0 B8R0.4 Br[Mg]CCCCC[Mg]Br OR320004 [0,0,0,0,0,0|4,0,0]=4 1 B8R0.4 C=CCCCCCC#N OR2954 [0,0,0,0,0,0|1,0,3]=4 2 B8R0.4 CCCCC#CCCO OR5517 [0,0,0,0,0,0|0,0,2]=2 3 B8R0.4 CCCCCCCCCl OR323270 [0,0,0,0,0,0|1,0,0]=1 4 B8R0.4 CCCCCCCCF PC5360 [0,0,0,0,0,0|1,0,0]=1 5 B8R0.4 CCCCCCC[Mg]Br OR320014 [0,0,0,0,0,0|2,0,0]=2 6 B8R0.4 CCCCCCC[Mg]Br OR320015 [0,0,0,0,0,0|2,0,0]=2 7 B8R0.4 CCCC[NH2+]CCCC PC2332 [0,0,0,0,0,0|2,0,0]=2 8 B8R0.4 N#CCCCNCCO OR322886 [0,0,0,0,0,0|2,0,1]=3 9 B8R0.4 [N-]=[N+]=NCCOCCO BIPG1115 [0,0,0,0,0,0|4,0,0]=4 10 B7R0.1 C=CCCCCCCl OR2940 [1,0,0,0,0,0|1,0,2]=4 11 B7R0.1 CCCC#CCCC OR5522 [1,0,0,0,0,0|0,0,2]=3 12 B7R0.1 CCCCCCC#N OR10119 [1,0,0,0,0,0|1,0,1]=3 13 B7R0.1 CCCCCCCF PC4522 [1,0,0,0,0,0|1,0,0]=2 14 B7R0.1 CCCCCC[Mg]Br OR320006 [1,0,0,0,0,0|2,0,0]=3 15 B7R0.1 CCCCCC[Mg]Br OR320007 [1,0,0,0,0,0|2,0,0]=3 16 B7R0.1 CCCCCC[Mg]Cl OR320009 [1,0,0,0,0,0|2,0,0]=3 17 B7R0.1 CCCNCCOC OR200127 [1,0,0,0,0,0|2,0,0]=3 18 B7R0.1 COCCOCCN BIPG1580 [1,0,0,0,0,0|3,0,0]=4 19 B7R0.1 COCCOCCO OR322353 [1,0,0,0,0,0|2,0,0]=3 20 B7R0.1 NCCCNCCN OR28922 [1,0,0,0,0,0|3,0,0]=4 21 B9R0.2 C=C(C)CCCCCCCl OR2950 [0,1,0,0,0,0|1,0,1]=3 22 B9R0.2 CCCCCC#CC(=O)O OR22085 [0,1,0,0,0,0|0,0,3]=4 23 B9R0.2 CCCCCCC[C@H](C)O OR304047 [0,1,0,0,0,0|0,0,0]=1 24 B9R0.2 CNCCOCCC(=O)O BIPG1535 [0,1,0,0,0,0|2,0,1]=4 25 B9R0.2 COCCOCCC(=O)O BIPG1541 [0,1,0,0,0,0|2,0,1]=4 26 B9R0.2 OB(O)CCCCCCBr OR360360 [0,1,0,0,0,0|2,0,0]=3 27 B9R0.5 CCCCC[C@@H](C)N=C=S OR322587 [0,1,0,0,0,0|1,1,1]=4 28 B9R0.5 CCCCC[C@H](C)N=C=S OR322583 [0,1,0,0,0,0|1,1,1]=4 29 B9R0.45 BrCCOCCOCCBr BIPG1333 [0,1,0,0,0,0|3,0,0]=4 30 B9R0.45 C=CCCCCCCC#N OR2955 [0,1,0,0,0,0|1,0,2]=4 31 B9R0.45 C=CCCCCCCCCl OR2942 [0,1,0,0,0,0|1,0,1]=3 32 B9R0.45 CCCCCCCCCF PC5314 [0,1,0,0,0,0|1,0,0]=2 33 B9R0.45 CCCCCCCC[Mg]Br OR320016 [0,1,0,0,0,0|1,0,0]=2 34 B9R0.45 CCCCCCCC[Mg]Br OR320017 [0,1,0,0,0,0|1,0,0]=2 35 B9R0.45 