0 B11R0.4 CCCCCCCC(=O)CCC 1P001KLF [0,0,0,0,0,0|1,0,2]=3 1 B11R0.4 CCCCCCCC(=O)OCC 1P003QV5 [0,0,0,0,0,0|2,0,2]=4 2 B11R0.4 CCCCCCNC(=O)CCC 1P0008GS [0,0,0,0,0,0|1,0,2]=3 3 B11R0.4 CCCCCCOC(=O)C=CC 1P002FCG [0,0,0,0,0,0|0,0,4]=4 4 B11R0.4 CCCCCCOC(=O)CC#N 1P007NP0 [0,0,0,0,0,0|1,0,3]=4 5 B11R0.4 CCCCCCOC(=O)CCC 1P002THL [0,0,0,0,0,0|0,0,2]=2 6 B11R0.4 CCCCCCOC(=O)COC 1P01KKGO [0,0,0,0,0,0|1,0,2]=3 7 B11R0.4 CCC\C=C\CCC(=O)OCC 1P00G3NF [0,0,0,0,0,0|2,0,2]=4 8 B11R0.4 CC\C=C/CCOC(=O)CCC 1P001VM8 [0,0,0,0,0,0|0,0,0]=0 9 B11R0.4 CC\C=C/CCOC(OCC)C 1P003O2Z [0,0,0,0,0,0|2,0,1]=3 10 B10R0.1 CCCC(=O)OCCCSC 1P001X2W [1,0,0,0,0,0|1,0,1]=3 11 B10R0.1 CCCCCCC(=O)CCC 1P00E9WM [1,0,0,0,0,0|0,0,2]=3 12 B10R0.1 CCCCCCC(=O)OCC 1P003QVV [1,0,0,0,0,0|1,0,2]=4 13 B10R0.1 CCOCCOC(=O)CC#N 1P003HN3 [1,0,0,0,0,0|2,0,1]=4 14 B10R0.74 CCCCCCCC(=O)CC 1P003JTK [1,0,0,0,0,0|1,0,2]=4 15 B10R0.74 CCCCCCOC(=O)CS 1P00290R [1,0,0,0,0,0|1,0,2]=4 16 B10R0.74 CC\C=C/CCOC(=O)CC 1P007FRW [1,0,0,0,0,0|0,0,0]=1 17 B12R0.1 CCCCCCCOC(=O)CCC 1P00E9RF [0,1,0,0,0,0|0,0,2]=3 18 B12R0.4 CCCCCCCC(=O)CC(C)C 1P003I45 [0,1,0,0,0,0|1,0,2]=4 19 B12R0.4 CC\C=C/CCOC(=O)CC(C)C 1P003PF8 [0,1,0,0,0,0|0,0,0]=1 20 B12R0.49 CC\C=C/CCOC(=O)C(CC)C 1P003PF7 [0,1,0,0,0,0|0,0,0]=1 21 B12R0.49 CC\C=C\CCOC(=O)\C(=C/C)\C 1P003PF4 [0,1,0,0,0,0|0,0,2]=3 22 B12R0.206 CCCCCCCC(=O)CCCC 1P002BHY [0,1,0,0,0,0|1,0,2]=4 23 B12R0.206 CCCCCCCC(=O)OCCC 1P00IBHI [0,1,0,0,0,0|1,0,2]=4 24 B12R0.239 CCCCCC(OC(=O)CCC)C 1P00C7XF [0,1,0,0,0,0|0,0,2]=3 25 B12R0.276 CCOC(=O)OCCOC(=O)OC 1P002B91 [0,1,0,0,0,0|3,0,0]=4 26 B12R0.285 CCOC(=O)CCCC(=O)OCC 1P003PXD [0,1,0,0,0,0|3,0,0]=4 27 B12R1.28 CCCCCC1CCCC(=O)N1 1P01J1VT [0,0,0,1,0,0|1,0,2]=4 28 B12R1.28 CCCCCC1CCCC(=O)O1 1P003N6E [0,0,0,1,0,0|0,0,2]=3 29 B12R1.28 CC\C=C/CC1CCCC(=O)O1 1P01Q7EA [0,0,0,1,0,0|0,0,0]=1 30 B12R1.32 CCCC(=O)NC1CCCNC1 1P00GNTR [0,0,0,1,0,0|2,0,1]=4 31 B12R1.32 CCCC(=O)NC1CCNCC1 1P019NVA [0,0,0,1,0,0|2,0,1]=4 32 B12R1.32 CCCC(=O)OC1CCCCC1 1P001O39 [0,0,0,1,0,0|0,0,2]=3 33 B12R1.32 CCNC(=O)OC1CCNCC1 1P005H4L [0,0,0,1,0,0|2,0,1]=4 34 B12R1.32 NCCC(=O)OC1CCCCC1 1P01B8T6 [0,0,0,1,0,0|1,0,2]=4 35 B12R1.51 CCCC(=O)OCC1CCCO1 1P00BC7P [0,0,0,1,0,0|1,0,1]=3 36 B12R1.215 O=C1CCCCCCCCCN1 1P0003MD [0,0,0,1,0,0|1,0,2]=4 37 B12R1.372 CCCCCCC1CCCC1=O 1P000VCS [0,0,0,1,0,0|1,0,2]=4 38 B12R1.372 CCCCCCN1CCCC1=O 1P00D9KJ [0,0,0,1,0,0|1,0,2]=4 39 B12R1.1564 CCCC(=O)N1CCNCCC1 1P00EI3I [0,0,0,1,0,0|2,0,1]=4 40 B9R0.5 CCCCCC(=O)OCC 1P000KDJ [2,0,0,0,0,0|1,0,1]=4 41 B9R0.5 CCCCNC(=O)CCC 1P0008GT [2,0,0,0,0,0|1,0,0]=3 42 B9R0.5 CCCCNC(=O)CNC 1P000EDK [2,0,0,0,0,0|2,0,0]=4 43 B9R0.5 CCCCOC(=O)CC#N 1P00IA7S [2,0,0,0,0,0|1,0,1]=4 44 B9R0.5 CCCCOC(=O)CCS 1P001T9W [2,0,0,0,0,0|1,0,0]=3 45 B9R0.5 CCCCOC(=O)COC 1P002548 [2,0,0,0,0,0|1,0,0]=3 46 B9R0.5 CCCCOC(=O)CON 1P01B5IP [2,0,0,0,0,0|2,0,0]=4 47 B9R0.5 CCCCOC(=O)OCCl 1P00EM35 [2,0,0,0,0,0|2,0,0]=4 48 B9R0.5 CCOCCC(=O)OCC 1P0035BK [2,0,0,0,0,0|2,0,0]=4 49 B9R0.5 CC\C=C\CC(=O)OCC 1P003QOE [2,0,0,0,0,0|1,0,0]=3 50 B9R0.5 OCCCOC(=O)CCO 1P024H5D [2,0,0,0,0,0|2,0,0]=4 51 B9R0.45 CCC=CCCC=CCO 1P008OOS [2,0,0,0,0,0|1,0,1]=4 52 B9R0.45 CCCCCC\C=C/CO 1P003PEU [2,0,0,0,0,0|1,0,1]=4 53 B9R0.45 CCCCCC\C=C\CO 1P003VD9 [2,0,0,0,0,0|1,0,1]=4 54 B9R0.45 CC\C=C/CC\C=C\CO 1P003VB5 [2,0,0,0,0,0|1,0,1]=4 55 B9R0.45 OCCCCC\C=C/CC 1P003PGA [2,0,0,0,0,0|1,0,1]=4 56 B9R0.46 CCCCCCC(=O)CC 1P003TQS [2,0,0,0,0,0|0,0,2]=4 57 B9R0.46 CCOCCOC(=O)CCl 1P00ETR1 [2,0,0,0,0,0|2,0,0]=4 58 B9R0.2 CC=CC=CCOC(=O)C 1P001NWK [2,0,0,0,0,0|0,0,2]=4 59 B9R0.2 CCCCCCOC(=O)C 1P001HZT [2,0,0,0,0,0|0,0,2]=4 60 B9R0.2 CCC\C=C\COC(=O)C 1P002QI7 [2,0,0,0,0,0|0,0,2]=4 61 B9R0.2 CC\C=C/CCOC(=O)C 1P003RQD [2,0,0,0,0,0|0,0,0]=2 62 B11R0.2 CCCCCOC(=O)CC(C)C 1P01CL2H [1,1,0,0,0,0|0,0,1]=3 63 B11R0.62 CCCC(=O)CCC(=O)OCC 1P001ING [1,1,0,0,0,0|1,0,0]=3 64 B11R0.62 CCOC(=N)CCC(=O)OCC 1P01EJ6G [1,1,0,0,0,0|2,0,0]=4 65 B11R0.62 CCOC(=O)CCC(=O)OCC 1P000KD1 [1,1,0,0,0,0|2,0,0]=4 66 B11R0.81 CCCCCCC(=O)OCCC 1P005S7M [1,1,0,0,0,0|0,0,2]=4 67 B11R0.142 CCCCCOC(=O)C(CC)C 1P01FGDI [1,1,0,0,0,0|0,0,1]=3 68 B11R0.174 CCOC(=O)CCCC(=O)CC 1P005V5N [1,1,0,0,0,0|1,0,1]=4 69 B11R0.176 CCCC(=O)OCCCC(=O)O 1P0030PI [1,1,0,0,0,0|1,0,1]=4 70 B11R0.140 CCCCOC(=O)C\C=C\CC 1P00819O [1,1,0,0,0,0|0,0,2]=4 71 B11R0.42 CCCCCCOC(=O)C(C)C 1P002NV1 [1,1,0,0,0,0|0,0,2]=4 72 B11R0.42 CC\C=C/CCOC(=O)C(C)C 