0 B7R0.1 C#CCCCCCCl SC-52143 [0,0,0,0,0,0|2,0,1]=3 1 B7R0.1 C#CCCCCCO SC-47536 [0,0,0,0,0,0|2,0,1]=3 2 B7R0.1 C#CCCCCNN SC-41716 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.1 CCCCCCCC SC-78848 [0,0,0,0,0,0|1,0,1]=2 4 B7R0.1 CCCCCN=C=S SC-05979 [0,0,0,0,0,0|1,1,1]=3 5 B7R0.1 CCCCCON=O SC-25603 [0,0,0,0,0,0|2,0,0]=2 6 B7R0.1 CCCCOCCCl SC-41513 [0,0,0,0,0,0|2,0,1]=3 7 B7R0.1 CCCCSCC#N SC-96134 [0,0,0,0,0,0|2,0,1]=3 8 B7R0.1 CCCCSCCN SC-38559 [0,0,0,0,0,0|2,0,1]=3 9 B7R0.1 CCCSSCCC SC-88855 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.1 COCCOCCBr SC-82752 [0,0,0,0,0,0|3,0,1]=4 11 B7R0.1 ClCCCCCCBr SC-99457 [0,0,0,0,0,0|2,0,1]=3 12 B7R0.1 ClCCCCCCCl SC-26774 [0,0,0,0,0,0|2,0,1]=3 13 B7R0.1 ClCCCCCCI SC-51061 [0,0,0,0,0,0|2,0,1]=3 14 B7R0.1 N#CCCCCCN SC-91222 [0,0,0,0,0,0|2,0,1]=3 15 B7R0.1 NCCCCCCO SC-47381 [0,0,0,0,0,0|1,0,2]=3 16 B7R0.1 NCCCNCCBr SC-48151 [0,0,0,0,0,0|3,0,1]=4 17 B7R0.1 O=CCCCCCO SC-94633 [0,0,0,0,0,0|1,0,0]=1 18 B7R0.1 OCCCCCCBr SC-23167 [0,0,0,0,0,0|1,0,2]=3 19 B7R0.1 OCCCOCCCl SC-50537 [0,0,0,0,0,0|2,0,2]=4 20 B7R0.1 SCCCCCCS SC-15339 [0,0,0,0,0,0|1,1,1]=3 21 B6R0.6 BrCCOCCBr SC-13704 [1,0,0,0,0,0|3,0,0]=4 22 B6R0.6 BrCC[NH2+]CCBr SC-82825 [1,0,0,0,0,0|3,0,0]=4 23 B6R0.6 C#CCCCCN SC-A3767 [1,0,0,0,0,0|1,0,2]=4 24 B6R0.6 C#CCCCCO SC-87514 [1,0,0,0,0,0|0,0,3]=4 25 B6R0.6 C=CCCCC=O SC-34117 [1,0,0,0,0,0|0,0,2]=3 26 B6R0.6 C=CCCCCBr SC-27023 [1,0,0,0,0,0|1,0,1]=3 27 B6R0.6 C=CCCCCN SC-34878 [1,0,0,0,0,0|1,0,1]=3 28 B6R0.6 C=CCCCCO SC-44461 [1,0,0,0,0,0|1,0,1]=3 29 B6R0.6 C=CCCCC[Zn+] SC-89392 [1,0,0,0,0,0|1,0,1]=3 30 B6R0.6 C=CCOCCI SC-50512 [1,0,0,0,0,0|2,0,1]=4 31 B6R0.6 C=CCOCCO SC-25613 [1,0,0,0,0,0|2,0,1]=4 32 B6R0.6 C=COCCCC SC-22799 [1,0,0,0,0,0|1,0,1]=3 33 B6R0.6 CCCCCC=O SC-06151 [1,0,0,0,0,0|0,0,0]=1 34 B6R0.6 CCCCNCC SC-47234 [1,0,0,0,0,0|1,0,1]=3 35 B6R0.6 CCCCON=O SC-70750 [1,0,0,0,0,0|2,0,0]=3 36 B6R0.6 CCCNCCO SC-20196 [1,0,0,0,0,0|1,0,1]=3 37 B6R0.6 CCC\C=C\C=O SC-25240 [1,0,0,0,0,0|0,0,2]=3 38 B6R0.6 CCOCCCN SC-74768 [1,0,0,0,0,0|2,0,0]=3 39 B6R0.6 CCOCCCO SC-00354 [1,0,0,0,0,0|1,0,1]=3 40 B6R0.6 CNCCCCO SC-13108 [1,0,0,0,0,0|1,0,1]=3 41 B6R0.6 CNCCCNC SC-47576 [1,0,0,0,0,0|2,0,1]=4 42 B6R0.6 CNCCCOC SC-51293 [1,0,0,0,0,0|2,0,1]=4 43 B6R0.6 CNCCCOC SC-A3034 [1,0,0,0,0,0|2,0,1]=4 44 B6R0.6 COCCCC=O SC-88270 [1,0,0,0,0,0|1,0,0]=2 45 B6R0.6 COCCCCCl SC-01876 [1,0,0,0,0,0|2,0,0]=3 46 B6R0.6 COCCCOC SC-47077 [1,0,0,0,0,0|2,0,1]=4 47 B6R0.6 COCCN=C=O SC-72245 [1,0,0,0,0,0|2,0,1]=4 48 B6R0.6 C\C=C\CCCO SC-48265 [1,0,0,0,0,0|0,0,3]=4 49 B6R0.6 ClCCNCCCl SC-18181 [1,0,0,0,0,0|3,0,0]=4 50 B6R0.6 FCCCCCBr SC-45318 [1,0,0,0,0,0|2,0,0]=3 51 B6R0.6 ICCCCCI SC-82357 [1,0,0,0,0,0|2,0,0]=3 52 B6R0.6 N#CCCCCBr SC-13250 [1,0,0,0,0,0|2,0,1]=4 53 B6R0.6 NCCCCCN SC-35536 [1,0,0,0,0,0|2,0,0]=3 54 B6R0.6 NCCCCCO SC-20467 [1,0,0,0,0,0|1,0,1]=3 55 B6R0.6 NCCNCCN SC-79061 [1,0,0,0,0,0|3,0,0]=4 56 B6R0.6 NCCOCCCl SC-88571 [1,0,0,0,0,0|3,0,0]=4 57 B6R0.6 NCCOCCN SC-87302 [1,0,0,0,0,0|3,0,0]=4 58 B6R0.6 NCCOCCN SC-93964 [1,0,0,0,0,0|3,0,0]=4 59 B6R0.6 NCCOCCO SC-49862 [1,0,0,0,0,0|2,0,1]=4 60 B6R0.6 NCCSCCO SC-77966 [1,0,0,0,0,0|2,0,1]=4 61 B6R0.6 O=C=NCCCCl SC-77667 [1,0,0,0,0,0|2,0,1]=4 62 B6R0.6 O=CCCCCCl SC-A3300 [1,0,0,0,0,0|1,0,0]=2 63 B6R0.6 OCCCCCBr SC-43699 [1,0,0,0,0,0|1,0,1]=3 64 B6R0.6 OCCCCCO SC-69222 [1,0,0,0,0,0|1,0,1]=3 65 B8R0.1 CCOC(=O)CNC=O SC-19934 [0,1,0,0,0,0|2,0,1]=4 66 B8R0.4 BrCCCCCCCBr SC-04650 [0,1,0,0,0,0|1,0,1]=3 67 B8R0.4 C=CCCCCCCBr SC-20943 [0,1,0,0,0,0|1,0,0]=2 68 B8R0.4 C=CCCCCCCCl SC-30488 [0,1,0,0,0,0|1,0,0]=2 69 B8R0.4 C=COCCOCCO SC-91513 [0,1,0,0,0,0|3,0,0]=4 70 B8R0.4 CCCCBCCCC SC-50243 [0,1,0,0,0,0|1,0,1]=3 71 B8R0.4 CCCCCCCCC SC-96410 [0,1,0,0,0,0|1,0,1]=3 72 B8R0.4 CCCCCCCCI SC-74556 [0,1,0,0,0,0|1,0,1]=3 73 B8R0.4 CCCCCCCC[Mg+] SC-92207 [0,1,0,0,0,0|1,0,1]=3 74 B8R0.4 CCCCCCCNC SC-58244 [0,1,0,0,0,0|1,0,1]=3 75 B8R0.4 CCCCOCCC=O SC-41651 [0,1,0,0,0,0|0,0,0]=1 76 B8R0.4 CCCC[NH2+]CCCC SC-83235 [0,1,0,0,0,0|1,0,1]=3 77 B8R0.4 COCCNCCOC SC-74267 [0,1,0,0,0,0|3,0,0]=4 78 B8R0.4 ClCCCOCCCCl SC-97635 [0,1,0,0,0,0|2,0,1]=4 79 B8R0.4 N#CCCCCCCBr SC-77029 [0,1,0,0,0,0|1,0,1]=3 80 B8R0.4 NCCCCCCCBr SC-40056 [0,1,0,0,0,0|1,0,1]=3 81 B8R0.4 NCCCCCCCCl SC-38783 [0,1,0,0,0,0|1,0,1]=3 82 B8R0.4 NCCCCCCCN SC-93904 [0,1,0,0,0,0|1,0,1]=3 83 B8R0.4 NCCCOCCCN SC-95725 [0,1,0,0,0,0|2,0,1]=4 84 B8R0.4 O=CCCCCCCBr SC-92032 [0,1,0,0,0,0|0,0,0]=1 85 B8R0.4 OCCCCCCCBr SC-49307 [0,1,0,0,0,0|0,0,2]=3 86 B8R0.4 OCCCCCCCO SC-97877 [0,1,0,0,0,0|0,0,2]=3 87 B8R0.4 OCCCNCCCO SC-85694 [0,1,0,0,0,0|1,0,2]=4 88 B8R0.4 OCCCNCCCO SC-A5668 [0,1,0,0,0,0|1,0,2]=4 89 B8R0.4 OCCCOCCCCl SC-50536 [0,1,0,0,0,0|1,0,2]=4 90 B8R0.6 C=CC(O)CCCCC SC-18002 [0,1,0,0,0,0|1,0,0]=2 91 B8R0.6 C=CCCC[C@@H](C)CO SC-31639 [0,1,0,0,0,0|2,0,0]=3 92 B8R0.6 C=CCCC[C@H](C)CO SC-31524 [0,1,0,0,0,0|2,0,0]=3 93 B8R0.7 C#CCCCCC(=O)O SC-20440 [0,1,0,0,0,0|0,0,2]=3 94 B8R0.7 C#CCOCCC(=O)O SC-A2263 [0,1,0,0,0,0|1,0,2]=4 95 B8R0.7 C=CCCOCC(=O)O SC-35006 [0,1,0,0,0,0|1,0,2]=4 96 B8R0.7 CC(C)CCCCCO SC-51101 [0,1,0,0,0,0|0,0,2]=3 97 B8R0.7 CC(C)OCCCCO SC-82574 [0,1,0,0,0,0|1,0,2]=4 98 B8R0.7 CCCCCCB(O)O SC-97201 [0,1,0,0,0,0|1,0,1]=3 99 B8R0.7 CCCCCCC(C)O SC-47133 [0,1,0,0,0,0|0,0,2]=3 100 B8R0.7 CCCCCOC(=O)Cl SC-18359 [0,1,0,0,0,0|1,0,0]=2 101 B8R0.7 CCCCOCC(=O)O SC-22619 [0,1,0,0,0,0|1,0,0]=2 102 B8R0.7 CCCCSCC(=N)N SC-38959 [0,1,0,0,0,0|2,0,0]=3 103 B8R0.7 CCOCCOC(=O)Cl SC-51564 [0,1,0,0,0,0|2,0,0]=3 104 B8R0.7 COCCCOC(C)=O