0 B7R0.4 C#CCCCC(=O)O SC-73017 [0,0,0,0,0,0|0,0,4]=4 1 B7R0.4 C#CCNCC(=O)O SC-10418 [0,0,0,0,0,0|1,0,3]=4 2 B7R0.4 C#CCNCC(=O)O SC-10419 [0,0,0,0,0,0|1,0,3]=4 3 B7R0.4 C#CCNCC(=O)O SC-65650 [0,0,0,0,0,0|1,0,3]=4 4 B7R0.4 C=CCCCC(=O)O SC-93956 [0,0,0,0,0,0|0,0,4]=4 5 B7R0.4 C=CCNCC(=O)O SC-74362 [0,0,0,0,0,0|1,0,3]=4 6 B7R0.4 C=CCOCC(=O)O SC-35140 [0,0,0,0,0,0|1,0,3]=4 7 B7R0.4 C=CCOCC(=O)O SC-49027 [0,0,0,0,0,0|1,0,3]=4 8 B7R0.4 CCCNCC(=O)O SC-97541 [0,0,0,0,0,0|1,0,1]=2 9 B7R0.4 CCCSCC(=O)O SC-45283 [0,0,0,0,0,0|1,0,1]=2 10 B7R0.4 CCC\C=C\C(=O)O SC-39942 [0,0,0,0,0,0|0,0,0]=0 11 B7R0.4 CCO\C=C\C(=O)Cl SC-50076 [0,0,0,0,0,0|2,0,0]=2 12 B7R0.4 CCO\C=C\C(=O)Cl SC-95806 [0,0,0,0,0,0|2,0,0]=2 13 B7R0.4 CCO\C=C\C(=O)O SC-89061 [0,0,0,0,0,0|1,0,0]=1 14 B7R0.4 CNCCCC(=O)O SC-49793 [0,0,0,0,0,0|1,0,2]=3 15 B7R0.4 CNCCCC(=O)O SC-A2900 [0,0,0,0,0,0|1,0,2]=3 16 B7R0.4 COCCCC(=O)O SC-51378 [0,0,0,0,0,0|1,0,2]=3 17 B7R0.4 COCCNC(N)=O SC-62189 [0,0,0,0,0,0|3,0,1]=4 18 B7R0.4 COC\C=C/C(C)=O SC-66315 [0,0,0,0,0,0|2,0,0]=2 19 B7R0.4 C\C=C\CCC(=O)O SC-21245 [0,0,0,0,0,0|0,0,4]=4 20 B7R0.4 NC(=O)CCCCBr SC-98143 [0,0,0,0,0,0|2,0,2]=4 21 B7R0.4 NCCCCC(=O)O SC-10120 [0,0,0,0,0,0|1,0,2]=3 22 B7R0.4 NCCCCC(=O)O SC-92391 [0,0,0,0,0,0|1,0,2]=3 23 B7R0.4 NCCCCC(N)=O SC-94858 [0,0,0,0,0,0|2,0,2]=4 24 B7R0.4 NCCCCC(N)=O SC-A4262 [0,0,0,0,0,0|2,0,2]=4 25 B7R0.4 NCCNCC(=O)O SC-21750 [0,0,0,0,0,0|2,0,1]=3 26 B7R0.4 O=C(Cl)CCCCBr SC-13447 [0,0,0,0,0,0|2,0,2]=4 27 B7R0.4 O=C(Cl)CCCCCl SC-16009 [0,0,0,0,0,0|2,0,2]=4 28 B7R0.4 O=C(O)CCCCBr SC-02338 [0,0,0,0,0,0|1,0,2]=3 29 B7R0.4 O=C([O-])COCCO SC-A2671 [0,0,0,0,0,0|2,0,2]=4 30 B6R0.4 C#CCCC(=O)O SC-51038 [1,0,0,0,0,0|0,0,3]=4 31 B6R0.4 C=CCCC(=O)O SC-25836 [1,0,0,0,0,0|0,0,3]=4 32 B6R0.4 CC(=O)CCCBr SC-91341 [1,0,0,0,0,0|2,0,1]=4 33 B6R0.4 CC(=O)OCCO SC-95931 [1,0,0,0,0,0|3,0,0]=4 34 B6R0.4 CC(C)=CCCBr SC-A5828 [1,0,0,0,0,0|3,0,0]=4 35 B6R0.4 CCCCB(O)O SC-04512 [1,0,0,0,0,0|1,0,2]=4 36 B6R0.4 CCCCC(=O)Cl SC-46867 [1,0,0,0,0,0|1,0,1]=3 37 B6R0.4 CC\C=C\C(=O)O SC-92876 [1,0,0,0,0,0|0,0,0]=1 38 B6R0.4 CNCCC(=O)O SC-27492 [1,0,0,0,0,0|1,0,1]=3 39 B6R0.4 CNCCC(=O)O SC-52914 [1,0,0,0,0,0|1,0,1]=3 40 B6R0.4 COCCC(=O)O SC-50255 [1,0,0,0,0,0|1,0,1]=3 41 B6R0.4 CO\C=C\C(C)=O SC-71024 [1,0,0,0,0,0|2,0,0]=3 42 B6R0.4 CSCCC(=O)O SC-96567 [1,0,0,0,0,0|1,0,1]=3 43 B6R0.4 C\C=C\CC(=O)O SC-10968 [1,0,0,0,0,0|0,0,2]=3 44 B6R0.4 N#CCCC(=O)O SC-49854 [1,0,0,0,0,0|1,0,2]=4 45 B6R0.4 NCCCC(=O)O SC-10045 [1,0,0,0,0,0|1,0,1]=3 46 B6R0.4 O=C(Cl)CCCBr SC-70369 [1,0,0,0,0,0|2,0,1]=4 47 B6R0.4 O=C(Cl)OCCF SC-53156 [1,0,0,0,0,0|3,0,0]=4 48 B6R0.4 O=C(O)CCCBr SC-02994 [1,0,0,0,0,0|1,0,1]=3 49 B6R0.4 O=C(O)CCCCl SC-89723 [1,0,0,0,0,0|1,0,1]=3 50 B6R0.4 O=C(O)\C=C\CBr SC-53654 [1,0,0,0,0,0|1,0,0]=2 51 B6R0.6 C=COCCCC SC-22799 [1,0,0,0,0,0|2,0,1]=4 52 B6R0.6 CCCCCC=O SC-06151 [1,0,0,0,0,0|0,0,2]=3 53 B6R0.6 CCCCON=O SC-70750 [1,0,0,0,0,0|2,0,1]=4 54 B6R0.6 CCCNCCO SC-20196 [1,0,0,0,0,0|1,0,2]=4 55 B6R0.6 CCC\C=C\C=O SC-25240 [1,0,0,0,0,0|0,0,0]=1 56 B6R0.6 COCCCC=O SC-88270 [1,0,0,0,0,0|1,0,2]=4 57 B6R0.6 C\C=C\C=C\CO SC-21408 [1,0,0,0,0,0|0,0,3]=4 58 B6R0.6 C\C=C\CCCO SC-48265 [1,0,0,0,0,0|2,0,1]=4 59 B6R0.6 O=CCCCCCl SC-A3300 [1,0,0,0,0,0|1,0,2]=4 60 B8R0.5 CCOC(=O)C=C(C)C SC-49947 [0,1,0,0,0,0|3,0,0]=4 61 B8R0.5 CCOC(=O)CC(=O)O SC-17786 [0,1,0,0,0,0|1,0,1]=3 62 B8R0.5 CCOC(=O)CC(=O)[O-] SC-26967 [0,1,0,0,0,0|1,0,2]=4 63 B8R0.5 CCOC(=O)CC(C)=O SC-18922 [0,1,0,0,0,0|2,0,1]=4 64 B8R0.5 CCOC(=O)\C=C(\C)N SC-46838 [0,1,0,0,0,0|3,0,0]=4 65 B8R0.6 CCCSCC(=O)OC SC-44744 [0,1,0,0,0,0|1,0,1]=3 66 B8R0.6 COC(=O)CCCCBr SC-66180 [0,1,0,0,0,0|1,0,2]=4 67 B8R0.7 C#CCCCCC(=O)O SC-20440 [0,1,0,0,0,0|0,0,3]=4 68 B8R0.7 C=CCCOCC(=O)O SC-35006 [0,1,0,0,0,0|1,0,2]=4 69 B8R0.7 CCCCCOC(=O)Cl SC-18359 [0,1,0,0,0,0|1,0,2]=4 70 B8R0.7 CCCCOCC(=O)O SC-22619 [0,1,0,0,0,0|0,0,2]=3 71 B8R0.7 CCOCCOC(=O)Cl SC-51564 [0,1,0,0,0,0|2,0,1]=4 72 B8R0.7 COCCCOC(C)=O SC-26578 [0,1,0,0,0,0|2,0,1]=4 73 B8R0.7 COCCOCC(=O)O SC-89730 [0,1,0,0,0,0|1,0,1]=3 74 B8R0.7 COCOCCC(=O)O SC-50551 [0,1,0,0,0,0|1,0,2]=4 75 B8R0.7 CSCC\C=C\C(=O)O SC-39251 [0,1,0,0,0,0|0,0,0]=1 76 B8R0.7 NCCCCCC(=O)O SC-10067 [0,1,0,0,0,0|0,0,2]=3 77 B8R0.7 O=C(O)CCCCCBr SC-04420 [0,1,0,0,0,0|0,0,2]=3 78 B8R0.7 O=C(O)CCCCCO SC-17400 [0,1,0,0,0,0|0,0,2]=3 79 B8R0.7 O=C(O)CCOCCBr SC-A2260 [0,1,0,0,0,0|1,0,2]=4 80 B8R0.7 O=C([O-])CCCCCO SC-82416 [0,1,0,0,0,0|0,0,3]=4 81 B8R0.7 O=C([O-])CCCCCO SC-A4948 [0,1,0,0,0,0|0,0,3]=4 82 B8R0.8 CCCCC(=O)C(=O)[O-] SC-94857 [0,1,0,0,0,0|0,0,2]=3 83 B8R0.8 CCCCC(Br)C(=O)Cl SC-66293 [0,1,0,0,0,0|1,0,2]=4 84 B8R0.8 CCCCC(C)C(=O)Cl SC-40559 [0,1,0,0,0,0|1,0,2]=4 85 B8R0.8 CCCCC(N)C(=O)O SC-10365 [0,1,0,0,0,0|0,0,2]=3 86 B8R0.8 CCCC[C@@H](N)C(=O)O SC-10363 [0,1,0,0,0,0|0,0,2]=3 87 B8R0.8 CCOC[C@H](N)C(=O)O SC-68756 [0,1,0,0,0,0|1,0,2]=4 88 B8R0.8 COCC[C@@H](N)C(=O)O SC-49310 [0,1,0,0,0,0|1,0,2]=4 89 B8R0.8 CSCC[C@H](N)C(=O)O SC-09744 [0,1,0,0,0,0|1,0,2]=4 90 B8R0.8 C[Se]CC[C@H](N)C(=O)O SC-19961 [0,1,0,0,0,0|1,0,2]=4 91 B8R0.8 C\C=C\C=C(/C)C(=O)[O-] SC-10258 [0,1,0,0,0,0|0,0,3]=4 92 B8R0.8 NCCCC(N)C(=O)O SC-10385 [0,1,0,0,0,0|1,0,2]=4 93 B8R0.8 NCCCC(N)C(=O)O SC-48991 [0,1,0,0,0,0|1,0,2]=4 94 B8R0.9 CCC(=O)CCC(=O)O SC-58454 [0,1,0,0,0,0|0,0,3]=4 95 B8R0.9 COC(=O)\C=C\C(=O)[O-] SC-65689 [0,1,0,0,0,0|1,0,2]=4 96 B8R0.21 CCCCCS(=O)(=O)O SC-90285 [0,1,0,0,0,0|1,0,2]=4 97 B8R0.28 C=C(C)CCCC(=O)O SC-31519 [0,1,0,0,0,0|0,0,3]=4 98 B8R0.28 CC(=O)C\C=C\C(=O)O SC-70039 [0,1,0,0,0,0|0,0,1]=2 99 B8R0.28 CC(C)C\C=C\C(=O)O SC-96534 [0,1,0,0,0,0|0,0,0]=1 100 B8R0.28 CN(C)C\C=C\C(=O)O SC-20214 [0,1,0,0,0,0|1,0,0]=2 101 B8R0.28 CN(C)C\C=C\C(=O)O SC-82699 [0,1,0,0,0,0|1,0,0]=2 102 B8R0.28 O=C(O)\C=C\CC(=O)O SC-37894 [0,1,0,0,0,0|1,0,1]=3 103 B8R1.1 CC1=CC=C(CN)O1 SC-84276 [0,0,0,1,0,0|2,0,1]=4 104 B8R1.1 CC1=CC=C(CO)O1 SC-62862 [0,0,0,1,0,0|2,0,1]=4 105 B8R1.1 O=C1CC=C(CO)O1 SC-52407 [0,0,0,1,0,0|1,0,2]=4 106 B8R1.1 O=C1NC[C@H](CCl)O1 SC-73276 [0,0,0,1,0,0|2,0,1]=4 107 B8R1.4 CC1=CC=CC(O)=N1 SC-21197 [0,0,0,1,0,0|1,0,2]=4 108 B8R1.4 CC1=NC(=O)C=CN1 SC-52114 [0,0,0,1,0,0|2,0,1]=4 109 B8R1.4 CC1=NC=CC(O)=C1 SC-47525 [0,0,0,1,0,0|2,0,1]=4 110 B8R1.4 CC1=NC=CC(O)=N1 SC-94927 [0,0,0,1,0,0|2,0,1]=4 111 B8R1.4 CC1CCCC(=O)N1 SC-90092 [0,0,0,1,0,0|1,0,2]=4 112 B8R1.4 CC1CCNC(=O)C1 SC-65553 [0,0,0,1,0,0|2,0,1]=4 113 B8R1.4 CC1CNCC(=O)N1 SC-68745 [0,0,0,1,0,0|2,0,1]=4 114 B8R1.4 C[C@H]1CCCC(=O)N1 SC-51761 [0,0,0,1,0,0|1,0,2]=4 115 B8R1.4 C[C@H]1COCC(=O)N1 SC-82343 [0,0,0,1,0,0|2,0,1]=4 116 B8R1.7 CC(=O)C1CCCC1 SC-34558 [0,0,0,1,0,0|1,0,2]=4 117 B8R1.7 CC(=O)C1CCCC1 SC-69830 [0,0,0,1,0,0|1,0,2]=4 118 B8R1.7 CC(=S)C1=CCCS1 SC-42218 [0,0,0,1,0,0|2,1,0]=4 119 B8R1.7 NC(=O)C1CCCN1 SC-24789 [0,0,0,1,0,0|2,0,1]=4 120 B8R1.7 NC(=O)[C@@H]1CCCN1 SC-06632 [0,0,0,1,0,0|2,0,1]=4 121 B8R1.7 NC(=O)[C@H]1CCCN1 SC-09817 [0,0,0,1,0,0|2,0,1]=4 122 B8R1.7 O=C(Cl)C1CCCC1 SC-45320 [0,0,0,1,0,0|1,0,2]=4 123 B8R1.7 O=C(Cl)N1CCCC1 SC-72914 [0,0,0,1,0,0|2,0,1]=4 124 B8R1.7 O=C(O)C1=CC=CN1 SC-54396 [0,0,0,1,0,0|1,0,2]=4 125 B8R1.7 O=C(O)C1=CC=NN1 SC-69621 [0,0,0,1,0,0|2,0,1]=4 126 B8R1.7 O=C(O)C1=CC=NO1 SC-47691 [0,0,0,1,0,0|2,0,1]=4 127 B8R1.7 O=C(O)C1=CC=NS1 SC-25295 [0,0,0,1,0,0|2,0,1]=4 128 B8R1.7 O=C(O)C1=CCCC1 SC-65352 [0,0,0,1,0,0|0,0,0]=1 129 B8R1.7 O=C(O)C1=CN=CO1 SC-49435 [0,0,0,1,0,0|2,0,1]=4 130 B8R1.7 