0 B7R0.7 C#CCC(N)COC CS-0216036 [0,0,0,0,0,0|3,0,1]=4 1 B7R0.7 CCCC(=N)OCC CS-0124516 [0,0,0,0,0,0|3,0,1]=4 2 B7R0.7 CCCC(C)CCO CS-0216041 [0,0,0,0,0,0|1,0,0]=1 3 B7R0.7 CCCC(C)SC#N CS-0590759 [0,0,0,0,0,0|3,0,1]=4 4 B7R0.7 CCCC(N)CCC CS-0206199 [0,0,0,0,0,0|2,0,0]=2 5 B7R0.7 CCCC(O)CCN CS-0241763 [0,0,0,0,0,0|1,1,0]=2 6 B7R0.7 CCCC(O)CNC CS-0237618 [0,0,0,0,0,0|2,1,0]=3 7 B7R0.7 CCC\C(C)=C\CO CS-0258444 [0,0,0,0,0,0|1,0,2]=3 8 B7R0.7 CCOC(=O)CCN CS-0343396 [0,0,0,0,0,0|2,1,1]=4 9 B7R0.7 CCOC(C)CCO CS-0523568 [0,0,0,0,0,0|2,0,0]=2 10 B7R0.7 CN(CCO)CCO CS-0510507 [0,0,0,0,0,0|3,0,0]=3 11 B7R0.7 CNCC(C)CCO CS-0239160 [0,0,0,0,0,0|2,0,0]=2 12 B7R0.7 COCC(N)CCO CS-0217710 [0,0,0,0,0,0|2,0,0]=2 13 B7R0.7 CSCC(N)CCO CS-0262815 [0,0,0,0,0,0|2,0,0]=2 14 B7R0.7 O=C(CCO)CCO CS-0139423 [0,0,0,0,0,0|1,1,1]=3 15 B6R0.1 C=CCC(N)CC CS-0538746 [1,0,0,0,0,0|1,0,2]=4 16 B6R0.1 C=CCC(O)CC CS-0238036 [1,0,0,0,0,0|0,1,2]=4 17 B6R0.1 C=CC[C@H](N)CO CS-0325766 [1,0,0,0,0,0|1,0,2]=4 18 B6R0.1 CCC(Br)COC CS-0231861 [1,0,0,0,0,0|2,0,0]=3 19 B6R0.1 CCC(C)CCCl CS-0257596 [1,0,0,0,0,0|2,0,0]=3 20 B6R0.1 CCC(N)CCO CS-0757410 [1,0,0,0,0,0|1,0,0]=2 21 B6R0.1 CCC(O)CCN CS-0252993 [1,0,0,0,0,0|1,1,0]=3 22 B6R0.1 CCC(O)CCO CS-0224666 [1,0,0,0,0,0|0,1,0]=2 23 B6R0.1 CCC(O)CNN CS-0739636 [1,0,0,0,0,0|2,1,0]=4 24 B6R0.1 CCCC(=N)NO CS-0208544 [1,0,0,0,0,0|2,0,1]=4 25 B6R0.1 CCCC(=O)CO CS-0239089 [1,0,0,0,0,0|0,1,1]=3 26 B6R0.1 CCCC(=O)SC CS-0323899 [1,0,0,0,0,0|1,1,1]=4 27 B6R0.1 CCCC(Br)CC CS-0320329 [1,0,0,0,0,0|1,0,0]=2 28 B6R0.1 CCCC(C)CBr CS-0296949 [1,0,0,0,0,0|2,0,0]=3 29 B6R0.1 CCCC(C)CCl CS-0621759 [1,0,0,0,0,0|2,0,0]=3 30 B6R0.1 CCCC(N)CC CS-0714492 [1,0,0,0,0,0|1,0,0]=2 31 B6R0.1 CCNC(C)CC CS-0441021 [1,0,0,0,0,0|2,0,0]=3 32 B6R0.1 CCOC(C)CN CS-0148791 [1,0,0,0,0,0|3,0,0]=4 33 B6R0.1 CCS(=O)CCN CS-0299668 [1,0,0,0,0,0|2,1,0]=4 34 B6R0.1 CNCC(C)CN CS-0443116 [1,0,0,0,0,0|3,0,0]=4 35 B6R0.1 CNCC(C)CO CS-0263897 [1,0,0,0,0,0|2,0,0]=3 36 B6R0.1 CN[C@@H](C)CCO CS-0802797 [1,0,0,0,0,0|2,0,0]=3 37 B6R0.1 CN[C@H](C)CCO CS-0858605 [1,0,0,0,0,0|2,0,0]=3 38 B6R0.1 COCC(N)CO CS-0091346 [1,0,0,0,0,0|2,0,0]=3 39 B6R0.1 COCC(O)CCl CS-0303388 [1,0,0,0,0,0|2,1,0]=4 40 B6R0.1 COCC(O)CF CS-0262658 [1,0,0,0,0,0|2,1,0]=4 41 B6R0.1 COC[C@@H](O)CN CS-0509864 [1,0,0,0,0,0|2,1,0]=4 42 B6R0.1 CSC(C)CCO CS-0242025 [1,0,0,0,0,0|2,0,0]=3 43 B6R0.1 CSCC(C)CN CS-0260731 [1,0,0,0,0,0|3,0,0]=4 44 B6R0.1 CSCC(C)CO CS-0242026 [1,0,0,0,0,0|2,0,0]=3 45 B6R0.1 C[C@H](CO)CCO CS-0197580 [1,0,0,0,0,0|2,0,0]=3 46 B6R0.1 NCC(N)CCO CS-0262956 [1,0,0,0,0,0|2,0,0]=3 47 B6R0.1 NCCC(O)CO CS-0212807 [1,0,0,0,0,0|1,1,0]=3 48 B6R0.1 N[C@@H](CO)CCO CS-0091341 [1,0,0,0,0,0|2,0,0]=3 49 B6R0.1 N[C@H](CS)CCS CS-0146136 [1,0,0,0,0,0|2,1,0]=4 50 B6R0.1 O=C(CO)CCO CS-0734935 [1,0,0,0,0,0|1,1,1]=4 51 B6R0.1 OCC[C@H](O)CCl CS-0127558 [1,0,0,0,0,0|1,1,0]=3 52 B6R0.6 C#CCCSCC CS-0225448 [1,0,0,0,0,0|2,0,1]=4 53 B6R0.6 C#CCSCCO CS-0215012 [1,0,0,0,0,0|1,0,2]=4 54 B6R0.6 C=CCCCCI CS-0236133 [1,0,0,0,0,0|1,0,2]=4 55 B6R0.6 C=CCNCCO CS-0129478 [1,0,0,0,0,0|1,0,2]=4 56 B6R0.6 CC#CCCCBr CS-0244909 [1,0,0,0,0,0|1,0,2]=4 57 B6R0.6 CC#CCCCN CS-0259117 [1,0,0,0,0,0|1,0,2]=4 58 B6R0.6 CC#CCCCO CS-0047308 [1,0,0,0,0,0|0,0,2]=3 59 B6R0.6 CCCCCCN CS-1055481 [1,0,0,0,0,0|1,0,0]=2 60 B6R0.6 CCCC\C=C\I CS-0752523 [1,0,0,0,0,0|1,0,2]=4 61 B6R0.6 CCCOCCBr CS-0249030 [1,0,0,0,0,0|2,0,0]=3 62 B6R0.6 CCOCCNC CS-0742450 [1,0,0,0,0,0|3,0,0]=4 63 B6R0.6 CNCC#CCO CS-0366443 [1,0,0,0,0,0|1,0,2]=4 64 B6R0.6 CNCCCCN CS-0149907 [1,0,0,0,0,0|2,0,0]=3 65 B6R0.6 COCCCON CS-0892186 [1,0,0,0,0,0|3,0,0]=4 66 B6R0.6 CSCCCCN CS-0808415 [1,0,0,0,0,0|2,0,0]=3 67 B6R0.6 C\C=C/CCCCl CS-0622433 [1,0,0,0,0,0|1,0,2]=4 68 B6R0.6 NCCCCCS CS-0528493 [1,0,0,0,0,0|1,1,0]=3 69 B6R0.6 NCCOCCF CS-0656223 [1,0,0,0,0,0|3,0,0]=4 70 B6R0.6 NCCSCCO CS-0214940 [1,0,0,0,0,0|2,0,0]=3 71 B8R0.1 C#CCCN(C)CCO CS-0248964 [0,1,0,0,0,0|2,0,1]=4 72 B8R0.1 C=CCC(O)CCCC CS-0452194 [0,1,0,0,0,0|1,1,1]=4 73 B8R0.1 CCCC(=O)OCCO CS-0161345 [0,1,0,0,0,0|0,1,1]=3 74 B8R0.1 CCCCC(=O)CCC CS-0297336 [0,1,0,0,0,0|1,1,1]=4 75 B8R0.1 CCCCC(C)CCO CS-0752013 [0,1,0,0,0,0|1,0,0]=2 76 B8R0.1 COCC(=O)NCCO CS-0236163 [0,1,0,0,0,0|1,1,1]=4 77 B8R0.1 COCCC(C)CCBr CS-0257580 [0,1,0,0,0,0|2,0,0]=3 78 B8R0.3 CCC(=O)N(C)CCO CS-0835971 [0,1,0,0,0,0|2,0,1]=4 79 B8R0.3 CCCC(O)C(N)CO CS-0242609 [0,1,0,0,0,0|0,1,0]=2 80 B8R0.3 CCN(C)C(C)CCN CS-0316720 [0,1,0,0,0,0|3,0,0]=4 81 B8R0.3 CCOC(=O)C(C)CO CS-0264889 [0,1,0,0,0,0|1,1,1]=4 82 B8R0.3 CCOC(=O)C(F)CO CS-0239267 [0,1,0,0,0,0|1,1,1]=4 83 B8R0.3 CCOC(=O)[C@@H](N)CO CS-0087925 [0,1,0,0,0,0|1,1,1]=4 84 B8R0.5 CC(=O)CN(C)CCO CS-0357534 [0,1,0,0,0,0|2,0,1]=4 85 B8R0.5 CC(C)CC(C)CCO CS-0943719 [0,1,0,0,0,0|1,0,0]=2 86 B8R0.5 CC(C)NC(=O)CCO CS-0261267 [0,1,0,0,0,0|1,1,1]=4 87 B8R0.5 CC(CCN)CC(=O)O CS-0222610 [0,1,0,0,0,0|2,0,1]=4 88 B8R0.5 CC(O)CN(C)CCO CS-1014333 [0,1,0,0,0,0|2,0,0]=3 89 B8R0.5 CCCC(C)CC(C)=O CS-0242500 [0,1,0,0,0,0|1,0,2]=4 90 B8R0.5 CCCC(C)CC(C)O CS-0510700 [0,1,0,0,0,0|1,0,0]=2 91 B8R0.5 CCCC(N)CC(=O)O CS-0297046 [0,1,0,0,0,0|1,0,1]=3 92 B8R0.5 CCCC(O)CC(=O)O CS-0062937 [0,1,0,0,0,0|0,1,1]=3 93 B8R0.5 CCCS(=O)CC(=O)O CS-0337548 [0,1,0,0,0,0|1,1,1]=4 94 B8R0.5 CNCC(N)CC(C)C CS-0224676 [0,1,0,0,0,0|3,0,0]=4 95 B8R0.5 COCC(O)CC(C)C CS-0259076 [0,1,0,0,0,0|2,1,0]=4 96 B8R0.22 CCCC(CCO)SC CS-W013304 [0,1,0,0,0,0|0,0,0]=1 97 B8R0.22 CCN(CCN)CCO CS-0234279 [0,1,0,0,0,0|3,0,0]=4 98 B8R0.30 CCCS(=O)(=O)CCC CS-0066346 [0,1,0,0,0,0|2,1,0]=4 99 B8R0.30 CNCC(C)(C)CCO CS-0225374 [0,1,0,0,0,0|2,0,0]=3 100 B8R0.30 OCCC(F)(F)CCO CS-0180953 [0,1,0,0,0,0|2,0,0]=3 