0 B11R0.3 BrCCCCCCCCCCBr 1P003307 [0,0,0,0,0,0|2,0,2]=4 1 B11R0.3 CCCCCCC=CC=CC=O 1P000ZZM [0,0,0,0,0,0|0,0,4]=4 2 B11R0.3 CCCCCCC=CC=CCO 1P003GCE [0,0,0,0,0,0|0,0,2]=2 3 B11R0.3 CCCCCCCCCCC#C 1P003EQS [0,0,0,0,0,0|1,0,3]=4 4 B11R0.3 CCCCCCCCCCC#N 1P003VQJ [0,0,0,0,0,0|1,0,3]=4 5 B11R0.3 CCCCCCCCCCC=C 1P003EQN [0,0,0,0,0,0|1,0,3]=4 6 B11R0.3 CCCCCCCCCCC=O 1P003VQG [0,0,0,0,0,0|0,0,4]=4 7 B11R0.3 CCCCCCCCCCCBr 1P003372 [0,0,0,0,0,0|1,0,2]=3 8 B11R0.3 CCCCCCCCCCCC 1P003QBY [0,0,0,0,0,0|1,0,2]=3 9 B11R0.3 CCCCCCCCCCCCl 1P002PQD [0,0,0,0,0,0|1,0,2]=3 10 B11R0.3 CCCCCCCCCCCI 1P003EWM [0,0,0,0,0,0|1,0,2]=3 11 B11R0.3 CCCCCCCCCCCO 1P0033AU [0,0,0,0,0,0|0,0,2]=2 12 B11R0.3 CCCCCCCCCCNC 1P005QI5 [0,0,0,0,0,0|2,0,2]=4 13 B11R0.3 CCCCCCCCCCNN 1P028BV9 [0,0,0,0,0,0|2,0,2]=4 14 B11R0.3 CCCCCCCCCN=[N+]=[N-] 1P0055P7 [0,0,0,0,0,0|3,0,1]=4 15 B11R0.3 CCCCCCCCNCCN 1P003TQ8 [0,0,0,0,0,0|2,0,1]=3 16 B11R0.3 CCCCCCCCNCCO 1P00D12Z [0,0,0,0,0,0|1,0,1]=2 17 B11R0.3 CCCCCCCCOCCO 1P0001OI [0,0,0,0,0,0|1,0,1]=2 18 B11R0.3 CCCCCCCCSCCO 1P0036GN [0,0,0,0,0,0|1,0,1]=2 19 B11R0.3 CCCCCCCC\C=C\C=O 1P00366F [0,0,0,0,0,0|0,0,2]=2 20 B11R0.3 CCCCCCCNCCCO 1P019VBC [0,0,0,0,0,0|1,0,2]=3 21 B11R0.3 CCCCCC\C=C\C=C\C=O 1P0030BQ [0,0,0,0,0,0|0,0,4]=4 22 B11R0.3 CCNCCCCCCNCC 1P000VL7 [0,0,0,0,0,0|3,0,1]=4 23 B11R0.3 ClCCCCCCCCCCBr 1P002W8W [0,0,0,0,0,0|2,0,2]=4 24 B11R0.3 ClCCCCCCCCCCCl 1P007Q66 [0,0,0,0,0,0|2,0,2]=4 25 B11R0.3 ICCCCCCCCCCI 1P001UON [0,0,0,0,0,0|2,0,2]=4 26 B11R0.3 NCCCCCCCCCCN 1P003DNW [0,0,0,0,0,0|2,0,2]=4 27 B11R0.3 NCCCCCCCCCCO 1P002MW9 [0,0,0,0,0,0|1,0,2]=3 28 B11R0.3 OCCCCCCCCCC#C 1P002V3M [0,0,0,0,0,0|0,0,4]=4 29 B11R0.3 OCCCCCCCCCC=C 1P003EB4 [0,0,0,0,0,0|0,0,4]=4 30 B11R0.3 OCCCCCCCCCCBr 1P00334H [0,0,0,0,0,0|1,0,2]=3 31 B11R0.3 OCCCCCCCCCCCl 1P00IKUV [0,0,0,0,0,0|1,0,2]=3 32 B11R0.3 OCCCCCCCCCCO 1P003306 [0,0,0,0,0,0|1,0,2]=3 33 B11R0.3 OCCOCCOCCOCC 1P0082UI [0,0,0,0,0,0|3,0,1]=4 34 B11R0.3 OCCSCCCCSCCO 1P005Z5P [0,0,0,0,0,0|3,0,1]=4 35 B11R0.3 SCCCCCCCCCCS 1P000IO7 [0,0,0,0,0,0|1,1,2]=4 36 B10R0.71 BrCCCCCCCCC=C 1P003EAP [1,0,0,0,0,0|1,0,2]=4 37 B10R0.71 BrCCCCCCCCCBr 1P0037N8 [1,0,0,0,0,0|2,0,1]=4 38 B10R0.71 CCCCC#CCCCCO 1P003N6G [1,0,0,0,0,0|0,0,3]=4 39 B10R0.71 CCCCCCCC#CCO 1P003PPQ [1,0,0,0,0,0|0,0,2]=3 40 B10R0.71 CCCCCCCC=CC=O 1P00366B [1,0,0,0,0,0|0,0,2]=3 41 B10R0.71 CCCCCCCCCC#C 1P003F4U [1,0,0,0,0,0|0,0,3]=4 42 B10R0.71 CCCCCCCCCC#N 1P002BB4 [1,0,0,0,0,0|1,0,2]=4 43 B10R0.71 CCCCCCCCCC=O 1P003PQ0 [1,0,0,0,0,0|0,0,2]=3 44 B10R0.71 CCCCCCCCCCBr 1P00355J [1,0,0,0,0,0|1,0,1]=3 45 B10R0.71 CCCCCCCCCCC 1P003TUT [1,0,0,0,0,0|0,0,2]=3 46 B10R0.71 CCCCCCCCCCCl 