0 B8R0.7 C#CCCCCC(=O)O MCULE-5828767633 [0,0,0,0,0,0|1,0,1]=2 1 B8R0.7 C#CCCCOC(=O)C MCULE-5113085970 [0,0,0,0,0,0|3,0,1]=4 2 B8R0.7 C#CCCOCC(=O)O MCULE-5200842540 [0,0,0,0,0,0|2,0,1]=3 3 B8R0.7 C#CCOCCC(=O)O MCULE-9710662304 [0,0,0,0,0,0|2,0,1]=3 4 B8R0.7 C=C(Br)CCCCC#N MCULE-7605078612 [0,0,0,0,0,0|2,0,2]=4 5 B8R0.7 C=C(Br)CCCCCC MCULE-3502674829 [0,0,0,0,0,0|3,0,0]=3 6 B8R0.7 C=C(Br)CCCCCCl MCULE-8350652246 [0,0,0,0,0,0|3,0,0]=3 7 B8R0.7 C=C(Br)CNCCCC MCULE-5896177180 [0,0,0,0,0,0|4,0,0]=4 8 B8R0.7 C=C(Br)CNCCCC MCULE-9529942902 [0,0,0,0,0,0|4,0,0]=4 9 B8R0.7 C=C(C)CCCCC#N MCULE-5170658288 [0,0,0,0,0,0|2,0,2]=4 10 B8R0.7 C=C(C)CCCCCC MCULE-2243788093 [0,0,0,0,0,0|3,0,0]=3 11 B8R0.7 C=C(C)CCCCCCl MCULE-5646492015 [0,0,0,0,0,0|3,0,0]=3 12 B8R0.7 C=C(C)CSCCCC MCULE-7053589995 [0,0,0,0,0,0|4,0,0]=4 13 B8R0.7 C=C(Cl)CCCCC#N MCULE-9800519169 [0,0,0,0,0,0|2,0,2]=4 14 B8R0.7 C=C(Cl)CCCCCC MCULE-4545659103 [0,0,0,0,0,0|3,0,0]=3 15 B8R0.7 C=C(Cl)CCCCCCl MCULE-3447520654 [0,0,0,0,0,0|3,0,0]=3 16 B8R0.7 C=CCCCCB(O)O MCULE-5017277637 [0,0,0,0,0,0|2,0,2]=4 17 B8R0.7 C=CCCCCC(=O)C MCULE-4268619428 [0,0,0,0,0,0|2,0,1]=3 18 B8R0.7 C=CCCCCC(=O)O MCULE-1991116122 [0,0,0,0,0,0|1,0,1]=2 19 B8R0.7 C=CCCCCN(=O)=O MCULE-9629476544 [0,0,0,0,0,0|2,0,2]=4 20 B8R0.7 C=CCCCOC(=O)C MCULE-2972695808 [0,0,0,0,0,0|3,0,1]=4 21 B8R0.7 C=CCCNCC(=O)O MCULE-7775351645 [0,0,0,0,0,0|2,0,1]=3 22 B8R0.7 C=CCCOCC(=O)O MCULE-8626594933 [0,0,0,0,0,0|2,0,1]=3 23 B8R0.7 C=CCNCCC(=O)N MCULE-4087711448 [0,0,0,0,0,0|3,0,1]=4 24 B8R0.7 C=CCOCCC(=O)O MCULE-6102747899 [0,0,0,0,0,0|2,0,1]=3 25 B8R0.7 CC#CCCCC(=O)C MCULE-4297141774 [0,0,0,0,0,0|2,0,2]=4 26 B8R0.7 CC#CCCCC(=O)O MCULE-2531382210 [0,0,0,0,0,0|1,0,2]=3 27 B8R0.7 CC(=O)CCCCC#N MCULE-2841814511 [0,0,0,0,0,0|1,0,2]=3 28 B8R0.7 CC(=O)CCCCCBr MCULE-8946921118 [0,0,0,0,0,0|2,0,0]=2 29 B8R0.7 CC(=O)CCCCCN MCULE-3568024595 [0,0,0,0,0,0|1,0,0]=1 30 B8R0.7 CC(=O)CCCCCN MCULE-9938894581 [0,0,0,0,0,0|1,0,0]=1 31 B8R0.7 CC(=O)CCCN=N#N MCULE-4708169857 [0,0,0,0,0,0|3,0,1]=4 32 B8R0.7 CC(=O)CCCOC=O MCULE-7473574321 [0,0,0,0,0,0|3,0,1]=4 33 B8R0.7 CC(=O)NCCCCN MCULE-6666803790 [0,0,0,0,0,0|2,0,0]=2 34 B8R0.7 CC(=O)NCCCCN MCULE-8971714473 [0,0,0,0,0,0|2,0,0]=2 35 B8R0.7 CC(=O)NCCCCO MCULE-5119895862 [0,0,0,0,0,0|3,0,0]=3 36 B8R0.7 CC(=O)OCCCCBr MCULE-6081921662 [0,0,0,0,0,0|3,0,0]=3 37 B8R0.7 CC(=O)OCCCCCl MCULE-3999602136 [0,0,0,0,0,0|3,0,0]=3 38 B8R0.7 CC(=O)OCCCCI MCULE-6699791525 [0,0,0,0,0,0|3,0,0]=3 39 B8R0.7 CC(=O)OCCCCO MCULE-7064721476 [0,0,0,0,0,0|3,0,0]=3 40 B8R0.7 CC(=O)OCCOCCl MCULE-2565061276 [0,0,0,0,0,0|4,0,0]=4 41 B8R0.7 CC(=O)SCCCCBr MCULE-1636667997 [0,0,0,0,0,0|3,0,0]=3 42 B8R0.7 CC(=O)SCCCCN MCULE-2425585672 [0,0,0,0,0,0|2,0,0]=2 43 B8R0.7 CC(=O)SCCCCN MCULE-9899884734 [0,0,0,0,0,0|2,0,0]=2 44 B8R0.7 CC(C)CCCCCBr MCULE-6339659463 [0,0,0,0,0,0|3,0,1]=4 45 B8R0.7 CC(C)CCCCCN MCULE-4764798524 [0,0,0,0,0,0|2,0,1]=3 46 B8R0.7 CC(C)CCCCCO MCULE-2133434329 [0,0,0,0,0,0|3,0,1]=4 47 B8R0.7 CC(C)CCNCCN MCULE-3917899793 [0,0,0,0,0,0|3,0,1]=4 48 B8R0.7 CC(C)CCOCCN MCULE-2357363560 [0,0,0,0,0,0|3,0,1]=4 49 B8R0.7 CC(C)COCCCN MCULE-1113222381 [0,0,0,0,0,0|3,0,1]=4 50 B8R0.7 CC(C)CSCCCN MCULE-7842745549 [0,0,0,0,0,0|3,0,1]=4 51 B8R0.7 CC(C)OCCCCN MCULE-1961317000 [0,0,0,0,0,0|3,0,1]=4 52 B8R0.7 CC(C)SCCCCN MCULE-5756873286 [0,0,0,0,0,0|3,0,1]=4 53 B8R0.7 CC=CCCCC(=O)C MCULE-7957571875 [0,0,0,0,0,0|2,0,2]=4 54 B8R0.7 CC=CCCCC(=O)O MCULE-3300087433 [0,0,0,0,0,0|1,0,2]=3 55 B8R0.7 CCCC/C=C/C(=O)C MCULE-1532446839 [0,0,0,0,0,0|2,0,2]=4 56 B8R0.7 CCCC/C=C/C(=O)O MCULE-6916224344 [0,0,0,0,0,0|1,0,2]=3 57 B8R0.7 CCCC=CCC(=O)O MCULE-3879649411 [0,0,0,0,0,0|1,0,2]=3 58 B8R0.7 CCCCC#CC(=O)O MCULE-4160128187 [0,0,0,0,0,0|1,0,2]=3 59 B8R0.7 CCCCC=CC(=O)C MCULE-6026245958 [0,0,0,0,0,0|2,0,2]=4 60 B8R0.7 CCCCC=CC(=O)Cl MCULE-3883159938 [0,0,0,0,0,0|2,0,2]=4 61 B8R0.7 CCCCC=CC(=O)O MCULE-6837768730 [0,0,0,0,0,0|1,0,2]=3 62 B8R0.7 CCCCCCB(O)O MCULE-6503959495 [0,0,0,0,0,0|2,0,1]=3 63 B8R0.7 CCCCCCC(=O)C MCULE-1152821440 [0,0,0,0,0,0|2,0,0]=2 64 B8R0.7 CCCCCCC(=O)Cl MCULE-8559884798 [0,0,0,0,0,0|2,0,0]=2 65 B8R0.7 CCCCCCC(=O)N MCULE-1210996881 [0,0,0,0,0,0|2,0,0]=2 66 B8R0.7 CCCCCCC(=O)O MCULE-1489137568 [0,0,0,0,0,0|1,0,0]=1 67 B8R0.7 CCCCCCC(=O)[O-] MCULE-1711655800 [0,0,0,0,0,0|1,0,1]=2 68 B8R0.7 CCCCCCC(Br)Br MCULE-5790254532 [0,0,0,0,0,0|3,0,1]=4 69 B8R0.7 CCCCCCC(C)Br MCULE-1528804584 [0,0,0,0,0,0|3,0,1]=4 70 B8R0.7 CCCCCCC(C)C MCULE-5799144994 [0,0,0,0,0,0|3,0,1]=4 71 B8R0.7 CCCCCCC(C)I MCULE-1825555561 [0,0,0,0,0,0|3,0,1]=4 72 B8R0.7 CCCCCCC(C)N MCULE-9884342317 [0,0,0,0,0,0|3,0,1]=4 73 B8R0.7 CCCCCCC(C)O MCULE-4635370769 [0,0,0,0,0,0|2,0,1]=3 74 B8R0.7 CCCCCCC(C)O MCULE-5095200181 [0,0,0,0,0,0|2,0,1]=3 75 B8R0.7 CCCCCCN(=O)=O MCULE-8283658415 [0,0,0,0,0,0|2,0,1]=3 76 B8R0.7 CCCCCCN(C)C MCULE-4445968611 [0,0,0,0,0,0|4,0,0]=4 77 B8R0.7 CCCCCCP(Cl)Cl MCULE-4074248554 [0,0,0,0,0,0|4,0,0]=4 78 B8R0.7 CCCCCC[C@@H](C)N MCULE-1174114183 [0,0,0,0,0,0|3,0,1]=4 79 B8R0.7 CCCCCC[C@@H](C)N MCULE-2566479481 [0,0,0,0,0,0|3,0,1]=4 80 B8R0.7 CCCCCC[C@@H](C)N MCULE-9213725375 [0,0,0,0,0,0|3,0,1]=4 81 B8R0.7 CCCCCC[C@@H](C)O MCULE-5245235461 [0,0,0,0,0,0|2,0,1]=3 82 B8R0.7 CCCCCC[C@@H](C)O MCULE-8537503782 [0,0,0,0,0,0|2,0,1]=3 83 B8R0.7 CCCCCC[C@H](C)N MCULE-1870649953 [0,0,0,0,0,0|3,0,1]=4 84 B8R0.7 CCCCCC[C@H](C)N MCULE-1893221172 [0,0,0,0,0,0|3,0,1]=4 85 B8R0.7 CCCCCC[C@H](C)N MCULE-7722036180 [0,0,0,0,0,0|3,0,1]=4 86 B8R0.7 CCCCCC[C@H](C)O MCULE-2655815413 [0,0,0,0,0,0|2,0,1]=3 87 B8R0.7 CCCCCC[C@H](C)O MCULE-7784149103 [0,0,0,0,0,0|2,0,1]=3 88 B8R0.7 CCCCCNC(=O)N MCULE-3139270247 [0,0,0,0,0,0|3,0,0]=3 89 B8R0.7 CCCCCOC(=O)C MCULE-4911325533 [0,0,0,0,0,0|3,0,0]=3 90 B8R0.7 CCCCCOC(=O)Cl MCULE-2896207255 [0,0,0,0,0,0|3,0,0]=3 91 B8R0.7 CCCCCOC(=S)[S-] MCULE-2950713727 [0,0,0,0,0,0|2,2,0]=4 92 B8R0.7 CCCCCOC(=S)[S-] MCULE-3707330245 [0,0,0,0,0,0|2,2,0]=4 93 B8R0.7 CCCCCON(=O)=O MCULE-5516967908 [0,0,0,0,0,0|3,0,1]=4 94 B8R0.7 CCCCCSC(=N)N MCULE-5906999949 [0,0,0,0,0,0|4,0,0]=4 95 B8R0.7 CCCCCSC(=N)N MCULE-7508276539 [0,0,0,0,0,0|4,0,0]=4 96 B8R0.7 CCCCNCC(=O)N MCULE-1276341431 [0,0,0,0,0,0|3,0,0]=3 97 B8R0.7 CCCCNCC(=O)N MCULE-6579402071 [0,0,0,0,0,0|3,0,0]=3 98 B8R0.7 CCCCNCC(=O)O MCULE-4725221957 [0,0,0,0,0,0|2,0,0]=2 99 B8R0.7 CCCCNCC(C)O MCULE-3151408580 [0,0,0,0,0,0|3,0,1]=4 100 B8R0.7 CCCCOCC(=O)O MCULE-9634255761 [0,0,0,0,0,0|2,0,0]=2 101 B8R0.7 CCCCOCC(C)O MCULE-6350800869 [0,0,0,0,0,0|3,0,1]=4 102 B8R0.7 CCCCSCC(=N)N MCULE-5468671942 [0,0,0,0,0,0|4,0,0]=4 103 B8R0.7 CCCCSCC(=O)O MCULE-3580384865 [0,0,0,0,0,0|2,0,0]=2 104 B8R0.7 CCCNCCC(=O)N MCULE-2654608736 [0,0,0,0,0,0|3,0,0]=3 105 B8R0.7 CCCNCCC(=O)N MCULE-2683588523 [0,0,0,0,0,0|3,0,0]=3 106 B8R0.7 CCCNCCC(=O)O MCULE-3144740259 [0,0,0,0,0,0|2,0,0]=2 107 B8R0.7 CCCNCCC(=O)O MCULE-3866165037 [0,0,0,0,0,0|2,0,0]=2 108 B8R0.7 CCCOCCC(=O)O MCULE-1927238608 [0,0,0,0,0,0|2,0,0]=2 109 B8R0.7 CCCSC=CC(=O)O MCULE-3074287995 [0,0,0,0,0,0|2,0,2]=4 110 B8R0.7 CCCSCCC(=O)O MCULE-6454518290 [0,0,0,0,0,0|2,0,0]=2 111 B8R0.7 CCNCCCC(=O)O MCULE-7019386199 [0,0,0,0,0,0|2,0,0]=2 112 B8R0.7 CCNCCCC(=O)O MCULE-8568253592 [0,0,0,0,0,0|2,0,0]=2 113 B8R0.7 CCOCCCC(=O)O MCULE-9064011886 [0,0,0,0,0,0|2,0,0]=2 114 B8R0.7 CCOCCNC(=O)N MCULE-7568793312 [0,0,0,0,0,0|4,0,0]=4 115 B8R0.7 CCOCCOC(=O)C MCULE-3053452981 [0,0,0,0,0,0|4,0,0]=4 116 B8R0.7 CCOCCOC(=O)Cl MCULE-9683410173 [0,0,0,0,0,0|4,0,0]=4 117 B8R0.7 CN(C)CCCCCN MCULE-4877386224 [0,0,0,0,0,0|3,0,0]=3 118 B8R0.7 CN(C)CCCCCN MCULE-8183173530 [0,0,0,0,0,0|3,0,0]=3 119 B8R0.7 CN(C)CCCCCN MCULE-8560175640 [0,0,0,0,0,0|3,0,0]=3 120 B8R0.7 CN(C)CCCCCO MCULE-4442986563 [0,0,0,0,0,0|4,0,0]=4 121 B8R0.7 CN(C)CCNCCN MCULE-7362552258 [0,0,0,0,0,0|4,0,0]=4 122 B8R0.7 CN(C)CCOCCN MCULE-3747000450 [0,0,0,0,0,0|4,0,0]=4 123 B8R0.7 CN(C)CCOCCN MCULE-4193790881 [0,0,0,0,0,0|4,0,0]=4 124 B8R0.7 CN(C)CCOCCN MCULE-7340326244 [0,0,0,0,0,0|4,0,0]=4 125 B8R0.7 CNCCCCC(=O)O MCULE-4298567521 [0,0,0,0,0,0|2,0,0]=2 126 B8R0.7 CNCCCCC(=O)O MCULE-5688320983 [0,0,0,0,0,0|2,0,0]=2 127 B8R0.7 CNCCCNC(=O)C MCULE-2682619502 [0,0,0,0,0,0|4,0,0]=4 128 B8R0.7 CNCCCNC(=O)C MCULE-3477977807 [0,0,0,0,0,0|4,0,0]=4 129 B8R0.7 CNCCOCC(=O)O MCULE-5408672373 [0,0,0,0,0,0|3,0,0]=3 130 B8R0.7 COCCCCB(O)O MCULE-5339704839 [0,0,0,0,0,0|3,0,1]=4 131 B8R0.7 COCCCCC(=O)O MCULE-1268596288 [0,0,0,0,0,0|2,0,0]=2 132 B8R0.7 COCCCCN(=O)=O MCULE-3527542330 [0,0,0,0,0,0|3,0,1]=4 133 B8R0.7 COCCCNC(=O)C MCULE-4149128250 [0,0,0,0,0,0|4,0,0]=4 134 B8R0.7 COCCCNC(=O)N MCULE-4038737956 [0,0,0,0,0,0|4,0,0]=4 135 B8R0.7 COCCNCC(=O)N MCULE-2300508230 [0,0,0,0,0,0|4,0,0]=4 136 B8R0.7 COCCNCC(=O)N MCULE-7059174365 [0,0,0,0,0,0|4,0,0]=4 137 B8R0.7 COCCNCC(=O)O MCULE-2703110743 [0,0,0,0,0,0|3,0,0]=3 138 B8R0.7 COCCNCC(=O)O MCULE-5854004501 [0,0,0,0,0,0|3,0,0]=3 139 B8R0.7 COCCOCC(=O)C MCULE-5956367525 [0,0,0,0,0,0|4,0,0]=4 140 B8R0.7 COCCOCC(=O)Cl MCULE-9321414156 [0,0,0,0,0,0|4,0,0]=4 141 B8R0.7 COCCOCC(=O)N MCULE-8987780803 [0,0,0,0,0,0|4,0,0]=4 142 B8R0.7 COCCOCC(=O)O MCULE-2561278418 [0,0,0,0,0,0|3,0,0]=3 143 B8R0.7 COCCSCC(=O)O MCULE-2908610834 [0,0,0,0,0,0|3,0,0]=3 144 B8R0.7 CS(=O)CCCCC#N MCULE-1279378713 [0,0,0,0,0,0|2,0,2]=4 145 B8R0.7 CSCCCCC(=O)O MCULE-4498129620 [0,0,0,0,0,0|2,0,0]=2 146 B8R0.7 CSCCCOC(=O)C MCULE-4403232519 [0,0,0,0,0,0|4,0,0]=4 147 B8R0.7 CSCCNCC(=O)O MCULE-1747724833 [0,0,0,0,0,0|3,0,0]=3 148 B8R0.7 CSCCNCC(=O)O MCULE-9991325079 [0,0,0,0,0,0|3,0,0]=3 149 B8R0.7 CSCCOCC(=O)O MCULE-2038020159 [0,0,0,0,0,0|3,0,0]=3 150 B8R0.7 CSSCCCC(=O)O MCULE-7947744639 [0,0,0,0,0,0|3,0,0]=3 151 B8R0.7 FC(F)CCCCCBr MCULE-1154573775 [0,0,0,0,0,0|3,0,1]=4 152 B8R0.7 N#CCCCCC(=O)N MCULE-7791035164 [0,0,0,0,0,0|1,0,2]=3 153 B8R0.7 N#CCCCCC(=O)O MCULE-1900756226 [0,0,0,0,0,0|0,0,2]=2 154 B8R0.7 N#CCCCCN(=O)=O MCULE-9210708651 [0,0,0,0,0,0|1,0,3]=4 155 B8R0.7 N#CCCNCC(=O)O MCULE-9226456604 [0,0,0,0,0,0|1,0,2]=3 156 B8R0.7 N#N=NCCCC(=O)O MCULE-1397586704 [0,0,0,0,0,0|2,0,1]=3 157 B8R0.7 N=C(N)NCCCCN MCULE-1546201217 [0,0,0,0,0,0|3,0,0]=3 158 B8R0.7 N=C(N)NCCCCN MCULE-8707833566 [0,0,0,0,0,0|3,0,0]=3 159 B8R0.7 N=C(N)NCCCCN MCULE-9916947559 [0,0,0,0,0,0|3,0,0]=3 160 B8R0.7 NC(=O)CCCCCBr MCULE-6938202710 [0,0,0,0,0,0|2,0,0]=2 161 B8R0.7 NC(=O)CCCCCO MCULE-2654184294 [0,0,0,0,0,0|2,0,0]=2 162 B8R0.7 NC(=O)CCNCCS MCULE-4682566242 [0,0,0,0,0,0|3,0,0]=3 163 B8R0.7 NCCCCCC(=O)N MCULE-1692086577 [0,0,0,0,0,0|1,0,0]=1 164 B8R0.7 NCCCCCC(=O)N MCULE-2191237198 [0,0,0,0,0,0|1,0,0]=1 165 B8R0.7 NCCCCCC(=O)O MCULE-3640363033 [0,0,0,0,0,0|0,0,0]=0 166 B8R0.7 NCCCCCC(=O)O MCULE-6389520144 [0,0,0,0,0,0|0,0,0]=0 167 B8R0.7 NCCCCCC(=O)[O-] MCULE-7336458907 [0,0,0,0,0,0|0,0,1]=1 168 B8R0.7 NCCCCNC(=O)N MCULE-6339634491 [0,0,0,0,0,0|2,0,0]=2 169 B8R0.7 NCCCCNC(=O)N MCULE-8210849027 [0,0,0,0,0,0|2,0,0]=2 170 B8R0.7 NCCCCNC(=[NH2+])N MCULE-1741616711 [0,0,0,0,0,0|3,0,0]=3 171 B8R0.7 NCCCCOC(F)F MCULE-2093293575 [0,0,0,0,0,0|3,0,1]=4 172 B8R0.7 NCCCNCC(=O)O MCULE-6526080048 [0,0,0,0,0,0|1,0,0]=1 173 B8R0.7 NCCCNCC(=O)O MCULE-6762903438 [0,0,0,0,0,0|1,0,0]=1 174 B8R0.7 NCCCOCC(=O)O MCULE-6428539436 [0,0,0,0,0,0|1,0,0]=1 175 B8R0.7 NCCCOCC(F)F MCULE-9811400597 [0,0,0,0,0,0|3,0,1]=4 176 B8R0.7 NCCNCCC(=O)O MCULE-6596967912 [0,0,0,0,0,0|1,0,0]=1 177 B8R0.7 NCCNCCC(=O)[O-] MCULE-8896439746 [0,0,0,0,0,0|1,0,1]=2 178 B8R0.7 NCCOCCC(=O)O MCULE-8535110656 [0,0,0,0,0,0|1,0,0]=1 179 B8R0.7 NCCOCCC(=O)O MCULE-9124828795 [0,0,0,0,0,0|1,0,0]=1 180 B8R0.7 NCCSCCC(=O)O MCULE-5309234181 [0,0,0,0,0,0|1,0,0]=1 181 B8R0.7 NOCCCCC(=O)O MCULE-2022616022 [0,0,0,0,0,0|1,0,0]=1 182 B8R0.7 NOCCCCC(=O)O MCULE-9375312454 [0,0,0,0,0,0|1,0,0]=1 183 B8R0.7 O=C(Cl)CCCCCBr MCULE-4314610726 [0,0,0,0,0,0|2,0,0]=2 184 B8R0.7 O=C(Cl)CCCCCCl MCULE-4526081631 [0,0,0,0,0,0|2,0,0]=2 185 B8R0.7 O=C(Cl)OCCCCCl MCULE-4992919323 [0,0,0,0,0,0|3,0,0]=3 186 B8R0.7 O=C(O)CCCCCBr MCULE-2086088700 [0,0,0,0,0,0|1,0,0]=1 187 B8R0.7 O=C(O)CCCCCCl MCULE-3419329115 [0,0,0,0,0,0|1,0,0]=1 188 B8R0.7 O=C(O)CCCCCF MCULE-6736431365 [0,0,0,0,0,0|1,0,0]=1 189 B8R0.7 O=C(O)CCCCCO MCULE-9202536119 [0,0,0,0,0,0|1,0,0]=1 190 B8R0.7 O=C(O)CCCCCS MCULE-1414350107 [0,0,0,0,0,0|1,0,0]=1 191 B8R0.7 O=C(O)CCNCCO MCULE-6594831168 [0,0,0,0,0,0|2,0,0]=2 192 B8R0.7 O=C(O)CCOCCBr MCULE-8991363781 [0,0,0,0,0,0|2,0,0]=2 193 B8R0.7 O=C(O)CCOCCO MCULE-7271806926 [0,0,0,0,0,0|2,0,0]=2 194 B8R0.7 O=C(O)CCOCCS MCULE-2136117046 [0,0,0,0,0,0|2,0,0]=2 195 B8R0.7 O=C(O)CCSCCO MCULE-4689447674 [0,0,0,0,0,0|2,0,0]=2 196 B8R0.7 O=C(O)COCCCBr MCULE-2393807719 [0,0,0,0,0,0|2,0,0]=2 197 B8R0.7 O=C([O-])CCCCCCl MCULE-7341419838 [0,0,0,0,0,0|1,0,1]=2 198 B8R0.7 O=C([O-])CCCCCO MCULE-5897469112 [0,0,0,0,0,0|1,0,1]=2 199 B8R0.7 O=C([O-])CCCCCO MCULE-9397608140 [0,0,0,0,0,0|1,0,1]=2 200 B8R0.7 O=CCCCCC(=O)O MCULE-8762346998 [0,0,0,0,0,0|1,0,1]=2 201 B8R0.7 O=CNCCCC(=O)O MCULE-9120755173 [0,0,0,0,0,0|2,0,1]=3 202 B8R0.7 O=N(=O)CCCCCBr MCULE-8173901748 [0,0,0,0,0,0|2,0,1]=3 203 B8R0.7 O=N(=O)CCCCCCl MCULE-6320526045 [0,0,0,0,0,0|2,0,1]=3 204 B8R0.7 O=N(=O)CCCCCO MCULE-8742649710 [0,0,0,0,0,0|2,0,1]=3 205 B8R0.7 O=N(=O)OCCCCO MCULE-8113401389 [0,0,0,0,0,0|3,0,1]=4 206 B8R0.7 OB(O)CCCCCBr MCULE-1080449080 [0,0,0,0,0,0|2,0,1]=3 207 B7R0.1 BrCCCCCCBr MCULE-5187406804 [1,0,0,0,0,0|2,0,1]=4 208 B7R0.1 C#CCCCCC=O MCULE-2019630243 [1,0,0,0,0,0|1,0,1]=3 209 B7R0.1 C#CCCCCCBr MCULE-1618292603 [1,0,0,0,0,0|2,0,1]=4 210 B7R0.1 C#CCCCCCC MCULE-4406928583 [1,0,0,0,0,0|2,0,1]=4 211 B7R0.1 C#CCCCCCCl MCULE-2788042800 [1,0,0,0,0,0|2,0,1]=4 212 B7R0.1 C#CCCCCCN MCULE-3067915237 [1,0,0,0,0,0|1,0,1]=3 213 B7R0.1 C#CCCCCCO MCULE-2909503471 [1,0,0,0,0,0|1,0,2]=4 214 B7R0.1 C#CCOCCCN MCULE-2240372630 [1,0,0,0,0,0|2,0,1]=4 215 B7R0.1 C#CCOCCCN MCULE-8708564884 [1,0,0,0,0,0|2,0,1]=4 216 B7R0.1 C/C=C/CCCCC MCULE-6911363331 [1,0,0,0,0,0|2,0,1]=4 217 B7R0.1 C/C=C\CCCCC MCULE-9470036254 [1,0,0,0,0,0|2,0,1]=4 218 B7R0.1 C=CCCCCC#N MCULE-5195400885 [1,0,0,0,0,0|1,0,2]=4 219 B7R0.1 C=CCCCCC=C MCULE-9285021489 [1,0,0,0,0,0|2,0,1]=4 220 B7R0.1 C=CCCCCC=O MCULE-6786275827 [1,0,0,0,0,0|1,0,1]=3 221 B7R0.1 C=CCCCCCBr MCULE-7782876660 [1,0,0,0,0,0|2,0,0]=3 222 B7R0.1 C=CCCCCCC MCULE-6867393536 [1,0,0,0,0,0|2,0,0]=3 223 B7R0.1 C=CCCCCCCl MCULE-2205880878 [1,0,0,0,0,0|2,0,0]=3 224 B7R0.1 C=CCCCCCI MCULE-1823596954 [1,0,0,0,0,0|2,0,0]=3 225 B7R0.1 C=CCCCCCN MCULE-2913783474 [1,0,0,0,0,0|1,0,0]=2 226 B7R0.1 C=CCCCCCN MCULE-9545708862 [1,0,0,0,0,0|1,0,0]=2 227 B7R0.1 C=CCCCCCO MCULE-1200112990 [1,0,0,0,0,0|2,0,0]=3 228 B7R0.1 C=CCCCCNC MCULE-3676018759 [1,0,0,0,0,0|3,0,0]=4 229 B7R0.1 C=CCCCCNC MCULE-9443600983 [1,0,0,0,0,0|3,0,0]=4 230 B7R0.1 C=CCCCCON MCULE-1155744928 [1,0,0,0,0,0|2,0,0]=3 231 B7R0.1 C=CCCCCON MCULE-1741904620 [1,0,0,0,0,0|2,0,0]=3 232 B7R0.1 C=CCCCNCC MCULE-2141378110 [1,0,0,0,0,0|3,0,0]=4 233 B7R0.1 C=CCCCNCC MCULE-4269657694 [1,0,0,0,0,0|3,0,0]=4 234 B7R0.1 C=CCCCOCCl MCULE-1172012073 [1,0,0,0,0,0|3,0,0]=4 235 B7R0.1 C=CCCNCCO MCULE-8357008337 [1,0,0,0,0,0|3,0,0]=4 236 B7R0.1 C=CCCOCCN MCULE-5958891740 [1,0,0,0,0,0|2,0,0]=3 237 B7R0.1 C=CCCOCCO MCULE-5369849290 [1,0,0,0,0,0|3,0,0]=4 238 B7R0.1 C=CCCSCCN MCULE-5541844264 [1,0,0,0,0,0|2,0,0]=3 239 B7R0.1 C=CCOCCC=O MCULE-3332311483 [1,0,0,0,0,0|2,0,1]=4 240 B7R0.1 C=CCOCCCBr MCULE-7892533278 [1,0,0,0,0,0|3,0,0]=4 241 B7R0.1 C=CCOCCCC MCULE-2214755289 [1,0,0,0,0,0|3,0,0]=4 242 B7R0.1 C=CCOCCCN MCULE-4862923195 [1,0,0,0,0,0|2,0,0]=3 243 B7R0.1 C=CCSCCCC MCULE-4868736488 [1,0,0,0,0,0|3,0,0]=4 244 B7R0.1 C=COCCCCC MCULE-4024159480 [1,0,0,0,0,0|3,0,0]=4 245 B7R0.1 C=COCCCCO MCULE-3537265926 [1,0,0,0,0,0|3,0,0]=4 246 B7R0.1 CC#CCCCC=O MCULE-9621727341 [1,0,0,0,0,0|1,0,2]=4 247 B7R0.1 CC/C=C\CCC=O MCULE-5862165111 [1,0,0,0,0,0|1,0,2]=4 248 B7R0.1 CC=CCCCCC MCULE-7111489659 [1,0,0,0,0,0|2,0,1]=4 249 B7R0.1 CC=CCCCCO MCULE-8707373340 [1,0,0,0,0,0|2,0,1]=4 250 B7R0.1 CCC=CCCC=O MCULE-1386777548 [1,0,0,0,0,0|1,0,2]=4 251 B7R0.1 CCCC/C=C/C=O MCULE-1260131686 [1,0,0,0,0,0|1,0,2]=4 252 B7R0.1 CCCCC#CC=O MCULE-6973833394 [1,0,0,0,0,0|1,0,2]=4 253 B7R0.1 CCCCC=CC=O MCULE-6776317009 [1,0,0,0,0,0|1,0,2]=4 254 B7R0.1 CCCCCC=CI MCULE-9964634818 [1,0,0,0,0,0|2,0,1]=4 255 B7R0.1 CCCCCCC#N MCULE-7652123212 [1,0,0,0,0,0|2,0,1]=4 256 B7R0.1 CCCCCCC=O MCULE-5251820425 [1,0,0,0,0,0|1,0,0]=2 257 B7R0.1 CCCCCCCBr MCULE-8042829299 [1,0,0,0,0,0|2,0,1]=4 258 B7R0.1 CCCCCCCC MCULE-3248084959 [1,0,0,0,0,0|2,0,1]=4 259 B7R0.1 CCCCCCCCl MCULE-6286146566 [1,0,0,0,0,0|2,0,1]=4 260 B7R0.1 CCCCCCCF MCULE-9794868174 [1,0,0,0,0,0|2,0,1]=4 261 B7R0.1 CCCCCCCI MCULE-2930393920 [1,0,0,0,0,0|2,0,1]=4 262 B7R0.1 CCCCCCCN MCULE-1126747714 [1,0,0,0,0,0|1,0,1]=3 263 B7R0.1 CCCCCCCO MCULE-5882959353 [1,0,0,0,0,0|1,0,1]=3 264 B7R0.1 CCCCCCCS MCULE-3901364910 [1,0,0,0,0,0|1,1,1]=4 265 B7R0.1 CCCCCCNC MCULE-1828296852 [1,0,0,0,0,0|3,0,0]=4 266 B7R0.1 CCCCCCNN MCULE-5116098983 [1,0,0,0,0,0|2,0,1]=4 267 B7R0.1 CCCCCCNO MCULE-4175875706 [1,0,0,0,0,0|2,0,0]=3 268 B7R0.1 CCCCCCNO MCULE-8719557426 [1,0,0,0,0,0|2,0,0]=3 269 B7R0.1 CCCCCCOC MCULE-7148964901 [1,0,0,0,0,0|3,0,0]=4 270 B7R0.1 CCCCCCON MCULE-1836746134 [1,0,0,0,0,0|2,0,1]=4 271 B7R0.1 CCCCCCON MCULE-9566158736 [1,0,0,0,0,0|2,0,1]=4 272 B7R0.1 CCCCCN=C=O MCULE-6020523044 [1,0,0,0,0,0|2,0,1]=4 273 B7R0.1 CCCCCOC=O MCULE-2718009140 [1,0,0,0,0,0|2,0,0]=3 274 B7R0.1 CCCCCON=O MCULE-8065075083 [1,0,0,0,0,0|3,0,0]=4 275 B7R0.1 CCCCNCCN MCULE-3865190511 [1,0,0,0,0,0|2,0,1]=4 276 B7R0.1 CCCCNCCO MCULE-3582031814 [1,0,0,0,0,0|2,0,1]=4 277 B7R0.1 CCCCOCCN MCULE-1817743996 [1,0,0,0,0,0|2,0,1]=4 278 B7R0.1 CCCCOCCN MCULE-3658840205 [1,0,0,0,0,0|2,0,1]=4 279 B7R0.1 CCCCOCCO MCULE-1727546427 [1,0,0,0,0,0|2,0,1]=4 280 B7R0.1 CCCCOCCO MCULE-4417721312 [1,0,0,0,0,0|2,0,1]=4 281 B7R0.1 CCCCSCCN MCULE-3521818954 [1,0,0,0,0,0|2,0,1]=4 282 B7R0.1 CCCCSCCN MCULE-5281011566 [1,0,0,0,0,0|2,0,1]=4 283 B7R0.1 CCCCSCCO MCULE-8791357083 [1,0,0,0,0,0|2,0,1]=4 284 B7R0.1 CCCNCCCN MCULE-6668094176 [1,0,0,0,0,0|2,0,1]=4 285 B7R0.1 CCCNCCCO MCULE-4366982860 [1,0,0,0,0,0|2,0,1]=4 286 B7R0.1 CCCOCCCN MCULE-5875738973 [1,0,0,0,0,0|2,0,1]=4 287 B7R0.1 CCCSCCCN MCULE-2911445961 [1,0,0,0,0,0|2,0,1]=4 288 B7R0.1 CCNCCCCO MCULE-4851249509 [1,0,0,0,0,0|2,0,1]=4 289 B7R0.1 CCOCCCCN MCULE-6583734908 [1,0,0,0,0,0|2,0,1]=4 290 B7R0.1 CCOCCCCO MCULE-9986213119 [1,0,0,0,0,0|2,0,1]=4 291 B7R0.1 CCSCCCCN MCULE-7961306984 [1,0,0,0,0,0|2,0,1]=4 292 B7R0.1 CCSCCCCO MCULE-1712194349 [1,0,0,0,0,0|2,0,1]=4 293 B7R0.1 CNCCCCCN MCULE-8023367999 [1,0,0,0,0,0|2,0,0]=3 294 B7R0.1 CNCCCCCO MCULE-2988249730 [1,0,0,0,0,0|2,0,1]=4 295 B7R0.1 CNCCCCCO MCULE-8033733525 [1,0,0,0,0,0|2,0,1]=4 296 B7R0.1 CNCCNCCN MCULE-6347214757 [1,0,0,0,0,0|3,0,0]=4 297 B7R0.1 CNCCNCCN MCULE-8600289461 [1,0,0,0,0,0|3,0,0]=4 298 B7R0.1 CNCCOCCN MCULE-8077914280 [1,0,0,0,0,0|3,0,0]=4 299 B7R0.1 COCCCCCBr MCULE-9843465236 [1,0,0,0,0,0|3,0,0]=4 300 B7R0.1 COCCCCCCl MCULE-6956815361 [1,0,0,0,0,0|3,0,0]=4 301 B7R0.1 COCCCCCN MCULE-2109050097 [1,0,0,0,0,0|2,0,0]=3 302 B7R0.1 COCCCCCO MCULE-6003118644 [1,0,0,0,0,0|2,0,1]=4 303 B7R0.1 COCCNCCN MCULE-4860380919 [1,0,0,0,0,0|3,0,0]=4 304 B7R0.1 COCCNCCN MCULE-8558629867 [1,0,0,0,0,0|3,0,0]=4 305 B7R0.1 COCCOCC=O MCULE-2621317944 [1,0,0,0,0,0|3,0,0]=4 306 B7R0.1 COCCOCCN MCULE-7016705271 [1,0,0,0,0,0|3,0,0]=4 307 B7R0.1 COCOCCC=O MCULE-3632276453 [1,0,0,0,0,0|3,0,0]=4 308 B7R0.1 COCOCCCN MCULE-4340598730 [1,0,0,0,0,0|3,0,0]=4 309 B7R0.1 CSCCCCCN MCULE-8771942873 [1,0,0,0,0,0|2,0,0]=3 310 B7R0.1 CSCCCCCO MCULE-3422729293 [1,0,0,0,0,0|2,0,1]=4 311 B7R0.1 ClCCCCCCBr MCULE-7471712605 [1,0,0,0,0,0|2,0,1]=4 312 B7R0.1 ClCCCCCCCl MCULE-2423183693 [1,0,0,0,0,0|2,0,1]=4 313 B7R0.1 ClCCCCCCI MCULE-2662361744 [1,0,0,0,0,0|2,0,1]=4 314 B7R0.1 FCCCCCCBr MCULE-9238324978 [1,0,0,0,0,0|2,0,1]=4 315 B7R0.1 ICCCCCCI MCULE-1005202656 [1,0,0,0,0,0|2,0,1]=4 316 B7R0.1 N#CCCCCCBr MCULE-2014100603 [1,0,0,0,0,0|2,0,1]=4 317 B7R0.1 N#CCCCCCCl MCULE-1324928568 [1,0,0,0,0,0|2,0,1]=4 318 B7R0.1 N#CCCCCCN MCULE-4837507252 [1,0,0,0,0,0|1,0,1]=3 319 B7R0.1 N#CCCOCCN MCULE-6674432245 [1,0,0,0,0,0|2,0,1]=4 320 B7R0.1 N#CCCOCCN MCULE-8115918193 [1,0,0,0,0,0|2,0,1]=4 321 B7R0.1 N#N=NCCCC=O MCULE-1592256561 [1,0,0,0,0,0|2,0,1]=4 322 B7R0.1 N#N=NCCCCN MCULE-6258134369 [1,0,0,0,0,0|3,0,0]=4 323 B7R0.1 N#N=NCCCCN MCULE-7187588793 [1,0,0,0,0,0|3,0,0]=4 324 B7R0.1 NCCCCCCBr MCULE-4017495581 [1,0,0,0,0,0|1,0,1]=3 325 B7R0.1 NCCCCCCBr MCULE-4048883510 [1,0,0,0,0,0|1,0,1]=3 326 B7R0.1 NCCCCCCN MCULE-1038764376 [1,0,0,0,0,0|1,0,1]=3 327 B7R0.1 NCCCCCCN MCULE-3766020930 [1,0,0,0,0,0|1,0,1]=3 328 B7R0.1 NCCCCCCN MCULE-9535729200 [1,0,0,0,0,0|1,0,1]=3 329 B7R0.1 NCCCCCCO MCULE-2264326846 [1,0,0,0,0,0|0,0,1]=2 330 B7R0.1 NCCCCCCS MCULE-3764839885 [1,0,0,0,0,0|0,1,1]=3 331 B7R0.1 NCCCCCCS MCULE-5822376723 [1,0,0,0,0,0|0,1,1]=3 332 B7R0.1 NCCCNCCBr MCULE-3804557930 [1,0,0,0,0,0|2,0,1]=4 333 B7R0.1 NCCCNCCBr MCULE-7533614613 [1,0,0,0,0,0|2,0,1]=4 334 B7R0.1 NCCCNCCBr MCULE-9607733996 [1,0,0,0,0,0|2,0,1]=4 335 B7R0.1 NCCCNCCN MCULE-4817006723 [1,0,0,0,0,0|2,0,1]=4 336 B7R0.1 NCCCNCCO MCULE-1084481336 [1,0,0,0,0,0|1,0,1]=3 337 B7R0.1 NCCCNCCS MCULE-2204209594 [1,0,0,0,0,0|1,1,1]=4 338 B7R0.1 NCCCNCCS MCULE-8506055366 [1,0,0,0,0,0|1,1,1]=4 339 B7R0.1 NCCCOCCO MCULE-7244821044 [1,0,0,0,0,0|1,0,1]=3 340 B7R0.1 NCCNCCCO MCULE-6476789217 [1,0,0,0,0,0|1,0,1]=3 341 B7R0.1 NCCOCCCO MCULE-2435588099 [1,0,0,0,0,0|1,0,1]=3 342 B7R0.1 NCCOCCCO MCULE-9188421727 [1,0,0,0,0,0|1,0,1]=3 343 B7R0.1 NCCSCCCO MCULE-1578023056 [1,0,0,0,0,0|1,0,1]=3 344 B7R0.1 NCCSSCCO MCULE-1512873976 [1,0,0,0,0,0|2,0,1]=4 345 B7R0.1 NOCCOCCO MCULE-7815173940 [1,0,0,0,0,0|2,0,1]=4 346 B7R0.1 O=CCCCCC=O MCULE-3751145550 [1,0,0,0,0,0|1,0,1]=3 347 B7R0.1 O=CCCCCCBr MCULE-7014516847 [1,0,0,0,0,0|1,0,0]=2 348 B7R0.1 O=CCCCCCCl MCULE-8269912560 [1,0,0,0,0,0|1,0,0]=2 349 B7R0.1 O=CCCCCCF MCULE-8174281286 [1,0,0,0,0,0|1,0,0]=2 350 B7R0.1 O=CCCCCCO MCULE-3978349845 [1,0,0,0,0,0|1,0,0]=2 351 B7R0.1 O=CCCCCCO MCULE-4997016680 [1,0,0,0,0,0|1,0,0]=2 352 B7R0.1 OCCCCCCBr MCULE-3500356936 [1,0,0,0,0,0|1,0,1]=3 353 B7R0.1 OCCCCCCCl MCULE-4507452440 [1,0,0,0,0,0|1,0,1]=3 354 B7R0.1 OCCCCCCF MCULE-7082491218 [1,0,0,0,0,0|1,0,1]=3 355 B7R0.1 OCCCCCCI MCULE-3710706648 [1,0,0,0,0,0|1,0,1]=3 356 B7R0.1 OCCCCCCO MCULE-8817570517 [1,0,0,0,0,0|1,0,1]=3 357 B7R0.1 OCCCCCCS MCULE-9135853131 [1,0,0,0,0,0|1,0,1]=3 358 B7R0.1 OCCCNCCO MCULE-1959450493 [1,0,0,0,0,0|2,0,1]=4 359 B7R0.1 OCCCOCCCl MCULE-9172390990 [1,0,0,0,0,0|2,0,1]=4 360 B7R0.1 OCCOCCCBr MCULE-3397483886 [1,0,0,0,0,0|2,0,1]=4 361 B7R0.1 SCCCCCCS MCULE-2873828857 [1,0,0,0,0,0|1,1,1]=4 362 B7R0.1 [NH3+]CCCCCC[NH3+] MCULE-2211304471 [1,0,0,0,0,0|1,0,2]=4 363 B7R0.4 C#CCCCC(=O)C MCULE-9860822800 [1,0,0,0,0,0|1,0,2]=4 364 B7R0.4 C#CCCCC(=O)Cl MCULE-8504740573 [1,0,0,0,0,0|1,0,2]=4 365 B7R0.4 C#CCCCC(=O)N MCULE-3927386617 [1,0,0,0,0,0|1,0,2]=4 366 B7R0.4 C#CCCCC(=O)O MCULE-7464892335 [1,0,0,0,0,0|0,0,2]=3 367 B7R0.4 C#CCNCC(=O)O MCULE-3308171795 [1,0,0,0,0,0|1,0,2]=4 368 B7R0.4 C#CCNCC(=O)O MCULE-7200045848 [1,0,0,0,0,0|1,0,2]=4 369 B7R0.4 C#CCOCC(=O)O MCULE-7164718181 [1,0,0,0,0,0|1,0,2]=4 370 B7R0.4 C#CCSCC(=O)O MCULE-4337210412 [1,0,0,0,0,0|1,0,2]=4 371 B7R0.4 C(=C/C(=O)O)\CCC MCULE-7580507705 [1,0,0,0,0,0|0,0,2]=3 372 B7R0.4 C(=C/CC(=O)O)\CC MCULE-2731794411 [1,0,0,0,0,0|0,0,2]=3 373 B7R0.4 C=C(Br)CCCCC MCULE-3049831354 [1,0,0,0,0,0|2,0,0]=3 374 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [1,0,0,0,0,0|2,0,0]=3 375 B7R0.4 C=C(Cl)CCCCC MCULE-5074452982 [1,0,0,0,0,0|2,0,0]=3 376 B7R0.4 C=C=CCCC(=O)O MCULE-4179366971 [1,0,0,0,0,0|0,0,3]=4 377 B7R0.4 C=CCCCC(=O)Cl MCULE-9125909850 [1,0,0,0,0,0|1,0,2]=4 378 B7R0.4 C=CCCCC(=O)O MCULE-6043142578 [1,0,0,0,0,0|0,0,2]=3 379 B7R0.4 C=CCNCC(=O)O MCULE-2925626447 [1,0,0,0,0,0|1,0,2]=4 380 B7R0.4 C=CCNCC(=O)O MCULE-6980667867 [1,0,0,0,0,0|1,0,2]=4 381 B7R0.4 C=CCOCC(=O)O MCULE-1419435306 [1,0,0,0,0,0|1,0,2]=4 382 B7R0.4 C=CCSCC(=O)O MCULE-1950424629 [1,0,0,0,0,0|1,0,2]=4 383 B7R0.4 CC#CCCC(=O)O MCULE-1415388780 [1,0,0,0,0,0|0,0,2]=3 384 B7R0.4 CC(=O)CCCC#N MCULE-5884370871 [1,0,0,0,0,0|1,0,2]=4 385 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [1,0,0,0,0,0|2,0,0]=3 386 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [1,0,0,0,0,0|2,0,0]=3 387 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [1,0,0,0,0,0|2,0,0]=3 388 B7R0.4 CC(=O)CSCCF MCULE-8129308816 [1,0,0,0,0,0|3,0,0]=4 389 B7R0.4 CC(=O)NCCCBr MCULE-5421597540 [1,0,0,0,0,0|3,0,0]=4 390 B7R0.4 CC(=O)NCCCCl MCULE-4056331581 [1,0,0,0,0,0|3,0,0]=4 391 B7R0.4 CC(=O)NCCCN MCULE-6321543480 [1,0,0,0,0,0|2,0,0]=3 392 B7R0.4 CC(=O)NCCCN MCULE-8441492497 [1,0,0,0,0,0|2,0,0]=3 393 B7R0.4 CC(=O)NCCCO MCULE-5627003249 [1,0,0,0,0,0|3,0,0]=4 394 B7R0.4 CC(=O)NCCON MCULE-3703048482 [1,0,0,0,0,0|3,0,0]=4 395 B7R0.4 CC(=O)OCCCBr MCULE-4735159476 [1,0,0,0,0,0|3,0,0]=4 396 B7R0.4 CC(=O)OCCCCl MCULE-4801419214 [1,0,0,0,0,0|3,0,0]=4 397 B7R0.4 CC(=O)OCCCI MCULE-5830086336 [1,0,0,0,0,0|3,0,0]=4 398 B7R0.4 CC(=O)OCCCO MCULE-1423430948 [1,0,0,0,0,0|3,0,0]=4 399 B7R0.4 CC(=O)OCCCS MCULE-2576827025 [1,0,0,0,0,0|3,0,0]=4 400 B7R0.4 CC(=O)SCCCBr MCULE-2716633608 [1,0,0,0,0,0|3,0,0]=4 401 B7R0.4 CC(=O)SCCCCl MCULE-3875604518 [1,0,0,0,0,0|3,0,0]=4 402 B7R0.4 CC(=O)SCCCO MCULE-9014625190 [1,0,0,0,0,0|3,0,0]=4 403 B7R0.4 CC(C)CCCCN MCULE-3591523204 [1,0,0,0,0,0|2,0,1]=4 404 B7R0.4 CC(N)CCCCN MCULE-3497267062 [1,0,0,0,0,0|2,0,1]=4 405 B7R0.4 CC(N)CCCCN MCULE-9887360104 [1,0,0,0,0,0|2,0,1]=4 406 B7R0.4 CC(O)CCCCO MCULE-3790969400 [1,0,0,0,0,0|2,0,1]=4 407 B7R0.4 CC(O)CNCCN MCULE-3904214677 [1,0,0,0,0,0|2,0,1]=4 408 B7R0.4 CC=CCCC(=O)O MCULE-4275247668 [1,0,0,0,0,0|0,0,2]=3 409 B7R0.4 CCC/C=C/C(=O)C MCULE-2005171902 [1,0,0,0,0,0|1,0,2]=4 410 B7R0.4 CCC=CCC(=O)O MCULE-5031939966 [1,0,0,0,0,0|0,0,2]=3 411 B7R0.4 CCCC#CC(=O)O MCULE-1682387091 [1,0,0,0,0,0|0,0,2]=3 412 B7R0.4 CCCC=CC(=O)C MCULE-5008490883 [1,0,0,0,0,0|1,0,2]=4 413 B7R0.4 CCCC=CC(=O)Cl MCULE-6782906777 [1,0,0,0,0,0|1,0,2]=4 414 B7R0.4 CCCC=CC(=O)O MCULE-6995077492 [1,0,0,0,0,0|0,0,2]=3 415 B7R0.4 CCCCCB(O)O MCULE-3441747739 [1,0,0,0,0,0|1,0,1]=3 416 B7R0.4 CCCCCC(=N)N MCULE-4874167268 [1,0,0,0,0,0|2,0,0]=3 417 B7R0.4 CCCCCC(=N)N MCULE-6942690708 [1,0,0,0,0,0|2,0,0]=3 418 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [1,0,0,0,0,0|1,0,0]=2 419 B7R0.4 CCCCCC(=O)Cl MCULE-5446850478 [1,0,0,0,0,0|1,0,0]=2 420 B7R0.4 CCCCCC(=O)N MCULE-3215992514 [1,0,0,0,0,0|1,0,0]=2 421 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [1,0,0,0,0,0|0,0,0]=1 422 B7R0.4 CCCCCC(=O)[O-] MCULE-5310584661 [1,0,0,0,0,0|0,0,1]=2 423 B7R0.4 CCCCCC(=O)[O-] MCULE-9495078126 [1,0,0,0,0,0|0,0,1]=2 424 B7R0.4 CCCCCC(=S)N MCULE-7633089850 [1,0,0,0,0,0|1,1,0]=3 425 B7R0.4 CCCCCC(C)Br MCULE-4688847972 [1,0,0,0,0,0|2,0,1]=4 426 B7R0.4 CCCCCC(C)C MCULE-9815158757 [1,0,0,0,0,0|2,0,1]=4 427 B7R0.4 CCCCCC(C)Cl MCULE-1461261404 [1,0,0,0,0,0|2,0,1]=4 428 B7R0.4 CCCCCC(C)N MCULE-1307982487 [1,0,0,0,0,0|2,0,1]=4 429 B7R0.4 CCCCCC(C)N MCULE-8625441795 [1,0,0,0,0,0|2,0,1]=4 430 B7R0.4 CCCCCC(C)N MCULE-9791654909 [1,0,0,0,0,0|2,0,1]=4 431 B7R0.4 CCCCCC(C)O MCULE-2463855771 [1,0,0,0,0,0|1,0,1]=3 432 B7R0.4 CCCCCC(C)S MCULE-3173115736 [1,0,0,0,0,0|1,1,1]=4 433 B7R0.4 CCCCCN(=O)=O MCULE-6853489453 [1,0,0,0,0,0|1,0,1]=3 434 B7R0.4 CCCCCP(Cl)Cl MCULE-9695212092 [1,0,0,0,0,0|3,0,0]=4 435 B7R0.4 CCCCC[C@@H](C)N MCULE-2460238945 [1,0,0,0,0,0|2,0,1]=4 436 B7R0.4 CCCCC[C@@H](C)N MCULE-6386771130 [1,0,0,0,0,0|2,0,1]=4 437 B7R0.4 CCCCC[C@@H](C)N MCULE-6470246577 [1,0,0,0,0,0|2,0,1]=4 438 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [1,0,0,0,0,0|1,0,1]=3 439 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [1,0,0,0,0,0|1,0,1]=3 440 B7R0.4 CCCCC[C@H](C)N MCULE-8119988811 [1,0,0,0,0,0|2,0,1]=4 441 B7R0.4 CCCCC[C@H](C)N MCULE-9987283826 [1,0,0,0,0,0|2,0,1]=4 442 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [1,0,0,0,0,0|1,0,1]=3 443 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [1,0,0,0,0,0|1,0,1]=3 444 B7R0.4 CCCCNC(=N)N MCULE-4548909930 [1,0,0,0,0,0|3,0,0]=4 445 B7R0.4 CCCCNC(=N)N MCULE-4773969181 [1,0,0,0,0,0|3,0,0]=4 446 B7R0.4 CCCCNC(=O)C MCULE-7266335096 [1,0,0,0,0,0|2,0,0]=3 447 B7R0.4 CCCCNC(=O)Cl MCULE-2148016012 [1,0,0,0,0,0|2,0,0]=3 448 B7R0.4 CCCCNC(=O)N MCULE-3263036294 [1,0,0,0,0,0|2,0,0]=3 449 B7R0.4 CCCCNC(=S)N MCULE-7448930772 [1,0,0,0,0,0|2,1,0]=4 450 B7R0.4 CCCCNN(=O)=O MCULE-2055512271 [1,0,0,0,0,0|2,0,1]=4 451 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [1,0,0,0,0,0|2,0,0]=3 452 B7R0.4 CCCCOC(=O)Cl MCULE-5750652482 [1,0,0,0,0,0|2,0,0]=3 453 B7R0.4 CCCCOC(=O)N MCULE-7719579696 [1,0,0,0,0,0|2,0,0]=3 454 B7R0.4 CCCCOC(=S)[S-] MCULE-2197583773 [1,0,0,0,0,0|1,2,0]=4 455 B7R0.4 CCCCOC(=S)[S-] MCULE-3219674247 [1,0,0,0,0,0|1,2,0]=4 456 B7R0.4 CCCCON(=O)=O MCULE-9175662186 [1,0,0,0,0,0|2,0,1]=4 457 B7R0.4 CCCCSC(=N)N MCULE-1202813594 [1,0,0,0,0,0|3,0,0]=4 458 B7R0.4 CCCCSC(=N)N MCULE-6798856505 [1,0,0,0,0,0|3,0,0]=4 459 B7R0.4 CCCCSC(=N)N MCULE-8701506154 [1,0,0,0,0,0|3,0,0]=4 460 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [1,0,0,0,0,0|2,0,0]=3 461 B7R0.4 CCCCSC(=O)Cl MCULE-8008254909 [1,0,0,0,0,0|2,0,0]=3 462 B7R0.4 CCCNCC(=O)N MCULE-2330202708 [1,0,0,0,0,0|2,0,0]=3 463 B7R0.4 CCCNCC(=O)N MCULE-3731054780 [1,0,0,0,0,0|2,0,0]=3 464 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [1,0,0,0,0,0|1,0,0]=2 465 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [1,0,0,0,0,0|1,0,0]=2 466 B7R0.4 CCCNCC(C)O MCULE-8110237473 [1,0,0,0,0,0|2,0,1]=4 467 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [1,0,0,0,0,0|1,0,0]=2 468 B7R0.4 CCCOCC(=S)N MCULE-4681127635 [1,0,0,0,0,0|2,1,0]=4 469 B7R0.4 CCCOCC(C)O MCULE-9214840563 [1,0,0,0,0,0|2,0,1]=4 470 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [1,0,0,0,0,0|2,0,0]=3 471 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [1,0,0,0,0,0|1,0,0]=2 472 B7R0.4 CCNCCC(=O)N MCULE-4857735433 [1,0,0,0,0,0|2,0,0]=3 473 B7R0.4 CCNCCC(=O)N MCULE-8238114591 [1,0,0,0,0,0|2,0,0]=3 474 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [1,0,0,0,0,0|1,0,0]=2 475 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [1,0,0,0,0,0|1,0,0]=2 476 B7R0.4 CCO/C=C/C(=O)O MCULE-6712227034 [1,0,0,0,0,0|1,0,2]=4 477 B7R0.4 CCOC=CC(=O)O MCULE-4776715351 [1,0,0,0,0,0|1,0,2]=4 478 B7R0.4 CCOCCC(=N)N MCULE-4926091113 [1,0,0,0,0,0|3,0,0]=4 479 B7R0.4 CCOCCC(=N)N MCULE-8590303415 [1,0,0,0,0,0|3,0,0]=4 480 B7R0.4 CCOCCC(=O)C MCULE-8449201493 [1,0,0,0,0,0|2,0,0]=3 481 B7R0.4 CCOCCC(=O)Cl MCULE-8299617790 [1,0,0,0,0,0|2,0,0]=3 482 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [1,0,0,0,0,0|1,0,0]=2 483 B7R0.4 CCOCNC(=O)N MCULE-7680870721 [1,0,0,0,0,0|3,0,0]=4 484 B7R0.4 CCSCCC(=O)O MCULE-9385724904 [1,0,0,0,0,0|1,0,0]=2 485 B7R0.4 CN(C)CCCCN MCULE-4457571368 [1,0,0,0,0,0|3,0,0]=4 486 B7R0.4 CN(C)CCCCN MCULE-9067239115 [1,0,0,0,0,0|3,0,0]=4 487 B7R0.4 CNCCCC(=O)N MCULE-8337447772 [1,0,0,0,0,0|2,0,0]=3 488 B7R0.4 CNCCCC(=O)N MCULE-9037809827 [1,0,0,0,0,0|2,0,0]=3 489 B7R0.4 CNCCCC(=O)O MCULE-7598762485 [1,0,0,0,0,0|1,0,0]=2 490 B7R0.4 CNCCCC(=O)O MCULE-7877286915 [1,0,0,0,0,0|1,0,0]=2 491 B7R0.4 CNCCNC(=O)C MCULE-5361712613 [1,0,0,0,0,0|3,0,0]=4 492 B7R0.4 CNCCNC(=O)C MCULE-9798024696 [1,0,0,0,0,0|3,0,0]=4 493 B7R0.4 CNCCOC(=O)C MCULE-1850077864 [1,0,0,0,0,0|3,0,0]=4 494 B7R0.4 CNCCOC(=O)C MCULE-7023987942 [1,0,0,0,0,0|3,0,0]=4 495 B7R0.4 COC/C=C/C(=O)O MCULE-7555080897 [1,0,0,0,0,0|1,0,2]=4 496 B7R0.4 COCC#CC(=O)O MCULE-5896712747 [1,0,0,0,0,0|1,0,2]=4 497 B7R0.4 COCC=CC(=O)O MCULE-5702384430 [1,0,0,0,0,0|1,0,2]=4 498 B7R0.4 COCCCC(=O)C MCULE-3606369396 [1,0,0,0,0,0|2,0,0]=3 499 B7R0.4 COCCCC(=O)O MCULE-3165881573 [1,0,0,0,0,0|1,0,0]=2 500 B7R0.4 COCCCC(=S)N MCULE-5066867181 [1,0,0,0,0,0|2,1,0]=4 501 B7R0.4 COCCCC(C)O MCULE-4190294636 [1,0,0,0,0,0|2,0,1]=4 502 B7R0.4 COCCNC(=O)C MCULE-2794263612 [1,0,0,0,0,0|3,0,0]=4 503 B7R0.4 COCCNC(=O)N MCULE-1380726553 [1,0,0,0,0,0|3,0,0]=4 504 B7R0.4 COCCOC(=O)C MCULE-3221264060 [1,0,0,0,0,0|3,0,0]=4 505 B7R0.4 COCCOC(=O)Cl MCULE-7308809094 [1,0,0,0,0,0|3,0,0]=4 506 B7R0.4 COCCOC(=O)N MCULE-3401505850 [1,0,0,0,0,0|3,0,0]=4 507 B7R0.4 CSCC=CC(=O)O MCULE-8220760222 [1,0,0,0,0,0|1,0,2]=4 508 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [1,0,0,0,0,0|1,0,0]=2 509 B7R0.4 CSCCNC(=O)C MCULE-2739431878 [1,0,0,0,0,0|3,0,0]=4 510 B7R0.4 CSCCNC(=O)N MCULE-7254695938 [1,0,0,0,0,0|3,0,0]=4 511 B7R0.4 CSCCOC(=O)C MCULE-3742242959 [1,0,0,0,0,0|3,0,0]=4 512 B7R0.4 CSSCCC(=O)O MCULE-6571821309 [1,0,0,0,0,0|2,0,0]=3 513 B7R0.4 N#CCCCC(=O)O MCULE-9921837071 [1,0,0,0,0,0|0,0,2]=3 514 B7R0.4 N#CCSCC(=O)O MCULE-4687961137 [1,0,0,0,0,0|1,0,2]=4 515 B7R0.4 N#N=NCCC(=O)O MCULE-2098979516 [1,0,0,0,0,0|2,0,1]=4 516 B7R0.4 N=C(N)CCCCCl MCULE-4352194585 [1,0,0,0,0,0|3,0,0]=4 517 B7R0.4 N=C(N)CCCCCl MCULE-5262170460 [1,0,0,0,0,0|3,0,0]=4 518 B7R0.4 NC(=O)CCCCBr MCULE-4949681497 [1,0,0,0,0,0|2,0,0]=3 519 B7R0.4 NC(=O)CCCCCl MCULE-7937142112 [1,0,0,0,0,0|2,0,0]=3 520 B7R0.4 NC(=O)CCCCO MCULE-4820227146 [1,0,0,0,0,0|2,0,0]=3 521 B7R0.4 NC(=O)COCCCl MCULE-1141300697 [1,0,0,0,0,0|3,0,0]=4 522 B7R0.4 NC(=O)COCCO MCULE-3158372920 [1,0,0,0,0,0|3,0,0]=4 523 B7R0.4 NC(=O)CSCCO MCULE-8225407259 [1,0,0,0,0,0|3,0,0]=4 524 B7R0.4 NC(=O)NCCCO MCULE-3167491311 [1,0,0,0,0,0|3,0,0]=4 525 B7R0.4 NCCCCC(=O)N MCULE-3198962228 [1,0,0,0,0,0|1,0,0]=2 526 B7R0.4 NCCCCC(=O)N MCULE-7986221705 [1,0,0,0,0,0|1,0,0]=2 527 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [1,0,0,0,0,0|0,0,0]=1 528 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [1,0,0,0,0,0|0,0,0]=1 529 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [1,0,0,0,0,0|0,0,0]=1 530 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [1,0,0,0,0,0|0,0,0]=1 531 B7R0.4 NCCCNC(=O)N MCULE-1109440921 [1,0,0,0,0,0|2,0,0]=3 532 B7R0.4 NCCCNC(=O)N MCULE-3933221897 [1,0,0,0,0,0|2,0,0]=3 533 B7R0.4 NCCCOS(=O)O MCULE-8389295774 [1,0,0,0,0,0|2,0,0]=3 534 B7R0.4 NCCNCC(=O)O MCULE-9689592343 [1,0,0,0,0,0|1,0,0]=2 535 B7R0.4 NCCNCC(=O)O MCULE-9795251557 [1,0,0,0,0,0|1,0,0]=2 536 B7R0.4 NCCOCC(=O)O MCULE-2375694645 [1,0,0,0,0,0|1,0,0]=2 537 B7R0.4 NCCOCC(=O)O MCULE-5877065986 [1,0,0,0,0,0|1,0,0]=2 538 B7R0.4 NCCSCC(=O)O MCULE-5565800206 [1,0,0,0,0,0|1,0,0]=2 539 B7R0.4 NCCSCC(=O)O MCULE-8322098978 [1,0,0,0,0,0|1,0,0]=2 540 B7R0.4 NOCCCC(=O)O MCULE-4102473285 [1,0,0,0,0,0|1,0,0]=2 541 B7R0.4 NOCCCC(=O)O MCULE-7068985203 [1,0,0,0,0,0|1,0,0]=2 542 B7R0.4 O=C(Cl)CCCCBr MCULE-5574450546 [1,0,0,0,0,0|2,0,0]=3 543 B7R0.4 O=C(Cl)CCCCCl MCULE-9605707894 [1,0,0,0,0,0|2,0,0]=3 544 B7R0.4 O=C(Cl)CCCCF MCULE-8110878511 [1,0,0,0,0,0|2,0,0]=3 545 B7R0.4 O=C(Cl)COCCCl MCULE-9707252778 [1,0,0,0,0,0|3,0,0]=4 546 B7R0.4 O=C(Cl)OCCCCl MCULE-2619287385 [1,0,0,0,0,0|3,0,0]=4 547 B7R0.4 O=C(Cl)OCCCF MCULE-4930474319 [1,0,0,0,0,0|3,0,0]=4 548 B7R0.4 O=C(O)C#CCCO MCULE-5211042941 [1,0,0,0,0,0|1,0,2]=4 549 B7R0.4 O=C(O)CCC=CBr MCULE-1826887170 [1,0,0,0,0,0|1,0,2]=4 550 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [1,0,0,0,0,0|1,0,0]=2 551 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [1,0,0,0,0,0|1,0,0]=2 552 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [1,0,0,0,0,0|1,0,0]=2 553 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [1,0,0,0,0,0|1,0,0]=2 554 B7R0.4 O=C(O)CNCCO MCULE-7501311949 [1,0,0,0,0,0|2,0,0]=3 555 B7R0.4 O=C(O)COCCBr MCULE-4593325557 [1,0,0,0,0,0|2,0,0]=3 556 B7R0.4 O=C(O)COCCCl MCULE-2978816248 [1,0,0,0,0,0|2,0,0]=3 557 B7R0.4 O=C(O)COCCF MCULE-9820799514 [1,0,0,0,0,0|2,0,0]=3 558 B7R0.4 O=C(O)COCCO MCULE-8297137880 [1,0,0,0,0,0|2,0,0]=3 559 B7R0.4 O=C(O)CSCCCl MCULE-5204967583 [1,0,0,0,0,0|2,0,0]=3 560 B7R0.4 O=C(O)CSCCO MCULE-1062560307 [1,0,0,0,0,0|2,0,0]=3 561 B7R0.4 O=C([O-])CCCCO MCULE-3836827182 [1,0,0,0,0,0|1,0,1]=3 562 B7R0.4 O=C([O-])COCCO MCULE-7093344226 [1,0,0,0,0,0|2,0,1]=4 563 B7R0.4 O=CCCCC(=O)O MCULE-8389457571 [1,0,0,0,0,0|1,0,1]=3 564 B7R0.4 O=N(=O)CCCCBr MCULE-8310183286 [1,0,0,0,0,0|2,0,1]=4 565 B7R0.4 O=N(=O)CCCCCl MCULE-9069384470 [1,0,0,0,0,0|2,0,1]=4 566 B7R0.4 O=N(=O)CCCCO MCULE-4639070341 [1,0,0,0,0,0|2,0,1]=4 567 B7R0.4 OB(O)CCCCBr MCULE-3231135677 [1,0,0,0,0,0|2,0,1]=4 568 B9R0.1 CCC(=CCCC(=O)O)C MCULE-6674917264 [0,1,0,0,0,0|1,0,2]=4 569 B9R0.1 CCC(=O)CCCC(=O)O MCULE-9954859815 [0,1,0,0,0,0|1,0,1]=3 570 B9R0.1 CCC(=O)NCCC(=O)O MCULE-8290753533 [0,1,0,0,0,0|2,0,1]=4 571 B9R0.1 CCC(C)CCCC(=O)O MCULE-5124776736 [0,1,0,0,0,0|1,0,0]=2 572 B9R0.1 CCC(C)CCOC(=O)C MCULE-7887852572 [0,1,0,0,0,0|3,0,0]=4 573 B9R0.1 CCC(C)NCCC(=O)N MCULE-1926892639 [0,1,0,0,0,0|3,0,0]=4 574 B9R0.1 CCC(C)NCCC(=O)N MCULE-9191758717 [0,1,0,0,0,0|3,0,0]=4 575 B9R0.1 CCC(C)OCCC(=O)C MCULE-5228891169 [0,1,0,0,0,0|3,0,0]=4 576 B9R0.1 CN(CCCC(=O)O)N=O MCULE-9429394767 [0,1,0,0,0,0|3,0,0]=4 577 B9R0.1 CNC(=O)CCCC(=O)O MCULE-1504372631 [0,1,0,0,0,0|2,0,1]=4 578 B9R0.1 COC(=O)CCCC(=O)O MCULE-9458960872 [0,1,0,0,0,0|2,0,1]=4 579 B9R0.1 NCC(=O)CCCC(=O)O MCULE-2734634895 [0,1,0,0,0,0|0,0,1]=2 580 B9R0.1 NCC(=O)CCCC(=O)O MCULE-7779987234 [0,1,0,0,0,0|0,0,1]=2 581 B9R0.1 NCC(=O)NCCC(=O)N MCULE-3860393064 [0,1,0,0,0,0|2,0,1]=4 582 B9R0.1 NCC(=O)NCCC(=O)N MCULE-8788981043 [0,1,0,0,0,0|2,0,1]=4 583 B9R0.1 NCC(=O)ONCC(=O)O MCULE-2802022381 [0,1,0,0,0,0|2,0,1]=4 584 B9R0.1 O=C(O)CCCC(O)CO MCULE-8338266320 [0,1,0,0,0,0|1,0,0]=2 585 B9R0.1 O=C(O)CCNC(=O)CBr MCULE-6072289927 [0,1,0,0,0,0|2,0,1]=4 586 B9R0.1 O=C(O)CCNC(=O)CCl MCULE-4076619762 [0,1,0,0,0,0|2,0,1]=4 587 B9R0.1 O=C(O)CCNC(=O)CO MCULE-2710668626 [0,1,0,0,0,0|2,0,1]=4 588 B9R0.2 C#CCCCCCC(=O)O MCULE-4594227399 [0,1,0,0,0,0|1,0,0]=2 589 B9R0.2 C=C(Br)CCCCCC#N MCULE-4350556935 [0,1,0,0,0,0|2,0,1]=4 590 B9R0.2 C=C(Br)CCCCCCC MCULE-7091252982 [0,1,0,0,0,0|3,0,0]=4 591 B9R0.2 C=C(Br)CCCCCCCl MCULE-7125450966 [0,1,0,0,0,0|3,0,0]=4 592 B9R0.2 C=C(C)CCCCCC#N MCULE-7388773793 [0,1,0,0,0,0|2,0,1]=4 593 B9R0.2 C=C(C)CCCCCCC MCULE-6074571960 [0,1,0,0,0,0|3,0,0]=4 594 B9R0.2 C=C(C)CCCCCCCl MCULE-8555589200 [0,1,0,0,0,0|3,0,0]=4 595 B9R0.2 C=C(Cl)CCCCCC#N MCULE-6824512274 [0,1,0,0,0,0|2,0,1]=4 596 B9R0.2 C=C(Cl)CCCCCCC MCULE-4513303196 [0,1,0,0,0,0|3,0,0]=4 597 B9R0.2 C=C(Cl)CCCCCCCl MCULE-6627377695 [0,1,0,0,0,0|3,0,0]=4 598 B9R0.2 C=CCCCCCC(=O)C MCULE-7133840219 [0,1,0,0,0,0|2,0,0]=3 599 B9R0.2 C=CCCCCCC(=O)O MCULE-6571932731 [0,1,0,0,0,0|1,0,0]=2 600 B9R0.2 C=CCCCCCN(=O)=O MCULE-8090586611 [0,1,0,0,0,0|2,0,1]=4 601 B9R0.2 C=CCCCCOC(=O)C MCULE-4254881456 [0,1,0,0,0,0|2,0,1]=4 602 B9R0.2 C=CCOCCCC(=O)O MCULE-5276221892 [0,1,0,0,0,0|1,0,1]=3 603 B9R0.2 CC(=O)CCCCCCN MCULE-5842243037 [0,1,0,0,0,0|1,0,0]=2 604 B9R0.2 CC(=O)CCCCCCN MCULE-6017408205 [0,1,0,0,0,0|1,0,0]=2 605 B9R0.2 CC(=O)NCCCCCCl MCULE-9253955715 [0,1,0,0,0,0|2,0,0]=3 606 B9R0.2 CC(=O)NCCCCCN MCULE-6340089295 [0,1,0,0,0,0|1,0,0]=2 607 B9R0.2 CC(=O)NCCCCCN MCULE-9533682248 [0,1,0,0,0,0|1,0,0]=2 608 B9R0.2 CC(=O)NCCOCCBr MCULE-2348291899 [0,1,0,0,0,0|3,0,0]=4 609 B9R0.2 CC(=O)NCCOCCO MCULE-4601425982 [0,1,0,0,0,0|3,0,0]=4 610 B9R0.2 CC(=O)OCCCCCBr MCULE-2710815321 [0,1,0,0,0,0|2,0,0]=3 611 B9R0.2 CC(=O)OCCCCCCl MCULE-4259346820 [0,1,0,0,0,0|2,0,0]=3 612 B9R0.2 CC(=O)OCCOCCCl MCULE-6641386197 [0,1,0,0,0,0|3,0,0]=4 613 B9R0.2 CC(=O)OCCOCCO MCULE-1731179198 [0,1,0,0,0,0|3,0,0]=4 614 B9R0.2 CC(=O)SCCCCC#N MCULE-7251511964 [0,1,0,0,0,0|1,0,2]=4 615 B9R0.2 CC(=O)SCCCCCBr MCULE-3706830993 [0,1,0,0,0,0|2,0,0]=3 616 B9R0.2 CC(C)CCCCCCN MCULE-5169278674 [0,1,0,0,0,0|2,0,1]=4 617 B9R0.2 CC(C)CCOCCCN MCULE-8121420339 [0,1,0,0,0,0|2,0,1]=4 618 B9R0.2 CC(C)CSCCCCN MCULE-2450122241 [0,1,0,0,0,0|2,0,1]=4 619 B9R0.2 CC(C)NCCCCCN MCULE-1109263155 [0,1,0,0,0,0|2,0,1]=4 620 B9R0.2 CCCC/C=C/CC(=O)O MCULE-3008379579 [0,1,0,0,0,0|1,0,1]=3 621 B9R0.2 CCCC=CCCC(=O)O MCULE-8091554117 [0,1,0,0,0,0|1,0,1]=3 622 B9R0.2 CCCCC#CCC(=O)O MCULE-2685341100 [0,1,0,0,0,0|1,0,1]=3 623 B9R0.2 CCCCC/C=C/C(=O)C MCULE-4810438787 [0,1,0,0,0,0|2,0,1]=4 624 B9R0.2 CCCCC/C=C/C(=O)O MCULE-5661205729 [0,1,0,0,0,0|1,0,1]=3 625 B9R0.2 CCCCC=CCC(=O)N MCULE-7054762763 [0,1,0,0,0,0|2,0,1]=4 626 B9R0.2 CCCCC=CCC(=O)O MCULE-1531958630 [0,1,0,0,0,0|1,0,1]=3 627 B9R0.2 CCCCCC#CC(=O)O MCULE-1860076106 [0,1,0,0,0,0|1,0,1]=3 628 B9R0.2 CCCCCC=CC(=O)C MCULE-2447853309 [0,1,0,0,0,0|2,0,1]=4 629 B9R0.2 CCCCCC=CC(=O)O MCULE-6969617806 [0,1,0,0,0,0|1,0,1]=3 630 B9R0.2 CCCCCCCB(O)O MCULE-2487835239 [0,1,0,0,0,0|2,0,1]=4 631 B9R0.2 CCCCCCCC(=N)N MCULE-8703701987 [0,1,0,0,0,0|3,0,0]=4 632 B9R0.2 CCCCCCCC(=O)C MCULE-9635928766 [0,1,0,0,0,0|2,0,0]=3 633 B9R0.2 CCCCCCCC(=O)Cl MCULE-9979489292 [0,1,0,0,0,0|2,0,0]=3 634 B9R0.2 CCCCCCCC(=O)N MCULE-8774193381 [0,1,0,0,0,0|2,0,0]=3 635 B9R0.2 CCCCCCCC(=O)O MCULE-5193957469 [0,1,0,0,0,0|1,0,0]=2 636 B9R0.2 CCCCCCCC(=O)[O-] MCULE-3608650495 [0,1,0,0,0,0|1,0,1]=3 637 B9R0.2 CCCCCCCC(=O)[O-] MCULE-8227046407 [0,1,0,0,0,0|1,0,1]=3 638 B9R0.2 CCCCCCCC(C)O MCULE-5218382339 [0,1,0,0,0,0|2,0,1]=4 639 B9R0.2 CCCCCCCN(=O)=O MCULE-3345030651 [0,1,0,0,0,0|2,0,1]=4 640 B9R0.2 CCCCCCC[C@H](C)O MCULE-6211597611 [0,1,0,0,0,0|2,0,1]=4 641 B9R0.2 CCCCCCNC(=O)N MCULE-4236638652 [0,1,0,0,0,0|2,0,0]=3 642 B9R0.2 CCCCCCNC(=S)N MCULE-1507775926 [0,1,0,0,0,0|2,1,0]=4 643 B9R0.2 CCCCCCOC(=O)C MCULE-7353613022 [0,1,0,0,0,0|2,0,0]=3 644 B9R0.2 CCCCCCOC(=O)Cl MCULE-3135055168 [0,1,0,0,0,0|2,0,0]=3 645 B9R0.2 CCCCCCOC(=O)N MCULE-3909923308 [0,1,0,0,0,0|2,0,0]=3 646 B9R0.2 CCCCCCOC(=S)[S-] MCULE-1848031601 [0,1,0,0,0,0|1,2,0]=4 647 B9R0.2 CCCCCCOC(=S)[S-] MCULE-2674237730 [0,1,0,0,0,0|1,2,0]=4 648 B9R0.2 CCCCCCSC(=N)N MCULE-5637553864 [0,1,0,0,0,0|3,0,0]=4 649 B9R0.2 CCCCCCSC(=N)N MCULE-7474503542 [0,1,0,0,0,0|3,0,0]=4 650 B9R0.2 CCCCCCSC(=[NH2+])N MCULE-5793664409 [0,1,0,0,0,0|3,0,0]=4 651 B9R0.2 CCCCCNCC(=O)N MCULE-1817354788 [0,1,0,0,0,0|2,0,0]=3 652 B9R0.2 CCCCCNCC(=O)N MCULE-5558188497 [0,1,0,0,0,0|2,0,0]=3 653 B9R0.2 CCCCCOCC(=O)O MCULE-8190672624 [0,1,0,0,0,0|1,0,0]=2 654 B9R0.2 CCCCOCCC(=O)O MCULE-3735085695 [0,1,0,0,0,0|1,0,0]=2 655 B9R0.2 CCCCSCCC(=O)O MCULE-7414288717 [0,1,0,0,0,0|1,0,0]=2 656 B9R0.2 CCCOCCCC(=O)O MCULE-8829980105 [0,1,0,0,0,0|1,0,0]=2 657 B9R0.2 CCCOCCOC(=O)Cl MCULE-3909524059 [0,1,0,0,0,0|3,0,0]=4 658 B9R0.2 CCCSCCCC(=O)O MCULE-9850452520 [0,1,0,0,0,0|1,0,0]=2 659 B9R0.2 CCNCCCCC(=O)O MCULE-1386195341 [0,1,0,0,0,0|1,0,0]=2 660 B9R0.2 CCNCCCCC(=O)O MCULE-1922836400 [0,1,0,0,0,0|1,0,0]=2 661 B9R0.2 CCOCCCCC(=O)O MCULE-8522289104 [0,1,0,0,0,0|1,0,0]=2 662 B9R0.2 CCOCCOCC(=O)O MCULE-2273372397 [0,1,0,0,0,0|2,0,0]=3 663 B9R0.2 CN(C)CCCCCCN MCULE-6623815643 [0,1,0,0,0,0|3,0,0]=4 664 B9R0.2 CN(C)CCCNCCN MCULE-1335401045 [0,1,0,0,0,0|3,0,0]=4 665 B9R0.2 CN(C)CCNCCCN MCULE-4771361677 [0,1,0,0,0,0|3,0,0]=4 666 B9R0.2 CNCCCCCC(=O)O MCULE-8016435275 [0,1,0,0,0,0|0,0,0]=1 667 B9R0.2 CNCCOCCC(=O)O MCULE-6581967922 [0,1,0,0,0,0|1,0,0]=2 668 B9R0.2 COCCCCCC(=O)O MCULE-1769987918 [0,1,0,0,0,0|1,0,0]=2 669 B9R0.2 COCCCCOC(=O)C MCULE-4352807618 [0,1,0,0,0,0|3,0,0]=4 670 B9R0.2 COCCCOCC(=O)O MCULE-7774967166 [0,1,0,0,0,0|2,0,0]=3 671 B9R0.2 COCCNCCC(=O)N MCULE-2441989659 [0,1,0,0,0,0|3,0,0]=4 672 B9R0.2 COCCNCCC(=O)O MCULE-3571993123 [0,1,0,0,0,0|2,0,0]=3 673 B9R0.2 COCCOCCC(=O)O MCULE-5125891492 [0,1,0,0,0,0|2,0,0]=3 674 B9R0.2 CS(=O)CCCCCC#N MCULE-6192284858 [0,1,0,0,0,0|2,0,1]=4 675 B9R0.2 CSCCCCCC(=O)O MCULE-9069370044 [0,1,0,0,0,0|1,0,0]=2 676 B9R0.2 C[NH2+]CCCCCC(=O)O MCULE-8971339830 [0,1,0,0,0,0|0,0,1]=2 677 B9R0.2 N#CCCCCCC(=O)O MCULE-6510846674 [0,1,0,0,0,0|0,0,1]=2 678 B9R0.2 N#CCCNCCC(=O)O MCULE-5749626028 [0,1,0,0,0,0|0,0,2]=3 679 B9R0.2 N#N=NCCCCC(=O)O MCULE-6676414217 [0,1,0,0,0,0|1,0,1]=3 680 B9R0.2 N#N=NCCOCC(=O)O MCULE-7862025452 [0,1,0,0,0,0|2,0,1]=4 681 B9R0.2 NC(=O)CCCCCCO MCULE-7432797193 [0,1,0,0,0,0|2,0,0]=3 682 B9R0.2 NC(=O)CCNCCCO MCULE-1089880795 [0,1,0,0,0,0|2,0,0]=3 683 B9R0.2 NC(=O)CCNCCCO MCULE-8808474432 [0,1,0,0,0,0|2,0,0]=3 684 B9R0.2 NC(=O)NCCOCCO MCULE-5514708038 [0,1,0,0,0,0|3,0,0]=4 685 B9R0.2 NCCCCCCC(=O)N MCULE-9587339996 [0,1,0,0,0,0|1,0,0]=2 686 B9R0.2 NCCCCCCC(=O)O MCULE-6089872609 [0,1,0,0,0,0|0,0,0]=1 687 B9R0.2 NCCCCCCC(=O)O MCULE-7769232328 [0,1,0,0,0,0|0,0,0]=1 688 B9R0.2 NCCSSCCC(=O)O MCULE-2378332819 [0,1,0,0,0,0|1,0,0]=2 689 B9R0.2 NCCSSCCC(=O)O MCULE-4249865017 [0,1,0,0,0,0|1,0,0]=2 690 B9R0.2 NOCCCCCC(=O)O MCULE-3221083368 [0,1,0,0,0,0|0,0,0]=1 691 B9R0.2 NOCCCCCC(=O)O MCULE-6721085396 [0,1,0,0,0,0|0,0,0]=1 692 B9R0.2 NOCCCCCC(=O)O MCULE-7170875932 [0,1,0,0,0,0|0,0,0]=1 693 B9R0.2 O=C(O)CCCCCCBr MCULE-3980379488 [0,1,0,0,0,0|1,0,0]=2 694 B9R0.2 O=C(O)CCCCCCF MCULE-7539264820 [0,1,0,0,0,0|1,0,0]=2 695 B9R0.2 O=C(O)CCCCCCO MCULE-7270362706 [0,1,0,0,0,0|1,0,0]=2 696 B9R0.2 O=C(O)CCCCCCS MCULE-5659986053 [0,1,0,0,0,0|1,0,0]=2 697 B9R0.2 O=C(O)CCCNCCO MCULE-8202070706 [0,1,0,0,0,0|1,0,0]=2 698 B9R0.2 O=C(O)CNCCCCO MCULE-6377863888 [0,1,0,0,0,0|1,0,0]=2 699 B9R0.2 O=CCCCCCC(=O)O MCULE-1442157793 [0,1,0,0,0,0|1,0,0]=2 700 B9R0.2 O=N(=O)CCCCCCBr MCULE-2338252232 [0,1,0,0,0,0|2,0,1]=4 701 B9R0.2 O=N(=O)CCCCCCCl MCULE-9710639685 [0,1,0,0,0,0|2,0,1]=4 702 B9R0.2 O=N(=O)CCCCCCO MCULE-4612254871 [0,1,0,0,0,0|2,0,1]=4 703 B9R0.2 OB(O)CCCCCCBr MCULE-2961009060 [0,1,0,0,0,0|2,0,1]=4 704 B9R0.2 P(=O)([O-])OCCCCCC MCULE-6311367116 [0,1,0,0,0,0|2,0,1]=4 705 B9R0.2 [NH2+]=C(N)SCCCCCC MCULE-3527944138 [0,1,0,0,0,0|3,0,0]=4 706 B9R0.4 C#CCCN(C)CC(=O)O MCULE-2368300215 [0,1,0,0,0,0|2,0,1]=4 707 B9R0.4 C#CCCN(C)CC(=O)O MCULE-3491335280 [0,1,0,0,0,0|2,0,1]=4 708 B9R0.4 C=CCCC(N)CC(=O)O MCULE-1616151020 [0,1,0,0,0,0|1,0,1]=3 709 B9R0.4 C=CCCC(N)CC(=O)O MCULE-6121434138 [0,1,0,0,0,0|1,0,1]=3 710 B9R0.4 CC(CC(=O)O)NCCO MCULE-6990108869 [0,1,0,0,0,0|2,0,0]=3 711 B9R0.4 CCCCC(=O)CC(=O)C MCULE-9961207967 [0,1,0,0,0,0|2,0,1]=4 712 B9R0.4 CCCCC(C)CC(=O)O MCULE-1674327007 [0,1,0,0,0,0|1,0,0]=2 713 B9R0.4 CCCCC(C)OC(=O)Cl MCULE-3267128498 [0,1,0,0,0,0|3,0,0]=4 714 B9R0.4 CCCCC(N)CC(=O)O MCULE-4002800812 [0,1,0,0,0,0|1,0,0]=2 715 B9R0.4 CCCCC(N)CC(=O)O MCULE-8705314129 [0,1,0,0,0,0|1,0,0]=2 716 B9R0.4 CCCCC(O)CC(=O)O MCULE-6348296633 [0,1,0,0,0,0|1,0,0]=2 717 B9R0.4 CCCC[C@@H](N)CC(=O)O MCULE-8271790861 [0,1,0,0,0,0|1,0,0]=2 718 B9R0.4 CCCC[C@H](C)CC(=O)O MCULE-2048808547 [0,1,0,0,0,0|1,0,0]=2 719 B9R0.4 CCCC[C@H](N)CC(=O)O MCULE-1387096023 [0,1,0,0,0,0|1,0,0]=2 720 B9R0.4 CN(CCC#N)CC(=O)O MCULE-1515172721 [0,1,0,0,0,0|1,0,2]=4 721 B9R0.4 COCCN(C)CC(=O)O MCULE-2440763888 [0,1,0,0,0,0|3,0,0]=4 722 B9R0.4 COCCN(C)CC(=O)O MCULE-6319676297 [0,1,0,0,0,0|3,0,0]=4 723 B9R0.4 CSCCC(N)CC(=O)O MCULE-1046928513 [0,1,0,0,0,0|2,0,0]=3 724 B9R0.4 CSCCC(N)CC(=O)O MCULE-8979030814 [0,1,0,0,0,0|2,0,0]=3 725 B9R0.4 CSCCC(O)CC(=O)O MCULE-8328222292 [0,1,0,0,0,0|2,0,0]=3 726 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-2765615228 [0,1,0,0,0,0|2,0,0]=3 727 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-5262188114 [0,1,0,0,0,0|2,0,0]=3 728 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-7951099593 [0,1,0,0,0,0|2,0,0]=3 729 B9R0.4 CSCC[C@@H](N)CC(=O)O MCULE-9117868798 [0,1,0,0,0,0|2,0,0]=3 730 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-1875547228 [0,1,0,0,0,0|2,0,0]=3 731 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-2149586027 [0,1,0,0,0,0|2,0,0]=3 732 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-2492945888 [0,1,0,0,0,0|2,0,0]=3 733 B9R0.4 CSCC[C@H](N)CC(=O)O MCULE-3229832789 [0,1,0,0,0,0|2,0,0]=3 734 B9R0.4 NCCCC(N)CC(=O)O MCULE-3705980324 [0,1,0,0,0,0|0,0,0]=1 735 B9R0.4 NCCCC(N)CC(=O)O MCULE-5566899547 [0,1,0,0,0,0|0,0,0]=1 736 B9R0.4 NCCC[C@@H](N)CC(=O)O MCULE-3425525065 [0,1,0,0,0,0|0,0,0]=1 737 B9R0.4 NCCC[C@H](N)CC(=O)O MCULE-2321041121 [0,1,0,0,0,0|0,0,0]=1 738 B9R0.4 NCCC[C@H](N)CC(=O)O MCULE-6552199637 [0,1,0,0,0,0|0,0,0]=1 739 B9R0.4 [N-]=[N+]=NC[C@@H](N)CC(=O)O MCULE-2831741781 [0,1,0,0,0,0|2,0,1]=4 740 B9R0.38 CCCCCCC(C)(C)O MCULE-4930467845 [0,1,0,0,0,0|2,0,1]=4 741 B9R0.38 CCCCCCP(=O)(Cl)Cl MCULE-7092836822 [0,1,0,0,0,0|3,0,0]=4 742 B9R0.38 CCCCCCP(=O)(O)O MCULE-9622755834 [0,1,0,0,0,0|2,0,0]=3 743 B9R0.38 CCCCCCS(=O)(=O)Cl MCULE-5853699428 [0,1,0,0,0,0|2,0,1]=4 744 B9R0.38 CCCCCCS(=O)(=O)O MCULE-4883139983 [0,1,0,0,0,0|2,0,0]=3 745 B9R0.38 CCCCCCS(=O)(=O)[O-] MCULE-4087141650 [0,1,0,0,0,0|2,0,1]=4 746 B9R0.38 CCCCNCP(=O)(C)O MCULE-4370254909 [0,1,0,0,0,0|3,0,0]=4 747 B9R0.38 CS(=O)(=O)CCCCCN MCULE-5280233986 [0,1,0,0,0,0|1,0,1]=3 748 B9R0.38 CS(=O)(=O)CCCCCN MCULE-7951763514 [0,1,0,0,0,0|1,0,1]=3 749 B9R0.38 CS(=O)(=O)CCCCCO MCULE-8167550516 [0,1,0,0,0,0|2,0,1]=4 750 B9R0.38 CS(=O)(=O)CCOCCN MCULE-1852727988 [0,1,0,0,0,0|2,0,1]=4 751 B9R0.38 CS(=O)(=O)CCOCCN MCULE-8898068986 [0,1,0,0,0,0|2,0,1]=4 752 B9R0.38 NCCCCCC(F)(F)F MCULE-2790205815 [0,1,0,0,0,0|2,0,1]=4 753 B9R0.38 NCCCCCC(N)(N)N MCULE-1706774109 [0,1,0,0,0,0|2,0,1]=4 754 B9R0.38 NCCCCCS(=O)(=O)O MCULE-7296557430 [0,1,0,0,0,0|1,0,0]=2 755 B9R0.38 NCCNCCS(=O)(=O)O MCULE-1404556880 [0,1,0,0,0,0|2,0,0]=3 756 B9R0.38 NCCNCCS(=O)(=O)[O-] MCULE-4087093626 [0,1,0,0,0,0|2,0,1]=4 757 B9R0.38 NCCOCCS(=O)(=O)N MCULE-5155164820 [0,1,0,0,0,0|2,0,1]=4 758 B9R0.38 NCCOCCS(=O)(=O)N MCULE-6203063192 [0,1,0,0,0,0|2,0,1]=4 759 B9R0.38 O=P(O)(O)CCOCCCl MCULE-4452895182 [0,1,0,0,0,0|3,0,0]=4 760 B9R0.46 C#CC(O)CCCCCBr MCULE-4507050415 [0,1,0,0,0,0|2,0,1]=4 761 B9R0.46 C#CC(O)CCCCCC MCULE-7473928469 [0,1,0,0,0,0|2,0,1]=4 762 B9R0.46 C#CCCCCC(=O)OC MCULE-4261649689 [0,1,0,0,0,0|1,0,1]=3 763 B9R0.46 C=CC(=O)CCCCCC MCULE-4486396694 [0,1,0,0,0,0|2,0,0]=3 764 B9R0.46 C=CC(=O)NCCCCO MCULE-8904662179 [0,1,0,0,0,0|3,0,0]=4 765 B9R0.46 C=CC(=O)OCCCCBr MCULE-9764748740 [0,1,0,0,0,0|3,0,0]=4 766 B9R0.46 C=CC(=O)OCCCCC MCULE-6727835934 [0,1,0,0,0,0|3,0,0]=4 767 B9R0.46 C=CC(=O)OCCCCCl MCULE-6562256525 [0,1,0,0,0,0|3,0,0]=4 768 B9R0.46 C=CC(=O)OCCCCO MCULE-5659811687 [0,1,0,0,0,0|3,0,0]=4 769 B9R0.46 C=CC(O)CCCCCC MCULE-8553741195 [0,1,0,0,0,0|2,0,1]=4 770 B9R0.46 C=CCCCCC(=O)OC MCULE-7317556908 [0,1,0,0,0,0|1,0,1]=3 771 B9R0.46 C=CCCNCC(=O)OC MCULE-1793995699 [0,1,0,0,0,0|2,0,1]=4 772 B9R0.46 C=CCCNCC(=O)OC MCULE-4679984261 [0,1,0,0,0,0|2,0,1]=4 