101 B8R1.4 CC1=CC(O)CCC1 CS-0328324 [0,0,0,1,0,0|1,0,2]=4 102 B8R1.4 CC1CC(N)CCO1 CS-0051836 [0,0,0,1,0,0|1,0,0]=2 103 B8R1.4 CC1CC(N)CCO1 CS-0069599 [0,0,0,1,0,0|1,0,0]=2 104 B8R1.4 CC1CC(O)CCN1 CS-0051832 [0,0,0,1,0,0|1,1,0]=3 105 B8R1.4 CC1CC(O)CCN1 CS-0057464 [0,0,0,1,0,0|1,1,0]=3 106 B8R1.4 CC1CCCC(I)C1 CS-0242653 [0,0,0,1,0,0|2,0,0]=3 107 B8R1.4 CC1CCCC(N)C1 CS-0205792 [0,0,0,1,0,0|2,0,0]=3 108 B8R1.4 CC1CCNC(C)C1 CS-0466025 [0,0,0,1,0,0|2,0,0]=3 109 B8R1.4 CC1CCOC(C)O1 CS-0455518 [0,0,0,1,0,0|2,0,0]=3 110 B8R1.4 CC1CNCC(O)C1 CS-0503711 [0,0,0,1,0,0|2,0,0]=3 111 B8R1.4 CC1CS(=O)CCN1 CS-0262267 [0,0,0,1,0,0|2,1,0]=4 112 B8R1.4 CN1CCC[C@@H](O)C1 CS-0053340 [0,0,0,1,0,0|2,0,0]=3 113 B8R1.4 C[C@@H]1CCC[C@@H](C)N1 CS-0075157 [0,0,0,1,0,0|3,0,0]=4 114 B8R1.4 C[C@@H]1C[C@@H](N)CCO1 CS-0879625 [0,0,0,1,0,0|1,0,0]=2 115 B8R1.4 C[C@@H]1C[C@H](O)CCN1 CS-0053467 [0,0,0,1,0,0|1,1,0]=3 116 B8R1.4 C[C@H]1CC(=O)CCN1 CS-0053434 [0,0,0,1,0,0|1,1,1]=4 117 B8R1.4 C[C@H]1CCCC(=O)C1 CS-0516748 [0,0,0,1,0,0|1,0,2]=4 118 B8R1.4 C[C@H]1C[C@@H](F)CCN1 CS-0500905 [0,0,0,1,0,0|2,0,0]=3 119 B8R1.4 C[C@H]1C[C@@H](O)CCN1 CS-0053413 [0,0,0,1,0,0|1,1,0]=3 120 B8R1.4 F[C@@H]1CNC[C@@H](F)C1 CS-0622918 [0,0,0,1,0,0|3,0,0]=4 121 B8R1.4 F[C@@H]1CNC[C@H](F)C1 CS-0372329 [0,0,0,1,0,0|3,0,0]=4 122 B8R1.4 F[C@H]1CNC[C@H](F)C1 CS-0187950 [0,0,0,1,0,0|3,0,0]=4 123 B8R1.4 NC1CCCC(F)C1 CS-0106921 [0,0,0,1,0,0|2,0,0]=3 124 B8R1.4 NC1CCCC(O)C1 CS-0155421 [0,0,0,1,0,0|1,0,0]=2 125 B8R1.4 NC1COCC(O)C1 CS-0050678 [0,0,0,1,0,0|2,0,0]=3 126 B8R1.4 N[C@@H]1CCC[C@@H](F)C1 CS-0047783 [0,0,0,1,0,0|2,0,0]=3 127 B8R1.4 N[C@@H]1CCC[C@@H](N)C1 CS-0110011 [0,0,0,1,0,0|2,0,0]=3 128 B8R1.4 N[C@@H]1CCC[C@H](O)C1 CS-0058728 [0,0,0,1,0,0|1,0,0]=2 129 B8R1.4 N[C@H]1CCC[C@H](O)C1 CS-0112699 [0,0,0,1,0,0|1,0,0]=2 130 B8R1.4 OC1CCCC(O)C1 CS-0135350 [0,0,0,1,0,0|0,1,0]=2 131 B8R1.4 O[C@@H]1CCC[C@@H](O)C1 CS-0135349 [0,0,0,1,0,0|0,1,0]=2 132 B8R1.4 O[C@@H]1CNC[C@@H](O)C1 CS-0782069 [0,0,0,1,0,0|1,1,0]=3 133 B8R1.4 O[C@@H]1CNC[C@H](F)C1 CS-0491292 [0,0,0,1,0,0|2,0,0]=3 134 B8R1.4 O[C@H]1CNC[C@H](O)C1 CS-0750051 [0,0,0,1,0,0|1,1,0]=3 135 B8R1.6 CCCC1CC(=O)C1 CS-0056900 [0,0,0,1,0,0|1,0,2]=4 136 B8R1.6 CCCC1CC(=O)N1 CS-0225863 [0,0,0,1,0,0|1,0,2]=4 137 B8R1.6 CCOC1CC(Cl)C1 CS-0237028 [0,0,0,1,0,0|3,0,0]=4 138 B8R1.6 CCOC1CC(O)C1 CS-0071048 [0,0,0,1,0,0|2,0,0]=3 139 B8R1.6 CCO[C@H]1C[C@@H](N)C1 CS-0049711 [0,0,0,1,0,0|3,0,0]=4 140 B8R1.6 CN1CC(CCO)C1 CS-0052322 [0,0,0,1,0,0|2,0,0]=3 141 B8R1.6 COC[C@H]1C[C@@H](N)C1 CS-0049727 [0,0,0,1,0,0|3,0,0]=4 142 B8R1.6 COC[C@H]1C[C@H](N)C1 CS-0622986 [0,0,0,1,0,0|3,0,0]=4 143 B8R1.6 NC1CN(CCO)C1 CS-0056387 [0,0,0,1,0,0|3,0,0]=4 144 B8R1.6 NCCN1CC(O)C1 CS-0309419 [0,0,0,1,0,0|3,0,0]=4 145 B8R1.6 OCCN1CC(F)C1 CS-0504730 [0,0,0,1,0,0|3,0,0]=4 146 B8R1.8 BrCCC1CCOC1 CS-0240277 [0,0,0,1,0,0|2,0,0]=3 147 B8R1.8 C#CCC1CCCN1 CS-0236064 [0,0,0,1,0,0|2,0,1]=4 148 B8R1.8 CCNC1CCOC1 CS-0056598 [0,0,0,1,0,0|2,0,0]=3 149 B8R1.8 CCN[C@@H]1CCNC1 CS-0451962 [0,0,0,1,0,0|3,0,0]=4 150 B8R1.8 CCOC1CCNC1 CS-0129134 [0,0,0,1,0,0|3,0,0]=4 151 B8R1.8 CNCC1CCCC1 CS-0252315 [0,0,0,1,0,0|3,0,0]=4 152 B8R1.8 CNCC1CCCO1 CS-0145099 [0,0,0,1,0,0|2,1,0]=4 153 B8R1.8 CNCC1CCCS1 CS-0247457 [0,0,0,1,0,0|2,0,0]=3 154 B8R1.8 CNCC1CCNC1 CS-0301635 [0,0,0,1,0,0|3,0,0]=4 155 B8R1.8 CNCC1CCOC1 CS-0056597 [0,0,0,1,0,0|2,0,0]=3 156 B8R1.8 COCC1CCCN1 CS-0210541 [0,0,0,1,0,0|3,0,0]=4 157 B8R1.8 COCC1CCNC1 CS-0038166 [0,0,0,1,0,0|3,0,0]=4 158 B8R1.8 COC[C@@H]1CCCN1 CS-0199813 [0,0,0,1,0,0|3,0,0]=4 159 B8R1.8 COC[C@@H]1CCNC1 CS-0057504 [0,0,0,1,0,0|3,0,0]=4 160 B8R1.8 CSCC1CCNC1 CS-0262528 [0,0,0,1,0,0|3,0,0]=4 161 B8R1.8 ClCCC1CCCC1 CS-0466562 [0,0,0,1,0,0|2,0,0]=3 162 B8R1.8 ClCOC1CCCC1 CS-0239460 [0,0,0,1,0,0|3,0,0]=4 163 B8R1.8 N#CCC1CCOC1 CS-0452818 [0,0,0,1,0,0|2,0,1]=4 164 B8R1.8 NCCC1=CCCC1 CS-0223851 [0,0,0,1,0,0|2,0,1]=4 165 B8R1.8 NCCC1CCOC1 CS-0309773 [0,0,0,1,0,0|2,0,0]=3 166 B8R1.8 NNCC1CCOC1 CS-0056704 [0,0,0,1,0,0|3,0,0]=4 167 B8R1.8 NOCC1CCOC1 CS-0287061 [0,0,0,1,0,0|3,0,0]=4 168 B8R1.8 OCCC1CCCN1 CS-0051801 [0,0,0,1,0,0|1,0,0]=2 169 B8R1.8 OCCC1CCCN1 CS-0068093 [0,0,0,1,0,0|1,0,0]=2 170 B8R1.8 OCCC1OCCO1 CS-0217470 [0,0,0,1,0,0|1,1,0]=3 171 B8R1.11 C#CC1CCCC1O CS-0449997 [0,0,0,1,0,0|1,1,1]=4 172 B8R1.11 C#C[C@@H]1CCC[C@H]1O CS-0525036 [0,0,0,1,0,0|1,1,1]=4 173 B8R1.11 CC1CCCC1CN CS-0235012 [0,0,0,1,0,0|2,0,0]=3 174 B8R1.11 CC1CCNC1CO CS-0236300 [0,0,0,1,0,0|2,0,0]=3 175 B8R1.11 CC1CCOC1CO CS-0623290 [0,0,0,1,0,0|2,0,0]=3 176 B8R1.11 CC1COCC1CCl CS-0199795 [0,0,0,1,0,0|3,0,0]=4 177 B8R1.11 CC1COCC1CO CS-0199773 [0,0,0,1,0,0|2,0,0]=3 178 B8R1.11 CC1OCCC1CBr CS-0238984 [0,0,0,1,0,0|3,0,0]=4 179 B8R1.11 CCC1CCNC1C CS-0235164 [0,0,0,1,0,0|3,0,0]=4 180 B8R1.11 CCC1CNCC1O CS-0224680 [0,0,0,1,0,0|2,1,0]=4 181 B8R1.11 CN1CCCC1CBr CS-0208884 [0,0,0,1,0,0|3,0,0]=4 182 B8R1.11 CN[C@@H]1CCC[C@@H]1O CS-0310334 [0,0,0,1,0,0|2,1,0]=4 183 B8R1.11 CN[C@@H]1CCC[C@H]1O CS-0782269 [0,0,0,1,0,0|2,1,0]=4 184 B8R1.11 CN[C@H]1CCC[C@H]1O CS-0309651 [0,0,0,1,0,0|2,1,0]=4 185 B8R1.11 CO[C@@H]1CCC[C@@H]1N CS-0172826 [0,0,0,1,0,0|3,0,0]=4 186 B8R1.11 CO[C@H]1CCC[C@@H]1N CS-0305937 [0,0,0,1,0,0|3,0,0]=4 187 B8R1.11 CO[C@H]1CCC[C@H]1N CS-0184253 [0,0,0,1,0,0|3,0,0]=4 188 B8R1.11 CSC1CCCC1N CS-0264089 [0,0,0,1,0,0|3,0,0]=4 189 B8R1.11 C[C@H]1CNC[C@@H]1CO CS-W021186 [0,0,0,1,0,0|2,0,0]=3 190 B8R1.11 C[C@H]1OCC[C@H]1CO CS-0037749 [0,0,0,1,0,0|2,0,0]=3 191 B8R1.11 N#C[C@@H]1CCC[C@@H]1N CS-0184189 [0,0,0,1,0,0|2,0,1]=4 192 B8R1.11 NC1COCC1CO CS-0725617 [0,0,0,1,0,0|2,0,0]=3 193 B8R1.11 NCC1CCCC1=O