0 B9R0.2 CCCCCCCC(=O)O SC-27437 [0,0,0,0,0,0|1,0,1]=2 1 B9R0.2 CCCCCCOC(=O)Cl SC-53671 [0,0,0,0,0,0|2,0,2]=4 2 B9R0.2 NCCCCCCC(=O)O SC-10087 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.4 BrCCCCCCCBr SC-04650 [1,0,0,0,0,0|2,0,0]=3 4 B8R0.4 C=CCCCCCCBr SC-20943 [1,0,0,0,0,0|1,0,2]=4 5 B8R0.4 CCCCCCCCC SC-96410 [1,0,0,0,0,0|0,0,0]=1 6 B8R0.4 CCCCCCCC[Mg+] SC-92207 [1,0,0,0,0,0|1,0,0]=2 7 B8R0.4 CCCCOCCC=O SC-41651 [1,0,0,0,0,0|1,0,2]=4 8 B8R0.4 CCCC[NH2+]CCCC SC-83235 [1,0,0,0,0,0|1,0,0]=2 9 B8R0.4 COCCNCCOC SC-74267 [1,0,0,0,0,0|3,0,0]=4 10 B8R0.4 ClCCCOCCCCl SC-97635 [1,0,0,0,0,0|3,0,0]=4 11 B8R0.4 NCCCCCCCN SC-93904 [1,0,0,0,0,0|2,0,0]=3 12 B8R0.4 NCCCOCCCN SC-95725 [1,0,0,0,0,0|3,0,0]=4 13 B8R0.4 O=CCCCCCCBr SC-92032 [1,0,0,0,0,0|1,0,2]=4 14 B8R0.4 OCCCCC#CCBr SC-92723 [1,0,0,0,0,0|1,0,2]=4 15 B8R0.4 OCCCCCCCBr SC-49307 [1,0,0,0,0,0|1,0,0]=2 16 B8R0.4 OCCCCCCCO SC-97877 [1,0,0,0,0,0|1,0,0]=2 17 B8R0.4 OCCSCSCCO SC-76893 [1,0,0,0,0,0|3,0,0]=4 18 B8R0.7 CC(C)OCCCCO SC-82574 [1,0,0,0,0,0|3,0,0]=4 19 B8R0.7 CCCCCCB(O)O SC-97201 [1,0,0,0,0,0|2,0,0]=3 20 B8R0.7 CCCCCCC(C)O SC-47133 [1,0,0,0,0,0|0,0,0]=1 21 B8R0.7 CCCCOCC(=O)O SC-22619 [1,0,0,0,0,0|2,0,1]=4 22 B8R0.7 NCCCCCC(=O)O SC-10067 [1,0,0,0,0,0|2,0,1]=4 23 B8R0.7 O=C(O)CCCCCBr SC-04420 [1,0,0,0,0,0|2,0,1]=4 24 B8R0.7 O=C(O)CCCCCO SC-17400 [1,0,0,0,0,0|2,0,1]=4 25 B10R0.3 CC(C)CCCC(C)CCBr SC-45428 [0,1,0,0,0,0|2,0,0]=3 26 B10R0.4 CC(=O)OCCCCCCBr SC-93957 [0,1,0,0,0,0|1,0,2]=4 27 B10R0.4 CC(C)CCCCCCCO SC-49157 [0,1,0,0,0,0|1,0,0]=2 28 B10R0.4 CCCCCCCCN(C)C SC-65204 [0,1,0,0,0,0|2,0,0]=3 29 B10R0.4 O=C(O)CCCCCCCBr SC-15671 [0,1,0,0,0,0|1,0,1]=3 30 B10R0.4 O=C(O)CCCCCCCO SC-46068 [0,1,0,0,0,0|1,0,1]=3 31 B10R0.6 CCCCCC(N)CC(=O)O SC-12428 [0,1,0,0,0,0|1,0,1]=3 32 B10R0.22 CCCCCCCS(=O)(=O)[O-] SC-15137 [0,1,0,0,0,0|2,0,1]=4 33 B10R0.74 COC(=O)CCCCCCN SC-65871 [0,1,0,0,0,0|1,0,2]=4 34 B10R0.74 COC(=O)CCCCCCN SC-A2642 [0,1,0,0,0,0|1,0,2]=4 35 B10R0.75 CCCCCCC(N)C(=O)O SC-10073 [0,1,0,0,0,0|1,0,1]=3 36 B10R1.18 CC(C)CN1CCNCC1 SC-05096 [0,0,0,1,0,0|3,0,0]=4 37 B10R1.18 CC(C)OC1CCNCC1 SC-15496 [0,0,0,1,0,0|3,0,0]=4 38 B10R1.18 CC(N)CC1CCCCC1 SC-50574 [0,0,0,1,0,0|1,0,0]=2 39 B10R1.18 CN(C)CC1CCNCC1 SC-92123 [0,0,0,1,0,0|3,0,0]=4 40 B10R1.18 O=C(O)CC1CCCNC1 SC-28383 [0,0,0,1,0,0|2,0,1]=4 41 B10R1.18 O=C(O)CC1CCNCC1 SC-25919 [0,0,0,1,0,0|2,0,1]=4 42 B10R1.18 O=C(O)CC1CCNCC1 SC-95171 [0,0,0,1,0,0|2,0,1]=4 43 B10R1.18 O=C(O)CC1CCOCC1 SC-06974 [0,0,0,1,0,0|2,0,1]=4 44 B10R1.18 O=C(O)CN1CCCCC1 SC-27156 [0,0,0,1,0,0|2,0,1]=4 45 B10R1.61 CC1CCCCC1C(=O)O SC-13884 [0,0,0,1,0,0|1,0,1]=3 46 B10R1.61 CC1CCCNC1C(=O)O SC-14001 [0,0,0,1,0,0|2,0,1]=4 47 B10R1.61 CN1CCCCC1C(=O)O SC-61396 [0,0,0,1,0,0|2,0,1]=4 48 B10R1.61 CN1CCCCC1C(=O)O SC-93743 [0,0,0,1,0,0|2,0,1]=4 49 B10R1.61 CN1CCCC[C@@H]1C(=O)O SC-53886 [0,0,0,1,0,0|2,0,1]=4 50 B10R1.61 NC1CCCCC1C(=O)O SC-96032 [0,0,0,1,0,0|2,0,1]=4 51 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O SC-93716 [0,0,0,1,0,0|2,0,1]=4 52 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O SC-67617 [0,0,0,1,0,0|2,0,1]=4 53 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O SC-A3216 [0,0,0,1,0,0|2,0,1]=4 54 B10R1.66 O=C(Cl)CCC1CCCC1 SC-19136 [0,0,0,1,0,0|1,0,2]=4 55 B10R1.66 O=C(O)CCC1CCCC1 SC-25882 [0,0,0,1,0,0|1,0,1]=3 56 B10R1.66 O=C(O)CCN1CCCC1 SC-40524 [0,0,0,1,0,0|2,0,1]=4 57 B10R1.66 O=C(O)CNC1CCCC1 SC-45413 [0,0,0,1,0,0|2,0,1]=4 58 B10R1.348 O=C(O)C1CCCCCC1 SC-13836 [0,0,0,1,0,0|1,0,1]=3 59 B10R1.348 O=C(O)C1CCCCCN1 SC-13854 [0,0,0,1,0,0|2,0,1]=4 60 B7R0.1 BrCCCCCCBr SC-05920 [2,0,0,0,0,0|2,0,0]=4 61 B7R0.1 C#CCCCCCO SC-47536 [2,0,0,0,0,0|0,0,2]=4 62 B7R0.1 CCCCOCCCl SC-41513 [2,0,0,0,0,0|2,0,0]=4 63 B7R0.1 ClCCCCCCBr SC-99457 [2,0,0,0,0,0|2,0,0]=4 64 B7R0.1 ClCCCCCCCl SC-26774 [2,0,0,0,0,0|2,0,0]=4 65 B7R0.1 ClCCCCCCI SC-51061 [2,0,0,0,0,0|2,0,0]=4 66 B7R0.1 NCCCCCCO SC-47381 [2,0,0,0,0,0|1,0,0]=3 67 B7R0.1 O=CCCCCCO SC-94633 [2,0,0,0,0,0|1,0,1]=4 68 B7R0.1 OCCCCCCBr SC-23167 [2,0,0,0,0,0|1,0,0]=3 69 B9R0.18 CCCCC(=O)CCCC SC-89430 [1,1,0,0,0,0|0,0,1]=3 70 B9R0.18 CCOCC(O)COCC SC-69159 [1,1,0,0,0,0|2,0,0]=4 