0 B6R0.4 C#CCCC(=O)C MCULE-8723638688 [0,0,0,0,0,0|1,0,2]=3 1 B6R0.4 C#CCCC(=O)Cl MCULE-5720262741 [0,0,0,0,0,0|2,0,2]=4 2 B6R0.4 C#CCCC(=O)N MCULE-4490482235 [0,0,0,0,0,0|2,0,2]=4 3 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [0,0,0,0,0,0|2,0,2]=4 4 B6R0.4 C#CCCC(=O)[O-] MCULE-2972869840 [0,0,0,0,0,0|2,0,2]=4 5 B6R0.4 C#CCNC(=O)C MCULE-1159984782 [0,0,0,0,0,0|1,0,2]=3 6 B6R0.4 C#CCNC(=O)N MCULE-4499144419 [0,0,0,0,0,0|2,0,2]=4 7 B6R0.4 C#CCOC(=O)C MCULE-5002994323 [0,0,0,0,0,0|0,0,2]=2 8 B6R0.4 C#CCOC(=O)Cl MCULE-5453166266 [0,0,0,0,0,0|1,0,2]=3 9 B6R0.4 C#CCOC(=O)N MCULE-9698208346 [0,0,0,0,0,0|1,0,2]=3 10 B6R0.4 C#CCOC(C)C MCULE-3111253071 [0,0,0,0,0,0|1,0,3]=4 11 B6R0.4 C/C=C/CC(=O)Cl MCULE-5377125313 [0,0,0,0,0,0|2,0,2]=4 12 B6R0.4 C/C=C/CC(=O)N MCULE-1942934157 [0,0,0,0,0,0|2,0,2]=4 13 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [0,0,0,0,0,0|2,0,2]=4 14 B6R0.4 C/C=N/NC(=O)N MCULE-5855402964 [0,0,0,0,0,0|3,0,1]=4 15 B6R0.4 C=C(C)CCC#N MCULE-9953519474 [0,0,0,0,0,0|3,0,1]=4 16 B6R0.4 C=C(C)CCCBr MCULE-5063918467 [0,0,0,0,0,0|3,0,0]=3 17 B6R0.4 C=C(C)CCCC MCULE-1010177756 [0,0,0,0,0,0|2,0,0]=2 18 B6R0.4 C=C(C)CCCO MCULE-4629274490 [0,0,0,0,0,0|3,0,0]=3 19 B6R0.4 C=C(C)CNCC MCULE-2237759977 [0,0,0,0,0,0|3,0,0]=3 20 B6R0.4 C=C(Cl)CCCCl MCULE-5713882356 [0,0,0,0,0,0|3,0,1]=4 21 B6R0.4 C=C(F)CCCO MCULE-1688645687 [0,0,0,0,0,0|3,0,1]=4 22 B6R0.4 C=CCCC(=C)C MCULE-2323382963 [0,0,0,0,0,0|2,0,2]=4 23 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [0,0,0,0,0,0|1,0,2]=3 24 B6R0.4 C=CCCC(=O)Cl MCULE-7378353157 [0,0,0,0,0,0|2,0,2]=4 25 B6R0.4 C=CCCC(=O)N MCULE-7202462484 [0,0,0,0,0,0|2,0,2]=4 26 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [0,0,0,0,0,0|2,0,2]=4 27 B6R0.4 C=CCNC(=O)C MCULE-7903624915 [0,0,0,0,0,0|1,0,2]=3 28 B6R0.4 C=CCNC(=O)N MCULE-1210131291 [0,0,0,0,0,0|2,0,2]=4 29 B6R0.4 C=CCOC(=O)C MCULE-9991130828 [0,0,0,0,0,0|0,0,2]=2 30 B6R0.4 C=CCOC(=O)Cl MCULE-3513251417 [0,0,0,0,0,0|1,0,2]=3 31 B6R0.4 C=CCOC(=O)N MCULE-4119124558 [0,0,0,0,0,0|1,0,2]=3 32 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [0,0,0,0,0,0|2,0,2]=4 33 B6R0.4 CC(=CCC#N)C MCULE-1406666578 [0,0,0,0,0,0|3,0,1]=4 34 B6R0.4 CC(=CCCBr)C MCULE-9403575147 [0,0,0,0,0,0|3,0,0]=3 35 B6R0.4 CC(=CCCN)C MCULE-9185531904 [0,0,0,0,0,0|3,0,0]=3 36 B6R0.4 CC(=CCCO)C MCULE-2493404466 [0,0,0,0,0,0|3,0,0]=3 37 B6R0.4 CC(=CCCO)C MCULE-8497528596 [0,0,0,0,0,0|3,0,0]=3 38 B6R0.4 CC(=O)CCC#N MCULE-6810756363 [0,0,0,0,0,0|2,0,1]=3 39 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [0,0,0,0,0,0|2,0,1]=3 40 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [0,0,0,0,0,0|2,0,0]=2 41 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [0,0,0,0,0,0|2,0,0]=2 42 B6R0.4 CC(=O)CCCO MCULE-1335342150 [0,0,0,0,0,0|2,0,0]=2 43 B6R0.4 CC(=O)CSC#N MCULE-5774397655 [0,0,0,0,0,0|3,0,1]=4 44 B6R0.4 CC(=O)NCC#N MCULE-2345227602 [0,0,0,0,0,0|2,0,1]=3 45 B6R0.4 CC(=O)NCCCl MCULE-7865062188 [0,0,0,0,0,0|2,0,0]=2 46 B6R0.4 CC(=O)NCCN MCULE-2230084818 [0,0,0,0,0,0|2,0,0]=2 47 B6R0.4 CC(=O)NCCO MCULE-5968518415 [0,0,0,0,0,0|2,0,0]=2 48 B6R0.4 CC(=O)NCCS MCULE-3345813615 [0,0,0,0,0,0|2,0,0]=2 49 B6R0.4 CC(=O)OCC#N MCULE-4866082576 [0,0,0,0,0,0|1,0,1]=2 50 B6R0.4 CC(=O)OCCBr MCULE-3760449773 [0,0,0,0,0,0|1,0,0]=1 51 B6R0.4 CC(=O)OCCCl MCULE-4570139017 [0,0,0,0,0,0|1,0,0]=1 52 B6R0.4 CC(=O)OCCN MCULE-4530529900 [0,0,0,0,0,0|1,0,0]=1 53 B6R0.4 CC(=O)OCCN MCULE-6854340494 [0,0,0,0,0,0|1,0,0]=1 54 B6R0.4 CC(=O)OCCO MCULE-1251660436 [0,0,0,0,0,0|1,0,0]=1 55 B6R0.4 CC(=O)SCC#N MCULE-5864559051 [0,0,0,0,0,0|1,1,1]=3 56 B6R0.4 CC(=O)SCCBr MCULE-1786480878 [0,0,0,0,0,0|1,1,0]=2 57 B6R0.4 CC(=O)SCCN MCULE-3819903256 [0,0,0,0,0,0|1,1,0]=2 58 B6R0.4 CC(=O)SCCN MCULE-4872130470 [0,0,0,0,0,0|1,1,0]=2 59 B6R0.4 CC(=O)SCCN MCULE-7084821345 [0,0,0,0,0,0|1,1,0]=2 60 B6R0.4 CC(Br)CCCBr MCULE-8808667049 [0,0,0,0,0,0|3,0,1]=4 61 B6R0.4 CC(C)CCCBr MCULE-2045625937 [0,0,0,0,0,0|3,0,1]=4 62 B6R0.4 CC(C)CCCCl MCULE-4841628592 [0,0,0,0,0,0|3,0,1]=4 63 B6R0.4 CC(C)CCCI MCULE-4035616717 [0,0,0,0,0,0|3,0,1]=4 64 B6R0.4 CC(C)CCCN MCULE-2232715676 [0,0,0,0,0,0|3,0,1]=4 65 B6R0.4 CC(C)CCCN MCULE-7121372197 [0,0,0,0,0,0|3,0,1]=4 66 B6R0.4 CC(C)CCCO MCULE-5797993948 [0,0,0,0,0,0|3,0,1]=4 67 B6R0.4 CC(C)CCCS MCULE-8417191578 [0,0,0,0,0,0|3,0,1]=4 68 B6R0.4 CC(C)NCCCl MCULE-1521398137 [0,0,0,0,0,0|3,0,1]=4 69 B6R0.4 CC(C)NCCCl MCULE-2586914937 [0,0,0,0,0,0|3,0,1]=4 70 B6R0.4 CC(C)NCCN MCULE-1003086359 [0,0,0,0,0,0|3,0,1]=4 71 B6R0.4 CC(C)NCCN MCULE-5066931507 [0,0,0,0,0,0|3,0,1]=4 72 B6R0.4 CC(C)NCCO MCULE-1749029105 [0,0,0,0,0,0|3,0,1]=4 73 B6R0.4 CC(C)OCC#N MCULE-4594795380 [0,0,0,0,0,0|2,0,2]=4 74 B6R0.4 CC(C)OCC=O MCULE-5974054323 [0,0,0,0,0,0|2,0,2]=4 75 B6R0.4 CC(C)OCCBr MCULE-8869065375 [0,0,0,0,0,0|2,0,1]=3 76 B6R0.4 CC(C)OCCCl MCULE-3848763715 [0,0,0,0,0,0|2,0,1]=3 77 B6R0.4 CC(C)OCCI MCULE-8259612531 [0,0,0,0,0,0|2,0,1]=3 78 B6R0.4 CC(C)OCCN MCULE-6140628944 [0,0,0,0,0,0|2,0,1]=3 79 B6R0.4 CC(C)OCCN MCULE-7438591135 [0,0,0,0,0,0|2,0,1]=3 80 B6R0.4 CC(C)OCCN MCULE-7614115649 [0,0,0,0,0,0|2,0,1]=3 81 B6R0.4 CC(C)OCCO MCULE-8766149613 [0,0,0,0,0,0|2,0,1]=3 82 B6R0.4 CC(C)SCCCl MCULE-4991548042 [0,0,0,0,0,0|2,1,1]=4 83 B6R0.4 CC(C)SCCN MCULE-2838203545 [0,0,0,0,0,0|2,1,1]=4 84 B6R0.4 CC(C)SCCN MCULE-6551225219 [0,0,0,0,0,0|2,1,1]=4 85 B6R0.4 CC(C)SCCO MCULE-1467015400 [0,0,0,0,0,0|2,1,1]=4 86 B6R0.4 CC(Cl)CCCCl MCULE-9382073752 [0,0,0,0,0,0|3,0,1]=4 87 B6R0.4 CC(Cl)CCCO MCULE-2554250532 [0,0,0,0,0,0|3,0,1]=4 88 B6R0.4 CC(N)CCCN MCULE-4857113826 [0,0,0,0,0,0|3,0,1]=4 89 B6R0.4 CC(N)CCCN MCULE-4899798325 [0,0,0,0,0,0|3,0,1]=4 90 B6R0.4 CC(N)CCCO MCULE-6629535696 [0,0,0,0,0,0|3,0,1]=4 91 B6R0.4 CC(O)CCCBr MCULE-5477662754 [0,0,0,0,0,0|2,0,2]=4 92 B6R0.4 CC(O)CCCCl MCULE-6993728810 [0,0,0,0,0,0|2,0,2]=4 93 B6R0.4 CC(O)CCCN MCULE-3754805134 [0,0,0,0,0,0|2,0,2]=4 94 B6R0.4 CC(O)CCCO MCULE-6580326052 [0,0,0,0,0,0|2,0,2]=4 95 B6R0.4 CC/C=C/C(=N)N MCULE-7871697378 [0,0,0,0,0,0|3,0,1]=4 96 B6R0.4 CC/C=C/C(=N)N MCULE-9276291098 [0,0,0,0,0,0|3,0,1]=4 97 B6R0.4 CC/C=C/C(=O)Cl MCULE-8929214872 [0,0,0,0,0,0|2,0,1]=3 98 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [0,0,0,0,0,0|2,0,1]=3 99 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [0,0,0,0,0,0|2,0,2]=4 100 B6R0.4 CC=NNC(=O)N MCULE-3878774235 [0,0,0,0,0,0|3,0,1]=4 101 B6R0.4 CCC#CC(=O)C MCULE-7788224704 [0,0,0,0,0,0|1,0,1]=2 102 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [0,0,0,0,0,0|2,0,1]=3 103 B6R0.4 CCC#CC(C)O MCULE-6395334377 [0,0,0,0,0,0|1,0,3]=4 104 B6R0.4 CCC=CC(=O)C MCULE-2986269826 [0,0,0,0,0,0|1,0,1]=2 105 B6R0.4 CCC=CC(=O)Cl MCULE-5159865849 [0,0,0,0,0,0|2,0,1]=3 106 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [0,0,0,0,0,0|2,0,1]=3 107 B6R0.4 CCCC=C(C)C MCULE-2110588796 [0,0,0,0,0,0|2,0,0]=2 108 B6R0.4 CCCCB(O)O MCULE-9002672645 [0,0,0,0,0,0|3,0,1]=4 109 B6R0.4 CCCCC(=N)N MCULE-3271993509 [0,0,0,0,0,0|3,0,0]=3 110 B6R0.4 CCCCC(=N)N MCULE-3935017760 [0,0,0,0,0,0|3,0,0]=3 111 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [0,0,0,0,0,0|2,0,0]=2 112 B6R0.4 CCCCC(=O)C MCULE-3554390184 [0,0,0,0,0,0|1,0,0]=1 113 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [0,0,0,0,0,0|2,0,0]=2 114 B6R0.4 CCCCC(=O)N MCULE-6419483436 [0,0,0,0,0,0|2,0,0]=2 115 B6R0.4 CCCCC(=O)O MCULE-2333640078 [0,0,0,0,0,0|2,0,0]=2 116 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [0,0,0,0,0,0|2,0,0]=2 117 B6R0.4 CCCCC(=S)N MCULE-8236760762 [0,0,0,0,0,0|2,1,0]=3 118 B6R0.4 CCCCC(C)Br MCULE-3252474574 [0,0,0,0,0,0|2,0,1]=3 119 B6R0.4 CCCCC(C)C MCULE-7568461039 [0,0,0,0,0,0|2,0,1]=3 120 B6R0.4 CCCCC(C)Cl MCULE-4825682003 [0,0,0,0,0,0|2,0,1]=3 121 B6R0.4 CCCCC(C)N MCULE-5349371506 [0,0,0,0,0,0|2,0,1]=3 122 B6R0.4 CCCCC(C)N MCULE-6696490028 [0,0,0,0,0,0|2,0,1]=3 123 B6R0.4 CCCCC(C)O MCULE-6558228722 [0,0,0,0,0,0|1,0,2]=3 124 B6R0.4 CCCCC(C)S MCULE-4791681848 [0,0,0,0,0,0|1,1,1]=3 125 B6R0.4 CCCCN(=O)=O MCULE-7679767771 [0,0,0,0,0,0|3,0,0]=3 126 B6R0.4 CCCCN(C)C MCULE-7202077639 [0,0,0,0,0,0|3,0,0]=3 127 B6R0.4 CCCCN(C)N MCULE-7927159797 [0,0,0,0,0,0|3,0,0]=3 128 B6R0.4 CCCCS(=O)[O-] MCULE-4347348762 [0,0,0,0,0,0|3,0,0]=3 129 B6R0.4 CCCCS(=O)[O-] MCULE-8153578421 [0,0,0,0,0,0|3,0,0]=3 130 B6R0.4 CCCC[C@@H](C)N MCULE-2673058676 [0,0,0,0,0,0|2,0,1]=3 131 B6R0.4 CCCC[C@@H](C)N MCULE-7666196055 [0,0,0,0,0,0|2,0,1]=3 132 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [0,0,0,0,0,0|1,0,2]=3 133 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [0,0,0,0,0,0|1,0,2]=3 134 B6R0.4 CCCC[C@H](C)N MCULE-6212068145 [0,0,0,0,0,0|2,0,1]=3 135 B6R0.4 CCCC[C@H](C)N MCULE-7818513999 [0,0,0,0,0,0|2,0,1]=3 136 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [0,0,0,0,0,0|1,0,2]=3 137 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [0,0,0,0,0,0|1,0,2]=3 138 B6R0.4 CCCNC(=N)N MCULE-6381843991 [0,0,0,0,0,0|3,0,0]=3 139 B6R0.4 CCCNC(=N)N MCULE-8286774592 [0,0,0,0,0,0|3,0,0]=3 140 B6R0.4 CCCNC(=O)C MCULE-5899703886 [0,0,0,0,0,0|1,0,0]=1 141 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [0,0,0,0,0,0|2,0,0]=2 142 B6R0.4 CCCNC(=O)N MCULE-8528844765 [0,0,0,0,0,0|2,0,0]=2 143 B6R0.4 CCCNC(=S)N MCULE-3142756488 [0,0,0,0,0,0|2,1,0]=3 144 B6R0.4 CCCNC(C)C MCULE-7475023734 [0,0,0,0,0,0|2,0,1]=3 145 B6R0.4 CCCOC(=O)C MCULE-7327042566 [0,0,0,0,0,0|0,0,0]=0 146 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [0,0,0,0,0,0|1,0,0]=1 147 B6R0.4 CCCOC(=O)N MCULE-2760622567 [0,0,0,0,0,0|1,0,0]=1 148 B6R0.4 CCCOC(=S)[S-] MCULE-9126934993 [0,0,0,0,0,0|1,1,0]=2 149 B6R0.4 CCCOC(=S)[S-] MCULE-9566804941 [0,0,0,0,0,0|1,1,0]=2 150 B6R0.4 CCCON(=O)=O MCULE-3372904250 [0,0,0,0,0,0|2,0,0]=2 151 B6R0.4 CCCSC(=N)N MCULE-4777505658 [0,0,0,0,0,0|2,1,0]=3 152 B6R0.4 CCCSC(=N)N MCULE-8873393921 [0,0,0,0,0,0|2,1,0]=3 153 B6R0.4 CCCSC(=O)C MCULE-4329646671 [0,0,0,0,0,0|0,1,0]=1 154 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [0,0,0,0,0,0|1,1,0]=2 155 B6R0.4 CCCSC(=[NH2+])N MCULE-6759252204 [0,0,0,0,0,0|2,1,0]=3 156 B6R0.4 CCCSC(C)C MCULE-2233656285 [0,0,0,0,0,0|1,1,1]=3 157 B6R0.4 CCN=CC(C)C MCULE-7306741362 [0,0,0,0,0,0|3,0,1]=4 158 B6R0.4 CCNCC(=O)C MCULE-5799315547 [0,0,0,0,0,0|2,0,0]=2 159 B6R0.4 CCNCC(=O)C MCULE-9258294157 [0,0,0,0,0,0|2,0,0]=2 160 B6R0.4 CCNCC(=O)N MCULE-1787248899 [0,0,0,0,0,0|3,0,0]=3 161 B6R0.4 CCNCC(=O)N MCULE-3821700273 [0,0,0,0,0,0|3,0,0]=3 162 B6R0.4 CCNCC(=O)O MCULE-5989480216 [0,0,0,0,0,0|3,0,0]=3 163 B6R0.4 CCNCC(=O)O MCULE-8087863397 [0,0,0,0,0,0|3,0,0]=3 164 B6R0.4 CCNCC(C)C MCULE-1625905125 [0,0,0,0,0,0|3,0,1]=4 165 B6R0.4 CCNCC(C)C MCULE-3527739859 [0,0,0,0,0,0|3,0,1]=4 166 B6R0.4 CCNCC(C)O MCULE-5078068369 [0,0,0,0,0,0|2,0,2]=4 167 B6R0.4 CCNC[C@@H](C)O MCULE-4291219061 [0,0,0,0,0,0|2,0,2]=4 168 B6R0.4 CCNC[C@@H](C)O MCULE-8603386701 [0,0,0,0,0,0|2,0,2]=4 169 B6R0.4 CCNC[C@H](C)O MCULE-7173470231 [0,0,0,0,0,0|2,0,2]=4 170 B6R0.4 CCNC[C@H](C)O MCULE-9651301254 [0,0,0,0,0,0|2,0,2]=4 171 B6R0.4 CCOCC(=N)N MCULE-3232806707 [0,0,0,0,0,0|4,0,0]=4 172 B6R0.4 CCOCC(=N)N MCULE-4996987536 [0,0,0,0,0,0|4,0,0]=4 173 B6R0.4 CCOCC(=O)C MCULE-2825677443 [0,0,0,0,0,0|2,0,0]=2 174 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [0,0,0,0,0,0|3,0,0]=3 175 B6R0.4 CCOCC(=O)O MCULE-1726530898 [0,0,0,0,0,0|3,0,0]=3 176 B6R0.4 CCOCC(=S)N MCULE-7064672670 [0,0,0,0,0,0|3,1,0]=4 177 B6R0.4 CCOCC(C)C MCULE-7986128672 [0,0,0,0,0,0|3,0,1]=4 178 B6R0.4 CCOCC(C)N MCULE-8540668261 [0,0,0,0,0,0|3,0,1]=4 179 B6R0.4 CCOCC(C)N MCULE-8720228996 [0,0,0,0,0,0|3,0,1]=4 180 B6R0.4 CCOCC(C)O MCULE-6224339526 [0,0,0,0,0,0|2,0,2]=4 181 B6R0.4 CCOC[C@@H](C)N MCULE-7053460047 [0,0,0,0,0,0|3,0,1]=4 182 B6R0.4 CCOC[C@@H](C)N MCULE-9865800502 [0,0,0,0,0,0|3,0,1]=4 183 B6R0.4 CCOC[C@@H](C)O MCULE-9075407512 [0,0,0,0,0,0|2,0,2]=4 184 B6R0.4 CCOC[C@H](C)N MCULE-2897416804 [0,0,0,0,0,0|3,0,1]=4 185 B6R0.4 CCOC[C@H](C)N MCULE-6799267946 [0,0,0,0,0,0|3,0,1]=4 186 B6R0.4 CCONC(C)C MCULE-2412572743 [0,0,0,0,0,0|3,0,1]=4 187 B6R0.4 CCONC(C)C MCULE-9246196365 [0,0,0,0,0,0|3,0,1]=4 188 B6R0.4 CCSCC(=O)C MCULE-9872082780 [0,0,0,0,0,0|2,0,0]=2 189 B6R0.4 CCSCC(=O)O MCULE-7471335718 [0,0,0,0,0,0|3,0,0]=3 190 B6R0.4 CCSCC(C)N MCULE-3399255190 [0,0,0,0,0,0|3,0,1]=4 191 B6R0.4 CN(C)CCCBr MCULE-2862944726 [0,0,0,0,0,0|4,0,0]=4 192 B6R0.4 CN(C)CCCBr MCULE-4596026048 [0,0,0,0,0,0|4,0,0]=4 193 B6R0.4 CN(C)CCCBr MCULE-7515880350 [0,0,0,0,0,0|4,0,0]=4 194 B6R0.4 CN(C)CCCCl MCULE-1347366200 [0,0,0,0,0,0|4,0,0]=4 195 B6R0.4 CN(C)CCCCl MCULE-3767329555 [0,0,0,0,0,0|4,0,0]=4 196 B6R0.4 CN(C)CCCI MCULE-2134226049 [0,0,0,0,0,0|4,0,0]=4 197 B6R0.4 CN(C)CCCI MCULE-2999516061 [0,0,0,0,0,0|4,0,0]=4 198 B6R0.4 CN(C)CCCN MCULE-3882436382 [0,0,0,0,0,0|4,0,0]=4 199 B6R0.4 CN(C)CCCN MCULE-4415270662 [0,0,0,0,0,0|4,0,0]=4 200 B6R0.4 CN(C)CCCN MCULE-4624916051 [0,0,0,0,0,0|4,0,0]=4 201 B6R0.4 CN(C)CCCN MCULE-4749435878 [0,0,0,0,0,0|4,0,0]=4 202 B6R0.4 CN(C)CCCN MCULE-9301668058 [0,0,0,0,0,0|4,0,0]=4 203 B6R0.4 CN(C)CCCO MCULE-7408728427 [0,0,0,0,0,0|4,0,0]=4 204 B6R0.4 CN(C)CCCS MCULE-7945161812 [0,0,0,0,0,0|4,0,0]=4 205 B6R0.4 CN(C)NCCCl MCULE-2462354397 [0,0,0,0,0,0|4,0,0]=4 206 B6R0.4 CN(C)NCCCl MCULE-7933853049 [0,0,0,0,0,0|4,0,0]=4 207 B6R0.4 CNCCC(=O)N MCULE-1118876220 [0,0,0,0,0,0|3,0,0]=3 208 B6R0.4 CNCCC(=O)N MCULE-6679713144 [0,0,0,0,0,0|3,0,0]=3 209 B6R0.4 CNCCC(=O)O MCULE-3627988097 [0,0,0,0,0,0|3,0,0]=3 210 B6R0.4 CNCCC(=O)O MCULE-9858204248 [0,0,0,0,0,0|3,0,0]=3 211 B6R0.4 CNCCC(C)C MCULE-3679914556 [0,0,0,0,0,0|3,0,1]=4 212 B6R0.4 CNCCC(C)C MCULE-9679972004 [0,0,0,0,0,0|3,0,1]=4 213 B6R0.4 CNCCC(C)N MCULE-5955505029 [0,0,0,0,0,0|3,0,1]=4 214 B6R0.4 CNCCC(C)N MCULE-8933967952 [0,0,0,0,0,0|3,0,1]=4 215 B6R0.4 CNCCC(C)O MCULE-1615526002 [0,0,0,0,0,0|2,0,2]=4 216 B6R0.4 CNCCN(C)C MCULE-3324857553 [0,0,0,0,0,0|4,0,0]=4 217 B6R0.4 CNCCN(C)C MCULE-8014008412 [0,0,0,0,0,0|4,0,0]=4 218 B6R0.4 CNCCN(C)C MCULE-9954339750 [0,0,0,0,0,0|4,0,0]=4 219 B6R0.4 CNCC[C@@H](C)N MCULE-6024494304 [0,0,0,0,0,0|3,0,1]=4 220 B6R0.4 CNCC[C@H](C)N MCULE-5449372796 [0,0,0,0,0,0|3,0,1]=4 221 B6R0.4 CNCC[C@H](C)N MCULE-8157402351 [0,0,0,0,0,0|3,0,1]=4 222 B6R0.4 CO/C=C/C(=O)C MCULE-1215649803 [0,0,0,0,0,0|2,0,1]=3 223 B6R0.4 CO/C=C/C(=O)O MCULE-3681049176 [0,0,0,0,0,0|3,0,1]=4 224 B6R0.4 COC=CC(=O)C MCULE-4868833764 [0,0,0,0,0,0|2,0,1]=3 225 B6R0.4 COC=CC(=O)Cl MCULE-4966577139 [0,0,0,0,0,0|3,0,1]=4 226 B6R0.4 COC=CC(=O)O MCULE-4252899122 [0,0,0,0,0,0|3,0,1]=4 227 B6R0.4 COCCC(=N)N MCULE-8118559492 [0,0,0,0,0,0|4,0,0]=4 228 B6R0.4 COCCC(=N)N MCULE-9000138086 [0,0,0,0,0,0|4,0,0]=4 229 B6R0.4 COCCC(=O)C MCULE-5939812376 [0,0,0,0,0,0|2,0,0]=2 230 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [0,0,0,0,0,0|3,0,0]=3 231 B6R0.4 COCCC(=O)N MCULE-7556483675 [0,0,0,0,0,0|3,0,0]=3 232 B6R0.4 COCCC(=O)O MCULE-3436347115 [0,0,0,0,0,0|3,0,0]=3 233 B6R0.4 COCCC(C)Br MCULE-6529807745 [0,0,0,0,0,0|3,0,1]=4 234 B6R0.4 COCCC(C)C MCULE-8727768886 [0,0,0,0,0,0|3,0,1]=4 235 B6R0.4 COCCC(C)N MCULE-6183216923 [0,0,0,0,0,0|3,0,1]=4 236 B6R0.4 COCCC(C)O MCULE-6536001437 [0,0,0,0,0,0|2,0,2]=4 237 B6R0.4 COCCN(C)C MCULE-5323166567 [0,0,0,0,0,0|4,0,0]=4 238 B6R0.4 COCCN(C)N MCULE-9480733049 [0,0,0,0,0,0|4,0,0]=4 239 B6R0.4 COCC[C@H](C)N MCULE-6163336851 [0,0,0,0,0,0|3,0,1]=4 240 B6R0.4 COCC[C@H](C)N MCULE-6363449253 [0,0,0,0,0,0|3,0,1]=4 241 B6R0.4 COCNC(=O)N MCULE-8367032240 [0,0,0,0,0,0|3,0,0]=3 242 B6R0.4 COCOC(=O)C MCULE-8876091916 [0,0,0,0,0,0|1,0,0]=1 243 B6R0.4 CON=CC(=O)O MCULE-6800819509 [0,0,0,0,0,0|4,0,0]=4 244 B6R0.4 CS(=O)CCCN MCULE-1124989526 [0,0,0,0,0,0|3,0,0]=3 245 B6R0.4 CS(=O)CCCN MCULE-8758903495 [0,0,0,0,0,0|3,0,0]=3 246 B6R0.4 CSCCC(=N)N MCULE-3926353306 [0,0,0,0,0,0|4,0,0]=4 247 B6R0.4 CSCCC(=N)N MCULE-4451485733 [0,0,0,0,0,0|4,0,0]=4 248 B6R0.4 CSCCC(=O)C MCULE-6178663156 [0,0,0,0,0,0|2,0,0]=2 249 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [0,0,0,0,0,0|3,0,0]=3 250 B6R0.4 CSCCC(=O)N MCULE-7105035733 [0,0,0,0,0,0|3,0,0]=3 251 B6R0.4 CSCCC(=O)O MCULE-9550032941 [0,0,0,0,0,0|3,0,0]=3 252 B6R0.4 CSCCC(C)N MCULE-3925048385 [0,0,0,0,0,0|3,0,1]=4 253 B6R0.4 CSCCC(C)O MCULE-5934844952 [0,0,0,0,0,0|2,0,2]=4 254 B6R0.4 CSCCN(C)C MCULE-2148124964 [0,0,0,0,0,0|4,0,0]=4 255 B6R0.4 CSCCN(C)C MCULE-5176242697 [0,0,0,0,0,0|4,0,0]=4 256 B6R0.4 CSCOC(=O)C MCULE-1498769347 [0,0,0,0,0,0|1,0,0]=1 257 B6R0.4 CSSCC(=O)O MCULE-5829510166 [0,0,0,0,0,0|4,0,0]=4 258 B6R0.4 C[C@@H](N)CCCO MCULE-8313291415 [0,0,0,0,0,0|3,0,1]=4 259 B6R0.4 C[C@@H](O)CCCO MCULE-1658231016 [0,0,0,0,0,0|2,0,2]=4 260 B6R0.4 FC(=CCCBr)F MCULE-2616028843 [0,0,0,0,0,0|4,0,0]=4 261 B6R0.4 FC(=CCCCl)F MCULE-2193644602 [0,0,0,0,0,0|4,0,0]=4 262 B6R0.4 FC(F)OCCBr MCULE-8028905013 [0,0,0,0,0,0|3,0,1]=4 263 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [0,0,0,0,0,0|3,0,1]=4 264 B6R0.4 N#CCNC(=O)N MCULE-9927791118 [0,0,0,0,0,0|3,0,1]=4 265 B6R0.4 N=C(N)NCCO MCULE-5114367892 [0,0,0,0,0,0|4,0,0]=4 266 B6R0.4 N=C(N)NCCO MCULE-6389092248 [0,0,0,0,0,0|4,0,0]=4 267 B6R0.4 N=C(N)NCCS MCULE-1108122235 [0,0,0,0,0,0|4,0,0]=4 268 B6R0.4 N=C(N)NCCS MCULE-1842583721 [0,0,0,0,0,0|4,0,0]=4 269 B6R0.4 N=C(N)NCCS MCULE-4497722042 [0,0,0,0,0,0|4,0,0]=4 270 B6R0.4 N=C(N)NCCS MCULE-6123443321 [0,0,0,0,0,0|4,0,0]=4 271 B6R0.4 N=C(N)SCCN MCULE-1482556327 [0,0,0,0,0,0|3,1,0]=4 272 B6R0.4 N=C(N)SCCO MCULE-5563309692 [0,0,0,0,0,0|3,1,0]=4 273 B6R0.4 N=C(N)SCCO MCULE-5671847690 [0,0,0,0,0,0|3,1,0]=4 274 B6R0.4 NC(=NCCO)N MCULE-5043697998 [0,0,0,0,0,0|4,0,0]=4 275 B6R0.4 NC(=NCCS)N MCULE-4111802244 [0,0,0,0,0,0|4,0,0]=4 276 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [0,0,0,0,0,0|3,0,0]=3 277 B6R0.4 NC(=O)CCCO MCULE-3779341561 [0,0,0,0,0,0|3,0,0]=3 278 B6R0.4 NC(=O)NCCCl MCULE-6117142945 [0,0,0,0,0,0|3,0,0]=3 279 B6R0.4 NC(=O)NCCF MCULE-9526714989 [0,0,0,0,0,0|3,0,0]=3 280 B6R0.4 NC(=O)NCCO MCULE-2353513655 [0,0,0,0,0,0|3,0,0]=3 281 B6R0.4 NC(=O)OCCCl MCULE-4259077420 [0,0,0,0,0,0|2,0,0]=2 282 B6R0.4 NC(=O)OCCO MCULE-7565460845 [0,0,0,0,0,0|2,0,0]=2 283 B6R0.4 NC(=S)CCCO MCULE-8951145487 [0,0,0,0,0,0|3,1,0]=4 284 B6R0.4 NC(=S)NCCO MCULE-9343742573 [0,0,0,0,0,0|3,1,0]=4 285 B6R0.4 NC/C=C/C(=O)O MCULE-1249244912 [0,0,0,0,0,0|3,0,1]=4 286 B6R0.4 NCC#CC(=O)O MCULE-8511125702 [0,0,0,0,0,0|3,0,1]=4 287 B6R0.4 NCC=CC(=O)O MCULE-3049811576 [0,0,0,0,0,0|3,0,1]=4 288 B6R0.4 NCC=CC(=O)O MCULE-5171717036 [0,0,0,0,0,0|3,0,1]=4 289 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [0,0,0,0,0,0|3,0,0]=3 290 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [0,0,0,0,0,0|3,0,0]=3 291 B6R0.4 NCCCC(=O)N MCULE-8039142092 [0,0,0,0,0,0|3,0,0]=3 292 B6R0.4 NCCCC(=O)N MCULE-8262250872 [0,0,0,0,0,0|3,0,0]=3 293 B6R0.4 NCCCC(=O)O MCULE-3615304273 [0,0,0,0,0,0|3,0,0]=3 294 B6R0.4 NCCCC(=O)O MCULE-7613134021 [0,0,0,0,0,0|3,0,0]=3 295 B6R0.4 NCCNC(=O)N MCULE-1197396950 [0,0,0,0,0,0|3,0,0]=3 296 B6R0.4 NCCNC(=O)N MCULE-2171700183 [0,0,0,0,0,0|3,0,0]=3 297 B6R0.4 NCCNC(=O)N MCULE-3799764813 [0,0,0,0,0,0|3,0,0]=3 298 B6R0.4 NCCNC(=S)N MCULE-7473616024 [0,0,0,0,0,0|3,1,0]=4 299 B6R0.4 NCCNC(=S)N MCULE-7947010145 [0,0,0,0,0,0|3,1,0]=4 300 B6R0.4 NCCOC(=O)N MCULE-4144808257 [0,0,0,0,0,0|2,0,0]=2 301 B6R0.4 NCCOC(=O)N MCULE-5815053840 [0,0,0,0,0,0|2,0,0]=2 302 B6R0.4 NCCOC(F)F MCULE-4294860342 [0,0,0,0,0,0|3,0,1]=4 303 B6R0.4 NCCOC(F)F MCULE-4957283927 [0,0,0,0,0,0|3,0,1]=4 304 B6R0.4 NCCON(=O)=O MCULE-1660868950 [0,0,0,0,0,0|3,0,0]=3 305 B6R0.4 NCCON(=O)=O MCULE-5781896981 [0,0,0,0,0,0|3,0,0]=3 306 B6R0.4 NOCCC(=O)O MCULE-1529492904 [0,0,0,0,0,0|4,0,0]=4 307 B6R0.4 NOCCC(=O)O MCULE-6297331357 [0,0,0,0,0,0|4,0,0]=4 308 B6R0.4 O=C(Cl)CCCBr MCULE-1389049838 [0,0,0,0,0,0|3,0,0]=3 309 B6R0.4 O=C(Cl)CCCCl MCULE-5885932072 [0,0,0,0,0,0|3,0,0]=3 310 B6R0.4 O=C(Cl)OCCBr MCULE-6758010852 [0,0,0,0,0,0|2,0,0]=2 311 B6R0.4 O=C(Cl)OCCCl MCULE-1505786385 [0,0,0,0,0,0|2,0,0]=2 312 B6R0.4 O=C(Cl)OCCF MCULE-5233366139 [0,0,0,0,0,0|2,0,0]=2 313 B6R0.4 O=C(O)/C=C/CBr MCULE-2012997584 [0,0,0,0,0,0|3,0,1]=4 314 B6R0.4 O=C(O)/C=C/CCl MCULE-5651159998 [0,0,0,0,0,0|3,0,1]=4 315 B6R0.4 O=C(O)/C=C/CO MCULE-1612823053 [0,0,0,0,0,0|3,0,1]=4 316 B6R0.4 O=C(O)C#CCCl MCULE-6341675394 [0,0,0,0,0,0|3,0,1]=4 317 B6R0.4 O=C(O)C#CCF MCULE-8744045229 [0,0,0,0,0,0|3,0,1]=4 318 B6R0.4 O=C(O)C#CCO MCULE-1849362182 [0,0,0,0,0,0|3,0,1]=4 319 B6R0.4 O=C(O)C=CCBr MCULE-3029375430 [0,0,0,0,0,0|3,0,1]=4 320 B6R0.4 O=C(O)C=CCCl MCULE-1050913038 [0,0,0,0,0,0|3,0,1]=4 321 B6R0.4 O=C(O)C=CCO MCULE-3375515425 [0,0,0,0,0,0|3,0,1]=4 322 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [0,0,0,0,0,0|3,0,0]=3 323 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [0,0,0,0,0,0|3,0,0]=3 324 B6R0.4 O=C(O)CCCF MCULE-2415675768 [0,0,0,0,0,0|3,0,0]=3 325 B6R0.4 O=C(O)CCCI MCULE-7794841553 [0,0,0,0,0,0|3,0,0]=3 326 B6R0.4 O=C(O)CCCS MCULE-3352840152 [0,0,0,0,0,0|3,0,0]=3 327 B6R0.4 O=C(O)CNCO MCULE-4092998319 [0,0,0,0,0,0|4,0,0]=4 328 B6R0.4 O=C([O-])CCCCl MCULE-4131322715 [0,0,0,0,0,0|3,0,0]=3 329 B6R0.4 O=C([O-])CNCO MCULE-2804068565 [0,0,0,0,0,0|4,0,0]=4 330 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [0,0,0,0,0,0|3,0,1]=4 331 B6R0.4 O=N(=O)CCCBr MCULE-7541604704 [0,0,0,0,0,0|4,0,0]=4 332 B6R0.4 O=N(=O)CCCCl MCULE-3635255631 [0,0,0,0,0,0|4,0,0]=4 333 B6R0.4 O=N(=O)CCCO MCULE-5021681032 [0,0,0,0,0,0|4,0,0]=4 334 B6R0.4 OCCOC(F)F MCULE-6004830165 [0,0,0,0,0,0|3,0,1]=4 335 B6R0.4 P(=O)([O-])OCCC MCULE-3877591764 [0,0,0,0,0,0|2,0,0]=2 336 B6R0.4 [NH2+]=C(N)SCC[NH3+] MCULE-2799536411 [0,0,0,0,0,0|3,1,0]=4 337 B5R0.1 C#CCC(=O)O MCULE-4680699666 [1,0,0,0,0,0|1,0,2]=4 338 B5R0.1 C(C)(N)CCC MCULE-4800297905 [1,0,0,0,0,0|1,0,1]=3 339 B5R0.1 C(C)(N)CCC MCULE-7674864567 [1,0,0,0,0,0|1,0,1]=3 340 B5R0.1 C(C)(N)CCO MCULE-5545469271 [1,0,0,0,0,0|2,0,1]=4 341 B5R0.1 C/C(=C/CI)/I MCULE-4907089043 [1,0,0,0,0,0|2,0,1]=4 342 B5R0.1 C/C(=C/CN)/Cl MCULE-1091573118 [1,0,0,0,0,0|2,0,1]=4 343 B5R0.1 C/C(=C/CN)/Cl MCULE-8112023611 [1,0,0,0,0,0|2,0,1]=4 344 B5R0.1 C/C(=C\CCl)/Cl MCULE-6679259233 [1,0,0,0,0,0|2,0,1]=4 345 B5R0.1 C/C=C/C(=O)C MCULE-2109656516 [1,0,0,0,0,0|0,0,2]=3 346 B5R0.1 C/C=C/C(=O)Cl MCULE-8378824386 [1,0,0,0,0,0|1,0,2]=4 347 B5R0.1 C/C=C/C(=O)N MCULE-2532228624 [1,0,0,0,0,0|1,0,2]=4 348 B5R0.1 C/C=C/C(=O)O MCULE-6937494852 [1,0,0,0,0,0|1,0,2]=4 349 B5R0.1 C=C(Br)CCBr MCULE-7638627279 [1,0,0,0,0,0|2,0,1]=4 350 B5R0.1 C=C(Br)CCO MCULE-3743908958 [1,0,0,0,0,0|2,0,1]=4 351 B5R0.1 C=C(Br)COC MCULE-5349428431 [1,0,0,0,0,0|2,0,1]=4 352 B5R0.1 C=C(C)CCBr MCULE-3439794005 [1,0,0,0,0,0|2,0,0]=3 353 B5R0.1 C=C(C)CCC MCULE-8225129744 [1,0,0,0,0,0|1,0,0]=2 354 B5R0.1 C=C(C)CCCl MCULE-2816016781 [1,0,0,0,0,0|2,0,0]=3 355 B5R0.1 C=C(C)CCI MCULE-6317205481 [1,0,0,0,0,0|2,0,0]=3 356 B5R0.1 C=C(C)CCN MCULE-4037025602 [1,0,0,0,0,0|2,0,0]=3 357 B5R0.1 C=C(C)CCN MCULE-5001503744 [1,0,0,0,0,0|2,0,0]=3 358 B5R0.1 C=C(C)CCO MCULE-2689800711 [1,0,0,0,0,0|2,0,0]=3 359 B5R0.1 C=C(C)CNC MCULE-6783886553 [1,0,0,0,0,0|2,0,0]=3 360 B5R0.1 C=C(C)CNC MCULE-8292313282 [1,0,0,0,0,0|2,0,0]=3 361 B5R0.1 C=C(C)CNN MCULE-1117931770 [1,0,0,0,0,0|3,0,0]=4 362 B5R0.1 C=C(C)CON MCULE-2773974323 [1,0,0,0,0,0|3,0,0]=4 363 B5R0.1 C=C(C)CON MCULE-5978680243 [1,0,0,0,0,0|3,0,0]=4 364 B5R0.1 C=C(C)OCC MCULE-5303468686 [1,0,0,0,0,0|1,0,0]=2 365 B5R0.1 C=CCC(=C)C MCULE-6294070836 [1,0,0,0,0,0|1,0,2]=4 366 B5R0.1 C=CCC(=O)Cl MCULE-6033189203 [1,0,0,0,0,0|1,0,2]=4 367 B5R0.1 C=CCC(=O)N MCULE-1205335257 [1,0,0,0,0,0|1,0,2]=4 368 B5R0.1 C=CCC(=O)O MCULE-6288979337 [1,0,0,0,0,0|1,0,2]=4 369 B5R0.1 C=CNC(=O)C MCULE-1260296806 [1,0,0,0,0,0|1,0,2]=4 370 B5R0.1 C=COC(=O)C MCULE-7626795765 [1,0,0,0,0,0|0,0,2]=3 371 B5R0.1 C=COC(=O)Cl MCULE-9915729615 [1,0,0,0,0,0|1,0,2]=4 372 B5R0.1 C=NCC(=O)N MCULE-7609497329 [1,0,0,0,0,0|2,0,1]=4 373 B5R0.1 CC#CC(=O)C MCULE-4083248904 [1,0,0,0,0,0|0,0,2]=3 374 B5R0.1 CC#CC(=O)Cl MCULE-6807810093 [1,0,0,0,0,0|1,0,2]=4 375 B5R0.1 CC#CC(=O)O MCULE-9994142213 [1,0,0,0,0,0|1,0,2]=4 376 B5R0.1 CC(=CCBr)C MCULE-7961276795 [1,0,0,0,0,0|2,0,1]=4 377 B5R0.1 CC(=CCCl)C MCULE-1110417103 [1,0,0,0,0,0|2,0,1]=4 378 B5R0.1 CC(=CCCl)Cl MCULE-9735045489 [1,0,0,0,0,0|2,0,1]=4 379 B5R0.1 CC(=CCI)I MCULE-4204968539 [1,0,0,0,0,0|2,0,1]=4 380 B5R0.1 CC(=CCN)C MCULE-7220252581 [1,0,0,0,0,0|2,0,1]=4 381 B5R0.1 CC(=CCN)C MCULE-8394581250 [1,0,0,0,0,0|2,0,1]=4 382 B5R0.1 CC(=CCN)Cl MCULE-1749173363 [1,0,0,0,0,0|2,0,1]=4 383 B5R0.1 CC(=CCN)Cl MCULE-5722512850 [1,0,0,0,0,0|2,0,1]=4 384 B5R0.1 CC(=CCO)C MCULE-3984123588 [1,0,0,0,0,0|2,0,1]=4 385 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [1,0,0,0,0,0|2,0,1]=4 386 B5R0.1 CC(=CCO)I MCULE-4600854759 [1,0,0,0,0,0|2,0,1]=4 387 B5R0.1 CC(=CCS)C MCULE-4180446913 [1,0,0,0,0,0|2,0,1]=4 388 B5R0.1 CC(=O)/C=N/O MCULE-5424156575 [1,0,0,0,0,0|2,0,1]=4 389 B5R0.1 CC(=O)/C=N\O MCULE-9083768531 [1,0,0,0,0,0|2,0,1]=4 390 B5R0.1 CC(=O)C=C=O MCULE-4335598177 [1,0,0,0,0,0|1,0,2]=4 391 B5R0.1 CC(=O)C=NO MCULE-5513006918 [1,0,0,0,0,0|2,0,1]=4 392 B5R0.1 CC(=O)CC#N MCULE-7203242552 [1,0,0,0,0,0|1,0,1]=3 393 B5R0.1 CC(=O)CCBr MCULE-2615300206 [1,0,0,0,0,0|1,0,0]=2 394 B5R0.1 CC(=O)CCCl MCULE-8019748964 [1,0,0,0,0,0|1,0,0]=2 395 B5R0.1 CC(=O)CCN MCULE-7550348751 [1,0,0,0,0,0|1,0,0]=2 396 B5R0.1 CC(=O)CCN MCULE-9519063810 [1,0,0,0,0,0|1,0,0]=2 397 B5R0.1 CC(=O)CCO MCULE-6328537335 [1,0,0,0,0,0|1,0,0]=2 398 B5R0.1 CC(=O)N=C=S MCULE-7540453687 [1,0,0,0,0,0|2,0,1]=4 399 B5R0.1 CC(=O)N=S=O MCULE-1420371815 [1,0,0,0,0,0|3,0,0]=4 400 B5R0.1 CC(=O)NC#N MCULE-8444599659 [1,0,0,0,0,0|2,0,1]=4 401 B5R0.1 CC(=O)NCO MCULE-4563335540 [1,0,0,0,0,0|2,0,0]=3 402 B5R0.1 CC(=O)OCBr MCULE-9842804945 [1,0,0,0,0,0|1,0,0]=2 403 B5R0.1 CC(=O)OCCl MCULE-6822222026 [1,0,0,0,0,0|1,0,0]=2 404 B5R0.1 CC(=O)SCBr MCULE-9794607323 [1,0,0,0,0,0|1,1,0]=3 405 B5R0.1 CC(Br)CCBr MCULE-1045475402 [1,0,0,0,0,0|2,0,1]=4 406 B5R0.1 CC(C)CCBr MCULE-7163010428 [1,0,0,0,0,0|2,0,1]=4 407 B5R0.1 CC(C)CCCl MCULE-8360122696 [1,0,0,0,0,0|2,0,1]=4 408 B5R0.1 CC(C)CCCl MCULE-9017922949 [1,0,0,0,0,0|2,0,1]=4 409 B5R0.1 CC(C)CCI MCULE-4934529500 [1,0,0,0,0,0|2,0,1]=4 410 B5R0.1 CC(C)CCN MCULE-3081003576 [1,0,0,0,0,0|2,0,1]=4 411 B5R0.1 CC(C)CCN MCULE-5118782389 [1,0,0,0,0,0|2,0,1]=4 412 B5R0.1 CC(C)CCN MCULE-5217981670 [1,0,0,0,0,0|2,0,1]=4 413 B5R0.1 CC(C)CCN MCULE-6280940933 [1,0,0,0,0,0|2,0,1]=4 414 B5R0.1 CC(C)CCO MCULE-7411270401 [1,0,0,0,0,0|2,0,1]=4 415 B5R0.1 CC(C)CCS MCULE-7115473363 [1,0,0,0,0,0|2,0,1]=4 416 B5R0.1 CC(C)OCCl MCULE-3680602217 [1,0,0,0,0,0|2,0,1]=4 417 B5R0.1 CC(Cl)CCCl MCULE-3656498608 [1,0,0,0,0,0|2,0,1]=4 418 B5R0.1 CC(Cl)CCO MCULE-1955496242 [1,0,0,0,0,0|2,0,1]=4 419 B5R0.1 CC(F)CCBr MCULE-3035340901 [1,0,0,0,0,0|2,0,1]=4 420 B5R0.1 CC(F)CCI MCULE-6469250150 [1,0,0,0,0,0|2,0,1]=4 421 B5R0.1 CC(F)CCN MCULE-2805813131 [1,0,0,0,0,0|2,0,1]=4 422 B5R0.1 CC(F)CCN MCULE-5849913362 [1,0,0,0,0,0|2,0,1]=4 423 B5R0.1 CC(N)CCN MCULE-5308134596 [1,0,0,0,0,0|2,0,1]=4 424 B5R0.1 CC(N)CCN MCULE-5880045507 [1,0,0,0,0,0|2,0,1]=4 425 B5R0.1 CC(N)CCN MCULE-7827515430 [1,0,0,0,0,0|2,0,1]=4 426 B5R0.1 CC(N)CCO MCULE-1771399942 [1,0,0,0,0,0|2,0,1]=4 427 B5R0.1 CC(N)CCO MCULE-7239872808 [1,0,0,0,0,0|2,0,1]=4 428 B5R0.1 CC(O)CCBr MCULE-7983169885 [1,0,0,0,0,0|1,0,2]=4 429 B5R0.1 CC(O)CCCl MCULE-2952545606 [1,0,0,0,0,0|1,0,2]=4 430 B5R0.1 CC(O)CCN MCULE-6836791276 [1,0,0,0,0,0|1,0,2]=4 431 B5R0.1 CC(O)CCN MCULE-7186260925 [1,0,0,0,0,0|1,0,2]=4 432 B5R0.1 CC(O)CCO MCULE-1694239851 [1,0,0,0,0,0|1,0,2]=4 433 B5R0.1 CC(O)CCO MCULE-7784884948 [1,0,0,0,0,0|1,0,2]=4 434 B5R0.1 CC(S)CCO MCULE-5702212503 [1,0,0,0,0,0|1,1,1]=4 435 B5R0.1 CC=CC(=O)C MCULE-4826977340 [1,0,0,0,0,0|0,0,2]=3 436 B5R0.1 CC=CC(=O)Cl MCULE-2747622237 [1,0,0,0,0,0|1,0,2]=4 437 B5R0.1 CC=CC(=O)N MCULE-9693879476 [1,0,0,0,0,0|1,0,2]=4 438 B5R0.1 CC=CC(=O)O MCULE-7970410217 [1,0,0,0,0,0|1,0,2]=4 439 B5R0.1 CCC=C(C)C MCULE-2405063894 [1,0,0,0,0,0|1,0,1]=3 440 B5R0.1 CCC=C(F)F MCULE-5180612061 [1,0,0,0,0,0|2,0,1]=4 441 B5R0.1 CCCB(O)O MCULE-4994980798 [1,0,0,0,0,0|2,0,1]=4 442 B5R0.1 CCCC(=N)N MCULE-5974105638 [1,0,0,0,0,0|2,0,0]=3 443 B5R0.1 CCCC(=N)N MCULE-9230704591 [1,0,0,0,0,0|2,0,0]=3 444 B5R0.1 CCCC(=O)C MCULE-7174095676 [1,0,0,0,0,0|0,0,0]=1 445 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [1,0,0,0,0,0|1,0,0]=2 446 B5R0.1 CCCC(=O)N MCULE-2712067671 [1,0,0,0,0,0|1,0,0]=2 447 B5R0.1 CCCC(=O)O MCULE-4116382006 [1,0,0,0,0,0|1,0,0]=2 448 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [1,0,0,0,0,0|1,0,0]=2 449 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [1,0,0,0,0,0|1,0,0]=2 450 B5R0.1 CCCC(=S)N MCULE-3529335988 [1,0,0,0,0,0|1,1,0]=3 451 B5R0.1 CCCC(=S)O MCULE-3382199964 [1,0,0,0,0,0|1,0,1]=3 452 B5R0.1 CCCC(C)Br MCULE-3178073667 [1,0,0,0,0,0|1,0,1]=3 453 B5R0.1 CCCC(C)C MCULE-9604552974 [1,0,0,0,0,0|1,0,1]=3 454 B5R0.1 CCCC(C)N MCULE-2640298430 [1,0,0,0,0,0|1,0,1]=3 455 B5R0.1 CCCC(C)N MCULE-7225905167 [1,0,0,0,0,0|1,0,1]=3 456 B5R0.1 CCCC(C)O MCULE-8205906299 [1,0,0,0,0,0|0,0,2]=3 457 B5R0.1 CCCC(C)S MCULE-1649095713 [1,0,0,0,0,0|0,1,1]=3 458 B5R0.1 CCCC(O)Cl MCULE-3188577082 [1,0,0,0,0,0|1,0,2]=4 459 B5R0.1 CCCN(=O)=O MCULE-5615753372 [1,0,0,0,0,0|2,0,0]=3 460 B5R0.1 CCCN(C)C MCULE-8702643596 [1,0,0,0,0,0|2,0,0]=3 461 B5R0.1 CCCS(=O)[O-] MCULE-4306915022 [1,0,0,0,0,0|2,0,0]=3 462 B5R0.1 CCCS(=O)[O-] MCULE-9775151913 [1,0,0,0,0,0|2,0,0]=3 463 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [1,0,0,0,0,0|1,0,1]=3 464 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [1,0,0,0,0,0|1,0,1]=3 465 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [1,0,0,0,0,0|1,0,1]=3 466 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [1,0,0,0,0,0|1,0,1]=3 467 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [1,0,0,0,0,0|0,0,2]=3 468 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [1,0,0,0,0,0|1,0,1]=3 469 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [1,0,0,0,0,0|1,0,1]=3 470 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [1,0,0,0,0,0|1,0,1]=3 471 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [1,0,0,0,0,0|1,0,1]=3 472 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [1,0,0,0,0,0|0,0,2]=3 473 B5R0.1 CCNC(=N)N MCULE-4729418155 [1,0,0,0,0,0|3,0,0]=4 474 B5R0.1 CCNC(=N)N MCULE-5123343071 [1,0,0,0,0,0|3,0,0]=4 475 B5R0.1 CCNC(=O)C MCULE-7543656350 [1,0,0,0,0,0|1,0,0]=2 476 B5R0.1 CCNC(=O)Cl MCULE-5831262934 [1,0,0,0,0,0|2,0,0]=3 477 B5R0.1 CCNC(=O)N MCULE-1913599861 [1,0,0,0,0,0|2,0,0]=3 478 B5R0.1 CCNC(=S)N MCULE-3849517146 [1,0,0,0,0,0|2,1,0]=4 479 B5R0.1 CCNC(C)C MCULE-8064118469 [1,0,0,0,0,0|2,0,1]=4 480 B5R0.1 CCOC(=N)C MCULE-3060267072 [1,0,0,0,0,0|1,0,0]=2 481 B5R0.1 CCOC(=N)C MCULE-3943786182 [1,0,0,0,0,0|1,0,0]=2 482 B5R0.1 CCOC(=N)N MCULE-3570858508 [1,0,0,0,0,0|2,0,0]=3 483 B5R0.1 CCOC(=N)N MCULE-6061063856 [1,0,0,0,0,0|2,0,0]=3 484 B5R0.1 CCOC(=O)C MCULE-6628539781 [1,0,0,0,0,0|0,0,0]=1 485 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [1,0,0,0,0,0|1,0,0]=2 486 B5R0.1 CCOC(=O)N MCULE-1776877276 [1,0,0,0,0,0|1,0,0]=2 487 B5R0.1 CCOC(=S)C MCULE-3358897597 [1,0,0,0,0,0|0,1,0]=2 488 B5R0.1 CCOC(=S)N MCULE-4649285010 [1,0,0,0,0,0|1,1,0]=3 489 B5R0.1 CCOC(=S)[S-] MCULE-6247969567 [1,0,0,0,0,0|1,1,0]=3 490 B5R0.1 CCOC(=S)[S-] MCULE-6902289618 [1,0,0,0,0,0|1,1,0]=3 491 B5R0.1 CCOC(=S)[S-] MCULE-9105300958 [1,0,0,0,0,0|1,1,0]=3 492 B5R0.1 CCOC(C)C MCULE-1934548340 [1,0,0,0,0,0|1,0,1]=3 493 B5R0.1 CCOC(C)Cl MCULE-8486994638 [1,0,0,0,0,0|1,0,1]=3 494 B5R0.1 CCOP(Cl)Cl MCULE-1218379857 [1,0,0,0,0,0|3,0,0]=4 495 B5R0.1 CCSC(=N)N MCULE-2161729152 [1,0,0,0,0,0|2,1,0]=4 496 B5R0.1 CCSC(=N)N MCULE-2547252984 [1,0,0,0,0,0|2,1,0]=4 497 B5R0.1 CCSC(=O)C MCULE-8015440229 [1,0,0,0,0,0|0,1,0]=2 498 B5R0.1 CCSC(=S)C MCULE-1502137460 [1,0,0,0,0,0|0,2,0]=3 499 B5R0.1 CCSC(=S)[S-] MCULE-2573650807 [1,0,0,0,0,0|1,2,0]=4 500 B5R0.1 CCSC(=S)[S-] MCULE-6172057982 [1,0,0,0,0,0|1,2,0]=4 501 B5R0.1 CCSC(C)C MCULE-3738251898 [1,0,0,0,0,0|1,1,1]=4 502 B5R0.1 CC[NH2+]C(=N)N MCULE-1701852752 [1,0,0,0,0,0|3,0,0]=4 503 B5R0.1 CC[O+]=C(N)N MCULE-2484225131 [1,0,0,0,0,0|2,0,1]=4 504 B5R0.1 CC[O+]=C(N)N MCULE-6688774534 [1,0,0,0,0,0|2,0,1]=4 505 B5R0.1 CN(C)CCBr MCULE-4844398053 [1,0,0,0,0,0|3,0,0]=4 506 B5R0.1 CN(C)CCCl MCULE-4297554717 [1,0,0,0,0,0|3,0,0]=4 507 B5R0.1 CN(C)CCCl MCULE-4465544992 [1,0,0,0,0,0|3,0,0]=4 508 B5R0.1 CN(C)CCI MCULE-4687894526 [1,0,0,0,0,0|3,0,0]=4 509 B5R0.1 CN(C)CCI MCULE-7464680246 [1,0,0,0,0,0|3,0,0]=4 510 B5R0.1 CN(C)CCI MCULE-9051868668 [1,0,0,0,0,0|3,0,0]=4 511 B5R0.1 CN(C)CCN MCULE-6693759372 [1,0,0,0,0,0|3,0,0]=4 512 B5R0.1 CN(C)CCN MCULE-6929925748 [1,0,0,0,0,0|3,0,0]=4 513 B5R0.1 CN(C)CCN MCULE-7881547574 [1,0,0,0,0,0|3,0,0]=4 514 B5R0.1 CN(C)CCO MCULE-5715813465 [1,0,0,0,0,0|3,0,0]=4 515 B5R0.1 CN(C)CCO MCULE-7567469160 [1,0,0,0,0,0|3,0,0]=4 516 B5R0.1 CN(C)CCO MCULE-9024108074 [1,0,0,0,0,0|3,0,0]=4 517 B5R0.1 CN(C)CCS MCULE-4356815596 [1,0,0,0,0,0|3,0,0]=4 518 B5R0.1 CN(C)CCS MCULE-4611688723 [1,0,0,0,0,0|3,0,0]=4 519 B5R0.1 CN(C)CCS MCULE-6259585517 [1,0,0,0,0,0|3,0,0]=4 520 B5R0.1 CN(N)CCN MCULE-2782966878 [1,0,0,0,0,0|3,0,0]=4 521 B5R0.1 CNCC(=O)C MCULE-3695443024 [1,0,0,0,0,0|1,0,0]=2 522 B5R0.1 CNCC(=O)C MCULE-7402723072 [1,0,0,0,0,0|1,0,0]=2 523 B5R0.1 CNCC(=O)N MCULE-2328887394 [1,0,0,0,0,0|2,0,0]=3 524 B5R0.1 CNCC(=O)N MCULE-3031605853 [1,0,0,0,0,0|2,0,0]=3 525 B5R0.1 CNCC(=O)N MCULE-7300977677 [1,0,0,0,0,0|2,0,0]=3 526 B5R0.1 CNCC(=O)O MCULE-3448356048 [1,0,0,0,0,0|2,0,0]=3 527 B5R0.1 CNCC(=O)O MCULE-4484444573 [1,0,0,0,0,0|2,0,0]=3 528 B5R0.1 CNCC(=O)[O-] MCULE-7993701866 [1,0,0,0,0,0|2,0,0]=3 529 B5R0.1 CNCC(C)C MCULE-6582386339 [1,0,0,0,0,0|2,0,1]=4 530 B5R0.1 CNCC(C)C MCULE-6856717783 [1,0,0,0,0,0|2,0,1]=4 531 B5R0.1 CNCC(C)F MCULE-4381138647 [1,0,0,0,0,0|2,0,1]=4 532 B5R0.1 CNCC(C)F MCULE-9018181183 [1,0,0,0,0,0|2,0,1]=4 533 B5R0.1 CNCC(C)O MCULE-3671071529 [1,0,0,0,0,0|1,0,2]=4 534 B5R0.1 CNCC(C)O MCULE-4171705304 [1,0,0,0,0,0|1,0,2]=4 535 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [1,0,0,0,0,0|1,0,2]=4 536 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [1,0,0,0,0,0|1,0,2]=4 537 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [1,0,0,0,0,0|1,0,2]=4 538 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [1,0,0,0,0,0|1,0,2]=4 539 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [1,0,0,0,0,0|1,0,2]=4 540 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [1,0,0,0,0,0|1,0,2]=4 541 B5R0.1 CNN=C(C)C MCULE-6307375856 [1,0,0,0,0,0|3,0,0]=4 542 B5R0.1 CNOC(=O)C MCULE-1464426541 [1,0,0,0,0,0|1,0,0]=2 543 B5R0.1 CNOC(=O)C MCULE-2976282666 [1,0,0,0,0,0|1,0,0]=2 544 B5R0.1 COC=C(C)C MCULE-6348538911 [1,0,0,0,0,0|2,0,1]=4 545 B5R0.1 COCC(=N)N MCULE-4711728356 [1,0,0,0,0,0|3,0,0]=4 546 B5R0.1 COCC(=N)N MCULE-7163250467 [1,0,0,0,0,0|3,0,0]=4 547 B5R0.1 COCC(=O)C MCULE-7262197587 [1,0,0,0,0,0|1,0,0]=2 548 B5R0.1 COCC(=O)Cl MCULE-5449267495 [1,0,0,0,0,0|2,0,0]=3 549 B5R0.1 COCC(=O)N MCULE-6674958132 [1,0,0,0,0,0|2,0,0]=3 550 B5R0.1 COCC(=O)O MCULE-3945589151 [1,0,0,0,0,0|2,0,0]=3 551 B5R0.1 COCC(=S)N MCULE-2046809269 [1,0,0,0,0,0|2,1,0]=4 552 B5R0.1 COCC(C)Br MCULE-6850689931 [1,0,0,0,0,0|2,0,1]=4 553 B5R0.1 COCC(C)I MCULE-8608265714 [1,0,0,0,0,0|2,0,1]=4 554 B5R0.1 COCC(C)N MCULE-1896873634 [1,0,0,0,0,0|2,0,1]=4 555 B5R0.1 COCC(C)N MCULE-2549420211 [1,0,0,0,0,0|2,0,1]=4 556 B5R0.1 COCC(C)N MCULE-3490410444 [1,0,0,0,0,0|2,0,1]=4 557 B5R0.1 COCC(C)N MCULE-7089888882 [1,0,0,0,0,0|2,0,1]=4 558 B5R0.1 COCC(C)O MCULE-4022733014 [1,0,0,0,0,0|1,0,2]=4 559 B5R0.1 COCC(C)O MCULE-7513310960 [1,0,0,0,0,0|1,0,2]=4 560 B5R0.1 COCN(C)C MCULE-1963225930 [1,0,0,0,0,0|3,0,0]=4 561 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [1,0,0,0,0,0|2,0,1]=4 562 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [1,0,0,0,0,0|2,0,1]=4 563 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [1,0,0,0,0,0|2,0,1]=4 564 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [1,0,0,0,0,0|2,0,1]=4 565 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [1,0,0,0,0,0|1,0,2]=4 566 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [1,0,0,0,0,0|1,0,2]=4 567 B5R0.1 COC[C@H](C)N MCULE-2465679418 [1,0,0,0,0,0|2,0,1]=4 568 B5R0.1 COC[C@H](C)N MCULE-2998593539 [1,0,0,0,0,0|2,0,1]=4 569 B5R0.1 COC[C@H](C)N MCULE-3161045661 [1,0,0,0,0,0|2,0,1]=4 570 B5R0.1 COC[C@H](C)N MCULE-9550165578 [1,0,0,0,0,0|2,0,1]=4 571 B5R0.1 COC[C@H](C)O MCULE-5908531683 [1,0,0,0,0,0|1,0,2]=4 572 B5R0.1 COC[C@H](C)O MCULE-8619138238 [1,0,0,0,0,0|1,0,2]=4 573 B5R0.1 CONC(=O)C MCULE-6601866630 [1,0,0,0,0,0|2,0,0]=3 574 B5R0.1 CONC(=O)N MCULE-3063713861 [1,0,0,0,0,0|3,0,0]=4 575 B5R0.1 CONC(=S)C MCULE-1876042939 [1,0,0,0,0,0|2,1,0]=4 576 B5R0.1 CS(=O)CC#N MCULE-1246621507 [1,0,0,0,0,0|2,0,1]=4 577 B5R0.1 CS(=O)CCBr MCULE-7846126230 [1,0,0,0,0,0|2,0,0]=3 578 B5R0.1 CS(=O)CCCl MCULE-7012781505 [1,0,0,0,0,0|2,0,0]=3 579 B5R0.1 CS(=O)CCN MCULE-6497874560 [1,0,0,0,0,0|2,0,0]=3 580 B5R0.1 CS(=O)CCN MCULE-8275663766 [1,0,0,0,0,0|2,0,0]=3 581 B5R0.1 CS(=O)CCN MCULE-8330490290 [1,0,0,0,0,0|2,0,0]=3 582 B5R0.1 CS(=O)CCO MCULE-8331553582 [1,0,0,0,0,0|2,0,0]=3 583 B5R0.1 CSCC(=N)N MCULE-7800929509 [1,0,0,0,0,0|3,0,0]=4 584 B5R0.1 CSCC(=N)N MCULE-8499985777 [1,0,0,0,0,0|3,0,0]=4 585 B5R0.1 CSCC(=O)C MCULE-4131794172 [1,0,0,0,0,0|1,0,0]=2 586 B5R0.1 CSCC(=O)Cl MCULE-9750052685 [1,0,0,0,0,0|2,0,0]=3 587 B5R0.1 CSCC(=O)N MCULE-4865579476 [1,0,0,0,0,0|2,0,0]=3 588 B5R0.1 CSCC(=O)O MCULE-7003418159 [1,0,0,0,0,0|2,0,0]=3 589 B5R0.1 CSCC(=S)N MCULE-5029100305 [1,0,0,0,0,0|2,1,0]=4 590 B5R0.1 CSCC(C)N MCULE-7985946030 [1,0,0,0,0,0|2,0,1]=4 591 B5R0.1 CSCC(C)O MCULE-2227652351 [1,0,0,0,0,0|1,0,2]=4 592 B5R0.1 CSCN(C)C MCULE-2931143051 [1,0,0,0,0,0|3,0,0]=4 593 B5R0.1 CSCS(=O)C MCULE-3167702486 [1,0,0,0,0,0|2,0,0]=3 594 B5R0.1 CSNC(=O)C MCULE-7350061514 [1,0,0,0,0,0|2,0,0]=3 595 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [1,0,0,0,0,0|2,0,1]=4 596 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [1,0,0,0,0,0|2,0,1]=4 597 B5R0.1 C[C@@H](O)CCN MCULE-7588849994 [1,0,0,0,0,0|1,0,2]=4 598 B5R0.1 C[C@@H](O)CCN MCULE-7895006310 [1,0,0,0,0,0|1,0,2]=4 599 B5R0.1 C[C@@H](O)CCN