0 B7R0.4 CC(N)CCCCC M10004600P [0,0,0,0,0,0|3,0,1]=4 1 B6R0.4 CC(C)CCC=O M10027096P [1,0,0,0,0,0|0,0,0]=1 2 B6R0.4 CC(C)CCCBr M10016880P [1,0,0,0,0,0|1,0,1]=3 3 B6R0.4 CC(C)CCCO M10016881P [1,0,0,0,0,0|0,0,2]=3 4 B6R0.4 CC(C)CN=C=O M10037383P [1,0,0,0,0,0|1,0,1]=3 5 B6R0.4 CC(CCC=C)=O M10003621P [1,0,0,0,0,0|2,0,1]=4 6 B6R0.4 CC(NCCCl)C M10088269P [1,0,0,0,0,0|2,0,1]=4 7 B6R0.4 CC(O)CCCO M10016886P [1,0,0,0,0,0|1,0,2]=4 8 B6R0.4 CC(OCCBr)C M10275026P [1,0,0,0,0,0|2,0,1]=4 9 B6R0.4 CN(C)CCCBr M10273573P [1,0,0,0,0,0|2,0,1]=4 10 B6R0.4 CN(CCCCl)C M10003627P [1,0,0,0,0,0|2,0,1]=4 11 B6R0.4 CNCCN(C)C M10005417P [1,0,0,0,0,0|2,0,1]=4 12 B6R0.4 N#CCCN(C)C M10035584P [1,0,0,0,0,0|2,0,1]=4 13 B6R0.4 O=CCC[N+]([O-])=O M10302523P [1,0,0,0,0,0|3,0,0]=4 14 B6R0.4 O=NOCC(C)C M10013695P [1,0,0,0,0,0|1,0,0]=2 15 B6R0.6 C=CCCCCCl M10208182P [1,0,0,0,0,0|3,0,0]=4 16 B6R0.6 CCCCCCI M10197538P [1,0,0,0,0,0|2,0,1]=4 17 B6R0.6 CCCCC[Mg]Br M10018552P [1,0,0,0,0,0|3,0,0]=4 18 B6R0.6 COBCCCC M10104694P [1,0,0,0,0,0|3,0,0]=4 19 B6R0.6 ClCCCN=C=O M10119739P [1,0,0,0,0,0|2,0,1]=4 20 B6R0.6 [Li]CCCCCC M10170025P [1,0,0,0,0,0|2,0,1]=4 21 B8R0.7 CC(C)CCCCCO M12278016P [0,1,0,0,0,0|1,0,2]=4 22 B8R0.21 C[Si](C)(CCOCCl)C M10464156P [0,1,0,0,0,0|1,1,1]=4 23 B8R0.28 CC(CCC=C(C)C)=O M10003758P [0,1,0,0,0,0|1,0,2]=4 24 B8R0.28 CC(OCC=C(C)C)=O M10028659P [0,1,0,0,0,0|0,0,2]=3 25 B8R0.28 NC(C)CCCC(C)C M10013728P [0,1,0,0,0,0|2,0,1]=4 26 B8R0.28 O=C(O)CCCN(C)C M10436635P [0,1,0,0,0,0|2,0,0]=3 27 B8R0.28 O=C(O)\C=C\CN(C)C M10996972P [0,1,0,0,0,0|2,0,1]=4 28 B8R1.4 O=C1CN(C)CCC1 M10077248P [0,0,0,1,0,0|2,0,0]=3 29 B8R1.4 O=C1NCCC(O)C1 M10882636P [0,0,0,1,0,0|2,0,0]=3 30 B8R1.4 O=C1NCCN(C)C1 M10224934P [0,0,0,1,0,0|2,0,0]=3 31 B8R1.4 O=C1NCC[C@H](O)C1 M10882637P [0,0,0,1,0,0|2,0,0]=3 32 B8R1.19 CC1(C)CCC=[N+]1[O-] M10053280P [0,0,0,1,0,0|2,0,1]=4 33 B5R0.1 C=COC(C)C M10023217P [2,0,0,0,0,0|1,0,0]=3 34 B5R0.1 CC(C)CCI M10013642P [2,0,0,0,0,0|1,0,0]=3 35 B5R0.1 CC(C)C[Mg]Br M10023214P [2,0,0,0,0,0|2,0,0]=4 36 B5R0.1 CC(N)CCC M10393249P [2,0,0,0,0,0|1,0,1]=4 37 B5R0.1 CC(N)CCO M10048445P [2,0,0,0,0,0|1,0,0]=3 38 B5R0.1 CC(OC=O)=O M10041862P [2,0,0,0,0,0|1,0,1]=4 39 B5R0.1 C[C@@H](N)CCO M10335804P [2,0,0,0,0,0|1,0,0]=3 40 B5R0.1 C[C@@H](O)COC M10067779P [2,0,0,0,0,0|1,0,1]=4 41 B5R0.1 C[C@H](N)CCO M10335803P [2,0,0,0,0,0|1,0,0]=3 42 B5R0.1 C[C@H](O)COC M10194416P [2,0,0,0,0,0|1,0,1]=4 43 B5R0.1 NCCN(C)C M10003486P [2,0,0,0,0,0|2,0,0]=4 44 B5R0.1 NNCC(C)C M10843147P [2,0,0,0,0,0|2,0,0]=4 45 B5R0.1 O=NOC(C)C M10013647P [2,0,0,0,0,0|1,0,0]=3 46 B5R0.2 C=CCCCCl M10023281P [2,0,0,0,0,0|2,0,0]=4 47 B5R0.2 C=CCOCC M10014106P [2,0,0,0,0,0|2,0,0]=4 48 B5R0.2 C=COCCO M10020115P [2,0,0,0,0,0|2,0,0]=4 49 B5R0.2 CCCN=C=O M10003745P [2,0,0,0,0,0|1,0,1]=4 50 B5R0.2 CCCOC=C M10020114P [2,0,0,0,0,0|1,0,0]=3 51 B5R0.2 COCCOC M10003738P [2,0,0,0,0,0|1,0,1]=4 52 B5R0.2 Cl[Mg]CCCC M10018540P [2,0,0,0,0,0|2,0,0]=4 53 B7R0.3 O=C(OC)CCC=O M10126962P [1,1,0,0,0,0|1,0,1]=4 54 B7R0.6 CC(C)CCB(O)O M10634235P [1,1,0,0,0,0|1,0,1]=4 55 B7R0.6 CC(C)\C=C\C(O)=O M10114075P [1,1,0,0,0,0|0,0,2]=4 56 B7R0.6 CC(CCC([O-])=O)=O M10183682P [1,1,0,0,0,0|1,0,1]=4 57 B7R0.6 C[S+](CCC(O)=O)C M10062116P [1,1,0,0,0,0|1,0,0]=3 58 B7R0.6 O=C(C)CCC([O-])=O M10015062P [1,1,0,0,0,0|1,0,1]=4 59 B7R0.6 O=C(Cl)OCC(C)C M10013714P [1,1,0,0,0,0|0,0,0]=2 60 B7R0.6 O=C(O)CCN(C)C M10133339P [1,1,0,0,0,0|1,0,0]=3 61 B7R0.8 O=COCC(F)(F)F M10215852P [1,1,0,0,0,0|2,0,0]=4 62 B7R0.1 C=CCCCCCCl M10023319P [1,1,0,0,0,0|2,0,0]=4 63 B7R0.1 CCCCOCCCl M10115661P [1,1,0,0,0,0|1,0,1]=4 64 B7R0.1 CCOCCOCC M10017029P [1,1,0,0,0,0|1,0,1]=4 65 B7R0.1 OCCCCOC=C M10151868P [1,1,0,0,0,0|1,0,0]=3 66 B9R0.53 CC(C)CC(N)CC(O)=O M10056453P [0,2,0,0,0,0|1,0,0]=3 67 B9R0.1 C=CC(OCCN(C)C)=O M10043973P [0,2,0,0,0,0|1,0,0]=3 68 B9R0.48 CC(C)CCC(OCC)=O M10189485P [0,2,0,0,0,0|1,0,1]=4 69 B9R0.55 O=C(N)NCCCN(C)C M10214122P [0,2,0,0,0,0|2,0,0]=4 70 B9R0.7 CC(C)CC[C@@H](N)C(O)=O M10747756P [0,2,0,0,0,0|1,0,0]=3 71 B9R0.7 CC(C)CC[C@H](N)C(O)=O