0 B8R1.1 CN1CCC(CN)C1 MC104144 [0,0,0,0,0,0|4,0,0]=4 1 B8R1.1 CN1CCC(CN)C1 MC105308 [0,0,0,0,0,0|4,0,0]=4 2 B8R1.1 CN1CCC(CO)C1 MC102370 [0,0,0,0,0,0|4,0,0]=4 3 B8R1.1 CN1CCC(CO)C1 MC102371 [0,0,0,0,0,0|4,0,0]=4 4 B8R1.1 NCC1CNC(=O)C1 MC101927 [0,0,0,0,0,0|3,0,0]=3 5 B8R1.1 NCC1CNC(=O)C1 MC105678 [0,0,0,0,0,0|3,0,0]=3 6 B8R1.1 NCC1CNC(=O)C1 MC121239 [0,0,0,0,0,0|3,0,0]=3 7 B8R1.1 NCC1CNC(=O)O1 MC103408 [0,0,0,0,0,0|2,0,0]=2 8 B8R1.1 NCC1COC(=O)N1 MC104254 [0,0,0,0,0,0|3,0,0]=3 9 B8R1.1 O=C1C=CC(CO)O1 MC20390 [0,0,0,0,0,0|1,0,2]=3 10 B8R1.1 O=C1CC(CF)CO1 MC10217 [0,0,0,0,0,0|3,0,0]=3 11 B8R1.1 O=C1CCC(CO)N1 CS13834 [0,0,0,0,0,0|2,0,0]=2 12 B8R1.1 O=C1CCC(CO)N1 CS15562 [0,0,0,0,0,0|2,0,0]=2 13 B8R1.1 O=C1NC(CO)CO1 MC427148 [0,0,0,0,0,0|3,0,0]=3 14 B7R1.1 BrCC1CCCC1 MC20145 [1,0,0,0,0,0|2,0,1]=4 15 B7R1.1 BrCC1CCCN1 MC114648 [1,0,0,0,0,0|2,0,1]=4 16 B7R1.1 BrCC1CCCO1 MC106365 [1,0,0,0,0,0|1,0,1]=3 17 B7R1.1 BrCC1OCCO1 CS21401 [1,0,0,0,0,0|2,0,1]=4 18 B7R1.1 CCC1CCCN1 MC110951 [1,0,0,0,0,0|1,0,1]=3 19 B7R1.1 CNC1CCOC1 MC104966 [1,0,0,0,0,0|3,0,0]=4 20 B7R1.1 CNC1CCOC1 MC105597 [1,0,0,0,0,0|3,0,0]=4 21 B7R1.1 COC1CCCN1 MC41692 [1,0,0,0,0,0|2,0,1]=4 22 B7R1.1 COC1CCNC1 CS12136 [1,0,0,0,0,0|3,0,0]=4 23 B7R1.1 COC1CCNC1 CS12137 [1,0,0,0,0,0|3,0,0]=4 24 B7R1.1 COC1CCNC1 CS22350 [1,0,0,0,0,0|3,0,0]=4 25 B7R1.1 ClCC1OCCO1 MC428002 [1,0,0,0,0,0|2,0,1]=4 26 B7R1.1 FCC1CCCN1 MC100102 [1,0,0,0,0,0|2,0,1]=4 27 B7R1.1 FCC1CCNC1 MC103199 [1,0,0,0,0,0|3,0,0]=4 28 B7R1.1 NCC1CCCC1 CS14873 [1,0,0,0,0,0|2,0,1]=4 29 B7R1.1 NCC1CCCN1 CS15469 [1,0,0,0,0,0|2,0,1]=4 30 B7R1.1 NCC1CCCN1 CS15745 [1,0,0,0,0,0|2,0,1]=4 31 B7R1.1 NCC1CCNC1 MC431426 [1,0,0,0,0,0|3,0,0]=4 32 B7R1.1 NCC1CCOC1 MC102307 [1,0,0,0,0,0|3,0,0]=4 33 B7R1.1 NCC1CCOC1 MC103862 [1,0,0,0,0,0|3,0,0]=4 34 B7R1.1 NCC1CCOC1 MC115675 [1,0,0,0,0,0|3,0,0]=4 35 B7R1.1 NCC1CCOC1 MC121256 [1,0,0,0,0,0|3,0,0]=4 36 B7R1.1 OCC1CC=CC1 CS20734 [1,0,0,0,0,0|2,0,1]=4 37 B7R1.1 OCC1CCCC1 CS11185 [1,0,0,0,0,0|2,0,1]=4 38 B7R1.1 OCC1CCCN1 CS17003 [1,0,0,0,0,0|2,0,1]=4 39 B7R1.1 OCC1CCCN1 CS22640 [1,0,0,0,0,0|2,0,1]=4 40 B7R1.1 OCC1CCCO1 MC20392 [1,0,0,0,0,0|1,0,1]=3 41 