CCCCCCCC[Mg]Cl OR320018 [0,1,0,0,0,0|1,0,0]=2 36 B9R0.45 CCCCCCCC[Mg]Cl OR320019 [0,1,0,0,0,0|1,0,0]=2 37 B9R0.45 CC\C=C/CCCCC=O OR322039 [0,1,0,0,0,0|0,0,3]=4 38 B9R0.45 NCCNCCNCCN OR323290 [0,1,0,0,0,0|3,0,0]=4 39 B9R0.45 OCCOCCOCCBr BIPG1325 [0,1,0,0,0,0|2,0,0]=3 40 B9R0.45 OCCOCCOCCS BIPG1840 [0,1,0,0,0,0|2,0,0]=3 41 B9R0.45 OCCSCCSCCO OR4854 [0,1,0,0,0,0|2,0,0]=3 42 B9R0.46 CCCCCCC(O)CC OR10034 [0,1,0,0,0,0|1,0,0]=2 43 B9R1.5 CC1CCNCCN1C OR470722 [0,0,0,1,0,0|3,0,0]=4 44 B9R1.5 N[C@@H]1CCCCC[C@H]1O OR307650 [0,0,0,1,0,0|1,0,0]=2 45 B9R1.8 BrCCN1CCCCC1 OR346238 [0,0,0,1,0,0|2,0,0]=3 46 B9R1.8 C#CCC1CCCCC1 OR25672 [0,0,0,1,0,0|1,0,1]=3 47 B9R1.8 CCCC1CCCCN1 OR480200 [0,0,0,1,0,0|1,0,0]=2 48 B9R1.8 CCCN1CCNCC1 OR5120 [0,0,0,1,0,0|3,0,0]=4 49 B9R1.8 CCC[C@H]1CCCCN1 OR321382 [0,0,0,1,0,0|1,0,0]=2 50 B9R1.8 CCOC1CCNCC1 OR315089 [0,0,0,1,0,0|3,0,0]=4 51 B9R1.8 COCC1COCCN1 OR451061 [0,0,0,1,0,0|3,0,0]=4 52 B9R1.8 COC[C@@H]1CNCCO1 OR451067 [0,0,0,1,0,0|2,0,0]=3 53 B9R1.8 COC[C@H]1CNCCO1 OR451068 [0,0,0,1,0,0|2,0,0]=3 54 B9R1.8 COC[C@H]1COCCN1 OR308173 [0,0,0,1,0,0|3,0,0]=4 55 B9R1.8 ClCCC1CCCCC1 OR111352 [0,0,0,1,0,0|1,0,0]=2 56 B9R1.8 FCCC1CCNCC1 PC450041 [0,0,0,1,0,0|2,0,0]=3 57 B9R1.8 FCCN1CCNCC1 PC449008 [0,0,0,1,0,0|3,0,0]=4 58 B9R1.8 NCCC1CCSCC1 OR471042 [0,0,0,1,0,0|2,0,0]=3 59 B9R1.8 OCCC1CCCCN1 OR350326 [0,0,0,1,0,0|1,0,0]=2 60 B9R1.8 OCC[C@@H]1CCCCN1 OR350353 [0,0,0,1,0,0|1,0,0]=2 61 B9R1.8 OCC[C@@H]1CCCCN1 OR350359 [0,0,0,1,0,0|1,0,0]=2 62 B9R1.8 OCC[C@H]1CCCCN1 OR350534 [0,0,0,1,0,0|1,0,0]=2 63 B9R1.14 CCN1CCC[C@@H]1CN OR309132 [0,0,0,1,0,0|2,0,0]=3 64 B9R1.15 CN1CCCCC1CCl OR11727 [0,0,0,1,0,0|2,0,0]=3 65 B9R1.15 CN1CCCCC1CO OR350237 [0,0,0,1,0,0|1,0,0]=2 66 B9R1.15 CN[C@@H]1CCCC[C@@H]1O OR307604 [0,0,0,1,0,0|1,0,0]=2 67 B9R1.15 CN[C@@H]1CCCC[C@H]1O OR307603 [0,0,0,1,0,0|1,0,0]=2 68 B9R1.15 C[C@H]1NCCC[C@@H]1C#N OR302708 [0,0,0,1,0,0|2,0,1]=4 