CS-0375906 [0,0,0,1,0,0|1,1,1]=4 194 B8R1.11 NCC1CCCC1N CS-0486203 [0,0,0,1,0,0|2,0,0]=3 195 B8R1.11 NC[C@@H]1COC[C@@H]1O CS-0049693 [0,0,0,1,0,0|2,1,0]=4 196 B8R1.11 OC[C@H]1NCC[C@@H]1O CS-0467460 [0,0,0,1,0,0|1,1,0]=3 197 B8R1.18 CN1C[C@@H](N)[C@H](O)C1 CS-0745282 [0,0,0,1,0,0|3,0,0]=4 198 B8R1.18 CN1C[C@H](F)[C@H](O)C1 CS-0623223 [0,0,0,1,0,0|3,0,0]=4 199 B8R1.18 CN1C[C@H](N)[C@H](O)C1 CS-0053297 [0,0,0,1,0,0|3,0,0]=4 200 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1O CS-0468430 [0,0,0,1,0,0|1,1,1]=4 201 B8R1.22 BrC1CCCOCC1 CS-0252969 [0,0,0,1,0,0|1,0,0]=2 202 B8R1.22 CC1CCCCCN1 CS-0283284 [0,0,0,1,0,0|3,0,0]=4 203 B8R1.22 CC1CCNCCN1 CS-W022406 [0,0,0,1,0,0|3,0,0]=4 204 B8R1.22 CC1CCOCCN1 CS-0197639 [0,0,0,1,0,0|2,0,0]=3 205 B8R1.22 CC1CCOCCN1 CS-0528792 [0,0,0,1,0,0|2,0,0]=3 206 B8R1.22 C[C@@H]1CCCCCN1 CS-0310322 [0,0,0,1,0,0|3,0,0]=4 207 B8R1.22 C[C@H]1CCCCCN1 CS-0310323 [0,0,0,1,0,0|3,0,0]=4 208 B8R1.22 F[C@H]1CCCCNC1 CS-0494405 [0,0,0,1,0,0|3,0,0]=4 209 B8R1.22 NC1CCCOCC1 CS-0136869 [0,0,0,1,0,0|1,0,0]=2 210 B8R1.22 O=C1CCCNCC1 CS-0440296 [0,0,0,1,0,0|1,1,1]=4 211 B8R1.22 OC1CCCCNC1 CS-0342050 [0,0,0,1,0,0|2,1,0]=4 212 B8R1.22 OC1CCCOCC1 CS-0136871 [0,0,0,1,0,0|0,1,0]=2 213 B8R1.22 O[C@@H]1CCCCNC1 CS-0491086 [0,0,0,1,0,0|2,1,0]=4 214 B8R1.22 O[C@H]1CCCNCC1 CS-0492739 [0,0,0,1,0,0|1,1,0]=3 215 B8R1.37 C#CCC(O)C1CC1 CS-0229893 [0,0,0,1,0,0|1,1,1]=4 216 B8R1.37 CCOC(=O)[C@@H]1CO1 CS-0055990 [0,0,0,1,0,0|1,1,1]=4 217 B8R1.37 CN(CCN)C1CC1 CS-0251428 [0,0,0,1,0,0|3,0,0]=4 218 B8R1.37 COCC(N)C1CC1 CS-0188014 [0,0,0,1,0,0|3,0,0]=4 219 B8R1.37 COCC(O)C1CC1 CS-0223379 [0,0,0,1,0,0|2,1,0]=4 220 B8R1.37 N#CCC(N)C1CC1 CS-0161151 [0,0,0,1,0,0|2,0,1]=4 221 B8R1.37 N#CCC(N)C1CC1 CS-1009555 [0,0,0,1,0,0|2,0,1]=4 222 B8R1.37 NCCC(O)C1CC1 CS-1057254 [0,0,0,1,0,0|1,1,0]=3 223 B8R1.66 CC1(CCN)COC1 CS-0449369 [0,0,0,1,0,0|3,0,0]=4 224 B8R1.66 CC1(CCO)COC1 CS-0057566 [0,0,0,1,0,0|2,0,0]=3 225 B8R1.66 CCCC1(C)CCN1 CS-0225763 [0,0,0,1,0,0|2,0,0]=3 226 B8R1.66 CNCC1(O)CCC1 CS-0310144 [0,0,0,1,0,0|2,1,0]=4 227 B8R1.66 N#CCC1(O)CCC1 CS-0475814 [0,0,0,1,0,0|1,1,1]=4 228 B8R1.66 NC1(CCO)CCC1 CS-0185413 [0,0,0,1,0,0|1,0,0]=2 229 B8R1.66 NC1(CCO)COC1 CS-0052287 [0,0,0,1,0,0|2,0,0]=3 230 B8R1.66 NCCC1(O)CNC1 CS-0484342 [0,0,0,1,0,0|2,1,0]=4 231 B8R1.66 NCCC1(O)COC1 CS-0879631 [0,0,0,1,0,0|2,1,0]=4 232 B8R1.66 OCCC1(O)CNC1 CS-0519242 [0,0,0,1,0,0|1,1,0]=3 233 B8R1.66 OCCC1(O)COC1 CS-0051770 [0,0,0,1,0,0|1,1,0]=3 234 B5R0.1 CC(N)CCN CS-0262681 [2,0,0,0,0,0|2,0,0]=4 235 B5R0.1 CC(O)CCCl CS-0959567 [2,0,0,0,0,0|1,1,0]=4 236 B5R0.1 CN(C)CCO CS-W009541 [2,0,0,0,0,0|2,0,0]=4 237 B5R0.1 CNCC(C)O CS-0754427 [2,0,0,0,0,0|1,1,0]=4 238 B5R0.1 CNC[C@@H](C)O CS-0375929 [2,0,0,0,0,0|1,1,0]=4 239 B5R0.1 CNC[C@H](C)O CS-0139471 [2,0,0,0,0,0|1,1,0]=4 240 B5R0.1 CNC[C@H](C)O CS-0652032 [2,0,0,0,0,0|1,1,0]=4 241 B5R0.1 CSCC(C)N CS-0217650 [2,0,0,0,0,0|2,0,0]=4 242 B5R0.1 C[C@@H](O)CCN CS-0113150 [2,0,0,0,0,0|1,1,0]=4 243 B5R0.2 CCCCCN CS-0214107 [2,0,0,0,0,0|1,0,0]=3 244 B5R0.2 CCCCCN CS-0468686 [2,0,0,0,0,0|1,0,0]=3 245 B5R0.2 CCNCCCl CS-0072216 [2,0,0,0,0,0|2,0,0]=4 246 B5R0.2 CCSCCN CS-0140655 [2,0,0,0,0,0|2,0,0]=4 247 B5R0.2 CC[Se][Se]CC CS-0331556 [2,0,0,0,0,0|2,0,0]=4 248 B5R0.2 CNCCCBr CS-0775766 [2,0,0,0,0,0|2,0,0]=4 249 B5R0.2 CNCCSC CS-0039272 [2,0,0,0,0,0|2,0,0]=4 250 B5R0.2 CNCCSC CS-0713670 [2,0,0,0,0,0|2,0,0]=4 251 B5R0.2 CSCCCCl CS-0307998 [2,0,0,0,0,0|2,0,0]=4 252 B5R0.2 NNCCCO CS-0742218 [2,0,0,0,0,0|2,0,0]=4 253 B5R0.3 CCC(Br)CBr CS-0204830 [2,0,0,0,0,0|2,0,0]=4 254 B5R0.3 CCC(O)CBr CS-0197080 [2,0,0,0,0,0|1,1,0]=4 255 B5R0.3 CCC(S)CC CS-0253155 [2,0,0,0,0,0|0,0,0]=2 256 B5R0.3 CNC(C)CO CS-0522344 [2,0,0,0,0,0|2,0,0]=4 257 B5R0.3 CN[C@H](C)CO CS-0697577 [2,0,0,0,0,0|2,0,0]=4 258 B5R0.3 C[C@@H](CN)CO CS-0231467 [2,0,0,0,0,0|2,0,0]=4 259 B5R0.3 NCC(F)CO CS-0523308 [2,0,0,0,0,0|2,0,0]=4 260 B5R0.3 NC[C@H](F)CO CS-0517422 [2,0,0,0,0,0|2,0,0]=4 261 B5R0.3 OCC(O)CO CS-0188495 [2,0,0,0,0,0|1,1,0]=4 262 B5R0.3 OC[C@@H](O)CF CS-0022575 [2,0,0,0,0,0|1,1,0]=4 263 B7R0.2 C=C(C)CC(C)CC CS-0205105 [1,1,0,0,0,0|1,0,1]=4 264 B7R0.2 C=C(C)CC(N)CO CS-0247968 [1,1,0,0,0,0|1,0,1]=4 265 B7R0.2 CC(C)CC(N)CN CS-0259672 [1,1,0,0,0,0|2,0,0]=4 266 B7R0.2 CC(CO)CN(C)C CS-0215040 [1,1,0,0,0,0|2,0,0]=4 267 B7R0.2 CCC(=O)CC(C)C CS-0205108 [1,1,0,0,0,0|0,1,1]=4 268 B7R0.2 CCC(O)CN(C)C CS-0246574 [1,1,0,0,0,0|1,1,0]=4 269 B7R0.2 CC[C@@H](C)CC(=O)O CS-0172023 [1,1,0,0,0,0|1,0,1]=4 270 B7R0.2 CC[C@@H](N)CC(=O)O CS-0236565 [1,1,0,0,0,0|1,0,1]=4 271 B7R0.2 CNC(C)CC(C)C CS-0273923 [1,1,0,0,0,0|2,0,0]=4 272 B7R0.2 CNC(C)CC(C)O CS-0759830 [1,1,0,0,0,0|2,0,0]=4 273 B7R0.2 COC(C)CC(C)O CS-0321884 [1,1,0,0,0,0|2,0,0]=4 274 B7R0.3 CC#CCC(O)CC CS-0328395 [1,1,0,0,0,0|0,1,1]=4 275 B7R0.3 CC(CN)CCCN CS-0168135 [1,1,0,0,0,0|2,0,0]=4 276 B7R0.3 CC(CO)CCCN CS-0224450 [1,1,0,0,0,0|1,0,0]=3 277 B7R0.3 CCC(=O)CCCCl CS-0233711 [1,1,0,0,0,0|0,1,1]=4 278 B7R0.3 CCC(=O)OCCO CS-0516698 [1,1,0,0,0,0|0,1,1]=4 279 B7R0.3 CCC(N)CCCO CS-0236618 [1,1,0,0,0,0|1,0,0]=3 280 B7R0.3 CCC(O)CCCN CS-0263098 [1,1,0,0,0,0|0,1,0]=3 281 B7R0.3 CCC(O)CCCN CS-1026727 [1,1,0,0,0,0|0,1,0]=3 282 B7R0.3 CCCCC(Br)CBr CS-0297339 [1,1,0,0,0,0|2,0,0]=4 283 B7R0.3 CCCCC(N)CO CS-0091368 [1,1,0,0,0,0|1,0,0]=3 284 B7R0.3 CCCNC(=O)CC CS-0225875 [1,1,0,0,0,0|0,1,1]=4 285 B7R0.3 CCCNC(C)CO CS-0450070 [1,1,0,0,0,0|1,0,0]=3 286 B7R0.3 CCCOC(C)CN CS-0365085 [1,1,0,0,0,0|2,0,0]=4 287 B7R0.3 CCNCC(O)CC CS-0669943 [1,1,0,0,0,0|0,1,0]=3 288 B7R0.3 CCSCC(C)NC CS-0264994 [1,1,0,0,0,0|2,0,0]=4 289 B7R0.3 COCCC(N)CO CS-0106481 [1,1,0,0,0,0|1,0,0]=3 