SC-26578 [0,1,0,0,0,0|2,0,0]=3 105 B8R0.7 COCCOCC(=O)O SC-89730 [0,1,0,0,0,0|2,0,0]=3 106 B8R0.7 COCOCCC(=O)O SC-50551 [0,1,0,0,0,0|2,0,0]=3 107 B8R0.7 CSCC\C=C\C(=O)O SC-39251 [0,1,0,0,0,0|1,0,2]=4 108 B8R0.7 N=C(N)NCCCCN SC-43917 [0,1,0,0,0,0|3,0,0]=4 109 B8R0.7 N=C(N)NCCCCN SC-48324 [0,1,0,0,0,0|3,0,0]=4 110 B8R0.7 NCCCCCC(=O)O SC-10067 [0,1,0,0,0,0|1,0,0]=2 111 B8R0.7 O=C(O)CCCCCBr SC-04420 [0,1,0,0,0,0|1,0,0]=2 112 B8R0.7 O=C(O)CCCCCO SC-17400 [0,1,0,0,0,0|1,0,0]=2 113 B8R0.7 O=C(O)CCOCCBr SC-A2260 [0,1,0,0,0,0|2,0,0]=3 114 B8R0.7 O=C([O-])CCCCCO SC-82416 [0,1,0,0,0,0|1,0,0]=2 115 B8R0.7 O=C([O-])CCCCCO SC-A4948 [0,1,0,0,0,0|1,0,0]=2 116 B8R0.7 O=[N+]([O-])OCCCCO SC-13995 [0,1,0,0,0,0|3,0,0]=4 117 B8R1.2 BrCC1CCCCC1 SC-02918 [0,0,0,1,0,0|1,0,1]=3 118 B8R1.2 BrCC1CCCNC1 SC-49285 [0,0,0,1,0,0|2,0,1]=4 119 B8R1.2 BrCC1CCCOC1 SC-44714 [0,0,0,1,0,0|2,0,1]=4 120 B8R1.2 BrCC1CCOCC1 SC-00660 [0,0,0,1,0,0|2,0,1]=4 121 B8R1.2 C#CC1CCCCC1 SC-96250 [0,0,0,1,0,0|1,0,1]=3 122 B8R1.2 C#CC1CCNCC1 SC-B8105 [0,0,0,1,0,0|2,0,1]=4 123 B8R1.2 C#CC1CCOCC1 SC-96268 [0,0,0,1,0,0|2,0,1]=4 124 B8R1.2 CCC1CCCCN1 SC-45892 [0,0,0,1,0,0|1,0,1]=3 125 B8R1.2 CCC1CCNCC1 SC-61435 [0,0,0,1,0,0|2,0,1]=4 126 B8R1.2 CCC1CCNCC1 SC-61436 [0,0,0,1,0,0|2,0,1]=4 127 B8R1.2 CCC1CNCCN1 SC-35798 [0,0,0,1,0,0|2,0,1]=4 128 B8R1.2 CCC1CNCCO1 SC-61843 [0,0,0,1,0,0|1,0,2]=4 129 B8R1.2 CNC1CCCNC1 SC-52816 [0,0,0,1,0,0|3,0,0]=4 130 B8R1.2 CNC1CCCOC1 SC-35264 [0,0,0,1,0,0|3,0,0]=4 131 B8R1.2 CNC1CCNCC1 SC-04666 [0,0,0,1,0,0|3,0,0]=4 132 B8R1.2 COC1CCC=CO1 SC-A4082 [0,0,0,1,0,0|1,0,2]=4 133 B8R1.2 COC1CCC=CO1 SC-A4207 [0,0,0,1,0,0|1,0,2]=4 134 B8R1.2 COC1CCCCO1 SC-22226 [0,0,0,1,0,0|1,0,2]=4 135 B8R1.2 COC1CCCNC1 SC-15522 [0,0,0,1,0,0|3,0,0]=4 136 B8R1.2 COC1CCCNC1 SC-45634 [0,0,0,1,0,0|3,0,0]=4 137 B8R1.2 COC1CCNCC1 SC-04308 [0,0,0,1,0,0|3,0,0]=4 138 B8R1.2 COC1CCNCC1 SC-11767 [0,0,0,1,0,0|3,0,0]=4 139 B8R1.2 CSC1CCOCC1 SC-72642 [0,0,0,1,0,0|3,0,0]=4 140 B8R1.2 ClCC1CCCCN1 SC-24603 [0,0,0,1,0,0|2,0,1]=4 141 B8R1.2 ClCC1CCCCN1 SC-84984 [0,0,0,1,0,0|2,0,1]=4 142 B8R1.2 ICC1CCOCC1 SC-28261 [0,0,0,1,0,0|2,0,1]=4 143 B8R1.2 N#CC1CCCNC1 SC-26961 [0,0,0,1,0,0|2,0,1]=4 144 B8R1.2 N#CC1CCNCC1 SC-04502 [0,0,0,1,0,0|2,0,1]=4 145 B8R1.2 N#CC1CCOCC1 SC-49321 [0,0,0,1,0,0|2,0,1]=4 146 B8R1.2 NCC1CCCCC1 SC-26900 [0,0,0,1,0,0|1,0,1]=3 147 B8R1.2 NCC1CCCCO1 SC-27902 [0,0,0,1,0,0|1,0,2]=4 148 B8R1.2 NCC1CCCOC1 SC-35931 [0,0,0,1,0,0|2,0,1]=4 149 B8R1.2 NCC1CCCOC1 SC-85451 [0,0,0,1,0,0|2,0,1]=4 150 B8R1.2 NCC1CCOCC1 SC-00740 [0,0,0,1,0,0|2,0,1]=4 151 B8R1.2 NC[C@H]1CCCNC1 SC-69050 [0,0,0,1,0,0|2,0,1]=4 152 B8R1.2 NNC1CCCCC1 SC-12375 [0,0,0,1,0,0|2,0,0]=3 153 B8R1.2 NNC1CCCCC1 SC-58187 [0,0,0,1,0,0|2,0,0]=3 154 B8R1.2 NNC1CCNCC1 SC-60004 [0,0,0,1,0,0|3,0,0]=4 155 B8R1.2 NNC1CCOCC1 SC-12777 [0,0,0,1,0,0|3,0,0]=4 156 B8R1.2 NNC1CCOCC1 SC-50560 [0,0,0,1,0,0|3,0,0]=4 157 B8R1.2 NNC1CCOCC1 SC-66150 [0,0,0,1,0,0|3,0,0]=4 158 B8R1.2 NNC1CCSCC1 SC-39027 [0,0,0,1,0,0|3,0,0]=4 159 B8R1.2 NOC1CCCCO1 SC-20198 [0,0,0,1,0,0|3,0,0]=4 160 B8R1.2 O=CC1=CCCCC1 SC-49393 [0,0,0,1,0,0|0,0,2]=3 161 B8R1.2 O=CC1=COCCC1 SC-46524 [0,0,0,1,0,0|1,0,2]=4 162 B8R1.2 O=CC1CCC=CO1 SC-50417 [0,0,0,1,0,0|1,0,2]=4 163 B8R1.2 O=CC1CCCCC1 SC-02305 [0,0,0,1,0,0|0,0,0]=1 164 B8R1.2 O=CC1CCCCN1 SC-29120 [0,0,0,1,0,0|1,0,0]=2 165 B8R1.2 O=CC1CCCOC1 SC-45114 [0,0,0,1,0,0|1,0,0]=2 166 B8R1.2 O=CC1CCNCC1 SC-21173 [0,0,0,1,0,0|1,0,0]=2 167 B8R1.2 O=CC1CCNCC1 SC-A3016 [0,0,0,1,0,0|1,0,0]=2 168 B8R1.2 O=CC1CCOCC1 SC-04900 [0,0,0,1,0,0|1,0,0]=2 169 B8R1.2 O=CC1CCSCC1 SC-96130 [0,0,0,1,0,0|1,0,0]=2 170 B8R1.2 OCC1CCCCO1 SC-00052 [0,0,0,1,0,0|1,0,2]=4 171 B8R1.2 OCC1CCCOC1 SC-45301 [0,0,0,1,0,0|1,0,2]=4 172 B8R1.2 OCC1CCNCC1 SC-06048 [0,0,0,1,0,0|1,0,2]=4 173 B8R1.2 OCC1CCOCC1 SC-01198 [0,0,0,1,0,0|1,0,2]=4 174 B8R1.2 OC[C@H]1CCCCN1 SC-83108 [0,0,0,1,0,0|1,0,2]=4 175 B8R1.2 ONC1CCCCC1 SC-A3793 [0,0,0,1,0,0|1,0,1]=3 176 B8R1.2 [C-]#[N+]C1CCCCC1 SC-62261 [0,0,0,1,0,0|2,0,0]=3 177 B8R1.5 CC1CCCCC1=O SC-20428 [0,0,0,1,0,0|0,0,0]=1 178 B8R1.5 CC1CCCNC1=O SC-53234 [0,0,0,1,0,0|1,0,0]=2 179 B8R1.5 CC1CNCCC1=O SC-16093 [0,0,0,1,0,0|1,0,0]=2 180 B8R1.5 CC1CNCCC1O SC-72799 [0,0,0,1,0,0|1,0,2]=4 181 B8R1.5 CC1CNCCN1C SC-02882 [0,0,0,1,0,0|3,0,0]=4 182 B8R1.5 CN1CCC=CC1=O SC-52341 [0,0,0,1,0,0|1,0,2]=4 183 B8R1.5 CN1CCNCC1=O SC-23480 [0,0,0,1,0,0|2,0,0]=3 184 B8R1.5 C[C@@H]1CCCC[C@@H]1N SC-A5246 [0,0,0,1,0,0|1,0,1]=3 185 B8R1.5 C[C@H]1CCCC[C@@H]1N SC-A5247 [0,0,0,1,0,0|1,0,1]=3 186 B8R1.5 C[C@H]1CCCC[C@H]1N SC-A5248 [0,0,0,1,0,0|1,0,1]=3 187 B8R1.5 C[C@H]1CNCCN1C SC-52572 [0,0,0,1,0,0|3,0,0]=4 188 B8R1.5 C[C@H]1NCCNC1=O SC-05130 [0,0,0,1,0,0|2,0,0]=3 189 B8R1.5 NC1CCCCC1=O SC-22252 [0,0,0,1,0,0|1,0,0]=2 190 B8R1.5 NC1CCCCC1=O SC-45445 [0,0,0,1,0,0|1,0,0]=2 191 B8R1.5 NC1CCCCC1=O SC-84826 [0,0,0,1,0,0|1,0,0]=2 192 B8R1.5 NC1CCCCC1N SC-02306 [0,0,0,1,0,0|2,0,1]=4 193 B8R1.5 NC1CCCCC1O SC-21798 [0,0,0,1,0,0|1,0,2]=4 194 B8R1.5 NC1CCCCC1O SC-45073 [0,0,0,1,0,0|1,0,2]=4 195 B8R1.5 NC1CCCC[C@@H]1O SC-44498 [0,0,0,1,0,0|1,0,2]=4 196 B8R1.5 NC1CCCNC1=O SC-14514 [0,0,0,1,0,0|2,0,0]=3 197 B8R1.5 NC1CCONC1=O SC-25333 [0,0,0,1,0,0|3,0,0]=4 198 B8R1.5 NN1CCCCC1=O SC-21321 [0,0,0,1,0,0|2,0,0]=3 199 B8R1.5 N[C@@H]1CCCC[C@@H]1O SC-26520 [0,0,0,1,0,0|1,0,2]=4 200 B8R1.5 N[C@@H]1CCCC[C@H]1N SC-17287 [0,0,0,1,0,0|2,0,1]=4 201 B8R1.5 N[C@@H]1CCCC[C@H]1O SC-15016 [0,0,0,1,0,0|1,0,2]=4 202 B8R1.5 N[C@@H]1CCCC[C@H]1O SC-26535 [0,0,0,1,0,0|1,0,2]=4 203 B8R1.5 