773 B9R0.46 C=CCNCCC(=O)OC MCULE-2549759040 [0,1,0,0,0,0|2,0,1]=4 774 B9R0.46 CCCCC#CC(=O)OC MCULE-6610188635 [0,1,0,0,0,0|1,0,2]=4 775 B9R0.46 CCCCC=CC(=O)OC MCULE-3507079471 [0,1,0,0,0,0|1,0,2]=4 776 B9R0.46 CCCCCCC(=O)CBr MCULE-5041636942 [0,1,0,0,0,0|2,0,0]=3 777 B9R0.46 CCCCCCC(=O)CC MCULE-6606139631 [0,1,0,0,0,0|2,0,0]=3 778 B9R0.46 CCCCCCC(=O)NN MCULE-6491418749 [0,1,0,0,0,0|2,0,0]=3 779 B9R0.46 CCCCCCC(=O)NO MCULE-7308576516 [0,1,0,0,0,0|1,0,0]=2 780 B9R0.46 CCCCCCC(=O)OC MCULE-7883111323 [0,1,0,0,0,0|1,0,0]=2 781 B9R0.46 CCCCCCC(C)C=O MCULE-4073561137 [0,1,0,0,0,0|2,0,1]=4 782 B9R0.46 CCCCCCC(C)CO MCULE-7202468291 [0,1,0,0,0,0|2,0,1]=4 783 B9R0.46 CCCCCCC(Cl)C=O MCULE-9755396866 [0,1,0,0,0,0|2,0,1]=4 784 B9R0.46 CCCCCCC(O)CBr MCULE-4248488641 [0,1,0,0,0,0|2,0,1]=4 785 B9R0.46 CCCCCCC(O)CC MCULE-7543978401 [0,1,0,0,0,0|2,0,1]=4 786 B9R0.46 CCCCCCC(O)CO MCULE-7396593748 [0,1,0,0,0,0|1,0,2]=4 787 B9R0.46 CCCCCC[C@@H](O)CO MCULE-9540453574 [0,1,0,0,0,0|1,0,2]=4 788 B9R0.46 CCCCCC[C@H](O)CO MCULE-8481484883 [0,1,0,0,0,0|1,0,2]=4 789 B9R0.46 CCCCCNC(=O)CCl MCULE-8028345115 [0,1,0,0,0,0|3,0,0]=4 790 B9R0.46 CCCCCOC(=O)CBr MCULE-3749700207 [0,1,0,0,0,0|3,0,0]=4 791 B9R0.46 CCCCCOC(=O)CC MCULE-6912037911 [0,1,0,0,0,0|3,0,0]=4 792 B9R0.46 CCCCCOC(=O)CCl MCULE-6254869186 [0,1,0,0,0,0|3,0,0]=4 793 B9R0.46 CCCCCOC(=O)CN MCULE-1223174561 [0,1,0,0,0,0|3,0,0]=4 794 B9R0.46 CCCCCOC(=O)CS MCULE-8048926704 [0,1,0,0,0,0|2,1,0]=4 795 B9R0.46 CCCCCOC(=O)C[NH3+] MCULE-4653269874 [0,1,0,0,0,0|3,0,0]=4 796 B9R0.46 CCCCSCC(=O)NN MCULE-4637902983 [0,1,0,0,0,0|3,0,0]=4 797 B9R0.46 CCCCSCC(=O)OC MCULE-1208944064 [0,1,0,0,0,0|2,0,0]=3 798 B9R0.46 CCCNCCC(=O)NC MCULE-7368054577 [0,1,0,0,0,0|3,0,0]=4 799 B9R0.46 CCCNCCC(=O)NN MCULE-5834849938 [0,1,0,0,0,0|3,0,0]=4 800 B9R0.46 CCCNCCC(=O)OC MCULE-4786941347 [0,1,0,0,0,0|2,0,0]=3 801 B9R0.46 CCNCCCC(=O)OC MCULE-1330024068 [0,1,0,0,0,0|2,0,0]=3 802 B9R0.46 CCNCCCC(=O)OC MCULE-1608160566 [0,1,0,0,0,0|2,0,0]=3 803 B9R0.46 CNCCCCC(=O)OC MCULE-3479794664 [0,1,0,0,0,0|2,0,0]=3 804 B9R0.46 CNCCCCC(=O)OC MCULE-3875784281 [0,1,0,0,0,0|2,0,0]=3 805 B9R0.46 COC(=O)CCCCC=O MCULE-6810055406 [0,1,0,0,0,0|1,0,1]=3 806 B9R0.46 COC(=O)CCCCCBr MCULE-5661009403 [0,1,0,0,0,0|1,0,0]=2 807 B9R0.46 COC(=O)CCCCCCl MCULE-2967199349 [0,1,0,0,0,0|1,0,0]=2 808 B9R0.46 COC(=O)CCCCCI MCULE-6638103547 [0,1,0,0,0,0|1,0,0]=2 809 B9R0.46 COC(=O)CCCCCN MCULE-9013585398 [0,1,0,0,0,0|0,0,0]=1 810 B9R0.46 COC(=O)CCCCCN MCULE-9184696999 [0,1,0,0,0,0|0,0,0]=1 811 B9R0.46 COC(=O)CCCCCO MCULE-6405405706 [0,1,0,0,0,0|1,0,0]=2 812 B9R0.46 COC(=O)CCCCCS MCULE-3886120866 [0,1,0,0,0,0|1,0,0]=2 813 B9R0.46 COC(=O)CCCN=C=S MCULE-8254687973 [0,1,0,0,0,0|2,0,1]=4 814 B9R0.46 COC(=O)CCCN=N#N MCULE-3436327994 [0,1,0,0,0,0|2,0,1]=4 815 B9R0.46 COC(=O)CCCSC#N MCULE-9607722002 [0,1,0,0,0,0|1,0,2]=4 816 B9R0.46 COC(=O)CCNCC#N MCULE-6687843428 [0,1,0,0,0,0|1,0,2]=4 817 B9R0.46 COC(=O)CCNCCO MCULE-8673898296 [0,1,0,0,0,0|2,0,0]=3 818 B9R0.46 COC(=O)CCNCCO MCULE-9372452891 [0,1,0,0,0,0|2,0,0]=3 819 B9R0.46 COC(=O)CCOCCO MCULE-2103874995 [0,1,0,0,0,0|2,0,0]=3 820 B9R0.46 COC(=O)CCSCCBr MCULE-9094494560 [0,1,0,0,0,0|2,0,0]=3 821 B9R0.46 COC(=O)CNCCC#N MCULE-4050903225 [0,1,0,0,0,0|1,0,2]=4 822 B9R0.46 COC(=O)CNCCC#N MCULE-9042406912 [0,1,0,0,0,0|1,0,2]=4 823 B9R0.46 COC(=O)COCCCBr MCULE-4809392864 [0,1,0,0,0,0|2,0,0]=3 824 B9R0.46 COC(=O)CSCCCCl MCULE-4673663390 [0,1,0,0,0,0|2,0,0]=3 825 B9R0.46 COC(=O)CSSCCO MCULE-3590920745 [0,1,0,0,0,0|3,0,0]=4 826 B9R0.46 COCCCCC(=O)OC MCULE-9886328481 [0,1,0,0,0,0|2,0,0]=3 827 B9R0.46 COCCNCC(=O)OC MCULE-2601282680 [0,1,0,0,0,0|3,0,0]=4 828 B9R0.46 COCCOCC(=O)OC MCULE-4614657424 [0,1,0,0,0,0|3,0,0]=4 829 B9R0.46 COCCSCC(=O)OC MCULE-2376910054 [0,1,0,0,0,0|3,0,0]=4 830 B9R0.46 NCCCCNC(=O)CCl MCULE-3702390388 [0,1,0,0,0,0|2,0,0]=3 831 B9R0.46 NCCCCNC(=O)CCl MCULE-8135973380 [0,1,0,0,0,0|2,0,0]=3 832 B9R0.46 NNC(=O)CCCCCO MCULE-7442906607 [0,1,0,0,0,0|2,0,0]=3 833 B9R0.46 O=C(CBr)OCCCCBr MCULE-6257815874 [0,1,0,0,0,0|3,0,0]=4 834 B9R0.46 OCCCCCC(O)CO MCULE-1241763539 [0,1,0,0,0,0|1,0,2]=4 835 B9R0.47 C#CCCC[C@@H](N)C(=O)O MCULE-1522125822 [0,1,0,0,0,0|1,0,1]=3 836 B9R0.47 C#CCCC[C@@H](N)C(=O)O MCULE-2184948430 [0,1,0,0,0,0|1,0,1]=3 837 B9R0.47 C#CCCC[C@H](N)C(=O)O MCULE-3478575968 [0,1,0,0,0,0|1,0,1]=3 838 B9R0.47 C#CCCC[C@H](N)C(=O)O MCULE-5307313414 [0,1,0,0,0,0|1,0,1]=3 839 B9R0.47 C#CCOC[C@H](N)C(=O)O MCULE-8879805332 [0,1,0,0,0,0|2,0,1]=4 840 B9R0.47 C#CCSCC(N)C(=O)O MCULE-8696971754 [0,1,0,0,0,0|2,0,1]=4 841 B9R0.47 C#CCSC[C@H](N)C(=O)O MCULE-9301300062 [0,1,0,0,0,0|2,0,1]=4 842 B9R0.47 C(N)(CCCCN)C(=O)O MCULE-7060791798 [0,1,0,0,0,0|0,0,0]=1 843 B9R0.47 C=CCCCC(C)C(=O)C MCULE-3594332716 [0,1,0,0,0,0|2,0,1]=4 844 B9R0.47 C=CCCCC(N)C(=O)O MCULE-3707920281 [0,1,0,0,0,0|1,0,1]=3 845 B9R0.47 C=CCCCC(N)C(=O)O MCULE-5939027667 [0,1,0,0,0,0|1,0,1]=3 846 B9R0.47 C=CCCCC(N)C(=O)O MCULE-6095387409 [0,1,0,0,0,0|1,0,1]=3 847 B9R0.47 C=CCCC[C@@H](N)C(=O)O MCULE-2101628204 [0,1,0,0,0,0|1,0,1]=3 848 B9R0.47 C=CCCC[C@@H](N)C(=O)O MCULE-7328150693 [0,1,0,0,0,0|1,0,1]=3 849 B9R0.47 C=CCCC[C@H](N)C(=O)O MCULE-1162071877 [0,1,0,0,0,0|1,0,1]=3 850 B9R0.47 C=CCCC[C@H](N)C(=O)O MCULE-7245809917 [0,1,0,0,0,0|1,0,1]=3 851 B9R0.47 C=CCCNC(C)C(=O)O MCULE-2164423879 [0,1,0,0,0,0|2,0,1]=4 852 B9R0.47 C=CCCOC(C)C(=O)O MCULE-4921869592 [0,1,0,0,0,0|2,0,1]=4 853 B9R0.47 C=CCSCC(N)C(=O)O MCULE-6058548878 [0,1,0,0,0,0|2,0,1]=4 854 B9R0.47 C=CCSCC(N)C(=O)O MCULE-9209051108 [0,1,0,0,0,0|2,0,1]=4 855 B9R0.47 C=CCSC[C@@H](N)C(=O)O MCULE-8305031365 [0,1,0,0,0,0|2,0,1]=4 856 B9R0.47 C=CCSC[C@@H](N)C(=O)O MCULE-9911064679 [0,1,0,0,0,0|2,0,1]=4 857 B9R0.47 C=CCSC[C@H](N)C(=O)O MCULE-8106938913 [0,1,0,0,0,0|2,0,1]=4 858 B9R0.47 C=CCSC[C@H](N)C(=O)O MCULE-8215284816 [0,1,0,0,0,0|2,0,1]=4 859 B9R0.47 C=CCSC[C@H](N)C(=O)O MCULE-9415243514 [0,1,0,0,0,0|2,0,1]=4 860 B9R0.47 C=CSCC[C@H](N)C(=O)O MCULE-2736074137 [0,1,0,0,0,0|2,0,1]=4 861 B9R0.47 CC(CSCCN)C(=O)O MCULE-8181129041 [0,1,0,0,0,0|1,0,0]=2 862 B9R0.47 CC(CSCCN)C(=O)O MCULE-9927031234 [0,1,0,0,0,0|1,0,0]=2 863 B9R0.47 CC(NCCC#N)C(=O)O MCULE-7314407236 [0,1,0,0,0,0|1,0,2]=4 864 B9R0.47 CCCC=CC(O)C(=O)O MCULE-9096490162 [0,1,0,0,0,0|1,0,2]=4 865 B9R0.47 CCCCCC(=O)C(=O)C MCULE-3171324169 [0,1,0,0,0,0|2,0,1]=4 866 B9R0.47 CCCCCC(=O)C(=O)O MCULE-2334480456 [0,1,0,0,0,0|1,0,1]=3 867 B9R0.47 CCCCCC(C)C(=O)C MCULE-8141962187 [0,1,0,0,0,0|2,0,0]=3 868 B9R0.47 CCCCCC(C)C(=O)O MCULE-3831811055 [0,1,0,0,0,0|1,0,0]=2 869 B9R0.47 CCCCCC(N)C(=O)O MCULE-5558679374 [0,1,0,0,0,0|1,0,0]=2 870 B9R0.47 CCCCCC(N)C(=O)O MCULE-8607576790 [0,1,0,0,0,0|1,0,0]=2 871 B9R0.47 CCCCCC(O)C(=O)O MCULE-4151749430 [0,1,0,0,0,0|1,0,0]=2 872 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-3981603450 [0,1,0,0,0,0|1,0,0]=2 873 B9R0.47 CCCCC[C@@H](N)C(=O)O MCULE-6090735433 [0,1,0,0,0,0|1,0,0]=2 874 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-8108024359 [0,1,0,0,0,0|1,0,0]=2 875 B9R0.47 CCCCC[C@H](N)C(=O)O MCULE-9961773652 [0,1,0,0,0,0|1,0,0]=2 876 B9R0.47 CCCCOC(C)C(=O)O MCULE-2711768240 [0,1,0,0,0,0|2,0,0]=3 877 B9R0.47 CCCCSC(C)C(=O)O MCULE-1538375330 [0,1,0,0,0,0|2,0,0]=3 878 B9R0.47 CCCSCC(N)C(=O)O MCULE-1465196294 [0,1,0,0,0,0|2,0,0]=3 879 B9R0.47 CCCSCC(N)C(=O)O MCULE-2196835186 [0,1,0,0,0,0|2,0,0]=3 880 B9R0.47 CCCSC[C@H](N)C(=O)O MCULE-2274873569 [0,1,0,0,0,0|2,0,0]=3 881 B9R0.47 CCNCCC(N)C(=O)O MCULE-8873123795 [0,1,0,0,0,0|2,0,0]=3 882 B9R0.47 CCSCCC(N)C(=O)O MCULE-8503033566 [0,1,0,0,0,0|2,0,0]=3 883 B9R0.47 CCSCCC(N)C(=O)O MCULE-9465623190 [0,1,0,0,0,0|2,0,0]=3 884 B9R0.47 CCSCC[C@@H](N)C(=O)O MCULE-2836325620 [0,1,0,0,0,0|2,0,0]=3 885 B9R0.47 CCSCC[C@H](N)C(=O)O MCULE-6614300528 [0,1,0,0,0,0|2,0,0]=3 886 B9R0.47 CC[Se]CCC(N)C(=O)O MCULE-7426703933 [0,1,0,0,0,0|2,0,0]=3 887 B9R0.47 COCCCC(C)C(=O)O MCULE-7159772792 [0,1,0,0,0,0|2,0,0]=3 888 B9R0.47 COCCNC(C)C(=O)O MCULE-1762428923 [0,1,0,0,0,0|3,0,0]=4 889 B9R0.47 COCCNC(C)C(=O)O MCULE-8532368084 [0,1,0,0,0,0|3,0,0]=4 890 B9R0.47 COCCOC(C)C(=O)O MCULE-5271320344 [0,1,0,0,0,0|3,0,0]=4 891 B9R0.47 CSCCOC(C)C(=O)O MCULE-2180057271 [0,1,0,0,0,0|3,0,0]=4 892 B9R0.47 CSCSC[C@H](N)C(=O)O MCULE-2792975111 [0,1,0,0,0,0|3,0,0]=4 893 B9R0.47 N#N=NCCC(N)C(=O)O MCULE-3306935085 [0,1,0,0,0,0|2,0,1]=4 894 B9R0.47 N/N=C/NC[C@H](N)C(=O)O MCULE-5611888169 [0,1,0,0,0,0|2,0,1]=4 895 B9R0.47 N/N=C/NC[C@H](N)C(=O)O MCULE-6448566029 [0,1,0,0,0,0|2,0,1]=4 896 B9R0.47 NC(CCCCO)C(=O)O MCULE-7372730935 [0,1,0,0,0,0|1,0,0]=2 897 B9R0.47 NC(CSCCO)C(=O)O MCULE-9765321939 [0,1,0,0,0,0|2,0,0]=3 898 B9R0.47 NCC#CCC(N)C(=O)O MCULE-6095484409 [0,1,0,0,0,0|0,0,2]=3 899 B9R0.47 NCC#CCC(N)C(=O)O MCULE-8713805302 [0,1,0,0,0,0|0,0,2]=3 900 B9R0.47 NCC=CCC(N)C(=O)O MCULE-9924781011 [0,1,0,0,0,0|0,0,2]=3 901 B9R0.47 NCCCCC(N)C(=O)N MCULE-5695768231 [0,1,0,0,0,0|1,0,0]=2 902 B9R0.47 NCCCCC(N)C(=O)N MCULE-8502146041 [0,1,0,0,0,0|1,0,0]=2 903 B9R0.47 NCCCCC(N)C(=O)O MCULE-1411873021 [0,1,0,0,0,0|0,0,0]=1 904 B9R0.47 NCCCCC(N)C(=O)O MCULE-1436032977 [0,1,0,0,0,0|0,0,0]=1 905 B9R0.47 NCCCCC(N)C(=O)O MCULE-5737537430 [0,1,0,0,0,0|0,0,0]=1 906 B9R0.47 NCCCCC(N)C(=O)O MCULE-6537319758 [0,1,0,0,0,0|0,0,0]=1 907 B9R0.47 NCCCCC(N)C(=O)O MCULE-9665753367 [0,1,0,0,0,0|0,0,0]=1 908 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2051883110 [0,1,0,0,0,0|0,0,0]=1 909 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-2174845427 [0,1,0,0,0,0|0,0,0]=1 910 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7229907816 [0,1,0,0,0,0|0,0,0]=1 911 B9R0.47 NCCCC[C@@H](N)C(=O)O MCULE-7646209988 [0,1,0,0,0,0|0,0,0]=1 912 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-2490465776 [0,1,0,0,0,0|1,0,0]=2 913 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-5523101334 [0,1,0,0,0,0|1,0,0]=2 914 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-7682920289 [0,1,0,0,0,0|1,0,0]=2 915 B9R0.47 NCCCC[C@H](N)C(=O)N MCULE-9381942600 [0,1,0,0,0,0|1,0,0]=2 916 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-1814780282 [0,1,0,0,0,0|0,0,0]=1 917 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2585671029 [0,1,0,0,0,0|0,0,0]=1 918 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-2735109468 [0,1,0,0,0,0|0,0,0]=1 919 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-3226089160 [0,1,0,0,0,0|0,0,0]=1 920 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-4736099943 [0,1,0,0,0,0|0,0,0]=1 921 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5602916309 [0,1,0,0,0,0|0,0,0]=1 922 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5669080418 [0,1,0,0,0,0|0,0,0]=1 923 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-5771120494 [0,1,0,0,0,0|0,0,0]=1 924 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-6467055628 [0,1,0,0,0,0|0,0,0]=1 925 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7268734331 [0,1,0,0,0,0|0,0,0]=1 926 B9R0.47 NCCCC[C@H](N)C(=O)O MCULE-7702716758 [0,1,0,0,0,0|0,0,0]=1 927 B9R0.47 NCCCC[C@H]([NH3+])C(=O)O MCULE-1421201563 [0,1,0,0,0,0|0,0,0]=1 928 B9R0.47 NCCOCC(N)C(=O)O MCULE-7224841130 [0,1,0,0,0,0|1,0,0]=2 929 B9R0.47 NCCOCC(N)C(=O)O MCULE-7654083918 [0,1,0,0,0,0|1,0,0]=2 930 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-4415047402 [0,1,0,0,0,0|1,0,0]=2 931 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-4663780920 [0,1,0,0,0,0|1,0,0]=2 932 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-4696145098 [0,1,0,0,0,0|1,0,0]=2 933 B9R0.47 NCCOC[C@H](N)C(=O)O MCULE-9286897415 [0,1,0,0,0,0|1,0,0]=2 934 B9R0.47 NCCSCC(N)C(=O)O MCULE-5256853681 [0,1,0,0,0,0|1,0,0]=2 935 B9R0.47 NCCSCC(N)C(=O)O MCULE-7420723141 [0,1,0,0,0,0|1,0,0]=2 936 B9R0.47 NCCSCC(N)C(=O)O MCULE-9409306380 [0,1,0,0,0,0|1,0,0]=2 937 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-3159724083 [0,1,0,0,0,0|1,0,0]=2 938 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-4836746198 [0,1,0,0,0,0|1,0,0]=2 939 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-6032940560 [0,1,0,0,0,0|1,0,0]=2 940 B9R0.47 NCCSC[C@H](N)C(=O)O MCULE-6994785146 [0,1,0,0,0,0|1,0,0]=2 941 B9R0.47 NCC[Se]C[C@H](N)C(=O)O MCULE-1630938680 [0,1,0,0,0,0|1,0,0]=2 942 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-1855458643 [0,1,0,0,0,0|1,0,0]=2 943 B9R0.47 N[C@@H](CCCCO)C(=O)O MCULE-3280637244 [0,1,0,0,0,0|1,0,0]=2 944 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-2690192301 [0,1,0,0,0,0|2,0,0]=3 945 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-8331389811 [0,1,0,0,0,0|2,0,0]=3 946 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-9071251692 [0,1,0,0,0,0|2,0,0]=3 947 B9R0.47 N[C@@H](CCCNO)C(=O)O MCULE-9613387165 [0,1,0,0,0,0|2,0,0]=3 948 B9R0.47 N[C@@H](CCSN=O)C(=O)O MCULE-6471102114 [0,1,0,0,0,0|3,0,0]=4 949 B9R0.47 N[C@@H](CSCCO)C(=O)O MCULE-4219102659 [0,1,0,0,0,0|2,0,0]=3 950 B9R0.47 N[C@H](CSCCO)C(=O)O MCULE-6379323435 [0,1,0,0,0,0|2,0,0]=3 951 B9R0.47 O=C(O)C(Br)CCCCBr MCULE-9265332965 [0,1,0,0,0,0|1,0,0]=2 952 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-2676284364 [0,1,0,0,0,0|0,0,0]=1 953 B9R0.47 [C@@H](N)(CCCCN)C(=O)O MCULE-3536027321 [0,1,0,0,0,0|0,0,0]=1 954 B9R0.47 [C@H](N)(CCNCC)C(=O)O MCULE-8327043663 [0,1,0,0,0,0|2,0,0]=3 955 B9R0.47 [C@H](N)(CSCC#C)C(=O)O MCULE-3451460749 [0,1,0,0,0,0|2,0,1]=4 956 B9R0.47 [N-]=[N+]=NCC[C@@H](N)C(=O)O MCULE-3468296516 [0,1,0,0,0,0|2,0,1]=4 957 B9R0.47 [N-]=[N+]=NCC[C@@H]([NH3+])C(=O)O MCULE-9960871536 [0,1,0,0,0,0|2,0,1]=4 958 B9R0.47 [N-]=[N+]=NCC[C@H](N)C(=O)O MCULE-3922595405 [0,1,0,0,0,0|2,0,1]=4 959 B9R0.47 [N-]=[N+]=NCC[C@H](N)C(=O)O MCULE-4625957807 [0,1,0,0,0,0|2,0,1]=4 960 B9R0.47 [N-]=[N+]=NCC[C@H](N)C(=O)O MCULE-5294285117 [0,1,0,0,0,0|2,0,1]=4 961 B9R0.47 [N-]=[N+]=NCC[C@H](N)C(=O)O MCULE-6236286481 [0,1,0,0,0,0|2,0,1]=4 962 B9R0.47 [N-]=[N+]=NCC[C@H](O)C(=O)O MCULE-6077907887 [0,1,0,0,0,0|2,0,1]=4 963 B9R0.47 [N-]=[N+]=NCC[C@H]([NH3+])C(=O)O MCULE-9804764124 [0,1,0,0,0,0|2,0,1]=4 964 B9R0.47 [NH3+][C@@H](CSCCO)C(=O)[O-] MCULE-6668183133 [0,1,0,0,0,0|2,0,1]=4 965 B9R0.48 C=C(C)CCC(C)CCC MCULE-7509184096 [0,1,0,0,0,0|3,0,0]=4 966 B9R0.48 CCCC(=O)CCC(=O)C MCULE-2562578971 [0,1,0,0,0,0|2,0,1]=4 967 B9R0.48 CCCC(=O)CCC(=O)O MCULE-4809633073 [0,1,0,0,0,0|1,0,1]=3 968 B9R0.48 CCCC(=O)NCC(=O)O MCULE-1331310812 [0,1,0,0,0,0|2,0,1]=4 969 B9R0.48 CCCC(C)CCC(=O)C MCULE-1446034135 [0,1,0,0,0,0|2,0,0]=3 970 B9R0.48 CCCC(C)CCC(=O)O MCULE-2307170636 [0,1,0,0,0,0|1,0,0]=2 971 B9R0.48 CCCC(C)COC(=O)C MCULE-3322580373 [0,1,0,0,0,0|3,0,0]=4 972 B9R0.48 CCCC(C)COC(=O)Cl MCULE-1504594923 [0,1,0,0,0,0|3,0,0]=4 973 B9R0.48 CCCC(Cl)CCC(=O)Cl MCULE-1887322362 [0,1,0,0,0,0|2,0,0]=3 974 B9R0.48 CCCC(N)CCC(=O)O MCULE-2596842997 [0,1,0,0,0,0|1,0,0]=2 975 B9R0.48 CCCC(N)CCC(=O)O MCULE-4723059719 [0,1,0,0,0,0|1,0,0]=2 976 B9R0.48 CCCN(C)CCC(=O)O MCULE-4436694860 [0,1,0,0,0,0|2,0,0]=3 977 B9R0.48 CCCN(C)CCC(=O)O MCULE-5636730093 [0,1,0,0,0,0|2,0,0]=3 978 B9R0.48 CCNC(=O)CCC(=O)O MCULE-1979773964 [0,1,0,0,0,0|2,0,1]=4 979 B9R0.48 CCOC(=O)CCC(=O)O MCULE-4329005000 [0,1,0,0,0,0|2,0,1]=4 980 B9R0.48 CN(CCO)CCC(=O)O MCULE-1755715725 [0,1,0,0,0,0|2,0,0]=3 981 B9R0.48 COCC(C)NCC(=O)O MCULE-1388451631 [0,1,0,0,0,0|3,0,0]=4 982 B9R0.48 COCC(C)NCC(=O)O MCULE-8506123448 [0,1,0,0,0,0|3,0,0]=4 983 B9R0.48 N#CCC(=O)CCC(=O)O MCULE-9068617053 [0,1,0,0,0,0|0,0,3]=4 984 B9R0.48 NCCC(=O)NCC(=O)O MCULE-4396558835 [0,1,0,0,0,0|1,0,1]=3 985 B9R0.48 NCCC(=O)NCC(=O)O MCULE-9256160395 [0,1,0,0,0,0|1,0,1]=3 986 B9R0.55 C=C(Br)CCCCC(=O)O MCULE-9413125657 [0,1,0,0,0,0|1,0,1]=3 987 B9R0.55 C=C(C)CCCCC(=O)O MCULE-2837812117 [0,1,0,0,0,0|1,0,1]=3 988 B9R0.55 C=C(Cl)CCCCC(=O)O MCULE-6161023222 [0,1,0,0,0,0|1,0,1]=3 989 B9R0.55 CC(=CCCCC(=O)O)C MCULE-3753028092 [0,1,0,0,0,0|1,0,2]=4 990 B9R0.55 CC(=O)CCCCC(=O)C MCULE-9230576763 [0,1,0,0,0,0|2,0,1]=4 991 B9R0.55 CC(=O)CCCCC(=O)O MCULE-6216368990 [0,1,0,0,0,0|1,0,1]=3 992 B9R0.55 CC(=O)CCCCC(C)C MCULE-8847308651 [0,1,0,0,0,0|2,0,0]=3 993 B9R0.55 CC(=O)CCCCN(C)C MCULE-4549437072 [0,1,0,0,0,0|3,0,0]=4 994 B9R0.55 CC(=O)CCOCC(C)C MCULE-8673860656 [0,1,0,0,0,0|3,0,0]=4 995 B9R0.55 CC(=O)NCCCC(=O)O MCULE-3194803041 [0,1,0,0,0,0|2,0,1]=4 996 B9R0.55 CC(=O)OCCCC(=O)O MCULE-3807110432 [0,1,0,0,0,0|2,0,1]=4 997 B9R0.55 CC(=O)SCCCC(=O)O MCULE-2047230148 [0,1,0,0,0,0|2,0,1]=4 998 B9R0.55 CC(C)C=CCCC(=O)O MCULE-4916288990 [0,1,0,0,0,0|1,0,2]=4 999 B9R0.55 CC(C)CCCCC(=O)N MCULE-5796308812 [0,1,0,0,0,0|2,0,0]=3 1000 B9R0.55 CC(C)CCCCC(=O)O MCULE-9552597130 [0,1,0,0,0,0|1,0,0]=2 1001 B9R0.55 CC(C)CCOCC(=O)O MCULE-8263995178 [0,1,0,0,0,0|2,0,0]=3 1002 B9R0.55 CC(C)CCSCC(=O)O MCULE-6718693744 [0,1,0,0,0,0|2,0,0]=3 1003 B9R0.55 CC(C)CNCCC(=O)O MCULE-7021054047 [0,1,0,0,0,0|2,0,0]=3 1004 B9R0.55 CC(C)CNCCC(=O)O MCULE-7640501484 [0,1,0,0,0,0|2,0,0]=3 1005 B9R0.55 CC(C)COCCC(=O)O MCULE-6429199224 [0,1,0,0,0,0|2,0,0]=3 1006 B9R0.55 CC(C)CSCCC(=O)O MCULE-9529480904 [0,1,0,0,0,0|2,0,0]=3 1007 B9R0.55 CC(C)NCCCC(=O)O MCULE-4053268267 [0,1,0,0,0,0|2,0,0]=3 1008 B9R0.55 CC(C)NCCCC(=O)O MCULE-8505810240 [0,1,0,0,0,0|2,0,0]=3 1009 B9R0.55 CC(C)OCCCC(=O)O MCULE-8577811101 [0,1,0,0,0,0|2,0,0]=3 1010 B9R0.55 CC(C)SCCCC(=O)O MCULE-7082519548 [0,1,0,0,0,0|2,0,0]=3 1011 B9R0.55 CC(N)CCCCC(=O)O MCULE-3306602652 [0,1,0,0,0,0|0,0,0]=1 1012 B9R0.55 CC(N)CCCCC(=O)O MCULE-3909320120 [0,1,0,0,0,0|0,0,0]=1 1013 B9R0.55 CC(N)CCCCC(C)N MCULE-6403395102 [0,1,0,0,0,0|2,0,1]=4 1014 B9R0.55 CN(C)CCCCC(=O)O MCULE-9080305665 [0,1,0,0,0,0|2,0,0]=3 1015 B9R0.55 CN(C)CCCCC(=O)O MCULE-9325797900 [0,1,0,0,0,0|2,0,0]=3 1016 B9R0.55 CN(C)CCNCC(=O)O MCULE-6551648059 [0,1,0,0,0,0|3,0,0]=4 1017 B9R0.55 CN(C)CCNCC(=O)O MCULE-7040720736 [0,1,0,0,0,0|3,0,0]=4 1018 B9R0.55 CN(C)CCOCC(=O)O MCULE-6117066964 [0,1,0,0,0,0|3,0,0]=4 1019 B9R0.55 CN(C)CCSCC(=O)O MCULE-5970767298 [0,1,0,0,0,0|3,0,0]=4 1020 B9R0.55 CN(C)CCSCC(=O)O MCULE-6364036095 [0,1,0,0,0,0|3,0,0]=4 1021 B9R0.55 N=C(N)NCCCC(=O)O MCULE-6633038701 [0,1,0,0,0,0|1,0,1]=3 1022 B9R0.55 NC(=O)CCCCC(=O)N MCULE-7701704987 [0,1,0,0,0,0|1,0,1]=3 1023 B9R0.55 NC(=O)CCCCC(=O)O MCULE-6793890356 [0,1,0,0,0,0|0,0,1]=2 1024 B9R0.55 NC(=O)CCCN=C(N)N MCULE-3216497199 [0,1,0,0,0,0|2,0,1]=4 1025 B9R0.55 NC(=O)CCCN=C(N)N MCULE-6570668893 [0,1,0,0,0,0|2,0,1]=4 1026 B9R0.55 NC(=O)CCNCC(=O)N MCULE-5287507547 [0,1,0,0,0,0|2,0,1]=4 1027 B9R0.55 NC(=O)CSCCC(=O)O MCULE-5092203912 [0,1,0,0,0,0|1,0,1]=3 1028 B9R0.55 NC(=O)NCCCC(=O)O MCULE-4986363363 [0,1,0,0,0,0|1,0,1]=3 1029 B9R0.55 O=C(Cl)CCCCC(=O)Cl MCULE-9846069486 [0,1,0,0,0,0|2,0,1]=4 1030 B9R0.55 O=C(O)CCCCC(=O)O MCULE-1336748609 [0,1,0,0,0,0|1,0,1]=3 1031 B9R0.55 O=C(O)CCCCC(=O)O MCULE-3664126855 [0,1,0,0,0,0|1,0,1]=3 1032 B9R0.55 O=C(O)CCCCC(=O)O MCULE-6331125687 [0,1,0,0,0,0|1,0,1]=3 1033 B9R0.55 O=C(O)CCCCC(=O)O MCULE-7006255210 [0,1,0,0,0,0|1,0,1]=3 1034 B9R0.55 O=C(O)CCCCC(=O)O MCULE-7155960751 [0,1,0,0,0,0|1,0,1]=3 1035 B9R0.55 O=C(O)CCCCC(F)F MCULE-4491962830 [0,1,0,0,0,0|1,0,0]=2 1036 B9R0.55 O=C(O)CCOCC(F)F MCULE-5247096062 [0,1,0,0,0,0|2,0,0]=3 1037 B9R0.55 O=C([O-])CCCCC(=O)O MCULE-3513522562 [0,1,0,0,0,0|1,0,1]=3 1038 B9R0.55 O=C([O-])CCCCC(=O)O MCULE-5232497586 [0,1,0,0,0,0|1,0,1]=3 1039 B9R0.55 O=C([O-])CCCCC(=O)O MCULE-9724137457 [0,1,0,0,0,0|1,0,1]=3 1040 B9R0.55 O=C([O-])CCCCC(=O)[O-] MCULE-3830406639 [0,1,0,0,0,0|1,0,2]=4 1041 B9R0.55 O=C([O-])CCCCC(=O)[O-] MCULE-8364635624 [0,1,0,0,0,0|1,0,2]=4 1042 B9R1.2 C#CC1CCCC(=O)C1 MCULE-9347784864 [0,0,0,1,0,0|2,0,1]=4 1043 B9R1.2 C1(CCCN(C1)C)CN MCULE-2271262657 [0,0,0,1,0,0|3,0,0]=4 1044 B9R1.2 C1(CCCN(C1)C)CN MCULE-8286462374 [0,0,0,1,0,0|3,0,0]=4 1045 B9R1.2 C=CC1CCCC(=O)C1 MCULE-4962666890 [0,0,0,1,0,0|2,0,1]=4 1046 B9R1.2 CC1CCCC(C1)CN MCULE-5692325071 [0,0,0,1,0,0|2,0,1]=4 1047 B9R1.2 CC1CCCC(O1)CN MCULE-9065375307 [0,0,0,1,0,0|1,0,1]=3 1048 B9R1.2 CCC1=CC(=O)CCC1 MCULE-3934640256 [0,0,0,1,0,0|2,0,1]=4 1049 B9R1.2 CCC1CC(=O)CCN1 MCULE-1220676585 [0,0,0,1,0,0|3,0,0]=4 1050 B9R1.2 CCC1CC(=O)CCN1 MCULE-3141090997 [0,0,0,1,0,0|3,0,0]=4 1051 B9R1.2 CCC1CC(=O)CCO1 MCULE-5885330152 [0,0,0,1,0,0|3,0,0]=4 1052 B9R1.2 CCC1CCCC(=O)C1 MCULE-2309757845 [0,0,0,1,0,0|2,0,0]=3 1053 B9R1.2 CCC1CCCC(=O)N1 MCULE-7034650517 [0,0,0,1,0,0|2,0,0]=3 1054 B9R1.2 CCC1CCCC(C1)O MCULE-5149394080 [0,0,0,1,0,0|2,0,1]=4 1055 B9R1.2 CCC1CCNC(=O)C1 MCULE-7827721769 [0,0,0,1,0,0|3,0,0]=4 1056 B9R1.2 CCC1CNCC(=O)N1 MCULE-1768212982 [0,0,0,1,0,0|3,0,0]=4 1057 B9R1.2 CCC1COCC(=O)N1 MCULE-1841359305 [0,0,0,1,0,0|3,0,0]=4 1058 B9R1.2 CCN1CCCC(=O)C1 MCULE-1438900169 [0,0,0,1,0,0|3,0,0]=4 1059 B9R1.2 CCN1CCCC(=O)C1 MCULE-2924579479 [0,0,0,1,0,0|3,0,0]=4 1060 B9R1.2 CC[C@@H]1CC(=O)CCN1 MCULE-6816021578 [0,0,0,1,0,0|3,0,0]=4 1061 B9R1.2 CC[C@@H]1CC(=O)CCN1 MCULE-7481609929 [0,0,0,1,0,0|3,0,0]=4 1062 B9R1.2 CC[C@@H]1CCCC(=O)C1 MCULE-3781767777 [0,0,0,1,0,0|2,0,0]=3 1063 B9R1.2 CC[C@@H]1COCC(=O)N1 MCULE-9098123465 [0,0,0,1,0,0|3,0,0]=4 1064 B9R1.2 CC[C@H]1CC(=O)CCN1 MCULE-1797323490 [0,0,0,1,0,0|3,0,0]=4 1065 B9R1.2 CC[C@H]1CC(=O)CCN1 MCULE-7692205564 [0,0,0,1,0,0|3,0,0]=4 1066 B9R1.2 CC[C@H]1CCCC(=O)C1 MCULE-5055612080 [0,0,0,1,0,0|2,0,0]=3 1067 B9R1.2 CC[C@H]1CNCC(=O)N1 MCULE-5604046217 [0,0,0,1,0,0|3,0,0]=4 1068 B9R1.2 CN1CCCC(C1)CN MCULE-2577219370 [0,0,0,1,0,0|3,0,0]=4 1069 B9R1.2 CN1CCCC(C1)CN MCULE-8304464940 [0,0,0,1,0,0|3,0,0]=4 1070 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-1159146844 [0,0,0,1,0,0|3,0,0]=4 1071 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-2312161748 [0,0,0,1,0,0|3,0,0]=4 1072 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-4996339542 [0,0,0,1,0,0|3,0,0]=4 1073 B9R1.2 CN1CCC[C@@H](C1)CN MCULE-9830055203 [0,0,0,1,0,0|3,0,0]=4 1074 B9R1.2 CN1CCC[C@H](C1)CN MCULE-4714048215 [0,0,0,1,0,0|3,0,0]=4 1075 B9R1.2 CN1CCC[C@H](C1)CN MCULE-7433181082 [0,0,0,1,0,0|3,0,0]=4 1076 B9R1.2 CN1CCC[C@H](C1)CN MCULE-7796559163 [0,0,0,1,0,0|3,0,0]=4 1077 B9R1.2 CN1CCC[C@H](C1)CN MCULE-8440296789 [0,0,0,1,0,0|3,0,0]=4 1078 B9R1.2 COC1CCCC(=O)C1 MCULE-4121364026 [0,0,0,1,0,0|3,0,0]=4 1079 B9R1.2 COC1CCCC(=O)N1 MCULE-3771491986 [0,0,0,1,0,0|3,0,0]=4 1080 B9R1.2 CSC1CCCC(=O)C1 MCULE-3076571291 [0,0,0,1,0,0|3,0,0]=4 1081 B9R1.2 N#CC1CCCC(=O)C1 MCULE-7187855455 [0,0,0,1,0,0|1,0,2]=4 1082 B9R1.2 NCC1CCCC(=O)N1 MCULE-2515108436 [0,0,0,1,0,0|1,0,0]=2 1083 B9R1.2 NCC1CCCC(=O)N1 MCULE-2893640240 [0,0,0,1,0,0|1,0,0]=2 1084 B9R1.2 NCC1CCCC(=O)N1 MCULE-4568961930 [0,0,0,1,0,0|1,0,0]=2 1085 B9R1.2 NCC1CCCC(C1)F MCULE-2632687383 [0,0,0,1,0,0|2,0,1]=4 1086 B9R1.2 NCC1CCCC(C1)F MCULE-7609751819 [0,0,0,1,0,0|2,0,1]=4 1087 B9R1.2 NCC1CCCC(C1)N MCULE-9853807311 [0,0,0,1,0,0|2,0,1]=4 1088 B9R1.2 NCC1CCCC(C1)O MCULE-3067555499 [0,0,0,1,0,0|1,0,1]=3 1089 B9R1.2 NCC1CCNC(=O)C1 MCULE-8340928139 [0,0,0,1,0,0|2,0,0]=3 1090 B9R1.2 NCC1CCNC(=O)C1 MCULE-9503049309 [0,0,0,1,0,0|2,0,0]=3 1091 B9R1.2 NCC1CCNC(=O)N1 MCULE-7299072097 [0,0,0,1,0,0|2,0,0]=3 1092 B9R1.2 NCC1CCNC(=O)O1 MCULE-4253031438 [0,0,0,1,0,0|1,0,0]=2 1093 B9R1.2 NC[C@@H]1CCC[C@H](C1)O MCULE-9062593795 [0,0,0,1,0,0|1,0,1]=3 1094 B9R1.2 NC[C@H]1CCNC(=O)C1 MCULE-6439919372 [0,0,0,1,0,0|2,0,0]=3 1095 B9R1.2 NC[C@H]1CCNC(=O)C1 MCULE-8074777058 [0,0,0,1,0,0|2,0,0]=3 1096 B9R1.2 O=C1CC(CCN1)CBr MCULE-5514747029 [0,0,0,1,0,0|3,0,0]=4 1097 B9R1.2 O=C1CC(CCN1)CO MCULE-9526076179 [0,0,0,1,0,0|3,0,0]=4 1098 B9R1.2 O=C1CCCC(C1)CF MCULE-4859859394 [0,0,0,1,0,0|2,0,0]=3 1099 B9R1.2 O=C1CCCC(C1)CO MCULE-5732276352 [0,0,0,1,0,0|2,0,0]=3 1100 B9R1.2 O=C1CCCC(N1)CO MCULE-6546170250 [0,0,0,1,0,0|2,0,0]=3 1101 B9R1.2 O=C1CCC[C@@H](N1)CO MCULE-6845836782 [0,0,0,1,0,0|2,0,0]=3 1102 B9R1.2 O=C1CCC[C@H](C1)CO MCULE-7659844168 [0,0,0,1,0,0|2,0,0]=3 1103 B9R1.2 O=C1CCC[C@H](N1)CO MCULE-2745722091 [0,0,0,1,0,0|2,0,0]=3 1104 B9R1.2 O=C1CCC[C@H](N1)CO MCULE-3358051383 [0,0,0,1,0,0|2,0,0]=3 1105 B9R1.2 O=C1CNC[C@H](N1)CO MCULE-7459264375 [0,0,0,1,0,0|3,0,0]=4 1106 B9R1.2 O=C1COCC(N1)CO MCULE-2108098178 [0,0,0,1,0,0|3,0,0]=4 1107 B9R1.2 O=C1COC[C@@H](N1)CO MCULE-1640734818 [0,0,0,1,0,0|3,0,0]=4 1108 B9R1.2 O=C1COC[C@@H](N1)CO MCULE-6633625871 [0,0,0,1,0,0|3,0,0]=4 1109 B9R1.2 O=C1C[C@H](CCN1)CO MCULE-5682710079 [0,0,0,1,0,0|3,0,0]=4 1110 B9R1.2 O=S1OCCC(O1)CCl MCULE-2917940908 [0,0,0,1,0,0|3,0,0]=4 1111 B9R1.2 OC1CCCC(C1)CCl MCULE-3541903770 [0,0,0,1,0,0|2,0,1]=4 1112 B9R1.6 C1(CC=CCC1)C(=O)O MCULE-7139174666 [0,0,0,1,0,0|1,0,2]=4 1113 B9R1.6 C1(CCCNC1)C(=O)N MCULE-1974021716 [0,0,0,1,0,0|3,0,0]=4 1114 B9R1.6 C1(CCCNC1)C(=O)N MCULE-3484822743 [0,0,0,1,0,0|3,0,0]=4 1115 B9R1.6 C1(CCCNC1)C(=O)O MCULE-5804171064 [0,0,0,1,0,0|2,0,0]=3 1116 B9R1.6 C1(CNCCN1)C(=O)O MCULE-2145678876 [0,0,0,1,0,0|1,0,0]=2 1117 B9R1.6 C1(CNCCN1)C(=O)O MCULE-9477513225 [0,0,0,1,0,0|1,0,0]=2 1118 B9R1.6 C1(COCCN1)C(=O)O MCULE-7653061162 [0,0,0,1,0,0|1,0,0]=2 1119 B9R1.6 C1(COCCN1)C(=O)O MCULE-8375563970 [0,0,0,1,0,0|1,0,0]=2 1120 B9R1.6 C=C(O)C1CNCCN1 MCULE-4032832858 [0,0,0,1,0,0|2,0,0]=3 1121 B9R1.6 C=C(O)C1CNCCN1 MCULE-7014741917 [0,0,0,1,0,0|2,0,0]=3 1122 B9R1.6 CC(=O)C1=CCCCC1 MCULE-9958324589 [0,0,0,1,0,0|2,0,1]=4 1123 B9R1.6 CC(=O)C1=NCCCC1 MCULE-8103583007 [0,0,0,1,0,0|1,0,2]=4 1124 B9R1.6 CC(=O)C1=NCCCC1 MCULE-8275418154 [0,0,0,1,0,0|1,0,2]=4 1125 B9R1.6 CC(=O)C1CCCCC1 MCULE-3582349091 [0,0,0,1,0,0|2,0,0]=3 1126 B9R1.6 CC(=O)C1CCCCN1 MCULE-2854776557 [0,0,0,1,0,0|1,0,0]=2 1127 B9R1.6 CC(=O)C1CCCCN1 MCULE-7483298696 [0,0,0,1,0,0|1,0,0]=2 1128 B9R1.6 CC(=O)C1CCCCO1 MCULE-6292051941 [0,0,0,1,0,0|2,0,0]=3 1129 B9R1.6 CC(=O)C1CCCNC1 MCULE-5048287619 [0,0,0,1,0,0|3,0,0]=4 1130 B9R1.6 CC(=O)C1CCCNC1 MCULE-7308448482 [0,0,0,1,0,0|3,0,0]=4 1131 B9R1.6 CC(=O)C1CCCOC1 MCULE-8355092375 [0,0,0,1,0,0|3,0,0]=4 1132 B9R1.6 CC(=O)C1CCNCC1 MCULE-5629644359 [0,0,0,1,0,0|3,0,0]=4 1133 B9R1.6 CC(=O)C1CCNCC1 MCULE-7994490746 [0,0,0,1,0,0|3,0,0]=4 1134 B9R1.6 CC(=O)C1CCOCC1 MCULE-4829713073 [0,0,0,1,0,0|3,0,0]=4 1135 B9R1.6 CC(=O)C1CCSCC1 MCULE-1825777359 [0,0,0,1,0,0|3,0,0]=4 1136 B9R1.6 CC(=O)C1CNCCO1 MCULE-1332213026 [0,0,0,1,0,0|3,0,0]=4 1137 B9R1.6 CC(=O)C1CNCCO1 MCULE-8599628301 [0,0,0,1,0,0|3,0,0]=4 1138 B9R1.6 CC(=O)C1COCCO1 MCULE-5168266299 [0,0,0,1,0,0|3,0,0]=4 1139 B9R1.6 CC(=O)N1CCCCC1 MCULE-2376049669 [0,0,0,1,0,0|3,0,0]=4 1140 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-6225629414 [0,0,0,1,0,0|1,0,0]=2 1141 B9R1.6 CC(=O)[C@@H]1CCCCN1 MCULE-9308955565 [0,0,0,1,0,0|1,0,0]=2 1142 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6405789728 [0,0,0,1,0,0|1,0,0]=2 1143 B9R1.6 CC(=O)[C@H]1CCCCN1 MCULE-6966774576 [0,0,0,1,0,0|1,0,0]=2 1144 B9R1.6 CC(C)C1CCCCN1 MCULE-3649476695 [0,0,0,1,0,0|2,0,1]=4 1145 B9R1.6 CC(C)C1CCCCN1 MCULE-8304532068 [0,0,0,1,0,0|2,0,1]=4 1146 B9R1.6 CC(N)C1CCCCN1 MCULE-2177574791 [0,0,0,1,0,0|2,0,1]=4 1147 B9R1.6 CC(O)C1CCCCC1 MCULE-5078012753 [0,0,0,1,0,0|2,0,1]=4 1148 B9R1.6 CC(O)C1CCCCN1 MCULE-2559324365 [0,0,0,1,0,0|1,0,1]=3 1149 B9R1.6 CC(O)C1CNCCN1 MCULE-7562437820 [0,0,0,1,0,0|2,0,1]=4 1150 B9R1.6 CS(=O)C1CCCCC1 MCULE-4263908685 [0,0,0,1,0,0|3,0,0]=4 1151 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-4304404236 [0,0,0,1,0,0|2,0,1]=4 1152 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-7854211857 [0,0,0,1,0,0|2,0,1]=4 1153 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 MCULE-2168214783 [0,0,0,1,0,0|2,0,1]=4 1154 B9R1.6 C[C@@H](O)[C@H]1CNCCN1 MCULE-8290718551 [0,0,0,1,0,0|2,0,1]=4 1155 B9R1.6 C[C@H](O)C1CCCCC1 MCULE-9702860419 [0,0,0,1,0,0|2,0,1]=4 1156 B9R1.6 FC(F)C1CCCCN1 MCULE-6330116488 [0,0,0,1,0,0|2,0,1]=4 1157 B9R1.6 FC(F)C1CCCCN1 MCULE-6975833618 [0,0,0,1,0,0|2,0,1]=4 1158 B9R1.6 N=C(N)C1CCCCC1 MCULE-3107787417 [0,0,0,1,0,0|3,0,0]=4 1159 B9R1.6 N=C(N)C1CCCCC1 MCULE-9030561972 [0,0,0,1,0,0|3,0,0]=4 1160 B9R1.6 N=C(N)C1CCCCN1 MCULE-3219883116 [0,0,0,1,0,0|2,0,0]=3 1161 B9R1.6 N=C(N)C1CCCCN1 MCULE-8067475683 [0,0,0,1,0,0|2,0,0]=3 1162 B9R1.6 NC(=O)C1CCCCC1 MCULE-8611311863 [0,0,0,1,0,0|2,0,0]=3 1163 B9R1.6 NC(=O)C1CCCCN1 MCULE-2544126054 [0,0,0,1,0,0|1,0,0]=2 1164 B9R1.6 NC(=O)C1CCCCN1 MCULE-6661716686 [0,0,0,1,0,0|1,0,0]=2 1165 B9R1.6 NC(=O)C1CCCNC1 MCULE-1833696438 [0,0,0,1,0,0|3,0,0]=4 1166 B9R1.6 NC(=O)C1CCCNC1 MCULE-5902080067 [0,0,0,1,0,0|3,0,0]=4 1167 B9R1.6 NC(=O)C1CCCOC1 MCULE-3754898627 [0,0,0,1,0,0|3,0,0]=4 1168 B9R1.6 NC(=O)C1CCNCC1 MCULE-8206211805 [0,0,0,1,0,0|3,0,0]=4 1169 B9R1.6 NC(=O)C1CCNCC1 MCULE-8840746533 [0,0,0,1,0,0|3,0,0]=4 1170 B9R1.6 NC(=O)C1CCOCC1 MCULE-1626473774 [0,0,0,1,0,0|3,0,0]=4 1171 B9R1.6 NC(=O)C1CNCCN1 MCULE-6032361805 [0,0,0,1,0,0|2,0,0]=3 1172 B9R1.6 NC(=O)C1CNCCN1 MCULE-7459621704 [0,0,0,1,0,0|2,0,0]=3 1173 B9R1.6 NC(=O)C1CNCCO1 MCULE-7045289444 [0,0,0,1,0,0|3,0,0]=4 1174 B9R1.6 NC(=O)C1CNCCO1 MCULE-8403360257 [0,0,0,1,0,0|3,0,0]=4 1175 B9R1.6 NC(=O)C1CNCCO1 MCULE-8477654103 [0,0,0,1,0,0|3,0,0]=4 1176 B9R1.6 NC(=O)C1COCCN1 MCULE-3997305592 [0,0,0,1,0,0|2,0,0]=3 1177 B9R1.6 NC(=O)C1COCCN1 MCULE-8679226087 [0,0,0,1,0,0|2,0,0]=3 1178 B9R1.6 NC(=O)C1CSCCN1 MCULE-5519659168 [0,0,0,1,0,0|2,0,0]=3 1179 B9R1.6 NC(=O)N1CCCCC1 MCULE-9935688246 [0,0,0,1,0,0|3,0,0]=4 1180 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-1302948446 [0,0,0,1,0,0|3,0,0]=4 1181 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-3790099707 [0,0,0,1,0,0|3,0,0]=4 1182 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-4105759578 [0,0,0,1,0,0|3,0,0]=4 1183 B9R1.6 NC(=O)[C@@H]1CCCNC1 MCULE-6022899132 [0,0,0,1,0,0|3,0,0]=4 1184 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-3203472135 [0,0,0,1,0,0|2,0,0]=3 1185 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-3866777440 [0,0,0,1,0,0|2,0,0]=3 1186 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-6105431602 [0,0,0,1,0,0|2,0,0]=3 1187 B9R1.6 NC(=O)[C@@H]1CNCCN1 MCULE-7727900968 [0,0,0,1,0,0|2,0,0]=3 1188 B9R1.6 NC(=O)[C@H]1CCCCN1 MCULE-5554529404 [0,0,0,1,0,0|1,0,0]=2 1189 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-3568267883 [0,0,0,1,0,0|3,0,0]=4 1190 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-6403292667 [0,0,0,1,0,0|3,0,0]=4 1191 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-7433087477 [0,0,0,1,0,0|3,0,0]=4 1192 B9R1.6 NC(=O)[C@H]1CCCNC1 MCULE-9069766695 [0,0,0,1,0,0|3,0,0]=4 1193 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-1527418805 [0,0,0,1,0,0|2,0,0]=3 1194 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-6529490056 [0,0,0,1,0,0|2,0,0]=3 1195 B9R1.6 NC(=O)[C@H]1CNCCN1 MCULE-9894216692 [0,0,0,1,0,0|2,0,0]=3 1196 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-1904729907 [0,0,0,1,0,0|2,0,0]=3 1197 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-7069433109 [0,0,0,1,0,0|2,0,0]=3 1198 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-7970834070 [0,0,0,1,0,0|2,0,0]=3 1199 B9R1.6 NC(=O)[C@H]1COCCN1 MCULE-9117686776 [0,0,0,1,0,0|2,0,0]=3 1200 B9R1.6 NC(=S)C1CCCCC1 MCULE-8109334870 [0,0,0,1,0,0|2,1,0]=4 1201 B9R1.6 O=C(Cl)C1=CCCCC1 MCULE-8228686007 [0,0,0,1,0,0|2,0,1]=4 1202 B9R1.6 O=C(Cl)C1CCCCC1 MCULE-5867897390 [0,0,0,1,0,0|2,0,0]=3 1203 B9R1.6 O=C(Cl)C1CCCCO1 MCULE-2871405989 [0,0,0,1,0,0|2,0,0]=3 1204 B9R1.6 O=C(Cl)C1CCNCC1 MCULE-6549888109 [0,0,0,1,0,0|3,0,0]=4 1205 B9R1.6 O=C(Cl)C1CCNCC1 MCULE-7154842850 [0,0,0,1,0,0|3,0,0]=4 1206 B9R1.6 O=C(Cl)C1CCOCC1 MCULE-5435965006 [0,0,0,1,0,0|3,0,0]=4 1207 B9R1.6 O=C(Cl)C1CCSCC1 MCULE-2089111376 [0,0,0,1,0,0|3,0,0]=4 1208 B9R1.6 O=C(Cl)N1CCCCC1 MCULE-8197895576 [0,0,0,1,0,0|3,0,0]=4 1209 B9R1.6 O=C(O)C1=CCCCC1 MCULE-1482472372 [0,0,0,1,0,0|1,0,1]=3 1210 B9R1.6 O=C(O)C1=CCCCO1 MCULE-8158964792 [0,0,0,1,0,0|1,0,2]=4 1211 B9R1.6 O=C(O)C1=CCCNC1 MCULE-7878143035 [0,0,0,1,0,0|2,0,1]=4 1212 B9R1.6 O=C(O)C1=CCCNC1 MCULE-9382105537 [0,0,0,1,0,0|2,0,1]=4 1213 B9R1.6 O=C(O)C1=CCCOC1 MCULE-4597846034 [0,0,0,1,0,0|2,0,1]=4 1214 B9R1.6 O=C(O)C1=CCCSC1 MCULE-6991730217 [0,0,0,1,0,0|2,0,1]=4 1215 B9R1.6 O=C(O)C1=CCNCC1 MCULE-7813592729 [0,0,0,1,0,0|2,0,1]=4 1216 B9R1.6 O=C(O)C1=CCNCC1 MCULE-9446043448 [0,0,0,1,0,0|2,0,1]=4 1217 B9R1.6 O=C(O)C1=CCOCC1 MCULE-8602474600 [0,0,0,1,0,0|2,0,1]=4 1218 B9R1.6 O=C(O)C1=COCCC1 MCULE-4203786677 [0,0,0,1,0,0|2,0,1]=4 1219 B9R1.6 O=C(O)C1=NNCCC1 MCULE-7500831474 [0,0,0,1,0,0|1,0,2]=4 1220 B9R1.6 O=C(O)C1C=CCCC1 MCULE-7827178223 [0,0,0,1,0,0|1,0,1]=3 1221 B9R1.6 O=C(O)C1CC=CCC1 MCULE-6262725586 [0,0,0,1,0,0|1,0,2]=4 1222 B9R1.6 O=C(O)C1CC=CCO1 MCULE-5751437850 [0,0,0,1,0,0|1,0,2]=4 1223 B9R1.6 O=C(O)C1CCC=CO1 MCULE-6447977583 [0,0,0,1,0,0|1,0,2]=4 1224 B9R1.6 O=C(O)C1CCCCC1 MCULE-2193918964 [0,0,0,1,0,0|1,0,0]=2 1225 B9R1.6 O=C(O)C1CCCCN1 MCULE-3485439173 [0,0,0,1,0,0|0,0,0]=1 1226 B9R1.6 O=C(O)C1CCCCN1 MCULE-4576094783 [0,0,0,1,0,0|0,0,0]=1 1227 B9R1.6 O=C(O)C1CCCCN1 MCULE-4851525706 [0,0,0,1,0,0|0,0,0]=1 1228 B9R1.6 O=C(O)C1CCCCN1 MCULE-6801625058 [0,0,0,1,0,0|0,0,0]=1 1229 B9R1.6 O=C(O)C1CCCCO1 MCULE-8947688342 [0,0,0,1,0,0|1,0,0]=2 1230 B9R1.6 O=C(O)C1CCCCS1 MCULE-6466357833 [0,0,0,1,0,0|1,0,0]=2 1231 B9R1.6 O=C(O)C1CCCNC1 MCULE-3189529983 [0,0,0,1,0,0|2,0,0]=3 1232 B9R1.6 O=C(O)C1CCCNC1 MCULE-5698100100 [0,0,0,1,0,0|2,0,0]=3 1233 B9R1.6 O=C(O)C1CCCNC1 MCULE-9486003126 [0,0,0,1,0,0|2,0,0]=3 1234 B9R1.6 O=C(O)C1CCCNN1 MCULE-1480488255 [0,0,0,1,0,0|1,0,0]=2 1235 B9R1.6 O=C(O)C1CCCNN1 MCULE-3054116225 [0,0,0,1,0,0|1,0,0]=2 1236 B9R1.6 O=C(O)C1CCCOC1 MCULE-3431951803 [0,0,0,1,0,0|2,0,0]=3 1237 B9R1.6 O=C(O)C1CCCSC1 MCULE-1777528306 [0,0,0,1,0,0|2,0,0]=3 1238 B9R1.6 O=C(O)C1CCNCC1 MCULE-5699874022 [0,0,0,1,0,0|2,0,0]=3 1239 B9R1.6 O=C(O)C1CCNCC1 MCULE-7477545245 [0,0,0,1,0,0|2,0,0]=3 1240 B9R1.6 O=C(O)C1CCOCC1 MCULE-4725122837 [0,0,0,1,0,0|2,0,0]=3 1241 B9R1.6 O=C(O)C1CCOCN1 MCULE-2724570105 [0,0,0,1,0,0|1,0,0]=2 1242 B9R1.6 O=C(O)C1CCOCN1 MCULE-7891527992 [0,0,0,1,0,0|1,0,0]=2 1243 B9R1.6 O=C(O)C1CCSCC1 MCULE-5031108601 [0,0,0,1,0,0|2,0,0]=3 1244 B9R1.6 O=C(O)C1CCSCN1 MCULE-7351632016 [0,0,0,1,0,0|1,0,0]=2 1245 B9R1.6 O=C(O)C1CCSCN1 MCULE-7786919982 [0,0,0,1,0,0|1,0,0]=2 1246 B9R1.6 O=C(O)C1CNCCN1 MCULE-2689074129 [0,0,0,1,0,0|1,0,0]=2 1247 B9R1.6 O=C(O)C1CNCCN1 MCULE-4697614875 [0,0,0,1,0,0|1,0,0]=2 1248 B9R1.6 O=C(O)C1CNCCN1 MCULE-7015381558 [0,0,0,1,0,0|1,0,0]=2 1249 B9R1.6 O=C(O)C1CNCCO1 MCULE-1106448255 [0,0,0,1,0,0|2,0,0]=3 1250 B9R1.6 O=C(O)C1CNCCO1 MCULE-5402647836 [0,0,0,1,0,0|2,0,0]=3 1251 B9R1.6 O=C(O)C1CNCCO1 MCULE-5647993069 [0,0,0,1,0,0|2,0,0]=3 1252 B9R1.6 O=C(O)C1CNCCO1 MCULE-6949638629 [0,0,0,1,0,0|2,0,0]=3 1253 B9R1.6 O=C(O)C1CNCCS1 MCULE-3981762124 [0,0,0,1,0,0|2,0,0]=3 1254 B9R1.6 O=C(O)C1CNCCS1 MCULE-4631923202 [0,0,0,1,0,0|2,0,0]=3 1255 B9R1.6 O=C(O)C1COCCN1 MCULE-2235592409 [0,0,0,1,0,0|1,0,0]=2 1256 B9R1.6 O=C(O)C1COCCN1 MCULE-6865044459 [0,0,0,1,0,0|1,0,0]=2 1257 B9R1.6 O=C(O)C1COCCO1 MCULE-3887767361 [0,0,0,1,0,0|2,0,0]=3 1258 B9R1.6 O=C(O)C1COCCO1 MCULE-6027603960 [0,0,0,1,0,0|2,0,0]=3 1259 B9R1.6 O=C(O)C1COCOC1 MCULE-4867087023 [0,0,0,1,0,0|3,0,0]=4 1260 B9R1.6 O=C(O)C1CSCCN1 MCULE-4003309722 [0,0,0,1,0,0|1,0,0]=2 1261 B9R1.6 O=C(O)C1CSCCN1 MCULE-5519716572 [0,0,0,1,0,0|1,0,0]=2 1262 B9R1.6 O=C(O)C1CSCCS1 MCULE-6267524662 [0,0,0,1,0,0|2,0,0]=3 1263 B9R1.6 O=C(O)C1NCCCS1 MCULE-7316372918 [0,0,0,1,0,0|1,0,0]=2 1264 B9R1.6 O=C(O)C1OCCCO1 MCULE-6505925267 [0,0,0,1,0,0|2,0,0]=3 1265 B9R1.6 O=C(O)C1SCCCS1 MCULE-6447130734 [0,0,0,1,0,0|2,0,0]=3 1266 B9R1.6 O=C(O)C1SCSCS1 MCULE-6847986458 [0,0,0,1,0,0|3,0,0]=4 1267 B9R1.6 O=C(O)N1CCCCC1 MCULE-2727154893 [0,0,0,1,0,0|2,0,0]=3 1268 B9R1.6 O=C(O)N1CCCCC1 MCULE-4559010344 [0,0,0,1,0,0|2,0,0]=3 1269 B9R1.6 O=C(O)N1CCNCC1 MCULE-3508385346 [0,0,0,1,0,0|3,0,0]=4 1270 B9R1.6 O=C(O)N1CCOCC1 MCULE-7938310937 [0,0,0,1,0,0|3,0,0]=4 1271 B9R1.6 O=C(O)N1CCSCC1 MCULE-4867596495 [0,0,0,1,0,0|3,0,0]=4 1272 B9R1.6 O=C(O)[C@@H]1CC=CCC1 MCULE-1597942572 [0,0,0,1,0,0|1,0,2]=4 1273 B9R1.6 O=C(O)[C@@H]1CC=CCC1 MCULE-6215840629 [0,0,0,1,0,0|1,0,2]=4 1274 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-3257537289 [0,0,0,1,0,0|0,0,0]=1 1275 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-7236775885 [0,0,0,1,0,0|0,0,0]=1 1276 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-8859089797 [0,0,0,1,0,0|0,0,0]=1 1277 B9R1.6 O=C(O)[C@@H]1CCCCN1 MCULE-9674307172 [0,0,0,1,0,0|0,0,0]=1 1278 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-4995364653 [0,0,0,1,0,0|1,0,0]=2 1279 B9R1.6 O=C(O)[C@@H]1CCCCO1 MCULE-8767901302 [0,0,0,1,0,0|1,0,0]=2 1280 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-3206278693 [0,0,0,1,0,0|2,0,0]=3 1281 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-5509362549 [0,0,0,1,0,0|2,0,0]=3 1282 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-8357747886 [0,0,0,1,0,0|2,0,0]=3 1283 B9R1.6 O=C(O)[C@@H]1CCCNC1 MCULE-9156802088 [0,0,0,1,0,0|2,0,0]=3 1284 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-1404699605 [0,0,0,1,0,0|1,0,0]=2 1285 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-4463982289 [0,0,0,1,0,0|1,0,0]=2 1286 B9R1.6 O=C(O)[C@@H]1CCCNN1 MCULE-6113826647 [0,0,0,1,0,0|1,0,0]=2 1287 B9R1.6 O=C(O)[C@@H]1CCCOC1 MCULE-8270310960 [0,0,0,1,0,0|2,0,0]=3 1288 B9R1.6 O=C(O)[C@@H]1CCCOC1 MCULE-9211958407 [0,0,0,1,0,0|2,0,0]=3 1289 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-2545046706 [0,0,0,1,0,0|1,0,0]=2 1290 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-5694807182 [0,0,0,1,0,0|1,0,0]=2 1291 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-7177432982 [0,0,0,1,0,0|1,0,0]=2 1292 B9R1.6 O=C(O)[C@@H]1CNCCN1 MCULE-7413709257 [0,0,0,1,0,0|1,0,0]=2 1293 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-3078161658 [0,0,0,1,0,0|2,0,0]=3 1294 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-4550123668 [0,0,0,1,0,0|2,0,0]=3 1295 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7218215777 [0,0,0,1,0,0|2,0,0]=3 1296 B9R1.6 O=C(O)[C@@H]1CNCCO1 MCULE-7983160968 [0,0,0,1,0,0|2,0,0]=3 1297 B9R1.6 O=C(O)[C@@H]1CNCCS1 MCULE-6650545170 [0,0,0,1,0,0|2,0,0]=3 1298 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-1789021231 [0,0,0,1,0,0|1,0,0]=2 1299 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-4026574279 [0,0,0,1,0,0|1,0,0]=2 1300 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-7736477261 [0,0,0,1,0,0|1,0,0]=2 1301 B9R1.6 O=C(O)[C@@H]1COCCN1 MCULE-8166049277 [0,0,0,1,0,0|1,0,0]=2 1302 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-3560012987 [0,0,0,1,0,0|2,0,0]=3 1303 B9R1.6 O=C(O)[C@@H]1COCCO1 MCULE-8883141087 [0,0,0,1,0,0|2,0,0]=3 1304 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-3905601111 [0,0,0,1,0,0|1,0,0]=2 1305 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-9668825603 [0,0,0,1,0,0|1,0,0]=2 1306 B9R1.6 O=C(O)[C@@H]1CSCCN1 MCULE-9675980130 [0,0,0,1,0,0|1,0,0]=2 1307 B9R1.6 O=C(O)[C@H]1CC=CCC1 MCULE-5009469360 [0,0,0,1,0,0|1,0,2]=4 1308 B9R1.6 O=C(O)[C@H]1CC=CCC1 MCULE-9797420475 [0,0,0,1,0,0|1,0,2]=4 1309 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8281618311 [0,0,0,1,0,0|0,0,0]=1 1310 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-8486513131 [0,0,0,1,0,0|0,0,0]=1 1311 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9333123477 [0,0,0,1,0,0|0,0,0]=1 1312 B9R1.6 O=C(O)[C@H]1CCCCN1 MCULE-9786740249 [0,0,0,1,0,0|0,0,0]=1 1313 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-2856988466 [0,0,0,1,0,0|1,0,0]=2 1314 B9R1.6 O=C(O)[C@H]1CCCCO1 MCULE-8960602925 [0,0,0,1,0,0|1,0,0]=2 1315 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-5644771403 [0,0,0,1,0,0|2,0,0]=3 1316 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-6473613352 [0,0,0,1,0,0|2,0,0]=3 1317 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-7395918259 [0,0,0,1,0,0|2,0,0]=3 1318 B9R1.6 O=C(O)[C@H]1CCCNC1 MCULE-8202628107 [0,0,0,1,0,0|2,0,0]=3 1319 B9R1.6 O=C(O)[C@H]1CCCNN1 MCULE-5460978548 [0,0,0,1,0,0|1,0,0]=2 1320 B9R1.6 O=C(O)[C@H]1CCCNN1 MCULE-6296084302 [0,0,0,1,0,0|1,0,0]=2 1321 B9R1.6 O=C(O)[C@H]1CCCOC1 MCULE-3913162278 [0,0,0,1,0,0|2,0,0]=3 1322 B9R1.6 O=C(O)[C@H]1CCCOC1 MCULE-4021468329 [0,0,0,1,0,0|2,0,0]=3 1323 B9R1.6 O=C(O)[C@H]1CCCSC1 MCULE-1373166628 [0,0,0,1,0,0|2,0,0]=3 1324 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-2073761586 [0,0,0,1,0,0|1,0,0]=2 1325 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-3099021896 [0,0,0,1,0,0|1,0,0]=2 1326 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-5862899979 [0,0,0,1,0,0|1,0,0]=2 1327 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-8591926633 [0,0,0,1,0,0|1,0,0]=2 1328 B9R1.6 O=C(O)[C@H]1CNCCN1 MCULE-9781518658 [0,0,0,1,0,0|1,0,0]=2 1329 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-1051281674 [0,0,0,1,0,0|2,0,0]=3 1330 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-2477891803 [0,0,0,1,0,0|2,0,0]=3 1331 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-5182952887 [0,0,0,1,0,0|2,0,0]=3 1332 B9R1.6 O=C(O)[C@H]1CNCCO1 MCULE-6051376580 [0,0,0,1,0,0|2,0,0]=3 1333 B9R1.6 O=C(O)[C@H]1CNCCS1 MCULE-7818958113 [0,0,0,1,0,0|2,0,0]=3 1334 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-2388461804 [0,0,0,1,0,0|1,0,0]=2 1335 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-3810653827 [0,0,0,1,0,0|1,0,0]=2 1336 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-6589310258 [0,0,0,1,0,0|1,0,0]=2 1337 B9R1.6 O=C(O)[C@H]1COCCN1 MCULE-9158991594 [0,0,0,1,0,0|1,0,0]=2 1338 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-6591475838 [0,0,0,1,0,0|2,0,0]=3 1339 B9R1.6 O=C(O)[C@H]1COCCO1 MCULE-9849453248 [0,0,0,1,0,0|2,0,0]=3 1340 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-2174373928 [0,0,0,1,0,0|1,0,0]=2 1341 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-5936347595 [0,0,0,1,0,0|1,0,0]=2 1342 B9R1.6 O=C(O)[C@H]1CSCCN1 MCULE-8464504119 [0,0,0,1,0,0|1,0,0]=2 1343 B9R1.6 O=C([O-])C1CCCCC1 MCULE-2430887278 [0,0,0,1,0,0|1,0,1]=3 1344 B9R1.6 O=C([O-])C1CCCCN1 MCULE-2358540296 [0,0,0,1,0,0|0,0,1]=2 1345 B9R1.6 O=N(=O)C1CCCCC1 MCULE-6198799449 [0,0,0,1,0,0|2,0,1]=4 1346 B9R1.6 O=S(O)C1CCCCC1 MCULE-2447383910 [0,0,0,1,0,0|2,0,0]=3 1347 B9R1.6 O=S([O-])C1CCCCC1 MCULE-4340070525 [0,0,0,1,0,0|2,0,1]=4 1348 B9R1.6 OB(O)C1CCCCC1 MCULE-7463281328 [0,0,0,1,0,0|2,0,1]=4 1349 B9R1.6 [C@H]1(CSCCN1)C(=O)O MCULE-2592294388 [0,0,0,1,0,0|1,0,0]=2 1350 B9R1.7 C=CCC1CCC(=O)C1 MCULE-2799866455 [0,0,0,1,0,0|2,0,1]=4 1351 B9R1.7 CC1CCC(O1)CCN MCULE-6897276194 [0,0,0,1,0,0|1,0,1]=3 1352 B9R1.7 CC1CCC(O1)CCO MCULE-3947673644 [0,0,0,1,0,0|2,0,1]=4 1353 B9R1.7 CCCC1CCC(=O)C1 MCULE-9793680877 [0,0,0,1,0,0|2,0,0]=3 1354 B9R1.7 CCCC1CCC(=O)O1 MCULE-7682573247 [0,0,0,1,0,0|1,0,0]=2 1355 B9R1.7 CCCC1CNC(=O)C1 MCULE-4931707298 [0,0,0,1,0,0|3,0,0]=4 1356 B9R1.7 CCCC1COC(=O)C1 MCULE-1327483782 [0,0,0,1,0,0|3,0,0]=4 1357 B9R1.7 CCCC1COC(=O)C1 MCULE-2912518782 [0,0,0,1,0,0|3,0,0]=4 1358 B9R1.7 CCCC1COC(=O)O1 MCULE-7663556618 [0,0,0,1,0,0|2,0,0]=3 1359 B9R1.7 CCC[C@@H]1COC(=O)C1 MCULE-3295643630 [0,0,0,1,0,0|3,0,0]=4 1360 B9R1.7 CCC[C@H]1COC(=O)C1 MCULE-4217358413 [0,0,0,1,0,0|3,0,0]=4 1361 B9R1.7 CCC[C@H]1COC(=O)C1 MCULE-4815713221 [0,0,0,1,0,0|3,0,0]=4 1362 B9R1.7 CCOC1CCC(=O)N1 MCULE-6221129998 [0,0,0,1,0,0|3,0,0]=4 1363 B9R1.7 CN1CCC(C1)CCN MCULE-2748206554 [0,0,0,1,0,0|3,0,0]=4 1364 B9R1.7 CN1CCC(C1)CCN MCULE-3390878789 [0,0,0,1,0,0|3,0,0]=4 1365 B9R1.7 CN1CC[C@@H](C1)CCN MCULE-2979045155 [0,0,0,1,0,0|3,0,0]=4 1366 B9R1.7 CNCC1CCC(=O)N1 MCULE-3081580104 [0,0,0,1,0,0|3,0,0]=4 1367 B9R1.7 CNC[C@@H]1CCC(=O)N1 MCULE-2568268658 [0,0,0,1,0,0|3,0,0]=4 1368 B9R1.7 CNC[C@@H]1CCC(=O)N1 MCULE-3483815914 [0,0,0,1,0,0|3,0,0]=4 1369 B9R1.7 COCC1CCC(=O)C1 MCULE-5327398944 [0,0,0,1,0,0|3,0,0]=4 1370 B9R1.7 COCC1COC(=O)O1 MCULE-4488263909 [0,0,0,1,0,0|3,0,0]=4 1371 B9R1.7 COC[C@@H]1COC(=O)O1 MCULE-4803003402 [0,0,0,1,0,0|3,0,0]=4 1372 B9R1.7 COC[C@@H]1COC(=O)O1 MCULE-7896550849 [0,0,0,1,0,0|3,0,0]=4 1373 B9R1.7 COC[C@H]1CNC(=O)O1 MCULE-1001119582 [0,0,0,1,0,0|3,0,0]=4 1374 B9R1.7 COC[C@H]1COC(=O)O1 MCULE-4532523996 [0,0,0,1,0,0|3,0,0]=4 1375 B9R1.7 COC[C@H]1COC(=O)O1 MCULE-4644835151 [0,0,0,1,0,0|3,0,0]=4 1376 B9R1.7 N#CCC1CCC(=O)N1 MCULE-1936081162 [0,0,0,1,0,0|1,0,2]=4 1377 B9R1.7 N#CC[C@@H]1CCC(=O)N1 MCULE-6728125451 [0,0,0,1,0,0|1,0,2]=4 1378 B9R1.7 N#CC[C@H]1CCC(=O)N1 MCULE-1463443311 [0,0,0,1,0,0|1,0,2]=4 1379 B9R1.7 N#CC[C@H]1CCC(=O)N1 MCULE-3830054780 [0,0,0,1,0,0|1,0,2]=4 1380 B9R1.7 NCCC1CCC(=O)N1 MCULE-5980289637 [0,0,0,1,0,0|1,0,0]=2 1381 B9R1.7 NCCC1CCC(C1)F MCULE-5549912018 [0,0,0,1,0,0|2,0,1]=4 1382 B9R1.7 NCCC1CCC(C1)F MCULE-5938015417 [0,0,0,1,0,0|2,0,1]=4 1383 B9R1.7 NCCC1CC[C@H](C1)O MCULE-3758609813 [0,0,0,1,0,0|1,0,1]=3 1384 B9R1.7 NCCC1CNC(=O)C1 MCULE-8054842830 [0,0,0,1,0,0|2,0,0]=3 1385 B9R1.7 NCCC1CNC(=O)C1 MCULE-8879419553 [0,0,0,1,0,0|2,0,0]=3 1386 B9R1.7 NCCN1CCC(C1)O MCULE-6486204934 [0,0,0,1,0,0|2,0,1]=4 1387 B9R1.7 NCCN1CC[C@@H](C1)O MCULE-5099361761 [0,0,0,1,0,0|2,0,1]=4 1388 B9R1.7 NCCN1CC[C@@H](C1)O MCULE-6257789938 [0,0,0,1,0,0|2,0,1]=4 1389 B9R1.7 NCCN1CC[C@@H](C1)O MCULE-6897946390 [0,0,0,1,0,0|2,0,1]=4 1390 B9R1.7 NCCN1CC[C@H](C1)O MCULE-6447258046 [0,0,0,1,0,0|2,0,1]=4 1391 B9R1.7 NCCN1CC[C@H](C1)O MCULE-9790959431 [0,0,0,1,0,0|2,0,1]=4 1392 B9R1.7 NCC[C@@H]1CCC(=O)N1 MCULE-8053535061 [0,0,0,1,0,0|1,0,0]=2 1393 B9R1.7 NCC[C@H]1CC[C@H](C1)O MCULE-7245034683 [0,0,0,1,0,0|1,0,1]=3 1394 B9R1.7 O=C1CC(CN1)CCO MCULE-6468116083 [0,0,0,1,0,0|3,0,0]=4 1395 B9R1.7 O=C1CC=C(O1)CCO MCULE-5445350928 [0,0,0,1,0,0|1,0,2]=4 1396 B9R1.7 O=C1CCC(N1)CCO MCULE-8691061986 [0,0,0,1,0,0|2,0,0]=3 1397 B9R1.7 O=C1CC[C@H](N1)CCO MCULE-7396523836 [0,0,0,1,0,0|2,0,0]=3 1398 B9R1.7 O=C1CC[C@H](N1)CCO MCULE-8307506069 [0,0,0,1,0,0|2,0,0]=3 1399 B9R1.7 O=S1OCC(O1)CCCl MCULE-1770094886 [0,0,0,1,0,0|3,0,0]=4 1400 B9R1.9 C=CCCC1CC(=O)N1 MCULE-8287193989 [0,0,0,1,0,0|2,0,1]=4 1401 B9R1.9 NCCCN1CC(C1)O MCULE-8415029828 [0,0,0,1,0,0|2,0,1]=4 1402 B9R1.13 C1(CCCN1)CC(=O)O MCULE-3743402418 [0,0,0,1,0,0|0,0,0]=1 1403 B9R1.13 C1(CCCN1)CC(=O)O MCULE-9966702869 [0,0,0,1,0,0|0,0,0]=1 1404 B9R1.13 C1(CCCN1)CN(C)C MCULE-4284415560 [0,0,0,1,0,0|3,0,0]=4 1405 B9R1.13 C1(CCNC1)CC(=O)O MCULE-7279534621 [0,0,0,1,0,0|2,0,0]=3 1406 B9R1.13 CC(=O)CC1C=CCC1 MCULE-6918580278 [0,0,0,1,0,0|2,0,1]=4 1407 B9R1.13 CC(=O)CC1CCCC1 MCULE-5830536761 [0,0,0,1,0,0|2,0,0]=3 1408 B9R1.13 CC(=O)CC1CCCO1 MCULE-7012539509 [0,0,0,1,0,0|2,0,0]=3 1409 B9R1.13 CC(=O)CC1CCOC1 MCULE-2391008206 [0,0,0,1,0,0|3,0,0]=4 1410 B9R1.13 CC(=O)CC1OCCO1 MCULE-2632722648 [0,0,0,1,0,0|3,0,0]=4 1411 B9R1.13 CC(=O)CN1CCCC1 MCULE-7257105125 [0,0,0,1,0,0|3,0,0]=4 1412 B9R1.13 CC(=O)NC1CCCC1 MCULE-5984597819 [0,0,0,1,0,0|3,0,0]=4 1413 B9R1.13 CC(=O)OC1CCCC1 MCULE-7737656947 [0,0,0,1,0,0|3,0,0]=4 1414 B9R1.13 CC(=O)OC1CCCO1 MCULE-9160883410 [0,0,0,1,0,0|3,0,0]=4 1415 B9R1.13 CC(C)CC1CCCN1 MCULE-1997095742 [0,0,0,1,0,0|2,0,1]=4 1416 B9R1.13 CC(C)CC1CCCN1 MCULE-6128010231 [0,0,0,1,0,0|2,0,1]=4 1417 B9R1.13 CC(O)CC1CCCN1 MCULE-7800705257 [0,0,0,1,0,0|1,0,1]=3 1418 B9R1.13 CN(C)CC1CCCN1 MCULE-1975946239 [0,0,0,1,0,0|3,0,0]=4 1419 B9R1.13 CN(C)CC1CCCN1 MCULE-2519779706 [0,0,0,1,0,0|3,0,0]=4 1420 B9R1.13 CN(C)CC1CCCN1 MCULE-5155079502 [0,0,0,1,0,0|3,0,0]=4 1421 B9R1.13 CN(C)CC1CCCN1 MCULE-6089779457 [0,0,0,1,0,0|3,0,0]=4 1422 B9R1.13 CN(C)CC1CCCN1 MCULE-9026626888 [0,0,0,1,0,0|3,0,0]=4 1423 B9R1.13 CN(C)C[C@@H]1CCCN1 MCULE-1696350889 [0,0,0,1,0,0|3,0,0]=4 1424 B9R1.13 CN(C)C[C@@H]1CCCN1 MCULE-2874838081 [0,0,0,1,0,0|3,0,0]=4 1425 B9R1.13 CN(C)C[C@@H]1CCCN1 MCULE-5227126984 [0,0,0,1,0,0|3,0,0]=4 1426 B9R1.13 CN(C)C[C@@H]1CCCN1 MCULE-7816053120 [0,0,0,1,0,0|3,0,0]=4 1427 B9R1.13 CN(C)C[C@@H]1CCCN1 MCULE-8673045914 [0,0,0,1,0,0|3,0,0]=4 1428 B9R1.13 CN(C)C[C@@H]1CCCN1 MCULE-9551683468 [0,0,0,1,0,0|3,0,0]=4 1429 B9R1.13 CN(C)C[C@H]1CCCN1 MCULE-2122309992 [0,0,0,1,0,0|3,0,0]=4 1430 B9R1.13 CN(C)C[C@H]1CCCN1 MCULE-3137819579 [0,0,0,1,0,0|3,0,0]=4 1431 B9R1.13 CN(C)C[C@H]1CCCN1 MCULE-3880126372 [0,0,0,1,0,0|3,0,0]=4 1432 B9R1.13 CN(C)C[C@H]1CCCN1 MCULE-6996711489 [0,0,0,1,0,0|3,0,0]=4 1433 B9R1.13 NC(=O)/N=C\1/CCCN1 MCULE-4992899283 [0,0,0,1,0,0|2,0,1]=4 1434 B9R1.13 NC(=O)CC1CCCC1 MCULE-2082339108 [0,0,0,1,0,0|2,0,0]=3 1435 B9R1.13 NC(=O)CC1CCCN1 MCULE-2142594957 [0,0,0,1,0,0|1,0,0]=2 1436 B9R1.13 NC(=O)CC1CCCN1 MCULE-8011902334 [0,0,0,1,0,0|1,0,0]=2 1437 B9R1.13 NC(=O)CC1CCNC1 MCULE-7856346382 [0,0,0,1,0,0|3,0,0]=4 1438 B9R1.13 NC(=O)CC1CCNC1 MCULE-9708437402 [0,0,0,1,0,0|3,0,0]=4 1439 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-2790931086 [0,0,0,1,0,0|1,0,0]=2 1440 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3723741843 [0,0,0,1,0,0|1,0,0]=2 1441 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-3877903747 [0,0,0,1,0,0|1,0,0]=2 1442 B9R1.13 NC(=O)C[C@H]1CCCN1 MCULE-5587287647 [0,0,0,1,0,0|1,0,0]=2 1443 B9R1.13 NC(=O)NC1CCCC1 MCULE-9715014489 [0,0,0,1,0,0|3,0,0]=4 1444 B9R1.13 NC(=O)NC1NCCN1 MCULE-5746168335 [0,0,0,1,0,0|3,0,0]=4 1445 B9R1.13 NC(=O)OC1CCCC1 MCULE-7706681395 [0,0,0,1,0,0|3,0,0]=4 1446 B9R1.13 NC(=S)CC1CCCC1 MCULE-6979331241 [0,0,0,1,0,0|2,1,0]=4 1447 B9R1.13 NC(=S)CC1CCCO1 MCULE-7256451681 [0,0,0,1,0,0|2,1,0]=4 1448 B9R1.13 O=C(Cl)CC1CCCC1 MCULE-1532102571 [0,0,0,1,0,0|2,0,0]=3 1449 B9R1.13 O=C(Cl)CC1CCCO1 MCULE-6649417514 [0,0,0,1,0,0|2,0,0]=3 1450 B9R1.13 O=C(Cl)CN1CCCC1 MCULE-5855966340 [0,0,0,1,0,0|3,0,0]=4 1451 B9R1.13 O=C(Cl)CN1CCCC1 MCULE-7423158222 [0,0,0,1,0,0|3,0,0]=4 1452 B9R1.13 O=C(Cl)OC1CCCC1 MCULE-2692212922 [0,0,0,1,0,0|3,0,0]=4 1453 B9R1.13 O=C(O)C=C1CCCC1 MCULE-1637420148 [0,0,0,1,0,0|1,0,2]=4 1454 B9R1.13 O=C(O)CC1=CCCC1 MCULE-5115478269 [0,0,0,1,0,0|1,0,1]=3 1455 B9R1.13 O=C(O)CC1C=CCC1 MCULE-6825390000 [0,0,0,1,0,0|1,0,1]=3 1456 B9R1.13 O=C(O)CC1CC=CC1 MCULE-8417475923 [0,0,0,1,0,0|1,0,2]=4 1457 B9R1.13 O=C(O)CC1CCCC1 MCULE-1115751804 [0,0,0,1,0,0|1,0,0]=2 1458 B9R1.13 O=C(O)CC1CCCN1 MCULE-6784535537 [0,0,0,1,0,0|0,0,0]=1 1459 B9R1.13 O=C(O)CC1CCCN1 MCULE-8302150253 [0,0,0,1,0,0|0,0,0]=1 1460 B9R1.13 O=C(O)CC1CCCO1 MCULE-8027346350 [0,0,0,1,0,0|1,0,0]=2 1461 B9R1.13 O=C(O)CC1CCNC1 MCULE-3199492917 [0,0,0,1,0,0|2,0,0]=3 1462 B9R1.13 O=C(O)CC1CCNC1 MCULE-3887627276 [0,0,0,1,0,0|2,0,0]=3 1463 B9R1.13 O=C(O)CC1CCOC1 MCULE-5167901709 [0,0,0,1,0,0|2,0,0]=3 1464 B9R1.13 O=C(O)CC1CCOC1 MCULE-9171332464 [0,0,0,1,0,0|2,0,0]=3 1465 B9R1.13 O=C(O)CC1CCSS1 MCULE-4893716992 [0,0,0,1,0,0|2,0,0]=3 1466 B9R1.13 