0 B11R0.148 B(C=CCCCCCCC)(O)O TS12749 [0,0,0,0,0,0|2,0,2]=4 1 B11R0.148 C(CCCCBr)CCCC(=O)O TS26010 [0,0,0,0,0,0|2,0,1]=3 2 B11R0.148 C(CCCCO)CCCC(=O)O TS45811 [0,0,0,0,0,0|2,0,1]=3 3 B11R0.148 C=CCCCCCCCC(=O)O TS12845 [0,0,0,0,0,0|1,0,3]=4 4 B11R0.148 CCCCC=CCCCC(=O)O TS45176 [0,0,0,0,0,0|1,0,3]=4 5 B11R0.148 CCCCCC=CCCC(=O)O TS45160 [0,0,0,0,0,0|1,0,3]=4 6 B11R0.148 CCCCCCCC=CC(=O)O TS12863 [0,0,0,0,0,0|1,0,3]=4 7 B11R0.148 CCCCCCCCCC(=C)C TS12605 [0,0,0,0,0,0|1,0,1]=2 8 B11R0.148 CCCCCCCCCC(=O)C TS45200 [0,0,0,0,0,0|0,0,2]=2 9 B11R0.148 CCCCCCCCCC(=O)N TS13057 [0,0,0,0,0,0|1,0,2]=3 10 B11R0.148 CCCCCCCCCC(=O)O TS45503 [0,0,0,0,0,0|1,0,1]=2 11 B11R0.148 CCCCCCCCCC(=O)[O-] TS69521 [0,0,0,0,0,0|1,0,2]=3 12 B11R0.148 CCCCCCCCCC(=O)[O-] TS84361 [0,0,0,0,0,0|1,0,2]=3 13 B11R0.148 CCCCCCCCCC(=O)[O-] TS92951 [0,0,0,0,0,0|1,0,2]=3 14 B11R0.148 CCCCCCCCCC(C)C TS45209 [0,0,0,0,0,0|1,0,0]=1 15 B11R0.148 CCCCCCCCCC(C)N TS45368 [0,0,0,0,0,0|1,0,0]=1 16 B11R0.148 CCCCCCCCNC(=S)N TS50807 [0,0,0,0,0,0|2,1,1]=4 17 B11R0.148 CCCCCCCCOC(=O)C TS45519 [0,0,0,0,0,0|1,0,2]=3 18 B11R0.148 CCCCCCCCOC(=O)Cl TS51574 [0,0,0,0,0,0|2,0,2]=4 19 B11R0.148 CCCCOCCOCC(=O)O TS46093 [0,0,0,0,0,0|3,0,1]=4 20 B11R0.148 CCCCOCCOCC(C)O TS46148 [0,0,0,0,0,0|2,0,0]=2 21 B11R0.148 CN(C)CCCCCCCCO TS45676 [0,0,0,0,0,0|3,0,0]=3 22 B10R0.4 B(CCCCCCCC)(O)O TS41838 [1,0,0,0,0,0|2,0,0]=3 23 B10R0.4 C(CCCC(=O)O)CCCBr TS01319 [1,0,0,0,0,0|2,0,1]=4 24 B10R0.4 C(CCCC(=O)O)CCCN TS11174 [1,0,0,0,0,0|2,0,1]=4 25 B10R0.4 C(CCCC(=O)O)CCCO TS11268 [1,0,0,0,0,0|2,0,1]=4 26 B10R0.4 CC(C)CCCCCCCO TS41982 [1,0,0,0,0,0|2,0,0]=3 27 B10R0.4 CCCCCCCCC(=O)C TS10747 [1,0,0,0,0,0|0,0,2]=3 28 B10R0.4 CCCCCCCCC(=O)Cl TS46204 [1,0,0,0,0,0|1,0,2]=4 29 B10R0.4 CCCCCCCCC(=O)N TS10891 [1,0,0,0,0,0|1,0,2]=4 30 B10R0.4 CCCCCCCCC(=O)O TS11031 [1,0,0,0,0,0|1,0,1]=3 31 B10R0.4 CCCCCCCCC(=O)[O-] TS14628 [1,0,0,0,0,0|1,0,2]=4 32 B10R0.4 CCCCCCCCC(C)Br TS49920 [1,0,0,0,0,0|1,0,0]=2 33 B10R0.4 CCCCCCCCC(C)C TS10780 [1,0,0,0,0,0|1,0,0]=2 34 B10R0.4 CCCCCCCCC(C)O TS41974 [1,0,0,0,0,0|0,0,0]=1 35 B10R0.4 CCCCCCCCN(C)C TS22279 [1,0,0,0,0,0|2,0,0]=3 36 B10R0.4 CCCCCCCCN(C)C TS41817 [1,0,0,0,0,0|2,0,0]=3 37 B10R0.4 CCCCCCCC[C@H](C)O TS41983 [1,0,0,0,0,0|0,0,0]=1 38 B10R0.4 CCCCCCCC[N+](=O)[O-] TS11163 [1,0,0,0,0,0|2,0,1]=4 39 B10R0.4 CCCCNCCNC(C)C TS41985 [1,0,0,0,0,0|3,0,0]=4 40 B10R0.4 CNCCCCCCN(C)C TS41989 [1,0,0,0,0,0|3,0,0]=4 41 B10R0.71 C#CCCCCCCCCO TS10479 [1,0,0,0,0,0|0,0,2]=3 42 B10R0.71 C(CCCCI)CCCCI TS67166 [1,0,0,0,0,0|2,0,0]=3 43 B10R0.71 C(CCCCN)CCCCN TS41990 [1,0,0,0,0,0|2,0,0]=3 44 B10R0.71 C(CCCCO)CCCCBr TS50279 [1,0,0,0,0,0|1,0,0]=2 45 B10R0.71 C(CCCCO)CCCCCl TS14310 [1,0,0,0,0,0|1,0,0]=2 46 B10R0.71 C(CCCCO)CCCCO TS42203 [1,0,0,0,0,0|1,0,0]=2 47 B10R0.71 C(CCCCS)CCCCS TS17566 [1,0,0,0,0,0|1,1,0]=3 48 B10R0.71 C(CCCl)COCCCCCl TS18772 [1,0,0,0,0,0|3,0,0]=4 49 B10R0.71 C(CNCCO)CNCCO TS11587 [1,0,0,0,0,0|3,0,0]=4 50 B10R0.71 C(CSCCO)CSCCO TS53738 [1,0,0,0,0,0|3,0,0]=4 51 B10R0.71 C=CCCCCCCCCBr TS22739 [1,0,0,0,0,0|1,0,2]=4 52 