0 B11R0.140 CCCCC[Sn](=O)CCCCC S395854 [0,0,0,0,0,0|2,0,0]=2 1 B11R0.140 CCCCNC(=O)NCCCC S546577 [0,0,0,0,0,0|2,0,0]=2 2 B10R0.71 CCCCCCCCCCF S570354 [1,0,0,0,0,0|2,0,1]=4 3 B10R0.71 CCCCCCCCSCC S570656 [1,0,0,0,0,0|2,0,1]=4 4 B10R0.71 CCCCCCNCCCC OTV000454 [1,0,0,0,0,0|1,0,1]=3 5 B10R0.71 CCCCCCOCCCN S392022 [1,0,0,0,0,0|1,0,1]=3 6 B10R0.71 CCCCCNCCCCC S503770 [1,0,0,0,0,0|2,0,0]=3 7 B10R0.71 [NH2+](CCCCl)CCCCCC R738158 [1,0,0,0,0,0|2,0,1]=4 8 B10R0.91 CCCCNC(=O)CNCC PH014734 [1,0,0,0,0,0|2,0,0]=3 9 B10R0.91 CCCCNC(=O)OCCI PH005343 [1,0,0,0,0,0|2,0,0]=3 10 B10R0.91 CCCCOC(=O)CCCN T160474 [1,0,0,0,0,0|1,0,0]=2 11 B10R0.91 CCNCC(=O)NCCOC PH014802 [1,0,0,0,0,0|3,0,0]=4 12 B12R0.47 CCCCOCC(=O)OCCCC S540676 [0,1,0,0,0,0|0,0,0]=1 13 B12R0.239 CCCCOC(=O)CC(=O)OCC S810886 [0,1,0,0,0,0|1,0,1]=3 14 B12R0.634 CCCCCS(=O)(=O)CCCCC PH011615 [0,1,0,0,0,0|2,0,0]=3 15 B12R0.634 CCCCOP(=S)(Cl)OCCCC S564699 [0,1,0,0,0,0|2,1,0]=4 16 B12R1.28 CCCCOC1=CC(=O)CCC1 PH011428 [0,0,0,1,0,0|2,0,1]=4 17 B9R0.45 CCCCCCCCNC CDS003222 [2,0,0,0,0,0|1,0,1]=4 18 B9R0.45 CCCCCNCCCC OTV000733 [2,0,0,0,0,0|1,0,0]=3 19 B9R0.45 CCCCNCCCCO PH011467 [2,0,0,0,0,0|2,0,0]=4 20 B9R0.5 CCCCCC(=O)CCC S411825 [2,0,0,0,0,0|0,0,0]=2 21 B9R0.5 CCCCCC(C)CCC S431648 [2,0,0,0,0,0|1,0,1]=4 22 B9R0.5 CCCCNC(=O)CCC EME00389 [2,0,0,0,0,0|1,0,0]=3 23 B9R0.5 CCCCNC(=O)CNC CBR01986 [2,0,0,0,0,0|2,0,0]=4 24 B9R0.5 CCCCNC(=O)NCC S802077 [2,0,0,0,0,0|2,0,0]=4 25 B9R0.5 CCCCNC(=O)OCC S406988 [2,0,0,0,0,0|1,0,0]=3 26 B9R0.5 CCOC(=O)CCCCI S677175 [2,0,0,0,0,0|1,0,0]=3 27 B9R0.5 CCOC(=O)CCCCN CDS023812 [2,0,0,0,0,0|1,0,0]=3 28 B9R0.5 CCOC(=O)NCCCBr PH001320 [2,0,0,0,0,0|2,0,0]=4 29 B9R0.5 [C-]#[N+]CCCC(=O)OCC PH015035 [2,0,0,0,0,0|1,0,1]=4 30 B11R0.3 CCCCCCCCCCSC S540161 [1,1,0,0,0,0|1,0,1]=4 31 B11R0.3 CCCCCCCCCSCC S547158 [1,1,0,0,0,0|1,0,1]=4 32 B11R0.3 CCCCCSSCCCCC CDS000577 [1,1,0,0,0,0|1,1,0]=4 33 B11R0.148 CCCCCCCCCC(C)Br S452572 [1,1,0,0,0,0|1,0,1]=4 