O=C(O)CC1OCCO1 MCULE-2253063465 [0,0,0,1,0,0|2,0,0]=3 1467 B9R1.13 O=C(O)CN1CCCC1 MCULE-3979513963 [0,0,0,1,0,0|2,0,0]=3 1468 B9R1.13 O=C(O)CN1CCCC1 MCULE-4046939568 [0,0,0,1,0,0|2,0,0]=3 1469 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-3034711788 [0,0,0,1,0,0|0,0,0]=1 1470 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-8632270998 [0,0,0,1,0,0|0,0,0]=1 1471 B9R1.13 O=C(O)C[C@@H]1CCCN1 MCULE-9053746158 [0,0,0,1,0,0|0,0,0]=1 1472 B9R1.13 O=C(O)C[C@@H]1CCCO1 MCULE-6652130024 [0,0,0,1,0,0|1,0,0]=2 1473 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-1313399028 [0,0,0,1,0,0|2,0,0]=3 1474 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-3013411353 [0,0,0,1,0,0|2,0,0]=3 1475 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-4082052328 [0,0,0,1,0,0|2,0,0]=3 1476 B9R1.13 O=C(O)C[C@@H]1CCNC1 MCULE-4709831049 [0,0,0,1,0,0|2,0,0]=3 1477 B9R1.13 O=C(O)C[C@@H]1CCOC1 MCULE-2630690308 [0,0,0,1,0,0|2,0,0]=3 1478 B9R1.13 O=C(O)C[C@@H]1CCOC1 MCULE-6148582776 [0,0,0,1,0,0|2,0,0]=3 1479 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-1934097379 [0,0,0,1,0,0|0,0,0]=1 1480 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-3129569449 [0,0,0,1,0,0|0,0,0]=1 1481 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-8499782890 [0,0,0,1,0,0|0,0,0]=1 1482 B9R1.13 O=C(O)C[C@H]1CCCN1 MCULE-9712071738 [0,0,0,1,0,0|0,0,0]=1 1483 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-3712345326 [0,0,0,1,0,0|2,0,0]=3 1484 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-4882389427 [0,0,0,1,0,0|2,0,0]=3 1485 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-5390328422 [0,0,0,1,0,0|2,0,0]=3 1486 B9R1.13 O=C(O)C[C@H]1CCNC1 MCULE-8402835022 [0,0,0,1,0,0|2,0,0]=3 1487 B9R1.13 O=C(O)C[C@H]1CCOC1 MCULE-3521696581 [0,0,0,1,0,0|2,0,0]=3 1488 B9R1.13 O=C(O)C[C@H]1CCOC1 MCULE-6096956796 [0,0,0,1,0,0|2,0,0]=3 1489 B9R1.13 OB(O)CC1CCCC1 MCULE-5721807920 [0,0,0,1,0,0|2,0,1]=4 1490 B9R1.13 [C@H]1(CCCN1)CC(=O)O MCULE-6368276149 [0,0,0,1,0,0|0,0,0]=1 1491 B9R1.24 CC1(CCCC1CN)C MCULE-2825475131 [0,0,0,1,0,0|2,0,1]=4 1492 B9R1.24 NCC1CCCC1(F)F MCULE-5921834572 [0,0,0,1,0,0|2,0,1]=4 1493 B9R1.24 NCC1CCCC1(F)F MCULE-7486005682 [0,0,0,1,0,0|2,0,1]=4 1494 B9R1.24 NCC1CCCS1(=O)=O MCULE-1202245085 [0,0,0,1,0,0|1,0,1]=3 1495 B9R1.24 NCC1CCCS1(=O)=O MCULE-5230323093 [0,0,0,1,0,0|1,0,1]=3 1496 B9R1.24 O=S1(=O)CCCC1CO MCULE-2122998276 [0,0,0,1,0,0|2,0,1]=4 1497 B9R1.40 C1(CCCCC1(F)F)N MCULE-2272642766 [0,0,0,1,0,0|2,0,1]=4 1498 B9R1.40 C1(CCCCC1(F)F)N MCULE-2805377498 [0,0,0,1,0,0|2,0,1]=4 1499 B9R1.40 CC1(CCCCC1N)C MCULE-5951764286 [0,0,0,1,0,0|2,0,1]=4 1500 B9R1.40 CC1(CCCCC1N)O MCULE-5300265774 [0,0,0,1,0,0|1,0,1]=3 1501 B9R1.40 NC1CCCCC1(F)F MCULE-6087305147 [0,0,0,1,0,0|2,0,1]=4 1502 B9R1.40 NC1CCCCC1(F)F MCULE-7710786653 [0,0,0,1,0,0|2,0,1]=4 1503 B9R1.40 N[C@@H]1CCCCC1(F)F MCULE-3305282256 [0,0,0,1,0,0|2,0,1]=4 1504 B9R1.40 N[C@@H]1CCCCC1(F)F MCULE-5464520416 [0,0,0,1,0,0|2,0,1]=4 1505 B9R1.40 N[C@@H]1CCCCC1(F)F MCULE-6396604034 [0,0,0,1,0,0|2,0,1]=4 1506 B9R1.40 N[C@@H]1CCCCC1(F)F MCULE-9996787741 [0,0,0,1,0,0|2,0,1]=4 1507 B9R1.40 N[C@H]1CCCCC1(F)F MCULE-2339284258 [0,0,0,1,0,0|2,0,1]=4 1508 B9R1.40 N[C@H]1CCCCC1(F)F MCULE-2735093239 [0,0,0,1,0,0|2,0,1]=4 1509 B9R1.40 N[C@H]1CCCCC1(F)F MCULE-8769925997 [0,0,0,1,0,0|2,0,1]=4 1510 B9R1.40 N[C@H]1CCCCC1(F)F MCULE-9241412975 [0,0,0,1,0,0|2,0,1]=4 1511 B9R1.41 C1(CCCN1C)C(=O)O MCULE-7988130618 [0,0,0,1,0,0|2,0,0]=3 1512 B9R1.41 CC(=O)C1CCCC1=O MCULE-8152440536 [0,0,0,1,0,0|2,0,1]=4 1513 B9R1.41 CC(C)C1CCCC1N MCULE-5814373788 [0,0,0,1,0,0|2,0,1]=4 1514 B9R1.41 CC1=C(CCC1)C(=O)O MCULE-4166872703 [0,0,0,1,0,0|1,0,2]=4 1515 B9R1.41 CC1CCCC1C(=O)O MCULE-5150428001 [0,0,0,1,0,0|1,0,0]=2 1516 B9R1.41 CC1CCNC1C(=O)O MCULE-3835684911 [0,0,0,1,0,0|2,0,0]=3 1517 B9R1.41 CC1CCNC1C(=O)O MCULE-8361777649 [0,0,0,1,0,0|2,0,0]=3 1518 B9R1.41 CC1CNCC1C(=O)O MCULE-1581522558 [0,0,0,1,0,0|2,0,0]=3 1519 B9R1.41 CC1CNCC1C(=O)O MCULE-6848551085 [0,0,0,1,0,0|2,0,0]=3 1520 B9R1.41 CC1NCCC1C(=O)O MCULE-5042669811 [0,0,0,1,0,0|2,0,0]=3 1521 B9R1.41 CC1NCCC1C(=O)O MCULE-8546677468 [0,0,0,1,0,0|2,0,0]=3 1522 B9R1.41 CC1OCCC1C(=O)O MCULE-4181521736 [0,0,0,1,0,0|2,0,0]=3 1523 B9R1.41 CN(C)C1CCCC1N MCULE-5950183829 [0,0,0,1,0,0|3,0,0]=4 1524 B9R1.41 CN(C)[C@@H]1CCC[C@@H]1N MCULE-1069168342 [0,0,0,1,0,0|3,0,0]=4 1525 B9R1.41 CN(C)[C@@H]1CCC[C@@H]1N MCULE-6602619868 [0,0,0,1,0,0|3,0,0]=4 1526 B9R1.41 CN(C)[C@@H]1CCC[C@H]1N MCULE-9367102336 [0,0,0,1,0,0|3,0,0]=4 1527 B9R1.41 CN(C)[C@H]1CCC[C@@H]1N MCULE-2581163388 [0,0,0,1,0,0|3,0,0]=4 1528 B9R1.41 CN(C)[C@H]1CCC[C@@H]1N MCULE-5322942161 [0,0,0,1,0,0|3,0,0]=4 1529 B9R1.41 CN(C)[C@H]1CCC[C@@H]1N MCULE-5779746424 [0,0,0,1,0,0|3,0,0]=4 1530 B9R1.41 CN1CCCC1C(=O)N MCULE-1474656837 [0,0,0,1,0,0|3,0,0]=4 1531 B9R1.41 CN1CCCC1C(=O)O MCULE-4884381644 [0,0,0,1,0,0|2,0,0]=3 1532 B9R1.41 CN1CCCC1C(=O)O MCULE-6241162207 [0,0,0,1,0,0|2,0,0]=3 1533 B9R1.41 CN1CCCC1C(=O)O MCULE-7232060205 [0,0,0,1,0,0|2,0,0]=3 1534 B9R1.41 CN1CCC[C@@H]1C(=O)N MCULE-1129223179 [0,0,0,1,0,0|3,0,0]=4 1535 B9R1.41 CN1CCC[C@@H]1C(=O)N MCULE-1418743058 [0,0,0,1,0,0|3,0,0]=4 1536 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-3947573313 [0,0,0,1,0,0|2,0,0]=3 1537 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-4168419254 [0,0,0,1,0,0|2,0,0]=3 1538 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-6504349835 [0,0,0,1,0,0|2,0,0]=3 1539 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-9943329201 [0,0,0,1,0,0|2,0,0]=3 1540 B9R1.41 CN1CCC[C@H]1C(=O)N MCULE-1155656545 [0,0,0,1,0,0|3,0,0]=4 1541 B9R1.41 CN1CCC[C@H]1C(=O)N MCULE-5987152150 [0,0,0,1,0,0|3,0,0]=4 1542 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-1661156416 [0,0,0,1,0,0|2,0,0]=3 1543 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-2535799805 [0,0,0,1,0,0|2,0,0]=3 1544 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-3283459585 [0,0,0,1,0,0|2,0,0]=3 1545 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-5506159927 [0,0,0,1,0,0|2,0,0]=3 1546 B9R1.41 CN1CSCC1C(=O)O MCULE-6053778396 [0,0,0,1,0,0|3,0,0]=4 1547 B9R1.41 CN1CSCC1C(=O)O MCULE-8768199445 [0,0,0,1,0,0|3,0,0]=4 1548 B9R1.41 CN1CSC[C@@H]1C(=O)O MCULE-9390031358 [0,0,0,1,0,0|3,0,0]=4 1549 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-2295281512 [0,0,0,1,0,0|3,0,0]=4 1550 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-3344236668 [0,0,0,1,0,0|3,0,0]=4 1551 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-6116857567 [0,0,0,1,0,0|3,0,0]=4 1552 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-7315008971 [0,0,0,1,0,0|3,0,0]=4 1553 B9R1.41 C[C@@H]1CCN[C@@H]1C(=O)O MCULE-6239309390 [0,0,0,1,0,0|2,0,0]=3 1554 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-1608471752 [0,0,0,1,0,0|2,0,0]=3 1555 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-2896759092 [0,0,0,1,0,0|2,0,0]=3 1556 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O MCULE-5338216485 [0,0,0,1,0,0|2,0,0]=3 1557 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-3425733853 [0,0,0,1,0,0|2,0,0]=3 1558 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-5424989009 [0,0,0,1,0,0|2,0,0]=3 1559 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O MCULE-1674735474 [0,0,0,1,0,0|2,0,0]=3 1560 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-8959062032 [0,0,0,1,0,0|2,0,0]=3 1561 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-9340754868 [0,0,0,1,0,0|2,0,0]=3 1562 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4624227681 [0,0,0,1,0,0|2,0,0]=3 1563 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4653588182 [0,0,0,1,0,0|2,0,0]=3 1564 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-1694933393 [0,0,0,1,0,0|2,0,0]=3 1565 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-9088637113 [0,0,0,1,0,0|2,0,0]=3 1566 B9R1.41 C[C@H]1CCN[C@H]1C(=O)O MCULE-1449988566 [0,0,0,1,0,0|2,0,0]=3 1567 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-3190006541 [0,0,0,1,0,0|2,0,0]=3 1568 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-7835079063 [0,0,0,1,0,0|2,0,0]=3 1569 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-1189864899 [0,0,0,1,0,0|2,0,0]=3 1570 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-8012665255 [0,0,0,1,0,0|2,0,0]=3 1571 B9R1.41 NC(=O)C1CCCC1=O MCULE-2399127943 [0,0,0,1,0,0|2,0,1]=4 1572 B9R1.41 NC(=O)C1CCCC1N MCULE-5593863466 [0,0,0,1,0,0|1,0,0]=2 1573 B9R1.41 NC(=O)C1CCCC1N MCULE-7208597206 [0,0,0,1,0,0|1,0,0]=2 1574 B9R1.41 NC(=O)C1NCCC1O MCULE-1947851170 [0,0,0,1,0,0|3,0,0]=4 1575 B9R1.41 NC(=O)C1NCCC1O MCULE-8983481897 [0,0,0,1,0,0|3,0,0]=4 1576 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-1275176642 [0,0,0,1,0,0|1,0,0]=2 1577 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2107283008 [0,0,0,1,0,0|1,0,0]=2 1578 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2865532845 [0,0,0,1,0,0|1,0,0]=2 1579 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-3874121291 [0,0,0,1,0,0|1,0,0]=2 1580 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O MCULE-7290076922 [0,0,0,1,0,0|2,0,0]=3 1581 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-1119399523 [0,0,0,1,0,0|3,0,0]=4 1582 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-4733398267 [0,0,0,1,0,0|3,0,0]=4 1583 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8085547151 [0,0,0,1,0,0|3,0,0]=4 1584 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8491779714 [0,0,0,1,0,0|3,0,0]=4 1585 B9R1.41 NC1=C(CCC1)C(=O)O MCULE-9287668193 [0,0,0,1,0,0|0,0,2]=3 1586 B9R1.41 NC1C=CCC1C(=O)O MCULE-8527386281 [0,0,0,1,0,0|0,0,2]=3 1587 B9R1.41 NC1C=CCC1C(=O)O MCULE-8529743719 [0,0,0,1,0,0|0,0,2]=3 1588 B9R1.41 NC1CCCC1C(=O)O MCULE-4916984038 [0,0,0,1,0,0|0,0,0]=1 1589 B9R1.41 NC1CCCC1C(=O)O MCULE-7220342321 [0,0,0,1,0,0|0,0,0]=1 1590 B9R1.41 NC1CCNC1C(=O)O MCULE-3789976956 [0,0,0,1,0,0|1,0,0]=2 1591 B9R1.41 NC1CCNC1C(=O)O MCULE-5356536056 [0,0,0,1,0,0|1,0,0]=2 1592 B9R1.41 NC1CNCC1C(=O)O MCULE-1244086282 [0,0,0,1,0,0|1,0,0]=2 1593 B9R1.41 NC1COCC1C(=O)O MCULE-7325840275 [0,0,0,1,0,0|1,0,0]=2 1594 B9R1.41 NC1COCC1C(=O)O MCULE-9068897815 [0,0,0,1,0,0|1,0,0]=2 1595 B9R1.41 NN1CCCC1C(=O)O MCULE-1374834183 [0,0,0,1,0,0|1,0,0]=2 1596 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-3446631182 [0,0,0,1,0,0|0,0,0]=1 1597 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-4537266002 [0,0,0,1,0,0|0,0,0]=1 1598 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9091292908 [0,0,0,1,0,0|0,0,0]=1 1599 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9780104108 [0,0,0,1,0,0|0,0,0]=1 1600 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-1397305924 [0,0,0,1,0,0|0,0,0]=1 1601 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-5447983159 [0,0,0,1,0,0|0,0,0]=1 1602 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-6345808896 [0,0,0,1,0,0|0,0,0]=1 1603 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-7658809060 [0,0,0,1,0,0|0,0,0]=1 1604 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-1080605796 [0,0,0,1,0,0|1,0,0]=2 1605 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5666272526 [0,0,0,1,0,0|1,0,0]=2 1606 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5723263979 [0,0,0,1,0,0|1,0,0]=2 1607 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-6574312344 [0,0,0,1,0,0|1,0,0]=2 1608 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O MCULE-9833243208 [0,0,0,1,0,0|1,0,0]=2 1609 B9R1.41 N[C@@H]1COC[C@H]1C(=O)O MCULE-7323429960 [0,0,0,1,0,0|1,0,0]=2 1610 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-5128495564 [0,0,0,1,0,0|0,0,0]=1 1611 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-7721875754 [0,0,0,1,0,0|0,0,0]=1 1612 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-8287396944 [0,0,0,1,0,0|0,0,0]=1 1613 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9470915806 [0,0,0,1,0,0|0,0,0]=1 1614 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9776724097 [0,0,0,1,0,0|0,0,0]=1 1615 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9997148303 [0,0,0,1,0,0|0,0,0]=1 1616 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-1768949677 [0,0,0,1,0,0|0,0,0]=1 1617 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-2999200875 [0,0,0,1,0,0|0,0,0]=1 1618 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-4735278058 [0,0,0,1,0,0|0,0,0]=1 1619 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-7501259126 [0,0,0,1,0,0|0,0,0]=1 1620 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O MCULE-4396526735 [0,0,0,1,0,0|1,0,0]=2 1621 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O MCULE-9025415433 [0,0,0,1,0,0|1,0,0]=2 1622 B9R1.41 N[C@H]1COC[C@H]1C(=O)O MCULE-2956846972 [0,0,0,1,0,0|1,0,0]=2 1623 B9R1.41 N[C@H]1COC[C@H]1C(=O)O MCULE-3321988270 [0,0,0,1,0,0|1,0,0]=2 1624 B9R1.41 O=C(Cl)C1CCCC1=O MCULE-1186628152 [0,0,0,1,0,0|2,0,1]=4 1625 B9R1.41 O=C(O)C1=C(CCC1)Cl MCULE-4349801654 [0,0,0,1,0,0|1,0,2]=4 1626 B9R1.41 O=C(O)C1CCCC1=O MCULE-9500236289 [0,0,0,1,0,0|1,0,1]=3 1627 B9R1.41 O=C(O)C1CCCC1O MCULE-5519958446 [0,0,0,1,0,0|1,0,0]=2 1628 B9R1.41 O=C(O)C1CCNC1=O MCULE-3110303122 [0,0,0,1,0,0|2,0,1]=4 1629 B9R1.41 O=C(O)C1CCOC1=O MCULE-1545162383 [0,0,0,1,0,0|2,0,1]=4 1630 B9R1.41 O=C(O)C1CNCC1O MCULE-4948062518 [0,0,0,1,0,0|2,0,0]=3 1631 B9R1.41 O=C(O)C1CNCC1O MCULE-8113161890 [0,0,0,1,0,0|2,0,0]=3 1632 B9R1.41 O=C(O)C1COCC1F MCULE-8830875984 [0,0,0,1,0,0|2,0,0]=3 1633 B9R1.41 O=C(O)C1CSCC1=O MCULE-2401489071 [0,0,0,1,0,0|2,0,1]=4 1634 B9R1.41 O=C(O)C1NCCC1F MCULE-2108063646 [0,0,0,1,0,0|2,0,0]=3 1635 B9R1.41 O=C(O)C1NCCC1F MCULE-6901343291 [0,0,0,1,0,0|2,0,0]=3 1636 B9R1.41 O=C(O)C1NCCC1O MCULE-3415911467 [0,0,0,1,0,0|2,0,0]=3 1637 B9R1.41 O=C(O)C1NCCC1O MCULE-3678949962 [0,0,0,1,0,0|2,0,0]=3 1638 B9R1.41 O=C(O)C1NCCC1O MCULE-6594922763 [0,0,0,1,0,0|2,0,0]=3 1639 B9R1.41 O=C(O)[C@@H]1CCNC1=O MCULE-2092808645 [0,0,0,1,0,0|2,0,1]=4 1640 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-3174474393 [0,0,0,1,0,0|2,0,0]=3 1641 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-5151888407 [0,0,0,1,0,0|2,0,0]=3 1642 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1216340314 [0,0,0,1,0,0|2,0,0]=3 1643 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1564327038 [0,0,0,1,0,0|2,0,0]=3 1644 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-8208546333 [0,0,0,1,0,0|2,0,0]=3 1645 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9489383113 [0,0,0,1,0,0|2,0,0]=3 1646 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9999937302 [0,0,0,1,0,0|2,0,0]=3 1647 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7001095632 [0,0,0,1,0,0|2,0,0]=3 1648 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7931619369 [0,0,0,1,0,0|2,0,0]=3 1649 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-1637514285 [0,0,0,1,0,0|2,0,0]=3 1650 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-7041138309 [0,0,0,1,0,0|2,0,0]=3 1651 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9174140225 [0,0,0,1,0,0|2,0,0]=3 1652 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9867563873 [0,0,0,1,0,0|2,0,0]=3 1653 B9R1.41 O=C(O)[C@@H]1[NH2+]CC[C@@H]1O MCULE-4350473030 [0,0,0,1,0,0|2,0,0]=3 1654 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O MCULE-7220456005 [0,0,0,1,0,0|1,0,0]=2 1655 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-1175817797 [0,0,0,1,0,0|2,0,0]=3 1656 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-5823079222 [0,0,0,1,0,0|2,0,0]=3 1657 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-6437141041 [0,0,0,1,0,0|2,0,0]=3 1658 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-8496599400 [0,0,0,1,0,0|2,0,0]=3 1659 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-1891620706 [0,0,0,1,0,0|2,0,0]=3 1660 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2757873569 [0,0,0,1,0,0|2,0,0]=3 1661 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2760733859 [0,0,0,1,0,0|2,0,0]=3 1662 B9R1.41 O=C(O)[C@H]1NCC[C@H]1F MCULE-8117073613 [0,0,0,1,0,0|2,0,0]=3 1663 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-2253713572 [0,0,0,1,0,0|2,0,0]=3 1664 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-4523708371 [0,0,0,1,0,0|2,0,0]=3 1665 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6240521801 [0,0,0,1,0,0|2,0,0]=3 1666 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6709232399 [0,0,0,1,0,0|2,0,0]=3 1667 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6746975985 [0,0,0,1,0,0|2,0,0]=3 1668 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-8268334758 [0,0,0,1,0,0|2,0,0]=3 1669 B9R1.41 [C@@H]1(CCN[C@H]1C(=O)O)O MCULE-2060265421 [0,0,0,1,0,0|2,0,0]=3 1670 B9R1.41 [C@@H]1(NCC[C@H]1O)C(=O)O MCULE-1208236317 [0,0,0,1,0,0|2,0,0]=3 1671 B9R1.41 [C@H]1(CCN[C@H]1C(=O)O)O MCULE-3906438921 [0,0,0,1,0,0|2,0,0]=3 1672 B9R1.48 CC1=CC(=O)CCCC1 MCULE-5466118884 [0,0,0,1,0,0|2,0,1]=4 1673 B9R1.48 CC1CCCCC(=O)C1 MCULE-5791948972 [0,0,0,1,0,0|2,0,0]=3 1674 B9R1.48 CC1CCCCC(=O)N1 MCULE-8985894348 [0,0,0,1,0,0|2,0,0]=3 1675 B9R1.48 CC1CNCCC(=O)N1 MCULE-3663408616 [0,0,0,1,0,0|3,0,0]=4 1676 B9R1.48 CN1CCCCC(C1)N MCULE-8384083495 [0,0,0,1,0,0|3,0,0]=4 1677 B9R1.48 NC1CCCCC(C1)O MCULE-5548192102 [0,0,0,1,0,0|1,0,1]=3 1678 B9R1.48 NC1CCCCC(C1)O MCULE-8953029807 [0,0,0,1,0,0|1,0,1]=3 1679 B9R1.48 NC1CCCNC(=O)C1 MCULE-3170887073 [0,0,0,1,0,0|2,0,0]=3 1680 B9R1.48 N[C@@H]1CCCC[C@@H](C1)O MCULE-7609350144 [0,0,0,1,0,0|1,0,1]=3 1681 B9R1.48 N[C@@H]1CCCC[C@@H](C1)O MCULE-9626764594 [0,0,0,1,0,0|1,0,1]=3 1682 B9R1.48 N[C@@H]1CCCC[C@H](C1)O MCULE-4772681431 [0,0,0,1,0,0|1,0,1]=3 1683 B9R1.48 N[C@@H]1CCCC[C@H](C1)O MCULE-6968396232 [0,0,0,1,0,0|1,0,1]=3 1684 B9R1.48 N[C@H]1CCCC[C@@H](C1)O MCULE-4503660630 [0,0,0,1,0,0|1,0,1]=3 1685 B9R1.48 N[C@H]1CCCC[C@@H](C1)O MCULE-4564760854 [0,0,0,1,0,0|1,0,1]=3 1686 B9R1.48 N[C@H]1CCCC[C@H](C1)O MCULE-2271050688 [0,0,0,1,0,0|1,0,1]=3 1687 B9R1.48 N[C@H]1CCCC[C@H](C1)O MCULE-7801993304 [0,0,0,1,0,0|1,0,1]=3 1688 B9R1.48 O=C1CC(CCCN1)O MCULE-6648954515 [0,0,0,1,0,0|3,0,0]=4 1689 B9R1.48 O=C1CCCCC(=O)C1 MCULE-7105668998 [0,0,0,1,0,0|2,0,1]=4 1690 B9R1.48 O=C1CCCCC(=O)N1 MCULE-4575266335 [0,0,0,1,0,0|2,0,1]=4 1691 B9R1.48 O=C1CCCCC(=O)O1 MCULE-7893102377 [0,0,0,1,0,0|1,0,1]=3 1692 B9R1.48 O=C1CCCCC(=S)N1 MCULE-9950295037 [0,0,0,1,0,0|2,0,1]=4 1693 B9R1.48 O=C1CCCCC(N1)O MCULE-6756895418 [0,0,0,1,0,0|2,0,0]=3 1694 B9R1.50 BrC1=CCCCCCC1 MCULE-5795272491 [0,0,0,1,0,0|3,0,0]=4 1695 B9R1.50 BrC1=CCCCCCC1 MCULE-6505985509 [0,0,0,1,0,0|3,0,0]=4 1696 B9R1.50 NC1CCCCCNC1 MCULE-8217686828 [0,0,0,1,0,0|2,0,1]=4 1697 B9R1.50 O=C1C=CCCCCC1 MCULE-8923461119 [0,0,0,1,0,0|2,0,0]=3 1698 B9R1.50 O=C1CCCCCCC1 MCULE-1352803313 [0,0,0,1,0,0|2,0,0]=3 1699 B9R1.50 O=C1CCCCCCN1 MCULE-4051743080 [0,0,0,1,0,0|2,0,0]=3 1700 B9R1.50 O=C1CCCCCCO1 MCULE-5149380112 [0,0,0,1,0,0|1,0,0]=2 1701 B9R1.50 O=C1CCNCCCN1 MCULE-8530271368 [0,0,0,1,0,0|3,0,0]=4 1702 B9R1.50 O=C1CCNCCCN1 MCULE-9622115909 [0,0,0,1,0,0|3,0,0]=4 1703 B9R1.50 O=C1CNCCCNC1 MCULE-1626282034 [0,0,0,1,0,0|2,0,0]=3 1704 B9R1.50 O=C1CNCCCNC1 MCULE-7735828109 [0,0,0,1,0,0|2,0,0]=3 1705 B9R1.50 O=C1NCCCCCN1 MCULE-7237090911 [0,0,0,1,0,0|3,0,0]=4 1706 B9R1.50 OC1C=CCCCCC1 MCULE-1181214133 [0,0,0,1,0,0|2,0,1]=4 1707 B9R1.50 OC1CCCCCCC1 MCULE-7379371136 [0,0,0,1,0,0|2,0,1]=4 1708 B9R1.50 OC1CNCCCNC1 MCULE-3177425947 [0,0,0,1,0,0|2,0,1]=4 1709 B9R1.50 OC1CNCCCNC1 MCULE-5698562435 [0,0,0,1,0,0|2,0,1]=4 1710 B9R1.59 CCCC1CC1C(=O)O MCULE-5011491615 [0,0,0,1,0,0|1,0,0]=2 1711 B9R1.59 CCC[C@@H]1C[C@@H]1C(=O)O MCULE-8208745989 [0,0,0,1,0,0|1,0,0]=2 1712 B9R1.59 CCC[C@@H]1C[C@H]1C(=O)O MCULE-1448060038 [0,0,0,1,0,0|1,0,0]=2 1713 B9R1.59 CCC[C@H]1C[C@H]1C(=O)O MCULE-6634735984 [0,0,0,1,0,0|1,0,0]=2 1714 B9R1.59 CCOC1CC1C(=O)O MCULE-2083001018 [0,0,0,1,0,0|2,0,0]=3 1715 B9R1.59 CCO[C@@H]1C[C@H]1C(=O)O MCULE-4372225112 [0,0,0,1,0,0|2,0,0]=3 1716 B9R1.59 CCO[C@H]1C[C@@H]1C(=O)O MCULE-5085446325 [0,0,0,1,0,0|2,0,0]=3 1717 B9R1.59 COC[C@@H]1C[C@H]1C(=O)O MCULE-9183962958 [0,0,0,1,0,0|2,0,0]=3 1718 B9R1.77 NCCCC1CC1(Cl)Cl MCULE-1608989263 [0,0,0,1,0,0|2,0,1]=4 1719 B9R1.77 NCCCC1CC1(Cl)Cl MCULE-7364791313 [0,0,0,1,0,0|2,0,1]=4 1720 B9R1.83 CCCCCCC1CO1 MCULE-5253323325 [0,0,0,1,0,0|2,0,1]=4 1721 B9R1.83 CCCCCC[C@H]1CO1 MCULE-2693826692 [0,0,0,1,0,0|2,0,1]=4 1722 B9R1.84 O=C(O)/C=C/C1CCC1 MCULE-9431961317 [0,0,0,1,0,0|1,0,2]=4 1723 B9R1.84 O=C(O)C#CC1CCC1 MCULE-8110230761 [0,0,0,1,0,0|1,0,2]=4 1724 B9R1.84 O=C(O)C=CC1CCC1 MCULE-9173078337 [0,0,0,1,0,0|1,0,2]=4 1725 B9R1.84 O=C(O)CCC1CCC1 MCULE-5780532364 [0,0,0,1,0,0|1,0,0]=2 1726 B9R1.84 O=C(O)CCN1CCC1 MCULE-6537917818 [0,0,0,1,0,0|2,0,0]=3 1727 B9R1.84 O=C(O)CNC1CCC1 MCULE-3999560243 [0,0,0,1,0,0|2,0,0]=3 1728 B9R1.84 O=C(O)CNC1COC1 MCULE-3211874256 [0,0,0,1,0,0|3,0,0]=4 1729 B9R1.84 O=C(O)CNC1COC1 MCULE-8317257994 [0,0,0,1,0,0|3,0,0]=4 1730 B9R1.84 O=C(O)COC1CCC1 MCULE-3354883487 [0,0,0,1,0,0|2,0,0]=3 1731 B9R1.84 O=C(O)COC1CNC1 MCULE-6412418210 [0,0,0,1,0,0|3,0,0]=4 1732 B9R1.84 O=C([O-])CCN1CCC1 MCULE-8406428888 [0,0,0,1,0,0|2,0,1]=4 1733 B9R1.84 O=N(=O)CCC1CCC1 MCULE-8361883109 [0,0,0,1,0,0|2,0,1]=4 1734 B9R1.85 O=C(O)CCCC1CC1 MCULE-4019156455 [0,0,0,1,0,0|1,0,0]=2 1735 B9R1.85 O=C(O)CCNC1CC1 MCULE-2302148090 [0,0,0,1,0,0|2,0,0]=3 1736 B9R1.85 O=C(O)CCNC1CC1 MCULE-5027011962 [0,0,0,1,0,0|2,0,0]=3 1737 B9R1.85 O=C(O)CCOC1CC1 MCULE-6940104376 [0,0,0,1,0,0|2,0,0]=3 1738 B9R1.85 O=C(O)CCSC1CC1 MCULE-5319803876 [0,0,0,1,0,0|2,0,0]=3 1739 B9R1.85 O=C(O)CNCC1CC1 MCULE-2914571109 [0,0,0,1,0,0|2,0,0]=3 1740 B9R1.85 O=C(O)CNCC1CC1 MCULE-8479764724 [0,0,0,1,0,0|2,0,0]=3 1741 B9R1.85 O=C(O)COCC1CC1 MCULE-1838251623 [0,0,0,1,0,0|2,0,0]=3 1742 B9R1.85 O=C(O)CSCC1CC1 MCULE-7765855577 [0,0,0,1,0,0|2,0,0]=3 1743 B9R1.86 CCC1CC1CC(=O)O MCULE-9659162510 [0,0,0,1,0,0|1,0,0]=2 1744 B9R1.96 C1(NCC1CC)C(=O)O MCULE-9517338987 [0,0,0,1,0,0|2,0,0]=3 1745 B9R1.96 CC(=O)N1CCC1CO MCULE-2554026906 [0,0,0,1,0,0|3,0,0]=4 1746 B9R1.96 CCC1CNC1C(=O)O MCULE-5561702986 [0,0,0,1,0,0|2,0,0]=3 1747 B9R1.96 CCC1CN[C@@H]1C(=O)O MCULE-1585063492 [0,0,0,1,0,0|2,0,0]=3 1748 B9R1.96 CCC1CN[C@@H]1C(=O)O MCULE-7143773936 [0,0,0,1,0,0|2,0,0]=3 1749 B9R1.96 CCN1CCC1C(=O)O MCULE-9616158921 [0,0,0,1,0,0|2,0,0]=3 1750 B9R1.96 CCN1CC[C@H]1C(=O)O MCULE-1971461514 [0,0,0,1,0,0|2,0,0]=3 1751 B9R1.96 CCN1CC[C@H]1C(=O)O MCULE-4762142431 [0,0,0,1,0,0|2,0,0]=3 1752 B9R1.96 N#CC1CCC1C(=O)O MCULE-1939970378 [0,0,0,1,0,0|0,0,2]=3 1753 B9R1.96 NCC1CCC1C(F)F MCULE-2784518021 [0,0,0,1,0,0|2,0,1]=4 1754 B9R1.96 O=C(O)C1CCC1CO MCULE-9648982851 [0,0,0,1,0,0|1,0,0]=2 1755 B9R1.96 O=C([O-])C1CCC1CO MCULE-8666321081 [0,0,0,1,0,0|1,0,1]=3 1756 B9R1.96 O=NN1CCC1C(=O)O MCULE-4855920103 [0,0,0,1,0,0|3,0,0]=4 1757 B9R1.148 CC1(CCCCCC1)O MCULE-5108307354 [0,0,0,1,0,0|2,0,1]=4 1758 B9R1.148 O=S1(=O)CCCCCN1 MCULE-7988582298 [0,0,0,1,0,0|1,0,1]=3 1759 B9R1.148 O=S1(=O)CCNCCN1 MCULE-5697547505 [0,0,0,1,0,0|2,0,1]=4 1760 B9R1.148 O=S1(=O)CCNCCN1 MCULE-8191760108 [0,0,0,1,0,0|2,0,1]=4 1761 B9R1.148 O=S1(=O)NCCCCN1 MCULE-2617905096 [0,0,0,1,0,0|2,0,1]=4 1762 B6R0.6 BrCCCCCBr MCULE-7929769310 [2,0,0,0,0,0|2,0,0]=4 1763 B6R0.6 C#CCCCC=O MCULE-4075029417 [2,0,0,0,0,0|0,0,2]=4 1764 B6R0.6 C#CCCCCC MCULE-7776756434 [2,0,0,0,0,0|1,0,1]=4 1765 B6R0.6 C#CCCCCN MCULE-1313888655 [2,0,0,0,0,0|0,0,2]=4 1766 B6R0.6 C#CCCCCN MCULE-5521830994 [2,0,0,0,0,0|0,0,2]=4 1767 B6R0.6 C#CCCCCO MCULE-2977997146 [2,0,0,0,0,0|1,0,1]=4 1768 B6R0.6 C/C=C/CCCC MCULE-6900331316 [2,0,0,0,0,0|1,0,1]=4 1769 B6R0.6 C/C=C\CCCC MCULE-8426867799 [2,0,0,0,0,0|1,0,1]=4 1770 B6R0.6 C=CCCCC=O MCULE-8676840281 [2,0,0,0,0,0|0,0,2]=4 1771 B6R0.6 C=CCCCCBr MCULE-4313298656 [2,0,0,0,0,0|1,0,1]=4 1772 B6R0.6 C=CCCCCC MCULE-5868303078 [2,0,0,0,0,0|1,0,0]=3 1773 B6R0.6 C=CCCCCCl MCULE-7600727876 [2,0,0,0,0,0|1,0,1]=4 1774 B6R0.6 C=CCCCCI MCULE-5694143061 [2,0,0,0,0,0|1,0,1]=4 1775 B6R0.6 C=CCCCCN MCULE-1489231988 [2,0,0,0,0,0|0,0,1]=3 1776 B6R0.6 C=CCCCCN MCULE-4288584778 [2,0,0,0,0,0|0,0,1]=3 1777 B6R0.6 C=CCCCCO MCULE-3631432277 [2,0,0,0,0,0|1,0,1]=4 1778 B6R0.6 C=CCCCNC MCULE-6696525157 [2,0,0,0,0,0|2,0,0]=4 1779 B6R0.6 C=CCCCNC MCULE-7417274044 [2,0,0,0,0,0|2,0,0]=4 1780 B6R0.6 C=CCCCON MCULE-6496647420 [2,0,0,0,0,0|1,0,1]=4 1781 B6R0.6 C=CCCCON MCULE-7055713530 [2,0,0,0,0,0|1,0,1]=4 1782 B6R0.6 C=CCNCCC MCULE-4239068147 [2,0,0,0,0,0|2,0,0]=4 1783 B6R0.6 C=CCNCCC MCULE-9778489216 [2,0,0,0,0,0|2,0,0]=4 1784 B6R0.6 C=CCOCCN MCULE-5411259412 [2,0,0,0,0,0|1,0,1]=4 1785 B6R0.6 C=CCOCCN MCULE-9798285838 [2,0,0,0,0,0|1,0,1]=4 1786 B6R0.6 C=CCSCCC MCULE-3855352363 [2,0,0,0,0,0|2,0,0]=4 1787 B6R0.6 C=CCSCCN MCULE-3972995930 [2,0,0,0,0,0|1,0,1]=4 1788 B6R0.6 C=CCSCCN MCULE-9922932955 [2,0,0,0,0,0|1,0,1]=4 1789 B6R0.6 C=COCCCC MCULE-2025922328 [2,0,0,0,0,0|2,0,0]=4 1790 B6R0.6 C=COCCCN MCULE-1669664157 [2,0,0,0,0,0|1,0,1]=4 1791 B6R0.6 CC/C=C\CC=O MCULE-1715953159 [2,0,0,0,0,0|0,0,2]=4 1792 B6R0.6 CC=CCCCC MCULE-7277981733 [2,0,0,0,0,0|1,0,1]=4 1793 B6R0.6 CCC#CCC=O MCULE-4049790039 [2,0,0,0,0,0|0,0,2]=4 1794 B6R0.6 CCC/C=C/C=O MCULE-3059768922 [2,0,0,0,0,0|0,0,2]=4 1795 B6R0.6 CCC=CCC=O MCULE-5764198290 [2,0,0,0,0,0|0,0,2]=4 1796 B6R0.6 CCCC=CC=O MCULE-5273169296 [2,0,0,0,0,0|0,0,2]=4 1797 B6R0.6 CCCCCC#N MCULE-7596791521 [2,0,0,0,0,0|1,0,1]=4 1798 B6R0.6 CCCCCC=O MCULE-6770578514 [2,0,0,0,0,0|0,0,0]=2 1799 B6R0.6 CCCCCCBr MCULE-6022503394 [2,0,0,0,0,0|1,0,1]=4 1800 B6R0.6 CCCCCCC MCULE-5817084747 [2,0,0,0,0,0|1,0,1]=4 1801 B6R0.6 CCCCCCCl MCULE-3706149525 [2,0,0,0,0,0|1,0,1]=4 1802 B6R0.6 CCCCCCF MCULE-4320903575 [2,0,0,0,0,0|1,0,1]=4 1803 B6R0.6 CCCCCCI MCULE-1021236615 [2,0,0,0,0,0|1,0,1]=4 1804 B6R0.6 CCCCCCN MCULE-2944455155 [2,0,0,0,0,0|0,0,1]=3 1805 B6R0.6 CCCCCCN MCULE-6014217174 [2,0,0,0,0,0|0,0,1]=3 1806 B6R0.6 CCCCCCN MCULE-6021451227 [2,0,0,0,0,0|0,0,1]=3 1807 B6R0.6 CCCCCCO MCULE-4299150163 [2,0,0,0,0,0|0,0,1]=3 1808 B6R0.6 CCCCCCS MCULE-5962964855 [2,0,0,0,0,0|0,1,1]=4 1809 B6R0.6 CCCCCNC MCULE-8082703734 [2,0,0,0,0,0|2,0,0]=4 1810 B6R0.6 CCCCCNN MCULE-5089668540 [2,0,0,0,0,0|1,0,1]=4 1811 B6R0.6 CCCCCNN MCULE-7265120524 [2,0,0,0,0,0|1,0,1]=4 1812 B6R0.6 CCCCCOC MCULE-3370181741 [2,0,0,0,0,0|2,0,0]=4 1813 B6R0.6 CCCCCON MCULE-5372426564 [2,0,0,0,0,0|1,0,1]=4 1814 B6R0.6 CCCCCON MCULE-8557641459 [2,0,0,0,0,0|1,0,1]=4 1815 B6R0.6 CCCCCSC MCULE-6566108868 [2,0,0,0,0,0|2,0,0]=4 1816 B6R0.6 CCCCN=C=O MCULE-3381327717 [2,0,0,0,0,0|1,0,1]=4 1817 B6R0.6 CCCCNC=O MCULE-8821792924 [2,0,0,0,0,0|1,0,0]=3 1818 B6R0.6 CCCCOC=O MCULE-4633421026 [2,0,0,0,0,0|1,0,0]=3 1819 B6R0.6 CCCCON=O MCULE-9992790020 [2,0,0,0,0,0|2,0,0]=4 1820 B6R0.6 CCCNCCN MCULE-2288945868 [2,0,0,0,0,0|1,0,1]=4 1821 B6R0.6 CCCNCCO MCULE-4813687741 [2,0,0,0,0,0|1,0,1]=4 1822 B6R0.6 CCCOCCN MCULE-1987261931 [2,0,0,0,0,0|1,0,1]=4 1823 B6R0.6 CCCOCCN MCULE-9033871038 [2,0,0,0,0,0|1,0,1]=4 1824 B6R0.6 CCCOCCO MCULE-3263526264 [2,0,0,0,0,0|1,0,1]=4 1825 B6R0.6 CCCSCCN MCULE-3934428121 [2,0,0,0,0,0|1,0,1]=4 1826 B6R0.6 CCCSCCN MCULE-5705755172 [2,0,0,0,0,0|1,0,1]=4 1827 B6R0.6 CCCSCCO MCULE-8371796663 [2,0,0,0,0,0|1,0,1]=4 1828 B6R0.6 CCNCCCN MCULE-5811169148 [2,0,0,0,0,0|1,0,1]=4 1829 B6R0.6 CCNCCCO MCULE-3251610052 [2,0,0,0,0,0|1,0,1]=4 1830 B6R0.6 CCOCCC=O MCULE-1664130148 [2,0,0,0,0,0|1,0,0]=3 1831 B6R0.6 CCOCCCN MCULE-3491529722 [2,0,0,0,0,0|1,0,1]=4 1832 B6R0.6 CCOCCCO MCULE-3077567484 [2,0,0,0,0,0|1,0,1]=4 1833 B6R0.6 CCSCCC=O MCULE-2493452950 [2,0,0,0,0,0|1,0,0]=3 1834 B6R0.6 CCSCCCN MCULE-4566450606 [2,0,0,0,0,0|1,0,1]=4 1835 B6R0.6 CCSCCCO MCULE-6719011943 [2,0,0,0,0,0|1,0,1]=4 1836 B6R0.6 CNCCCCN MCULE-2542685963 [2,0,0,0,0,0|1,0,1]=4 1837 B6R0.6 CNCCCCN MCULE-7925344560 [2,0,0,0,0,0|1,0,1]=4 1838 B6R0.6 CNCCCCO MCULE-9264393637 [2,0,0,0,0,0|1,0,1]=4 1839 B6R0.6 COCCCC=O MCULE-2055914202 [2,0,0,0,0,0|1,0,0]=3 1840 B6R0.6 COCCCCN MCULE-9584631056 [2,0,0,0,0,0|1,0,1]=4 1841 B6R0.6 COCCCCO MCULE-2543196930 [2,0,0,0,0,0|1,0,1]=4 1842 B6R0.6 COCCCCO MCULE-8659106280 [2,0,0,0,0,0|1,0,1]=4 1843 B6R0.6 COCCNC=O MCULE-9003279073 [2,0,0,0,0,0|2,0,0]=4 1844 B6R0.6 CSCCCC=O MCULE-6353729217 [2,0,0,0,0,0|1,0,0]=3 1845 B6R0.6 CSCCCCN MCULE-2391033479 [2,0,0,0,0,0|1,0,1]=4 1846 B6R0.6 CSCCCCO MCULE-1045422424 [2,0,0,0,0,0|1,0,1]=4 1847 B6R0.6 ClCCCCCBr MCULE-6767883252 [2,0,0,0,0,0|2,0,0]=4 1848 B6R0.6 ClCCCCCCl MCULE-9302388009 [2,0,0,0,0,0|2,0,0]=4 1849 B6R0.6 ClCCCCCI MCULE-2173931817 [2,0,0,0,0,0|2,0,0]=4 1850 B6R0.6 FCCCCCBr MCULE-1314383985 [2,0,0,0,0,0|2,0,0]=4 1851 B6R0.6 ICCCCCI MCULE-2889089700 [2,0,0,0,0,0|2,0,0]=4 1852 B6R0.6 N#CCCCCN MCULE-4183048720 [2,0,0,0,0,0|1,0,1]=4 1853 B6R0.6 N#CCCCCN MCULE-4775375165 [2,0,0,0,0,0|1,0,1]=4 1854 B6R0.6 N#CCCCCO MCULE-4289736283 [2,0,0,0,0,0|0,0,2]=4 1855 B6R0.6 NCCCCCBr MCULE-3577483607 [2,0,0,0,0,0|1,0,0]=3 1856 B6R0.6 NCCCCCBr MCULE-7572691537 [2,0,0,0,0,0|1,0,0]=3 1857 B6R0.6 NCCCCCF MCULE-1057270243 [2,0,0,0,0,0|1,0,0]=3 1858 B6R0.6 NCCCCCN MCULE-3785554987 [2,0,0,0,0,0|1,0,0]=3 1859 B6R0.6 NCCCCCN MCULE-5173983982 [2,0,0,0,0,0|1,0,0]=3 1860 B6R0.6 NCCCCCO MCULE-8877250712 [2,0,0,0,0,0|0,0,0]=2 1861 B6R0.6 NCCCCCS MCULE-1813104379 [2,0,0,0,0,0|0,1,0]=3 1862 B6R0.6 NCCCCCS MCULE-6081835870 [2,0,0,0,0,0|0,1,0]=3 1863 B6R0.6 NCCCCNO MCULE-6478748569 [2,0,0,0,0,0|1,0,0]=3 1864 B6R0.6 NCCCNC=O MCULE-9651299205 [2,0,0,0,0,0|1,0,0]=3 1865 B6R0.6 NCCNCCCl MCULE-8909584172 [2,0,0,0,0,0|2,0,0]=4 1866 B6R0.6 NCCNCCCl MCULE-9412103836 [2,0,0,0,0,0|2,0,0]=4 1867 B6R0.6 NCCNCCN MCULE-4710767146 [2,0,0,0,0,0|2,0,0]=4 1868 B6R0.6 NCCNCCN MCULE-4803305991 [2,0,0,0,0,0|2,0,0]=4 1869 B6R0.6 NCCNCCO MCULE-2112359407 [2,0,0,0,0,0|1,0,0]=3 1870 B6R0.6 NCCOCCBr MCULE-6520580224 [2,0,0,0,0,0|2,0,0]=4 1871 B6R0.6 NCCOCCCl MCULE-1975521529 [2,0,0,0,0,0|2,0,0]=4 1872 B6R0.6 NCCOCCCl MCULE-9715175348 [2,0,0,0,0,0|2,0,0]=4 1873 B6R0.6 NCCOCCF MCULE-4126568309 [2,0,0,0,0,0|2,0,0]=4 1874 B6R0.6 NCCOCCF MCULE-4641621710 [2,0,0,0,0,0|2,0,0]=4 1875 B6R0.6 NCCOCCN MCULE-1630934305 [2,0,0,0,0,0|2,0,0]=4 1876 B6R0.6 NCCOCCN MCULE-3282393357 [2,0,0,0,0,0|2,0,0]=4 1877 B6R0.6 NCCOCCN MCULE-3788231540 [2,0,0,0,0,0|2,0,0]=4 1878 B6R0.6 NCCOCCO MCULE-1073574088 [2,0,0,0,0,0|1,0,0]=3 1879 B6R0.6 NCCSCCN MCULE-4317147284 [2,0,0,0,0,0|2,0,0]=4 1880 B6R0.6 NCCSCCN MCULE-5449033874 [2,0,0,0,0,0|2,0,0]=4 1881 B6R0.6 NCCSCCO MCULE-1475378446 [2,0,0,0,0,0|1,0,0]=3 1882 B6R0.6 NNCCCCO MCULE-3928748589 [2,0,0,0,0,0|1,0,0]=3 1883 B6R0.6 O=CCCCC=O MCULE-6802048757 [2,0,0,0,0,0|1,0,1]=4 1884 B6R0.6 O=CCCCCCl MCULE-1257670284 [2,0,0,0,0,0|1,0,0]=3 1885 B6R0.6 O=CCCCCO MCULE-7959082228 [2,0,0,0,0,0|1,0,0]=3 1886 B6R0.6 O=CNCCCO MCULE-7926485528 [2,0,0,0,0,0|2,0,0]=4 1887 B6R0.6 OCCCCCBr MCULE-1444733196 [2,0,0,0,0,0|1,0,0]=3 1888 B6R0.6 OCCCCCCl MCULE-5666058059 [2,0,0,0,0,0|1,0,0]=3 1889 B6R0.6 OCCCCCF MCULE-9253204275 [2,0,0,0,0,0|1,0,0]=3 1890 B6R0.6 OCCCCCI MCULE-8707758496 [2,0,0,0,0,0|1,0,0]=3 1891 B6R0.6 OCCCCCO MCULE-1044076048 [2,0,0,0,0,0|1,0,0]=3 1892 B6R0.6 OCCNCCCl MCULE-7809492267 [2,0,0,0,0,0|2,0,0]=4 1893 B6R0.6 OCCNCCCl MCULE-9007709158 [2,0,0,0,0,0|2,0,0]=4 1894 B6R0.6 OCCNCCO MCULE-9183096746 [2,0,0,0,0,0|2,0,0]=4 1895 B6R0.6 OCCNCCO MCULE-9803420258 [2,0,0,0,0,0|2,0,0]=4 1896 B6R0.6 OCCOCCBr MCULE-2641000270 [2,0,0,0,0,0|2,0,0]=4 1897 B6R0.6 OCCOCCCl MCULE-7320539957 [2,0,0,0,0,0|2,0,0]=4 1898 B6R0.6 OCCOCCF MCULE-1780385479 [2,0,0,0,0,0|2,0,0]=4 1899 B6R0.6 OCCOCCI MCULE-1083607130 [2,0,0,0,0,0|2,0,0]=4 1900 B6R0.6 OCCOCCO MCULE-1531783732 [2,0,0,0,0,0|2,0,0]=4 1901 B6R0.6 OCCSCCO MCULE-5502656030 [2,0,0,0,0,0|2,0,0]=4 1902 B6R0.6 OCCSCCS MCULE-4418561990 [2,0,0,0,0,0|2,0,0]=4 1903 B6R0.6 SCCCCCS MCULE-4899719552 [2,0,0,0,0,0|1,1,0]=4 1904 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [2,0,0,0,0,0|0,0,2]=4 1905 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [2,0,0,0,0,0|0,0,2]=4 1906 B6R0.4 C=C(C)CCCC MCULE-1010177756 [2,0,0,0,0,0|2,0,0]=4 1907 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [2,0,0,0,0,0|0,0,2]=4 1908 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [2,0,0,0,0,0|0,0,2]=4 1909 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [2,0,0,0,0,0|2,0,0]=4 1910 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [2,0,0,0,0,0|2,0,0]=4 1911 B6R0.4 CC(=O)CCCO MCULE-1335342150 [2,0,0,0,0,0|2,0,0]=4 1912 B6R0.4 CC(=O)NCCN MCULE-2230084818 [2,0,0,0,0,0|2,0,0]=4 1913 B6R0.4 CC(=O)OCCN MCULE-4530529900 [2,0,0,0,0,0|2,0,0]=4 1914 B6R0.4 CC(=O)OCCN MCULE-6854340494 [2,0,0,0,0,0|2,0,0]=4 1915 B6R0.4 CC(=O)SCCN MCULE-3819903256 [2,0,0,0,0,0|2,0,0]=4 1916 B6R0.4 CC(=O)SCCN MCULE-4872130470 [2,0,0,0,0,0|2,0,0]=4 1917 B6R0.4 CC(=O)SCCN MCULE-7084821345 [2,0,0,0,0,0|2,0,0]=4 1918 B6R0.4 CC(O)CCCN MCULE-3754805134 [2,0,0,0,0,0|1,0,1]=4 1919 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [2,0,0,0,0,0|0,0,2]=4 1920 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [2,0,0,0,0,0|0,0,2]=4 1921 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [2,0,0,0,0,0|0,0,2]=4 1922 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [2,0,0,0,0,0|0,0,2]=4 1923 B6R0.4 CCCCB(O)O MCULE-9002672645 [2,0,0,0,0,0|1,0,1]=4 1924 B6R0.4 CCCCC(=N)N MCULE-3271993509 [2,0,0,0,0,0|2,0,0]=4 1925 B6R0.4 CCCCC(=N)N MCULE-3935017760 [2,0,0,0,0,0|2,0,0]=4 1926 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [2,0,0,0,0,0|1,0,0]=3 1927 B6R0.4 CCCCC(=O)C MCULE-3554390184 [2,0,0,0,0,0|1,0,0]=3 1928 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [2,0,0,0,0,0|1,0,0]=3 1929 B6R0.4 CCCCC(=O)N MCULE-6419483436 [2,0,0,0,0,0|1,0,0]=3 1930 B6R0.4 CCCCC(=O)O MCULE-2333640078 [2,0,0,0,0,0|0,0,0]=2 1931 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [2,0,0,0,0,0|0,0,1]=3 1932 B6R0.4 CCCCC(=S)N MCULE-8236760762 [2,0,0,0,0,0|1,1,0]=4 1933 B6R0.4 CCCCC(C)O MCULE-6558228722 [2,0,0,0,0,0|1,0,1]=4 1934 B6R0.4 CCCCN(=O)=O MCULE-7679767771 [2,0,0,0,0,0|1,0,1]=4 1935 B6R0.4 CCCCS(=O)[O-] MCULE-4347348762 [2,0,0,0,0,0|1,0,1]=4 1936 B6R0.4 CCCCS(=O)[O-] MCULE-8153578421 [2,0,0,0,0,0|1,0,1]=4 1937 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [2,0,0,0,0,0|1,0,1]=4 1938 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [2,0,0,0,0,0|1,0,1]=4 1939 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [2,0,0,0,0,0|1,0,1]=4 1940 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [2,0,0,0,0,0|1,0,1]=4 1941 B6R0.4 CCCNC(=O)C MCULE-5899703886 [2,0,0,0,0,0|2,0,0]=4 1942 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [2,0,0,0,0,0|2,0,0]=4 1943 B6R0.4 CCCNC(=O)N MCULE-8528844765 [2,0,0,0,0,0|2,0,0]=4 1944 B6R0.4 CCCOC(=O)C MCULE-7327042566 [2,0,0,0,0,0|2,0,0]=4 1945 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [2,0,0,0,0,0|2,0,0]=4 1946 B6R0.4 CCCOC(=O)N MCULE-2760622567 [2,0,0,0,0,0|2,0,0]=4 1947 B6R0.4 CCCSC(=O)C MCULE-4329646671 [2,0,0,0,0,0|2,0,0]=4 1948 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [2,0,0,0,0,0|2,0,0]=4 1949 B6R0.4 CCNCC(=O)C MCULE-5799315547 [2,0,0,0,0,0|2,0,0]=4 1950 B6R0.4 CCNCC(=O)C MCULE-9258294157 [2,0,0,0,0,0|2,0,0]=4 1951 B6R0.4 CCNCC(=O)N MCULE-1787248899 [2,0,0,0,0,0|2,0,0]=4 1952 B6R0.4 CCNCC(=O)N MCULE-3821700273 [2,0,0,0,0,0|2,0,0]=4 1953 B6R0.4 CCNCC(=O)O MCULE-5989480216 [2,0,0,0,0,0|1,0,0]=3 1954 B6R0.4 CCNCC(=O)O MCULE-8087863397 [2,0,0,0,0,0|1,0,0]=3 1955 B6R0.4 CCOCC(=O)C MCULE-2825677443 [2,0,0,0,0,0|2,0,0]=4 1956 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [2,0,0,0,0,0|2,0,0]=4 1957 B6R0.4 CCOCC(=O)O MCULE-1726530898 [2,0,0,0,0,0|1,0,0]=3 1958 B6R0.4 CCSCC(=O)C MCULE-9872082780 [2,0,0,0,0,0|2,0,0]=4 1959 B6R0.4 CCSCC(=O)O MCULE-7471335718 [2,0,0,0,0,0|1,0,0]=3 1960 B6R0.4 CNCCC(=O)N MCULE-1118876220 [2,0,0,0,0,0|2,0,0]=4 1961 B6R0.4 CNCCC(=O)N MCULE-6679713144 [2,0,0,0,0,0|2,0,0]=4 1962 B6R0.4 CNCCC(=O)O MCULE-3627988097 [2,0,0,0,0,0|1,0,0]=3 1963 B6R0.4 CNCCC(=O)O MCULE-9858204248 [2,0,0,0,0,0|1,0,0]=3 1964 B6R0.4 COCCC(=O)C MCULE-5939812376 [2,0,0,0,0,0|2,0,0]=4 1965 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [2,0,0,0,0,0|2,0,0]=4 1966 B6R0.4 COCCC(=O)N MCULE-7556483675 [2,0,0,0,0,0|2,0,0]=4 1967 B6R0.4 COCCC(=O)O MCULE-3436347115 [2,0,0,0,0,0|1,0,0]=3 1968 B6R0.4 CS(=O)CCCN MCULE-1124989526 [2,0,0,0,0,0|2,0,0]=4 1969 B6R0.4 CS(=O)CCCN MCULE-8758903495 [2,0,0,0,0,0|2,0,0]=4 1970 B6R0.4 CSCCC(=O)C MCULE-6178663156 [2,0,0,0,0,0|2,0,0]=4 1971 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [2,0,0,0,0,0|2,0,0]=4 1972 B6R0.4 CSCCC(=O)N MCULE-7105035733 [2,0,0,0,0,0|2,0,0]=4 1973 B6R0.4 CSCCC(=O)O MCULE-9550032941 [2,0,0,0,0,0|1,0,0]=3 1974 B6R0.4 CSSCC(=O)O MCULE-5829510166 [2,0,0,0,0,0|2,0,0]=4 1975 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [2,0,0,0,0,0|0,0,2]=4 1976 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [2,0,0,0,0,0|2,0,0]=4 1977 B6R0.4 NC(=O)CCCO MCULE-3779341561 [2,0,0,0,0,0|2,0,0]=4 1978 B6R0.4 NC/C=C/C(=O)O MCULE-1249244912 [2,0,0,0,0,0|0,0,2]=4 1979 B6R0.4 NCC#CC(=O)O MCULE-8511125702 [2,0,0,0,0,0|0,0,2]=4 1980 B6R0.4 NCC=CC(=O)O MCULE-3049811576 [2,0,0,0,0,0|0,0,2]=4 1981 B6R0.4 NCC=CC(=O)O MCULE-5171717036 [2,0,0,0,0,0|0,0,2]=4 1982 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [2,0,0,0,0,0|1,0,0]=3 1983 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [2,0,0,0,0,0|1,0,0]=3 1984 B6R0.4 NCCCC(=O)N MCULE-8039142092 [2,0,0,0,0,0|1,0,0]=3 1985 B6R0.4 NCCCC(=O)N MCULE-8262250872 [2,0,0,0,0,0|1,0,0]=3 1986 B6R0.4 NCCCC(=O)O MCULE-3615304273 [2,0,0,0,0,0|0,0,0]=2 1987 B6R0.4 NCCCC(=O)O MCULE-7613134021 [2,0,0,0,0,0|0,0,0]=2 1988 B6R0.4 NCCNC(=O)N MCULE-1197396950 [2,0,0,0,0,0|2,0,0]=4 1989 B6R0.4 NCCNC(=O)N MCULE-2171700183 [2,0,0,0,0,0|2,0,0]=4 1990 B6R0.4 NCCNC(=O)N MCULE-3799764813 [2,0,0,0,0,0|2,0,0]=4 1991 B6R0.4 NCCOC(=O)N MCULE-4144808257 [2,0,0,0,0,0|2,0,0]=4 1992 B6R0.4 NCCOC(=O)N MCULE-5815053840 [2,0,0,0,0,0|2,0,0]=4 1993 B6R0.4 NOCCC(=O)O MCULE-1529492904 [2,0,0,0,0,0|1,0,0]=3 1994 B6R0.4 NOCCC(=O)O MCULE-6297331357 [2,0,0,0,0,0|1,0,0]=3 1995 B6R0.4 O=C(Cl)CCCBr MCULE-1389049838 [2,0,0,0,0,0|2,0,0]=4 1996 B6R0.4 O=C(Cl)CCCCl MCULE-5885932072 [2,0,0,0,0,0|2,0,0]=4 1997 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [2,0,0,0,0,0|1,0,0]=3 1998 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [2,0,0,0,0,0|1,0,0]=3 1999 B6R0.4 O=C(O)CCCF MCULE-2415675768 [2,0,0,0,0,0|1,0,0]=3 2000 B6R0.4 O=C(O)CCCI MCULE-7794841553 [2,0,0,0,0,0|1,0,0]=3 2001 B6R0.4 O=C(O)CCCS MCULE-3352840152 [2,0,0,0,0,0|1,0,0]=3 2002 B6R0.4 O=C(O)CNCO MCULE-4092998319 [2,0,0,0,0,0|2,0,0]=4 2003 B6R0.4 O=C([O-])CCCCl MCULE-4131322715 [2,0,0,0,0,0|1,0,1]=4 2004 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [2,0,0,0,0,0|1,0,1]=4 2005 B8R0.1 C#CCCC(O)CCN MCULE-1222620525 [1,1,0,0,0,0|1,0,1]=4 2006 B8R0.1 C#CCCC(O)CCN MCULE-1377722654 [1,1,0,0,0,0|1,0,1]=4 2007 B8R0.1 C=CCC(O)CCCC MCULE-4055894447 [1,1,0,0,0,0|2,0,0]=4 2008 B8R0.1 C=CCCC(C)CCC MCULE-8046771961 [1,1,0,0,0,0|2,0,0]=4 2009 B8R0.1 C=CCCC(O)CCC MCULE-4495559867 [1,1,0,0,0,0|2,0,0]=4 2010 B8R0.1 CCCC(C)CCCO MCULE-9229761768 [1,1,0,0,0,0|1,0,1]=4 2011 B8R0.1 CCCC(C)COC=O MCULE-4206126891 [1,1,0,0,0,0|2,0,0]=4 2012 B8R0.1 CCCC(O)CCCO MCULE-4169738114 [1,1,0,0,0,0|1,0,1]=4 2013 B8R0.1 CCCCC(C)CCO MCULE-7796394440 [1,1,0,0,0,0|1,0,1]=4 2014 B8R0.1 CCCCC(N)CCO MCULE-1718868981 [1,1,0,0,0,0|1,0,1]=4 2015 B8R0.1 CCCCC(N)CCO MCULE-6967408250 [1,1,0,0,0,0|1,0,1]=4 2016 B8R0.1 CCCCC(N)CCO MCULE-7169926590 [1,1,0,0,0,0|1,0,1]=4 2017 B8R0.1 CCCCC(N)CCO MCULE-7195068070 [1,1,0,0,0,0|1,0,1]=4 2018 B8R0.1 CCCCC(O)CCO MCULE-1527111701 [1,1,0,0,0,0|1,0,1]=4 2019 B8R0.1 CCCC[C@H](N)CCO MCULE-1556286414 [1,1,0,0,0,0|1,0,1]=4 2020 B8R0.1 CCCC[C@H](N)CCO MCULE-5421326968 [1,1,0,0,0,0|1,0,1]=4 2021 B8R0.1 CCCC[C@H](N)CCO MCULE-8706513986 [1,1,0,0,0,0|1,0,1]=4 2022 B8R0.1 CN(CCO)CCCN MCULE-8815292888 [1,1,0,0,0,0|1,0,1]=4 2023 B8R0.4 C#CCCCCCC=O MCULE-6168802703 [1,1,0,0,0,0|1,0,0]=3 2024 B8R0.4 C#CCCCCCCN MCULE-1593470538 [1,1,0,0,0,0|1,0,1]=4 2025 B8R0.4 C#CCCCCCCN MCULE-4412235962 [1,1,0,0,0,0|1,0,1]=4 2026 B8R0.4 C#CCCCCCCO MCULE-9399870702 [1,1,0,0,0,0|1,0,1]=4 2027 B8R0.4 C=CCCCCCC#N MCULE-9178830162 [1,1,0,0,0,0|1,0,1]=4 2028 B8R0.4 C=CCCCCCC=C MCULE-3963888938 [1,1,0,0,0,0|2,0,0]=4 2029 B8R0.4 C=CCCCCCC=O MCULE-9514877352 [1,1,0,0,0,0|1,0,0]=3 2030 B8R0.4 C=CCCCCCCBr MCULE-6451772855 [1,1,0,0,0,0|2,0,0]=4 2031 B8R0.4 C=CCCCCCCC MCULE-8103203416 [1,1,0,0,0,0|2,0,0]=4 2032 B8R0.4 C=CCCCCCCCl MCULE-2359680024 [1,1,0,0,0,0|2,0,0]=4 2033 B8R0.4 C=CCCCCCCI MCULE-2548377676 [1,1,0,0,0,0|2,0,0]=4 2034 B8R0.4 C=CCCCCCCN MCULE-3465800348 [1,1,0,0,0,0|1,0,0]=3 2035 B8R0.4 C=CCCCCCCN MCULE-9820466293 [1,1,0,0,0,0|1,0,0]=3 2036 B8R0.4 C=CCCCCCCO MCULE-8561904793 [1,1,0,0,0,0|1,0,1]=4 2037 B8R0.4 C=CCCCCCNC MCULE-9487840122 [1,1,0,0,0,0|1,0,0]=3 2038 B8R0.4 C=CCCCCCON MCULE-4401326316 [1,1,0,0,0,0|1,0,0]=3 2039 B8R0.4 C=CCCCCCON MCULE-7563390889 [1,1,0,0,0,0|1,0,0]=3 2040 B8R0.4 C=CCCNCCCO MCULE-1492709649 [1,1,0,0,0,0|2,0,0]=4 2041 B8R0.4 C=CCOCCCCO MCULE-6517087003 [1,1,0,0,0,0|2,0,0]=4 2042 B8R0.4 CC=CCCCCCC MCULE-2766900913 [1,1,0,0,0,0|2,0,0]=4 2043 B8R0.4 CCCCC/C=C/C=O MCULE-9410244042 [1,1,0,0,0,0|1,0,1]=4 2044 B8R0.4 CCCCC/C=C/CO MCULE-2538979274 [1,1,0,0,0,0|1,0,1]=4 2045 B8R0.4 CCCCCC#CC=O MCULE-6367130572 [1,1,0,0,0,0|1,0,1]=4 2046 B8R0.4 CCCCCC=CC=O MCULE-7640230490 [1,1,0,0,0,0|1,0,1]=4 2047 B8R0.4 CCCCCC=CCO MCULE-7026544339 [1,1,0,0,0,0|1,0,1]=4 2048 B8R0.4 CCCCCCC=CI MCULE-3614174427 [1,1,0,0,0,0|2,0,0]=4 2049 B8R0.4 CCCCCCCC=O MCULE-7111365457 [1,1,0,0,0,0|1,0,0]=3 2050 B8R0.4 CCCCCCCCN MCULE-6095227778 [1,1,0,0,0,0|1,0,1]=4 2051 B8R0.4 CCCCCCCCN MCULE-7012389700 [1,1,0,0,0,0|1,0,1]=4 2052 B8R0.4 CCCCCCCCN MCULE-7076053015 [1,1,0,0,0,0|1,0,1]=4 2053 B8R0.4 CCCCCCCCO MCULE-2656577895 [1,1,0,0,0,0|1,0,1]=4 2054 B8R0.4 CCCCCCCNC MCULE-1143610772 [1,1,0,0,0,0|1,0,1]=4 2055 B8R0.4 CCCCCCCNN MCULE-7800659587 [1,1,0,0,0,0|1,0,1]=4 2056 B8R0.4 CCCCCCCON MCULE-6380236924 [1,1,0,0,0,0|1,0,1]=4 2057 B8R0.4 CCCCCCCON MCULE-6581043184 [1,1,0,0,0,0|1,0,1]=4 2058 B8R0.4 CCCCCCN=C=O MCULE-6808788959 [1,1,0,0,0,0|1,0,1]=4 2059 B8R0.4 CCCCCCNC=O MCULE-3719637754 [1,1,0,0,0,0|1,0,0]=3 2060 B8R0.4 CCCCCCOC=O MCULE-1329787181 [1,1,0,0,0,0|1,0,0]=3 2061 B8R0.4 CCCCCCON=O MCULE-9048754026 [1,1,0,0,0,0|2,0,0]=4 2062 B8R0.4 CCCCCNCCN MCULE-5873419228 [1,1,0,0,0,0|1,0,1]=4 2063 B8R0.4 CCCCCNCCO MCULE-7662965930 [1,1,0,0,0,0|1,0,1]=4 2064 B8R0.4 CCCCCOCCO MCULE-3393695257 [1,1,0,0,0,0|1,0,1]=4 2065 B8R0.4 CCCCCSCCO MCULE-1239137782 [1,1,0,0,0,0|1,0,1]=4 2066 B8R0.4 CCCCNCCCN MCULE-6098022466 [1,1,0,0,0,0|1,0,1]=4 2067 B8R0.4 CCCCNCCCO MCULE-7171357018 [1,1,0,0,0,0|1,0,1]=4 2068 B8R0.4 CCCCOCCCN MCULE-2107763231 [1,1,0,0,0,0|1,0,1]=4 2069 B8R0.4 CCCCOCCCO MCULE-2797403638 [1,1,0,0,0,0|1,0,1]=4 2070 B8R0.4 CCCCSCCCN MCULE-6519812920 [1,1,0,0,0,0|1,0,1]=4 2071 B8R0.4 CCCNCCCCN MCULE-1576152293 [1,1,0,0,0,0|1,0,1]=4 2072 B8R0.4 CCCNCCCCN MCULE-2764845788 [1,1,0,0,0,0|1,0,1]=4 2073 B8R0.4 CCCSCCCCN MCULE-7923615539 [1,1,0,0,0,0|1,0,1]=4 2074 B8R0.4 CCNCCCCCN MCULE-1094310455 [1,1,0,0,0,0|1,0,1]=4 2075 B8R0.4 CCOCCOCC=O MCULE-4431979706 [1,1,0,0,0,0|2,0,0]=4 2076 B8R0.4 CNCCCCCCN MCULE-3241182046 [1,1,0,0,0,0|1,0,1]=4 2077 B8R0.4 CNCCCCCCO MCULE-2582847385 [1,1,0,0,0,0|0,0,1]=3 2078 B8R0.4 COCCCCCCBr MCULE-8590853100 [1,1,0,0,0,0|1,0,1]=4 2079 B8R0.4 COCCCCCCO MCULE-5454628686 [1,1,0,0,0,0|1,0,1]=4 2080 B8R0.4 COCCCNCCN MCULE-6697775895 [1,1,0,0,0,0|1,0,1]=4 2081 B8R0.4 COCCNCCCN MCULE-7319591268 [1,1,0,0,0,0|1,0,1]=4 2082 B8R0.4 COCCOCCC=O MCULE-4095630051 [1,1,0,0,0,0|2,0,0]=4 2083 B8R0.4 COCCOCCCN MCULE-8835423066 [1,1,0,0,0,0|1,0,1]=4 2084 B8R0.4 CSCCCCCCN MCULE-3785645703 [1,1,0,0,0,0|0,1,1]=4 2085 B8R0.4 CSCCCCCCO MCULE-1590282643 [1,1,0,0,0,0|1,0,1]=4 2086 B8R0.4 N#N=NCCCCCN MCULE-4346251964 [1,1,0,0,0,0|2,0,0]=4 2087 B8R0.4 N#N=NCCCCCN MCULE-4601745002 [1,1,0,0,0,0|2,0,0]=4 2088 B8R0.4 NCCCCCCCBr MCULE-2103124315 [1,1,0,0,0,0|1,0,1]=4 2089 B8R0.4 NCCCCCCCBr MCULE-9591138313 [1,1,0,0,0,0|1,0,1]=4 2090 B8R0.4 NCCCCCCCN MCULE-3408586405 [1,1,0,0,0,0|1,0,1]=4 2091 B8R0.4 NCCCCCCCO MCULE-6098435698 [1,1,0,0,0,0|0,0,1]=3 2092 B8R0.4 NCCCCCCCO MCULE-8352830275 [1,1,0,0,0,0|0,0,1]=3 2093 B8R0.4 NCCCCNCCO MCULE-5679490980 [1,1,0,0,0,0|0,0,1]=3 2094 B8R0.4 NCCCNCCCN MCULE-3936851596 [1,1,0,0,0,0|1,0,1]=4 2095 B8R0.4 NCCCNCCCO MCULE-1085206494 [1,1,0,0,0,0|0,0,1]=3 2096 B8R0.4 NCCCOCCCN MCULE-5378554478 [1,1,0,0,0,0|1,0,1]=4 2097 B8R0.4 NCCCOCCCO MCULE-9489688996 [1,1,0,0,0,0|0,0,1]=3 2098 B8R0.4 NCCNCCCCO MCULE-1668134399 [1,1,0,0,0,0|0,0,1]=3 2099 B8R0.4 NCCNCCCCO MCULE-8060063829 [1,1,0,0,0,0|0,0,1]=3 2100 B8R0.4 O=CCCCCCC=O MCULE-7016999051 [1,1,0,0,0,0|1,0,0]=3 2101 B8R0.4 O=CCCCCCCBr MCULE-3046622133 [1,1,0,0,0,0|1,0,0]=3 2102 B8R0.4 OCCCCCCCBr MCULE-2559114853 [1,1,0,0,0,0|1,0,1]=4 2103 B8R0.4 OCCCCCCCCl MCULE-4143586059 [1,1,0,0,0,0|1,0,1]=4 2104 B8R0.4 OCCCCCCCI MCULE-3420024644 [1,1,0,0,0,0|1,0,1]=4 2105 B8R0.4 OCCCCCCCO MCULE-1201837142 [1,1,0,0,0,0|1,0,1]=4 2106 B8R0.4 OCCCNCCCO MCULE-1813882908 [1,1,0,0,0,0|1,0,1]=4 2107 B8R0.4 OCCCNCCCO MCULE-4567401301 [1,1,0,0,0,0|1,0,1]=4 2108 B8R0.4 OCCCOCCCCl MCULE-9999003892 [1,1,0,0,0,0|1,0,1]=4 2109 B8R0.4 OCCCOCCCO MCULE-2894245516 [1,1,0,0,0,0|1,0,1]=4 2110 B8R0.4 OCCCSCCCO MCULE-2025331376 [1,1,0,0,0,0|1,0,1]=4 2111 B8R0.6 C=CC(O)CCCCC MCULE-3974016765 [1,1,0,0,0,0|2,0,0]=4 2112 B8R0.6 C=CCOCC(O)CN MCULE-8007017645 [1,1,0,0,0,0|2,0,0]=4 2113 B8R0.6 CCC(C)CCCCO MCULE-9107164434 [1,1,0,0,0,0|1,0,1]=4 2114 B8R0.6 CCCCCC(C)CO MCULE-4884757032 [1,1,0,0,0,0|1,0,1]=4 2115 B8R0.6 CCCCCC(O)CN MCULE-6091710122 [1,1,0,0,0,0|1,0,1]=4 2116 B8R0.6 CCCCCC(O)CO MCULE-4124719814 [1,1,0,0,0,0|1,0,1]=4 2117 B8R0.6 CC[C@H](C)CCCCO MCULE-2674922341 [1,1,0,0,0,0|1,0,1]=4 2118 B8R0.6 CC[C@H](C)CCCCO MCULE-7482991055 [1,1,0,0,0,0|1,0,1]=4 2119 B8R0.6 NCCCCC(N)CO MCULE-5938273372 [1,1,0,0,0,0|0,0,1]=3 2120 B8R0.6 NCCCCC(N)CO MCULE-9464237285 [1,1,0,0,0,0|0,0,1]=3 2121 B8R0.6 NCCCCC(N)CS MCULE-1078097453 [1,1,0,0,0,0|0,1,1]=4 2122 B8R0.6 NCCCC[C@H](N)CO MCULE-4735749396 [1,1,0,0,0,0|0,0,1]=3 2123 B8R0.6 NCCCC[C@H](N)CO MCULE-6997150748 [1,1,0,0,0,0|0,0,1]=3 2124 B8R0.6 NCCCC[C@H](N)CO MCULE-7936699760 [1,1,0,0,0,0|0,0,1]=3 2125 B8R0.6 NCCCC[C@H](N)CO MCULE-9135547877 [1,1,0,0,0,0|0,0,1]=3 2126 B8R0.6 NCCNCC(O)CO MCULE-4818647623 [1,1,0,0,0,0|1,0,1]=4 2127 B8R0.6 OCCCCC(O)CO MCULE-5891501842 [1,1,0,0,0,0|1,0,1]=4 2128 B8R0.5 C#CCC(N)CC(=O)O MCULE-2010410671 [1,1,0,0,0,0|0,0,2]=4 2129 B8R0.5 C#CCC(N)CC(=O)O MCULE-9655976746 [1,1,0,0,0,0|0,0,2]=4 2130 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-1849013560 [1,1,0,0,0,0|0,0,2]=4 2131 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-5050240935 [1,1,0,0,0,0|0,0,2]=4 2132 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-7394019004 [1,1,0,0,0,0|0,0,2]=4 2133 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-8376747540 [1,1,0,0,0,0|0,0,2]=4 2134 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-1446527937 [1,1,0,0,0,0|0,0,2]=4 2135 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-4559086818 [1,1,0,0,0,0|0,0,2]=4 2136 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-5154381271 [1,1,0,0,0,0|0,0,2]=4 2137 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-9666448400 [1,1,0,0,0,0|0,0,2]=4 2138 B8R0.5 C/C=C/C(O)CC(=O)O MCULE-3416519692 [1,1,0,0,0,0|0,0,2]=4 2139 B8R0.5 C=C(C)CC(C)CCC MCULE-7442491404 [1,1,0,0,0,0|2,0,0]=4 2140 B8R0.5 C=C(CCC)CC(=O)O MCULE-5240115049 [1,1,0,0,0,0|0,0,1]=3 2141 B8R0.5 C=CCC(N)CC(=O)O MCULE-1468461223 [1,1,0,0,0,0|0,0,2]=4 2142 B8R0.5 C=CCC(N)CC(=O)O MCULE-3288937491 [1,1,0,0,0,0|0,0,2]=4 2143 B8R0.5 C=CCC(N)CC(=O)O MCULE-4022730599 [1,1,0,0,0,0|0,0,2]=4 2144 B8R0.5 C=CCC(N)CC(=O)O MCULE-5843795649 [1,1,0,0,0,0|0,0,2]=4 2145 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-4754294062 [1,1,0,0,0,0|0,0,2]=4 2146 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-7831408077 [1,1,0,0,0,0|0,0,2]=4 2147 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-8503288377 [1,1,0,0,0,0|0,0,2]=4 2148 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-9398972010 [1,1,0,0,0,0|0,0,2]=4 2149 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-1784444892 [1,1,0,0,0,0|0,0,2]=4 2150 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-3247296447 [1,1,0,0,0,0|0,0,2]=4 2151 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-5484030094 [1,1,0,0,0,0|0,0,2]=4 2152 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-8982980423 [1,1,0,0,0,0|0,0,2]=4 2153 B8R0.5 CC=CC(O)CC(=O)O MCULE-9449456878 [1,1,0,0,0,0|0,0,2]=4 2154 B8R0.5 CCC/C(=C/C(=O)O)/C MCULE-2055195599 [1,1,0,0,0,0|0,0,2]=4 2155 B8R0.5 CCCC(=CC(=O)O)C MCULE-9033187683 [1,1,0,0,0,0|0,0,2]=4 2156 B8R0.5 CCCC(=O)CC(=O)C MCULE-1126963023 [1,1,0,0,0,0|1,0,1]=4 2157 B8R0.5 CCCC(=O)CC(=O)O MCULE-8977313826 [1,1,0,0,0,0|0,0,1]=3 2158 B8R0.5 CCCC(C)CC(=O)C MCULE-7925360299 [1,1,0,0,0,0|1,0,0]=3 2159 B8R0.5 CCCC(C)CC(=O)O MCULE-6002154473 [1,1,0,0,0,0|0,0,0]=2 2160 B8R0.5 CCCC(C)CC(C)O MCULE-3968478752 [1,1,0,0,0,0|1,0,1]=4 2161 B8R0.5 CCCC(C)OC(=O)C MCULE-2841775696 [1,1,0,0,0,0|2,0,0]=4 2162 B8R0.5 CCCC(C)OC(=O)Cl MCULE-8719460411 [1,1,0,0,0,0|2,0,0]=4 2163 B8R0.5 CCCC(C)OC(=O)N MCULE-5471819133 [1,1,0,0,0,0|2,0,0]=4 2164 B8R0.5 CCCC(N)CC(=O)O MCULE-1356349547 [1,1,0,0,0,0|0,0,0]=2 2165 B8R0.5 CCCC(N)CC(=O)O MCULE-4946770886 [1,1,0,0,0,0|0,0,0]=2 2166 B8R0.5 CCCC(N)CC(=O)O MCULE-5502250330 [1,1,0,0,0,0|0,0,0]=2 2167 B8R0.5 CCCC(N)CC(=O)O MCULE-9959180111 [1,1,0,0,0,0|0,0,0]=2 2168 B8R0.5 CCCC(O)CC(=O)O MCULE-3158579605 [1,1,0,0,0,0|0,0,0]=2 2169 B8R0.5 CCCN(C)CC(=O)O MCULE-2690950295 [1,1,0,0,0,0|1,0,0]=3 2170 B8R0.5 CCCN(C)CC(=O)O MCULE-9588106269 [1,1,0,0,0,0|1,0,0]=3 2171 B8R0.5 CCCS(=O)CC(=O)O MCULE-4278595326 [1,1,0,0,0,0|1,0,0]=3 2172 B8R0.5 CCC[C@@H](N)CC(=O)O MCULE-9961668094 [1,1,0,0,0,0|0,0,0]=2 2173 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-1726586898 [1,1,0,0,0,0|0,0,0]=2 2174 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5359238908 [1,1,0,0,0,0|0,0,0]=2 2175 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5593873511 [1,1,0,0,0,0|0,0,0]=2 2176 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-7588873691 [1,1,0,0,0,0|0,0,0]=2 2177 B8R0.5 CCNC(=O)CC(=O)O MCULE-6073095545 [1,1,0,0,0,0|1,0,1]=4 2178 B8R0.5 CCNC(C)CC(=O)O MCULE-2938286546 [1,1,0,0,0,0|1,0,0]=3 2179 B8R0.5 CCNC(C)CC(=O)O MCULE-4848873654 [1,1,0,0,0,0|1,0,0]=3 2180 B8R0.5 CCOC(=O)CC(=O)O MCULE-9495505919 [1,1,0,0,0,0|1,0,1]=4 2181 B8R0.5 CCSC(C)CC(=O)O MCULE-9735540046 [1,1,0,0,0,0|1,0,0]=3 2182 B8R0.5 CN(CCO)CC(=O)O MCULE-9266824629 [1,1,0,0,0,0|2,0,0]=4 2183 B8R0.5 CNCC(O)CC(=O)O MCULE-4502865855 [1,1,0,0,0,0|1,0,0]=3 2184 B8R0.5 CNCC(O)CC(=O)O MCULE-5628718703 [1,1,0,0,0,0|1,0,0]=3 2185 B8R0.5 COCC(C)CC(=O)O MCULE-7551495663 [1,1,0,0,0,0|1,0,0]=3 2186 B8R0.5 NCCC(O)CC(=O)O MCULE-3095949832 [1,1,0,0,0,0|0,0,0]=2 2187 B8R0.5 NCCC(O)CC(=O)O MCULE-8864780829 [1,1,0,0,0,0|0,0,0]=2 2188 B8R0.8 C#CCCC(N)C(=O)O MCULE-2306841483 [1,1,0,0,0,0|0,0,2]=4 2189 B8R0.8 C#CCCC(O)C(=O)O MCULE-1983462487 [1,1,0,0,0,0|0,0,2]=4 2190 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-3328230047 [1,1,0,0,0,0|0,0,2]=4 2191 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-8588363102 [1,1,0,0,0,0|0,0,2]=4 2192 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-3269292516 [1,1,0,0,0,0|0,0,2]=4 2193 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6769399323 [1,1,0,0,0,0|0,0,2]=4 2194 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6930343823 [1,1,0,0,0,0|0,0,2]=4 2195 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-9522590396 [1,1,0,0,0,0|0,0,2]=4 2196 B8R0.8 C(N)(CCCC)C(=O)N MCULE-1406613793 [1,1,0,0,0,0|1,0,0]=3 2197 B8R0.8 C(N)(CCCC)C(=O)N MCULE-4692008742 [1,1,0,0,0,0|1,0,0]=3 2198 B8R0.8 C=CCCC(C)C(=O)O MCULE-3089071984 [1,1,0,0,0,0|0,0,2]=4 2199 B8R0.8 C=CCCC(N)C(=O)O MCULE-1524160350 [1,1,0,0,0,0|0,0,2]=4 2200 B8R0.8 C=CCCC(N)C(=O)O MCULE-5522822192 [1,1,0,0,0,0|0,0,2]=4 2201 B8R0.8 C=CCCC(N)C(=O)O MCULE-7998584890 [1,1,0,0,0,0|0,0,2]=4 2202 B8R0.8 C=CCC[C@@H](N)C(=O)O MCULE-4571532321 [1,1,0,0,0,0|0,0,2]=4 2203 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-2235047291 [1,1,0,0,0,0|0,0,2]=4 2204 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-4644458098 [1,1,0,0,0,0|0,0,2]=4 2205 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-7821274952 [1,1,0,0,0,0|0,0,2]=4 2206 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-9807212949 [1,1,0,0,0,0|0,0,2]=4 2207 B8R0.8 CC#CCC(N)C(=O)O MCULE-2943446929 [1,1,0,0,0,0|0,0,2]=4 2208 B8R0.8 CC#CCC(N)C(=O)O MCULE-8126081664 [1,1,0,0,0,0|0,0,2]=4 2209 B8R0.8 CC#CC[C@@H](N)C(=O)O MCULE-5156383275 [1,1,0,0,0,0|0,0,2]=4 2210 B8R0.8 CC#CC[C@H](N)C(=O)O MCULE-4618959735 [1,1,0,0,0,0|0,0,2]=4 2211 B8R0.8 CC#CC[C@H](N)C(=O)O MCULE-7818390064 [1,1,0,0,0,0|0,0,2]=4 2212 B8R0.8 CC(CCCCl)C(=O)O MCULE-6504631587 [1,1,0,0,0,0|1,0,0]=3 2213 B8R0.8 CC(OCCN)C(=O)O MCULE-4117277894 [1,1,0,0,0,0|1,0,0]=3 2214 B8R0.8 CC(OCCN)C(=O)O MCULE-6407651037 [1,1,0,0,0,0|1,0,0]=3 2215 B8R0.8 CC(OCCO)C(=O)O MCULE-4305620136 [1,1,0,0,0,0|2,0,0]=4 2216 B8R0.8 CCC/C=C(\C)/C(=O)O MCULE-4080682767 [1,1,0,0,0,0|0,0,2]=4 2217 B8R0.8 CCCC=C(C)C(=O)O MCULE-1072900673 [1,1,0,0,0,0|0,0,2]=4 2218 B8R0.8 CCCCC(=O)C(=O)C MCULE-5957201570 [1,1,0,0,0,0|1,0,1]=4 2219 B8R0.8 CCCCC(=O)C(=O)O MCULE-7796922508 [1,1,0,0,0,0|0,0,1]=3 2220 B8R0.8 CCCCC(=O)C(=O)[O-] MCULE-4575533706 [1,1,0,0,0,0|0,0,2]=4 2221 B8R0.8 CCCCC(Br)C(=O)N MCULE-9831415558 [1,1,0,0,0,0|1,0,0]=3 2222 B8R0.8 CCCCC(Br)C(=O)O MCULE-5428502537 [1,1,0,0,0,0|0,0,0]=2 2223 B8R0.8 CCCCC(C)C(=O)C MCULE-2303839464 [1,1,0,0,0,0|1,0,0]=3 2224 B8R0.8 CCCCC(C)C(=O)Cl MCULE-1718383314 [1,1,0,0,0,0|1,0,0]=3 2225 B8R0.8 CCCCC(C)C(=O)N MCULE-6062124512 [1,1,0,0,0,0|1,0,0]=3 2226 B8R0.8 CCCCC(C)C(=O)O MCULE-7933263354 [1,1,0,0,0,0|0,0,0]=2 2227 B8R0.8 CCCCC(C)C(C)O MCULE-2881990446 [1,1,0,0,0,0|1,0,1]=4 2228 B8R0.8 CCCCC(F)C(=O)O MCULE-2276381656 [1,1,0,0,0,0|0,0,0]=2 2229 B8R0.8 CCCCC(N)C(=O)C MCULE-2471947344 [1,1,0,0,0,0|1,0,0]=3 2230 B8R0.8 CCCCC(N)C(=O)C MCULE-4947552776 [1,1,0,0,0,0|1,0,0]=3 2231 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [1,1,0,0,0,0|0,0,0]=2 2232 B8R0.8 CCCCC(N)C(C)O MCULE-3645367149 [1,1,0,0,0,0|1,0,1]=4 2233 B8R0.8 CCCCC(N)C(C)O MCULE-4512291097 [1,1,0,0,0,0|1,0,1]=4 2234 B8R0.8 CCCCC(O)C(=O)N MCULE-1063256537 [1,1,0,0,0,0|1,0,0]=3 2235 B8R0.8 CCCCC(O)C(=O)O MCULE-2557585903 [1,1,0,0,0,0|0,0,0]=2 2236 B8R0.8 CCCCN(C)C(=O)Cl MCULE-6884962631 [1,1,0,0,0,0|2,0,0]=4 2237 B8R0.8 CCCC[C@@H](C)C(=O)O MCULE-3454696473 [1,1,0,0,0,0|0,0,0]=2 2238 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [1,1,0,0,0,0|0,0,0]=2 2239 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [1,1,0,0,0,0|0,0,0]=2 2240 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9016844851 [1,1,0,0,0,0|0,0,0]=2 2241 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9437190196 [1,1,0,0,0,0|0,0,0]=2 2242 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-1555661156 [1,1,0,0,0,0|1,0,0]=3 2243 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9202467107 [1,1,0,0,0,0|1,0,0]=3 2244 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9573872199 [1,1,0,0,0,0|1,0,0]=3 2245 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9773159994 [1,1,0,0,0,0|1,0,0]=3 2246 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [1,1,0,0,0,0|0,0,0]=2 2247 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [1,1,0,0,0,0|0,0,0]=2 2248 B8R0.8 CCCNC(=O)C(=O)O MCULE-6074987864 [1,1,0,0,0,0|1,0,1]=4 2249 B8R0.8 CCCOC(C)C(=O)O MCULE-4477829415 [1,1,0,0,0,0|1,0,0]=3 2250 B8R0.8 CCNCC(C)C(=O)O MCULE-3863191122 [1,1,0,0,0,0|1,0,0]=3 2251 B8R0.8 CCNCC(C)C(=O)O MCULE-4164323563 [1,1,0,0,0,0|1,0,0]=3 2252 B8R0.8 CCOCC(C)C(=O)O MCULE-5346959026 [1,1,0,0,0,0|1,0,0]=3 2253 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9199053225 [1,1,0,0,0,0|1,0,0]=3 2254 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9684903914 [1,1,0,0,0,0|1,0,0]=3 2255 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-6351196285 [1,1,0,0,0,0|1,0,0]=3 2256 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-7653589662 [1,1,0,0,0,0|1,0,0]=3 2257 B8R0.8 CCSCC(N)C(=O)O MCULE-9449250733 [1,1,0,0,0,0|1,0,0]=3 2258 B8R0.8 COCCC(C)C(=O)O MCULE-5066180613 [1,1,0,0,0,0|1,0,0]=3 2259 B8R0.8 COCCC(N)C(=O)N MCULE-4212561129 [1,1,0,0,0,0|2,0,0]=4 2260 B8R0.8 COCCC(N)C(=O)N MCULE-5370323024 [1,1,0,0,0,0|2,0,0]=4 2261 B8R0.8 COCCC(N)C(=O)O MCULE-3018605108 [1,1,0,0,0,0|1,0,0]=3 2262 B8R0.8 COCC[C@H](N)C(=O)O MCULE-6748608543 [1,1,0,0,0,0|1,0,0]=3 2263 B8R0.8 COCC[C@H](N)C(=O)O MCULE-8586358852 [1,1,0,0,0,0|1,0,0]=3 2264 B8R0.8 CSCCC(=O)C(=O)O MCULE-6752350933 [1,1,0,0,0,0|1,0,1]=4 2265 B8R0.8 CSCCC(N)C(=O)N MCULE-8379409756 [1,1,0,0,0,0|2,0,0]=4 2266 B8R0.8 CSCCC(N)C(=O)N MCULE-9130755274 [1,1,0,0,0,0|2,0,0]=4 2267 B8R0.8 CSCCC(N)C(=O)N MCULE-9536539093 [1,1,0,0,0,0|2,0,0]=4 2268 B8R0.8 CSCCC(N)C(=O)N MCULE-9630072876 [1,1,0,0,0,0|2,0,0]=4 2269 B8R0.8 CSCCC(N)C(=O)O MCULE-5626142345 [1,1,0,0,0,0|1,0,0]=3 2270 B8R0.8 CSCCC(O)C(=O)N MCULE-9019971815 [1,1,0,0,0,0|2,0,0]=4 2271 B8R0.8 CSCCC(O)C(=O)O MCULE-3684026487 [1,1,0,0,0,0|1,0,0]=3 2272 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-2209985195 [1,1,0,0,0,0|1,0,0]=3 2273 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-9944164883 [1,1,0,0,0,0|1,0,0]=3 2274 B8R0.8 CSCC[C@@H](N)C(=O)[O-] MCULE-2405585602 [1,1,0,0,0,0|1,0,1]=4 2275 B8R0.8 CSCC[C@@H](N)C(=O)[O-] MCULE-6869616866 [1,1,0,0,0,0|1,0,1]=4 2276 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-1318828477 [1,1,0,0,0,0|2,0,0]=4 2277 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-2645914311 [1,1,0,0,0,0|2,0,0]=4 2278 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-4676970409 [1,1,0,0,0,0|2,0,0]=4 2279 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-6619857551 [1,1,0,0,0,0|2,0,0]=4 2280 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-3383932641 [1,1,0,0,0,0|1,0,0]=3 2281 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-4603455639 [1,1,0,0,0,0|1,0,0]=3 2282 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-7228063662 [1,1,0,0,0,0|1,0,0]=3 2283 B8R0.8 C[Se]CCC(N)C(=O)O MCULE-9212969564 [1,1,0,0,0,0|1,0,0]=3 2284 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5333020269 [1,1,0,0,0,0|1,0,0]=3 2285 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5980340572 [1,1,0,0,0,0|1,0,0]=3 2286 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [1,1,0,0,0,0|1,0,0]=3 2287 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [1,1,0,0,0,0|0,0,0]=2 2288 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [1,1,0,0,0,0|0,0,0]=2 2289 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [1,1,0,0,0,0|0,0,0]=2 2290 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [1,1,0,0,0,0|0,0,0]=2 2291 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [1,1,0,0,0,0|0,0,0]=2 2292 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [1,1,0,0,0,0|0,0,0]=2 2293 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [1,1,0,0,0,0|0,0,0]=2 2294 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [1,1,0,0,0,0|0,0,0]=2 2295 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [1,1,0,0,0,0|0,0,0]=2 2296 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [1,1,0,0,0,0|0,0,0]=2 2297 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [1,1,0,0,0,0|0,0,0]=2 2298 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [1,1,0,0,0,0|0,0,0]=2 2299 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [1,1,0,0,0,0|0,0,0]=2 2300 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [1,1,0,0,0,0|0,0,0]=2 2301 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [1,1,0,0,0,0|0,0,0]=2 2302 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [1,1,0,0,0,0|0,0,0]=2 2303 B8R0.8 NOCCC(N)C(=O)O MCULE-1540658941 [1,1,0,0,0,0|1,0,0]=3 2304 B8R0.8 NOCCC(N)C(=O)O MCULE-3729513992 [1,1,0,0,0,0|1,0,0]=3 2305 B8R0.8 NOCC[C@@H](N)C(=O)O MCULE-3273727827 [1,1,0,0,0,0|1,0,0]=3 2306 B8R0.8 NOCC[C@H](N)C(=O)O MCULE-2315172974 [1,1,0,0,0,0|1,0,0]=3 2307 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [1,1,0,0,0,0|1,0,0]=3 2308 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [1,1,0,0,0,0|1,0,0]=3 2309 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [1,1,0,0,0,0|1,0,0]=3 2310 B8R0.8 O=C([O-])C(O)CCCO MCULE-5137868319 [1,1,0,0,0,0|1,0,1]=4 2311 B8R0.8 [C@@H](N)(CCC=C)C(=O)O MCULE-9648209291 [1,1,0,0,0,0|0,0,2]=4 2312 B8R0.8 [C@H](N)(CCON)C(=O)O MCULE-1309966773 [1,1,0,0,0,0|1,0,0]=3 2313 B8R0.9 C=CC(N)CCC(=O)O MCULE-3453656580 [1,1,0,0,0,0|0,0,2]=4 2314 B8R0.9 C=CC(N)CCC(=O)O MCULE-4435406748 [1,1,0,0,0,0|0,0,2]=4 2315 B8R0.9 C=C[C@@H](N)CCC(=O)O MCULE-5470042954 [1,1,0,0,0,0|0,0,2]=4 2316 B8R0.9 C=C[C@@H](N)CCC(=O)O MCULE-9017090012 [1,1,0,0,0,0|0,0,2]=4 2317 B8R0.9 C=C[C@H](N)CCC(=O)O MCULE-4615585642 [1,1,0,0,0,0|0,0,2]=4 2318 B8R0.9 CC(=O)NCC(C)CN MCULE-6305271563 [1,1,0,0,0,0|2,0,0]=4 2319 B8R0.9 CC(C#N)CCC(=O)O MCULE-6867167636 [1,1,0,0,0,0|0,0,2]=4 2320 B8R0.9 CC(CCl)CCC(=O)Cl MCULE-3716923938 [1,1,0,0,0,0|2,0,0]=4 2321 B8R0.9 CCC(=CCC(=O)O)C MCULE-3358969895 [1,1,0,0,0,0|0,0,2]=4 2322 B8R0.9 CCC(=O)CCC(=O)C MCULE-7923444653 [1,1,0,0,0,0|1,0,1]=4 2323 B8R0.9 CCC(=O)CCC(=O)O MCULE-4505750030 [1,1,0,0,0,0|0,0,1]=3 2324 B8R0.9 CCC(=O)NCC(=O)O MCULE-9173889437 [1,1,0,0,0,0|1,0,1]=4 2325 B8R0.9 CCC(C)CCC(=O)C MCULE-6498666006 [1,1,0,0,0,0|1,0,0]=3 2326 B8R0.9 CCC(C)CCC(=O)O MCULE-9270270979 [1,1,0,0,0,0|0,0,0]=2 2327 B8R0.9 CCC(C)CCC(C)O MCULE-4781356880 [1,1,0,0,0,0|1,0,1]=4 2328 B8R0.9 CCC(C)COC(=O)C MCULE-1846190306 [1,1,0,0,0,0|2,0,0]=4 2329 B8R0.9 CCC(C)COC(=O)Cl MCULE-7986633908 [1,1,0,0,0,0|2,0,0]=4 2330 B8R0.9 CCC(C)NCC(=O)O MCULE-1578825700 [1,1,0,0,0,0|1,0,0]=3 2331 B8R0.9 CCC(C)NCC(=O)O MCULE-8981987872 [1,1,0,0,0,0|1,0,0]=3 2332 B8R0.9 CCC(C)OCC(=O)O MCULE-8235265405 [1,1,0,0,0,0|1,0,0]=3 2333 B8R0.9 CCC(Cl)CCC(=O)Cl MCULE-3849391288 [1,1,0,0,0,0|1,0,0]=3 2334 B8R0.9 CCC(N)CCC(=O)O MCULE-3116763773 [1,1,0,0,0,0|0,0,0]=2 2335 B8R0.9 CCC(N)CCC(=O)O MCULE-9126260921 [1,1,0,0,0,0|0,0,0]=2 2336 B8R0.9 CCC(O)CCC(=O)O MCULE-1512608136 [1,1,0,0,0,0|0,0,0]=2 2337 B8R0.9 CCC(O)CCC(=O)[O-] MCULE-6831827135 [1,1,0,0,0,0|0,0,1]=3 2338 B8R0.9 CCN(C)CCC(=O)O MCULE-2510720087 [1,1,0,0,0,0|1,0,0]=3 2339 B8R0.9 CCN(C)CCC(=O)O MCULE-4192684079 [1,1,0,0,0,0|1,0,0]=3 2340 B8R0.9 CCS(=O)CCC(=O)O MCULE-4027618720 [1,1,0,0,0,0|1,0,0]=3 2341 B8R0.9 CC[C@H](N)C=CC(=O)O MCULE-8933495159 [1,1,0,0,0,0|0,0,2]=4 2342 B8R0.9 CNC(=O)CCC(=O)O MCULE-8340443315 [1,1,0,0,0,0|1,0,1]=4 2343 B8R0.9 COC(=O)CCC(=O)O MCULE-4083173324 [1,1,0,0,0,0|1,0,1]=4 2344 B8R0.9 COC(C)CCC(=O)O MCULE-5873043454 [1,1,0,0,0,0|1,0,0]=3 2345 B8R0.9 CSC(C)CCC(=O)O MCULE-3505570511 [1,1,0,0,0,0|1,0,0]=3 2346 B8R0.9 NCC(=O)CCC(=O)O MCULE-6371115085 [1,1,0,0,0,0|0,0,1]=3 2347 B8R0.9 NCC(=O)CCC(=O)O MCULE-8125179397 [1,1,0,0,0,0|0,0,1]=3 2348 B8R0.9 NCC(=O)CCC(=O)O MCULE-8676354165 [1,1,0,0,0,0|0,0,1]=3 2349 B8R0.9 NCC(=O)NCC(=O)O MCULE-1239116894 [1,1,0,0,0,0|1,0,1]=4 2350 B8R0.9 NCC(=O)NCC(=O)O MCULE-2139302839 [1,1,0,0,0,0|1,0,1]=4 2351 B8R0.9 NCC(N)CCC(=O)O MCULE-1054409990 [1,1,0,0,0,0|0,0,0]=2 2352 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-2916881042 [1,1,0,0,0,0|0,0,0]=2 2353 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-7249154843 [1,1,0,0,0,0|0,0,0]=2 2354 B8R0.9 NNC(=O)CCC(=O)O MCULE-7643180740 [1,1,0,0,0,0|1,0,1]=4 2355 B8R0.9 NNC(=O)CCC(=O)O MCULE-9888193887 [1,1,0,0,0,0|1,0,1]=4 2356 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-1233079264 [1,1,0,0,0,0|1,0,0]=3 2357 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-8091475267 [1,1,0,0,0,0|1,0,0]=3 2358 B8R0.9 O=C(O)CCC(=O)CBr MCULE-8373387398 [1,1,0,0,0,0|1,0,1]=4 2359 B8R0.9 O=C(O)CCP(=O)CO MCULE-3163541128 [1,1,0,0,0,0|2,0,0]=4 2360 B8R0.21 CCCCCC(C)(C)O MCULE-8173858480 [1,1,0,0,0,0|1,0,1]=4 2361 B8R0.21 CCCCCS(=O)(=O)Cl MCULE-6896424187 [1,1,0,0,0,0|1,0,1]=4 2362 B8R0.21 CCCCCS(=O)(=O)N MCULE-5002185424 [1,1,0,0,0,0|1,0,1]=4 2363 B8R0.21 CCCCCS(=O)(=O)O MCULE-3941343492 [1,1,0,0,0,0|1,0,0]=3 2364 B8R0.21 CCCCCS(=O)(=O)[O-] MCULE-8928036198 [1,1,0,0,0,0|1,0,1]=4 2365 B8R0.21 CCCCNS(=O)(=O)O MCULE-9277142869 [1,1,0,0,0,0|2,0,0]=4 2366 B8R0.21 CCCCOP(=O)(O)O MCULE-7637624598 [1,1,0,0,0,0|2,0,0]=4 2367 B8R0.21 COCCCS(=O)(=O)O MCULE-2207949915 [1,1,0,0,0,0|2,0,0]=4 2368 B8R0.21 CS(=O)(=O)CCCCN MCULE-2550166149 [1,1,0,0,0,0|1,0,1]=4 2369 B8R0.21 CS(=O)(=O)CCCCN MCULE-9182498058 [1,1,0,0,0,0|1,0,1]=4 2370 B8R0.21 NCCCCP(=O)(O)O MCULE-2632534074 [1,1,0,0,0,0|1,0,0]=3 2371 B8R0.21 NCCCCS(=O)(=O)N MCULE-1137234818 [1,1,0,0,0,0|1,0,1]=4 2372 B8R0.21 NCCCCS(=O)(=O)N MCULE-5156729166 [1,1,0,0,0,0|1,0,1]=4 2373 B8R0.21 NCCCSS(=O)(=O)O MCULE-5247150694 [1,1,0,0,0,0|2,0,0]=4 2374 B8R0.21 O=P(O)(O)CCCCBr MCULE-5686227952 [1,1,0,0,0,0|2,0,0]=4 2375 B8R0.21 O=S(=O)(O)CCCCO MCULE-7293075600 [1,1,0,0,0,0|2,0,0]=4 2376 B8R0.28 C=C(Br)CCCC(=O)O MCULE-5394609034 [1,1,0,0,0,0|0,0,2]=4 2377 B8R0.28 C=C(C)CCCC(=O)O MCULE-1282031449 [1,1,0,0,0,0|0,0,1]=3 2378 B8R0.28 C=C(C)CCCC(C)C MCULE-5830488183 [1,1,0,0,0,0|2,0,0]=4 2379 B8R0.28 C=C(Cl)CCCC(=O)O MCULE-9525654231 [1,1,0,0,0,0|0,0,2]=4 2380 B8R0.28 CC(=CCCC(=O)O)C MCULE-5848388333 [1,1,0,0,0,0|0,0,2]=4 2381 B8R0.28 CC(=O)CCCC(=O)C MCULE-9250637004 [1,1,0,0,0,0|1,0,1]=4 2382 B8R0.28 CC(=O)CCCC(=O)N MCULE-8753142022 [1,1,0,0,0,0|1,0,1]=4 2383 B8R0.28 CC(=O)CCCC(=O)O MCULE-2498129200 [1,1,0,0,0,0|0,0,1]=3 2384 B8R0.28 CC(=O)CCCC(C)C MCULE-7256575819 [1,1,0,0,0,0|1,0,0]=3 2385 B8R0.28 CC(=O)CCCN(C)C MCULE-8876627134 [1,1,0,0,0,0|2,0,0]=4 2386 B8R0.28 CC(=O)CCOC(C)C MCULE-5907441510 [1,1,0,0,0,0|2,0,0]=4 2387 B8R0.28 CC(=O)CNCC(C)C MCULE-3943786157 [1,1,0,0,0,0|2,0,0]=4 2388 B8R0.28 CC(=O)CNCC(C)C MCULE-9329085422 [1,1,0,0,0,0|2,0,0]=4 2389 B8R0.28 CC(=O)CSCC(C)C MCULE-1710631404 [1,1,0,0,0,0|2,0,0]=4 2390 B8R0.28 CC(=O)NCCC(=O)O MCULE-8867286578 [1,1,0,0,0,0|1,0,1]=4 2391 B8R0.28 CC(=O)NCCC(C)C MCULE-7572826846 [1,1,0,0,0,0|2,0,0]=4 2392 B8R0.28 CC(=O)OCCC(=O)O MCULE-6617841906 [1,1,0,0,0,0|1,0,1]=4 2393 B8R0.28 CC(=O)OCCC(C)C MCULE-3274854886 [1,1,0,0,0,0|2,0,0]=4 2394 B8R0.28 CC(=O)SCCC(=O)O MCULE-2263963171 [1,1,0,0,0,0|1,0,1]=4 2395 B8R0.28 CC(C)/C=C/CC(=O)O MCULE-6288178603 [1,1,0,0,0,0|0,0,2]=4 2396 B8R0.28 CC(C)C=CCC(=O)O MCULE-1057297040 [1,1,0,0,0,0|0,0,2]=4 2397 B8R0.28 CC(C)CC=CC(=O)O MCULE-4966710694 [1,1,0,0,0,0|0,0,2]=4 2398 B8R0.28 CC(C)CCCC(=O)O MCULE-3645348479 [1,1,0,0,0,0|0,0,0]=2 2399 B8R0.28 CC(C)CCCC(C)O MCULE-6655675430 [1,1,0,0,0,0|1,0,1]=4 2400 B8R0.28 CC(C)CCCN(=O)=O MCULE-2817926193 [1,1,0,0,0,0|1,0,1]=4 2401 B8R0.28 CC(C)CCNC(=O)N MCULE-7857218878 [1,1,0,0,0,0|2,0,0]=4 2402 B8R0.28 CC(C)CCOC(=O)Cl MCULE-1140125816 [1,1,0,0,0,0|2,0,0]=4 2403 B8R0.28 CC(C)CNCC(=O)N MCULE-6834225327 [1,1,0,0,0,0|2,0,0]=4 2404 B8R0.28 CC(C)CNCC(=O)N MCULE-8464570977 [1,1,0,0,0,0|2,0,0]=4 2405 B8R0.28 CC(C)CNCC(=O)O MCULE-4695293444 [1,1,0,0,0,0|1,0,0]=3 2406 B8R0.28 CC(C)CNCC(=O)O MCULE-9936739681 [1,1,0,0,0,0|1,0,0]=3 2407 B8R0.28 CC(C)COCC(=O)N MCULE-8148336060 [1,1,0,0,0,0|2,0,0]=4 2408 B8R0.28 CC(C)COCC(=O)O MCULE-8643896966 [1,1,0,0,0,0|1,0,0]=3 2409 B8R0.28 CC(C)CSCC(=O)O MCULE-5182400762 [1,1,0,0,0,0|1,0,0]=3 2410 B8R0.28 CC(C)NCCC(=O)N MCULE-4812986605 [1,1,0,0,0,0|2,0,0]=4 2411 B8R0.28 CC(C)NCCC(=O)O MCULE-2087792459 [1,1,0,0,0,0|1,0,0]=3 2412 B8R0.28 CC(C)NCCC(=O)O MCULE-6893587807 [1,1,0,0,0,0|1,0,0]=3 2413 B8R0.28 CC(C)OCCC(=O)O MCULE-6533666992 [1,1,0,0,0,0|1,0,0]=3 2414 B8R0.28 CC(C)SCCC(=O)O MCULE-1434094352 [1,1,0,0,0,0|1,0,0]=3 2415 B8R0.28 CC(Cl)CCCC(=O)Cl MCULE-6993455396 [1,1,0,0,0,0|1,0,0]=3 2416 B8R0.28 CC(O)CCCC(=O)O MCULE-6696855762 [1,1,0,0,0,0|0,0,0]=2 2417 B8R0.28 CC(O)CCCC(=O)[O-] MCULE-7722587632 [1,1,0,0,0,0|0,0,1]=3 2418 B8R0.28 CN(C)CCCC(=O)Cl MCULE-4211417336 [1,1,0,0,0,0|2,0,0]=4 2419 B8R0.28 CN(C)CCCC(=O)Cl MCULE-6854328742 [1,1,0,0,0,0|2,0,0]=4 2420 B8R0.28 CN(C)CCCC(=O)O MCULE-5562283434 [1,1,0,0,0,0|1,0,0]=3 2421 B8R0.28 CN(C)CCCC(=O)O MCULE-5657963851 [1,1,0,0,0,0|1,0,0]=3 2422 B8R0.28 N=C(N)NCCC(=O)O MCULE-6783592689 [1,1,0,0,0,0|1,0,1]=4 2423 B8R0.28 N=C(N)SCCC(=O)O MCULE-6820090813 [1,1,0,0,0,0|1,0,1]=4 2424 B8R0.28 N=C(N)SCCC(=O)O MCULE-9820250060 [1,1,0,0,0,0|1,0,1]=4 2425 B8R0.28 NC(=O)CCCC(=O)N MCULE-8380308624 [1,1,0,0,0,0|1,0,1]=4 2426 B8R0.28 NC(=O)CCCC(=O)O MCULE-9714346244 [1,1,0,0,0,0|0,0,1]=3 2427 B8R0.28 NC(=O)CNCC(=O)O MCULE-2816922286 [1,1,0,0,0,0|1,0,1]=4 2428 B8R0.28 NC(=O)COCC(=O)O MCULE-3868584388 [1,1,0,0,0,0|1,0,1]=4 2429 B8R0.28 NC(=O)CSCC(=O)O MCULE-1419621262 [1,1,0,0,0,0|1,0,1]=4 2430 B8R0.28 NC(=O)NCCC(=O)O MCULE-3799706782 [1,1,0,0,0,0|1,0,1]=4 2431 B8R0.28 NC(=S)SCCC(=O)O MCULE-1371836153 [1,1,0,0,0,0|1,0,1]=4 2432 B8R0.28 O=C(O)CCCC(=O)O MCULE-4286022994 [1,1,0,0,0,0|1,0,1]=4 2433 B8R0.28 O=C(O)CCCC(F)F MCULE-1906281877 [1,1,0,0,0,0|1,0,0]=3 2434 B8R0.28 O=C(O)CCCN(=O)=O MCULE-2601801792 [1,1,0,0,0,0|2,0,0]=4 2435 B8R0.28 O=C(O)COCC(F)F MCULE-2599944385 [1,1,0,0,0,0|2,0,0]=4 2436 B10R0.3 CCCC(=O)CCCC(=O)O MCULE-5554652459 [0,2,0,0,0,0|1,0,0]=3 2437 B10R0.3 CCCC(=O)NCCC(=O)O MCULE-9942655490 [0,2,0,0,0,0|1,0,1]=4 2438 B10R0.3 CCCC(C)CCCC(=O)C MCULE-6836595014 [0,2,0,0,0,0|2,0,0]=4 2439 B10R0.3 CCCC(C)CCCC(=O)O MCULE-9813732292 [0,2,0,0,0,0|1,0,0]=3 2440 B10R0.3 CCCC(C)CCOC(=O)C MCULE-7488303006 [0,2,0,0,0,0|2,0,0]=4 2441 B10R0.3 CCCC(O)CCCC(=O)O MCULE-6567242953 [0,2,0,0,0,0|1,0,0]=3 2442 B10R0.3 CCCC(S)CCOC(=O)C MCULE-9110387170 [0,2,0,0,0,0|2,0,0]=4 2443 B10R0.3 CCNC(=O)CCCC(=O)O MCULE-4769569674 [0,2,0,0,0,0|1,0,1]=4 2444 B10R0.3 CCOC(=O)CCCC(=O)O MCULE-2798972740 [0,2,0,0,0,0|1,0,1]=4 2445 B10R0.3 NCCC(=O)NCCC(=O)O MCULE-9840310477 [0,2,0,0,0,0|0,0,1]=3 2446 B10R0.57 CC[C@@H](C)[C@H](N)CCC(=O)O MCULE-6163799872 [0,2,0,0,0,0|1,0,0]=3 2447 B10R0.57 CC[C@@H](C)[C@H](N)CCC(=O)O MCULE-8974084013 [0,2,0,0,0,0|1,0,0]=3 2448 B10R0.57 NCC(=O)C(N)CCC(=O)O MCULE-6909697909 [0,2,0,0,0,0|0,0,1]=3 2449 B10R0.59 CCC(=O)CCCC(=O)OC MCULE-7955202588 [0,2,0,0,0,0|1,0,1]=4 2450 B10R0.59 CCC(C)NCCC(=O)OC MCULE-1748183130 [0,2,0,0,0,0|2,0,0]=4 2451 B10R0.65 CCC(C)(C)CCCC(=O)O MCULE-9915000352 [0,2,0,0,0,0|1,0,0]=3 2452 B10R0.77 CCN(CC)CCCC(=O)O MCULE-5832756552 [0,2,0,0,0,0|2,0,0]=4 2453 B10R0.77 CCN(CC)CCCC(=O)O MCULE-6485709585 [0,2,0,0,0,0|2,0,0]=4 2454 B10R0.82 NC(CCP(=O)CO)C(=O)O MCULE-2901685887 [0,2,0,0,0,0|2,0,0]=4 2455 B10R0.82 NCC(F)CCC(N)C(=O)O MCULE-5359725270 [0,2,0,0,0,0|0,0,0]=2 2456 B10R0.82 NCC(F)CCC(N)C(=O)O MCULE-7837362209 [0,2,0,0,0,0|0,0,0]=2 2457 B10R0.82 NCC(O)CCC(N)C(=O)O MCULE-6064290143 [0,2,0,0,0,0|0,0,0]=2 2458 B10R0.82 NCC(O)CCC(N)C(=O)O MCULE-6546706417 [0,2,0,0,0,0|0,0,0]=2 2459 B10R0.82 NCC(O)CC[C@H](N)C(=O)O MCULE-4925093695 [0,2,0,0,0,0|0,0,0]=2 2460 B10R0.82 NCC(O)CC[C@H](N)C(=O)O MCULE-7103430731 [0,2,0,0,0,0|0,0,0]=2 2461 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O MCULE-1390178110 [0,2,0,0,0,0|0,0,0]=2 2462 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O MCULE-7788161688 [0,2,0,0,0,0|0,0,0]=2 2463 B10R0.98 CC(=O)CCCC(C)C(=O)O MCULE-5760169093 [0,2,0,0,0,0|1,0,1]=4 2464 B10R0.98 CC(C)C(=O)CCCC(=O)O MCULE-1233637144 [0,2,0,0,0,0|1,0,1]=4 2465 B10R0.98 CC(C)CCCC(C)C(=O)O MCULE-3667108752 [0,2,0,0,0,0|1,0,0]=3 2466 B10R0.98 CC(C)CCCC(N)C(=O)O MCULE-5699505174 [0,2,0,0,0,0|1,0,0]=3 2467 B10R0.98 CC(C)CCCC(N)C(=O)O MCULE-8151358815 [0,2,0,0,0,0|1,0,0]=3 2468 B10R0.98 CC(C)CCC[C@H](N)C(=O)O MCULE-3341158972 [0,2,0,0,0,0|1,0,0]=3 2469 B10R0.98 CC(C)CCC[C@H](N)C(=O)O MCULE-6452147303 [0,2,0,0,0,0|1,0,0]=3 2470 B10R0.98 CC(C)CCOC(C)C(=O)O MCULE-3181346418 [0,2,0,0,0,0|2,0,0]=4 2471 B10R0.98 CC(N)CCCC(C)C(=O)O MCULE-5130020295 [0,2,0,0,0,0|0,0,0]=2 2472 B10R0.98 CC(N)CCCC(C)C(=O)O MCULE-6070288614 [0,2,0,0,0,0|0,0,0]=2 2473 B10R0.98 CN(C)CCC[C@H](N)C(=O)O MCULE-9481059271 [0,2,0,0,0,0|2,0,0]=4 2474 B10R0.98 C[C@H](N)C(=O)NCCC(=O)O MCULE-5592804189 [0,2,0,0,0,0|1,0,1]=4 2475 B10R0.98 N=C(N)NCCC(N)C(=O)O MCULE-2234773343 [0,2,0,0,0,0|1,0,1]=4 2476 B10R0.98 N=C(N)NCCC(N)C(=O)O MCULE-9635728361 [0,2,0,0,0,0|1,0,1]=4 2477 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O MCULE-5360635274 [0,2,0,0,0,0|1,0,1]=4 2478 B10R0.98 N=C(N)NCC[C@H](N)C(=O)O MCULE-7633853490 [0,2,0,0,0,0|1,0,1]=4 2479 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-3021567253 [0,2,0,0,0,0|1,0,1]=4 2480 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-7434229402 [0,2,0,0,0,0|1,0,1]=4 2481 B10R0.98 NC(CCCC(=O)O)C(=O)O MCULE-8474963048 [0,2,0,0,0,0|1,0,1]=4 2482 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O MCULE-1991686030 [0,2,0,0,0,0|1,0,1]=4 2483 B10R0.98 N[C@@H](CCCC(=O)O)C(=O)O MCULE-6053925503 [0,2,0,0,0,0|1,0,1]=4 2484 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O MCULE-3179500404 [0,2,0,0,0,0|1,0,1]=4 2485 B10R0.98 N[C@H](CCCC(=O)O)C(=O)O MCULE-9722366772 [0,2,0,0,0,0|1,0,1]=4 2486 B10R0.98 O=C(O)CCCC(O)C(=O)O MCULE-5970708862 [0,2,0,0,0,0|1,0,1]=4 2487 B10R0.98 O=C(O)CCC[C@H](O)C(=O)O MCULE-4157551693 [0,2,0,0,0,0|1,0,1]=4 2488 B10R0.4 C#CCCCCCCC(=O)O MCULE-9844370313 [0,2,0,0,0,0|1,0,0]=3 2489 B10R0.4 C#CCOCCOCC(=O)O MCULE-2117769924 [0,2,0,0,0,0|1,0,1]=4 2490 B10R0.4 C(=CC(=O)O)CCCCCC MCULE-5063564829 [0,2,0,0,0,0|1,0,0]=3 2491 B10R0.4 C=CCCCCCCC(=O)C MCULE-3952725967 [0,2,0,0,0,0|2,0,0]=4 2492 B10R0.4 C=CCCCCCCC(=O)O MCULE-3663585072 [0,2,0,0,0,0|1,0,0]=3 2493 B10R0.4 C=CCCCCCOC(=O)C MCULE-7198359038 [0,2,0,0,0,0|2,0,0]=4 2494 B10R0.4 C=CCOCCOCC(=O)O MCULE-8100852333 [0,2,0,0,0,0|1,0,1]=4 2495 B10R0.4 CC(=O)CCCCCCCO MCULE-6975960500 [0,2,0,0,0,0|2,0,0]=4 2496 B10R0.4 CC(=O)NCCCCCCN MCULE-6988947031 [0,2,0,0,0,0|1,0,0]=3 2497 B10R0.4 CC(=O)OCCCCCCBr MCULE-9658847674 [0,2,0,0,0,0|2,0,0]=4 2498 B10R0.4 CC(=O)OCCCCCCCl MCULE-2777138332 [0,2,0,0,0,0|2,0,0]=4 2499 B10R0.4 CC(=O)SCCCCCCN MCULE-6118060031 [0,2,0,0,0,0|1,0,0]=3 2500 B10R0.4 CC(=O)SCCCCCCN MCULE-7116355086 [0,2,0,0,0,0|1,0,0]=3 2501 B10R0.4 CCCCC/C=C/CC(=O)O MCULE-1378284129 [0,2,0,0,0,0|1,0,0]=3 2502 B10R0.4 CCCCCC/C=C/C(=O)O MCULE-8167234483 [0,2,0,0,0,0|1,0,0]=3 2503 B10R0.4 CCCCCC=CCC(=O)O MCULE-5507503933 [0,2,0,0,0,0|1,0,0]=3 2504 B10R0.4 CCCCCCC=CC(=O)C MCULE-7025674174 [0,2,0,0,0,0|2,0,0]=4 2505 B10R0.4 CCCCCCCCC(=O)C MCULE-6168357226 [0,2,0,0,0,0|2,0,0]=4 2506 B10R0.4 CCCCCCCCC(=O)Cl MCULE-7596715750 [0,2,0,0,0,0|2,0,0]=4 2507 B10R0.4 CCCCCCCCC(=O)N MCULE-6415702858 [0,2,0,0,0,0|2,0,0]=4 2508 B10R0.4 CCCCCCCCC(=O)O MCULE-4736597375 [0,2,0,0,0,0|1,0,0]=3 2509 B10R0.4 CCCCCCCCC(=O)[O-] MCULE-1077439841 [0,2,0,0,0,0|1,0,1]=4 2510 B10R0.4 CCCCCCCNC(=O)C MCULE-3916780915 [0,2,0,0,0,0|2,0,0]=4 2511 B10R0.4 CCCCCCCOC(=O)C MCULE-7061891812 [0,2,0,0,0,0|2,0,0]=4 2512 B10R0.4 CCCCCCCOC(=O)Cl MCULE-9018506867 [0,2,0,0,0,0|2,0,0]=4 2513 B10R0.4 CCCCCCNCC(=O)O MCULE-3361498309 [0,2,0,0,0,0|1,0,0]=3 2514 B10R0.4 CCCCCCOCC(=O)O MCULE-6951993364 [0,2,0,0,0,0|1,0,0]=3 2515 B10R0.4 CCCCCCSCC(=O)O MCULE-5086023021 [0,2,0,0,0,0|1,0,0]=3 2516 B10R0.4 CCCCOCCOC(=O)C MCULE-4906127008 [0,2,0,0,0,0|2,0,0]=4 2517 B10R0.4 CCCCSCCCC(=O)O MCULE-5928316679 [0,2,0,0,0,0|1,0,0]=3 2518 B10R0.4 CCOCCCCCC(=O)O MCULE-9514442276 [0,2,0,0,0,0|1,0,0]=3 2519 B10R0.4 CCOCCOCCC(=O)O MCULE-7483626719 [0,2,0,0,0,0|1,0,0]=3 2520 B10R0.4 COCCCNCCC(=O)N MCULE-2468408250 [0,2,0,0,0,0|2,0,0]=4 2521 B10R0.4 COCCCOCCC(=O)O MCULE-5178930362 [0,2,0,0,0,0|1,0,0]=3 2522 B10R0.4 CSCCCCCCC(=O)O MCULE-9976800222 [0,2,0,0,0,0|1,0,0]=3 2523 B10R0.4 N#N=NCCCCCC(=O)O MCULE-1473761098 [0,2,0,0,0,0|0,0,1]=3 2524 B10R0.4 N#N=NCCOCCC(=O)O MCULE-2033309776 [0,2,0,0,0,0|1,0,1]=4 2525 B10R0.4 NC(=O)CCCCCCCBr MCULE-4427479699 [0,2,0,0,0,0|2,0,0]=4 2526 B10R0.4 NCCCCCCCC(=O)O MCULE-2737882810 [0,2,0,0,0,0|0,0,0]=2 2527 B10R0.4 NCCCCCCCC(=O)O MCULE-4269382976 [0,2,0,0,0,0|0,0,0]=2 2528 B10R0.4 NCCCCCCNC(=O)O MCULE-3865214371 [0,2,0,0,0,0|0,0,0]=2 2529 B10R0.4 NCCCNCCCC(=O)O MCULE-2780784491 [0,2,0,0,0,0|0,0,0]=2 2530 B10R0.4 NCCCNCCCC(=O)O MCULE-8488597292 [0,2,0,0,0,0|0,0,0]=2 2531 B10R0.4 NCCOCCOCC(=O)O MCULE-8111157626 [0,2,0,0,0,0|0,0,0]=2 2532 B10R0.4 NCCOCCOCC(=O)O MCULE-9455562840 [0,2,0,0,0,0|0,0,0]=2 2533 B10R0.4 NCCSSCCNC(=O)O MCULE-5576549611 [0,2,0,0,0,0|1,0,0]=3 2534 B10R0.4 O=C(Cl)CCCCCCCBr MCULE-5775098735 [0,2,0,0,0,0|2,0,0]=4 2535 B10R0.4 O=C(O)CCCCCCCBr MCULE-6425557416 [0,2,0,0,0,0|1,0,0]=3 2536 B10R0.4 O=C(O)CCCCCCCO MCULE-1839591073 [0,2,0,0,0,0|1,0,0]=3 2537 B10R0.4 O=C(O)CCCCCCCS MCULE-6555950664 [0,2,0,0,0,0|1,0,0]=3 2538 B10R0.4 O=C(O)COCCOCCCl MCULE-2275317201 [0,2,0,0,0,0|1,0,0]=3 2539 B10R0.4 O=C(O)COCCOCCO MCULE-1507756107 [0,2,0,0,0,0|1,0,0]=3 2540 B10R0.4 O=C([O-])COCCOCCO MCULE-7695579733 [0,2,0,0,0,0|1,0,1]=4 2541 B10R0.4 O=CCCCCCCC(=O)O MCULE-3146118588 [0,2,0,0,0,0|1,0,0]=3 2542 B10R0.4 O=CNCCCCCC(=O)O MCULE-1392572274 [0,2,0,0,0,0|0,0,0]=2 2543 B10R0.6 CCCCCC(=O)CC(=O)C MCULE-8236892696 [0,2,0,0,0,0|2,0,0]=4 2544 B10R0.6 CCCCCC(C)CC(=O)C MCULE-9366517192 [0,2,0,0,0,0|2,0,0]=4 2545 B10R0.6 CCCCCC(C)CC(=O)O MCULE-2066533125 [0,2,0,0,0,0|1,0,0]=3 2546 B10R0.6 CCCCCC(C)OC(=O)Cl MCULE-6347220296 [0,2,0,0,0,0|2,0,0]=4 2547 B10R0.6 CCCCCC(N)CC(=O)O MCULE-1332766356 [0,2,0,0,0,0|1,0,0]=3 2548 B10R0.6 CCCCCC(N)CC(=O)O MCULE-6217126659 [0,2,0,0,0,0|1,0,0]=3 2549 B10R0.6 CCCCCC(O)CC(=O)O MCULE-4825961688 [0,2,0,0,0,0|1,0,0]=3 2550 B10R0.6 CCCCC[C@@H](O)CC(=O)O MCULE-2570880673 [0,2,0,0,0,0|1,0,0]=3 2551 B10R0.6 CCCCC[C@H](O)CC(=O)O MCULE-3222730819 [0,2,0,0,0,0|1,0,0]=3 2552 B10R0.6 CCCCC[C@H](O)CC(=O)O MCULE-6407518730 [0,2,0,0,0,0|1,0,0]=3 2553 B10R0.6 NCCCC[C@H](N)CC(=O)O MCULE-4895569973 [0,2,0,0,0,0|0,0,0]=2 2554 B10R0.6 NCCCC[C@H](N)CC(=O)O MCULE-7821167225 [0,2,0,0,0,0|0,0,0]=2 2555 B10R0.6 NCCCC[C@H](N)CC(=O)O MCULE-8763571530 [0,2,0,0,0,0|0,0,0]=2 2556 B10R0.6 NCCCC[C@H](N)CC(=O)O MCULE-9870503005 [0,2,0,0,0,0|0,0,0]=2 2557 B10R0.22 CCCCCCCP(=O)(O)O MCULE-4624203907 [0,2,0,0,0,0|2,0,0]=4 2558 B10R0.22 CCCCNCCS(=O)(=O)O MCULE-8200198538 [0,2,0,0,0,0|2,0,0]=4 2559 B10R0.22 CS(=O)(=S)OCCCCCN MCULE-6013549087 [0,2,0,0,0,0|1,1,0]=4 2560 B10R0.22 CS(=O)(=S)OCCCCCN MCULE-7180207362 [0,2,0,0,0,0|1,1,0]=4 2561 B10R0.22 NCCCCCCS(=O)(=O)O MCULE-3506394412 [0,2,0,0,0,0|1,0,0]=3 2562 B10R0.22 NCCNCCCS(=O)(=O)O MCULE-1519703013 [0,2,0,0,0,0|1,0,0]=3 2563 B10R0.22 NCCNCCC[Si](O)(O)O MCULE-4341273487 [0,2,0,0,0,0|0,1,1]=4 2564 B10R0.22 O=P(O)(O)CCCCCCBr MCULE-1779770763 [0,2,0,0,0,0|2,0,0]=4 2565 B10R0.55 CCC(=O)CCCCC(=O)O MCULE-8497826453 [0,2,0,0,0,0|1,0,0]=3 2566 B10R0.55 CCC(=O)NCCCC(=O)O MCULE-4434353680 [0,2,0,0,0,0|1,0,1]=4 2567 B10R0.55 CCC(C)CCCCC(=O)O MCULE-5735580085 [0,2,0,0,0,0|1,0,0]=3 2568 B10R0.55 CNC(=O)CCCCC(=O)O MCULE-3369426299 [0,2,0,0,0,0|0,0,1]=3 2569 B10R0.55 COC(=O)CCCCC(=O)C MCULE-8144817566 [0,2,0,0,0,0|1,0,1]=4 2570 B10R0.55 COC(=O)CCCCC(=O)Cl MCULE-8505175389 [0,2,0,0,0,0|1,0,1]=4 2571 B10R0.55 COC(=O)CCCCC(=O)O MCULE-2104484744 [0,2,0,0,0,0|1,0,1]=4 2572 B10R0.55 COC(=O)CCCCN(=O)=O MCULE-6729844099 [0,2,0,0,0,0|2,0,0]=4 2573 B10R0.55 COC(=O)CCNCC(C)C MCULE-2144072528 [0,2,0,0,0,0|2,0,0]=4 2574 B10R0.55 COC(=O)CSCCC(=S)N MCULE-7692304295 [0,2,0,0,0,0|1,0,1]=4 2575 B10R0.55 NC(=O)NCCC[C@H](N)CO MCULE-3843882509 [0,2,0,0,0,0|2,0,0]=4 2576 B10R0.55 NC(=O)NCCC[C@H](N)CO MCULE-6658263929 [0,2,0,0,0,0|2,0,0]=4 2577 B10R0.55 NCC(=O)NCCCC(=O)O MCULE-6161493754 [0,2,0,0,0,0|0,0,1]=3 2578 B10R0.55 O=C(O)CCCNC(=O)CCl MCULE-4514491154 [0,2,0,0,0,0|1,0,1]=4 2579 B10R0.74 C#CCCCCCC(=O)CBr MCULE-8428078872 [0,2,0,0,0,0|2,0,0]=4 2580 B10R0.74 C#CCCCCCC(=O)OC MCULE-3816855542 [0,2,0,0,0,0|1,0,0]=3 2581 B10R0.74 C=CC(=O)OCCCCCC MCULE-5221212930 [0,2,0,0,0,0|2,0,0]=4 2582 B10R0.74 C=CC(=O)OCCCCCO MCULE-8331922167 [0,2,0,0,0,0|2,0,0]=4 2583 B10R0.74 CCCCC/C=C/C(=O)OC MCULE-1812424019 [0,2,0,0,0,0|1,0,1]=4 2584 B10R0.74 CCCCCC#CC(=O)OC MCULE-8436103758 [0,2,0,0,0,0|1,0,1]=4 2585 B10R0.74 CCCCCC=CC(=O)OC MCULE-3787684558 [0,2,0,0,0,0|1,0,1]=4 2586 B10R0.74 CCCCCCCC(=O)CC MCULE-3418685291 [0,2,0,0,0,0|2,0,0]=4 2587 B10R0.74 CCCCCCCC(=O)NN MCULE-6629350924 [0,2,0,0,0,0|2,0,0]=4 2588 B10R0.74 CCCCCCCC(=O)NO MCULE-2604662374 [0,2,0,0,0,0|1,0,0]=3 2589 B10R0.74 CCCCCCCC(=O)N[O-] MCULE-1745709791 [0,2,0,0,0,0|1,0,1]=4 2590 B10R0.74 CCCCCCCC(=O)N[O-] MCULE-4610313780 [0,2,0,0,0,0|1,0,1]=4 2591 B10R0.74 CCCCCCCC(=O)OC MCULE-9368782203 [0,2,0,0,0,0|1,0,0]=3 2592 B10R0.74 CCCCCCNC(=O)CCl MCULE-9418401258 [0,2,0,0,0,0|2,0,0]=4 2593 B10R0.74 CCCCCCOC(=O)CC MCULE-7750085667 [0,2,0,0,0,0|2,0,0]=4 2594 B10R0.74 CCCCCCOC(=O)CCl MCULE-7320709801 [0,2,0,0,0,0|2,0,0]=4 2595 B10R0.74 CCCCCCOC(=O)CN MCULE-5357348178 [0,2,0,0,0,0|2,0,0]=4 2596 B10R0.74 CCCCCCOC(=O)CS MCULE-4845823799 [0,2,0,0,0,0|1,1,0]=4 2597 B10R0.74 CCCCCCOC(=O)C[NH3+] MCULE-4114261473 [0,2,0,0,0,0|2,0,0]=4 2598 B10R0.74 CCOCCSCC(=O)OC MCULE-6906722616 [0,2,0,0,0,0|2,0,0]=4 2599 B10R0.74 CNC(=O)CCNCCCO MCULE-4109393411 [0,2,0,0,0,0|2,0,0]=4 2600 B10R0.74 COC(=O)CCCCCC=O MCULE-1071696685 [0,2,0,0,0,0|1,0,0]=3 2601 B10R0.74 COC(=O)CCCCCCBr MCULE-5801566678 [0,2,0,0,0,0|1,0,0]=3 2602 B10R0.74 COC(=O)CCCCCCI MCULE-5629338002 [0,2,0,0,0,0|1,0,0]=3 2603 B10R0.74 COC(=O)CCCCCCN MCULE-3174162228 [0,2,0,0,0,0|0,0,0]=2 2604 B10R0.74 COC(=O)CCCCCCN MCULE-7552954472 [0,2,0,0,0,0|0,0,0]=2 2605 B10R0.74 COC(=O)CCCCCCO MCULE-1234987175 [0,2,0,0,0,0|1,0,0]=3 2606 B10R0.74 COC(=O)CCCCN=N#N MCULE-6501695945 [0,2,0,0,0,0|1,0,1]=4 2607 B10R0.74 COC(=O)CCNCCCO MCULE-4138256366 [0,2,0,0,0,0|1,0,0]=3 2608 B10R0.74 COC(=O)CCOCCCO MCULE-5017264772 [0,2,0,0,0,0|1,0,0]=3 2609 B10R0.74 COCCNCCC(=O)OC MCULE-2355570615 [0,2,0,0,0,0|2,0,0]=4 2610 B10R0.74 COCCOCCC(=O)OC MCULE-5131212223 [0,2,0,0,0,0|2,0,0]=4 2611 B10R0.74 NCC(=O)NCCCCCBr MCULE-2648430779 [0,2,0,0,0,0|2,0,0]=4 2612 B10R0.74 NCC(=O)NCCCCCBr MCULE-8496903301 [0,2,0,0,0,0|2,0,0]=4 2613 B10R0.74 NNC(=O)CCCCCCCl MCULE-4836054847 [0,2,0,0,0,0|2,0,0]=4 2614 B10R0.74 NNC(=O)CCNCCCO MCULE-4852442536 [0,2,0,0,0,0|2,0,0]=4 2615 B10R0.75 C=CCCCCC(N)C(=O)O MCULE-9003674294 [0,2,0,0,0,0|1,0,0]=3 2616 B10R0.75 C=CCCCC[C@@H](N)C(=O)O MCULE-5424595854 [0,2,0,0,0,0|1,0,0]=3 2617 B10R0.75 C=CCCCC[C@@H](N)C(=O)O MCULE-7894205841 [0,2,0,0,0,0|1,0,0]=3 2618 B10R0.75 C=CCCCC[C@H](N)C(=O)O MCULE-6386840550 [0,2,0,0,0,0|1,0,0]=3 2619 B10R0.75 C=CCCCC[C@H](N)C(=O)O MCULE-8206632491 [0,2,0,0,0,0|1,0,0]=3 2620 B10R0.75 CCCCCCC(=O)N(C)C MCULE-3501701523 [0,2,0,0,0,0|2,0,0]=4 2621 B10R0.75 CCCCCCC(Br)C(=O)Br MCULE-8391154868 [0,2,0,0,0,0|2,0,0]=4 2622 B10R0.75 CCCCCCC(Br)C(=O)O MCULE-3532642872 [0,2,0,0,0,0|1,0,0]=3 2623 B10R0.75 CCCCCCC(C)C(=O)C MCULE-2296587993 [0,2,0,0,0,0|2,0,0]=4 2624 B10R0.75 CCCCCCC(C)C(=O)Cl MCULE-4801747974 [0,2,0,0,0,0|2,0,0]=4 2625 B10R0.75 CCCCCCC(C)C(=O)O MCULE-6664640382 [0,2,0,0,0,0|1,0,0]=3 2626 B10R0.75 CCCCCCC(F)C(=O)O MCULE-3865739259 [0,2,0,0,0,0|1,0,0]=3 2627 B10R0.75 CCCCCCC(N)C(=O)O MCULE-2527731470 [0,2,0,0,0,0|1,0,0]=3 2628 B10R0.75 CCCCCCC(N)C(=O)O MCULE-5498377990 [0,2,0,0,0,0|1,0,0]=3 2629 B10R0.75 CCCCCCC(O)C(=O)O MCULE-1679305682 [0,2,0,0,0,0|1,0,0]=3 2630 B10R0.75 CCCCCC[C@@H](N)C(=O)O MCULE-9163680563 [0,2,0,0,0,0|1,0,0]=3 2631 B10R0.75 CCCCCC[C@@H](N)C(=O)O MCULE-9959237270 [0,2,0,0,0,0|1,0,0]=3 2632 B10R0.75 CCCCCC[C@H](N)C(=O)O MCULE-6660531044 [0,2,0,0,0,0|1,0,0]=3 2633 B10R0.75 CCCCCC[C@H](N)C(=O)O MCULE-7151037911 [0,2,0,0,0,0|1,0,0]=3 2634 B10R0.75 CCCCSC[C@@H](N)C(=O)O MCULE-8737283640 [0,2,0,0,0,0|1,0,0]=3 2635 B10R0.75 CCCCSC[C@H](N)C(=O)O MCULE-5383064231 [0,2,0,0,0,0|1,0,0]=3 2636 B10R0.75 CCOCCOC(C)C(=O)O MCULE-1855650459 [0,2,0,0,0,0|2,0,0]=4 2637 B10R0.75 CNCCCCC(N)C(=O)O MCULE-5703952072 [0,2,0,0,0,0|0,0,0]=2 2638 B10R0.75 CNCCCCC(N)C(=O)O MCULE-8267439974 [0,2,0,0,0,0|0,0,0]=2 2639 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-4130643324 [0,2,0,0,0,0|0,0,0]=2 2640 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-5394599260 [0,2,0,0,0,0|0,0,0]=2 2641 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-6328038825 [0,2,0,0,0,0|0,0,0]=2 2642 B10R0.75 CNCCCC[C@H](N)C(=O)O MCULE-6736060504 [0,2,0,0,0,0|0,0,0]=2 2643 B10R0.75 COCCSCC(N)C(=O)O MCULE-1808987613 [0,2,0,0,0,0|2,0,0]=4 2644 B10R0.75 N#CCCSCC(N)C(=O)O MCULE-3478080944 [0,2,0,0,0,0|0,0,2]=4 2645 B10R0.75 NC(CCNCC=O)C(=O)O MCULE-6659524915 [0,2,0,0,0,0|1,0,1]=4 2646 B10R0.75 NC(CSCCCO)C(=O)O MCULE-6250464318 [0,2,0,0,0,0|1,0,0]=3 2647 B10R0.75 NCCCCC[C@@H](N)C(=O)O MCULE-7846811170 [0,2,0,0,0,0|0,0,0]=2 2648 B10R0.75 NCCCCC[C@@H](N)C(=O)O MCULE-8562914837 [0,2,0,0,0,0|0,0,0]=2 2649 B10R0.75 NCCCCC[C@H](N)C(=O)O MCULE-4522889843 [0,2,0,0,0,0|0,0,0]=2 2650 B10R0.75 NCCCCC[C@H](N)C(=O)O MCULE-9026496023 [0,2,0,0,0,0|0,0,0]=2 2651 B10R0.75 NCCCSC[C@H](N)C(=O)O MCULE-9670718396 [0,2,0,0,0,0|0,0,0]=2 2652 B10R0.75 NCCC[Se]C[C@H](N)C(=O)O MCULE-4318104451 [0,2,0,0,0,0|0,0,0]=2 2653 B10R0.75 NCCO/C=C/[C@H](N)C(=O)O MCULE-3843418907 [0,2,0,0,0,0|0,0,2]=4 2654 B10R0.75 NCCO/C=C/[C@H](N)C(=O)O MCULE-9640707026 [0,2,0,0,0,0|0,0,2]=4 2655 B10R0.75 NCCOC=CC(N)C(=O)O MCULE-1542354581 [0,2,0,0,0,0|0,0,2]=4 2656 B10R0.75 NCCOC=C[C@H](N)C(=O)O MCULE-5022414897 [0,2,0,0,0,0|0,0,2]=4 2657 B10R0.75 NCCOC=C[C@H](N)C(=O)O MCULE-6783991597 [0,2,0,0,0,0|0,0,2]=4 2658 B10R0.75 N[C@@H](CCSCCO)C(=O)O MCULE-2974080305 [0,2,0,0,0,0|1,0,0]=3 2659 B10R0.75 N[C@@H](CSCCCO)C(=O)O MCULE-1323141415 [0,2,0,0,0,0|1,0,0]=3 2660 B10R0.75 N[C@@H](CSCCCO)C(=O)O MCULE-8256841743 [0,2,0,0,0,0|1,0,0]=3 2661 B10R0.75 N[C@@H](CSSCCO)C(=O)O MCULE-7717227685 [0,2,0,0,0,0|2,0,0]=4 2662 B10R0.75 O=C(O)C(=O)CCCCCCl MCULE-5263490690 [0,2,0,0,0,0|1,0,0]=3 2663 B10R0.75 [N-]=[N+]=NCCC[C@@H](N)C(=O)O MCULE-2902827107 [0,2,0,0,0,0|1,0,1]=4 2664 B10R0.75 [N-]=[N+]=NCCC[C@@H]([NH3+])C(=O)O MCULE-7342778742 [0,2,0,0,0,0|1,0,1]=4 2665 B10R0.75 [N-]=[N+]=NCCC[C@H](N)C(=O)O MCULE-6058924639 [0,2,0,0,0,0|1,0,1]=4 2666 B10R0.75 [N-]=[N+]=NCCC[C@H](N)C(=O)O MCULE-6632469133 [0,2,0,0,0,0|1,0,1]=4 2667 B10R0.75 [N-]=[N+]=NCCC[C@H](N)C(=O)O MCULE-7192387796 [0,2,0,0,0,0|1,0,1]=4 2668 B10R0.75 [N-]=[N+]=NCCC[C@H]([NH3+])C(=O)O MCULE-6281928342 [0,2,0,0,0,0|1,0,1]=4 2669 B10R0.78 C#CCCC(=O)CCC(=O)O MCULE-9596963824 [0,2,0,0,0,0|1,0,1]=4 2670 B10R0.78 CCCCC(=O)CCC(=O)O MCULE-7337930692 [0,2,0,0,0,0|1,0,0]=3 2671 B10R0.78 CCCCC(=O)NCC(=O)O MCULE-9839707919 [0,2,0,0,0,0|1,0,1]=4 2672 B10R0.78 CCCCC(C)CCC(=O)O MCULE-2454273176 [0,2,0,0,0,0|1,0,0]=3 2673 B10R0.78 CCCCC(N)CCC(=O)O MCULE-2622598542 [0,2,0,0,0,0|1,0,0]=3 2674 B10R0.78 CCCCC(N)CCC(=O)O MCULE-5683869807 [0,2,0,0,0,0|1,0,0]=3 2675 B10R0.78 CCCCC(O)CCC(=O)O MCULE-6806538778 [0,2,0,0,0,0|1,0,0]=3 2676 B10R0.78 CCCCC(O)CCC(=O)[O-] MCULE-9148086354 [0,2,0,0,0,0|1,0,1]=4 2677 B10R0.78 CCCCN(C)CCC(=O)Cl MCULE-7206863872 [0,2,0,0,0,0|2,0,0]=4 2678 B10R0.78 CCCCN(C)CCC(=O)Cl MCULE-9921667039 [0,2,0,0,0,0|2,0,0]=4 2679 B10R0.78 CCCCN(C)CCC(=O)O MCULE-3286714152 [0,2,0,0,0,0|1,0,0]=3 2680 B10R0.78 CCCCS(=O)CCC(=O)O MCULE-7420971633 [0,2,0,0,0,0|1,0,0]=3 2681 B10R0.78 CCCC[C@H](C)CCC(=O)O MCULE-4790339661 [0,2,0,0,0,0|1,0,0]=3 2682 B10R0.78 CCCNC(=O)CCC(=O)O MCULE-3093591706 [0,2,0,0,0,0|1,0,1]=4 2683 B10R0.78 COCCN(C)CCC(=O)O MCULE-2595956640 [0,2,0,0,0,0|2,0,0]=4 2684 B10R0.78 COCCN(C)CCC(=O)O MCULE-5654625094 [0,2,0,0,0,0|2,0,0]=4 2685 B10R0.78 O=C(O)CCC(=O)NCCO MCULE-4471208897 [0,2,0,0,0,0|1,0,1]=4 2686 B10R0.78 O=CCCC(=O)CCC(=O)O MCULE-4413858827 [0,2,0,0,0,0|1,0,1]=4 2687 B10R0.97 C=C(Br)CCCCCC(=O)O MCULE-1129581582 [0,2,0,0,0,0|1,0,0]=3 2688 B10R0.97 C=C(C)CCCCCC(=O)O MCULE-6091105789 [0,2,0,0,0,0|1,0,0]=3 2689 B10R0.97 C=C(Cl)CCCCCC(=O)O MCULE-6548751857 [0,2,0,0,0,0|1,0,0]=3 2690 B10R0.97 CC(=CCCCCC(=O)O)C MCULE-6679290438 [0,2,0,0,0,0|1,0,1]=4 2691 B10R0.97 CC(=O)CCCCCC(=O)Cl MCULE-9699420066 [0,2,0,0,0,0|2,0,0]=4 2692 B10R0.97 CC(=O)CCCCCC(=O)O MCULE-4488400468 [0,2,0,0,0,0|1,0,0]=3 2693 B10R0.97 CC(=O)NCCCCC(=O)O MCULE-6323800073 [0,2,0,0,0,0|1,0,1]=4 2694 B10R0.97 CC(C)CCCCCC(=O)O MCULE-6934503036 [0,2,0,0,0,0|1,0,0]=3 2695 B10R0.97 CC(C)CCCOCC(=O)O MCULE-7389478050 [0,2,0,0,0,0|1,0,0]=3 2696 B10R0.97 CC(O)CCCCCC(=O)O MCULE-8533691013 [0,2,0,0,0,0|1,0,0]=3 2697 B10R0.97 CN(C)CCCCCC(=O)O MCULE-1002014230 [0,2,0,0,0,0|0,0,0]=2 2698 B10R0.97 CN(C)CCCCCC(=O)O MCULE-2670396647 [0,2,0,0,0,0|0,0,0]=2 2699 B10R0.97 N=C(N)CCCCCC(=N)N MCULE-7581700737 [0,2,0,0,0,0|2,0,0]=4 2700 B10R0.97 N=C(N)NCCCCC(=O)O MCULE-2807872503 [0,2,0,0,0,0|0,0,1]=3 2701 B10R0.97 N=C(N)SCCCCC(=O)O MCULE-6602460811 [0,2,0,0,0,0|0,0,1]=3 2702 B10R0.97 NC(=O)CCSCCC(=O)N MCULE-6169485438 [0,2,0,0,0,0|1,0,1]=4 2703 B10R0.97 NC(=O)NCCCCC(=O)O MCULE-1121500109 [0,2,0,0,0,0|0,0,1]=3 2704 B10R0.97 NC(=[NH2+])SCCCCC(=O)O MCULE-4252972328 [0,2,0,0,0,0|0,0,1]=3 2705 B10R0.97 O=C(Cl)CCCCCC(=O)Cl MCULE-6184277171 [0,2,0,0,0,0|2,0,0]=4 2706 B10R0.97 O=C(O)CCCCCC(=O)O MCULE-9618389016 [0,2,0,0,0,0|1,0,0]=3 2707 B10R0.97 O=C(O)CCCCCC(F)F MCULE-9302536317 [0,2,0,0,0,0|1,0,0]=3 2708 B10R0.97 O=C(O)CCCCCN(=O)=O MCULE-4861594242 [0,2,0,0,0,0|0,0,1]=3 2709 B10R0.97 O=C(O)CCCCON(=O)=O MCULE-6522646680 [0,2,0,0,0,0|1,0,1]=4 2710 B10R0.97 O=C(O)CCNCCC(=O)O MCULE-9497656945 [0,2,0,0,0,0|1,0,1]=4 2711 B10R0.97 O=C(O)CCOCCC(=O)O MCULE-3213537394 [0,2,0,0,0,0|1,0,1]=4 2712 B10R0.97 O=C(O)CCSCCC(=O)O MCULE-1300073378 [0,2,0,0,0,0|1,0,1]=4 2713 B10R0.18 CCCCC(=O)CC(=O)OC MCULE-2441269867 [0,2,0,0,0,0|1,0,1]=4 2714 B10R0.18 CCCCC(O)CC(=O)OC MCULE-3777448851 [0,2,0,0,0,0|1,0,0]=3 2715 B10R0.32 CCCC(C)C(N)CC(=O)O MCULE-9134317193 [0,2,0,0,0,0|1,0,0]=3 2716 B10R0.81 CCCCC(N)C(O)C(=O)O MCULE-9772584692 [0,2,0,0,0,0|1,0,0]=3 2717 B10R0.81 CCCC[C@@H](N)[C@H](O)C(=O)O MCULE-8826953669 [0,2,0,0,0,0|1,0,0]=3 2718 B10R0.81 CCCC[C@H](N)[C@H](O)C(=O)O MCULE-6737057860 [0,2,0,0,0,0|1,0,0]=3 2719 B10R0.81 COCCC(C)C(N)C(=O)O MCULE-6609752945 [0,2,0,0,0,0|2,0,0]=4 2720 B10R0.87 CCCCC(CC)CC(=O)C MCULE-4325342616 [0,2,0,0,0,0|2,0,0]=4 2721 B10R0.87 CCCCC(CC)CC(=O)O MCULE-3612456700 [0,2,0,0,0,0|1,0,0]=3 2722 B10R0.96 CC(C)CCC(C)CC(=O)O MCULE-4888752092 [0,2,0,0,0,0|1,0,0]=3 2723 B10R0.96 CC(CCC(=O)O)CC(=O)O MCULE-7386549049 [0,2,0,0,0,0|1,0,1]=4 2724 B10R0.96 C[C@H](CCC(=O)O)CC(=O)O MCULE-1721699813 [0,2,0,0,0,0|1,0,1]=4 2725 B10R0.96 C[C@H](CCC(=O)O)CC(=O)O MCULE-7525360323 [0,2,0,0,0,0|1,0,1]=4 2726 B10R0.96 NC(=O)CCC(N)CC(=O)O MCULE-3003314518 [0,2,0,0,0,0|0,0,1]=3 2727 B10R0.96 NC(=O)CCC(N)CC(=O)O MCULE-7683510788 [0,2,0,0,0,0|0,0,1]=3 2728 B10R0.96 NC(=O)CC[C@@H](N)CC(=O)O MCULE-8316748928 [0,2,0,0,0,0|0,0,1]=3 2729 B10R0.96 NC(=O)CC[C@@H](N)CC(=O)O MCULE-8667775229 [0,2,0,0,0,0|0,0,1]=3 2730 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-2836546299 [0,2,0,0,0,0|0,0,1]=3 2731 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-4298371176 [0,2,0,0,0,0|0,0,1]=3 2732 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-4441176096 [0,2,0,0,0,0|0,0,1]=3 2733 B10R0.96 NC(=O)CC[C@H](N)CC(=O)O MCULE-5599562900 [0,2,0,0,0,0|0,0,1]=3 2734 B10R0.96 NC(CCC(=O)O)CC(=O)O MCULE-8155260586 [0,2,0,0,0,0|1,0,1]=4 2735 B10R0.96 NC(CCC(=O)O)CC(=O)O MCULE-8574900055 [0,2,0,0,0,0|1,0,1]=4 2736 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-5068946859 [0,2,0,0,0,0|1,0,1]=4 2737 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-8151605170 [0,2,0,0,0,0|1,0,1]=4 2738 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-8505675120 [0,2,0,0,0,0|1,0,1]=4 2739 B10R0.96 N[C@@H](CCC(=O)O)CC(=O)O MCULE-9871725008 [0,2,0,0,0,0|1,0,1]=4 2740 B10R0.96 N[C@H](CCC(=O)O)CC(=O)O MCULE-3923729315 [0,2,0,0,0,0|1,0,1]=4 2741 B10R0.96 N[C@H](CCC(=O)O)CC(=O)O MCULE-6851763365 [0,2,0,0,0,0|1,0,1]=4 2742 B10R0.122 CCCCS(=O)(=O)CC(=O)O MCULE-9125747616 [0,2,0,0,0,0|2,0,0]=4 2743 B10R0.5 CCCCC[C@H](N)P(=O)(O)O MCULE-5419319712 [0,2,0,0,0,0|2,0,0]=4 2744 B10R0.15 CC(C)(C)CCCCC(=O)O MCULE-8286567269 [0,2,0,0,0,0|1,0,0]=3 2745 B10R0.15 CC(C)(C)OCCCC(=O)O MCULE-2716548684 [0,2,0,0,0,0|2,0,0]=4 2746 B10R0.15 CC(C)(C)SCCCC(=O)O MCULE-5087513039 [0,2,0,0,0,0|2,0,0]=4 2747 B10R0.15 C[Si](C)(C)CCCCC(=O)O MCULE-8618985909 [0,2,0,0,0,0|1,1,0]=4 2748 B10R0.15 NS(=O)(=O)NCCCC(=O)O MCULE-4104736072 [0,2,0,0,0,0|2,0,0]=4 2749 B10R0.15 O=C(O)CCCCC(F)(F)F MCULE-8060628423 [0,2,0,0,0,0|1,0,0]=3 2750 B10R0.15 O=C(O)CCCCP(=O)(O)O MCULE-9230270330 [0,2,0,0,0,0|2,0,0]=4 2751 B10R0.15 O=C(O)CCOCC(F)(F)F MCULE-4631364728 [0,2,0,0,0,0|2,0,0]=4 2752 B10R0.15 O=C(O)CNCCC(F)(F)F MCULE-1896656370 [0,2,0,0,0,0|2,0,0]=4 2753 B10R0.15 O=C(O)CNCCC(F)(F)F MCULE-2886577265 [0,2,0,0,0,0|2,0,0]=4 2754 B10R0.15 O=C(O)CSCCC(F)(F)F MCULE-8689621327 [0,2,0,0,0,0|2,0,0]=4 2755 B10R0.62 CCS(=O)(=O)CCCCCN MCULE-2998985956 [0,2,0,0,0,0|1,0,1]=4 2756 B10R0.1 C#CCCCCC(=O)OCC MCULE-4159925776 [0,2,0,0,0,0|1,0,1]=4 2757 B10R0.1 C=CCCCCC(=O)OCC MCULE-4796834258 [0,2,0,0,0,0|1,0,1]=4 2758 B10R0.1 CCCCCCC(=O)CCC MCULE-1716736963 [0,2,0,0,0,0|2,0,0]=4 2759 B10R0.1 CCCCCCC(=O)OCC MCULE-9137582636 [0,2,0,0,0,0|1,0,0]=3 2760 B10R0.1 CCCCNCC(=O)OCC MCULE-9216905823 [0,2,0,0,0,0|2,0,0]=4 2761 B10R0.1 CCCNCCC(=O)OCC MCULE-7490328359 [0,2,0,0,0,0|2,0,0]=4 2762 B10R0.1 CCOC(=O)CCCCC#N MCULE-4576520215 [0,2,0,0,0,0|0,0,2]=4 2763 B10R0.1 CCOC(=O)CCCCC=O MCULE-7732334617 [0,2,0,0,0,0|1,0,1]=4 2764 B10R0.1 CCOC(=O)CCCCCBr MCULE-8003265411 [0,2,0,0,0,0|1,0,0]=3 2765 B10R0.1 CCOC(=O)CCCCCCl MCULE-4088253059 [0,2,0,0,0,0|1,0,0]=3 2766 B10R0.1 CCOC(=O)CCCCCI MCULE-9635955061 [0,2,0,0,0,0|1,0,0]=3 2767 B10R0.1 CCOC(=O)CCCCCN MCULE-3923374138 [0,2,0,0,0,0|0,0,0]=2 2768 B10R0.1 CCOC(=O)CCCCCN MCULE-5512054492 [0,2,0,0,0,0|0,0,0]=2 2769 B10R0.1 CCOC(=O)CCCCCO MCULE-3245932025 [0,2,0,0,0,0|1,0,0]=3 2770 B10R0.1 CCOC(=O)CCSCCO MCULE-8638992281 [0,2,0,0,0,0|2,0,0]=4 2771 B10R0.1 CCOC(=O)COCCCCl MCULE-4550907435 [0,2,0,0,0,0|2,0,0]=4 2772 B10R0.1 CCOC(=O)COCCCO MCULE-9785348075 [0,2,0,0,0,0|2,0,0]=4 2773 B10R0.1 CCOCCCC(=O)OCC MCULE-9855302324 [0,2,0,0,0,0|2,0,0]=4 2774 B10R0.83 C=CCCCC(N)C(=O)OC MCULE-1972402066 [0,2,0,0,0,0|1,0,1]=4 2775 B10R0.83 CCCCCC(N)C(=O)NC MCULE-6020353560 [0,2,0,0,0,0|2,0,0]=4 2776 B10R0.83 CCCCCC(N)C(=O)OC MCULE-2018052401 [0,2,0,0,0,0|1,0,0]=3 2777 B10R0.83 CCCCCC(N)C(=O)OC MCULE-5487541008 [0,2,0,0,0,0|1,0,0]=3 2778 B10R0.83 CCCCCC(O)C(=O)OC MCULE-9996510127 [0,2,0,0,0,0|1,0,0]=3 2779 B10R0.83 CCCCC[C@H](N)C(=O)NC MCULE-9979996978 [0,2,0,0,0,0|2,0,0]=4 2780 B10R0.83 CNC(=O)[C@@H](N)CCCCN MCULE-4853574180 [0,2,0,0,0,0|1,0,0]=3 2781 B10R0.83 COC(=O)C(C)CSCCO MCULE-1337971468 [0,2,0,0,0,0|2,0,0]=4 2782 B10R0.83 COC(=O)C(N)CCCCN MCULE-4653959448 [0,2,0,0,0,0|0,0,0]=2 2783 B10R0.83 COC(=O)C(N)CCCCN MCULE-5717864681 [0,2,0,0,0,0|0,0,0]=2 2784 B10R0.83 COC(=O)C(N)CCCCN MCULE-8914801986 [0,2,0,0,0,0|0,0,0]=2 2785 B10R0.83 COC(=O)C(N)CCCCO MCULE-5166100554 [0,2,0,0,0,0|1,0,0]=3 2786 B10R0.83 COC(=O)C(N)CCCCO MCULE-6738034786 [0,2,0,0,0,0|1,0,0]=3 2787 B10R0.83 COC(=O)C([NH3+])CCCC[NH3+] MCULE-3249374734 [0,2,0,0,0,0|0,0,1]=3 2788 B10R0.83 COC(=O)[C@@H](N)CCCCN MCULE-1350520573 [0,2,0,0,0,0|0,0,0]=2 2789 B10R0.83 COC(=O)[C@@H](N)CCCCN MCULE-6307487491 [0,2,0,0,0,0|0,0,0]=2 2790 B10R0.83 COC(=O)[C@H](N)CCCCN MCULE-2204531892 [0,2,0,0,0,0|0,0,0]=2 2791 B10R0.83 COC(=O)[C@H](N)CCCCN MCULE-2624615589 [0,2,0,0,0,0|0,0,0]=2 2792 B10R0.83 COC(=O)[C@H](N)CCCCN MCULE-6994501008 [0,2,0,0,0,0|0,0,0]=2 2793 B10R0.83 COC(=O)[C@H](N)CCCCN MCULE-7046980735 [0,2,0,0,0,0|0,0,0]=2 2794 B10R0.83 COC(=O)[C@H](N)CCCCN MCULE-7404594930 [0,2,0,0,0,0|0,0,0]=2 2795 B10R0.83 NCCCC[C@H](N)C(=O)CCl MCULE-8447625474 [0,2,0,0,0,0|1,0,0]=3 2796 B10R0.83 NCCCC[C@H](N)C(=O)NO MCULE-6731609596 [0,2,0,0,0,0|0,0,0]=2 2797 B10R0.83 [C@H](N)(CCCCN)C(=O)OC MCULE-5018936719 [0,2,0,0,0,0|0,0,0]=2 2798 B10R0.83 [C@H](N)(CCCCN)C(=O)OC MCULE-8447837964 [0,2,0,0,0,0|0,0,0]=2 2799 B10R0.108 COC(=O)CNC(=O)CCN MCULE-4558731190 [0,2,0,0,0,0|1,0,1]=4 2800 B10R0.108 COC(=O)CNC(=O)CCN MCULE-6225597626 [0,2,0,0,0,0|1,0,1]=4 2801 B10R0.26 CCCC(C)CC(N)C(=O)O MCULE-8848436054 [0,2,0,0,0,0|1,0,0]=3 2802 B10R0.26 CCCS(=O)CC(N)C(=O)O MCULE-8745806923 [0,2,0,0,0,0|2,0,0]=4 2803 B10R0.26 CCCS(=O)C[C@H](N)C(=O)O MCULE-6968745632 [0,2,0,0,0,0|2,0,0]=4 2804 B10R0.42 C=CCCC[C@@](C)(N)C(=O)O MCULE-2310142201 [0,2,0,0,0,0|1,0,1]=4 2805 B10R0.42 C=CCCC[C@](C)(N)C(=O)O MCULE-5334270405 [0,2,0,0,0,0|1,0,1]=4 2806 B10R0.42 CCCCCC(C)(C)C(=O)O MCULE-7728669545 [0,2,0,0,0,0|1,0,0]=3 2807 B10R0.42 C[C@@](N)(CCCCN)C(=O)O MCULE-5286287442 [0,2,0,0,0,0|0,0,0]=2 2808 B10R0.86 CCCCCC(CC)C(=O)C MCULE-1913128605 [0,2,0,0,0,0|2,0,0]=4 2809 B10R0.86 CCCCCC(CC)C(=O)O MCULE-3515775261 [0,2,0,0,0,0|1,0,0]=3 2810 B10R0.86 CNC(CCCCN)C(=O)O MCULE-3351204873 [0,2,0,0,0,0|0,0,0]=2 2811 B10R0.86 CNC(CCCCN)C(=O)O MCULE-6279634717 [0,2,0,0,0,0|0,0,0]=2 2812 B10R0.86 CN[C@@H](CCCCN)C(=O)O MCULE-1289342070 [0,2,0,0,0,0|0,0,0]=2 2813 B10R0.86 CN[C@@H](CCCCN)C(=O)O MCULE-4082358865 [0,2,0,0,0,0|0,0,0]=2 2814 B10R0.86 CN[C@@H](CCCCN)C(=O)O MCULE-5920807456 [0,2,0,0,0,0|0,0,0]=2 2815 B10R0.86 CN[C@@H](CCCCN)C(=O)O MCULE-9072694055 [0,2,0,0,0,0|0,0,0]=2 2816 B10R0.105 CC(C)(CCN)CCC(=O)O MCULE-6274447452 [0,2,0,0,0,0|0,0,0]=2 2817 B10R0.105 CC(C)(CCN)CCC(=O)O MCULE-8872228372 [0,2,0,0,0,0|0,0,0]=2 2818 B10R0.105 CCCS(=O)(=O)CCC(=O)O MCULE-5637790872 [0,2,0,0,0,0|2,0,0]=4 2819 B10R0.105 O=C(O)CCS(=O)(=O)CCCl MCULE-3085325606 [0,2,0,0,0,0|2,0,0]=4 2820 B10R0.105 O=C(O)CCS(=O)(=O)CCO MCULE-1223279473 [0,2,0,0,0,0|2,0,0]=4 2821 B8R1.2 BrCC1C=CCCC1 MCULE-3497010416 [1,0,0,1,0,0|2,0,0]=4 2822 B8R1.2 BrCC1CCCCN1 MCULE-2625695671 [1,0,0,1,0,0|1,0,1]=4 2823 B8R1.2 BrCC1CCCCN1 MCULE-9807498006 [1,0,0,1,0,0|1,0,1]=4 2824 B8R1.2 BrCC1CCCCO1 MCULE-7555024882 [1,0,0,1,0,0|1,0,1]=4 2825 B8R1.2 C#CC1CCCCN1 MCULE-4194715110 [1,0,0,1,0,0|1,0,1]=4 2826 B8R1.2 C#CC1CCCCN1 MCULE-7315074830 [1,0,0,1,0,0|1,0,1]=4 2827 B8R1.2 C1(CCCCN1)CO MCULE-7414417382 [1,0,0,1,0,0|0,0,1]=3 2828 B8R1.2 C1(CCCCO1)CC MCULE-5189391029 [1,0,0,1,0,0|1,0,1]=4 2829 B8R1.2 C1(CCCOC1)CN MCULE-9009856435 [1,0,0,1,0,0|2,0,0]=4 2830 B8R1.2 C1(COCCO1)CN MCULE-3098204775 [1,0,0,1,0,0|1,0,1]=4 2831 B8R1.2 C1(COCCO1)CN MCULE-7024108523 [1,0,0,1,0,0|1,0,1]=4 2832 B8R1.2 C=CC1CCCCC1 MCULE-5657998956 [1,0,0,1,0,0|2,0,0]=4 2833 B8R1.2 C=CC1CCCCN1 MCULE-1327502475 [1,0,0,1,0,0|1,0,0]=3 2834 B8R1.2 C=CC1CCCCN1 MCULE-7059257921 [1,0,0,1,0,0|1,0,0]=3 2835 B8R1.2 CCC1CCCCN1 MCULE-1463828922 [1,0,0,1,0,0|1,0,1]=4 2836 B8R1.2 CCC1CCCCN1 MCULE-4345537199 [1,0,0,1,0,0|1,0,1]=4 2837 B8R1.2 CCC1CCCCN1 MCULE-4598810496 [1,0,0,1,0,0|1,0,1]=4 2838 B8R1.2 CCC1CCCCN1 MCULE-6373382965 [1,0,0,1,0,0|1,0,1]=4 2839 B8R1.2 CC[C@@H]1CCCCN1 MCULE-1012550179 [1,0,0,1,0,0|1,0,1]=4 2840 B8R1.2 CC[C@@H]1CCCCN1 MCULE-6669069574 [1,0,0,1,0,0|1,0,1]=4 2841 B8R1.2 CC[C@@H]1CCCCN1 MCULE-7355467130 [1,0,0,1,0,0|1,0,1]=4 2842 B8R1.2 CC[C@@H]1CCCCN1 MCULE-7542229673 [1,0,0,1,0,0|1,0,1]=4 2843 B8R1.2 CC[C@H]1CCCCN1 MCULE-2554275022 [1,0,0,1,0,0|1,0,1]=4 2844 B8R1.2 CC[C@H]1CCCCN1 MCULE-3433938348 [1,0,0,1,0,0|1,0,1]=4 2845 B8R1.2 CC[C@H]1CCCCN1 MCULE-5134937129 [1,0,0,1,0,0|1,0,1]=4 2846 B8R1.2 CC[C@H]1CCCCN1 MCULE-9567977241 [1,0,0,1,0,0|1,0,1]=4 2847 B8R1.2 ClCC1CCCCN1 MCULE-3215583581 [1,0,0,1,0,0|1,0,1]=4 2848 B8R1.2 ClCC1CCCCN1 MCULE-8949714419 [1,0,0,1,0,0|1,0,1]=4 2849 B8R1.2 ClCC1CCCCO1 MCULE-7493119643 [1,0,0,1,0,0|1,0,1]=4 2850 B8R1.2 FCC1CCCCN1 MCULE-4091234595 [1,0,0,1,0,0|1,0,1]=4 2851 B8R1.2 FCC1CCCCN1 MCULE-7748360337 [1,0,0,1,0,0|1,0,1]=4 2852 B8R1.2 FC[C@@H]1CCCCN1 MCULE-2249718416 [1,0,0,1,0,0|1,0,1]=4 2853 B8R1.2 FC[C@@H]1CCCCN1 MCULE-2335185919 [1,0,0,1,0,0|1,0,1]=4 2854 B8R1.2 FC[C@@H]1CCCCN1 MCULE-7515953101 [1,0,0,1,0,0|1,0,1]=4 2855 B8R1.2 FC[C@@H]1CCCCN1 MCULE-8096430166 [1,0,0,1,0,0|1,0,1]=4 2856 B8R1.2 ICC1CCCCN1 MCULE-5434926156 [1,0,0,1,0,0|1,0,1]=4 2857 B8R1.2 ICC1CCCCN1 MCULE-5785133159 [1,0,0,1,0,0|1,0,1]=4 2858 B8R1.2 ICC1CCCCO1 MCULE-4630701067 [1,0,0,1,0,0|1,0,1]=4 2859 B8R1.2 N#CC1CCCCN1 MCULE-1697826413 [1,0,0,1,0,0|1,0,1]=4 2860 B8R1.2 N#CC1CCCCN1 MCULE-3334055664 [1,0,0,1,0,0|1,0,1]=4 2861 B8R1.2 N#CC1CCCCN1 MCULE-4086101013 [1,0,0,1,0,0|1,0,1]=4 2862 B8R1.2 N#CC1CCCCN1 MCULE-6025106560 [1,0,0,1,0,0|1,0,1]=4 2863 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-4428095484 [1,0,0,1,0,0|1,0,1]=4 2864 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-4927353010 [1,0,0,1,0,0|1,0,1]=4 2865 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-5087232665 [1,0,0,1,0,0|1,0,1]=4 2866 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-5509246319 [1,0,0,1,0,0|1,0,1]=4 2867 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-6114021285 [1,0,0,1,0,0|1,0,1]=4 2868 B8R1.2 N#C[C@@H]1CCCCN1 MCULE-7595225760 [1,0,0,1,0,0|1,0,1]=4 2869 B8R1.2 N#C[C@H]1CCCCN1 MCULE-3583532381 [1,0,0,1,0,0|1,0,1]=4 2870 B8R1.2 N#C[C@H]1CCCCN1 MCULE-4527493190 [1,0,0,1,0,0|1,0,1]=4 2871 B8R1.2 N#C[C@H]1CCCCN1 MCULE-7988967151 [1,0,0,1,0,0|1,0,1]=4 2872 B8R1.2 N#C[C@H]1CCCCN1 MCULE-9951441572 [1,0,0,1,0,0|1,0,1]=4 2873 B8R1.2 NCC1CC=CCC1 MCULE-9374023591 [1,0,0,1,0,0|1,0,1]=4 2874 B8R1.2 NCC1CCC=CO1 MCULE-9848121283 [1,0,0,1,0,0|0,0,1]=3 2875 B8R1.2 NCC1CCCCC1 MCULE-3156148976 [1,0,0,1,0,0|1,0,1]=4 2876 B8R1.2 NCC1CCCCC1 MCULE-7375566253 [1,0,0,1,0,0|1,0,1]=4 2877 B8R1.2 NCC1CCCCC1 MCULE-8029432210 [1,0,0,1,0,0|1,0,1]=4 2878 B8R1.2 NCC1CCCCN1 MCULE-5628582900 [1,0,0,1,0,0|1,0,1]=4 2879 B8R1.2 NCC1CCCCN1 MCULE-7762336274 [1,0,0,1,0,0|1,0,1]=4 2880 B8R1.2 NCC1CCCCO1 MCULE-2644735894 [1,0,0,1,0,0|0,0,1]=3 2881 B8R1.2 NCC1CCCCO1 MCULE-5042678896 [1,0,0,1,0,0|0,0,1]=3 2882 B8R1.2 NCC1CCCCS1 MCULE-1705875111 [1,0,0,1,0,0|0,1,1]=4 2883 B8R1.2 NCC1CCCNC1 MCULE-3758525803 [1,0,0,1,0,0|2,0,0]=4 2884 B8R1.2 NCC1CCCNC1 MCULE-4215149964 [1,0,0,1,0,0|2,0,0]=4 2885 B8R1.2 NCC1CCCOC1 MCULE-2859652493 [1,0,0,1,0,0|2,0,0]=4 2886 B8R1.2 NCC1CCCOC1 MCULE-5411442728 [1,0,0,1,0,0|2,0,0]=4 2887 B8R1.2 NCC1CCCOC1 MCULE-6616131288 [1,0,0,1,0,0|2,0,0]=4 2888 B8R1.2 NCC1CCCOC1 MCULE-9893994601 [1,0,0,1,0,0|2,0,0]=4 2889 B8R1.2 NCC1CCCSC1 MCULE-1894328803 [1,0,0,1,0,0|2,0,0]=4 2890 B8R1.2 NCC1CNCCO1 MCULE-4362254656 [1,0,0,1,0,0|1,0,1]=4 2891 B8R1.2 NCC1CNCCO1 MCULE-9062864656 [1,0,0,1,0,0|1,0,1]=4 2892 B8R1.2 NCC1COCCO1 MCULE-1612004893 [1,0,0,1,0,0|1,0,1]=4 2893 B8R1.2 NCC1COCCO1 MCULE-9278150730 [1,0,0,1,0,0|1,0,1]=4 2894 B8R1.2 NCC1OCCCO1 MCULE-8138335107 [1,0,0,1,0,0|1,0,1]=4 2895 B8R1.2 NC[C@@H]1CCCCN1 MCULE-2094976900 [1,0,0,1,0,0|1,0,1]=4 2896 B8R1.2 NC[C@@H]1CCCCN1 MCULE-3736890217 [1,0,0,1,0,0|1,0,1]=4 2897 B8R1.2 NC[C@@H]1CCCCO1 MCULE-1435985280 [1,0,0,1,0,0|0,0,1]=3 2898 B8R1.2 NC[C@@H]1CCCCO1 MCULE-4778440271 [1,0,0,1,0,0|0,0,1]=3 2899 B8R1.2 NC[C@@H]1CCCCO1 MCULE-6014338525 [1,0,0,1,0,0|0,0,1]=3 2900 B8R1.2 NC[C@@H]1CCCCO1 MCULE-9488694680 [1,0,0,1,0,0|0,0,1]=3 2901 B8R1.2 NC[C@@H]1CCCNC1 MCULE-4700132151 [1,0,0,1,0,0|2,0,0]=4 2902 B8R1.2 NC[C@@H]1CCCNC1 MCULE-4826798446 [1,0,0,1,0,0|2,0,0]=4 2903 B8R1.2 NC[C@@H]1CCCNC1 MCULE-5621058783 [1,0,0,1,0,0|2,0,0]=4 2904 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5314997557 [1,0,0,1,0,0|2,0,0]=4 2905 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5553412637 [1,0,0,1,0,0|2,0,0]=4 2906 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6349833867 [1,0,0,1,0,0|2,0,0]=4 2907 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6463109886 [1,0,0,1,0,0|2,0,0]=4 2908 B8R1.2 NC[C@@H]1COCCO1 MCULE-2337005422 [1,0,0,1,0,0|1,0,1]=4 2909 B8R1.2 NC[C@@H]1COCCO1 MCULE-5052227155 [1,0,0,1,0,0|1,0,1]=4 2910 B8R1.2 NC[C@@H]1COCCO1 MCULE-5182478394 [1,0,0,1,0,0|1,0,1]=4 2911 B8R1.2 NC[C@@H]1COCCO1 MCULE-9731790782 [1,0,0,1,0,0|1,0,1]=4 2912 B8R1.2 NC[C@H]1CCCCN1 MCULE-2124027272 [1,0,0,1,0,0|1,0,1]=4 2913 B8R1.2 NC[C@H]1CCCCN1 MCULE-5815797207 [1,0,0,1,0,0|1,0,1]=4 2914 B8R1.2 NC[C@H]1CCCCO1 MCULE-2835389541 [1,0,0,1,0,0|0,0,1]=3 2915 B8R1.2 NC[C@H]1CCCCO1 MCULE-4500797236 [1,0,0,1,0,0|0,0,1]=3 2916 B8R1.2 NC[C@H]1CCCCO1 MCULE-5990717573 [1,0,0,1,0,0|0,0,1]=3 2917 B8R1.2 NC[C@H]1CCCCO1 MCULE-7362278601 [1,0,0,1,0,0|0,0,1]=3 2918 B8R1.2 NC[C@H]1CCCNC1 MCULE-1544884485 [1,0,0,1,0,0|2,0,0]=4 2919 B8R1.2 NC[C@H]1CCCNC1 MCULE-1869159747 [1,0,0,1,0,0|2,0,0]=4 2920 B8R1.2 NC[C@H]1CCCNC1 MCULE-5445972707 [1,0,0,1,0,0|2,0,0]=4 2921 B8R1.2 NC[C@H]1CCCNC1 MCULE-5734934526 [1,0,0,1,0,0|2,0,0]=4 2922 B8R1.2 NC[C@H]1CCCNC1 MCULE-9259563350 [1,0,0,1,0,0|2,0,0]=4 2923 B8R1.2 NC[C@H]1CCCOC1 MCULE-1996808023 [1,0,0,1,0,0|2,0,0]=4 2924 B8R1.2 NC[C@H]1CCCOC1 MCULE-8044635428 [1,0,0,1,0,0|2,0,0]=4 2925 B8R1.2 NC[C@H]1CCCOC1 MCULE-8246511133 [1,0,0,1,0,0|2,0,0]=4 2926 B8R1.2 NC[C@H]1CCCOC1 MCULE-8378816563 [1,0,0,1,0,0|2,0,0]=4 2927 B8R1.2 NC[C@H]1COCCO1 MCULE-1148680339 [1,0,0,1,0,0|1,0,1]=4 2928 B8R1.2 NC[C@H]1COCCO1 MCULE-6244775356 [1,0,0,1,0,0|1,0,1]=4 2929 B8R1.2 NC[C@H]1COCCO1 MCULE-6383517047 [1,0,0,1,0,0|1,0,1]=4 2930 B8R1.2 NC[C@H]1COCCO1 MCULE-9768281737 [1,0,0,1,0,0|1,0,1]=4 2931 B8R1.2 NOC1CCCCO1 MCULE-2818785498 [1,0,0,1,0,0|1,0,1]=4 2932 B8R1.2 O=CC1=CCCCC1 MCULE-6209420256 [1,0,0,1,0,0|1,0,1]=4 2933 B8R1.2 O=CC1C=CCCC1 MCULE-7360804121 [1,0,0,1,0,0|1,0,1]=4 2934 B8R1.2 O=CC1CCCCC1 MCULE-7345097178 [1,0,0,1,0,0|1,0,0]=3 2935 B8R1.2 O=CC1CCCCN1 MCULE-7681438476 [1,0,0,1,0,0|0,0,0]=2 2936 B8R1.2 O=CC1CCCCN1 MCULE-9370686295 [1,0,0,1,0,0|0,0,0]=2 2937 B8R1.2 O=CC1CCCCO1 MCULE-6497412510 [1,0,0,1,0,0|1,0,0]=3 2938 B8R1.2 O=CC1CCCNC1 MCULE-4037480911 [1,0,0,1,0,0|2,0,0]=4 2939 B8R1.2 O=CC1CCCNC1 MCULE-9205787069 [1,0,0,1,0,0|2,0,0]=4 2940 B8R1.2 O=CC1CCCOC1 MCULE-6841728518 [1,0,0,1,0,0|2,0,0]=4 2941 B8R1.2 O=CC1CCCSC1 MCULE-8369808876 [1,0,0,1,0,0|2,0,0]=4 2942 B8R1.2 O=CC1CCNCC1 MCULE-3856245073 [1,0,0,1,0,0|2,0,0]=4 2943 B8R1.2 O=CC1CCNCC1 MCULE-8439609130 [1,0,0,1,0,0|2,0,0]=4 2944 B8R1.2 O=CC1CCOCC1 MCULE-6884786677 [1,0,0,1,0,0|2,0,0]=4 2945 B8R1.2 O=CC1CCSCC1 MCULE-4728594373 [1,0,0,1,0,0|2,0,0]=4 2946 B8R1.2 O=CC1COCCO1 MCULE-3817488986 [1,0,0,1,0,0|2,0,0]=4 2947 B8R1.2 O=CN1CCCCC1 MCULE-3028605826 [1,0,0,1,0,0|2,0,0]=4 2948 B8R1.2 OCC1C=CCCC1 MCULE-3264381346 [1,0,0,1,0,0|2,0,0]=4 2949 B8R1.2 OCC1CCC=CO1 MCULE-7646685626 [1,0,0,1,0,0|1,0,1]=4 2950 B8R1.2 OCC1CCCCC1 MCULE-6571547092 [1,0,0,1,0,0|1,0,1]=4 2951 B8R1.2 OCC1CCCCN1 MCULE-1839660028 [1,0,0,1,0,0|0,0,1]=3 2952 B8R1.2 OCC1CCCCN1 MCULE-5190999833 [1,0,0,1,0,0|0,0,1]=3 2953 B8R1.2 OCC1CCCCO1 MCULE-2390789074 [1,0,0,1,0,0|1,0,1]=4 2954 B8R1.2 OCC1CCCCO1 MCULE-7483291767 [1,0,0,1,0,0|1,0,1]=4 2955 B8R1.2 OCC1CCCCS1 MCULE-8533707311 [1,0,0,1,0,0|1,0,1]=4 2956 B8R1.2 OCC1CNCCN1 MCULE-1401587868 [1,0,0,1,0,0|1,0,1]=4 2957 B8R1.2 OCC1CNCCN1 MCULE-7423856879 [1,0,0,1,0,0|1,0,1]=4 2958 B8R1.2 OCC1CNCCN1 MCULE-8309538868 [1,0,0,1,0,0|1,0,1]=4 2959 B8R1.2 OCC1CNCCN1 MCULE-9359285661 [1,0,0,1,0,0|1,0,1]=4 2960 B8R1.2 OCC1COCCN1 MCULE-1141875416 [1,0,0,1,0,0|1,0,1]=4 2961 B8R1.2 OCC1COCCN1 MCULE-2383049328 [1,0,0,1,0,0|1,0,1]=4 2962 B8R1.2 OCC1COCCN1 MCULE-3747324792 [1,0,0,1,0,0|1,0,1]=4 2963 B8R1.2 OCC1COCCN1 MCULE-8656197859 [1,0,0,1,0,0|1,0,1]=4 2964 B8R1.2 OCC1CSCCN1 MCULE-9615907863 [1,0,0,1,0,0|1,0,1]=4 2965 B8R1.2 OC[C@@H]1CCCCN1 MCULE-6170192975 [1,0,0,1,0,0|0,0,1]=3 2966 B8R1.2 OC[C@@H]1CCCCN1 MCULE-7805438267 [1,0,0,1,0,0|0,0,1]=3 2967 B8R1.2 OC[C@@H]1CCCCN1 MCULE-8160671578 [1,0,0,1,0,0|0,0,1]=3 2968 B8R1.2 OC[C@@H]1CCCCO1 MCULE-5978396739 [1,0,0,1,0,0|1,0,1]=4 2969 B8R1.2 OC[C@@H]1CCCCO1 MCULE-8715909099 [1,0,0,1,0,0|1,0,1]=4 2970 B8R1.2 OC[C@@H]1CNCCN1 MCULE-3656110325 [1,0,0,1,0,0|1,0,1]=4 2971 B8R1.2 OC[C@@H]1CNCCN1 MCULE-7030471384 [1,0,0,1,0,0|1,0,1]=4 2972 B8R1.2 OC[C@@H]1CNCCN1 MCULE-7465480170 [1,0,0,1,0,0|1,0,1]=4 2973 B8R1.2 OC[C@@H]1CNCCN1 MCULE-9542102138 [1,0,0,1,0,0|1,0,1]=4 2974 B8R1.2 OC[C@@H]1COCCN1 MCULE-2260461335 [1,0,0,1,0,0|1,0,1]=4 2975 B8R1.2 OC[C@@H]1COCCN1 MCULE-7365178843 [1,0,0,1,0,0|1,0,1]=4 2976 B8R1.2 OC[C@@H]1COCCN1 MCULE-8155625467 [1,0,0,1,0,0|1,0,1]=4 2977 B8R1.2 OC[C@@H]1COCCN1 MCULE-9822056975 [1,0,0,1,0,0|1,0,1]=4 2978 B8R1.2 OC[C@H]1CCC=CO1 MCULE-3753346509 [1,0,0,1,0,0|1,0,1]=4 2979 B8R1.2 OC[C@H]1CCCCN1 MCULE-1585224164 [1,0,0,1,0,0|0,0,1]=3 2980 B8R1.2 OC[C@H]1CCCCN1 MCULE-2860177964 [1,0,0,1,0,0|0,0,1]=3 2981 B8R1.2 OC[C@H]1CCCCO1 MCULE-4700719427 [1,0,0,1,0,0|1,0,1]=4 2982 B8R1.2 OC[C@H]1CCCCO1 MCULE-7990169259 [1,0,0,1,0,0|1,0,1]=4 2983 B8R1.2 OC[C@H]1CNCCN1 MCULE-2062612556 [1,0,0,1,0,0|1,0,1]=4 2984 B8R1.2 OC[C@H]1CNCCN1 MCULE-3003505442 [1,0,0,1,0,0|1,0,1]=4 2985 B8R1.2 OC[C@H]1CNCCN1 MCULE-3400481255 [1,0,0,1,0,0|1,0,1]=4 2986 B8R1.2 OC[C@H]1CNCCN1 MCULE-5683382374 [1,0,0,1,0,0|1,0,1]=4 2987 B8R1.2 OC[C@H]1CNCCN1 MCULE-8795905011 [1,0,0,1,0,0|1,0,1]=4 2988 B8R1.2 OC[C@H]1COCCN1 MCULE-2570187475 [1,0,0,1,0,0|1,0,1]=4 2989 B8R1.2 OC[C@H]1COCCN1 MCULE-5479794518 [1,0,0,1,0,0|1,0,1]=4 2990 B8R1.2 OC[C@H]1COCCN1 MCULE-5550353523 [1,0,0,1,0,0|1,0,1]=4 2991 B8R1.2 OC[C@H]1COCCN1 MCULE-6091772249 [1,0,0,1,0,0|1,0,1]=4 2992 B8R1.2 ONC1CCCCC1 MCULE-7854482550 [1,0,0,1,0,0|2,0,0]=4 2993 B8R1.2 O[NH2+]C1CCCCC1 MCULE-5578731568 [1,0,0,1,0,0|2,0,0]=4 2994 B8R1.5 C=C1CCCCC1O MCULE-3853228524 [1,0,0,1,0,0|2,0,0]=4 2995 B8R1.5 C=C1CCCCC1O MCULE-5911864977 [1,0,0,1,0,0|2,0,0]=4 2996 B8R1.5 C=C1COCCC1N MCULE-4966385224 [1,0,0,1,0,0|2,0,0]=4 2997 B8R1.5 CC1CCCCC1=O MCULE-6363555535 [1,0,0,1,0,0|1,0,0]=3 2998 B8R1.5 CC1CCCCC1N MCULE-3041016580 [1,0,0,1,0,0|1,0,1]=4 2999 B8R1.5 CC1CCCCC1N MCULE-4294403075 [1,0,0,1,0,0|1,0,1]=4 3000 B8R1.5 CC1CCCCC1O MCULE-2704647488 [1,0,0,1,0,0|1,0,1]=4 3001 B8R1.5 CC1CCCNC1=O MCULE-5295531632 [1,0,0,1,0,0|2,0,0]=4 3002 B8R1.5 CC1CCCOC1=O MCULE-5926029136 [1,0,0,1,0,0|2,0,0]=4 3003 B8R1.5 CC1CCNCC1=O MCULE-8618050685 [1,0,0,1,0,0|2,0,0]=4 3004 B8R1.5 CC1CCNCC1=O MCULE-9238977073 [1,0,0,1,0,0|2,0,0]=4 3005 B8R1.5 CC1CCOCC1=O MCULE-2481965177 [1,0,0,1,0,0|2,0,0]=4 3006 B8R1.5 CC1CNCCC1=O MCULE-6306655160 [1,0,0,1,0,0|2,0,0]=4 3007 B8R1.5 CC1CNCCC1=O MCULE-9018912988 [1,0,0,1,0,0|2,0,0]=4 3008 B8R1.5 CC1COCCC1=O MCULE-2694187526 [1,0,0,1,0,0|2,0,0]=4 3009 B8R1.5 CC1CSCCC1=O MCULE-4565033608 [1,0,0,1,0,0|2,0,0]=4 3010 B8R1.5 CC1NCCCC1=O MCULE-1303642695 [1,0,0,1,0,0|2,0,0]=4 3011 B8R1.5 CC1NCCCC1=O MCULE-6618358169 [1,0,0,1,0,0|2,0,0]=4 3012 B8R1.5 CC1SCCCC1=O MCULE-7641066964 [1,0,0,1,0,0|2,0,0]=4 3013 B8R1.5 CN1CCCCC1=O MCULE-9619129797 [1,0,0,1,0,0|2,0,0]=4 3014 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-2207912311 [1,0,0,1,0,0|1,0,1]=4 3015 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-3227199256 [1,0,0,1,0,0|1,0,1]=4 3016 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-4948677049 [1,0,0,1,0,0|1,0,1]=4 3017 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-6377741621 [1,0,0,1,0,0|1,0,1]=4 3018 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-8426223529 [1,0,0,1,0,0|1,0,1]=4 3019 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-9542068395 [1,0,0,1,0,0|1,0,1]=4 3020 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-3547716632 [1,0,0,1,0,0|1,0,1]=4 3021 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-9259793572 [1,0,0,1,0,0|1,0,1]=4 3022 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-2021817746 [1,0,0,1,0,0|1,0,1]=4 3023 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-3944837592 [1,0,0,1,0,0|1,0,1]=4 3024 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-3841584035 [1,0,0,1,0,0|1,0,1]=4 3025 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-4158219749 [1,0,0,1,0,0|1,0,1]=4 3026 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-8973971252 [1,0,0,1,0,0|1,0,1]=4 3027 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-9885453921 [1,0,0,1,0,0|1,0,1]=4 3028 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-4879328575 [1,0,0,1,0,0|1,0,1]=4 3029 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-7331434797 [1,0,0,1,0,0|1,0,1]=4 3030 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-1533998857 [1,0,0,1,0,0|1,0,1]=4 3031 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5254242664 [1,0,0,1,0,0|1,0,1]=4 3032 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5432486645 [1,0,0,1,0,0|1,0,1]=4 3033 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-7149509445 [1,0,0,1,0,0|1,0,1]=4 3034 B8R1.5 C[C@H]1CNCCC1=O MCULE-8062269317 [1,0,0,1,0,0|2,0,0]=4 3035 B8R1.5 C[C@H]1CNCCC1=O MCULE-9510433313 [1,0,0,1,0,0|2,0,0]=4 3036 B8R1.5 C[C@H]1COCCC1=O MCULE-3103478095 [1,0,0,1,0,0|2,0,0]=4 3037 B8R1.5 NC1CCCCC1=O MCULE-2382898926 [1,0,0,1,0,0|0,0,0]=2 3038 B8R1.5 NC1CCCCC1=O MCULE-9230455128 [1,0,0,1,0,0|0,0,0]=2 3039 B8R1.5 NC1CCCCC1Cl MCULE-3676302646 [1,0,0,1,0,0|1,0,1]=4 3040 B8R1.5 NC1CCCCC1Cl MCULE-7920658638 [1,0,0,1,0,0|1,0,1]=4 3041 B8R1.5 NC1CCCCC1F MCULE-6643891539 [1,0,0,1,0,0|1,0,1]=4 3042 B8R1.5 NC1CCCCC1F MCULE-7855236144 [1,0,0,1,0,0|1,0,1]=4 3043 B8R1.5 NC1CCCCC1N MCULE-1677916175 [1,0,0,1,0,0|1,0,1]=4 3044 B8R1.5 NC1CCCCC1N MCULE-9568644004 [1,0,0,1,0,0|1,0,1]=4 3045 B8R1.5 NC1CCCCC1O MCULE-1427424523 [1,0,0,1,0,0|0,0,1]=3 3046 B8R1.5 NC1CCCCC1O MCULE-2793336591 [1,0,0,1,0,0|0,0,1]=3 3047 B8R1.5 NC1CCCNC1=O MCULE-2560564171 [1,0,0,1,0,0|1,0,0]=3 3048 B8R1.5 NC1CCCNC1=O MCULE-4494449620 [1,0,0,1,0,0|1,0,0]=3 3049 B8R1.5 NC1CCCNC1=O MCULE-7473475906 [1,0,0,1,0,0|1,0,0]=3 3050 B8R1.5 NC1CCCNC1=O MCULE-8288645102 [1,0,0,1,0,0|1,0,0]=3 3051 B8R1.5 NC1CCNCC1O MCULE-2705091841 [1,0,0,1,0,0|1,0,1]=4 3052 B8R1.5 NC1CCOCC1O MCULE-2815184899 [1,0,0,1,0,0|1,0,1]=4 3053 B8R1.5 NC1CCOCC1O MCULE-4548392204 [1,0,0,1,0,0|1,0,1]=4 3054 B8R1.5 NC1COCCC1=O MCULE-2621905094 [1,0,0,1,0,0|1,0,0]=3 3055 B8R1.5 NC1COCCC1=O MCULE-5417580672 [1,0,0,1,0,0|1,0,0]=3 3056 B8R1.5 NC1COCCC1O MCULE-6374385354 [1,0,0,1,0,0|1,0,1]=4 3057 B8R1.5 NC1COCCC1O MCULE-7944406292 [1,0,0,1,0,0|1,0,1]=4 3058 B8R1.5 NN1CCCCC1=O MCULE-3663308028 [1,0,0,1,0,0|1,0,0]=3 3059 B8R1.5 NN1CCCCC1=O MCULE-9929233745 [1,0,0,1,0,0|1,0,0]=3 3060 B8R1.5 NN1CCCNC1=O MCULE-1690172508 [1,0,0,1,0,0|2,0,0]=4 3061 B8R1.5 NN1CCCOC1=O MCULE-6942418314 [1,0,0,1,0,0|2,0,0]=4 3062 B8R1.5 N[C@@H]1CCCC[C@@H]1F MCULE-1657692826 [1,0,0,1,0,0|1,0,1]=4 3063 B8R1.5 N[C@@H]1CCCC[C@@H]1F MCULE-3328673946 [1,0,0,1,0,0|1,0,1]=4 3064 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2753918610 [1,0,0,1,0,0|0,0,1]=3 3065 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2761271370 [1,0,0,1,0,0|0,0,1]=3 3066 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-4978213189 [1,0,0,1,0,0|0,0,1]=3 3067 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-9182719952 [1,0,0,1,0,0|0,0,1]=3 3068 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-3474870548 [1,0,0,1,0,0|1,0,1]=4 3069 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-3984172565 [1,0,0,1,0,0|1,0,1]=4 3070 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-4705427644 [1,0,0,1,0,0|1,0,1]=4 3071 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-7025237099 [1,0,0,1,0,0|1,0,1]=4 3072 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-1186999216 [1,0,0,1,0,0|1,0,1]=4 3073 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-2134025562 [1,0,0,1,0,0|1,0,1]=4 3074 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6149251599 [1,0,0,1,0,0|1,0,1]=4 3075 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6588424966 [1,0,0,1,0,0|1,0,1]=4 3076 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-1509174959 [1,0,0,1,0,0|0,0,1]=3 3077 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-2336529349 [1,0,0,1,0,0|0,0,1]=3 3078 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-4732604931 [1,0,0,1,0,0|0,0,1]=3 3079 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-6124510830 [1,0,0,1,0,0|0,0,1]=3 3080 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-7301593250 [1,0,0,1,0,0|0,0,1]=3 3081 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-8501577810 [1,0,0,1,0,0|0,0,1]=3 3082 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2058435105 [1,0,0,1,0,0|1,0,0]=3 3083 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2444659445 [1,0,0,1,0,0|1,0,0]=3 3084 B8R1.5 N[C@@H]1CCCNC1=O MCULE-3005560472 [1,0,0,1,0,0|1,0,0]=3 3085 B8R1.5 N[C@@H]1CCCNC1=O MCULE-6935410876 [1,0,0,1,0,0|1,0,0]=3 3086 B8R1.5 N[C@@H]1CCNC[C@H]1O MCULE-1435526553 [1,0,0,1,0,0|1,0,1]=4 3087 B8R1.5 N[C@@H]1CCNC[C@H]1O MCULE-8731873892 [1,0,0,1,0,0|1,0,1]=4 3088 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-1888816293 [1,0,0,1,0,0|1,0,1]=4 3089 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-3667258867 [1,0,0,1,0,0|1,0,1]=4 3090 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-3915823883 [1,0,0,1,0,0|1,0,1]=4 3091 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-9959521476 [1,0,0,1,0,0|1,0,1]=4 3092 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-1071839837 [1,0,0,1,0,0|1,0,1]=4 3093 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-6051401821 [1,0,0,1,0,0|1,0,1]=4 3094 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-7013720281 [1,0,0,1,0,0|1,0,1]=4 3095 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-8477518337 [1,0,0,1,0,0|1,0,1]=4 3096 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-1031623201 [1,0,0,1,0,0|1,0,1]=4 3097 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-2846030882 [1,0,0,1,0,0|1,0,1]=4 3098 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-8863364874 [1,0,0,1,0,0|1,0,1]=4 3099 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-9836639365 [1,0,0,1,0,0|1,0,1]=4 3100 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-4436769496 [1,0,0,1,0,0|1,0,1]=4 3101 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-6163244980 [1,0,0,1,0,0|1,0,1]=4 3102 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-8697534407 [1,0,0,1,0,0|1,0,1]=4 3103 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-9625047427 [1,0,0,1,0,0|1,0,1]=4 3104 B8R1.5 N[C@H]1CCCC[C@@H]1F MCULE-2983212378 [1,0,0,1,0,0|1,0,1]=4 3105 B8R1.5 N[C@H]1CCCC[C@@H]1F MCULE-6196710696 [1,0,0,1,0,0|1,0,1]=4 3106 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-3653211978 [1,0,0,1,0,0|1,0,1]=4 3107 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-5059719804 [1,0,0,1,0,0|1,0,1]=4 3108 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1277967673 [1,0,0,1,0,0|0,0,1]=3 3109 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1301750612 [1,0,0,1,0,0|0,0,1]=3 3110 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-3861922722 [1,0,0,1,0,0|0,0,1]=3 3111 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-8489439004 [1,0,0,1,0,0|0,0,1]=3 3112 B8R1.5 N[C@H]1CCCC[C@H]1F MCULE-7579368841 [1,0,0,1,0,0|1,0,1]=4 3113 B8R1.5 N[C@H]1CCCC[C@H]1F MCULE-8479221038 [1,0,0,1,0,0|1,0,1]=4 3114 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-2011367325 [1,0,0,1,0,0|1,0,1]=4 3115 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-7126233212 [1,0,0,1,0,0|1,0,1]=4 3116 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-1599409645 [1,0,0,1,0,0|0,0,1]=3 3117 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-3318800690 [1,0,0,1,0,0|0,0,1]=3 3118 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-4235445104 [1,0,0,1,0,0|0,0,1]=3 3119 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6518289705 [1,0,0,1,0,0|0,0,1]=3 3120 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6606691116 [1,0,0,1,0,0|0,0,1]=3 3121 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-9979333085 [1,0,0,1,0,0|0,0,1]=3 3122 B8R1.5 N[C@H]1CCCNC1=O MCULE-1247931890 [1,0,0,1,0,0|1,0,0]=3 3123 B8R1.5 N[C@H]1CCCNC1=O MCULE-2425510086 [1,0,0,1,0,0|1,0,0]=3 3124 B8R1.5 N[C@H]1CCCNC1=O MCULE-6121950966 [1,0,0,1,0,0|1,0,0]=3 3125 B8R1.5 N[C@H]1CCCNC1=O MCULE-7701042199 [1,0,0,1,0,0|1,0,0]=3 3126 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-1217623714 [1,0,0,1,0,0|1,0,1]=4 3127 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-4607259008 [1,0,0,1,0,0|1,0,1]=4 3128 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-4749541215 [1,0,0,1,0,0|1,0,1]=4 3129 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-9683658087 [1,0,0,1,0,0|1,0,1]=4 3130 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-1807586879 [1,0,0,1,0,0|1,0,1]=4 3131 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-1937023434 [1,0,0,1,0,0|1,0,1]=4 3132 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-4374635229 [1,0,0,1,0,0|1,0,1]=4 3133 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-4873019238 [1,0,0,1,0,0|1,0,1]=4 3134 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-1937054893 [1,0,0,1,0,0|1,0,1]=4 3135 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-4877924283 [1,0,0,1,0,0|1,0,1]=4 3136 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-6674323819 [1,0,0,1,0,0|1,0,1]=4 3137 B8R1.5 N[C@H]1COCC[C@H]1O MCULE-7305089306 [1,0,0,1,0,0|1,0,1]=4 3138 B8R1.5 N[C@H]1COCC[C@H]1O MCULE-8372108333 [1,0,0,1,0,0|1,0,1]=4 3139 B8R1.5 O=C1CCCCC1=O MCULE-5770827130 [1,0,0,1,0,0|1,0,1]=4 3140 B8R1.5 O=C1CCCCC1Br MCULE-9356057483 [1,0,0,1,0,0|1,0,0]=3 3141 B8R1.5 O=C1CCCCC1Cl MCULE-1580566298 [1,0,0,1,0,0|1,0,0]=3 3142 B8R1.5 O=C1CCCCC1F MCULE-6406930837 [1,0,0,1,0,0|1,0,0]=3 3143 B8R1.5 O=C1CCCCC1O MCULE-7509366699 [1,0,0,1,0,0|1,0,0]=3 3144 B8R1.5 O=C1CCNCC1Br MCULE-1607524353 [1,0,0,1,0,0|2,0,0]=4 3145 B8R1.5 O=C1CCNCC1Br MCULE-2623420651 [1,0,0,1,0,0|2,0,0]=4 3146 B8R1.5 O=C1CCNCC1Br MCULE-9921456309 [1,0,0,1,0,0|2,0,0]=4 3147 B8R1.5 O=C1CCNCC1F MCULE-4156323292 [1,0,0,1,0,0|2,0,0]=4 3148 B8R1.5 O=C1CCNCC1F MCULE-5488977269 [1,0,0,1,0,0|2,0,0]=4 3149 B8R1.5 O=C1CCNC[C@@H]1F MCULE-1703177711 [1,0,0,1,0,0|2,0,0]=4 3150 B8R1.5 O=C1CCNC[C@@H]1F MCULE-2722101377 [1,0,0,1,0,0|2,0,0]=4 3151 B8R1.5 O=C1CCNC[C@@H]1F MCULE-3843083136 [1,0,0,1,0,0|2,0,0]=4 3152 B8R1.5 O=C1CCNC[C@@H]1F MCULE-8423259867 [1,0,0,1,0,0|2,0,0]=4 3153 B8R1.5 O=C1CCNC[C@H]1F MCULE-4893691455 [1,0,0,1,0,0|2,0,0]=4 3154 B8R1.5 O=C1CCNC[C@H]1F MCULE-7014608979 [1,0,0,1,0,0|2,0,0]=4 3155 B8R1.5 O=C1CCOCC1Br MCULE-1103002154 [1,0,0,1,0,0|2,0,0]=4 3156 B8R1.5 O=C1CCOCC1Cl MCULE-6926183930 [1,0,0,1,0,0|2,0,0]=4 3157 B8R1.5 O=C1CCOCC1F MCULE-8590362767 [1,0,0,1,0,0|2,0,0]=4 3158 B8R1.5 O=C1CCOCC1O MCULE-7032874317 [1,0,0,1,0,0|2,0,0]=4 3159 B8R1.5 O=C1CCOC[C@@H]1Br MCULE-8729201111 [1,0,0,1,0,0|2,0,0]=4 3160 B8R1.5 O=C1CCOC[C@@H]1F MCULE-3075219245 [1,0,0,1,0,0|2,0,0]=4 3161 B8R1.5 O=C1NCCCC1Br MCULE-1860833784 [1,0,0,1,0,0|2,0,0]=4 3162 B8R1.5 O=C1NCCCC1O MCULE-4922755542 [1,0,0,1,0,0|2,0,0]=4 3163 B8R1.5 O=C1NCCC[C@@H]1O MCULE-2813817931 [1,0,0,1,0,0|2,0,0]=4 3164 B8R1.5 O=C1NCCC[C@@H]1O MCULE-3354550946 [1,0,0,1,0,0|2,0,0]=4 3165 B8R1.5 O=C1NCCC[C@H]1O MCULE-2892218765 [1,0,0,1,0,0|2,0,0]=4 3166 B8R1.5 O=C1NCCC[C@H]1O MCULE-8394704933 [1,0,0,1,0,0|2,0,0]=4 3167 B8R1.5 O=C1OCCCC1Br MCULE-4407787541 [1,0,0,1,0,0|2,0,0]=4 3168 B8R1.5 O=C1OCCCC1O MCULE-3021418071 [1,0,0,1,0,0|2,0,0]=4 3169 B8R1.5 OC1CCCCC1Cl MCULE-8650942069 [1,0,0,1,0,0|1,0,1]=4 3170 B8R1.5 OC1CCCCC1F MCULE-7634543650 [1,0,0,1,0,0|1,0,1]=4 3171 B8R1.5 OC1CCCCC1O MCULE-2967360901 [1,0,0,1,0,0|1,0,1]=4 3172 B8R1.5 O[C@@H]1CCCC[C@H]1F MCULE-2305949625 [1,0,0,1,0,0|1,0,1]=4 3173 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3067807104 [1,0,0,1,0,0|1,0,1]=4 3174 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3429096841 [1,0,0,1,0,0|1,0,1]=4 3175 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-9892753066 [1,0,0,1,0,0|1,0,1]=4 3176 B8R1.5 O[C@@H]1CCCC[C@H]1S MCULE-6222162383 [1,0,0,1,0,0|1,0,1]=4 3177 B8R1.5 O[C@H]1CCCC[C@@H]1F MCULE-7833708338 [1,0,0,1,0,0|1,0,1]=4 3178 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-7078207162 [1,0,0,1,0,0|1,0,1]=4 3179 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-9836847707 [1,0,0,1,0,0|1,0,1]=4 3180 B8R1.5 O[C@H]1CCCC[C@H]1Br MCULE-8133807743 [1,0,0,1,0,0|1,0,1]=4 3181 B8R1.5 O[C@H]1CCCC[C@H]1O MCULE-3539097516 [1,0,0,1,0,0|1,0,1]=4 3182 B8R1.5 [C@@H]1(CCOC[C@@H]1O)N MCULE-2201413833 [1,0,0,1,0,0|1,0,1]=4 3183 B8R1.5 [C@@H]1(CCOC[C@H]1N)O MCULE-7745052941 [1,0,0,1,0,0|1,0,1]=4 3184 B8R1.5 [C@@H]1(COCC[C@@H]1O)N MCULE-2864950342 [1,0,0,1,0,0|1,0,1]=4 3185 B8R1.5 [C@H]1(CCCC[C@H]1F)O MCULE-7751753244 [1,0,0,1,0,0|1,0,1]=4 3186 B8R1.5 [C@H]1(CCOC[C@@H]1O)N MCULE-3291339796 [1,0,0,1,0,0|1,0,1]=4 3187 B8R1.5 [C@H]1(CCOC[C@@H]1O)N MCULE-5641035715 [1,0,0,1,0,0|1,0,1]=4 3188 B8R1.5 [C@H]1(COCC[C@H]1N)O MCULE-2088495989 [1,0,0,1,0,0|1,0,1]=4 3189 B8R1.5 [C@H]1(COCC[C@H]1O)N MCULE-5409068801 [1,0,0,1,0,0|1,0,1]=4 3190 B8R1.8 BrCCC1CCCN1 MCULE-2232238063 [1,0,0,1,0,0|1,0,1]=4 3191 B8R1.8 BrCCC1CCCN1 MCULE-4566190828 [1,0,0,1,0,0|1,0,1]=4 3192 B8R1.8 BrCCC1CCCO1 MCULE-6674503285 [1,0,0,1,0,0|1,0,1]=4 3193 B8R1.8 C1(CCCN1)COC MCULE-7740200307 [1,0,0,1,0,0|2,0,0]=4 3194 B8R1.8 C=CCC1CCCC1 MCULE-6306576171 [1,0,0,1,0,0|2,0,0]=4 3195 B8R1.8 C=CCC1CCCN1 MCULE-2522287788 [1,0,0,1,0,0|1,0,0]=3 3196 B8R1.8 C=CCC1CCCN1 MCULE-9373442327 [1,0,0,1,0,0|1,0,0]=3 3197 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-1619177702 [1,0,0,1,0,0|1,0,0]=3 3198 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-1817861281 [1,0,0,1,0,0|1,0,0]=3 3199 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-4058658588 [1,0,0,1,0,0|1,0,0]=3 3200 B8R1.8 C=CC[C@@H]1CCCN1 MCULE-5972924318 [1,0,0,1,0,0|1,0,0]=3 3201 B8R1.8 C=CC[C@H]1CCCN1 MCULE-4617277800 [1,0,0,1,0,0|1,0,0]=3 3202 B8R1.8 C=CC[C@H]1CCCN1 MCULE-6182243336 [1,0,0,1,0,0|1,0,0]=3 3203 B8R1.8 CCCC1C=CCC1 MCULE-9112058760 [1,0,0,1,0,0|2,0,0]=4 3204 B8R1.8 CCCC1CCCN1 MCULE-5407564403 [1,0,0,1,0,0|1,0,1]=4 3205 B8R1.8 CCCC1CCCN1 MCULE-7322918348 [1,0,0,1,0,0|1,0,1]=4 3206 B8R1.8 CNCC1CCCN1 MCULE-4712712967 [1,0,0,1,0,0|2,0,0]=4 3207 B8R1.8 CNCC1CCCN1 MCULE-5324951635 [1,0,0,1,0,0|2,0,0]=4 3208 B8R1.8 CNC[C@@H]1CCCN1 MCULE-5179827632 [1,0,0,1,0,0|2,0,0]=4 3209 B8R1.8 CNC[C@@H]1CCCN1 MCULE-5716678959 [1,0,0,1,0,0|2,0,0]=4 3210 B8R1.8 CNC[C@@H]1CCCN1 MCULE-5978107840 [1,0,0,1,0,0|2,0,0]=4 3211 B8R1.8 CNC[C@H]1CCCN1 MCULE-1238692148 [1,0,0,1,0,0|2,0,0]=4 3212 B8R1.8 CNC[C@H]1CCCN1 MCULE-8720393230 [1,0,0,1,0,0|2,0,0]=4 3213 B8R1.8 COCC1CCCN1 MCULE-3490399589 [1,0,0,1,0,0|2,0,0]=4 3214 B8R1.8 COCC1CCCN1 MCULE-7671263939 [1,0,0,1,0,0|2,0,0]=4 3215 B8R1.8 COC[C@@H]1CCCN1 MCULE-2033169765 [1,0,0,1,0,0|2,0,0]=4 3216 B8R1.8 COC[C@@H]1CCCN1 MCULE-2588521588 [1,0,0,1,0,0|2,0,0]=4 3217 B8R1.8 COC[C@@H]1CCCN1 MCULE-9107605896 [1,0,0,1,0,0|2,0,0]=4 3218 B8R1.8 COC[C@@H]1CCCN1 MCULE-9163912821 [1,0,0,1,0,0|2,0,0]=4 3219 B8R1.8 COC[C@H]1CCCN1 MCULE-4066409185 [1,0,0,1,0,0|2,0,0]=4 3220 B8R1.8 COC[C@H]1CCCN1 MCULE-4591980137 [1,0,0,1,0,0|2,0,0]=4 3221 B8R1.8 COC[C@H]1CCCN1 MCULE-4935200138 [1,0,0,1,0,0|2,0,0]=4 3222 B8R1.8 COC[C@H]1CCCN1 MCULE-7300265857 [1,0,0,1,0,0|2,0,0]=4 3223 B8R1.8 CSCC1CCCN1 MCULE-9005961775 [1,0,0,1,0,0|2,0,0]=4 3224 B8R1.8 ClCCC1CCCO1 MCULE-5564811515 [1,0,0,1,0,0|1,0,1]=4 3225 B8R1.8 NCCC1CC=CC1 MCULE-1981261517 [1,0,0,1,0,0|1,0,1]=4 3226 B8R1.8 NCCC1CC=CC1 MCULE-5939427419 [1,0,0,1,0,0|1,0,1]=4 3227 B8R1.8 NCCC1CCCC1 MCULE-1321612615 [1,0,0,1,0,0|1,0,1]=4 3228 B8R1.8 NCCC1CCCC1 MCULE-2815985200 [1,0,0,1,0,0|1,0,1]=4 3229 B8R1.8 NCCC1CCCC1 MCULE-4452900288 [1,0,0,1,0,0|1,0,1]=4 3230 B8R1.8 NCCC1CCCN1 MCULE-3948200302 [1,0,0,1,0,0|1,0,1]=4 3231 B8R1.8 NCCC1CCCN1 MCULE-8874469745 [1,0,0,1,0,0|1,0,1]=4 3232 B8R1.8 NCCC1CCCO1 MCULE-3914619069 [1,0,0,1,0,0|0,0,1]=3 3233 B8R1.8 NCCC1CCCS1 MCULE-7458730281 [1,0,0,1,0,0|0,1,1]=4 3234 B8R1.8 NCCC1CCCS1 MCULE-8525017759 [1,0,0,1,0,0|0,1,1]=4 3235 B8R1.8 NCCC1CCOC1 MCULE-6310605956 [1,0,0,1,0,0|2,0,0]=4 3236 B8R1.8 NCCC1CCOC1 MCULE-9247340750 [1,0,0,1,0,0|2,0,0]=4 3237 B8R1.8 NCCC1CCSC1 MCULE-3085969507 [1,0,0,1,0,0|2,0,0]=4 3238 B8R1.8 NCCC1OCCO1 MCULE-1472103372 [1,0,0,1,0,0|1,0,1]=4 3239 B8R1.8 NCC[C@H]1CCCO1 MCULE-2485674670 [1,0,0,1,0,0|0,0,1]=3 3240 B8R1.8 NCC[C@H]1CCCO1 MCULE-3778854223 [1,0,0,1,0,0|0,0,1]=3 3241 B8R1.8 NNCC1CCCO1 MCULE-1236160453 [1,0,0,1,0,0|1,0,1]=4 3242 B8R1.8 NNCC1CCCO1 MCULE-3775714919 [1,0,0,1,0,0|1,0,1]=4 3243 B8R1.8 O=CCC1CCCC1 MCULE-1337960294 [1,0,0,1,0,0|1,0,0]=3 3244 B8R1.8 O=CCC1CCOC1 MCULE-3891672561 [1,0,0,1,0,0|2,0,0]=4 3245 B8R1.8 O=CCC1OCCO1 MCULE-1412194468 [1,0,0,1,0,0|2,0,0]=4 3246 B8R1.8 O=CCN1CCCC1 MCULE-4391534239 [1,0,0,1,0,0|2,0,0]=4 3247 B8R1.8 O=CNC1CCCC1 MCULE-1453368274 [1,0,0,1,0,0|2,0,0]=4 3248 B8R1.8 OCCC1CCCC1 MCULE-3680571056 [1,0,0,1,0,0|1,0,1]=4 3249 B8R1.8 OCCC1CCCN1 MCULE-3516684599 [1,0,0,1,0,0|0,0,1]=3 3250 B8R1.8 OCCC1CCCN1 MCULE-7335032539 [1,0,0,1,0,0|0,0,1]=3 3251 B8R1.8 OCCC1CCCO1 MCULE-4437776676 [1,0,0,1,0,0|1,0,1]=4 3252 B8R1.8 OCC[C@@H]1CCCN1 MCULE-5399846336 [1,0,0,1,0,0|0,0,1]=3 3253 B8R1.8 OCC[C@H]1CCCN1 MCULE-9442938016 [1,0,0,1,0,0|0,0,1]=3 3254 B8R1.10 NCCCC1CCC1 MCULE-7549286728 [1,0,0,1,0,0|1,0,1]=4 3255 B8R1.10 O=CCCC1CCC1 MCULE-9673511848 [1,0,0,1,0,0|1,0,0]=3 3256 B8R1.10 O=CCCC1CCO1 MCULE-1882673341 [1,0,0,1,0,0|1,0,0]=3 3257 B8R1.10 OCCCC1CCC1 MCULE-1577610703 [1,0,0,1,0,0|1,0,1]=4 3258 B8R1.11 C1(CCCN1C)CN MCULE-3823756764 [1,0,0,1,0,0|2,0,0]=4 3259 B8R1.11 CC1CCCC1CN MCULE-3896736641 [1,0,0,1,0,0|1,0,1]=4 3260 B8R1.11 CC1CCCC1CN MCULE-8678978716 [1,0,0,1,0,0|1,0,1]=4 3261 B8R1.11 CC1CCCC1CO MCULE-9356546543 [1,0,0,1,0,0|1,0,1]=4 3262 B8R1.11 CC1OCCC1C=O MCULE-5505705817 [1,0,0,1,0,0|2,0,0]=4 3263 B8R1.11 CCC1CCCC1=O MCULE-1884299455 [1,0,0,1,0,0|1,0,0]=3 3264 B8R1.11 CCC1CCCC1N MCULE-3368757457 [1,0,0,1,0,0|1,0,1]=4 3265 B8R1.11 CCC1CCNC1=O MCULE-8307536027 [1,0,0,1,0,0|2,0,0]=4 3266 B8R1.11 CCC1CCOC1=O MCULE-2375464273 [1,0,0,1,0,0|2,0,0]=4 3267 B8R1.11 CCC1COCC1=O MCULE-5486171882 [1,0,0,1,0,0|2,0,0]=4 3268 B8R1.11 CCN1CCCC1=O MCULE-7206309773 [1,0,0,1,0,0|2,0,0]=4 3269 B8R1.11 CCN1CCCC1=O MCULE-7415495937 [1,0,0,1,0,0|2,0,0]=4 3270 B8R1.11 CC[C@@H]1CCC[C@H]1N MCULE-6461151240 [1,0,0,1,0,0|1,0,1]=4 3271 B8R1.11 CN1CCCC1CN MCULE-2455567320 [1,0,0,1,0,0|2,0,0]=4 3272 B8R1.11 CN1CCCC1CN MCULE-4385272553 [1,0,0,1,0,0|2,0,0]=4 3273 B8R1.11 CN1CCCC1CN MCULE-6012303918 [1,0,0,1,0,0|2,0,0]=4 3274 B8R1.11 CN1CCC[C@@H]1CN MCULE-6894579934 [1,0,0,1,0,0|2,0,0]=4 3275 B8R1.11 CN1CCC[C@@H]1CN MCULE-9545868600 [1,0,0,1,0,0|2,0,0]=4 3276 B8R1.11 CN1CCC[C@@H]1CN MCULE-9979136465 [1,0,0,1,0,0|2,0,0]=4 3277 B8R1.11 CN1CCC[C@H]1C=O MCULE-5852490757 [1,0,0,1,0,0|2,0,0]=4 3278 B8R1.11 CN1CCC[C@H]1CN MCULE-5808625886 [1,0,0,1,0,0|2,0,0]=4 3279 B8R1.11 CN1CCC[C@H]1CN MCULE-7551556135 [1,0,0,1,0,0|2,0,0]=4 3280 B8R1.11 CN1CCC[C@H]1CN MCULE-8399390985 [1,0,0,1,0,0|2,0,0]=4 3281 B8R1.11 CN1CCC[C@H]1CN MCULE-9386333411 [1,0,0,1,0,0|2,0,0]=4 3282 B8R1.11 COC1CCCC1=O MCULE-2741778082 [1,0,0,1,0,0|2,0,0]=4 3283 B8R1.11 COC1CCCC1N MCULE-8362175674 [1,0,0,1,0,0|2,0,0]=4 3284 B8R1.11 COC1CCCC1N MCULE-9069118012 [1,0,0,1,0,0|2,0,0]=4 3285 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-4692120885 [1,0,0,1,0,0|2,0,0]=4 3286 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-5926423252 [1,0,0,1,0,0|2,0,0]=4 3287 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-7482120389 [1,0,0,1,0,0|2,0,0]=4 3288 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-8564106437 [1,0,0,1,0,0|2,0,0]=4 3289 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-3230499380 [1,0,0,1,0,0|2,0,0]=4 3290 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-3289874569 [1,0,0,1,0,0|2,0,0]=4 3291 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-6247013104 [1,0,0,1,0,0|2,0,0]=4 3292 B8R1.11 CO[C@H]1CCC[C@@H]1N MCULE-2030514470 [1,0,0,1,0,0|2,0,0]=4 3293 B8R1.11 CO[C@H]1CCC[C@@H]1N MCULE-7221434150 [1,0,0,1,0,0|2,0,0]=4 3294 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-5694225216 [1,0,0,1,0,0|2,0,0]=4 3295 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-6324790556 [1,0,0,1,0,0|2,0,0]=4 3296 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-7994033941 [1,0,0,1,0,0|2,0,0]=4 3297 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-9253743808 [1,0,0,1,0,0|2,0,0]=4 3298 B8R1.11 CSC1CCCC1N MCULE-2843614842 [1,0,0,1,0,0|2,0,0]=4 3299 B8R1.11 N#CC1CCCC1=O MCULE-6254621629 [1,0,0,1,0,0|0,0,2]=4 3300 B8R1.11 N#CC1CCCC1N MCULE-2657790377 [1,0,0,1,0,0|1,0,1]=4 3301 B8R1.11 N#CC1CCCC1N MCULE-3586283447 [1,0,0,1,0,0|1,0,1]=4 3302 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-3868705638 [1,0,0,1,0,0|1,0,1]=4 3303 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-5875539247 [1,0,0,1,0,0|1,0,1]=4 3304 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-8719885109 [1,0,0,1,0,0|1,0,1]=4 3305 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-9418838624 [1,0,0,1,0,0|1,0,1]=4 3306 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-3483623297 [1,0,0,1,0,0|1,0,1]=4 3307 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-3989890564 [1,0,0,1,0,0|1,0,1]=4 3308 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-8145436082 [1,0,0,1,0,0|1,0,1]=4 3309 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-8299410277 [1,0,0,1,0,0|1,0,1]=4 3310 B8R1.11 NC1CCCC1CO MCULE-9652022908 [1,0,0,1,0,0|0,0,1]=3 3311 B8R1.11 NC1COCC1CO MCULE-6651647999 [1,0,0,1,0,0|1,0,1]=4 3312 B8R1.11 NCC1CCCC1=O MCULE-4144323636 [1,0,0,1,0,0|0,0,0]=2 3313 B8R1.11 NCC1CCCC1=O MCULE-8761719757 [1,0,0,1,0,0|0,0,0]=2 3314 B8R1.11 NCC1CCCC1F MCULE-6144218913 [1,0,0,1,0,0|1,0,1]=4 3315 B8R1.11 NCC1CCCC1F MCULE-6567537087 [1,0,0,1,0,0|1,0,1]=4 3316 B8R1.11 NCC1CCCC1N MCULE-8430269654 [1,0,0,1,0,0|1,0,1]=4 3317 B8R1.11 NCC1CCCC1O MCULE-6648305550 [1,0,0,1,0,0|0,0,1]=3 3318 B8R1.11 NCC1CCOC1=O MCULE-5843107965 [1,0,0,1,0,0|1,0,0]=3 3319 B8R1.11 NCC1CCOC1=O MCULE-6077637171 [1,0,0,1,0,0|1,0,0]=3 3320 B8R1.11 NCC1COCC1O MCULE-7629136815 [1,0,0,1,0,0|1,0,1]=4 3321 B8R1.11 NCC1COCC1O MCULE-9331285001 [1,0,0,1,0,0|1,0,1]=4 3322 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-1610227273 [1,0,0,1,0,0|1,0,1]=4 3323 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-1834909475 [1,0,0,1,0,0|1,0,1]=4 3324 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-2170917176 [1,0,0,1,0,0|1,0,1]=4 3325 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-2741482456 [1,0,0,1,0,0|1,0,1]=4 3326 B8R1.11 NC[C@@H]1COC[C@@H]1O MCULE-1244186811 [1,0,0,1,0,0|1,0,1]=4 3327 B8R1.11 NC[C@@H]1COC[C@@H]1O MCULE-6610306543 [1,0,0,1,0,0|1,0,1]=4 3328 B8R1.11 NC[C@@H]1COC[C@H]1O MCULE-3050365915 [1,0,0,1,0,0|1,0,1]=4 3329 B8R1.11 NC[C@@H]1COC[C@H]1O MCULE-7562651947 [1,0,0,1,0,0|1,0,1]=4 3330 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-3389541880 [1,0,0,1,0,0|1,0,1]=4 3331 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-4457950567 [1,0,0,1,0,0|1,0,1]=4 3332 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-8588609893 [1,0,0,1,0,0|1,0,1]=4 3333 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-9441669251 [1,0,0,1,0,0|1,0,1]=4 3334 B8R1.11 NC[C@H]1COC[C@H]1O MCULE-8711391145 [1,0,0,1,0,0|1,0,1]=4 3335 B8R1.11 NC[C@H]1COC[C@H]1O MCULE-9812036421 [1,0,0,1,0,0|1,0,1]=4 3336 B8R1.11 NN1CCCC1CO MCULE-1842894120 [1,0,0,1,0,0|1,0,1]=4 3337 B8R1.11 NN1CCC[C@H]1CO MCULE-2058705707 [1,0,0,1,0,0|1,0,1]=4 3338 B8R1.11 NNC1CCCC1O MCULE-4679888412 [1,0,0,1,0,0|1,0,1]=4 3339 B8R1.11 NN[C@@H]1CCC[C@H]1O MCULE-6631597748 [1,0,0,1,0,0|1,0,1]=4 3340 B8R1.11 NN[C@@H]1CCC[C@H]1O MCULE-9568290705 [1,0,0,1,0,0|1,0,1]=4 3341 B8R1.11 NOC1CCOC1=O MCULE-1912651031 [1,0,0,1,0,0|2,0,0]=4 3342 B8R1.11 N[C@@H]1CCC[C@H]1CO MCULE-7218353328 [1,0,0,1,0,0|0,0,1]=3 3343 B8R1.11 N[C@@H]1COC[C@@H]1CO MCULE-8267820303 [1,0,0,1,0,0|1,0,1]=4 3344 B8R1.11 N[C@@H]1COC[C@H]1CO MCULE-3070797384 [1,0,0,1,0,0|1,0,1]=4 3345 B8R1.11 N[C@@H]1COC[C@H]1CO MCULE-4572096805 [1,0,0,1,0,0|1,0,1]=4 3346 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-3793323277 [1,0,0,1,0,0|0,0,1]=3 3347 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-5297422093 [1,0,0,1,0,0|0,0,1]=3 3348 B8R1.11 N[C@H]1COC[C@@H]1CO MCULE-2948740480 [1,0,0,1,0,0|1,0,1]=4 3349 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-3409455124 [1,0,0,1,0,0|1,0,1]=4 3350 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-6058647833 [1,0,0,1,0,0|1,0,1]=4 3351 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-6847790594 [1,0,0,1,0,0|1,0,1]=4 3352 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-8456266436 [1,0,0,1,0,0|1,0,1]=4 3353 B8R1.11 O=C1CCCC1CO MCULE-9171970685 [1,0,0,1,0,0|1,0,0]=3 3354 B8R1.11 O=C1CCCN1CBr MCULE-1337183945 [1,0,0,1,0,0|2,0,0]=4 3355 B8R1.11 O=C1CCCN1CCl MCULE-6204630639 [1,0,0,1,0,0|2,0,0]=4 3356 B8R1.11 O=C1CCCN1CO MCULE-6508920438 [1,0,0,1,0,0|2,0,0]=4 3357 B8R1.11 O=C1NCCC1CO MCULE-8442279545 [1,0,0,1,0,0|2,0,0]=4 3358 B8R1.11 O=C1NCC[C@@H]1CO MCULE-5339343040 [1,0,0,1,0,0|2,0,0]=4 3359 B8R1.11 OCC1CCCC1O MCULE-7244611817 [1,0,0,1,0,0|1,0,1]=4 3360 B8R1.11 [C@H]1(CCC[C@H]1CO)N MCULE-8523302139 [1,0,0,1,0,0|0,0,1]=3 3361 B8R1.11 [C@H]1(COC[C@@H]1CN)O MCULE-1038770438 [1,0,0,1,0,0|1,0,1]=4 3362 B8R1.11 [C@H]1(COC[C@H]1CN)O MCULE-3362382906 [1,0,0,1,0,0|1,0,1]=4 3363 B8R1.11 [C@H]1(COC[C@H]1CN)O MCULE-8153203630 [1,0,0,1,0,0|1,0,1]=4 3364 B8R1.12 C1(CCC1CO)CO MCULE-2925182914 [1,0,0,1,0,0|1,0,1]=4 3365 B8R1.12 NCC1CCC1CN MCULE-4127003858 [1,0,0,1,0,0|1,0,1]=4 3366 B8R1.12 NC[C@@H]1CC[C@H]1CN MCULE-1825799395 [1,0,0,1,0,0|1,0,1]=4 3367 B8R1.12 NC[C@@H]1CC[C@H]1CN MCULE-8343153828 [1,0,0,1,0,0|1,0,1]=4 3368 B8R1.12 OC[C@@H]1CC[C@H]1CO MCULE-9248215797 [1,0,0,1,0,0|1,0,1]=4 3369 B8R1.12 [C@@H]1(CC[C@H]1CO)CO MCULE-3818148307 [1,0,0,1,0,0|1,0,1]=4 3370 B8R1.13 C=CCC1CCC1=O MCULE-1128394688 [1,0,0,1,0,0|1,0,1]=4 3371 B8R1.13 CCCC1CCC1=O MCULE-7626165824 [1,0,0,1,0,0|1,0,0]=3 3372 B8R1.13 COCC1CCC1N MCULE-2980403375 [1,0,0,1,0,0|2,0,0]=4 3373 B8R1.13 COCC1CCC1N MCULE-4247085069 [1,0,0,1,0,0|2,0,0]=4 3374 B8R1.13 COC[C@@H]1CC[C@@H]1N MCULE-1015639522 [1,0,0,1,0,0|2,0,0]=4 3375 B8R1.13 COC[C@@H]1CC[C@@H]1N MCULE-6601508773 [1,0,0,1,0,0|2,0,0]=4 3376 B8R1.13 COC[C@@H]1CC[C@H]1N MCULE-4823593055 [1,0,0,1,0,0|2,0,0]=4 3377 B8R1.13 COC[C@@H]1CC[C@H]1N MCULE-6349984221 [1,0,0,1,0,0|2,0,0]=4 3378 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-2210338858 [1,0,0,1,0,0|2,0,0]=4 3379 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-2877629860 [1,0,0,1,0,0|2,0,0]=4 3380 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-5582450257 [1,0,0,1,0,0|2,0,0]=4 3381 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-5666025932 [1,0,0,1,0,0|2,0,0]=4 3382 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-6479999687 [1,0,0,1,0,0|2,0,0]=4 3383 B8R1.13 COC[C@H]1CC[C@@H]1N MCULE-9238987984 [1,0,0,1,0,0|2,0,0]=4 3384 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-4476949370 [1,0,0,1,0,0|2,0,0]=4 3385 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-4812696512 [1,0,0,1,0,0|2,0,0]=4 3386 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-5922011030 [1,0,0,1,0,0|2,0,0]=4 3387 B8R1.13 COC[C@H]1CC[C@H]1N MCULE-8467603557 [1,0,0,1,0,0|2,0,0]=4 3388 B8R1.13 O=C1CCC1CCCl MCULE-1577834742 [1,0,0,1,0,0|1,0,0]=3 3389 B8R1.17 CNCC1CC1CN MCULE-9603697675 [1,0,0,1,0,0|2,0,0]=4 3390 B8R1.22 BrC1=CCCCCC1 MCULE-1629255872 [1,0,0,1,0,0|2,0,0]=4 3391 B8R1.22 BrC1C=CCCCC1 MCULE-3305569927 [1,0,0,1,0,0|2,0,0]=4 3392 B8R1.22 CC1CCCCCN1 MCULE-2095896439 [1,0,0,1,0,0|1,0,1]=4 3393 B8R1.22 CC1CCCCCN1 MCULE-5848089936 [1,0,0,1,0,0|1,0,1]=4 3394 B8R1.22 C[C@@H]1CCCCCN1 MCULE-6288089261 [1,0,0,1,0,0|1,0,1]=4 3395 B8R1.22 C[C@@H]1CCCCCN1 MCULE-9958468096 [1,0,0,1,0,0|1,0,1]=4 3396 B8R1.22 C[C@H]1CCCCCN1 MCULE-2291249179 [1,0,0,1,0,0|1,0,1]=4 3397 B8R1.22 C[C@H]1CCCCCN1 MCULE-2695293080 [1,0,0,1,0,0|1,0,1]=4 3398 B8R1.22 NC1=NCCCCC1 MCULE-2757008672 [1,0,0,1,0,0|1,0,1]=4 3399 B8R1.22 NC1=NCCCCC1 MCULE-7781415779 [1,0,0,1,0,0|1,0,1]=4 3400 B8R1.22 NC1C=CCCCC1 MCULE-4893389838 [1,0,0,1,0,0|1,0,0]=3 3401 B8R1.22 NC1CCCCCC1 MCULE-6214185878 [1,0,0,1,0,0|1,0,1]=4 3402 B8R1.22 NC1CCCCNC1 MCULE-9702629623 [1,0,0,1,0,0|2,0,0]=4 3403 B8R1.22 NC1CCCCNC1 MCULE-9973726441 [1,0,0,1,0,0|2,0,0]=4 3404 B8R1.22 N[C@@H]1CCCCNC1 MCULE-4063472101 [1,0,0,1,0,0|2,0,0]=4 3405 B8R1.22 N[C@@H]1CCCCNC1 MCULE-6734296273 [1,0,0,1,0,0|2,0,0]=4 3406 B8R1.22 N[C@H]1CCCCNC1 MCULE-2962012084 [1,0,0,1,0,0|2,0,0]=4 3407 B8R1.22 N[C@H]1CCCCNC1 MCULE-4348209410 [1,0,0,1,0,0|2,0,0]=4 3408 B8R1.22 N[C@H]1CCCCNC1 MCULE-5018449571 [1,0,0,1,0,0|2,0,0]=4 3409 B8R1.22 N[C@H]1CCCCNC1 MCULE-6428493067 [1,0,0,1,0,0|2,0,0]=4 3410 B8R1.22 N[C@H]1CCCCNC1 MCULE-9621520180 [1,0,0,1,0,0|2,0,0]=4 3411 B8R1.22 O=C1C=CCCCC1 MCULE-5281461360 [1,0,0,1,0,0|1,0,1]=4 3412 B8R1.22 O=C1C=CCCCN1 MCULE-6257739832 [1,0,0,1,0,0|0,0,2]=4 3413 B8R1.22 O=C1CCCCCC1 MCULE-3507111924 [1,0,0,1,0,0|1,0,0]=3 3414 B8R1.22 O=C1CCCCCN1 MCULE-4544579564 [1,0,0,1,0,0|0,0,0]=2 3415 B8R1.22 O=C1CCCCCO1 MCULE-3051096014 [1,0,0,1,0,0|1,0,0]=3 3416 B8R1.22 O=C1CCCCNC1 MCULE-8257380915 [1,0,0,1,0,0|2,0,0]=4 3417 B8R1.22 O=C1CCCCNC1 MCULE-8344538815 [1,0,0,1,0,0|2,0,0]=4 3418 B8R1.22 O=C1CCCNCC1 MCULE-3201401906 [1,0,0,1,0,0|2,0,0]=4 3419 B8R1.22 O=C1CCCNCC1 MCULE-8264253371 [1,0,0,1,0,0|2,0,0]=4 3420 B8R1.22 O=C1CCCOCC1 MCULE-9595066384 [1,0,0,1,0,0|2,0,0]=4 3421 B8R1.22 O=C1CCCSCC1 MCULE-9359592851 [1,0,0,1,0,0|2,0,0]=4 3422 B8R1.22 O=C1CCNCCN1 MCULE-1678306131 [1,0,0,1,0,0|1,0,0]=3 3423 B8R1.22 O=C1CCNCCN1 MCULE-1867860146 [1,0,0,1,0,0|1,0,0]=3 3424 B8R1.22 O=C1CCOCCN1 MCULE-6881734685 [1,0,0,1,0,0|1,0,0]=3 3425 B8R1.22 O=C1CCOCCO1 MCULE-1433837187 [1,0,0,1,0,0|2,0,0]=4 3426 B8R1.22 O=C1CCSCCN1 MCULE-9445131358 [1,0,0,1,0,0|1,0,0]=3 3427 B8R1.22 O=C1CNCCCN1 MCULE-6106237928 [1,0,0,1,0,0|1,0,0]=3 3428 B8R1.22 O=C1CNCCCN1 MCULE-9943393784 [1,0,0,1,0,0|1,0,0]=3 3429 B8R1.22 O=C1COCCCN1 MCULE-1471963909 [1,0,0,1,0,0|1,0,0]=3 3430 B8R1.22 O=C1OCCCCO1 MCULE-1107419276 [1,0,0,1,0,0|2,0,0]=4 3431 B8R1.22 OC1CCCCCC1 MCULE-2514105258 [1,0,0,1,0,0|1,0,1]=4 3432 B8R1.22 S=C1CCCCCN1 MCULE-6573611309 [1,0,0,1,0,0|0,1,0]=3 3433 B8R1.22 S=C1NCCCCN1 MCULE-5312414479 [1,0,0,1,0,0|1,1,0]=4 3434 B8R1.36 CCCCCC1CO1 MCULE-2249864409 [1,0,0,1,0,0|1,0,1]=4 3435 B8R1.36 NCCCCC1CC1 MCULE-8530038799 [1,0,0,1,0,0|1,0,1]=4 3436 B8R1.36 O=CCCCC1CC1 MCULE-4652283620 [1,0,0,1,0,0|1,0,0]=3 3437 B8R1.36 OCCCCC1CC1 MCULE-6334640431 [1,0,0,1,0,0|1,0,1]=4 3438 B8R1.36 OCCCCC1CO1 MCULE-4018278864 [1,0,0,1,0,0|1,0,1]=4 3439 B8R1.49 C1=CCCCCCC1 MCULE-9704495201 [1,0,0,1,0,0|2,0,0]=4 3440 B8R1.49 C1=CCCCCCC1 MCULE-9874244790 [1,0,0,1,0,0|2,0,0]=4 3441 B8R1.49 C1CCCNCCC1 MCULE-5976326835 [1,0,0,1,0,0|1,0,1]=4 3442 B8R1.49 C1CCCNCCC1 MCULE-9979746026 [1,0,0,1,0,0|1,0,1]=4 3443 B8R1.1 C1(CCC(=O)N1)CBr MCULE-4451864575 [1,0,0,1,0,0|2,0,0]=4 3444 B8R1.1 C1(CCC(=O)N1)CN MCULE-3169700074 [1,0,0,1,0,0|1,0,0]=3 3445 B8R1.1 C1(CCC(=O)N1)CO MCULE-8513534447 [1,0,0,1,0,0|2,0,0]=4 3446 B8R1.1 C1(CNC(=O)C1)CN MCULE-6663370335 [1,0,0,1,0,0|2,0,0]=4 3447 B8R1.1 C1(CNC(=O)C1)CN MCULE-8237162259 [1,0,0,1,0,0|2,0,0]=4 3448 B8R1.1 C1(CNC(=O)O1)CO MCULE-2451079587 [1,0,0,1,0,0|2,0,0]=4 3449 B8R1.1 CC1CCC(O1)CN MCULE-4161233821 [1,0,0,1,0,0|1,0,1]=4 3450 B8R1.1 CCC1=CC(=O)CC1 MCULE-6681801286 [1,0,0,1,0,0|1,0,1]=4 3451 B8R1.1 CCC1C=CC(=O)O1 MCULE-8058927851 [1,0,0,1,0,0|0,0,2]=4 3452 B8R1.1 CCC1CC(=O)CO1 MCULE-7105024194 [1,0,0,1,0,0|2,0,0]=4 3453 B8R1.1 CCC1CCC(=O)C1 MCULE-8455504217 [1,0,0,1,0,0|1,0,0]=3 3454 B8R1.1 CCC1CCC(=O)N1 MCULE-6150249637 [1,0,0,1,0,0|1,0,0]=3 3455 B8R1.1 CCC1CCC(=O)O1 MCULE-5161861312 [1,0,0,1,0,0|0,0,0]=2 3456 B8R1.1 CCC1CNC(=O)C1 MCULE-1800672545 [1,0,0,1,0,0|2,0,0]=4 3457 B8R1.1 CCC1CNC(=O)O1 MCULE-9388725409 [1,0,0,1,0,0|1,0,0]=3 3458 B8R1.1 CCC1COC(=O)C1 MCULE-1996435734 [1,0,0,1,0,0|2,0,0]=4 3459 B8R1.1 CCC1COC(=O)N1 MCULE-4345668230 [1,0,0,1,0,0|2,0,0]=4 3460 B8R1.1 CCC1COC(=O)O1 MCULE-5743084846 [1,0,0,1,0,0|1,0,0]=3 3461 B8R1.1 CCN1CCC(=O)C1 MCULE-5806094458 [1,0,0,1,0,0|2,0,0]=4 3462 B8R1.1 CC[C@@H]1CCC(=O)C1 MCULE-7687801028 [1,0,0,1,0,0|1,0,0]=3 3463 B8R1.1 CC[C@@H]1CCC(=O)O1 MCULE-9831904901 [1,0,0,1,0,0|0,0,0]=2 3464 B8R1.1 CC[C@H]1CCC(=O)C1 MCULE-6479003670 [1,0,0,1,0,0|1,0,0]=3 3465 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-2443615902 [1,0,0,1,0,0|2,0,0]=4 3466 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-9191549724 [1,0,0,1,0,0|2,0,0]=4 3467 B8R1.1 COC1CCC(=O)C1 MCULE-3259977239 [1,0,0,1,0,0|2,0,0]=4 3468 B8R1.1 COC1CCC(=O)N1 MCULE-9661875090 [1,0,0,1,0,0|2,0,0]=4 3469 B8R1.1 NCC1CCC(=O)N1 MCULE-2195138544 [1,0,0,1,0,0|1,0,0]=3 3470 B8R1.1 NCC1CCC(=O)N1 MCULE-5064964559 [1,0,0,1,0,0|1,0,0]=3 3471 B8R1.1 NCC1CCC(=O)N1 MCULE-9686422256 [1,0,0,1,0,0|1,0,0]=3 3472 B8R1.1 NCC1CCC(=O)N1 MCULE-9973113927 [1,0,0,1,0,0|1,0,0]=3 3473 B8R1.1 NCC1CCC(=O)O1 MCULE-5413792723 [1,0,0,1,0,0|0,0,0]=2 3474 B8R1.1 NCC1CCC(=O)O1 MCULE-8312895206 [1,0,0,1,0,0|0,0,0]=2 3475 B8R1.1 NCC1CCC(C1)O MCULE-1780130995 [1,0,0,1,0,0|1,0,1]=4 3476 B8R1.1 NCC1CCC(C1)O MCULE-5002398342 [1,0,0,1,0,0|1,0,1]=4 3477 B8R1.1 NCC1CNC(=O)C1 MCULE-2522987651 [1,0,0,1,0,0|2,0,0]=4 3478 B8R1.1 NCC1CNC(=O)C1 MCULE-7249550892 [1,0,0,1,0,0|2,0,0]=4 3479 B8R1.1 NCC1CNC(=O)C1 MCULE-7253893960 [1,0,0,1,0,0|2,0,0]=4 3480 B8R1.1 NCC1CNC(=O)O1 MCULE-3940030823 [1,0,0,1,0,0|1,0,0]=3 3481 B8R1.1 NCC1CNC(=O)O1 MCULE-7671055394 [1,0,0,1,0,0|1,0,0]=3 3482 B8R1.1 NCC1COC(=O)N1 MCULE-8454292565 [1,0,0,1,0,0|2,0,0]=4 3483 B8R1.1 NCC1COC(=O)N1 MCULE-9068275563 [1,0,0,1,0,0|2,0,0]=4 3484 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-5772277021 [1,0,0,1,0,0|1,0,0]=3 3485 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-6147061481 [1,0,0,1,0,0|1,0,0]=3 3486 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-7644508115 [1,0,0,1,0,0|1,0,0]=3 3487 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-7782108755 [1,0,0,1,0,0|1,0,0]=3 3488 B8R1.1 NC[C@@H]1CC[C@@H](C1)O MCULE-2662561877 [1,0,0,1,0,0|1,0,1]=4 3489 B8R1.1 NC[C@@H]1CC[C@H](C1)O MCULE-9258933196 [1,0,0,1,0,0|1,0,1]=4 3490 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-1184474214 [1,0,0,1,0,0|2,0,0]=4 3491 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-2421452869 [1,0,0,1,0,0|2,0,0]=4 3492 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-3903743084 [1,0,0,1,0,0|2,0,0]=4 3493 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-9080425518 [1,0,0,1,0,0|2,0,0]=4 3494 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-1463241001 [1,0,0,1,0,0|1,0,0]=3 3495 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-3217887113 [1,0,0,1,0,0|1,0,0]=3 3496 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-5423398321 [1,0,0,1,0,0|1,0,0]=3 3497 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-9322185538 [1,0,0,1,0,0|1,0,0]=3 3498 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-1485902199 [1,0,0,1,0,0|1,0,0]=3 3499 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-1751255260 [1,0,0,1,0,0|1,0,0]=3 3500 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-3641870628 [1,0,0,1,0,0|1,0,0]=3 3501 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-9839264859 [1,0,0,1,0,0|1,0,0]=3 3502 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-1995293557 [1,0,0,1,0,0|1,0,1]=4 3503 B8R1.1 NC[C@H]1CC[C@@H](C1)O MCULE-9517253792 [1,0,0,1,0,0|1,0,1]=4 3504 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-5659749587 [1,0,0,1,0,0|1,0,1]=4 3505 B8R1.1 NC[C@H]1CC[C@H](C1)O MCULE-9056303043 [1,0,0,1,0,0|1,0,1]=4 3506 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-7212975165 [1,0,0,1,0,0|2,0,0]=4 3507 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8203034485 [1,0,0,1,0,0|2,0,0]=4 3508 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8803246698 [1,0,0,1,0,0|2,0,0]=4 3509 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-9580224880 [1,0,0,1,0,0|2,0,0]=4 3510 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-1224919034 [1,0,0,1,0,0|1,0,0]=3 3511 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-6003746665 [1,0,0,1,0,0|1,0,0]=3 3512 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-6937146715 [1,0,0,1,0,0|1,0,0]=3 3513 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-9419881517 [1,0,0,1,0,0|1,0,0]=3 3514 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-1988909942 [1,0,0,1,0,0|2,0,0]=4 3515 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-9340310155 [1,0,0,1,0,0|2,0,0]=4 3516 B8R1.1 O=C1CCC(C1)CF MCULE-9077358027 [1,0,0,1,0,0|2,0,0]=4 3517 B8R1.1 O=C1CCC(C1)CO MCULE-7524267942 [1,0,0,1,0,0|2,0,0]=4 3518 B8R1.1 O=C1CCC(N1)CBr MCULE-7024022934 [1,0,0,1,0,0|2,0,0]=4 3519 B8R1.1 O=C1CCC(N1)CI MCULE-6956070937 [1,0,0,1,0,0|2,0,0]=4 3520 B8R1.1 O=C1CCC(N1)CO MCULE-1498000761 [1,0,0,1,0,0|2,0,0]=4 3521 B8R1.1 O=C1CCC(O1)CBr MCULE-9370722806 [1,0,0,1,0,0|1,0,0]=3 3522 B8R1.1 O=C1CCC(O1)CCl MCULE-3199749385 [1,0,0,1,0,0|1,0,0]=3 3523 B8R1.1 O=C1CCC(O1)CI MCULE-4432096360 [1,0,0,1,0,0|1,0,0]=3 3524 B8R1.1 O=C1CCC(O1)CO MCULE-3178999726 [1,0,0,1,0,0|1,0,0]=3 3525 B8R1.1 O=C1CCC(O1)CO MCULE-4390773734 [1,0,0,1,0,0|1,0,0]=3 3526 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-2590805877 [1,0,0,1,0,0|2,0,0]=4 3527 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-7134607780 [1,0,0,1,0,0|2,0,0]=4 3528 B8R1.1 O=C1CC[C@@H](N1)CBr MCULE-4537645558 [1,0,0,1,0,0|2,0,0]=4 3529 B8R1.1 O=C1CC[C@@H](N1)CBr MCULE-6830001458 [1,0,0,1,0,0|2,0,0]=4 3530 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3021506643 [1,0,0,1,0,0|2,0,0]=4 3531 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3659077476 [1,0,0,1,0,0|2,0,0]=4 3532 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-1532290348 [1,0,0,1,0,0|1,0,0]=3 3533 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-3600746831 [1,0,0,1,0,0|1,0,0]=3 3534 B8R1.1 O=C1CC[C@H](N1)CBr MCULE-1684731751 [1,0,0,1,0,0|2,0,0]=4 3535 B8R1.1 O=C1CC[C@H](N1)CBr MCULE-4479348379 [1,0,0,1,0,0|2,0,0]=4 3536 B8R1.1 O=C1CC[C@H](N1)CO MCULE-4532009930 [1,0,0,1,0,0|2,0,0]=4 3537 B8R1.1 O=C1CC[C@H](N1)CO MCULE-6466848372 [1,0,0,1,0,0|2,0,0]=4 3538 B8R1.1 O=C1CC[C@H](O1)CO MCULE-1675076625 [1,0,0,1,0,0|1,0,0]=3 3539 B8R1.1 O=C1CC[C@H](O1)CO MCULE-6265569115 [1,0,0,1,0,0|1,0,0]=3 3540 B8R1.1 O=C1NCC(O1)CBr MCULE-3294572412 [1,0,0,1,0,0|2,0,0]=4 3541 B8R1.1 O=C1NCC(O1)CCl MCULE-6711754093 [1,0,0,1,0,0|2,0,0]=4 3542 B8R1.1 O=C1NCC(O1)CCl MCULE-6847066968 [1,0,0,1,0,0|2,0,0]=4 3543 B8R1.1 O=C1NCC(O1)CO MCULE-8225938772 [1,0,0,1,0,0|2,0,0]=4 3544 B8R1.1 O=C1NC[C@@H](O1)CCl MCULE-4606501061 [1,0,0,1,0,0|2,0,0]=4 3545 B8R1.1 O=C1NC[C@@H](O1)CO MCULE-4749906822 [1,0,0,1,0,0|2,0,0]=4 3546 B8R1.1 O=C1NC[C@@H](O1)CO MCULE-7879354917 [1,0,0,1,0,0|2,0,0]=4 3547 B8R1.1 O=C1NC[C@H](O1)CCl