290 B7R0.3 CSCCC(N)CO CS-0091223 [1,1,0,0,0,0|1,0,0]=3 291 B7R0.3 CSCCC(O)CN CS-0075038 [1,1,0,0,0,0|1,1,0]=4 292 B7R0.3 NCC(Cl)CCCCl CS-0319681 [1,1,0,0,0,0|2,0,0]=4 293 B7R0.3 OC(CCl)CCCCl CS-0224667 [1,1,0,0,0,0|1,1,0]=4 294 B7R0.5 CC(=O)C(Cl)CCO CS-0444407 [1,1,0,0,0,0|1,0,1]=4 295 B7R0.5 CC(C)C(N)CCO CS-0208211 [1,1,0,0,0,0|1,0,0]=3 296 B7R0.5 CCCC(=O)C(C)C CS-0204265 [1,1,0,0,0,0|0,1,1]=4 297 B7R0.5 CCCC(Br)C(C)Br CS-0314640 [1,1,0,0,0,0|1,0,0]=3 298 B7R0.5 CCC[C@@H](O)C(=O)O CS-0697299 [1,1,0,0,0,0|0,1,1]=4 299 B7R0.5 CCNC(C)C(C)C CS-0697364 [1,1,0,0,0,0|2,0,0]=4 300 B7R0.5 CNCC(N)C(C)C CS-0235452 [1,1,0,0,0,0|2,0,0]=4 301 B7R0.5 COCC(C)C(C)N CS-0239715 [1,1,0,0,0,0|2,0,0]=4 302 B7R0.5 COCC(O)C(C)C CS-0265308 [1,1,0,0,0,0|1,1,0]=4 303 B7R0.10 CCC(C)C(N)CO CS-0091231 [1,1,0,0,0,0|1,0,0]=3 304 B7R0.10 CCN(C)C(C)CO CS-0298081 [1,1,0,0,0,0|2,0,0]=4 305 B7R0.10 CCN(C)[C@@H](C)CO CS-0858619 [1,1,0,0,0,0|2,0,0]=4 306 B7R0.10 OC[C@H](O)[C@@H](O)CO CS-0133193 [1,1,0,0,0,0|1,1,0]=4 307 B7R0.11 CCC(C)(C)CCCl CS-0217973 [1,1,0,0,0,0|2,0,0]=4 308 B7R0.11 CCC(C)(C)CCO CS-0264957 [1,1,0,0,0,0|1,0,0]=3 309 B7R0.11 CCC(C)(N)CCO CS-0295506 [1,1,0,0,0,0|1,0,0]=3 310 B7R0.11 CCC(C)(O)CCN CS-0239873 [1,1,0,0,0,0|1,1,0]=4 311 B7R0.11 CCCC(C)(N)CN CS-0262804 [1,1,0,0,0,0|2,0,0]=4 312 B7R0.11 CCCC(C)(N)CO CS-0091365 [1,1,0,0,0,0|1,0,0]=3 313 B7R0.11 CCNC(C)(C)CO CS-0715615 [1,1,0,0,0,0|2,0,0]=4 314 B7R0.11 CCOC(C)(C)CO CS-0959717 [1,1,0,0,0,0|2,0,0]=4 315 B7R0.11 CNCC(C)(C)CO CS-0447676 [1,1,0,0,0,0|2,0,0]=4 316 B7R0.11 COCC(C)(C)CO CS-0239625 [1,1,0,0,0,0|2,0,0]=4 317 B7R0.12 CCC(CC)CCBr CS-0876650 [1,1,0,0,0,0|2,0,0]=4 318 B7R0.12 CCC(CSC)NC CS-0225953 [1,1,0,0,0,0|2,0,0]=4 319 B7R0.12 CCN[C@@H](CC)CO CS-0210509 [1,1,0,0,0,0|1,1,0]=4 320 B7R0.12 CCOC(CC)CN CS-0443759 [1,1,0,0,0,0|2,0,0]=4 321 B7R0.12 CCOC(CN)CO CS-0223138 [1,1,0,0,0,0|2,0,0]=4 322 B7R0.1 C=CCCCCCN CS-0239363 [1,1,0,0,0,0|1,0,1]=4 323 B7R0.1 C=CCCCCNC CS-0158388 [1,1,0,0,0,0|1,0,1]=4 324 B7R0.1 CC#CCCCCO CS-0232984 [1,1,0,0,0,0|0,0,1]=3 325 B7R0.1 CCCCCCCCl CS-0204709 [1,1,0,0,0,0|1,0,0]=3 326 B7R0.1 CCCCCCCI CS-0152148 [1,1,0,0,0,0|1,0,0]=3 327 B7R0.1 CCCCCCNO CS-1023249 [1,1,0,0,0,0|0,0,0]=2 328 B7R0.1 CCCCNCC#N CS-0323723 [1,1,0,0,0,0|1,0,1]=4 329 B7R0.1 CCCCOCCN CS-0454484 [1,1,0,0,0,0|1,0,0]=3 330 B7R0.1 CCCC\C=C\CO CS-0185682 [1,1,0,0,0,0|0,0,1]=3 331 B7R0.1 CCCNCCCN CS-0739607 [1,1,0,0,0,0|1,0,0]=3 332 B7R0.1 CCCNNCCC CS-0751063 [1,1,0,0,0,0|2,0,0]=4 333 B7R0.1 CCCOCCCBr CS-0960548 [1,1,0,0,0,0|1,0,0]=3 334 B7R0.1 CCCOCCCO CS-0235577 [1,1,0,0,0,0|0,0,0]=2 335 B7R0.1 CC\C=C/CCCO CS-0185758 [1,1,0,0,0,0|0,0,1]=3 336 B7R0.1 CNCCCCCN CS-0301759 [1,1,0,0,0,0|1,0,0]=3 337 B7R0.1 COCCCCCBr CS-0261752 [1,1,0,0,0,0|1,0,0]=3 338 B7R0.1 COCCOCCCl CS-0700581 [1,1,0,0,0,0|2,0,0]=4 339 B7R0.1 COCCOCCN CS-0115789 [1,1,0,0,0,0|2,0,0]=4 340 B7R0.1 CSCCCCCO CS-0233668 [1,1,0,0,0,0|0,0,0]=2 341 B7R0.1 FCCCCCCBr CS-0451811 [1,1,0,0,0,0|1,0,0]=3 342 B7R0.1 N#CCCNCCO CS-0158481 [1,1,0,0,0,0|1,0,1]=4 343 B7R0.1 NCCCOCCO CS-0036940 [1,1,0,0,0,0|1,0,0]=3 344 B7R0.1 NCCOCCCO CS-0238974 [1,1,0,0,0,0|1,0,0]=3 345 B7R0.1 NCCOCCCO CS-0376731 [1,1,0,0,0,0|1,0,0]=3 346 B7R0.1 NCCOCCON CS-0528757 [1,1,0,0,0,0|2,0,0]=4 347 B7R0.1 OCCCCCCI CS-0511928 [1,1,0,0,0,0|0,0,0]=2 348 B7R0.4 C#CCCCC(C)O CS-0243899 [1,1,0,0,0,0|0,0,2]=4 349 B7R0.4 C=CCCCC(C)O CS-0231877 [1,1,0,0,0,0|0,0,2]=4 350 B7R0.4 CC(=O)CCCCBr CS-0155060 [1,1,0,0,0,0|1,0,1]=4 351 B7R0.4 CC(Br)CCCCO CS-0902597 [1,1,0,0,0,0|0,0,0]=2 352 B7R0.4 CC(C)CCCCN CS-0262512 [1,1,0,0,0,0|1,0,0]=3 353 B7R0.4 CC(C)CNCCO CS-0961264 [1,1,0,0,0,0|1,0,0]=3 354 B7R0.4 CC(C)COCCO CS-0308916 [1,1,0,0,0,0|1,0,0]=3 355 B7R0.4 CC(C)NCCCO CS-0715621 [1,1,0,0,0,0|1,0,0]=3 356 B7R0.4 CC(C)OCCCO CS-0258072 [1,1,0,0,0,0|1,0,0]=3 357 B7R0.4 CC(C)SCCCN CS-0365787 [1,1,0,0,0,0|2,0,0]=4 358 B7R0.4 CCCNCC(=O)O CS-0297938 [1,1,0,0,0,0|1,0,1]=4 359 B7R0.4 CCCNCC(F)F CS-0075467 [1,1,0,0,0,0|2,0,0]=4 360 B7R0.4 CN(C)CCCCBr CS-0263668 [1,1,0,0,0,0|2,0,0]=4 361 B7R0.4 CNCCCC(C)O CS-0242809 [1,1,0,0,0,0|1,0,0]=3 362 B7R0.4 COCCCB(O)O CS-0234676 [1,1,0,0,0,0|2,0,0]=4 363 B7R0.4 NCCCCC(=O)O CS-0214080 [1,1,0,0,0,0|1,0,1]=4 364 B7R0.4 O=C(O)CCCCO CS-W022392 [1,1,0,0,0,0|1,0,1]=4 365 B9R0.4 C=CCCC(C)CC(C)O CS-0243889 [0,2,0,0,0,0|1,0,1]=4 366 B9R0.4 CC(C)CC(C)CCCO CS-0539593 [0,2,0,0,0,0|1,0,0]=3 367 B9R0.4 CCNCC(N)CC(C)C CS-0223457 [0,2,0,0,0,0|2,0,0]=4 368 B9R0.4 CSCCC(N)CC(=O)O CS-0201750 [0,2,0,0,0,0|1,0,1]=4 369 B9R0.8 CCC(C)C(C)NCCO CS-0235952 [0,2,0,0,0,0|1,0,0]=3 370 B9R0.18 COCCN(C)CCCN CS-0248143 [0,2,0,0,0,0|2,0,0]=4 371 B9R0.18 O=C(CCCO)NCCO CS-0083610 [0,2,0,0,0,0|0,1,1]=4 372 B9R0.34 CCCC(O)CC(=O)OC CS-0066118 [0,2,0,0,0,0|0,1,1]=4 373 B9R0.34 CCC[C@@H](O)CC(=O)OC CS-0510256 [0,2,0,0,0,0|0,1,1]=4 374 B9R0.34 CCC[C@H](N)CC(=O)OC CS-0162038 [0,2,0,0,0,0|1,0,1]=4 375 B9R0.35 CCCC(C)C(C)NCC CS-0259102 [0,2,0,0,0,0|2,0,0]=4 376 B9R0.35 COC[C@H](O)[C@@H](O)COC CS-0599387 [0,2,0,0,0,0|1,1,0]=4 377 B9R0.40 CCCCC(CN)CCC CS-0230441 [0,2,0,0,0,0|2,0,0]=4 378 B9R0.48 CCCC(C)CCC(C)=O CS-0296966 [0,2,0,0,0,0|1,0,1]=4 379 B9R0.48 CCCN(C)CCC(=O)O CS-0258300 [0,2,0,0,0,0|2,0,0]=4 380 B9R0.48 CCOC(C)CCC(=O)O CS-0278972 [0,2,0,0,0,0|2,0,0]=4 381 B9R0.6 CCCC(C)C(O)C(=O)O CS-0296942 [0,2,0,0,0,0|1,0,1]=4 382 B9R0.6 CCCC(O)C(N)C(=O)O CS-0234506 [0,2,0,0,0,0|0,1,1]=4 383 B9R0.6 CCC[C@H](N)C(O)C(=O)O CS-0664685 [0,2,0,0,0,0|1,0,1]=4 384 B9R0.19 CCCC(O)C(C)(C)CO CS-0539578 [0,2,0,0,0,0|0,1,0]=3 385 B9R0.14 CCCC(CC)CC(=O)O CS-0698415 [0,2,0,0,0,0|1,0,1]=4 386 B9R0.44 CC(C)(C)CC(N)CCO