0 B8R0.28 C=C(C)CCCC(=O)O SC-31519 [0,0,0,0,0,0|2,0,2]=4 1 B8R0.28 C=C(C)\C=C\OC(C)=O SC-31173 [0,0,0,0,0,0|0,0,4]=4 2 B8R0.28 CC(C)C\C=C\C(=O)O SC-96534 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.28 CN(C)CCCC(=N)N SC-42054 [0,0,0,0,0,0|4,0,0]=4 4 B8R0.28 CN(C)C\C=C\C(=O)O SC-20214 [0,0,0,0,0,0|3,0,1]=4 5 B8R0.28 CN(C)C\C=C\C(=O)O SC-82699 [0,0,0,0,0,0|3,0,1]=4 6 B7R0.4 C#CCCOC(=O)Cl SC-53146 [1,0,0,0,0,0|1,0,2]=4 7 B7R0.4 C#CCCOC(C)=O SC-50550 [1,0,0,0,0,0|0,0,2]=3 8 B7R0.4 C=C(C)CCCCBr SC-31361 [1,0,0,0,0,0|3,0,0]=4 9 B7R0.4 C=C(C)CCCCO SC-32201 [1,0,0,0,0,0|3,0,0]=4 10 B7R0.4 CC(C)CCON=O SC-22768 [1,0,0,0,0,0|1,0,0]=2 11 B7R0.4 CCCNCC(=O)O SC-97541 [1,0,0,0,0,0|3,0,0]=4 12 B7R0.4 CCCSCC(=O)O SC-45283 [1,0,0,0,0,0|3,0,0]=4 13 B7R0.4 CCC\C=C\C(=O)O SC-39942 [1,0,0,0,0,0|2,0,1]=4 14 B7R0.4 CNCCCC(=O)O SC-49793 [1,0,0,0,0,0|3,0,0]=4 15 B7R0.4 CNCCCC(=O)O SC-A2900 [1,0,0,0,0,0|3,0,0]=4 16 B7R0.4 CNCCCN(C)C SC-95620 [1,0,0,0,0,0|3,0,0]=4 17 B7R0.4 COCCCC(=O)O SC-51378 [1,0,0,0,0,0|3,0,0]=4 18 B7R0.4 COCCNC(N)=O SC-62189 [1,0,0,0,0,0|3,0,0]=4 19 B7R0.4 COC\C=C/C(C)=O SC-66315 [1,0,0,0,0,0|2,0,1]=4 20 B7R0.4 NC(=O)CCCCBr SC-98143 [1,0,0,0,0,0|3,0,0]=4 21 B7R0.4 NCCCCC(=O)O SC-10120 [1,0,0,0,0,0|3,0,0]=4 22 B7R0.4 NCCCCC(=O)O SC-92391 [1,0,0,0,0,0|3,0,0]=4 23 B7R0.4 NCCCCC(N)=O SC-94858 [1,0,0,0,0,0|3,0,0]=4 24 B7R0.4 NCCCCC(N)=O SC-A4262 [1,0,0,0,0,0|3,0,0]=4 25 B7R0.4 O=C(Cl)CCCCBr SC-13447 [1,0,0,0,0,0|3,0,0]=4 26 B7R0.4 O=C(Cl)CCCCCl SC-16009 [1,0,0,0,0,0|3,0,0]=4 27 B7R0.4 O=C(O)CCCCBr SC-02338 [1,0,0,0,0,0|3,0,0]=4 28 B9R0.1 CC(C)=CCCC(C)C=O SC-79180 [0,1,0,0,0,0|2,0,1]=4 29 B9R0.1 CC(C)CCCC(C)NN SC-38599 [0,1,0,0,0,0|2,0,1]=4 30 B9R0.1 COC(=O)CCCC(C)=O SC-A5811 [0,1,0,0,0,0|2,0,1]=4 31 B9R0.7 CC(=O)C(=O)OCC(C)C SC-26296 [0,1,0,0,0,0|2,0,0]=3 32 B9R0.7 CC(C)CC[C@H](N)C(=O)O SC-93270 [0,1,0,0,0,0|2,0,0]=3 33 B9R0.7 CC(C)OC[C@H](N)C(=O)O SC-68757 [0,1,0,0,0,0|3,0,0]=4 34 B9R0.53 CC(C)C[C@H](N)CC(=O)O SC-26176 [0,1,0,0,0,0|2,0,0]=3 35 B9R0.56 C=C(C)CCC[Si](C)(C)C SC-34201 [0,1,0,0,0,0|2,1,0]=4 