1P0001OR [1,0,0,0,0,0|1,0,1]=3 47 B10R0.71 CCCCCCCCCCF 1P003ESX [1,0,0,0,0,0|1,0,1]=3 48 B10R0.71 CCCCCCCCCCI 1P002A9D [1,0,0,0,0,0|1,0,1]=3 49 B10R0.71 CCCCCCCCCCN 1P002E07 [1,0,0,0,0,0|1,0,1]=3 50 B10R0.71 CCCCCCCCCCO 1P00355I [1,0,0,0,0,0|0,0,1]=2 51 B10R0.71 CCCCCCCCCCS 1P0039EB [1,0,0,0,0,0|0,1,1]=3 52 B10R0.71 CCCCCCCCCNC 1P00CAVB [1,0,0,0,0,0|1,0,1]=3 53 B10R0.71 CCCCCCCCCNC 1P019X1L [1,0,0,0,0,0|1,0,1]=3 54 B10R0.71 CCCCCCCCN=C=O 1P003F1O [1,0,0,0,0,0|1,0,2]=4 55 B10R0.71 CCCCCCCCN=C=S 1P003TXQ [1,0,0,0,0,0|1,1,1]=4 56 B10R0.71 CCCCCCCCN=[N+]=[N-] 1P01JPUA [1,0,0,0,0,0|3,0,0]=4 57 B10R0.71 CCCCCCCCNC=O 1P00EFFC [1,0,0,0,0,0|1,0,1]=3 58 B10R0.71 CCCCCCCCOC=C 1P006KEJ [1,0,0,0,0,0|1,0,1]=3 59 B10R0.71 CCCCCCCCOC=O 1P009RCI [1,0,0,0,0,0|1,0,1]=3 60 B10R0.71 CCCCCNCCCCC 1P002AAK [1,0,0,0,0,0|1,0,2]=4 61 B10R0.71 CCCCCNCCCOC 1P008SV1 [1,0,0,0,0,0|2,0,1]=4 62 B10R0.71 CCCCCSCCCCC 1P003Q54 [1,0,0,0,0,0|1,0,2]=4 63 B10R0.71 CCCCC\C=C/CCCO 1P003PFU [1,0,0,0,0,0|0,0,3]=4 64 B10R0.71 CCCCOCCOCCO 1P00351F [1,0,0,0,0,0|2,0,1]=4 65 B10R0.71 CCCC\C=C/CCCCO 1P006UVP [1,0,0,0,0,0|0,0,3]=4 66 B10R0.71 CCCC\C=C\CCCCO 1P003VF5 [1,0,0,0,0,0|0,0,3]=4 67 B10R0.71 ClCCCCCCCCCCl 1P005ICV [1,0,0,0,0,0|2,0,1]=4 68 B10R0.71 ICCCCCCCCC=C 1P000VU0 [1,0,0,0,0,0|1,0,2]=4 69 B10R0.71 NCCCCCCCCC=C 1P00DNKA [1,0,0,0,0,0|1,0,2]=4 70 B10R0.71 NCCCCCCCCC=C 1P01BBIR [1,0,0,0,0,0|1,0,2]=4 71 B10R0.71 NCCCCCCCCCN 1P003E96 [1,0,0,0,0,0|2,0,1]=4 72 B10R0.71 NCCCCCCCCCO 1P01G2KI [1,0,0,0,0,0|1,0,1]=3 73 B10R0.71 NCCCCCCCCCO 1P028EJD [1,0,0,0,0,0|1,0,1]=3 74 B10R0.71 OCCCCCCCCC#C 1P002554 [1,0,0,0,0,0|0,0,3]=4 75 B10R0.71 OCCCCCCCCC=C 1P000UKY [1,0,0,0,0,0|0,0,3]=4 76 B10R0.71 OCCCCCCCCCBr 1P0034VR [1,0,0,0,0,0|1,0,1]=3 77 B10R0.71 OCCCCCCCCCCl 1P0037SY [1,0,0,0,0,0|1,0,1]=3 78 B10R0.71 OCCCCCCCCCO 1P00397I [1,0,0,0,0,0|1,0,1]=3 79 B10R0.71 OCCCCNCCCCO 1P00349O [1,0,0,0,0,0|2,0,1]=4 80 B10R0.71 OCCCCOCCCCCl 1P01C4GB [1,0,0,0,0,0|2,0,1]=4 81 B10R0.71 OCCOCCCCCCCl 1P01DXZV [1,0,0,0,0,0|2,0,1]=4 82 B10R0.71 SCCCCCCCCCS 1P003E99 [1,0,0,0,0,0|1,1,1]=4 83 B12R0.1 BrCCCCCCCC(=O)OCC 1P0036NL [0,1,0,0,0,0|3,0,0]=4 84 B12R0.1 CCCCCCCCC(=O)OCC 1P000KD0 [0,1,0,0,0,0|2,0,0]=3 85 B12R0.1 CCCCCCCOC(=O)CCC 1P00E9RF [0,1,0,0,0,0|2,0,1]=4 86 B12R0.1 NCCCCCCCC(=O)OCC 1P019TQ7 [0,1,0,0,0,0|3,0,0]=4 87 B12R0.1 OCCCCCCCC(=O)OCC 1P005ZM1 [0,1,0,0,0,0|3,0,0]=4 88 B12R0.5 BrCCCCCCCCCCCBr 1P001XIQ [0,1,0,0,0,0|1,0,2]=4 89 B12R0.5 CCCCCCCCCC#CCO 1P005YVN [0,1,0,0,0,0|0,0,2]=3 90 B12R0.5 CCCCCCCCCCCC#C 1P002SL8 [0,1,0,0,0,0|1,0,2]=4 91 B12R0.5 CCCCCCCCCCCC#N 1P003QC4 [0,1,0,0,0,0|1,0,2]=4 92 B12R0.5 CCCCCCCCCCCC=C 1P003F4Q [0,1,0,0,0,0|1,0,2]=4 93 B12R0.5 CCCCCCCCCCCC=O 1P003QCB [0,1,0,0,0,0|0,0,3]=4 94 B12R0.5 CCCCCCCCCCCCBr 1P00336S [0,1,0,0,0,0|1,0,2]=4 95 B12R0.5 CCCCCCCCCCCCC 1P003TUM [0,1,0,0,0,0|1,0,2]=4 96 B12R0.5 CCCCCCCCCCCCCl 1P0035JW [0,1,0,0,0,0|1,0,2]=4 97 B12R0.5 CCCCCCCCCCCCF 1P003ESY [0,1,0,0,0,0|1,0,2]=4 98 B12R0.5 CCCCCCCCCCCCI 1P003EWF [0,1,0,0,0,0|1,0,2]=4 99 B12R0.5 CCCCCCCCCCCCN 1P000LU2 [0,1,0,0,0,0|1,0,2]=4 100 B12R0.5 CCCCCCCCCCCCN 1P002E08 [0,1,0,0,0,0|1,0,2]=4 101 B12R0.5 CCCCCCCCCCCCN 1P002SPM [0,1,0,0,0,0|1,0,2]=4 102 B12R0.5 CCCCCCCCCCCCN 1P003QCG [0,1,0,0,0,0|1,0,2]=4 103 B12R0.5 CCCCCCCCCCCCN 1P01DFU7 [0,1,0,0,0,0|1,0,2]=4 104 B12R0.5 CCCCCCCCCCCCO 1P00337T [0,1,0,0,0,0|0,0,2]=3 105 B12R0.5 CCCCCCCCCCCNN 1P027Z5K [0,1,0,0,0,0|1,0,2]=4 106 B12R0.5 CCCCCCCCC\C=C\C=O 1P0071OJ [0,1,0,0,0,0|0,0,2]=3 107 B12R0.5 CCCCCCCCNCCCN 1P005G33 [0,1,0,0,0,0|1,0,2]=4 108 B12R0.5 CCCCCCCCOCCCN 1P019YLX [0,1,0,0,0,0|1,0,2]=4 109 B12R0.5 CCCCCCCC\C=C/CCO 1P00399I [0,1,0,0,0,0|0,0,0]=1 110 B12R0.5 CCCCCCCOCCCCO 1P01FPH4 [0,1,0,0,0,0|0,0,2]=3 111 B12R0.5 CCCCCCC\C=C\C=C\C=O 1P003CHN [0,1,0,0,0,0|0,0,3]=4 112 B12R0.5 CCCCCCNCCCCCC 1P003Q4W [0,1,0,0,0,0|1,0,2]=4 113 B12R0.5 CCCCCCOCCOCCO 1P00HCSY [0,1,0,0,0,0|1,0,1]=3 114 B12R0.5 CCCCCCSCCCCCC 1P003TIW [0,1,0,0,0,0|1,0,2]=4 115 B12R0.5 CCCC\C=C/CCCCCCO 1P00BGOL [0,1,0,0,0,0|0,0,3]=4 116 B12R0.5 CCCC\C=C\CCCCCCO 1P001XI3 [0,1,0,0,0,0|0,0,3]=4 117 B12R0.5 CCC\C=C/CCCCCCCO 1P00C0Y8 [0,1,0,0,0,0|2,0,0]=3 118 B12R0.5 NCCCCCCCCCCCN 1P003DO0 [0,1,0,0,0,0|1,0,2]=4 119 B12R0.5 NCCCCCCCCCCCO 1P01ALKO [0,1,0,0,0,0|0,0,2]=3 120 B12R0.5 OCCCCCCCCC#CCC 1P003O1C [0,1,0,0,0,0|0,0,3]=4 121 B12R0.5 OCCCCCCCCCCC#C 1P0023QA [0,1,0,0,0,0|0,0,3]=4 122 B12R0.5 OCCCCCCCCCCC=C 1P007EDW [0,1,0,0,0,0|0,0,3]=4 123 B12R0.5 OCCCCCCCCCCCBr 1P001SMG [0,1,0,0,0,0|0,0,2]=3 124 B12R0.5 OCCCCCCCCCCCO 1P003DO3 [0,1,0,0,0,0|0,0,2]=3 125 B12R0.5 OCCCCCCCCCCCS 1P003EBN [0,1,0,0,0,0|0,0,2]=3 126 B12R0.5 OCCCCCCCCCOCC 1P00DBL7 [0,1,0,0,0,0|0,0,2]=3 127 B12R0.5 OCCCCCCCC\C=C/CC 1P007G1P [0,1,0,0,0,0|1,0,0]=2 128 B12R0.5 OCCCCCCC\C=C\C=C\C 1P007IRD [0,1,0,0,0,0|1,0,2]=4 129 B12R0.206 CCCCCCCC(=O)NCCO 1P00FU3T [0,1,0,0,0,0|1,0,2]=4 130 B12R0.206 CCCCCCCC(=O)SCCO 1P01JMMV [0,1,0,0,0,0|1,0,2]=4 131 B12R0.234 CCCCCCCCC=CC(=O)O 1P003IF8 [0,1,0,0,0,0|0,0,1]=2 132 B12R0.234 CCCCCCCCC=CC(=O)[O-] 1P003VV3 [0,1,0,0,0,0|0,0,2]=3 133 B12R0.234 CCCCCCCCCCB(O)O 1P002OOL [0,1,0,0,0,0|1,0,2]=4 134 B12R0.234 CCCCCCCCCCC(=O)O 1P003RB4 [0,1,0,0,0,0|0,0,3]=4 135 B12R0.234 CCCCCCCCCCC(N)C 1P007M64 [0,1,0,0,0,0|1,0,2]=4 136 B12R0.234 CCCCCCCCCCC(O)C 1P0006VP [0,1,0,0,0,0|0,0,2]=3 