CS-0234547 [0,2,0,0,0,0|1,0,0]=3 387 B9R0.53 CC(C)CC(C)CC(=O)O CS-0257349 [0,2,0,0,0,0|1,0,1]=4 388 B9R0.53 CC(C)CC(N)CC(C)C CS-0669407 [0,2,0,0,0,0|2,0,0]=4 389 B9R0.15 CCCC(CCC)C(C)=O CS-0237364 [0,2,0,0,0,0|1,1,0]=4 390 B9R0.59 CCCC(O)(CN)CCC CS-0262374 [0,2,0,0,0,0|1,1,0]=4 391 B7R1.1 CCC1=CCCC1 CS-0449911 [1,0,0,1,0,0|1,0,1]=4 392 B7R1.1 CCC1CCCC1 CS-0634975 [1,0,0,1,0,0|1,0,0]=3 393 B7R1.1 CCC1CCNC1 CS-0230617 [1,0,0,1,0,0|2,0,0]=4 394 B7R1.1 CCC1CCNC1 CS-0455557 [1,0,0,1,0,0|2,0,0]=4 395 B7R1.1 CNC1CCOC1 CS-0048784 [1,0,0,1,0,0|2,0,0]=4 396 B7R1.1 CN[C@@H]1CCOC1 CS-0053318 [1,0,0,1,0,0|2,0,0]=4 397 B7R1.1 CN[C@@H]1CCOC1 CS-0057591 [1,0,0,1,0,0|2,0,0]=4 398 B7R1.1 CN[C@H]1CCOC1 CS-0057592 [1,0,0,1,0,0|2,0,0]=4 399 B7R1.1 FCC1CCCN1 CS-0184179 [1,0,0,1,0,0|2,0,0]=4 400 B7R1.1 NCC1CCCS1 CS-0230826 [1,0,0,1,0,0|1,0,0]=3 401 B7R1.1 NC[C@H]1CCCN1 CS-0466272 [1,0,0,1,0,0|2,0,0]=4 402 B7R1.1 NC[C@H]1CCOC1 CS-0053314 [1,0,0,1,0,0|2,0,0]=4 403 B7R1.1 OCC1=CCCC1 CS-0234175 [1,0,0,1,0,0|1,0,1]=4 404 B7R1.1 OCC1C=CCC1 CS-0341069 [1,0,0,1,0,0|1,0,1]=4 405 B7R1.1 OCC1COCO1 CS-W019304 [1,0,0,1,0,0|1,1,0]=4 406 B7R1.1 [C@@H]1(CN)CCCN1 CS-W016651 [1,0,0,1,0,0|2,0,0]=4 407 B7R1.2 CC1CC(O)CN1 CS-0222526 [1,0,0,1,0,0|1,1,0]=4 408 B7R1.2 CC1CCC(=O)C1 CS-0015918 [1,0,0,1,0,0|0,1,1]=4 409 B7R1.2 CC1CCC(Br)C1 CS-0240107 [1,0,0,1,0,0|1,0,0]=3 410 B7R1.2 CC1CCC(C)N1 CS-0159607 [1,0,0,1,0,0|2,0,0]=4 411 B7R1.2 CC1CNC(C)C1 CS-0217723 [1,0,0,1,0,0|2,0,0]=4 412 B7R1.2 CN1CCC(Cl)C1 CS-0577956 [1,0,0,1,0,0|2,0,0]=4 413 B7R1.2 C[C@@H]1CC[C@@H](C)N1 CS-0053461 [1,0,0,1,0,0|2,0,0]=4 414 B7R1.2 C[C@@H]1CN[C@H](C)C1 CS-0673874 [1,0,0,1,0,0|2,0,0]=4 415 B7R1.2 N[C@@H]1CC[C@@H](O)C1 CS-0030169 [1,0,0,1,0,0|1,0,0]=3 416 B7R1.2 N[C@H]1CC[C@@H](F)C1 CS-0655134 [1,0,0,1,0,0|2,0,0]=4 417 B7R1.2 N[C@H]1CC[C@H](F)C1 CS-0906992 [1,0,0,1,0,0|2,0,0]=4 418 B7R1.2 N[C@H]1CC[C@H](N)C1 CS-0858582 [1,0,0,1,0,0|2,0,0]=4 419 B7R1.2 O=C1CC[C@H](O)C1 CS-0495545 [1,0,0,1,0,0|0,1,1]=4 420 B7R1.2 OC1CCC(F)C1 CS-0477400 [1,0,0,1,0,0|1,0,0]=3 421 B7R1.3 BrC1CCSCC1 CS-0309064 [1,0,0,1,0,0|1,1,0]=4 422 B7R1.3 CC1CCCCN1 CS-0666428 [1,0,0,1,0,0|2,0,0]=4 423 B7R1.3 CN1CCOCC1 CS-0151062 [1,0,0,1,0,0|2,0,0]=4 424 B7R1.3 ClC1CCNCC1 CS-0453479 [1,0,0,1,0,0|2,0,0]=4 425 B7R1.3 F[C@H]1CCCNC1 CS-0053267 [1,0,0,1,0,0|2,0,0]=4 426 B7R1.3 IC1CCSCC1 CS-0045981 [1,0,0,1,0,0|1,1,0]=4 427 B7R1.3 NC1CCCNC1 CS-W005316 [1,0,0,1,0,0|2,0,0]=4 428 B7R1.3 N[C@@H]1CCCOC1 CS-0183316 [1,0,0,1,0,0|1,0,0]=3 429 B7R1.3 N[C@H]1CCCOC1 CS-0046122 [1,0,0,1,0,0|1,0,0]=3 430 B7R1.3 SC1CCCNC1 CS-0048753 [1,0,0,1,0,0|1,0,0]=3 431 B7R1.3 SC1CCSCC1 CS-0232823 [1,0,0,1,0,0|0,1,0]=3 432 B7R1.3 [C@H]1(O)CCCOC1 CS-W007290 [1,0,0,1,0,0|0,1,0]=3 433 B7R1.4 CC1CNCC1C CS-0172207 [1,0,0,1,0,0|2,0,0]=4 434 B7R1.4 C[C@@H]1CCC[C@@H]1N CS-0197543 [1,0,0,1,0,0|1,0,0]=3 435 B7R1.4 C[C@@H]1CNC[C@@H]1N CS-0310325 [1,0,0,1,0,0|2,0,0]=4 436 B7R1.4 C[C@@H]1NCC[C@@H]1O CS-0501476 [1,0,0,1,0,0|1,1,0]=4 437 B7R1.4 C[C@H]1CCC[C@H]1O CS-0036366 [1,0,0,1,0,0|0,1,0]=3 438 B7R1.4 C[C@H]1COC[C@@H]1N CS-0184287 [1,0,0,1,0,0|2,0,0]=4 439 B7R1.4 C[C@H]1OCC[C@@H]1N CS-1057343 [1,0,0,1,0,0|1,0,0]=3 440 B7R1.4 ClC1CCOC1Cl CS-0451541 [1,0,0,1,0,0|2,0,0]=4 441 B7R1.4 NC1CCCC1Br CS-0230543 [1,0,0,1,0,0|2,0,0]=4 442 B7R1.4 NC1CCCC1Cl CS-0230256 [1,0,0,1,0,0|2,0,0]=4 443 B7R1.4 NC1CCCC1N CS-0197792 [1,0,0,1,0,0|2,0,0]=4 444 B7R1.4 N[C@@H]1CCC[C@@H]1O CS-0368662 [1,0,0,1,0,0|1,0,0]=3 445 B7R1.4 N[C@@H]1CCC[C@@H]1O CS-0513808 [1,0,0,1,0,0|1,0,0]=3 446 B7R1.4 N[C@@H]1CCC[C@H]1F CS-0311814 [1,0,0,1,0,0|2,0,0]=4 447 B7R1.4 N[C@@H]1CCC[C@H]1N CS-0356557 [1,0,0,1,0,0|2,0,0]=4 448 B7R1.4 N[C@@H]1COC[C@@H]1O CS-0029555 [1,0,0,1,0,0|2,0,0]=4 449 B7R1.4 N[C@@H]1COC[C@H]1O CS-0046712 [1,0,0,1,0,0|2,0,0]=4 450 B7R1.4 N[C@H]1COC[C@@H]1O CS-0184532 [1,0,0,1,0,0|2,0,0]=4 451 B7R1.4 OC1CCCC1O CS-0451973 [1,0,0,1,0,0|0,1,0]=3 452 B7R1.4 OC1CNCC1O CS-0083889 [1,0,0,1,0,0|1,1,0]=4 453 B7R1.4 OC1CNCC1O CS-0496937 [1,0,0,1,0,0|1,1,0]=4 454 B7R1.4 OC1COCC1Br CS-0487203 [1,0,0,1,0,0|2,0,0]=4 455 B7R1.4 O[C@@H]1CCC[C@H]1O CS-0782195 [1,0,0,1,0,0|0,1,0]=3 456 B7R1.4 O[C@@H]1CNC[C@@H]1F CS-0058738 [1,0,0,1,0,0|2,0,0]=4 457 B7R1.4 O[C@H]1CCC[C@@H]1O CS-0058322 [1,0,0,1,0,0|0,1,0]=3 458 B7R1.4 O[C@H]1CNC[C@H]1F CS-0502667 [1,0,0,1,0,0|2,0,0]=4 459 B7R1.4 O[C@H]1COC[C@@H]1O CS-0173155 [1,0,0,1,0,0|1,1,0]=4 460 B7R1.4 [C@@H]1(N)CCC[C@H]1O CS-0031413 [1,0,0,1,0,0|1,0,0]=3 461 B7R1.6 BrCCC1CCC1 CS-0623989 [1,0,0,1,0,0|2,0,0]=4 462 B7R1.6 CCNC1CCC1 CS-0436117 [1,0,0,1,0,0|2,0,0]=4 463 B7R1.6 CCNC1COC1 CS-0045508 [1,0,0,1,0,0|2,0,0]=4 464 B7R1.6 CNCC1COC1 CS-0048871 [1,0,0,1,0,0|2,0,0]=4 465 B7R1.6 COC[C@@H]1CCN1 CS-0053449 [1,0,0,1,0,0|2,0,0]=4 466 B7R1.6 COC[C@H]1CCN1 CS-0053501 [1,0,0,1,0,0|2,0,0]=4 467 B7R1.6 NCCC1CCC1 CS-0135451 [1,0,0,1,0,0|2,0,0]=4 468 B7R1.6 NCCC1CCO1 CS-0052220 [1,0,0,1,0,0|1,1,0]=4 469 B7R1.6 NCCC1COC1 CS-0052217 [1,0,0,1,0,0|2,0,0]=4 470 B7R1.6 OCCC1CCC1 CS-0054337 [1,0,0,1,0,0|1,0,0]=3 471 B7R1.6 OCCC1CCO1 CS-0052219 [1,0,0,1,0,0|0,1,0]=3 472 B7R1.6 OCCC1CNC1 CS-0052250 [1,0,0,1,0,0|2,0,0]=4 473 B7R1.6 OCC[C@@H]1CCO1 CS-0623027 [1,0,0,1,0,0|0,1,0]=3 474 B7R1.8 COC1CCC1N CS-0654190 [1,0,0,1,0,0|2,0,0]=4 475 B7R1.8 CO[C@@H]1CC[C@@H]1N CS-0476856 [1,0,0,1,0,0|2,0,0]=4 476 B7R1.8 CO[C@@H]1CC[C@H]1N CS-0309645 [1,0,0,1,0,0|2,0,0]=4 477 B7R1.8 NCC1CCC1F CS-0045560 [1,0,0,1,0,0|2,0,0]=4 478 B7R1.8 OCC1CCC1F CS-0045492 [1,0,0,1,0,0|1,0,0]=3 479 B7R1.8 OC[C@H]1CC[C@H]1O CS-0499615 [1,0,0,1,0,0|0,1,0]=3 480 B7R1.9 NCC1CC1CO CS-0056025 [1,0,0,1,0,0|2,0,0]=4 481 