B7R1.1 OCC1CCNC1 CS11284 [1,0,0,0,0,0|3,0,0]=4 42 B7R1.1 OCC1CCNC1 CS16764 [1,0,0,0,0,0|3,0,0]=4 43 B7R1.1 OCC1CCNC1 CS18341 [1,0,0,0,0,0|3,0,0]=4 44 B7R1.1 OCC1CCNC1 MC102405 [1,0,0,0,0,0|3,0,0]=4 45 B7R1.1 OCC1CCNC1 MC115660 [1,0,0,0,0,0|3,0,0]=4 46 B7R1.1 OCC1CCOC1 MC113000 [1,0,0,0,0,0|3,0,0]=4 47 B7R1.1 OCC1CCOC1 MC113001 [1,0,0,0,0,0|3,0,0]=4 48 B7R1.1 OCC1CCOC1 MC427704 [1,0,0,0,0,0|3,0,0]=4 49 B7R1.2 CC1=CC(=O)CC1 CS22356 [1,0,0,0,0,0|1,0,1]=3 50 B7R1.2 CC1=CC(=O)CO1 MC429080 [1,0,0,0,0,0|2,0,1]=4 51 B7R1.2 CC1=NC(C)CO1 MC428186 [1,0,0,0,0,0|3,0,0]=4 52 B7R1.2 CC1=NNC(=O)O1 CS10427 [1,0,0,0,0,0|2,0,1]=4 53 B7R1.2 CC1=NSC(=O)O1 MC42245 [1,0,0,0,0,0|2,0,1]=4 54 B7R1.2 CC1CCC(C)N1 MC102818 [1,0,0,0,0,0|2,0,1]=4 55 B7R1.2 CC1COC(=O)N1 CS14300 [1,0,0,0,0,0|2,0,0]=3 56 B7R1.2 CC1COC(=O)O1 MC428298 [1,0,0,0,0,0|1,0,0]=2 57 B7R1.2 CN1CCC(=O)C1 CS20760 [1,0,0,0,0,0|2,0,0]=3 58 B7R1.2 NC1CNC(=O)C1 MC103473 [1,0,0,0,0,0|3,0,0]=4 59 B7R1.2 NC1COC(=O)C1 CS14340 [1,0,0,0,0,0|3,0,0]=4 60 B7R1.2 NC1COC(=O)C1 CS14674 [1,0,0,0,0,0|3,0,0]=4 61 B7R1.2 O=C1CC(O)CN1 CS14706 [1,0,0,0,0,0|3,0,0]=4 62 B7R1.2 O=C1CC(O)CN1 CS16472 [1,0,0,0,0,0|3,0,0]=4 63 B7R1.2 O=C1CCC(=O)N1 MC41707 [1,0,0,0,0,0|2,0,1]=4 64 B7R1.2 O=C1CCC(I)C1 MC115016 [1,0,0,0,0,0|2,0,0]=3 65 B9R1.7 CCCC1COC(=O)C1 MC426027 [0,1,0,0,0,0|2,0,0]=3 66 B9R1.7 CCNC1CCN(C)C1 MC103676 [0,1,0,0,0,0|3,0,0]=4 67 B9R1.7 CCOC1=CC(=O)CC1 MC425592 [0,1,0,0,0,0|1,0,1]=3 68 B9R1.7 CN1CCC(CCO)C1 MC102377 [0,1,0,0,0,0|3,0,0]=4 69 B9R1.21 OCC1CCC(CO)O1 CS11151 [0,1,0,0,0,0|1,0,2]=4 70 B9R1.35 CC(C)C1COC(=O)N1 CS22803 [0,1,0,0,0,0|2,0,0]=3 71 B9R1.35 CC(C)C1CSC(=S)N1 CS14634 [0,1,0,0,0,0|2,1,0]=4 72 B9R1.35 O=C1CCC(C(=O)O)C1 CS19439 [0,1,0,0,0,0|2,0,1]=4 73 B9R1.35 O=C1CCC(C(=O)O)C1 MC105133 [0,1,0,0,0,0|2,0,1]=4 74 B9R1.35 O=C1CCC(C(=O)O)C1 MC105627 [0,1,0,0,0,0|2,0,1]=4 75 B9R1.35 O=C1CCC(C(=O)O)N1 CS22212 [0,1,0,0,0,0|2,0,1]=4 76 B9R1.35 O=C1CCC(C(=O)O)N1 MC438135 [0,1,0,0,0,0|2,0,1]=4 77 B9R1.35 O=C1CCC(C(=O)O)S1 MC103888 [0,1,0,0,0,0|1,1,1]=4 78 B9R1.132 CN1C(=O)CCC1CO MC102373 [0,1,0,0,0,0|2,0,0]=3 79 B9R1.133 NCC1CCS(=O)(=O)C1 MC104488 [0,1,0,0,0,0|3,0,0]=4 