137 B12R0.234 CCCCCCCCOCC(=O)O 1P00EMDM [0,1,0,0,0,0|1,0,2]=4 138 B12R0.234 CCCCCCCC\C=C\C(=O)O 1P001QA1 [0,1,0,0,0,0|0,0,1]=2 139 B12R0.234 OCCCCCCCC=CC(=O)O 1P00ID7H [0,1,0,0,0,0|1,0,1]=3 140 B12R0.234 OCCCCCCC\C=C\C(=O)O 1P001GFL [0,1,0,0,0,0|1,0,1]=3 141 B12R0.248 CCCCCCCCCC(=O)NN 1P002A5M [0,1,0,0,0,0|2,0,1]=4 142 B12R0.248 CCCCCCCCCC(=O)NO 1P01ACG8 [0,1,0,0,0,0|1,0,1]=3 143 B12R0.248 CCCCCCCCCC(=O)OC 1P003SGO [0,1,0,0,0,0|2,0,1]=4 144 B12R0.248 CCCCCCCCNC(=O)C=C 1P0004HT [0,1,0,0,0,0|2,0,1]=4 145 B12R0.248 CCCCCCCCOC(=O)C=C 1P00I58H [0,1,0,0,0,0|2,0,1]=4 146 B12R0.248 CCCCCCCCOC(=O)CN 1P003R92 [0,1,0,0,0,0|2,0,0]=3 147 B12R0.248 CCCCCCCCOC(=O)CS 1P003TQ7 [0,1,0,0,0,0|1,1,0]=3 148 B12R0.248 OCCCCCCCCC(CO)O 1P003DQ4 [0,1,0,0,0,0|1,0,2]=4 149 B12R1.8 CCCCCCC1CCCNC1 1P01ATAO [0,0,0,1,0,0|2,0,1]=4 150 B12R1.8 CCCCCCC1CCNCC1 1P01ATAP [0,0,0,1,0,0|2,0,1]=4 151 B12R1.8 COCCNCC1CCC=CC1 1P01BE4H [0,0,0,1,0,0|3,0,0]=4 152 B12R1.8 OCCCCCN1CCCCC1 1P002YN1 [0,0,0,1,0,0|1,0,2]=4 153 B12R1.8 OCCOCCN1CCCCC1 1P0038GD [0,0,0,1,0,0|2,0,1]=4 154 B12R1.37 CCCCCCCC1CCCN1 1P028J5P [0,0,0,1,0,0|1,0,2]=4 155 B12R1.37 CCCCCCCC1CCNC1 1P028IH7 [0,0,0,1,0,0|2,0,1]=4 156 B12R1.37 CCCCCCCC1OCCO1 1P0073ZN [0,0,0,1,0,0|1,0,1]=3 157 B12R1.37 CCCCCCCc1ccsc1 1P003JZ7 [0,0,0,1,0,0|2,0,1]=4 158 B12R1.121 OCCOC1CCCCC1CC 1P01ADCG [0,0,0,1,0,0|1,0,1]=3 159 B12R1.329 OCCCN1CCCCCCC1 1P01A76I [0,0,0,1,0,0|1,0,2]=4 160 B12R1.329 OCCNC1CCCCCCC1 1P01BDCH [0,0,0,1,0,0|1,0,1]=3 161 B12R1.329 OCCNC1CCCCCCC1 1P01BDM4 [0,0,0,1,0,0|1,0,1]=3 162 B12R1.375 BrCCCCCCCCC1CC1 1P028VIQ [0,0,0,1,0,0|1,0,2]=4 163 B12R1.375 NCCCCCCCCC1CC1 1P028W6Z [0,0,0,1,0,0|1,0,2]=4 164 B12R1.375 OCCCCCCCCC1CC1 1P028VZJ [0,0,0,1,0,0|0,0,2]=3 165 B12R1.375 OCCCCCCCCC1CO1 1P028VQQ [0,0,0,1,0,0|1,0,2]=4 166 B12R1.375 SCCCCCCCCC1CC1 1P027Z3A [0,0,0,1,0,0|0,1,2]=4 167 B12R1.550 C1CCCCCC=CCCCC1 1P001MS2 [0,0,0,1,0,0|1,0,0]=2 168 B12R1.550 C1CCCCCCCCCCC1 1P002YQN [0,0,0,1,0,0|1,0,2]=4 169 B12R1.1410 CCCCCC1OC1C\C=C\O 1P007MN1 [0,0,0,1,0,0|1,0,2]=4 170 B12R1.1414 OCCCNC1CCCCCC1 1P027Z5U [0,0,0,1,0,0|1,0,2]=4 171 B9R0.45 BrCCCCCCCC=C 1P0036Q8 [2,0,0,0,0,0|1,0,0]=3 172 B9R0.45 BrCCCCCCCCBr 1P003347 [2,0,0,0,0,0|2,0,0]=4 173 B9R0.45 C=CCCCCCCC=C 1P001VIT [2,0,0,0,0,0|0,0,2]=4 174 B9R0.45 CCC=CCCC=CCO 1P008OOS [2,0,0,0,0,0|0,0,2]=4 175 B9R0.45 CCCCCCCCC#C 1P003EQC [2,0,0,0,0,0|0,0,2]=4 176 B9R0.45 CCCCCCCCC#N 1P003TQ4 [2,0,0,0,0,0|1,0,1]=4 177 B9R0.45 CCCCCCCCC=C 1P003EQB [2,0,0,0,0,0|0,0,0]=2 178 B9R0.45 CCCCCCCCC=O 1P000LU5 [2,0,0,0,0,0|0,0,1]=3 179 B9R0.45 CCCCCCCCCBr 1P00336X [2,0,0,0,0,0|1,0,0]=3 180 B9R0.45 CCCCCCCCCC 1P000LU6 [2,0,0,0,0,0|0,0,1]=3 181 B9R0.45 CCCCCCCCCCl 1P002PQE [2,0,0,0,0,0|1,0,0]=3 182 B9R0.45 CCCCCCCCCI 1P003EWH [2,0,0,0,0,0|1,0,0]=3 183 B9R0.45 CCCCCCCCCN 1P003TQZ [2,0,0,0,0,0|1,0,0]=3 184 B9R0.45 CCCCCCCCCO 1P003F1B [2,0,0,0,0,0|0,0,0]=2 185 B9R0.45 CCCCCCCCNC 1P003TOZ [2,0,0,0,0,0|1,0,0]=3 186 B9R0.45 CCCCCCCC[Mg]Br 1P003TQ9 [2,0,0,0,0,0|2,0,0]=4 187 B9R0.45 CCCCCCCNC=O 1P00F2XX [2,0,0,0,0,0|1,0,1]=4 188 B9R0.45 CCCCCCCNCC 1P0035UB [2,0,0,0,0,0|1,0,1]=4 189 B9R0.45 CCCCCCNCCO 1P00DHAH [2,0,0,0,0,0|1,0,0]=3 190 B9R0.45 CCCCCCOCCO 1P009Q2T [2,0,0,0,0,0|1,0,0]=3 191 B9R0.45 CCCCCCOCCS 1P028OWQ [2,0,0,0,0,0|1,1,0]=4 192 B9R0.45 CCCCCC\C=C/CO 1P003PEU [2,0,0,0,0,0|0,0,0]=2 193 B9R0.45 CCCCCC\C=C\C=O 1P002H9P [2,0,0,0,0,0|0,0,2]=4 194 B9R0.45 CCCCCC\C=C\CO 1P003VD9 [2,0,0,0,0,0|0,0,0]=2 195 B9R0.45 CCCCCNCCC=C 1P028LV9 [2,0,0,0,0,0|1,0,0]=3 196 B9R0.45 CCCCC\C=C/CCO 1P003PFK [2,0,0,0,0,0|0,0,2]=4 197 B9R0.45 CCCCC\C=C\CC=C 1P028052 [2,0,0,0,0,0|0,0,2]=4 198 B9R0.45 CCCCC\C=C\CCO 1P00867N [2,0,0,0,0,0|0,0,2]=4 199 B9R0.45 CCCCNCCCCO 1P003KQG [2,0,0,0,0,0|1,0,0]=3 200 B9R0.45 CCCCOCCCCO 1P0038BC [2,0,0,0,0,0|1,0,0]=3 201 B9R0.45 CCCC\C=C\CCCO 1P001XI5 [2,0,0,0,0,0|0,0,2]=4 202 B9R0.45 CCCOCCOCCO 1P006H7P [2,0,0,0,0,0|2,0,0]=4 203 B9R0.45 CC\C=C/CC\C=C\CO 1P003VB5 [2,0,0,0,0,0|0,0,2]=4 204 B9R0.45 CNCCCCCCCO 1P027UT7 [2,0,0,0,0,0|1,0,0]=3 205 B9R0.45 CNCCCCCCNC 1P000VL8 [2,0,0,0,0,0|2,0,0]=4 206 B9R0.45 COCCCCCCOC 1P00107G [2,0,0,0,0,0|2,0,0]=4 207 B9R0.45 ClCCCCCCCC=C 1P004S8L [2,0,0,0,0,0|1,0,0]=3 208 B9R0.45 ClCCCCCCCCBr 1P002W8X [2,0,0,0,0,0|2,0,0]=4 209 B9R0.45 ClCCCCCCCCCl 1P003E8O [2,0,0,0,0,0|2,0,0]=4 210 B9R0.45 ICCCCCCCCI 1P002PUG [2,0,0,0,0,0|2,0,0]=4 211 B9R0.45 NCCCCCCCC=C 1P01BCF4 [2,0,0,0,0,0|1,0,0]=3 212 B9R0.45 NCCCCCCCCN 1P003E8L [2,0,0,0,0,0|2,0,0]=4 213 B9R0.45 NCCCCCCCCO 1P002ESB [2,0,0,0,0,0|1,0,0]=3 214 B9R0.45 NCCCCCCCCO 1P028H2N [2,0,0,0,0,0|1,0,0]=3 215 B9R0.45 NCCNCCCCCO 1P024I6J [2,0,0,0,0,0|2,0,0]=4 216 B9R0.45 OCCCCCCCC#C 1P0005EG [2,0,0,0,0,0|0,0,2]=4 217 B9R0.45 OCCCCCCCC=C 1P000UT0 [2,0,0,0,0,0|1,0,0]=3 218 B9R0.45 OCCCCCCCC=O 1P007QFH [2,0,0,0,0,0|1,0,1]=4 219 B9R0.45 OCCCCCCCCBr 1P0034VD [2,0,0,0,0,0|1,0,0]=3 220 B9R0.45 OCCCCCCCCCl 1P002MSB [2,0,0,0,0,0|1,0,0]=3 221 B9R0.45 OCCCCCCCCO 1P003E90 [2,0,0,0,0,0|1,0,0]=3 222 B9R0.45 OCCCCCOCCO 1P028MN6 [2,0,0,0,0,0|2,0,0]=4 223 B9R0.45 OCCCCC\C=C/CC 1P003PGA [2,0,0,0,0,0|0,0,2]=4 224 B9R0.45 SCCCCCCCC=C 1P028TO2 [2,0,0,0,0,0|1,0,0]=3 225 B9R0.45 SCCCCCCCCS 1P000IO8 [2,0,0,0,0,0|1,1,0]=4 226 B11R0.4 CCCCCCCC(=O)CCC 1P001KLF [1,1,0,0,0,0|1,0,1]=4 227 B11R0.4 CCCCCCCC(=O)OCC 1P003QV5 [1,1,0,0,0,0|2,0,0]=4 228 B11R0.4 CCCCCCOC(=O)C=CC 1P002FCG [1,1,0,0,0,0|1,0,1]=4 229 B11R0.40 BrCCCCCCCC(=O)CCl 1P028CR2 [1,1,0,0,0,0|2,0,0]=4 230 B11R0.40 BrCCCCCCCC(=O)OC 1P007N2N [1,1,0,0,0,0|2,0,0]=4 231 B11R0.40 CCCCCCCCC(=O)OC 1P001Z2N [1,1,0,0,0,0|1,0,0]=3 232 B11R0.40 CCCCCCCCC(C=O)C 1P00ACIS [1,1,0,0,0,0|0,0,2]=4 233 B11R0.40 CCCCCCCCC(CC)O 1P003KDR [1,1,0,0,0,0|0,0,2]=4 234 B11R0.40 CCCCCCCCC(CO)N 1P01BNU3 [1,1,0,0,0,0|0,0,1]=3 235 B11R0.40 CCCCCCCCC(CO)O 1P003DTV [1,1,0,0,0,0|0,0,1]=3 236 B11R0.40 CCCCCCOCC(CO)O 1P0086M3 [1,1,0,0,0,0|1,0,1]=4 237 B11R0.40 NCCCCCCCC(=O)OC 1P008NEX [1,1,0,0,0,0|2,0,0]=4 238 B11R0.40 OCCCCCCCC(=O)OC 1P0028RG [1,1,0,0,0,0|2,0,0]=4 239 B11R0.140 CCCCCC(CCCCC)N 1P00CLKI [1,1,0,0,0,0|0,0,2]=4 240 B11R0.140 CCCCCC(CCCCC)O 1P0034UB [1,1,0,0,0,0|0,0,2]=4 241 B11R0.148 BrCCCCCCCCC(=O)O 1P003O15 [1,1,0,0,0,0|1,0,1]=4 242 B11R0.148 CCCCCCCC=CC(=O)O 1P00ABWS [1,1,0,0,0,0|0,0,1]=3 243 B11R0.148 CCCCCCCCCC(=O)C 1P003SI6 [1,1,0,0,0,0|0,0,1]=3 244 B11R0.148 CCCCCCCCCC(=O)Cl 1P008RJA [1,1,0,0,0,0|0,0,2]=4 245 B11R0.148 CCCCCCCCCC(=O)N 1P003PQ1 [1,1,0,0,0,0|0,0,2]=4 246 B11R0.148 CCCCCCCCCC(=O)O 1P0037TK [1,1,0,0,0,0|0,0,1]=3 247 B11R0.148 CCCCCCCCCC(=O)[O-] 1P0001OW [1,1,0,0,0,0|0,0,2]=4 248 B11R0.148 CCCCCCCCCC(O)C 1P001WJA [1,1,0,0,0,0|0,0,1]=3 249 B11R0.148 CCCCCCCCNC(=O)C 1P01B9HX [1,1,0,0,0,0|1,0,0]=3 250 B11R0.148 CCCCCCCCNC(=O)N 1P003AUV [1,1,0,0,0,0|1,0,1]=4 251 B11R0.148 CCCCCCCCNC(=S)N 1P0011OT [1,1,0,0,0,0|1,1,0]=4 252 B11R0.148 CCCCCCCCOC(=O)C 1P003TXL [1,1,0,0,0,0|1,0,0]=3 253 B11R0.148 CCCCCCCCOC(=O)Cl 1P003PAH [1,1,0,0,0,0|1,0,1]=4 254 B11R0.148 CCCCCCCC[SiH2]C(Cl)Cl 1P001FTD [1,1,0,0,0,0|1,1,0]=4 255 B11R0.148 CCCCCCCNCC(=O)O 1P01AH6G [1,1,0,0,0,0|1,0,1]=4 256 B11R0.148 CCCCCCC\C=C\B(O)O 1P00EA55 [1,1,0,0,0,0|1,0,0]=3 257 B11R0.148 CCCCCCC\C=C\C(=O)O 1P00366C [1,1,0,0,0,0|0,0,1]=3 258 B11R0.148 CNCCCCCCCC(=O)O 1P01R00D [1,1,0,0,0,0|1,0,1]=4 259 B11R0.148 CSCCCCCCCC(=O)O 1P0288NR [1,1,0,0,0,0|1,0,1]=4 260 B11R0.148 NCCCCCCCCC(=O)O 1P00846F [1,1,0,0,0,0|1,0,1]=4 261 B11R0.148 OCCCCCCCCC(=O)O 1P0034VX [1,1,0,0,0,0|1,0,1]=4 262 B11R0.148 OCCCCCCCCN(C)C 1P003NYU [1,1,0,0,0,0|1,0,1]=4 263 B13R0.2 BrCCCCCCCCC(=O)OCC 1P002W8Y [0,2,0,0,0,0|2,0,0]=4 264 B13R0.2 CCCCCCCCCC(=O)OCC 1P003PQ4 [0,2,0,0,0,0|1,0,1]=4 265 B13R0.2 CCCCCCCCCC(=O)OCCl 1P005PS7 [0,2,0,0,0,0|1,0,1]=4 266 B13R0.2 CCCCCCCCCC(CCO)C 1P01BFON [0,2,0,0,0,0|0,0,2]=4 267 B13R0.2 CCCCCCCCCC(CCO)O 1P00332P [0,2,0,0,0,0|0,0,2]=4 268 B13R0.2 CCCCCCCCNC(=O)CC#N 1P0078PN [0,2,0,0,0,0|2,0,0]=4 269 B13R0.2 CCCCCCCCOC(=O)CC#N 1P001PCR [0,2,0,0,0,0|2,0,0]=4 270 B13R0.2 