M10215341P [0,2,0,0,0,0|1,0,0]=3 72 B9R0.56 C[N+](C)(C)CCCC(O)=O M10085429P [0,2,0,0,0,0|2,0,0]=4 73 B7R1.2 CC1OS(OC1)=O M10031271P [1,0,0,1,0,0|2,0,0]=4 74 B7R1.2 N[C@H]1COC(C1)=O M10174878P [1,0,0,1,0,0|1,0,0]=3 75 B7R1.2 O=C1CC(CC1)=O M10058164P [1,0,0,1,0,0|1,0,1]=4 76 B7R1.2 O=C1CN(C)CC1 M10472463P [1,0,0,1,0,0|1,0,0]=3 77 B7R1.2 O=C1OC(CO1)C M10003516P [1,0,0,1,0,0|1,0,0]=3 78 B7R1.2 O=C1OCC(Cl)O1 M10058922P [1,0,0,1,0,0|2,0,0]=4 79 B7R1.2 O=C1OCC(F)O1 M10694293P [1,0,0,1,0,0|2,0,0]=4 80 B7R1.2 O=C1OC[C@H](C)O1 M10258723P [1,0,0,1,0,0|1,0,0]=3 81 B7R1.2 O=C1OC[C@H](O)C1 M10299052P [1,0,0,1,0,0|1,0,0]=3 82 B7R1.3 C[C@H]1CNCCC1 M10841057P [1,0,0,1,0,0|1,0,1]=4 83 B7R1.14 CC1(C)NCCC1 M10225767P [1,0,0,1,0,0|1,0,1]=4 84 B7R1.23 N#CC1C(C)(C)C1 M10079621P [1,0,0,1,0,0|1,0,1]=4 85 B7R1.1 O=CC1OCCC1 M10109701P [1,0,0,1,0,0|2,0,0]=4 86 B7R1.4 C=C1CCOC1=O M10013811P [1,0,0,1,0,0|0,0,2]=4 87 B7R1.4 O=C1C(Br)CCC1 M10172483P [1,0,0,1,0,0|2,0,0]=4 88 B7R1.4 O=C1C(C)CCC1 M10027182P [1,0,0,1,0,0|1,0,0]=3 89 B7R1.4 O=C1C(Cl)CCC1 M10018599P [1,0,0,1,0,0|2,0,0]=4 90 B7R1.4 O=C1NCCC1O M10135336P [1,0,0,1,0,0|2,0,0]=4 91 B7R1.4 O=C1NCC[C@@H]1N M10060287P [1,0,0,1,0,0|2,0,0]=4 92 B7R1.4 O=C1NCC[C@@H]1N M10288485P [1,0,0,1,0,0|2,0,0]=4 93 B7R1.4 O=C1NCC[C@H]1O M10468150P [1,0,0,1,0,0|2,0,0]=4 94 B9R1.34 O=C1CC(C)NC(C)C1 M11091903P [0,1,0,1,0,0|2,0,0]=4 95 B9R1.34 O=C1CC(CC(C)C1)=O M10062153P [0,1,0,1,0,0|1,0,1]=4 96 B9R1.53 CC(OC1CC(C1)=O)=O M10397990P [0,1,0,1,0,0|1,0,1]=4 97 B9R1.66 O=C1CC(C)(C)OCC1 M10028787P [0,1,0,1,0,0|2,0,0]=4 98 B9R1.66 O=C1CC(C)(O)CCO1 M12271779P [0,1,0,1,0,0|0,0,0]=2 99 B9R1.40 O=C1C(C)(C)CCCC1 M10028759P [0,1,0,1,0,0|1,0,0]=3 100 B9R1.35 O=C(C1CN(C)CC1)O M10190927P [0,1,0,1,0,0|2,0,0]=4 101 B9R1.35 O=C(C1CN(C)CC1)O M10254714P [0,1,0,1,0,0|2,0,0]=4 102 B9R1.35 O=C1OC[C@H](C(C)C)N1 M10146629P [0,1,0,1,0,0|0,0,0]=2 103 B9R1.10 O=C1C=CC(C)(C)CC1 M10026199P [0,1,0,1,0,0|2,0,0]=4 104 B9R1.133 O=CC1OC(C)(C)OC1 M10079815P [0,1,0,1,0,0|2,0,0]=4