1P003PFC [1,1,0,0,0,0|0,0,0]=2 73 B11R0.42 CC\C=C/CCOC(=O)C(O)C 1P003PFD [1,1,0,0,0,0|0,0,0]=2 74 B13R0.2 CCCCCCCCOC(=O)CCC 1P003TXO [0,2,0,0,0,0|0,0,2]=4 75 B13R0.367 CCOC(=O)OCCOC(=O)OCC 1P003GH1 [0,2,0,0,0,0|2,0,0]=4 76 B13R0.338 CCCCCC(=O)OCC\C=C/CC 1P007JLH [0,2,0,0,0,0|0,0,0]=2 77 B13R0.338 CCCCCCOC(=O)CCCCC 1P003RDY [0,2,0,0,0,0|0,0,2]=4 78 B13R0.338 CCC\C=C\COC(=O)\C=C\CCC 1P00DT58 [0,2,0,0,0,0|0,0,2]=4 79 B13R0.338 CC\C=C/CCOC(=O)C\C=C/CC 1P003PFA [0,2,0,0,0,0|0,0,0]=2 80 B13R0.338 CC\C=C\CCOC(=O)C\C=C\CC 1P01XD4N [0,2,0,0,0,0|0,0,0]=2 81 B11R1.16 CCCC(=O)C1CCCCC1 1P00AQCZ [1,0,0,1,0,0|0,0,2]=4 82 B11R1.16 CCCC(=O)C1CCNCC1 1P00C98X [1,0,0,1,0,0|1,0,1]=4 83 B11R1.16 CCCC(=O)N1CCNCC1 1P002I7I [1,0,0,1,0,0|2,0,0]=4 84 B11R1.16 CCCC(=O)N1CCNCC1 1P028IGD [1,0,0,1,0,0|2,0,0]=4 85 B11R1.16 CCOC(=O)C1CCC=CC1 1P001NKX [1,0,0,1,0,0|1,0,0]=3 86 B11R1.16 CCOC(=O)C1CCC=CO1 1P00580G [1,0,0,1,0,0|2,0,0]=4 87 B11R1.24 CCCCC1CCCC(=O)O1 1P00I6T9 [1,0,0,1,0,0|0,0,1]=3 88 B11R1.30 CCOC(=O)CC1CCC=C1 1P01C2JP [1,0,0,1,0,0|1,0,0]=3 89 B11R1.101 O=C1CCCCCCCCC1 1P001MVM [1,0,0,1,0,0|0,0,2]=4 90 B11R1.101 O=C1CCCCCCCCN1 1P028KAM [1,0,0,1,0,0|1,0,1]=4 91 B11R1.230 CC1CC(=O)OC1CCCC 1P00I87D [1,0,0,1,0,0|0,0,1]=3 92 B11R1.25 CCC(=O)OCC1CCCO1 1P003D5Z [1,0,0,1,0,0|1,0,1]=4 93 B11R1.27 CCCCCC1CCC(=O)O1 1P00HAPV [1,0,0,1,0,0|0,0,2]=4 94 B11R1.852 COC(=O)C1CCC=CCC1 1P01EMNL [1,0,0,1,0,0|2,0,0]=4 95 B13R1.6 CCCCCCC1CCCC(=O)O1 1P00ICL2 [0,1,0,1,0,0|0,0,2]=4 96 B13R1.190 CCCCCCC1OC(=O)CC1C 1P0064LJ [0,1,0,1,0,0|0,0,2]=4 97 B13R1.135 CC[C@@H](C(=O)OC1CCCCC1)N 1P01A2LF [0,1,0,1,0,0|0,0,2]=4 98 B13R1.554 CCC(C(=O)OCC1CCCO1)C 1P027XFJ [0,1,0,1,0,0|1,0,1]=4 99 B13R1.44 COCCC(=O)OC1CCCCC1 1P02872N [0,1,0,1,0,0|0,0,2]=4 100 B13R1.1511 CCOC(=O)C1CCC(=O)CC1C 1P01A3IF [0,1,0,1,0,0|2,0,0]=4 101 B13R1.1511 CCOC(=O)[C@@H]1CCC(=O)C[C@H]1C 1P00PWAF [0,1,0,1,0,0|2,0,0]=4 102 B13R1.1511 CCOC(=O)[C@H]1CCC(=O)C[C@@H]1C 1P01XAIZ [0,1,0,1,0,0|2,0,0]=4 103 B13R2.444 O=C(C1CC1)OC2CCNCC2 1P01DPV1 [0,0,0,2,0,0|1,0,1]=4 104 B13R2.856 CCOC(=O)C1CC2CC1C=C2 1P0004SY [0,0,0,2,0,0|2,0,0]=4 105 B13R2.856 CCOC(=O)N1CC2CC1C=C2 1P028ZLQ [0,0,0,2,0,0|2,0,0]=4