O=C(O)C1=CN=CS1 SC-22113 [0,0,0,1,0,0|2,0,1]=4 131 B8R1.7 O=C(O)C1=CN=NN1 SC-14701 [0,0,0,1,0,0|3,0,0]=4 132 B8R1.7 O=C(O)C1=CNC=C1 SC-07354 [0,0,0,1,0,0|1,0,2]=4 133 B8R1.7 O=C(O)C1=CNC=C1 SC-20168 [0,0,0,1,0,0|1,0,2]=4 134 B8R1.7 O=C(O)C1=CNC=N1 SC-00265 [0,0,0,1,0,0|2,0,1]=4 135 B8R1.7 O=C(O)C1=CNN=C1 SC-20122 [0,0,0,1,0,0|2,0,1]=4 136 B8R1.7 O=C(O)C1=COC=C1 SC-04786 [0,0,0,1,0,0|1,0,2]=4 137 B8R1.7 O=C(O)C1=COC=N1 SC-83825 [0,0,0,1,0,0|2,0,1]=4 138 B8R1.7 O=C(O)C1=CON=C1 SC-06036 [0,0,0,1,0,0|2,0,1]=4 139 B8R1.7 O=C(O)C1=CSC=C1 SC-07139 [0,0,0,1,0,0|1,0,2]=4 140 B8R1.7 O=C(O)C1=CSC=N1 SC-92909 [0,0,0,1,0,0|2,0,1]=4 141 B8R1.7 O=C(O)C1=CSN=C1 SC-70058 [0,0,0,1,0,0|2,0,1]=4 142 B8R1.7 O=C(O)C1=CSN=N1 SC-17799 [0,0,0,1,0,0|3,0,0]=4 143 B8R1.7 O=C(O)C1=NCCC1 SC-A4966 [0,0,0,1,0,0|1,0,0]=2 144 B8R1.7 O=C(O)C1=NNC=C1 SC-20998 [0,0,0,1,0,0|2,0,1]=4 145 B8R1.7 O=C(O)C1=NOC=C1 SC-12936 [0,0,0,1,0,0|2,0,1]=4 146 B8R1.7 O=C(O)C1=NSC=C1 SC-82581 [0,0,0,1,0,0|2,0,1]=4 147 B8R1.7 O=C(O)C1C=CCC1 SC-25940 [0,0,0,1,0,0|0,0,2]=3 148 B8R1.7 O=C(O)C1C=CCN1 SC-50874 [0,0,0,1,0,0|1,0,2]=4 149 B8R1.7 O=C(O)C1CCCC1 SC-18675 [0,0,0,1,0,0|0,0,2]=3 150 B8R1.7 O=C(O)C1CCCO1 SC-A4307 [0,0,0,1,0,0|1,0,1]=3 151 B8R1.7 O=C(O)C1CCCS1 SC-12921 [0,0,0,1,0,0|1,0,1]=3 152 B8R1.7 O=C(O)C1CCOC1 SC-21248 [0,0,0,1,0,0|1,0,2]=4 153 B8R1.7 O=C(O)[C@@H]1C=CCN1 SC-21522 [0,0,0,1,0,0|1,0,2]=4 154 B8R1.7 O=C(O)[C@@H]1CCCN1 SC-09806 [0,0,0,1,0,0|1,0,1]=3 155 B8R1.7 O=C(O)[C@@H]1CCCO1 SC-07093 [0,0,0,1,0,0|1,0,1]=3 156 B8R1.7 O=C(O)[C@@H]1CCNC1 SC-48463 [0,0,0,1,0,0|1,0,2]=4 157 B8R1.7 O=C(O)[C@@H]1CCOC1 SC-25192 [0,0,0,1,0,0|1,0,2]=4 158 B8R1.7 O=C(O)[C@@H]1CSCN1 SC-77532 [0,0,0,1,0,0|2,0,1]=4 159 B8R1.7 O=C(O)[C@H]1C=CCN1 SC-52280 [0,0,0,1,0,0|1,0,2]=4 160 B8R1.7 O=C(O)[C@H]1CCCO1 SC-07092 [0,0,0,1,0,0|1,0,1]=3 161 B8R1.7 O=C(O)[C@H]1CCNC1 SC-25206 [0,0,0,1,0,0|1,0,2]=4 162 B8R1.7 O=C(O)[C@H]1CCOC1 SC-25181 [0,0,0,1,0,0|1,0,2]=4 163 B8R1.7 OB(O)C1=CCCC1 SC-53221 [0,0,0,1,0,0|1,0,1]=3 164 B8R1.7 OC(=S)[C@H]1CCCO1 SC-28168 [0,0,0,1,0,0|1,1,1]=4 165 B8R1.7 [C@@H]1(C(N)=O)CCCN1 SC-09818 [0,0,0,1,0,0|2,0,1]=4 166 B8R1.7 [C@H]1(C(=O)O)CCNC1 SC-48462 [0,0,0,1,0,0|1,0,2]=4 167 B8R1.7 [C@H]1(C(N)=O)CCCN1 SC-13550 [0,0,0,1,0,0|2,0,1]=4 168 B8R1.22 O=C1C=CCCCC1 SC-99582 [0,0,0,1,0,0|1,0,0]=2 169 B8R1.22 O=C1C=CCCCN1 SC-50475 [0,0,0,1,0,0|1,0,0]=2 170 B8R1.22 O=C1CNCCCN1 SC-21981 [0,0,0,1,0,0|2,0,1]=4 171 B8R1.34 O=C(O)C=C1CCC1 SC-67620 [0,0,0,1,0,0|0,0,0]=1 172 B8R1.34 O=C(O)CC1CCC1 SC-26391 [0,0,0,1,0,0|0,0,2]=3 173 B8R1.34 O=C(O)CC1COC1 SC-70807 [0,0,0,1,0,0|1,0,2]=4 174 B8R1.34 O=C(O)CN1CCC1 SC-A4384 [0,0,0,1,0,0|1,0,1]=3 175 B8R1.35 O=C(O)CCC1CC1 SC-31428 [0,0,0,1,0,0|0,0,2]=3 176 B8R1.35 O=C(O)\C=C\C1CC1 SC-39438 [0,0,0,1,0,0|0,0,0]=1 177 B5R0.1 C#CCC(=O)O SC-40344 [2,0,0,0,0,0|0,0,2]=4 178 B5R0.1 C=CCC(=O)O SC-49093 [2,0,0,0,0,0|0,0,2]=4 179 B5R0.1 CC#CC(=O)O SC-76460 [2,0,0,0,0,0|0,0,2]=4 180 B5R0.1 CC(=O)CCCl SC-21586 [2,0,0,0,0,0|2,0,0]=4 181 B5R0.1 CC(=O)CCO SC-65678 [2,0,0,0,0,0|2,0,0]=4 182 B5R0.1 CCCB(O)O SC-47544 [2,0,0,0,0,0|1,0,1]=4 183 B5R0.1 CCCC(=N)N SC-19347 [2,0,0,0,0,0|2,0,0]=4 184 B5R0.1 CCCC(=O)[O-] SC-15718 [2,0,0,0,0,0|0,0,1]=3 185 B5R0.1 CCCC(C)O SC-03320 [2,0,0,0,0,0|1,0,1]=4 186 B5R0.1 CNCC(N)=O SC-10429 [2,0,0,0,0,0|2,0,0]=4 187 B5R0.1 COCC(=O)Cl SC-27381 [2,0,0,0,0,0|2,0,0]=4 188 B5R0.1 CSCC(N)=O SC-27108 [2,0,0,0,0,0|2,0,0]=4 189 B5R0.1 C\C=C/C(C)=O SC-48085 [2,0,0,0,0,0|1,0,0]=3 190 B5R0.1 C\C=C\B(O)O SC-15014 [2,0,0,0,0,0|1,0,1]=4 191 B5R0.1 C\C=C\C(=O)Cl SC-16256 [2,0,0,0,0,0|1,0,0]=3 192 B5R0.1 C\C=C\C(=O)O SC-25924 [2,0,0,0,0,0|0,0,0]=2 193 B5R0.1 C\C=C\[N+](=O)[O-] SC-65946 [2,0,0,0,0,0|1,0,1]=4 194 B5R0.1 NCCC(N)=O SC-48688 [2,0,0,0,0,0|2,0,0]=4 195 B5R0.1 NCCC(N)=O SC-84499 [2,0,0,0,0,0|2,0,0]=4 196 B5R0.1 O=C(Cl)CCCl SC-16310 [2,0,0,0,0,0|2,0,0]=4 197 B5R0.1 O=C(O)CCF SC-53145 [2,0,0,0,0,0|1,0,0]=3 198 B5R0.1 O=C(O)CCS SC-22642 [2,0,0,0,0,0|1,0,0]=3 199 B5R0.2 C=CCCCBr SC-47340 [2,0,0,0,0,0|1,0,1]=4 200 B5R0.2 C=CCCCN SC-28944 [2,0,0,0,0,0|1,0,1]=4 201 B5R0.2 C=CCCCN SC-91892 [2,0,0,0,0,0|1,0,1]=4 202 B5R0.2 C=CCCCO SC-78424 [2,0,0,0,0,0|1,0,1]=4 203 B5R0.2 C=COCCC SC-13613 [2,0,0,0,0,0|1,0,0]=3 204 B5R0.2 COCCC=O SC-85357 [2,0,0,0,0,0|1,0,1]=4 205 B5R0.2 NC\C=C\CO SC-22303 [2,0,0,0,0,0|1,0,1]=4 206 B5R0.2 O=CCCCBr SC-69595 [2,0,0,0,0,0|1,0,1]=4 207 B5R0.2 OC\C=C/CO SC-27134 [2,0,0,0,0,0|1,0,1]=4 208 B5R0.2 OC\C=C\CBr SC-36162 [2,0,0,0,0,0|1,0,1]=4 209 B7R0.2 CCC(=O)OC(C)=O SC-96821 [1,1,0,0,0,0|2,0,0]=4 210 B7R0.2 CCC(C)OC(=O)Cl SC-69084 [1,1,0,0,0,0|2,0,0]=4 211 B7R0.2 CCC(N)CC(=O)O SC-59260 [1,1,0,0,0,0|0,0,1]=3 212 B7R0.2 CCC(O)CC(C)=O SC-92943 [1,1,0,0,0,0|1,0,1]=4 213 B7R0.2 COC(=O)CC(=O)O SC-21351 [1,1,0,0,0,0|1,0,1]=4 214 B7R0.2 NCC(O)CC(=O)O SC-50844 [1,1,0,0,0,0|1,0,1]=4 215 B7R0.2 NC[C@@H](O)CC(=O)O SC-04302 [1,1,0,0,0,0|1,0,1]=4 216 B7R0.2 N[C@H](CO)CC(=O)O SC-72100 [1,1,0,0,0,0|1,0,1]=4 217 B7R0.3 CCCCC(=O)NN SC-59745 [1,1,0,0,0,0|1,0,1]=4 218 B7R0.3 CC\C=C\C(=O)OC SC-62851 [1,1,0,0,0,0|0,0,0]=2 219 B7R0.3 COC(=O)CCCBr SC-46963 [1,1,0,0,0,0|1,0,1]=4 220 B7R0.3 COC(=O)CCCO SC-43794 [1,1,0,0,0,0|1,0,1]=4 221 B7R0.3 COC(=O)\C=C\CBr SC-17676 [1,1,0,0,0,0|1,0,0]=3 222 B7R0.3 COC(=O)\C=C\CBr SC-49570 [1,1,0,0,0,0|1,0,0]=3 223 B7R0.3 COCCC(=O)OC SC-46379 [1,1,0,0,0,0|1,0,1]=4 224 B7R0.3 CO\C=C\C(=O)OC SC-62260 [1,1,0,0,0,0|1,0,0]=3 225 B7R0.3 CO\C=C\C(=O)OC SC-90792 [1,1,0,0,0,0|1,0,0]=3 226 B7R0.5 CCCC(Br)C(=O)O SC-27020 [1,1,0,0,0,0|0,0,1]=3 227 B7R0.5 CCC[C@@H](C)C(=O)O SC-43566 [1,1,0,0,0,0|0,0,1]=3 228 B7R0.5 CCC[C@H](C)C(=O)O SC-67603 [1,1,0,0,0,0|0,0,1]=3 229 B7R0.5 CCC[C@H](N)C(=O)O SC-06139 [1,1,0,0,0,0|0,0,1]=3 230 B7R0.5 CCC[C@H](O)C(=O)O SC-21948 [1,1,0,0,0,0|0,0,1]=3 231 B7R0.5 CCOC(=O)C(=O)Cl SC-26882 [1,1,0,0,0,0|2,0,0]=4 232 B7R0.5 CCOC(=O)C(=O)O SC-26569 [1,1,0,0,0,0|1,0,0]=3 233 B7R0.5 CCOC(=O)C(=O)[O-] SC-73549 [1,1,0,0,0,0|1,0,1]=4 234 B7R0.5 CCOC(=O)C(C)=O SC-15232 [1,1,0,0,0,0|2,0,0]=4 235 B7R0.5 CCOC(=O)C(N)=O SC-20979 [1,1,0,0,0,0|2,0,0]=4 236 B7R0.5 CC\C=C(/C)C(=O)O SC-62297 [1,1,0,0,0,0|0,0,0]=2 237 B7R0.5 COCC(N)C(=O)O SC-43930 [1,1,0,0,0,0|1,0,1]=4 238 B7R0.5 COC[C@@H](N)C(=O)O SC-44175 [1,1,0,0,0,0|1,0,1]=4 239 B7R0.5 COC[C@@H](N)C(=O)O SC-52821 [1,1,0,0,0,0|1,0,1]=4 240 B7R0.5 COC[C@H](N)C(=O)O SC-26107 [1,1,0,0,0,0|1,0,1]=4 241 B7R0.5 COC[C@H](N)C(=O)O SC-47929 [1,1,0,0,0,0|1,0,1]=4 242 B7R0.5 NC(CCO)C(=O)O SC-10290 [1,1,0,0,0,0|1,0,1]=4 243 B7R0.5 NCCC(N)C(=O)O SC-10146 [1,1,0,0,0,0|1,0,1]=4 244 B7R0.5 NCCC(N)C(=O)O SC-20723 [1,1,0,0,0,0|1,0,1]=4 245 B7R0.5 NCCC(N)C(=O)O SC-23452 [1,1,0,0,0,0|1,0,1]=4 246 B7R0.5 NCCC(N)C(=O)O SC-25055 [1,1,0,0,0,0|1,0,1]=4 247 B7R0.5 NCCC(O)C(=O)O SC-16245 [1,1,0,0,0,0|1,0,1]=4 248 B7R0.5 NCC[C@@H](O)C(=O)O SC-26595 [1,1,0,0,0,0|1,0,1]=4 249 B7R0.5 NCC[C@H](N)C(=O)O SC-10144 [1,1,0,0,0,0|1,0,1]=4 250 B7R0.5 N[C@@H](CCO)C(=O)O SC-10291 [1,1,0,0,0,0|1,0,1]=4 251 B7R0.5 OCC\C(Br)=C(\O)Br SC-19489 [1,1,0,0,0,0|2,0,0]=4 252 B7R0.6 C=C(C)CCC(=O)O SC-31541 [1,1,0,0,0,0|0,0,2]=4 253 B7R0.6 CC(=O)\C=C\C(=O)O SC-94119 [1,1,0,0,0,0|0,0,1]=3 254 B7R0.6 CC(=O)\C=C\N(C)C SC-92543 [1,1,0,0,0,0|2,0,0]=4 255 B7R0.6 CC(C)CCC(=O)O SC-57917 [1,1,0,0,0,0|0,0,1]=3 256 B7R0.6 CC(C)OCC(=O)O SC-88240 [1,1,0,0,0,0|1,0,1]=4 257 B7R0.6 CC(Cl)CCC(=O)Cl SC-74180 [1,1,0,0,0,0|1,0,1]=4 