36 B9R0.56 CC(=O)OCC[N+](C)(C)C SC-15132 [0,1,0,0,0,0|1,0,0]=2 37 B9R0.56 CC(=O)OCC[N+](C)(C)C SC-46171 [0,1,0,0,0,0|1,0,0]=2 38 B9R0.56 CC(=O)OCC[N+](C)(C)C SC-94067 [0,1,0,0,0,0|1,0,0]=2 39 B9R0.56 CC(=O)SCC[N+](C)(C)C SC-90575 [0,1,0,0,0,0|1,1,0]=3 40 B9R0.56 CC(F)(F)CCCC(=O)O SC-34273 [0,1,0,0,0,0|3,0,0]=4 41 B9R1.35 CC(=O)N1CCC(O)C1 SC-00079 [0,0,0,1,0,0|2,0,0]=3 42 B9R1.35 CC(=O)N1CC[C@@H](O)C1 SC-53670 [0,0,0,1,0,0|2,0,0]=3 43 B9R1.35 CN1CCC(C(=O)O)C1 SC-71513 [0,0,0,1,0,0|3,0,0]=4 44 B9R1.35 NC1CCC(C(=O)O)C1 SC-62151 [0,0,0,1,0,0|3,0,0]=4 45 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 SC-82495 [0,0,0,1,0,0|3,0,0]=4 46 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 SC-93696 [0,0,0,1,0,0|3,0,0]=4 47 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 SC-93674 [0,0,0,1,0,0|3,0,0]=4 48 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 SC-52614 [0,0,0,1,0,0|3,0,0]=4 49 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 SC-69232 [0,0,0,1,0,0|3,0,0]=4 50 B9R1.35 O=C(O)[C@H]1CC[C@@H](O)C1 SC-48116 [0,0,0,1,0,0|3,0,0]=4 51 B9R1.35 [C@@H]1(C(C)C)COC(=O)N1 SC-07436 [0,0,0,1,0,0|1,0,0]=2 52 B9R1.35 [C@H]1(C(C)C)COC(=O)N1 SC-01650 [0,0,0,1,0,0|1,0,0]=2 53 B9R1.35 [C@H]1(C(C)C)CSC(=S)N1 SC-08832 [0,0,0,1,0,0|1,2,0]=4 54 B9R1.49 CN1CCCC(=O)CC1 SC-01972 [0,0,0,1,0,0|2,0,0]=3 55 B9R1.53 CC(=O)OC1CC(=O)N1 SC-20312 [0,0,0,1,0,0|2,0,1]=4 56 B9R1.66 CC1(C)CC(=O)CCO1 SC-22069 [0,0,0,1,0,0|2,0,0]=3 57 B9R1.66 CC1(C)CC(N)CCO1 SC-A4709 [0,0,0,1,0,0|2,0,1]=4 58 B9R1.66 CC1(C)CCCC(=O)C1 SC-67598 [0,0,0,1,0,0|1,0,0]=2 59 B7R0.6 C=C(C)CCC(=O)O SC-31541 [0,0,0,0,1,0|1,0,2]=4 60 B7R0.6 CC(=O)CNC(C)=O SC-72248 [0,0,0,0,1,0|2,0,1]=4 61 B7R0.6 CC(=O)OCC(=O)O SC-65254 [0,0,0,0,1,0|2,0,1]=4 62 B7R0.6 CC(=O)\C=C\N(C)C SC-92543 [0,0,0,0,1,0|1,0,2]=4 63 B7R0.6 CC(C)CCC(=O)O SC-57917 [0,0,0,0,1,0|1,0,0]=2 64 B7R0.6 CC(C)CCC(C)O SC-53086 [0,0,0,0,1,0|0,0,2]=3 65 B7R0.6 CC(C)CC[N+](=O)[O-] SC-93989 [0,0,0,0,1,0|2,0,0]=3 66 B7R0.6 CC(C)CNC(N)=S SC-88305 [0,0,0,0,1,0|2,1,0]=4 67 B7R0.6 CC(C)OCC(=O)O