80 B7R0.2 CCC(=O)CC(C)=O CS21124 [0,0,1,0,0,0|2,0,1]=4 81 B7R0.2 CCC(=O)OC(C)=O CS16382 [0,0,1,0,0,0|1,0,1]=3 82 B7R0.3 C=CCCC(O)CCl MC114485 [0,0,1,0,0,0|2,0,0]=3 83 B7R0.3 C=CCOC(=O)CCl MC428296 [0,0,1,0,0,0|1,0,2]=4 84 B7R0.3 CCC(O)CCCO MC116029 [0,0,1,0,0,0|0,0,2]=3 85 B7R0.3 COC(=O)CCC=O MC21172 [0,0,1,0,0,0|1,0,2]=4 86 B7R0.3 COC(=O)CCCBr MC427387 [0,0,1,0,0,0|3,0,0]=4 87 B7R0.3 COC(=O)CCCN MC439309 [0,0,1,0,0,0|3,0,0]=4 88 B7R0.4 C#CCCCC(=O)O CS14686 [0,0,1,0,0,0|0,0,2]=3 89 B7R0.4 C=CCNCC(=O)O MC439317 [0,0,1,0,0,0|1,0,2]=4 90 B7R0.4 CC(=O)CCCCBr CS10627 [0,0,1,0,0,0|2,0,0]=3 91 B7R0.4 CC(O)CCCCO MC112436 [0,0,1,0,0,0|2,0,1]=4 92 B7R0.4 CCCCCB(O)O CS22305 [0,0,1,0,0,0|1,0,1]=3 93 B7R0.4 CCCCCC(C)O CS21570 [0,0,1,0,0,0|1,0,1]=3 94 B7R0.4 CCCOCC(=O)O MC425744 [0,0,1,0,0,0|1,0,0]=2 95 B7R0.4 CCC\C=C\C(C)=O MC20875 [0,0,1,0,0,0|1,0,2]=4 96 B7R0.4 CCO\C=C\C(=O)O CS22271 [0,0,1,0,0,0|1,0,2]=4 97 B7R0.4 NCCCCC(=O)O MC428108 [0,0,1,0,0,0|1,0,0]=2 98 B7R0.4 NCCNCC(=O)O MC436179 [0,0,1,0,0,0|2,0,0]=3 99 B7R0.4 O=C(O)CCCCBr MC41866 [0,0,1,0,0,0|1,0,0]=2 100 B9R2.39 O=C1NC2C=CC1C2 CS19496 [0,0,0,1,0,0|1,0,2]=4 101 B9R2.39 O=C1NC2C=CC1C2 CS19497 [0,0,0,1,0,0|1,0,2]=4 102 B9R2.68 C1CC2CCC(C1)N2 MC444465 [0,0,0,1,0,0|2,0,1]=4 103 B9R2.68 C1CC2CNCC1O2 CS10860 [0,0,0,1,0,0|2,0,1]=4 104 B7R1.8 CN1CCC1CN MC104666 [0,0,0,0,1,0|3,0,0]=4 105 B7R1.8 CN1CCC1CN MC104667 [0,0,0,0,1,0|3,0,0]=4 106 B7R1.8 CN1CCC1CN MC105491 [0,0,0,0,1,0|3,0,0]=4 107 B7R1.8 O=C1CCC1CO MC104211 [0,0,0,0,1,0|1,0,0]=2 108 B7R1.8 O=C1CCC1CO MC104212 [0,0,0,0,1,0|1,0,0]=2 109 B7R1.8 O=C1CCC1CO MC104213 [0,0,0,0,1,0|1,0,0]=2 110 B7R1.10 NCC1CC(=O)C1 MC444212 [0,0,0,0,1,0|2,0,0]=3 111 B7R1.10 NCC1CC(=O)N1 MC111758 [0,0,0,0,1,0|2,0,0]=3 112 B7R1.10 O=C1CC(CI)N1 MC111759 [0,0,0,0,1,0|2,0,0]=3 113 B7R1.10 O=C1CC(CO)C1 MC113039 [0,0,0,0,1,0|2,0,0]=3 114 B9R1.1 CNC1CCC(=O)CC1 CS14610 [0,0,0,0,0,1|2,0,0]=3 115 B9R1.1 COC1CCC(=O)CC1 CS14437 [0,0,0,0,0,1|2,0,0]=3 116 B9R1.1 N#CC1CCC(=O)CC1 CS13355 [0,0,0,0,0,1|2,0,1]=4 117 B9R1.1 NCC1CCC(=O)NC1 MC101985 [0,0,0,0,0,1|2,0,0]=3 118 B9R1.1 O=CC1CCC(=O)CC1 MC112097 [0,0,0,0,0,1|2,0,1]=4 119 