69 B9R1.15 NC[C@@H]1CCCC[C@@H]1N OR307557 [0,0,0,1,0,0|2,0,0]=3 70 B9R1.15 N[C@H]1CC=CC[C@H]1CO OR307590 [0,0,0,1,0,0|1,0,2]=4 71 B9R1.15 OC[C@@H]1CCNC[C@@H]1F PC430259 [0,0,0,1,0,0|2,0,0]=3 72 B9R1.15 OC[C@H]1CCNC[C@H]1F PC430119 [0,0,0,1,0,0|2,0,0]=3 73 B9R1.33 CN1CCCC1CCO OR350277 [0,0,0,1,0,0|1,0,0]=2 74 B9R1.33 CN1CCC[C@@H]1CCN OR315013 [0,0,0,1,0,0|2,0,0]=3 75 B9R1.33 CN1CCC[C@H]1CCN OR315014 [0,0,0,1,0,0|2,0,0]=3 76 B9R1.50 NC1C=CCCCCC1 OR310351 [0,0,0,1,0,0|1,0,2]=4 77 B9R1.50 O=C1CCCCCCN1 OR25888 [0,0,0,1,0,0|1,0,2]=4 78 B9R1.89 N#CC1CCCNCC1 OR302408 [0,0,0,1,0,0|2,0,1]=4 79 B6R0.6 CCC#CCCO OR5514 [2,0,0,0,0,0|0,0,2]=4 80 B6R0.6 CCCCCCF PC4817 [2,0,0,0,0,0|1,0,0]=3 81 B6R0.6 CCCCC[Mg]Br OR320127 [2,0,0,0,0,0|2,0,0]=4 82 B6R0.6 CCCCC[Mg]Br OR320128 [2,0,0,0,0,0|2,0,0]=4 83 B6R0.6 CCCCC[Mg]Cl OR320129 [2,0,0,0,0,0|2,0,0]=4 84 B6R0.6 CCCCC[Mg]Cl OR320130 [2,0,0,0,0,0|2,0,0]=4 85 B6R0.6 CCCNNCC OR315350 [2,0,0,0,0,0|2,0,0]=4 86 B6R0.6 CCCOCCN OR322245 [2,0,0,0,0,0|2,0,0]=4 87 B6R0.6 CCOCCCO OR0975 [2,0,0,0,0,0|1,0,0]=3 88 B6R0.6 FCCCCCBr PC49114 [2,0,0,0,0,0|2,0,0]=4 89 B6R0.6 ICCCCCI OR2937 [2,0,0,0,0,0|2,0,0]=4 90 B6R0.6 OCCOCCBr BIPG1324 [2,0,0,0,0,0|2,0,0]=4 91 B8R0.1 COCCN(C)CCO OR305582 [1,1,0,0,0,0|2,0,0]=4 92 B8R0.6 CCCCCC(O)CC OR10038 [1,1,0,0,0,0|0,0,0]=2 93 B8R0.6 CCCCC[C@@H](O)CCl OR304095 [1,1,0,0,0,0|1,0,0]=3 94 B8R0.6 CCCCC[C@H](O)CCl OR304096 [1,1,0,0,0,0|1,0,0]=3 95 B8R0.6 N#CC(O)CCCCO OR471070 [1,1,0,0,0,0|1,0,1]=4 96 B8R0.7 CCCCCC[C@@H](C)N OR315297 [1,1,0,0,0,0|0,0,0]=2 97 B8R0.7 CCCCCC[C@@H](C)O OR10015 [1,1,0,0,0,0|0,0,0]=2 98 B8R0.7 CCCCCC[C@H](C)N OR315268 [1,1,0,0,0,0|0,0,0]=2 99 B8R0.7 CCCCOCC(=O)O OR470003 [1,1,0,0,0,0|1,0,1]=4 100 B8R0.7 O=C(O)CCCCCI OR183411 [1,1,0,0,0,0|1,0,1]=4 101 B8R0.7 OB(O)CCCCCBr OR360449 [1,1,0,0,0,0|2,0,0]=4 102 B10R0.4 C=CCCCCCCB(O)O OR361512 [0,2,0,0,0,0|0,0,2]=4 103 