0 B9R0.43 CCC(CC)OCC(=O)O 2121-1-0U [0,0,0,0,0,0|3,0,0]=3 1 B9R0.43 CCC(COC(C)=O)OC 2123-1-1G [0,0,0,0,0,0|1,0,0]=1 2 B9R0.43 CCN(CC)CCC(=O)O 4158-5-03 [0,0,0,0,0,0|3,0,0]=3 3 B8R0.9 CC(=O)OCC(=O)CCl 2129-5-0G [1,0,0,0,0,0|2,0,1]=4 4 B8R0.9 CC(=O)OCC(C)CBr 2123-9-0N [1,0,0,0,0,0|1,0,0]=2 5 B8R0.9 CCC(C)CCC(C)C 1100-1-26 [1,0,0,0,0,0|2,0,1]=4 6 B8R0.9 CCC(C)COC(=O)Cl 2116-5-28 [1,0,0,0,0,0|1,0,0]=2 7 B8R0.9 CCC(Cl)CCC(=O)Cl 2116-5-23 [1,0,0,0,0,0|3,0,0]=4 8 B8R0.11 CCCCC(CC)CN 3130-1-0E [1,0,0,0,0,0|2,0,1]=4 9 B8R0.11 CCN(CC)CCNC 3131-1-23 [1,0,0,0,0,0|3,0,0]=4 10 B10R0.45 CCC(=O)CCN(CC)CC 4156-1-50 [0,1,0,0,0,0|2,0,0]=3 11 B10R0.144 CCC(CC)C(N)CC(=O)O 4157-1-41 [0,1,0,0,0,0|2,0,0]=3 12 B10R1.66 O=C(Cl)CCC1CCCC1 2216-5-08 [0,0,0,1,0,0|2,0,0]=3 13 B10R1.66 O=C(O)CCC1CCCO1 2H21-1-0X [0,0,0,1,0,0|3,0,0]=4 14 B10R1.66 O=C(O)COC1CCCC1 2221-1-0H [0,0,0,1,0,0|3,0,0]=4 15 B8R0.16 C=CC(CC)OC(C)=O 2324-1-0G [0,0,0,0,1,0|0,0,2]=3 16 B8R0.16 CCN(CC)CC(C)Cl 3132-5-05 [0,0,0,0,1,0|2,0,1]=4 17 B8R0.16 CCN(CC)CC(C)O 4132-1-02 [0,0,0,0,1,0|1,0,2]=4 18 B10R0.77 C=C(C)C#CCN(CC)CC 3532-1-04 [0,0,0,0,0,1|3,0,0]=4 19 B7R0.3 CCCCC(C)CC 1100-1-00 [2,0,0,0,0,0|1,0,1]=4 20 B7R0.4 C=C(C)CCCCC 1300-1-36 [2,0,0,0,0,0|2,0,0]=4 21 B7R0.4 C=CCCOC(C)=O 2323-1-1E [2,0,0,0,0,0|0,0,2]=4 22 B7R0.4 CC(=O)CCCCCl 2117-5-05 [2,0,0,0,0,0|2,0,0]=4 23 B7R0.4 CC(=O)NCCCN 4148-5-0D [2,0,0,0,0,0|2,0,0]=4 24 B7R0.4 CC(=O)NCCCO 4156-1-Y9 [2,0,0,0,0,0|2,0,0]=4 25 B7R0.4 CC(=O)OCCCCl 2123-5-0U [2,0,0,0,0,0|1,0,0]=3 26 B7R0.4 CC(=O)OCCCF 2123-3-1D [2,0,0,0,0,0|1,0,0]=3 27 B7R0.4 CCCCCC(C)=O 2117-1-14 [2,0,0,0,0,0|1,0,0]=3 28 B7R0.4 CCCCCC(N)=O 4148-1-1F [2,0,0,0,0,0|2,0,0]=4 29 B7R0.4 CCCCOC(=O)Cl 2116-5-31 [2,0,0,0,0,0|1,0,0]=3 30 B7R0.4 CCCCOC(N)=O 4156-1-2H [2,0,0,0,0,0|1,0,0]=3 31 B7R0.4 CCCCO[N+](=O)[O-] 4154-1-0C [2,0,0,0,0,0|2,0,0]=4 32 B7R0.4 CCCCSC(C)=O 6166-1-0F [2,0,0,0,0,0|0,1,0]=3 33 B7R0.4 CCC\C=C\C(C)=O 2317-1-0B [2,0,0,0,0,0|1,0,1]=4 34 B7R0.4 O=C(Cl)OCCCCl 2123-5-0S [2,0,0,0,0,0|2,0,0]=4 35 