258 B7R0.6 CN(C)CCC(=O)O SC-84721 [1,1,0,0,0,0|1,0,1]=4 259 B7R0.6 CN(C)CCC(=O)O SC-84792 [1,1,0,0,0,0|1,0,1]=4 260 B7R0.6 CN(C)CCC(=O)O SC-98010 [1,1,0,0,0,0|1,0,1]=4 261 B7R0.6 C[C@@H](O)COC(=O)O SC-01561 [1,1,0,0,0,0|1,0,0]=3 262 B7R0.1 O=CCCCCCO SC-94633 [1,1,0,0,0,0|0,0,2]=4 263 B7R0.1 OCC\C=C\CCO SC-85734 [1,1,0,0,0,0|1,0,1]=4 264 B7R0.7 CCOC(=O)CC=O SC-14726 [1,1,0,0,0,0|1,0,1]=4 265 B7R0.7 CCOC(=O)\C=C\[O-] SC-71247 [1,1,0,0,0,0|1,0,1]=4 266 B9R0.4 CCCC[C@@H](C)CC(=O)O SC-52448 [0,2,0,0,0,0|0,0,2]=4 267 B9R0.4 CCCOC(=O)CC(C)=O SC-65215 [0,2,0,0,0,0|1,0,1]=4 268 B9R0.6 CCCC(C)C(N)C(=O)O SC-45629 [0,2,0,0,0,0|0,0,2]=4 269 B9R0.34 CCCC(=O)CC(=O)OC SC-27187 [0,2,0,0,0,0|0,0,1]=3 270 B9R0.34 COCC(=O)CC(=O)OC SC-49499 [0,2,0,0,0,0|1,0,1]=4 271 B9R0.53 CC(C)C[C@H](N)CC(=O)O SC-26176 [0,2,0,0,0,0|0,0,2]=4 272 B9R0.53 CC(C)OC(=O)CC(=O)O SC-31951 [0,2,0,0,0,0|1,0,1]=4 273 B9R0.58 CCCS(=O)(=O)CC(=O)O SC-38522 [0,2,0,0,0,0|1,0,1]=4 274 B9R0.5 CCC\C=C\C(=O)OCC SC-49613 [0,2,0,0,0,0|0,0,0]=2 275 B9R0.5 CCO\C=C\C(=O)OCC SC-24996 [0,2,0,0,0,0|1,0,0]=3 276 B9R0.5 CCO\C=C\C(=O)OCC SC-A2733 [0,2,0,0,0,0|1,0,0]=3 277 B9R0.46 COC(=O)CCCCCBr SC-02787 [0,2,0,0,0,0|0,0,2]=4 278 B9R0.46 COC(=O)CCCCCN SC-B3833 [0,2,0,0,0,0|0,0,2]=4 279 B9R0.47 CCCCCC(N)C(=O)O SC-10084 [0,2,0,0,0,0|0,0,2]=4 280 B9R0.47 CCCCCC(N)C(=O)O SC-10085 [0,2,0,0,0,0|0,0,2]=4 281 B9R0.47 CCCCC[C@@H](N)C(=O)O SC-10086 [0,2,0,0,0,0|0,0,2]=4 282 B9R0.47 CCSCCC(N)C(=O)O SC-10254 [0,2,0,0,0,0|0,0,2]=4 283 B9R0.47 CC[Se]CCC(N)C(=O)O SC-69852 [0,2,0,0,0,0|0,0,2]=4 284 B9R0.47 COCCC[C@@H](N)C(=O)O SC-49289 [0,2,0,0,0,0|0,0,2]=4 285 B9R0.47 CSCCC[C@@H](N)C(=O)O SC-49287 [0,2,0,0,0,0|0,0,2]=4 286 B9R0.47 NCCCCC(N)C(=O)O SC-06113 [0,2,0,0,0,0|0,0,2]=4 287 B9R0.47 NCCCCC(N)C(=O)O SC-09671 [0,2,0,0,0,0|0,0,2]=4 288 B9R0.47 NCCCCC(N)C(=O)O SC-19760 [0,2,0,0,0,0|0,0,2]=4 289 B9R0.47 NCCCCC(N)C(=O)O SC-20502 [0,2,0,0,0,0|0,0,2]=4 290 B9R0.47 NCCCC[C@H](N)C(=O)O SC-09670 [0,2,0,0,0,0|0,0,2]=4 291 B9R0.47 NCCCC[C@H](N)C(=O)O SC-22201 [0,2,0,0,0,0|0,0,2]=4 292 B9R0.47 [C@@H](N)(CCCCN)C(=O)O SC-07335 [0,2,0,0,0,0|0,0,2]=4 293 B9R0.2 C=CCCCOCC(=O)O SC-34349 [0,2,0,0,0,0|1,0,1]=4 294 B9R0.2 CCCCCCCC(=O)O SC-22580 [0,2,0,0,0,0|0,0,2]=4 295 B9R0.2 CCCCCCCC(=O)O SC-27437 [0,2,0,0,0,0|0,0,2]=4 296 B9R0.2 NCCCCCCC(=O)O SC-10087 [0,2,0,0,0,0|0,0,2]=4 297 B9R0.2 NCCCCCCC(=O)O SC-52825 [0,2,0,0,0,0|0,0,2]=4 298 B9R0.2 O=C(O)CCCCCCBr SC-03639 [0,2,0,0,0,0|0,0,2]=4 299 B9R0.2 O=C(O)CCCCCCO SC-53796 [0,2,0,0,0,0|0,0,2]=4 300 B9R0.48 CCOC(=O)CCC(=O)O SC-48671 [0,2,0,0,0,0|1,0,1]=4 301 B9R0.48 CCOC(=O)\C=C\C(=O)O SC-17455 [0,2,0,0,0,0|0,0,1]=3 302 B9R0.55 CC(C)CCCCC(=O)O SC-47475 [0,2,0,0,0,0|0,0,2]=4 303 B9R0.55 CN(C)CCNCC(=O)O SC-48750 [0,2,0,0,0,0|1,0,1]=4 304 B9R0.55 O=C(O)\C=C\CCC(=O)O SC-66378 [0,2,0,0,0,0|0,0,1]=3 305 B9R0.7 CC(=O)C(=O)OCC(C)C SC-26296 [0,2,0,0,0,0|2,0,0]=4 306 B9R0.7 CC(C)CC[C@H](N)C(=O)O SC-93270 [0,2,0,0,0,0|0,0,2]=4 307 B9R0.13 C=C[C@@H](CCCC)C(=O)O SC-31049 [0,2,0,0,0,0|0,0,2]=4 308 B9R0.13 C=C[C@H](CCCC)C(=O)O SC-31462 [0,2,0,0,0,0|0,0,2]=4 309 B9R0.13 CCO\C=C(/C#N)C(C)=O SC-34309 [0,2,0,0,0,0|2,0,0]=4 310 B9R0.56 CC(F)(F)CCCC(=O)O SC-34273 [0,2,0,0,0,0|0,0,2]=4 311 B9R0.56 C[N+](C)(C)C\C=C/C(=O)[O-] SC-50943 [0,2,0,0,0,0|1,0,1]=4 312 B7R1.2 CC1=CC=C(Br)O1 SC-66940 [1,0,0,1,0,0|1,0,1]=4 313 B7R1.2 CC1CCC(=O)C1 SC-93748 [1,0,0,1,0,0|1,0,1]=4 314 B7R1.2 CC1CCC(=O)N1 SC-89347 [1,0,0,1,0,0|1,0,1]=4 315 B7R1.2 CC1CNC(=O)C1 SC-50248 [1,0,0,1,0,0|2,0,0]=4 316 B7R1.2 CC1CNC(=O)N1 SC-65644 [1,0,0,1,0,0|2,0,0]=4 317 B7R1.2 CC1COC(=O)C1 SC-60836 [1,0,0,1,0,0|2,0,0]=4 318 B7R1.2 CN1C=CC(=O)N1 SC-98976 [1,0,0,1,0,0|2,0,0]=4 319 B7R1.2 C[C@@H]1CCC(=O)O1 SC-65777 [1,0,0,1,0,0|0,0,1]=3 320 B7R1.2 C[C@@H]1COC(=O)C1 SC-45465 [1,0,0,1,0,0|2,0,0]=4 321 B7R1.2 C[C@@H]1COC(=O)N1 SC-43641 [1,0,0,1,0,0|2,0,0]=4 322 B7R1.2 C[C@@H]1COC(=O)N1 SC-51055 [1,0,0,1,0,0|2,0,0]=4 323 B7R1.2 C[C@H]1CCC(=O)O1 SC-86851 [1,0,0,1,0,0|0,0,1]=3 324 B7R1.2 C[C@H]1COC(=O)N1 SC-51056 [1,0,0,1,0,0|2,0,0]=4 325 B7R1.2 C[C@H]1COC(=O)O1 SC-04943 [1,0,0,1,0,0|1,0,0]=3 326 B7R1.2 O=C1C=CC(Cl)O1 SC-69817 [1,0,0,1,0,0|1,0,0]=3 327 B7R1.2 O=C1CCC(Cl)O1 SC-69818 [1,0,0,1,0,0|1,0,1]=4 328 B7R1.2 O=C1OCC(F)O1 SC-19199 [1,0,0,1,0,0|2,0,0]=4 329 B7R1.3 BrC1=CCCCC1 SC-69986 [1,0,0,1,0,0|2,0,0]=4 330 B7R1.3 CC1=CCCCC1 SC-99243 [1,0,0,1,0,0|2,0,0]=4 331 B7R1.3 O=C1C=CCCN1 SC-25185 [1,0,0,1,0,0|1,0,0]=3 332 B7R1.3 O=C1CCCCN1 SC-16274 [1,0,0,1,0,0|1,0,1]=4 333 B7R1.3 O=C1CCCCO1 SC-65111 [1,0,0,1,0,0|0,0,1]=3 334 B7R1.3 O=C1CNCCO1 SC-84883 [1,0,0,1,0,0|1,0,1]=4 335 B7R1.3 OC1C=CCCC1 SC-21514 [1,0,0,1,0,0|1,0,1]=4 336 B7R1.7 CC\C=C\[C@H]1CO1 SC-A2838 [1,0,0,1,0,0|1,0,1]=4 337 B7R1.12 CC1CC1C(=O)Cl SC-60998 [1,0,0,1,0,0|1,0,1]=4 338 B7R1.12 CC1CC1C(=O)O SC-71058 [1,0,0,1,0,0|0,0,1]=3 339 B7R1.12 O=C(O)C1CC1F SC-85228 [1,0,0,1,0,0|1,0,1]=4 340 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F SC-83847 [1,0,0,1,0,0|1,0,1]=4 341 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F SC-A4679 [1,0,0,1,0,0|1,0,1]=4 342 B7R1.12 O=C(O)[C@H]1C[C@H]1F SC-72913 [1,0,0,1,0,0|1,0,1]=4 343 B7R1.18 CC(=O)C1CCC1 SC-74316 [1,0,0,1,0,0|1,0,1]=4 344 B7R1.18 O=C(Cl)C1CCC1 SC-46657 [1,0,0,1,0,0|1,0,1]=4 345 B7R1.18 O=C(O)C1CCC1 SC-17776 [1,0,0,1,0,0|0,0,1]=3 346 B7R1.18 O=C(O)C1CCN1 SC-53260 [1,0,0,1,0,0|1,0,1]=4 347 B7R1.18 O=C(O)C1CCO1 SC-22549 [1,0,0,1,0,0|1,0,1]=4 348 B7R1.18 O=C(O)C1COC1 SC-48326 [1,0,0,1,0,0|1,0,1]=4 349 B7R1.18 O=C(O)[C@H]1CCN1 SC-24616 [1,0,0,1,0,0|1,0,1]=4 350 B7R1.20 CC(=O)CC1CC1 SC-21396 [1,0,0,1,0,0|1,0,1]=4 351 B7R1.20 NC(=O)NC1CC1 SC-84633 [1,0,0,1,0,0|2,0,0]=4 352 B7R1.20 O=C(O)CC1CC1 SC-13938 [1,0,0,1,0,0|0,0,1]=3 353 B7R1.1 CCN1C=CC=N1 SC-28162 [1,0,0,1,0,0|2,0,0]=4 354 B7R1.1 CC[C-]1C=CC=C1 SC-49908 [1,0,0,1,0,0|1,0,1]=4 355 B7R1.1 CNC1=CC=CO1 SC-51291 [1,0,0,1,0,0|1,0,1]=4 356 B7R1.1 COC1=CC=CO1 SC-21425 [1,0,0,1,0,0|1,0,1]=4 357 B7R1.1 N#CC1=CCCC1 SC-50518 [1,0,0,1,0,0|1,0,1]=4 358 B7R1.1 O=CC1CCCC1 SC-21778 [1,0,0,1,0,0|0,0,2]=4 359 B7R1.1 O=CC1CCCC1 SC-44728 [1,0,0,1,0,0|0,0,2]=4 360 B7R1.4 CC1CCCC1=O SC-89605 [1,0,0,1,0,0|0,0,2]=4 361 B7R1.4 CC1CCNC1=O SC-21672 [1,0,0,1,0,0|1,0,1]=4 362 B7R1.4 CC1CCOC1=O SC-20996 [1,0,0,1,0,0|1,0,1]=4 363 B7R1.4 CN1N=CC=C1O SC-91361 [1,0,0,1,0,0|2,0,0]=4 364 B7R1.4 CN1SC=CC1=O SC-16032 [1,0,0,1,0,0|2,0,0]=4 365 B9R1.7 CCCC1=CC=C(Br)O1 SC-69515 [0,1,0,1,0,0|1,0,0]=3 366 B9R1.7 CCCC1=CC=C(Br)S1 SC-69538 [0,1,0,1,0,0|1,1,0]=4 367 B9R1.7 CCCC1CCC(=O)O1 SC-52458 [0,1,0,1,0,0|0,0,2]=4 368 B9R1.13 O=C(O)C=C1CCCC1 SC-36663 [0,1,0,1,0,0|0,0,0]=2 369 B9R1.13 O=C(O)CC1CCCN1 SC-49134 [0,1,0,1,0,0|0,0,2]=4 370 B9R1.13 O=C(O)CC1CCCN1 SC-70978 [0,1,0,1,0,0|0,0,2]=4 371 B9R1.13 O=C(O)CC1CCNC1 SC-48282 [0,1,0,1,0,0|0,0,2]=4 372 B9R1.13 O=C(O)CC1CCNC1 SC-53663 [0,1,0,1,0,0|0,0,2]=4 373 B9R1.13 O=C(O)CN1CCCC1 SC-69994 [0,1,0,1,0,0|0,0,2]=4 374 B9R1.13 O=C(O)C[C@@H]1CCCN1 SC-86132 [0,1,0,1,0,0|0,0,2]=4 375 B9R1.34 CC1=CC(O)=CC(=O)O1 SC-53888 [0,1,0,1,0,0|0,0,2]=4 376 B9R1.34 CC1CC(=O)CC(=O)C1 SC-26551 [0,1,0,1,0,0|1,0,1]=4 377 B9R1.34 CC1CC(=O)OC(=O)C1 SC-68133 [0,1,0,1,0,0|2,0,0]=4 378 B9R1.34 CC1CC(O)=CC(=O)O1 SC-53500 [0,1,0,1,0,0|0,0,0]=2 379 B9R1.41 CC1=C(C(=O)O)C=CS1 SC-65867 [0,1,0,1,0,0|0,0,2]=4 380 B9R1.41 CC1=C(C(=O)O)C=NO1 SC-04454 [0,1,0,1,0,0|1,0,1]=4 381 B9R1.41 