B10R0.4 CCCCCCCCB(O)O OR360045 [0,2,0,0,0,0|0,0,0]=2 104 B10R0.4 CCCCCCCC[C@H](C)O OR304048 [0,2,0,0,0,0|0,0,0]=2 105 B10R0.4 CCCCCC\C=C\B(O)O OR10575 [0,2,0,0,0,0|0,0,2]=4 106 B10R0.4 CCOCCOCCC(=O)O OR323150 [0,2,0,0,0,0|1,0,1]=4 107 B10R0.4 OCCOCCOCC(F)F PC450213 [0,2,0,0,0,0|2,0,0]=4 108 B10R0.22 O=P(O)(O)CCCCCCBr OR323067 [0,2,0,0,0,0|2,0,0]=4 109 B10R0.74 CCCCCCC[C@@H](O)CCl OR304097 [0,2,0,0,0,0|0,0,0]=2 110 B10R0.74 CCCCCCC[C@H](O)CCl OR304098 [0,2,0,0,0,0|0,0,0]=2 111 B10R0.1 CCCCCC[C@H](C)N=C=S OR322588 [0,2,0,0,0,0|0,1,1]=4 112 B10R0.71 C=CCCCCCCCC#N OR2956 [0,2,0,0,0,0|1,0,1]=4 113 B10R0.71 CCCCCCCCCCBr OR8776 [0,2,0,0,0,0|1,0,0]=3 114 B10R0.41 CCN(CC)CCCCCBr OR470746 [0,2,0,0,0,0|2,0,0]=4 115 B10R0.41 CCN(CC)CCCCCCl OR470747 [0,2,0,0,0,0|2,0,0]=4 116 B8R1.2 BrCC1CCCNC1 OR471031 [1,0,0,1,0,0|2,0,0]=4 117 B8R1.2 CCC1CNCCO1 OR308183 [1,0,0,1,0,0|1,0,0]=3 118 B8R1.2 CC[C@@H]1CNCCO1 OR308185 [1,0,0,1,0,0|1,0,0]=3 119 B8R1.2 CC[C@@H]1COCCN1 OR308178 [1,0,0,1,0,0|2,0,0]=4 120 B8R1.2 CC[C@H]1CNCCO1 OR308184 [1,0,0,1,0,0|1,0,0]=3 121 B8R1.2 CNC1CCNCC1 OR470425 [1,0,0,1,0,0|2,0,0]=4 122 B8R1.2 COC1CCCNC1 OR302757 [1,0,0,1,0,0|2,0,0]=4 123 B8R1.2 ClCC1CCNCC1 OR471034 [1,0,0,1,0,0|2,0,0]=4 124 B8R1.2 ClCC1OCCCO1 OR346179 [1,0,0,1,0,0|2,0,0]=4 125 B8R1.2 Cl[Mg]C1CCCCC1 OR320010 [1,0,0,1,0,0|2,0,0]=4 126 B8R1.2 Cl[Mg]C1CCCCC1 OR320012 [1,0,0,1,0,0|2,0,0]=4 127 B8R1.2 Cl[Mg]C1CCCCC1 OR320013 [1,0,0,1,0,0|2,0,0]=4 128 B8R1.2 FCC1CCCNC1 PC400517 [1,0,0,1,0,0|2,0,0]=4 129 B8R1.2 FCC1CCNCC1 PC430318 [1,0,0,1,0,0|2,0,0]=4 130 B8R1.2 ICC1CCNCC1 OR471030 [1,0,0,1,0,0|2,0,0]=4 131 B8R1.2 OCC1CCCNC1 OR302390 [1,0,0,1,0,0|1,0,0]=3 132 B8R1.2 OCC1CCCNC1 OR350315 [1,0,0,1,0,0|1,0,0]=3 133 B8R1.2 OCC1CNCCO1 OR308192 [1,0,0,1,0,0|2,0,0]=4 134 B8R1.2 OCC1CNCCO1 OR315521 [1,0,0,1,0,0|2,0,0]=4 135 B8R1.2 OCC1COCCN1 OR308163 [1,0,0,1,0,0|2,0,0]=4 136 B8R1.2 