0 B9R0.46 C=CC(OCCOCC)=O M10003373P [0,0,0,0,0,0|2,0,2]=4 1 B9R0.46 O=C(OC)CCCCCBr M10129964P [0,0,0,0,0,0|2,0,0]=2 2 B9R0.46 O=C(OC)CCCCCO M10064340P [0,0,0,0,0,0|2,0,0]=2 3 B8R0.4 BrCCCCCCCBr M10064364P [1,0,0,0,0,0|2,0,1]=4 4 B8R0.4 CCCCCCCCI M10017037P [1,0,0,0,0,0|1,0,1]=3 5 B8R0.4 CCCCCCN=C=O M10045007P [1,0,0,0,0,0|2,0,1]=4 6 B8R0.4 CCCCC\C=C\C=O M10045247P [1,0,0,0,0,0|1,0,2]=4 7 B8R0.4 CCCCNCCCC M10087124P [1,0,0,0,0,0|1,0,1]=3 8 B8R0.4 OCCCCCCCO M10017038P [1,0,0,0,0,0|2,0,1]=4 9 B8R0.6 CCCCCC([O-])CC M10026061P [1,0,0,0,0,0|0,0,2]=3 10 B8R0.6 O=C(OC)CCCCCl M10129961P [1,0,0,0,0,0|2,0,0]=3 11 B8R0.6 O=C(OCCCC)CCl M10014991P [1,0,0,0,0,0|2,0,0]=3 12 B8R0.6 O=C(OCCCC)CO M10104696P [1,0,0,0,0,0|2,0,0]=3 13 B8R0.7 BrCCCCOC(C)=O M10065998P [1,0,0,0,0,0|2,0,0]=3 14 B8R0.7 C#CCCCCC(O)=O M10212111P [1,0,0,0,0,0|1,0,2]=4 15 B8R0.7 C=CCCCCC(O)=O M10027121P [1,0,0,0,0,0|1,0,2]=4 16 B8R0.7 CC(C)CCCCCO M12278016P [1,0,0,0,0,0|2,0,1]=4 17 B8R0.7 CC(O)CCCCCC M10060290P [1,0,0,0,0,0|0,0,2]=3 18 B8R0.7 CC(O)COCCCC M10069007P [1,0,0,0,0,0|1,0,2]=4 19 B8R0.7 CCCCCCB(O)O M10142242P [1,0,0,0,0,0|2,0,1]=4 20 B8R0.7 CCCC\C=C\C(O)=O M10158440P [1,0,0,0,0,0|1,0,2]=4 21 B8R0.7 CSCCCOC(C)=O M10144018P [1,0,0,0,0,0|2,0,0]=3 22 B8R0.7 C[C@@H](O)CCCCCC M10082518P [1,0,0,0,0,0|0,0,2]=3 23 B8R0.7 C[C@H](O)CCCCCC M10084602P [1,0,0,0,0,0|0,0,2]=3 24 B8R0.7 O=C(Cl)CCCCCBr M10176911P [1,0,0,0,0,0|2,0,0]=3 25 B8R0.7 O=C(Cl)OCCCCC M10017366P [1,0,0,0,0,0|2,0,0]=3 26 B8R0.7 O=C(Cl)OCCOCC M10016994P [1,0,0,0,0,0|3,0,0]=4 27 B8R0.7 O=C(O)CCCCCN M10196151P [1,0,0,0,0,0|2,0,0]=3 28 B8R0.7 O=C(O)COCCCC M10044886P [1,0,0,0,0,0|2,0,0]=3 29 B8R0.7 O=C(O)COCCOC M10140131P [1,0,0,0,0,0|3,0,0]=4 30 B10R0.1 O=C(OCC)CCCCCO M10070500P [0,1,0,0,0,0|1,0,0]=2 31 B10R0.59 CCC(OCOC(CC)=O)=O M10055917P [0,1,0,0,0,0|2,0,1]=4 32 B10R0.74 C=CC(OCCCCCC)=O M10044707P [0,1,0,0,0,0|0,0,2]=3 33 B10R0.74 CCCCCCCC(NN)=O M10088132P [0,1,0,0,0,0|2,0,0]=3 34 B10R0.74 CCCCCCCC(NO)=O M10104471P [0,1,0,0,0,0|2,0,0]=3 35 B10R0.74 O=C(OC)CCCCCCN M10152761P [0,1,0,0,0,0|1,0,0]=2 36 B10R1.1 OC1CCC(CCC)CC1 M10264159P [0,0,0,1,0,0|0,0,2]=3 37 B10R1.15 