CCCCCCCCOC(=O)CCC 1P003TXO [0,2,0,0,0,0|1,0,1]=4 271 B13R0.2 CCCCCCC\C=C\C(=O)OCC 1P003QXU [0,2,0,0,0,0|1,0,1]=4 272 B13R0.66 CCCCCCCCC(=O)CCCC 1P007KFZ [0,2,0,0,0,0|1,0,1]=4 273 B13R0.54 CCCCCCCCCCCC(=O)O 1P0035JV [0,2,0,0,0,0|0,0,2]=4 274 B13R0.54 CCCCCCCCCCCC(O)C 1P001WJ9 [0,2,0,0,0,0|0,0,2]=4 275 B13R0.54 CCCCCCCCCCC[13C](=O)O 1P00GSZ8 [0,2,0,0,0,0|0,0,2]=4 276 B13R0.54 CCCCCCCCC\C=C\C(=O)O 1P00C7OT [0,2,0,0,0,0|0,0,1]=3 277 B13R0.54 OCCCCCCCCCCC(C)C 1P01DEB0 [0,2,0,0,0,0|0,0,2]=4 278 B13R0.147 CCCCCCCCCCC(CO)O 1P003QBZ [0,2,0,0,0,0|0,0,2]=4 279 B13R0.147 CCCCCCCCOCC(CO)O 1P009LY6 [0,2,0,0,0,0|0,0,2]=4 280 B13R0.147 NCCCCCCCCNC(=O)CBr 1P028ID4 [0,2,0,0,0,0|2,0,0]=4 281 B13R0.336 CCCCCCCCCCCCCO 1P002SWO [0,2,0,0,0,0|0,0,2]=4 282 B13R0.336 CCCCCCCCCC\C=C\C=O 1P003VDH [0,2,0,0,0,0|0,0,2]=4 283 B13R0.336 CCCCOCCOCCOCCO 1P003VIM [0,2,0,0,0,0|1,0,1]=4 284 B13R0.336 CNCCCCCCCCCCCO 1P01BCP8 [0,2,0,0,0,0|0,0,2]=4 285 B13R0.336 NCCCCCCCCCCCCO 1P003EBS [0,2,0,0,0,0|0,0,2]=4 286 B13R0.336 OCCCCCCCCCCCC#C 1P0023Q9 [0,2,0,0,0,0|0,0,2]=4 287 B13R0.336 OCCCCCCCCCCCC=C 1P01X6MH [0,2,0,0,0,0|0,0,2]=4 288 B13R0.336 OCCCCCCCCCCCCBr 1P003EBU [0,2,0,0,0,0|0,0,2]=4 289 B13R0.336 OCCCCCCCCCCCCO 1P003DO5 [0,2,0,0,0,0|0,0,2]=4 290 B13R0.336 OCCCCCOCCCCCCCl 1P01FMLU [0,2,0,0,0,0|0,0,2]=4 291 B13R0.336 OCCOCCOCCCCCCCl 1P01DYVU [0,2,0,0,0,0|1,0,1]=4 292 B13R0.338 CCCCCC(=O)OCC\C=C/CC 1P007JLH [0,2,0,0,0,0|1,0,1]=4 293 B13R0.150 CCCCCCCCNC(=O)C(=O)O 1P01B4GK [0,2,0,0,0,0|1,0,1]=4 294 B13R0.150 CCCCCCCCOC(=O)C(C)C 1P007BSK [0,2,0,0,0,0|2,0,0]=4 295 B13R0.280 CCCCCCCCCCC(O)(C)C 1P01EN15 [0,2,0,0,0,0|0,0,2]=4 296 B11R1.4 CCCCCCc1ccco1 1P0033SP [1,0,0,1,0,0|0,0,2]=4 297 B11R1.4 NCCCCCC1CCCC1 1P027OD8 [1,0,0,1,0,0|1,0,1]=4 298 B11R1.17 NCCCC1CCCCC1O 1P01A1LB [1,0,0,1,0,0|1,0,1]=4 299 B11R1.17 OCCCN1CCCCC1C 1P006RRJ [1,0,0,1,0,0|1,0,1]=4 300 B11R1.17 OCCNC1CCCCC1C 1P02826J [1,0,0,1,0,0|1,0,1]=4 301 B11R1.28 BrCCCCC1CCCCC1 1P00EA73 [1,0,0,1,0,0|1,0,1]=4 302 B11R1.28 C=COCCC1CCCCC1 1P01G10C [1,0,0,1,0,0|1,0,1]=4 303 B11R1.28 CCCCCC1CCCCC1 1P003TRH [1,0,0,1,0,0|0,0,2]=4 304 B11R1.28 CCCCOC1CCCCO1 1P0038NS [1,0,0,1,0,0|1,0,1]=4 305 B11R1.28 CCCNCC1CCCCO1 1P01ABUO [1,0,0,1,0,0|1,0,1]=4 306 B11R1.28 OCCCCC1CCCCC1 1P003LQG [1,0,0,1,0,0|0,0,1]=3 307 B11R1.28 OCCCCC1CCCCN1 1P003KH2 [1,0,0,1,0,0|1,0,1]=4 308 B11R1.28 OCCCCC1CCCCO1 1P01EMV4 [1,0,0,1,0,0|1,0,1]=4 309 B11R1.28 OCCCCC1CCCNC1 1P0007B2 [1,0,0,1,0,0|1,0,1]=4 310 B11R1.28 OCCCCC1CCNCC1 1P002CLD [1,0,0,1,0,0|1,0,1]=4 311 B11R1.28 OCCCCC1CCNCC1 1P003KLM [1,0,0,1,0,0|1,0,1]=4 312 B11R1.28 OCCCCN1CCCCC1 1P00DABZ [1,0,0,1,0,0|1,0,1]=4 313 