B10R0.71 C=CCCCCCCCCO TS41685 [1,0,0,0,0,0|0,0,2]=3 53 B10R0.71 CCC#CCCCCCCCl TS13284 [1,0,0,0,0,0|1,0,2]=4 54 B10R0.71 CCC=CCCCCCCO TS10743 [1,0,0,0,0,0|0,0,2]=3 55 B10R0.71 CCCCC#CCCCCCl TS13285 [1,0,0,0,0,0|1,0,2]=4 56 B10R0.71 CCCCC=CCCCCO TS10746 [1,0,0,0,0,0|0,0,2]=3 57 B10R0.71 CCCCC=CCCCCO TS10765 [1,0,0,0,0,0|0,0,2]=3 58 B10R0.71 CCCCCC#CCCCC TS10232 [1,0,0,0,0,0|0,0,2]=3 59 B10R0.71 CCCCCC#CCCCCl TS13283 [1,0,0,0,0,0|1,0,2]=4 60 B10R0.71 CCCCCC=CCCCO TS10760 [1,0,0,0,0,0|0,0,2]=3 61 B10R0.71 CCCCCCC#CCCC TS10234 [1,0,0,0,0,0|0,0,2]=3 62 B10R0.71 CCCCCCC#CCCO TS41425 [1,0,0,0,0,0|0,0,2]=3 63 B10R0.71 CCCCCCCC#CCC TS41206 [1,0,0,0,0,0|0,0,2]=3 64 B10R0.71 CCCCCCCC#CCO TS10482 [1,0,0,0,0,0|0,0,2]=3 65 B10R0.71 CCCCCCCC=CCO TS41687 [1,0,0,0,0,0|0,0,2]=3 66 B10R0.71 CCCCCCCCCC#C TS41204 [1,0,0,0,0,0|0,0,2]=3 67 B10R0.71 CCCCCCCCCC#N TS10352 [1,0,0,0,0,0|1,0,1]=3 68 B10R0.71 CCCCCCCCCC=C TS10512 [1,0,0,0,0,0|0,0,2]=3 69 B10R0.71 CCCCCCCCCC=O TS09040 [1,0,0,0,0,0|0,0,2]=3 70 B10R0.71 CCCCCCCCCCBr TS00033 [1,0,0,0,0,0|1,0,0]=2 71 B10R0.71 CCCCCCCCCCC TS10779 [1,0,0,0,0,0|0,0,0]=1 72 B10R0.71 CCCCCCCCCCCl TS92952 [1,0,0,0,0,0|1,0,0]=2 73 B10R0.71 CCCCCCCCCCF TS42224 [1,0,0,0,0,0|1,0,0]=2 74 B10R0.71 CCCCCCCCCCI TS93518 [1,0,0,0,0,0|1,0,0]=2 75 B10R0.71 CCCCCCCCCCN TS41819 [1,0,0,0,0,0|1,0,0]=2 76 B10R0.71 CCCCCCCCCCO TS41975 [1,0,0,0,0,0|0,0,0]=1 77 B10R0.71 CCCCCCCCCCS TS13579 [1,0,0,0,0,0|0,1,0]=2 78 B10R0.71 CCCCCCCCCOC TS11057 [1,0,0,0,0,0|1,0,0]=2 79 B10R0.71 CCCCCCCCCSC TS13577 [1,0,0,0,0,0|1,0,0]=2 80 B10R0.71 CCCCCCCCN=C=O TS10607 [1,0,0,0,0,0|1,0,2]=4 81 B10R0.71 CCCCCCCCN=C=S TS45362 [1,0,0,0,0,0|1,1,1]=4 82 B10R0.71 CCCCCCCCNCC TS41820 [1,0,0,0,0,0|1,0,0]=2 83 B10R0.71 CCCCCCCCOC=O TS11019 [1,0,0,0,0,0|1,0,2]=4 84 B10R0.71 CCCCCCCCOCCl TS14311 [1,0,0,0,0,0|2,0,0]=3 85 B10R0.71 CCCCCCCCSC#N TS45363 [1,0,0,0,0,0|2,0,1]=4 86 B10R0.71 CCCCCCCCSCC TS13580 [1,0,0,0,0,0|1,0,0]=2 87 B10R0.71 CCCCCCCOCCO TS11305 [1,0,0,0,0,0|1,0,0]=2 88 B10R0.71 CCCCCCNCCC#N TS41450 [1,0,0,0,0,0|2,0,1]=4 89 B10R0.71 CCCCCNCCCCC TS41815 [1,0,0,0,0,0|1,0,0]=2 90 B10R0.71 CCCCCSCCCCC TS13578 [1,0,0,0,0,0|1,0,0]=2 91 B10R0.71 CCCCOCCOCCO TS11577 [1,0,0,0,0,0|2,0,0]=3 92 B10R0.71 CCCCOCOCCCC TS11308 [1,0,0,0,0,0|2,0,0]=3 93 B10R0.71 CCOCCNCCOCC TS42342 [1,0,0,0,0,0|3,0,0]=4 94 B10R0.71 CCOCCOCCOCC TS11580 [1,0,0,0,0,0|3,0,0]=4 95 B10R0.71 COCCOCCOCCO TS01743 [1,0,0,0,0,0|3,0,0]=4 96 B12R0.4 CCCCCCCC(=O)CC(C)C TS48640 [0,1,0,0,0,0|1,0,1]=3 97 B12R0.4 CCCCCCCC(=O)OC(C)C TS15683 [0,1,0,0,0,0|2,0,1]=4 98 B12R0.4 CCCCCCCC(C)CC(=O)O TS15679 [0,1,0,0,0,0|1,0,1]=3 99 B12R0.4 CCCCCCCC(C)OC(=O)C TS48951 [0,1,0,0,0,0|1,0,2]=4 100 B12R0.4 CCCCCCCC(CC(=O)O)O TS50773 [0,1,0,0,0,0|1,0,1]=3 101 B12R0.4 CCCCCCOC(=O)CC(C)C TS15684 [0,1,0,0,0,0|2,0,1]=4 102 B12R0.119 CCCCCCCCCN(=O)(C)C TS15856 [0,1,0,0,0,0|1,0,1]=3 103 B12R0.119 CCCCCCCCCS(=O)(=O)[O-] TS53034 [0,1,0,0,0,0|2,0,1]=4 104 B12R0.119 CCCCCCCCC[N+](C)(C)C TS73498 [0,1,0,0,0,0|2,0,0]=3 105 B12R0.119 CCCCCNCCNC(C)(C)C TS48974 [0,1,0,0,0,0|3,0,0]=4 106 B12R0.184 CC(C)CCCCCCC(=O)OC TS48958 [0,1,0,0,0,0|2,0,1]=4 107 B12R0.233 CCCCCC(=O)OCCC(C)C TS48959 [0,1,0,0,0,0|2,0,1]=4 108 B12R0.233 CCCCCC(C)CCCC(C)C TS15359 [0,1,0,0,0,0|1,0,0]=2 109 B12R0.234 B(CCCCCCCCCC)(O)O TS15553 [0,1,0,0,0,0|2,0,0]=3 110 B12R0.234 C#CCCCCCCCCC(=O)O TS15017 [0,1,0,0,0,0|1,0,2]=4 111 B12R0.234 C(CCCCC(=O)O)CCCCBr TS28167 [0,1,0,0,0,0|1,0,1]=3 112 B12R0.234 C(CCCCC(=O)O)CCCCO TS50772 [0,1,0,0,0,0|1,0,1]=3 113 B12R0.234 C=CCCCCCCCCC(=O)O TS34607 [0,1,0,0,0,0|1,0,2]=4 114 B12R0.234 CC#CCCCCCCCC(=O)O TS48314 [0,1,0,0,0,0|1,0,2]=4 115 B12R0.234 CCCCCCCCC=CC(=O)O TS48605 [0,1,0,0,0,0|1,0,2]=4 116 B12R0.234 CCCCCCCCCCC(=C)C TS15042 [0,1,0,0,0,0|1,0,1]=3 117 B12R0.234 CCCCCCCCCCC(=O)C TS48629 [0,1,0,0,0,0|0,0,2]=3 118 B12R0.234 CCCCCCCCCCC(=O)Cl TS38726 [0,1,0,0,0,0|1,0,2]=4 119 B12R0.234 CCCCCCCCCCC(=O)O TS15677 [0,1,0,0,0,0|1,0,1]=3 120 B12R0.234 CCCCCCCCCCC(C)Br TS62703 [0,1,0,0,0,0|1,0,0]=2 121 B12R0.234 CCCCCCCCCCC(C)C TS15358 [0,1,0,0,0,0|1,0,0]=2 122 B12R0.234 CCCCCCCCCCC(C)O TS15701 [0,1,0,0,0,0|0,0,0]=1 123 B12R0.234 CCCCCCCCCCN(C)C TS48781 [0,1,0,0,0,0|2,0,0]=3 124 B12R0.234 CCCCCCCCCCS(=O)C TS38695 [0,1,0,0,0,0|1,0,1]=3 125 B12R0.234 CCCCCCCCCC[Si](C)C TS19096 [0,1,0,0,0,0|1,1,0]=3 126 B12R0.234 CCCCCCCCCOC(=O)C TS48960 [0,1,0,0,0,0|0,0,2]=3 127 B12R0.234 CCCCCCCCCOC(=O)Cl TS20294 [0,1,0,0,0,0|1,0,2]=4 128 B12R0.248 CCCCCCCCCC(=O)CC TS15346 [0,1,0,0,0,0|0,0,2]=3 129 B12R0.248 CCCCCCCCCC(=O)OC TS48954 [0,1,0,0,0,0|0,0,2]=3 130 B12R0.248 CCCCCCCCCC(C)C=O TS48631 [0,1,0,0,0,0|0,0,1]=2 131 B12R0.248 CCCCCCCCCC(C)CO TS15702 [0,1,0,0,0,0|0,0,0]=1 132 B12R0.248 CCCCCCCCCC(CC)O TS48965 [0,1,0,0,0,0|0,0,0]=1 133 B12R0.248 CCCCCCCCCC(CCl)Cl TS23981 [0,1,0,0,0,0|1,0,0]=2 134 B12R0.248 CCCCCCCCOC(=O)CBr TS28166 [0,1,0,0,0,0|1,0,2]=4 135 B12R0.248 CCCCCCCCOC(=O)CN TS23756 [0,1,0,0,0,0|1,0,2]=4 136 B12R0.248 CCCCCNCCNC(C)CC TS48973 [0,1,0,0,0,0|3,0,0]=4 137 B12R0.248 COC(=O)CCCCCCCCO TS50771 [0,1,0,0,0,0|1,0,2]=4 138 B12R0.251 CCCCCCCCC(C(=O)O)Br TS28165 [0,1,0,0,0,0|1,0,1]=3 139 B12R0.251 CCCCCCCCC(C(=O)O)N TS15845 [0,1,0,0,0,0|1,0,1]=3 140 B12R0.251 CCCCCCCCC(C)C(=O)O TS15682 [0,1,0,0,0,0|1,0,1]=3 141 B12R0.251 CCCCCCCC[C@@H](C(=O)O)N TS15840 [0,1,0,0,0,0|1,0,1]=3 142 B12R0.251 CCCCCCCC[C@H](C(=O)O)N TS15833 [0,1,0,0,0,0|1,0,1]=3 143 B12R0.255 CCCCCCC(=O)OCC(C)C TS48946 [0,1,0,0,0,0|2,0,1]=4 144 B12R1.7 CCCCCCC1CCC(=O)O1 TS12849 [0,0,0,1,0,0|1,0,1]=3 145 B12R1.28 CCCCCC1CCCC(=O)O1 TS12854 [0,0,0,1,0,0|1,0,1]=3 146 B12R1.215 C1CCCCCC(=O)CCCC1 TS44920 [0,0,0,1,0,0|0,0,2]=3 147 B12R1.252 C1CCC(CC1)CCCC(=O)O TS45167 [0,0,0,1,0,0|1,0,1]=3 148 B12R1.252 C1CCC(CC1)CCCC(=O)[O-] TS13838 [0,0,0,1,0,0|1,0,2]=4 149 B12R1.252 C1CCC(CC1)CCCC(=O)[O-] TS17479 [0,0,0,1,0,0|1,0,2]=4 150 B12R1.252 C1CCC(CC1)CCCC(=O)[O-] TS33883 [0,0,0,1,0,0|1,0,2]=4 151 B12R1.252 C1CCC(CC1)CCCC(=O)[O-] TS43539 [0,0,0,1,0,0|1,0,2]=4 152 B12R1.252 C1CCC(CC1)CCCC(=O)[O-] TS66513 [0,0,0,1,0,0|1,0,2]=4 153 B12R1.252 C1CCC(CC1)CCCC(=O)[O-] TS81207 [0,0,0,1,0,0|1,0,2]=4 154 B12R1.252 C1CCC(CC1)CCCC(=O)[O-] TS82408 [0,0,0,1,0,0|1,0,2]=4 155 B12R1.252 C1CCC(CC1)CCCC(=O)[O-] TS83716 [0,0,0,1,0,0|1,0,2]=4 156 B12R1.252 C1CCC(CC1)NCCC(=O)O TS45330 [0,0,0,1,0,0|2,0,1]=4 157 B12R1.252 C1CNCCC1CCCC(=O)O TS20456 [0,0,0,1,0,0|2,0,1]=4 158 B12R1.283 CCCN1CCCCC1C(=O)O TS45337 [0,0,0,1,0,0|2,0,1]=4 159 B12R1.321 CCCCC1CCCCC(=O)O1 TS12856 [0,0,0,1,0,0|1,0,1]=3 160 B12R1.1335 C1CCCC([BrH]CCC1)C(=O)O TS26014 [0,0,0,1,0,0|2,0,1]=4 161 B9R0.2 CC(C)CCCCCCBr TS39155 [2,0,0,0,0,0|2,0,0]=4 162 B9R0.2 CC(C)CCCCCCN TS06894 [2,0,0,0,0,0|2,0,0]=4 163 B9R0.2 CCCCCCCC(=C)C TS06520 [2,0,0,0,0,0|1,0,1]=4 164 B9R0.2 CCCCCCCC(=O)C TS06758 [2,0,0,0,0,0|0,0,2]=4 165 B9R0.2 CCCCCCCC(=O)O TS40219 [2,0,0,0,0,0|1,0,1]=4 166 B9R0.2 CCCCCCCC(C)Br TS39158 [2,0,0,0,0,0|1,0,0]=3 167 B9R0.2 CCCCCCCC(C)C TS37672 [2,0,0,0,0,0|1,0,0]=3 168 B9R0.2 CCCCCCC[C@@H](C)N TS06891 [2,0,0,0,0,0|1,0,0]=3 169 B9R0.2 CCCCCCC[C@H](C)N TS06890 [2,0,0,0,0,0|1,0,0]=3 170 B9R0.45 C#CCCCCCCCO TS06488 [2,0,0,0,0,0|0,0,2]=4 171 B9R0.45 C(CCCCBr)CCCBr TS74186 [2,0,0,0,0,0|2,0,0]=4 172 B9R0.45 C(CCCCBr)CCCO TS59627 [2,0,0,0,0,0|1,0,0]=3 173 B9R0.45 C(CCCCCl)CCCCl TS48395 [2,0,0,0,0,0|2,0,0]=4 174 B9R0.45 C(CCCCCl)CCCO TS55696 [2,0,0,0,0,0|1,0,0]=3 175 B9R0.45 C(CCCCN)CCCN TS07039 [2,0,0,0,0,0|2,0,0]=4 176 B9R0.45 C(CCCCN)CCCN TS49233 [2,0,0,0,0,0|2,0,0]=4 177 B9R0.45 C(CCCCO)CCCN TS40336 [2,0,0,0,0,0|1,0,0]=3 178 B9R0.45 C(CCCCO)CCCO TS34596 [2,0,0,0,0,0|1,0,0]=3 179 B9R0.45 C(CCCCS)CCCS TS14294 [2,0,0,0,0,0|1,1,0]=4 180 B9R0.45 C=CCCCCCCCO TS37642 [2,0,0,0,0,0|0,0,2]=4 181 B9R0.45 CCC=CCCCCCO TS06747 [2,0,0,0,0,0|0,0,2]=4 182 B9R0.45 CCCCC#CCCCC TS06315 [2,0,0,0,0,0|0,0,2]=4 183 B9R0.45 CCCCC=CCCCC TS06526 [2,0,0,0,0,0|0,0,2]=4 184 B9R0.45 CCCCC=CCCCC TS06534 [2,0,0,0,0,0|0,0,2]=4 185 B9R0.45 CCCCCC#CCCC TS06313 [2,0,0,0,0,0|0,0,2]=4 186 B9R0.45 CCCCCC#CCCO TS06497 [2,0,0,0,0,0|0,0,2]=4 187 B9R0.45 CCCCCC=CCCC TS06525 [2,0,0,0,0,0|0,0,2]=4 188 B9R0.45 CCCCCC=CCCC TS06539 [2,0,0,0,0,0|0,0,2]=4 189 B9R0.45 CCCCCC=CCCO TS06745 [2,0,0,0,0,0|0,0,2]=4 190 B9R0.45 CCCCCCC#CCC TS06319 [2,0,0,0,0,0|0,0,2]=4 191 B9R0.45 CCCCCCC#CCO TS06501 [2,0,0,0,0,0|0,0,2]=4 192 B9R0.45 CCCCCCC=CCC TS06528 [2,0,0,0,0,0|0,0,2]=4 193 B9R0.45 CCCCCCC=CCC TS06538 [2,0,0,0,0,0|0,0,2]=4 194 B9R0.45 CCCCCCC=CCO TS37637 [2,0,0,0,0,0|0,0,2]=4 195 B9R0.45 CCCCCCCC#CC TS06312 [2,0,0,0,0,0|0,0,2]=4 196 B9R0.45 CCCCCCCCC#C TS06311 [2,0,0,0,0,0|0,0,2]=4 197 B9R0.45 CCCCCCCCC=C TS06521 [2,0,0,0,0,0|0,0,2]=4 198 B9R0.45 CCCCCCCCC=O TS06760 [2,0,0,0,0,0|0,0,2]=4 199 B9R0.45 CCCCCCCCCBr TS00421 [2,0,0,0,0,0|1,0,0]=3 200 B9R0.45 CCCCCCCCCC TS37669 [2,0,0,0,0,0|0,0,0]=2 201 B9R0.45 CCCCCCCCCF TS40465 [2,0,0,0,0,0|1,0,0]=3 202 B9R0.45 CCCCCCCCCN TS06895 [2,0,0,0,0,0|1,0,0]=3 203 B9R0.45 CCCCCCCCCO TS07020 [2,0,0,0,0,0|0,0,0]=2 204 B9R0.45 CCCCCCCCCS TS11320 [2,0,0,0,0,0|0,1,0]=3 205 B9R0.45 CCCCCCCCNC TS06887 [2,0,0,0,0,0|1,0,0]=3 206 B9R0.45 CCCCCCCCSC TS11321 [2,0,0,0,0,0|1,0,0]=3 207 B9R0.45 CCCCCCCC[Mg]Br TS22286 [2,0,0,0,0,0|2,0,0]=4 208 B9R0.45 CCCCCCCNCC TS06892 [2,0,0,0,0,0|1,0,0]=3 209 B9R0.45 CCCCCCNCCN TS07030 [2,0,0,0,0,0|2,0,0]=4 210 B9R0.45 CCCCCCNCCO TS40337 [2,0,0,0,0,0|1,0,0]=3 211 B9R0.45 CCCCCCOCCO TS07250 [2,0,0,0,0,0|1,0,0]=3 212 B9R0.45 CCCCCCSCCCl TS14704 [2,0,0,0,0,0|2,0,0]=4 213 B9R0.45 CCCCCCSCCO TS42515 [2,0,0,0,0,0|1,0,0]=3 214 B9R0.45 CCCCCNCCCC TS06893 [2,0,0,0,0,0|1,0,0]=3 215 B9R0.45 CCCCNCCCCO TS40341 [2,0,0,0,0,0|1,0,0]=3 216 B9R0.45 CCCCSSCCCC TS14290 [2,0,0,0,0,0|2,0,0]=4 217 B9R0.45 CCOCCCCOCC TS07247 [2,0,0,0,0,0|2,0,0]=4 218 B9R0.45 CCSCCCCSCC TS14292 [2,0,0,0,0,0|2,0,0]=4 219 B9R0.45 CNCCCCCCNC TS07026 [2,0,0,0,0,0|2,0,0]=4 220 B9R0.45 CSCCCCCCSC TS14288 [2,0,0,0,0,0|2,0,0]=4 221 B11R0.2 CCCCCCC(=O)CC(C)C TS45202 [1,1,0,0,0,0|1,0,1]=4 222 B11R0.2 CCCCCCC(CC(=O)O)O TS45805 [1,1,0,0,0,0|1,0,1]=4 223 B11R0.30 CC(C)CCCCCCC(=O)O TS45506 [1,1,0,0,0,0|1,0,1]=4 224 B11R0.40 C(CCCC(CO)O)CCCO TS46147 [1,1,0,0,0,0|1,0,0]=3 225 B11R0.40 CCCCCCCCC(=O)CC TS12886 [1,1,0,0,0,0|0,0,2]=4 226 B11R0.40 CCCCCCCCC(=O)OC TS45510 [1,1,0,0,0,0|0,0,2]=4 227 B11R0.40 CCCCCCCCC(C)CBr TS56641 [1,1,0,0,0,0|1,0,0]=3 228 B11R0.40 CCCCCCCCC(CBr)Br TS58941 [1,1,0,0,0,0|1,0,0]=3 229 B11R0.40 CCCCCCCCC(CC)O TS45539 [1,1,0,0,0,0|0,0,0]=2 230 B11R0.40 CCCCCCCCC(CCl)Cl TS21103 [1,1,0,0,0,0|1,0,0]=3 231 B11R0.40 CCCCCCCCC(CO)O TS45836 [1,1,0,0,0,0|0,0,0]=2 232 B11R0.40 CCCCCCCC[C@@H](CO)O TS45841 [1,1,0,0,0,0|0,0,0]=2 233 B11R0.40 CCCCCCCC[C@H](CO)O TS45840 [1,1,0,0,0,0|0,0,0]=2 234 B11R0.42 CCCCCCCC(C(=O)O)N TS13378 [1,1,0,0,0,0|1,0,1]=4 235 B11R0.42 CCCCCCCC(C(=O)O)O TS45806 [1,1,0,0,0,0|1,0,1]=4 236 B11R0.42 CCCCCCCC(C(C)C)O TS45538 [1,1,0,0,0,0|1,0,0]=3 237 B11R0.42 CCCCCCCC(C)C(=O)O TS45498 [1,1,0,0,0,0|1,0,1]=4 238 B11R0.42 CCCCCCCC(C)C(C)C TS45212 [1,1,0,0,0,0|1,0,0]=3 239 B11R0.42 CCCCCCC[C@@H](C(=O)O)N TS13377 [1,1,0,0,0,0|1,0,1]=4 240 B11R0.42 CCCCCCC[C@H](C(=O)O)N TS13376 [1,1,0,0,0,0|1,0,1]=4 241 B11R0.46 CCCCCC(C)CCC(=O)O TS13225 [1,1,0,0,0,0|1,0,1]=4 242 B11R0.147 CCCCC(C)CCCC(C)C TS45213 [1,1,0,0,0,0|1,0,0]=3 243 B11R0.159 CCCCCCCCP(=O)(O)O TS17833 [1,1,0,0,0,0|2,0,0]=4 244 B11R0.159 CCCCCCCCS(=O)(=O)O TS17934 [1,1,0,0,0,0|2,0,0]=4 245 B11R0.159 CCCCCCCC[N+](C)(C)C TS20461 [1,1,0,0,0,0|2,0,0]=4 246 B11R0.159 CCCCCCCC[Si](C)(C)Cl TS20302 [1,1,0,0,0,0|1,1,0]=4 247 B11R0.159 CCCCCCCC[Si](C)(Cl)Cl TS24353 [1,1,0,0,0,0|1,1,0]=4 248 B11R0.3 C#CCCCCCCCCCO TS44914 [1,1,0,0,0,0|0,0,1]=3 249 B11R0.3 C(CCCCCBr)CCCCBr TS58940 [1,1,0,0,0,0|1,0,0]=3 250 B11R0.3 C(CCCCCBr)CCCCO TS34605 [1,1,0,0,0,0|0,0,0]=2 251 B11R0.3 C(CCCCCCl)CCCCCl TS21104 [1,1,0,0,0,0|1,0,0]=3 252 B11R0.3 C(CCCCCCl)CCCCO TS51578 [1,1,0,0,0,0|0,0,0]=2 253 B11R0.3 C(CCCCCI)CCCCI TS93403 [1,1,0,0,0,0|1,0,0]=3 254 B11R0.3 C(CCCCCN)CCCCN TS45546 [1,1,0,0,0,0|1,0,0]=3 255 B11R0.3 C(CCCCCO)CCCCN TS45677 [1,1,0,0,0,0|0,0,0]=2 256 B11R0.3 C(CCCCCO)CCCCO TS07870 [1,1,0,0,0,0|0,0,0]=2 257 B11R0.3 C(CCCCCS)CCCCS TS20278 [1,1,0,0,0,0|0,1,0]=3 258 B11R0.3 C(CCSCCO)CSCCO TS43873 [1,1,0,0,0,0|2,0,0]=4 259 