N[C@@H]1CCCNC1=O SC-48796 [0,0,0,1,0,0|2,0,0]=3 204 B8R1.5 N[C@H]1CCCC[C@@H]1N SC-02456 [0,0,0,1,0,0|2,0,1]=4 205 B8R1.5 N[C@H]1CCCC[C@@H]1O SC-26530 [0,0,0,1,0,0|1,0,2]=4 206 B8R1.5 N[C@H]1CCCC[C@H]1O SC-26560 [0,0,0,1,0,0|1,0,2]=4 207 B8R1.5 N[C@H]1CCCC[C@H]1O SC-35500 [0,0,0,1,0,0|1,0,2]=4 208 B8R1.5 N[C@H]1CCCC[C@H]1O SC-70916 [0,0,0,1,0,0|1,0,2]=4 209 B8R1.5 N[C@H]1CCCC[C@H]1O SC-99850 [0,0,0,1,0,0|1,0,2]=4 210 B8R1.5 N[C@H]1CCCNC1=O SC-14826 [0,0,0,1,0,0|2,0,0]=3 211 B8R1.5 N[C@H]1CCCNC1=O SC-27263 [0,0,0,1,0,0|2,0,0]=3 212 B8R1.5 O=C1CCCCC1=O SC-46435 [0,0,0,1,0,0|1,0,1]=3 213 B8R1.5 O=C1CCCCC1Br SC-86496 [0,0,0,1,0,0|1,0,0]=2 214 B8R1.5 O=C1CCCCC1Cl SC-20977 [0,0,0,1,0,0|1,0,0]=2 215 B8R1.5 O=C1CCCCC1O SC-49144 [0,0,0,1,0,0|1,0,0]=2 216 B8R1.5 O=C1CCNCC1Br SC-94331 [0,0,0,1,0,0|2,0,0]=3 217 B8R1.5 O=C1CCOCC1Br SC-33711 [0,0,0,1,0,0|2,0,0]=3 218 B8R1.5 O=C1NCCCC1O SC-14922 [0,0,0,1,0,0|2,0,0]=3 219 B8R1.5 [C@@H]1(N)CCCC[C@H]1N SC-26625 [0,0,0,1,0,0|2,0,1]=4 220 B8R1.5 [C@H]1(N)CCCC[C@H]1N SC-45540 [0,0,0,1,0,0|2,0,1]=4 221 B8R1.8 BrCCC1CCCC1 SC-51481 [0,0,0,1,0,0|1,0,1]=3 222 B8R1.8 C=CCC1CCNC1 SC-36233 [0,0,0,1,0,0|2,0,0]=3 223 B8R1.8 CNCC1CCCN1 SC-84535 [0,0,0,1,0,0|2,0,1]=4 224 B8R1.8 CNCC1CCNC1 SC-29018 [0,0,0,1,0,0|3,0,0]=4 225 B8R1.8 COCC1CCNC1 SC-A4865 [0,0,0,1,0,0|3,0,0]=4 226 B8R1.8 COC[C@@H]1CCCN1 SC-08833 [0,0,0,1,0,0|2,0,1]=4 227 B8R1.8 COC[C@H]1CCCN1 SC-06922 [0,0,0,1,0,0|2,0,1]=4 228 B8R1.8 ClCCN1CCCC1 SC-52413 [0,0,0,1,0,0|2,0,1]=4 229 B8R1.8 ClCCN1CCCC1 SC-57931 [0,0,0,1,0,0|2,0,1]=4 230 B8R1.8 ICCC1CCCC1 SC-A5886 [0,0,0,1,0,0|1,0,1]=3 231 B8R1.8 N#CCC1CCCC1 SC-40258 [0,0,0,1,0,0|1,0,1]=3 232 B8R1.8 N#CCN1CCCC1 SC-68917 [0,0,0,1,0,0|2,0,1]=4 233 B8R1.8 NCCC1CCCC1 SC-44893 [0,0,0,1,0,0|1,0,1]=3 234 B8R1.8 NCCC1CCCC1 SC-A3050 [0,0,0,1,0,0|1,0,1]=3 235 B8R1.8 NCCN1CCCC1 SC-27229 [0,0,0,1,0,0|2,0,1]=4 236 B8R1.8 NNCC1CCCC1 SC-12831 [0,0,0,1,0,0|2,0,0]=3 237 B8R1.8 NNCC1CCCO1 SC-42789 [0,0,0,1,0,0|3,0,0]=4 238 B8R1.8 NNCC1CCCO1 SC-48294 [0,0,0,1,0,0|3,0,0]=4 239 B8R1.8 NNCC1CCOC1 SC-53935 [0,0,0,1,0,0|3,0,0]=4 240 B8R1.8 O=C=NC1CCCC1 SC-27896 [0,0,0,1,0,0|1,0,1]=3 241 B8R1.8 O=CCC1CCCC1 SC-40655 [0,0,0,1,0,0|0,0,0]=1 242 B8R1.8 OCCC1CCCC1 SC-41116 [0,0,0,1,0,0|0,0,2]=3 243 B8R1.8 OCCC1CCCN1 SC-48011 [0,0,0,1,0,0|1,0,2]=4 244 B8R1.8 OCCC1CCNC1 SC-48001 [0,0,0,1,0,0|1,0,2]=4 245 B8R1.8 OCCC1CCNC1 SC-83461 [0,0,0,1,0,0|1,0,2]=4 246 B8R1.10 C=CCOC1CNC1 SC-36666 [0,0,0,1,0,0|3,0,0]=4 247 B8R1.10 CCCOC1CNC1 SC-29137 [0,0,0,1,0,0|3,0,0]=4 248 B8R1.10 CCCOC1CNC1 SC-36647 [0,0,0,1,0,0|3,0,0]=4 249 B8R1.10 OCCCC1COC1 SC-72817 [0,0,0,1,0,0|1,0,2]=4 250 B8R1.10 OCCCN1CCC1 SC-13062 [0,0,0,1,0,0|1,0,2]=4 251 B8R1.10 OCCOC1CCC1 SC-49823 [0,0,0,1,0,0|1,0,2]=4 252 B8R1.11 C=CN1CCCC1=O SC-47246 [0,0,0,1,0,0|1,0,2]=4 253 B8R1.11 CC1CCCC1NN SC-41421 [0,0,0,1,0,0|2,0,0]=3 254 B8R1.11 CC1SCCC1NN SC-41748 [0,0,0,1,0,0|3,0,0]=4 255 B8R1.11 CN1CCCC1CO SC-45186 [0,0,0,1,0,0|1,0,2]=4 256 B8R1.11 CN1CCC[C@@H]1CO SC-45385 [0,0,0,1,0,0|1,0,2]=4 257 B8R1.11 CN1CCC[C@H]1CO SC-03638 [0,0,0,1,0,0|1,0,2]=4 258 B8R1.11 N#CC1CCCC1=O SC-46105 [0,0,0,1,0,0|1,0,1]=3 259 B8R1.11 N[C@H]1CCC[C@H]1CO SC-20351 [0,0,0,1,0,0|1,0,2]=4 260 B8R1.11 O=C1CCCN1CBr SC-45741 [0,0,0,1,0,0|2,0,0]=3 261 B8R1.11 O=C1CCCN1CCl SC-61208 [0,0,0,1,0,0|2,0,0]=3 262 B8R1.22 CC1CCNCCN1 SC-52803 [0,0,0,1,0,0|2,0,1]=4 263 B8R1.22 CC1OCCCCO1 SC-26173 [0,0,0,1,0,0|1,0,2]=4 264 B8R1.22 CN1CCCNCC1 SC-19624 [0,0,0,1,0,0|3,0,0]=4 265 B8R1.22 NC1CCCCCC1 SC-51775 [0,0,0,1,0,0|1,0,1]=3 266 B8R1.22 NC1CCCCNC1 SC-49484 [0,0,0,1,0,0|2,0,1]=4 267 B8R1.22 NC1CCCCNC1 SC-A3641 [0,0,0,1,0,0|2,0,1]=4 268 B8R1.22 NC1CCCNCC1 SC-94792 [0,0,0,1,0,0|2,0,1]=4 269 B8R1.22 O=C1C=CCCCC1 SC-99582 [0,0,0,1,0,0|0,0,2]=3 270 B8R1.22 O=C1C=CCCCN1 SC-50475 [0,0,0,1,0,0|1,0,2]=4 271 B8R1.22 O=C1CCCNCC1 SC-20974 [0,0,0,1,0,0|1,0,0]=2 272 B8R1.22 O=C1CCNCCN1 SC-05951 [0,0,0,1,0,0|2,0,0]=3 273 B8R1.22 O=C1CCNCCN1 SC-21923 [0,0,0,1,0,0|2,0,0]=3 274 B8R1.22 O=C1CNCCCN1 SC-21981 [0,0,0,1,0,0|2,0,0]=3 275 B8R1.22 OC1CCCNCC1 SC-83100 [0,0,0,1,0,0|1,0,2]=4 276 B8R1.22 S=C1NCCCCN1 SC-67011 [0,0,0,1,0,0|2,1,0]=4 277 B8R1.49 C1=CCCC=CCC1 SC-52202 [0,0,0,1,0,0|1,0,2]=4 278 B8R1.49 C1=CCCC=CCC1 SC-53604 [0,0,0,1,0,0|1,0,2]=4 279 B8R1.49 C1=CCCC=CCC1 SC-53877 [0,0,0,1,0,0|1,0,2]=4 280 B8R1.49 C1=CCCC=CCC1 SC-53881 [0,0,0,1,0,0|1,0,2]=4 281 B8R1.49 C1=CCCC=CCC1 SC-53947 [0,0,0,1,0,0|1,0,2]=4 282 B8R1.49 C1=CCCC=CCC1 SC-66783 [0,0,0,1,0,0|1,0,2]=4 283 B8R1.49 C1=CCCC=CCC1 SC-67683 [0,0,0,1,0,0|1,0,2]=4 284 B8R1.49 C1=CCCC=CCC1 SC-67722 [0,0,0,1,0,0|1,0,2]=4 285 B8R1.49 C1=CCCC=CCC1 SC-68546 [0,0,0,1,0,0|1,0,2]=4 286 B8R1.49 C1=CCCC=CCC1 SC-73756 [0,0,0,1,0,0|1,0,2]=4 287 B8R1.49 C1=CCCC=CCC1 SC-73757 [0,0,0,1,0,0|1,0,2]=4 288 B8R1.49 C1=CCCCCCC1 SC-67725 [0,0,0,1,0,0|1,0,0]=2 289 B8R1.49 C1=CCCCCCC1 SC-67879 [0,0,0,1,0,0|1,0,0]=2 290 B5R0.2 C=CCCCBr SC-47340 [2,0,0,0,0,0|1,0,1]=4 291 B5R0.2 C=CCCCN SC-28944 [2,0,0,0,0,0|1,0,1]=4 292 B5R0.2 C=CCCCN SC-91892 [2,0,0,0,0,0|1,0,1]=4 293 B5R0.2 C=CCCCO SC-78424 [2,0,0,0,0,0|1,0,1]=4 294 B5R0.2 C=COCCC SC-13613 [2,0,0,0,0,0|1,0,1]=4 295 B5R0.2 CC#CCC=O SC-89818 [2,0,0,0,0,0|0,0,2]=4 296 B5R0.2 CCCCNN SC-68008 [2,0,0,0,0,0|2,0,0]=4 297 B5R0.2 CCCNCC SC-02236 [2,0,0,0,0,0|1,0,0]=3 298 B5R0.2 CCSCCBr SC-16797 [2,0,0,0,0,0|2,0,0]=4 299 B5R0.2 CCSCCCl SC-43710 [2,0,0,0,0,0|2,0,0]=4 300 B5R0.2 CCSCCN SC-65401 [2,0,0,0,0,0|2,0,0]=4 301 B5R0.2 CNCCCCl SC-96339 [2,0,0,0,0,0|2,0,0]=4 302 