OC[C@@H]1CNCCO1 OR308169 [1,0,0,1,0,0|2,0,0]=4 137 B8R1.2 OC[C@H]1CNCCO1 OR308168 [1,0,0,1,0,0|2,0,0]=4 138 B8R1.5 CC1CCCCC1N OR322011 [1,0,0,1,0,0|1,0,0]=3 139 B8R1.5 C[C@@H]1CCCC[C@@H]1N OR471351 [1,0,0,1,0,0|1,0,0]=3 140 B8R1.5 C[C@H]1CCCC[C@H]1N OR471352 [1,0,0,1,0,0|1,0,0]=3 141 B8R1.5 C[C@H]1COCC[C@H]1N OR302579 [1,0,0,1,0,0|2,0,0]=4 142 B8R1.5 FC1CCCCC1Br PC8345 [1,0,0,1,0,0|2,0,0]=4 143 B8R1.5 NC1CCNCC1O OR480288 [1,0,0,1,0,0|2,0,0]=4 144 B8R1.5 O[C@@H]1CNCC[C@H]1F PC409062 [1,0,0,1,0,0|2,0,0]=4 145 B8R1.8 CCN[C@H]1CCNC1 OR322670 [1,0,0,1,0,0|2,0,0]=4 146 B8R1.8 NCCC1CCCC1 OR322275 [1,0,0,1,0,0|1,0,0]=3 147 B8R1.8 NNCC1CCCC1 OR322929 [1,0,0,1,0,0|2,0,0]=4 148 B8R1.10 CNCCC1CCC1 OR451079 [1,0,0,1,0,0|1,0,0]=3 149 B8R1.10 OCCCC1CNC1 OR312190 [1,0,0,1,0,0|1,0,0]=3 150 B8R1.10 OCCNC1COC1 OR312182 [1,0,0,1,0,0|2,0,0]=4 151 B8R1.11 CN1CCC[C@@H]1CO OR315047 [1,0,0,1,0,0|1,0,0]=3 152 B8R1.11 N[C@H]1CCC[C@H]1CO OR307659 [1,0,0,1,0,0|1,0,0]=3 153 B8R1.22 NC1CCCCCC1 OR10092 [1,0,0,1,0,0|1,0,0]=3 154 B8R1.36 OCCCCC1CN1 OR340173 [1,0,0,1,0,0|1,0,0]=3 155 B10R1.10 CCCN1CCCC(O)C1 OR471449 [0,1,0,1,0,0|1,0,0]=3 156 B10R1.18 CN(C)C[C@@H]1CNCCO1 OR451065 [0,1,0,1,0,0|2,0,0]=4 157 B10R1.18 CN(C)C[C@H]1CNCCO1 OR451066 [0,1,0,1,0,0|2,0,0]=4 158 B10R1.18 O=C(O)CC1CCCCN1 OR470052 [0,1,0,1,0,0|1,0,1]=4 159 B10R1.18 O=C(O)CC1CCNCC1 OR8971 [0,1,0,1,0,0|1,0,1]=4 160 B10R1.38 C[C@]1(N)CCCC[C@H]1CO OR307596 [0,1,0,1,0,0|0,0,0]=2 161 B10R1.38 C[C@]1(O)CCCC[C@H]1CN OR307599 [0,1,0,1,0,0|1,0,0]=3 162 B10R1.38 OCC1CCNCC1(F)F PC430301 [0,1,0,1,0,0|2,0,0]=4 163 B10R1.38 OCC1CNCCC1(F)F PC430178 [0,1,0,1,0,0|2,0,0]=4 164 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O OR309359 [0,1,0,1,0,0|1,0,1]=4 165 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O OR307112 [0,1,0,1,0,0|1,0,1]=4 166 B10R1.21 N#CCCNC1CCCC1 OR302367 [0,1,0,1,0,0|1,0,1]=4 167 B10R1.137 CCOC(=O)CC1CCO1 