MCULE-9071323255 [1,0,0,0,0,0|1,0,2]=4 600 B5R0.1 C[C@@H](O)CCN MCULE-9627550610 [1,0,0,0,0,0|1,0,2]=4 601 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [1,0,0,0,0,0|1,0,2]=4 602 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [1,0,0,0,0,0|1,0,2]=4 603 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [1,0,0,0,0,0|2,0,1]=4 604 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [1,0,0,0,0,0|2,0,1]=4 605 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [1,0,0,0,0,0|2,0,1]=4 606 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [1,0,0,0,0,0|2,0,1]=4 607 B5R0.1 C[C@H](O)CCN MCULE-7570743309 [1,0,0,0,0,0|1,0,2]=4 608 B5R0.1 C[C@H](O)CCN MCULE-9428853702 [1,0,0,0,0,0|1,0,2]=4 609 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [1,0,0,0,0,0|1,0,2]=4 610 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [1,0,0,0,0,0|1,0,2]=4 611 B5R0.1 C[NH+](C)CCBr MCULE-4990293495 [1,0,0,0,0,0|3,0,0]=4 612 B5R0.1 C[S+](C)CCCl MCULE-1305595131 [1,0,0,0,0,0|3,0,0]=4 613 B5R0.1 C[S+](C)CCCl MCULE-9761617787 [1,0,0,0,0,0|3,0,0]=4 614 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [1,0,0,0,0,0|2,0,0]=3 615 B5R0.1 N#CCC(=O)Cl MCULE-7971055738 [1,0,0,0,0,0|2,0,1]=4 616 B5R0.1 N#CCC(=O)N MCULE-8538286230 [1,0,0,0,0,0|2,0,1]=4 617 B5R0.1 N#CCC(=O)O MCULE-3440765061 [1,0,0,0,0,0|2,0,1]=4 618 B5R0.1 N#CCC(=O)[O-] MCULE-2598625909 [1,0,0,0,0,0|2,0,1]=4 619 B5R0.1 N#CCC(=O)[O-] MCULE-3532110520 [1,0,0,0,0,0|2,0,1]=4 620 B5R0.1 N=C(N)CCCl MCULE-2314996365 [1,0,0,0,0,0|3,0,0]=4 621 B5R0.1 N=C(N)CCCl MCULE-3129838313 [1,0,0,0,0,0|3,0,0]=4 622 B5R0.1 N=C(N)CCO MCULE-4567824707 [1,0,0,0,0,0|3,0,0]=4 623 B5R0.1 N=C(N)CCO MCULE-7139693715 [1,0,0,0,0,0|3,0,0]=4 624 B5R0.1 NC(=O)CCBr MCULE-3930714776 [1,0,0,0,0,0|2,0,0]=3 625 B5R0.1 NC(=O)CCCl MCULE-8300320959 [1,0,0,0,0,0|2,0,0]=3 626 B5R0.1 NC(=O)CCO MCULE-4026170350 [1,0,0,0,0,0|2,0,0]=3 627 B5R0.1 NC(=O)CCS MCULE-7451827717 [1,0,0,0,0,0|2,0,0]=3 628 B5R0.1 NC(=O)NCO MCULE-7403641101 [1,0,0,0,0,0|3,0,0]=4 629 B5R0.1 NCCC(=O)Cl MCULE-1298355499 [1,0,0,0,0,0|2,0,0]=3 630 B5R0.1 NCCC(=O)N MCULE-2899414135 [1,0,0,0,0,0|2,0,0]=3 631 B5R0.1 NCCC(=O)N MCULE-6993286668 [1,0,0,0,0,0|2,0,0]=3 632 B5R0.1 NCCC(=O)O MCULE-1344289084 [1,0,0,0,0,0|2,0,0]=3 633 B5R0.1 NCCC(=O)O MCULE-2298605337 [1,0,0,0,0,0|2,0,0]=3 634 B5R0.1 NCCC(=O)O MCULE-9375577631 [1,0,0,0,0,0|2,0,0]=3 635 B5R0.1 NCCC(=O)[O-] MCULE-2492250086 [1,0,0,0,0,0|2,0,0]=3 636 B5R0.1 NCCN(=O)=O MCULE-8137427440 [1,0,0,0,0,0|3,0,0]=4 637 B5R0.1 NCCP(=O)O MCULE-7093964616 [1,0,0,0,0,0|3,0,0]=4 638 B5R0.1 NCCS(=O)O MCULE-4372248641 [1,0,0,0,0,0|3,0,0]=4 639 B5R0.1 NNCC(=O)N MCULE-2794619708 [1,0,0,0,0,0|3,0,0]=4 640 B5R0.1 NNCC(=O)N MCULE-6773156087 [1,0,0,0,0,0|3,0,0]=4 641 B5R0.1 NNCC(=O)O MCULE-4908184724 [1,0,0,0,0,0|3,0,0]=4 642 B5R0.1 NNCC(=O)O MCULE-6315598774 [1,0,0,0,0,0|3,0,0]=4 643 B5R0.1 NOCC(=O)O MCULE-4566186819 [1,0,0,0,0,0|3,0,0]=4 644 B5R0.1 NOCC(=O)O MCULE-4824237418 [1,0,0,0,0,0|3,0,0]=4 645 B5R0.1 NOCC(=O)O MCULE-8132180423 [1,0,0,0,0,0|3,0,0]=4 646 B5R0.1 O=C(Cl)CCBr MCULE-4659506608 [1,0,0,0,0,0|2,0,0]=3 647 B5R0.1 O=C(Cl)CCCl MCULE-3313924878 [1,0,0,0,0,0|2,0,0]=3 648 B5R0.1 O=C(Cl)CCF MCULE-3316397790 [1,0,0,0,0,0|2,0,0]=3 649 B5R0.1 O=C(Cl)OCCl MCULE-2130588147 [1,0,0,0,0,0|2,0,0]=3 650 B5R0.1 O=C(O)CCBr MCULE-2816055853 [1,0,0,0,0,0|2,0,0]=3 651 B5R0.1 O=C(O)CCCl MCULE-8511144183 [1,0,0,0,0,0|2,0,0]=3 652 B5R0.1 O=C(O)CCF MCULE-4382025684 [1,0,0,0,0,0|2,0,0]=3 653 B5R0.1 O=C(O)CCI MCULE-3371354708 [1,0,0,0,0,0|2,0,0]=3 654 B5R0.1 O=C(O)CCO MCULE-3428604829 [1,0,0,0,0,0|2,0,0]=3 655 B5R0.1 O=C(O)CCS MCULE-3211932163 [1,0,0,0,0,0|2,0,0]=3 656 B5R0.1 O=C(O)CNO MCULE-4437067339 [1,0,0,0,0,0|3,0,0]=4 657 B5R0.1 O=C([O-])CCO MCULE-4429611588 [1,0,0,0,0,0|2,0,0]=3 658 B5R0.1 O=N(=O)CCO MCULE-2060841405 [1,0,0,0,0,0|3,0,0]=4 659 B5R0.1 O=N(=O)CCS MCULE-4845430658 [1,0,0,0,0,0|3,0,0]=4 660 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [1,0,0,0,0,0|0,0,2]=3 661 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [1,0,0,0,0,0|1,0,2]=4 662 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [1,0,0,0,0,0|0,0,2]=3 663 B5R0.2 C#CCCC=O MCULE-9994552907 [1,0,0,0,0,0|1,0,2]=4 664 B5R0.2 C#CCCCC MCULE-5706969297 [1,0,0,0,0,0|1,0,2]=4 665 B5R0.2 C#CCOCC MCULE-1055202735 [1,0,0,0,0,0|0,0,3]=4 666 B5R0.2 C/C=C/C=C/C MCULE-9400628806 [1,0,0,0,0,0|1,0,2]=4 667 B5R0.2 C/C=C/CC#N MCULE-3707973146 [1,0,0,0,0,0|2,0,1]=4 668 B5R0.2 C/C=C/CCC MCULE-9851656818 [1,0,0,0,0,0|1,0,0]=2 669 B5R0.2 C/C=C/CCO MCULE-3952855392 [1,0,0,0,0,0|2,0,0]=3 670 B5R0.2 C/C=C/OCC MCULE-2891896400 [1,0,0,0,0,0|2,0,0]=3 671 B5R0.2 C/C=C\CCC MCULE-1013657748 [1,0,0,0,0,0|1,0,0]=2 672 B5R0.2 C=C/C=C/CC MCULE-5996202716 [1,0,0,0,0,0|1,0,2]=4 673 B5R0.2 C=CC/C=C/C MCULE-8732875285 [1,0,0,0,0,0|1,0,2]=4 674 B5R0.2 C=CCC=CC MCULE-8643449832 [1,0,0,0,0,0|1,0,2]=4 675 B5R0.2 C=CCCC=O MCULE-7850336174 [1,0,0,0,0,0|1,0,2]=4 676 B5R0.2 C=CCCCBr MCULE-5027518679 [1,0,0,0,0,0|2,0,1]=4 677 B5R0.2 C=CCCCC MCULE-4750698031 [1,0,0,0,0,0|1,0,1]=3 678 B5R0.2 C=CCCCCl MCULE-3877430809 [1,0,0,0,0,0|2,0,1]=4 679 B5R0.2 C=CCCCI MCULE-8692831514 [1,0,0,0,0,0|2,0,1]=4 680 B5R0.2 C=CCCCN MCULE-5787926547 [1,0,0,0,0,0|2,0,1]=4 681 B5R0.2 C=CCCCN MCULE-7346989227 [1,0,0,0,0,0|2,0,1]=4 682 B5R0.2 C=CCCCO MCULE-5946342321 [1,0,0,0,0,0|2,0,1]=4 683 B5R0.2 C=CCCNC MCULE-2124263362 [1,0,0,0,0,0|2,0,1]=4 684 B5R0.2 C=CCCNC MCULE-5024925990 [1,0,0,0,0,0|2,0,1]=4 685 B5R0.2 C=CCCOC MCULE-4681354270 [1,0,0,0,0,0|2,0,1]=4 686 B5R0.2 C=CCNC=O MCULE-1911798514 [1,0,0,0,0,0|1,0,2]=4 687 B5R0.2 C=CCNCC MCULE-6987567673 [1,0,0,0,0,0|2,0,1]=4 688 B5R0.2 C=CCNCC MCULE-8318544337 [1,0,0,0,0,0|2,0,1]=4 689 B5R0.2 C=CCOC=C MCULE-7085070702 [1,0,0,0,0,0|0,0,3]=4 690 B5R0.2 C=CCOC=O MCULE-4161785970 [1,0,0,0,0,0|0,0,2]=3 691 B5R0.2 C=CCOCC MCULE-4363356618 [1,0,0,0,0,0|0,0,3]=4 692 B5R0.2 C=CCONC MCULE-4537899476 [1,0,0,0,0,0|1,0,2]=4 693 B5R0.2 C=CCONC MCULE-9645204142 [1,0,0,0,0,0|1,0,2]=4 694 B5R0.2 C=CCSCC MCULE-3816911529 [1,0,0,0,0,0|2,0,1]=4 695 B5R0.2 C=COCCC MCULE-4423853666 [1,0,0,0,0,0|0,0,1]=2 696 B5R0.2 C=COCCCl MCULE-7782311030 [1,0,0,0,0,0|1,0,1]=3 697 B5R0.2 C=COCCN MCULE-8052872924 [1,0,0,0,0,0|1,0,1]=3 698 B5R0.2 C=COCCN MCULE-8496820259 [1,0,0,0,0,0|1,0,1]=3 699 B5R0.2 C=COCCO MCULE-9383372818 [1,0,0,0,0,0|1,0,1]=3 700 B5R0.2 CC#CCC=O MCULE-6071390808 [1,0,0,0,0,0|1,0,2]=4 701 B5R0.2 CC#CCCBr MCULE-5650557113 [1,0,0,0,0,0|2,0,1]=4 702 B5R0.2 CC#CCCC MCULE-8179328151 [1,0,0,0,0,0|1,0,1]=3 703 B5R0.2 CC#CCCN MCULE-2130545109 [1,0,0,0,0,0|2,0,1]=4 704 B5R0.2 CC#CCCN MCULE-7156357315 [1,0,0,0,0,0|2,0,1]=4 705 B5R0.2 CC#CCCO MCULE-9400138491 [1,0,0,0,0,0|2,0,1]=4 706 B5R0.2 CC#CCNC MCULE-3549759323 [1,0,0,0,0,0|2,0,1]=4 707 B5R0.2 CC#CCNC MCULE-7250319597 [1,0,0,0,0,0|2,0,1]=4 708 B5R0.2 CC/C=C/C=O MCULE-5102906061 [1,0,0,0,0,0|1,0,1]=3 709 B5R0.2 CC/C=C/CC MCULE-6762040186 [1,0,0,0,0,0|1,0,2]=4 710 B5R0.2 CC/C=C\CC MCULE-9418110460 [1,0,0,0,0,0|1,0,2]=4 711 B5R0.2 CC=CC=CC MCULE-7702675183 [1,0,0,0,0,0|1,0,2]=4 712 B5R0.2 CC=CCC#N MCULE-6960681395 [1,0,0,0,0,0|2,0,1]=4 713 B5R0.2 CC=CCCBr MCULE-7329159278 [1,0,0,0,0,0|2,0,0]=3 714 B5R0.2 CC=CCCC MCULE-8736231124 [1,0,0,0,0,0|1,0,0]=2 715 B5R0.2 CC=CCCN MCULE-5129102475 [1,0,0,0,0,0|2,0,0]=3 716 B5R0.2 CC=CCCN MCULE-8500001929 [1,0,0,0,0,0|2,0,0]=3 717 B5R0.2 CC=CCCO MCULE-4302367089 [1,0,0,0,0,0|2,0,0]=3 718 B5R0.2 CC=COCC MCULE-1473170404 [1,0,0,0,0,0|2,0,0]=3 719 B5R0.2 CC=CSSC MCULE-2442770677 [1,0,0,0,0,0|3,0,0]=4 720 B5R0.2 CCC#CC=O MCULE-3889262436 [1,0,0,0,0,0|1,0,1]=3 721 B5R0.2 CCC#CCC MCULE-2027962178 [1,0,0,0,0,0|1,0,2]=4 722 B5R0.2 CCC=CC=O MCULE-1318250395 [1,0,0,0,0,0|1,0,1]=3 723 B5R0.2 CCC=CCC MCULE-5435957422 [1,0,0,0,0,0|1,0,2]=4 724 B5R0.2 CCCC#CI MCULE-5016901652 [1,0,0,0,0,0|2,0,1]=4 725 B5R0.2 CCCC=NO MCULE-7364375780 [1,0,0,0,0,0|2,0,1]=4 726 B5R0.2 CCCCC#N MCULE-4015236167 [1,0,0,0,0,0|2,0,1]=4 727 B5R0.2 CCCCC=O MCULE-4736782822 [1,0,0,0,0,0|1,0,0]=2 728 B5R0.2 CCCCCBr MCULE-8513521912 [1,0,0,0,0,0|2,0,1]=4 729 B5R0.2 CCCCCC MCULE-3465692202 [1,0,0,0,0,0|1,0,1]=3 730 B5R0.2 CCCCCCl MCULE-4412759460 [1,0,0,0,0,0|2,0,1]=4 731 B5R0.2 CCCCCF MCULE-6399883281 [1,0,0,0,0,0|2,0,1]=4 732 B5R0.2 CCCCCI MCULE-4590300793 [1,0,0,0,0,0|2,0,1]=4 733 B5R0.2 CCCCCN MCULE-3371742982 [1,0,0,0,0,0|2,0,1]=4 734 B5R0.2 CCCCCN MCULE-4371067300 [1,0,0,0,0,0|2,0,1]=4 735 B5R0.2 CCCCCN MCULE-6547961798 [1,0,0,0,0,0|2,0,1]=4 736 B5R0.2 CCCCCN MCULE-7483248760 [1,0,0,0,0,0|2,0,1]=4 737 B5R0.2 CCCCCO MCULE-8714292632 [1,0,0,0,0,0|1,0,2]=4 738 B5R0.2 CCCCCS MCULE-5476379340 [1,0,0,0,0,0|1,1,1]=4 739 B5R0.2 CCCCNC MCULE-9321610906 [1,0,0,0,0,0|2,0,0]=3 740 B5R0.2 CCCCNN MCULE-6681305566 [1,0,0,0,0,0|3,0,0]=4 741 B5R0.2 CCCCNN MCULE-6890760890 [1,0,0,0,0,0|3,0,0]=4 742 B5R0.2 CCCCNN MCULE-7362497327 [1,0,0,0,0,0|3,0,0]=4 743 B5R0.2 CCCCNN MCULE-8463623644 [1,0,0,0,0,0|3,0,0]=4 744 B5R0.2 CCCCNO MCULE-1911206569 [1,0,0,0,0,0|2,0,1]=4 745 B5R0.2 CCCCNO MCULE-3820646216 [1,0,0,0,0,0|2,0,1]=4 746 B5R0.2 CCCCOC MCULE-9814272675 [1,0,0,0,0,0|2,0,0]=3 747 B5R0.2 CCCCON MCULE-7582349983 [1,0,0,0,0,0|3,0,0]=4 748 B5R0.2 CCCCON MCULE-8175627798 [1,0,0,0,0,0|3,0,0]=4 749 B5R0.2 CCCCSC MCULE-2799775567 [1,0,0,0,0,0|2,0,0]=3 750 B5R0.2 CCCN=C=O MCULE-9014468293 [1,0,0,0,0,0|1,0,1]=3 751 B5R0.2 CCCN=C=S MCULE-7947940355 [1,0,0,0,0,0|1,1,1]=4 752 B5R0.2 CCCNC=O MCULE-6344556391 [1,0,0,0,0,0|1,0,0]=2 753 B5R0.2 CCCNCC MCULE-7948828264 [1,0,0,0,0,0|1,0,1]=3 754 B5R0.2 CCCNCC MCULE-9107549207 [1,0,0,0,0,0|1,0,1]=3 755 B5R0.2 CCCOC=O MCULE-3133604529 [1,0,0,0,0,0|0,0,0]=1 756 B5R0.2 CCCOCBr MCULE-3585683043 [1,0,0,0,0,0|1,0,1]=3 757 B5R0.2 CCCOCC MCULE-9971916790 [1,0,0,0,0,0|0,0,1]=2 758 B5R0.2 CCCOCCl MCULE-1932627202 [1,0,0,0,0,0|1,0,1]=3 759 B5R0.2 CCCSC#N MCULE-9018157774 [1,0,0,0,0,0|1,1,1]=4 760 B5R0.2 CCCSCC MCULE-4547385568 [1,0,0,0,0,0|0,1,1]=3 761 B5R0.2 CCCSSC MCULE-3127072032 [1,0,0,0,0,0|1,1,0]=3 762 B5R0.2 CCNCCCl MCULE-2589770119 [1,0,0,0,0,0|2,0,1]=4 763 B5R0.2 CCNCCCl MCULE-3098032672 [1,0,0,0,0,0|2,0,1]=4 764 B5R0.2 CCNCCN MCULE-7854769899 [1,0,0,0,0,0|2,0,1]=4 765 B5R0.2 CCNCCO MCULE-2537734730 [1,0,0,0,0,0|2,0,1]=4 766 B5R0.2 CCNCCO MCULE-3738714907 [1,0,0,0,0,0|2,0,1]=4 767 B5R0.2 CCNNCC MCULE-4789314801 [1,0,0,0,0,0|2,0,1]=4 768 B5R0.2 CCNNCC MCULE-9060220585 [1,0,0,0,0,0|2,0,1]=4 769 B5R0.2 CCO/C=C\Br MCULE-7396084973 [1,0,0,0,0,0|3,0,0]=4 770 B5R0.2 CCOC=CBr MCULE-5241125671 [1,0,0,0,0,0|3,0,0]=4 771 B5R0.2 CCOCC#N MCULE-6709940440 [1,0,0,0,0,0|1,0,2]=4 772 B5R0.2 CCOCCBr MCULE-4818900555 [1,0,0,0,0,0|1,0,1]=3 773 B5R0.2 CCOCCCl MCULE-1290576729 [1,0,0,0,0,0|1,0,1]=3 774 B5R0.2 CCOCCI MCULE-1833092968 [1,0,0,0,0,0|1,0,1]=3 775 B5R0.2 CCOCCN MCULE-1254431240 [1,0,0,0,0,0|1,0,1]=3 776 B5R0.2 CCOCCN MCULE-4039110889 [1,0,0,0,0,0|1,0,1]=3 777 B5R0.2 CCOCCN MCULE-4400456933 [1,0,0,0,0,0|1,0,1]=3 778 B5R0.2 CCOCCO MCULE-4311513289 [1,0,0,0,0,0|1,0,1]=3 779 B5R0.2 CCOCCS MCULE-3968740645 [1,0,0,0,0,0|1,0,1]=3 780 B5R0.2 CCSCC=O MCULE-8069035019 [1,0,0,0,0,0|2,0,0]=3 781 B5R0.2 CCSCCBr MCULE-9449933342 [1,0,0,0,0,0|1,1,1]=4 782 B5R0.2 CCSCCCl MCULE-4057847237 [1,0,0,0,0,0|1,1,1]=4 783 B5R0.2 CCSCCN MCULE-3375644872 [1,0,0,0,0,0|1,1,1]=4 784 B5R0.2 CCSCCN MCULE-4466279976 [1,0,0,0,0,0|1,1,1]=4 785 B5R0.2 CCSCCO MCULE-3557086162 [1,0,0,0,0,0|1,1,1]=4 786 B5R0.2 CCSCCS MCULE-4583054157 [1,0,0,0,0,0|1,1,1]=4 787 B5R0.2 CCSSCC MCULE-7989926475 [1,0,0,0,0,0|1,1,1]=4 788 B5R0.2 CC[Se][Se]CC MCULE-2725282576 [1,0,0,0,0,0|1,1,1]=4 789 B5R0.2 CNCCCBr MCULE-3376600253 [1,0,0,0,0,0|3,0,0]=4 790 B5R0.2 CNCCCBr MCULE-6212326106 [1,0,0,0,0,0|3,0,0]=4 791 B5R0.2 CNCCCCl MCULE-1007719210 [1,0,0,0,0,0|3,0,0]=4 792 B5R0.2 CNCCCCl MCULE-6146901643 [1,0,0,0,0,0|3,0,0]=4 793 B5R0.2 CNCCCF MCULE-7647417887 [1,0,0,0,0,0|3,0,0]=4 794 B5R0.2 CNCCCN MCULE-1736081896 [1,0,0,0,0,0|3,0,0]=4 795 B5R0.2 CNCCCO MCULE-9530478547 [1,0,0,0,0,0|3,0,0]=4 796 B5R0.2 CNCCNC MCULE-1378979868 [1,0,0,0,0,0|3,0,0]=4 797 B5R0.2 CNCCNC MCULE-3281508478 [1,0,0,0,0,0|3,0,0]=4 798 B5R0.2 CNCCOC MCULE-2857904484 [1,0,0,0,0,0|3,0,0]=4 799 B5R0.2 CNCCOC MCULE-5342712496 [1,0,0,0,0,0|3,0,0]=4 800 B5R0.2 CNCCSC MCULE-2812984399 [1,0,0,0,0,0|3,0,0]=4 801 B5R0.2 CNCCSC MCULE-2942435951 [1,0,0,0,0,0|3,0,0]=4 802 B5R0.2 CNOCCN MCULE-3163962093 [1,0,0,0,0,0|2,0,0]=3 803 B5R0.2 CNOCCN MCULE-7379538500 [1,0,0,0,0,0|2,0,0]=3 804 B5R0.2 COCCC=O MCULE-2812117208 [1,0,0,0,0,0|2,0,0]=3 805 B5R0.2 COCCCBr MCULE-6489536401 [1,0,0,0,0,0|3,0,0]=4 806 B5R0.2 COCCCCl MCULE-9192274624 [1,0,0,0,0,0|3,0,0]=4 807 B5R0.2 COCCCF MCULE-5055725246 [1,0,0,0,0,0|3,0,0]=4 808 B5R0.2 COCCCI MCULE-9111605439 [1,0,0,0,0,0|3,0,0]=4 809 B5R0.2 COCCCN MCULE-1421362990 [1,0,0,0,0,0|3,0,0]=4 810 B5R0.2 COCCCN MCULE-4783132205 [1,0,0,0,0,0|3,0,0]=4 811 B5R0.2 COCCCO MCULE-4041418048 [1,0,0,0,0,0|3,0,0]=4 812 B5R0.2 COCCCS MCULE-2371333731 [1,0,0,0,0,0|3,0,0]=4 813 B5R0.2 COCCOC MCULE-7572196731 [1,0,0,0,0,0|3,0,0]=4 814 B5R0.2 COCCSC MCULE-5362054021 [1,0,0,0,0,0|3,0,0]=4 815 B5R0.2 COCN=C=O MCULE-6951734265 [1,0,0,0,0,0|2,0,1]=4 816 B5R0.2 CONCCN MCULE-3332727097 [1,0,0,0,0,0|3,0,0]=4 817 B5R0.2 CONCCN MCULE-5066538639 [1,0,0,0,0,0|3,0,0]=4 818 B5R0.2 CONCCO MCULE-9787830121 [1,0,0,0,0,0|3,0,0]=4 819 B5R0.2 CSCCC=O MCULE-6273241704 [1,0,0,0,0,0|2,0,0]=3 820 B5R0.2 CSCCCBr MCULE-8399851816 [1,0,0,0,0,0|3,0,0]=4 821 B5R0.2 CSCCCCl MCULE-1829120476 [1,0,0,0,0,0|3,0,0]=4 822 B5R0.2 CSCCCN MCULE-1030938424 [1,0,0,0,0,0|3,0,0]=4 823 B5R0.2 CSCCCN MCULE-4664984921 [1,0,0,0,0,0|3,0,0]=4 824 B5R0.2 CSCCCO MCULE-9232413185 [1,0,0,0,0,0|3,0,0]=4 825 B5R0.2 CSCCCS MCULE-8405766359 [1,0,0,0,0,0|3,0,0]=4 826 B5R0.2 CSSCCN MCULE-7065189564 [1,0,0,0,0,0|2,1,0]=4 827 B5R0.2 CSSCCN MCULE-8654200268 [1,0,0,0,0,0|2,1,0]=4 828 B5R0.2 ClCCOCCl MCULE-7585684590 [1,0,0,0,0,0|2,0,1]=4 829 B5R0.2 ClCOCCBr MCULE-6843473950 [1,0,0,0,0,0|2,0,1]=4 830 B5R0.2 N#CCCC=O MCULE-9521735106 [1,0,0,0,0,0|2,0,1]=4 831 B5R0.2 N#CCOC=O MCULE-4453241991 [1,0,0,0,0,0|1,0,1]=3 832 B5R0.2 O=C=NCCBr MCULE-9707894644 [1,0,0,0,0,0|2,0,1]=4 833 B5R0.2 O=C=NCCCl MCULE-8919918461 [1,0,0,0,0,0|2,0,1]=4 834 B5R0.2 O=CCCC=O MCULE-3362810468 [1,0,0,0,0,0|2,0,1]=4 835 B5R0.2 O=CCCC=O MCULE-3813951568 [1,0,0,0,0,0|2,0,1]=4 836 B5R0.2 O=CCCCBr MCULE-7239613396 [1,0,0,0,0,0|2,0,0]=3 837 B5R0.2 O=CCCCCl MCULE-3011225716 [1,0,0,0,0,0|2,0,0]=3 838 B5R0.2 O=CCCCI MCULE-3153720790 [1,0,0,0,0,0|2,0,0]=3 839 B5R0.2 O=CCCCO MCULE-8728420992 [1,0,0,0,0,0|2,0,0]=3 840 B5R0.2 O=CNCCO MCULE-3688614090 [1,0,0,0,0,0|2,0,0]=3 841 B5R0.2 O=COCCO MCULE-1922672843 [1,0,0,0,0,0|1,0,0]=2 842 B5R0.2 OC=CCCBr MCULE-3964604828 [1,0,0,0,0,0|2,0,1]=4 843 B5R0.2 OC=CCCBr MCULE-5728835735 [1,0,0,0,0,0|2,0,1]=4 844 B7R0.2 C(O)(CN)CC(=O)O MCULE-8378388788 [0,1,0,0,0,0|3,0,0]=4 845 B7R0.2 C=C(C#N)OC(=O)C MCULE-8738842712 [0,1,0,0,0,0|1,0,2]=4 846 B7R0.2 C=C(C)CC(C)CC MCULE-1001667584 [0,1,0,0,0,0|2,0,0]=3 847 B7R0.2 C=C(C)CC(N)CO MCULE-9114906744 [0,1,0,0,0,0|3,0,0]=4 848 B7R0.2 C=CC(C)OC(=O)C MCULE-9221300039 [0,1,0,0,0,0|0,0,2]=3 849 B7R0.2 CC(=O)NC(=O)CBr MCULE-3222708274 [0,1,0,0,0,0|2,0,1]=4 850 B7R0.2 CC(=O)NC(C)CN MCULE-4226474809 [0,1,0,0,0,0|2,0,0]=3 851 B7R0.2 CC(=O)NC(C)CN MCULE-7570690280 [0,1,0,0,0,0|2,0,0]=3 852 B7R0.2 CC(=O)NC(C)CO MCULE-9455210462 [0,1,0,0,0,0|2,0,0]=3 853 B7R0.2 CC(=O)N[C@H](C)CO MCULE-2174899443 [0,1,0,0,0,0|2,0,0]=3 854 B7R0.2 CC(=O)N[C@H](C)CO MCULE-5097293473 [0,1,0,0,0,0|2,0,0]=3 855 B7R0.2 CC(=O)OC(Br)CBr MCULE-7215936142 [0,1,0,0,0,0|1,0,0]=2 856 B7R0.2 CC(CCl)CC(=O)Cl MCULE-3163826919 [0,1,0,0,0,0|3,0,0]=4 857 B7R0.2 CC(CCl)OC(=O)N MCULE-7734729292 [0,1,0,0,0,0|2,0,0]=3 858 B7R0.2 CC(CN)CC(=O)O MCULE-1594242184 [0,1,0,0,0,0|3,0,0]=4 859 B7R0.2 CC(CN)CC(=O)O MCULE-8074816359 [0,1,0,0,0,0|3,0,0]=4 860 B7R0.2 CCC(=CC(=O)O)C MCULE-3864767099 [0,1,0,0,0,0|2,0,1]=4 861 B7R0.2 CCC(=O)CC(=O)C MCULE-1892470405 [0,1,0,0,0,0|1,0,1]=3 862 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [0,1,0,0,0,0|2,0,1]=4 863 B7R0.2 CCC(=O)OC(=O)C MCULE-8264492254 [0,1,0,0,0,0|0,0,1]=2 864 B7R0.2 CCC(=O)OC(C)C MCULE-6546381101 [0,1,0,0,0,0|1,0,2]=4 865 B7R0.2 CCC(C)CC(=N)N MCULE-6434778899 [0,1,0,0,0,0|3,0,0]=4 866 B7R0.2 CCC(C)CC(=N)N MCULE-7964734356 [0,1,0,0,0,0|3,0,0]=4 867 B7R0.2 CCC(C)CC(=O)C MCULE-5801548800 [0,1,0,0,0,0|1,0,0]=2 868 B7R0.2 CCC(C)CC(=O)Cl MCULE-3063561496 [0,1,0,0,0,0|2,0,0]=3 869 B7R0.2 CCC(C)CC(=O)O MCULE-3409782202 [0,1,0,0,0,0|2,0,0]=3 870 B7R0.2 CCC(C)CC(=O)O MCULE-6537278030 [0,1,0,0,0,0|2,0,0]=3 871 B7R0.2 CCC(C)CC(C)C MCULE-9492683095 [0,1,0,0,0,0|2,0,1]=4 872 B7R0.2 CCC(C)CC(C)N MCULE-2633957870 [0,1,0,0,0,0|2,0,1]=4 873 B7R0.2 CCC(C)CC(C)N MCULE-5740038174 [0,1,0,0,0,0|2,0,1]=4 874 B7R0.2 CCC(C)NC(=O)N MCULE-6186330882 [0,1,0,0,0,0|2,0,0]=3 875 B7R0.2 CCC(C)NC(=S)N MCULE-8856391382 [0,1,0,0,0,0|2,1,0]=4 876 B7R0.2 CCC(C)OC(=O)C MCULE-8410375215 [0,1,0,0,0,0|0,0,0]=1 877 B7R0.2 CCC(C)OC(=O)Cl MCULE-1512790698 [0,1,0,0,0,0|1,0,0]=2 878 B7R0.2 CCC(C)SC(=O)Cl MCULE-4681925921 [0,1,0,0,0,0|1,1,0]=3 879 B7R0.2 CCC(N)CC(=O)O MCULE-1744910444 [0,1,0,0,0,0|2,0,0]=3 880 B7R0.2 CCC(N)CC(=O)O MCULE-5610499925 [0,1,0,0,0,0|2,0,0]=3 881 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [0,1,0,0,0,0|1,0,2]=4 882 B7R0.2 CCC(N)CN(C)C MCULE-7794272438 [0,1,0,0,0,0|3,0,0]=4 883 B7R0.2 CCC(O)CC(=O)C MCULE-1222748729 [0,1,0,0,0,0|1,0,0]=2 884 B7R0.2 CCC(O)CC(=O)O MCULE-4663578527 [0,1,0,0,0,0|2,0,0]=3 885 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [0,1,0,0,0,0|1,0,2]=4 886 B7R0.2 CCC(O)CN(=O)=O MCULE-6965491054 [0,1,0,0,0,0|3,0,0]=4 887 B7R0.2 CCC(O)CN(C)C MCULE-5823673760 [0,1,0,0,0,0|3,0,0]=4 888 B7R0.2 CCN(C)CC(=O)C MCULE-5302720081 [0,1,0,0,0,0|2,0,0]=3 889 B7R0.2 CCN(C)CC(=O)C MCULE-7283054437 [0,1,0,0,0,0|2,0,0]=3 890 B7R0.2 CCN(C)CC(=O)O MCULE-3102395413 [0,1,0,0,0,0|3,0,0]=4 891 B7R0.2 CCS(=O)CC(=O)O MCULE-5648298475 [0,1,0,0,0,0|3,0,0]=4 892 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-5550070887 [0,1,0,0,0,0|2,0,0]=3 893 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-9572363620 [0,1,0,0,0,0|2,0,0]=3 894 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-1158271004 [0,1,0,0,0,0|2,0,0]=3 895 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-2354820947 [0,1,0,0,0,0|2,0,0]=3 896 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-4284161835 [0,1,0,0,0,0|2,0,0]=3 897 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-9523089766 [0,1,0,0,0,0|2,0,0]=3 898 B7R0.2 CC[C@@H](N)CN(C)C MCULE-4272885891 [0,1,0,0,0,0|3,0,0]=4 899 B7R0.2 CC[C@@H](N)CN(C)C MCULE-8695009794 [0,1,0,0,0,0|3,0,0]=4 900 B7R0.2 CC[C@H](C)CC(=O)O MCULE-4177365854 [0,1,0,0,0,0|2,0,0]=3 901 B7R0.2 CC[C@H](C)CC(=O)O MCULE-5173108207 [0,1,0,0,0,0|2,0,0]=3 902 B7R0.2 CC[C@H](N)CC(=O)O MCULE-1463536674 [0,1,0,0,0,0|2,0,0]=3 903 B7R0.2 CC[C@H](N)CC(=O)O MCULE-2865599647 [0,1,0,0,0,0|2,0,0]=3 904 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4506847599 [0,1,0,0,0,0|2,0,0]=3 905 