SC-88240 [0,0,0,0,1,0|2,0,0]=3 68 B7R0.6 CC(Cl)CCC(=O)Cl SC-74180 [0,0,0,0,1,0|2,0,0]=3 69 B7R0.6 CC(O)CCC(C)O SC-92842 [0,0,0,0,1,0|1,0,2]=4 70 B7R0.6 CN(C)CCC(=N)N SC-40941 [0,0,0,0,1,0|3,0,0]=4 71 B7R0.6 CN(C)CCC(=O)O SC-84721 [0,0,0,0,1,0|2,0,0]=3 72 B7R0.6 CN(C)CCC(=O)O SC-84792 [0,0,0,0,1,0|2,0,0]=3 73 B7R0.6 CN(C)CCC(=O)O SC-98010 [0,0,0,0,1,0|2,0,0]=3 74 B7R0.6 CN(C)CCC(N)=O SC-89196 [0,0,0,0,1,0|2,0,0]=3 75 B7R0.6 CN(C)CCN(C)C SC-98070 [0,0,0,0,1,0|3,0,0]=4 76 B7R0.6 C[C@@H](O)COC(=O)O SC-01561 [0,0,0,0,1,0|2,0,0]=3 77 B7R0.6 C[C@H](O)CC[C@H](C)O SC-03635 [0,0,0,0,1,0|1,0,2]=4 78 B9R0.55 CC(C)CCCCC(=O)O SC-47475 [0,0,0,0,0,1|2,0,0]=3 79 B9R0.55 CN(C)CCNCC(=O)O SC-48750 [0,0,0,0,0,1|3,0,0]=4 80 B6R0.4 C#CCOC(C)=O SC-90220 [2,0,0,0,0,0|0,0,2]=4 81 B6R0.4 C=C(C)CCCBr SC-32900 [2,0,0,0,0,0|2,0,0]=4 82 B6R0.4 C=C(C)CCCO SC-14313 [2,0,0,0,0,0|2,0,0]=4 83 B6R0.4 C=C(C)CNCC SC-47240 [2,0,0,0,0,0|2,0,0]=4 84 B6R0.4 C=COCC(C)C SC-19102 [2,0,0,0,0,0|0,0,1]=3 85 B6R0.4 CC(=O)CCCBr SC-91341 [2,0,0,0,0,0|1,0,0]=3 86 B6R0.4 CC(=O)OCCO SC-95931 [2,0,0,0,0,0|1,0,0]=3 87 B6R0.4 CC(C)CCCO SC-67391 [2,0,0,0,0,0|0,0,2]=4 88 B6R0.4 CCCCC(=O)Cl SC-46867 [2,0,0,0,0,0|1,0,0]=3 89 B6R0.4 CCCNC(C)C SC-50047 [2,0,0,0,0,0|1,0,1]=4 90 B6R0.4 CNCCC(=O)O SC-27492 [2,0,0,0,0,0|2,0,0]=4 91 B6R0.4 CNCCC(=O)O SC-52914 [2,0,0,0,0,0|2,0,0]=4 92 B6R0.4 CNCCN(C)C SC-29103 [2,0,0,0,0,0|2,0,0]=4 93 B6R0.4 COCCC(=O)O SC-50255 [2,0,0,0,0,0|2,0,0]=4 94 B6R0.4 COCCN(C)C SC-21743 [2,0,0,0,0,0|1,0,0]=3 95 B6R0.4 CSCCC(=O)O SC-96567 [2,0,0,0,0,0|2,0,0]=4 96 B6R0.4 NCCCC(=O)O SC-10045 [2,0,0,0,0,0|2,0,0]=4 97 B6R0.4 O=C(Cl)CCCBr SC-70369 [2,0,0,0,0,0|2,0,0]=4 98 B6R0.4 O=C(Cl)OCCF SC-53156 [2,0,0,0,0,0|2,0,0]=4 99 B6R0.4 O=C(O)CCCBr SC-02994 [2,0,0,0,0,0|2,0,0]=4 100 B6R0.4 O=C(O)CCCCl SC-89723 [2,0,0,0,0,0|2,0,0]=4 101 B6R0.6 C=COCCCC SC-22799 [2,0,0,0,0,0|0,0,1]=3 102 B6R0.6 CCCCCC=O SC-06151 [2,0,0,0,0,0|1,0,0]=3 103 B6R0.6 CCCCNCC SC-47234 [2,0,0,0,0,0|1,0,1]=4 104 B6R0.6 CCCCON=O SC-70750 [2,0,0,0,0,0|1,0,0]=3 105 B6R0.6 CCC\C=C\C=O