MCULE-1912687608 [1,0,0,1,0,0|2,0,0]=4 3548 B8R1.1 O=C1NC[C@H](O1)CO MCULE-2698871687 [1,0,0,1,0,0|2,0,0]=4 3549 B8R1.1 O=C1NC[C@H](O1)CO MCULE-5771560221 [1,0,0,1,0,0|2,0,0]=4 3550 B8R1.1 O=C1OCC(O1)CCl MCULE-7212643481 [1,0,0,1,0,0|2,0,0]=4 3551 B8R1.1 O=C1OCC(O1)CF MCULE-2066386250 [1,0,0,1,0,0|2,0,0]=4 3552 B8R1.1 O=C1OCC(O1)CO MCULE-1831262013 [1,0,0,1,0,0|2,0,0]=4 3553 B8R1.1 [C@H]1(CNC(=O)O1)CCl MCULE-6032247892 [1,0,0,1,0,0|2,0,0]=4 3554 B8R1.4 C1(CC(=O)CCN1)C MCULE-1061296374 [1,0,0,1,0,0|2,0,0]=4 3555 B8R1.4 C1(CC(=O)CCN1)C MCULE-4465075512 [1,0,0,1,0,0|2,0,0]=4 3556 B8R1.4 C1(CC(=O)CCN1)C MCULE-9958407361 [1,0,0,1,0,0|2,0,0]=4 3557 B8R1.4 C1(CNCC(=O)N1)C MCULE-3246707428 [1,0,0,1,0,0|2,0,0]=4 3558 B8R1.4 C=C1CCCC(=O)O1 MCULE-1342678884 [1,0,0,1,0,0|0,0,2]=4 3559 B8R1.4 CC1=CC(=O)CCC1 MCULE-6849313207 [1,0,0,1,0,0|1,0,1]=4 3560 B8R1.4 CC1=CCCC(=O)O1 MCULE-1590433845 [1,0,0,1,0,0|0,0,2]=4 3561 B8R1.4 CC1CC(=O)CCN1 MCULE-3306158037 [1,0,0,1,0,0|2,0,0]=4 3562 B8R1.4 CC1CC(=O)CCN1 MCULE-4556824309 [1,0,0,1,0,0|2,0,0]=4 3563 B8R1.4 CC1CC(=O)CCN1 MCULE-6103506996 [1,0,0,1,0,0|2,0,0]=4 3564 B8R1.4 CC1CC(=O)CCN1 MCULE-9670943852 [1,0,0,1,0,0|2,0,0]=4 3565 B8R1.4 CC1CC(=O)CCO1 MCULE-3051168755 [1,0,0,1,0,0|2,0,0]=4 3566 B8R1.4 CC1CC=CC(=O)O1 MCULE-3191839185 [1,0,0,1,0,0|0,0,2]=4 3567 B8R1.4 CC1CCCC(=O)C1 MCULE-6473963111 [1,0,0,1,0,0|1,0,0]=3 3568 B8R1.4 CC1CCCC(=O)C1 MCULE-9918051823 [1,0,0,1,0,0|1,0,0]=3 3569 B8R1.4 CC1CCCC(=O)N1 MCULE-3851963076 [1,0,0,1,0,0|1,0,0]=3 3570 B8R1.4 CC1CCCC(=O)O1 MCULE-4000069856 [1,0,0,1,0,0|0,0,0]=2 3571 B8R1.4 CC1CCCC(C1)O MCULE-5839979596 [1,0,0,1,0,0|1,0,1]=4 3572 B8R1.4 CC1CCC[C@H](C1)O MCULE-8817611474 [1,0,0,1,0,0|1,0,1]=4 3573 B8R1.4 CC1CCNC(=O)C1 MCULE-8903018599 [1,0,0,1,0,0|2,0,0]=4 3574 B8R1.4 CC1CCNC(=O)N1 MCULE-6491047836 [1,0,0,1,0,0|2,0,0]=4 3575 B8R1.4 CC1CCOC(=O)C1 MCULE-2682865017 [1,0,0,1,0,0|2,0,0]=4 3576 B8R1.4 CC1CCOC(=O)O1 MCULE-5929311811 [1,0,0,1,0,0|1,0,0]=3 3577 B8R1.4 CC1CCOS(=O)O1 MCULE-8688981983 [1,0,0,1,0,0|2,0,0]=4 3578 B8R1.4 CC1CNCC(=O)N1 MCULE-5727167900 [1,0,0,1,0,0|2,0,0]=4 3579 B8R1.4 CC1CNCC(=O)N1 MCULE-9599432640 [1,0,0,1,0,0|2,0,0]=4 3580 B8R1.4 CC1COCC(=O)N1 MCULE-4768427051 [1,0,0,1,0,0|2,0,0]=4 3581 B8R1.4 CC1COCC(=O)N1 MCULE-5909800781 [1,0,0,1,0,0|2,0,0]=4 3582 B8R1.4 CN1CCCC(=O)C1 MCULE-1067967474 [1,0,0,1,0,0|2,0,0]=4 3583 B8R1.4 CN1CCCC(=O)C1 MCULE-4816876030 [1,0,0,1,0,0|2,0,0]=4 3584 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7688577280 [1,0,0,1,0,0|2,0,0]=4 3585 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7762440526 [1,0,0,1,0,0|2,0,0]=4 3586 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-8158589956 [1,0,0,1,0,0|2,0,0]=4 3587 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-9544551566 [1,0,0,1,0,0|2,0,0]=4 3588 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-4878813100 [1,0,0,1,0,0|2,0,0]=4 3589 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-7917159022 [1,0,0,1,0,0|2,0,0]=4 3590 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-1868776628 [1,0,0,1,0,0|1,0,0]=3 3591 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-6973928430 [1,0,0,1,0,0|1,0,0]=3 3592 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-2050655386 [1,0,0,1,0,0|1,0,0]=3 3593 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-7049359933 [1,0,0,1,0,0|1,0,0]=3 3594 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-6306078053 [1,0,0,1,0,0|0,0,0]=2 3595 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-7616070208 [1,0,0,1,0,0|0,0,0]=2 3596 B8R1.4 C[C@@H]1CCC[C@@H](C1)O MCULE-9818117668 [1,0,0,1,0,0|1,0,1]=4 3597 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-3378865379 [1,0,0,1,0,0|2,0,0]=4 3598 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-5740698320 [1,0,0,1,0,0|2,0,0]=4 3599 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-7692987274 [1,0,0,1,0,0|2,0,0]=4 3600 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-8897582822 [1,0,0,1,0,0|2,0,0]=4 3601 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-1758598852 [1,0,0,1,0,0|2,0,0]=4 3602 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-2011395384 [1,0,0,1,0,0|2,0,0]=4 3603 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-1599463757 [1,0,0,1,0,0|2,0,0]=4 3604 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-4580048332 [1,0,0,1,0,0|2,0,0]=4 3605 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5356496154 [1,0,0,1,0,0|2,0,0]=4 3606 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5733481696 [1,0,0,1,0,0|2,0,0]=4 3607 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-6641640616 [1,0,0,1,0,0|2,0,0]=4 3608 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-8001129555 [1,0,0,1,0,0|2,0,0]=4 3609 B8R1.4 C[C@H]1CC(=O)CCO1 MCULE-7799394182 [1,0,0,1,0,0|2,0,0]=4 3610 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-4643975445 [1,0,0,1,0,0|1,0,0]=3 3611 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-6122391840 [1,0,0,1,0,0|1,0,0]=3 3612 B8R1.4 C[C@H]1CCC[C@H](C1)O MCULE-9355825371 [1,0,0,1,0,0|1,0,1]=4 3613 B8R1.4 C[C@H]1CCNC(=O)C1 MCULE-7120988665 [1,0,0,1,0,0|2,0,0]=4 3614 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3182538973 [1,0,0,1,0,0|2,0,0]=4 3615 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3207104811 [1,0,0,1,0,0|2,0,0]=4 3616 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-5895954143 [1,0,0,1,0,0|2,0,0]=4 3617 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-6535652978 [1,0,0,1,0,0|2,0,0]=4 3618 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-5693624195 [1,0,0,1,0,0|2,0,0]=4 3619 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-8476323396 [1,0,0,1,0,0|2,0,0]=4 3620 B8R1.4 NC1=CC(=O)CCC1 MCULE-3362548403 [1,0,0,1,0,0|1,0,1]=4 3621 B8R1.4 NC1C=C(CCC1)F MCULE-7477602128 [1,0,0,1,0,0|2,0,0]=4 3622 B8R1.4 NC1CCCC(=O)C1 MCULE-3659606498 [1,0,0,1,0,0|1,0,0]=3 3623 B8R1.4 NC1CCCC(=O)C1 MCULE-8815445353 [1,0,0,1,0,0|1,0,0]=3 3624 B8R1.4 NC1CCCC(C1)O MCULE-6642881941 [1,0,0,1,0,0|1,0,1]=4 3625 B8R1.4 NC1CCCC(C1)O MCULE-7481733301 [1,0,0,1,0,0|1,0,1]=4 3626 B8R1.4 NC1CCNC(=O)C1 MCULE-2185303732 [1,0,0,1,0,0|2,0,0]=4 3627 B8R1.4 NC1CCNC(=O)C1 MCULE-4290135082 [1,0,0,1,0,0|2,0,0]=4 3628 B8R1.4 NC1CCNC(=O)C1 MCULE-6525283699 [1,0,0,1,0,0|2,0,0]=4 3629 B8R1.4 NC1CCNC(=O)C1 MCULE-8080194775 [1,0,0,1,0,0|2,0,0]=4 3630 B8R1.4 NC1COCC(=O)C1 MCULE-4958107203 [1,0,0,1,0,0|2,0,0]=4 3631 B8R1.4 NC1COCC(=O)C1 MCULE-9645630994 [1,0,0,1,0,0|2,0,0]=4 3632 B8R1.4 N[C@@H]1CCCC(=O)C1 MCULE-4006583256 [1,0,0,1,0,0|1,0,0]=3 3633 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-2185895220 [1,0,0,1,0,0|1,0,1]=4 3634 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-6878512399 [1,0,0,1,0,0|1,0,1]=4 3635 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-7794771906 [1,0,0,1,0,0|1,0,1]=4 3636 B8R1.4 N[C@@H]1CCC[C@@H](C1)O MCULE-9600913098 [1,0,0,1,0,0|1,0,1]=4 3637 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-3943542357 [1,0,0,1,0,0|1,0,1]=4 3638 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-7462583711 [1,0,0,1,0,0|1,0,1]=4 3639 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-8163415958 [1,0,0,1,0,0|1,0,1]=4 3640 B8R1.4 N[C@@H]1CCC[C@H](C1)O MCULE-9050533878 [1,0,0,1,0,0|1,0,1]=4 3641 B8R1.4 N[C@@H]1CCNC(=O)C1 MCULE-8276559925 [1,0,0,1,0,0|2,0,0]=4 3642 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-3299834957 [1,0,0,1,0,0|2,0,0]=4 3643 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-6683156371 [1,0,0,1,0,0|2,0,0]=4 3644 B8R1.4 N[C@H]1CCCC(=O)C1 MCULE-9786035316 [1,0,0,1,0,0|1,0,0]=3 3645 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-2088777566 [1,0,0,1,0,0|1,0,1]=4 3646 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-6052884406 [1,0,0,1,0,0|1,0,1]=4 3647 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-7145455722 [1,0,0,1,0,0|1,0,1]=4 3648 B8R1.4 N[C@H]1CCC[C@@H](C1)O MCULE-8458598098 [1,0,0,1,0,0|1,0,1]=4 3649 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-1402442931 [1,0,0,1,0,0|1,0,1]=4 3650 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-2566868682 [1,0,0,1,0,0|1,0,1]=4 3651 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-8263508625 [1,0,0,1,0,0|1,0,1]=4 3652 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-9158452946 [1,0,0,1,0,0|1,0,1]=4 3653 B8R1.4 N[C@H]1CCC[C@H](C1)O MCULE-9908500977 [1,0,0,1,0,0|1,0,1]=4 3654 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-1641151984 [1,0,0,1,0,0|2,0,0]=4 3655 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-2042394403 [1,0,0,1,0,0|2,0,0]=4 3656 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-6400271298 [1,0,0,1,0,0|2,0,0]=4 3657 B8R1.4 O=C1CCCC(=O)O1 MCULE-4866925975 [1,0,0,1,0,0|1,0,1]=4 3658 B8R1.4 O=C1CCCC(C1)O MCULE-3100717907 [1,0,0,1,0,0|2,0,0]=4 3659 B8R1.4 O=C1CCC[C@@H](C1)O MCULE-3841179351 [1,0,0,1,0,0|2,0,0]=4 3660 B8R1.4 [C@@H]1(CCCC(=O)N1)C MCULE-8906937588 [1,0,0,1,0,0|1,0,0]=3 3661 B8R1.4 [C@H]1(CCC[C@H](C1)O)N MCULE-1919170190 [1,0,0,1,0,0|1,0,1]=4 3662 B8R1.4 [C@H]1(CCC[C@H](C1)O)N MCULE-2985238129 [1,0,0,1,0,0|1,0,1]=4 3663 B8R1.6 CCCC1CC(=O)C1 MCULE-8820429798 [1,0,0,1,0,0|1,0,0]=3 3664 B8R1.6 COCC1CC(=O)C1 MCULE-2514529767 [1,0,0,1,0,0|2,0,0]=4 3665 B8R1.6 NCCC1CC(C1)O MCULE-6387064695 [1,0,0,1,0,0|1,0,1]=4 3666 B8R1.6 NCCC1CC(C1)O MCULE-9498169113 [1,0,0,1,0,0|1,0,1]=4 3667 B8R1.6 NCC[C@H]1C[C@H](C1)O MCULE-1788933104 [1,0,0,1,0,0|1,0,1]=4 3668 B8R1.6 NCC[C@H]1C[C@H](C1)O MCULE-5167300652 [1,0,0,1,0,0|1,0,1]=4 3669 B8R1.7 C1(CCCN1)C(=O)N MCULE-2539007211 [1,0,0,1,0,0|1,0,0]=3 3670 B8R1.7 C1(CCCN1)C(=O)N MCULE-7289713183 [1,0,0,1,0,0|1,0,0]=3 3671 B8R1.7 C1(CCNC1)C(=O)N MCULE-4476688014 [1,0,0,1,0,0|2,0,0]=4 3672 B8R1.7 C1(CCNC1)C(=O)N MCULE-8592806332 [1,0,0,1,0,0|2,0,0]=4 3673 B8R1.7 C1(CCNC1)C(=O)O MCULE-3210241958 [1,0,0,1,0,0|1,0,0]=3 3674 B8R1.7 C1(CCNC1)C(=O)O MCULE-6517290754 [1,0,0,1,0,0|1,0,0]=3 3675 B8R1.7 C1(CCOC1)C(=O)O MCULE-4859263225 [1,0,0,1,0,0|1,0,0]=3 3676 B8R1.7 CC(=O)C1CCCC1 MCULE-7952211819 [1,0,0,1,0,0|1,0,0]=3 3677 B8R1.7 CC(=O)C1CCCN1 MCULE-2528977871 [1,0,0,1,0,0|1,0,0]=3 3678 B8R1.7 CC(=O)C1CCCN1 MCULE-9222880225 [1,0,0,1,0,0|1,0,0]=3 3679 B8R1.7 CC(=O)C1CCCO1 MCULE-7518147693 [1,0,0,1,0,0|2,0,0]=4 3680 B8R1.7 CC(=O)C1CCNC1 MCULE-2147779518 [1,0,0,1,0,0|2,0,0]=4 3681 B8R1.7 CC(=O)C1CCNC1 MCULE-2964372059 [1,0,0,1,0,0|2,0,0]=4 3682 B8R1.7 CC(=O)C1CCOC1 MCULE-2105633909 [1,0,0,1,0,0|2,0,0]=4 3683 B8R1.7 CC(=O)C1NCCS1 MCULE-4092674646 [1,0,0,1,0,0|2,0,0]=4 3684 B8R1.7 CC(=O)C1NCCS1 MCULE-8660367055 [1,0,0,1,0,0|2,0,0]=4 3685 B8R1.7 CC(=O)N1CCCC1 MCULE-6839528034 [1,0,0,1,0,0|2,0,0]=4 3686 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-1290635339 [1,0,0,1,0,0|1,0,0]=3 3687 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2855198659 [1,0,0,1,0,0|1,0,0]=3 3688 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2944662012 [1,0,0,1,0,0|1,0,0]=3 3689 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-4806473466 [1,0,0,1,0,0|1,0,0]=3 3690 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-2015960170 [1,0,0,1,0,0|2,0,0]=4 3691 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-3381319090 [1,0,0,1,0,0|2,0,0]=4 3692 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-2095368644 [1,0,0,1,0,0|1,0,0]=3 3693 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-5460066005 [1,0,0,1,0,0|1,0,0]=3 3694 B8R1.7 CC(=O)[C@H]1CCCO1 MCULE-5637204370 [1,0,0,1,0,0|2,0,0]=4 3695 B8R1.7 CC(O)C1CCCC1 MCULE-6730583511 [1,0,0,1,0,0|1,0,1]=4 3696 B8R1.7 C[C@@H](O)C1CCCC1 MCULE-2530250478 [1,0,0,1,0,0|1,0,1]=4 3697 B8R1.7 C[C@H](O)C1CCCC1 MCULE-9054245488 [1,0,0,1,0,0|1,0,1]=4 3698 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5014228849 [1,0,0,1,0,0|1,0,1]=4 3699 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5063876687 [1,0,0,1,0,0|1,0,1]=4 3700 B8R1.7 N=C(N)C1CCCC1 MCULE-3526902612 [1,0,0,1,0,0|2,0,0]=4 3701 B8R1.7 N=C(N)C1CCCC1 MCULE-7613986881 [1,0,0,1,0,0|2,0,0]=4 3702 B8R1.7 N=C(N)C1CCCN1 MCULE-3357684433 [1,0,0,1,0,0|2,0,0]=4 3703 B8R1.7 N=C(N)C1CCCN1 MCULE-7506606085 [1,0,0,1,0,0|2,0,0]=4 3704 B8R1.7 NC(=O)C1CCCC1 MCULE-3900666396 [1,0,0,1,0,0|1,0,0]=3 3705 B8R1.7 NC(=O)C1CCCN1 MCULE-4159463416 [1,0,0,1,0,0|1,0,0]=3 3706 B8R1.7 NC(=O)C1CCCN1 MCULE-4804910089 [1,0,0,1,0,0|1,0,0]=3 3707 B8R1.7 NC(=O)C1CCCO1 MCULE-9101921416 [1,0,0,1,0,0|2,0,0]=4 3708 B8R1.7 NC(=O)C1CCNC1 MCULE-6035608651 [1,0,0,1,0,0|2,0,0]=4 3709 B8R1.7 NC(=O)C1CCNC1 MCULE-8602888952 [1,0,0,1,0,0|2,0,0]=4 3710 B8R1.7 NC(=O)C1CCOC1 MCULE-7120435380 [1,0,0,1,0,0|2,0,0]=4 3711 B8R1.7 NC(=O)C1CSCN1 MCULE-7557874523 [1,0,0,1,0,0|2,0,0]=4 3712 B8R1.7 NC(=O)N1CCCC1 MCULE-2282948234 [1,0,0,1,0,0|2,0,0]=4 3713 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2635874022 [1,0,0,1,0,0|1,0,0]=3 3714 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2652734118 [1,0,0,1,0,0|1,0,0]=3 3715 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-4692992308 [1,0,0,1,0,0|1,0,0]=3 3716 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-6463625531 [1,0,0,1,0,0|1,0,0]=3 3717 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-3181755658 [1,0,0,1,0,0|2,0,0]=4 3718 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-9348376356 [1,0,0,1,0,0|2,0,0]=4 3719 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1320057579 [1,0,0,1,0,0|2,0,0]=4 3720 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1678228480 [1,0,0,1,0,0|2,0,0]=4 3721 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-3340066069 [1,0,0,1,0,0|2,0,0]=4 3722 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-8833406496 [1,0,0,1,0,0|2,0,0]=4 3723 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-1391877694 [1,0,0,1,0,0|1,0,0]=3 3724 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-2636422628 [1,0,0,1,0,0|1,0,0]=3 3725 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-3135852117 [1,0,0,1,0,0|1,0,0]=3 3726 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-9661392945 [1,0,0,1,0,0|1,0,0]=3 3727 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-1673594093 [1,0,0,1,0,0|2,0,0]=4 3728 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-6725123306 [1,0,0,1,0,0|2,0,0]=4 3729 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-7222756259 [1,0,0,1,0,0|2,0,0]=4 3730 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-8100234071 [1,0,0,1,0,0|2,0,0]=4 3731 B8R1.7 NC(=O)[C@H]1CCOC1 MCULE-1231475693 [1,0,0,1,0,0|2,0,0]=4 3732 B8R1.7 NC(=S)C1CCCC1 MCULE-8081902896 [1,0,0,1,0,0|1,1,0]=4 3733 B8R1.7 O=C(Cl)C1CCCC1 MCULE-1337538941 [1,0,0,1,0,0|1,0,0]=3 3734 B8R1.7 O=C(Cl)C1CCCO1 MCULE-9691919934 [1,0,0,1,0,0|2,0,0]=4 3735 B8R1.7 O=C(Cl)C1CCOC1 MCULE-9071234830 [1,0,0,1,0,0|2,0,0]=4 3736 B8R1.7 O=C(Cl)N1CCCC1 MCULE-2201729080 [1,0,0,1,0,0|2,0,0]=4 3737 B8R1.7 O=C(O)C1=CCCC1 MCULE-2928571993 [1,0,0,1,0,0|0,0,2]=4 3738 B8R1.7 O=C(O)C1=NCCC1 MCULE-2664768755 [1,0,0,1,0,0|0,0,2]=4 3739 B8R1.7 O=C(O)C1C=CCC1 MCULE-8870546284 [1,0,0,1,0,0|0,0,2]=4 3740 B8R1.7 O=C(O)C1C=CCN1 MCULE-2141949922 [1,0,0,1,0,0|0,0,2]=4 3741 B8R1.7 O=C(O)C1C=CCN1 MCULE-3068035697 [1,0,0,1,0,0|0,0,2]=4 3742 B8R1.7 O=C(O)C1C=CCN1 MCULE-4825351403 [1,0,0,1,0,0|0,0,2]=4 3743 B8R1.7 O=C(O)C1C=CCN1 MCULE-9928071710 [1,0,0,1,0,0|0,0,2]=4 3744 B8R1.7 O=C(O)C1CC=CC1 MCULE-7876630177 [1,0,0,1,0,0|0,0,2]=4 3745 B8R1.7 O=C(O)C1CCC=N1 MCULE-1792151957 [1,0,0,1,0,0|0,0,2]=4 3746 B8R1.7 O=C(O)C1CCCC1 MCULE-6415159340 [1,0,0,1,0,0|0,0,0]=2 3747 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [1,0,0,1,0,0|0,0,0]=2 3748 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [1,0,0,1,0,0|0,0,0]=2 3749 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [1,0,0,1,0,0|0,0,0]=2 3750 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [1,0,0,1,0,0|0,0,0]=2 3751 B8R1.7 O=C(O)C1CCCO1 MCULE-1952289090 [1,0,0,1,0,0|1,0,0]=3 3752 B8R1.7 O=C(O)C1CCCO1 MCULE-5387481824 [1,0,0,1,0,0|1,0,0]=3 3753 B8R1.7 O=C(O)C1CCCS1 MCULE-7760686042 [1,0,0,1,0,0|1,0,0]=3 3754 B8R1.7 O=C(O)C1CCNC1 MCULE-4976520029 [1,0,0,1,0,0|1,0,0]=3 3755 B8R1.7 O=C(O)C1CCNC1 MCULE-5937045785 [1,0,0,1,0,0|1,0,0]=3 3756 B8R1.7 O=C(O)C1CCNC1 MCULE-6983695276 [1,0,0,1,0,0|1,0,0]=3 3757 B8R1.7 O=C(O)C1CCOC1 MCULE-3567941338 [1,0,0,1,0,0|1,0,0]=3 3758 B8R1.7 O=C(O)C1CCSC1 MCULE-7898686734 [1,0,0,1,0,0|1,0,0]=3 3759 B8R1.7 O=C(O)C1COCN1 MCULE-4997392610 [1,0,0,1,0,0|1,0,0]=3 3760 B8R1.7 O=C(O)C1COCN1 MCULE-7001651226 [1,0,0,1,0,0|1,0,0]=3 3761 B8R1.7 O=C(O)C1CSCN1 MCULE-2391637686 [1,0,0,1,0,0|1,0,0]=3 3762 B8R1.7 O=C(O)C1CSCN1 MCULE-9622331370 [1,0,0,1,0,0|1,0,0]=3 3763 B8R1.7 O=C(O)C1CSSC1 MCULE-8231952386 [1,0,0,1,0,0|2,0,0]=4 3764 B8R1.7 O=C(O)C1NCCS1 MCULE-2504435743 [1,0,0,1,0,0|1,0,0]=3 3765 B8R1.7 O=C(O)C1SCCS1 MCULE-4466563646 [1,0,0,1,0,0|2,0,0]=4 3766 B8R1.7 O=C(O)N1CCCC1 MCULE-7984061130 [1,0,0,1,0,0|1,0,0]=3 3767 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-2515045579 [1,0,0,1,0,0|0,0,2]=4 3768 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-3589058117 [1,0,0,1,0,0|0,0,2]=4 3769 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-7995918745 [1,0,0,1,0,0|0,0,2]=4 3770 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-8155212892 [1,0,0,1,0,0|0,0,2]=4 3771 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [1,0,0,1,0,0|0,0,0]=2 3772 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [1,0,0,1,0,0|0,0,0]=2 3773 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [1,0,0,1,0,0|0,0,0]=2 3774 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [1,0,0,1,0,0|0,0,0]=2 3775 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-5193388500 [1,0,0,1,0,0|1,0,0]=3 3776 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-8181760406 [1,0,0,1,0,0|1,0,0]=3 3777 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-3068007507 [1,0,0,1,0,0|1,0,0]=3 3778 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4477578687 [1,0,0,1,0,0|1,0,0]=3 3779 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4524201006 [1,0,0,1,0,0|1,0,0]=3 3780 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4868292658 [1,0,0,1,0,0|1,0,0]=3 3781 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-4807765276 [1,0,0,1,0,0|1,0,0]=3 3782 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-7912413581 [1,0,0,1,0,0|1,0,0]=3 3783 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1547472283 [1,0,0,1,0,0|1,0,0]=3 3784 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1876089066 [1,0,0,1,0,0|1,0,0]=3 3785 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1926856350 [1,0,0,1,0,0|1,0,0]=3 3786 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-9876695932 [1,0,0,1,0,0|1,0,0]=3 3787 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-4243406881 [1,0,0,1,0,0|1,0,0]=3 3788 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-6343154165 [1,0,0,1,0,0|1,0,0]=3 3789 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-2145380755 [1,0,0,1,0,0|0,0,2]=4 3790 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-5768283844 [1,0,0,1,0,0|0,0,2]=4 3791 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-8522372891 [1,0,0,1,0,0|0,0,2]=4 3792 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [1,0,0,1,0,0|0,0,0]=2 3793 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [1,0,0,1,0,0|0,0,0]=2 3794 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-2258024439 [1,0,0,1,0,0|1,0,0]=3 3795 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-5143953192 [1,0,0,1,0,0|1,0,0]=3 3796 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2003400674 [1,0,0,1,0,0|1,0,0]=3 3797 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2851087395 [1,0,0,1,0,0|1,0,0]=3 3798 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7223432888 [1,0,0,1,0,0|1,0,0]=3 3799 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7610384670 [1,0,0,1,0,0|1,0,0]=3 3800 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-3213766488 [1,0,0,1,0,0|1,0,0]=3 3801 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-9627397250 [1,0,0,1,0,0|1,0,0]=3 3802 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-6095527710 [1,0,0,1,0,0|1,0,0]=3 3803 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-9117444908 [1,0,0,1,0,0|1,0,0]=3 3804 B8R1.7 O=C([O-])C1CCCN1 MCULE-9155494525 [1,0,0,1,0,0|0,0,1]=3 3805 B8R1.7 O=C([O-])C1CSCN1 MCULE-9836043803 [1,0,0,1,0,0|1,0,1]=4 3806 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-2694821396 [1,0,0,1,0,0|0,0,1]=3 3807 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-8353601451 [1,0,0,1,0,0|0,0,1]=3 3808 B8R1.7 O=N(=O)C1CCCC1 MCULE-6499665829 [1,0,0,1,0,0|1,0,1]=4 3809 B8R1.7 O=S([O-])C1CCCC1 MCULE-4973639131 [1,0,0,1,0,0|1,0,1]=4 3810 B8R1.7 O=S([O-])C1CCCC1 MCULE-9227389818 [1,0,0,1,0,0|1,0,1]=4 3811 B8R1.7 OB(O)C1CCCC1 MCULE-7101191940 [1,0,0,1,0,0|1,0,1]=4 3812 B8R1.7 OB(O)C1CCCN1 MCULE-5123578937 [1,0,0,1,0,0|1,0,1]=4 3813 B8R1.7 OB(O)C1CCCN1 MCULE-6072524963 [1,0,0,1,0,0|1,0,1]=4 3814 B8R1.7 [C@@H]1(CSCN1)C(=O)[O-] MCULE-3895380806 [1,0,0,1,0,0|1,0,1]=4 3815 B8R1.19 CC1(CCCC1N)O MCULE-3396541731 [1,0,0,1,0,0|1,0,1]=4 3816 B8R1.19 CC1CCCS1(=O)=O MCULE-2985632984 [1,0,0,1,0,0|1,0,1]=4 3817 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-4508286005 [1,0,0,1,0,0|1,0,1]=4 3818 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-9668737274 [1,0,0,1,0,0|1,0,1]=4 3819 B8R1.19 C[C@@]1(CCC[C@H]1N)O MCULE-2369187970 [1,0,0,1,0,0|1,0,1]=4 3820 B8R1.19 C[C@]1(CCC[C@@H]1N)O MCULE-2644040109 [1,0,0,1,0,0|1,0,1]=4 3821 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-2446086306 [1,0,0,1,0,0|1,0,1]=4 3822 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-8959851594 [1,0,0,1,0,0|1,0,1]=4 3823 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-9937788175 [1,0,0,1,0,0|1,0,1]=4 3824 B8R1.20 CC1CC1CC(=O)O MCULE-3151390667 [1,0,0,1,0,0|0,0,0]=2 3825 B8R1.31 C1(CCN1C)C(=O)O MCULE-3478640390 [1,0,0,1,0,0|1,0,0]=3 3826 B8R1.31 C=C1CCC1C(=O)O MCULE-7307560863 [1,0,0,1,0,0|0,0,2]=4 3827 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C MCULE-1543129128 [1,0,0,1,0,0|1,0,0]=3 3828 B8R1.31 CC1CCC1C(=O)O MCULE-2755332087 [1,0,0,1,0,0|0,0,0]=2 3829 B8R1.31 CC1CNC1C(=O)O MCULE-4084486339 [1,0,0,1,0,0|1,0,0]=3 3830 B8R1.31 CC1NCC1C(=O)O MCULE-3701314568 [1,0,0,1,0,0|1,0,0]=3 3831 B8R1.31 CN1CCC1C(=O)O MCULE-5037838055 [1,0,0,1,0,0|1,0,0]=3 3832 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-3293015609 [1,0,0,1,0,0|1,0,0]=3 3833 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-6726499104 [1,0,0,1,0,0|1,0,0]=3 3834 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-1519401164 [1,0,0,1,0,0|1,0,0]=3 3835 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-2682368839 [1,0,0,1,0,0|1,0,0]=3 3836 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-6870930523 [1,0,0,1,0,0|1,0,0]=3 3837 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-9495962068 [1,0,0,1,0,0|1,0,0]=3 3838 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-4996743185 [1,0,0,1,0,0|1,0,0]=3 3839 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-5548697786 [1,0,0,1,0,0|1,0,0]=3 3840 B8R1.31 NC1CCC1C(=O)O MCULE-1271890671 [1,0,0,1,0,0|0,0,0]=2 3841 B8R1.31 NC1CCC1C(=O)O MCULE-6203451123 [1,0,0,1,0,0|0,0,0]=2 3842 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O MCULE-7309195085 [1,0,0,1,0,0|0,0,0]=2 3843 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-1231832702 [1,0,0,1,0,0|0,0,0]=2 3844 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-4120413857 [1,0,0,1,0,0|0,0,0]=2 3845 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-7581321099 [1,0,0,1,0,0|0,0,0]=2 3846 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-8814127531 [1,0,0,1,0,0|0,0,0]=2 3847 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O MCULE-1877122488 [1,0,0,1,0,0|0,0,0]=2 3848 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-2323153571 [1,0,0,1,0,0|0,0,0]=2 3849 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3627026930 [1,0,0,1,0,0|0,0,0]=2 3850 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3814908416 [1,0,0,1,0,0|0,0,0]=2 3851 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-8552378194 [1,0,0,1,0,0|0,0,0]=2 3852 B8R1.31 O=C(O)C1CCC1F MCULE-6928594613 [1,0,0,1,0,0|1,0,0]=3 3853 B8R1.31 O=C(O)C1CCC1O MCULE-5612797663 [1,0,0,1,0,0|1,0,0]=3 3854 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O MCULE-4502275905 [1,0,0,1,0,0|1,0,0]=3 3855 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O MCULE-1446557503 [1,0,0,1,0,0|1,0,0]=3 3856 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-3693378535 [1,0,0,1,0,0|0,0,0]=2 3857 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-4998471402 [1,0,0,1,0,0|0,0,0]=2 3858 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-1179436878 [1,0,0,1,0,0|0,0,0]=2 3859 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-6666180327 [1,0,0,1,0,0|0,0,0]=2 3860 B8R1.31 [C@@H]1(NC[C@H]1C)C(=O)O MCULE-4107819391 [1,0,0,1,0,0|1,0,0]=3 3861 B8R1.34 CC(=O)CC1CCC1 MCULE-8119711389 [1,0,0,1,0,0|1,0,0]=3 3862 B8R1.34 CC(=O)CC1COC1 MCULE-8127220146 [1,0,0,1,0,0|2,0,0]=4 3863 B8R1.34 N=C(N)CC1CCC1 MCULE-7694021103 [1,0,0,1,0,0|2,0,0]=4 3864 B8R1.34 NC(=O)CC1CNC1 MCULE-3085452095 [1,0,0,1,0,0|2,0,0]=4 3865 B8R1.34 NC(=O)CC1CNC1 MCULE-7868797282 [1,0,0,1,0,0|2,0,0]=4 3866 B8R1.34 NC(=O)NC1CCC1 MCULE-4153424610 [1,0,0,1,0,0|2,0,0]=4 3867 B8R1.34 NC(=S)CC1CCC1 MCULE-7458307170 [1,0,0,1,0,0|1,1,0]=4 3868 B8R1.34 O=C(Cl)CC1CCC1 MCULE-4282346796 [1,0,0,1,0,0|1,0,0]=3 3869 B8R1.34 O=C(O)C=C1CCC1 MCULE-7015909117 [1,0,0,1,0,0|0,0,2]=4 3870 B8R1.34 O=C(O)CC1CCC1 MCULE-3720911045 [1,0,0,1,0,0|0,0,0]=2 3871 B8R1.34 O=C(O)CC1CCN1 MCULE-4161960358 [1,0,0,1,0,0|0,0,0]=2 3872 B8R1.34 O=C(O)CC1CCO1 MCULE-7021545652 [1,0,0,1,0,0|1,0,0]=3 3873 B8R1.34 O=C(O)CC1CNC1 MCULE-4671495498 [1,0,0,1,0,0|1,0,0]=3 3874 B8R1.34 O=C(O)CC1CNC1 MCULE-5456583939 [1,0,0,1,0,0|1,0,0]=3 3875 B8R1.34 O=C(O)CC1CNC1 MCULE-9655427403 [1,0,0,1,0,0|1,0,0]=3 3876 B8R1.34 O=C(O)CC1COC1 MCULE-1090518485 [1,0,0,1,0,0|1,0,0]=3 3877 B8R1.34 O=C(O)CC1CSC1 MCULE-1573505481 [1,0,0,1,0,0|1,0,0]=3 3878 B8R1.34 O=C(O)CN1CCC1 MCULE-2649525817 [1,0,0,1,0,0|1,0,0]=3 3879 B8R1.34 O=C(O)CN1CCC1 MCULE-6889274435 [1,0,0,1,0,0|1,0,0]=3 3880 B8R1.34 O=C([O-])CC1COC1 MCULE-8848528767 [1,0,0,1,0,0|1,0,1]=4 3881 B8R1.35 CC(=O)CCC1CC1 MCULE-1674877061 [1,0,0,1,0,0|1,0,0]=3 3882 B8R1.35 CC(=O)NCC1CC1 MCULE-1770864212 [1,0,0,1,0,0|2,0,0]=4 3883 B8R1.35 NC(=O)CNC1CC1 MCULE-1569675703 [1,0,0,1,0,0|2,0,0]=4 3884 B8R1.35 NC(=O)CNC1CC1 MCULE-2912062351 [1,0,0,1,0,0|2,0,0]=4 3885 B8R1.35 NC(=O)NCC1CC1 MCULE-9526171923 [1,0,0,1,0,0|2,0,0]=4 3886 B8R1.35 O=C(Cl)OCC1CC1 MCULE-5850240668 [1,0,0,1,0,0|2,0,0]=4 3887 B8R1.35 O=C(O)/C=C/C1CC1 MCULE-2218783834 [1,0,0,1,0,0|0,0,2]=4 3888 B8R1.35 O=C(O)C#CC1CC1 MCULE-8494271998 [1,0,0,1,0,0|0,0,2]=4 3889 B8R1.35 O=C(O)C=CC1CC1 MCULE-9706214568 [1,0,0,1,0,0|0,0,2]=4 3890 B8R1.35 O=C(O)CCC1CC1 MCULE-1377442346 [1,0,0,1,0,0|0,0,0]=2 3891 B8R1.35 O=C(O)CCC1CO1 MCULE-1859826371 [1,0,0,1,0,0|1,0,0]=3 3892 B8R1.35 O=C(O)CCC1N=N1 MCULE-7773347718 [1,0,0,1,0,0|1,0,1]=4 3893 B8R1.35 O=C(O)CNC1CC1 MCULE-7811029224 [1,0,0,1,0,0|1,0,0]=3 3894 B8R1.35 O=C(O)CNC1CC1 MCULE-9104732369 [1,0,0,1,0,0|1,0,0]=3 3895 B8R1.35 O=C(O)COC1CC1 MCULE-2555477617 [1,0,0,1,0,0|1,0,0]=3 3896 B8R1.35 O=C(O)CSC1CC1 MCULE-7890561094 [1,0,0,1,0,0|1,0,0]=3 3897 B8R1.35 O=N(=O)CCC1CC1 MCULE-7393596142 [1,0,0,1,0,0|1,0,1]=4 3898 B8R1.43 C#CC1CC1C(=O)O MCULE-3287712150 [1,0,0,1,0,0|0,0,2]=4 3899 B8R1.43 C#C[C@@H]1C[C@H]1C(=O)O MCULE-3682886945 [1,0,0,1,0,0|0,0,2]=4 3900 B8R1.43 C#C[C@H]1C[C@@H]1C(=O)O MCULE-7332146893 [1,0,0,1,0,0|0,0,2]=4 3901 B8R1.43 C#C[C@H]1C[C@@H]1C(=O)O MCULE-8247580113 [1,0,0,1,0,0|0,0,2]=4 3902 B8R1.43 C#C[C@H]1C[C@H]1C(=O)O MCULE-7681925135 [1,0,0,1,0,0|0,0,2]=4 3903 B8R1.43 C=C[C@@H]1C[C@H]1C(=O)O MCULE-6323262453 [1,0,0,1,0,0|0,0,2]=4 3904 B8R1.43 C=C[C@H]1C[C@H]1C(=O)O MCULE-6983531899 [1,0,0,1,0,0|0,0,2]=4 3905 B8R1.43 CCC1CC1C(=O)O MCULE-2993174891 [1,0,0,1,0,0|0,0,0]=2 3906 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O MCULE-8944777861 [1,0,0,1,0,0|0,0,0]=2 3907 B8R1.43 COC1CC1C(=O)O MCULE-8490015991 [1,0,0,1,0,0|1,0,0]=3 3908 B8R1.43 N#CC1CC1C(=O)O MCULE-9124706645 [1,0,0,1,0,0|0,0,2]=4 3909 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O MCULE-5445653149 [1,0,0,1,0,0|0,0,2]=4 3910 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O MCULE-6130530861 [1,0,0,1,0,0|0,0,2]=4 3911 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O MCULE-3330628556 [1,0,0,1,0,0|0,0,2]=4 3912 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O MCULE-6684718700 [1,0,0,1,0,0|0,0,2]=4 3913 B8R1.43 NC(=O)C1CC1CO MCULE-3191620985 [1,0,0,1,0,0|2,0,0]=4 3914 B8R1.43 NCC1CC1C(=O)O MCULE-8216751454 [1,0,0,1,0,0|0,0,0]=2 3915 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-3415372050 [1,0,0,1,0,0|0,0,0]=2 3916 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-6765918556 [1,0,0,1,0,0|0,0,0]=2 3917 B8R1.43 O=C(O)C1CC1CCl MCULE-8596410287 [1,0,0,1,0,0|1,0,0]=3 3918 B8R1.43 O=C(O)C1CC1CF MCULE-8263605468 [1,0,0,1,0,0|1,0,0]=3 3919 B8R1.43 O=C(O)C1CC1CO MCULE-5433690867 [1,0,0,1,0,0|1,0,0]=3 3920 B8R1.43 O=C(O)[C@@H]1C[C@H]1CCl MCULE-7560724994 [1,0,0,1,0,0|1,0,0]=3 3921 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO MCULE-9657133495 [1,0,0,1,0,0|1,0,0]=3 3922 B8R1.43 O=C(O)[C@H]1C[C@@H]1CO MCULE-1395497386 [1,0,0,1,0,0|1,0,0]=3 3923 B8R1.43 [C@@H]1(C[C@H]1C(=O)O)C#N MCULE-9124193326 [1,0,0,1,0,0|0,0,2]=4 3924 B8R1.43 [C@H]1(C[C@H]1C(=O)O)C#N MCULE-3751215343 [1,0,0,1,0,0|0,0,2]=4 3925 B8R1.48 NCC1CCS1(=O)=O MCULE-7456939034 [1,0,0,1,0,0|1,0,1]=4 3926 B8R1.48 NCC1CCS1(=O)=O MCULE-7842168331 [1,0,0,1,0,0|1,0,1]=4 3927 B8R1.72 CC1(CCCCC1)O MCULE-9091358177 [1,0,0,1,0,0|1,0,1]=4 3928 B8R1.72 N=S1(=O)CCCCC1 MCULE-8920208485 [1,0,0,1,0,0|2,0,0]=4 3929 B8R1.72 O=S1(=O)CCCCN1 MCULE-6296400181 [1,0,0,1,0,0|1,0,1]=4 3930 B10R1.13 C=C1CCC(CC1)C(=O)O MCULE-9520777832 [0,1,0,1,0,0|1,0,1]=4 3931 B10R1.13 CC(=O)C1CCC(CC1)C MCULE-6102529388 [0,1,0,1,0,0|2,0,0]=4 3932 B10R1.13 CC(=O)C1CCC(CC1)N MCULE-1009720315 [0,1,0,1,0,0|2,0,0]=4 3933 B10R1.13 CC(=O)C1CCC(CC1)N MCULE-5617448654 [0,1,0,1,0,0|2,0,0]=4 3934 B10R1.13 CC(=O)C1CCC(CC1)O MCULE-8384212790 [0,1,0,1,0,0|2,0,0]=4 3935 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)C MCULE-1016150505 [0,1,0,1,0,0|2,0,0]=4 3936 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)N MCULE-6674769937 [0,1,0,1,0,0|2,0,0]=4 3937 B10R1.13 CC(=O)[C@H]1CC[C@@H](CC1)N MCULE-7289775544 [0,1,0,1,0,0|2,0,0]=4 3938 B10R1.13 CC1CC=C(CC1)C(=O)O MCULE-7341526311 [0,1,0,1,0,0|1,0,1]=4 3939 B10R1.13 CC1CCC(CC1)C(=O)Cl MCULE-4812590612 [0,1,0,1,0,0|2,0,0]=4 3940 B10R1.13 CC1CCC(CC1)C(=O)O MCULE-3225182334 [0,1,0,1,0,0|1,0,0]=3 3941 B10R1.13 CC1CCC(CN1)C(=O)O MCULE-3840727873 [0,1,0,1,0,0|2,0,0]=4 3942 B10R1.13 CC1CCC(CN1)C(=O)O MCULE-5946890830 [0,1,0,1,0,0|2,0,0]=4 3943 B10R1.13 CC1CCC(CO1)C(=O)O MCULE-6526905782 [0,1,0,1,0,0|2,0,0]=4 3944 B10R1.13 CC1CCC(NC1)C(=O)O MCULE-2912599846 [0,1,0,1,0,0|0,0,0]=2 3945 B10R1.13 CC1CCC(NC1)C(=O)O MCULE-3297162881 [0,1,0,1,0,0|0,0,0]=2 3946 B10R1.13 CC1COC(CN1)C(=O)O MCULE-7809709557 [0,1,0,1,0,0|2,0,0]=4 3947 B10R1.13 CN1CCC(CC1)C(=O)O MCULE-1330176845 [0,1,0,1,0,0|2,0,0]=4 3948 B10R1.13 CN1CCC(CC1)C(=O)O MCULE-2860414660 [0,1,0,1,0,0|2,0,0]=4 3949 B10R1.13 C[C@@H]1CC[C@@H](CN1)C(=O)O MCULE-8843664488 [0,1,0,1,0,0|2,0,0]=4 3950 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-2204464981 [0,1,0,1,0,0|2,0,0]=4 3951 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-2225073323 [0,1,0,1,0,0|2,0,0]=4 3952 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-3036379148 [0,1,0,1,0,0|2,0,0]=4 3953 B10R1.13 C[C@@H]1CC[C@H](CN1)C(=O)O MCULE-9649426657 [0,1,0,1,0,0|2,0,0]=4 3954 B10R1.13 C[C@@H]1CN[C@H](CO1)C(=O)O MCULE-8093925660 [0,1,0,1,0,0|1,0,0]=3 3955 B10R1.13 C[C@@H]1CN[C@H](CO1)C(=O)O MCULE-9603514021 [0,1,0,1,0,0|1,0,0]=3 3956 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)Cl MCULE-2231388476 [0,1,0,1,0,0|2,0,0]=4 3957 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)N MCULE-9668889856 [0,1,0,1,0,0|2,0,0]=4 3958 B10R1.13 C[C@H]1CC[C@@H](CC1)C(=O)O MCULE-3272652270 [0,1,0,1,0,0|1,0,0]=3 3959 B10R1.13 C[C@H]1CC[C@@H](CN1)C(=O)O MCULE-6340569413 [0,1,0,1,0,0|2,0,0]=4 3960 B10R1.13 C[C@H]1CC[C@H](CC1)C(=O)O MCULE-7434442752 [0,1,0,1,0,0|1,0,0]=3 3961 B10R1.13 C[C@H]1CC[C@H](CN1)C(=O)O MCULE-3955685184 [0,1,0,1,0,0|2,0,0]=4 3962 B10R1.13 C[C@H]1CN[C@@H](CO1)C(=O)O MCULE-4706739993 [0,1,0,1,0,0|1,0,0]=3 3963 B10R1.13 C[C@H]1CN[C@@H](CO1)C(=O)O MCULE-9210189761 [0,1,0,1,0,0|1,0,0]=3 3964 B10R1.13 NC(=O)C1CCC(CC1)N MCULE-4469475065 [0,1,0,1,0,0|2,0,0]=4 3965 B10R1.13 NC(=O)C1CCC(CC1)N MCULE-4892039405 [0,1,0,1,0,0|2,0,0]=4 3966 B10R1.13 NC(=O)C1CCC(CC1)O MCULE-9699134683 [0,1,0,1,0,0|2,0,0]=4 3967 B10R1.13 NC(=O)C1CCC(CO1)N MCULE-1702911232 [0,1,0,1,0,0|2,0,0]=4 3968 B10R1.13 NC(=O)C1CCC(CO1)N MCULE-9609134356 [0,1,0,1,0,0|2,0,0]=4 3969 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-1123100792 [0,1,0,1,0,0|2,0,0]=4 3970 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-1890273222 [0,1,0,1,0,0|2,0,0]=4 3971 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-3122399272 [0,1,0,1,0,0|2,0,0]=4 3972 B10R1.13 NC(=O)[C@@H]1CC[C@H](CO1)N MCULE-5583780093 [0,1,0,1,0,0|2,0,0]=4 3973 B10R1.13 NC(=O)[C@H]1CC[C@@H](CC1)O MCULE-6564995524 [0,1,0,1,0,0|2,0,0]=4 3974 B10R1.13 NC(=O)[C@H]1CC[C@H](CC1)N MCULE-1727204707 [0,1,0,1,0,0|2,0,0]=4 3975 B10R1.13 NC(=O)[C@H]1CC[C@H](CC1)N MCULE-4007102653 [0,1,0,1,0,0|2,0,0]=4 3976 B10R1.13 NC1CC=C(CC1)C(=O)O MCULE-8027933659 [0,1,0,1,0,0|1,0,1]=4 3977 B10R1.13 NC1CCC(CC1)C(=O)Cl MCULE-4909714198 [0,1,0,1,0,0|2,0,0]=4 3978 B10R1.13 NC1CCC(CC1)C(=O)O MCULE-6722954971 [0,1,0,1,0,0|1,0,0]=3 3979 B10R1.13 NC1CCC(CC1)C(=O)O MCULE-9273524734 [0,1,0,1,0,0|1,0,0]=3 3980 B10R1.13 N[C@H]1CC[C@@H](CC1)C(=O)O MCULE-5282665037 [0,1,0,1,0,0|1,0,0]=3 3981 B10R1.13 N[C@H]1CC[C@@H](CC1)C(=O)O MCULE-8647828626 [0,1,0,1,0,0|1,0,0]=3 3982 B10R1.13 N[C@H]1CC[C@H](CC1)C(=O)O MCULE-1388612667 [0,1,0,1,0,0|1,0,0]=3 3983 B10R1.13 N[C@H]1CC[C@H](CC1)C(=O)O MCULE-8724032546 [0,1,0,1,0,0|1,0,0]=3 3984 B10R1.13 O=C(Cl)C1CCC(CC1)O MCULE-9104583730 [0,1,0,1,0,0|2,0,0]=4 3985 B10R1.13 O=C(O)C1CCC(CC1)Br MCULE-4952970959 [0,1,0,1,0,0|1,0,0]=3 3986 B10R1.13 O=C(O)C1CCC(CC1)Cl MCULE-9596975674 [0,1,0,1,0,0|1,0,0]=3 3987 B10R1.13 O=C(O)C1CCC(CC1)F MCULE-8237318279 [0,1,0,1,0,0|1,0,0]=3 3988 B10R1.13 O=C(O)C1CCC(CC1)O MCULE-2480420127 [0,1,0,1,0,0|1,0,0]=3 3989 B10R1.13 O=C(O)C1CCC(CN1)O MCULE-3204705068 [0,1,0,1,0,0|0,0,0]=2 3990 B10R1.13 O=C(O)C1CCC(CN1)O MCULE-7178398033 [0,1,0,1,0,0|0,0,0]=2 3991 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-1384355113 [0,1,0,1,0,0|0,0,0]=2 3992 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-1678351091 [0,1,0,1,0,0|0,0,0]=2 3993 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-5287470680 [0,1,0,1,0,0|0,0,0]=2 3994 B10R1.13 O=C(O)[C@@H]1CC[C@@H](CN1)O MCULE-7907264464 [0,1,0,1,0,0|0,0,0]=2 3995 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-2425882122 [0,1,0,1,0,0|0,0,0]=2 3996 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-3071319870 [0,1,0,1,0,0|0,0,0]=2 3997 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-3130571634 [0,1,0,1,0,0|0,0,0]=2 3998 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-4156067811 [0,1,0,1,0,0|0,0,0]=2 3999 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-6185299507 [0,1,0,1,0,0|0,0,0]=2 4000 B10R1.13 O=C(O)[C@@H]1CC[C@H](CN1)O MCULE-8875046289 [0,1,0,1,0,0|0,0,0]=2 4001 B10R1.13 O=C(O)[C@H]1CC[C@@H](CC1)F MCULE-9036564869 [0,1,0,1,0,0|1,0,0]=3 4002 B10R1.13 O=C(O)[C@H]1CC[C@@H](CC1)O MCULE-6625595981 [0,1,0,1,0,0|1,0,0]=3 4003 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-2267551829 [0,1,0,1,0,0|0,0,0]=2 4004 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-7339394632 [0,1,0,1,0,0|0,0,0]=2 4005 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-7777420620 [0,1,0,1,0,0|0,0,0]=2 4006 B10R1.13 O=C(O)[C@H]1CC[C@@H](CN1)O MCULE-9629486094 [0,1,0,1,0,0|0,0,0]=2 4007 B10R1.13 O=C(O)[C@H]1CC[C@H](CC1)F MCULE-1112147502 [0,1,0,1,0,0|1,0,0]=3 4008 B10R1.13 O=C(O)[C@H]1CC[C@H](CC1)O MCULE-5519058025 [0,1,0,1,0,0|1,0,0]=3 4009 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-3991583469 [0,1,0,1,0,0|0,0,0]=2 4010 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-8329848691 [0,1,0,1,0,0|0,0,0]=2 4011 B10R1.13 O=C(O)[C@H]1CC[C@H](CN1)O MCULE-8730600296 [0,1,0,1,0,0|0,0,0]=2 4012 B10R1.13 O=C1CCC(CC1)C(=O)O MCULE-3268045048 [0,1,0,1,0,0|1,0,1]=4 4013 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-4067834062 [0,1,0,1,0,0|0,0,1]=3 4014 B10R1.13 O=C1CCC(NC1)C(=O)O MCULE-8147757527 [0,1,0,1,0,0|0,0,1]=3 4015 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-4350301488 [0,1,0,1,0,0|0,0,1]=3 4016 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-6122427477 [0,1,0,1,0,0|0,0,1]=3 4017 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-7864506900 [0,1,0,1,0,0|0,0,1]=3 4018 B10R1.13 O=C1CC[C@@H](NC1)C(=O)O MCULE-8690683788 [0,1,0,1,0,0|0,0,1]=3 4019 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-2845724258 [0,1,0,1,0,0|0,0,1]=3 4020 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-4534690891 [0,1,0,1,0,0|0,0,1]=3 4021 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-5755683417 [0,1,0,1,0,0|0,0,1]=3 4022 B10R1.13 O=C1CC[C@H](NC1)C(=O)O MCULE-6015971784 [0,1,0,1,0,0|0,0,1]=3 4023 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-1011618274 [0,1,0,1,0,0|1,0,1]=4 4024 B10R1.13 O=C1CNC(CN1)C(=O)O MCULE-9345081526 [0,1,0,1,0,0|1,0,1]=4 4025 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-1270509503 [0,1,0,1,0,0|1,0,1]=4 4026 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-5912128916 [0,1,0,1,0,0|1,0,1]=4 4027 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-6974754540 [0,1,0,1,0,0|1,0,1]=4 4028 B10R1.13 O=C1CN[C@@H](CN1)C(=O)O MCULE-9137341829 [0,1,0,1,0,0|1,0,1]=4 4029 B10R1.13 O=C1CN[C@H](CN1)C(=O)O MCULE-8928326150 [0,1,0,1,0,0|1,0,1]=4 4030 B10R1.13 [C@@H]1(CC[C@H](NC1)C(=O)O)O MCULE-1423621462 [0,1,0,1,0,0|0,0,0]=2 4031 B10R1.13 [C@@H]1(CC[C@H](NC1)C(=O)O)O MCULE-1814136074 [0,1,0,1,0,0|0,0,0]=2 4032 B10R1.14 CCC(C)C1CCC(=O)C1 MCULE-5167904978 [0,1,0,1,0,0|2,0,0]=4 4033 B10R1.31 C1(NC(CS1)C(=O)O)CC MCULE-6124427567 [0,1,0,1,0,0|2,0,0]=4 4034 B10R1.31 CC(=O)N1CCC(C1)CN MCULE-1403031762 [0,1,0,1,0,0|2,0,0]=4 4035 B10R1.31 CC(=O)N1CCC(C1)CN MCULE-1933467126 [0,1,0,1,0,0|2,0,0]=4 4036 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9089135115 [0,1,0,1,0,0|1,0,0]=3 4037 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9951781675 [0,1,0,1,0,0|1,0,0]=3 4038 B10R1.31 CCC1NC(CS1)C(=O)O MCULE-2037916598 [0,1,0,1,0,0|2,0,0]=4 4039 B10R1.31 CCN1CCC(C1)C(=O)O MCULE-6987605321 [0,1,0,1,0,0|2,0,0]=4 4040 B10R1.31 COC1CCC(C1)C(=O)O MCULE-5189432372 [0,1,0,1,0,0|2,0,0]=4 4041 B10R1.31 CO[C@H]1CC[C@@H](C1)C(=O)O MCULE-8255434197 [0,1,0,1,0,0|2,0,0]=4 4042 B10R1.31 CO[C@H]1CC[C@H](C1)C(=O)O MCULE-3942607370 [0,1,0,1,0,0|2,0,0]=4 4043 B10R1.31 NCC1CCN(C1)C(=O)N MCULE-7656043539 [0,1,0,1,0,0|2,0,0]=4 4044 B10R1.31 NCC1CCN(C1)C(=O)N MCULE-8800247157 [0,1,0,1,0,0|2,0,0]=4 4045 B10R1.31 NC[C@@H]1CN[C@@H](C1)C(=O)O MCULE-2543185174 [0,1,0,1,0,0|1,0,0]=3 4046 B10R1.31 NC[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5699643655 [0,1,0,1,0,0|1,0,0]=3 4047 B10R1.54 CC(=O)CC1CCC(=O)N1 MCULE-5590242632 [0,1,0,1,0,0|1,0,1]=4 4048 B10R1.54 CC(C)CC1CCC(=O)C1 MCULE-8411928960 [0,1,0,1,0,0|2,0,0]=4 4049 B10R1.54 CC1CCC(C1)CC(=O)O MCULE-2712956835 [0,1,0,1,0,0|1,0,0]=3 4050 B10R1.54 CC1CCC(O1)CC(=O)O MCULE-8857014749 [0,1,0,1,0,0|1,0,0]=3 4051 B10R1.54 CC1CCN(C1)CC(=O)O MCULE-1407049911 [0,1,0,1,0,0|2,0,0]=4 4052 B10R1.54 CC1CCN(C1)CC(=O)O MCULE-9097138381 [0,1,0,1,0,0|2,0,0]=4 4053 B10R1.54 CN1CCC(C1)CC(=O)O MCULE-6518175603 [0,1,0,1,0,0|2,0,0]=4 4054 B10R1.54 CN1CCC(C1)CC(=O)O MCULE-7858558191 [0,1,0,1,0,0|2,0,0]=4 4055 B10R1.54 NC1CCN(C1)CC(=O)O MCULE-5943171118 [0,1,0,1,0,0|1,0,0]=3 4056 B10R1.54 NC1CCN(C1)CC(=O)O MCULE-9229773679 [0,1,0,1,0,0|1,0,0]=3 4057 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-2161728364 [0,1,0,1,0,0|1,0,0]=3 4058 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-8593996404 [0,1,0,1,0,0|1,0,0]=3 4059 B10R1.54 N[C@@H]1CCN(C1)CC(=O)O MCULE-8985734275 [0,1,0,1,0,0|1,0,0]=3 4060 B10R1.54 N[C@H]1CCN(C1)CC(=O)O MCULE-1503909439 [0,1,0,1,0,0|1,0,0]=3 4061 B10R1.54 N[C@H]1CCN(C1)CC(=O)O MCULE-6977922157 [0,1,0,1,0,0|1,0,0]=3 4062 B10R1.54 O=C(O)CC1CC(CN1)O MCULE-7161298106 [0,1,0,1,0,0|0,0,0]=2 4063 B10R1.54 O=C(O)CC1CC(CN1)O MCULE-8476180516 [0,1,0,1,0,0|0,0,0]=2 4064 B10R1.54 O=C(O)CC1CCC(=O)C1 MCULE-8065311815 [0,1,0,1,0,0|1,0,1]=4 4065 B10R1.54 O=C(O)CC1CCC(=O)N1 MCULE-4378271581 [0,1,0,1,0,0|0,0,1]=3 4066 B10R1.54 O=C(O)CC1CCC(=O)O1 MCULE-3722776234 [0,1,0,1,0,0|1,0,1]=4 4067 B10R1.54 O=C(O)CC1CCC(C1)O MCULE-1306554926 [0,1,0,1,0,0|1,0,0]=3 4068 B10R1.54 O=C(O)CN1CCC(C1)Br MCULE-3288536521 [0,1,0,1,0,0|2,0,0]=4 4069 B10R1.54 O=C(O)CN1CCC(C1)Cl MCULE-1930405641 [0,1,0,1,0,0|2,0,0]=4 4070 B10R1.54 O=C(O)CN1CCC(C1)I MCULE-4537982496 [0,1,0,1,0,0|2,0,0]=4 4071 B10R1.54 O=C(O)CN1CCC(C1)O MCULE-7707471649 [0,1,0,1,0,0|2,0,0]=4 4072 B10R1.54 O=C(O)CN1CCC(C1)O MCULE-8936002282 [0,1,0,1,0,0|2,0,0]=4 4073 B10R1.54 O=C(O)CN1CC[C@@H](C1)O MCULE-1249814394 [0,1,0,1,0,0|2,0,0]=4 4074 B10R1.54 O=C(O)CN1CC[C@@H](C1)O MCULE-2140738871 [0,1,0,1,0,0|2,0,0]=4 4075 B10R1.54 O=C(O)CN1CC[C@H](C1)O MCULE-4416769889 [0,1,0,1,0,0|2,0,0]=4 4076 B10R1.54 O=C(O)CN1CC[C@H](C1)O MCULE-4926367147 [0,1,0,1,0,0|2,0,0]=4 4077 B10R1.54 O=C(O)C[C@@H]1CC(CN1)O MCULE-5520496479 [0,1,0,1,0,0|0,0,0]=2 4078 B10R1.54 O=C(O)C[C@@H]1CC(CN1)O MCULE-9606256613 [0,1,0,1,0,0|0,0,0]=2 4079 B10R1.54 O=C(O)C[C@@H]1CCC(=O)N1 MCULE-2294433482 [0,1,0,1,0,0|0,0,1]=3 4080 B10R1.54 O=C(O)C[C@@H]1CCC(=O)N1 MCULE-6637712682 [0,1,0,1,0,0|0,0,1]=3 4081 B10R1.54 O=C(O)C[C@@H]1CC[C@@H](C1)O MCULE-2394601749 [0,1,0,1,0,0|1,0,0]=3 4082 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-1516021519 [0,1,0,1,0,0|0,0,0]=2 4083 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-4246846585 [0,1,0,1,0,0|0,0,0]=2 4084 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-5090681884 [0,1,0,1,0,0|0,0,0]=2 4085 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-6554402545 [0,1,0,1,0,0|0,0,0]=2 4086 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-8720083389 [0,1,0,1,0,0|0,0,0]=2 4087 B10R1.54 O=C(O)C[C@@H]1C[C@H](CN1)O MCULE-9359661762 [0,1,0,1,0,0|0,0,0]=2 4088 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 MCULE-1700675888 [0,1,0,1,0,0|1,0,1]=4 4089 B10R1.54 O=C(O)C[C@H]1CCC(=O)C1 MCULE-3179723751 [0,1,0,1,0,0|1,0,1]=4 4090 B10R1.54 O=C(O)C[C@H]1CCC(=O)N1 MCULE-1080082151 [0,1,0,1,0,0|0,0,1]=3 4091 B10R1.54 O=C(O)C[C@H]1CCC(=O)N1 MCULE-2947978966 [0,1,0,1,0,0|0,0,1]=3 4092 B10R1.54 O=C(O)C[C@H]1COC(=O)N1 MCULE-1807368276 [0,1,0,1,0,0|1,0,1]=4 4093 B10R1.79 O=C1CCCC(CCC1)O MCULE-4016461466 [0,1,0,1,0,0|2,0,0]=4 4094 B10R1.127 O=C(O)CCCC1CCC1 MCULE-4719788416 [0,1,0,1,0,0|1,0,0]=3 4095 B10R1.127 O=C(O)CCOC1COC1 MCULE-4318139300 [0,1,0,1,0,0|2,0,0]=4 4096 B10R1.127 O=C(O)COCC1CCC1 MCULE-7673852901 [0,1,0,1,0,0|1,0,0]=3 4097 B10R1.153 COC(=O)CCNC1CC1 MCULE-2301897798 [0,1,0,1,0,0|2,0,0]=4 4098 B10R1.153 COC(=O)CNCC1CC1 MCULE-6592202789 [0,1,0,1,0,0|2,0,0]=4 4099 B10R1.153 COC(=O)CNCC1CC1 MCULE-9101924352 [0,1,0,1,0,0|2,0,0]=4 4100 B10R1.168 CCC1CN(C1)CC(=O)O MCULE-2392138654 [0,1,0,1,0,0|2,0,0]=4 4101 B10R1.168 CCC1CN(C1)CC(=O)O MCULE-5514382088 [0,1,0,1,0,0|2,0,0]=4 4102 B10R1.171 CC1(CCCC(O1)CN)C MCULE-3816264715 [0,1,0,1,0,0|1,0,1]=4 4103 B10R1.171 NCC1CCCS(=O)(=O)C1 MCULE-5389206511 [0,1,0,1,0,0|1,0,1]=4 4104 B10R1.171 NCC1CCCS(=O)(=O)C1 MCULE-5664764803 [0,1,0,1,0,0|1,0,1]=4 4105 B10R1.194 CC1C(CCN1C)C(=O)O MCULE-3080880087 [0,1,0,1,0,0|2,0,0]=4 4106 B10R1.194 CC1C(CCN1C)C(=O)O MCULE-8463571511 [0,1,0,1,0,0|2,0,0]=4 4107 B10R1.194 CC1CCC(N1C)C(=O)O MCULE-1631473352 [0,1,0,1,0,0|2,0,0]=4 4108 B10R1.194 C[C@@H]1CC[C@H](N1C)C(=O)O MCULE-5064787674 [0,1,0,1,0,0|2,0,0]=4 4109 B10R1.194 C[C@@H]1CC[C@H](N1C)C(=O)O MCULE-5375480697 [0,1,0,1,0,0|2,0,0]=4 4110 B10R1.194 C[C@@H]1[C@@H](CCN1C)C(=O)O MCULE-1037781010 [0,1,0,1,0,0|2,0,0]=4 4111 B10R1.194 C[C@@H]1[C@@H](CCN1C)C(=O)O MCULE-5608694177 [0,1,0,1,0,0|2,0,0]=4 4112 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-2143702379 [0,1,0,1,0,0|2,0,0]=4 4113 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-3730566868 [0,1,0,1,0,0|2,0,0]=4 4114 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-7974927719 [0,1,0,1,0,0|2,0,0]=4 4115 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-9806319171 [0,1,0,1,0,0|2,0,0]=4 4116 B10R1.197 CCC1CCCC(=O)CC1 MCULE-9268041087 [0,1,0,1,0,0|2,0,0]=4 4117 B10R1.197 O=C1COC(CCN1)CO MCULE-1957898816 [0,1,0,1,0,0|2,0,0]=4 4118 B10R1.350 CC1(CC1)CCCC(=O)O MCULE-2954866291 [0,1,0,1,0,0|1,0,0]=3 4119 B10R1.350 CC1(N=N1)CCCC(=O)O MCULE-2970288895 [0,1,0,1,0,0|1,0,1]=4 4120 B10R1.10 CCCC1CC(=O)CCN1 MCULE-1509807204 [0,1,0,1,0,0|2,0,0]=4 4121 B10R1.10 CCCC1CC(=O)CCN1 MCULE-1669137140 [0,1,0,1,0,0|2,0,0]=4 4122 B10R1.10 CCCC1CC(=O)CCO1 MCULE-7566764510 [0,1,0,1,0,0|2,0,0]=4 4123 B10R1.10 CCCC1CCCC(=O)C1 MCULE-7668769463 [0,1,0,1,0,0|2,0,0]=4 4124 B10R1.10 CCCC1CCCC(=O)O1 MCULE-9181432444 [0,1,0,1,0,0|1,0,0]=3 4125 B10R1.10 CCCC1CCNC(=O)C1 MCULE-2999950135 [0,1,0,1,0,0|2,0,0]=4 4126 B10R1.10 CCOC1CCCC(=O)C1 MCULE-1985935662 [0,1,0,1,0,0|2,0,0]=4 4127 B10R1.10 COCC1CCCC(=O)C1 MCULE-5201599537 [0,1,0,1,0,0|2,0,0]=4 4128 B10R1.10 NCCN1CCCC(C1)O MCULE-6725597156 [0,1,0,1,0,0|1,0,1]=4 4129 B10R1.10 NCCN1CCCC(C1)O MCULE-7889283104 [0,1,0,1,0,0|1,0,1]=4 4130 B10R1.10 NCCN1CCCC(C1)O MCULE-8907973877 [0,1,0,1,0,0|1,0,1]=4 4131 B10R1.10 NCCN1CCC[C@@H](C1)O MCULE-6735541284 [0,1,0,1,0,0|1,0,1]=4 4132 B10R1.10 NCCN1CCC[C@H](C1)O MCULE-8332215910 [0,1,0,1,0,0|1,0,1]=4 4133 B10R1.10 NCCN1CCNC(=O)C1 MCULE-8111198516 [0,1,0,1,0,0|2,0,0]=4 4134 B10R1.10 O=C1CCCC(O1)CCBr MCULE-4728327671 [0,1,0,1,0,0|1,0,0]=3 4135 B10R1.16 C=CCCC1CCC(=O)C1 MCULE-9803992044 [0,1,0,1,0,0|2,0,0]=4 4136 B10R1.16 CCCCC1CCC(=O)O1 MCULE-2172174471 [0,1,0,1,0,0|1,0,0]=3 4137 B10R1.16 CCCCC1CNC(=O)C1 MCULE-7940886893 [0,1,0,1,0,0|2,0,0]=4 4138 B10R1.16 CCCCC1COC(=O)N1 MCULE-7413985675 [0,1,0,1,0,0|2,0,0]=4 4139 B10R1.16 N#N=NCC1CCC(=O)O1 MCULE-3535457497 [0,1,0,1,0,0|1,0,1]=4 4140 B10R1.16 NCCCC1=NNC(=O)C1 MCULE-3428014489 [0,1,0,1,0,0|1,0,1]=4 4141 B10R1.16 NCCCN1CC[C@H](C1)O MCULE-6127930765 [0,1,0,1,0,0|1,0,1]=4 4142 B10R1.18 CC(=O)CC1=CCCCC1 MCULE-7211325077 [0,1,0,1,0,0|2,0,0]=4 4143 B10R1.18 CC(=O)CC1CCCCC1 MCULE-4557008527 [0,1,0,1,0,0|2,0,0]=4 4144 B10R1.18 CC(=O)CC1CCCCN1 MCULE-1827771795 [0,1,0,1,0,0|1,0,0]=3 4145 B10R1.18 CC(=O)CC1CCCCN1 MCULE-9317294757 [0,1,0,1,0,0|1,0,0]=3 4146 B10R1.18 CC(=O)CC1CCCCO1 MCULE-1058487646 [0,1,0,1,0,0|2,0,0]=4 4147 B10R1.18 CC(=O)CC1CCCOC1 MCULE-4781249046 [0,1,0,1,0,0|2,0,0]=4 4148 B10R1.18 CC(=O)CC1CCNCC1 MCULE-3381787603 [0,1,0,1,0,0|2,0,0]=4 4149 B10R1.18 CC(=O)CC1CCNCC1 MCULE-3485224360 [0,1,0,1,0,0|2,0,0]=4 4150 B10R1.18 CC(=O)CC1CCOCC1 MCULE-6845890561 [0,1,0,1,0,0|2,0,0]=4 4151 B10R1.18 CC(=O)CC1COCCN1 MCULE-5675632157 [0,1,0,1,0,0|1,0,0]=3 4152 B10R1.18 CC(=O)CC1COCCN1 MCULE-9995133275 [0,1,0,1,0,0|1,0,0]=3 4153 B10R1.18 CC(=O)CN1CCCCC1 MCULE-2519145455 [0,1,0,1,0,0|2,0,0]=4 4154 B10R1.18 CC(=O)CN1CCCCC1 MCULE-8358959341 [0,1,0,1,0,0|2,0,0]=4 4155 B10R1.18 CC(=O)C[C@H]1CCCCN1 MCULE-2330430389 [0,1,0,1,0,0|1,0,0]=3 4156 B10R1.18 CC(=O)NC1CCCCC1 MCULE-8353778142 [0,1,0,1,0,0|2,0,0]=4 4157 B10R1.18 CC(=O)NC1CCCNC1 MCULE-2923451430 [0,1,0,1,0,0|2,0,0]=4 4158 B10R1.18 CC(=O)NC1CCCNC1 MCULE-7850537912 [0,1,0,1,0,0|2,0,0]=4 4159 B10R1.18 CC(=O)N[C@@H]1CCCNC1 MCULE-3102769783 [0,1,0,1,0,0|2,0,0]=4 4160 B10R1.18 CC(=O)N[C@@H]1CCCNC1 MCULE-4313494103 [0,1,0,1,0,0|2,0,0]=4 4161 B10R1.18 CC(=O)N[C@H]1CCCNC1 MCULE-1582624021 [0,1,0,1,0,0|2,0,0]=4 4162 B10R1.18 CC(=O)N[C@H]1CCCNC1 MCULE-7588247669 [0,1,0,1,0,0|2,0,0]=4 4163 B10R1.18 CC(=O)OC1CCCCC1 MCULE-8221153491 [0,1,0,1,0,0|2,0,0]=4 4164 B10R1.18 CC(=O)OC1CCCCS1 MCULE-7999769363 [0,1,0,1,0,0|2,0,0]=4 4165 B10R1.18 CC(=O)OC1CCCNC1 MCULE-1733458491 [0,1,0,1,0,0|2,0,0]=4 4166 B10R1.18 CC(=O)OC1CCCNC1 MCULE-4433179343 [0,1,0,1,0,0|2,0,0]=4 4167 B10R1.18 CC(O)CC1CCCCN1 MCULE-5900716273 [0,1,0,1,0,0|1,0,1]=4 4168 B10R1.18 CC(O)CC1COCCN1 MCULE-9693602239 [0,1,0,1,0,0|1,0,1]=4 4169 B10R1.18 NC(=O)CC1CCCCC1 MCULE-4951525688 [0,1,0,1,0,0|2,0,0]=4 4170 B10R1.18 NC(=O)CC1CCCCN1 MCULE-2185479052 [0,1,0,1,0,0|1,0,0]=3 4171 B10R1.18 NC(=O)CC1CCCCN1 MCULE-4538477610 [0,1,0,1,0,0|1,0,0]=3 4172 B10R1.18 NC(=O)CC1CCCNC1 MCULE-9261260462 [0,1,0,1,0,0|1,0,0]=3 4173 B10R1.18 NC(=O)CC1CCCNC1 MCULE-9756580933 [0,1,0,1,0,0|1,0,0]=3 4174 B10R1.18 NC(=O)CC1CCNCC1 MCULE-4391382932 [0,1,0,1,0,0|2,0,0]=4 4175 B10R1.18 NC(=O)CC1CCNCC1 MCULE-4639158092 [0,1,0,1,0,0|2,0,0]=4 4176 B10R1.18 NC(=O)CC1CCOCC1 MCULE-6220113088 [0,1,0,1,0,0|2,0,0]=4 4177 B10R1.18 NC(=O)CC1CNCCO1 MCULE-2394638010 [0,1,0,1,0,0|2,0,0]=4 4178 B10R1.18 NC(=O)CC1COCCN1 MCULE-1907387140 [0,1,0,1,0,0|1,0,0]=3 4179 B10R1.18 NC(=O)CC1COCCN1 MCULE-6398693859 [0,1,0,1,0,0|1,0,0]=3 4180 B10R1.18 NC(=O)CN1CCCCC1 MCULE-5267943459 [0,1,0,1,0,0|2,0,0]=4 4181 B10R1.18 NC(=O)NC1CCCCC1 MCULE-8036346010 [0,1,0,1,0,0|2,0,0]=4 4182 B10R1.18 NC(=O)NC1CCCNC1 MCULE-6949169935 [0,1,0,1,0,0|2,0,0]=4 4183 B10R1.18 NC(=O)NC1CCCNC1 MCULE-7043674090 [0,1,0,1,0,0|2,0,0]=4 4184 B10R1.18 NC(=O)OC1CCCCC1 MCULE-3235010863 [0,1,0,1,0,0|2,0,0]=4 4185 B10R1.18 O=C(Cl)CC1CCCCC1 MCULE-2220383860 [0,1,0,1,0,0|2,0,0]=4 4186 B10R1.18 O=C(Cl)CC1CCOCC1 MCULE-6068907888 [0,1,0,1,0,0|2,0,0]=4 4187 B10R1.18 O=C(Cl)OC1CCCCC1 MCULE-4011557961 [0,1,0,1,0,0|2,0,0]=4 4188 B10R1.18 O=C(O)C=C1CCCCC1 MCULE-2830279446 [0,1,0,1,0,0|1,0,1]=4 