71 B9R0.45 BrCCCCCCCCBr SC-44358 [1,1,0,0,0,0|1,0,0]=3 72 B9R0.45 C#CCCCCCCCC SC-65396 [1,1,0,0,0,0|0,0,1]=3 73 B9R0.45 C#CCCCCCCCO SC-71987 [1,1,0,0,0,0|0,0,1]=3 74 B9R0.45 CCCCCCCCCBr SC-65114 [1,1,0,0,0,0|0,0,0]=2 75 B9R0.45 CCCCCCCCNC SC-62266 [1,1,0,0,0,0|0,0,0]=2 76 B9R0.45 NCCOCCOCCO SC-52912 [1,1,0,0,0,0|2,0,0]=4 77 B9R0.45 OCCCCCCCCBr SC-13899 [1,1,0,0,0,0|0,0,0]=2 78 B9R0.45 OCCOCCOCCCl SC-70482 [1,1,0,0,0,0|2,0,0]=4 79 B9R0.45 OCCSCCSCCO SC-81333 [1,1,0,0,0,0|2,0,0]=4 80 B9R0.46 CCCCCCC(O)CO SC-79225 [1,1,0,0,0,0|0,0,0]=2 81 B9R0.47 CCCCCC(N)C(=O)O SC-10084 [1,1,0,0,0,0|1,0,1]=4 82 B9R0.47 CCCCCC(N)C(=O)O SC-10085 [1,1,0,0,0,0|1,0,1]=4 83 B9R0.47 CCCCC[C@@H](N)C(=O)O SC-10086 [1,1,0,0,0,0|1,0,1]=4 84 B11R0.42 CCCCCCC[C@@H](N)C(=O)O SC-10110 [0,2,0,0,0,0|1,0,0]=3 85 B11R0.46 CCCCCN(C)CCC(=O)O SC-19427 [0,2,0,0,0,0|1,0,1]=4 86 B11R0.148 O=C(O)CCCCCCCCBr SC-52958 [0,2,0,0,0,0|1,0,1]=4 87 B9R1.5 OC1CCCCCC1O SC-45470 [1,0,0,1,0,0|1,0,0]=3 88 B9R1.8 BrCCC1CCOCC1 SC-99287 [1,0,0,1,0,0|2,0,0]=4 89 B9R1.8 BrCCC1OCCCO1 SC-89023 [1,0,0,1,0,0|2,0,0]=4 90 B9R1.8 CCCN1CCNCC1 SC-82764 [1,0,0,1,0,0|2,0,0]=4 91 B9R1.8 CCNC1CCOCC1 SC-45632 [1,0,0,1,0,0|2,0,0]=4 92 B9R1.8 COCC1CCCCN1 SC-48480 [1,0,0,1,0,0|2,0,0]=4 93 B9R1.8 COCC1CCNCC1 SC-B8194 [1,0,0,1,0,0|2,0,0]=4 94 B9R1.8 COCC1CNCCO1 SC-99967 [1,0,0,1,0,0|2,0,0]=4 95 B9R1.8 ClCCN1CCCCC1 SC-12781 [1,0,0,1,0,0|2,0,0]=4 96 B9R1.8 N#CCC1CCCCC1 SC-72238 [1,0,0,1,0,0|1,0,1]=4 97 B9R1.8 NCCC1CCOCC1 SC-06091 [1,0,0,1,0,0|2,0,0]=4 98 B9R1.8 NCCN1CCCCC1 SC-69190 [1,0,0,1,0,0|2,0,0]=4 99 B9R1.8 NNCC1CCCCC1 SC-58983 [1,0,0,1,0,0|2,0,0]=4 100 B9R1.8 O=CCC1CCCCC1 SC-12759 [1,0,0,1,0,0|0,0,2]=4 101 B9R1.8 OCCC1CCCCN1 SC-01221 [1,0,0,1,0,0|1,0,0]=3 102 B9R1.8 OCCC1CCNCC1 SC-05824 [1,0,0,1,0,0|1,0,0]=3 103 B9R1.8 OCCC1CCNCC1 SC-A3238 [1,0,0,1,0,0|1,0,0]=3 104 B9R1.8 OCCC1CNCCO1 SC-24452 [1,0,0,1,0,0|2,0,0]=4 105 B9R1.8 OCCN1CCOCC1 SC-27241 [1,0,0,1,0,0|2,0,0]=4 106 B9R1.8 [NH3+]NCC1CCCCC1 SC-41857 [1,0,0,1,0,0|2,0,0]=4 107 B9R1.12 BrCCCC1OCCO1 SC-A3539 [1,0,0,1,0,0|2,0,0]=4 108 B9R1.12 ClCCCN1CCCC1 SC-12630 [1,0,0,1,0,0|2,0,0]=4 109 B9R1.12 O=CCCC1CCCC1 SC-40969 [1,0,0,1,0,0|0,0,2]=4 110 B9R1.12 OCCCN1CCCC1 SC-25910 [1,0,0,1,0,0|1,0,0]=3 111 B9R1.14 CCN1CCCC1CN SC-17902 [1,0,0,1,0,0|2,0,0]=4 112 B9R1.14 [C@H]1(CN)CCCN1CC SC-15944 [1,0,0,1,0,0|2,0,0]=4 113 B9R1.15 C[C@H]1CCCN[C@@H]1CO SC-91585 [1,0,0,1,0,0|1,0,0]=3 114 B9R1.33 CN1CCCC1CCN SC-15358 [1,0,0,1,0,0|2,0,0]=4 115 B9R1.39 NCCCC1CCC1O SC-95269 [1,0,0,1,0,0|1,0,0]=3 116 B9R1.50 O=C1CCCCCCC1 SC-19957 [1,0,0,1,0,0|0,0,2]=4 117 B9R1.2 CCN1CCCC(N)C1 SC-83319 [1,0,0,1,0,0|2,0,0]=4 118 B9R1.6 CC(O)C1CCCCC1 SC-22092 [1,0,0,1,0,0|0,0,0]=2 119 B9R1.6 O=C(O)C1CCCCC1 SC-22688 [1,0,0,1,0,0|1,0,1]=4 120 B9R1.6 OB(O)C1CCCCC1 SC-86762 [1,0,0,1,0,0|2,0,0]=4 121 B9R1.9 NCCCN1CC(O)C1 SC-14223 [1,0,0,1,0,0|2,0,0]=4 122 B9R1.13 CC(C)C[C@H]1CCCN1 SC-91874 [1,0,0,1,0,0|2,0,0]=4 123 B9R1.40 CC1(C)CCCC[C@@H]1N SC-89246 [1,0,0,1,0,0|2,0,0]=4 124 B9R1.40 CC1(C)CCCC[C@H]1N SC-89247 [1,0,0,1,0,0|2,0,0]=4 125 B9R1.84 O=C(O)CCC1CCC1 SC-30968 [1,0,0,1,0,0|1,0,1]=4 126 B9R1.148 FC1(F)CCCCCC1 SC-88944 [1,0,0,1,0,0|2,0,0]=4 127 B11R1.15 CCOC(=O)C1CCC(O)C1 SC-51294 [0,1,0,1,0,0|1,0,1]=4 128 B11R1.166 CC1CCC(C(C)C)C(O)C1 SC-01321 [0,1,0,1,0,0|2,0,0]=4 129 B11R1.53 CN[C@@H]1CCCC[C@H]1N(C)C SC-48830 [0,1,0,1,0,0|2,0,0]=4 130 B11R1.91 O=C(O)CCC1CCNCC1 SC-25243 [0,1,0,1,0,0|1,0,1]=4 131 B11R1.213 CC1(C)OC[C@H](CCCO)O1 SC-91218 [0,1,0,1,0,0|2,0,0]=4 132 B11R1.20 CN(C)CC1CCC(N)CC1 SC-A2385 [0,1,0,1,0,0|2,0,0]=4 133 B11R1.20 O=C(O)CC1CCC(O)CC1 SC-49645 [0,1,0,1,0,0|1,0,1]=4 134 B11R1.852 O=C(CBr)C1CCCCCC1 SC-35498 [0,1,0,1,0,0|0,0,2]=4 135 B11R1.35 N[C@@H](CC1CCCC1)C(=O)O SC-19682 [0,1,0,1,0,0|1,0,1]=4 136 B11R1.36 N[C@H](C(=O)O)C1CCCCC1 SC-19465 [0,1,0,1,0,0|1,0,1]=4 137 B11R1.36 [C@H](N)(C(=O)O)C1CCCCC1 SC-11100 [0,1,0,1,0,0|1,0,1]=4 138 B11R2.748 OC1COC2(CCCC2)C1 SC-B8771 [0,0,0,2,0,0|1,0,0]=3 139 B11R2.432 CN1C2CCC1CC(N)C2 SC-87634 [0,0,0,2,0,0|2,0,0]=4 140 B11R2.432 CN1[C@H]2CC[C@@H]1C[C@@H](O)C2 SC-13932 [0,0,0,2,0,0|1,0,0]=3