,1,0,0|2,0,0]=4 253 B8R1.2 CO[C@H]1CCCNC1 TS90968 [1,0,0,1,0,0|2,0,0]=4 254 B8R1.8 C1COC(O1)CCBr TS47043 [1,0,0,1,0,0|1,0,1]=4 255 B8R1.8 C1COC(O1)CCCl TS06134 [1,0,0,1,0,0|1,0,1]=4 256 B8R1.8 C1COC(O1)CCN TS39612 [1,0,0,1,0,0|1,0,1]=4 257 B8R1.8 C1COC(O1)C[Mg]Br TS51359 [1,0,0,1,0,0|2,0,0]=4 258 B8R1.8 CNCC1CCCO1 TS32151 [1,0,0,1,0,0|2,0,0]=4 259 B8R1.8 COCC1CCCO1 TS04584 [1,0,0,1,0,0|2,0,0]=4 260 B8R1.60 COC1(COC1)OC TS90095 [1,0,0,1,0,0|1,0,0]=3 261 B8R1.7 C1CC(OC1)C(=O)O TS65650 [0,0,0,1,1,0|2,0,0]=4 262 B8R1.7 C1C[C@@H](OC1)C(=O)O TS46582 [0,0,0,1,1,0|2,0,0]=4 263 B8R1.7 C1C[C@H](OC1)C(=O)O TS08647 [0,0,0,1,1,0|2,0,0]=4 264 B8R1.7 CC(=O)C1CCCC1 TS46943 [0,0,0,1,1,0|2,0,0]=4 265 B8R1.7 CC(=O)C1CCCC1 TS52586 [0,0,0,1,1,0|2,0,0]=4 266 B8R1.7 CN(C)C1OCCO1 TS04669 [0,0,0,1,1,0|2,0,0]=4 267 B10R1.66 C1COC(O1)CCC(=O)O TS07160 [0,0,0,1,0,1|1,0,0]=3 268 B10R1.66 C1COC(O1)CC[N+](=O)[O-] TS40501 [0,0,0,1,0,1|2,0,0]=4 269 B10R1.66 CC(=O)OCC1CCCO1 TS06945 [0,0,0,1,0,1|1,0,0]=3 270 B10R1.18 C1CCOC(C1)CC(=O)O TS60188 [0,1,0,1,0,0|2,0,0]=4 271 B10R1.18 C1COC(CN1)CC(=O)O TS40294 [0,1,0,1,0,0|2,0,0]=4 272 B10R1.18 C1COCC(N1)CC(=O)O TS40297 [0,1,0,1,0,0|2,0,0]=4 273 B10R1.18 CC(=O)CC1CCCCC1 TS06510 [0,1,0,1,0,0|2,0,0]=4 274 B10R1.54 CC1COC(O1)CC(C)C TS06987 [0,1,0,1,0,0|1,0,1]=4 275 B10R1.491 COC1(CC(C1)CBr)OC TS92208 [0,1,0,1,0,0|1,0,1]=4 276 B10R1.491 COC1(CC(C1)CN)OC TS92423 [0,1,0,1,0,0|1,0,1]=4 277 B10R1.491 COC1(CC(C1)CO)OC TS46529 [0,1,0,1,0,0|0,0,2]=4 278 B10R2.71 C1CC2CC(=O)CC1O2 TS92514 [0,0,0,2,0,0|1,0,0]=3 279 B10R2.71 C1C[C@H]2CC(=O)C[C@@H]1N2 TS01613 [0,0,0,2,0,0|2,0,0]=4 280 B10R2.71 C1C[C@H]2CC(=O)C[C@@H]1N2 TS01614 [0,0,0,2,0,0|2,0,0]=4 281 B10R2.316 C1COC2(O1)CC(C2)Br TS91390 [0,0,0,2,0,0|1,0,1]=4 282 B10R2.316 C=C1CC2(C1)OCCO2 TS92493 [0,0,0,2,0,0|1,0,0]=3 283 B6R0.3 CC(=O)C(=O)OC TS31579 [1,0,0,0,1,0|0,0,2]=4 284 B6R0.3 CC(=O)N(C)OC TS56410 [1,0,0,0,1,0|1,0,0]=3 285 B6R0.3 CC(C(=O)C)SC TS32356 [1,0,0,0,1,0|0,1,0]=3 286 B6R0.3 CC(C(=O)O)NC TS31640 [1,0,0,0,1,0|2,0,0]=4 287 B6R0.3 CC(CO)C(=O)C TS03953 [1,0,0,0,1,0|2,0,0]=4 288 B6R0.3 CC=C(C)C(=O)C TS31447 [1,0,0,0,1,0|1,0,1]=4 289 B6R0.3 CCC(C(=C)C)O TS31517 [1,0,0,0,1,0|2,0,0]=4 290 B6R0.3 CCC(C(=O)C)S TS32355 [1,0,0,0,1,0|1,1,0]=4 291 B6R0.3 CCC(C(=O)O)O TS31670 [1,0,0,0,1,0|2,0,0]=4 292 B6R0.3 CCC(C(=O)[O-])O TS05131 [1,0,0,0,1,0|2,0,0]=4 293 B6R0.3 CCC(C)C(=O)C TS31518 [1,0,0,0,1,0|1,0,0]=3 294 B6R0.3 CCC(C)C(=O)Cl TS04836 [1,0,0,0,1,0|2,0,0]=4 295 B6R0.3 CCC(C)C(=O)O TS03945 [1,0,0,0,1,0|2,0,0]=4 296 B6R0.3 CC[C@@H](C(=O)O)O TS08124 [1,0,0,0,1,0|2,0,0]=4 297 B6R0.3 C[C@@H](C(=O)O)NC TS31642 [1,0,0,0,1,0|2,0,0]=4 298 B6R0.3 C[C@@H](C(=O)O)NC TS37312 [1,0,0,0,1,0|2,0,0]=4 299 B6R0.3 C[C@@H](C(=O)O)OC TS31663 [1,0,0,0,1,0|1,0,0]=3 300 B6R0.3 C[C@H](C(=O)N)OC TS31644 [1,0,0,0,1,0|1,0,0]=3 301 B8R0.9 CC(=O)CCC(=O)OC TS05537 [1,0,0,0,0,1|0,0,2]=4 302 B8R0.9 CC(=O)OCC(CO)O TS05871 [1,0,0,0,0,1|2,0,0]=4 303 B8R0.9 CCC(C)CCC(=O)C TS05381 [1,0,0,0,0,1|1,0,0]=3 304 B8R0.9 CCC(C)CCC(=O)O TS36505 [1,0,0,0,0,1|2,0,0]=4 305 B8R0.9 CCC(C)COC(=O)C TS01135 [1,0,0,0,0,1|1,0,0]=3 306 B10R0.77 CN(C)CCCC(OC)OC TS93494 [0,0,0,0,0,2|2,0,0]=4