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4819674539 [0,1,0,0,0,0|2,0,0]=3 906 B7R0.2 CC[C@H](N)CN(C)C MCULE-4335497059 [0,1,0,0,0,0|3,0,0]=4 907 B7R0.2 CC[C@H](N)CN(C)C MCULE-5607250734 [0,1,0,0,0,0|3,0,0]=4 908 B7R0.2 CNC(=CC(=O)C)C MCULE-1943688292 [0,1,0,0,0,0|2,0,1]=4 909 B7R0.2 CNC(=O)CC(=O)C MCULE-4316009681 [0,1,0,0,0,0|2,0,1]=4 910 B7R0.2 CNC(=O)NC(=O)C MCULE-9100713966 [0,1,0,0,0,0|2,0,1]=4 911 B7R0.2 CNC(C)CC(=O)N MCULE-1474658720 [0,1,0,0,0,0|3,0,0]=4 912 B7R0.2 CNC(C)CC(=O)N MCULE-4481385519 [0,1,0,0,0,0|3,0,0]=4 913 B7R0.2 CNC(C)CC(=O)O MCULE-6592893730 [0,1,0,0,0,0|3,0,0]=4 914 B7R0.2 CNC(C)CC(=O)O MCULE-7655437452 [0,1,0,0,0,0|3,0,0]=4 915 B7R0.2 CNC(C)CS(=O)C MCULE-5598071425 [0,1,0,0,0,0|3,0,0]=4 916 B7R0.2 COC(=CC(=O)C)C MCULE-1939113485 [0,1,0,0,0,0|2,0,1]=4 917 B7R0.2 COC(=O)CC(=O)C MCULE-1265364784 [0,1,0,0,0,0|2,0,1]=4 918 B7R0.2 COC(C)CC(=O)O MCULE-7063015720 [0,1,0,0,0,0|3,0,0]=4 919 B7R0.2 CSC(C)CC(=O)O MCULE-7827833531 [0,1,0,0,0,0|3,0,0]=4 920 B7R0.2 C[C@H](CN)CC(=O)O MCULE-4808630217 [0,1,0,0,0,0|3,0,0]=4 921 B7R0.2 C[C@H](CN)CC(=O)O MCULE-5474405940 [0,1,0,0,0,0|3,0,0]=4 922 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [0,1,0,0,0,0|3,0,0]=4 923 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [0,1,0,0,0,0|3,0,0]=4 924 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [0,1,0,0,0,0|3,0,0]=4 925 B7R0.2 NCC(N)CC(=O)O MCULE-5523883615 [0,1,0,0,0,0|3,0,0]=4 926 B7R0.2 NCC(N)CC(=O)O MCULE-7594259237 [0,1,0,0,0,0|3,0,0]=4 927 B7R0.2 NCC(O)CC(=O)O MCULE-9221352157 [0,1,0,0,0,0|3,0,0]=4 928 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-6348974465 [0,1,0,0,0,0|3,0,0]=4 929 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-9397628218 [0,1,0,0,0,0|3,0,0]=4 930 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-2174350055 [0,1,0,0,0,0|3,0,0]=4 931 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-8177708130 [0,1,0,0,0,0|3,0,0]=4 932 B7R0.2 NC[C@H](N)CC(=O)O MCULE-6133569516 [0,1,0,0,0,0|3,0,0]=4 933 B7R0.2 NC[C@H](N)CC(=O)O MCULE-7098533469 [0,1,0,0,0,0|3,0,0]=4 934 B7R0.2 NC[C@H](O)CC(=O)O MCULE-6634973995 [0,1,0,0,0,0|3,0,0]=4 935 B7R0.2 NC[C@H](O)CC(=O)O MCULE-8055679819 [0,1,0,0,0,0|3,0,0]=4 936 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [0,1,0,0,0,0|3,0,0]=4 937 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [0,1,0,0,0,0|3,0,0]=4 938 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [0,1,0,0,0,0|3,0,0]=4 939 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [0,1,0,0,0,0|3,0,0]=4 940 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [0,1,0,0,0,0|3,0,0]=4 941 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [0,1,0,0,0,0|3,0,0]=4 942 B7R0.2 O=C([O-])CC(O)CO MCULE-5202762172 [0,1,0,0,0,0|3,0,0]=4 943 B7R0.2 O=C([O-])CC(O)CO MCULE-6219855770 [0,1,0,0,0,0|3,0,0]=4 944 B7R0.2 [NH3+][C@H](CO)CC(=O)[O-] MCULE-5131942851 [0,1,0,0,0,0|3,0,0]=4 945 B7R0.3 C#CCCC(=O)OC MCULE-8778440511 [0,1,0,0,0,0|1,0,2]=4 946 B7R0.3 C#CCNC(=O)CBr MCULE-4982494323 [0,1,0,0,0,0|1,0,2]=4 947 B7R0.3 C#CCNC(=O)CC MCULE-2258533582 [0,1,0,0,0,0|1,0,2]=4 948 B7R0.3 C#CCNC(=O)CCl MCULE-8014837574 [0,1,0,0,0,0|1,0,2]=4 949 B7R0.3 C#CCNC(=O)CI MCULE-1660068128 [0,1,0,0,0,0|1,0,2]=4 950 B7R0.3 C#CCNC(=O)CN MCULE-4492178837 [0,1,0,0,0,0|1,0,2]=4 951 B7R0.3 C#CCNC(=O)CN MCULE-7672614770 [0,1,0,0,0,0|1,0,2]=4 952 B7R0.3 C#CCNC(=O)NC MCULE-5171868572 [0,1,0,0,0,0|1,0,2]=4 953 B7R0.3 C#CCNC(=O)OC MCULE-3058580094 [0,1,0,0,0,0|1,0,2]=4 954 B7R0.3 C#CCOC(=O)C=C MCULE-7867773841 [0,1,0,0,0,0|0,0,3]=4 955 B7R0.3 C#CCOC(=O)CC MCULE-9368945481 [0,1,0,0,0,0|0,0,2]=3 956 B7R0.3 C#CCOC(=O)OC MCULE-7912235498 [0,1,0,0,0,0|0,0,2]=3 957 B7R0.3 C/C=C/CC(=O)OC MCULE-7204157194 [0,1,0,0,0,0|1,0,2]=4 958 B7R0.3 C=C(C=O)CCCC MCULE-4974026399 [0,1,0,0,0,0|1,0,1]=3 959 B7R0.3 C=C(CC)CCCC MCULE-5118701402 [0,1,0,0,0,0|2,0,0]=3 960 B7R0.3 C=C(CCl)OCOC MCULE-3049043061 [0,1,0,0,0,0|2,0,0]=3 961 B7R0.3 C=CC(=O)CCCCl MCULE-7188402172 [0,1,0,0,0,0|2,0,1]=4 962 B7R0.3 C=CC(=O)NCCC MCULE-5704500398 [0,1,0,0,0,0|1,0,1]=3 963 B7R0.3 C=CC(=O)NCCN MCULE-5552021639 [0,1,0,0,0,0|2,0,1]=4 964 B7R0.3 C=CC(=O)NCCN MCULE-6417335153 [0,1,0,0,0,0|2,0,1]=4 965 B7R0.3 C=CC(=O)NCCO MCULE-2036150536 [0,1,0,0,0,0|2,0,1]=4 966 B7R0.3 C=CC(=O)OCCBr MCULE-3258133915 [0,1,0,0,0,0|1,0,1]=3 967 B7R0.3 C=CC(=O)OCCC MCULE-5292603407 [0,1,0,0,0,0|0,0,1]=2 968 B7R0.3 C=CC(=O)OCCCl MCULE-6902160724 [0,1,0,0,0,0|1,0,1]=3 969 B7R0.3 C=CC(=O)OCCF MCULE-6798260659 [0,1,0,0,0,0|1,0,1]=3 970 B7R0.3 C=CC(=O)OCCN MCULE-9056583453 [0,1,0,0,0,0|1,0,1]=3 971 B7R0.3 C=CC(=O)OCCO MCULE-3147939665 [0,1,0,0,0,0|1,0,1]=3 972 B7R0.3 C=CCCC(=O)CBr MCULE-8443541398 [0,1,0,0,0,0|1,0,2]=4 973 B7R0.3 C=CCCC(=O)CC MCULE-7933484898 [0,1,0,0,0,0|1,0,2]=4 974 B7R0.3 C=CCCC(=O)CCl MCULE-4669619111 [0,1,0,0,0,0|1,0,2]=4 975 B7R0.3 C=CCCC(=O)NC MCULE-9859680580 [0,1,0,0,0,0|1,0,2]=4 976 B7R0.3 C=CCCC(=O)OC MCULE-8671478952 [0,1,0,0,0,0|1,0,2]=4 977 B7R0.3 C=CCNC(=O)CBr MCULE-5894560132 [0,1,0,0,0,0|1,0,2]=4 978 B7R0.3 C=CCNC(=O)CCl MCULE-4830676670 [0,1,0,0,0,0|1,0,2]=4 979 B7R0.3 C=CCNC(=O)CN MCULE-8221456161 [0,1,0,0,0,0|1,0,2]=4 980 B7R0.3 C=CCNC(=O)CN MCULE-9764331326 [0,1,0,0,0,0|1,0,2]=4 981 B7R0.3 C=CCNC(=O)CO MCULE-1240234665 [0,1,0,0,0,0|1,0,2]=4 982 B7R0.3 C=CCNC(=O)CS MCULE-1040670812 [0,1,0,0,0,0|1,0,2]=4 983 B7R0.3 C=CCOC(=O)C=C MCULE-8478082091 [0,1,0,0,0,0|0,0,3]=4 984 B7R0.3 C=CCOC(=O)CBr MCULE-1915528510 [0,1,0,0,0,0|0,0,2]=3 985 B7R0.3 C=CCOC(=O)CCl MCULE-4722834512 [0,1,0,0,0,0|0,0,2]=3 986 B7R0.3 C=CCOC(=O)CI MCULE-1155914135 [0,1,0,0,0,0|0,0,2]=3 987 B7R0.3 C=CCOC(=O)CN MCULE-2053601318 [0,1,0,0,0,0|0,0,2]=3 988 B7R0.3 C=CCOC(=O)CN MCULE-8513191813 [0,1,0,0,0,0|0,0,2]=3 989 B7R0.3 C=CCOC(=O)CS MCULE-3191036289 [0,1,0,0,0,0|0,0,2]=3 990 B7R0.3 C=CCOC(=O)OC MCULE-9416609870 [0,1,0,0,0,0|0,0,2]=3 991 B7R0.3 CC#CCC(=O)OC MCULE-4727663716 [0,1,0,0,0,0|1,0,2]=4 992 B7R0.3 CC(C#N)OCCBr MCULE-3358143980 [0,1,0,0,0,0|2,0,1]=4 993 B7R0.3 CC(CBr)OCCBr MCULE-2889401501 [0,1,0,0,0,0|2,0,1]=4 994 B7R0.3 CC/C=C/C(=O)OC MCULE-5661442711 [0,1,0,0,0,0|1,0,1]=3 995 B7R0.3 CC=CCC(=O)OC MCULE-9658428283 [0,1,0,0,0,0|1,0,2]=4 996 B7R0.3 CCC(=O)CCCBr MCULE-3298679210 [0,1,0,0,0,0|2,0,0]=3 997 B7R0.3 CCC(=O)CCCCl MCULE-3397599793 [0,1,0,0,0,0|2,0,0]=3 998 B7R0.3 CCC(=O)NCCN MCULE-3384406070 [0,1,0,0,0,0|2,0,0]=3 999 B7R0.3 CCC(=O)NCCN MCULE-3992696592 [0,1,0,0,0,0|2,0,0]=3 1000 B7R0.3 CCC(=O)NCCN MCULE-4556462042 [0,1,0,0,0,0|2,0,0]=3 1001 B7R0.3 CCC(=O)NCCO MCULE-7351790148 [0,1,0,0,0,0|2,0,0]=3 1002 B7R0.3 CCC(=O)OCCCl MCULE-7825392065 [0,1,0,0,0,0|1,0,0]=2 1003 B7R0.3 CCC(=O)OCCO MCULE-6019276519 [0,1,0,0,0,0|1,0,0]=2 1004 B7R0.3 CCC(=O)OCOC MCULE-8101176829 [0,1,0,0,0,0|1,0,0]=2 1005 B7R0.3 CCC=CC(=O)OC MCULE-2390679048 [0,1,0,0,0,0|1,0,1]=3 1006 B7R0.3 CCCC/C(=N/O)/N MCULE-2186271962 [0,1,0,0,0,0|2,0,1]=4 1007 B7R0.3 CCCC=C(C)CC MCULE-4699949699 [0,1,0,0,0,0|2,0,0]=3 1008 B7R0.3 CCCCC(=N)OC MCULE-3917139857 [0,1,0,0,0,0|2,0,0]=3 1009 B7R0.3 CCCCC(=N)OC MCULE-8394549097 [0,1,0,0,0,0|2,0,0]=3 1010 B7R0.3 CCCCC(=NO)C MCULE-8239265636 [0,1,0,0,0,0|1,0,1]=3 1011 B7R0.3 CCCCC(=O)CBr MCULE-5866288227 [0,1,0,0,0,0|1,0,0]=2 1012 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [0,1,0,0,0,0|1,0,0]=2 1013 B7R0.3 CCCCC(=O)CCl MCULE-9673190063 [0,1,0,0,0,0|1,0,0]=2 1014 B7R0.3 CCCCC(=O)NC MCULE-6810865419 [0,1,0,0,0,0|1,0,0]=2 1015 B7R0.3 CCCCC(=O)NN MCULE-9535710488 [0,1,0,0,0,0|2,0,0]=3 1016 B7R0.3 CCCCC(=O)OC MCULE-8635651818 [0,1,0,0,0,0|1,0,0]=2 1017 B7R0.3 CCCCC(Br)CBr MCULE-9142273359 [0,1,0,0,0,0|2,0,1]=4 1018 B7R0.3 CCCCC(Br)CC MCULE-3813549657 [0,1,0,0,0,0|2,0,1]=4 1019 B7R0.3 CCCCC(C)CC MCULE-9471981954 [0,1,0,0,0,0|2,0,1]=4 1020 B7R0.3 CCCCC(C)NC MCULE-7492621121 [0,1,0,0,0,0|2,0,1]=4 1021 B7R0.3 CCCCC(Cl)C=O MCULE-7474969991 [0,1,0,0,0,0|2,0,1]=4 1022 B7R0.3 CCCCC(Cl)CCl MCULE-6681580076 [0,1,0,0,0,0|2,0,1]=4 1023 B7R0.3 CCCCC(N)CC MCULE-1353863738 [0,1,0,0,0,0|2,0,1]=4 1024 B7R0.3 CCCCC(N)CC MCULE-9870475040 [0,1,0,0,0,0|2,0,1]=4 1025 B7R0.3 CCCCC(N)CN MCULE-2038464943 [0,1,0,0,0,0|2,0,1]=4 1026 B7R0.3 CCCCC(N)CO MCULE-1874423109 [0,1,0,0,0,0|2,0,1]=4 1027 B7R0.3 CCCCC(N)CO MCULE-2041767659 [0,1,0,0,0,0|2,0,1]=4 1028 B7R0.3 CCCCC(N)CO MCULE-4533575851 [0,1,0,0,0,0|2,0,1]=4 1029 B7R0.3 CCCCC(N)CO MCULE-7141990411 [0,1,0,0,0,0|2,0,1]=4 1030 B7R0.3 CCCCC(O)CBr MCULE-8416535559 [0,1,0,0,0,0|1,0,2]=4 1031 B7R0.3 CCCCC(O)CC MCULE-3912386534 [0,1,0,0,0,0|1,0,2]=4 1032 B7R0.3 CCCCC(O)CN MCULE-1383380728 [0,1,0,0,0,0|1,0,2]=4 1033 B7R0.3 CCCCC(O)CO MCULE-6903923961 [0,1,0,0,0,0|1,0,2]=4 1034 B7R0.3 CCCCN(C)CC MCULE-7723007145 [0,1,0,0,0,0|3,0,0]=4 1035 B7R0.3 CCCC[C@@H](N)CO MCULE-1379297850 [0,1,0,0,0,0|2,0,1]=4 1036 B7R0.3 CCCC[C@@H](N)CO MCULE-5016786633 [0,1,0,0,0,0|2,0,1]=4 1037 B7R0.3 CCCC[C@@H](N)CO MCULE-6669873658 [0,1,0,0,0,0|2,0,1]=4 1038 B7R0.3 CCCC[C@@H](N)CO MCULE-6809294141 [0,1,0,0,0,0|2,0,1]=4 1039 B7R0.3 CCCC[C@H](C)C=O MCULE-7821873587 [0,1,0,0,0,0|1,0,1]=3 1040 B7R0.3 CCCC[C@H](N)CO MCULE-3277509271 [0,1,0,0,0,0|2,0,1]=4 1041 B7R0.3 CCCC[C@H](N)CO MCULE-5867397890 [0,1,0,0,0,0|2,0,1]=4 1042 B7R0.3 CCCNC(=O)CBr MCULE-3357000060 [0,1,0,0,0,0|1,0,0]=2 1043 B7R0.3 CCCNC(=O)CCl MCULE-3171078913 [0,1,0,0,0,0|1,0,0]=2 1044 B7R0.3 CCCNC(=O)CN MCULE-2964958967 [0,1,0,0,0,0|1,0,0]=2 1045 B7R0.3 CCCNC(=O)CN MCULE-4880764199 [0,1,0,0,0,0|1,0,0]=2 1046 B7R0.3 CCCNC(=O)NN MCULE-9369722445 [0,1,0,0,0,0|2,0,0]=3 1047 B7R0.3 CCCNC(=S)NN MCULE-3677693813 [0,1,0,0,0,0|2,1,0]=4 1048 B7R0.3 CCCNC(C)CC MCULE-8533643430 [0,1,0,0,0,0|2,0,1]=4 1049 B7R0.3 CCCNC(C)CO MCULE-6575712324 [0,1,0,0,0,0|1,0,2]=4 1050 B7R0.3 CCCOC(=O)CBr MCULE-9392658897 [0,1,0,0,0,0|0,0,0]=1 1051 B7R0.3 CCCOC(=O)CC MCULE-2749425161 [0,1,0,0,0,0|0,0,0]=1 1052 B7R0.3 CCCOC(=O)CCl MCULE-4900509903 [0,1,0,0,0,0|0,0,0]=1 1053 B7R0.3 CCCOC(=O)CN MCULE-5016724090 [0,1,0,0,0,0|0,0,0]=1 1054 B7R0.3 CCCOC(=O)CN MCULE-9899563764 [0,1,0,0,0,0|0,0,0]=1 1055 B7R0.3 CCCOC(=O)CS MCULE-7918412380 [0,1,0,0,0,0|0,0,0]=1 1056 B7R0.3 CCCOC(=O)OC MCULE-7254829881 [0,1,0,0,0,0|0,0,0]=1 1057 B7R0.3 CCCOC(C)CN MCULE-2816840734 [0,1,0,0,0,0|1,0,1]=3 1058 B7R0.3 CCCOC(C)CN MCULE-6461157704 [0,1,0,0,0,0|1,0,1]=3 1059 B7R0.3 CCNCC(=O)NC MCULE-6292959559 [0,1,0,0,0,0|2,0,0]=3 1060 B7R0.3 CCNCC(=O)OC MCULE-7988488004 [0,1,0,0,0,0|2,0,0]=3 1061 B7R0.3 CCNCC(=O)OC MCULE-9483901468 [0,1,0,0,0,0|2,0,0]=3 1062 B7R0.3 CCO/C=C(/C)\C=O MCULE-3167895853 [0,1,0,0,0,0|2,0,0]=3 1063 B7R0.3 CCO/C=C(\C)/C=O MCULE-5904529641 [0,1,0,0,0,0|2,0,0]=3 1064 B7R0.3 CCOC=C(C)C=O MCULE-8349392891 [0,1,0,0,0,0|2,0,0]=3 1065 B7R0.3 CCOCC(=O)CCl MCULE-3495077500 [0,1,0,0,0,0|2,0,0]=3 1066 B7R0.3 CCOCC(=O)NN MCULE-1157330147 [0,1,0,0,0,0|3,0,0]=4 1067 B7R0.3 CCOCC(=O)NN MCULE-3371253482 [0,1,0,0,0,0|3,0,0]=4 1068 B7R0.3 CCOCC(=O)OC MCULE-5158396979 [0,1,0,0,0,0|2,0,0]=3 1069 B7R0.3 CCONC(=O)CN MCULE-8014418978 [0,1,0,0,0,0|2,0,0]=3 1070 B7R0.3 CCONC(=O)CN MCULE-9229677559 [0,1,0,0,0,0|2,0,0]=3 1071 B7R0.3 CCSCC(=O)NN MCULE-2532030709 [0,1,0,0,0,0|3,0,0]=4 1072 B7R0.3 CCSCC(=O)OC MCULE-2538182357 [0,1,0,0,0,0|2,0,0]=3 1073 B7R0.3 CNC(=O)C=CCN MCULE-3646722223 [0,1,0,0,0,0|2,0,1]=4 1074 B7R0.3 CNC(=O)C=CCN MCULE-6988679780 [0,1,0,0,0,0|2,0,1]=4 1075 B7R0.3 CNC(=O)CCCCl MCULE-9460684794 [0,1,0,0,0,0|2,0,0]=3 1076 B7R0.3 CNC(=O)CCCN MCULE-4766031038 [0,1,0,0,0,0|2,0,0]=3 1077 B7R0.3 CNC(=O)CCCN MCULE-8992476653 [0,1,0,0,0,0|2,0,0]=3 1078 B7R0.3 CNC(=O)CCCO MCULE-2592655912 [0,1,0,0,0,0|2,0,0]=3 1079 B7R0.3 CNC(=O)CCOC MCULE-1263122933 [0,1,0,0,0,0|2,0,0]=3 1080 B7R0.3 CNC(=O)NCCN MCULE-4075769099 [0,1,0,0,0,0|2,0,0]=3 1081 B7R0.3 CNC(=O)NCCN MCULE-9668937902 [0,1,0,0,0,0|2,0,0]=3 1082 B7R0.3 CNC(=O)NCCO MCULE-7936045962 [0,1,0,0,0,0|2,0,0]=3 1083 B7R0.3 CNC(=O)OCCCl MCULE-9946450406 [0,1,0,0,0,0|1,0,0]=2 1084 B7R0.3 CNC(=O)OCCO MCULE-7181085118 [0,1,0,0,0,0|1,0,0]=2 1085 B7R0.3 CNCCC(=O)NC MCULE-1793457920 [0,1,0,0,0,0|2,0,0]=3 1086 B7R0.3 CNCCC(=O)NC MCULE-7089073664 [0,1,0,0,0,0|2,0,0]=3 1087 B7R0.3 CNCCC(=O)OC MCULE-5657949377 [0,1,0,0,0,0|2,0,0]=3 1088 B7R0.3 CNCCC(=O)OC MCULE-9145127599 [0,1,0,0,0,0|2,0,0]=3 1089 B7R0.3 CNOCC(=O)OC MCULE-1491246414 [0,1,0,0,0,0|3,0,0]=4 1090 B7R0.3 CNOCC(=O)OC MCULE-2119135006 [0,1,0,0,0,0|3,0,0]=4 1091 B7R0.3 CO/C=C/C(=O)OC MCULE-8858181328 [0,1,0,0,0,0|2,0,1]=4 1092 B7R0.3 COC(=N)CCCCl MCULE-3704020642 [0,1,0,0,0,0|3,0,0]=4 1093 B7R0.3 COC(=N)CCCCl MCULE-6282500757 [0,1,0,0,0,0|3,0,0]=4 1094 B7R0.3 COC(=O)/C=C/CBr MCULE-5511432414 [0,1,0,0,0,0|2,0,1]=4 1095 B7R0.3 COC(=O)/C=C/CN MCULE-6249542756 [0,1,0,0,0,0|2,0,1]=4 1096 B7R0.3 COC(=O)/C=C/CN MCULE-7014993899 [0,1,0,0,0,0|2,0,1]=4 1097 B7R0.3 COC(=O)/C=C\CBr MCULE-5925439397 [0,1,0,0,0,0|2,0,1]=4 1098 B7R0.3 COC(=O)C#CCN MCULE-5567960811 [0,1,0,0,0,0|2,0,1]=4 1099 B7R0.3 COC(=O)C#CCN MCULE-9518684465 [0,1,0,0,0,0|2,0,1]=4 1100 B7R0.3 COC(=O)C#CCO MCULE-5683806193 [0,1,0,0,0,0|2,0,1]=4 1101 B7R0.3 COC(=O)C=CCBr MCULE-1558782396 [0,1,0,0,0,0|2,0,1]=4 1102 B7R0.3 COC(=O)C=CCN MCULE-4573398613 [0,1,0,0,0,0|2,0,1]=4 1103 B7R0.3 COC(=O)C=CCN MCULE-4807348004 [0,1,0,0,0,0|2,0,1]=4 1104 B7R0.3 COC(=O)C=CCN MCULE-7751483147 [0,1,0,0,0,0|2,0,1]=4 1105 B7R0.3 COC(=O)CCC#N MCULE-3476013569 [0,1,0,0,0,0|2,0,1]=4 1106 B7R0.3 COC(=O)CCC=O MCULE-2572188002 [0,1,0,0,0,0|2,0,1]=4 1107 B7R0.3 COC(=O)CCCBr MCULE-3856139347 [0,1,0,0,0,0|2,0,0]=3 1108 B7R0.3 COC(=O)CCCCl MCULE-9725150748 [0,1,0,0,0,0|2,0,0]=3 1109 B7R0.3 COC(=O)CCCI MCULE-6607823615 [0,1,0,0,0,0|2,0,0]=3 1110 B7R0.3 COC(=O)CCCN MCULE-2399653885 [0,1,0,0,0,0|2,0,0]=3 1111 B7R0.3 COC(=O)CCCN MCULE-7745643244 [0,1,0,0,0,0|2,0,0]=3 1112 B7R0.3 COC(=O)CCCO MCULE-6149839873 [0,1,0,0,0,0|2,0,0]=3 1113 B7R0.3 COC(=O)CCCS MCULE-6897052882 [0,1,0,0,0,0|2,0,0]=3 1114 B7R0.3 COC(=O)CCSC MCULE-8525618169 [0,1,0,0,0,0|2,0,0]=3 1115 B7R0.3 COC(=O)NCCN MCULE-4816806580 [0,1,0,0,0,0|2,0,0]=3 1116 B7R0.3 COC(=O)NCCN MCULE-9765640123 [0,1,0,0,0,0|2,0,0]=3 1117 B7R0.3 COC(=O)NCCO MCULE-7141835204 [0,1,0,0,0,0|2,0,0]=3 1118 B7R0.3 COC=CC(=O)OC MCULE-3167643214 [0,1,0,0,0,0|2,0,1]=4 1119 B7R0.3 COCCC(=O)CCl MCULE-2918704994 [0,1,0,0,0,0|2,0,0]=3 1120 B7R0.3 COCCC(=O)NN MCULE-6895114863 [0,1,0,0,0,0|3,0,0]=4 1121 B7R0.3 COCCC(=O)OC MCULE-5918489580 [0,1,0,0,0,0|2,0,0]=3 1122 B7R0.3 COCOC(C)CO MCULE-5033492685 [0,1,0,0,0,0|1,0,2]=4 1123 B7R0.3 COCO[C@@H](C)CO MCULE-2279257941 [0,1,0,0,0,0|1,0,2]=4 1124 B7R0.3 COCO[C@H](C)CO MCULE-6639618074 [0,1,0,0,0,0|1,0,2]=4 1125 B7R0.3 COCO[C@H](C)CO MCULE-9421136678 [0,1,0,0,0,0|1,0,2]=4 1126 B7R0.3 N#CCNC(=O)CCl MCULE-3245517796 [0,1,0,0,0,0|2,0,1]=4 1127 B7R0.3 N#CCNC(=O)CN MCULE-1672566609 [0,1,0,0,0,0|2,0,1]=4 1128 B7R0.3 N#CCNC(=O)CN MCULE-7737504322 [0,1,0,0,0,0|2,0,1]=4 1129 B7R0.3 NCC(=O)NCCF MCULE-1969796129 [0,1,0,0,0,0|2,0,0]=3 1130 B7R0.3 NCC(=O)NCCF MCULE-9924478230 [0,1,0,0,0,0|2,0,0]=3 1131 B7R0.3 NCC(=O)NCCO MCULE-3809178129 [0,1,0,0,0,0|2,0,0]=3 1132 B7R0.3 NCC(=O)NCCO MCULE-7057019123 [0,1,0,0,0,0|2,0,0]=3 1133 B7R0.3 NCC(=O)OCCCl MCULE-7924059164 [0,1,0,0,0,0|1,0,0]=2 1134 B7R0.3 NCC(=O)OCCCl MCULE-9260214783 [0,1,0,0,0,0|1,0,0]=2 1135 B7R0.3 NCCNC(=O)CCl MCULE-6059411085 [0,1,0,0,0,0|2,0,0]=3 1136 B7R0.3 NCCNC(=O)CCl MCULE-7545329795 [0,1,0,0,0,0|2,0,0]=3 1137 B7R0.3 NNC(=O)CCCCl MCULE-9370062145 [0,1,0,0,0,0|3,0,0]=4 1138 B7R0.3 NNC(=O)CCCO MCULE-4131007358 [0,1,0,0,0,0|3,0,0]=4 1139 B7R0.3 NNC(=O)OCCCl MCULE-1796161427 [0,1,0,0,0,0|2,0,0]=3 1140 B7R0.3 NNC(=O)OCCCl MCULE-3977269565 [0,1,0,0,0,0|2,0,0]=3 1141 B7R0.3 NNC(=O)OCCO MCULE-9375766063 [0,1,0,0,0,0|2,0,0]=3 1142 B7R0.3 O=C(CCl)CCCCl MCULE-2362491395 [0,1,0,0,0,0|2,0,0]=3 1143 B7R0.3 O=C(CCl)NCCCl MCULE-2029189763 [0,1,0,0,0,0|2,0,0]=3 1144 B7R0.3 O=C(CCl)NCCO MCULE-2803332455 [0,1,0,0,0,0|2,0,0]=3 1145 B7R0.3 O=C(CCl)OCCCl MCULE-7706105725 [0,1,0,0,0,0|1,0,0]=2 1146 B7R0.3 O=C(CO)NCCO MCULE-8933511918 [0,1,0,0,0,0|2,0,0]=3 1147 B7R0.4 C#CCCCC(=O)C MCULE-9860822800 [0,1,0,0,0,0|1,0,1]=3 1148 B7R0.4 C#CCCCC(=O)Cl MCULE-8504740573 [0,1,0,0,0,0|2,0,1]=4 1149 B7R0.4 C#CCCCC(=O)N MCULE-3927386617 [0,1,0,0,0,0|2,0,1]=4 1150 B7R0.4 C#CCCCC(=O)O MCULE-7464892335 [0,1,0,0,0,0|2,0,1]=4 1151 B7R0.4 C#CCCNC(=O)C MCULE-2003551338 [0,1,0,0,0,0|1,0,1]=3 1152 B7R0.4 C#CCCNC(=O)N MCULE-3889590992 [0,1,0,0,0,0|2,0,1]=4 1153 B7R0.4 C#CCCOC(=O)Cl MCULE-5894719916 [0,1,0,0,0,0|1,0,1]=3 1154 B7R0.4 C#CCCOC(=O)N MCULE-4721276092 [0,1,0,0,0,0|1,0,1]=3 1155 B7R0.4 C#CCOCC(=O)O MCULE-7164718181 [0,1,0,0,0,0|1,0,2]=4 1156 B7R0.4 C#CCON=C(C)C MCULE-1915803401 [0,1,0,0,0,0|1,0,2]=4 1157 B7R0.4 C(=C/C(=O)O)\CCC MCULE-7580507705 [0,1,0,0,0,0|2,0,0]=3 1158 B7R0.4 C(=C/CC(=O)O)\CC MCULE-2731794411 [0,1,0,0,0,0|2,0,1]=4 1159 B7R0.4 C/C=C/COC(=O)C MCULE-4948306153 [0,1,0,0,0,0|0,0,1]=2 1160 B7R0.4 C=C(Br)CCCCC MCULE-3049831354 [0,1,0,0,0,0|2,0,1]=4 1161 B7R0.4 C=C(C)CCC=CC MCULE-7970794651 [0,1,0,0,0,0|2,0,1]=4 1162 B7R0.4 C=C(C)CCCC#N MCULE-2408925107 [0,1,0,0,0,0|2,0,1]=4 1163 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [0,1,0,0,0,0|2,0,0]=3 1164 B7R0.4 C=C(Cl)CCCCC MCULE-5074452982 [0,1,0,0,0,0|2,0,1]=4 1165 B7R0.4 C=CC=COC(=O)C MCULE-8556263077 [0,1,0,0,0,0|0,0,3]=4 1166 B7R0.4 C=CCCCC(=O)Cl MCULE-9125909850 [0,1,0,0,0,0|2,0,1]=4 1167 B7R0.4 C=CCCCC(=O)O MCULE-6043142578 [0,1,0,0,0,0|2,0,1]=4 1168 B7R0.4 C=CCCOC(=O)C MCULE-4554969214 [0,1,0,0,0,0|0,0,1]=2 1169 B7R0.4 C=CCCOC(=O)Cl MCULE-1917342500 [0,1,0,0,0,0|1,0,1]=3 1170 B7R0.4 C=CCOCC(=O)O MCULE-1419435306 [0,1,0,0,0,0|1,0,2]=4 1171 B7R0.4 C=CCONC(=O)C MCULE-1401456265 [0,1,0,0,0,0|0,0,2]=3 1172 B7R0.4 CC#CCCC(=O)O MCULE-1415388780 [0,1,0,0,0,0|2,0,1]=4 1173 B7R0.4 CC(=C=CCCO)C MCULE-7603464206 [0,1,0,0,0,0|2,0,1]=4 1174 B7R0.4 CC(=CCCC=O)C MCULE-3815388926 [0,1,0,0,0,0|2,0,1]=4 1175 B7R0.4 CC(=CCCCO)C MCULE-5263952692 [0,1,0,0,0,0|2,0,0]=3 1176 B7R0.4 CC(=O)CCCC#N MCULE-5884370871 [0,1,0,0,0,0|1,0,1]=3 1177 B7R0.4 CC(=O)CCCCBr MCULE-8801446022 [0,1,0,0,0,0|1,0,0]=2 1178 B7R0.4 CC(=O)CCCCCl MCULE-2883443563 [0,1,0,0,0,0|1,0,0]=2 1179 B7R0.4 CC(=O)CCCCO MCULE-9846338144 [0,1,0,0,0,0|1,0,0]=2 1180 B7R0.4 CC(=O)CCN=N#N MCULE-3526103207 [0,1,0,0,0,0|3,0,0]=4 1181 B7R0.4 CC(=O)CSCCF MCULE-8129308816 [0,1,0,0,0,0|1,1,0]=3 1182 B7R0.4 CC(=O)NCCC#N MCULE-1781318297 [0,1,0,0,0,0|1,0,1]=3 1183 B7R0.4 CC(=O)NCCC=O MCULE-1907633123 [0,1,0,0,0,0|1,0,1]=3 1184 B7R0.4 CC(=O)NCCCBr MCULE-5421597540 [0,1,0,0,0,0|1,0,0]=2 1185 B7R0.4 CC(=O)NCCCCl MCULE-4056331581 [0,1,0,0,0,0|1,0,0]=2 1186 B7R0.4 CC(=O)NCCCN MCULE-6321543480 [0,1,0,0,0,0|1,0,0]=2 1187 B7R0.4 CC(=O)NCCCN MCULE-8441492497 [0,1,0,0,0,0|1,0,0]=2 1188 B7R0.4 CC(=O)NCCCO MCULE-5627003249 [0,1,0,0,0,0|1,0,0]=2 1189 B7R0.4 CC(=O)NCCON MCULE-3703048482 [0,1,0,0,0,0|2,0,0]=3 1190 B7R0.4 CC(=O)OCCCBr MCULE-4735159476 [0,1,0,0,0,0|0,0,0]=1 1191 B7R0.4 CC(=O)OCCCCl MCULE-4801419214 [0,1,0,0,0,0|0,0,0]=1 1192 B7R0.4 CC(=O)OCCCI MCULE-5830086336 [0,1,0,0,0,0|0,0,0]=1 1193 B7R0.4 CC(=O)OCCCO MCULE-1423430948 [0,1,0,0,0,0|0,0,0]=1 1194 B7R0.4 CC(=O)OCCCS MCULE-2576827025 [0,1,0,0,0,0|0,0,0]=1 1195 B7R0.4 CC(=O)SCCC#N MCULE-4159295037 [0,1,0,0,0,0|0,1,1]=3 1196 B7R0.4 CC(=O)SCCC=O MCULE-3054558493 [0,1,0,0,0,0|0,1,1]=3 1197 B7R0.4 CC(=O)SCCCBr MCULE-2716633608 [0,1,0,0,0,0|0,1,0]=2 1198 B7R0.4 CC(=O)SCCCCl MCULE-3875604518 [0,1,0,0,0,0|0,1,0]=2 1199 B7R0.4 CC(=O)SCCCO MCULE-9014625190 [0,1,0,0,0,0|0,1,0]=2 1200 B7R0.4 CC(Br)CCCCO MCULE-2106751856 [0,1,0,0,0,0|2,0,1]=4 1201 B7R0.4 CC(C)CCCCBr MCULE-9236389539 [0,1,0,0,0,0|2,0,1]=4 1202 B7R0.4 CC(C)CCCCCl MCULE-5223516486 [0,1,0,0,0,0|2,0,1]=4 1203 B7R0.4 CC(C)CCCCN MCULE-3591523204 [0,1,0,0,0,0|2,0,1]=4 1204 B7R0.4 CC(C)CCCCO MCULE-9053698607 [0,1,0,0,0,0|2,0,1]=4 1205 B7R0.4 CC(C)COCCBr MCULE-7232103778 [0,1,0,0,0,0|2,0,1]=4 1206 B7R0.4 CC(C)COCCN MCULE-9238454281 [0,1,0,0,0,0|2,0,1]=4 1207 B7R0.4 CC(C)COCCN MCULE-9987398976 [0,1,0,0,0,0|2,0,1]=4 1208 B7R0.4 CC(C)COCCO MCULE-2997702641 [0,1,0,0,0,0|2,0,1]=4 1209 B7R0.4 CC(C)NCCCN MCULE-2900400569 [0,1,0,0,0,0|2,0,1]=4 1210 B7R0.4 CC(C)NCCCO MCULE-4556994899 [0,1,0,0,0,0|2,0,1]=4 1211 B7R0.4 CC(C)NCCCO MCULE-9550690390 [0,1,0,0,0,0|2,0,1]=4 1212 B7R0.4 CC(C)OCCC#N MCULE-4613636194 [0,1,0,0,0,0|1,0,2]=4 1213 B7R0.4 CC(C)OCCCBr MCULE-6061340501 [0,1,0,0,0,0|1,0,1]=3 1214 B7R0.4 CC(C)OCCCCl MCULE-5339928259 [0,1,0,0,0,0|1,0,1]=3 1215 B7R0.4 CC(C)OCCCN MCULE-6787172017 [0,1,0,0,0,0|1,0,1]=3 1216 B7R0.4 CC(C)OCCCN MCULE-8495001717 [0,1,0,0,0,0|1,0,1]=3 1217 B7R0.4 CC(C)OCCCO MCULE-9280654202 [0,1,0,0,0,0|1,0,1]=3 1218 B7R0.4 CC(C)OCCON MCULE-8218216454 [0,1,0,0,0,0|2,0,1]=4 1219 B7R0.4 CC(C)SCCCN MCULE-6322440113 [0,1,0,0,0,0|1,1,1]=4 1220 B7R0.4 CC(C)SCCCO MCULE-4296249117 [0,1,0,0,0,0|1,1,1]=4 1221 B7R0.4 CC(Cl)CCCCCl MCULE-4829013540 [0,1,0,0,0,0|2,0,1]=4 1222 B7R0.4 CC(Cl)COCCCl MCULE-5744839272 [0,1,0,0,0,0|2,0,1]=4 1223 B7R0.4 CC(N)CCCCN MCULE-3497267062 [0,1,0,0,0,0|2,0,1]=4 1224 B7R0.4 CC(N)CCCCN MCULE-9887360104 [0,1,0,0,0,0|2,0,1]=4 1225 B7R0.4 CC(N)CCCCO MCULE-7039935081 [0,1,0,0,0,0|2,0,1]=4 1226 B7R0.4 CC(N)CCCCO MCULE-8167834378 [0,1,0,0,0,0|2,0,1]=4 1227 B7R0.4 CC(O)CCCCO MCULE-3790969400 [0,1,0,0,0,0|1,0,2]=4 1228 B7R0.4 CC=CC=CC(=O)C MCULE-1781846029 [0,1,0,0,0,0|1,0,2]=4 1229 B7R0.4 CC=CCCC(=O)O MCULE-4275247668 [0,1,0,0,0,0|2,0,1]=4 1230 B7R0.4 CCC/C=C/C(=O)C MCULE-2005171902 [0,1,0,0,0,0|1,0,0]=2 1231 B7R0.4 CCC=CCC(=O)O MCULE-5031939966 [0,1,0,0,0,0|2,0,1]=4 1232 B7R0.4 CCCC#CC(=O)O MCULE-1682387091 [0,1,0,0,0,0|2,0,0]=3 1233 B7R0.4 CCCC#CC(C)O MCULE-4333844811 [0,1,0,0,0,0|1,0,2]=4 1234 B7R0.4 CCCC=CC(=O)C MCULE-5008490883 [0,1,0,0,0,0|1,0,0]=2 1235 B7R0.4 CCCC=CC(=O)Cl MCULE-6782906777 [0,1,0,0,0,0|2,0,0]=3 1236 B7R0.4 CCCC=CC(=O)O MCULE-6995077492 [0,1,0,0,0,0|2,0,0]=3 1237 B7R0.4 CCCC=CC(C)C MCULE-6546702510 [0,1,0,0,0,0|2,0,1]=4 1238 B7R0.4 CCCCCC(=N)N MCULE-4874167268 [0,1,0,0,0,0|3,0,0]=4 1239 B7R0.4 CCCCCC(=N)N MCULE-6942690708 [0,1,0,0,0,0|3,0,0]=4 1240 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [0,1,0,0,0,0|1,0,0]=2 1241 B7R0.4 CCCCCC(=O)Cl MCULE-5446850478 [0,1,0,0,0,0|2,0,0]=3 1242 B7R0.4 CCCCCC(=O)N MCULE-3215992514 [0,1,0,0,0,0|2,0,0]=3 1243 B7R0.4 CCCCCC(=O)O MCULE-1671810139 [0,1,0,0,0,0|2,0,0]=3 1244 B7R0.4 CCCCCC(=O)[O-] MCULE-5310584661 [0,1,0,0,0,0|2,0,0]=3 1245 B7R0.4 CCCCCC(=O)[O-] MCULE-9495078126 [0,1,0,0,0,0|2,0,0]=3 1246 B7R0.4 CCCCCC(=S)N MCULE-7633089850 [0,1,0,0,0,0|2,1,0]=4 1247 B7R0.4 CCCCCC(C)Br MCULE-4688847972 [0,1,0,0,0,0|2,0,1]=4 1248 B7R0.4 CCCCCC(C)C MCULE-9815158757 [0,1,0,0,0,0|2,0,1]=4 1249 B7R0.4 CCCCCC(C)Cl MCULE-1461261404 [0,1,0,0,0,0|2,0,1]=4 1250 B7R0.4 CCCCCC(C)N MCULE-1307982487 [0,1,0,0,0,0|2,0,1]=4 1251 B7R0.4 CCCCCC(C)N MCULE-8625441795 [0,1,0,0,0,0|2,0,1]=4 1252 B7R0.4 CCCCCC(C)N MCULE-9791654909 [0,1,0,0,0,0|2,0,1]=4 1253 B7R0.4 CCCCCC(C)O MCULE-2463855771 [0,1,0,0,0,0|1,0,2]=4 1254 B7R0.4 CCCCCC(C)S MCULE-3173115736 [0,1,0,0,0,0|1,1,1]=4 1255 B7R0.4 CCCCCN(=O)=O MCULE-6853489453 [0,1,0,0,0,0|3,0,0]=4 1256 B7R0.4 CCCCC[C@@H](C)N MCULE-2460238945 [0,1,0,0,0,0|2,0,1]=4 1257 B7R0.4 CCCCC[C@@H](C)N MCULE-6386771130 [0,1,0,0,0,0|2,0,1]=4 1258 B7R0.4 CCCCC[C@@H](C)N MCULE-6470246577 [0,1,0,0,0,0|2,0,1]=4 1259 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [0,1,0,0,0,0|1,0,2]=4 1260 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [0,1,0,0,0,0|1,0,2]=4 1261 B7R0.4 CCCCC[C@H](C)N MCULE-8119988811 [0,1,0,0,0,0|2,0,1]=4 1262 B7R0.4 CCCCC[C@H](C)N MCULE-9987283826 [0,1,0,0,0,0|2,0,1]=4 1263 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [0,1,0,0,0,0|1,0,2]=4 1264 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [0,1,0,0,0,0|1,0,2]=4 1265 B7R0.4 CCCCNC(=N)N MCULE-4548909930 [0,1,0,0,0,0|3,0,0]=4 1266 B7R0.4 CCCCNC(=N)N MCULE-4773969181 [0,1,0,0,0,0|3,0,0]=4 1267 B7R0.4 CCCCNC(=O)C MCULE-7266335096 [0,1,0,0,0,0|1,0,0]=2 1268 B7R0.4 CCCCNC(=O)Cl MCULE-2148016012 [0,1,0,0,0,0|2,0,0]=3 1269 B7R0.4 CCCCNC(=O)N MCULE-3263036294 [0,1,0,0,0,0|2,0,0]=3 1270 B7R0.4 CCCCNC(=S)N MCULE-7448930772 [0,1,0,0,0,0|2,1,0]=4 1271 B7R0.4 CCCCNC(C)C MCULE-2695970517 [0,1,0,0,0,0|2,0,1]=4 1272 B7R0.4 CCCCNC(C)C MCULE-9973816117 [0,1,0,0,0,0|2,0,1]=4 1273 B7R0.4 CCCCNN(=O)=O MCULE-2055512271 [0,1,0,0,0,0|3,0,0]=4 1274 B7R0.4 CCCCOC(=O)C MCULE-2107021121 [0,1,0,0,0,0|0,0,0]=1 1275 B7R0.4 CCCCOC(=O)Cl MCULE-5750652482 [0,1,0,0,0,0|1,0,0]=2 1276 B7R0.4 CCCCOC(=O)N MCULE-7719579696 [0,1,0,0,0,0|1,0,0]=2 1277 B7R0.4 CCCCOC(=S)[S-] MCULE-2197583773 [0,1,0,0,0,0|1,1,0]=3 1278 B7R0.4 CCCCOC(=S)[S-] MCULE-3219674247 [0,1,0,0,0,0|1,1,0]=3 1279 B7R0.4 CCCCOC(C)C MCULE-1504269570 [0,1,0,0,0,0|1,0,1]=3 1280 B7R0.4 CCCCOC(Cl)Cl MCULE-2958816896 [0,1,0,0,0,0|2,0,1]=4 1281 B7R0.4 CCCCON(=O)=O MCULE-9175662186 [0,1,0,0,0,0|2,0,0]=3 1282 B7R0.4 CCCCSC(=N)N MCULE-1202813594 [0,1,0,0,0,0|2,1,0]=4 1283 B7R0.4 CCCCSC(=N)N MCULE-6798856505 [0,1,0,0,0,0|2,1,0]=4 1284 B7R0.4 CCCCSC(=N)N MCULE-8701506154 [0,1,0,0,0,0|2,1,0]=4 1285 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [0,1,0,0,0,0|0,1,0]=2 1286 B7R0.4 CCCCSC(=O)Cl MCULE-8008254909 [0,1,0,0,0,0|1,1,0]=3 1287 B7R0.4 CCCNCC(=O)N MCULE-2330202708 [0,1,0,0,0,0|2,0,0]=3 1288 B7R0.4 CCCNCC(=O)N MCULE-3731054780 [0,1,0,0,0,0|2,0,0]=3 1289 B7R0.4 CCCNCC(=O)O MCULE-4384128915 [0,1,0,0,0,0|2,0,0]=3 1290 B7R0.4 CCCNCC(=O)O MCULE-7537317046 [0,1,0,0,0,0|2,0,0]=3 1291 B7R0.4 CCCNCC(C)C MCULE-2869656642 [0,1,0,0,0,0|2,0,1]=4 1292 B7R0.4 CCCNCC(C)O MCULE-8110237473 [0,1,0,0,0,0|1,0,2]=4 1293 B7R0.4 CCCOCC(=O)O MCULE-6841640058 [0,1,0,0,0,0|1,0,0]=2 1294 B7R0.4 CCCOCC(=S)N MCULE-4681127635 [0,1,0,0,0,0|1,1,0]=3 1295 B7R0.4 CCCOCC(C)O MCULE-9214840563 [0,1,0,0,0,0|0,0,2]=3 1296 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [0,1,0,0,0,0|0,1,0]=2 1297 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [0,1,0,0,0,0|1,1,0]=3 1298 B7R0.4 CCNCCC(=O)N MCULE-4857735433 [0,1,0,0,0,0|2,0,0]=3 1299 B7R0.4 CCNCCC(=O)N MCULE-8238114591 [0,1,0,0,0,0|2,0,0]=3 1300 B7R0.4 CCNCCC(=O)O MCULE-4226597657 [0,1,0,0,0,0|2,0,0]=3 1301 B7R0.4 CCNCCC(=O)O MCULE-9183951914 [0,1,0,0,0,0|2,0,0]=3 1302 B7R0.4 CCNCCN(C)C MCULE-6722045380 [0,1,0,0,0,0|3,0,0]=4 1303 B7R0.4 CCO/C=C/C(=O)Cl MCULE-5623807124 [0,1,0,0,0,0|2,0,1]=4 1304 B7R0.4 CCO/C=C/C(=O)O MCULE-6712227034 [0,1,0,0,0,0|2,0,1]=4 1305 B7R0.4 CCOC=CC(=O)Cl MCULE-1242349133 [0,1,0,0,0,0|2,0,1]=4 1306 B7R0.4 CCOC=CC(=O)O MCULE-4776715351 [0,1,0,0,0,0|2,0,1]=4 1307 B7R0.4 CCOCCC(=N)N MCULE-4926091113 [0,1,0,0,0,0|3,0,0]=4 1308 B7R0.4 CCOCCC(=N)N MCULE-8590303415 [0,1,0,0,0,0|3,0,0]=4 1309 B7R0.4 CCOCCC(=O)C MCULE-8449201493 [0,1,0,0,0,0|1,0,0]=2 1310 B7R0.4 CCOCCC(=O)Cl MCULE-8299617790 [0,1,0,0,0,0|2,0,0]=3 1311 B7R0.4 CCOCCC(=O)O MCULE-3962084059 [0,1,0,0,0,0|2,0,0]=3 1312 B7R0.4 CCOCNC(=O)N MCULE-7680870721 [0,1,0,0,0,0|2,0,0]=3 1313 B7R0.4 CCSCCC(=O)O MCULE-9385724904 [0,1,0,0,0,0|2,0,0]=3 1314 B7R0.4 CCSCCC(C)N MCULE-6854502332 [0,1,0,0,0,0|2,0,1]=4 1315 B7R0.4 CN(C)CCCCBr MCULE-3700239066 [0,1,0,0,0,0|3,0,0]=4 1316 B7R0.4 CN(C)CCCCBr MCULE-5243977766 [0,1,0,0,0,0|3,0,0]=4 1317 B7R0.4 CN(C)CCCCCl MCULE-5038597183 [0,1,0,0,0,0|3,0,0]=4 1318 B7R0.4 CN(C)CCCCCl MCULE-8885080954 [0,1,0,0,0,0|3,0,0]=4 1319 B7R0.4 CN(C)CCCCN MCULE-4457571368 [0,1,0,0,0,0|3,0,0]=4 1320 B7R0.4 CN(C)CCCCN MCULE-9067239115 [0,1,0,0,0,0|3,0,0]=4 1321 B7R0.4 CN(C)CCCCO MCULE-6973654872 [0,1,0,0,0,0|3,0,0]=4 1322 B7R0.4 CNCCCC(=O)N MCULE-8337447772 [0,1,0,0,0,0|2,0,0]=3 1323 B7R0.4 CNCCCC(=O)N MCULE-9037809827 [0,1,0,0,0,0|2,0,0]=3 1324 B7R0.4 CNCCCC(=O)O MCULE-7598762485 [0,1,0,0,0,0|2,0,0]=3 1325 B7R0.4 CNCCCC(=O)O MCULE-7877286915 [0,1,0,0,0,0|2,0,0]=3 1326 B7R0.4 CNCCCC(C)C MCULE-1784678333 [0,1,0,0,0,0|2,0,1]=4 1327 B7R0.4 CNCCCN(C)C MCULE-2186520808 [0,1,0,0,0,0|3,0,0]=4 1328 B7R0.4 CNCCNC(=O)C MCULE-5361712613 [0,1,0,0,0,0|1,0,0]=2 1329 B7R0.4 CNCCNC(=O)C MCULE-9798024696 [0,1,0,0,0,0|1,0,0]=2 1330 B7R0.4 CNCCNC(C)C MCULE-9007534493 [0,1,0,0,0,0|2,0,1]=4 1331 B7R0.4 CNCCOC(=O)C MCULE-1850077864 [0,1,0,0,0,0|0,0,0]=1 1332 B7R0.4 CNCCOC(=O)C MCULE-7023987942 [0,1,0,0,0,0|0,0,0]=1 1333 B7R0.4 CNCCSC(=N)N MCULE-4335831899 [0,1,0,0,0,0|2,1,0]=4 1334 B7R0.4 CNCCSC(=N)N MCULE-5500737932 [0,1,0,0,0,0|2,1,0]=4 1335 B7R0.4 COC/C=C/C(=O)O MCULE-7555080897 [0,1,0,0,0,0|2,0,1]=4 1336 B7R0.4 COCC#CC(=O)O MCULE-5896712747 [0,1,0,0,0,0|2,0,1]=4 1337 B7R0.4 COCC=CC(=O)O MCULE-5702384430 [0,1,0,0,0,0|2,0,1]=4 1338 B7R0.4 COCCCC(=O)C MCULE-3606369396 [0,1,0,0,0,0|1,0,0]=2 1339 B7R0.4 COCCCC(=O)O MCULE-3165881573 [0,1,0,0,0,0|2,0,0]=3 1340 B7R0.4 COCCCC(=S)N MCULE-5066867181 [0,1,0,0,0,0|2,1,0]=4 1341 B7R0.4 COCCCC(C)N MCULE-4298611846 [0,1,0,0,0,0|2,0,1]=4 1342 B7R0.4 COCCCC(C)N MCULE-8139434838 [0,1,0,0,0,0|2,0,1]=4 1343 B7R0.4 COCCCC(C)O MCULE-4190294636 [0,1,0,0,0,0|1,0,2]=4 1344 B7R0.4 COCCNC(=N)N MCULE-4122240317 [0,1,0,0,0,0|3,0,0]=4 1345 B7R0.4 COCCNC(=N)N MCULE-5184785677 [0,1,0,0,0,0|3,0,0]=4 1346 B7R0.4 COCCNC(=N)N MCULE-5799549903 [0,1,0,0,0,0|3,0,0]=4 1347 B7R0.4 COCCNC(=O)C MCULE-2794263612 [0,1,0,0,0,0|1,0,0]=2 1348 B7R0.4 COCCNC(=O)N MCULE-1380726553 [0,1,0,0,0,0|2,0,0]=3 1349 B7R0.4 COCCNC(=S)N MCULE-1285240117 [0,1,0,0,0,0|2,1,0]=4 1350 B7R0.4 COCCNC(C)C MCULE-2061720092 [0,1,0,0,0,0|2,0,1]=4 1351 B7R0.4 COCCOC(=O)C MCULE-3221264060 [0,1,0,0,0,0|0,0,0]=1 1352 B7R0.4 COCCOC(=O)Cl MCULE-7308809094 [0,1,0,0,0,0|1,0,0]=2 1353 B7R0.4 COCCOC(=O)N MCULE-3401505850 [0,1,0,0,0,0|1,0,0]=2 1354 B7R0.4 COCCSC(=N)N MCULE-2093405339 [0,1,0,0,0,0|2,1,0]=4 1355 B7R0.4 COCCSC(=N)N MCULE-7836023475 [0,1,0,0,0,0|2,1,0]=4 1356 B7R0.4 CS(=O)CCCC#N MCULE-9441417021 [0,1,0,0,0,0|2,0,1]=4 1357 B7R0.4 CSCC=CC(=O)O MCULE-8220760222 [0,1,0,0,0,0|2,0,1]=4 1358 B7R0.4 CSCCCC(=O)O MCULE-2126637794 [0,1,0,0,0,0|2,0,0]=3 1359 B7R0.4 CSCCNC(=O)C MCULE-2739431878 [0,1,0,0,0,0|1,0,0]=2 1360 B7R0.4 CSCCNC(=O)N MCULE-7254695938 [0,1,0,0,0,0|2,0,0]=3 1361 B7R0.4 CSCCNC(=S)N MCULE-1778031613 [0,1,0,0,0,0|2,1,0]=4 1362 B7R0.4 CSCCOC(=O)C MCULE-3742242959 [0,1,0,0,0,0|0,0,0]=1 1363 B7R0.4 CSSCCC(=O)O MCULE-6571821309 [0,1,0,0,0,0|3,0,0]=4 1364 B7R0.4 N#CCCCC(=O)O MCULE-9921837071 [0,1,0,0,0,0|2,0,1]=4 1365 B7R0.4 N=C(N)CCCCCl MCULE-4352194585 [0,1,0,0,0,0|3,0,0]=4 1366 B7R0.4 N=C(N)CCCCCl MCULE-5262170460 [0,1,0,0,0,0|3,0,0]=4 1367 B7R0.4 NC(=O)CCCCBr MCULE-4949681497 [0,1,0,0,0,0|2,0,0]=3 1368 B7R0.4 NC(=O)CCCCCl MCULE-7937142112 [0,1,0,0,0,0|2,0,0]=3 1369 B7R0.4 NC(=O)CCCCO MCULE-4820227146 [0,1,0,0,0,0|2,0,0]=3 1370 B7R0.4 NC(=O)COCCCl MCULE-1141300697 [0,1,0,0,0,0|2,0,0]=3 1371 B7R0.4 NC(=O)COCCO MCULE-3158372920 [0,1,0,0,0,0|2,0,0]=3 1372 B7R0.4 NC(=O)CSCCO MCULE-8225407259 [0,1,0,0,0,0|2,1,0]=4 1373 B7R0.4 NC(=O)NCCCO MCULE-3167491311 [0,1,0,0,0,0|2,0,0]=3 1374 B7R0.4 NCCCCC(=O)N MCULE-3198962228 [0,1,0,0,0,0|2,0,0]=3 1375 B7R0.4 NCCCCC(=O)N MCULE-7986221705 [0,1,0,0,0,0|2,0,0]=3 1376 B7R0.4 NCCCCC(=O)O MCULE-1155829905 [0,1,0,0,0,0|2,0,0]=3 1377 B7R0.4 NCCCCC(=O)O MCULE-3920398524 [0,1,0,0,0,0|2,0,0]=3 1378 B7R0.4 NCCCCC(=O)O MCULE-4404796498 [0,1,0,0,0,0|2,0,0]=3 1379 B7R0.4 NCCCCC(=O)O MCULE-4971679857 [0,1,0,0,0,0|2,0,0]=3 1380 B7R0.4 NCCCNC(=O)N MCULE-1109440921 [0,1,0,0,0,0|2,0,0]=3 1381 B7R0.4 NCCCNC(=O)N MCULE-3933221897 [0,1,0,0,0,0|2,0,0]=3 1382 B7R0.4 NCCCOC(F)F MCULE-9181708891 [0,1,0,0,0,0|2,0,1]=4 1383 B7R0.4 NCCCOS(=O)O MCULE-8389295774 [0,1,0,0,0,0|2,0,0]=3 1384 B7R0.4 NCCNCC(=O)O MCULE-9689592343 [0,1,0,0,0,0|3,0,0]=4 1385 B7R0.4 NCCNCC(=O)O MCULE-9795251557 [0,1,0,0,0,0|3,0,0]=4 1386 B7R0.4 NCCOCC(=O)O MCULE-2375694645 [0,1,0,0,0,0|2,0,0]=3 1387 B7R0.4 NCCOCC(=O)O MCULE-5877065986 [0,1,0,0,0,0|2,0,0]=3 1388 B7R0.4 NCCSCC(=O)O MCULE-5565800206 [0,1,0,0,0,0|2,1,0]=4 1389 B7R0.4 NCCSCC(=O)O MCULE-8322098978 [0,1,0,0,0,0|2,1,0]=4 1390 B7R0.4 NOCCCC(=O)O MCULE-4102473285 [0,1,0,0,0,0|3,0,0]=4 1391 B7R0.4 NOCCCC(=O)O MCULE-7068985203 [0,1,0,0,0,0|3,0,0]=4 1392 B7R0.4 O=C(Cl)CCCCBr MCULE-5574450546 [0,1,0,0,0,0|2,0,0]=3 1393 B7R0.4 O=C(Cl)CCCCCl MCULE-9605707894 [0,1,0,0,0,0|2,0,0]=3 1394 B7R0.4 O=C(Cl)CCCCF MCULE-8110878511 [0,1,0,0,0,0|2,0,0]=3 1395 B7R0.4 O=C(Cl)COCCCl MCULE-9707252778 [0,1,0,0,0,0|2,0,0]=3 1396 B7R0.4 O=C(Cl)OCCCCl MCULE-2619287385 [0,1,0,0,0,0|1,0,0]=2 1397 B7R0.4 O=C(Cl)OCCCF MCULE-4930474319 [0,1,0,0,0,0|1,0,0]=2 1398 B7R0.4 O=C(O)C#CCCO MCULE-5211042941 [0,1,0,0,0,0|2,0,1]=4 1399 B7R0.4 O=C(O)CCCCBr MCULE-2655919094 [0,1,0,0,0,0|2,0,0]=3 1400 B7R0.4 O=C(O)CCCCCl MCULE-4094641005 [0,1,0,0,0,0|2,0,0]=3 1401 B7R0.4 O=C(O)CCCCO MCULE-8816195933 [0,1,0,0,0,0|2,0,0]=3 1402 B7R0.4 O=C(O)CCCCS MCULE-2427465795 [0,1,0,0,0,0|2,0,0]=3 1403 B7R0.4 O=C(O)CNCCO MCULE-7501311949 [0,1,0,0,0,0|3,0,0]=4 1404 B7R0.4 O=C(O)COCCBr MCULE-4593325557 [0,1,0,0,0,0|2,0,0]=3 1405 B7R0.4 O=C(O)COCCCl MCULE-2978816248 [0,1,0,0,0,0|2,0,0]=3 1406 B7R0.4 O=C(O)COCCF MCULE-9820799514 [0,1,0,0,0,0|2,0,0]=3 1407 B7R0.4 O=C(O)COCCO MCULE-8297137880 [0,1,0,0,0,0|2,0,0]=3 1408 B7R0.4 O=C(O)CSCCCl MCULE-5204967583 [0,1,0,0,0,0|2,1,0]=4 1409 B7R0.4 O=C(O)CSCCO MCULE-1062560307 [0,1,0,0,0,0|2,1,0]=4 1410 B7R0.4 O=C([O-])CCCCO MCULE-3836827182 [0,1,0,0,0,0|2,0,0]=3 1411 B7R0.4 O=C([O-])COCCO MCULE-7093344226 [0,1,0,0,0,0|2,0,0]=3 1412 B7R0.4 O=CCCCC(=O)O MCULE-8389457571 [0,1,0,0,0,0|2,0,1]=4 1413 B7R0.4 O=N(=O)CCCCBr MCULE-8310183286 [0,1,0,0,0,0|3,0,0]=4 1414 B7R0.4 O=N(=O)CCCCCl MCULE-9069384470 [0,1,0,0,0,0|3,0,0]=4 1415 B7R0.4 O=N(=O)CCCCO MCULE-4639070341 [0,1,0,0,0,0|3,0,0]=4 1416 B7R0.4 O=N(=O)OCCCO MCULE-3030828224 [0,1,0,0,0,0|2,0,0]=3 1417 B7R0.4 O=S(Cl)OCCCF MCULE-7923197186 [0,1,0,0,0,0|2,0,0]=3 1418 B7R0.5 C#CCN(C)C(=O)C MCULE-6473061855 [0,1,0,0,0,0|1,0,2]=4 1419 B7R0.5 C=C(C)C(=O)OCC MCULE-9496497565 [0,1,0,0,0,0|3,0,0]=4 1420 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [0,1,0,0,0,0|2,0,0]=3 1421 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [0,1,0,0,0,0|3,0,0]=4 1422 B7R0.5 C=C(COC)C(=O)O MCULE-8964616960 [0,1,0,0,0,0|3,0,0]=4 1423 B7R0.5 C=CCC(C)C(=O)C MCULE-4395269639 [0,1,0,0,0,0|1,0,2]=4 1424 B7R0.5 CC(=O)C(C)CCBr MCULE-4705039689 [0,1,0,0,0,0|2,0,0]=3 1425 B7R0.5 CC(=O)C(C)CCCl MCULE-2960091698 [0,1,0,0,0,0|2,0,0]=3 1426 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [0,1,0,0,0,0|2,0,0]=3 1427 B7R0.5 CC(=O)C(Cl)CCCl MCULE-4634341484 [0,1,0,0,0,0|2,0,0]=3 1428 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [0,1,0,0,0,0|2,0,0]=3 1429 B7R0.5 CC(=O)N(C)CCN MCULE-3153405152 [0,1,0,0,0,0|2,0,0]=3 1430 B7R0.5 CC(=O)N(C)CCN MCULE-4043248689 [0,1,0,0,0,0|2,0,0]=3 1431 B7R0.5 CC(=O)N(C)CCO MCULE-4135818139 [0,1,0,0,0,0|2,0,0]=3 1432 B7R0.5 CC(CCCl)C(=O)Cl MCULE-4844969943 [0,1,0,0,0,0|3,0,0]=4 1433 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [0,1,0,0,0,0|3,0,0]=4 1434 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [0,1,0,0,0,0|3,0,0]=4 1435 B7R0.5 CC(CCN)S(=O)C MCULE-4983155747 [0,1,0,0,0,0|3,0,0]=4 1436 B7R0.5 CC(CCO)C(=O)N MCULE-3037868887 [0,1,0,0,0,0|3,0,0]=4 1437 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [0,1,0,0,0,0|3,0,0]=4 1438 B7R0.5 CC(CCO)C(=O)[O-] MCULE-2278638513 [0,1,0,0,0,0|3,0,0]=4 1439 B7R0.5 CC/C=C(\C)/C(=O)O MCULE-1290613859 [0,1,0,0,0,0|2,0,1]=4 1440 B7R0.5 CCC=C(C)C(=O)O MCULE-5045441145 [0,1,0,0,0,0|2,0,1]=4 1441 B7R0.5 CCC=C(F)C(=O)O MCULE-6630499680 [0,1,0,0,0,0|2,0,1]=4 1442 B7R0.5 CCCC(=C(F)F)F MCULE-1831306144 [0,1,0,0,0,0|3,0,0]=4 1443 B7R0.5 CCCC(=O)C(=O)C MCULE-8267463586 [0,1,0,0,0,0|1,0,0]=2 1444 B7R0.5 CCCC(=O)C(=O)N MCULE-6625605588 [0,1,0,0,0,0|2,0,0]=3 1445 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [0,1,0,0,0,0|2,0,0]=3 1446 B7R0.5 CCCC(=O)C(C)Br MCULE-8743472868 [0,1,0,0,0,0|2,0,1]=4 1447 B7R0.5 CCCC(=O)C(C)C MCULE-7690543374 [0,1,0,0,0,0|2,0,1]=4 1448 B7R0.5 CCCC(=O)N(C)C MCULE-8154537620 [0,1,0,0,0,0|3,0,0]=4 1449 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [0,1,0,0,0,0|1,0,0]=2 1450 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [0,1,0,0,0,0|2,0,0]=3 1451 B7R0.5 CCCC(Br)C(C)Br MCULE-4740207556 [0,1,0,0,0,0|2,0,1]=4 1452 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [0,1,0,0,0,0|1,0,0]=2 1453 B7R0.5 CCCC(C)C(=O)Cl MCULE-4855016209 [0,1,0,0,0,0|2,0,0]=3 1454 B7R0.5 CCCC(C)C(=O)N MCULE-1948746391 [0,1,0,0,0,0|2,0,0]=3 1455 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [0,1,0,0,0,0|2,0,0]=3 1456 B7R0.5 CCCC(C)C(C)C MCULE-1008931357 [0,1,0,0,0,0|2,0,1]=4 1457 B7R0.5 CCCC(C)C(C)N MCULE-3555650010 [0,1,0,0,0,0|2,0,1]=4 1458 B7R0.5 CCCC(C)C(C)N MCULE-8637319249 [0,1,0,0,0,0|2,0,1]=4 1459 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [0,1,0,0,0,0|1,0,2]=4 1460 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [0,1,0,0,0,0|2,0,0]=3 1461 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [0,1,0,0,0,0|2,0,0]=3 1462 B7R0.5 CCCC(N)C(=O)N MCULE-5159221123 [0,1,0,0,0,0|2,0,0]=3 1463 B7R0.5 CCCC(N)C(=O)N MCULE-5742773956 [0,1,0,0,0,0|2,0,0]=3 1464 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [0,1,0,0,0,0|2,0,0]=3 1465 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [0,1,0,0,0,0|2,0,0]=3 1466 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [0,1,0,0,0,0|2,0,0]=3 1467 B7R0.5 CCCC(O)C(=O)N MCULE-3143432132 [0,1,0,0,0,0|2,0,0]=3 1468 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [0,1,0,0,0,0|2,0,0]=3 1469 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [0,1,0,0,0,0|2,0,0]=3 1470 B7R0.5 CCCC(O)C(C)C MCULE-8942406791 [0,1,0,0,0,0|2,0,1]=4 1471 B7R0.5 CCCN(C)C(=O)Cl MCULE-2930764127 [0,1,0,0,0,0|2,0,0]=3 1472 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [0,1,0,0,0,0|2,0,0]=3 1473 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [0,1,0,0,0,0|2,0,0]=3 1474 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [0,1,0,0,0,0|2,0,0]=3 1475 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [0,1,0,0,0,0|2,0,0]=3 1476 B7R0.5 CCC[C@H](N)C(=O)N MCULE-2163059771 [0,1,0,0,0,0|2,0,0]=3 1477 B7R0.5 CCC[C@H](N)C(=O)N MCULE-4687172013 [0,1,0,0,0,0|2,0,0]=3 1478 B7R0.5 CCC[C@H](N)C(=O)N MCULE-7482592029 [0,1,0,0,0,0|2,0,0]=3 1479 B7R0.5 CCC[C@H](N)C(=O)N MCULE-9639796243 [0,1,0,0,0,0|2,0,0]=3 1480 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [0,1,0,0,0,0|2,0,0]=3 1481 