B9R1.2 NCC1CCNC(=O)C1 MC101902 [0,0,0,0,0,1|2,0,0]=3 120 B9R1.2 NCC1CCNC(=O)C1 MC102333 [0,0,0,0,0,1|2,0,0]=3 121 B9R1.2 O=C1CC(CO)CCN1 MC444199 [0,0,0,0,0,1|2,0,0]=3 122 B9R1.2 O=C1COCC(CO)N1 CS17255 [0,0,0,0,0,1|2,0,0]=3 123 B6R0.1 C#CC(=O)OCC MC434052 [1,0,1,0,0,0|0,0,2]=4 124 B6R0.1 CCC(C)CCBr MC112369 [1,0,1,0,0,0|2,0,0]=4 125 B6R0.1 CCCC(=O)NN CS22544 [1,0,1,0,0,0|2,0,0]=4 126 B6R0.1 CCCC(O)CO CS20495 [1,0,1,0,0,0|1,0,1]=4 127 B6R0.1 CCNC(=O)NC MC428152 [1,0,1,0,0,0|2,0,0]=4 128 B6R0.1 CCOC(=O)CBr MC41907 [1,0,1,0,0,0|1,0,0]=3 129 B6R0.1 CCOC(=O)CCl MC41910 [1,0,1,0,0,0|1,0,0]=3 130 B6R0.1 CCOC(=O)CN CS15347 [1,0,1,0,0,0|1,0,0]=3 131 B6R0.1 CCOC(=O)CO CS11386 [1,0,1,0,0,0|1,0,0]=3 132 B6R0.1 CCOC(=O)NN CS11383 [1,0,1,0,0,0|2,0,0]=4 133 B6R0.1 CNC(=O)CCN MC112263 [1,0,1,0,0,0|2,0,0]=4 134 B6R0.1 CNCC(=O)OC MC438154 [1,0,1,0,0,0|2,0,0]=4 135 B6R0.1 COC(=O)CCBr CS18993 [1,0,1,0,0,0|2,0,0]=4 136 B6R0.1 COC(=O)CCN CS22266 [1,0,1,0,0,0|2,0,0]=4 137 B6R0.1 OC(CBr)CCBr MC107100 [1,0,1,0,0,0|2,0,0]=4 138 B6R0.1 OC(CBr)CCBr MC107101 [1,0,1,0,0,0|2,0,0]=4 139 B6R0.1 OCCC(O)CO MC42234 [1,0,1,0,0,0|1,0,1]=4 140 B6R0.4 C#CCCC(=O)O MC428029 [1,0,1,0,0,0|0,0,2]=4 141 B6R0.4 C=CCCC(=O)O CS15216 [1,0,1,0,0,0|0,0,2]=4 142 B6R0.4 CC(=O)CCCBr CS10305 [1,0,1,0,0,0|2,0,0]=4 143 B6R0.4 CC(=O)CCCCl CS10334 [1,0,1,0,0,0|2,0,0]=4 144 B6R0.4 CC(=O)NCCCl MC33011 [1,0,1,0,0,0|2,0,0]=4 145 B6R0.4 CC(C)CCC=O MC428026 [1,0,1,0,0,0|1,0,0]=3 146 B6R0.4 CCCCC(=O)Cl MC40508 [1,0,1,0,0,0|1,0,0]=3 147 B6R0.4 N#CCCC(=O)O CS22262 [1,0,1,0,0,0|1,0,1]=4 148 B6R0.4 NCCCC(=O)O CS14998 [1,0,1,0,0,0|1,0,0]=3 149 B6R0.4 NCCCC(N)=O MC112262 [1,0,1,0,0,0|2,0,0]=4 150 B6R0.4 O=C(Cl)CCCCl MC40450 [1,0,1,0,0,0|2,0,0]=4 151 B6R0.4 O=C(O)CCCBr CS14053 [1,0,1,0,0,0|1,0,0]=3 152 B6R0.6 C=CCCCCCl MC427568 [1,0,1,0,0,0|2,0,0]=4 153 B6R0.6 C=CCCCCN MC111853 [1,0,1,0,0,0|2,0,0]=4 154 B6R0.6 C=CCCCCO CS10397 [1,0,1,0,0,0|2,0,0]=4 155 B6R0.6 CCCOCCCl MC428009 [1,0,1,0,0,0|1,0,1]=4 156 B6R0.6 COCCCC=O MC111975 [1,0,1,0,0,0|1,0,0]=3 157 B6R0.6 OCCCCCCl CS14778 [1,0,1,0,0,0|1,0,1]=4 158 B6R0.6 OCCCCCO CS20549 [1,0,1,0,0,0|1,0,1]=4 159 B6R1.2 CC1=NCCC1 