O=C(C1CC=CCC1)OC M10092649P [0,0,0,1,0,0|1,0,2]=4 38 B10R1.15 O=C(C1CCCCO1)OC M10496543P [0,0,0,1,0,0|2,0,0]=3 39 B10R1.15 O=C(C1CCNCC1)OC M10105873P [0,0,0,1,0,0|2,0,0]=3 40 B10R1.15 O=C(C1CNCCC1)OC M10585818P [0,0,0,1,0,0|2,0,0]=3 41 B10R1.15 O=C(C1COCCC1)OC M10157007P [0,0,0,1,0,0|2,0,0]=3 42 B10R1.15 O=C(C1NCCCC1)OC M10217579P [0,0,0,1,0,0|2,0,0]=3 43 B10R1.15 O=C(N1CCNCC1)OC M10254909P [0,0,0,1,0,0|3,0,0]=4 44 B10R1.15 O=C(N1CCOCC1)CCl M10030803P [0,0,0,1,0,0|3,0,0]=4 45 B10R1.15 O=C([C@@H]1NCCCC1)OC M11191820P [0,0,0,1,0,0|2,0,0]=3 46 B10R1.15 O=C([C@H]1CNCCC1)OC M10793660P [0,0,0,1,0,0|2,0,0]=3 47 B10R1.27 O=C(OC)C[C@H]1NCCC1 M10847729P [0,0,0,1,0,0|2,0,0]=3 48 B10R1.149 O=C(C1C(O)CCC1)OC M10590550P [0,0,0,1,0,0|2,0,0]=3 49 B7R0.1 C=CCCCCCCl M10023319P [2,0,0,0,0,0|1,0,1]=4 50 B7R0.1 CCCCCCCI M10061657P [2,0,0,0,0,0|1,0,0]=3 51 B7R0.1 CCCCOCCCl M10115661P [2,0,0,0,0,0|2,0,0]=4 52 B7R0.1 CCCSSCCC M10017032P [2,0,0,0,0,0|2,0,0]=4 53 B7R0.1 CCOCCOCC M10017029P [2,0,0,0,0,0|2,0,0]=4 54 B7R0.1 ICCCCCCI M10017025P [2,0,0,0,0,0|2,0,0]=4 55 B7R0.1 NCCCCCCN M10083288P [2,0,0,0,0,0|2,0,0]=4 56 B7R0.3 O=C(OC)CCCN M10119950P [2,0,0,0,0,0|2,0,0]=4 57 B7R0.3 O=C(OCCC)CBr M10226573P [2,0,0,0,0,0|2,0,0]=4 58 B7R0.4 CC(CCCCBr)=O M10113189P [2,0,0,0,0,0|1,0,0]=3 59 B7R0.4 CC(N)CCCCC M10004600P [2,0,0,0,0,0|1,0,1]=4 60 B7R0.4 CC(OCCOC)=O M10003718P [2,0,0,0,0,0|2,0,0]=4 61 B7R0.4 CCCCCC(Cl)=O M10005436P [2,0,0,0,0,0|1,0,0]=3 62 B7R0.4 O=C(N)NCCCC M10195780P [2,0,0,0,0,0|2,0,0]=4 63 B7R0.4 O=C(N)NCCCC M10200467P [2,0,0,0,0,0|2,0,0]=4 64 B7R0.4 O=C(O)CCCCO M10123275P [2,0,0,0,0,0|2,0,0]=4 65 B7R0.4 O=C(O)CCOCC M10062024P [2,0,0,0,0,0|2,0,0]=4 66 B7R0.4 O=C(O)COCCC M10276951P [2,0,0,0,0,0|2,0,0]=4 67 B7R0.4 O=C([O-])CCCCO M10233260P [2,0,0,0,0,0|2,0,0]=4 68 B9R0.18 O=[Sn](CCCC)CCCC M10021207P [1,1,0,0,0,0|1,0,1]=4 69 B9R0.45 CCCCCCCCCI M10191776P [1,1,0,0,0,0|0,0,1]=3 70 B9R0.45 CCCCCCCCNC M10043978P [1,1,0,0,0,0|0,0,1]=3 71 B9R0.45 CCCCCC\C=C\C=O M10157563P [1,1,0,0,0,0|0,0,2]=4 72 B9R0.45 COCCOCCOCC M10024868P [1,1,0,0,0,0|2,0,0]=4 73 B9R0.45 OCCCCCCCCBr M10256068P [1,1,0,0,0,0|1,0,1]=4 74 B9R0.8 