34 B11R0.148 CCCCCCCCCC(C)N S540293 [1,1,0,0,0,0|1,0,1]=4 35 B11R0.46 CCCCCC(=O)CCC(=O)O T330051 [1,1,0,0,0,0|1,0,1]=4 36 B11R0.155 CCCCCC(=O)C(C)CCC S504874 [1,1,0,0,0,0|0,0,0]=2 37 B13R0.165 CCCCCC[Sn](=O)CCCCCC S395749 [0,2,0,0,0,0|2,0,0]=4 38 B13R0.165 CCCCSCC(=O)NCCCOC PH008776 [0,2,0,0,0,0|1,0,0]=3 39 B13R0.338 CCCCCCCC(=O)OCCCC CDS000585 [0,2,0,0,0,0|0,0,0]=2 40 B13R0.398 CCCCNC(=O)C(=O)NCCCC R582514 [0,2,0,0,0,0|1,0,1]=4 41 B13R0.800 CCCCOC(OCCCC)C(=O)C S541036 [0,2,0,0,0,0|1,0,1]=4 42 B13R0.1286 CCCCOP(=O)(CCl)OCCCC S372749 [0,2,0,0,0,0|2,0,0]=4 43 B13R0.1286 CCCCOP(=O)(NN)OCCCC PH008755 [0,2,0,0,0,0|2,0,0]=4 44 B13R0.339 CCCCOC(=O)CCC(N)C(=O)O PH008960 [0,2,0,0,0,0|1,0,1]=4 45 B13R0.1281 CCCCNC(=O)N(CC)CCCC S869767 [0,2,0,0,0,0|2,0,0]=4 46 B11R1.4 CCCCOCC1CCCO1 S866369 [1,0,0,1,0,0|1,0,1]=4 47 B11R1.28 CCCCCC1CCCCC1 S431664 [1,0,0,1,0,0|1,0,1]=4 48 B11R1.92 C1CCCCCCCCCC1 T330035 [1,0,0,1,0,0|1,0,1]=4 49 B11R1.101 OC1CCCC=CCCCC1 S931985 [1,0,0,1,0,0|2,0,0]=4 50 B11R1.203 CCCCC1CCCCCN1 PH015579 [1,0,0,1,0,0|2,0,0]=4 51 B11R1.285 CCNCC(=O)NCC1CC1 PH014803 [1,0,0,1,0,0|2,0,0]=4 52 B11R1.605 C=C1CCCC(C1CCO)C S884537 [1,0,0,1,0,0|2,0,0]=4 53 B11R1.756 CCCCCC1(CCCC1)O S412457 [1,0,0,1,0,0|0,0,2]=4 54 B11R1.900 CCCCC1(CCCCC1)O S406953 [1,0,0,1,0,0|0,0,2]=4 55 B13R1.24 CCCCNC(=O)C1CCCCC1 R371726 [0,1,0,1,0,0|1,0,0]=3 56 B13R1.24 CCCCNC(=O)N1CCOCC1 S607886 [0,1,0,1,0,0|2,0,0]=4 57 B13R1.24 CCCCOC(=O)N1CCNCC1 PH008366 [0,1,0,1,0,0|1,0,0]=3 58 B13R1.725 CCCCNC(=O)C1CCCC1=O S869651 [0,1,0,1,0,0|1,0,1]=4 59 B13R1.725 CCCCOC(=O)C1CCCC1=O S342947 [0,1,0,1,0,0|0,0,1]=3 60 B13R1.1617 COCCN1C(=O)CCC1CCN PH018382 [0,1,0,1,0,0|2,0,0]=4 61 B13R2.10210 C[N+]12CCCC1CC(=O)NCC2 T162590 [0,0,0,2,0,0|2,0,0]=4 62 B13R2.4787 [C@H]12CCCCCCCC1C(=O)N2 T179159 [0,0,0,2,0,0|1,0,0]=3 63 B13R2.4787 [C@H]12CCCCCCC[C@H]1C(=O)N2 T179191 [0,0,0,2,0,0|1,0,0]=3 64 B13R2.10201 CN1C2CCCC1CC(=O)NC2 T299030 [0,0,0,2,0,0|2,0,0]=4