CS21664 [2,0,0,0,0,0|2,0,0]=4 160 B6R1.2 CC1CCCN1 CS18299 [2,0,0,0,0,0|1,0,1]=4 161 B6R1.2 CC1CCCN1 CS18800 [2,0,0,0,0,0|1,0,1]=4 162 B6R1.2 CC1CCCN1 CS19735 [2,0,0,0,0,0|1,0,1]=4 163 B6R1.2 CC1CCCN1 CS21699 [2,0,0,0,0,0|1,0,1]=4 164 B6R1.2 CC1CCCN1 CS21700 [2,0,0,0,0,0|1,0,1]=4 165 B6R1.2 CC1CCCN1 MC428345 [2,0,0,0,0,0|1,0,1]=4 166 B6R1.2 CC1CCCO1 MC20580 [2,0,0,0,0,0|0,0,1]=3 167 B6R1.2 NC1=NCCC1 CS19310 [2,0,0,0,0,0|2,0,0]=4 168 B6R1.2 O=C1CCCC1 MC21085 [2,0,0,0,0,0|1,0,0]=3 169 B6R1.2 O=C1CCNC1 CS22412 [2,0,0,0,0,0|2,0,0]=4 170 B6R1.2 O=C1CCOC1 CS18178 [2,0,0,0,0,0|2,0,0]=4 171 B6R1.2 O=C1CCSC1 MC20305 [2,0,0,0,0,0|2,0,0]=4 172 B6R1.2 O=C1CNCN1 CS15654 [2,0,0,0,0,0|2,0,0]=4 173 B6R1.2 O=C1NCCN1 CS21607 [2,0,0,0,0,0|2,0,0]=4 174 B6R1.2 O=C1NCCS1 CS20525 [2,0,0,0,0,0|1,1,0]=4 175 B6R1.2 O=C1OCCO1 CS20012 [2,0,0,0,0,0|1,0,0]=3 176 B8R0.2 CCC(C)C(N)C(=O)O MC20633 [0,1,1,0,0,0|2,0,0]=4 177 B8R0.2 CCC(C)C(N)C(=O)O MC437790 [0,1,1,0,0,0|2,0,0]=4 178 B8R0.2 CCC(C)C(N)C(=O)O MC437791 [0,1,1,0,0,0|2,0,0]=4 179 B8R0.2 CCC(C)C(N)C(=O)O MC437792 [0,1,1,0,0,0|2,0,0]=4 180 B8R0.2 CCC(C)C(N)C(=O)O MC437793 [0,1,1,0,0,0|2,0,0]=4 181 B8R0.2 CCC(C)C(N)C(=O)O MC437794 [0,1,1,0,0,0|2,0,0]=4 182 B8R0.2 CCC(C)C(N)C(N)=O MC437802 [0,1,1,0,0,0|2,0,0]=4 183 B8R0.23 CC(C)C(C)CC(=O)O MC112320 [0,1,1,0,0,0|2,0,0]=4 184 B8R0.1 CCOC(=O)CCCO MC111642 [0,1,1,0,0,0|2,0,0]=4 185 B8R0.3 CCCC(N)C(=O)OC MC438026 [0,1,1,0,0,0|2,0,0]=4 186 B8R0.3 CCOC(=O)C(=O)CC CS13439 [0,1,1,0,0,0|2,0,0]=4 187 B8R0.3 O=CCC(O)C(O)CO CS21863 [0,1,1,0,0,0|1,0,0]=3 188 B8R0.6 C=CCOCC(O)CO MC436170 [0,1,1,0,0,0|2,0,0]=4 189 B8R0.6 CCCCNC(=O)CCl CS11766 [0,1,1,0,0,0|2,0,0]=4 190 B8R0.6 CCCSCC(=O)OC MC434048 [0,1,1,0,0,0|1,1,0]=4 191 B8R0.9 C=CC(=O)OCC(C)O CS21600 [0,1,1,0,0,0|0,0,2]=4 192 B8R0.7 CCCCCCB(O)O MC31067 [0,1,1,0,0,0|1,0,1]=4 193 B8R0.7 COCCOCC(=O)O MC10458 [0,1,1,0,0,0|1,0,0]=3 194 B8R0.7 CSCCCCC(=O)O MC112374 [0,1,1,0,0,0|0,0,0]=2 195 B8R0.7 NCCCCCC(=O)O CS13381 [0,1,1,0,0,0|0,0,0]=2 196 B8R0.7 O=C(O)CCCCCBr CS18405 [0,1,1,0,0,0|0,0,0]=2 197 B8R0.21 CCCCCS(=O)(=O)[O-] MC445019 [0,1,1,0,0,0|1,0,1]=4 198 B8R0.21 CCCCCS(=O)(=O)[O-] MC445025 [0,1,1,0,0,0|1,0,1]=4 199 B8R0.28 CN(C)CCCC(=O)O CS18615 [0,1,1,0,0,0|1,0,0]=3 200 B8R0.28 O=C(O)CCCC(=O)O MC20876 [0,1,1,0,0,0|1,0,1]=4 201 B8R1.8 BrCCC1OCCO1 CS18251 [1,1,0,0,0,0|1,0,1]=4 202 B8R1.8 COCC1CCCN1 CS20310 [1,1,0,0,0,0|1,0,1]=4 203 B8R1.8 COCC1CCNC1 MC104848 [1,1,0,0,0,0|2,0,0]=4 204 B8R1.8 COCC1CCNC1 MC105535 [1,1,0,0,0,0|2,0,0]=4 205 B8R1.8 ICCC1CCCC1 MC106254 [1,1,0,0,0,0|1,0,1]=4 206 B8R1.8 NCCC1CCCC1 CS15909 [1,1,0,0,0,0|1,0,1]=4 207 B8R1.8 OCCC1CCCN1 MC103847 [1,1,0,0,0,0|1,0,1]=4 208 B8R1.8 OCCC1CCCN1 MC106622 [1,1,0,0,0,0|1,0,1]=4 209 B8R1.18 CC1CC(=O)OC1=O MC440511 [1,1,0,0,0,0|1,0,1]=4 210 B8R1.18 CC1CC(S)C(C)O1 MC115503 [1,1,0,0,0,0|1,0,1]=4 211 B8R1.50 CC1=C(O)C(=O)CC1 CS16508 [1,1,0,0,0,0|1,0,1]=4 212 B8R1.51 CC1(C)CNC(=O)C1 CS22480 [1,1,0,0,0,0|2,0,0]=4 213 B8R1.51 CC1(C)CNC(=O)N1 MC443125 [1,1,0,0,0,0|2,0,0]=4 214 B10R1.1 CCCC1CCC(=O)OC1 MC440473 [0,1,0,0,0,1|0,0,0]=2 215 B10R1.1 NCCN1CCC(=O)CC1 MC111194 [0,1,0,0,0,1|2,0,0]=4 216 B10R1.13 CN(C)C1CCC(=O)CC1 MC429047 [0,1,0,0,0,1|2,0,0]=4 217 B10R1.10 CCCC1CCCC(=O)C1 MC106166 [0,1,0,0,0,1|1,0,0]=3 218 B10R1.10 CCOC1=CC(=O)CCC1 MC428210 [0,1,0,0,0,1|1,0,1]=4 219 B10R1.10 COCC1CCCC(=O)C1 MC106177 [0,1,0,0,0,1|1,0,0]=3 220 B10R1.14 COC(=O)C1CCC(=O)C1 MC104918 [0,2,0,0,0,0|1,0,1]=4 221 B10R1.14 COC(=O)C1CCC(=O)C1 MC105581 [0,2,0,0,0,0|1,0,1]=4 222 B10R1.14 COC(=O)C1CCC(=O)N1 CS14546 [0,2,0,0,0,0|1,0,1]=4 223 B10R1.14 COC(=O)C1CCC(=O)N1 CS15487 [0,2,0,0,0,0|1,0,1]=4 224 B10R1.94 CCOC1=C(Br)C(=O)CC1 MC425599 [0,2,0,0,0,0|1,0,1]=4 225 B8R1.4 CC1CC(=O)CCN1 MC101989 [0,0,1,1,0,0|2,0,0]=4 226 B8R1.4 CC1CC(=O)CCN1 MC103769 [0,0,1,1,0,0|2,0,0]=4 227 B8R1.4 CC1CC(=O)CCN1 MC444193 [0,0,1,1,0,0|2,0,0]=4 228 B8R1.4 CC1CC(=O)CCO1 MC103799 [0,0,1,1,0,0|2,0,0]=4 229 B8R1.4 CC1CC(=O)CCO1 MC103800 [0,0,1,1,0,0|2,0,0]=4 230 B8R1.4 CC1CC(=O)CCO1 MC31001 [0,0,1,1,0,0|2,0,0]=4 231 B8R1.4 CC1CNCC(=O)N1 MC103795 [0,0,1,1,0,0|2,0,0]=4 232 B8R1.4 CC1CNCC(=O)N1 MC104244 [0,0,1,1,0,0|2,0,0]=4 233 B8R1.4 CC1CNCC(=O)N1 MC444027 [0,0,1,1,0,0|2,0,0]=4 234 B8R1.4 O=C1CCCC(=O)O1 CS11243 [0,0,1,1,0,0|1,0,1]=4 235 B8R1.34 CC(=O)SC1CNC1 