SC-25240 [2,0,0,0,0,0|1,0,1]=4 106 B6R0.6 CCOCCCN SC-74768 [2,0,0,0,0,0|1,0,1]=4 107 B6R0.6 CCOCCCO SC-00354 [2,0,0,0,0,0|1,0,1]=4 108 B6R0.6 COCCCC=O SC-88270 [2,0,0,0,0,0|2,0,0]=4 109 B6R0.6 C\C=C\CCCO SC-48265 [2,0,0,0,0,0|2,0,0]=4 110 B6R0.6 O=CCCCCCl SC-A3300 [2,0,0,0,0,0|2,0,0]=4 111 B8R0.6 C=CCCC[C@@H](C)CO SC-31639 [1,1,0,0,0,0|1,0,1]=4 112 B8R0.6 C=CCCC[C@H](C)CO SC-31524 [1,1,0,0,0,0|1,0,1]=4 113 B8R0.6 CCCSCC(=O)OC SC-44744 [1,1,0,0,0,0|2,0,0]=4 114 B8R0.6 CNCCCC(=O)NC SC-51967 [1,1,0,0,0,0|2,0,0]=4 115 B8R0.6 COC(=O)CCCCBr SC-66180 [1,1,0,0,0,0|2,0,0]=4 116 B8R0.7 CC(C)CCCCCO SC-51101 [1,1,0,0,0,0|1,0,1]=4 117 B8R0.7 CC(C)OCCCCO SC-82574 [1,1,0,0,0,0|1,0,1]=4 118 B8R0.7 CCCCCOC(=O)Cl SC-18359 [1,1,0,0,0,0|1,0,0]=3 119 B8R0.7 CCCCOCC(=O)O SC-22619 [1,1,0,0,0,0|1,0,0]=3 120 B8R0.7 CCOCCOC(=O)Cl SC-51564 [1,1,0,0,0,0|1,0,0]=3 121 B8R0.7 COCCCOC(C)=O SC-26578 [1,1,0,0,0,0|0,0,0]=2 122 B8R0.7 COCCOCC(=O)O SC-89730 [1,1,0,0,0,0|2,0,0]=4 123 B8R0.7 NCCCCCC(=O)O SC-10067 [1,1,0,0,0,0|2,0,0]=4 124 B8R0.7 O=C(O)CCCCCBr SC-04420 [1,1,0,0,0,0|2,0,0]=4 125 B8R0.7 O=C(O)CCCCCO SC-17400 [1,1,0,0,0,0|2,0,0]=4 126 B8R0.7 O=C([O-])CCCCCO SC-82416 [1,1,0,0,0,0|2,0,0]=4 127 B8R0.7 O=C([O-])CCCCCO SC-A4948 [1,1,0,0,0,0|2,0,0]=4 128 B8R0.7 O=[N+]([O-])OCCCCO SC-13995 [1,1,0,0,0,0|2,0,0]=4 129 B8R0.8 CCCCC(=O)C(=O)[O-] SC-94857 [1,1,0,0,0,0|2,0,0]=4 130 B8R0.8 CCCCC(Br)C(=O)Cl SC-66293 [1,1,0,0,0,0|2,0,0]=4 131 B8R0.8 CCCCC(C)C(=O)Cl SC-40559 [1,1,0,0,0,0|2,0,0]=4 132 B8R0.8 CCCCC(N)C(=O)O SC-10365 [1,1,0,0,0,0|2,0,0]=4 133 B8R0.8 CCCC[C@@H](N)C(=O)O SC-10363 [1,1,0,0,0,0|2,0,0]=4 134 B8R0.9 CC(=O)OCC(=O)CCl SC-53558 [1,1,0,0,0,0|1,0,1]=4 135 B8R0.21 CCCCOP(C)(=O)Cl SC-51943 [1,1,0,0,0,0|1,0,0]=3 136 B8R0.23 C=C(CC(C)C)C(C)=O SC-A2921 [0,1,0,0,1,0|0,0,1]=3 137 B8R0.23 CC(=O)CC(O)[C@H](C)N SC-76554 [0,1,0,0,1,0|1,0,0]=3 138 B8R0.23 CC(C)CC(=O)C(=O)O SC-13856 [0,1,0,0,1,0|1,0,1]=4 139 B8R0.23 CC(C)CC(=O)C(=O)[O-] SC-19264 [0,1,0,0,1,0|1,0,1]=4 140 B8R0.23 CC(C)CC(Br)C(=O)O SC-A4035 [0,1,0,0,1,0|1,0,0]=3 141 