B5R0.2 CNCCCO SC-94106 [2,0,0,0,0,0|1,0,1]=4 303 B5R0.2 CNCCNC SC-19090 [2,0,0,0,0,0|2,0,0]=4 304 B5R0.2 CNCCSC SC-74374 [2,0,0,0,0,0|2,0,0]=4 305 B5R0.2 CNCCSC SC-83575 [2,0,0,0,0,0|2,0,0]=4 306 B5R0.2 COCCC=O SC-85357 [2,0,0,0,0,0|1,0,0]=3 307 B5R0.2 COCCCBr SC-20920 [2,0,0,0,0,0|2,0,0]=4 308 B5R0.2 COCCOC SC-16461 [2,0,0,0,0,0|2,0,0]=4 309 B5R0.2 FCCCCBr SC-43880 [2,0,0,0,0,0|2,0,0]=4 310 B5R0.2 NCCCCBr SC-39791 [2,0,0,0,0,0|2,0,0]=4 311 B5R0.2 NCCCCCl SC-14246 [2,0,0,0,0,0|2,0,0]=4 312 B5R0.2 NCCCCF SC-25718 [2,0,0,0,0,0|2,0,0]=4 313 B5R0.2 NCCCCN SC-20919 [2,0,0,0,0,0|2,0,0]=4 314 B5R0.2 NCCCCO SC-48186 [2,0,0,0,0,0|1,0,1]=4 315 B5R0.2 O=CCCC=O SC-13455 [2,0,0,0,0,0|1,0,1]=4 316 B5R0.2 O=CCCCBr SC-69595 [2,0,0,0,0,0|1,0,0]=3 317 B5R0.2 OCCCCBr SC-12645 [2,0,0,0,0,0|1,0,1]=4 318 B5R0.2 OCCCCCl SC-23109 [2,0,0,0,0,0|1,0,1]=4 319 B7R0.3 C=CCCC(O)CN SC-34956 [1,1,0,0,0,0|1,0,1]=4 320 B7R0.3 CCOCC(O)CO SC-90419 [1,1,0,0,0,0|1,0,1]=4 321 B7R0.3 COC(=O)CCC=O SC-47529 [1,1,0,0,0,0|1,0,1]=4 322 B7R0.3 CSCC[C@H](N)CO SC-08986 [1,1,0,0,0,0|1,0,1]=4 323 B7R0.4 C#CCCCC(=O)O SC-73017 [1,1,0,0,0,0|0,0,2]=4 324 B7R0.4 C=C(C)CCCCBr SC-31361 [1,1,0,0,0,0|1,0,1]=4 325 B7R0.4 C=C(C)CCCCO SC-32201 [1,1,0,0,0,0|0,0,2]=4 326 B7R0.4 C=CCCCC(=O)O SC-93956 [1,1,0,0,0,0|0,0,2]=4 327 B7R0.4 CC(C)CCON=O SC-22768 [1,1,0,0,0,0|2,0,0]=4 328 B7R0.4 CCCNCC(=O)O SC-97541 [1,1,0,0,0,0|1,0,0]=3 329 B7R0.4 CCCSCC(=O)O SC-45283 [1,1,0,0,0,0|1,0,0]=3 330 B7R0.4 CCC\C=C\C(=O)O SC-39942 [1,1,0,0,0,0|0,0,2]=4 331 B7R0.4 CCOCCC(=N)N SC-40468 [1,1,0,0,0,0|2,0,0]=4 332 B7R0.4 CN(C)CCCCBr SC-48986 [1,1,0,0,0,0|2,0,0]=4 333 B7R0.4 CN(C)CCCCN SC-54232 [1,1,0,0,0,0|2,0,0]=4 334 B7R0.4 CNCCCC(=O)O SC-49793 [1,1,0,0,0,0|1,0,0]=3 335 B7R0.4 CNCCCC(=O)O SC-A2900 [1,1,0,0,0,0|1,0,0]=3 336 B7R0.4 COCCCC(=O)O SC-51378 [1,1,0,0,0,0|1,0,0]=3 337 B7R0.4 COCCNC(N)=O SC-62189 [1,1,0,0,0,0|2,0,0]=4 338 B7R0.4 C\C=C\CCC(=O)O SC-21245 [1,1,0,0,0,0|0,0,2]=4 339 B7R0.4 N=C(N)CCCCCl SC-55396 [1,1,0,0,0,0|2,0,0]=4 340 B7R0.4 NC(=O)CCCCBr SC-98143 [1,1,0,0,0,0|1,0,0]=3 341 B7R0.4 NCCCCC(=O)O SC-10120 [1,1,0,0,0,0|1,0,0]=3 342 B7R0.4 NCCCCC(=O)O SC-92391 [1,1,0,0,0,0|1,0,0]=3 343 B7R0.4 NCCCCC(N)=O SC-94858 [1,1,0,0,0,0|1,0,0]=3 344 B7R0.4 NCCCCC(N)=O SC-A4262 [1,1,0,0,0,0|1,0,0]=3 345 B7R0.4 NCCNCC(=O)O SC-21750 [1,1,0,0,0,0|2,0,0]=4 346 B7R0.4 O=C(Cl)CCCCBr SC-13447 [1,1,0,0,0,0|1,0,0]=3 347 B7R0.4 O=C(Cl)CCCCCl SC-16009 [1,1,0,0,0,0|1,0,0]=3 348 B7R0.4 O=C(O)CCCCBr SC-02338 [1,1,0,0,0,0|1,0,0]=3 349 B7R0.4 O=C([O-])COCCO SC-A2671 [1,1,0,0,0,0|2,0,0]=4 350 B7R0.7 CC(CCO)CCO SC-15062 [1,1,0,0,0,0|1,0,1]=4 351 B7R0.7 CCCC(C)CNN SC-42603 [1,1,0,0,0,0|2,0,0]=4 352 B7R0.7 CCCN(C)CCC SC-85868 [1,1,0,0,0,0|1,0,1]=4 353 B7R0.7 CCC[C@H](N)CCO SC-A3499 [1,1,0,0,0,0|0,0,1]=3 354 B7R0.7 CCOC(=O)CC=O SC-14726 [1,1,0,0,0,0|1,0,1]=4 355 B9R0.4 CCCC[C@@H](C)CC(=O)O SC-52448 [0,2,0,0,0,0|0,0,0]=2 356 B9R0.4 CCCOC(=O)CC(C)=O SC-65215 [0,2,0,0,0,0|1,0,1]=4 357 B9R0.18 CCCCC(=O)CCCC SC-89430 [0,2,0,0,0,0|1,0,1]=4 358 B9R0.40 CCCCC(CC)CNN SC-42550 [0,2,0,0,0,0|2,0,0]=4 359 B9R0.40 CCCCC(CC)CNN SC-58978 [0,2,0,0,0,0|2,0,0]=4 360 B9R0.48 CCOC(=O)CCC(=O)O SC-48671 [0,2,0,0,0,0|1,0,1]=4 361 B9R0.2 C=CCCCOCC(=O)O SC-34349 [0,2,0,0,0,0|0,0,2]=4 362 B9R0.2 CCCCCCCC(=N)N SC-40677 [0,2,0,0,0,0|1,0,0]=3 363 B9R0.2 CCCCCCCC(=O)O SC-22580 [0,2,0,0,0,0|0,0,0]=2 364 B9R0.2 CCCCCCCC(=O)O SC-27437 [0,2,0,0,0,0|0,0,0]=2 365 B9R0.2 CCCCCCCC(=O)[O-] SC-18483 [0,2,0,0,0,0|0,0,0]=2 366 B9R0.2 CCCCCCCC(=O)[O-] SC-26042 [0,2,0,0,0,0|0,0,0]=2 367 B9R0.2 CCCCCCCC(=O)[O-] SC-52189 [0,2,0,0,0,0|0,0,0]=2 368 B9R0.2 CCCCCCCC(=O)[O-] SC-79959 [0,2,0,0,0,0|0,0,0]=2 369 B9R0.2 CCCCCCOC(=O)Cl SC-53671 [0,2,0,0,0,0|0,0,0]=2 370 B9R0.2 CCCCOCCC(=N)N SC-42275 [0,2,0,0,0,0|1,0,0]=3 371 B9R0.2 N=C(N)CCCCCCCl SC-38531 [0,2,0,0,0,0|1,0,0]=3 372 B9R0.2 NCCCCCCC(=O)O SC-10087 [0,2,0,0,0,0|0,0,0]=2 373 B9R0.2 NCCCCCCC(=O)O SC-52825 [0,2,0,0,0,0|0,0,0]=2 374 B9R0.2 O=C(O)CCCCCCBr SC-03639 [0,2,0,0,0,0|0,0,0]=2 375 B9R0.2 O=C(O)CCCCCCO SC-53796 [0,2,0,0,0,0|0,0,0]=2 376 B9R0.45 BrCCCCCCCCBr SC-44358 [0,2,0,0,0,0|1,0,1]=4 377 B9R0.45 C#CCCCCCCCC SC-65396 [0,2,0,0,0,0|1,0,1]=4 378 B9R0.45 C#CCCCCCCCO SC-71987 [0,2,0,0,0,0|0,0,2]=4 379 B9R0.45 CCCCC#CCCCCl SC-62360 [0,2,0,0,0,0|1,0,1]=4 380 B9R0.45 CCCCCCCCCBr SC-65114 [0,2,0,0,0,0|1,0,1]=4 381 B9R0.45 CCCCCCCCNC SC-62266 [0,2,0,0,0,0|1,0,1]=4 382 B9R0.45 CCCCCCCNCC SC-28603 [0,2,0,0,0,0|1,0,1]=4 383 B9R0.45 NCCCCCCCCBr SC-69472 [0,2,0,0,0,0|1,0,1]=4 384 B9R0.45 NCCCCCCCCO SC-50444 [0,2,0,0,0,0|0,0,2]=4 385 B9R0.45 NCCCCNCCCN SC-69371 [0,2,0,0,0,0|1,0,1]=4 386 B9R0.45 OCCCCCCCCBr SC-13899 [0,2,0,0,0,0|0,0,2]=4 387 B9R0.46 COC(=O)CCCCC=O SC-92554 [0,2,0,0,0,0|0,0,1]=3 388 B9R0.46 COC(=O)CCCCCBr SC-02787 [0,2,0,0,0,0|1,0,0]=3 389 B9R0.46 COC(=O)CCCCCN SC-B3833 [0,2,0,0,0,0|1,0,0]=3 390 B9R0.1 CC(C)=CCCC(C)C=O SC-79180 [0,2,0,0,0,0|0,0,2]=4 391 B9R0.1 CC(C)CCCC(C)NN SC-38599 [0,2,0,0,0,0|2,0,0]=4 392 B9R0.1 COC(=O)CCCC(=O)O SC-85837 [0,2,0,0,0,0|1,0,1]=4 393 B9R0.1 COC(=O)CCCC(C)=O SC-A5811 [0,2,0,0,0,0|1,0,1]=4 394 B9R0.47 C=CCCC[C@@H](C)C(=O)O SC-31827 [0,2,0,0,0,0|0,0,2]=4 395 B9R0.47 C=CCCC[C@H](C)C(=O)O SC-31058 [0,2,0,0,0,0|0,0,2]=4 396 B9R0.47 CCCCCC(N)C(=O)O SC-10084 [0,2,0,0,0,0|0,0,0]=2 397 B9R0.47 CCCCCC(N)C(=O)O SC-10085 [0,2,0,0,0,0|0,0,0]=2 398 B9R0.47 CCCCC[C@@H](N)C(=O)O SC-10086 [0,2,0,0,0,0|0,0,0]=2 399 B9R0.47 CCSCCC(N)C(=O)O SC-10254 [0,2,0,0,0,0|1,0,0]=3 400 B9R0.47 CC[Se]CCC(N)C(=O)O