OR309063 [0,1,0,1,0,0|1,0,1]=4 168 B10R1.17 BrCCCN1CCCCC1 OR471188 [0,1,0,1,0,0|1,0,0]=3 169 B10R1.17 BrCCCN1CCOCC1 OR471189 [0,1,0,1,0,0|2,0,0]=4 170 B10R1.17 COCCC1CCCCN1 OR302436 [0,1,0,1,0,0|1,0,0]=3 171 B10R1.17 OCCCC1CCCNC1 OR470567 [0,1,0,1,0,0|0,0,0]=2 172 B10R1.17 OCCCN1CCOCC1 OR310606 [0,1,0,1,0,0|1,0,0]=3 173 B10R1.17 OCCNC1CCCCC1 OR322052 [0,1,0,1,0,0|0,0,0]=2 174 B10R1.17 OCCOC1CCCCC1 OR470058 [0,1,0,1,0,0|0,0,0]=2 175 B10R1.17 S=C=NCC1CCCCC1 OR322093 [0,1,0,1,0,0|0,1,1]=4 176 B10R1.216 CCCC[N+]1(C)CCCC1 PC1926 [0,1,0,1,0,0|2,0,0]=4 177 B10R1.1 NN1CCN(CCO)CC1 OR322388 [0,1,0,1,0,0|2,0,0]=4 178 B10R1.1 OC1CCN(CCF)CC1 PC3464 [0,1,0,1,0,0|2,0,0]=4 179 B10R1.15 N[C@@H](CO)C1CCCCC1 OR316024 [0,1,0,1,0,0|0,0,0]=2 180 B10R1.15 N[C@H](CO)C1CCCCC1 OR316023 [0,1,0,1,0,0|0,0,0]=2 181 B10R2.1 NC1CC12CCCCC2 OR315179 [0,0,0,2,0,0|1,0,0]=3 182 B10R2.1 NC1CC12CCOCC2 OR306566 [0,0,0,2,0,0|2,0,0]=4 183 B10R2.7 C1CNC2CCCC2C1 OR302431 [0,0,0,2,0,0|1,0,0]=3 184 B10R2.408 C1CC2CCCC(C1)N2 OR302571 [0,0,0,2,0,0|1,0,0]=3 185 B10R2.408 C1CC2CNCC(C1)C2 OR302421 [0,0,0,2,0,0|2,0,0]=4 186 B10R2.409 C1CC2CCC1CNC2 OR350406 [0,0,0,2,0,0|2,0,0]=4 187 B10R2.484 C1CC2(C1)CCNCC2 OR317147 [0,0,0,2,0,0|2,0,0]=4 188 B10R2.484 C1CC2(CCN1)CCO2 OR301345 [0,0,0,2,0,0|1,0,0]=3 189 B10R2.484 C1CCC2(CC1)CNC2 OR312339 [0,0,0,2,0,0|2,0,0]=4 190 B10R2.484 C1CCC2(CCC2)NC1 OR312262 [0,0,0,2,0,0|1,0,0]=3 191 B10R2.484 C1CCC2(CCC2)NC1 OR317071 [0,0,0,2,0,0|1,0,0]=3 192 B10R2.484 C1CCC2(COC2)NC1 OR309121 [0,0,0,2,0,0|2,0,0]=4 193 B10R2.484 C1CNCC2(C1)CCC2 OR312261 [0,0,0,2,0,0|2,0,0]=4 194 B10R2.484 C1CNCC2(C1)CCO2 OR470832 [0,0,0,2,0,0|1,0,0]=3 195 B10R2.484 C1COC2(CN1)COC2 OR312320 [0,0,0,2,0,0|2,0,0]=4 196 B10R2.99 OCC1CC2C=CC1C2 OR315262 [0,0,0,2,0,0|0,0,2]=4 197 B10R2.138 C1CC2CCC(CN1)O2 OR315189 [0,0,0,2,0,0|1,0,0]=3 198 B10R2.2 NN1CC2CCCC2C1 OR322305 [0,0,0,2,0,0|2,0,0]=4