CC1=C(C(=O)O)N=CN1 SC-03838 [0,1,0,1,0,0|1,0,1]=4 382 B9R1.41 CC1=C(C(=O)O)N=CO1 SC-49411 [0,1,0,1,0,0|1,0,1]=4 383 B9R1.41 CC1=C(C(=O)O)N=CS1 SC-43511 [0,1,0,1,0,0|1,0,1]=4 384 B9R1.41 CC1=C(C(=O)O)NC=C1 SC-55368 [0,1,0,1,0,0|0,0,2]=4 385 B9R1.41 CC1=C(C(=O)O)OC=C1 SC-21785 [0,1,0,1,0,0|0,0,2]=4 386 B9R1.41 CC1=NNC=C1C(=O)O SC-53982 [0,1,0,1,0,0|1,0,1]=4 387 B9R1.41 CC1=NOC=C1C(=O)O SC-25323 [0,1,0,1,0,0|1,0,1]=4 388 B9R1.41 CN1C=CC=C1C(=O)O SC-46120 [0,1,0,1,0,0|0,0,2]=4 389 B9R1.41 CN1C=CN=C1C(=O)O SC-02310 [0,1,0,1,0,0|1,0,1]=4 390 B9R1.41 CN1C=NC=C1C(=O)O SC-21088 [0,1,0,1,0,0|1,0,1]=4 391 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-21501 [0,1,0,1,0,0|0,0,2]=4 392 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-28867 [0,1,0,1,0,0|0,0,2]=4 393 B9R1.41 CN1CCC[C@@H]1C(=O)O SC-52270 [0,1,0,1,0,0|0,0,2]=4 394 B9R1.41 CN1CCC[C@H]1C(=O)O SC-21471 [0,1,0,1,0,0|0,0,2]=4 395 B9R1.41 CN1CCC[C@H]1C(=O)O SC-23602 [0,1,0,1,0,0|0,0,2]=4 396 B9R1.41 CN1N=CC=C1C(=O)O SC-25328 [0,1,0,1,0,0|1,0,1]=4 397 B9R1.41 CN1N=NC=C1C(=O)O SC-A4534 [0,1,0,1,0,0|2,0,0]=4 398 B9R1.41 NC1CCCC1C(=O)O SC-29667 [0,1,0,1,0,0|0,0,2]=4 399 B9R1.41 NC1CCCC1C(=O)O SC-A3650 [0,1,0,1,0,0|0,0,2]=4 400 B9R1.41 NC1CCNC1C(=O)O SC-49345 [0,1,0,1,0,0|1,0,1]=4 401 B9R1.41 NC1CCSC1C(=O)O SC-29866 [0,1,0,1,0,0|1,0,1]=4 402 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O SC-21947 [0,1,0,1,0,0|1,0,1]=4 403 B9R1.48 O=C1CCCCC(=O)C1 SC-14500 [0,1,0,1,0,0|1,0,1]=4 404 B9R1.48 O=C1CCCCC(=O)O1 SC-92931 [0,1,0,1,0,0|2,0,0]=4 405 B9R1.52 C=C1CC(N)C1C(=O)O SC-29552 [0,1,0,1,0,0|1,0,1]=4 406 B9R1.137 NC(CC(=O)O)C1CC1 SC-89968 [0,1,0,1,0,0|0,0,2]=4 407 B9R1.1 CCC1=CN=C(O)C=C1 SC-69260 [0,1,0,1,0,0|1,0,1]=4 408 B9R1.3 CN1C=CC=C(O)C1=O SC-47298 [0,1,0,1,0,0|1,0,1]=4 409 B9R1.11 COC(=O)C1=CCCC1 SC-47854 [0,1,0,1,0,0|0,0,0]=2 410 B9R1.11 COC(=O)C1CCCC1 SC-58226 [0,1,0,1,0,0|0,0,2]=4 411 B9R1.11 COC(=O)C1CCCN1 SC-01646 [0,1,0,1,0,0|1,0,1]=4 412 B9R1.11 COC(=O)C1CCCN1 SC-12256 [0,1,0,1,0,0|1,0,1]=4 413 B9R1.11 COC(=O)[C@@H]1CCCN1 SC-17303 [0,1,0,1,0,0|1,0,1]=4 414 B9R1.11 COC(=O)[C@H]1CCCN1 SC-09823 [0,1,0,1,0,0|1,0,1]=4 415 B9R1.11 COC(=O)[C@H]1CCCN1 SC-50892 [0,1,0,1,0,0|1,0,1]=4 416 B9R1.11 NNC(=O)C1=CCCC1 SC-40083 [0,1,0,1,0,0|1,0,0]=3 417 B9R1.21 CCC1=NC=C(C=O)O1 SC-32508 [0,1,0,1,0,0|1,0,1]=4 418 B9R1.21 CCN1C=CC(C=O)=N1 SC-49067 [0,1,0,1,0,0|2,0,0]=4 419 B9R1.21 O=CC1=CC=C(CO)O1 SC-22154 [0,1,0,1,0,0|1,0,1]=4 420 B9R1.79 COC(=O)CC1CCC1 SC-34808 [0,1,0,1,0,0|0,0,2]=4 421 B9R1.6 O=C(Cl)C1=CCCCC1 SC-61008 [0,1,0,1,0,0|1,0,0]=3 422 B9R1.6 O=C(O)C1=CCCCC1 SC-44267 [0,1,0,1,0,0|0,0,0]=2 423 B9R1.6 O=C(O)C1=CCCCO1 SC-26873 [0,1,0,1,0,0|0,0,0]=2 424 B9R1.6 O=C(O)C1=CCCOC1 SC-35927 [0,1,0,1,0,0|0,0,0]=2 425 B9R1.6 O=C(O)C1=CCCSC1 SC-51278 [0,1,0,1,0,0|0,0,0]=2 426 B9R1.6 O=C(O)C1=CCNCC1 SC-49604 [0,1,0,1,0,0|0,0,0]=2 427 B9R1.6 O=C(O)C1=CCNCC1 SC-49605 [0,1,0,1,0,0|0,0,0]=2 428 B9R1.6 O=C(O)C1CC=CCC1 SC-19459 [0,1,0,1,0,0|0,0,2]=4 429 B9R1.6 O=C(O)C1CC=CCC1 SC-79651 [0,1,0,1,0,0|0,0,2]=4 430 B9R1.6 O=C(O)C1CCCCO1 SC-27357 [0,1,0,1,0,0|0,0,2]=4 431 B9R1.6 O=C(O)C1CCCOC1 SC-49188 [0,1,0,1,0,0|0,0,2]=4 432 B9R1.6 O=C(O)C1CCOCC1 SC-05124 [0,1,0,1,0,0|0,0,2]=4 433 B9R1.6 O=C(O)C1CNCCN1 SC-21327 [0,1,0,1,0,0|1,0,1]=4 434 B9R1.6 O=C(O)C1CNCCO1 SC-27398 [0,1,0,1,0,0|1,0,1]=4 435 B9R1.6 O=C(O)C1CNCCS1 SC-49246 [0,1,0,1,0,0|1,0,1]=4 436 B9R1.6 O=C(O)C1CNCCS1 SC-A2935 [0,1,0,1,0,0|1,0,1]=4 437 B9R1.6 O=C(O)C1COCCN1 SC-22999 [0,1,0,1,0,0|1,0,1]=4 438 B9R1.6 O=C(O)C1COCCN1 SC-25354 [0,1,0,1,0,0|1,0,1]=4 439 B9R1.6 O=C(O)C1COCCN1 SC-27629 [0,1,0,1,0,0|1,0,1]=4 440 B9R1.6 O=C(O)C1CSCCN1 SC-47973 [0,1,0,1,0,0|1,0,1]=4 