4189 B10R1.18 O=C(O)CC1=CCCCC1 MCULE-9909477927 [0,1,0,1,0,0|1,0,0]=3 4190 B10R1.18 O=C(O)CC1=CCOCC1 MCULE-9800538477 [0,1,0,1,0,0|1,0,1]=4 4191 B10R1.18 O=C(O)CC1C=CCCC1 MCULE-3207533436 [0,1,0,1,0,0|1,0,0]=3 4192 B10R1.18 O=C(O)CC1CC=CCC1 MCULE-3427584067 [0,1,0,1,0,0|1,0,1]=4 4193 B10R1.18 O=C(O)CC1CCCCC1 MCULE-3370925166 [0,1,0,1,0,0|1,0,0]=3 4194 B10R1.18 O=C(O)CC1CCCCN1 MCULE-7593127940 [0,1,0,1,0,0|0,0,0]=2 4195 B10R1.18 O=C(O)CC1CCCCN1 MCULE-7653711252 [0,1,0,1,0,0|0,0,0]=2 4196 B10R1.18 O=C(O)CC1CCCCO1 MCULE-2711682647 [0,1,0,1,0,0|1,0,0]=3 4197 B10R1.18 O=C(O)CC1CCCNC1 MCULE-3254470591 [0,1,0,1,0,0|0,0,0]=2 4198 B10R1.18 O=C(O)CC1CCCNC1 MCULE-7958803985 [0,1,0,1,0,0|0,0,0]=2 4199 B10R1.18 O=C(O)CC1CCCOC1 MCULE-5877605158 [0,1,0,1,0,0|1,0,0]=3 4200 B10R1.18 O=C(O)CC1CCNCC1 MCULE-1130327966 [0,1,0,1,0,0|1,0,0]=3 4201 B10R1.18 O=C(O)CC1CCNCC1 MCULE-2100213856 [0,1,0,1,0,0|1,0,0]=3 4202 B10R1.18 O=C(O)CC1CCOCC1 MCULE-7878329119 [0,1,0,1,0,0|1,0,0]=3 4203 B10R1.18 O=C(O)CC1CCSCC1 MCULE-3567762107 [0,1,0,1,0,0|1,0,0]=3 4204 B10R1.18 O=C(O)CC1CNCCN1 MCULE-5141588986 [0,1,0,1,0,0|0,0,0]=2 4205 B10R1.18 O=C(O)CC1CNCCO1 MCULE-3058504133 [0,1,0,1,0,0|1,0,0]=3 4206 B10R1.18 O=C(O)CC1CNCCO1 MCULE-3387061328 [0,1,0,1,0,0|1,0,0]=3 4207 B10R1.18 O=C(O)CC1CNCCO1 MCULE-4327756750 [0,1,0,1,0,0|1,0,0]=3 4208 B10R1.18 O=C(O)CC1CNCCO1 MCULE-4883251317 [0,1,0,1,0,0|1,0,0]=3 4209 B10R1.18 O=C(O)CC1COCCN1 MCULE-4486190659 [0,1,0,1,0,0|0,0,0]=2 4210 B10R1.18 O=C(O)CC1COCCN1 MCULE-8010316572 [0,1,0,1,0,0|0,0,0]=2 4211 B10R1.18 O=C(O)CC1COCCO1 MCULE-8632741098 [0,1,0,1,0,0|1,0,0]=3 4212 B10R1.18 O=C(O)CC1CSCCS1 MCULE-4793456872 [0,1,0,1,0,0|1,0,0]=3 4213 B10R1.18 O=C(O)CC1OCCCO1 MCULE-1471723881 [0,1,0,1,0,0|1,0,0]=3 4214 B10R1.18 O=C(O)CN1CCCCC1 MCULE-9137136186 [0,1,0,1,0,0|1,0,0]=3 4215 B10R1.18 O=C(O)CN1CCCCC1 MCULE-9769416161 [0,1,0,1,0,0|1,0,0]=3 4216 B10R1.18 O=C(O)CN1CCNCC1 MCULE-4945447446 [0,1,0,1,0,0|2,0,0]=4 4217 B10R1.18 O=C(O)CN1CCNCC1 MCULE-6990903527 [0,1,0,1,0,0|2,0,0]=4 4218 B10R1.18 O=C(O)CN1CCNCC1 MCULE-8811795576 [0,1,0,1,0,0|2,0,0]=4 4219 B10R1.18 O=C(O)CN1CCOCC1 MCULE-2955270234 [0,1,0,1,0,0|2,0,0]=4 4220 B10R1.18 O=C(O)CN1CCOCC1 MCULE-5710414541 [0,1,0,1,0,0|2,0,0]=4 4221 B10R1.18 O=C(O)CN1CCSCC1 MCULE-9107067895 [0,1,0,1,0,0|2,0,0]=4 4222 B10R1.18 O=C(O)CN1CCSCC1 MCULE-9299535292 [0,1,0,1,0,0|2,0,0]=4 4223 B10R1.18 O=C(O)C[C@@H]1CC=CCC1 MCULE-6316447839 [0,1,0,1,0,0|1,0,1]=4 4224 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-3905830299 [0,1,0,1,0,0|0,0,0]=2 4225 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-5277218457 [0,1,0,1,0,0|0,0,0]=2 4226 B10R1.18 O=C(O)C[C@@H]1CCCCN1 MCULE-7510387772 [0,1,0,1,0,0|0,0,0]=2 4227 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-5325818659 [0,1,0,1,0,0|0,0,0]=2 4228 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-7001078313 [0,1,0,1,0,0|0,0,0]=2 4229 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-8120215253 [0,1,0,1,0,0|0,0,0]=2 4230 B10R1.18 O=C(O)C[C@@H]1CCCNC1 MCULE-9602652995 [0,1,0,1,0,0|0,0,0]=2 4231 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-4498530905 [0,1,0,1,0,0|1,0,0]=3 4232 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-4549445854 [0,1,0,1,0,0|1,0,0]=3 4233 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-5055136882 [0,1,0,1,0,0|1,0,0]=3 4234 B10R1.18 O=C(O)C[C@@H]1CNCCO1 MCULE-7244079860 [0,1,0,1,0,0|1,0,0]=3 4235 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-2046760558 [0,1,0,1,0,0|0,0,0]=2 4236 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-4473145834 [0,1,0,1,0,0|0,0,0]=2 4237 B10R1.18 O=C(O)C[C@@H]1COCCN1 MCULE-5100169676 [0,1,0,1,0,0|0,0,0]=2 4238 B10R1.18 O=C(O)C[C@H]1CCCCN1 MCULE-3680996115 [0,1,0,1,0,0|0,0,0]=2 4239 B10R1.18 O=C(O)C[C@H]1CCCCN1 MCULE-4674662417 [0,1,0,1,0,0|0,0,0]=2 4240 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-1302740697 [0,1,0,1,0,0|0,0,0]=2 4241 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-2509529219 [0,1,0,1,0,0|0,0,0]=2 4242 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-3753473259 [0,1,0,1,0,0|0,0,0]=2 4243 B10R1.18 O=C(O)C[C@H]1CCCNC1 MCULE-9619904988 [0,1,0,1,0,0|0,0,0]=2 4244 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-1832902178 [0,1,0,1,0,0|1,0,0]=3 4245 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-5015018730 [0,1,0,1,0,0|1,0,0]=3 4246 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-5838446318 [0,1,0,1,0,0|1,0,0]=3 4247 B10R1.18 O=C(O)C[C@H]1CNCCO1 MCULE-9119322865 [0,1,0,1,0,0|1,0,0]=3 4248 B10R1.18 O=C(O)C[C@H]1COCCN1 MCULE-8571286067 [0,1,0,1,0,0|0,0,0]=2 4249 B10R1.18 O=C(O)C[C@H]1COCCN1 MCULE-9555376320 [0,1,0,1,0,0|0,0,0]=2 4250 B10R1.18 O=C(O)NC1CCCCC1 MCULE-5645794848 [0,1,0,1,0,0|1,0,0]=3 4251 B10R1.18 O=P(O)CN1CCCCC1 MCULE-5899780033 [0,1,0,1,0,0|2,0,0]=4 4252 B10R1.24 CCCCCC1CC(=O)C1 MCULE-5494050284 [0,1,0,1,0,0|2,0,0]=4 4253 B10R1.38 CC1(CCCCC1CN)O MCULE-2446688175 [0,1,0,1,0,0|1,0,1]=4 4254 B10R1.38 CC1(CCCCC1CN)O MCULE-7077538912 [0,1,0,1,0,0|1,0,1]=4 4255 B10R1.38 NCC1CCCCS1(=O)=O MCULE-6226155734 [0,1,0,1,0,0|1,0,1]=4 4256 B10R1.38 NCC1CCCCS1(=O)=O MCULE-7779455256 [0,1,0,1,0,0|1,0,1]=4 4257 B10R1.39 C=C(C)C1OCCC1CN MCULE-2272351432 [0,1,0,1,0,0|2,0,0]=4 4258 B10R1.39 CC(=O)N1CCCC1CBr MCULE-5385585494 [0,1,0,1,0,0|2,0,0]=4 4259 B10R1.39 CC(=O)N1CCCC1CCl MCULE-4718210475 [0,1,0,1,0,0|2,0,0]=4 4260 B10R1.39 CC(=O)N1CCCC1CI MCULE-8872854102 [0,1,0,1,0,0|2,0,0]=4 4261 B10R1.39 CC(=O)N1CCCC1CN MCULE-8374406668 [0,1,0,1,0,0|1,0,0]=3 4262 B10R1.39 CC(=O)N1CCCC1CO MCULE-2029735886 [0,1,0,1,0,0|2,0,0]=4 4263 B10R1.39 CC(=O)N1CCC[C@@H]1CO MCULE-3119909139 [0,1,0,1,0,0|2,0,0]=4 4264 B10R1.39 CC(=O)N1CCC[C@@H]1CO MCULE-7915815739 [0,1,0,1,0,0|2,0,0]=4 4265 B10R1.39 CC(=O)N1CCC[C@H]1CBr MCULE-6544208894 [0,1,0,1,0,0|2,0,0]=4 4266 B10R1.39 CC(=O)N1CCC[C@H]1CCl MCULE-4340233486 [0,1,0,1,0,0|2,0,0]=4 4267 B10R1.39 CC(=O)N1CCC[C@H]1CI MCULE-4108721215 [0,1,0,1,0,0|2,0,0]=4 4268 B10R1.39 CC(=O)N1CCC[C@H]1CN MCULE-8445880935 [0,1,0,1,0,0|1,0,0]=3 4269 B10R1.39 CC(=O)N1CCC[C@H]1CO MCULE-3135356114 [0,1,0,1,0,0|2,0,0]=4 4270 B10R1.39 CC(=O)N1CCC[C@H]1CO MCULE-9351527842 [0,1,0,1,0,0|2,0,0]=4 4271 B10R1.39 CCC1CCCC1C(=O)O MCULE-2134315765 [0,1,0,1,0,0|1,0,0]=3 4272 B10R1.39 CCC1CCNC1C(=O)O MCULE-1392850907 [0,1,0,1,0,0|1,0,0]=3 4273 B10R1.39 CCC1CCNC1C(=O)O MCULE-2618729884 [0,1,0,1,0,0|1,0,0]=3 4274 B10R1.39 CCC1NCCC1C(=O)O MCULE-6308897662 [0,1,0,1,0,0|1,0,0]=3 4275 B10R1.39 CCC1NCCC1C(=O)O MCULE-6989316364 [0,1,0,1,0,0|1,0,0]=3 4276 B10R1.39 CCC1OCCC1C(=O)O MCULE-3029813377 [0,1,0,1,0,0|1,0,0]=3 4277 B10R1.39 CCN1CCCC1C(=O)O MCULE-9170639085 [0,1,0,1,0,0|1,0,0]=3 4278 B10R1.39 CCN1CCC[C@@H]1C(=O)N MCULE-2931781805 [0,1,0,1,0,0|2,0,0]=4 4279 B10R1.39 CCN1CCC[C@@H]1C(=O)O MCULE-6272401541 [0,1,0,1,0,0|1,0,0]=3 4280 B10R1.39 CCN1CCC[C@H]1C(=O)N MCULE-7196500635 [0,1,0,1,0,0|2,0,0]=4 4281 B10R1.39 CCN1CCC[C@H]1C(=O)N MCULE-8340783541 [0,1,0,1,0,0|2,0,0]=4 4282 B10R1.39 CCN1CCC[C@H]1C(=O)O MCULE-4672768595 [0,1,0,1,0,0|1,0,0]=3 4283 B10R1.39 CCN1CCC[C@H]1C(=O)O MCULE-5066096497 [0,1,0,1,0,0|1,0,0]=3 4284 B10R1.39 CC[C@@H]1CNC[C@@H]1C(=O)O MCULE-8464460557 [0,1,0,1,0,0|1,0,0]=3 4285 B10R1.39 CC[C@H]1CNC[C@H]1C(=O)O MCULE-2742804200 [0,1,0,1,0,0|1,0,0]=3 4286 B10R1.39 COC1CCCC1C(=O)O MCULE-6165424004 [0,1,0,1,0,0|1,0,0]=3 4287 B10R1.39 CSC1CCCC1C(=O)O MCULE-7830513386 [0,1,0,1,0,0|1,0,0]=3 4288 B10R1.39 NC(=O)N1CCC[C@H]1CO MCULE-1529936614 [0,1,0,1,0,0|2,0,0]=4 4289 B10R1.39 NCC1CCCC1C(=O)O MCULE-5775773821 [0,1,0,1,0,0|0,0,0]=2 4290 B10R1.39 NCC1CCCC1C(=O)O MCULE-6872336527 [0,1,0,1,0,0|0,0,0]=2 4291 B10R1.39 NCC1OCCC1C(=O)O MCULE-2668866861 [0,1,0,1,0,0|0,0,0]=2 4292 B10R1.39 NCC1OCCC1C(=O)O MCULE-9067491644 [0,1,0,1,0,0|0,0,0]=2 4293 B10R1.39 NC[C@@H]1CSCN1C(=O)O MCULE-1801556250 [0,1,0,1,0,0|1,0,0]=3 4294 B10R1.39 O=C(O)C1CNCC1CO MCULE-4689035983 [0,1,0,1,0,0|1,0,0]=3 4295 B10R1.39 O=CN1CCC[C@H]1C(=O)O MCULE-4414225416 [0,1,0,1,0,0|1,0,1]=4 4296 B10R1.39 O=CN1CCC[C@H]1C(=O)O MCULE-8771289289 [0,1,0,1,0,0|1,0,1]=4 4297 B10R1.39 O=NN1CCCC1C(=O)O MCULE-4315718435 [0,1,0,1,0,0|1,0,1]=4 4298 B10R1.61 CC(=O)C1=C(CCCC1)N MCULE-6911820459 [0,1,0,1,0,0|1,0,1]=4 4299 B10R1.61 CC(=O)C1CCCCC1=O MCULE-4487262627 [0,1,0,1,0,0|2,0,0]=4 4300 B10R1.61 CC(=O)C1CCCCC1C MCULE-9283684652 [0,1,0,1,0,0|2,0,0]=4 4301 B10R1.61 CC(=O)C1CCCCC1F MCULE-4625331195 [0,1,0,1,0,0|2,0,0]=4 4302 B10R1.61 CC(=O)C1CCCCC1N MCULE-2419182932 [0,1,0,1,0,0|1,0,0]=3 4303 B10R1.61 CC(=O)C1CCCCC1N MCULE-6311029678 [0,1,0,1,0,0|1,0,0]=3 4304 B10R1.61 CC(=O)C1NCCCC1C MCULE-2230049407 [0,1,0,1,0,0|1,0,0]=3 4305 B10R1.61 CC(=O)C1NCCCC1C MCULE-8677498528 [0,1,0,1,0,0|1,0,0]=3 4306 B10R1.61 CC1=C(CCCC1)C(=O)O MCULE-2899177590 [0,1,0,1,0,0|1,0,1]=4 4307 B10R1.61 CC1CC=CCC1C(=O)O MCULE-9141456284 [0,1,0,1,0,0|1,0,1]=4 4308 B10R1.61 CC1CCCC=C1C(=O)O MCULE-2002913109 [0,1,0,1,0,0|1,0,1]=4 4309 B10R1.61 CC1CCCCC1C(=O)Cl MCULE-7597713129 [0,1,0,1,0,0|2,0,0]=4 4310 B10R1.61 CC1CCCCC1C(=O)O MCULE-3305682191 [0,1,0,1,0,0|1,0,0]=3 4311 B10R1.61 CC1CCCCN1C(=O)Cl MCULE-6389946008 [0,1,0,1,0,0|2,0,0]=4 4312 B10R1.61 CC1CCCNC1C(=O)N MCULE-8821146640 [0,1,0,1,0,0|1,0,0]=3 4313 B10R1.61 CC1CCNCC1C(=O)O MCULE-8748624987 [0,1,0,1,0,0|1,0,0]=3 4314 B10R1.61 CC1CCNCC1C(=O)O MCULE-9934986088 [0,1,0,1,0,0|1,0,0]=3 4315 B10R1.61 CC1CNCCC1C(=O)O MCULE-4662714630 [0,1,0,1,0,0|1,0,0]=3 4316 B10R1.61 CC1CNCCC1C(=O)O MCULE-7019458300 [0,1,0,1,0,0|1,0,0]=3 4317 B10R1.61 CC1COCCC1C(=O)O MCULE-3541844170 [0,1,0,1,0,0|1,0,0]=3 4318 B10R1.61 CC1NCCCC1C(=O)O MCULE-1657397096 [0,1,0,1,0,0|1,0,0]=3 4319 B10R1.61 CC1NCCCC1C(=O)O MCULE-3297923255 [0,1,0,1,0,0|1,0,0]=3 4320 B10R1.61 CC1OCCCC1C(=O)O MCULE-1412449239 [0,1,0,1,0,0|1,0,0]=3 4321 B10R1.61 CC1OCCNC1C(=O)O MCULE-7650728786 [0,1,0,1,0,0|1,0,0]=3 4322 B10R1.61 CC1OCCNC1C(=O)O MCULE-7980002158 [0,1,0,1,0,0|1,0,0]=3 4323 B10R1.61 CN1CCCCC1C(=N)N MCULE-3877430212 [0,1,0,1,0,0|2,0,0]=4 4324 B10R1.61 CN1CCCCC1C(=N)N MCULE-6905385954 [0,1,0,1,0,0|2,0,0]=4 4325 B10R1.61 CN1CCCCC1C(=O)O MCULE-3456275150 [0,1,0,1,0,0|0,0,0]=2 4326 B10R1.61 CN1CCCCC1C(=O)O MCULE-6372652181 [0,1,0,1,0,0|0,0,0]=2 4327 B10R1.61 CN1CCCCC1C(=O)O MCULE-7834522939 [0,1,0,1,0,0|0,0,0]=2 4328 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2245294368 [0,1,0,1,0,0|0,0,0]=2 4329 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2258119449 [0,1,0,1,0,0|0,0,0]=2 4330 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-4757725445 [0,1,0,1,0,0|0,0,0]=2 4331 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-9648696079 [0,1,0,1,0,0|0,0,0]=2 4332 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5396822712 [0,1,0,1,0,0|0,0,0]=2 4333 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5529863786 [0,1,0,1,0,0|0,0,0]=2 4334 B10R1.61 CN1CCNCC1C(=O)N MCULE-5869045526 [0,1,0,1,0,0|2,0,0]=4 4335 B10R1.61 CN1CCNCC1C(=O)N MCULE-6913155408 [0,1,0,1,0,0|2,0,0]=4 4336 B10R1.61 CN1CCNCC1C(=O)O MCULE-1461373192 [0,1,0,1,0,0|1,0,0]=3 4337 B10R1.61 CN1CCNCC1C(=O)O MCULE-2314108697 [0,1,0,1,0,0|1,0,0]=3 4338 B10R1.61 CN1CCNCC1C(=O)O MCULE-6876364616 [0,1,0,1,0,0|1,0,0]=3 4339 B10R1.61 CN1CCNC[C@@H]1C(=O)O MCULE-6844980804 [0,1,0,1,0,0|1,0,0]=3 4340 B10R1.61 CN1CCNC[C@@H]1C(=O)O MCULE-9108769184 [0,1,0,1,0,0|1,0,0]=3 4341 B10R1.61 CN1CCNC[C@H]1C(=O)O MCULE-5706230528 [0,1,0,1,0,0|1,0,0]=3 4342 B10R1.61 CN1CCNC[C@H]1C(=O)O MCULE-6493932779 [0,1,0,1,0,0|1,0,0]=3 4343 B10R1.61 CN1CCOCC1C(=O)O MCULE-3133710690 [0,1,0,1,0,0|1,0,0]=3 4344 B10R1.61 CN1CCOCC1C(=O)O MCULE-3290676693 [0,1,0,1,0,0|1,0,0]=3 4345 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-1062473078 [0,1,0,1,0,0|1,0,0]=3 4346 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-1353468073 [0,1,0,1,0,0|1,0,0]=3 4347 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-2754171059 [0,1,0,1,0,0|1,0,0]=3 4348 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-8165717473 [0,1,0,1,0,0|1,0,0]=3 4349 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-4042448961 [0,1,0,1,0,0|1,0,0]=3 4350 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-4563667791 [0,1,0,1,0,0|1,0,0]=3 4351 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-6824999437 [0,1,0,1,0,0|1,0,0]=3 4352 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-9114074540 [0,1,0,1,0,0|1,0,0]=3 4353 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-1327276849 [0,1,0,1,0,0|1,0,0]=3 4354 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-3578282795 [0,1,0,1,0,0|1,0,0]=3 4355 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-5453839569 [0,1,0,1,0,0|1,0,0]=3 4356 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-8712948607 [0,1,0,1,0,0|1,0,0]=3 4357 B10R1.61 C[C@@H]1NCCC[C@H]1C(=O)O MCULE-4097586923 [0,1,0,1,0,0|1,0,0]=3 4358 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-5754974970 [0,1,0,1,0,0|1,0,0]=3 4359 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-9389286375 [0,1,0,1,0,0|1,0,0]=3 4360 B10R1.61 C[C@H]1NCCC[C@@H]1C(=O)O MCULE-1705027594 [0,1,0,1,0,0|1,0,0]=3 4361 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8221283836 [0,1,0,1,0,0|1,0,0]=3 4362 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8542699735 [0,1,0,1,0,0|1,0,0]=3 4363 B10R1.61 C[C@H]1OCCC[C@H]1C(=O)O MCULE-9860065784 [0,1,0,1,0,0|1,0,0]=3 4364 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-1879170734 [0,1,0,1,0,0|1,0,0]=3 4365 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4061314927 [0,1,0,1,0,0|1,0,0]=3 4366 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4489336660 [0,1,0,1,0,0|1,0,0]=3 4367 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4667134552 [0,1,0,1,0,0|1,0,0]=3 4368 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-5449945964 [0,1,0,1,0,0|1,0,0]=3 4369 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-7387257453 [0,1,0,1,0,0|1,0,0]=3 4370 B10R1.61 NC(=O)C1CC=CCC1N MCULE-2161108232 [0,1,0,1,0,0|1,0,1]=4 4371 B10R1.61 NC(=O)C1CC=CCC1N MCULE-3871276776 [0,1,0,1,0,0|1,0,1]=4 4372 B10R1.61 NC(=O)C1CCCCC1=O MCULE-4980594289 [0,1,0,1,0,0|2,0,0]=4 4373 B10R1.61 NC(=O)C1CCCCC1N MCULE-2662216069 [0,1,0,1,0,0|1,0,0]=3 4374 B10R1.61 NC(=O)C1CCCCC1N MCULE-7467804033 [0,1,0,1,0,0|1,0,0]=3 4375 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-2158727978 [0,1,0,1,0,0|1,0,1]=4 4376 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-4418712159 [0,1,0,1,0,0|1,0,1]=4 4377 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-4498785860 [0,1,0,1,0,0|1,0,1]=4 4378 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-4657399850 [0,1,0,1,0,0|1,0,1]=4 4379 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-8109711316 [0,1,0,1,0,0|1,0,1]=4 4380 B10R1.61 NC(=O)[C@@H]1CC=CC[C@H]1N MCULE-8970935013 [0,1,0,1,0,0|1,0,1]=4 4381 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-2263565157 [0,1,0,1,0,0|1,0,0]=3 4382 B10R1.61 NC(=O)[C@@H]1CCCC[C@@H]1N MCULE-4928808183 [0,1,0,1,0,0|1,0,0]=3 4383 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-3135295628 [0,1,0,1,0,0|1,0,0]=3 4384 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-6221057684 [0,1,0,1,0,0|1,0,0]=3 4385 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-8654148060 [0,1,0,1,0,0|1,0,0]=3 4386 B10R1.61 NC(=O)[C@H]1CCCC[C@H]1N MCULE-9581516213 [0,1,0,1,0,0|1,0,0]=3 4387 B10R1.61 NC1=C(CCCC1)C(=O)O MCULE-4360190675 [0,1,0,1,0,0|0,0,1]=3 4388 B10R1.61 NC1C=CCCC1C(=O)O MCULE-4465863020 [0,1,0,1,0,0|0,0,1]=3 4389 B10R1.61 NC1C=CCCC1C(=O)O MCULE-7419185648 [0,1,0,1,0,0|0,0,1]=3 4390 B10R1.61 NC1CC=CCC1C(=O)O MCULE-1611474561 [0,1,0,1,0,0|0,0,1]=3 4391 B10R1.61 NC1CC=CCC1C(=O)O MCULE-7218542670 [0,1,0,1,0,0|0,0,1]=3 4392 B10R1.61 NC1CCCCC1C(=O)O MCULE-4736252154 [0,1,0,1,0,0|0,0,0]=2 4393 B10R1.61 NC1CCCCC1C(=O)O MCULE-6203238767 [0,1,0,1,0,0|0,0,0]=2 4394 B10R1.61 NC1COCCC1C(=O)O MCULE-3475622537 [0,1,0,1,0,0|0,0,0]=2 4395 B10R1.61 N[C@@H]1C=CCC[C@@H]1C(=O)O MCULE-5919685636 [0,1,0,1,0,0|0,0,1]=3 4396 B10R1.61 N[C@@H]1C=CCC[C@@H]1C(=O)O MCULE-7012622007 [0,1,0,1,0,0|0,0,1]=3 4397 B10R1.61 N[C@@H]1C=CCC[C@@H]1C(=O)O MCULE-7228704167 [0,1,0,1,0,0|0,0,1]=3 4398 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-2340179433 [0,1,0,1,0,0|0,0,1]=3 4399 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-5382709957 [0,1,0,1,0,0|0,0,1]=3 4400 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-5760660665 [0,1,0,1,0,0|0,0,1]=3 4401 B10R1.61 N[C@@H]1CC=CC[C@@H]1C(=O)O MCULE-7312327841 [0,1,0,1,0,0|0,0,1]=3 4402 B10R1.61 N[C@@H]1CC=CC[C@H]1C(=O)O MCULE-6730051789 [0,1,0,1,0,0|0,0,1]=3 4403 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-1790728170 [0,1,0,1,0,0|0,0,0]=2 4404 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-3150171920 [0,1,0,1,0,0|0,0,0]=2 4405 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-4600025587 [0,1,0,1,0,0|0,0,0]=2 4406 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-9708582870 [0,1,0,1,0,0|0,0,0]=2 4407 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-3088249896 [0,1,0,1,0,0|0,0,0]=2 4408 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-4663931442 [0,1,0,1,0,0|0,0,0]=2 4409 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-6017464144 [0,1,0,1,0,0|0,0,0]=2 4410 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-9507759371 [0,1,0,1,0,0|0,0,0]=2 4411 B10R1.61 N[C@H]1C=CCC[C@H]1C(=O)O MCULE-1084812750 [0,1,0,1,0,0|0,0,1]=3 4412 B10R1.61 N[C@H]1C=CCC[C@H]1C(=O)O MCULE-7223852983 [0,1,0,1,0,0|0,0,1]=3 4413 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-2088008231 [0,1,0,1,0,0|0,0,1]=3 4414 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-2783014205 [0,1,0,1,0,0|0,0,1]=3 4415 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-4211428411 [0,1,0,1,0,0|0,0,1]=3 4416 B10R1.61 N[C@H]1CC=CC[C@H]1C(=O)O MCULE-6091505598 [0,1,0,1,0,0|0,0,1]=3 4417 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-2040720562 [0,1,0,1,0,0|0,0,0]=2 4418 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-5411687824 [0,1,0,1,0,0|0,0,0]=2 4419 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-6353451287 [0,1,0,1,0,0|0,0,0]=2 4420 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-9744443114 [0,1,0,1,0,0|0,0,0]=2 4421 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-1070315128 [0,1,0,1,0,0|0,0,0]=2 4422 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-2665445473 [0,1,0,1,0,0|0,0,0]=2 4423 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-5776301031 [0,1,0,1,0,0|0,0,0]=2 4424 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-7183400727 [0,1,0,1,0,0|0,0,0]=2 4425 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-4608934385 [0,1,0,1,0,0|0,0,0]=2 4426 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-7590284479 [0,1,0,1,0,0|0,0,0]=2 4427 B10R1.61 O=C(O)C1=C(CCCC1)Br MCULE-4432967237 [0,1,0,1,0,0|1,0,1]=4 4428 B10R1.61 O=C(O)C1=C(CCCC1)Cl MCULE-4191246644 [0,1,0,1,0,0|1,0,1]=4 4429 B10R1.61 O=C(O)C1CCCCC1=O MCULE-1684765148 [0,1,0,1,0,0|1,0,0]=3 4430 B10R1.61 O=C(O)C1CCCCC1F MCULE-9495362772 [0,1,0,1,0,0|1,0,0]=3 4431 B10R1.61 O=C(O)C1CCCCC1O MCULE-4502285714 [0,1,0,1,0,0|1,0,0]=3 4432 B10R1.61 O=C(O)C1CCCCN1O MCULE-1338694603 [0,1,0,1,0,0|0,0,0]=2 4433 B10R1.61 O=C(O)C1CCCNC1=O MCULE-5733950200 [0,1,0,1,0,0|1,0,1]=4 4434 B10R1.61 O=C(O)C1CCNCC1F MCULE-5749357486 [0,1,0,1,0,0|1,0,0]=3 4435 B10R1.61 O=C(O)C1CCNCC1F MCULE-7431262807 [0,1,0,1,0,0|1,0,0]=3 4436 B10R1.61 O=C(O)C1CNCCC1=O MCULE-3624462455 [0,1,0,1,0,0|1,0,1]=4 4437 B10R1.61 O=C(O)C1NCCCC1O MCULE-2981139992 [0,1,0,1,0,0|0,0,0]=2 4438 B10R1.61 O=C(O)C1NCCNC1=O MCULE-5861499693 [0,1,0,1,0,0|1,0,1]=4 4439 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-2224593354 [0,1,0,1,0,0|0,0,0]=2 4440 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-3743184576 [0,1,0,1,0,0|0,0,0]=2 4441 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-2137327596 [0,1,0,1,0,0|0,0,0]=2 4442 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3028221093 [0,1,0,1,0,0|0,0,0]=2 4443 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3468221525 [0,1,0,1,0,0|0,0,0]=2 4444 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-5449397815 [0,1,0,1,0,0|0,0,0]=2 4445 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-2786788134 [0,1,0,1,0,0|0,0,0]=2 4446 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-3262303247 [0,1,0,1,0,0|0,0,0]=2 4447 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4026886814 [0,1,0,1,0,0|0,0,0]=2 4448 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4165843552 [0,1,0,1,0,0|0,0,0]=2 4449 B10R1.61 O=C([O-])C1CCCCC1=O MCULE-2483955816 [0,1,0,1,0,0|1,0,1]=4 4450 B10R1.61 O=C([O-])C1CCCCN1O MCULE-1323846734 [0,1,0,1,0,0|0,0,1]=3 4451 B10R1.64 CC(=O)CN1CCCC1C MCULE-5489343795 [0,1,0,1,0,0|2,0,0]=4 4452 B10R1.64 CC(=O)N[C@@H]1CCC[C@H]1F MCULE-5761457763 [0,1,0,1,0,0|2,0,0]=4 4453 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O MCULE-6420976383 [0,1,0,1,0,0|2,0,0]=4 4454 B10R1.64 CC(=O)N[C@H]1CCC[C@@H]1O MCULE-9888711851 [0,1,0,1,0,0|2,0,0]=4 4455 B10R1.64 CC(=O)O[C@@H]1CCC[C@H]1O MCULE-7895175018 [0,1,0,1,0,0|2,0,0]=4 4456 B10R1.64 CC1CCCC1CC(=O)O MCULE-1034129697 [0,1,0,1,0,0|1,0,0]=3 4457 B10R1.64 CC1CCCN1CC(=O)O MCULE-5477147476 [0,1,0,1,0,0|1,0,0]=3 4458 B10R1.64 CC1CCCN1CC(=O)O MCULE-7787437864 [0,1,0,1,0,0|1,0,0]=3 4459 B10R1.64 CC1OCCC1CC(=O)O MCULE-3630286814 [0,1,0,1,0,0|1,0,0]=3 4460 B10R1.64 CN1CCCC1CC(=O)O MCULE-1900515698 [0,1,0,1,0,0|0,0,0]=2 4461 B10R1.64 CN1CCCC1CC(=O)O MCULE-4392051296 [0,1,0,1,0,0|0,0,0]=2 4462 B10R1.64 CN1CCC[C@H]1CC(=O)O MCULE-2926738632 [0,1,0,1,0,0|0,0,0]=2 4463 B10R1.64 NC1CCCC1CC(=O)O MCULE-7275948763 [0,1,0,1,0,0|0,0,0]=2 4464 B10R1.64 NC1CCCC1CC(=O)O MCULE-7852876693 [0,1,0,1,0,0|0,0,0]=2 4465 B10R1.64 O=C(Cl)CC1CCCC1=O MCULE-7029776897 [0,1,0,1,0,0|2,0,0]=4 4466 B10R1.64 O=C(O)CC1CCCC1=O MCULE-9371811615 [0,1,0,1,0,0|1,0,0]=3 4467 B10R1.64 O=C(O)CC1CCNC1=O MCULE-4096969007 [0,1,0,1,0,0|1,0,1]=4 4468 B10R1.64 O=C(O)CN1CCCC1=O MCULE-3122232316 [0,1,0,1,0,0|1,0,1]=4 4469 B10R1.66 CC(=O)CCC1CCCC1 MCULE-9602514524 [0,1,0,1,0,0|2,0,0]=4 4470 B10R1.66 CC(=O)NCC1CCCN1 MCULE-7607447093 [0,1,0,1,0,0|1,0,0]=3 4471 B10R1.66 CC(=O)NCC1CCCN1 MCULE-9543275549 [0,1,0,1,0,0|1,0,0]=3 4472 B10R1.66 CC(=O)NCC1CCCO1 MCULE-2959865168 [0,1,0,1,0,0|2,0,0]=4 4473 B10R1.66 CC(=O)NCC1CCNC1 MCULE-1169092409 [0,1,0,1,0,0|2,0,0]=4 4474 B10R1.66 CC(=O)NCC1CCNC1 MCULE-2188033072 [0,1,0,1,0,0|2,0,0]=4 4475 B10R1.66 CC(=O)NCC1CCNC1 MCULE-8407363763 [0,1,0,1,0,0|2,0,0]=4 4476 B10R1.66 CC(=O)NC[C@@H]1CCCN1 MCULE-5496183974 [0,1,0,1,0,0|1,0,0]=3 4477 B10R1.66 CC(=O)OCC1CCCO1 MCULE-7611136571 [0,1,0,1,0,0|2,0,0]=4 4478 B10R1.66 CC(=O)OCC1CCNC1 MCULE-3194324923 [0,1,0,1,0,0|2,0,0]=4 4479 B10R1.66 CC(=O)OCC1CCNC1 MCULE-5886937054 [0,1,0,1,0,0|2,0,0]=4 4480 B10R1.66 NC(=O)CCC1CCCC1 MCULE-6308384459 [0,1,0,1,0,0|2,0,0]=4 4481 B10R1.66 NC(=O)CCN1CCCC1 MCULE-1109710642 [0,1,0,1,0,0|2,0,0]=4 4482 B10R1.66 NC(=O)CNC1CCCC1 MCULE-5401113380 [0,1,0,1,0,0|2,0,0]=4 4483 B10R1.66 NC(=O)CNC1CCCC1 MCULE-8595660552 [0,1,0,1,0,0|2,0,0]=4 4484 B10R1.66 NC(=O)COC1CCCC1 MCULE-6280655419 [0,1,0,1,0,0|2,0,0]=4 4485 B10R1.66 NC(=O)COC1CCNC1 MCULE-5330541162 [0,1,0,1,0,0|2,0,0]=4 4486 B10R1.66 NC(=O)COC1CCNC1 MCULE-9721061747 [0,1,0,1,0,0|2,0,0]=4 4487 B10R1.66 NC(=O)NCC1CCCN1 MCULE-3595646758 [0,1,0,1,0,0|1,0,0]=3 4488 B10R1.66 NC(=O)NCC1CCCO1 MCULE-5540789879 [0,1,0,1,0,0|2,0,0]=4 4489 B10R1.66 O=C(Cl)CCC1CCCC1 MCULE-6098498258 [0,1,0,1,0,0|2,0,0]=4 4490 B10R1.66 O=C(Cl)OCC1CCCO1 MCULE-9360559044 [0,1,0,1,0,0|2,0,0]=4 4491 B10R1.66 O=C(O)/C=C/C1CCCC1 MCULE-5196632480 [0,1,0,1,0,0|1,0,1]=4 4492 B10R1.66 O=C(O)C#CC1CCCO1 MCULE-1325340304 [0,1,0,1,0,0|1,0,1]=4 4493 B10R1.66 O=C(O)C=CC1CCCC1 MCULE-4492328269 [0,1,0,1,0,0|1,0,1]=4 4494 B10R1.66 O=C(O)C=CC1CCCO1 MCULE-7330043473 [0,1,0,1,0,0|1,0,1]=4 4495 B10R1.66 O=C(O)CCC1CCCC1 MCULE-4583118303 [0,1,0,1,0,0|1,0,0]=3 4496 B10R1.66 O=C(O)CCC1CCCN1 MCULE-2613608732 [0,1,0,1,0,0|0,0,0]=2 4497 B10R1.66 O=C(O)CCC1CCCN1 MCULE-8814917549 [0,1,0,1,0,0|0,0,0]=2 4498 B10R1.66 O=C(O)CCC1CCCO1 MCULE-4111498968 [0,1,0,1,0,0|1,0,0]=3 4499 B10R1.66 O=C(O)CCC1CCNC1 MCULE-8082069026 [0,1,0,1,0,0|0,0,0]=2 4500 B10R1.66 O=C(O)CCC1CCNC1 MCULE-8359539011 [0,1,0,1,0,0|0,0,0]=2 4501 B10R1.66 O=C(O)CCC1CCOC1 MCULE-9339795680 [0,1,0,1,0,0|1,0,0]=3 4502 B10R1.66 O=C(O)CCC1OCCO1 MCULE-1077920259 [0,1,0,1,0,0|1,0,0]=3 4503 B10R1.66 O=C(O)CCN1CCCC1 MCULE-4735526690 [0,1,0,1,0,0|1,0,0]=3 4504 B10R1.66 O=C(O)CCN1CCCC1 MCULE-6724732496 [0,1,0,1,0,0|1,0,0]=3 4505 B10R1.66 O=C(O)CCN1CCCO1 MCULE-4658280001 [0,1,0,1,0,0|1,0,0]=3 4506 B10R1.66 O=C(O)CCN1CCCO1 MCULE-5549624995 [0,1,0,1,0,0|1,0,0]=3 4507 B10R1.66 O=C(O)CC[C@@H]1CCCN1 MCULE-9918992229 [0,1,0,1,0,0|0,0,0]=2 4508 B10R1.66 O=C(O)CC[C@@H]1CCCO1 MCULE-8942407071 [0,1,0,1,0,0|1,0,0]=3 4509 B10R1.66 O=C(O)CC[C@H]1CCCO1 MCULE-8877470669 [0,1,0,1,0,0|1,0,0]=3 4510 B10R1.66 O=C(O)CNC1=NCCC1 MCULE-9201187486 [0,1,0,1,0,0|0,0,2]=4 4511 B10R1.66 O=C(O)CNC1=NCCN1 MCULE-9859449073 [0,1,0,1,0,0|1,0,1]=4 4512 B10R1.66 O=C(O)CNC1CCCC1 MCULE-2656159228 [0,1,0,1,0,0|1,0,0]=3 4513 B10R1.66 O=C(O)CNC1CCCC1 MCULE-9561013929 [0,1,0,1,0,0|1,0,0]=3 4514 B10R1.66 O=C(O)COC1CCCC1 MCULE-2079008170 [0,1,0,1,0,0|1,0,0]=3 4515 B10R1.66 O=C(O)COC1CCOC1 MCULE-9235017197 [0,1,0,1,0,0|2,0,0]=4 4516 B10R1.66 O=C(O)CSC1=NCCN1 MCULE-3626085668 [0,1,0,1,0,0|1,0,1]=4 4517 B10R1.66 O=C(O)CSC1CCCC1 MCULE-7601914378 [0,1,0,1,0,0|1,0,0]=3 4518 B10R1.77 O=C1CCCCCC(=O)C1 MCULE-5507646577 [0,1,0,1,0,0|2,0,0]=4 4519 B10R1.77 O=C1CCCCCC(=O)O1 MCULE-4901663442 [0,1,0,1,0,0|1,0,0]=3 4520 B10R1.78 O=C1CCCCCCCC1 MCULE-1205201333 [0,1,0,1,0,0|2,0,0]=4 4521 B10R1.78 O=C1CCCCCCCN1 MCULE-2754830482 [0,1,0,1,0,0|2,0,0]=4 4522 B10R1.78 O=C1CCCCCCCO1 MCULE-8839309567 [0,1,0,1,0,0|1,0,0]=3 4523 B10R1.86 C1(CCN1CCC)C(=O)O MCULE-6068820697 [0,1,0,1,0,0|1,0,0]=3 4524 B10R1.86 C1(CCN1CCF)C(=O)O MCULE-2135962737 [0,1,0,1,0,0|1,0,0]=3 4525 B10R1.86 CCCN1CCC1C(=O)O MCULE-3134623791 [0,1,0,1,0,0|1,0,0]=3 4526 B10R1.86 CCCN1CC[C@H]1C(=O)O MCULE-3091851598 [0,1,0,1,0,0|1,0,0]=3 4527 B10R1.86 CCCN1CC[C@H]1C(=O)O MCULE-5611349990 [0,1,0,1,0,0|1,0,0]=3 4528 B10R1.86 O=C(O)[C@@H]1CCN1CCF MCULE-3445864469 [0,1,0,1,0,0|1,0,0]=3 4529 B10R1.86 [C@H]1(CCN1CCF)C(=O)O MCULE-3345473633 [0,1,0,1,0,0|1,0,0]=3 4530 B10R1.126 O=C(O)CCCCC1CC1 MCULE-2606424315 [0,1,0,1,0,0|1,0,0]=3 4531 B10R1.126 O=C(O)CCNCC1CC1 MCULE-5098818326 [0,1,0,1,0,0|1,0,0]=3 4532 B10R1.126 O=C(O)CCOCC1CC1 MCULE-4509324999 [0,1,0,1,0,0|1,0,0]=3 4533 B10R1.126 O=C(O)CCSCC1CC1 MCULE-6245691771 [0,1,0,1,0,0|1,0,0]=3 4534 B10R1.133 NCCC1CCCS1(=O)=O MCULE-2892450980 [0,1,0,1,0,0|1,0,1]=4 4535 B10R1.133 NCCC1CCCS1(=O)=O MCULE-7530034914 [0,1,0,1,0,0|1,0,1]=4 4536 B10R1.133 NCCN1CCCS1(=O)=O MCULE-2728739500 [0,1,0,1,0,0|1,0,1]=4 4537 B10R1.133 NCCN1CCCS1(=O)=O MCULE-2953446941 [0,1,0,1,0,0|1,0,1]=4 4538 B10R1.144 CCCCC1CC1C(=O)O MCULE-5737299312 [0,1,0,1,0,0|1,0,0]=3 4539 B10R1.162 COC1CCCCC(C1)N MCULE-1070617113 [0,1,0,1,0,0|1,0,1]=4 4540 B10R1.162 CO[C@H]1CCCC[C@@H](C1)N MCULE-1076782624 [0,1,0,1,0,0|1,0,1]=4 4541 B10R1.162 CO[C@H]1CCCC[C@H](C1)N MCULE-7848033039 [0,1,0,1,0,0|1,0,1]=4 4542 B10R1.162 NCC1CCCCC(=O)N1 MCULE-4887883772 [0,1,0,1,0,0|1,0,0]=3 4543 B10R1.162 O=C1CC(CCCN1)CO MCULE-9468190378 [0,1,0,1,0,0|2,0,0]=4 4544 B10R1.162 O=C1CCCCC(N1)CO MCULE-9454883286 [0,1,0,1,0,0|2,0,0]=4 4545 B10R1.348 CC(=O)C1CCCCCC1 MCULE-9324503120 [0,1,0,1,0,0|2,0,0]=4 4546 B10R1.348 CC(=O)N1CCCCCC1 MCULE-4232660324 [0,1,0,1,0,0|2,0,0]=4 4547 B10R1.348 NC(=O)C1CCCCCC1 MCULE-2005648941 [0,1,0,1,0,0|2,0,0]=4 4548 B10R1.348 NC(=O)C1CCCCNC1 MCULE-6748059498 [0,1,0,1,0,0|1,0,0]=3 4549 B10R1.348 NC(=O)C1CCCCNC1 MCULE-8697140088 [0,1,0,1,0,0|1,0,0]=3 4550 B10R1.348 NC(=O)C1CNCCOC1 MCULE-3555049909 [0,1,0,1,0,0|2,0,0]=4 4551 B10R1.348 NC(=O)N1CCCCCC1 MCULE-6181473782 [0,1,0,1,0,0|2,0,0]=4 4552 B10R1.348 O=C(Cl)C1CCCCCC1 MCULE-4659434885 [0,1,0,1,0,0|2,0,0]=4 4553 B10R1.348 O=C(Cl)N1CCCCCC1 MCULE-3861437886 [0,1,0,1,0,0|2,0,0]=4 4554 B10R1.348 O=C(O)C1=CCCCCC1 MCULE-5438079704 [0,1,0,1,0,0|1,0,0]=3 4555 B10R1.348 O=C(O)C1=CCCOCC1 MCULE-6315041103 [0,1,0,1,0,0|1,0,1]=4 4556 B10R1.348 O=C(O)C1CCC=CCC1 MCULE-6767000432 [0,1,0,1,0,0|1,0,1]=4 4557 B10R1.348 O=C(O)C1CCCCCC1 MCULE-7903672891 [0,1,0,1,0,0|1,0,0]=3 4558 B10R1.348 O=C(O)C1CCCCCN1 MCULE-2741684183 [0,1,0,1,0,0|0,0,0]=2 4559 B10R1.348 O=C(O)C1CCCCCN1 MCULE-7374703751 [0,1,0,1,0,0|0,0,0]=2 4560 B10R1.348 O=C(O)C1CCCCNC1 MCULE-3392190626 [0,1,0,1,0,0|0,0,0]=2 4561 B10R1.348 O=C(O)C1CCCCNC1 MCULE-7795043703 [0,1,0,1,0,0|0,0,0]=2 4562 B10R1.348 O=C(O)C1CCCNCC1 MCULE-7690110773 [0,1,0,1,0,0|1,0,0]=3 4563 B10R1.348 O=C(O)C1CCCNCC1 MCULE-9766781803 [0,1,0,1,0,0|1,0,0]=3 4564 B10R1.348 O=C(O)C1CCCOCC1 MCULE-9318516869 [0,1,0,1,0,0|1,0,0]=3 4565 B10R1.348 O=C(O)C1CNCCCN1 MCULE-3558230210 [0,1,0,1,0,0|0,0,0]=2 4566 B10R1.348 O=C(O)C1CNCCCN1 MCULE-6835715048 [0,1,0,1,0,0|0,0,0]=2 4567 B10R1.348 O=C(O)C1CNCCCO1 MCULE-2282415374 [0,1,0,1,0,0|1,0,0]=3 4568 B10R1.348 O=C(O)C1CNCCCO1 MCULE-3064687044 [0,1,0,1,0,0|1,0,0]=3 4569 B10R1.348 O=C(O)C1COCCOC1 MCULE-7686530449 [0,1,0,1,0,0|2,0,0]=4 4570 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2016813857 [0,1,0,1,0,0|0,0,0]=2 4571 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-2504826586 [0,1,0,1,0,0|0,0,0]=2 4572 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-4939523441 [0,1,0,1,0,0|0,0,0]=2 4573 B10R1.348 O=C(O)[C@@H]1CCCCCN1 MCULE-8497154031 [0,1,0,1,0,0|0,0,0]=2 4574 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-1709248067 [0,1,0,1,0,0|0,0,0]=2 4575 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4607599990 [0,1,0,1,0,0|0,0,0]=2 4576 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-4947785395 [0,1,0,1,0,0|0,0,0]=2 4577 B10R1.348 O=C(O)[C@H]1CCCCCN1 MCULE-8502245212 [0,1,0,1,0,0|0,0,0]=2 4578 B10R1.348 O=C(O)[C@H]1CCCNCC1 MCULE-2658567129 [0,1,0,1,0,0|1,0,0]=3 4579 B10R1.8 CC1CC(CC(=O)N1)CN MCULE-4583006616 [0,1,0,1,0,0|2,0,0]=4 4580 B10R1.8 CC1CC(CC(=O)N1)CN MCULE-5588706286 [0,1,0,1,0,0|2,0,0]=4 4581 B10R1.91 CCOC1C(C1C(=O)O)C MCULE-2261632181 [0,1,0,1,0,0|2,0,0]=4 4582 B10R1.130 NCCC1OC(=O)NC1=O MCULE-7050720184 [0,1,0,1,0,0|1,0,1]=4 4583 B10R1.165 CCC1CN(C1C(=O)O)C MCULE-5939427175 [0,1,0,1,0,0|2,0,0]=4 4584 B10R1.165 CCC1CN([C@@H]1C(=O)O)C MCULE-3015108374 [0,1,0,1,0,0|2,0,0]=4 4585 B10R1.165 CCC1CN([C@@H]1C(=O)O)C MCULE-3864383046 [0,1,0,1,0,0|2,0,0]=4 4586 B10R1.266 CC(CC(=O)O)C1CCC1 MCULE-6722364184 [0,1,0,1,0,0|1,0,0]=3 4587 B10R1.266 CN(CC(=O)O)C1CCC1 MCULE-1496285495 [0,1,0,1,0,0|2,0,0]=4 4588 B10R1.266 NC(CC(=O)O)C1CCC1 MCULE-2395479190 [0,1,0,1,0,0|1,0,0]=3 4589 B10R1.266 NC(CC(=O)O)C1CCC1 MCULE-6970002304 [0,1,0,1,0,0|1,0,0]=3 4590 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-5065468951 [0,1,0,1,0,0|1,0,0]=3 4591 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-5782293460 [0,1,0,1,0,0|1,0,0]=3 4592 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-7296271886 [0,1,0,1,0,0|1,0,0]=3 4593 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-8027827308 [0,1,0,1,0,0|1,0,0]=3 4594 B10R1.268 O=C(O)CS(=O)CC1CC1 MCULE-8236079442 [0,1,0,1,0,0|2,0,0]=4 4595 B10R1.276 O=C1CCCCC(N1)(Cl)Cl MCULE-2700914471 [0,1,0,1,0,0|2,0,0]=4 4596 B10R1.370 CC1(CCCC1)CC(=O)O MCULE-4967984413 [0,1,0,1,0,0|1,0,0]=3 4597 B10R1.370 CC1(OCCO1)CC(=O)O MCULE-8187059716 [0,1,0,1,0,0|2,0,0]=4 4598 B10R1.370 NC1(CCCC1)CC(=O)O MCULE-5280016961 [0,1,0,1,0,0|1,0,0]=3 4599 B10R1.370 NC1(CCCC1)CC(=O)O MCULE-8706705761 [0,1,0,1,0,0|1,0,0]=3 4600 B10R1.370 NC1(CCSC1)CC(=O)O MCULE-1913904908 [0,1,0,1,0,0|2,0,0]=4 4601 B10R1.370 O=C(O)CC1(CCCC1)O MCULE-7504539994 [0,1,0,1,0,0|1,0,0]=3 4602 B10R1.370 O=C(O)CC1(CCOC1)O MCULE-7553623965 [0,1,0,1,0,0|2,0,0]=4 4603 B10R1.28 CC(C)(O)C1CCCCN1 MCULE-6643036551 [0,1,0,1,0,0|1,0,1]=4 4604 B10R1.28 CC(C)(O)C1CCCCN1 MCULE-8918854525 [0,1,0,1,0,0|1,0,1]=4 4605 B10R1.28 O=P(O)(O)C1CCCCC1 MCULE-5721503179 [0,1,0,1,0,0|2,0,0]=4 4606 B10R1.95 NCCC1CCS(=O)(=O)C1 MCULE-2596762438 [0,1,0,1,0,0|1,0,1]=4 4607 B10R1.95 NCCC1CCS(=O)(=O)C1 MCULE-9153130282 [0,1,0,1,0,0|1,0,1]=4 4608 B10R1.281 NS(=O)(=O)CC1CCCN1 MCULE-1940903206 [0,1,0,1,0,0|1,0,1]=4 4609 B10R1.281 NS(=O)(=O)CC1CCCN1 MCULE-8126293288 [0,1,0,1,0,0|1,0,1]=4 4610 B10R1.281 NS(=O)(=O)C[C@@H]1CCCN1 MCULE-1923254184 [0,1,0,1,0,0|1,0,1]=4 4611 B10R1.1 CCCC1CCC(=O)CC1 MCULE-4621155554 [0,1,0,1,0,0|2,0,0]=4 4612 B10R1.1 NCCC1CCC(=O)NC1 MCULE-4442979377 [0,1,0,1,0,0|1,0,0]=3 4613 B10R1.1 NCCC1CCC(CC1)O MCULE-6058469002 [0,1,0,1,0,0|1,0,1]=4 4614 B10R1.1 NCCN1CCC(=O)CC1 MCULE-2069270488 [0,1,0,1,0,0|2,0,0]=4 4615 B10R1.1 NCCN1CCC(=O)CC1 MCULE-9356955275 [0,1,0,1,0,0|2,0,0]=4 4616 B10R1.1 O=C1CCC(CC1)CCO MCULE-2016332390 [0,1,0,1,0,0|2,0,0]=4 4617 B10R1.2 CN1C(=O)CCCC1CN MCULE-5353606512 [0,1,0,1,0,0|1,0,0]=3 4618 B10R1.2 CN1C(=O)CCCC1CN MCULE-9312653603 [0,1,0,1,0,0|1,0,0]=3 4619 B10R1.2 CN1C(=O)CCCC1CO MCULE-1046217121 [0,1,0,1,0,0|2,0,0]=4 4620 B10R1.2 CN1C(=O)NCCC1CN MCULE-3590580692 [0,1,0,1,0,0|2,0,0]=4 4621 B10R1.2 CN1CCCC(C1=O)CN MCULE-3789237198 [0,1,0,1,0,0|2,0,0]=4 4622 B10R1.2 CN1CCCC(C1=O)CN MCULE-8693154455 [0,1,0,1,0,0|2,0,0]=4 4623 B10R1.7 CC1CCCCCCC1=O MCULE-5002473983 [0,1,0,1,0,0|2,0,0]=4 4624 B10R1.7 O=C1CCCCCC=C1F MCULE-8826870713 [0,1,0,1,0,0|2,0,0]=4 4625 B10R1.7 O=C1NCCCCCC1I MCULE-6621175147 [0,1,0,1,0,0|1,0,1]=4 4626 B10R1.15 C1(CCCCN1)C(=O)OC MCULE-3306037072 [0,1,0,1,0,0|0,0,0]=2 4627 B10R1.15 C1(CCCCN1)C(=O)OC MCULE-9288344897 [0,1,0,1,0,0|0,0,0]=2 4628 B10R1.15 C1(CCCNC1)C(=O)OC MCULE-4117287216 [0,1,0,1,0,0|2,0,0]=4 4629 B10R1.15 C1(CCCNC1)C(=O)OC MCULE-8091301795 [0,1,0,1,0,0|2,0,0]=4 4630 B10R1.15 C1(CNCCN1)C(=O)OC MCULE-2958013355 [0,1,0,1,0,0|1,0,0]=3 4631 B10R1.15 C1(CNCCN1)C(=O)OC MCULE-6072954554 [0,1,0,1,0,0|1,0,0]=3 4632 B10R1.15 C1(COCCN1)C(=O)OC MCULE-1359060783 [0,1,0,1,0,0|1,0,0]=3 4633 B10R1.15 C1(COCCN1)C(=O)OC MCULE-5136187934 [0,1,0,1,0,0|1,0,0]=3 4634 B10R1.15 C=CC(=O)C1CCCCC1 MCULE-2668727628 [0,1,0,1,0,0|2,0,0]=4 4635 B10R1.15 CC(=NO)C1CCCCC1 MCULE-1684283685 [0,1,0,1,0,0|2,0,0]=4 4636 B10R1.15 CC(CO)C1CCCCN1 MCULE-4944883554 [0,1,0,1,0,0|1,0,1]=4 4637 B10R1.15 CCC(=O)C1CCCCC1 MCULE-8203276385 [0,1,0,1,0,0|2,0,0]=4 4638 B10R1.15 CCC(=O)C1CCCCN1 MCULE-6703727171 [0,1,0,1,0,0|1,0,0]=3 4639 B10R1.15 CCC(=O)C1CCCCN1 MCULE-7018103553 [0,1,0,1,0,0|1,0,0]=3 4640 B10R1.15 CCC(O)C1CCCCN1 MCULE-7730134295 [0,1,0,1,0,0|1,0,1]=4 4641 B10R1.15 CC[C@@H](O)[C@@H]1CCCCN1 MCULE-5363275416 [0,1,0,1,0,0|1,0,1]=4 4642 B10R1.15 CNC(=O)C1CCCCC1 MCULE-4980742243 [0,1,0,1,0,0|2,0,0]=4 4643 B10R1.15 CNC(=O)C1CCCCN1 MCULE-2059398226 [0,1,0,1,0,0|1,0,0]=3 4644 B10R1.15 CNC(=O)C1CCCCN1 MCULE-6797335969 [0,1,0,1,0,0|1,0,0]=3 4645 B10R1.15 CNC(=O)C1COCCN1 MCULE-9896951123 [0,1,0,1,0,0|2,0,0]=4 4646 B10R1.15 CNC(=O)[C@@H]1CCCCN1 MCULE-3578222481 [0,1,0,1,0,0|1,0,0]=3 4647 B10R1.15 CNC(=O)[C@@H]1CCCCN1 MCULE-5767177119 [0,1,0,1,0,0|1,0,0]=3 4648 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-1484363402 [0,1,0,1,0,0|1,0,0]=3 4649 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-2898288746 [0,1,0,1,0,0|1,0,0]=3 4650 B10R1.15 CNC(=O)[C@H]1CCCCN1 MCULE-8199763754 [0,1,0,1,0,0|1,0,0]=3 4651 B10R1.15 COC(=O)C1=CCCCC1 MCULE-3153400458 [0,1,0,1,0,0|1,0,1]=4 4652 B10R1.15 COC(=O)C1CC=CCN1 MCULE-5717808763 [0,1,0,1,0,0|0,0,2]=4 4653 B10R1.15 COC(=O)C1CCCCC1 MCULE-6850082589 [0,1,0,1,0,0|1,0,0]=3 4654 B10R1.15 COC(=O)C1CCCCN1 MCULE-1345527122 [0,1,0,1,0,0|0,0,0]=2 4655 B10R1.15 COC(=O)C1CCCCN1 MCULE-3343413800 [0,1,0,1,0,0|0,0,0]=2 4656 B10R1.15 COC(=O)C1CCCCO1 MCULE-4699637806 [0,1,0,1,0,0|1,0,0]=3 4657 B10R1.15 COC(=O)C1CCCCS1 MCULE-5621167539 [0,1,0,1,0,0|1,0,0]=3 4658 B10R1.15 COC(=O)C1CCCNC1 MCULE-5215588899 [0,1,0,1,0,0|2,0,0]=4 4659 B10R1.15 COC(=O)C1CCCNC1 MCULE-8977979820 [0,1,0,1,0,0|2,0,0]=4 4660 B10R1.15 COC(=O)C1CCCNN1 MCULE-3033001919 [0,1,0,1,0,0|1,0,0]=3 4661 B10R1.15 COC(=O)C1CCCNN1 MCULE-3440886963 [0,1,0,1,0,0|1,0,0]=3 4662 B10R1.15 COC(=O)C1CCCOC1 MCULE-8852064521 [0,1,0,1,0,0|2,0,0]=4 4663 B10R1.15 COC(=O)C1CCNCC1 MCULE-5613020223 [0,1,0,1,0,0|2,0,0]=4 4664 B10R1.15 COC(=O)C1CCNCC1 MCULE-9635570834 [0,1,0,1,0,0|2,0,0]=4 4665 B10R1.15 COC(=O)C1CCOCC1 MCULE-9277091866 [0,1,0,1,0,0|2,0,0]=4 4666 B10R1.15 COC(=O)C1CCSCC1 MCULE-2533530421 [0,1,0,1,0,0|2,0,0]=4 4667 B10R1.15 COC(=O)C1CNCCN1 MCULE-5461430924 [0,1,0,1,0,0|1,0,0]=3 4668 B10R1.15 COC(=O)C1CNCCN1 MCULE-5985522017 [0,1,0,1,0,0|1,0,0]=3 4669 B10R1.15 COC(=O)C1CNCCO1 MCULE-2698329193 [0,1,0,1,0,0|2,0,0]=4 4670 B10R1.15 COC(=O)C1CNCCO1 MCULE-4908930366 [0,1,0,1,0,0|2,0,0]=4 4671 B10R1.15 COC(=O)C1CNCCO1 MCULE-5645711588 [0,1,0,1,0,0|2,0,0]=4 4672 B10R1.15 COC(=O)C1CNCCO1 MCULE-6370167621 [0,1,0,1,0,0|2,0,0]=4 4673 B10R1.15 COC(=O)C1CNCCO1 MCULE-8941359764 [0,1,0,1,0,0|2,0,0]=4 4674 B10R1.15 COC(=O)C1COCCN1 MCULE-3550093500 [0,1,0,1,0,0|1,0,0]=3 4675 B10R1.15 COC(=O)C1COCCN1 MCULE-6551273056 [0,1,0,1,0,0|1,0,0]=3 4676 B10R1.15 COC(=O)C1COCCN1 MCULE-6840431140 [0,1,0,1,0,0|1,0,0]=3 4677 B10R1.15 COC(=O)C1CSCCN1 MCULE-3631055578 [0,1,0,1,0,0|1,0,0]=3 4678 B10R1.15 COC(=O)C1CSCCN1 MCULE-7757706847 [0,1,0,1,0,0|1,0,0]=3 4679 B10R1.15 COC(=O)C1SCCCS1 MCULE-8385963909 [0,1,0,1,0,0|2,0,0]=4 4680 B10R1.15 COC(=O)N1CCCCC1 MCULE-4843476028 [0,1,0,1,0,0|2,0,0]=4 4681 B10R1.15 COC(=O)N1CCCCC1 MCULE-8096578349 [0,1,0,1,0,0|2,0,0]=4 4682 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-4659733955 [0,1,0,1,0,0|0,0,0]=2 4683 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-6675153946 [0,1,0,1,0,0|0,0,0]=2 4684 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-7164905117 [0,1,0,1,0,0|0,0,0]=2 4685 B10R1.15 COC(=O)[C@@H]1CCCCN1 MCULE-8391987811 [0,1,0,1,0,0|0,0,0]=2 4686 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-1357072117 [0,1,0,1,0,0|2,0,0]=4 4687 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-6685948915 [0,1,0,1,0,0|2,0,0]=4 4688 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-7943195603 [0,1,0,1,0,0|2,0,0]=4 4689 B10R1.15 COC(=O)[C@@H]1CCCNC1 MCULE-8245028670 [0,1,0,1,0,0|2,0,0]=4 4690 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-4492703729 [0,1,0,1,0,0|1,0,0]=3 4691 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-4789174904 [0,1,0,1,0,0|1,0,0]=3 4692 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-6004868841 [0,1,0,1,0,0|1,0,0]=3 4693 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-8447894362 [0,1,0,1,0,0|1,0,0]=3 4694 B10R1.15 COC(=O)[C@@H]1CCCNN1 MCULE-8973989363 [0,1,0,1,0,0|1,0,0]=3 4695 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-5551273180 [0,1,0,1,0,0|1,0,0]=3 4696 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-5976690411 [0,1,0,1,0,0|1,0,0]=3 4697 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-7451026930 [0,1,0,1,0,0|1,0,0]=3 4698 B10R1.15 COC(=O)[C@@H]1CNCCN1 MCULE-8752855910 [0,1,0,1,0,0|1,0,0]=3 4699 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-1095109510 [0,1,0,1,0,0|2,0,0]=4 4700 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-4732803083 [0,1,0,1,0,0|2,0,0]=4 4701 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-5642785598 [0,1,0,1,0,0|2,0,0]=4 4702 B10R1.15 COC(=O)[C@@H]1CNCCO1 MCULE-5749221307 [0,1,0,1,0,0|2,0,0]=4 4703 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-5162429786 [0,1,0,1,0,0|1,0,0]=3 4704 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-7239532241 [0,1,0,1,0,0|1,0,0]=3 4705 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-7684323850 [0,1,0,1,0,0|1,0,0]=3 4706 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-8072335300 [0,1,0,1,0,0|1,0,0]=3 4707 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-8375175370 [0,1,0,1,0,0|1,0,0]=3 4708 B10R1.15 COC(=O)[C@@H]1COCCN1 MCULE-9876388752 [0,1,0,1,0,0|1,0,0]=3 4709 B10R1.15 COC(=O)[C@@H]1CSCCN1 MCULE-2644672819 [0,1,0,1,0,0|1,0,0]=3 4710 B10R1.15 COC(=O)[C@@H]1CSCCN1 MCULE-8721567121 [0,1,0,1,0,0|1,0,0]=3 4711 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-5042289968 [0,1,0,1,0,0|0,0,0]=2 4712 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-5552610931 [0,1,0,1,0,0|0,0,0]=2 4713 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-6096933206 [0,1,0,1,0,0|0,0,0]=2 4714 B10R1.15 COC(=O)[C@H]1CCCCN1 MCULE-6748268572 [0,1,0,1,0,0|0,0,0]=2 4715 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-1258591863 [0,1,0,1,0,0|2,0,0]=4 4716 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-2913297882 [0,1,0,1,0,0|2,0,0]=4 4717 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-7994934831 [0,1,0,1,0,0|2,0,0]=4 4718 B10R1.15 COC(=O)[C@H]1CCCNC1 MCULE-9664872744 [0,1,0,1,0,0|2,0,0]=4 4719 B10R1.15 COC(=O)[C@H]1CCCOC1 MCULE-3895837022 [0,1,0,1,0,0|2,0,0]=4 4720 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-1502399125 [0,1,0,1,0,0|1,0,0]=3 4721 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-4305901126 [0,1,0,1,0,0|1,0,0]=3 4722 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-4581702554 [0,1,0,1,0,0|1,0,0]=3 4723 B10R1.15 COC(=O)[C@H]1CNCCN1 MCULE-5249386287 [0,1,0,1,0,0|1,0,0]=3 4724 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-1713285364 [0,1,0,1,0,0|2,0,0]=4 4725 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-2717742188 [0,1,0,1,0,0|2,0,0]=4 4726 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-3191998281 [0,1,0,1,0,0|2,0,0]=4 4727 B10R1.15 COC(=O)[C@H]1CNCCO1 MCULE-4522663718 [0,1,0,1,0,0|2,0,0]=4 4728 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-2095296947 [0,1,0,1,0,0|1,0,0]=3 4729 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-4051082225 [0,1,0,1,0,0|1,0,0]=3 4730 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-5485853687 [0,1,0,1,0,0|1,0,0]=3 4731 B10R1.15 COC(=O)[C@H]1COCCN1 MCULE-8734141342 [0,1,0,1,0,0|1,0,0]=3 4732 B10R1.15 COC(=O)[C@H]1CSCCN1 MCULE-6859763829 [0,1,0,1,0,0|1,0,0]=3 4733 B10R1.15 N/C(=N/O)/C1CCCCC1 MCULE-7400174450 [0,1,0,1,0,0|2,0,0]=4 4734 B10R1.15 NCC(=O)C1CCCCC1 MCULE-5312619543 [0,1,0,1,0,0|2,0,0]=4 4735 B10R1.15 NCC(=O)C1CCCCC1 MCULE-8215004471 [0,1,0,1,0,0|2,0,0]=4 4736 B10R1.15 NNC(=O)C1CCCCC1 MCULE-3486870731 [0,1,0,1,0,0|2,0,0]=4 4737 B10R1.15 NNC(=O)C1CCCCO1 MCULE-7036120684 [0,1,0,1,0,0|2,0,0]=4 4738 B10R1.15 O/N=C(\Cl)/C1CCCCC1 MCULE-3114876572 [0,1,0,1,0,0|2,0,0]=4 4739 B10R1.15 O=C(CBr)C1CCCCC1 MCULE-1828005520 [0,1,0,1,0,0|2,0,0]=4 4740 B10R1.15 O=C(CCl)C1CCCCC1 MCULE-1798641564 [0,1,0,1,0,0|2,0,0]=4 4741 B10R1.15 O=C(CCl)C1CCCCO1 MCULE-3635601081 [0,1,0,1,0,0|2,0,0]=4 4742 B10R1.15 O=C(CO)C1CCCCC1 MCULE-7711081081 [0,1,0,1,0,0|1,0,0]=3 4743 B10R1.15 O=C(CO)N1CCCCC1 MCULE-2972774035 [0,1,0,1,0,0|2,0,0]=4 4744 B10R1.15 O=C(NO)C1CCCCC1 MCULE-4311817351 [0,1,0,1,0,0|1,0,0]=3 4745 B10R1.15 O=C(NO)C1CCNCC1 MCULE-3667251310 [0,1,0,1,0,0|2,0,0]=4 4746 B10R1.15 OCC(O)C1CCCCN1 MCULE-6655190494 [0,1,0,1,0,0|0,0,2]=4 4747 B10R1.27 COC(=O)/C=C/1\CCCN1 MCULE-9234856543 [0,1,0,1,0,0|0,0,2]=4 4748 B10R1.27 COC(=O)C=C1CCCN1 MCULE-8409180030 [0,1,0,1,0,0|0,0,2]=4 4749 B10R1.27 COC(=O)CC1=CCCC1 MCULE-8638739617 [0,1,0,1,0,0|1,0,1]=4 4750 B10R1.27 COC(=O)CC1CCCC1 MCULE-9342597891 [0,1,0,1,0,0|1,0,0]=3 4751 B10R1.27 COC(=O)CC1CCCN1 MCULE-5803935472 [0,1,0,1,0,0|0,0,0]=2 4752 B10R1.27 COC(=O)CC1CCCN1 MCULE-8428971594 [0,1,0,1,0,0|0,0,0]=2 4753 B10R1.27 COC(=O)CC1CCCN1 MCULE-8962564154 [0,1,0,1,0,0|0,0,0]=2 4754 B10R1.27 COC(=O)CC1CCCN1 MCULE-9463345165 [0,1,0,1,0,0|0,0,0]=2 4755 B10R1.27 COC(=O)CC1CCCO1 MCULE-5045576239 [0,1,0,1,0,0|1,0,0]=3 4756 B10R1.27 COC(=O)CC1CCNC1 MCULE-1335311848 [0,1,0,1,0,0|2,0,0]=4 4757 B10R1.27 COC(=O)CC1CCNC1 MCULE-1342941310 [0,1,0,1,0,0|2,0,0]=4 4758 B10R1.27 COC(=O)CC1CCOC1 MCULE-5503781159 [0,1,0,1,0,0|2,0,0]=4 4759 B10R1.27 COC(=O)CC1OCCO1 MCULE-1011128337 [0,1,0,1,0,0|2,0,0]=4 4760 B10R1.27 COC(=O)CN1CCCC1 MCULE-6435350712 [0,1,0,1,0,0|2,0,0]=4 4761 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-3432361428 [0,1,0,1,0,0|0,0,0]=2 4762 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-4923467879 [0,1,0,1,0,0|0,0,0]=2 4763 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-7489755473 [0,1,0,1,0,0|0,0,0]=2 4764 B10R1.27 COC(=O)C[C@@H]1CCCN1 MCULE-9818066506 [0,1,0,1,0,0|0,0,0]=2 4765 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-2278430991 [0,1,0,1,0,0|2,0,0]=4 4766 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-7607667453 [0,1,0,1,0,0|2,0,0]=4 4767 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-7633055222 [0,1,0,1,0,0|2,0,0]=4 4768 B10R1.27 COC(=O)C[C@@H]1CCNC1 MCULE-8491722899 [0,1,0,1,0,0|2,0,0]=4 4769 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-3400926095 [0,1,0,1,0,0|0,0,0]=2 4770 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-3995901791 [0,1,0,1,0,0|0,0,0]=2 4771 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-6386262688 [0,1,0,1,0,0|0,0,0]=2 4772 B10R1.27 COC(=O)C[C@H]1CCCN1 MCULE-9243040577 [0,1,0,1,0,0|0,0,0]=2 4773 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-2917470545 [0,1,0,1,0,0|2,0,0]=4 4774 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-4018086942 [0,1,0,1,0,0|2,0,0]=4 4775 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-5775187737 [0,1,0,1,0,0|2,0,0]=4 4776 B10R1.27 COC(=O)C[C@H]1CCNC1 MCULE-6881593954 [0,1,0,1,0,0|2,0,0]=4 4777 B10R1.27 N/C(=N/O)/CC1CCCC1 MCULE-5747462847 [0,1,0,1,0,0|2,0,0]=4 4778 B10R1.27 N/C(=N\O)/CC1CCCO1 MCULE-5663324435 [0,1,0,1,0,0|2,0,0]=4 4779 B10R1.27 NNC(=O)CC1CCCC1 MCULE-6266427637 [0,1,0,1,0,0|2,0,0]=4 4780 B10R1.27 NNC(=O)CC1CCCO1 MCULE-5795900293 [0,1,0,1,0,0|2,0,0]=4 4781 B10R1.27 O=C(CO)NC1CCCC1 MCULE-7488310244 [0,1,0,1,0,0|2,0,0]=4 4782 B10R1.27 O=C(NO)OC1CCCC1 MCULE-8628794772 [0,1,0,1,0,0|2,0,0]=4 4783 B10R1.94 CCCC1=C(C(=O)CC1)O MCULE-2996179116 [0,1,0,1,0,0|1,0,1]=4 4784 B10R1.99 COC(=O)C1CC1CCO MCULE-9852071077 [0,1,0,1,0,0|1,0,0]=3 4785 B10R1.99 COC(=O)[C@H]1C[C@@H]1CCO MCULE-2333161396 [0,1,0,1,0,0|1,0,0]=3 4786 B10R1.99 COC(=O)[C@H]1C[C@@H]1CCO MCULE-2823946888 [0,1,0,1,0,0|1,0,0]=3 4787 B10R1.99 NNC(=O)C1CC1CCO MCULE-8301608988 [0,1,0,1,0,0|2,0,0]=4 4788 B10R1.149 COC(=O)C1=C(CCC1)N MCULE-9863493137 [0,1,0,1,0,0|0,0,2]=4 4789 B10R1.149 COC(=O)C1CCCC1=O MCULE-6028022990 [0,1,0,1,0,0|1,0,1]=4 4790 B10R1.149 COC(=O)C1CCCC1N MCULE-1292074679 [0,1,0,1,0,0|0,0,0]=2 4791 B10R1.149 COC(=O)C1CCCC1N MCULE-1475645605 [0,1,0,1,0,0|0,0,0]=2 4792 B10R1.149 COC(=O)C1CCCC1O MCULE-3674845958 [0,1,0,1,0,0|1,0,0]=3 4793 B10R1.149 COC(=O)C1CCCN1C MCULE-4362840235 [0,1,0,1,0,0|2,0,0]=4 4794 B10R1.149 COC(=O)C1CCCN1C MCULE-5596975421 [0,1,0,1,0,0|2,0,0]=4 4795 B10R1.149 COC(=O)C1CCNC1C MCULE-8241817730 [0,1,0,1,0,0|2,0,0]=4 4796 B10R1.149 COC(=O)C1CCNC1C MCULE-8840385748 [0,1,0,1,0,0|2,0,0]=4 4797 B10R1.149 COC(=O)C1CCOC1C MCULE-1899362431 [0,1,0,1,0,0|2,0,0]=4 4798 B10R1.149 COC(=O)C1CNCC1C MCULE-7210179317 [0,1,0,1,0,0|2,0,0]=4 4799 B10R1.149 COC(=O)C1CNCC1C MCULE-8278654714 [0,1,0,1,0,0|2,0,0]=4 4800 B10R1.149 COC(=O)C1COCC1N MCULE-4643249679 [0,1,0,1,0,0|1,0,0]=3 4801 B10R1.149 COC(=O)C1COCC1N MCULE-5720773592 [0,1,0,1,0,0|1,0,0]=3 4802 B10R1.149 COC(=O)C1NCCC1C MCULE-2145747628 [0,1,0,1,0,0|2,0,0]=4 4803 B10R1.149 COC(=O)C1NCCC1O MCULE-7668238984 [0,1,0,1,0,0|2,0,0]=4 4804 B10R1.149 COC(=O)C1NCCC1O MCULE-8444325552 [0,1,0,1,0,0|2,0,0]=4 4805 B10R1.149 COC(=O)[C@@H]1CCCN1C MCULE-1885742091 [0,1,0,1,0,0|2,0,0]=4 4806 B10R1.149 COC(=O)[C@@H]1CCCN1C MCULE-9974114171 [0,1,0,1,0,0|2,0,0]=4 4807 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-2645143657 [0,1,0,1,0,0|0,0,0]=2 4808 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-7497757726 [0,1,0,1,0,0|0,0,0]=2 4809 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-8238495714 [0,1,0,1,0,0|0,0,0]=2 4810 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-9068401272 [0,1,0,1,0,0|0,0,0]=2 4811 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-9532295626 [0,1,0,1,0,0|0,0,0]=2 4812 B10R1.149 COC(=O)[C@@H]1CCC[C@H]1N MCULE-8649678944 [0,1,0,1,0,0|0,0,0]=2 4813 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C MCULE-2548615141 [0,1,0,1,0,0|2,0,0]=4 4814 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C MCULE-6985668415 [0,1,0,1,0,0|2,0,0]=4 4815 B10R1.149 COC(=O)[C@@H]1COC[C@@H]1N MCULE-2028778520 [0,1,0,1,0,0|1,0,0]=3 4816 B10R1.149 COC(=O)[C@@H]1COC[C@H]1N MCULE-2770189409 [0,1,0,1,0,0|1,0,0]=3 4817 B10R1.149 COC(=O)[C@@H]1COC[C@H]1N MCULE-9601097180 [0,1,0,1,0,0|1,0,0]=3 4818 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1C MCULE-6327833377 [0,1,0,1,0,0|2,0,0]=4 4819 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-3563774658 [0,1,0,1,0,0|2,0,0]=4 4820 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-4025671364 [0,1,0,1,0,0|2,0,0]=4 4821 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-4085872822 [0,1,0,1,0,0|2,0,0]=4 4822 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-5987049143 [0,1,0,1,0,0|2,0,0]=4 4823 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1C MCULE-8404202430 [0,1,0,1,0,0|2,0,0]=4 4824 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-7580132055 [0,1,0,1,0,0|2,0,0]=4 4825 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-8046366255 [0,1,0,1,0,0|2,0,0]=4 4826 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-8054998969 [0,1,0,1,0,0|2,0,0]=4 4827 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-9150462314 [0,1,0,1,0,0|2,0,0]=4 4828 B10R1.149 COC(=O)[C@H]1CCCN1C MCULE-4739167857 [0,1,0,1,0,0|2,0,0]=4 4829 B10R1.149 COC(=O)[C@H]1CCCN1C MCULE-5685325244 [0,1,0,1,0,0|2,0,0]=4 4830 B10R1.149 COC(=O)[C@H]1CCCN1N MCULE-2618575181 [0,1,0,1,0,0|1,0,0]=3 4831 B10R1.149 COC(=O)[C@H]1CCCN1N MCULE-6641562773 [0,1,0,1,0,0|1,0,0]=3 4832 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N MCULE-1925401143 [0,1,0,1,0,0|0,0,0]=2 4833 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N MCULE-3666883935 [0,1,0,1,0,0|0,0,0]=2 4834 B10R1.149 COC(=O)[C@H]1CCC[C@H]1N MCULE-2108800799 [0,1,0,1,0,0|0,0,0]=2 4835 B10R1.149 COC(=O)[C@H]1CCC[C@H]1N