B7R1.9 NC[C@H]1C[C@H]1CO CS-0444092 [1,0,0,1,0,0|2,0,0]=4 482 B7R1.10 CC1CC(CBr)C1 CS-0216867 [1,0,0,1,0,0|2,0,0]=4 483 B7R1.10 CO[C@H]1C[C@@H](O)C1 CS-0183124 [1,0,0,1,0,0|2,0,0]=4 484 B7R1.10 CO[C@H]1C[C@H](O)C1 CS-0139369 [1,0,0,1,0,0|2,0,0]=4 485 B7R1.10 NCC1CC(O)C1 CS-0053792 [1,0,0,1,0,0|2,0,0]=4 486 B7R1.10 NC[C@H]1C[C@H](O)C1 CS-0053933 [1,0,0,1,0,0|2,0,0]=4 487 B7R1.10 N[C@H]1C[C@@H](CO)C1 CS-0053863 [1,0,0,1,0,0|2,0,0]=4 488 B7R1.10 N[C@H]1C[C@H](CO)C1 CS-0045535 [1,0,0,1,0,0|2,0,0]=4 489 B7R1.10 N[C@H]1C[C@H](CO)C1 CS-0055246 [1,0,0,1,0,0|2,0,0]=4 490 B7R1.10 OC1CC(CBr)C1 CS-0501424 [1,0,0,1,0,0|2,0,0]=4 491 B7R1.10 O[C@H]1C[C@@H](CF)C1 CS-0504579 [1,0,0,1,0,0|2,0,0]=4 492 B7R1.21 CCOC1(Br)CC1 CS-0239630 [1,0,0,1,0,0|2,0,0]=4 493 B7R1.21 CCOC1(O)CC1 CS-0056034 [1,0,0,1,0,0|1,1,0]=4 494 B7R1.21 COCC1(O)CC1 CS-0055994 [1,0,0,1,0,0|1,1,0]=4 495 B7R1.21 OCCC1(O)CC1 CS-0052907 [1,0,0,1,0,0|0,1,0]=3 496 B7R1.22 CC(CO)C1CC1 CS-0238008 [1,0,0,1,0,0|1,0,0]=3 497 B7R1.22 NC(CO)C1CC1 CS-0091326 [1,0,0,1,0,0|1,0,0]=3 498 B7R1.22 NCC(N)C1CC1 CS-0216834 [1,0,0,1,0,0|2,0,0]=4 499 B7R1.22 N[C@@H](CO)C1CC1 CS-0091328 [1,0,0,1,0,0|1,0,0]=3 500 B7R1.22 N[C@H](CO)C1CC1 CS-0091327 [1,0,0,1,0,0|1,0,0]=3 501 B7R1.22 OC(CBr)C1CC1 CS-0271403 [1,0,0,1,0,0|1,1,0]=4 502 B7R1.25 CC1(CN)CCO1 CS-0506326 [1,0,0,1,0,0|2,0,0]=4 503 B7R1.25 CC1(CO)CCN1 CS-0172765 [1,0,0,1,0,0|2,0,0]=4 504 B7R1.25 CC1(CO)CCO1 CS-0183569 [1,0,0,1,0,0|2,0,0]=4 505 B7R1.25 CC1(CO)CSC1 CS-0091512 [1,0,0,1,0,0|2,0,0]=4 506 B7R1.25 CCC1(C)CNC1 CS-0309769 [1,0,0,1,0,0|2,0,0]=4 507 B7R1.25 CCC1(F)CNC1 CS-0467869 [1,0,0,1,0,0|2,0,0]=4 508 B7R1.25 CCC1(N)CCC1 CS-0183631 [1,0,0,1,0,0|1,0,0]=3 509 B7R1.25 CCC1(N)CNC1 CS-0057351 [1,0,0,1,0,0|2,0,0]=4 510 B7R1.25 CCC1(N)COC1 CS-0172212 [1,0,0,1,0,0|2,0,0]=4 511 B7R1.25 C[C@]1(CN)CCO1 CS-0310466 [1,0,0,1,0,0|2,0,0]=4 512 B7R1.25 NC1(CO)CCC1 CS-0040898 [1,0,0,1,0,0|1,0,0]=3 513 B7R1.25 NCC1(F)CCC1 CS-0053659 [1,0,0,1,0,0|2,0,0]=4 514 B7R1.25 OCC1(F)CNC1 CS-0036390 [1,0,0,1,0,0|2,0,0]=4 515 B7R1.25 OCC1(F)COC1 CS-0045510 [1,0,0,1,0,0|2,0,0]=4 516 B7R1.25 OCC1(O)CCC1 CS-0504512 [1,0,0,1,0,0|0,1,0]=3 517 B7R1.25 OCC1(O)CNC1 CS-0049771 [1,0,0,1,0,0|1,1,0]=4 518 B7R1.25 OCC1(O)CNC1 CS-0852008 [1,0,0,1,0,0|1,1,0]=4 519 B7R1.7 CCCNC1CC1 CS-0506986 [1,0,0,1,0,0|2,0,0]=4 520 B7R1.7 CCCNC1CC1 CS-0670952 [1,0,0,1,0,0|2,0,0]=4 521 B7R1.7 CNCCC1CC1 CS-0223210 [1,0,0,1,0,0|2,0,0]=4 522 B7R1.7 ClCCOC1CC1 CS-0074137 [1,0,0,1,0,0|2,0,0]=4 523 B7R1.7 NCCCC1CC1 CS-0700627 [1,0,0,1,0,0|1,0,0]=3 524 B7R1.7 OCCCC1CC1 CS-0224534 [1,0,0,1,0,0|0,0,0]=2 525 B9R1.2 CC1CC(C=O)CCO1 CS-0232409 [0,1,0,1,0,0|0,1,0]=3 526 B9R1.2 CC1CC(CBr)CCO1 CS-0237419 [0,1,0,1,0,0|1,0,0]=3 527 B9R1.2 CC1CC(CN)CCO1 CS-0225755 [0,1,0,1,0,0|1,0,0]=3 528 B9R1.2 CC1CC(CO)CCO1 CS-0232577 [0,1,0,1,0,0|0,1,0]=3 529 B9R1.2 CC1CCCC(CN)C1 CS-0251202 [0,1,0,1,0,0|2,0,0]=4 530 B9R1.2 CC1CCCC(CO)C1 CS-0487356 [0,1,0,1,0,0|1,0,0]=3 531 B9R1.2 CC1CCCC(CO)N1 CS-0055515 [0,1,0,1,0,0|1,0,0]=3 532 B9R1.2 CCC1CC(=O)CCO1 CS-0061467 [0,1,0,1,0,0|0,1,1]=4 533 B9R1.2 CCC1CC(N)CCO1 CS-0285451 [0,1,0,1,0,0|1,0,0]=3 534 B9R1.2 CCC1CCCC(C)C1 CS-0451768 [0,1,0,1,0,0|2,0,0]=4 535 B9R1.2 CNC1CCCC(C)C1 CS-0247146 [0,1,0,1,0,0|2,0,0]=4 536 B9R1.2 COC1CCCC(I)C1 CS-0234229 [0,1,0,1,0,0|1,0,0]=3 537 B9R1.2 CO[C@@H]1CCN[C@@H](C)C1 CS-0463645 [0,1,0,1,0,0|1,1,0]=4 538 B9R1.2 CO[C@H]1CCC[C@@H](N)C1 CS-0903887 [0,1,0,1,0,0|1,0,0]=3 539 B9R1.2 CO[C@H]1CCC[C@@H](O)C1 CS-0058288 [0,1,0,1,0,0|0,1,0]=3 540 B9R1.2 CO[C@H]1CCN[C@H](C)C1 CS-0493675 [0,1,0,1,0,0|1,1,0]=4 541 B9R1.2 CSC1CCCC(N)C1 CS-0261819 [0,1,0,1,0,0|1,0,0]=3 542 B9R1.2 C[C@@H]1CNC[C@H](CO)O1 CS-0147344 [0,1,0,1,0,0|2,0,0]=4 543 B9R1.2 N#C[C@@H]1CCC[C@H](N)C1 CS-1057070 [0,1,0,1,0,0|2,0,0]=4 544 B9R1.2 NC1CCOC(CO)C1 CS-0858519 [0,1,0,1,0,0|1,0,0]=3 545 B9R1.2 NC[C@H]1CCC[C@@H](O)C1 CS-0858481 [0,1,0,1,0,0|1,0,0]=3 546 B9R1.2 N[C@@H]1CCC[C@@H](CO)C1 CS-0622954 [0,1,0,1,0,0|1,0,0]=3 547 B9R1.2 O=C1CCC[C@H](CO)N1 CS-0214865 [0,1,0,1,0,0|0,1,1]=4 548 B9R1.7 CC1CCN(CCO)C1 CS-0308270 [0,1,0,1,0,0|2,0,0]=4 549 B9R1.7 CN1CCC(CCN)C1 CS-0052316 [0,1,0,1,0,0|2,0,0]=4 550 B9R1.7 CN1CCC(CCO)C1 CS-0052315 [0,1,0,1,0,0|1,0,0]=3 551 B9R1.7 CN1CC[C@H](CCO)C1 CS-0476254 [0,1,0,1,0,0|1,0,0]=3 552 B9R1.7 O=C1CCC(CCO)N1 CS-0215642 [0,1,0,1,0,0|1,0,1]=4 553 B9R1.8 BrCCC1CCCCN1 CS-0208298 [0,1,0,1,0,0|2,0,0]=4 554 B9R1.8 BrCCC1COCCO1 CS-0719836 [0,1,0,1,0,0|1,1,0]=4 555 B9R1.8 CCCC1CCNCC1 CS-0206254 [0,1,0,1,0,0|2,0,0]=4 556 B9R1.8 CCCC1COCCN1 CS-0713513 [0,1,0,1,0,0|1,0,0]=3 557 B9R1.8 CCCN1CCOCC1 CS-0517736 [0,1,0,1,0,0|2,0,0]=4 558 B9R1.8 CCC[C@@H]1CCCCN1 CS-0475592 [0,1,0,1,0,0|2,0,0]=4 559 B9R1.8 CCC[C@H]1CCCCN1 CS-0197282 [0,1,0,1,0,0|2,0,0]=4 560 B9R1.8 CCNC1CCOCC1 CS-0714519 [0,1,0,1,0,0|2,0,0]=4 561 B9R1.8 CNC[C@@H]1COCCO1 CS-0052976 [0,1,0,1,0,0|2,0,0]=4 562 B9R1.8 CNC[C@@H]1COCCO1 CS-0184077 [0,1,0,1,0,0|2,0,0]=4 563 B9R1.8 CNC[C@H]1COCCO1 CS-0052975 [0,1,0,1,0,0|2,0,0]=4 564 B9R1.8 ClCCC1CCCCC1 CS-0440494 [0,1,0,1,0,0|2,0,0]=4 565 B9R1.8 ClCCC1CCOCC1 CS-0215147 [0,1,0,1,0,0|2,0,0]=4 566 B9R1.8 FCCC1CCCNC1 CS-0245247 [0,1,0,1,0,0|2,0,0]=4 567 B9R1.8 ICCC1CCOCC1 CS-0244783 [0,1,0,1,0,0|2,0,0]=4 568 B9R1.8 NCCC1CCCCC1 CS-0018750 [0,1,0,1,0,0|2,0,0]=4 569 B9R1.8 NCCC1CCCNC1 CS-0461182 [0,1,0,1,0,0|2,0,0]=4 570 B9R1.8 NCCC1CCNCC1 CS-0671510 [0,1,0,1,0,0|2,0,0]=4 571 B9R1.8 NCCC1CCSCC1 CS-0443990 [0,1,0,1,0,0|2,0,0]=4 572 B9R1.8 OCCC1CCCCN1 CS-0691341 [0,1,0,1,0,0|1,0,0]=3 573 B9R1.8 OCCC1CNCCO1 CS-0307946 [0,1,0,1,0,0|0,1,0]=3 574 B9R1.8 OCCC1CNCCO1 CS-0315539 [0,1,0,1,0,0|0,1,0]=3 575 B9R1.8 OCCC1COCCO1 CS-0375670 [0,1,0,1,0,0|0,1,0]=3 576 B9R1.8 OCCC1CSCCN1 CS-0230523 [0,1,0,1,0,0|1,0,0]=3 577 B9R1.8 OCC[C@H]1COCCN1 CS-0146957 [0,1,0,1,0,0|1,0,0]=3 578 B9R1.12 BrCCCC1CCCO1 CS-0266152 [0,1,0,1,0,0|1,1,0]=4 579 B9R1.12 BrCCCC1CCOC1 CS-0242906 [0,1,0,1,0,0|1,0,0]=3 580 B9R1.12 BrCCOC1CCOC1 CS-0256708 [0,1,0,1,0,0|2,0,0]=4 581 B9R1.12 CCCCC1CCCN1 CS-0297439 [0,1,0,1,0,0|2,0,0]=4 582 B9R1.12 CCCNC1CCCC1 CS-0714457 [0,1,0,1,0,0|2,0,0]=4 583 B9R1.12 COCCC1CCCN1 CS-0052298 [0,1,0,1,0,0|1,0,0]=3 584 B9R1.12 COCCC1CCNC1 CS-0233999 [0,1,0,1,0,0|2,0,0]=4 585 B9R1.12 ClCCCC1CCCC1 CS-0264770 [0,1,0,1,0,0|2,0,0]=4 586 B9R1.12 ICCCC1CCCC1 CS-0416115 [0,1,0,1,0,0|2,0,0]=4 587 B9R1.12 NCCCC1CCCC1 CS-0058004 [0,1,0,1,0,0|2,0,0]=4 588 B9R1.12 NCCCC1CCCO1 CS-0286651 [0,1,0,1,0,0|1,1,0]=4 589 B9R1.12 NCCCC1CCOC1 CS-0266462 [0,1,0,1,0,0|1,0,0]=3 590 B9R1.12 OCCCC1CCCO1 CS-0116649 [0,1,0,1,0,0|0,1,0]=3 591 B9R1.15 CC1CCCNC1CN CS-0236285 [0,1,0,1,0,0|2,0,0]=4 592 B9R1.15 CC1NCCCC1CO CS-0463088 [0,1,0,1,0,0|1,0,0]=3 593 B9R1.15 CCC1CCCCC1Br CS-0245703 [0,1,0,1,0,0|2,0,0]=4 594 B9R1.15 CCC1CCCCC1N CS-0247815 [0,1,0,1,0,0|2,0,0]=4 595 B9R1.15 CCC1CCCCC1O CS-0204697 [0,1,0,1,0,0|1,1,0]=4 596 B9R1.15 CN1CCNCC1CO CS-0570637 [0,1,0,1,0,0|2,0,0]=4 597 B9R1.15 CN1CCOC[C@H]1CO CS-0103636 [0,1,0,1,0,0|2,0,0]=4 598 B9R1.15 CO[C@@H]1COCC[C@H]1N CS-0053240 [0,1,0,1,0,0|2,0,0]=4 599 B9R1.15 CO[C@H]1COCC[C@@H]1N CS-0058690 [0,1,0,1,0,0|2,0,0]=4 600 B9R1.15 NCC1CCCCC1O CS-0139277 [0,1,0,1,0,0|1,1,0]=4 601 B9R1.15 NC[C@@H]1CCCC[C@@H]1O CS-0356778 [0,1,0,1,0,0|1,1,0]=4 602 B9R1.15 NC[C@@H]1CCNC[C@@H]1O CS-0049692 [0,1,0,1,0,0|1,1,0]=4 603 B9R1.15 NC[C@@H]1CCNC[C@H]1O CS-0047768 [0,1,0,1,0,0|1,1,0]=4 604 B9R1.15 N[C@@H]1CCCC[C@@H]1CO CS-0139614 [0,1,0,1,0,0|1,0,0]=3 605 B9R1.15 N[C@@H]1CCCC[C@@H]1CO CS-0667650 [0,1,0,1,0,0|1,0,0]=3 606 B9R1.15 N[C@@H]1CCCC[C@H]1CO CS-0139608 [0,1,0,1,0,0|1,0,0]=3 607 B9R1.15 N[C@@H]1CCCC[C@H]1CO CS-0139612 [0,1,0,1,0,0|1,0,0]=3 608 B9R1.15 N[C@H]1CCCC[C@H]1CO CS-0135573 [0,1,0,1,0,0|1,0,0]=3 609 B9R1.15 OCC1CCNCC1O CS-0039725 [0,1,0,1,0,0|0,1,0]=3 610 B9R1.15 OC[C@@H]1CCNC[C@@H]1F CS-0506253 [0,1,0,1,0,0|1,0,0]=3 611 B9R1.15 OC[C@@H]1CCNC[C@@H]1O CS-0049686 [0,1,0,1,0,0|0,1,0]=3 612 B9R1.22 CN1C[C@H](N)C[C@H]1CO CS-0357063 [0,1,0,1,0,0|2,0,0]=4 613 B9R1.22 CO[C@@H]1CN(C)C[C@H]1O CS-0309983 [0,1,0,1,0,0|2,0,0]=4 614 B9R1.33 CCO[C@H]1COC[C@@H]1N CS-0443435 [0,1,0,1,0,0|2,0,0]=4 615 B9R1.33 CCSC1CCCC1N CS-0265491 [0,1,0,1,0,0|2,0,0]=4 616 B9R1.33 CN1CCCC1CCBr CS-0222749 [0,1,0,1,0,0|2,0,0]=4 617 B9R1.33 CN1CCC[C@@H]1CCO CS-0341913 [0,1,0,1,0,0|1,0,0]=3 618 B9R1.33 CN1CCC[C@H]1CCN CS-0054115 [0,1,0,1,0,0|2,0,0]=4 619 B9R1.33 CNCC1CCOC1C CS-0283447 [0,1,0,1,0,0|2,0,0]=4 620 B9R1.33 COC[C@H]1CCCN1N CS-0313906 [0,1,0,1,0,0|2,0,0]=4 621 B9R1.33 O=C1CCCC1CCBr CS-0265383 [0,1,0,1,0,0|1,1,0]=4 622 B9R1.33 O=C1CCCN1CCO CS-W009539 [0,1,0,1,0,0|0,1,1]=4 623 B9R1.50 OC1CCC=CCCC1 CS-0884630 [0,1,0,1,0,0|1,1,0]=4 624 B9R1.50 OC1CCC=CCCC1 CS-0884672 [0,1,0,1,0,0|1,1,0]=4 625 B9R1.69 CC1CC(N)CCN1C CS-0054044 [0,1,0,1,0,0|2,0,0]=4 626 B9R1.69 CC1CCC(N)CC1C CS-0262840 [0,1,0,1,0,0|2,0,0]=4 627 B9R1.73 NCCC(O)C1CCC1 CS-0241634 [0,1,0,1,0,0|1,1,0]=4 628 B9R1.117 CC1(OCCN)CCC1 CS-0223364 [0,1,0,1,0,0|2,0,0]=4 629 B9R1.134 CC1(CCO)OCCO1 CS-0153760 [0,1,0,1,0,0|1,1,0]=4 630 B9R1.134 CCCC1(N)CCOC1 CS-0239222 [0,1,0,1,0,0|1,0,0]=3 631 B9R1.134 CNCC1(C)OCCO1 CS-0323152 [0,1,0,1,0,0|2,0,0]=4 632 B9R1.134 NC1(CCO)CCOC1 CS-0635828 [0,1,0,1,0,0|1,0,0]=3 633 B9R1.134 NCCC1(O)CCCC1 CS-0433340 [0,1,0,1,0,0|1,1,0]=4 634 B9R1.3 CC1CCCC(O)C1C CS-0196810 [0,1,0,1,0,0|1,0,0]=3 635 B9R1.5 N[C@@H]1CCCCC[C@H]1N CS-0246549 [0,1,0,1,0,0|2,0,0]=4 636 B9R1.5 N[C@@H]1CCCCC[C@H]1O CS-0472520 [0,1,0,1,0,0|1,1,0]=4 637 B9R1.11 CC(CN)C1CCCC1 CS-0225481 [0,1,0,1,0,0|2,0,0]=4 638 B9R1.11 CCC(N)C1CCOC1 CS-0264118 [0,1,0,1,0,0|1,0,0]=3 639 B9R1.11 NC(CO)C1CCOC1 CS-0088139 [0,1,0,1,0,0|2,0,0]=4 640 B9R1.11 NCC(O)C1CCCC1 CS-0261936 [0,1,0,1,0,0|2,0,0]=4 641 B9R1.11 N[C@@H](CO)C1CCCC1 CS-0682668 [0,1,0,1,0,0|1,0,0]=3 642 B9R1.11 N[C@H](CO)C1CCCC1 CS-0436842 [0,1,0,1,0,0|1,0,0]=3 643 B9R1.202 CC1(CO)CCCC1N CS-0354871 [0,1,0,1,0,0|1,0,0]=3 644 B9R1.202 CN1CCC[C@@]1(C)CO CS-0648697 [0,1,0,1,0,0|2,0,0]=4 645 B9R1.13 CC(O)CC1CCCO1 CS-0237384 [0,1,0,1,0,0|0,1,0]=3 646 B9R1.13 CC(O)CC1CCOC1 CS-0237308 [0,1,0,1,0,0|1,0,0]=3 647 B9R1.13 CC(O)CN1CCCC1 CS-0723801 [0,1,0,1,0,0|2,0,0]=4 648 B9R1.34 CC1CC(C)CC(Br)C1 CS-0248281 [0,1,0,1,0,0|2,0,0]=4 649 B9R1.34 CC1CC(C)CC(C)C1 CS-0464528 [0,1,0,1,0,0|2,0,0]=4 650 B9R1.34 CC1CC(C)CC(I)C1 CS-0256383 [0,1,0,1,0,0|2,0,0]=4 651 B9R1.34 CC1CC(C)NC(C)C1 CS-0908792 [0,1,0,1,0,0|2,0,0]=4 652 B9R1.34 CC1CC(N)CC(C)N1 CS-0223473 [0,1,0,1,0,0|2,0,0]=4 653 B9R1.34 C[C@H]1CC(N)C[C@@H](C)O1 CS-0058242 [0,1,0,1,0,0|1,0,0]=3 654 B9R1.34 N[C@H]1C[C@@H](N)C[C@@H](N)C1 CS-0516950 [0,1,0,1,0,0|2,0,0]=4 655 B9R1.34 OC1CC(O)CC(O)C1 CS-0464706 [0,1,0,1,0,0|0,1,0]=3 656 B9R1.41 CC(O)[C@@H]1CCCN1C CS-0159083 [0,1,0,1,0,0|2,0,0]=4 657 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O CS-0130157 [0,1,0,1,0,0|1,0,1]=4 658 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O CS-0131294 [0,1,0,1,0,0|1,0,1]=4 659 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O CS-0132060 [0,1,0,1,0,0|1,0,1]=4 660 B9R1.41 O=C(O)C1CCCC1O CS-0486250 [0,1,0,1,0,0|0,1,1]=4 661 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O CS-0376880 [0,1,0,1,0,0|0,1,1]=4 662 B9R1.66 CC1(C)CC(S)CCO1 CS-0232816 [0,1,0,1,0,0|0,0,0]=2 663 B9R1.66 CC1(C)CCCC(Br)C1 