441 B9R1.6 O=C(O)N1CCSCC1 SC-33160 [0,1,0,1,0,0|1,0,1]=4 442 B9R1.6 O=C(O)[C@@H]1CC=CCC1 SC-92067 [0,1,0,1,0,0|0,0,2]=4 443 B9R1.6 O=C(O)[C@@H]1CCCNN1 SC-49631 [0,1,0,1,0,0|1,0,1]=4 444 B9R1.6 O=C(O)[C@@H]1CNCCN1 SC-08890 [0,1,0,1,0,0|1,0,1]=4 445 B9R1.6 O=C(O)[C@@H]1CSCCN1 SC-82353 [0,1,0,1,0,0|1,0,1]=4 446 B9R1.6 O=C(O)[C@H]1CC=CCC1 SC-65686 [0,1,0,1,0,0|0,0,2]=4 447 B9R1.6 O=C(O)[C@H]1CNCCN1 SC-00676 [0,1,0,1,0,0|1,0,1]=4 448 B9R1.6 O=C(O)[C@H]1CSCCN1 SC-33694 [0,1,0,1,0,0|1,0,1]=4 449 B9R1.6 OB(O)C1=CCCCC1 SC-25437 [0,1,0,1,0,0|1,0,1]=4 450 B9R1.6 OB(O)C1=CCOCC1 SC-94123 [0,1,0,1,0,0|1,0,1]=4 451 B9R1.6 [C@@H]1(C(=O)O)CCCNC1 SC-02884 [0,1,0,1,0,0|0,0,2]=4 452 B9R1.6 [C@H]1(C(=O)O)CCCNC1 SC-05572 [0,1,0,1,0,0|0,0,2]=4 453 B9R1.84 O=C(O)CCC1CCC1 SC-30968 [0,1,0,1,0,0|0,0,2]=4 454 B9R1.84 O=C(O)CNC1CCC1 SC-53570 [0,1,0,1,0,0|0,0,2]=4 455 B9R1.84 O=C(O)\C=C\C1CCC1 SC-14219 [0,1,0,1,0,0|0,0,0]=2 456 B9R1.35 CC1=CC=C(C(=O)O)N1 SC-94836 [0,1,0,1,0,0|0,0,2]=4 457 B9R1.35 CC1=CC=C(C(=O)O)O1 SC-20513 [0,1,0,1,0,0|0,0,2]=4 458 B9R1.35 CC1=CC=C(C(=O)O)S1 SC-02082 [0,1,0,1,0,0|0,0,2]=4 459 B9R1.35 CC1=NC(C(=O)O)=CN1 SC-48423 [0,1,0,1,0,0|1,0,1]=4 460 B9R1.35 CC1=NC(C(=O)O)=CO1 SC-30359 [0,1,0,1,0,0|1,0,1]=4 461 B9R1.35 CC1=NC(C(=O)O)=CO1 SC-66016 [0,1,0,1,0,0|1,0,1]=4 462 B9R1.35 CC1=NC(C(=O)O)=CS1 SC-27449 [0,1,0,1,0,0|1,0,1]=4 463 B9R1.35 CC1=NC=C(C(=O)O)O1 SC-43630 [0,1,0,1,0,0|1,0,1]=4 464 B9R1.35 CC1=NC=C(C(=O)O)S1 SC-31817 [0,1,0,1,0,0|1,0,1]=4 465 B9R1.35 CN1C=C(C(=O)O)C=N1 SC-52446 [0,1,0,1,0,0|2,0,0]=4 466 B9R1.35 CN1C=CC(C(=O)O)=C1 SC-04203 [0,1,0,1,0,0|1,0,1]=4 467 B9R1.35 CN1C=CC(C(=O)O)=N1 SC-48405 [0,1,0,1,0,0|1,0,1]=4 468 B9R1.35 NC1C=C(C(=O)O)CC1 SC-51450 [0,1,0,1,0,0|0,0,0]=2 469 B9R1.35 NC1CCC(C(=O)O)C1 SC-62151 [0,1,0,1,0,0|0,0,2]=4 470 B9R1.35 NC1COC(C(=O)O)C1 SC-97560 [0,1,0,1,0,0|1,0,1]=4 471 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 SC-82495 [0,1,0,1,0,0|0,0,2]=4 472 B9R1.35 N[C@@H]1CC[C@@H](C(=O)O)C1 SC-93696 [0,1,0,1,0,0|0,0,2]=4 473 B9R1.35 N[C@@H]1CC[C@H](C(=O)O)C1 SC-93674 [0,1,0,1,0,0|0,0,2]=4 474 B9R1.35 N[C@H]1C=C[C@@H](C(=O)O)C1 SC-95196 [0,1,0,1,0,0|0,0,2]=4 475 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 SC-52614 [0,1,0,1,0,0|0,0,2]=4 476 B9R1.35 N[C@H]1CC[C@@H](C(=O)O)C1 SC-69232 [0,1,0,1,0,0|0,0,2]=4 477 B9R1.35 N[C@H]1CN[C@H](C(=O)O)C1 SC-24076 [0,1,0,1,0,0|1,0,1]=4 478 B9R1.35 O=C(O)C1CC(O)CN1 SC-03594 [0,1,0,1,0,0|1,0,1]=4 479 B9R1.35 O=C(O)C1CC(O)CN1 SC-09594 [0,1,0,1,0,0|1,0,1]=4 480 B9R1.35 O=C(O)C1CC(O)CN1 SC-29014 [0,1,0,1,0,0|1,0,1]=4 481 B9R1.35 O=C(O)[C@@H]1C[C@@H](F)CN1 SC-89720 [0,1,0,1,0,0|1,0,1]=4 482 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CN1 SC-52573 [0,1,0,1,0,0|1,0,1]=4 483 B9R1.35 O=C(O)[C@@H]1C[C@H](O)CO1 SC-66730 [0,1,0,1,0,0|1,0,1]=4 484 B9R1.35 O=C(O)[C@H]1CC[C@@H](O)C1 SC-48116 [0,1,0,1,0,0|0,0,2]=4 485 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SC-48740 [0,1,0,1,0,0|1,0,1]=4 486 B9R1.35 O=C(O)[C@H]1C[C@H](O)CN1 SC-52422 [0,1,0,1,0,0|1,0,1]=4 487 B9R1.110 NC(C(=O)O)C1CCC1 SC-94779 [0,1,0,1,0,0|0,0,2]=4 488 B9R1.112 C[C@H](NC1CC1)C(=O)O SC-11115 [0,1,0,1,0,0|1,0,1]=4 489 B9R1.112 C[C@H](NC1CC1)C(=O)O SC-11116 [0,1,0,1,0,0|1,0,1]=4 490 B9R1.112 NC(CC1CC1)C(=O)O SC-60891 [0,1,0,1,0,0|0,0,2]=4 491 B9R1.112 NC(CC1CC1)C(=O)O SC-A4366 [0,1,0,1,0,0|0,0,2]=4 492 B9R1.112 N[C@@H](CC1CC1)C(=O)O SC-20866 [0,1,0,1,0,0|0,0,2]=4 493 B9R1.163 CC1(C(=O)O)CCCC1 SC-26150 [0,1,0,1,0,0|0,0,2]=4 494 B9R1.163 C[C@]1(C(=O)O)CCCN1 SC-87593 [0,1,0,1,0,0|1,0,1]=4 495 B9R1.163 NC1(C(=O)O)CCCC1 SC-11054 [0,1,0,1,0,0|0,0,2]=4 496 B9R1.163 O=C(O)C1(O)CCCC1 SC-A3517 [0,1,0,1,0,0|0,0,2]=4