MCULE-9702061223 [0,1,0,1,0,0|0,0,0]=2 4836 B10R1.149 COC(=O)[C@H]1CCC[C@H]1O MCULE-9551218859 [0,1,0,1,0,0|1,0,0]=3 4837 B10R1.149 COC(=O)[C@H]1CCN[C@@H]1C MCULE-2992960189 [0,1,0,1,0,0|2,0,0]=4 4838 B10R1.149 COC(=O)[C@H]1CCN[C@@H]1C MCULE-9449255589 [0,1,0,1,0,0|2,0,0]=4 4839 B10R1.149 COC(=O)[C@H]1CCN[C@H]1C MCULE-1719318949 [0,1,0,1,0,0|2,0,0]=4 4840 B10R1.149 COC(=O)[C@H]1CCN[C@H]1C MCULE-7330244444 [0,1,0,1,0,0|2,0,0]=4 4841 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-1764804596 [0,1,0,1,0,0|2,0,0]=4 4842 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-2864244140 [0,1,0,1,0,0|2,0,0]=4 4843 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-5987586809 [0,1,0,1,0,0|2,0,0]=4 4844 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-8761929916 [0,1,0,1,0,0|2,0,0]=4 4845 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-8926066537 [0,1,0,1,0,0|2,0,0]=4 4846 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-9572268200 [0,1,0,1,0,0|2,0,0]=4 4847 B10R1.149 COC(=O)[C@H]1CNC[C@H]1O MCULE-3516416146 [0,1,0,1,0,0|2,0,0]=4 4848 B10R1.149 COC(=O)[C@H]1CNC[C@H]1O MCULE-5550156083 [0,1,0,1,0,0|2,0,0]=4 4849 B10R1.149 COC(=O)[C@H]1COC[C@@H]1N MCULE-3460136130 [0,1,0,1,0,0|1,0,0]=3 4850 B10R1.149 COC(=O)[C@H]1COC[C@@H]1N MCULE-9139612146 [0,1,0,1,0,0|1,0,0]=3 4851 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-5871041714 [0,1,0,1,0,0|1,0,0]=3 4852 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-6548766790 [0,1,0,1,0,0|1,0,0]=3 4853 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-7696136714 [0,1,0,1,0,0|1,0,0]=3 4854 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-8815307889 [0,1,0,1,0,0|1,0,0]=3 4855 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-9302309227 [0,1,0,1,0,0|1,0,0]=3 4856 B10R1.149 COC(=O)[C@H]1COC[C@H]1N MCULE-9730204585 [0,1,0,1,0,0|1,0,0]=3 4857 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1C MCULE-6874278829 [0,1,0,1,0,0|2,0,0]=4 4858 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-1707749919 [0,1,0,1,0,0|2,0,0]=4 4859 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-2162736804 [0,1,0,1,0,0|2,0,0]=4 4860 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-2328775326 [0,1,0,1,0,0|2,0,0]=4 4861 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-6152782400 [0,1,0,1,0,0|2,0,0]=4 4862 B10R1.149 COC(=O)[C@H]1NCC[C@H]1C MCULE-1156779891 [0,1,0,1,0,0|2,0,0]=4 4863 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-3447587166 [0,1,0,1,0,0|2,0,0]=4 4864 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-5783585395 [0,1,0,1,0,0|2,0,0]=4 4865 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-7552928230 [0,1,0,1,0,0|2,0,0]=4 4866 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-8961364493 [0,1,0,1,0,0|2,0,0]=4 4867 B10R1.149 C[C@H]1CNC[C@@H]1C(=O)CO MCULE-2509682466 [0,1,0,1,0,0|2,0,0]=4 4868 B10R1.149 [C@@H]1(CCN[C@@H]1C(=O)OC)O MCULE-3575931306 [0,1,0,1,0,0|2,0,0]=4 4869 B10R1.149 [C@@H]1(CCN[C@@H]1C(=O)OC)O MCULE-5233829978 [0,1,0,1,0,0|2,0,0]=4 4870 B10R1.149 [C@@H]1(NCC[C@H]1O)C(=O)OC MCULE-4044407927 [0,1,0,1,0,0|2,0,0]=4 4871 B10R1.149 [C@@H]1(NCC[C@H]1O)C(=O)OC MCULE-7536456993 [0,1,0,1,0,0|2,0,0]=4 4872 B10R1.151 COC(=O)CCC1CNC1 MCULE-1365275007 [0,1,0,1,0,0|2,0,0]=4 4873 B10R1.151 COC(=O)CCC1CNC1 MCULE-2678688700 [0,1,0,1,0,0|2,0,0]=4 4874 B10R1.151 COC(=O)CCN1CCC1 MCULE-1137855857 [0,1,0,1,0,0|2,0,0]=4 4875 B10R1.151 COC(=O)COC1CCC1 MCULE-1185518800 [0,1,0,1,0,0|2,0,0]=4 4876 B10R1.161 COC1=CCCCCCC1 MCULE-3500334234 [0,1,0,1,0,0|2,0,0]=4 4877 B10R1.161 COC1=CCCCCCC1 MCULE-4140921077 [0,1,0,1,0,0|2,0,0]=4 4878 B10R1.161 COC1=NCCCCCC1 MCULE-5781494943 [0,1,0,1,0,0|2,0,0]=4 4879 B10R1.161 O=CC1=CCCCCCC1 MCULE-3035020921 [0,1,0,1,0,0|2,0,0]=4 4880 B10R1.161 O=CC1=CCCCCCC1 MCULE-5359478815 [0,1,0,1,0,0|2,0,0]=4 4881 B10R1.161 ON=C1CCCCCCC1 MCULE-1582039185 [0,1,0,1,0,0|2,0,0]=4 4882 B10R1.172 COC1=CC(CCC1)CO MCULE-4704775875 [0,1,0,1,0,0|2,0,0]=4 4883 B10R1.172 NC[C@@H]1CCC[C@@H](C1)CO MCULE-4521290774 [0,1,0,1,0,0|1,0,1]=4 4884 B10R1.172 NC[C@@H]1CCC[C@@H](C1)CO MCULE-7994183611 [0,1,0,1,0,0|1,0,1]=4 4885 B10R1.175 COC(=O)C1CCC1C#N MCULE-2118721488 [0,1,0,1,0,0|0,0,2]=4 4886 B10R1.175 COC(=O)C1CCC1CO MCULE-4671679944 [0,1,0,1,0,0|1,0,0]=3 4887 B10R1.230 C#C[C@@]1(CCCC[C@@H]1N)O MCULE-2980219862 [0,1,0,1,0,0|1,0,1]=4 4888 B10R1.275 CN1CCCCC(C1=O)N MCULE-1128026770 [0,1,0,1,0,0|2,0,0]=4 4889 B10R1.275 CN1CCCCC(C1=O)N MCULE-5720348878 [0,1,0,1,0,0|2,0,0]=4 4890 B10R1.275 CN1CCCC[C@@H](C1=O)N MCULE-2695124435 [0,1,0,1,0,0|2,0,0]=4 4891 B10R1.275 CN1CCCC[C@@H](C1=O)N MCULE-5087189943 [0,1,0,1,0,0|2,0,0]=4 4892 B10R1.275 CN1CCCC[C@@H](C1=O)N MCULE-8004795447 [0,1,0,1,0,0|2,0,0]=4 4893 B10R1.275 CN1CCCC[C@@H](C1=O)N MCULE-8596695391 [0,1,0,1,0,0|2,0,0]=4 4894 B10R1.275 CN1CCCC[C@H](C1=O)N MCULE-3422308826 [0,1,0,1,0,0|2,0,0]=4 4895 B10R1.275 CN1CCCC[C@H](C1=O)N MCULE-6992352501 [0,1,0,1,0,0|2,0,0]=4 4896 B10R1.275 N[C@@H]1CCCC[C@H]([C@@H]1O)O MCULE-8809733803 [0,1,0,1,0,0|0,0,2]=4 4897 B10R1.23 CC(C(=O)O)C1CCCC1 MCULE-5802736245 [0,1,0,1,0,0|1,0,0]=3 4898 B10R1.23 CC(C(=O)O)C1CCCO1 MCULE-7845267101 [0,1,0,1,0,0|1,0,0]=3 4899 B10R1.23 CC(C(=O)O)C1CCOC1 MCULE-7866218529 [0,1,0,1,0,0|2,0,0]=4 4900 B10R1.23 CC(C(=O)O)N1CCCC1 MCULE-1089880160 [0,1,0,1,0,0|2,0,0]=4 4901 B10R1.23 CC(C(=O)O)N1CCCC1 MCULE-6643699902 [0,1,0,1,0,0|2,0,0]=4 4902 B10R1.23 CC(C(=O)O)N1CCCC1 MCULE-9316791928 [0,1,0,1,0,0|2,0,0]=4 4903 B10R1.23 C[C@@H](C(=O)O)N1CCCC1 MCULE-3614375066 [0,1,0,1,0,0|2,0,0]=4 4904 B10R1.23 C[C@@H](C(=O)O)N1CCCC1 MCULE-3855579270 [0,1,0,1,0,0|2,0,0]=4 4905 B10R1.23 C[C@H](C(=O)O)N1CCCC1 MCULE-8338161515 [0,1,0,1,0,0|2,0,0]=4 4906 B10R1.23 C[C@H](C(=O)O)N1CCCC1 MCULE-8839356147 [0,1,0,1,0,0|2,0,0]=4 4907 B10R1.23 NC(=O)C(F)C1CCCC1 MCULE-2132325699 [0,1,0,1,0,0|2,0,0]=4 4908 B10R1.23 NC(=O)C(N)C1CCCC1 MCULE-5304987336 [0,1,0,1,0,0|2,0,0]=4 4909 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-7146175523 [0,1,0,1,0,0|1,0,0]=3 4910 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-7746486136 [0,1,0,1,0,0|1,0,0]=3 4911 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-9888348666 [0,1,0,1,0,0|1,0,0]=3 4912 B10R1.23 NC(C(=O)O)C1CCCO1 MCULE-3670924700 [0,1,0,1,0,0|1,0,0]=3 4913 B10R1.23 NC(C(=O)O)C1CCNC1 MCULE-1642984994 [0,1,0,1,0,0|2,0,0]=4 4914 B10R1.23 NC(C(=O)O)C1CCNC1 MCULE-8012924580 [0,1,0,1,0,0|2,0,0]=4 4915 B10R1.23 NC(C(=O)O)C1CCOC1 MCULE-9063647673 [0,1,0,1,0,0|2,0,0]=4 4916 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 MCULE-2078695461 [0,1,0,1,0,0|1,0,0]=3 4917 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 MCULE-7548517913 [0,1,0,1,0,0|1,0,0]=3 4918 B10R1.23 N[C@H](C(=O)O)C1CCCC1 MCULE-1391706498 [0,1,0,1,0,0|1,0,0]=3 4919 B10R1.23 N[C@H](C(=O)O)C1CCCC1 MCULE-5447481000 [0,1,0,1,0,0|1,0,0]=3 4920 B10R1.23 O=C(O)C(=O)C1CCCC1 MCULE-3971745471 [0,1,0,1,0,0|1,0,1]=4 4921 B10R1.23 O=C(O)C(Br)C1CCCC1 MCULE-1051918450 [0,1,0,1,0,0|1,0,0]=3 4922 B10R1.23 O=C(O)C(F)C1CCCC1 MCULE-8637303916 [0,1,0,1,0,0|1,0,0]=3 4923 B10R1.23 O=C(O)C(F)C1CCOC1 MCULE-4380204267 [0,1,0,1,0,0|2,0,0]=4 4924 B10R1.23 O=C(O)C(O)C1CCCC1 MCULE-1471598195 [0,1,0,1,0,0|1,0,0]=3 4925 B10R1.23 O=C(O)C(O)C1CCNC1 MCULE-8304713060 [0,1,0,1,0,0|2,0,0]=4 4926 B10R1.23 O=C(O)[C@@H](Br)C1CCCC1 MCULE-6560406332 [0,1,0,1,0,0|1,0,0]=3 4927 B10R1.23 O=C(O)[C@H](O)C1CCCC1 MCULE-1883242923 [0,1,0,1,0,0|1,0,0]=3 4928 B10R1.93 CCCC1CC(C1)C(=O)O MCULE-7182602664 [0,1,0,1,0,0|1,0,0]=3 4929 B10R1.93 CCOC1CC(C1)C(=O)O MCULE-2644121943 [0,1,0,1,0,0|2,0,0]=4 4930 B10R1.93 COCC1CC(C1)C(=O)O MCULE-8420432135 [0,1,0,1,0,0|2,0,0]=4 4931 B10R1.113 CC(=O)N1CCCC(C1)N MCULE-4642648861 [0,1,0,1,0,0|2,0,0]=4 4932 B10R1.113 CC(=O)N1CCCC(C1)N MCULE-7081928105 [0,1,0,1,0,0|2,0,0]=4 4933 B10R1.113 CC(=O)N1CCC[C@@H](C1)N MCULE-2900342300 [0,1,0,1,0,0|2,0,0]=4 4934 B10R1.113 CC(=O)N1CCC[C@@H](C1)N MCULE-5325252584 [0,1,0,1,0,0|2,0,0]=4 4935 B10R1.113 CC(=O)N1CCC[C@@H](C1)N MCULE-9462446118 [0,1,0,1,0,0|2,0,0]=4 4936 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-2743229947 [0,1,0,1,0,0|2,0,0]=4 4937 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-2860088162 [0,1,0,1,0,0|2,0,0]=4 4938 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-5518465296 [0,1,0,1,0,0|2,0,0]=4 4939 B10R1.113 CC(=O)N1CCC[C@H](C1)N MCULE-8760084774 [0,1,0,1,0,0|2,0,0]=4 4940 B10R1.113 CC(C)C1CCCC(=O)C1 MCULE-1852539155 [0,1,0,1,0,0|2,0,0]=4 4941 B10R1.113 CC1=NCCC(N1)C(=O)O MCULE-8417553503 [0,1,0,1,0,0|1,0,1]=4 4942 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-7720743223 [0,1,0,1,0,0|2,0,0]=4 4943 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-8584436669 [0,1,0,1,0,0|2,0,0]=4 4944 B10R1.113 CC1CC(CCO1)C(=O)O MCULE-8051149188 [0,1,0,1,0,0|2,0,0]=4 4945 B10R1.113 CC1CCCC(C1)C(=O)O MCULE-1709216331 [0,1,0,1,0,0|1,0,0]=3 4946 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-2752928027 [0,1,0,1,0,0|0,0,0]=2 4947 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7361502591 [0,1,0,1,0,0|0,0,0]=2 4948 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7906995060 [0,1,0,1,0,0|0,0,0]=2 4949 B10R1.113 CC1CCCC(O1)C(=O)O MCULE-2545962496 [0,1,0,1,0,0|1,0,0]=3 4950 B10R1.113 CC1CCNC(C1)C(=O)N MCULE-8372541866 [0,1,0,1,0,0|1,0,0]=3 4951 B10R1.113 CC1CCNC(C1)C(=O)O MCULE-7170086856 [0,1,0,1,0,0|0,0,0]=2 4952 B10R1.113 CC1CCNC(C1)C(C)O MCULE-6816426503 [0,1,0,1,0,0|1,0,1]=4 4953 B10R1.113 CC1CNCC(C1)C(=O)O MCULE-6208683659 [0,1,0,1,0,0|2,0,0]=4 4954 B10R1.113 CC1CNCC(O1)C(=O)O MCULE-4851002529 [0,1,0,1,0,0|2,0,0]=4 4955 B10R1.113 CC1COCC(N1)C(=O)N MCULE-4300959650 [0,1,0,1,0,0|2,0,0]=4 4956 B10R1.113 CC1COCC(N1)C(=O)O MCULE-6739051094 [0,1,0,1,0,0|1,0,0]=3 4957 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-2577677138 [0,1,0,1,0,0|2,0,0]=4 4958 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-9093982856 [0,1,0,1,0,0|2,0,0]=4 4959 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3472059995 [0,1,0,1,0,0|2,0,0]=4 4960 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3661518240 [0,1,0,1,0,0|2,0,0]=4 4961 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-4244061094 [0,1,0,1,0,0|2,0,0]=4 4962 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-1368409828 [0,1,0,1,0,0|2,0,0]=4 4963 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-2079226353 [0,1,0,1,0,0|2,0,0]=4 4964 B10R1.113 CN1CCNC(C1)C(=O)N MCULE-3257789162 [0,1,0,1,0,0|2,0,0]=4 4965 B10R1.113 CN1CCNC(C1)C(=O)N MCULE-6597619500 [0,1,0,1,0,0|2,0,0]=4 4966 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-2247528725 [0,1,0,1,0,0|1,0,0]=3 4967 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-9094338983 [0,1,0,1,0,0|1,0,0]=3 4968 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-5238925665 [0,1,0,1,0,0|1,0,0]=3 4969 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-6341643779 [0,1,0,1,0,0|1,0,0]=3 4970 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-1518073789 [0,1,0,1,0,0|1,0,0]=3 4971 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-8312508233 [0,1,0,1,0,0|1,0,0]=3 4972 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-5046751827 [0,1,0,1,0,0|2,0,0]=4 4973 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-8819512874 [0,1,0,1,0,0|2,0,0]=4 4974 B10R1.113 CS(=O)C1CCCC(C1)N MCULE-3230262975 [0,1,0,1,0,0|2,0,0]=4 4975 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-4534640450 [0,1,0,1,0,0|1,0,0]=3 4976 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6827473516 [0,1,0,1,0,0|0,0,0]=2 4977 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6916060172 [0,1,0,1,0,0|0,0,0]=2 4978 B10R1.113 C[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2658835025 [0,1,0,1,0,0|1,0,0]=3 4979 B10R1.113 C[C@@H]1CCN[C@@H](C1)C(=O)O MCULE-6382189211 [0,1,0,1,0,0|0,0,0]=2 4980 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-3220705725 [0,1,0,1,0,0|0,0,0]=2 4981 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-4368703620 [0,1,0,1,0,0|0,0,0]=2 4982 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-5852226290 [0,1,0,1,0,0|0,0,0]=2 4983 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-8448888283 [0,1,0,1,0,0|0,0,0]=2 4984 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-6787897599 [0,1,0,1,0,0|2,0,0]=4 4985 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-7011808441 [0,1,0,1,0,0|2,0,0]=4 4986 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-1640808929 [0,1,0,1,0,0|2,0,0]=4 4987 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-5152957457 [0,1,0,1,0,0|2,0,0]=4 4988 B10R1.113 C[C@@H]1CNC[C@H](C1)C(=O)O MCULE-8762702780 [0,1,0,1,0,0|2,0,0]=4 4989 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-6500795104 [0,1,0,1,0,0|2,0,0]=4 4990 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-9135304432 [0,1,0,1,0,0|2,0,0]=4 4991 B10R1.113 C[C@H]1CCC[C@@H](C1)C(=O)O MCULE-2151963828 [0,1,0,1,0,0|1,0,0]=3 4992 B10R1.113 C[C@H]1CCC[C@H](C1)C(=O)O MCULE-9191189376 [0,1,0,1,0,0|1,0,0]=3 4993 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3797871093 [0,1,0,1,0,0|0,0,0]=2 4994 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3813657182 [0,1,0,1,0,0|0,0,0]=2 4995 B10R1.113 C[C@H]1CCN[C@H](C1)C(=O)O MCULE-8048617173 [0,1,0,1,0,0|0,0,0]=2 4996 B10R1.113 C[C@H]1CNC[C@@H](C1)C(=O)O MCULE-9182357479 [0,1,0,1,0,0|2,0,0]=4 4997 B10R1.113 C[C@H]1CNC[C@H](C1)C(=O)O MCULE-7208949681 [0,1,0,1,0,0|2,0,0]=4 4998 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-3777490064 [0,1,0,1,0,0|2,0,0]=4 4999 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-7587755997 [0,1,0,1,0,0|2,0,0]=4 5000 B10R1.113 NC(=O)C1CCCC(=O)C1 MCULE-3502536681 [0,1,0,1,0,0|1,0,1]=4 5001 B10R1.113 NC(=O)C1CCCC(C1)N MCULE-5887465193 [0,1,0,1,0,0|1,0,0]=3 5002 B10R1.113 NC(=O)N1CCCC(C1)N MCULE-6231215658 [0,1,0,1,0,0|2,0,0]=4 5003 B10R1.113 NC(=O)N1CCCC(C1)N MCULE-7051693066 [0,1,0,1,0,0|2,0,0]=4 5004 B10R1.113 NC(=O)N1CCC[C@H](C1)N MCULE-7905125532 [0,1,0,1,0,0|2,0,0]=4 5005 B10R1.113 NC(=O)N1CCC[C@H](C1)N MCULE-9518047308 [0,1,0,1,0,0|2,0,0]=4 5006 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-1352569589 [0,1,0,1,0,0|1,0,0]=3 5007 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3084012877 [0,1,0,1,0,0|1,0,0]=3 5008 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3571668618 [0,1,0,1,0,0|1,0,0]=3 5009 B10R1.113 NC(=O)[C@@H]1CCC[C@H](C1)N MCULE-3930179934 [0,1,0,1,0,0|1,0,0]=3 5010 B10R1.113 NC1C=CCC(C1)C(=O)O MCULE-4308750395 [0,1,0,1,0,0|0,0,2]=4 5011 B10R1.113 NC1C=CCC(C1)C(=O)O MCULE-5984594154 [0,1,0,1,0,0|0,0,2]=4 5012 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-1721377644 [0,1,0,1,0,0|0,0,0]=2 5013 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-3598251126 [0,1,0,1,0,0|0,0,0]=2 5014 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7071803947 [0,1,0,1,0,0|1,0,0]=3 5015 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7129710557 [0,1,0,1,0,0|1,0,0]=3 5016 B10R1.113 N[C@@H]1C=CCC(C1)C(=O)O MCULE-5349723370 [0,1,0,1,0,0|0,0,2]=4 5017 B10R1.113 N[C@@H]1C=CCC(C1)C(=O)O MCULE-8912699325 [0,1,0,1,0,0|0,0,2]=4 5018 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5563204448 [0,1,0,1,0,0|0,0,0]=2 5019 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5798146682 [0,1,0,1,0,0|0,0,0]=2 5020 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-8105249419 [0,1,0,1,0,0|0,0,0]=2 5021 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-9161171059 [0,1,0,1,0,0|0,0,0]=2 5022 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2713838733 [0,1,0,1,0,0|0,0,0]=2 5023 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2810146308 [0,1,0,1,0,0|0,0,0]=2 5024 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-3141762073 [0,1,0,1,0,0|0,0,0]=2 5025 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-6970045085 [0,1,0,1,0,0|0,0,0]=2 5026 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-5264166397 [0,1,0,1,0,0|1,0,0]=3 5027 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-6153195788 [0,1,0,1,0,0|1,0,0]=3 5028 B10R1.113 N[C@H]1C=CCC(C1)C(=O)O MCULE-1166952810 [0,1,0,1,0,0|0,0,2]=4 5029 B10R1.113 N[C@H]1C=CCC(C1)C(=O)O MCULE-4761766781 [0,1,0,1,0,0|0,0,2]=4 5030 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-3283868687 [0,1,0,1,0,0|0,0,0]=2 5031 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-5009823003 [0,1,0,1,0,0|0,0,0]=2 5032 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-6716939610 [0,1,0,1,0,0|0,0,0]=2 5033 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-8264766500 [0,1,0,1,0,0|0,0,0]=2 5034 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-1016300044 [0,1,0,1,0,0|0,0,0]=2 5035 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-2730367375 [0,1,0,1,0,0|0,0,0]=2 5036 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3326410223 [0,1,0,1,0,0|0,0,0]=2 5037 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3370817462 [0,1,0,1,0,0|0,0,0]=2 5038 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3467671648 [0,1,0,1,0,0|0,0,0]=2 5039 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-7929171022 [0,1,0,1,0,0|0,0,0]=2 5040 B10R1.113 O=C(O)C1=CC(CCC1)O MCULE-3053514968 [0,1,0,1,0,0|1,0,1]=4 5041 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-2758341308 [0,1,0,1,0,0|0,0,0]=2 5042 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-7585455422 [0,1,0,1,0,0|0,0,0]=2 5043 B10R1.113 O=C(O)C1CCCC(C1)F MCULE-2589850350 [0,1,0,1,0,0|1,0,0]=3 5044 B10R1.113 O=C(O)C1CCCC(C1)O MCULE-9068909742 [0,1,0,1,0,0|1,0,0]=3 5045 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-1307689360 [0,1,0,1,0,0|2,0,0]=4 5046 B10R1.113 O=C(O)C1CNCC(C1)O MCULE-6671293935 [0,1,0,1,0,0|2,0,0]=4 5047 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-2725116552 [0,1,0,1,0,0|1,0,0]=3 5048 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-7493333189 [0,1,0,1,0,0|1,0,0]=3 5049 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-1509835362 [0,1,0,1,0,0|1,0,0]=3 5050 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-2282540668 [0,1,0,1,0,0|1,0,0]=3 5051 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-2678948022 [0,1,0,1,0,0|1,0,0]=3 5052 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-6048774329 [0,1,0,1,0,0|1,0,0]=3 5053 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-1390000123 [0,1,0,1,0,0|0,0,0]=2 5054 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-5873942206 [0,1,0,1,0,0|0,0,0]=2 5055 B10R1.113 O=C(O)[C@@H]1C[C@H](CCN1)O MCULE-5317131791 [0,1,0,1,0,0|0,0,0]=2 5056 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-1308626340 [0,1,0,1,0,0|1,0,0]=3 5057 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-5789638591 [0,1,0,1,0,0|1,0,0]=3 5058 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3370494896 [0,1,0,1,0,0|1,0,0]=3 5059 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3728932412 [0,1,0,1,0,0|1,0,0]=3 5060 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1474484031 [0,1,0,1,0,0|0,0,0]=2 5061 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1820373402 [0,1,0,1,0,0|0,0,0]=2 5062 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4771226737 [0,1,0,1,0,0|0,0,0]=2 5063 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4907773186 [0,1,0,1,0,0|0,0,0]=2 5064 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-8175624129 [0,1,0,1,0,0|0,0,0]=2 5065 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-4751772547 [0,1,0,1,0,0|0,0,0]=2 5066 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-6686826243 [0,1,0,1,0,0|0,0,0]=2 5067 B10R1.113 O=C1CCCC(C1)C(=O)O MCULE-6286773194 [0,1,0,1,0,0|1,0,1]=4 5068 B10R1.113 O=C1CCCC(C1)C(F)F MCULE-2034413487 [0,1,0,1,0,0|2,0,0]=4 5069 B10R1.113 O=C1CCCC(N1)C(=O)O MCULE-9444010827 [0,1,0,1,0,0|0,0,1]=3 5070 B10R1.113 O=C1CCCC(N1)C(=O)O MCULE-9607599809 [0,1,0,1,0,0|0,0,1]=3 5071 B10R1.113 O=C1CCC[C@@H](C1)C(=O)O MCULE-5396925186 [0,1,0,1,0,0|1,0,1]=4 5072 B10R1.113 O=C1CCC[C@@H](N1)C(=O)O MCULE-3091454903 [0,1,0,1,0,0|0,0,1]=3 5073 B10R1.113 O=C1CCC[C@@H](N1)C(=O)O MCULE-5853502175 [0,1,0,1,0,0|0,0,1]=3 5074 B10R1.113 O=C1CCC[C@H](C1)C(=O)O MCULE-8936667281 [0,1,0,1,0,0|1,0,1]=4 5075 B10R1.113 O=C1CCC[C@H](N1)C(=O)O MCULE-6509598163 [0,1,0,1,0,0|0,0,1]=3 5076 B10R1.113 O=C1CCC[C@H](N1)C(=O)O MCULE-7646943695 [0,1,0,1,0,0|0,0,1]=3 5077 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-6916176336 [0,1,0,1,0,0|0,0,1]=3 5078 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-9262761817 [0,1,0,1,0,0|0,0,1]=3 5079 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-1115212106 [0,1,0,1,0,0|0,0,1]=3 5080 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5896394571 [0,1,0,1,0,0|0,0,1]=3 5081 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5937606037 [0,1,0,1,0,0|0,0,1]=3 5082 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-7073629862 [0,1,0,1,0,0|0,0,1]=3 5083 B10R1.113 O=C1CNCC(N1)C(=O)O MCULE-4117148380 [0,1,0,1,0,0|1,0,1]=4 5084 B10R1.113 O=C1CNC[C@@H](N1)C(=O)O MCULE-3006600193 [0,1,0,1,0,0|1,0,1]=4 5085 B10R1.113 O=C1CNC[C@H](N1)C(=O)O MCULE-4345470043 [0,1,0,1,0,0|1,0,1]=4 5086 B10R1.113 O=C1CSCC(N1)C(=O)O MCULE-7630386798 [0,1,0,1,0,0|1,0,1]=4 5087 B10R1.113 O=C1CSC[C@H](N1)C(=O)O MCULE-1412113570 [0,1,0,1,0,0|1,0,1]=4 5088 B10R1.113 O=C1NC(CCO1)C(=O)O MCULE-4281750243 [0,1,0,1,0,0|1,0,1]=4 5089 B10R1.113 O=C1NCCC(N1)C(=O)O MCULE-6196729766 [0,1,0,1,0,0|1,0,1]=4 5090 B10R1.113 O=C1N[C@@H](CCO1)C(=O)O MCULE-7121690603 [0,1,0,1,0,0|1,0,1]=4 5091 B10R1.113 [C@@H]1(CCCC(N1)C)C(=O)O MCULE-7930307305 [0,1,0,1,0,0|0,0,0]=2 5092 B10R1.113 [C@H]1(CCCN(C1)C)C(=O)O MCULE-4364645223 [0,1,0,1,0,0|2,0,0]=4 5093 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-2539251802 [0,1,0,1,0,0|0,0,0]=2 5094 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-4407634771 [0,1,0,1,0,0|0,0,0]=2 5095 B10R1.131 CCCC1OC(=O)C(O1)C MCULE-3323635957 [0,1,0,1,0,0|2,0,0]=4 5096 B10R1.131 CN1CC(CC1=O)CCN MCULE-6918414305 [0,1,0,1,0,0|2,0,0]=4 5097 B10R1.176 CN1CCC(CC1=O)CN MCULE-3850118896 [0,1,0,1,0,0|2,0,0]=4 5098 B10R1.176 CN1CCC(CC1=O)CN MCULE-4980643488 [0,1,0,1,0,0|2,0,0]=4 5099 B10R1.176 CN1CCC(CC1=O)CN MCULE-7115920789 [0,1,0,1,0,0|2,0,0]=4 5100 B10R1.176 CN1CC[C@@H](CC1=O)CN MCULE-7105353134 [0,1,0,1,0,0|2,0,0]=4 5101 B10R1.176 CN1CC[C@@H](CC1=O)CN MCULE-8900496569 [0,1,0,1,0,0|2,0,0]=4 5102 B10R1.204 CC(CC1CCC1)C(=O)O MCULE-9404107634 [0,1,0,1,0,0|1,0,0]=3 5103 B10R1.204 C[C@H](NC1CCC1)C(=O)O MCULE-7409631566 [0,1,0,1,0,0|2,0,0]=4 5104 B10R1.204 NC(=O)C(F)CC1CCC1 MCULE-6493382532 [0,1,0,1,0,0|2,0,0]=4 5105 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-3218968630 [0,1,0,1,0,0|1,0,0]=3 5106 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-4504908507 [0,1,0,1,0,0|1,0,0]=3 5107 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-9377321223 [0,1,0,1,0,0|1,0,0]=3 5108 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-1216111783 [0,1,0,1,0,0|1,0,0]=3 5109 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-5390134859 [0,1,0,1,0,0|1,0,0]=3 5110 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-5493935992 [0,1,0,1,0,0|1,0,0]=3 5111 B10R1.204 N[C@H](CC1CCC1)C(=O)O MCULE-3225528393 [0,1,0,1,0,0|1,0,0]=3 5112 B10R1.204 N[C@H](CC1CCC1)C(=O)O MCULE-7473428983 [0,1,0,1,0,0|1,0,0]=3 5113 B10R1.204 O=C(O)C(F)CC1CCC1 MCULE-4701098034 [0,1,0,1,0,0|1,0,0]=3 5114 B10R1.204 O=C(O)[C@H](O)CC1CCC1 MCULE-8975040339 [0,1,0,1,0,0|1,0,0]=3 5115 B10R1.205 CC(OCC1CC1)C(=O)O MCULE-4908101296 [0,1,0,1,0,0|2,0,0]=4 5116 B10R1.291 CC1CCCC1(C)C(=O)O MCULE-3149463709 [0,1,0,1,0,0|1,0,0]=3 5117 B10R1.291 CC1OCCC1(C)C(=O)O MCULE-4774939870 [0,1,0,1,0,0|2,0,0]=4 5118 B10R1.291 CN1CCCC1(C)C(=O)O MCULE-3073966944 [0,1,0,1,0,0|2,0,0]=4 5119 B10R1.291 CN1CCC[C@@]1(C)C(=O)O MCULE-3527940712 [0,1,0,1,0,0|2,0,0]=4 5120 B10R1.291 CN1CCC[C@]1(C)C(=O)O MCULE-2144267845 [0,1,0,1,0,0|2,0,0]=4 5121 B10R1.291 C[C@]1(CCC[C@@H]1N)C(=O)O MCULE-2571628010 [0,1,0,1,0,0|0,0,0]=2 5122 B10R1.291 C[C@]1(CCC[C@@H]1N)C(=O)O MCULE-3056122824 [0,1,0,1,0,0|0,0,0]=2 5123 B10R1.363 CC(=O)C1(CCCCC1)Br MCULE-1087745376 [0,1,0,1,0,0|2,0,0]=4 5124 B10R1.363 CC(=O)C1(CCCCC1)C MCULE-2400194377 [0,1,0,1,0,0|2,0,0]=4 5125 B10R1.363 CC(=O)C1(CCCCC1)N MCULE-2403671270 [0,1,0,1,0,0|2,0,0]=4 5126 B10R1.363 CC(=O)C1(CCCCC1)N MCULE-8220968252 [0,1,0,1,0,0|2,0,0]=4 5127 B10R1.363 CC(=O)C1(CCCCC1)O MCULE-8708554984 [0,1,0,1,0,0|2,0,0]=4 5128 B10R1.363 CC1(C=CCCC1)C(=O)O MCULE-7610148262 [0,1,0,1,0,0|1,0,1]=4 5129 B10R1.363 CC1(CCCCC1)C(=O)Cl MCULE-2304699201 [0,1,0,1,0,0|2,0,0]=4 5130 B10R1.363 CC1(CCCCC1)C(=O)N MCULE-2748976288 [0,1,0,1,0,0|2,0,0]=4 5131 B10R1.363 CC1(CCCCC1)C(=O)O MCULE-8617368211 [0,1,0,1,0,0|1,0,0]=3 5132 B10R1.363 CC1(CCCCN1)C(=O)N MCULE-5510028076 [0,1,0,1,0,0|1,0,0]=3 5133 B10R1.363 CC1(CCCCN1)C(=O)N MCULE-9010382394 [0,1,0,1,0,0|1,0,0]=3 5134 B10R1.363 CC1(CCCCN1)C(=O)O MCULE-4353837718 [0,1,0,1,0,0|0,0,0]=2 5135 B10R1.363 CC1(CCCCN1)C(=O)O MCULE-5823768018 [0,1,0,1,0,0|0,0,0]=2 5136 B10R1.363 CC1(CCCCO1)C(=O)O MCULE-8167039984 [0,1,0,1,0,0|1,0,0]=3 5137 B10R1.363 CC1(CCCNC1)C(=O)O MCULE-1830247756 [0,1,0,1,0,0|2,0,0]=4 5138 B10R1.363 CC1(CCCNC1)C(=O)O MCULE-4554317503 [0,1,0,1,0,0|2,0,0]=4 5139 B10R1.363 CC1(CCCOC1)C(=O)O MCULE-3722771180 [0,1,0,1,0,0|2,0,0]=4 5140 B10R1.363 CC1(CCNCC1)C(=O)O MCULE-5925956345 [0,1,0,1,0,0|2,0,0]=4 5141 B10R1.363 CC1(CCNCC1)C(=O)O MCULE-9595642308 [0,1,0,1,0,0|2,0,0]=4 5142 B10R1.363 CC1(CCOCC1)C(=O)O MCULE-6824729734 [0,1,0,1,0,0|2,0,0]=4 5143 B10R1.363 CC1(CCSCC1)C(=O)O MCULE-4494370785 [0,1,0,1,0,0|2,0,0]=4 5144 B10R1.363 CC1(CNCCO1)C(=O)O MCULE-6864976931 [0,1,0,1,0,0|2,0,0]=4 5145 B10R1.363 CC1(CNCCO1)C(=O)O MCULE-7815848744 [0,1,0,1,0,0|2,0,0]=4 5146 B10R1.363 CC1(COCCN1)C(=O)O MCULE-2577762263 [0,1,0,1,0,0|1,0,0]=3 5147 B10R1.363 CC1(COCCN1)C(=O)O MCULE-4596611063 [0,1,0,1,0,0|1,0,0]=3 5148 B10R1.363 CC1(COCCO1)C(=O)O MCULE-5074851185 [0,1,0,1,0,0|2,0,0]=4 5149 B10R1.363 C[C@@]1(CCCCN1)C(=O)O MCULE-2751244606 [0,1,0,1,0,0|0,0,0]=2 5150 B10R1.363 C[C@@]1(CCCCN1)C(=O)O MCULE-9588562839 [0,1,0,1,0,0|0,0,0]=2 5151 B10R1.363 C[C@@]1(CCCCO1)C(=O)O MCULE-8351337180 [0,1,0,1,0,0|1,0,0]=3 5152 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-2580172241 [0,1,0,1,0,0|2,0,0]=4 5153 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-5735574050 [0,1,0,1,0,0|2,0,0]=4 5154 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-6097682986 [0,1,0,1,0,0|2,0,0]=4 5155 B10R1.363 C[C@@]1(CCCNC1)C(=O)O MCULE-8361078667 [0,1,0,1,0,0|2,0,0]=4 5156 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-2019738412 [0,1,0,1,0,0|0,0,0]=2 5157 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-5663835052 [0,1,0,1,0,0|0,0,0]=2 5158 B10R1.363 C[C@]1(CCCCN1)C(=O)O MCULE-8254704116 [0,1,0,1,0,0|0,0,0]=2 5159 B10R1.363 C[C@]1(CCCCO1)C(=O)O MCULE-1520204390 [0,1,0,1,0,0|1,0,0]=3 5160 B10R1.363 C[C@]1(CCCCO1)C(=O)O MCULE-5357080399 [0,1,0,1,0,0|1,0,0]=3 5161 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-4789999853 [0,1,0,1,0,0|2,0,0]=4 5162 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-5338426663 [0,1,0,1,0,0|2,0,0]=4 5163 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-6021049561 [0,1,0,1,0,0|2,0,0]=4 5164 B10R1.363 C[C@]1(CCCNC1)C(=O)O MCULE-7816386590 [0,1,0,1,0,0|2,0,0]=4 5165 B10R1.363 NC(=O)C1(CCCCC1)N MCULE-9213834644 [0,1,0,1,0,0|2,0,0]=4 5166 B10R1.363 NC(=O)C1(CCCCC1)O MCULE-9953817877 [0,1,0,1,0,0|2,0,0]=4 5167 B10R1.363 NC1(CCCCC1)C(=O)O MCULE-9219404299 [0,1,0,1,0,0|1,0,0]=3 5168 B10R1.363 NC1(CCCOC1)C(=O)O MCULE-7592747043 [0,1,0,1,0,0|2,0,0]=4 5169 B10R1.363 NC1(CCCSC1)C(=O)O MCULE-5875012341 [0,1,0,1,0,0|2,0,0]=4 5170 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-2468722313 [0,1,0,1,0,0|2,0,0]=4 5171 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-4525710147 [0,1,0,1,0,0|2,0,0]=4 5172 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-5856930946 [0,1,0,1,0,0|2,0,0]=4 5173 B10R1.363 NC1(CCNCC1)C(=O)O MCULE-8458518802 [0,1,0,1,0,0|2,0,0]=4 5174 B10R1.363 NC1(CCOCC1)C(=O)O MCULE-8720926076 [0,1,0,1,0,0|2,0,0]=4 5175 B10R1.363 NC1(CCOCC1)C(=O)O MCULE-9032013861 [0,1,0,1,0,0|2,0,0]=4 5176 B10R1.363 NC1(CCSCC1)C(=O)O MCULE-3400288648 [0,1,0,1,0,0|2,0,0]=4 5177 B10R1.363 NC1(CCSCC1)C(=O)O MCULE-7826194478 [0,1,0,1,0,0|2,0,0]=4 5178 B10R1.363 O=C(Cl)C1(CCCCC1)Br MCULE-3943135228 [0,1,0,1,0,0|2,0,0]=4 5179 B10R1.363 O=C(Cl)C1(CCCCC1)Cl MCULE-5594029874 [0,1,0,1,0,0|2,0,0]=4 5180 B10R1.363 O=C(O)C1(CCCCC1)Br MCULE-4457572618 [0,1,0,1,0,0|1,0,0]=3 5181 B10R1.363 O=C(O)C1(CCCCC1)Cl MCULE-9172453010 [0,1,0,1,0,0|1,0,0]=3 5182 B10R1.363 O=C(O)C1(CCCCC1)F MCULE-6566089811 [0,1,0,1,0,0|1,0,0]=3 5183 B10R1.363 O=C(O)C1(CCCCC1)O MCULE-8504861268 [0,1,0,1,0,0|1,0,0]=3 5184 B10R1.363 O=C(O)C1(CCCNC1)O MCULE-4880129058 [0,1,0,1,0,0|2,0,0]=4 5185 B10R1.363 O=C(O)C1(CCCNC1)O MCULE-9960592206 [0,1,0,1,0,0|2,0,0]=4 5186 B10R1.363 O=C(O)C1(CCCOC1)F MCULE-8290066035 [0,1,0,1,0,0|2,0,0]=4 5187 B10R1.363 O=C(O)C1(CCNCC1)F MCULE-1312767997 [0,1,0,1,0,0|2,0,0]=4 5188 B10R1.363 O=C(O)C1(CCNCC1)F MCULE-5915477961 [0,1,0,1,0,0|2,0,0]=4 5189 B10R1.363 O=C(O)C1(CCNCC1)O MCULE-4619147711 [0,1,0,1,0,0|2,0,0]=4 5190 B10R1.363 O=C(O)C1(CCNCC1)O MCULE-6538244346 [0,1,0,1,0,0|2,0,0]=4 5191 B10R1.363 O=C(O)C1(CCOCC1)F MCULE-7783441156 [0,1,0,1,0,0|2,0,0]=4 5192 B10R1.363 O=C(O)C1(CCOCC1)O MCULE-4186201239 [0,1,0,1,0,0|2,0,0]=4 5193 B10R1.363 O=C(O)C1(CCSCC1)O MCULE-8230713014 [0,1,0,1,0,0|2,0,0]=4 5194 B10R1.363 [NH3+]C1(CCCCC1)C(=O)O MCULE-1248384499 [0,1,0,1,0,0|1,0,0]=3 5195 B10R1.59 C=C1C[C@@H]([C@@H](C1)C(=O)O)N MCULE-9822470688 [0,1,0,1,0,0|0,0,1]=3 5196 B10R1.59 CC1CC(C(O1)C(=O)O)C MCULE-6609295709 [0,1,0,1,0,0|2,0,0]=4 5197 B10R1.59 CC1CC(C(O1)C)C(=O)O MCULE-4495071251 [0,1,0,1,0,0|2,0,0]=4 5198 B10R1.59 CC1CC(N(C1)C)C(=O)O MCULE-1544526499 [0,1,0,1,0,0|2,0,0]=4 5199 B10R1.59 CC1CC(N(C1)C)C(=O)O MCULE-4035906246 [0,1,0,1,0,0|2,0,0]=4 5200 B10R1.59 CN1CC(CC1C(=O)O)N MCULE-7362090633 [0,1,0,1,0,0|2,0,0]=4 5201 B10R1.59 CN1CC(CC1C(=O)O)O MCULE-6963505872 [0,1,0,1,0,0|2,0,0]=4 5202 B10R1.59 CN1C[C@@H](C[C@@H]1C(=O)O)O MCULE-7645006550 [0,1,0,1,0,0|2,0,0]=4 5203 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)F MCULE-1701571164 [0,1,0,1,0,0|2,0,0]=4 5204 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)F MCULE-3801669792 [0,1,0,1,0,0|2,0,0]=4 5205 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)O MCULE-4289101461 [0,1,0,1,0,0|2,0,0]=4 5206 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)O MCULE-5652344615 [0,1,0,1,0,0|2,0,0]=4 5207 B10R1.59 CN1C[C@H](C[C@@H]1C(=O)O)O MCULE-4231676044 [0,1,0,1,0,0|2,0,0]=4 5208 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)N MCULE-7565756526 [0,1,0,1,0,0|2,0,0]=4 5209 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)N MCULE-8931908939 [0,1,0,1,0,0|2,0,0]=4 5210 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)O MCULE-2551559641 [0,1,0,1,0,0|2,0,0]=4 5211 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)O MCULE-4981449681 [0,1,0,1,0,0|2,0,0]=4 5212 B10R1.59 C[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-3249388528 [0,1,0,1,0,0|2,0,0]=4 5213 B10R1.59 C[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-5892295670 [0,1,0,1,0,0|2,0,0]=4 5214 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1379494499 [0,1,0,1,0,0|2,0,0]=4 5215 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1502363575 [0,1,0,1,0,0|2,0,0]=4 5216 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1565262465 [0,1,0,1,0,0|2,0,0]=4 5217 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-4515635703 [0,1,0,1,0,0|2,0,0]=4 5218 B10R1.59 [C@H]1(C[C@H](CN1C)C)C(=O)O MCULE-6457651208 [0,1,0,1,0,0|2,0,0]=4 5219 B10R1.82 CC1CC(C1)CCC(=O)O MCULE-4964737509 [0,1,0,1,0,0|1,0,0]=3 5220 B10R1.82 O=C(O)CCC1CC(=O)C1 MCULE-8509527472 [0,1,0,1,0,0|1,0,1]=4 5221 B10R1.211 O=C(O)CCC(=O)C1CC1 MCULE-1941504047 [0,1,0,1,0,0|1,0,1]=4 5222 B10R1.353 CC1(CCC1)OCC(=O)O MCULE-2400973002 [0,1,0,1,0,0|2,0,0]=4 5223 B10R1.353 O=C(O)CCC1(CCC1)O MCULE-3689946882 [0,1,0,1,0,0|1,0,0]=3 5224 B10R1.353 O=C([O-])CCC1(CCC1)O MCULE-6907877071 [0,1,0,1,0,0|1,0,1]=4 5225 B10R1.128 CC1(CCCC1C(=O)O)C MCULE-4580682391 [0,1,0,1,0,0|1,0,0]=3 5226 B10R1.128 CC1(CCCC1C(=O)O)N MCULE-6959799055 [0,1,0,1,0,0|0,0,0]=2 5227 B10R1.128 CC1(CCCC1C(=O)O)N MCULE-7529713765 [0,1,0,1,0,0|0,0,0]=2 5228 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-4368125699 [0,1,0,1,0,0|2,0,0]=4 5229 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-9548940162 [0,1,0,1,0,0|2,0,0]=4 5230 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9288829524 [0,1,0,1,0,0|2,0,0]=4 5231 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9565122593 [0,1,0,1,0,0|2,0,0]=4 5232 B10R1.128 CC1(CNCC1C(=O)O)C MCULE-3386370307 [0,1,0,1,0,0|2,0,0]=4 5233 B10R1.128 CC1(CNCC1C(=O)O)C MCULE-6121405177 [0,1,0,1,0,0|2,0,0]=4 5234 B10R1.128 CC1(CNC[C@@H]1C(=O)O)C MCULE-2007377437 [0,1,0,1,0,0|2,0,0]=4 5235 B10R1.128 CC1(CNC[C@@H]1C(=O)O)C MCULE-2184930829 [0,1,0,1,0,0|2,0,0]=4 5236 B10R1.128 CC1(CNC[C@H]1C(=O)O)C MCULE-1263349937 [0,1,0,1,0,0|2,0,0]=4 5237 B10R1.128 CC1(CNC[C@H]1C(=O)O)C MCULE-7547643584 [0,1,0,1,0,0|2,0,0]=4 5238 B10R1.128 CC1(OCCC1C(=O)O)C MCULE-4433776174 [0,1,0,1,0,0|2,0,0]=4 5239 B10R1.128 C[C@]1(CCC[C@@H]1C(=O)O)N MCULE-2638855066 [0,1,0,1,0,0|0,0,0]=2 5240 B10R1.128 C[C@]1(CCC[C@@H]1C(=O)O)N MCULE-7472901526 [0,1,0,1,0,0|0,0,0]=2 5241 B10R1.128 C[N+]1(CCCC1C(=O)O)C MCULE-4111590223 [0,1,0,1,0,0|2,0,0]=4 5242 B10R1.128 C[N+]1(CCC[C@H]1C(=O)O)C MCULE-8126384491 [0,1,0,1,0,0|2,0,0]=4 5243 B10R1.128 O=C(O)C1CCCC1(F)F MCULE-3687597013 [0,1,0,1,0,0|1,0,0]=3 5244 B10R1.128 O=C(O)C1CCCS1(=O)=O MCULE-6333477940 [0,1,0,1,0,0|2,0,0]=4 5245 B10R1.128 O=C(O)C1CNCC1(F)F MCULE-2270064252 [0,1,0,1,0,0|2,0,0]=4 5246 B10R1.128 O=C(O)C1CNCC1(F)F MCULE-2781860407 [0,1,0,1,0,0|2,0,0]=4 5247 B10R1.128 O=C(O)C1NCCC1(F)F MCULE-2455048138 [0,1,0,1,0,0|2,0,0]=4 5248 B10R1.128 O=C(O)C1NCCC1(F)F MCULE-9521153177 [0,1,0,1,0,0|2,0,0]=4 5249 B10R1.128 O=C(O)C1OCCC1(F)F MCULE-1033630667 [0,1,0,1,0,0|2,0,0]=4 5250 B10R1.128 O=C(O)[C@@H]1OCCC1(F)F MCULE-3394730004 [0,1,0,1,0,0|2,0,0]=4 5251 B10R1.128 O=C(O)[C@H]1OCCC1(F)F MCULE-2296740232 [0,1,0,1,0,0|2,0,0]=4 5252 B10R1.352 CC(=O)CCC1CC1(Cl)Cl MCULE-1315696810 [0,1,0,1,0,0|2,0,0]=4 5253 B10R1.352 CC1(CC1CCC(=O)O)C MCULE-6164876776 [0,1,0,1,0,0|1,0,0]=3 5254 B10R1.352 O=C(O)CCC1CC1(Cl)Cl MCULE-9473215932 [0,1,0,1,0,0|1,0,0]=3 5255 B10R1.352 O=C(O)CCC1CC1(F)F MCULE-8332200330 [0,1,0,1,0,0|1,0,0]=3 5256 B10R1.361 C1(CCN1C(C)C)C(=O)O MCULE-2301490448 [0,1,0,1,0,0|2,0,0]=4 5257 B10R1.361 CC(C)N1CCC1C(=O)O MCULE-3327703206 [0,1,0,1,0,0|2,0,0]=4 5258 B10R1.361 CC(C)N1CC[C@H]1C(=O)O MCULE-1726046033 [0,1,0,1,0,0|2,0,0]=4 5259 B10R1.361 CC(C)N1CC[C@H]1C(=O)O MCULE-3879944736 [0,1,0,1,0,0|2,0,0]=4 5260 B10R1.361 NC(=O)C1CCC1C(=O)O MCULE-3903818494 [0,1,0,1,0,0|0,0,1]=3 5261 B10R1.361 NC(=O)[C@H]1CC[C@H]1C(=O)N MCULE-7732298882 [0,1,0,1,0,0|1,0,1]=4 5262 B10R1.361 O=C(O)C1CCC1C(=O)O MCULE-6136792366 [0,1,0,1,0,0|1,0,1]=4 5263 B10R1.361 O=C(O)[C@@H]1CC[C@H]1C(=O)O MCULE-2743190923 [0,1,0,1,0,0|1,0,1]=4 5264 B10R1.361 O=C(O)[C@@H]1CC[C@H]1C(=O)O MCULE-6841335407 [0,1,0,1,0,0|1,0,1]=4 5265 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O MCULE-3432000151 [0,1,0,1,0,0|1,0,1]=4 5266 B10R1.361 O=C(O)[C@H]1CC[C@@H]1C(=O)O MCULE-6937334278 [0,1,0,1,0,0|1,0,1]=4 5267 B10R1.361 O=C(O)[C@H]1CC[C@H]1C(=O)O MCULE-8609403409 [0,1,0,1,0,0|1,0,1]=4 5268 B10R1.361 [C@@H]1(CC[C@@H]1C(=O)O)C(=O)O MCULE-4637916300 [0,1,0,1,0,0|1,0,1]=4 5269 B10R1.368 CC(C)C[C@@H]1C[C@H]1C(=O)O MCULE-7367162008 [0,1,0,1,0,0|1,0,0]=3 5270 B10R2.61 O=C1CC2CCCC1C2 MCULE-9902349455 [0,0,0,2,0,0|2,0,0]=4 5271 B10R2.61 O=C1NC2CCCC1C2 MCULE-9859470381 [0,0,0,2,0,0|2,0,0]=4 5272 B10R2.61 O=C1NC2CCNC1C2 MCULE-4221823714 [0,0,0,2,0,0|1,0,0]=3 5273 B10R2.61 O=C1N[C@H]2CCC[C@@H]1C2 MCULE-2498857906 [0,0,0,2,0,0|2,0,0]=4 5274 B10R2.61 O=C1OC2CCNC1C2 MCULE-8392788767 [0,0,0,2,0,0|0,0,0]=2 5275 B10R2.61 O=C1OC2CCOC1C2 MCULE-4977323499 [0,0,0,2,0,0|1,0,0]=3 5276 B10R2.61 OC1CC2CCCC1N2 MCULE-3954082989 [0,0,0,2,0,0|1,0,1]=4 5277 B10R2.61 OC1CC2CCCC1N2 MCULE-7079809262 [0,0,0,2,0,0|1,0,1]=4 5278 B10R2.61 O[C@@H]1C[C@H]2CCC[C@@H]1N2 MCULE-2552895453 [0,0,0,2,0,0|1,0,1]=4 5279 B10R2.61 O[C@@H]1C[C@H]2CCC[C@@H]1N2 MCULE-4250815389 [0,0,0,2,0,0|1,0,1]=4 5280 B10R2.61 O[C@H]1C[C@H]2CCC[C@@H]1N2 MCULE-2822355852 [0,0,0,2,0,0|1,0,1]=4 5281 B10R2.61 O[C@H]1C[C@H]2CCC[C@@H]1N2 MCULE-4302363856 [0,0,0,2,0,0|1,0,1]=4 5282 B10R2.61 [C@@H]12CCC[C@@H](N1)C[C@@H]2O MCULE-1866289078 [0,0,0,2,0,0|1,0,1]=4 5283 B10R2.61 [C@@H]12CCC[C@@H](N1)C[C@@H]2O MCULE-9478811687 [0,0,0,2,0,0|1,0,1]=4 5284 B10R2.61 [C@@H]12CCC[C@@H](N1)C[C@H]2O MCULE-8012690560 [0,0,0,2,0,0|1,0,1]=4 5285 B10R2.61 [C@@H]12CCC[C@@H](N1)C[C@H]2O MCULE-8087701413 [0,0,0,2,0,0|1,0,1]=4 5286 B10R2.61 [C@H]12CCC[C@H](C1)C(=O)N2 MCULE-6927488861 [0,0,0,2,0,0|2,0,0]=4 5287 B10R2.62 C12CCC(CC1)C(=O)C2 MCULE-8282529338 [0,0,0,2,0,0|2,0,0]=4 5288 B10R2.62 C12CCC(CC1)C(=O)O2 MCULE-4611258343 [0,0,0,2,0,0|1,0,0]=3 5289 B10R2.62 O=C1CC2CCC1CC2 MCULE-8331389597 [0,0,0,2,0,0|2,0,0]=4 5290 B10R2.62 O=C1NC2CCC1CC2 MCULE-1572331637 [0,0,0,2,0,0|2,0,0]=4 5291 B10R2.62 O=C1OC2CCC1CC2 MCULE-7150392682 [0,0,0,2,0,0|1,0,0]=3 5292 B10R2.62 OC1CC2CCC1NC2 MCULE-1285981370 [0,0,0,2,0,0|1,0,1]=4 5293 B10R2.62 OC1CC2CCC1NC2 MCULE-1510372436 [0,0,0,2,0,0|1,0,1]=4 5294 B10R2.71 C=C1CC2CCC(C1)N2 MCULE-2186810171 [0,0,0,2,0,0|2,0,0]=4 5295 B10R2.71 C=C1CC2CCC(C1)N2 MCULE-8231278845 [0,0,0,2,0,0|2,0,0]=4 5296 B10R2.71 NC1CC2CCC(C1)O2 MCULE-4457544306 [0,0,0,2,0,0|1,0,1]=4 5297 B10R2.71 NC1CC2CCC(C1)O2 MCULE-9929281022 [0,0,0,2,0,0|1,0,1]=4 5298 B10R2.71 N[C@@H]1C[C@@H]2CC[C@H](C1)O2 MCULE-3383622461 [0,0,0,2,0,0|1,0,1]=4 5299 B10R2.71 O=C1CC2CCC(C1)C2 MCULE-7387433305 [0,0,0,2,0,0|2,0,0]=4 5300 B10R2.71 O=C1CC2CCC(C1)N2 MCULE-2112708434 [0,0,0,2,0,0|1,0,0]=3 5301 B10R2.71 O=C1CC2CCC(C1)N2 MCULE-8795004919 [0,0,0,2,0,0|1,0,0]=3 5302 B10R2.71 O=C1CC2CCC(C1)O2 MCULE-1445667771 [0,0,0,2,0,0|2,0,0]=4 5303 B10R2.71 O=C1CC2CCC(C1)S2 MCULE-6020280495 [0,0,0,2,0,0|2,0,0]=4 5304 B10R2.71 O=C1C[C@@H]2CC[C@H](C1)N2 MCULE-5358522556 [0,0,0,2,0,0|1,0,0]=3 5305 B10R2.71 OC1CC2CCC(C1)N2 MCULE-1984182265 [0,0,0,2,0,0|1,0,1]=4 5306 B10R2.71 OC1CC2CCC(C1)N2 MCULE-8723724278 [0,0,0,2,0,0|1,0,1]=4 5307 B10R2.71 OC1CC2CNC(C1)C2 MCULE-7235392219 [0,0,0,2,0,0|1,0,1]=4 5308 B10R2.71 O[C@@H]1C[C@@H]2CC[C@H](C1)N2 MCULE-5739413050 [0,0,0,2,0,0|1,0,1]=4 5309 B10R2.71 O[C@@H]1C[C@@H]2CC[C@H](C1)N2 MCULE-7201642986 [0,0,0,2,0,0|1,0,1]=4 5310 B10R2.71 [C@@H]1(C[C@@H]2CC[C@H](C1)N2)O MCULE-1257362100 [0,0,0,2,0,0|1,0,1]=4 5311 B10R2.71 [C@@H]1(C[C@@H]2CC[C@H](C1)N2)O MCULE-6641612222 [0,0,0,2,0,0|1,0,1]=4 5312 B10R2.71 [C@@H]12CC[C@@H](N1)CC(=O)C2 MCULE-2967790803 [0,0,0,2,0,0|1,0,0]=3 5313 B10R2.71 [C@@H]12CC[C@@H](N1)CC(=O)C2 MCULE-9821654462 [0,0,0,2,0,0|1,0,0]=3 5314 B10R2.71 [C@@H]12CC[C@@H](O1)C[C@@H](C2)N MCULE-2499502135 [0,0,0,2,0,0|1,0,1]=4 5315 B10R2.71 [C@@H]12CC[C@@H](O1)C[C@H](C2)N MCULE-4965442507 [0,0,0,2,0,0|1,0,1]=4 5316 B10R2.71 [C@@H]12CC[C@@H](O1)C[C@H](C2)N MCULE-9924603903 [0,0,0,2,0,0|1,0,1]=4 5317 B10R2.99 NCC1CC2CCC1O2 MCULE-8924760145 [0,0,0,2,0,0|1,0,1]=4 5318 B10R2.99 NC[C@@H]1C[C@@H]2CC[C@H]1O2 MCULE-7277701440 [0,0,0,2,0,0|1,0,1]=4 5319 B10R2.99 NC[C@H]1C[C@@H]2CC[C@H]1O2 MCULE-8597812107 [0,0,0,2,0,0|1,0,1]=4 5320 B10R2.99 [C@@H]12CC[C@@H](O1)C(C2)CN MCULE-9909873398 [0,0,0,2,0,0|1,0,1]=4 5321 B10R2.408 C1CC2CNCC(C1)O2 MCULE-6150799471 [0,0,0,2,0,0|1,0,1]=4 5322 B10R2.408 C1CC2CNCC(C1)O2 MCULE-6878487900 [0,0,0,2,0,0|1,0,1]=4 5323 B10R2.534 O=C1CCCC2(C1)CC2 MCULE-4819962384 [0,0,0,2,0,0|2,0,0]=4 5324 B10R2.534 O=C1CCCC2(N1)CC2 MCULE-3728161144 [0,0,0,2,0,0|2,0,0]=4 5325 B10R2.320 O=C1CC2C1CCCC2 MCULE-8899093243 [0,0,0,2,0,0|2,0,0]=4 5326 B10R2.320 O=C1NC2C1CCCC2 MCULE-4769358198 [0,0,0,2,0,0|2,0,0]=4 5327 B10R2.344 O=C(O)C12CC1CCN2 MCULE-8958769379 [0,0,0,2,0,0|0,0,0]=2 5328 B10R2.344 O=C(O)C12CC1CCN2 MCULE-9918894627 [0,0,0,2,0,0|0,0,0]=2 5329 B10R2.344 O=C(O)C12CCCC1C2 MCULE-1433395114 [0,0,0,2,0,0|1,0,0]=3 5330 B10R2.344 O=C(O)C12CCNC1C2 MCULE-4622558327 [0,0,0,2,0,0|2,0,0]=4 5331 B10R2.344 O=C(O)C12CCNC1C2 MCULE-5876870827 [0,0,0,2,0,0|2,0,0]=4 5332 B10R2.344 O=C(O)C12CNCC1C2 MCULE-1023234959 [0,0,0,2,0,0|2,0,0]=4 5333 B10R2.344 O=C(O)C12CNCC1C2 MCULE-2698470641 [0,0,0,2,0,0|2,0,0]=4 5334 B10R2.344 O=C(O)C12COCC1C2 MCULE-4962599130 [0,0,0,2,0,0|2,0,0]=4 5335 B10R2.344 O=C(O)[C@@]12CC1CCN2 MCULE-8361805191 [0,0,0,2,0,0|0,0,0]=2 5336 B10R2.344 O=C(O)[C@@]12CC1CCN2 MCULE-9298532680 [0,0,0,2,0,0|0,0,0]=2 5337 B10R2.344 O=C(O)[C@@]12COC[C@@H]1C2 MCULE-5335382694 [0,0,0,2,0,0|2,0,0]=4 5338 B10R2.344 O=C(O)[C@@]12COC[C@@H]1C2 MCULE-6955865926 [0,0,0,2,0,0|2,0,0]=4 5339 B10R2.344 O=C(O)[C@]12COCC1C2 MCULE-6646373866 [0,0,0,2,0,0|2,0,0]=4 5340 B10R2.344 [C@@H]12COC[C@@]1(C2)C(=O)O MCULE-1926490936 [0,0,0,2,0,0|2,0,0]=4 5341 B10R2.344 [C@@H]12COC[C@@]1(C2)C(=O)O MCULE-4045090245 [0,0,0,2,0,0|2,0,0]=4 5342 B10R2.351 O=C(O)C1C2C1CCC2 MCULE-5457069948 [0,0,0,2,0,0|1,0,0]=3 5343 B10R2.351 O=C(O)C1C2C1CNC2 MCULE-2636221459 [0,0,0,2,0,0|2,0,0]=4 5344 B10R2.351 O=C(O)C1C2C1CNC2 MCULE-6853944528 [0,0,0,2,0,0|2,0,0]=4 5345 B10R2.351 O=C(O)C1C2C1COC2 MCULE-7410101644 [0,0,0,2,0,0|2,0,0]=4 5346 B10R2.351 O=C(O)C1C2C1OCC2 MCULE-7995568672 [0,0,0,2,0,0|1,0,0]=3 5347 B10R2.351 O=C(O)[C@@H]1[C@@H]2[C@H]1CNC2 MCULE-4336908718 [0,0,0,2,0,0|2,0,0]=4 5348 B10R2.351 O=C(O)[C@@H]1[C@@H]2[C@H]1COC2 MCULE-2602641452 [0,0,0,2,0,0|2,0,0]=4 5349 B10R2.351 O=C(O)[C@H]1[C@@H]2[C@H]1CNC2 MCULE-3047485005 [0,0,0,2,0,0|2,0,0]=4 5350 B10R2.351 O=C(O)[C@H]1[C@@H]2[C@H]1CNC2 MCULE-7215981155 [0,0,0,2,0,0|2,0,0]=4 5351 B10R2.351 [C@@H]12CNC[C@@H]1[C@H]2C(=O)O MCULE-8121766639 [0,0,0,2,0,0|2,0,0]=4 5352 B10R2.351 [C@H]12COC[C@H]1[C@H]2C(=O)O MCULE-2561176480 [0,0,0,2,0,0|2,0,0]=4 5353 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-8087821545 [0,0,0,2,0,0|0,0,0]=2 5354 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-9943749675 [0,0,0,2,0,0|0,0,0]=2 5355 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-3741942930 [0,0,0,2,0,0|0,0,0]=2 5356 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-8099098772 [0,0,0,2,0,0|0,0,0]=2 5357 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-6549710478 [0,0,0,2,0,0|0,0,0]=2 5358 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-7349536483 [0,0,0,2,0,0|0,0,0]=2 5359 B10R2.355 O=C(O)[C@H]1NC[C@@H]2[C@H]1C2 MCULE-1865131686 [0,0,0,2,0,0|0,0,0]=2 5360 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-3923610209 [0,0,0,2,0,0|0,0,0]=2 5361 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-6551780838 [0,0,0,2,0,0|0,0,0]=2 5362 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-9694754423 [0,0,0,2,0,0|0,0,0]=2 5363 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-4493728887 [0,0,0,2,0,0|0,0,0]=2 5364 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8766409370 [0,0,0,2,0,0|0,0,0]=2 5365 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8840539566 [0,0,0,2,0,0|0,0,0]=2 5366 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-1970630066 [0,0,0,2,0,0|0,0,0]=2 5367 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-7946950016 [0,0,0,2,0,0|0,0,0]=2 5368 B10R2.355 [C@H]12C[C@H]1CN[C@@H]2C(=O)O MCULE-9408302039 [0,0,0,2,0,0|0,0,0]=2 5369 B10R2.355 [C@H]12C[C@H]1CN[C@H]2C(=O)O MCULE-4802776373 [0,0,0,2,0,0|0,0,0]=2 5370 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-4859115894 [0,0,0,2,0,0|1,0,0]=3 5371 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-7323043594 [0,0,0,2,0,0|1,0,0]=3 5372 B10R2.357 C12CC(NC1C2)C(=O)N MCULE-7946144059 [0,0,0,2,0,0|1,0,0]=3 5373 B10R2.357 O=C(O)C1CC2CC2C1 MCULE-9890442572 [0,0,0,2,0,0|1,0,0]=3 5374 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-4212410891 [0,0,0,2,0,0|0,0,0]=2 5375 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-5642169472 [0,0,0,2,0,0|0,0,0]=2 5376 B10R2.357 O=C(O)C1CC2CC2N1 MCULE-6526449280 [0,0,0,2,0,0|0,0,0]=2 5377 B10R2.357 O=C(O)C1CC2OC2C1 MCULE-1665894100 [0,0,0,2,0,0|2,0,0]=4 5378 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 MCULE-8901519673 [0,0,0,2,0,0|0,0,0]=2 5379 B10R2.357 O=C(O)[C@@H]1C[C@@H]2C[C@@H]2N1 MCULE-8974728452 [0,0,0,2,0,0|0,0,0]=2 5380 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-2251552616 [0,0,0,2,0,0|0,0,0]=2 5381 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-3670081653 [0,0,0,2,0,0|0,0,0]=2 5382 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-4127413852 [0,0,0,2,0,0|0,0,0]=2 5383 B10R2.357 O=C(O)[C@@H]1C[C@H]2C[C@H]2N1 MCULE-5543837378 [0,0,0,2,0,0|0,0,0]=2 5384 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-2699537727 [0,0,0,2,0,0|0,0,0]=2 5385 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-2957583599 [0,0,0,2,0,0|0,0,0]=2 5386 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-8019742930 [0,0,0,2,0,0|0,0,0]=2 5387 B10R2.357 [C@@H]12C[C@@H](N[C@@H]1C2)C(=O)O MCULE-9906255485 [0,0,0,2,0,0|0,0,0]=2 5388 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-1783881546 [0,0,0,2,0,0|1,0,0]=3 5389 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-2191940678 [0,0,0,2,0,0|1,0,0]=3 5390 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-3269432034 [0,0,0,2,0,0|1,0,0]=3 5391 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-4463912241 [0,0,0,2,0,0|1,0,0]=3 5392 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-6809518361 [0,0,0,2,0,0|1,0,0]=3 5393 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-6941150528 [0,0,0,2,0,0|1,0,0]=3 5394 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-9444667290 [0,0,0,2,0,0|1,0,0]=3 5395 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)N MCULE-9739462821 [0,0,0,2,0,0|1,0,0]=3 5396 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-3004356941 [0,0,0,2,0,0|0,0,0]=2 5397 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-7104749205 [0,0,0,2,0,0|0,0,0]=2 5398 B10R2.357 [C@H]12C[C@H]1C[C@H](N2)C(=O)O MCULE-9522199577 [0,0,0,2,0,0|0,0,0]=2 5399 B10R2.2 O=C1CC2C=CCC2O1 MCULE-5417858498 [0,0,0,2,0,0|1,0,1]=4 5400 B10R2.2 O=C1CC2NCCC2N1 MCULE-2516258983 [0,0,0,2,0,0|1,0,0]=3 5401 B10R2.2 O=C1CC2NCCC2N1 MCULE-4812066577 [0,0,0,2,0,0|1,0,0]=3 5402 B10R2.2 O=C1NC2CCCC2O1 MCULE-1083402024 [0,0,0,2,0,0|2,0,0]=4 5403 B10R2.2 [C@@H]12CCC=C1CC(=O)O2 MCULE-9594804536 [0,0,0,2,0,0|1,0,1]=4 5404 B10R2.2 [C@@H]12CCC[C@@H]1NC(=O)C2 MCULE-5874650388 [0,0,0,2,0,0|2,0,0]=4 5405 B10R2.2 [C@H]12CC(=O)N[C@H]1CCN2 MCULE-1007187560 [0,0,0,2,0,0|1,0,0]=3 5406 B10R2.2 [C@H]12CC(=O)N[C@H]1CCN2 MCULE-8278160952 [0,0,0,2,0,0|1,0,0]=3 5407 B10R2.2 [C@H]12CC=C[C@H]1CC(=O)O2 MCULE-4514192918 [0,0,0,2,0,0|1,0,1]=4 5408 B10R2.2 [C@H]12CC=C[C@H]1CC(=O)O2 MCULE-6824565850 [0,0,0,2,0,0|1,0,1]=4 5409 B10R2.14 O=C1CCC(C1)C2CC2 MCULE-1709197682 [0,0,0,2,0,0|2,0,0]=4 5410 B10R2.32 C12CCNC1C(=O)NC2 MCULE-9691167616 [0,0,0,2,0,0|2,0,0]=4 5411 B10R2.32 O=C1CCC2C1CCC2 MCULE-7663799084 [0,0,0,2,0,0|2,0,0]=4 5412 B10R2.32 O=C1CCC2N1CCC2 MCULE-2278509511 [0,0,0,2,0,0|2,0,0]=4 5413 B10R2.32 O=C1OCC2C1CCC2 MCULE-1680539728 [0,0,0,2,0,0|1,0,0]=3 5414 B10R2.32 O[C@@H]1CC[C@@H]2[C@H]1NCC2 MCULE-5080250769 [0,0,0,2,0,0|1,0,1]=4 5415 B10R2.32 O[C@@H]1CC[C@@H]2[C@H]1NCC2 MCULE-7790238150 [0,0,0,2,0,0|1,0,1]=4 5416 B10R2.32 [C@@H]12CCN[C@@H]1C(=O)NC2 MCULE-6925376025 [0,0,0,2,0,0|2,0,0]=4 5417 B10R2.32 [C@H]12CCC[C@H]1C(=O)OC2 MCULE-7791113994 [0,0,0,2,0,0|1,0,0]=3 5418 B10R2.32 [C@H]12CCN[C@H]1C(=O)NC2 MCULE-5094345573 [0,0,0,2,0,0|2,0,0]=4 5419 B10R2.32 [C@H]12CCN[C@H]1C(=O)NC2 MCULE-5128140663 [0,0,0,2,0,0|2,0,0]=4 5420 B10R2.63 NC1CC2CC(C1C2)O MCULE-3175801783 [0,0,0,2,0,0|1,0,1]=4 5421 B10R2.63 NC1CC2CC(C1C2)O MCULE-4511947514 [0,0,0,2,0,0|1,0,1]=4 5422 B10R2.138 C1CC2CCC(O2)CN1 MCULE-5862819983 [0,0,0,2,0,0|1,0,1]=4 5423 B10R2.138 C1CC2CCC(O2)CN1 MCULE-9819700345 [0,0,0,2,0,0|1,0,1]=4 5424 B10R2.332 O=C1CCC2(C1)CCC2 MCULE-9361787932 [0,0,0,2,0,0|2,0,0]=4 5425 B10R2.332 O=C1CCC2(N1)CCC2 MCULE-1454490432 [0,0,0,2,0,0|2,0,0]=4 5426 B10R2.332 O=C1NCC2(O1)CCC2 MCULE-8605215026 [0,0,0,2,0,0|2,0,0]=4 5427 B10R2.316 O=C1CC2(C1)CCCC2 MCULE-7565643889 [0,0,0,2,0,0|2,0,0]=4 5428 B10R2.316 O=C1CC2(N1)CCCC2 MCULE-3716375013 [0,0,0,2,0,0|2,0,0]=4 5429 B10R2.337 O=C1CC(C1)C2CCC2 MCULE-8010144390 [0,0,0,2,0,0|2,0,0]=4 5430 B10R2.28 O=S1(=O)CC2CC1CN2 MCULE-1631937348 [0,0,0,2,0,0|1,0,1]=4 5431 B10R2.28 O=S1(=O)CC2CC1CN2 MCULE-8874375783 [0,0,0,2,0,0|1,0,1]=4 5432 B10R2.28 O=S1(=O)C[C@@H]2C[C@H]1CN2 MCULE-1991930440 [0,0,0,2,0,0|1,0,1]=4 5433 B10R2.28 O=S1(=O)C[C@@H]2C[C@H]1CN2 MCULE-5009531096 [0,0,0,2,0,0|1,0,1]=4 5434 B10R2.28 [C@@H]12C[C@@H](CN1)S(=O)(=O)C2 MCULE-3573221494 [0,0,0,2,0,0|1,0,1]=4 5435 B10R2.28 [C@@H]12C[C@@H](CN1)S(=O)(=O)C2 MCULE-9007865535 [0,0,0,2,0,0|1,0,1]=4 5436 B10R2.28 [C@H]12C[C@H](CN1)S(=O)(=O)C2 MCULE-2288550546 [0,0,0,2,0,0|1,0,1]=4 5437 B10R2.28 [C@H]12C[C@H](CN1)S(=O)(=O)C2 MCULE-6792523380 [0,0,0,2,0,0|1,0,1]=4 5438 B10R2.28 [C@H]12C[C@H](CN1)S(=O)(=O)C2 MCULE-8075523083 [0,0,0,2,0,0|1,0,1]=4 5439 B10R2.28 [C@H]12C[C@H](CN1)S(=O)(=O)C2 MCULE-8803542882 [0,0,0,2,0,0|1,0,1]=4 5440 B10R2.69 OC1CNCC2CC2C1 MCULE-2305349861 [0,0,0,2,0,0|1,0,1]=4 5441 B10R2.117 CC12CCCC1C(=O)N2 MCULE-9281165627 [0,0,0,2,0,0|2,0,0]=4 5442 B10R2.177 CC12CC(=O)CCC1C2 MCULE-5784409358 [0,0,0,2,0,0|2,0,0]=4 5443 B10R2.42 O=C1OC(=O)C2C1CC2 MCULE-9570381244 [0,0,0,2,0,0|1,0,1]=4 5444 B10R2.42 O=C1OC(=O)[C@H]2[C@@H]1CC2 MCULE-7330334348 [0,0,0,2,0,0|1,0,1]=4 5445 B10R2.633 O=C(O)C1CC1C2CC2 MCULE-6848931753 [0,0,0,2,0,0|1,0,0]=3 5446 B10R2.633 O=C(O)[C@H]1C[C@@H]1C2CC2 MCULE-1673827734 [0,0,0,2,0,0|1,0,0]=3 5447 B10R2.638 O=C(O)C1CC12CCC2 MCULE-5122422025 [0,0,0,2,0,0|1,0,0]=3 5448 B10R2.638 O=C(O)C1CC12COC2 MCULE-3616837602 [0,0,0,2,0,0|2,0,0]=4 5449 B10R2.638 O=C(O)[C@H]1CC12CCC2 MCULE-6436884704 [0,0,0,2,0,0|1,0,0]=3 5450 B10R2.358 O=C(O)C1CCC12CC2 MCULE-5575310904 [0,0,0,2,0,0|1,0,0]=3