B11R1.28 OCCCNC1CCCCC1 1P028LDA [1,0,0,1,0,0|1,0,1]=4 314 B11R1.28 OCCCOC1CCCCC1 1P018SCW [1,0,0,1,0,0|1,0,1]=4 315 B11R1.28 OCCNCC1CCC=CC1 1P01BEC0 [1,0,0,1,0,0|2,0,0]=4 316 B11R1.28 OCCNCC1CCCCC1 1P01AFZR [1,0,0,1,0,0|1,0,1]=4 317 B11R1.41 CCCC1CCCCC1CN 1P01C2C1 [1,0,0,1,0,0|1,0,1]=4 318 B11R1.41 OCCN1CCCCC1CC 1P024HCK [1,0,0,1,0,0|1,0,1]=4 319 B11R1.92 C1CCCCCCNCCC1 1P002YQQ [1,0,0,1,0,0|1,0,1]=4 320 B11R1.99 BrCCCCCCCC1CC1 1P027ZNK [1,0,0,1,0,0|1,0,1]=4 321 B11R1.99 CCCCCCCCC1CO1 1P003DVQ [1,0,0,1,0,0|0,0,1]=3 322 B11R1.99 NCCCCCCCC1CC1 1P02923X [1,0,0,1,0,0|1,0,1]=4 323 B11R1.99 SCCCCCCCC1CC1 1P028WMZ [1,0,0,1,0,0|0,1,1]=4 324 B11R1.101 NC1CCCCCCCCC1 1P01EIMU [1,0,0,1,0,0|1,0,1]=4 325 B11R1.101 O=C1CCCCCCCCC1 1P001MVM [1,0,0,1,0,0|0,0,2]=4 326 B11R1.101 O=C1CCCCCCCCN1 1P028KAM [1,0,0,1,0,0|1,0,1]=4 327 B11R1.117 CNCC1CCCCCCC1 1P019TOQ [1,0,0,1,0,0|1,0,1]=4 328 B11R1.117 NCCC1CCCCCCC1 1P00DB9B [1,0,0,1,0,0|1,0,1]=4 329 B11R1.117 OCCC1CCCCCCC1 1P02850I [1,0,0,1,0,0|0,0,1]=3 330 B11R1.203 NCCCC1CCCCCC1 1P028ZOC [1,0,0,1,0,0|1,0,1]=4 331 B11R1.203 OCCCN1CCCCCC1 1P002Y36 [1,0,0,1,0,0|1,0,1]=4 332 B11R1.203 OCCCN1CCCCCC1 1P01EMVO [1,0,0,1,0,0|1,0,1]=4 333 B11R1.203 OCCOC1CCCCCC1 1P01DTBI [1,0,0,1,0,0|1,0,1]=4 334 B11R1.248 COC1=NCCCCCCC1 1P01DVF8 [1,0,0,1,0,0|2,0,0]=4 335 B13R1.42 CCOC(=O)CCC1CCCCC1 1P0003QE [0,1,0,1,0,0|2,0,0]=4 336 B13R1.119 CCCCCCCCc1cccs1 1P0033VQ [0,1,0,1,0,0|0,1,1]=4 337 B13R1.119 CCCCCCCCc1ccsc1 1P00348H [0,1,0,1,0,0|0,1,1]=4 338 B13R1.119 CCCCCCCCn1cccc1 1P003F19 [0,1,0,1,0,0|1,0,1]=4 339 B13R1.119 CCCCCCCCn1ccnc1 1P0033AI [0,1,0,1,0,0|2,0,0]=4 340 B13R1.119 CCCCCCNCc1ccco1 1P01B14R [0,1,0,1,0,0|0,0,2]=4 341 B13R1.279 O=C1CCCCCCCCCCC1 1P003PKP [0,1,0,1,0,0|1,0,1]=4 342 B13R1.279 O=C1CCCCCCCCCCN1 1P0038DP [0,1,0,1,0,0|2,0,0]=4 343 B13R1.279 OC1CCCCCCCCCCC1 1P003PKO [0,1,0,1,0,0|0,0,2]=4 344 B13R1.1575 CCOC(=O)CC1CCCCCC1 1P003QVC [0,1,0,1,0,0|2,0,0]=4 345 B13R1.659 CCCCCCCCCCC1OC1 1P002W5X [0,1,0,1,0,0|0,0,2]=4 346 B13R1.659 OCCCCCCCCCC1CC1 1P01EMYD [0,1,0,1,0,0|0,0,2]=4 347 B13R1.27 CCCCCCCC1CCC(=O)O1 1P00HAPW [0,1,0,1,0,0|2,0,0]=4 348 B13R1.9 CCCCCCC1CCC(=O)CC1 1P00DXH1 [0,1,0,1,0,0|1,0,1]=4 349 B13R1.718 ClCC(=O)NCCC1CCCCC1 1P019W4J [0,1,0,1,0,0|2,0,0]=4 350 B13R1.1870 ClCC(=O)NC1CCCCCCC1 1P00C6B8 [0,1,0,1,0,0|2,0,0]=4 351 B13R2.3 C1CCC(CC1)C2CNCCO2 1P000NOC [0,0,0,2,0,0|1,0,1]=4 352 B13R2.3 C1CCC(CC1)C2CNCCO2 1P021YU2 [0,0,0,2,0,0|1,0,1]=4 353 B13R2.64 C1COC(CN1)CC2CCCC2 1P0281BO [0,0,0,2,0,0|1,0,1]=4 354 B13R2.8001 C1CCCC2(CC1)CNCCO2 1P01A0SD [0,0,0,2,0,0|1,0,1]=4 355 B13R2.7258 OCC12CCCCC1CCCC2 1P0289YF [0,0,0,2,0,0|0,0,2]=4