SC-69852 [0,2,0,0,0,0|1,0,0]=3 401 B9R0.47 COCCC[C@@H](N)C(=O)O SC-49289 [0,2,0,0,0,0|1,0,0]=3 402 B9R0.47 CSCCC[C@@H](N)C(=O)O SC-49287 [0,2,0,0,0,0|1,0,0]=3 403 B9R0.47 NCCCCC(N)C(=O)O SC-06113 [0,2,0,0,0,0|1,0,0]=3 404 B9R0.47 NCCCCC(N)C(=O)O SC-09671 [0,2,0,0,0,0|1,0,0]=3 405 B9R0.47 NCCCCC(N)C(=O)O SC-19760 [0,2,0,0,0,0|1,0,0]=3 406 B9R0.47 NCCCCC(N)C(=O)O SC-20502 [0,2,0,0,0,0|1,0,0]=3 407 B9R0.47 NCCCC[C@H](N)C(=O)O SC-09670 [0,2,0,0,0,0|1,0,0]=3 408 B9R0.47 NCCCC[C@H](N)C(=O)O SC-22201 [0,2,0,0,0,0|1,0,0]=3 409 B9R0.47 [C@@H](N)(CCCCN)C(=O)O SC-07335 [0,2,0,0,0,0|1,0,0]=3 410 B9R0.50 CCCCCC(CO)CO SC-70663 [0,2,0,0,0,0|0,0,2]=4 411 B9R0.38 CC(C)(C)CCCCC=O SC-77139 [0,2,0,0,0,0|0,0,0]=2 412 B9R0.38 CCCCCCP(=O)(O)O SC-22196 [0,2,0,0,0,0|1,0,0]=3 413 B9R0.38 CCCCCCS(=O)(=O)[O-] SC-45417 [0,2,0,0,0,0|1,0,0]=3 414 B9R0.55 CC(=O)NCCCC(=O)O SC-46117 [0,2,0,0,0,0|1,0,1]=4 415 B9R0.55 CC(C)CCCCC(=O)O SC-47475 [0,2,0,0,0,0|0,0,0]=2 416 B9R0.55 CN(C)CCNCC(=O)O SC-48750 [0,2,0,0,0,0|2,0,0]=4 417 B9R0.55 O=C(Cl)CCCCC(=O)Cl SC-78887 [0,2,0,0,0,0|1,0,1]=4 418 B7R1.1 BrCC1CCCC1 SC-04017 [1,0,0,1,0,0|1,0,0]=3 419 B7R1.1 BrCC1CCOC1 SC-13106 [1,0,0,1,0,0|2,0,0]=4 420 B7R1.1 C#CC1CCCC1 SC-52548 [1,0,0,1,0,0|0,0,2]=4 421 B7R1.1 C#CC1CCCC1 SC-82441 [1,0,0,1,0,0|0,0,2]=4 422 B7R1.1 CCC1CCCN1 SC-29181 [1,0,0,1,0,0|1,0,0]=3 423 B7R1.1 CNC1CCCC1 SC-52894 [1,0,0,1,0,0|1,0,1]=4 424 B7R1.1 CNC1CCCC1 SC-A3381 [1,0,0,1,0,0|1,0,1]=4 425 B7R1.1 ClCC1CCCC1 SC-52756 [1,0,0,1,0,0|1,0,0]=3 426 B7R1.1 ICC1CCCC1 SC-19498 [1,0,0,1,0,0|1,0,0]=3 427 B7R1.1 ICC1CCOC1 SC-26534 [1,0,0,1,0,0|2,0,0]=4 428 B7R1.1 N#CC1CCCC1 SC-84423 [1,0,0,1,0,0|1,0,1]=4 429 B7R1.1 NCC1CCCC1 SC-22285 [1,0,0,1,0,0|1,0,0]=3 430 B7R1.1 NCC1CCCC1 SC-25234 [1,0,0,1,0,0|1,0,0]=3 431 B7R1.1 NCC1CCCN1 SC-98158 [1,0,0,1,0,0|2,0,0]=4 432 B7R1.1 NCC1CCOC1 SC-12415 [1,0,0,1,0,0|2,0,0]=4 433 B7R1.1 NCC1CCOC1 SC-35383 [1,0,0,1,0,0|2,0,0]=4 434 B7R1.1 NC[C@@H]1CCCO1 SC-28608 [1,0,0,1,0,0|1,0,1]=4 435 B7R1.1 NC[C@H]1CCCO1 SC-06512 [1,0,0,1,0,0|1,0,1]=4 436 B7R1.1 NNC1CCCC1 SC-12771 [1,0,0,1,0,0|2,0,0]=4 437 B7R1.1 NNC1CCCC1 SC-62645 [1,0,0,1,0,0|2,0,0]=4 438 B7R1.1 O=CC1CCCC1 SC-21778 [1,0,0,1,0,0|0,0,0]=2 439 B7R1.1 O=CC1CCCC1 SC-44728 [1,0,0,1,0,0|0,0,0]=2 440 B7R1.1 O=CC1CCNC1 SC-85271 [1,0,0,1,0,0|1,0,0]=3 441 B7R1.1 O=CC1CCOC1 SC-29081 [1,0,0,1,0,0|1,0,0]=3 442 B7R1.1 OCC1CCCC1 SC-03842 [1,0,0,1,0,0|0,0,1]=3 443 B7R1.1 OCC1CCCN1 SC-12006 [1,0,0,1,0,0|1,0,1]=4 444 B7R1.1 OCC1CCCO1 SC-94849 [1,0,0,1,0,0|1,0,1]=4 445 B7R1.1 OCC1CCNC1 SC-19805 [1,0,0,1,0,0|1,0,1]=4 446 B7R1.1 OCC1CCOC1 SC-21250 [1,0,0,1,0,0|1,0,1]=4 447 B7R1.1 OC[C@@H]1CCCN1 SC-48321 [1,0,0,1,0,0|1,0,1]=4 448 B7R1.1 OC[C@@H]1CCCO1 SC-20330 [1,0,0,1,0,0|1,0,1]=4 449 B7R1.1 OC[C@@H]1CCCO1 SC-68774 [1,0,0,1,0,0|1,0,1]=4 450 B7R1.1 OC[C@@H]1CCNC1 SC-48002 [1,0,0,1,0,0|1,0,1]=4 451 B7R1.1 OC[C@H]1CCNC1 SC-47992 [1,0,0,1,0,0|1,0,1]=4 452 B7R1.3 BrC1=CCCCC1 SC-69986 [1,0,0,1,0,0|1,0,1]=4 453 B7R1.3 BrC1CCCNC1 SC-24227 [1,0,0,1,0,0|2,0,0]=4 454 B7R1.3 BrC1CCCOC1 SC-43426 [1,0,0,1,0,0|2,0,0]=4 455 B7R1.3 BrC1CCNCC1 SC-05213 [1,0,0,1,0,0|2,0,0]=4 456 B7R1.3 BrC1CCNCC1 SC-48705 [1,0,0,1,0,0|2,0,0]=4 457 B7R1.3 BrC1CCOCC1 SC-27394 [1,0,0,1,0,0|2,0,0]=4 458 B7R1.3 C=C1CCNCC1 SC-88353 [1,0,0,1,0,0|1,0,1]=4 459 B7R1.3 C=C1CCOCC1 SC-88950 [1,0,0,1,0,0|1,0,1]=4 460 B7R1.3 CC1=CCCCC1 SC-99243 [1,0,0,1,0,0|0,0,1]=3 461 B7R1.3 CC1=CCCNC1 SC-82898 [1,0,0,1,0,0|1,0,1]=4 462 B7R1.3 CC1=CCNCC1 SC-B8899 [1,0,0,1,0,0|1,0,1]=4 463 B7R1.3 CC1CCCCC1 SC-79075 [1,0,0,1,0,0|0,0,1]=3 464 B7R1.3 CC1CNCCO1 SC-49158 [1,0,0,1,0,0|1,0,1]=4 465 B7R1.3 CC1CNCCO1 SC-82780 [1,0,0,1,0,0|1,0,1]=4 466 B7R1.3 CC1CNCCO1 SC-A3535 [1,0,0,1,0,0|1,0,1]=4 467 B7R1.3 CC1COCCN1 SC-49161 [1,0,0,1,0,0|2,0,0]=4 468 B7R1.3 CC1OCCCO1 SC-49961 [1,0,0,1,0,0|1,0,1]=4 469 B7R1.3 C[C@@H]1CNCCO1 SC-43965 [1,0,0,1,0,0|1,0,1]=4 470 B7R1.3 C[C@@H]1CNCCO1 SC-88816 [1,0,0,1,0,0|1,0,1]=4 471 B7R1.3 C[C@@H]1COCCN1 SC-53986 [1,0,0,1,0,0|2,0,0]=4 472 B7R1.3 C[C@@H]1COCCN1 SC-53994 [1,0,0,1,0,0|2,0,0]=4 473 B7R1.3 C[C@H]1CCCCN1 SC-77306 [1,0,0,1,0,0|1,0,0]=3 474 B7R1.3 C[C@H]1CCCNC1 SC-99949 [1,0,0,1,0,0|1,0,1]=4 475 B7R1.3 C[C@H]1CCCNC1 SC-A5624 [1,0,0,1,0,0|1,0,1]=4 476 B7R1.3 C[C@H]1CNCCO1 SC-44479 [1,0,0,1,0,0|1,0,1]=4 477 B7R1.3 C[C@H]1COCCN1 SC-21564 [1,0,0,1,0,0|2,0,0]=4 478 B7R1.3 C[C@H]1COCCN1 SC-69967 [1,0,0,1,0,0|2,0,0]=4 479 B7R1.3 C[SiH]1CCCCO1 SC-91060 [1,0,0,1,0,0|0,1,1]=4 480 B7R1.3 ClC1CCNCC1 SC-24517 [1,0,0,1,0,0|2,0,0]=4 481 B7R1.3 FC1CCCCC1 SC-09547 [1,0,0,1,0,0|1,0,0]=3 482 B7R1.3 FC1CCCNC1 SC-21265 [1,0,0,1,0,0|2,0,0]=4 483 B7R1.3 FC1CCNCC1 SC-43923 [1,0,0,1,0,0|2,0,0]=4 484 B7R1.3 FC1CCNCC1 SC-51343 [1,0,0,1,0,0|2,0,0]=4 485 B7R1.3 IC1CCOCC1 SC-98886 [1,0,0,1,0,0|2,0,0]=4 486 B7R1.3 NC1CCCNC1 SC-54118 [1,0,0,1,0,0|2,0,0]=4 487 B7R1.3 NC1CCCNC1 SC-77469 [1,0,0,1,0,0|2,0,0]=4 488 B7R1.3 NC1CCCOC1 SC-35742 [1,0,0,1,0,0|2,0,0]=4 489 B7R1.3 NC1CCCOC1 SC-49332 [1,0,0,1,0,0|2,0,0]=4 490 B7R1.3 NC1CCOCC1 SC-03529 [1,0,0,1,0,0|2,0,0]=4 491 B7R1.3 NC1CCOCC1 SC-04006 [1,0,0,1,0,0|2,0,0]=4 492 B7R1.3 NC1CCSCC1 SC-35455 [1,0,0,1,0,0|2,0,0]=4 493 B7R1.3 NC1CCSCC1 SC-49681 [1,0,0,1,0,0|2,0,0]=4 494 B7R1.3 NN1CCCCC1 SC-17998 [1,0,0,1,0,0|2,0,0]=4 495 B7R1.3 N[C@@H]1CCCNC1 SC-03568 [1,0,0,1,0,0|2,0,0]=4 496 B7R1.3 N[C@@H]1CCCOC1 SC-71639 [1,0,0,1,0,0|2,0,0]=4 497 B7R1.3 N[C@@H]1CCCOC1 SC-96408 [1,0,0,1,0,0|2,0,0]=4 498 B7R1.3 N[C@H]1CCCNC1 SC-25042 [1,0,0,1,0,0|2,0,0]=4 499 B7R1.3 