B7R0.6 C=C(C)COC(C)=O 2324-1-0F [2,0,0,0,0,0|0,0,2]=4 36 B7R0.6 CC(=O)CCC(C)C 2117-1-12 [2,0,0,0,0,0|1,0,0]=3 37 B7R0.6 CC(=O)OCC(C)F 2123-3-0L [2,0,0,0,0,0|1,0,0]=3 38 B7R0.6 CC(=O)ON=C(C)C 4156-1-59 [2,0,0,0,0,0|1,0,1]=4 39 B7R0.6 CC(C)CCC(=O)O 2121-1-29 [2,0,0,0,0,0|2,0,0]=4 40 B7R0.6 CC(F)COC(=O)Cl 2123-7-0B [2,0,0,0,0,0|2,0,0]=4 41 B7R0.12 C=CCN(CC)CC 3332-1-00 [2,0,0,0,0,0|1,0,1]=4 42 B7R0.12 CCC(CC)C[Mg]Br 9112-9-00 [2,0,0,0,0,0|2,0,0]=4 43 B9R0.48 CCCC(C)COC(C)=O 2123-1-1F [1,1,0,0,0,0|0,0,0]=2 44 B11R0.185 CCCC(C)(CO)COC(N)=O 4156-1-30 [0,2,0,0,0,0|2,0,0]=4 45 B9R1.1 CNC1CCC(=O)CC1 4233-5-02 [1,0,0,1,0,0|2,0,0]=4 46 B9R1.1 COC1CCC(=O)CC1 2217-1-0A [1,0,0,1,0,0|2,0,0]=4 47 B9R1.1 NCC1CCC(=O)NC1 4H48-1-BN [1,0,0,1,0,0|2,0,0]=4 48 B9R1.1 O=C1CCC(CO)CC1 P311-A-79 [1,0,0,1,0,0|2,0,0]=4 49 B9R1.1 O=C1CCC(CO)CN1 4H48-1-CG [1,0,0,1,0,0|2,0,0]=4 50 B9R1.35 CC(=O)N1CC[C@@H](O)C1 4H56-1-PC [1,0,0,1,0,0|2,0,0]=4 51 B9R1.49 CN1CCCC(=O)CC1 4H56-5-AU [1,0,0,1,0,0|2,0,0]=4 52 B9R1.69 CC1CCC(=O)CC1C 2217-1-1C [1,0,0,1,0,0|1,0,0]=3 53 B9R1.12 O=CCCC1CCCC1 2215-1-09 [1,0,0,1,0,0|1,0,0]=3 54 B9R1.2 CCC1CCCC(=O)N1 4H48-1-CF [0,0,0,1,1,0|1,0,0]=3 55 B9R1.2 NCC1CCNC(=O)C1 4H48-1-BL [0,0,0,1,1,0|2,0,0]=4 56 B9R1.2 O=C1CCCC(CO)N1 4H48-1-CE [0,0,0,1,1,0|2,0,0]=4 57 B9R1.2 O=C1CCC[C@@H](CO)N1 4H31-1-S0 [0,0,0,1,1,0|2,0,0]=4 58 B9R1.2 O=C1CCC[C@H](CO)N1 4H31-1-R0 [0,0,0,1,1,0|2,0,0]=4 59 B9R1.13 CC(=O)NC1CCCC1 4248-1-0F [0,0,0,1,1,0|1,0,0]=3 60 B9R1.13 CC(=O)N[C@@H]1CCNC1 4H48-1-R3 [0,0,0,1,1,0|2,0,0]=4 61 B9R1.13 CC(=O)N[C@H]1CCNC1 4H48-1-S4 [0,0,0,1,1,0|2,0,0]=4 62 B9R1.13 NC(=O)CN1CCCC1 4H48-1-030 [0,0,0,1,1,0|2,0,0]=4 63 B9R1.13 O=C(O)CC1CCCO1 2H21-1-0B [0,0,0,1,1,0|2,0,0]=4 64 B9R1.13 O=C(O)CC1CCNC1 4H21-1-W3 [0,0,0,1,1,0|2,0,0]=4 65 B9R1.13 O=C(O)CC1CCNC1 4H58-1-H4 [0,0,0,1,1,0|2,0,0]=4 66 B9R1.13 O=C(O)CC1CCOC1 2H21-1-59 [0,0,0,1,1,0|2,0,0]=4 67 B11R1.3 CC[C@H]1CC[C@H](C(=O)O)CC1 2221-1-40 [0,0,0,1,0,1|2,0,0]=4 68 B11R1.3 CNC1CCN(C(C)=O)CC1 4H31-1-49 [0,0,0,1,0,1|2,0,0]=4 