CS-0243467 [0,1,0,1,0,0|2,0,0]=4 664 B9R1.66 CC1(C)CCCC(N)C1 CS-0184384 [0,1,0,1,0,0|2,0,0]=4 665 B9R1.66 CC1(C)CCC[C@@H](N)C1 CS-0058226 [0,1,0,1,0,0|2,0,0]=4 666 B9R1.66 CC1(C)CCC[C@H](N)C1 CS-0504605 [0,1,0,1,0,0|2,0,0]=4 667 B9R1.66 CC1CC(C)(O)CCO1 CS-0891773 [0,1,0,1,0,0|0,1,0]=3 668 B9R1.66 CC1CC(F)(F)CCN1 CS-0173183 [0,1,0,1,0,0|2,0,0]=4 669 B9R1.66 C[C@@H]1CC(F)(F)CCN1 CS-0500903 [0,1,0,1,0,0|2,0,0]=4 670 B9R1.66 C[C@H]1CC(F)(F)CCN1 CS-0256136 [0,1,0,1,0,0|2,0,0]=4 671 B9R1.66 N[C@@H]1CCCC(F)(F)C1 CS-0437320 [0,1,0,1,0,0|2,0,0]=4 672 B9R1.66 N[C@H]1CCCC(F)(F)C1 CS-0184243 [0,1,0,1,0,0|2,0,0]=4 673 B9R1.66 O=S1(=O)CCCC(O)C1 CS-0229955 [0,1,0,1,0,0|1,1,0]=4 674 B9R1.66 O=S1(=O)CCCC(S)C1 CS-0246301 [0,1,0,1,0,0|1,0,1]=4 675 B9R1.86 CCC1CC1CC(=O)O CS-0451400 [0,1,0,1,0,0|1,0,1]=4 676 B9R1.136 CC1(C)CC(CCN)C1 CS-0748884 [0,1,0,1,0,0|2,0,0]=4 677 B9R1.136 OCCC1CC(F)(F)C1 CS-0052292 [0,1,0,1,0,0|2,0,0]=4 678 B9R1.14 CNC1CCCC1SC CS-0264947 [0,1,0,1,0,0|2,0,0]=4 679 B9R1.14 COC1CCCC1CN CS-0232083 [0,1,0,1,0,0|1,1,0]=4 680 B9R1.14 CSC1CCCC1C#N CS-0250161 [0,1,0,1,0,0|1,0,1]=4 681 B9R1.14 O=CN1CCC[C@H]1CO CS-0763703 [0,1,0,1,0,0|1,1,0]=4 682 B9R1.14 OCC1CNCC1CO CS-0947935 [0,1,0,1,0,0|1,1,0]=4 683 B9R1.89 CCC1CCCNCC1 CS-0453585 [0,1,0,1,0,0|2,0,0]=4 684 B9R1.89 CNC1CCCCCC1 CS-0245333 [0,1,0,1,0,0|2,0,0]=4 685 B9R1.89 CNC1CCCNCC1 CS-0224035 [0,1,0,1,0,0|2,0,0]=4 686 B9R1.89 CSC1CCCCNC1 CS-0222995 [0,1,0,1,0,0|2,0,0]=4 687 B9R1.89 N#CC1CCCNCC1 CS-0623043 [0,1,0,1,0,0|2,0,0]=4 688 B9R1.89 N#CC1CCCOCC1 CS-0238115 [0,1,0,1,0,0|1,0,0]=3 689 B9R1.89 NCC1CCCOCC1 CS-0238220 [0,1,0,1,0,0|1,0,0]=3 690 B9R1.89 NNC1CCCCCC1 CS-0315588 [0,1,0,1,0,0|2,0,0]=4 691 B9R1.175 CCCC1(C#N)CCC1 CS-0223788 [0,1,0,1,0,0|2,0,0]=4 692 B9R1.175 CCCC1(CN)CCC1 CS-0297223 [0,1,0,1,0,0|2,0,0]=4 693 B9R1.175 CCCC1(CO)CCC1 CS-0524585 [0,1,0,1,0,0|1,1,0]=4 694 B9R1.175 CNC1(CCO)CCC1 CS-0623333 [0,1,0,1,0,0|1,0,0]=3 695 B9R1.24 CC1(C)CCCC1CBr CS-0279227 [0,1,0,1,0,0|2,0,0]=4 696 B9R1.24 CC1(C)CCCC1CN CS-0073238 [0,1,0,1,0,0|2,0,0]=4 697 B9R1.24 CC1(C)CCCC1CO CS-0021772 [0,1,0,1,0,0|1,0,0]=3 698 B9R1.24 CC1(C)CCOC1CI CS-0891777 [0,1,0,1,0,0|2,0,0]=4 699 B9R1.24 CC1(C)CNCC1CO CS-0467886 [0,1,0,1,0,0|2,0,0]=4 700 B9R1.24 CC1(C)OCCC1CO CS-0664422 [0,1,0,1,0,0|2,0,0]=4 701 B9R1.24 O=S1(=O)CCCC1CO CS-0495522 [0,1,0,1,0,0|1,1,0]=4 702 B9R1.148 CC1(C)CCCNCC1 CS-0047363 [0,1,0,1,0,0|2,0,0]=4 703 B9R1.148 CC1(C)CCCNCC1 CS-0482535 [0,1,0,1,0,0|2,0,0]=4 704 B9R1.148 CC1(O)CCCNCC1 CS-0055162 [0,1,0,1,0,0|1,1,0]=4 705 B9R1.148 CC1(O)CCCOCC1 CS-0231129 [0,1,0,1,0,0|0,1,0]=3 706 B9R2.8 NC1CC2CC(C1)C2 CS-0475757 [0,0,0,2,0,0|2,0,0]=4 707 B9R2.8 OC1CC2CC(C1)C2 CS-0475752 [0,0,0,2,0,0|1,0,0]=3 708 B9R2.39 NC1CC2CCC1C2 CS-0119836 [0,0,0,2,0,0|2,0,0]=4 709 B9R2.39 OC1CC2CC1CN2 CS-0052047 [0,0,0,2,0,0|1,0,0]=3 710 B9R2.39 OC1CC2CC1CN2 CS-0055416 [0,0,0,2,0,0|1,0,0]=3 711 B9R2.39 OC1CC2CCC1O2 CS-0825043 [0,0,0,2,0,0|0,1,0]=3 712 B9R2.39 OC1CC2CNC1C2 CS-0052046 [0,0,0,2,0,0|2,0,0]=4 713 B9R2.39 OC1CN2CCC1C2 CS-0264979 [0,0,0,2,0,0|2,0,0]=4 714 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1N2 CS-0053632 [0,0,0,2,0,0|1,0,0]=3 715 B9R2.39 O[C@H]1C[C@@H]2CC[C@H]1N2 CS-0053625 [0,0,0,2,0,0|1,0,0]=3 716 B9R2.39 O[C@H]1C[C@@H]2CN[C@H]1C2 CS-0309642 [0,0,0,2,0,0|2,0,0]=4 717 B9R2.39 [C@@H]12CCN(C[C@@H]1O)C2 CS-0104756 [0,0,0,2,0,0|2,0,0]=4 718 B9R2.39 [C@@H]12CC[C@@H](C[C@H]1O)C2 CS-0927583 [0,0,0,2,0,0|1,0,0]=3 719 B9R2.39 [C@@H]12C[C@@H](CN1)C[C@@H]2O CS-0878876 [0,0,0,2,0,0|2,0,0]=4 720 B9R2.39 [C@H]12C[C@H](O)[C@H](CN1)C2 CS-0623048 [0,0,0,2,0,0|1,0,0]=3 721 B9R2.68 C1CC2CCC(C2)N1 CS-0130658 [0,0,0,2,0,0|2,0,0]=4 722 B9R2.68 C1NCC2CC1CO2 CS-0133615 [0,0,0,2,0,0|2,0,0]=4 723 B9R2.7 [C@H]12C[C@H](N)[C@H]1CCO2 CS-0760087 [0,0,0,2,0,0|1,0,0]=3 724 B9R2.84 NCCC12CC(C1)C2 CS-0747522 [0,0,0,2,0,0|2,0,0]=4 725 B9R2.138 OC1CC2(CNC2)C1 CS-0069540 [0,0,0,2,0,0|2,0,0]=4 726 B9R2.2 C1CC(C2CC2)CN1 CS-0754286 [0,0,0,2,0,0|2,0,0]=4 727 B9R2.2 C1CCC(C2CO2)C1 CS-0233727 [0,0,0,2,0,0|1,0,0]=3 728 B9R2.2 C1CNC(C2CC2)C1 CS-0340051 [0,0,0,2,0,0|2,0,0]=4 729 B9R2.3 C1CC2CNCC2O1 CS-0057664 [0,0,0,2,0,0|2,0,0]=4 730 B9R2.3 C1NC[C@@H]2COC[C@@H]12 CS-0183065 [0,0,0,2,0,0|2,0,0]=4 731 B9R2.3 [C@@H]12CCC[C@H]1CNC2 CS-0495746 [0,0,0,2,0,0|2,0,0]=4 732 B9R2.3 [C@@H]12CCO[C@@H]1CCN2 CS-0092761 [0,0,0,2,0,0|1,0,0]=3 733 B9R2.3 [C@@H]12CNC[C@@H]1COC2 CS-0049661 [0,0,0,2,0,0|2,0,0]=4 734 B9R2.65 OCC1C2CCOC12 CS-0726246 [0,0,0,2,0,0|0,1,0]=3 735 B9R2.65 [C@@H]12CNC[C@@H]1[C@@H]2CO CS-0049601 [0,0,0,2,0,0|2,0,0]=4 736 B9R2.65 [C@H]12COC[C@@H]1C2CO CS-0047773 [0,0,0,2,0,0|2,0,0]=4 737 B9R2.173 C1CC2(CCO2)CN1 CS-0102307 [0,0,0,2,0,0|2,0,0]=4 738 B9R2.173 C1CC2(CCO2)CN1 CS-0183401 [0,0,0,2,0,0|2,0,0]=4 739 B9R2.173 C1CC2(CCOC2)N1 CS-0050156 [0,0,0,2,0,0|2,0,0]=4 740 B9R2.173 C1CC2(CNC2)CO1 CS-0183419 [0,0,0,2,0,0|2,0,0]=4 741 B9R2.173 C1CCC2(C1)CCN2 CS-0052637 [0,0,0,2,0,0|2,0,0]=4 742 B9R2.173 C1CNC2(C1)CCC2 CS-0074098 [0,0,0,2,0,0|2,0,0]=4 743 B9R2.173 C1CNC2(C1)CCC2 CS-0139249 [0,0,0,2,0,0|2,0,0]=4 744 B9R2.5 NC1CCCC12CC2 CS-0505616 [0,0,0,2,0,0|2,0,0]=4 745 B9R2.56 OCC12COCC1C2 CS-0120233 [0,0,0,2,0,0|2,0,0]=4 746 B9R2.56 OC[C@]12CNC[C@H]1C2 CS-0267862 [0,0,0,2,0,0|2,0,0]=4 747 B9R2.70 [C@@H]12CN[C@H](CO)[C@@H]1C2 CS-0053080 [0,0,0,2,0,0|2,0,0]=4 748 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO CS-0053567 [0,0,0,2,0,0|2,0,0]=4 749 B9R2.123 NC1C2CCCCC12 CS-0183372 [0,0,0,2,0,0|2,0,0]=4 750 B9R2.6 CC12CCNCC1C2 CS-0050165 [0,0,0,2,0,0|2,0,0]=4 751 B9R2.87 NC(C1CC1)C2CC2 CS-W019419 [0,0,0,2,0,0|2,0,0]=4