B8R0.23 CC(C)CC(N)C(=O)O SC-09638 [0,1,0,0,1,0|1,0,0]=3 142 B8R0.23 CC(C)CC(N)C(=O)O SC-09639 [0,1,0,0,1,0|1,0,0]=3 143 B8R0.23 CC(C)CC(O)C(=O)O SC-08876 [0,1,0,0,1,0|1,0,0]=3 144 B8R0.23 CC(C)CC(O)C(=O)O SC-25183 [0,1,0,0,1,0|1,0,0]=3 145 B8R0.23 CC(C)C[C@@H](N)C(=O)O SC-09637 [0,1,0,0,1,0|1,0,0]=3 146 B8R0.23 CC(C)C[C@@H](O)C(=O)O SC-13459 [0,1,0,0,1,0|1,0,0]=3 147 B8R0.23 CC(C)C[C@H](Cl)C(=O)O SC-08865 [0,1,0,0,1,0|1,0,0]=3 148 B8R0.23 CC(C)C[C@H](N)C(N)=O SC-09656 [0,1,0,0,1,0|1,0,0]=3 149 B8R0.29 CC(C)(C)CCC(=O)O SC-49427 [0,1,0,0,1,0|1,0,0]=3 150 B8R0.29 CC(C)(C)NCC(=O)O SC-82899 [0,1,0,0,1,0|2,0,0]=4 151 B8R0.29 CC(C)(C)OCC(=O)O SC-46034 [0,1,0,0,1,0|2,0,0]=4 152 B8R0.29 CC(F)(F)CCC(=O)O SC-34612 [0,1,0,0,1,0|2,0,0]=4 153 B10R0.96 CC(=O)CCC(=O)OC(C)C SC-94827 [0,1,0,0,0,1|1,0,1]=4 154 B10R0.98 C=C(C)C(=O)OCCN(C)C SC-80654 [0,1,0,0,0,1|2,0,0]=4 155 B10R0.3 CC(C)=CCC[C@H](C)CCO SC-49208 [0,2,0,0,0,0|2,0,0]=4 156 B10R0.44 COC(=O)CC(=O)CC(C)C SC-53185 [0,2,0,0,0,0|1,0,1]=4 157 B10R0.92 CC(C)[C@@H](N)COP(=O)(O)O SC-44305 [0,2,0,0,0,0|2,0,0]=4 158 B10R0.31 CC(C)(C)CC(N)CC(N)=O SC-59259 [0,2,0,0,0,0|2,0,0]=4 159 B10R0.31 CC(C[N+](C)(C)C)OC(N)=O SC-76414 [0,2,0,0,0,0|2,0,0]=4 160 B8R1.1 O=C1CC(CO)CN1 SC-66045 [1,0,0,1,0,0|2,0,0]=4 161 B8R1.1 O=C1N[C@@H](CO)CO1 SC-33166 [1,0,0,1,0,0|2,0,0]=4 162 B8R1.1 O=C1N[C@H](CO)CO1 SC-33358 [1,0,0,1,0,0|2,0,0]=4 163 B8R1.4 CC1CC(=O)CCN1 SC-14913 [1,0,0,1,0,0|2,0,0]=4 164 B8R1.4 CC1CC(=O)CCN1 SC-26346 [1,0,0,1,0,0|2,0,0]=4 165 B8R1.4 CC1CC(=O)CCO1 SC-43658 [1,0,0,1,0,0|2,0,0]=4 166 B8R1.4 CC1CC(O)CCO1 SC-15639 [1,0,0,1,0,0|1,0,1]=4 167 B8R1.4 CC1CCCC(=O)N1 SC-90092 [1,0,0,1,0,0|2,0,0]=4 168 B8R1.4 CC1CCNC(=O)C1 SC-65553 [1,0,0,1,0,0|1,0,0]=3 169 B8R1.4 CC1CCNC(C)C1 SC-05916 [1,0,0,1,0,0|1,0,1]=4 170 B8R1.4 CN1CCCC(=O)C1 SC-88063 [1,0,0,1,0,0|2,0,0]=4 171 B8R1.4 CN1CCNC(=O)C1 SC-43594 [1,0,0,1,0,0|2,0,0]=4 172 B8R1.4 C[C@H]1CCCC(=O)N1 SC-51761 [1,0,0,1,0,0|2,0,0]=4 173 B8R1.4 NC1CCCC(=O)C1 SC-82662 [1,0,0,1,0,0|2,0,0]=4 174 B8R1.4 NC1CCNC(=O)C1 SC-86171 [1,0,0,1,0,0|2,0,0]=4 175 B8R1.4 O=C1CC(O)CCN1 SC-14921 [1,0,0,1,0,0|2,0,0]=4 176 B8R1.4 O=C1CC(O)CCN1 SC-26449 [1,0,0,1,0,0|2,0,0]=4 177 B8R1.6 COCC1CC(=O)C1 SC-65908 [1,0,0,1,0,0|2,0,0]=4 178 B8R1.7 CC(=O)C1CCCC1 SC-34558 [1,0,0,1,0,0|1,0,0]=3 179 B8R1.7 CC(=O)C1CCCC1 SC-69830 [1,0,0,1,0,0|1,0,0]=3 180 B8R1.7 O=C(Cl)C1CCCC1 SC-45320 [1,0,0,1,0,0|2,0,0]=4 181 B8R1.7 O=C(Cl)N1CCCC1 SC-72914 [1,0,0,1,0,0|2,0,0]=4 182 B8R1.7 O=C(O)C1CCCC1 SC-18675 [1,0,0,1,0,0|2,0,0]=4 183 B8R1.19 CC1(C)CCCC1=O SC-65127 [1,0,0,1,0,0|1,0,0]=3 184 B8R1.19 CC1(C)CCOC1=O SC-15803 [1,0,0,1,0,0|0,0,0]=2 185 B8R1.19 CC1(C)CONC1=O SC-83064 [1,0,0,1,0,0|2,0,0]=4 186 B8R1.22 CC1OCCCCO1 SC-26173 [1,0,0,1,0,0|0,0,2]=4 187 B8R1.22 O=C1C=CCCCC1 SC-99582 [1,0,0,1,0,0|1,0,1]=4 188 B8R1.22 O=C1CCCNCC1 SC-20974 [1,0,0,1,0,0|2,0,0]=4 189 B8R1.22 O=C1CCNCCN1 SC-05951 [1,0,0,1,0,0|2,0,0]=4 190 B8R1.22 O=C1CCNCCN1 SC-21923 [1,0,0,1,0,0|2,0,0]=4 191 B8R1.22 O=C1CNCCCN1 SC-21981 [1,0,0,1,0,0|2,0,0]=4 192 B8R1.34 CC(=O)NC1CNC1 SC-48410 [1,0,0,1,0,0|2,0,0]=4 193 B8R1.34 O=C(O)CC1CCC1 SC-26391 [1,0,0,1,0,0|2,0,0]=4 194 B8R1.35 CC(=O)OCC1CO1 SC-74435 [1,0,0,1,0,0|1,0,0]=3 195 B8R1.35 O=C(O)CCC1CC1 SC-31428 [1,0,0,1,0,0|2,0,0]=4 196 B8R1.72 CC1(C)CCCNC1 SC-A4757 [1,0,0,1,0,0|2,0,0]=4 197 B8R1.72 CC1(C)CCNCC1 SC-04309 [1,0,0,1,0,0|1,0,1]=4 198 B8R1.72 CC1(C)CCNCC1 SC-15068 [1,0,0,1,0,0|1,0,1]=4 199 B8R1.72 CC1(N)CCOCC1 SC-B7062 [1,0,0,1,0,0|1,0,1]=4 200 B8R1.72 CC1(O)CCOCC1 SC-21971 [1,0,0,1,0,0|1,0,1]=4 201 B8R1.72 O=S1(=O)CCCCO1 SC-15335 [1,0,0,1,0,0|2,0,0]=4 202 B8R1.3 CC1=CCC(=O)CC1 SC-83877 [0,0,0,1,1,0|0,0,2]=4 203 B8R1.3 CC1CCC(=O)CC1 SC-27685 [0,0,0,1,1,0|0,0,0]=2 204 B8R1.3 CC1CCC(=S)CC1 SC-42109 [0,0,0,1,1,0|0,1,0]=3 205 B8R1.3 CC1CCC(N)CC1 SC-47816 [0,0,0,1,1,0|1,0,1]=4 206 B8R1.3 CC1CCC(N)CC1 SC-54542 [0,0,0,1,1,0|1,0,1]=4 207 B8R1.3 CN1CCC(=O)CC1 SC-01124 [0,0,0,1,1,0|1,0,0]=3 208 B8R1.3 CN1CCC(=S)CC1 SC-42847 [0,0,0,1,1,0|1,1,0]=4 209 B8R1.3 C[C@@H]1CC[C@@H](C)NC1 SC-49594 [0,0,0,1,1,0|1,0,1]=4 210 B8R1.3 C[C@H]1CC[C@@H](N)CC1 SC-68012 [0,0,0,1,1,0|1,0,1]=4 211 B8R1.3 NC1CCC(=O)CC1 SC-51421 [0,0,0,1,1,0|1,0,0]=3 212 B8R1.3 NC1CCC(=O)CC1 SC-94303 [0,0,0,1,1,0|1,0,0]=3 213 B8R1.3 N[C@H]1CCC(=O)NC1 SC-A3084 [0,0,0,1,1,0|2,0,0]=4 214 B8R1.3 O=C1CCC(=O)CC1 SC-15336 [0,0,0,1,1,0|1,0,1]=4 215 B8R1.3 O=C1CCC(Br)CC1 SC-97780 [0,0,0,1,1,0|1,0,0]=3 216 B8R1.3 O=C1CCC(O)CC1 SC-22101 [0,0,0,1,1,0|1,0,0]=3 217 B8R1.3 O=C1CCC(O)CN1 SC-14920 [0,0,0,1,1,0|2,0,0]=4 218 B8R1.3 O=C1CC[C@@H](O)CN1 SC-69872 [0,0,0,1,1,0|2,0,0]=4 219 B8R1.3 O=C1CC[C@H](O)CN1 SC-69873 [0,0,0,1,1,0|2,0,0]=4 220 B8R1.23 CC(=O)N1CC(N)C1 SC-51444 [0,0,0,1,1,0|2,0,0]=4 221 B8R1.23 CC(=O)N1CC(N)C1 SC-A3072 [0,0,0,1,1,0|2,0,0]=4 222 B8R1.23 CC(=O)N1CC(N)C1 SC-B8083 [0,0,0,1,1,0|2,0,0]=4 223 B8R1.23 CC(=O)N1CC(O)C1 SC-93602 [0,0,0,1,1,0|2,0,0]=4 224 B8R1.23 CC1CC(C(=O)O)C1 SC-73078 [0,0,0,1,1,0|1,0,0]=3 225 B8R1.23 CN1CC(C(=O)O)C1 SC-49053 [0,0,0,1,1,0|2,0,0]=4 226 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 SC-48610 [0,0,0,1,1,0|2,0,0]=4 227 B8R1.23 N[C@H]1C[C@@H](C(=O)O)C1 SC-70419 [0,0,0,1,1,0|2,0,0]=4 228 B8R1.23 O=C(O)C1CC(F)C1 SC-26589 [0,0,0,1,1,0|2,0,0]=4 229 B8R1.23 O=C(O)[C@H]1C[C@H](O)C1 SC-96294 [0,0,0,1,1,0|2,0,0]=4 230 B8R1.51 CC1(C)C=CC(=O)C1 SC-91103 [0,0,0,1,1,0|0,0,2]=4 231 B8R1.51 CC1(C)CCC(=O)O1 SC-21203 [0,0,0,1,1,0|1,0,0]=3 232 B8R1.51 CC1(C)CNC(=O)C1 SC-70558 [0,0,0,1,1,0|1,0,0]=3 233 B10R1.54 CC(=O)O[C@H]1C=C[C@@H](O)C1 SC-49020 [0,0,0,1,0,1|1,0,1]=4 234 B10R1.54 CC(C)CC1CNC(=O)C1 SC-94804 [0,0,0,1,0,1|1,0,0]=3 235 B10R1.113 CC(=O)N1CCC[C@H](O)C1 SC-88350 [0,0,0,1,0,1|2,0,0]=4 236 B10R1.113 CC(C)C1CC(=O)CCN1 SC-35112 [0,0,0,1,0,1|1,0,0]=3 237 B10R1.113 CC1CCCC(C(=O)O)C1 SC-52381 [0,0,0,1,0,1|2,0,0]=4 238 B10R1.113 C[C@@H]1CCN[C@@H](C(=O)O)C1 SC-21748 [0,0,0,1,0,1|2,0,0]=4 239 B10R1.113 C[C@@H]1CCN[C@@H](C(=O)[O-])C1 SC-15310 [0,0,0,1,0,1|2,0,0]=4 240 B10R1.13 CC(=O)C1CCN(C)CC1 SC-48905 [0,1,0,1,0,0|2,0,0]=4 241 B10R1.13 CC(=O)N1CCC(Cl)CC1 SC-69628 [0,1,0,1,0,0|2,0,0]=4 242 B10R1.13 CC(=O)N1CCC(I)CC1 SC-52662 [0,1,0,1,0,0|2,0,0]=4 243 B10R1.13 