N[C@H]1CCCOC1 SC-94110 [1,0,0,1,0,0|2,0,0]=4 500 B7R1.3 O=C1CCCCN1 SC-16274 [1,0,0,1,0,0|1,0,0]=3 501 B7R1.3 O=C1CCCCO1 SC-65111 [1,0,0,1,0,0|1,0,0]=3 502 B7R1.3 O=C1CCCNC1 SC-29391 [1,0,0,1,0,0|1,0,0]=3 503 B7R1.3 O=C1CCCNC1 SC-48015 [1,0,0,1,0,0|1,0,0]=3 504 B7R1.3 O=C1CCCOC1 SC-14944 [1,0,0,1,0,0|1,0,0]=3 505 B7R1.3 O=C1CCNCC1 SC-04379 [1,0,0,1,0,0|1,0,0]=3 506 B7R1.3 O=C1CCNCC1 SC-19352 [1,0,0,1,0,0|1,0,0]=3 507 B7R1.3 O=C1CCOCC1 SC-03251 [1,0,0,1,0,0|1,0,0]=3 508 B7R1.3 O=C1CCSCC1 SC-19697 [1,0,0,1,0,0|1,0,0]=3 509 B7R1.3 O=C1CNCCN1 SC-05365 [1,0,0,1,0,0|2,0,0]=4 510 B7R1.3 O=C1CNCCO1 SC-84883 [1,0,0,1,0,0|2,0,0]=4 511 B7R1.3 O=C1COCCN1 SC-24222 [1,0,0,1,0,0|2,0,0]=4 512 B7R1.3 O=C1CSCCN1 SC-28581 [1,0,0,1,0,0|2,0,0]=4 513 B7R1.3 OC1C=CCCC1 SC-21514 [1,0,0,1,0,0|1,0,1]=4 514 B7R1.3 OC1CCCCO1 SC-84303 [1,0,0,1,0,0|1,0,1]=4 515 B7R1.3 OC1CCCNC1 SC-47771 [1,0,0,1,0,0|1,0,1]=4 516 B7R1.3 OC1CCCOC1 SC-35801 [1,0,0,1,0,0|1,0,1]=4 517 B7R1.3 OC1CCNCC1 SC-05165 [1,0,0,1,0,0|1,0,1]=4 518 B7R1.3 OC1CCNCC1 SC-45566 [1,0,0,1,0,0|1,0,1]=4 519 B7R1.3 OC1CCOCC1 SC-02372 [1,0,0,1,0,0|1,0,1]=4 520 B7R1.3 OC1CCSCC1 SC-35917 [1,0,0,1,0,0|1,0,1]=4 521 B7R1.3 ON1CCCCC1 SC-13334 [1,0,0,1,0,0|1,0,1]=4 522 B7R1.3 O[C@@H]1CCCOC1 SC-19794 [1,0,0,1,0,0|1,0,1]=4 523 B7R1.3 O[C@H]1CCCOC1 SC-48375 [1,0,0,1,0,0|1,0,1]=4 524 B7R1.3 SC1CCOCC1 SC-47759 [1,0,0,1,0,0|1,1,0]=4 525 B7R1.3 [Mg+]C1CCCCC1 SC-69022 [1,0,0,1,0,0|1,0,0]=3 526 B7R1.4 CC1=CCCC1=O SC-15856 [1,0,0,1,0,0|0,0,2]=4 527 B7R1.4 CC1CCCC1=O SC-89605 [1,0,0,1,0,0|0,0,0]=2 528 B7R1.4 CC1CCCC1=S SC-42934 [1,0,0,1,0,0|0,1,0]=3 529 B7R1.4 CC1CCCC1N SC-71052 [1,0,0,1,0,0|1,0,0]=3 530 B7R1.4 CC1CCNC1=O SC-21672 [1,0,0,1,0,0|1,0,0]=3 531 B7R1.4 CC1CCOC1=O SC-20996 [1,0,0,1,0,0|1,0,0]=3 532 B7R1.4 CC1SCCC1=S SC-42506 [1,0,0,1,0,0|1,1,0]=4 533 B7R1.4 CN1CCNC1=O SC-89793 [1,0,0,1,0,0|2,0,0]=4 534 B7R1.4 C[C@H]1CNC[C@@H]1O SC-A5707 [1,0,0,1,0,0|1,0,1]=4 535 B7R1.4 NC1CCCC1N SC-66238 [1,0,0,1,0,0|2,0,0]=4 536 B7R1.4 NC1CCCC1O SC-21764 [1,0,0,1,0,0|1,0,1]=4 537 B7R1.4 NC1CCNC1=O SC-13910 [1,0,0,1,0,0|2,0,0]=4 538 B7R1.4 NC1CCNC1=O SC-48795 [1,0,0,1,0,0|2,0,0]=4 539 B7R1.4 NC1CCNC1=O SC-51089 [1,0,0,1,0,0|2,0,0]=4 540 B7R1.4 NC1CCNC1=O SC-53072 [1,0,0,1,0,0|2,0,0]=4 541 B7R1.4 N[C@@H]1CCC[C@@H]1O SC-27358 [1,0,0,1,0,0|1,0,1]=4 542 B7R1.4 N[C@@H]1CCNC1=O SC-65959 [1,0,0,1,0,0|2,0,0]=4 543 B7R1.4 N[C@@H]1CCNC1=O SC-A2225 [1,0,0,1,0,0|2,0,0]=4 544 B7R1.4 N[C@@H]1CCOC1=O SC-28003 [1,0,0,1,0,0|2,0,0]=4 545 B7R1.4 N[C@H]1CCC[C@@H]1O SC-27686 [1,0,0,1,0,0|1,0,1]=4 546 B7R1.4 N[C@H]1CCC[C@H]1N SC-83490 [1,0,0,1,0,0|2,0,0]=4 547 B7R1.4 N[C@H]1CCNC1=O SC-96457 [1,0,0,1,0,0|2,0,0]=4 548 B7R1.4 N[C@H]1CCOC1=O SC-01385 [1,0,0,1,0,0|2,0,0]=4 549 B7R1.4 N[C@H]1CCOC1=O SC-28113 [1,0,0,1,0,0|2,0,0]=4 550 B7R1.4 N[C@H]1CCOC1=O SC-51606 [1,0,0,1,0,0|2,0,0]=4 551 B7R1.4 O=C1CCCC1Br SC-70088 [1,0,0,1,0,0|1,0,0]=3 552 B7R1.4 O=C1CCCC1Cl SC-21538 [1,0,0,1,0,0|1,0,0]=3 553 B7R1.4 O=C1NCCC1O SC-26159 [1,0,0,1,0,0|2,0,0]=4 554 B7R1.4 O=C1NCC[C@@H]1O SC-21960 [1,0,0,1,0,0|2,0,0]=4 555 B7R1.4 O=C1NCC[C@H]1O SC-87526 [1,0,0,1,0,0|2,0,0]=4 556 B7R1.4 O=C1OCC[C@@H]1O SC-14306 [1,0,0,1,0,0|2,0,0]=4 557 B7R1.4 O=C1OCC[C@H]1O SC-08904 [1,0,0,1,0,0|2,0,0]=4 558 B7R1.4 O[C@@H]1CCC[C@H]1O SC-A2623 [1,0,0,1,0,0|1,0,1]=4 559 B7R1.4 S=C1CCCC1Cl SC-42320 [1,0,0,1,0,0|1,1,0]=4 560 B7R1.4 [C@@H]1(N)CCC[C@H]1O SC-16146 [1,0,0,1,0,0|1,0,1]=4 561 B7R1.4 [C@H]1(N)CCC[C@@H]1O SC-20046 [1,0,0,1,0,0|1,0,1]=4 562 B7R1.4 [C@H]1(N)CCC[C@H]1O SC-25435 [1,0,0,1,0,0|1,0,1]=4 563 B7R1.5 CC1CC1CNN SC-60063 [1,0,0,1,0,0|2,0,0]=4 564 B7R1.6 N#CCC1CCC1 SC-39102 [1,0,0,1,0,0|1,0,1]=4 565 B7R1.6 NCCC1CCC1 SC-B8576 [1,0,0,1,0,0|1,0,0]=3 566 B7R1.6 NCCC1COC1 SC-49992 [1,0,0,1,0,0|2,0,0]=4 567 B7R1.6 NCCN1CCC1 SC-51425 [1,0,0,1,0,0|2,0,0]=4 568 B7R1.6 NNCC1CCC1 SC-12830 [1,0,0,1,0,0|2,0,0]=4 569 B7R1.6 OCCC1COC1 SC-53429 [1,0,0,1,0,0|1,0,1]=4 570 B7R1.7 C=CCCC1CO1 SC-99784 [1,0,0,1,0,0|1,0,1]=4 571 B7R1.24 C1CNCCNC1 SC-04887 [1,0,0,1,0,0|2,0,0]=4 572 B7R1.24 C1CNCCOC1 SC-72124 [1,0,0,1,0,0|1,0,1]=4 573 B9R1.2 CC1CCCC(NN)C1 SC-39258 [0,1,0,1,0,0|2,0,0]=4 574 B9R1.2 CC1CCCC(NN)C1 SC-58987 [0,1,0,1,0,0|2,0,0]=4 575 B9R1.2 CCC1CC(=O)CCN1 SC-35111 [0,1,0,1,0,0|1,0,0]=3 576 B9R1.2 COC1=CC(=O)CCC1 SC-50468 [0,1,0,1,0,0|1,0,1]=4 577 B9R1.2 N#C[C@@H]1CCC[C@H](N)C1 SC-A5734 [0,1,0,1,0,0|1,0,1]=4 578 B9R1.2 NCC1CCCC(N)C1 SC-66231 [0,1,0,1,0,0|1,0,1]=4 579 B9R1.2 O=C1CCCC(CCl)C1 SC-33730 [0,1,0,1,0,0|1,0,0]=3 580 B9R1.2 O=C1CCCC(CO)N1 SC-21439 [0,1,0,1,0,0|1,0,0]=3 581 B9R1.2 O=C1CCCN(CCl)C1 SC-41654 [0,1,0,1,0,0|2,0,0]=4 582 B9R1.7 CCCC1CCC(=O)O1 SC-52458 [0,1,0,1,0,0|0,0,0]=2 583 B9R1.7 COCC1CNC(=O)C1 SC-48746 [0,1,0,1,0,0|2,0,0]=4 584 B9R1.7 NCCN1CCC(=O)C1 SC-39650 [0,1,0,1,0,0|2,0,0]=4 585 B9R1.8 BrCCC1CCCCC1 SC-20104 [0,1,0,1,0,0|1,0,1]=4 586 B9R1.8 BrCCC1CCOCC1 SC-99287 [0,1,0,1,0,0|1,0,1]=4 587 B9R1.8 C=CCN1CCOCC1 SC-48174 [0,1,0,1,0,0|2,0,0]=4 588 B9R1.8 COCC1CCCCN1 SC-48480 [0,1,0,1,0,0|1,0,1]=4 589 B9R1.8 COCC1CCNCC1 SC-B8194 [0,1,0,1,0,0|2,0,0]=4 590 B9R1.8 ClCCC1CCCCN1 SC-42081 [0,1,0,1,0,0|1,0,1]=4 591 B9R1.8 ClCCN1CCCCC1 SC-12781 [0,1,0,1,0,0|1,0,1]=4 592 B9R1.8 N#CCC1CCCCC1 SC-40063 [0,1,0,1,0,0|1,0,1]=4 593 B9R1.8 N#CCC1CCCCC1 SC-72238 [0,1,0,1,0,0|1,0,1]=4 594 B9R1.8 N#CCC1CCNCC1 SC-A3150 [0,1,0,1,0,0|1,0,1]=4 595 B9R1.8 N#CCC1CCOCC1 SC-53285 [0,1,0,1,0,0|1,0,1]=4 596 B9R1.8 NCCC1CCOCC1 SC-06091 [0,1,0,1,0,0|1,0,1]=4 597 B9R1.8 NCCC1CCOCC1 SC-66190 [0,1,0,1,0,0|1,0,1]=4 598 B9R1.8 NCCN1CCCCC1 SC-47028 [0,1,0,1,0,0|1,0,1]=4 599 B9R1.8 NCCN1CCCCC1 SC-69190 [0,1,0,1,0,0|1,0,1]=4 600 B9R1.8 NNCC1CCCCC1 SC-58983 [0,1,0,1,0,0|1,0,1]=4 601 B9R1.8 NNCC1CCOCC1 SC-12835 [0,1,0,1,0,0|2,0,0]=4 602 B9R1.8 O=CCC1CCCCC1 SC-12759 [0,1,0,1,0,0|0,0,0]=2 603 B9R1.8 O=CCC1CCOCC1 SC-88269 [0,1,0,1,0,0|0,0,0]=2 604 B9R1.8 O=CCN1CCOCC1 SC-12451 [0,1,0,1,0,0|1,0,0]=3 605 B9R1.8 OCCC1CCCCN1 SC-01221 [0,1,0,1,0,0|0,0,2]=4 606 B9R1.8 OCCC1CCNCC1 SC-05824 [0,1,0,1,0,0|0,0,2]=4 607 B9R1.8 OCCC1CCNCC1 SC-A3238 [0,1,0,1,0,0|0,0,2]=4 608 B9R1.8 OCCN1CCCCC1 SC-69188 [0,1,0,1,0,0|0,0,2]=4 609 B9R1.8 [NH3+]NCC1CCCCC1 SC-41857 [0,1,0,1,0,0|1,0,1]=4 610 B9R1.9 NCCCN1CC(=O)C1 SC-39287 [0,1,0,1,0,0|2,0,0]=4 611 B9R1.9 O=C1CN(CCCCl)C1 SC-39097 [0,1,0,1,0,0|2,0,0]=4 612 B9R1.12 ClCCCN1CCCC1 SC-12630 [0,1,0,1,0,0|1,0,1]=4 613 B9R1.12 ClCCCN1CCCC1 SC-12631 [0,1,0,1,0,0|1,0,1]=4 614 B9R1.12 ClCCCN1CCCC1 SC-A5689 [0,1,0,1,0,0|1,0,1]=4 615 B9R1.12 N#C\C=C\C1CCCC1 SC-65529 [0,1,0,1,0,0|1,0,1]=4 616 B9R1.12 NNCCC1CCCC1 SC-59967 [0,1,0,1,0,0|1,0,1]=4 617 B9R1.12 NNCCN1CCCC1 SC-54661 [0,1,0,1,0,0|2,0,0]=4 618 B9R1.12 O=CCCC1CCCC1 SC-40969 [0,1,0,1,0,0|0,0,0]=2 619 B9R1.12 OCCCN1CCCC1 SC-25910 [0,1,0,1,0,0|0,0,2]=4 620 B9R1.15 CC1CCCCC1NN SC-58984 [0,1,0,1,0,0|1,0,1]=4 621 B9R1.15 CCC1CNCCC1=O SC-35797 [0,1,0,1,0,0|0,0,0]=2 622 B9R1.15 CCN1CCNCC1=O SC-23525 [0,1,0,1,0,0|1,0,0]=3 623 B9R1.15 CN1CCCCC1C=O SC-41014 [0,1,0,1,0,0|0,0,0]=2 624 B9R1.15 CN1CCCCC1CO SC-02380 [0,1,0,1,0,0|0,0,2]=4 625 B9R1.15 C[C@H]1CCCN[C@@H]1CO SC-91585 [0,1,0,1,0,0|0,0,2]=4 626 B9R1.15 N#CC1CCCCC1=O SC-77521 [0,1,0,1,0,0|0,0,1]=3 627 B9R1.15 N#CC1CNCCC1=O SC-28185 [0,1,0,1,0,0|1,0,1]=4 628 B9R1.15 NNC1CCCCC1Cl SC-41429 [0,1,0,1,0,0|2,0,0]=4 629 B9R1.15 O=C1CCCC\C1=C\O SC-49490 [0,1,0,1,0,0|0,0,2]=4 630 B9R1.33 C=CCC1CCNC1=O SC-26246 [0,1,0,1,0,0|0,0,2]=4 631 B9R1.33 CCCN1CCCC1=O SC-03677 [0,1,0,1,0,0|0,0,0]=2 632 B9R1.33 CN1CCCC1CCCl SC-16555 [0,1,0,1,0,0|1,0,1]=4 633 B9R1.33 COC[C@H]1CCCN1N SC-06538 [0,1,0,1,0,0|2,0,0]=4 634 B9R1.33 N#CCN1CCCC1=O SC-61209 [0,1,0,1,0,0|1,0,1]=4 635 B9R1.33 O=C1CCCN1CCBr SC-48584 [0,1,0,1,0,0|1,0,0]=3 636 B9R1.33 O=C1NCCN1CCCl SC-96180 [0,1,0,1,0,0|2,0,0]=4 637 B9R1.33 [C@@H]1(COC)CCCN1N SC-05634 [0,1,0,1,0,0|2,0,0]=4 638 B9R1.48 O=C1CCCCC(=O)C1 SC-14500 [0,1,0,1,0,0|0,0,1]=3 639 B9R1.48 O=C1CCCCC(=O)O1 SC-92931 [0,1,0,1,0,0|1,0,1]=4 640 B9R1.49 CN1CCCC(=O)CC1 SC-01972 [0,1,0,1,0,0|1,0,0]=3 641 B9R1.50 O=C1CCCCCCC1 SC-19957 [0,1,0,1,0,0|0,0,0]=2 642 B9R1.69 CC1CCC(O)CC1C SC-49456 [0,1,0,1,0,0|1,0,1]=4 643 B9R1.69 CC1CN(C)C(=O)CN1 SC-24030 [0,1,0,1,0,0|2,0,0]=4 644 B9R1.69 CC1CN(C)CCC1=O SC-21048 [0,1,0,1,0,0|1,0,0]=3 645 B9R1.69 CN1CCC(=O)CC1=O SC-A3321 [0,1,0,1,0,0|1,0,1]=4 646 B9R1.69 C[C@@H]1CN(C)C(=O)CN1 SC-29190 [0,1,0,1,0,0|2,0,0]=4 647 B9R1.69 C[C@H]1CN(C)C(=O)CN1 SC-28562 [0,1,0,1,0,0|2,0,0]=4 648 B9R1.5 NC1CCCCNC1=O SC-23204 [0,1,0,1,0,0|1,0,0]=3 649 B9R1.5 N[C@@H]1CCCCC[C@H]1N SC-32905 [0,1,0,1,0,0|1,0,1]=4 650 B9R1.5 N[C@H]1CCCCNC1=O SC-21866 [0,1,0,1,0,0|1,0,0]=3 651 B9R1.5 O=C1CCCCCC1Cl SC-52650 [0,1,0,1,0,0|0,0,0]=2 652 B9R1.5 OC1CCCCCC1O SC-45470 [0,1,0,1,0,0|0,0,2]=4 653 B9R1.5 [C@H]1(N)CCCCNC1=O SC-47624 [0,1,0,1,0,0|1,0,0]=3 654 B9R1.14 CCN1CCCC1CN SC-17902 [0,1,0,1,0,0|1,0,1]=4 655 B9R1.14 [C@H]1(CN)CCCN1CC SC-15944 [0,1,0,1,0,0|1,0,1]=4 656 B9R1.39 NCCCC1CCC1O SC-95269 [0,1,0,1,0,0|0,0,2]=4 657 B9R1.89 CCC1CCCCCN1 SC-25511 [0,1,0,1,0,0|1,0,1]=4 658 B9R1.89 NNC1CCCCCC1 SC-38703 [0,1,0,1,0,0|1,0,1]=4 659 B9R1.89 NNC1CCCCCC1 SC-59846 [0,1,0,1,0,0|1,0,1]=4 660 B9R1.89 OCC1CCCCCC1 SC-12449 [0,1,0,1,0,0|0,0,2]=4 661 B9R1.1 CC1CCC(CBr)CC1 SC-48130 [0,1,0,1,0,0|1,0,1]=4 662 B9R1.1 CC1CCC(NN)CC1 SC-58985 [0,1,0,1,0,0|2,0,0]=4 663 B9R1.1 CN1CCC(C=O)CC1 SC-20169 [0,1,0,1,0,0|1,0,0]=3 664 B9R1.1 CNC1CCC(O)CC1 SC-84448 [0,1,0,1,0,0|2,0,0]=4 665 B9R1.1 COC1CCC(N)CC1 SC-47584 [0,1,0,1,0,0|2,0,0]=4 666 B9R1.1 COC1CCC(N)CC1 SC-47593 [0,1,0,1,0,0|2,0,0]=4 667 B9R1.1 COC1CCC(N)CC1 SC-96500 [0,1,0,1,0,0|2,0,0]=4 668 B9R1.1 COC1CCC(N)CC1 SC-98601 [0,1,0,1,0,0|2,0,0]=4 669 B9R1.1 COC1CCC(O)CC1 SC-52814 [0,1,0,1,0,0|2,0,0]=4 670 B9R1.1 CO[C@H]1CC[C@@H](N)CC1 SC-88965 [0,1,0,1,0,0|2,0,0]=4 671 B9R1.1 CSC1CCC(O)CC1 SC-95858 [0,1,0,1,0,0|2,0,0]=4 672 B9R1.1 N#CC1CCC(O)CC1 SC-22486 [0,1,0,1,0,0|1,0,1]=4 673 B9R1.1 NC1CCC(CO)CC1 SC-47767 [0,1,0,1,0,0|0,0,2]=4 674 B9R1.1 NC1CCC(CO)CC1 SC-47772 [0,1,0,1,0,0|0,0,2]=4 675 B9R1.1 NC1CCC(CO)CC1 SC-47996 [0,1,0,1,0,0|0,0,2]=4 676 B9R1.1 NCC1CCC(N)CC1 SC-50982 [0,1,0,1,0,0|1,0,1]=4 677 B9R1.1 NC[C@H]1CC[C@@H](O)CC1 SC-B7291 [0,1,0,1,0,0|1,0,1]=4 678 B9R1.1 NNC1CCC(O)CC1 SC-41881 [0,1,0,1,0,0|2,0,0]=4 679 B9R1.1 O=CC1CCC(=O)CC1 SC-94874 [0,1,0,1,0,0|0,0,1]=3 680 B9R1.1 OCC1CCC(O)CC1 SC-62888 [0,1,0,1,0,0|0,0,2]=4 681 B9R1.3 CC1=C(C)C(=O)CCC1 SC-68706 [0,1,0,1,0,0|0,0,2]=4 682 B9R1.3 CC1C(=O)CCCC1=O SC-24698 [0,1,0,1,0,0|0,0,1]=3 683 B9R1.3 CN1CCCC(N)C1=O SC-53874 [0,1,0,1,0,0|1,0,0]=3 684 B9R1.3 O=C1CCCC(=O)C1Br SC-32804 [0,1,0,1,0,0|1,0,1]=4 685 B9R1.3 O=C1CCCC(=O)C1Cl SC-31874 [0,1,0,1,0,0|1,0,1]=4 686 B9R1.11 CC(NN)C1CCCC1 SC-52179 [0,1,0,1,0,0|2,0,0]=4 687 B9R1.11 NCC(O)C1CCCC1 SC-34279 [0,1,0,1,0,0|1,0,1]=4 688 B9R1.21 CCC1CCC(NN)C1 SC-41422 [0,1,0,1,0,0|2,0,0]=4 689 B9R1.118 CC1(CO)CCCCC1 SC-94042 [0,1,0,1,0,0|0,0,2]=4 690 B9R1.118 NCC1(O)CCCCC1 SC-39594 [0,1,0,1,0,0|1,0,1]=4 691 B9R1.118 OCC1(O)CCCCC1 SC-67618 [0,1,0,1,0,0|0,0,2]=4 692 B9R1.132 CN1CCC(CO)C1=O SC-68667 [0,1,0,1,0,0|2,0,0]=4 693 B9R1.6 CC(=O)C1CCCCC1 SC-28527 [0,1,0,1,0,0|0,0,0]=2 694 B9R1.6 CC(=O)C1CCNCC1 SC-48315 [0,1,0,1,0,0|1,0,0]=3 695 B9R1.6 CC(=O)C1CCOCC1 SC-66039 [0,1,0,1,0,0|1,0,0]=3 696 B9R1.6 CC(=O)N1CCCCC1 SC-A5459 [0,1,0,1,0,0|1,0,0]=3 697 B9R1.6 CC(=O)N1CCNCC1 SC-00989 [0,1,0,1,0,0|2,0,0]=4 698 B9R1.6 CC(O)C1CCCCC1 SC-22092 [0,1,0,1,0,0|0,0,2]=4 699 B9R1.6 N=C(N)C1CCCCC1 SC-12461 [0,1,0,1,0,0|1,0,0]=3 700 B9R1.6 N=C(N)N1CCCCC1 SC-65494 [0,1,0,1,0,0|2,0,0]=4 701 B9R1.6 NC(=O)C1CCCCN1 SC-13181 [0,1,0,1,0,0|1,0,0]=3 702 B9R1.6 NC(=O)C1CCNCC1 SC-04160 [0,1,0,1,0,0|1,0,0]=3 703 B9R1.6 O=C(Cl)C1=CCCCC1 SC-61008 [0,1,0,1,0,0|0,0,2]=4 704 B9R1.6 O=C(Cl)C1CCCCC1 SC-22783 [0,1,0,1,0,0|0,0,0]=2 705 B9R1.6 O=C(Cl)C1CCOCC1 SC-49140 [0,1,0,1,0,0|1,0,0]=3 706 B9R1.6 O=C(O)C1=CCCCC1 SC-44267 [0,1,0,1,0,0|0,0,2]=4 707 B9R1.6 O=C(O)C1CC=CCC1 SC-19459 [0,1,0,1,0,0|0,0,2]=4 708 B9R1.6 O=C(O)C1CC=CCC1 SC-79651 [0,1,0,1,0,0|0,0,2]=4 709 B9R1.6 O=C(O)C1CCCCO1 SC-27357 [0,1,0,1,0,0|1,0,0]=3 710 B9R1.6 O=C(O)C1CCCOC1 SC-49188 [0,1,0,1,0,0|1,0,0]=3 711 B9R1.6 O=C(O)C1CCOCC1 SC-05124 [0,1,0,1,0,0|1,0,0]=3 712 B9R1.6 O=C(O)C1CNCCN1 SC-21327 [0,1,0,1,0,0|2,0,0]=4 713 B9R1.6 O=C(O)C1CNCCO1 SC-27398 [0,1,0,1,0,0|2,0,0]=4 714 B9R1.6 O=C(O)C1CNCCS1 SC-49246 [0,1,0,1,0,0|2,0,0]=4 715 B9R1.6 O=C(O)C1CNCCS1 SC-A2935 [0,1,0,1,0,0|2,0,0]=4 716 B9R1.6 O=C(O)C1COCCN1 SC-22999 [0,1,0,1,0,0|2,0,0]=4 717 B9R1.6 O=C(O)C1COCCN1 SC-25354 [0,1,0,1,0,0|2,0,0]=4 718 B9R1.6 O=C(O)C1COCCN1 SC-27629 [0,1,0,1,0,0|2,0,0]=4 719 B9R1.6 O=C(O)C1CSCCN1 SC-47973 [0,1,0,1,0,0|2,0,0]=4 720 B9R1.6 O=C(O)N1CCSCC1 SC-33160 [0,1,0,1,0,0|2,0,0]=4 721 B9R1.6 O=C(O)[C@@H]1CC=CCC1 SC-92067 [0,1,0,1,0,0|0,0,2]=4 722 B9R1.6 O=C(O)[C@@H]1CCCNN1 SC-49631 [0,1,0,1,0,0|2,0,0]=4 723 B9R1.6 O=C(O)[C@@H]1CNCCN1 SC-08890 [0,1,0,1,0,0|2,0,0]=4 724 B9R1.6 O=C(O)[C@@H]1CSCCN1 SC-82353 [0,1,0,1,0,0|2,0,0]=4 725 B9R1.6 O=C(O)[C@H]1CC=CCC1 SC-65686 [0,1,0,1,0,0|0,0,2]=4 726 B9R1.6 O=C(O)[C@H]1CNCCN1 SC-00676 [0,1,0,1,0,0|2,0,0]=4 727 B9R1.6 O=C(O)[C@H]1CSCCN1 SC-33694 [0,1,0,1,0,0|2,0,0]=4 728 B9R1.6 OB(O)C1CCCCC1 SC-86762 [0,1,0,1,0,0|1,0,1]=4 729 B9R1.6 [C@@H]1(C(=O)O)CCCNC1 SC-02884 [0,1,0,1,0,0|1,0,0]=3 730 B9R1.6 [C@H]1(C(=O)O)CCCNC1 SC-05572 [0,1,0,1,0,0|1,0,0]=3 731 B9R1.13 CC(=O)NC1CCNC1 SC-08933 [0,1,0,1,0,0|2,0,0]=4 732 B9R1.13 CC(=O)N[C@@H]1CCNC1 SC-08932 [0,1,0,1,0,0|2,0,0]=4 733 B9R1.13 CC(C)CC1CCCN1 SC-29304 [0,1,0,1,0,0|1,0,1]=4 734 B9R1.13 CC(C)C[C@H]1CCCN1 SC-91874 [0,1,0,1,0,0|1,0,1]=4 735 B9R1.13 N=C(N)NC1CCCC1 SC-21656 [0,1,0,1,0,0|2,0,0]=4 736 B9R1.13 N=C(N)NC1CCCC1 SC-60370 [0,1,0,1,0,0|2,0,0]=4 737 B9R1.13 NC(N)=NC1CCCC1 SC-20655 [0,1,0,1,0,0|2,0,0]=4 738 B9R1.13 O=C(Cl)OC1CCCC1 SC-69079 [0,1,0,1,0,0|1,0,0]=3 739 B9R1.13 O=C(O)C=C1CCCC1 SC-36663 [0,1,0,1,0,0|0,0,2]=4 740 B9R1.13 O=C(O)CC1CCCN1 SC-49134 [0,1,0,1,0,0|1,0,0]=3 741 B9R1.13 O=C(O)CC1CCCN1 SC-70978 [0,1,0,1,0,0|1,0,0]=3 742 B9R1.13 O=C(O)CC1CCNC1 SC-48282 [0,1,0,1,0,0|1,0,0]=3 743 B9R1.13 O=C(O)CC1CCNC1 SC-53663 [0,1,0,1,0,0|1,0,0]=3 744 B9R1.13 O=C(O)CN1CCCC1 SC-69994 [0,1,0,1,0,0|1,0,0]=3 745 B9R1.13 O=C(O)C[C@@H]1CCCN1 SC-86132 [0,1,0,1,0,0|1,0,0]=3 746 B9R1.24 CC1(C)CCCC1NN SC-13131 [0,1,0,1,0,0|2,0,0]=4 747 B9R1.40 CC1(C)CCCC[C@@H]1N SC-89246 [0,1,0,1,0,0|1,0,1]=4 748 B9R1.40 CC1(C)CCCC[C@H]1N SC-89247 [0,1,0,1,0,0|1,0,1]=4 749 B9R1.40 CC1(Cl)CCCCC1=O SC-69954 [0,1,0,1,0,0|0,0,0]=2 750 B9R1.41 CC(Cl)N1CCCC1=O SC-68545 [0,1,0,1,0,0|1,0,0]=3 751 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-21501 [0,1,0,1,0,0|1,0,0]=3 752 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-28867 [0,1,0,1,0,0|1,0,0]=3 753 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-52270 [0,1,0,1,0,0|1,0,0]=3 754 B9R1.41 CN1CCC[C@H]1C(=O)O SC-21471 [0,1,0,1,0,0|1,0,0]=3 755 B9R1.41 CN1CCC[C@H]1C(=O)O SC-23602 [0,1,0,1,0,0|1,0,0]=3 756 B9R1.41 NC1CCCC1C(=O)O SC-29667 [0,1,0,1,0,0|1,0,0]=3 757 B9R1.41 NC1CCCC1C(=O)O SC-A3650 [0,1,0,1,0,0|1,0,0]=3 758 B9R1.41 NC1CCNC1C(=O)O SC-49345 [0,1,0,1,0,0|2,0,0]=4 759 B9R1.41 NC1CCSC1C(=O)O SC-29866 [0,1,0,1,0,0|2,0,0]=4 760 B9R1.41 NC1CSCC1C(=O)O SC-30185 [0,1,0,1,0,0|2,0,0]=4 761 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O SC-21947 [0,1,0,1,0,0|2,0,0]=4 762 B9R1.84 O=C(O)CCC1CCC1 SC-30968 [0,1,0,1,0,0|0,0,0]=2 763 B9R1.84 O=C(O)CNC1CCC1 SC-53570 [0,1,0,1,0,0|1,0,0]=3 764 B9R1.84 O=C(O)\C=C\C1CCC1 SC-14219 [0,1,0,1,0,0|0,0,2]=4 765 B9R1.84 O=[N+]([O-])CCC1CCC1 SC-50111 [0,1,0,1,0,0|1,0,0]=3 766 B9R1.148 FC1(F)CCCCCC1 SC-88944 [0,1,0,1,0,0|1,0,1]=4 767 B9R2.49 C1CC2CCC1CN2 SC-A4554 [0,0,0,2,0,0|1,0,1]=4 768 B9R2.68 C1CC2CCC(C1)N2 SC-B6806 [0,0,0,2,0,0|1,0,1]=4 769 B9R2.174 C1CCC2(CC1)NN2 SC-70265 [0,0,0,2,0,0|2,0,0]=4 770 B9R2.39 BrC1CC2CCC1C2 SC-A3245 [0,0,0,2,0,0|1,0,1]=4 771 B9R2.39 O=C1CC2CCC1C2 SC-50094 [0,0,0,2,0,0|0,0,0]=2 772 B9R2.39 O=C1NC2CCC1C2 SC-90767 [0,0,0,2,0,0|1,0,0]=3 773 B9R2.39 [C@H]12CC[C@H](C1)C(=O)N2 SC-52249 [0,0,0,2,0,0|1,0,0]=3 774 B9R2.109 O=C1CCCC2CC12 SC-68708 [0,0,0,2,0,0|0,0,0]=2 775 B9R2.109 O=C1CCCC2OC12 SC-A3025 [0,0,0,2,0,0|1,0,0]=3 776 B9R2.3 C1CC2CNCC2C1 SC-05391 [0,0,0,2,0,0|1,0,1]=4 777 B9R2.3 C1CC2CNCC2C1 SC-45531 [0,0,0,2,0,0|1,0,1]=4 778 B9R2.3 [C@H]12CCC[C@H]1CNC2 SC-51510 [0,0,0,2,0,0|1,0,1]=4 779 B9R2.7 O=C1CC2C=CCC12 SC-48173 [0,0,0,2,0,0|0,0,2]=4 780 B9R2.173 C1CC2(C1)CCNC2 SC-70247 [0,0,0,2,0,0|2,0,0]=4 781 B9R2.21 O=C1CCC2CC2C1 SC-68751 [0,0,0,2,0,0|0,0,0]=2 782 B9R2.20 O=C1NCC2CCC12 SC-49834 [0,0,0,2,0,0|1,0,0]=3