CCCCC(Br)C(OC)=O M10064420P [1,1,0,0,0,0|1,0,0]=3 75 B9R0.8 CCCCC(Br)C(OC)=O M10437847P [1,1,0,0,0,0|1,0,0]=3 76 B9R0.8 O=C(OC)[C@@H](N)CCCN M10242020P [1,1,0,0,0,0|2,0,0]=4 77 B9R0.34 CCC(OC(C)COC)=O M10772795P [1,1,0,0,0,0|2,0,0]=4 78 B9R0.34 CCCC(O)CC(OC)=O M10169115P [1,1,0,0,0,0|1,0,0]=3 79 B9R0.47 CC(C(OCCCC)=O)=O M10165130P [1,1,0,0,0,0|1,0,1]=4 80 B9R0.47 C[C@H](O)C(OCCCC)=O M10223932P [1,1,0,0,0,0|1,0,0]=3 81 B9R0.4 CC(OC(C)=O)COCC M10278996P [1,1,0,0,0,0|2,0,0]=4 82 B9R0.38 CCCCCCP(O)(O)=O M10065651P [1,1,0,0,0,0|2,0,0]=4 83 B9R0.55 O=C(O)CCCCC(C)=O M10051384P [1,1,0,0,0,0|1,0,1]=4 84 B11R0.4 CCCC(OC\C=C\CCC)=O M10270404P [0,2,0,0,0,0|0,0,2]=4 85 B11R0.4 O=C(OCC)CCCCCCBr M10207592P [0,2,0,0,0,0|0,0,0]=2 86 B11R0.4 O=C(OCC)CCCCCCN M10207661P [0,2,0,0,0,0|0,0,0]=2 87 B11R0.142 CCCCCCC(Br)C(OC)=O M10075136P [0,2,0,0,0,0|1,0,0]=3 88 B11R0.155 CCCCCC(C(OCC)=O)=O M10120553P [0,2,0,0,0,0|0,0,1]=3 89 B11R0.155 CC\C=C(C)\C(O)CCCCC M10484703P [0,2,0,0,0,0|1,0,0]=3 90 B11R0.42 C=C(C)C(OCCCCCC)=O M10005409P [0,2,0,0,0,0|0,0,1]=3 91 B11R0.42 CCCCCCCC(N(C)C)=O M10027091P [0,2,0,0,0,0|1,0,0]=3 92 B9R1.8 CCCC1CCCCC1 M10034652P [1,0,0,1,0,0|0,0,1]=3 93 B9R1.8 CCOC1CCNCC1 M10027298P [1,0,0,1,0,0|2,0,0]=4 94 B9R1.8 NCCC1CCCCC1 M10076838P [1,0,0,1,0,0|1,0,1]=4 95 B9R1.8 OCCC1CCCCC1 M10063359P [1,0,0,1,0,0|1,0,1]=4 96 B9R1.8 OCCC1CCNCC1 M10599588P [1,0,0,1,0,0|2,0,0]=4 97 B9R1.14 CCN1[C@@H](CN)CCC1 M10176853P [1,0,0,1,0,0|2,0,0]=4 98 B9R1.89 COC1CCNCCC1 M10098596P [1,0,0,1,0,0|2,0,0]=4 99 B9R1.103 N1CCCCCCCC1 M10078823P [1,0,0,1,0,0|1,0,0]=3 100 B9R1.1 N#CC1CCC(CC1)=O M10225432P [1,0,0,1,0,0|1,0,1]=4 101 B9R1.1 O=C1CCC(OC)CC1 M10124180P [1,0,0,1,0,0|1,0,0]=3 102 B9R1.1 O=C1NCC(CO)CC1 M10769348P [1,0,0,1,0,0|2,0,0]=4 103 B9R1.11 ClCC(N1CCCC1)=O M10165063P [1,0,0,1,0,0|2,0,0]=4 104 B9R1.11 O=C(C1CNCC1)OC M10828155P [1,0,0,1,0,0|2,0,0]=4 105 B9R1.11 O=C(C1OCCC1)OC M10233304P [1,0,0,1,0,0|2,0,0]=4 106 B9R1.118 OC1(CC)CCCCC1 M10038193P [1,0,0,1,0,0|0,0,2]=4 107 B9R1.6 CC(C1CCCCC1)=O M10021388P [1,0,0,1,0,0|0,0,0]=2 108 B9R1.6 CC(C1CCOCC1)=O M10742643P [1,0,0,1,0,0|1,0,0]=3 109 B9R1.6 O=C(C1CCCCC1)O M10002681P [1,0,0,1,0,0|1,0,0]=3 110 B9R1.6 O=C(C1CCCCC1)[O-] M10005124P [1,0,0,1,0,0|1,0,0]=3 111 B9R1.6 O=C(C1CCCCO1)O M10261099P [1,0,0,1,0,0|2,0,0]=4 112 B9R1.6 O=C(C1CCOCC1)O M10071426P [1,0,0,1,0,0|2,0,0]=4 113 B9R1.6 O=C(C1COCCC1)O M10012480P [1,0,0,1,0,0|2,0,0]=4 114 B9R1.6 O=C(Cl)C1CCOCC1 M10241966P [1,0,0,1,0,0|2,0,0]=4 115 B9R1.6 O=C([C@H]1CNCCC1)O M11020814P [1,0,0,1,0,0|2,0,0]=4 116 B9R1.13 CC(N[C@@H]1CNCC1)=O M10695408P [1,0,0,1,0,0|2,0,0]=4 117 B9R1.13 O=C(O)CC1COCC1 M10746626P [1,0,0,1,0,0|2,0,0]=4 118 B9R1.13 O=C(O)CC1OCCC1 M10043869P [1,0,0,1,0,0|2,0,0]=4 119 B9R1.13 O=C(O)C[C@@H]1NCCC1 M10330790P [1,0,0,1,0,0|2,0,0]=4 120 B9R1.13 O=C(O)C[C@@H]1NCCC1 M10879019P [1,0,0,1,0,0|2,0,0]=4 121 B9R1.13 O=C(O)C[C@H]1CNCC1 M10715094P [1,0,0,1,0,0|2,0,0]=4 122 B9R1.41 O=C([C@H]1N(C)CCC1)O M10011652P [1,0,0,1,0,0|2,0,0]=4 123 B11R1.16 NCCN(C1CCCCC1)C M10844339P [0,1,0,1,0,0|2,0,0]=4 124 B11R1.16 O=C(C1CCNCC1)OCC M10771698P [0,1,0,1,0,0|1,0,0]=3 125 B11R1.16 O=C(C1CNCCC1)OCC M10066727P [0,1,0,1,0,0|1,0,0]=3 126 B11R1.16 O=C(C1CNCCC1)OCC M10067963P [0,1,0,1,0,0|1,0,0]=3 127 B11R1.16 O=C(C1NCCCC1)OCC M10466005P [0,1,0,1,0,0|1,0,0]=3 128 B11R1.16 O=C(C1NCCNC1)OCC M10586758P [0,1,0,1,0,0|2,0,0]=4 129 B11R1.199 O=C([C@H]1[C@@H](O)CCC1)OCC M10340054P [0,1,0,1,0,0|1,0,0]=3 130 B11R1.289 O=C(CCN1CCC1)OCC M10110138P [0,1,0,1,0,0|1,0,0]=3 131 B11R1.40 O=C(OC)CC1CCNCC1 M10482818P [0,1,0,1,0,0|1,0,0]=3 132 B11R1.40 O=C(OC)CC1NCCNC1 M10872267P [0,1,0,1,0,0|2,0,0]=4 133 B11R1.40 O=C(OC)CC1NCCNC1 M12277833P [0,1,0,1,0,0|2,0,0]=4 134 B11R1.20 CC(OC1CCC(CC1)=O)=O M10244760P [0,1,0,1,0,0|1,0,1]=4 135 B11R1.20 O=C1CCC(OC(C)C)CC1 M10435461P [0,1,0,1,0,0|1,0,0]=3 136 B11R1.23 O=C(C1CN(C)CCC1)OC M10034835P [0,1,0,1,0,0|2,0,0]=4 137 B11R1.22 O=C(C1CCC(O)CC1)OC M10149669P [0,1,0,1,0,0|1,0,0]=3 138 B11R1.22 O=C(C1CCN(C)CC1)OC M10034838P [0,1,0,1,0,0|2,0,0]=4 139 B11R1.22 O=C([C@H]1CC[C@H](O)CC1)OC M10084042P [0,1,0,1,0,0|1,0,0]=3 140 B11R1.1 OC1CCC(CCCC)CC1 M10438951P [0,1,0,1,0,0|0,0,2]=4 141 B11R1.852 O=C(C1CCCCCC1)OC M10314157P [0,1,0,1,0,0|1,0,0]=3 142 B11R1.878 O=C(C1(N)CCCCC1)OC M10064001P [0,1,0,1,0,0|1,0,0]=3