CC(=O)N1CCC(N)CC1 SC-23551 [0,1,0,1,0,0|2,0,0]=4 244 B10R1.13 CC(=O)N1CCC(N)CC1 SC-92386 [0,1,0,1,0,0|2,0,0]=4 245 B10R1.13 CC(=O)N1CCC(O)CC1 SC-15455 [0,1,0,1,0,0|2,0,0]=4 246 B10R1.13 CC(C)N1CCC(=O)CC1 SC-05143 [0,1,0,1,0,0|2,0,0]=4 247 B10R1.13 CN(C)C1CCC(=O)CC1 SC-85674 [0,1,0,1,0,0|2,0,0]=4 248 B10R1.13 C[C@H]1CC[C@H](C(=O)O)CC1 SC-00751 [0,1,0,1,0,0|2,0,0]=4 249 B10R1.14 COC(=O)C1CCC(O)C1 SC-A3344 [0,1,0,1,0,0|2,0,0]=4 250 B10R1.14 COC(=O)[C@H]1CC[C@H](O)C1 SC-84077 [0,1,0,1,0,0|2,0,0]=4 251 B10R1.31 CC(=O)N1CCC(CBr)C1 SC-92944 [0,1,0,1,0,0|1,0,0]=3 252 B10R1.127 CC(C)CCOC1CNC1 SC-36547 [0,1,0,1,0,0|1,0,1]=4 253 B10R1.329 CC1(C)CC(=O)C=C(N)C1 SC-13256 [0,1,0,1,0,0|1,0,1]=4 254 B10R1.329 CC1(C)CC(=O)NC(=O)C1 SC-99802 [0,1,0,1,0,0|1,0,1]=4 255 B10R1.329 CC1(C)CC(=O)OC(=O)C1 SC-A4598 [0,1,0,1,0,0|0,0,1]=3 256 B10R1.55 CC(C)(C)[C@H]1COC(=O)N1 SC-52397 [0,1,0,1,0,0|1,0,0]=3 257 B10R2.357 O=C(O)C1CC2CC2C1 SC-25088 [0,0,0,2,0,0|2,0,0]=4 258 B10R2.357 O=C(O)C1CC2CC2C1 SC-B7776 [0,0,0,2,0,0|2,0,0]=4 259 B6R0.2 CC(=O)CC(C)=O SC-68118 [0,0,0,0,2,0|1,0,1]=4 260 B6R0.2 CC(=O)CC(C)=O SC-77723 [0,0,0,0,2,0|1,0,1]=4 261 B6R0.2 CC(=O)NC(C)C SC-A3057 [0,0,0,0,2,0|1,0,0]=3 262 B6R0.2 CC(C)CC(=N)N SC-40541 [0,0,0,0,2,0|2,0,0]=4 263 B6R0.2 CC(C)CC(C)Br SC-26522 [0,0,0,0,2,0|1,0,1]=4 264 B6R0.2 CC(C)OC(=O)Cl SC-26628 [0,0,0,0,2,0|1,0,0]=3 265 B6R0.2 CC(C)OC(C)C SC-65190 [0,0,0,0,2,0|1,0,1]=4 266 B6R0.2 CC(Cl)OC(=O)Cl SC-13624 [0,0,0,0,2,0|2,0,0]=4 267 B6R0.2 CC(O)CC(=O)[O-] SC-85388 [0,0,0,0,2,0|2,0,0]=4 268 B6R0.2 CN(C)CC(=O)Cl SC-48853 [0,0,0,0,2,0|2,0,0]=4 269 B6R0.2 CN(C)CC(=O)O SC-09555 [0,0,0,0,2,0|2,0,0]=4 270 B6R0.2 CN(C)CC(=O)O SC-51828 [0,0,0,0,2,0|2,0,0]=4 271 B6R0.2 CN(C)CC(N)=O SC-89197 [0,0,0,0,2,0|2,0,0]=4 272 B6R0.2 C[C@@H](N)CC(=O)O SC-10059 [0,0,0,0,2,0|2,0,0]=4 273 B6R0.2 C[C@@H](N)CC(=O)O SC-44142 [0,0,0,0,2,0|2,0,0]=4 274 B6R0.2 C[C@H](N)CC(=O)O SC-21979 [0,0,0,0,2,0|2,0,0]=4 275 B6R0.2 C[C@H](O)CC(=O)O SC-B3327 [0,0,0,0,2,0|2,0,0]=4 276 B6R0.2 C[S+](C)CC(=O)[O-] SC-72907 [0,0,0,0,2,0|2,0,0]=4