69 B11R1.91 CC(=O)OCC1CCCCC1 2223-1-0V [0,1,0,1,0,0|0,0,0]=2 70 B11R1.91 O=C(O)CCC1CCCCC1 2221-1-0D [0,1,0,1,0,0|2,0,0]=4 71 B11R1.25 C=CC(=O)OCC1CCCO1 2H24-1-00 [0,1,0,1,0,0|1,0,1]=4 72 B11R1.25 CCC(=O)OCC1CCCO1 2H23-1-1H [0,1,0,1,0,0|1,0,0]=3 73 B11R1.25 COC(=O)CCC1CCCC1 2223-1-0Q [0,1,0,1,0,0|1,0,0]=3 74 B11R1.25 COC(=O)CCC1CCNC1 4H58-1-9N [0,1,0,1,0,0|2,0,0]=4 75 B11R1.25 COC(=O)CNC1CCCC1 4256-5-0J [0,1,0,1,0,0|2,0,0]=4 76 B11R1.25 COC(=O)\C=C\C1CCCC1 2323-1-0R [0,1,0,1,0,0|1,0,1]=4 77 B11R1.278 CCN1CCC(=O)C(C)C1C 4H17-5-33 [0,1,0,1,0,0|2,0,0]=4 78 B11R1.35 N[C@@H](CC1CCCC1)C(=O)O 4257-1-S6 [0,1,0,1,0,0|2,0,0]=4 79 B11R2.63 CN1C2CCC(=O)C1CC2 4H56-1-KS [0,0,0,2,0,0|2,0,0]=4 80 B11R2.845 CC(=O)C1CC2CCC1C2 2217-1-37 [0,0,0,2,0,0|1,0,0]=3 81 B11R2.1839 NC(=O)C12CCC(CC1)C2 4248-1-08 [0,0,0,2,0,0|2,0,0]=4 82 B11R2.1839 O=C(O)C12CCC(CC1)C2 2221-1-21 [0,0,0,2,0,0|2,0,0]=4 83 B11R2.748 O=C1CC2(CCCC2)CN1 4H48-1-02M [0,0,0,2,0,0|1,0,0]=3 84 B11R2.748 O=C1CC2(CCNC2)CN1 4H48-5-BE [0,0,0,2,0,0|2,0,0]=4 85 B7R0.2 C=CC(C)OC(C)=O 2323-1-1F [1,0,0,0,1,0|0,0,2]=4 86 B7R0.2 CC(=O)NC(C)CN 4148-1-0B [1,0,0,0,1,0|2,0,0]=4 87 B7R0.2 CC(=O)NC(C)CN 4148-5-0L [1,0,0,0,1,0|2,0,0]=4 88 B7R0.2 CC(=O)OC(Br)CBr 2123-9-21 [1,0,0,0,1,0|2,0,0]=4 89 B7R0.2 CC(CN)CC(=O)O 4157-5-12 [1,0,0,0,1,0|2,0,0]=4 90 B7R0.2 CCC(=O)CC(C)=O 2118-1-09 [1,0,0,0,1,0|1,0,1]=4 91 B7R0.2 CCC(C)CC(=O)O 2121-1-00 [1,0,0,0,1,0|1,0,0]=3 92 B7R0.2 CCC(C)CC(C)C 1100-1-24 [1,0,0,0,1,0|1,0,1]=4 93 B7R0.2 CCC(C)OC(=O)Cl 2116-5-08 [1,0,0,0,1,0|1,0,0]=3 94 B7R0.2 CCC(N)CC(=O)O 4157-1-20 [1,0,0,0,1,0|2,0,0]=4 95 B7R0.2 CC[C@@H](N)CC(=O)O 4156-5-R2 [1,0,0,0,1,0|2,0,0]=4 96 B7R0.2 CC[C@H](C)CC(=O)O 2121-1-S4 [1,0,0,0,1,0|1,0,0]=3 97 B7R0.15 CCN(CC)C(C)=O 4148-1-0J [0,0,0,0,2,0|1,0,0]=3 98 B7R0.15 CCN(CC)C(N)=O 4153-1-0C [0,0,0,0,2,0|2,0,0]=4 99 B9R0.1 CCC(C)CCOC(C)=O 2123-1-1C [1,0,0,0,0,1|0,0,0]=2 100 B9R0.1 COC(C)CCOC(C)=O 2123-1-1E [1,0,0,0,0,1|1,0,0]=3 101 B11R0.22 CNC(C#CCOC(C)=O)NC 4556-1-02 [0,0,0,0,0,2|2,0,0]=4