MC103969 [0,0,1,1,0,0|1,1,0]=4 236 B8R1.34 O=C(O)CC1CCC1 CS11177 [0,0,1,1,0,0|2,0,0]=4 237 B8R1.2 OCC1CCC=CO1 MC20505 [0,0,1,1,0,0|2,0,0]=4 238 B8R1.3 C=C1CCC(=O)CC1 MC106742 [0,0,1,1,0,0|1,0,1]=4 239 B8R1.3 C=C1CCC(C)CC1 MC105701 [0,0,1,1,0,0|2,0,0]=4 240 B8R1.3 CN1CCC(=O)CC1 CS18410 [0,0,1,1,0,0|2,0,0]=4 241 B8R1.3 CN1CCC(O)CC1 CS13491 [0,0,1,1,0,0|2,0,0]=4 242 B8R1.3 NC1CCC(=O)CC1 CS22583 [0,0,1,1,0,0|1,0,0]=3 243 B8R1.3 NC1CCC(=O)NC1 MC113024 [0,0,1,1,0,0|2,0,0]=4 244 B8R1.3 NC1CCC(=O)NC1 MC444382 [0,0,1,1,0,0|2,0,0]=4 245 B8R1.3 NC1CCC(O)CC1 CS12038 [0,0,1,1,0,0|1,0,1]=4 246 B8R1.3 NC1CCC(O)CC1 CS15381 [0,0,1,1,0,0|1,0,1]=4 247 B8R1.3 NC1CCC(O)CC1 CS18581 [0,0,1,1,0,0|1,0,1]=4 248 B8R1.3 NC1CCC(O)CC1 CS18592 [0,0,1,1,0,0|1,0,1]=4 249 B8R1.3 O=C1CCC(=O)CC1 CS19236 [0,0,1,1,0,0|0,0,2]=4 250 B8R1.3 O=C1CCC(O)CC1 CS22889 [0,0,1,1,0,0|0,0,0]=2 251 B8R1.3 OC1CCC(O)CC1 CS20531 [0,0,1,1,0,0|0,0,2]=4 252 B8R1.3 OC1CCC(O)CC1 MC103601 [0,0,1,1,0,0|0,0,2]=4 253 B8R1.5 CC1CCNCC1=O MC105562 [0,0,1,1,0,0|2,0,0]=4 254 B8R1.5 CC1CNCCC1=O MC106748 [0,0,1,1,0,0|2,0,0]=4 255 B8R1.5 CC1COCCC1=O MC425868 [0,0,1,1,0,0|2,0,0]=4 256 B8R1.5 NC1CCCNC1=O MC106744 [0,0,1,1,0,0|2,0,0]=4 257 B8R1.5 O=C1NCCCC1Br CS14644 [0,0,1,1,0,0|2,0,0]=4 258 B8R1.5 O=C1NCCCC1O CS19689 [0,0,1,1,0,0|2,0,0]=4 259 B8R1.5 O=C1OCCCC1O CS16147 [0,0,1,1,0,0|1,0,0]=3 260 B8R1.22 O=C1CCCNCC1 CS19096 [0,0,1,1,0,0|2,0,0]=4 261 B8R1.22 O=C1CCNCCN1 CS18857 [0,0,1,1,0,0|2,0,0]=4 262 B8R1.22 O=C1CCSCCN1 MC121122 [0,0,1,1,0,0|2,0,0]=4 263 B8R1.35 O=C(O)CCC1CC1 CS19562 [0,0,1,1,0,0|0,0,0]=2 264 B8R2.22 C1CC2CNCC12 MC103502 [1,0,0,1,0,0|2,0,0]=4 265 B8R2.22 C1CC2CNCC12 MC105043 [1,0,0,1,0,0|2,0,0]=4 266 B8R2.34 C1=CC2CCC1C2 CS11805 [1,0,0,1,0,0|1,0,0]=3 267 B8R2.34 C1CC2CCC1N2 CS10780 [1,0,0,1,0,0|1,0,1]=4 268 B8R2.34 C1CC2CCC1N2 MC113036 [1,0,0,1,0,0|1,0,1]=4 269 B8R2.34 C1OC2CNC1C2 CS12565 [1,0,0,1,0,0|1,0,1]=4 270 B8R2.34 C1OC2CNC1C2 MC102221 [1,0,0,1,0,0|1,0,1]=4 271 B8R2.34 C1OC2CNC1C2 MC103903 [1,0,0,1,0,0|1,0,1]=4 272 B8R2.34 C1OC2CNC1C2 MC105588 [1,0,0,1,0,0|1,0,1]=4 273 B8R2.34 C1OC2CNC1C2 MC31167 [1,0,0,1,0,0|1,0,1]=4 274 B8R2.34 C1OC2CNC1C2 