B11R0.3 C=CCCCCCCCCCBr TS25359 [1,1,0,0,0,0|0,0,2]=4 260 B11R0.3 C=CCCCCCCCCCCl TS16102 [1,1,0,0,0,0|0,0,2]=4 261 B11R0.3 C=CCCCCCCCCCN TS45037 [1,1,0,0,0,0|0,0,2]=4 262 B11R0.3 C=CCCCCCCCCCO TS12885 [1,1,0,0,0,0|0,0,1]=3 263 B11R0.3 CCCCCC#CCCCCC TS43148 [1,1,0,0,0,0|0,0,1]=3 264 B11R0.3 CCCCCCC#CCCCC TS43144 [1,1,0,0,0,0|0,0,1]=3 265 B11R0.3 CCCCCCCCC=CCO TS12884 [1,1,0,0,0,0|0,0,1]=3 266 B11R0.3 CCCCCCCCCCC#C TS43145 [1,1,0,0,0,0|0,0,1]=3 267 B11R0.3 CCCCCCCCCCC=C TS12600 [1,1,0,0,0,0|0,0,1]=3 268 B11R0.3 CCCCCCCCCCC=O TS12882 [1,1,0,0,0,0|0,0,1]=3 269 B11R0.3 CCCCCCCCCCCC TS45211 [1,1,0,0,0,0|0,0,0]=2 270 B11R0.3 CCCCCCCCCCCCl TS51219 [1,1,0,0,0,0|0,0,0]=2 271 B11R0.3 CCCCCCCCCCCF TS13565 [1,1,0,0,0,0|0,0,0]=2 272 B11R0.3 CCCCCCCCCCCN TS45371 [1,1,0,0,0,0|0,0,0]=2 273 B11R0.3 CCCCCCCCCCCO TS45537 [1,1,0,0,0,0|0,0,0]=2 274 B11R0.3 CCCCCCCCCCCS TS50816 [1,1,0,0,0,0|0,0,0]=2 275 B11R0.3 CCCCCCCCCCNC TS45367 [1,1,0,0,0,0|0,0,0]=2 276 B11R0.3 CCCCCCCCCCOC TS45542 [1,1,0,0,0,0|0,0,0]=2 277 B11R0.3 CCCCCCCCCC[Mg]Br TS27354 [1,1,0,0,0,0|1,0,0]=3 278 B11R0.3 CCCCCCCCCOC=O TS13219 [1,1,0,0,0,0|0,0,2]=4 279 B11R0.3 CCCCCCCCNCCN TS13245 [1,1,0,0,0,0|1,0,0]=3 280 B11R0.3 CCCCCCCCOCC=C TS45199 [1,1,0,0,0,0|0,0,2]=4 281 B11R0.3 CCCCCCCCOCC=O TS45516 [1,1,0,0,0,0|0,0,2]=4 282 B11R0.3 CCCCCCCCOCCO TS45839 [1,1,0,0,0,0|0,0,0]=2 283 B11R0.3 CCCCCCCCSCCCl TS43568 [1,1,0,0,0,0|1,0,0]=3 284 B11R0.3 CCCCCCCCSCCO TS51196 [1,1,0,0,0,0|0,0,0]=2 285 B11R0.3 CCCCCOCCOCCO TS46149 [1,1,0,0,0,0|1,0,0]=3 286 B11R0.3 CCCCCSSCCCCC TS20279 [1,1,0,0,0,0|1,0,0]=3 287 B11R0.3 CCCCOCCOCCCC TS45833 [1,1,0,0,0,0|1,0,0]=3 288 B11R0.3 CCCCOCCOCCOC TS46151 [1,1,0,0,0,0|2,0,0]=4 289 B11R0.3 CCNCCCCCCNCC TS45547 [1,1,0,0,0,0|1,0,0]=3 290 B11R0.3 CCOCCOCCOCCO TS14214 [1,1,0,0,0,0|2,0,0]=4 291 B11R0.4 CCCCCCCC(=O)OCC TS45501 [1,1,0,0,0,0|1,0,1]=4 292 B11R0.4 CCCCCCCC(CCC)O TS45536 [1,1,0,0,0,0|0,0,0]=2 293 B11R0.4 CCCCCCOC(=O)CCC TS45526 [1,1,0,0,0,0|1,0,1]=4 294 B11R0.81 CCCCCCC(=O)OCCC TS13224 [1,1,0,0,0,0|1,0,1]=4 295 B11R0.81 CCCCCCC(CCCC)O TS45543 [1,1,0,0,0,0|0,0,0]=2 296 B11R0.81 CCCCCOC(=O)CCCC TS45500 [1,1,0,0,0,0|1,0,1]=4 297 B11R0.140 CCCCCC(=O)CCCCC TS45197 [1,1,0,0,0,0|0,0,1]=3 298 B11R0.140 CCCCCC(CCCCC)N TS45370 [1,1,0,0,0,0|0,0,0]=2 299 B11R0.140 CCCCCC(CCCCC)O TS45541 [1,1,0,0,0,0|0,0,0]=2 300 B11R0.140 CCCCCS(=O)CCCCC TS51197 [1,1,0,0,0,0|1,0,0]=3 301 B13R0.274 CCCCCCCC(CC(=O)OC)O TS19446 [0,2,0,0,0,0|0,0,2]=4 302 B13R0.286 CCCCCCCC(CC(Cl)(Cl)Cl)Cl TS54299 [0,2,0,0,0,0|2,0,0]=4 303 B13R0.335 CCCCCCCCC(C)CC(=O)O TS37966 [0,2,0,0,0,0|1,0,1]=4 304 B13R0.335 CCCCCCCCC(CC(=O)O)O TS19441 [0,2,0,0,0,0|1,0,1]=4 305 B13R0.280 CCCCCCCCCCN(=O)(C)C TS19265 [0,2,0,0,0,0|1,0,1]=4 306 B13R0.280 CCCCCCCCCCP(=O)(C)C TS49478 [0,2,0,0,0,0|1,0,1]=4 307 B13R0.280 CCCCCCCCCCP(=O)(O)O TS50142 [0,2,0,0,0,0|2,0,0]=4 308 B13R0.280 CCCCCCCCCC[N+](C)(C)C TS25811 [0,2,0,0,0,0|2,0,0]=4 309 B13R0.280 CCCCCCCCCC[N+](C)(C)C TS34204 [0,2,0,0,0,0|2,0,0]=4 310 B13R0.280 CCCCCCCCCC[Si](C)(C)Cl TS56586 [0,2,0,0,0,0|1,1,0]=4 