MC444007 [1,0,0,1,0,0|1,0,1]=4 275 B8R2.55 C1CC2(CC2)CN1 MC103447 [1,0,0,1,0,0|2,0,0]=4 276 B8R2.55 C1CNC2(C1)CC2 MC103449 [1,0,0,1,0,0|1,0,1]=4 277 B10R2.178 O=C1CCC2CCC1N2 MC105539 [0,0,0,1,0,1|1,0,0]=3 278 B10R2.178 O=C1NCC2CCC1N2 MC105362 [0,0,0,1,0,1|2,0,0]=4 279 B10R2.71 O=C1CC2CCC(C1)N2 CS18910 [0,0,0,1,0,1|1,0,0]=3 280 B10R2.534 O=C1CCCC2(CC2)N1 CS17693 [0,0,0,1,0,1|1,0,0]=3 281 B10R2.2 O=C1CC2C=CCC2N1 MC105316 [0,1,0,1,0,0|1,0,1]=4 282 B10R2.32 O=C1NCC2CCNC12 MC103732 [0,1,0,1,0,0|2,0,0]=4 283 B10R2.138 C1CC2CCC(CN1)O2 MC121376 [0,1,0,1,0,0|1,0,1]=4 284 B10R2.332 O=C1CC2(CNC2)CN1 CS17396 [0,1,0,1,0,0|2,0,0]=4 285 B10R2.332 O=C1NCC2(CCC2)O1 MC101986 [0,1,0,1,0,0|1,0,0]=3 286 B6R0.3 CC(CN)C(=O)O MC105846 [0,0,1,0,1,0|2,0,0]=4 287 B6R0.3 CC(CN)C(=O)O MC105847 [0,0,1,0,1,0|2,0,0]=4 288 B6R0.3 CCC(Br)C(=O)O MC426015 [0,0,1,0,1,0|2,0,0]=4 289 B6R0.3 CCC(Cl)C(=O)O MC426016 [0,0,1,0,1,0|2,0,0]=4 290 B6R0.3 CCC(N)C(=O)O CS13661 [0,0,1,0,1,0|2,0,0]=4 291 B6R0.3 CCC(N)C(=O)O CS14054 [0,0,1,0,1,0|2,0,0]=4 292 B6R0.3 CCC(N)C(=O)O CS14084 [0,0,1,0,1,0|2,0,0]=4 293 B6R0.3 CCC(N)C(N)=O CS15891 [0,0,1,0,1,0|2,0,0]=4 294 B6R0.3 CCC(N)C(N)=O MC436006 [0,0,1,0,1,0|2,0,0]=4 295 B6R0.3 CNC(C)C(=O)O MC428068 [0,0,1,0,1,0|2,0,0]=4 296 B6R0.3 CNC(C)C(=O)O MC428076 [0,0,1,0,1,0|2,0,0]=4 297 B6R0.3 CNC(C)C(=O)O MC428084 [0,0,1,0,1,0|2,0,0]=4 298 B6R0.3 COC(C)C(=O)O CS14024 [0,0,1,0,1,0|2,0,0]=4 299 B6R0.3 COC(C)C(=O)O MC425243 [0,0,1,0,1,0|2,0,0]=4 300 B6R0.3 CON(C)C(C)=O CS11789 [0,0,1,0,1,0|2,0,0]=4 301 B6R1.6 BrCC1CCC1 MC10470 [1,0,0,0,1,0|1,0,1]=4 302 B6R1.6 BrCC1CCO1 MC444177 [1,0,0,0,1,0|1,0,0]=3 303 B6R1.6 NCC1CCC1 CS11178 [1,0,0,0,1,0|1,0,1]=4 304 B6R1.6 NCC1CCN1 MC121273 [1,0,0,0,1,0|2,0,0]=4 305 B6R1.6 NCC1CCO1 MC121118 [1,0,0,0,1,0|1,0,0]=3 306 B6R1.6 OCC1CCN1 CS15230 [1,0,0,0,1,0|2,0,0]=4 307 B6R1.6 OCC1CCN1 MC102029 [1,0,0,0,1,0|2,0,0]=4 308 B6R1.6 OCC1CCN1 MC102030 [1,0,0,0,1,0|2,0,0]=4 309 B6R1.6 OCC1CCO1 CS15009 [1,0,0,0,1,0|1,0,0]=3 310 B6R1.4 CC1COC1=O MC121237 [1,0,0,0,1,0|1,0,0]=3 311 B6R1.5 NC1CC(=O)C1 MC444232 [1,0,0,0,1,0|2,0,0]=4 312 B6R1.5 O=C1CC(F)C1 MC104154 [1,0,0,0,1,0|2,0,0]=4