311 B13R0.280 CCCCCCCCCC[Si](C)(Cl)Cl TS28789 [0,2,0,0,0,0|1,1,0]=4 312 B13R0.280 CCCCCCCCCOS(=O)(=O)O TS23892 [0,2,0,0,0,0|2,0,0]=4 313 B13R0.280 CCCCCCNCCNC(C)(C)C TS19089 [0,2,0,0,0,0|2,0,0]=4 314 B13R0.1215 CCCCCCCCCC(C)(C#C)O TS53732 [0,2,0,0,0,0|0,0,0]=2 315 B13R0.201 C(CCCC(CCl)Cl)CCC(CCl)Cl TS54298 [0,2,0,0,0,0|2,0,0]=4 316 B13R0.54 C(CCCCCBr)CCCCC(=O)O TS68927 [0,2,0,0,0,0|1,0,1]=4 317 B13R0.54 C(CCCCCN)CCCCC(=O)O TS19255 [0,2,0,0,0,0|1,0,1]=4 318 B13R0.54 C(CCCCCO)CCCCC(=O)O TS19440 [0,2,0,0,0,0|1,0,1]=4 319 B13R0.54 C(CCCCCS)CCCCC(=O)O TS22494 [0,2,0,0,0,0|1,0,1]=4 320 B13R0.54 C=CCCCCCCCCCC(=O)O TS18691 [0,2,0,0,0,0|1,0,1]=4 321 B13R0.54 CC(C)CCCCCCCCCCO TS19085 [0,2,0,0,0,0|1,0,0]=3 322 B13R0.54 CCCCCCC=CCCCC(=O)O TS18694 [0,2,0,0,0,0|1,0,1]=4 323 B13R0.54 CCCCCCCCCC=CC(=O)O TS54086 [0,2,0,0,0,0|1,0,1]=4 324 B13R0.54 CCCCCCCCCCCC(=C)C TS18337 [0,2,0,0,0,0|1,0,1]=4 325 B13R0.54 CCCCCCCCCCCC(=O)C TS18716 [0,2,0,0,0,0|0,0,2]=4 326 B13R0.54 CCCCCCCCCCCC(=O)O TS19259 [0,2,0,0,0,0|1,0,1]=4 327 B13R0.54 CCCCCCCCCCCC(=O)O TS37977 [0,2,0,0,0,0|1,0,1]=4 328 B13R0.54 CCCCCCCCCCCC(=O)O TS68181 [0,2,0,0,0,0|1,0,1]=4 329 B13R0.54 CCCCCCCCCCCC(=O)O TS75367 [0,2,0,0,0,0|1,0,1]=4 330 B13R0.54 CCCCCCCCCCCC(=O)O TS93845 [0,2,0,0,0,0|1,0,1]=4 331 B13R0.54 CCCCCCCCCCCC(=O)O TS94033 [0,2,0,0,0,0|1,0,1]=4 332 B13R0.54 CCCCCCCCCCCC(C)Br TS29897 [0,2,0,0,0,0|1,0,0]=3 333 B13R0.54 CCCCCCCCCCCC(C)C TS54110 [0,2,0,0,0,0|1,0,0]=3 334 B13R0.54 CCCCCCCCCCCC(C)N TS37784 [0,2,0,0,0,0|1,0,0]=3 335 B13R0.54 CCCCCCCCCCCC(C)O TS19079 [0,2,0,0,0,0|0,0,0]=2 336 B13R0.147 CCCCCCCCCCC(=O)OC TS37967 [0,2,0,0,0,0|0,0,2]=4 337 B13R0.147 CCCCCCCCCCC(C)CC TS54109 [0,2,0,0,0,0|1,0,0]=3 338 B13R0.147 CCCCCCCCCCC(CC)O TS19081 [0,2,0,0,0,0|0,0,0]=2 339 B13R0.147 CCCCCCCCCCC(CCl)Cl TS26351 [0,2,0,0,0,0|1,0,0]=3 340 B13R0.147 CCCCCCCCCCC(CO)O TS19457 [0,2,0,0,0,0|0,0,0]=2 341 B13R0.147 CCCCCCCCCC[C@@H](CO)O TS19459 [0,2,0,0,0,0|0,0,0]=2 342 B13R0.147 CCCCCCCCCC[C@H](CO)O TS19458 [0,2,0,0,0,0|0,0,0]=2 343 B13R0.147 CCCCCCNCCNC(C)CC TS19087 [0,2,0,0,0,0|2,0,0]=4 344 B13R0.147 COC(=O)CCCCCCCCCBr TS68925 [0,2,0,0,0,0|0,0,2]=4 345 B13R0.147 COC(=O)CCCCCCCCCO TS19445 [0,2,0,0,0,0|0,0,2]=4 346 B13R0.150 CCCCCCCCCC(=O)N(C)C TS37778 [0,2,0,0,0,0|0,0,2]=4 347 B13R0.150 CCCCCCCCCC(C(=O)O)Br TS68926 [0,2,0,0,0,0|1,0,0]=3 348 B13R0.150 CCCCCCCCCC(C(=O)O)O TS19443 [0,2,0,0,0,0|0,0,1]=3 349 B13R0.150 CCCCCCCCCC(C)C(=O)O TS37976 [0,2,0,0,0,0|0,0,0]=2 350 B13R0.154 CCCCCCCC(=O)OCC(C)C TS37973 [0,2,0,0,0,0|1,0,1]=4 351 B13R0.179 CC(C)CCCCCCCCC(=O)O TS19069 [0,2,0,0,0,0|1,0,1]=4 352 B13R0.179 CC(C)CCCCCCCOC(=O)C TS37971 [0,2,0,0,0,0|0,0,2]=4 353 B13R0.202 CCC(C)CCCCCCCC(=O)O TS37972 [0,2,0,0,0,0|1,0,1]=4 354 B13R0.2 CCCCCCCCCC(=O)CCC TS54094 [0,2,0,0,0,0|0,0,2]=4 355 B13R0.2 CCCCCCCCCC(=O)OC=C TS54076 [0,2,0,0,0,0|1,0,1]=4 356 B13R0.2 CCCCCCCCCC(=O)OCC TS19068 [0,2,0,0,0,0|0,0,2]=4 357 B13R0.2 CCCCCCCCCC(CCC)O TS19082 [0,2,0,0,0,0|0,0,0]=2 358 B13R0.340 CCCCCCCCC(C(=O)OC)O TS19442 [0,2,0,0,0,0|0,0,2]=4 359 B13R0.412 CCCCCCCCCC(OC)OC TS19455 [0,2,0,0,0,0|0,0,0]=2 360 B13R0.412 CCCCNCCC[SiH2]C(OC)OC TS22662 [0,2,0,0,0,0|1,1,0]=4 361 B13R0.61 CCCCCCCCC(CC)C(=O)O TS37957 [0,2,0,0,0,0|1,0,1]=4 362 B13R0.413 CCCCCCCCC(C)(C)C(=O)O TS37958 [0,2,0,0,0,0|1,0,1]=4 363 B11R1.24 CCCCC1CCCC(=O)O1 TS10721 [1,0,0,1,0,0|1,0,1]=4 364 B11R1.27 CCCCCC1OCC(O1)C TS11037 [1,0,0,1,0,0|1,0,0]=3 365 B11R1.78 CCCCCCC1CC(=O)O1 TS41639 [1,0,0,1,0,0|1,0,1]=4 366 B11R1.99 C=CCCCCCCC1CO1 TS10487 [1,0,0,1,0,0|0,0,2]=4 367 B11R1.99 C=CCCCCCC[C@@H]1CO1 TS41443 [1,0,0,1,0,0|0,0,2]=4 368 B11R1.99 CCCCCCCCC1CO1 TS10750 [1,0,0,1,0,0|0,0,0]=2 369 B11R1.99 CCCCCCCC[C@@H]1CO1 TS41692 [1,0,0,1,0,0|0,0,0]=2 370 B11R1.99 CCCCCCOC[C@H]1CO1 TS11040 [1,0,0,1,0,0|1,0,0]=3 371 B11R1.101 C1CCCCC(=O)CCCC1 TS59759 [1,0,0,1,0,0|0,0,2]=4 372 B11R1.101 C1CCCCC(CCCC1)O TS10745 [1,0,0,1,0,0|0,0,0]=2 373 B11R1.4 C1CCN(C1)CCCCCN TS09152 [1,0,0,1,0,0|2,0,0]=4 374 B11R1.4 CCCCCCC1OCCO1 TS41943 [1,0,0,1,0,0|1,0,0]=3 375 B11R1.17 CC1CCCCN1CCCN TS41701 [1,0,0,1,0,0|2,0,0]=4 376 B11R1.17 CCCCC1CCCCC1O TS10744 [1,0,0,1,0,0|0,0,0]=2 377 B11R1.28 C#CCCCC1CCCCC1 TS40930 [1,0,0,1,0,0|0,0,2]=4 378 B11R1.28 C1CCC(CC1)CCCCBr TS22565 [1,0,0,1,0,0|1,0,0]=3 379 B11R1.28 C1CCC(CC1)CCCCN TS41542 [1,0,0,1,0,0|1,0,0]=3 380 B11R1.28 C1CCC(CC1)CCCCO TS41690 [1,0,0,1,0,0|0,0,0]=2 381 B11R1.28 C1CCC(CC1)NCCCN TS41702 [1,0,0,1,0,0|2,0,0]=4 382 B11R1.28 C1CCOC(C1)OCCCBr TS50264 [1,0,0,1,0,0|2,0,0]=4 383 B11R1.28 C1CCOC(C1)OCCCCl TS47644 [1,0,0,1,0,0|2,0,0]=4 384 B11R1.28 C1CNCCC1CCCCBr TS70755 [1,0,0,1,0,0|2,0,0]=4 385 B11R1.28 CCCCCC1CCCCC1 TS10509 [1,0,0,1,0,0|0,0,0]=2 386 B11R1.117 C1CCCC(CCC1)CCN TS41546 [1,0,0,1,0,0|1,0,0]=3 387 B11R1.180 CCCCCC1CCCC1=O TS41436 [1,0,0,1,0,0|0,0,2]=4 388 B11R1.203 CCCCN1CCCNCC1 TS41699 [1,0,0,1,0,0|2,0,0]=4 389 B13R1.27 CCCCCCCC1CCC(=O)O1 TS15334 [0,1,0,1,0,0|1,0,1]=4 390 B13R1.5437 CCCCCCCC1(CC(=O)O1)C TS48602 [0,1,0,1,0,0|1,0,1]=4 391 B13R1.337 C1CCC(CC1)CCCCC(=O)O TS48613 [0,1,0,1,0,0|1,0,1]=4 392 B13R1.3441 CC1(OC[C@@H](O1)CCCCCO)C TS50774 [0,1,0,1,0,0|2,0,0]=4 393 B13R1.3441 CCCCCCC1COC(O1)(C)C TS48961 [0,1,0,1,0,0|1,0,0]=3 394 B13R1.1988 C1CCCN(CC1)CCCC(=O)O TS48762 [0,1,0,1,0,0|1,0,1]=4 395 B13R1.6 CCCCCCC1CCCC(=O)O1 TS48608 [0,1,0,1,0,0|1,0,1]=4 396 B13R1.6 CCCCCCC1CCCC(C1)C TS15045 [0,1,0,1,0,0|1,0,0]=3 397 B13R1.279 C1CCCCCC(=O)CCCCC1 TS48333 [0,1,0,1,0,0|0,0,2]=4 398 B13R1.279 C1CCCCCC(CCCCC1)Br TS62423 [0,1,0,1,0,0|1,0,0]=3 399 B13R1.279 C1CCCCCC(CCCCC1)N TS15173 [0,1,0,1,0,0|1,0,0]=3 400 B13R1.279 C1CCCCCC(CCCCC1)O TS48634 [0,1,0,1,0,0|0,0,0]=2 401 B13R1.279 C1CCCCCOC(=O)CCCC1 TS15332 [0,1,0,1,0,0|0,0,2]=4 402 B13R1.279 C=C1CCCCCCCCCCC1 TS47981 [0,1,0,1,0,0|1,0,1]=4 403 B13R1.572 CCCCN1CCCCC1C(=O)O TS15476 [0,1,0,1,0,0|1,0,1]=4 404 B13R1.659 CCCCCCCCCCC1CO1 TS48630 [0,1,0,1,0,0|0,0,0]=2 405 B13R1.659 CCCCCCCCCC[C@@H]1CO1 TS48641 [0,1,0,1,0,0|0,0,0]=2 406 B13R1.9 CCCCCCC1CCC(CC1)C TS15046 [0,1,0,1,0,0|1,0,0]=3 407 B13R2.2290 C1[C@H](O1)CCCCCC[C@@H]2CO2 TS12862 [0,0,0,2,0,0|1,0,0]=3