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [0,1,0,0,0,0|2,0,0]=3 1482 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [0,1,0,0,0,0|2,0,0]=3 1483 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [0,1,0,0,0,0|2,0,0]=3 1484 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [0,1,0,0,0,0|2,0,0]=3 1485 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [0,1,0,0,0,0|3,0,0]=4 1486 B7R0.5 CCNC(C)C(=O)N MCULE-2861818493 [0,1,0,0,0,0|3,0,0]=4 1487 B7R0.5 CCNC(C)C(=O)N MCULE-6110291237 [0,1,0,0,0,0|3,0,0]=4 1488 B7R0.5 CCNC(C)C(=O)O MCULE-5445574810 [0,1,0,0,0,0|3,0,0]=4 1489 B7R0.5 CCNC(C)C(=O)O MCULE-5666785247 [0,1,0,0,0,0|3,0,0]=4 1490 B7R0.5 CCN[C@H](C)C(=O)O MCULE-9676358201 [0,1,0,0,0,0|3,0,0]=4 1491 B7R0.5 CCOC(=O)C(=O)C MCULE-5817261721 [0,1,0,0,0,0|2,0,0]=3 1492 B7R0.5 CCOC(=O)C(=O)Cl MCULE-6454421959 [0,1,0,0,0,0|3,0,0]=4 1493 B7R0.5 CCOC(=O)C(=O)N MCULE-2968497645 [0,1,0,0,0,0|3,0,0]=4 1494 B7R0.5 CCOC(=O)C(=O)O MCULE-2368024441 [0,1,0,0,0,0|3,0,0]=4 1495 B7R0.5 CCOC(=O)C(=O)[O-] MCULE-1807862684 [0,1,0,0,0,0|3,0,0]=4 1496 B7R0.5 CCOC(=S)C(=O)N MCULE-4600711043 [0,1,0,0,0,0|3,0,0]=4 1497 B7R0.5 CCOC(C)C(=O)O MCULE-2185795311 [0,1,0,0,0,0|3,0,0]=4 1498 B7R0.5 CCSC(C)C(=O)O MCULE-9817243573 [0,1,0,0,0,0|3,0,0]=4 1499 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [0,1,0,0,0,0|3,0,0]=4 1500 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [0,1,0,0,0,0|3,0,0]=4 1501 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [0,1,0,0,0,0|3,0,0]=4 1502 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [0,1,0,0,0,0|3,0,0]=4 1503 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [0,1,0,0,0,0|3,0,0]=4 1504 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [0,1,0,0,0,0|3,0,0]=4 1505 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [0,1,0,0,0,0|3,0,0]=4 1506 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [0,1,0,0,0,0|3,0,0]=4 1507 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [0,1,0,0,0,0|3,0,0]=4 1508 B7R0.5 COCC(C)C(=O)C MCULE-5328927786 [0,1,0,0,0,0|2,0,0]=3 1509 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [0,1,0,0,0,0|3,0,0]=4 1510 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [0,1,0,0,0,0|3,0,0]=4 1511 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [0,1,0,0,0,0|3,0,0]=4 1512 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [0,1,0,0,0,0|3,0,0]=4 1513 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [0,1,0,0,0,0|3,0,0]=4 1514 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [0,1,0,0,0,0|3,0,0]=4 1515 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [0,1,0,0,0,0|3,0,0]=4 1516 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [0,1,0,0,0,0|3,0,0]=4 1517 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [0,1,0,0,0,0|3,0,0]=4 1518 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [0,1,0,0,0,0|3,0,0]=4 1519 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [0,1,0,0,0,0|3,0,0]=4 1520 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [0,1,0,0,0,0|3,0,0]=4 1521 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [0,1,0,0,0,0|3,0,0]=4 1522 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [0,1,0,0,0,0|3,0,0]=4 1523 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [0,1,0,0,0,0|3,0,0]=4 1524 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [0,1,0,0,0,0|3,0,0]=4 1525 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [0,1,0,0,0,0|3,0,0]=4 1526 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [0,1,0,0,0,0|3,0,0]=4 1527 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [0,1,0,0,0,0|3,0,0]=4 1528 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [0,1,0,0,0,0|3,0,0]=4 1529 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [0,1,0,0,0,0|3,0,0]=4 1530 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [0,1,0,0,0,0|3,0,0]=4 1531 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [0,1,0,0,0,0|3,0,0]=4 1532 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [0,1,0,0,0,0|3,0,0]=4 1533 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [0,1,0,0,0,0|3,0,0]=4 1534 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [0,1,0,0,0,0|3,0,0]=4 1535 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [0,1,0,0,0,0|3,0,0]=4 1536 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [0,1,0,0,0,0|3,0,0]=4 1537 B7R0.5 NC(=O)C(Br)CCBr MCULE-5008510444 [0,1,0,0,0,0|3,0,0]=4 1538 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [0,1,0,0,0,0|3,0,0]=4 1539 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [0,1,0,0,0,0|3,0,0]=4 1540 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [0,1,0,0,0,0|3,0,0]=4 1541 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [0,1,0,0,0,0|3,0,0]=4 1542 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [0,1,0,0,0,0|3,0,0]=4 1543 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [0,1,0,0,0,0|3,0,0]=4 1544 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [0,1,0,0,0,0|3,0,0]=4 1545 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [0,1,0,0,0,0|3,0,0]=4 1546 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [0,1,0,0,0,0|3,0,0]=4 1547 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [0,1,0,0,0,0|3,0,0]=4 1548 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [0,1,0,0,0,0|3,0,0]=4 1549 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [0,1,0,0,0,0|3,0,0]=4 1550 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [0,1,0,0,0,0|3,0,0]=4 1551 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [0,1,0,0,0,0|3,0,0]=4 1552 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [0,1,0,0,0,0|3,0,0]=4 1553 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [0,1,0,0,0,0|3,0,0]=4 1554 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [0,1,0,0,0,0|3,0,0]=4 1555 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [0,1,0,0,0,0|3,0,0]=4 1556 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [0,1,0,0,0,0|3,0,0]=4 1557 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [0,1,0,0,0,0|3,0,0]=4 1558 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [0,1,0,0,0,0|3,0,0]=4 1559 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [0,1,0,0,0,0|3,0,0]=4 1560 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [0,1,0,0,0,0|3,0,0]=4 1561 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [0,1,0,0,0,0|3,0,0]=4 1562 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [0,1,0,0,0,0|3,0,0]=4 1563 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [0,1,0,0,0,0|3,0,0]=4 1564 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [0,1,0,0,0,0|3,0,0]=4 1565 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [0,1,0,0,0,0|3,0,0]=4 1566 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [0,1,0,0,0,0|3,0,0]=4 1567 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [0,1,0,0,0,0|3,0,0]=4 1568 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [0,1,0,0,0,0|3,0,0]=4 1569 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [0,1,0,0,0,0|3,0,0]=4 1570 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [0,1,0,0,0,0|3,0,0]=4 1571 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [0,1,0,0,0,0|3,0,0]=4 1572 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [0,1,0,0,0,0|3,0,0]=4 1573 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [0,1,0,0,0,0|3,0,0]=4 1574 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [0,1,0,0,0,0|3,0,0]=4 1575 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [0,1,0,0,0,0|3,0,0]=4 1576 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [0,1,0,0,0,0|3,0,0]=4 1577 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [0,1,0,0,0,0|3,0,0]=4 1578 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [0,1,0,0,0,0|3,0,0]=4 1579 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [0,1,0,0,0,0|3,0,0]=4 1580 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [0,1,0,0,0,0|3,0,0]=4 1581 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [0,1,0,0,0,0|3,0,0]=4 1582 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [0,1,0,0,0,0|3,0,0]=4 1583 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [0,1,0,0,0,0|3,0,0]=4 1584 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [0,1,0,0,0,0|3,0,0]=4 1585 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [0,1,0,0,0,0|3,0,0]=4 1586 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [0,1,0,0,0,0|3,0,0]=4 1587 B7R0.5 O=C(Br)C(Br)CCBr MCULE-1496301616 [0,1,0,0,0,0|3,0,0]=4 1588 B7R0.5 O=C(Cl)C(Br)CCBr MCULE-9787639147 [0,1,0,0,0,0|3,0,0]=4 1589 B7R0.5 O=C(Cl)C(Br)CCCl MCULE-6400872582 [0,1,0,0,0,0|3,0,0]=4 1590 B7R0.5 O=C(O)C(Br)CCBr MCULE-3091819269 [0,1,0,0,0,0|3,0,0]=4 1591 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [0,1,0,0,0,0|3,0,0]=4 1592 B7R0.6 C=C(Br)CNC(=O)C MCULE-4123179812 [0,1,0,0,0,0|1,0,2]=4 1593 B7R0.6 C=C(C)CCC(=C)C MCULE-6018302318 [0,1,0,0,0,0|2,0,1]=4 1594 B7R0.6 C=C(C)CCC(=O)C MCULE-4201277876 [0,1,0,0,0,0|1,0,1]=3 1595 B7R0.6 C=C(C)CCC(=O)N MCULE-7602727888 [0,1,0,0,0,0|2,0,1]=4 1596 B7R0.6 C=C(C)CCC(=O)O MCULE-8738532812 [0,1,0,0,0,0|2,0,1]=4 1597 B7R0.6 C=C(C)CCC(C)Br MCULE-6437209576 [0,1,0,0,0,0|2,0,0]=3 1598 B7R0.6 C=C(C)CCC(C)C MCULE-2459654294 [0,1,0,0,0,0|2,0,0]=3 1599 B7R0.6 C=C(C)CCC(C)N MCULE-9861269774 [0,1,0,0,0,0|2,0,0]=3 1600 B7R0.6 C=C(C)CCC(C)O MCULE-5005514248 [0,1,0,0,0,0|2,0,0]=3 1601 B7R0.6 C=C(C)COC(=O)C MCULE-7739945243 [0,1,0,0,0,0|0,0,1]=2 1602 B7R0.6 C=C(Cl)CSC(=O)C MCULE-4264447992 [0,1,0,0,0,0|0,1,2]=4 1603 B7R0.6 CC(=CCC(C)C)C MCULE-5578852998 [0,1,0,0,0,0|2,0,0]=3 1604 B7R0.6 CC(=O)/C=C/N(C)C MCULE-7703636114 [0,1,0,0,0,0|2,0,1]=4 1605 B7R0.6 CC(=O)C=CC(=O)C MCULE-9472466140 [0,1,0,0,0,0|1,0,2]=4 1606 B7R0.6 CC(=O)C=CC(C)C MCULE-7908862390 [0,1,0,0,0,0|1,0,1]=3 1607 B7R0.6 CC(=O)C=CN(C)C MCULE-2800987098 [0,1,0,0,0,0|2,0,1]=4 1608 B7R0.6 CC(=O)CCC(=O)C MCULE-3166810473 [0,1,0,0,0,0|1,0,1]=3 1609 B7R0.6 CC(=O)CCC(=O)N MCULE-8943258659 [0,1,0,0,0,0|2,0,1]=4 1610 B7R0.6 CC(=O)CCC(=O)O MCULE-1392778065 [0,1,0,0,0,0|2,0,1]=4 1611 B7R0.6 CC(=O)CCC(=O)[O-] MCULE-4975344808 [0,1,0,0,0,0|2,0,1]=4 1612 B7R0.6 CC(=O)CCC(C)C MCULE-8518693213 [0,1,0,0,0,0|1,0,0]=2 1613 B7R0.6 CC(=O)CCC(F)F MCULE-3009814756 [0,1,0,0,0,0|2,0,0]=3 1614 B7R0.6 CC(=O)CCN(=O)=O MCULE-4726243654 [0,1,0,0,0,0|3,0,0]=4 1615 B7R0.6 CC(=O)CCN(C)C MCULE-1601022082 [0,1,0,0,0,0|2,0,0]=3 1616 B7R0.6 CC(=O)CCN(C)C MCULE-2933383790 [0,1,0,0,0,0|2,0,0]=3 1617 B7R0.6 CC(=O)CNC(=O)C MCULE-7941086302 [0,1,0,0,0,0|1,0,1]=3 1618 B7R0.6 CC(=O)CNC(=O)Cl MCULE-2043888982 [0,1,0,0,0,0|2,0,1]=4 1619 B7R0.6 CC(=O)CNC(C)C MCULE-2033555652 [0,1,0,0,0,0|2,0,0]=3 1620 B7R0.6 CC(=O)CNC(C)C MCULE-2990661777 [0,1,0,0,0,0|2,0,0]=3 1621 B7R0.6 CC(=O)COC(=O)C MCULE-2994552521 [0,1,0,0,0,0|0,0,1]=2 1622 B7R0.6 CC(=O)COC(C)C MCULE-4426769810 [0,1,0,0,0,0|2,0,0]=3 1623 B7R0.6 CC(=O)CSC(C)C MCULE-6486341454 [0,1,0,0,0,0|2,0,0]=3 1624 B7R0.6 CC(=O)NCC(=O)Cl MCULE-3900899057 [0,1,0,0,0,0|2,0,1]=4 1625 B7R0.6 CC(=O)NCC(=O)N MCULE-7934502236 [0,1,0,0,0,0|2,0,1]=4 1626 B7R0.6 CC(=O)NCC(=O)O MCULE-5811325186 [0,1,0,0,0,0|2,0,1]=4 1627 B7R0.6 CC(=O)NCC(C)O MCULE-2406798273 [0,1,0,0,0,0|1,0,0]=2 1628 B7R0.6 CC(=O)NN=C(C)C MCULE-9759901228 [0,1,0,0,0,0|2,0,1]=4 1629 B7R0.6 CC(=O)NNC(=O)C MCULE-3292268906 [0,1,0,0,0,0|2,0,1]=4 1630 B7R0.6 CC(=O)NNC(C)C MCULE-8896858149 [0,1,0,0,0,0|2,0,0]=3 1631 B7R0.6 CC(=O)OCC(=O)Cl MCULE-3086938222 [0,1,0,0,0,0|1,0,1]=3 1632 B7R0.6 CC(=O)OCC(=O)O MCULE-6837320824 [0,1,0,0,0,0|1,0,1]=3 1633 B7R0.6 CC(=O)OCC(=S)N MCULE-7893306089 [0,1,0,0,0,0|1,0,1]=3 1634 B7R0.6 CC(=O)OCC(C)C MCULE-4530584087 [0,1,0,0,0,0|0,0,0]=1 1635 B7R0.6 CC(=O)OCC(C)O MCULE-3660209140 [0,1,0,0,0,0|0,0,0]=1 1636 B7R0.6 CC(=O)OCC(F)F MCULE-9491615455 [0,1,0,0,0,0|1,0,0]=2 1637 B7R0.6 CC(=O)ON=C(C)C MCULE-4373487613 [0,1,0,0,0,0|1,0,1]=3 1638 B7R0.6 CC(=O)SCC(=O)O MCULE-1974657694 [0,1,0,0,0,0|1,1,1]=4 1639 B7R0.6 CC(Br)CCC(C)Br MCULE-4511070452 [0,1,0,0,0,0|2,0,1]=4 1640 B7R0.6 CC(C)/C=C/C(=O)O MCULE-1713089516 [0,1,0,0,0,0|2,0,1]=4 1641 B7R0.6 CC(C)C#CC(=O)O MCULE-6919480170 [0,1,0,0,0,0|2,0,1]=4 1642 B7R0.6 CC(C)C=CC(=O)O MCULE-3981825295 [0,1,0,0,0,0|2,0,1]=4 1643 B7R0.6 CC(C)CCC(=N)N MCULE-1131862481 [0,1,0,0,0,0|3,0,0]=4 1644 B7R0.6 CC(C)CCC(=N)N MCULE-3040841257 [0,1,0,0,0,0|3,0,0]=4 1645 B7R0.6 CC(C)CCC(=O)Cl MCULE-6874903195 [0,1,0,0,0,0|2,0,0]=3 1646 B7R0.6 CC(C)CCC(=O)N MCULE-3571818514 [0,1,0,0,0,0|2,0,0]=3 1647 B7R0.6 CC(C)CCC(=O)O MCULE-7691755837 [0,1,0,0,0,0|2,0,0]=3 1648 B7R0.6 CC(C)CCC(=S)N MCULE-7175463316 [0,1,0,0,0,0|2,1,0]=4 1649 B7R0.6 CC(C)CCC(C)Br MCULE-4005079361 [0,1,0,0,0,0|2,0,1]=4 1650 B7R0.6 CC(C)CCC(C)C MCULE-4093485278 [0,1,0,0,0,0|2,0,1]=4 1651 B7R0.6 CC(C)CCC(C)N MCULE-3038746969 [0,1,0,0,0,0|2,0,1]=4 1652 B7R0.6 CC(C)CCC(C)N MCULE-7972635029 [0,1,0,0,0,0|2,0,1]=4 1653 B7R0.6 CC(C)CCC(C)O MCULE-6292509345 [0,1,0,0,0,0|1,0,2]=4 1654 B7R0.6 CC(C)CCN(=O)=O MCULE-1596287630 [0,1,0,0,0,0|3,0,0]=4 1655 B7R0.6 CC(C)CNC(=O)N MCULE-8112905719 [0,1,0,0,0,0|2,0,0]=3 1656 B7R0.6 CC(C)CNC(=S)N MCULE-4099725026 [0,1,0,0,0,0|2,1,0]=4 1657 B7R0.6 CC(C)CNC(C)C MCULE-1556200503 [0,1,0,0,0,0|2,0,1]=4 1658 B7R0.6 CC(C)CNC(C)C MCULE-9703437877 [0,1,0,0,0,0|2,0,1]=4 1659 B7R0.6 CC(C)COC(=O)Cl MCULE-4183178448 [0,1,0,0,0,0|1,0,0]=2 1660 B7R0.6 CC(C)COC(=O)N MCULE-3163620577 [0,1,0,0,0,0|1,0,0]=2 1661 B7R0.6 CC(C)COC(=S)[S-] MCULE-2950087835 [0,1,0,0,0,0|1,1,0]=3 1662 B7R0.6 CC(C)COC(=S)[S-] MCULE-9454360265 [0,1,0,0,0,0|1,1,0]=3 1663 B7R0.6 CC(C)CSC(=N)N MCULE-3628542246 [0,1,0,0,0,0|2,1,0]=4 1664 B7R0.6 CC(C)CSC(=N)N MCULE-5586193026 [0,1,0,0,0,0|2,1,0]=4 1665 B7R0.6 CC(C)NCC(=O)Cl MCULE-3841055671 [0,1,0,0,0,0|3,0,0]=4 1666 B7R0.6 CC(C)NCC(=O)N MCULE-3100213662 [0,1,0,0,0,0|3,0,0]=4 1667 B7R0.6 CC(C)NCC(=O)N MCULE-9178070179 [0,1,0,0,0,0|3,0,0]=4 1668 B7R0.6 CC(C)NCC(=O)O MCULE-4344882030 [0,1,0,0,0,0|3,0,0]=4 1669 B7R0.6 CC(C)NCC(=O)O MCULE-7052227156 [0,1,0,0,0,0|3,0,0]=4 1670 B7R0.6 CC(C)OCC(=O)Cl MCULE-5892054766 [0,1,0,0,0,0|3,0,0]=4 1671 B7R0.6 CC(C)OCC(=O)O MCULE-8295905061 [0,1,0,0,0,0|3,0,0]=4 1672 B7R0.6 CC(C)OC[C@H](C)O MCULE-2195035455 [0,1,0,0,0,0|1,0,1]=3 1673 B7R0.6 CC(C)SCC(=O)O MCULE-3990750464 [0,1,0,0,0,0|3,0,0]=4 1674 B7R0.6 CC(Cl)CCC(=O)Cl MCULE-3066199297 [0,1,0,0,0,0|2,0,0]=3 1675 B7R0.6 CC(N)CCC(=O)O MCULE-3711689460 [0,1,0,0,0,0|2,0,0]=3 1676 B7R0.6 CC(N)CCC(=O)O MCULE-5008572656 [0,1,0,0,0,0|2,0,0]=3 1677 B7R0.6 CC(N)CCN(C)C MCULE-9256005237 [0,1,0,0,0,0|3,0,0]=4 1678 B7R0.6 CC(N)CCS(=O)C MCULE-2870651099 [0,1,0,0,0,0|2,0,0]=3 1679 B7R0.6 CC(N)CCS(=O)C MCULE-7863963703 [0,1,0,0,0,0|2,0,0]=3 1680 B7R0.6 CC(N)COC(F)F MCULE-1844819697 [0,1,0,0,0,0|2,0,1]=4 1681 B7R0.6 CC(N)COC(F)F MCULE-9510461424 [0,1,0,0,0,0|2,0,1]=4 1682 B7R0.6 CC(O)CCC(=O)O MCULE-6352217997 [0,1,0,0,0,0|2,0,0]=3 1683 B7R0.6 CC(O)CCC(=O)[O-] MCULE-5872581098 [0,1,0,0,0,0|2,0,0]=3 1684 B7R0.6 CC(O)CCC(C)O MCULE-6170497684 [0,1,0,0,0,0|1,0,2]=4 1685 B7R0.6 CC(O)CCN(C)C MCULE-7246080230 [0,1,0,0,0,0|3,0,0]=4 1686 B7R0.6 CC(O)CNC(C)C MCULE-9932831006 [0,1,0,0,0,0|2,0,1]=4 1687 B7R0.6 CC(O)COC(C)C MCULE-3357280817 [0,1,0,0,0,0|1,0,1]=3 1688 B7R0.6 CC(S)CCC(=O)O MCULE-9612173883 [0,1,0,0,0,0|2,0,0]=3 1689 B7R0.6 CN(C)CCC(=O)O MCULE-5553815845 [0,1,0,0,0,0|3,0,0]=4 1690 B7R0.6 CN(C)CCC(=O)O MCULE-7454823322 [0,1,0,0,0,0|3,0,0]=4 1691 B7R0.6 CS(=O)CCC(=O)O MCULE-8243349779 [0,1,0,0,0,0|3,0,0]=4 1692 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-3295260637 [0,1,0,0,0,0|2,0,0]=3 1693 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-5409083898 [0,1,0,0,0,0|2,0,0]=3 1694 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-6530230723 [0,1,0,0,0,0|2,0,0]=3 1695 B7R0.6 C[C@@H](N)CCC(=O)O MCULE-7530095699 [0,1,0,0,0,0|2,0,0]=3 1696 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-3982464496 [0,1,0,0,0,0|1,0,2]=4 1697 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-6083261012 [0,1,0,0,0,0|1,0,2]=4 1698 B7R0.6 C[C@@H](O)CC[C@@H](C)O MCULE-8142548171 [0,1,0,0,0,0|1,0,2]=4 1699 B7R0.6 C[C@@H](O)COC(=O)O MCULE-3794886346 [0,1,0,0,0,0|1,0,0]=2 1700 B7R0.6 C[C@H](N)CCC(=O)O MCULE-3621527632 [0,1,0,0,0,0|2,0,0]=3 1701 B7R0.6 C[C@H](N)CCC(=O)O MCULE-7670557122 [0,1,0,0,0,0|2,0,0]=3 1702 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-5867971604 [0,1,0,0,0,0|1,0,2]=4 1703 B7R0.6 C[C@H](O)CC[C@H](C)O MCULE-7024859164 [0,1,0,0,0,0|1,0,2]=4 1704 B7R0.6 C[S+](C)CCC(=O)O MCULE-8115187503 [0,1,0,0,0,0|3,0,0]=4 1705 B7R0.6 C[S+](C)CCC(=O)O MCULE-9668037011 [0,1,0,0,0,0|3,0,0]=4 1706 B7R0.6 C[S+](C)CCC(=O)[O-] MCULE-4039981521 [0,1,0,0,0,0|3,0,0]=4 1707 B7R0.6 O=C(Cl)OCC(F)F MCULE-4977819635 [0,1,0,0,0,0|2,0,0]=3 1708 B7R0.6 O=C(O)CCC(F)F MCULE-6002651269 [0,1,0,0,0,0|3,0,0]=4 1709 B7R0.8 C#CCOS(=O)(=O)C MCULE-4442812251 [0,1,0,0,0,0|1,0,2]=4 1710 B7R0.8 C=CCOS(=O)(=O)C MCULE-5703564114 [0,1,0,0,0,0|1,0,2]=4 1711 B7R0.8 CC(C)(C)OCCBr MCULE-8312810817 [0,1,0,0,0,0|2,0,1]=4 1712 B7R0.8 CC(C)(C)OCCI MCULE-2149225094 [0,1,0,0,0,0|2,0,1]=4 1713 B7R0.8 CC(C)(C)OCCN MCULE-8529298799 [0,1,0,0,0,0|2,0,1]=4 1714 B7R0.8 CC(C)(C)OCCN MCULE-9331958272 [0,1,0,0,0,0|2,0,1]=4 1715 B7R0.8 CC(C)(C)OCCO MCULE-7079168773 [0,1,0,0,0,0|2,0,1]=4 1716 B7R0.8 CCCCC(C)(C)C MCULE-4446772090 [0,1,0,0,0,0|2,0,1]=4 1717 B7R0.8 CCCCC(C)(C)O MCULE-6518378731 [0,1,0,0,0,0|1,0,2]=4 1718 B7R0.8 CCCCP(=O)(O)O MCULE-8779445551 [0,1,0,0,0,0|3,0,0]=4 1719 B7R0.8 CCCCS(=O)(=O)Cl MCULE-8979625112 [0,1,0,0,0,0|3,0,0]=4 1720 B7R0.8 CCCCS(=O)(=O)F MCULE-6322697475 [0,1,0,0,0,0|3,0,0]=4 1721 B7R0.8 CCCCS(=O)(=O)N MCULE-2248674497 [0,1,0,0,0,0|3,0,0]=4 1722 B7R0.8 CCCCS(=O)(=O)O MCULE-8566681643 [0,1,0,0,0,0|3,0,0]=4 1723 B7R0.8 CCCCS(=O)(=O)[O-] MCULE-9859570424 [0,1,0,0,0,0|3,0,0]=4 1724 B7R0.8 CCCC[N+](C)(C)C MCULE-6094336787 [0,1,0,0,0,0|3,0,0]=4 1725 B7R0.8 CCCC[N+](C)(C)C MCULE-6922813961 [0,1,0,0,0,0|3,0,0]=4 1726 B7R0.8 CCCC[N+](C)(C)C MCULE-7733910392 [0,1,0,0,0,0|3,0,0]=4 1727 B7R0.8 CCCC[Si](C)(C)Cl MCULE-6810849853 [0,1,0,0,0,0|2,1,0]=4 1728 B7R0.8 CCCC[Si](C)(Cl)Cl MCULE-9750896400 [0,1,0,0,0,0|2,1,0]=4 1729 B7R0.8 CCCNC(C)(C)C MCULE-3688632776 [0,1,0,0,0,0|2,0,1]=4 1730 B7R0.8 CCCNC(C)(C)C MCULE-5354845024 [0,1,0,0,0,0|2,0,1]=4 1731 B7R0.8 CCCNS(=O)(=O)Cl MCULE-2009056611 [0,1,0,0,0,0|3,0,0]=4 1732 B7R0.8 CCCNS(=O)(=O)N MCULE-6687904727 [0,1,0,0,0,0|3,0,0]=4 1733 B7R0.8 CCCNS(=O)(=O)[NH-] MCULE-3618826223 [0,1,0,0,0,0|3,0,0]=4 1734 B7R0.8 CCCNS(=O)(=O)[NH-] MCULE-6494717778 [0,1,0,0,0,0|3,0,0]=4 1735 B7R0.8 CCCNS(=O)(=O)[NH-] MCULE-7408201076 [0,1,0,0,0,0|3,0,0]=4 1736 B7R0.8 CCCOC(C)(C)C MCULE-4291970439 [0,1,0,0,0,0|1,0,1]=3 1737 B7R0.8 CCCOP(=O)(C)O MCULE-3556230581 [0,1,0,0,0,0|1,0,0]=2 1738 B7R0.8 CCCOP(=S)(C)[S-] MCULE-1450745735 [0,1,0,0,0,0|1,1,0]=3 1739 B7R0.8 CCCOP(=S)(C)[S-] MCULE-7731450470 [0,1,0,0,0,0|1,1,0]=3 1740 B7R0.8 CCCOS(=O)(=O)C MCULE-8443601449 [0,1,0,0,0,0|1,0,0]=2 1741 B7R0.8 CCCOS(=O)(=O)[O-] MCULE-1092510375 [0,1,0,0,0,0|2,0,0]=3 1742 B7R0.8 CCCOS(=O)(=O)[O-] MCULE-6070478843 [0,1,0,0,0,0|2,0,0]=3 1743 B7R0.8 CNCCS(=O)(=O)C MCULE-5880210307 [0,1,0,0,0,0|3,0,0]=4 1744 B7R0.8 CNCCS(=O)(=O)C MCULE-6808272578 [0,1,0,0,0,0|3,0,0]=4 1745 B7R0.8 CP(=O)(O)CCCN MCULE-1158131505 [0,1,0,0,0,0|3,0,0]=4 1746 B7R0.8 CP(=O)(O)CCCN MCULE-8748054523 [0,1,0,0,0,0|3,0,0]=4 1747 B7R0.8 CS(=O)(=NCCN)C MCULE-3558710314 [0,1,0,0,0,0|3,0,0]=4 1748 B7R0.8 CS(=O)(=NCCN)C MCULE-4394646642 [0,1,0,0,0,0|3,0,0]=4 1749 B7R0.8 CS(=O)(=NCCN)C MCULE-4787241983 [0,1,0,0,0,0|3,0,0]=4 1750 B7R0.8 CS(=O)(=O)CCCBr MCULE-2086749914 [0,1,0,0,0,0|3,0,0]=4 1751 B7R0.8 CS(=O)(=O)CCCCl MCULE-6105041795 [0,1,0,0,0,0|3,0,0]=4 1752 B7R0.8 CS(=O)(=O)CCCI MCULE-8038229906 [0,1,0,0,0,0|3,0,0]=4 1753 B7R0.8 CS(=O)(=O)CCCN MCULE-2348963019 [0,1,0,0,0,0|3,0,0]=4 1754 B7R0.8 CS(=O)(=O)CCCN MCULE-8313734317 [0,1,0,0,0,0|3,0,0]=4 1755 B7R0.8 CS(=O)(=O)CCCO MCULE-6816358475 [0,1,0,0,0,0|3,0,0]=4 1756 B7R0.8 CS(=O)(=O)NCCBr MCULE-1824456277 [0,1,0,0,0,0|3,0,0]=4 1757 B7R0.8 CS(=O)(=O)NCCCl MCULE-8530695984 [0,1,0,0,0,0|3,0,0]=4 1758 B7R0.8 CS(=O)(=O)NCCI MCULE-8659941425 [0,1,0,0,0,0|3,0,0]=4 1759 B7R0.8 CS(=O)(=O)NCCN MCULE-4856835139 [0,1,0,0,0,0|3,0,0]=4 1760 B7R0.8 CS(=O)(=O)NCCN MCULE-5265059473 [0,1,0,0,0,0|3,0,0]=4 1761 B7R0.8 CS(=O)(=O)NCCO MCULE-2565384564 [0,1,0,0,0,0|3,0,0]=4 1762 B7R0.8 CS(=O)(=O)OCCCl MCULE-8198079010 [0,1,0,0,0,0|2,0,0]=3 1763 B7R0.8 CS(=O)(=O)OCCF MCULE-7277769013 [0,1,0,0,0,0|2,0,0]=3 1764 B7R0.8 CS(=O)(=O)SCCN MCULE-5969057578 [0,1,0,0,0,0|2,1,0]=4 1765 B7R0.8 CS(=O)(=O)SCCN MCULE-7003127591 [0,1,0,0,0,0|2,1,0]=4 1766 B7R0.8 CS(=O)(=S)OCCBr MCULE-3017854867 [0,1,0,0,0,0|2,0,0]=3 1767 B7R0.8 CS(=O)(=S)OCCN MCULE-7727893446 [0,1,0,0,0,0|2,0,0]=3 1768 B7R0.8 CS(=O)(=S)OCCN MCULE-8197856093 [0,1,0,0,0,0|2,0,0]=3 1769 B7R0.8 C[Si](C)(C)OCCCl MCULE-1539145182 [0,1,0,0,0,0|2,1,0]=4 1770 B7R0.8 C[Si](C)(C)OCCI MCULE-7904217545 [0,1,0,0,0,0|2,1,0]=4 1771 B7R0.8 C[Si](C)(C)OCCN MCULE-2773772382 [0,1,0,0,0,0|2,1,0]=4 1772 B7R0.8 C[Si](C)(C)OCCO MCULE-3523451816 [0,1,0,0,0,0|2,1,0]=4 1773 B7R0.8 NCCOP(=O)(O)O MCULE-8775715246 [0,1,0,0,0,0|3,0,0]=4 1774 B7R0.8 NCCOP(=O)([O-])[O-] MCULE-7319714248 [0,1,0,0,0,0|3,0,0]=4 1775 B7R0.8 NCCOS(=O)(=O)O MCULE-1813036738 [0,1,0,0,0,0|3,0,0]=4 1776 B7R0.8 O=P(Cl)(Cl)OCCBr MCULE-7892286580 [0,1,0,0,0,0|3,0,0]=4 1777 B7R0.8 O=P(Cl)(Cl)OCCCl MCULE-4630375119 [0,1,0,0,0,0|3,0,0]=4 1778 B7R0.8 O=S(=O)(O)OCCCl MCULE-4767434420 [0,1,0,0,0,0|3,0,0]=4 1779 B7R1.2 C1(CNC(=O)C1)N MCULE-6663942203 [0,0,0,1,0,0|2,0,0]=3 1780 B7R1.2 C1(CNC(=O)C1)N MCULE-7862049809 [0,0,0,1,0,0|2,0,0]=3 1781 B7R1.2 C1(CNC(=O)C1)O MCULE-5557473335 [0,0,0,1,0,0|2,0,0]=3 1782 B7R1.2 C1(COC(=O)N1)C MCULE-2821940224 [0,0,0,1,0,0|1,0,0]=2 1783 B7R1.2 CC1=CC(=NO1)C MCULE-5128459474 [0,0,0,1,0,0|2,0,1]=4 1784 B7R1.2 CC1=CC(=O)CC1 MCULE-5496838191 [0,0,0,1,0,0|1,0,2]=4 1785 B7R1.2 CC1=CC(=O)CO1 MCULE-6570401610 [0,0,0,1,0,0|2,0,1]=4 1786 B7R1.2 CC1=CC(=O)OC1 MCULE-6549202383 [0,0,0,1,0,0|0,0,2]=3 1787 B7R1.2 CC1=COC(=C1)C MCULE-9104872009 [0,0,0,1,0,0|1,0,2]=4 1788 B7R1.2 CC1=COC(=N1)C MCULE-3626673481 [0,0,0,1,0,0|1,0,2]=4 1789 B7R1.2 CC1=NC(CC1)C MCULE-9630685459 [0,0,0,1,0,0|2,0,0]=3 1790 B7R1.2 CC1=NC(CO1)C MCULE-2489340707 [0,0,0,1,0,0|1,0,0]=2 1791 B7R1.2 CC1=NC(CS1)C MCULE-8843957654 [0,0,0,1,0,0|1,1,0]=3 1792 B7R1.2 CC1=NNC(=O)C1 MCULE-2406140611 [0,0,0,1,0,0|2,0,1]=4 1793 B7R1.2 CC1=NOC(=O)C1 MCULE-2665741338 [0,0,0,1,0,0|1,0,1]=3 1794 B7R1.2 CC1=NOC(=O)C1 MCULE-3084424307 [0,0,0,1,0,0|1,0,1]=3 1795 B7R1.2 CC1=NOC(=O)O1 MCULE-5416417255 [0,0,0,1,0,0|2,0,1]=4 1796 B7R1.2 CC1C=CC(=O)O1 MCULE-7172637771 [0,0,0,1,0,0|2,0,1]=4 1797 B7R1.2 CC1CC(=NO1)N MCULE-8353889650 [0,0,0,1,0,0|3,0,0]=4 1798 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [0,0,0,1,0,0|2,0,0]=3 1799 B7R1.2 CC1CC(=O)CS1 MCULE-7518365363 [0,0,0,1,0,0|2,0,0]=3 1800 B7R1.2 CC1CC(=O)NN1 MCULE-2056748401 [0,0,0,1,0,0|2,0,0]=3 1801 B7R1.2 CC1CC(=O)NN1 MCULE-8107476665 [0,0,0,1,0,0|2,0,0]=3 1802 B7R1.2 CC1CC(CO1)N MCULE-5031195609 [0,0,0,1,0,0|2,0,1]=4 1803 B7R1.2 CC1CC(CO1)N MCULE-6627149239 [0,0,0,1,0,0|2,0,1]=4 1804 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [0,0,0,1,0,0|2,0,1]=4 1805 B7R1.2 CC1CCC(=N1)N MCULE-3470792627 [0,0,0,1,0,0|3,0,0]=4 1806 B7R1.2 CC1CCC(=N1)N MCULE-7952001291 [0,0,0,1,0,0|3,0,0]=4 1807 B7R1.2 CC1CCC(=O)C1 MCULE-6716533429 [0,0,0,1,0,0|1,0,0]=2 1808 B7R1.2 CC1CCC(=O)N1 MCULE-8928464449 [0,0,0,1,0,0|2,0,0]=3 1809 B7R1.2 CC1CCC(=O)N1 MCULE-9236321365 [0,0,0,1,0,0|2,0,0]=3 1810 B7R1.2 CC1CCC(=O)O1 MCULE-3014789527 [0,0,0,1,0,0|2,0,0]=3 1811 B7R1.2 CC1CCC(C1)Br MCULE-3834311364 [0,0,0,1,0,0|2,0,1]=4 1812 B7R1.2 CC1CCC(C1)Cl MCULE-7669391571 [0,0,0,1,0,0|2,0,1]=4 1813 B7R1.2 CC1CCC(C1)N MCULE-3681457592 [0,0,0,1,0,0|2,0,1]=4 1814 B7R1.2 CC1CCC(C1)N MCULE-8238390084 [0,0,0,1,0,0|2,0,1]=4 1815 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [0,0,0,1,0,0|1,0,2]=4 1816 B7R1.2 CC1CCC(N1)C MCULE-8652550641 [0,0,0,1,0,0|2,0,1]=4 1817 B7R1.2 CC1CCC(N1)C MCULE-9945795318 [0,0,0,1,0,0|2,0,1]=4 1818 B7R1.2 CC1CCC(O1)C MCULE-6766843462 [0,0,0,1,0,0|1,0,2]=4 1819 B7R1.2 CC1CC[C@H](N1)C MCULE-7537248866 [0,0,0,1,0,0|2,0,1]=4 1820 B7R1.2 CC1CC[C@H](N1)C MCULE-8839413924 [0,0,0,1,0,0|2,0,1]=4 1821 B7R1.2 CC1CN=C(O1)N MCULE-2936787754 [0,0,0,1,0,0|2,0,1]=4 1822 B7R1.2 CC1CN=C(O1)N MCULE-5542499755 [0,0,0,1,0,0|2,0,1]=4 1823 B7R1.2 CC1CN=C(S1)N MCULE-5641549444 [0,0,0,1,0,0|2,1,0]=4 1824 B7R1.2 CC1CN=C(S1)N MCULE-9229369376 [0,0,0,1,0,0|2,1,0]=4 1825 B7R1.2 CC1CNC(=O)C1 MCULE-7180589009 [0,0,0,1,0,0|1,0,0]=2 1826 B7R1.2 CC1CNC(=O)N1 MCULE-3789430210 [0,0,0,1,0,0|2,0,0]=3 1827 B7R1.2 CC1CNC(=O)O1 MCULE-1288358267 [0,0,0,1,0,0|2,0,0]=3 1828 B7R1.2 CC1CNC(=S)N1 MCULE-5305006156 [0,0,0,1,0,0|2,1,0]=4 1829 B7R1.2 CC1CNC(=S)S1 MCULE-1131079445 [0,0,0,1,0,0|2,1,0]=4 1830 B7R1.2 CC1CNC(C1)C MCULE-3051496448 [0,0,0,1,0,0|2,0,1]=4 1831 B7R1.2 CC1CNC(C1)C MCULE-9324057254 [0,0,0,1,0,0|2,0,1]=4 1832 B7R1.2 CC1COC(=O)C1 MCULE-7226555218 [0,0,0,1,0,0|0,0,0]=1 1833 B7R1.2 CC1COC(=O)N1 MCULE-5787960105 [0,0,0,1,0,0|1,0,0]=2 1834 B7R1.2 CC1COC(=O)O1 MCULE-9055336051 [0,0,0,1,0,0|1,0,0]=2 1835 B7R1.2 CC1COC(=S)N1 MCULE-4793665300 [0,0,0,1,0,0|1,1,0]=3 1836 B7R1.2 CC1COC(O1)C MCULE-5670718739 [0,0,0,1,0,0|0,0,2]=3 1837 B7R1.2 CC1COS(=O)O1 MCULE-7795249539 [0,0,0,1,0,0|2,0,0]=3 1838 B7R1.2 CC1CSC(=O)S1 MCULE-5074098161 [0,0,0,1,0,0|1,1,0]=3 1839 B7R1.2 CC1CSC(=S)N1 MCULE-9334196132 [0,0,0,1,0,0|1,2,0]=4 1840 B7R1.2 CC1NCC(=O)N1 MCULE-9790180398 [0,0,0,1,0,0|3,0,0]=4 1841 B7R1.2 CN1CCC(=O)C1 MCULE-4017029823 [0,0,0,1,0,0|2,0,0]=3 1842 B7R1.2 CN1CCC(=O)C1 MCULE-8684002131 [0,0,0,1,0,0|2,0,0]=3 1843 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-1621276410 [0,0,0,1,0,0|2,0,0]=3 1844 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-8721208019 [0,0,0,1,0,0|2,0,0]=3 1845 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-2915942259 [0,0,0,1,0,0|2,0,0]=3 1846 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-8123247569 [0,0,0,1,0,0|2,0,0]=3 1847 B7R1.2 C[C@@H]1CCC(=O)O1 MCULE-5934008113 [0,0,0,1,0,0|2,0,0]=3 1848 B7R1.2 C[C@@H]1CC[C@@H](C1)N MCULE-9471729241 [0,0,0,1,0,0|2,0,1]=4 1849 B7R1.2 C[C@@H]1CC[C@H](C1)N MCULE-5368765184 [0,0,0,1,0,0|2,0,1]=4 1850 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-1673197449 [0,0,0,1,0,0|2,0,1]=4 1851 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-2729648845 [0,0,0,1,0,0|2,0,1]=4 1852 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-4960548681 [0,0,0,1,0,0|2,0,1]=4 1853 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-9686295802 [0,0,0,1,0,0|2,0,1]=4 1854 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-2439559922 [0,0,0,1,0,0|1,0,0]=2 1855 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-7246323100 [0,0,0,1,0,0|1,0,0]=2 1856 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-8336717940 [0,0,0,1,0,0|2,0,0]=3 1857 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-9661080313 [0,0,0,1,0,0|2,0,0]=3 1858 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1121808555 [0,0,0,1,0,0|0,0,0]=1 1859 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1627827491 [0,0,0,1,0,0|0,0,0]=1 1860 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-2439588002 [0,0,0,1,0,0|1,0,0]=2 1861 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-5329850427 [0,0,0,1,0,0|1,0,0]=2 1862 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-3187800510 [0,0,0,1,0,0|1,0,0]=2 1863 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-6719271655 [0,0,0,1,0,0|1,0,0]=2 1864 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-3272300487 [0,0,0,1,0,0|2,0,0]=3 1865 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-4583858198 [0,0,0,1,0,0|2,0,0]=3 1866 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-5135895304 [0,0,0,1,0,0|2,0,0]=3 1867 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-6058896534 [0,0,0,1,0,0|2,0,0]=3 1868 B7R1.2 C[C@H]1CCC(=O)C1 MCULE-7319626625 [0,0,0,1,0,0|1,0,0]=2 1869 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-2618122031 [0,0,0,1,0,0|2,0,0]=3 1870 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-6630066118 [0,0,0,1,0,0|2,0,0]=3 1871 B7R1.2 C[C@H]1CCC(=O)O1 MCULE-5274272771 [0,0,0,1,0,0|2,0,0]=3 1872 B7R1.2 C[C@H]1CC[C@@H](C1)N MCULE-1080493056 [0,0,0,1,0,0|2,0,1]=4 1873 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-4583560293 [0,0,0,1,0,0|2,0,1]=4 1874 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8297612622 [0,0,0,1,0,0|2,0,1]=4 1875 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8699883146 [0,0,0,1,0,0|2,0,1]=4 1876 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8917914682 [0,0,0,1,0,0|2,0,1]=4 1877 B7R1.2 C[C@H]1CC[C@H](C1)C MCULE-8059507758 [0,0,0,1,0,0|2,0,1]=4 1878 B7R1.2 C[C@H]1CC[C@H](C1)N MCULE-7070775136 [0,0,0,1,0,0|2,0,1]=4 1879 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-1935235769 [0,0,0,1,0,0|2,0,1]=4 1880 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-9833374653 [0,0,0,1,0,0|2,0,1]=4 1881 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-3395896178 [0,0,0,1,0,0|1,0,0]=2 1882 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-8492971593 [0,0,0,1,0,0|1,0,0]=2 1883 B7R1.2 C[C@H]1COC(=O)C1 MCULE-6050720348 [0,0,0,1,0,0|0,0,0]=1 1884 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7240884474 [0,0,0,1,0,0|1,0,0]=2 1885 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7811823319 [0,0,0,1,0,0|1,0,0]=2 1886 B7R1.2 C[C@H]1COC(=O)O1 MCULE-2416711374 [0,0,0,1,0,0|1,0,0]=2 1887 B7R1.2 C[C@H]1COC(=O)O1 MCULE-4223856214 [0,0,0,1,0,0|1,0,0]=2 1888 B7R1.2 C[C@H]1CSC(=S)N1 MCULE-6690407523 [0,0,0,1,0,0|1,2,0]=4 1889 B7R1.2 NC1CCC(=O)C1 MCULE-5102535286 [0,0,0,1,0,0|2,0,0]=3 1890 B7R1.2 NC1CCC(=O)C1 MCULE-7722818264 [0,0,0,1,0,0|2,0,0]=3 1891 B7R1.2 NC1CCC(=O)N1 MCULE-1843033026 [0,0,0,1,0,0|3,0,0]=4 1892 B7R1.2 NC1CCC(=O)N1 MCULE-7671057220 [0,0,0,1,0,0|3,0,0]=4 1893 B7R1.2 NC1CCS(=O)C1 MCULE-7416029311 [0,0,0,1,0,0|3,0,0]=4 1894 B7R1.2 NC1CCS(=O)C1 MCULE-8914660363 [0,0,0,1,0,0|3,0,0]=4 1895 B7R1.2 NC1CNC(=O)C1 MCULE-1690074091 [0,0,0,1,0,0|2,0,0]=3 1896 B7R1.2 NC1CNC(=O)C1 MCULE-2563813057 [0,0,0,1,0,0|2,0,0]=3 1897 B7R1.2 NC1CNC(=O)C1 MCULE-5332234739 [0,0,0,1,0,0|2,0,0]=3 1898 B7R1.2 NC1CNC(=O)C1 MCULE-9955937074 [0,0,0,1,0,0|2,0,0]=3 1899 B7R1.2 NC1COC(=O)C1 MCULE-1027386953 [0,0,0,1,0,0|1,0,0]=2 1900 B7R1.2 NC1COC(=O)C1 MCULE-1493825051 [0,0,0,1,0,0|1,0,0]=2 1901 B7R1.2 NC1COC(=O)C1 MCULE-3118610284 [0,0,0,1,0,0|1,0,0]=2 1902 B7R1.2 NC1COC(=O)C1 MCULE-8194840985 [0,0,0,1,0,0|1,0,0]=2 1903 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-1502944618 [0,0,0,1,0,0|2,0,0]=3 1904 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-2444469131 [0,0,0,1,0,0|2,0,0]=3 1905 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-7277309874 [0,0,0,1,0,0|2,0,0]=3 1906 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-8533160250 [0,0,0,1,0,0|2,0,0]=3 1907 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-2437548952 [0,0,0,1,0,0|1,0,0]=2 1908 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4215135536 [0,0,0,1,0,0|1,0,0]=2 1909 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4884145743 [0,0,0,1,0,0|1,0,0]=2 1910 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-9276068415 [0,0,0,1,0,0|1,0,0]=2 1911 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-1884894725 [0,0,0,1,0,0|2,0,0]=3 1912 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-2130809002 [0,0,0,1,0,0|2,0,0]=3 1913 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-3881338264 [0,0,0,1,0,0|2,0,0]=3 1914 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-4324375667 [0,0,0,1,0,0|2,0,0]=3 1915 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-5900761307 [0,0,0,1,0,0|2,0,0]=3 1916 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-6007209179 [0,0,0,1,0,0|2,0,0]=3 1917 B7R1.2 N[C@H]1COC(=O)C1 MCULE-2936782126 [0,0,0,1,0,0|1,0,0]=2 1918 B7R1.2 N[C@H]1COC(=O)C1 MCULE-4255876921 [0,0,0,1,0,0|1,0,0]=2 1919 B7R1.2 N[C@H]1COC(=O)C1 MCULE-5377151477 [0,0,0,1,0,0|1,0,0]=2 1920 B7R1.2 N[C@H]1COC(=O)C1 MCULE-6406960509 [0,0,0,1,0,0|1,0,0]=2 1921 B7R1.2 O=C1C=C(CO1)Br MCULE-8883097432 [0,0,0,1,0,0|1,0,2]=4 1922 B7R1.2 O=C1C=C(CO1)O MCULE-5095558101 [0,0,0,1,0,0|1,0,2]=4 1923 B7R1.2 O=C1C=CC(C1)O MCULE-6464451546 [0,0,0,1,0,0|2,0,1]=4 1924 B7R1.2 O=C1C=C[C@@H](C1)O MCULE-4535052390 [0,0,0,1,0,0|2,0,1]=4 1925 B7R1.2 O=C1C=C[C@H](C1)O MCULE-9347047598 [0,0,0,1,0,0|2,0,1]=4 1926 B7R1.2 O=C1CC(=CO1)O MCULE-3691688750 [0,0,0,1,0,0|1,0,2]=4 1927 B7R1.2 O=C1CC(CN1)O MCULE-8498039777 [0,0,0,1,0,0|2,0,0]=3 1928 B7R1.2 O=C1CC(CN1)S MCULE-3257609096 [0,0,0,1,0,0|2,0,0]=3 1929 B7R1.2 O=C1CC(CO1)O MCULE-3779919332 [0,0,0,1,0,0|1,0,0]=2 1930 B7R1.2 O=C1CC(CO1)O MCULE-5609071664 [0,0,0,1,0,0|1,0,0]=2 1931 B7R1.2 O=C1CCC(=O)C1 MCULE-6436831689 [0,0,0,1,0,0|2,0,1]=4 1932 B7R1.2 O=C1CCC(C1)F MCULE-9585894610 [0,0,0,1,0,0|2,0,0]=3 1933 B7R1.2 O=C1CCC(C1)I MCULE-5558007377 [0,0,0,1,0,0|2,0,0]=3 1934 B7R1.2 O=C1CCC(C1)O MCULE-8500536547 [0,0,0,1,0,0|2,0,0]=3 1935 B7R1.2 O=C1CCC(N1)O MCULE-1790956080 [0,0,0,1,0,0|3,0,0]=4 1936 B7R1.2 O=C1CCC(O1)F MCULE-6874239017 [0,0,0,1,0,0|3,0,0]=4 1937 B7R1.2 O=C1CCC(O1)O MCULE-5296344468 [0,0,0,1,0,0|3,0,0]=4 1938 B7R1.2 O=C1CNC(=O)C1 MCULE-6981924013 [0,0,0,1,0,0|2,0,1]=4 1939 B7R1.2 O=C1COC(=O)C1 MCULE-3258090872 [0,0,0,1,0,0|1,0,1]=3 1940 B7R1.2 O=C1COC(=O)N1 MCULE-3103815953 [0,0,0,1,0,0|2,0,1]=4 1941 B7R1.2 O=C1COC(=O)[N-]1 MCULE-2786348217 [0,0,0,1,0,0|2,0,1]=4 1942 B7R1.2 O=C1C[C@@H](CN1)O MCULE-2016792324 [0,0,0,1,0,0|2,0,0]=3 1943 B7R1.2 O=C1C[C@@H](CN1)O MCULE-9756194758 [0,0,0,1,0,0|2,0,0]=3 1944 B7R1.2 O=C1C[C@@H](CO1)O MCULE-1467506377 [0,0,0,1,0,0|1,0,0]=2 1945 B7R1.2 O=C1C[C@@H](CO1)O MCULE-3668466479 [0,0,0,1,0,0|1,0,0]=2 1946 B7R1.2 O=C1C[C@H](CN1)O MCULE-2017150152 [0,0,0,1,0,0|2,0,0]=3 1947 B7R1.2 O=C1C[C@H](CN1)O MCULE-5168961542 [0,0,0,1,0,0|2,0,0]=3 1948 B7R1.2 O=C1C[C@H](CN1)S MCULE-6980612759 [0,0,0,1,0,0|2,0,0]=3 1949 B7R1.2 O=C1C[C@H](CN1)S MCULE-7205538285 [0,0,0,1,0,0|2,0,0]=3 1950 B7R1.2 O=C1C[C@H](CO1)O MCULE-5756899897 [0,0,0,1,0,0|1,0,0]=2 1951 B7R1.2 O=C1C[C@H](CO1)O MCULE-6247095672 [0,0,0,1,0,0|1,0,0]=2 1952 B7R1.2 O=C1OCC(O1)Cl MCULE-4046020713 [0,0,0,1,0,0|2,0,0]=3 1953 B7R1.2 O=C1OCC(O1)F MCULE-7198712298 [0,0,0,1,0,0|2,0,0]=3 1954 B7R1.2 [C@H]1(CCC(=O)C1)C MCULE-3827565169 [0,0,0,1,0,0|1,0,0]=2 1955 B7R1.3 BrC1=CCCCC1 MCULE-6137796305 [0,0,0,1,0,0|2,0,0]=3 1956 B7R1.3 BrC1=CCCNC1 MCULE-1016336040 [0,0,0,1,0,0|3,0,0]=4 1957 B7R1.3 BrC1=CCCNC1 MCULE-9845052592 [0,0,0,1,0,0|3,0,0]=4 1958 B7R1.3 BrC1=CCOCC1 MCULE-7609274912 [0,0,0,1,0,0|3,0,0]=4 1959 B7R1.3 BrC1=CCSCC1 MCULE-6964400494 [0,0,0,1,0,0|3,0,0]=4 1960 B7R1.3 BrC1=COCCC1 MCULE-7754503978 [0,0,0,1,0,0|3,0,0]=4 1961 B7R1.3 BrC1CCCCC1 MCULE-7879113781 [0,0,0,1,0,0|2,0,1]=4 1962 B7R1.3 BrC1CCCCN1 MCULE-3863852230 [0,0,0,1,0,0|2,0,1]=4 1963 B7R1.3 BrC1CCCCO1 MCULE-3659439382 [0,0,0,1,0,0|1,0,1]=3 1964 B7R1.3 C1(CNCCO1)C MCULE-2805380245 [0,0,0,1,0,0|2,0,1]=4 1965 B7R1.3 C1(CNCCO1)C MCULE-3532041523 [0,0,0,1,0,0|2,0,1]=4 1966 B7R1.3 C=C1CCCCC1 MCULE-9812236661 [0,0,0,1,0,0|2,0,0]=3 1967 B7R1.3 C=C1CCCCN1 MCULE-8375354748 [0,0,0,1,0,0|2,0,0]=3 1968 B7R1.3 C=C1CCCNC1 MCULE-2588575300 [0,0,0,1,0,0|3,0,0]=4 1969 B7R1.3 C=C1CCCNC1 MCULE-9758065019 [0,0,0,1,0,0|3,0,0]=4 1970 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [0,0,0,1,0,0|3,0,0]=4 1971 B7R1.3 C=C1CCNCC1 MCULE-4460895436 [0,0,0,1,0,0|3,0,0]=4 1972 B7R1.3 C=C1CCNCC1 MCULE-6605411269 [0,0,0,1,0,0|3,0,0]=4 1973 B7R1.3 C=C1CCNCC1 MCULE-6729798105 [0,0,0,1,0,0|3,0,0]=4 1974 B7R1.3 C=C1CCOCC1 MCULE-2744722311 [0,0,0,1,0,0|3,0,0]=4 1975 B7R1.3 CB1OCCCO1 MCULE-5692862103 [0,0,0,1,0,0|1,0,1]=3 1976 B7R1.3 CC1=CCCC=C1 MCULE-6224653152 [0,0,0,1,0,0|2,0,1]=4 1977 B7R1.3 CC1=CCCCC1 MCULE-2795172496 [0,0,0,1,0,0|2,0,0]=3 1978 B7R1.3 CC1=CCCNC1 MCULE-8145216779 [0,0,0,1,0,0|3,0,0]=4 1979 B7R1.3 CC1=CCCNC1 MCULE-9021954061 [0,0,0,1,0,0|3,0,0]=4 1980 B7R1.3 CC1=CCNCC1 MCULE-1503915992 [0,0,0,1,0,0|3,0,0]=4 1981 B7R1.3 CC1=CCNCC1 MCULE-3349815065 [0,0,0,1,0,0|3,0,0]=4 1982 B7R1.3 CC1=NCCNC1 MCULE-2066788449 [0,0,0,1,0,0|3,0,0]=4 1983 B7R1.3 CC1CCCCC1 MCULE-3843525768 [0,0,0,1,0,0|2,0,1]=4 1984 B7R1.3 CC1CCCCN1 MCULE-1741870990 [0,0,0,1,0,0|2,0,1]=4 1985 B7R1.3 CC1CCCCN1 MCULE-4453126703 [0,0,0,1,0,0|2,0,1]=4 1986 B7R1.3 CC1CCCCN1 MCULE-6620063962 [0,0,0,1,0,0|2,0,1]=4 1987 B7R1.3 CC1CCCCN1 MCULE-6838766744 [0,0,0,1,0,0|2,0,1]=4 1988 B7R1.3 CC1CCCCN1 MCULE-9227931620 [0,0,0,1,0,0|2,0,1]=4 1989 B7R1.3 CC1CCCCO1 MCULE-4439683294 [0,0,0,1,0,0|1,0,1]=3 1990 B7R1.3 CC1CCOCO1 MCULE-5013590651 [0,0,0,1,0,0|2,0,1]=4 1991 B7R1.3 CC1CNCCO1 MCULE-3071497485 [0,0,0,1,0,0|2,0,1]=4 1992 B7R1.3 CC1CNCCO1 MCULE-7956728736 [0,0,0,1,0,0|2,0,1]=4 1993 B7R1.3 CC1NCCCO1 MCULE-2236660860 [0,0,0,1,0,0|1,0,1]=3 1994 B7R1.3 CC1SCCCS1 MCULE-8431698431 [0,0,0,1,0,0|0,2,1]=4 1995 B7R1.3 CN1CCCCC1 MCULE-3308944277 [0,0,0,1,0,0|3,0,0]=4 1996 B7R1.3 CN1CCCCO1 MCULE-4407617276 [0,0,0,1,0,0|2,0,0]=3 1997 B7R1.3 CN1CCCCO1 MCULE-6297284655 [0,0,0,1,0,0|2,0,0]=3 1998 B7R1.3 C[C@@H]1CCCCN1 MCULE-1372285636 [0,0,0,1,0,0|2,0,1]=4 1999 B7R1.3 C[C@@H]1CCCCN1 MCULE-1676908545 [0,0,0,1,0,0|2,0,1]=4 2000 B7R1.3 C[C@@H]1CCCCN1 MCULE-4298634468 [0,0,0,1,0,0|2,0,1]=4 2001 B7R1.3 C[C@@H]1CCCCN1 MCULE-6629826210 [0,0,0,1,0,0|2,0,1]=4 2002 B7R1.3 C[C@@H]1CNCCO1 MCULE-1787977539 [0,0,0,1,0,0|2,0,1]=4 2003 B7R1.3 C[C@@H]1CNCCO1 MCULE-2608004746 [0,0,0,1,0,0|2,0,1]=4 2004 B7R1.3 C[C@@H]1CNCCO1 MCULE-5447097956 [0,0,0,1,0,0|2,0,1]=4 2005 B7R1.3 C[C@@H]1CNCCO1 MCULE-9396954187 [0,0,0,1,0,0|2,0,1]=4 2006 B7R1.3 C[C@H]1CCCCN1 MCULE-3586455704 [0,0,0,1,0,0|2,0,1]=4 2007 B7R1.3 C[C@H]1CCCCN1 MCULE-5638638213 [0,0,0,1,0,0|2,0,1]=4 2008 B7R1.3 C[C@H]1CCCCN1 MCULE-5867717461 [0,0,0,1,0,0|2,0,1]=4 2009 B7R1.3 C[C@H]1CCCCN1 MCULE-7106826493 [0,0,0,1,0,0|2,0,1]=4 2010 B7R1.3 C[C@H]1CNCCO1 MCULE-3158147539 [0,0,0,1,0,0|2,0,1]=4 2011 B7R1.3 C[C@H]1CNCCO1 MCULE-5193705878 [0,0,0,1,0,0|2,0,1]=4 2012 B7R1.3 C[C@H]1CNCCO1 MCULE-8337677707 [0,0,0,1,0,0|2,0,1]=4 2013 B7R1.3 C[C@H]1CNCCO1 MCULE-9425432414 [0,0,0,1,0,0|2,0,1]=4 2014 B7R1.3 ClC1=CCCCC1 MCULE-6882712527 [0,0,0,1,0,0|2,0,0]=3 2015 B7R1.3 ClC1=CCCNC1 MCULE-2132976242 [0,0,0,1,0,0|3,0,0]=4 2016 B7R1.3 ClC1=CCCNC1 MCULE-9013141821 [0,0,0,1,0,0|3,0,0]=4 2017 B7R1.3 ClC1CCCCC1 MCULE-9519865350 [0,0,0,1,0,0|2,0,1]=4 2018 B7R1.3 ClC1CCCCO1 MCULE-3251653488 [0,0,0,1,0,0|1,0,1]=3 2019 B7R1.3 FC1=CCCNC1 MCULE-5131057553 [0,0,0,1,0,0|3,0,0]=4 2020 B7R1.3 FC1=CCCNC1 MCULE-8459145085 [0,0,0,1,0,0|3,0,0]=4 2021 B7R1.3 FC1=CCNCC1 MCULE-5573410633 [0,0,0,1,0,0|3,0,0]=4 2022 B7R1.3 FC1=CCNCC1 MCULE-9755070929 [0,0,0,1,0,0|3,0,0]=4 2023 B7R1.3 FC1CCCCC1 MCULE-4555555520 [0,0,0,1,0,0|2,0,1]=4 2024 B7R1.3 FC1CCCCO1 MCULE-8724227177 [0,0,0,1,0,0|1,0,1]=3 2025 B7R1.3 IC1CCCCC1 MCULE-4499971048 [0,0,0,1,0,0|2,0,1]=4 2026 B7R1.3 N=C1NCCCO1 MCULE-4713912893 [0,0,0,1,0,0|2,0,0]=3 2027 B7R1.3 N=C1NCCCS1 MCULE-5425383221 [0,0,0,1,0,0|2,1,0]=4 2028 B7R1.3 NC1=NCCCC1 MCULE-1020722938 [0,0,0,1,0,0|2,0,0]=3 2029 B7R1.3 NC1=NCCCC1 MCULE-9735306041 [0,0,0,1,0,0|2,0,0]=3 2030 B7R1.3 NC1=NCCCN1 MCULE-1407334516 [0,0,0,1,0,0|3,0,0]=4 2031 B7R1.3 NC1=NCCCN1 MCULE-1674112662 [0,0,0,1,0,0|3,0,0]=4 2032 B7R1.3 NC1=NCCCO1 MCULE-1909217779 [0,0,0,1,0,0|2,0,0]=3 2033 B7R1.3 NC1=NCCCS1 MCULE-2157831645 [0,0,0,1,0,0|2,1,0]=4 2034 B7R1.3 NC1=NCCCS1 MCULE-7522126566 [0,0,0,1,0,0|2,1,0]=4 2035 B7R1.3 NC1=NCCSC1 MCULE-4272591822 [0,0,0,1,0,0|3,0,0]=4 2036 B7R1.3 NC1CCCCC1 MCULE-1274688385 [0,0,0,1,0,0|2,0,1]=4 2037 B7R1.3 NC1CCCCC1 MCULE-6218418825 [0,0,0,1,0,0|2,0,1]=4 2038 B7R1.3 NC1CCCCC1 MCULE-7654331405 [0,0,0,1,0,0|2,0,1]=4 2039 B7R1.3 NC1CCCCC1 MCULE-9211684304 [0,0,0,1,0,0|2,0,1]=4 2040 B7R1.3 NC1CCCCN1 MCULE-8429969520 [0,0,0,1,0,0|2,0,1]=4 2041 B7R1.3 NN1CCCCC1 MCULE-2078041523 [0,0,0,1,0,0|3,0,0]=4 2042 B7R1.3 NN1CCCCC1 MCULE-3853977450 [0,0,0,1,0,0|3,0,0]=4 2043 B7R1.3 O=C1C=CCCC1 MCULE-5207755083 [0,0,0,1,0,0|1,0,1]=3 2044 B7R1.3 O=C1C=CCCN1 MCULE-9815380990 [0,0,0,1,0,0|1,0,2]=4 2045 B7R1.3 O=C1C=CCCO1 MCULE-2962791770 [0,0,0,1,0,0|0,0,2]=3 2046 B7R1.3 O=C1C=CCOC1 MCULE-4817981961 [0,0,0,1,0,0|2,0,1]=4 2047 B7R1.3 O=C1C=COCC1 MCULE-2954829305 [0,0,0,1,0,0|2,0,1]=4 2048 B7R1.3 O=C1CC=CCN1 MCULE-7370958955 [0,0,0,1,0,0|1,0,2]=4 2049 B7R1.3 O=C1CCCCC1 MCULE-5664385838 [0,0,0,1,0,0|1,0,0]=2 2050 B7R1.3 O=C1CCCCN1 MCULE-9168245534 [0,0,0,1,0,0|1,0,0]=2 2051 B7R1.3 O=C1CCCCO1 MCULE-4682307363 [0,0,0,1,0,0|0,0,0]=1 2052 B7R1.3 O=C1CCCCS1 MCULE-5383777119 [0,0,0,1,0,0|0,1,0]=2 2053 B7R1.3 O=C1CCCNC1 MCULE-2774326662 [0,0,0,1,0,0|2,0,0]=3 2054 B7R1.3 O=C1CCCNC1 MCULE-8149766009 [0,0,0,1,0,0|2,0,0]=3 2055 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [0,0,0,1,0,0|2,0,0]=3 2056 B7R1.3 O=C1CCCSC1 MCULE-1649390503 [0,0,0,1,0,0|2,0,0]=3 2057 B7R1.3 O=C1CCNCC1 MCULE-7526186270 [0,0,0,1,0,0|2,0,0]=3 2058 B7R1.3 O=C1CCNCC1 MCULE-9761063200 [0,0,0,1,0,0|2,0,0]=3 2059 B7R1.3 O=C1CCNCN1 MCULE-5793765281 [0,0,0,1,0,0|2,0,0]=3 2060 B7R1.3 O=C1CCOCC1 MCULE-6728095514 [0,0,0,1,0,0|2,0,0]=3 2061 B7R1.3 O=C1CCSCC1 MCULE-8638366518 [0,0,0,1,0,0|2,0,0]=3 2062 B7R1.3 O=C1CNCCN1 MCULE-5599978871 [0,0,0,1,0,0|2,0,0]=3 2063 B7R1.3 O=C1CNCCO1 MCULE-2634056082 [0,0,0,1,0,0|1,0,0]=2 2064 B7R1.3 O=C1CNCCO1 MCULE-6420255529 [0,0,0,1,0,0|1,0,0]=2 2065 B7R1.3 O=C1COCCN1 MCULE-8242898041 [0,0,0,1,0,0|2,0,0]=3 2066 B7R1.3 O=C1COCCO1 MCULE-5754504096 [0,0,0,1,0,0|1,0,0]=2 2067 B7R1.3 O=C1CSCCN1 MCULE-1492056440 [0,0,0,1,0,0|2,0,0]=3 2068 B7R1.3 O=C1CSCSC1 MCULE-8034252746 [0,0,0,1,0,0|3,0,0]=4 2069 B7R1.3 O=C1NCCCN1 MCULE-4876148406 [0,0,0,1,0,0|2,0,0]=3 2070 B7R1.3 O=C1NCCCO1 MCULE-9333383492 [0,0,0,1,0,0|1,0,0]=2 2071 B7R1.3 O=C1NNCCO1 MCULE-2913818828 [0,0,0,1,0,0|2,0,0]=3 2072 B7R1.3 O=C1OCCCO1 MCULE-7728322911 [0,0,0,1,0,0|1,0,0]=2 2073 B7R1.3 O=P1OCCCO1 MCULE-9154920312 [0,0,0,1,0,0|2,0,0]=3 2074 B7R1.3 O=S1CCCCC1 MCULE-1275253796 [0,0,0,1,0,0|2,0,0]=3 2075 B7R1.3 O=S1CCCSC1 MCULE-5552019770 [0,0,0,1,0,0|3,0,0]=4 2076 B7R1.3 O=S1CCNCC1 MCULE-1812570930 [0,0,0,1,0,0|3,0,0]=4 2077 B7R1.3 O=S1CCNCC1 MCULE-9878649050 [0,0,0,1,0,0|3,0,0]=4 2078 B7R1.3 O=S1CCOCC1 MCULE-4979531002 [0,0,0,1,0,0|3,0,0]=4 2079 B7R1.3 O=S1OCCCO1 MCULE-4755606100 [0,0,0,1,0,0|2,0,0]=3 2080 B7R1.3 OB1OCCCO1 MCULE-7976289917 [0,0,0,1,0,0|2,0,1]=4 2081 B7R1.3 OC1CCCCC1 MCULE-8217921343 [0,0,0,1,0,0|1,0,2]=4 2082 B7R1.3 OC1CCCCN1 MCULE-7168605870 [0,0,0,1,0,0|1,0,2]=4 2083 B7R1.3 OC1CCCCN1 MCULE-9833825308 [0,0,0,1,0,0|1,0,2]=4 2084 B7R1.3 OC1CCCCO1 MCULE-1415784498 [0,0,0,1,0,0|0,0,2]=3 2085 B7R1.3 OC1CNCCO1 MCULE-7048275202 [0,0,0,1,0,0|1,0,2]=4 2086 B7R1.3 OC1CNCCO1 MCULE-9716087824 [0,0,0,1,0,0|1,0,2]=4 2087 B7R1.3 ON1CCCCC1 MCULE-5529301217 [0,0,0,1,0,0|2,0,1]=4 2088 B7R1.3 S=C1CCCCC1 MCULE-6072375043 [0,0,0,1,0,0|1,1,0]=3 2089 B7R1.3 S=C1CCCCN1 MCULE-2004608075 [0,0,0,1,0,0|1,1,0]=3 2090 B7R1.3 S=C1COCCN1 MCULE-1743172522 [0,0,0,1,0,0|2,1,0]=4 2091 B7R1.3 S=C1NCCCN1 MCULE-6601711997 [0,0,0,1,0,0|2,1,0]=4 2092 B7R1.3 S=C1NCCCO1 MCULE-2364674450 [0,0,0,1,0,0|1,1,0]=3 2093 B7R1.3 S=C1NCCCS1 MCULE-8898215455 [0,0,0,1,0,0|1,2,0]=4 2094 B7R1.3 SC1CCCCC1 MCULE-2644288416 [0,0,0,1,0,0|1,1,1]=4 2095 B7R1.3 [NH3+]C1CCCCC1 MCULE-7876724648 [0,0,0,1,0,0|2,0,1]=4 2096 B7R1.5 CCCC1CC1N MCULE-6204339829 [0,0,0,1,0,0|2,0,1]=4 2097 B7R1.5 CCCC1ON1C MCULE-8959342998 [0,0,0,1,0,0|2,0,1]=4 2098 B7R1.7 BrCCOC1CC1 MCULE-5137842235 [0,0,0,1,0,0|2,0,1]=4 2099 B7R1.7 CCCCC1CO1 MCULE-8403189539 [0,0,0,1,0,0|1,0,2]=4 2100 B7R1.7 CCCNC1CC1 MCULE-7033521193 [0,0,0,1,0,0|2,0,1]=4 2101 B7R1.7 CCCNC1CC1 MCULE-8227176324 [0,0,0,1,0,0|2,0,1]=4 2102 B7R1.7 ClCCOC1CC1 MCULE-1732267732 [0,0,0,1,0,0|2,0,1]=4 2103 B7R1.7 NCCOC1CC1 MCULE-2021686793 [0,0,0,1,0,0|2,0,1]=4 2104 B7R1.7 NCCOC1CC1 MCULE-9123639402 [0,0,0,1,0,0|2,0,1]=4 2105 B7R1.7 OCCOC1CC1 MCULE-8583841482 [0,0,0,1,0,0|2,0,1]=4 2106 B7R1.10 C#CC1CC(=O)C1 MCULE-3858789141 [0,0,0,1,0,0|1,0,2]=4 2107 B7R1.10 C=C1CC(C1)CBr MCULE-5306604568 [0,0,0,1,0,0|3,0,0]=4 2108 B7R1.10 C=C1CC(C1)CN MCULE-1227151583 [0,0,0,1,0,0|3,0,0]=4 2109 B7R1.10 C=C1CC(C1)CO MCULE-6295731045 [0,0,0,1,0,0|3,0,0]=4 2110 B7R1.10 C=C1CC(C1)NC MCULE-3988893291 [0,0,0,1,0,0|3,0,0]=4 2111 B7R1.10 C=CC1CC(=O)C1 MCULE-2741892250 [0,0,0,1,0,0|1,0,2]=4 2112 B7R1.10 C=CC1CC(=O)N1 MCULE-2790457728 [0,0,0,1,0,0|1,0,2]=4 2113 B7R1.10 CCC1CC(=O)C1 MCULE-6356390328 [0,0,0,1,0,0|1,0,0]=2 2114 B7R1.10 COC1CC(=O)C1 MCULE-3488458490 [0,0,0,1,0,0|2,0,0]=3 2115 B7R1.10 CSC1CC(=O)C1 MCULE-4578180421 [0,0,0,1,0,0|2,0,0]=3 2116 B7R1.10 N#CC1CC(=O)C1 MCULE-7054848642 [0,0,0,1,0,0|2,0,1]=4 2117 B7R1.10 NCC1CC(=O)C1 MCULE-2475090953 [0,0,0,1,0,0|2,0,0]=3 2118 B7R1.10 NCC1CC(=O)C1 MCULE-3448735299 [0,0,0,1,0,0|2,0,0]=3 2119 B7R1.10 NCC1CC(=O)N1 MCULE-6099913032 [0,0,0,1,0,0|2,0,0]=3 2120 B7R1.10 O=C1CC(C1)CBr MCULE-3146426428 [0,0,0,1,0,0|2,0,0]=3 2121 B7R1.10 O=C1CC(C1)CCl MCULE-9945216137 [0,0,0,1,0,0|2,0,0]=3 2122 B7R1.10 O=C1CC(C1)CF MCULE-5064337976 [0,0,0,1,0,0|2,0,0]=3 2123 B7R1.10 O=C1CC(C1)CO MCULE-6785243243 [0,0,0,1,0,0|2,0,0]=3 2124 B7R1.10 O=C1CC(N1)CI MCULE-8223453504 [0,0,0,1,0,0|2,0,0]=3 2125 B7R1.10 O=C1CC(N1)CO MCULE-5966757004 [0,0,0,1,0,0|2,0,0]=3 2126 B7R1.10 O=C1CC(N1)CO MCULE-7672639952 [0,0,0,1,0,0|2,0,0]=3 2127 B7R1.10 O=C1CC(O1)CBr MCULE-1451058371 [0,0,0,1,0,0|1,0,0]=2 2128 B7R1.10 O=C1C[C@@H](N1)CO MCULE-7235908958 [0,0,0,1,0,0|2,0,0]=3 2129 B7R1.10 O=C1C[C@@H](N1)CO MCULE-9940834935 [0,0,0,1,0,0|2,0,0]=3 2130 B7R1.10 O=C1C[C@H](N1)CO MCULE-1643787736 [0,0,0,1,0,0|2,0,0]=3 2131 B7R1.12 CC(=O)C1CC1C MCULE-5857709747 [0,0,0,1,0,0|1,0,0]=2 2132 B7R1.12 CC(=O)[C@@H]1C[C@H]1C MCULE-4367650211 [0,0,0,1,0,0|1,0,0]=2 2133 B7R1.12 CC1CC1C(=O)Cl MCULE-7645594952 [0,0,0,1,0,0|2,0,0]=3 2134 B7R1.12 CC1CC1C(=O)N MCULE-4145079494 [0,0,0,1,0,0|2,0,0]=3 2135 B7R1.12 CC1CC1C(=O)O MCULE-1757330006 [0,0,0,1,0,0|2,0,0]=3 2136 B7R1.12 CC1SC1C(=O)N MCULE-7010314546 [0,0,0,1,0,0|3,0,0]=4 2137 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-1245851874 [0,0,0,1,0,0|2,0,0]=3 2138 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-9582782871 [0,0,0,1,0,0|2,0,0]=3 2139 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-2621918749 [0,0,0,1,0,0|2,0,0]=3 2140 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-7347988261 [0,0,0,1,0,0|2,0,0]=3 2141 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-4499487863 [0,0,0,1,0,0|2,0,0]=3 2142 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-9300153165 [0,0,0,1,0,0|2,0,0]=3 2143 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-4410115478 [0,0,0,1,0,0|2,0,0]=3 2144 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-6590525761 [0,0,0,1,0,0|2,0,0]=3 2145 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-8070492716 [0,0,0,1,0,0|2,0,0]=3 2146 B7R1.12 NC(=O)C1CC1N MCULE-9433325277 [0,0,0,1,0,0|3,0,0]=4 2147 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F MCULE-2857193174 [0,0,0,1,0,0|3,0,0]=4 2148 B7R1.12 O=C(O)C1CC1Br MCULE-6387317137 [0,0,0,1,0,0|3,0,0]=4 2149 B7R1.12 O=C(O)C1CC1Cl MCULE-8907850405 [0,0,0,1,0,0|3,0,0]=4 2150 B7R1.12 O=C(O)C1CC1F MCULE-8258481986 [0,0,0,1,0,0|3,0,0]=4 2151 B7R1.12 O=C(O)C1CC1I MCULE-9535592263 [0,0,0,1,0,0|3,0,0]=4 2152 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-1882710455 [0,0,0,1,0,0|3,0,0]=4 2153 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-7715660561 [0,0,0,1,0,0|3,0,0]=4 2154 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-7741460434 [0,0,0,1,0,0|3,0,0]=4 2155 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-2594739726 [0,0,0,1,0,0|3,0,0]=4 2156 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-3033770510 [0,0,0,1,0,0|3,0,0]=4 2157 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-6224902495 [0,0,0,1,0,0|3,0,0]=4 2158 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br MCULE-3031410853 [0,0,0,1,0,0|3,0,0]=4 2159 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-1201733028 [0,0,0,1,0,0|3,0,0]=4 2160 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-5963625184 [0,0,0,1,0,0|3,0,0]=4 2161 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-9724617114 [0,0,0,1,0,0|3,0,0]=4 2162 B7R1.12 O=C(O)[C@@H]1C[C@H]1I MCULE-3702576454 [0,0,0,1,0,0|3,0,0]=4 2163 B7R1.12 O=C(O)[C@H]1C[C@@H]1F MCULE-3766204952 [0,0,0,1,0,0|3,0,0]=4 2164 B7R1.12 O=C(O)[C@H]1C[C@@H]1F MCULE-4258983574 [0,0,0,1,0,0|3,0,0]=4 2165 B7R1.12 O=C(O)[C@H]1C[C@H]1Br MCULE-3094747797 [0,0,0,1,0,0|3,0,0]=4 2166 B7R1.12 O=C(O)[C@H]1C[C@H]1F MCULE-7993479857 [0,0,0,1,0,0|3,0,0]=4 2167 B7R1.12 O=C(O)[C@H]1C[C@H]1F MCULE-9922834235 [0,0,0,1,0,0|3,0,0]=4 2168 B7R1.12 O=C(O)[C@H]1C[C@H]1I MCULE-5714437007 [0,0,0,1,0,0|3,0,0]=4 2169 B7R1.12 O=C(O)[C@H]1C[C@H]1I MCULE-8000208987 [0,0,0,1,0,0|3,0,0]=4 2170 B7R1.12 [C@H]1(C[C@H]1C(=O)O)C MCULE-9539625763 [0,0,0,1,0,0|2,0,0]=3 2171 B7R1.14 CC1(CCCC1)Br MCULE-8706490914 [0,0,0,1,0,0|2,0,1]=4 2172 B7R1.14 CC1(CCCC1)N MCULE-1696024032 [0,0,0,1,0,0|2,0,1]=4 2173 B7R1.14 CC1(CCCC1)N MCULE-7897960444 [0,0,0,1,0,0|2,0,1]=4 2174 B7R1.14 CC1(CCCC1)O MCULE-1425529053 [0,0,0,1,0,0|1,0,2]=4 2175 B7R1.14 CC1(CCCN1)C MCULE-3172250386 [0,0,0,1,0,0|2,0,1]=4 2176 B7R1.14 CC1(CCCN1)C MCULE-6227706175 [0,0,0,1,0,0|2,0,1]=4 2177 B7R1.14 CC1(NCCO1)C MCULE-5384206883 [0,0,0,1,0,0|2,0,1]=4 2178 B7R1.14 CC1(OCCO1)C MCULE-3382136459 [0,0,0,1,0,0|2,0,1]=4 2179 B7R1.14 C[N+]1(CCCC1)C MCULE-3715522497 [0,0,0,1,0,0|3,0,0]=4 2180 B7R1.14 C[N+]1(CCCC1)C MCULE-9941565311 [0,0,0,1,0,0|3,0,0]=4 2181 B7R1.14 C[Si]1(CCCC1)C MCULE-1541355807 [0,0,0,1,0,0|2,1,0]=4 2182 B7R1.14 N=S1(=O)CCCC1 MCULE-6922708158 [0,0,0,1,0,0|3,0,0]=4 2183 B7R1.14 O=P1(CCCC1)Cl MCULE-9877294162 [0,0,0,1,0,0|3,0,0]=4 2184 B7R1.14 O=P1(OCCO1)Cl MCULE-8220157277 [0,0,0,1,0,0|3,0,0]=4 2185 B7R1.14 O=S1(=O)CCCC1 MCULE-3506686856 [0,0,0,1,0,0|3,0,0]=4 2186 B7R1.14 O=S1(=O)CCCN1 MCULE-8201546192 [0,0,0,1,0,0|3,0,0]=4 2187 B7R1.14 O=S1(=O)CCCO1 MCULE-4897687828 [0,0,0,1,0,0|2,0,0]=3 2188 B7R1.14 O=S1(=O)NCCO1 MCULE-2978152198 [0,0,0,1,0,0|3,0,0]=4 2189 B7R1.14 O=S1(=O)OCCO1 MCULE-4563579294 [0,0,0,1,0,0|3,0,0]=4 2190 B7R1.17 CC1(OCC1N)C MCULE-2792085100 [0,0,0,1,0,0|2,0,1]=4 2191 B7R1.17 CC1(OCC1O)C MCULE-4679216060 [0,0,0,1,0,0|2,0,1]=4 2192 B7R1.17 CC1(OC[C@@H]1N)C MCULE-1806722832 [0,0,0,1,0,0|2,0,1]=4 2193 B7R1.17 CC1CNS1(=O)=O MCULE-9736489046 [0,0,0,1,0,0|3,0,0]=4 2194 B7R1.18 C1(CCN1)C(=O)O MCULE-9324355017 [0,0,0,1,0,0|3,0,0]=4 2195 B7R1.18 CC(=O)C1CCC1 MCULE-5770046789 [0,0,0,1,0,0|1,0,0]=2 2196 B7R1.18 CC(=O)C1CNC1 MCULE-2354733934 [0,0,0,1,0,0|2,0,0]=3 2197 B7R1.18 CC(=O)C1CNC1 MCULE-3110609785 [0,0,0,1,0,0|2,0,0]=3 2198 B7R1.18 CC(=O)C1CNC1 MCULE-4112322251 [0,0,0,1,0,0|2,0,0]=3 2199 B7R1.18 CC(=O)C1COC1 MCULE-3416774210 [0,0,0,1,0,0|2,0,0]=3 2200 B7R1.18 CC(=O)N1C=CC1 MCULE-4207230175 [0,0,0,1,0,0|1,0,2]=4 2201 B7R1.18 CC(=O)N1CCC1 MCULE-6467100562 [0,0,0,1,0,0|1,0,0]=2 2202 B7R1.18 CC(N)C1CCC1 MCULE-1055775237 [0,0,0,1,0,0|2,0,1]=4 2203 B7R1.18 CC(N)C1CCC1 MCULE-4303681430 [0,0,0,1,0,0|2,0,1]=4 2204 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [0,0,0,1,0,0|1,0,2]=4 2205 B7R1.18 CS(=O)C1CNC1 MCULE-1896314246 [0,0,0,1,0,0|3,0,0]=4 2206 B7R1.18 CS(=O)C1CNC1 MCULE-3655021594 [0,0,0,1,0,0|3,0,0]=4 2207 B7R1.18 C[C@@H](N)C1CCC1 MCULE-4670161237 [0,0,0,1,0,0|2,0,1]=4 2208 B7R1.18 C[C@@H](N)C1CCC1 MCULE-6520272933 [0,0,0,1,0,0|2,0,1]=4 2209 B7R1.18 C[C@@H](N)C1CCC1 MCULE-8342688572 [0,0,0,1,0,0|2,0,1]=4 2210 B7R1.18 C[C@@H](N)C1CCC1 MCULE-9076983662 [0,0,0,1,0,0|2,0,1]=4 2211 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [0,0,0,1,0,0|1,0,2]=4 2212 B7R1.18 C[C@H](N)C1CCC1 MCULE-2555280675 [0,0,0,1,0,0|2,0,1]=4 2213 B7R1.18 C[C@H](N)C1CCC1 MCULE-3888125434 [0,0,0,1,0,0|2,0,1]=4 2214 B7R1.18 C[C@H](N)C1CCC1 MCULE-6963105805 [0,0,0,1,0,0|2,0,1]=4 2215 B7R1.18 C[C@H](N)C1CCC1 MCULE-7483270694 [0,0,0,1,0,0|2,0,1]=4 2216 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [0,0,0,1,0,0|1,0,2]=4 2217 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [0,0,0,1,0,0|1,0,2]=4 2218 B7R1.18 N=C(N)C1CCC1 MCULE-3470535674 [0,0,0,1,0,0|3,0,0]=4 2219 B7R1.18 N=C(N)C1CCC1 MCULE-4802517706 [0,0,0,1,0,0|3,0,0]=4 2220 B7R1.18 N=C(N)C1CCC1 MCULE-5858986439 [0,0,0,1,0,0|3,0,0]=4 2221 B7R1.18 NC(=O)C1CCC1 MCULE-5151176129 [0,0,0,1,0,0|2,0,0]=3 2222 B7R1.18 NC(=O)C1CCN1 MCULE-1856696035 [0,0,0,1,0,0|3,0,0]=4 2223 B7R1.18 NC(=O)C1CCN1 MCULE-5757704016 [0,0,0,1,0,0|3,0,0]=4 2224 B7R1.18 NC(=O)C1CNC1 MCULE-2319282799 [0,0,0,1,0,0|3,0,0]=4 2225 B7R1.18 NC(=O)C1CNC1 MCULE-4985073048 [0,0,0,1,0,0|3,0,0]=4 2226 B7R1.18 NC(=O)C1CNC1 MCULE-8796959516 [0,0,0,1,0,0|3,0,0]=4 2227 B7R1.18 NC(=O)C1COC1 MCULE-1077689713 [0,0,0,1,0,0|3,0,0]=4 2228 B7R1.18 NC(=O)N1CCC1 MCULE-1594728830 [0,0,0,1,0,0|2,0,0]=3 2229 B7R1.18 NC(=O)[C@H]1CCN1 MCULE-7187425143 [0,0,0,1,0,0|3,0,0]=4 2230 B7R1.18 NC(=S)C1CCC1 MCULE-9753547991 [0,0,0,1,0,0|2,1,0]=4 2231 B7R1.18 NC(=S)N1CCC1 MCULE-5688954257 [0,0,0,1,0,0|2,1,0]=4 2232 B7R1.18 O=C(Cl)C1CCC1 MCULE-2155859428 [0,0,0,1,0,0|2,0,0]=3 2233 B7R1.18 O=C(Cl)N1CCC1 MCULE-8313088104 [0,0,0,1,0,0|2,0,0]=3 2234 B7R1.18 O=C(O)C1=CCC1 MCULE-4244912351 [0,0,0,1,0,0|2,0,1]=4 2235 B7R1.18 O=C(O)C1CCC1 MCULE-2498509888 [0,0,0,1,0,0|2,0,0]=3 2236 B7R1.18 O=C(O)C1CCN1 MCULE-1336085891 [0,0,0,1,0,0|3,0,0]=4 2237 B7R1.18 O=C(O)C1CCN1 MCULE-6501890131 [0,0,0,1,0,0|3,0,0]=4 2238 B7R1.18 O=C(O)C1CCN1 MCULE-7647115314 [0,0,0,1,0,0|3,0,0]=4 2239 B7R1.18 O=C(O)C1CCO1 MCULE-6065911736 [0,0,0,1,0,0|3,0,0]=4 2240 B7R1.18 O=C(O)C1CCO1 MCULE-9296370119 [0,0,0,1,0,0|3,0,0]=4 2241 B7R1.18 O=C(O)C1CNC1 MCULE-2350328355 [0,0,0,1,0,0|3,0,0]=4 2242 B7R1.18 O=C(O)C1CNC1 MCULE-7890374869 [0,0,0,1,0,0|3,0,0]=4 2243 B7R1.18 O=C(O)C1COC1 MCULE-2530431165 [0,0,0,1,0,0|3,0,0]=4 2244 B7R1.18 O=C(O)C1CSC1 MCULE-4019152056 [0,0,0,1,0,0|3,0,0]=4 2245 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2126306157 [0,0,0,1,0,0|3,0,0]=4 2246 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2597576629 [0,0,0,1,0,0|3,0,0]=4 2247 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-6006656004 [0,0,0,1,0,0|3,0,0]=4 2248 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-7241612713 [0,0,0,1,0,0|3,0,0]=4 2249 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-5117442811 [0,0,0,1,0,0|3,0,0]=4 2250 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-8116248615 [0,0,0,1,0,0|3,0,0]=4 2251 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-3254184046 [0,0,0,1,0,0|3,0,0]=4 2252 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5162570273 [0,0,0,1,0,0|3,0,0]=4 2253 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5488052558 [0,0,0,1,0,0|3,0,0]=4 2254 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-8240936495 [0,0,0,1,0,0|3,0,0]=4 2255 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-5499247834 [0,0,0,1,0,0|3,0,0]=4 2256 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-7468207073 [0,0,0,1,0,0|3,0,0]=4 2257 B7R1.18 O=N(=O)C1CCC1 MCULE-1263563910 [0,0,0,1,0,0|3,0,0]=4 2258 B7R1.18 O=S([O-])C1CCC1 MCULE-2181260614 [0,0,0,1,0,0|3,0,0]=4 2259 B7R1.18 O=S([O-])C1CCC1 MCULE-5691798035 [0,0,0,1,0,0|3,0,0]=4 2260 B7R1.20 CC(=O)CC1CC1 MCULE-3465510397 [0,0,0,1,0,0|1,0,0]=2 2261 B7R1.20 CC(=O)NC1CC1 MCULE-7553641762 [0,0,0,1,0,0|1,0,0]=2 2262 B7R1.20 CC(C)NC1CC1 MCULE-6011790113 [0,0,0,1,0,0|2,0,1]=4 2263 B7R1.20 CC(C)NC1CC1 MCULE-8727654998 [0,0,0,1,0,0|2,0,1]=4 2264 B7R1.20 CC(N)CC1CC1 MCULE-1913565015 [0,0,0,1,0,0|2,0,1]=4 2265 B7R1.20 CC(N)CC1CC1 MCULE-2214997571 [0,0,0,1,0,0|2,0,1]=4 2266 B7R1.20 CC(O)CC1CC1 MCULE-1952195648 [0,0,0,1,0,0|1,0,2]=4 2267 B7R1.20 CN(C)CC1CC1 MCULE-6678267289 [0,0,0,1,0,0|3,0,0]=4 2268 B7R1.20 C[C@@H](O)CC1CC1 MCULE-2616688976 [0,0,0,1,0,0|1,0,2]=4 2269 B7R1.20 C[C@H](O)CC1CC1 MCULE-5001414363 [0,0,0,1,0,0|1,0,2]=4 2270 B7R1.20 N=C(N)CC1CC1 MCULE-6959128379 [0,0,0,1,0,0|3,0,0]=4 2271 B7R1.20 N=C(N)CC1CC1 MCULE-7106217917 [0,0,0,1,0,0|3,0,0]=4 2272 B7R1.20 N=C(N)NC1CC1 MCULE-6195253401 [0,0,0,1,0,0|3,0,0]=4 2273 B7R1.20 N=C(N)NC1CC1 MCULE-7842873377 [0,0,0,1,0,0|3,0,0]=4 2274 B7R1.20 N=C(N)NC1CC1 MCULE-9778544365 [0,0,0,1,0,0|3,0,0]=4 2275 B7R1.20 NC(=NC1CC1)N MCULE-4635451272 [0,0,0,1,0,0|3,0,0]=4 2276 B7R1.20 NC(=O)CC1CC1 MCULE-3835601763 [0,0,0,1,0,0|2,0,0]=3 2277 B7R1.20 NC(=O)CC1CO1 MCULE-9954364706 [0,0,0,1,0,0|3,0,0]=4 2278 B7R1.20 NC(=O)NC1CC1 MCULE-4338833542 [0,0,0,1,0,0|2,0,0]=3 2279 B7R1.20 NC(=S)CC1CC1 MCULE-3521862976 [0,0,0,1,0,0|2,1,0]=4 2280 B7R1.20 NC(=S)NC1CC1 MCULE-1691696534 [0,0,0,1,0,0|2,1,0]=4 2281 B7R1.20 O=C(Cl)CC1CC1 MCULE-9640878584 [0,0,0,1,0,0|2,0,0]=3 2282 B7R1.20 O=C(Cl)NC1CC1 MCULE-8107862020 [0,0,0,1,0,0|2,0,0]=3 2283 B7R1.20 O=C(Cl)OC1CC1 MCULE-4373365407 [0,0,0,1,0,0|1,0,0]=2 2284 B7R1.20 O=C(O)C=C1CC1 MCULE-7214971091 [0,0,0,1,0,0|2,0,1]=4 2285 B7R1.20 O=C(O)CC1CC1 MCULE-3026300598 [0,0,0,1,0,0|2,0,0]=3 2286 B7R1.20 O=C(O)CC1CO1 MCULE-5322663834 [0,0,0,1,0,0|3,0,0]=4 2287 B7R1.20 O=C(O)C[C@H]1CO1 MCULE-2418249972 [0,0,0,1,0,0|3,0,0]=4 2288 B7R1.20 O=N(=O)CC1CC1 MCULE-1695328225 [0,0,0,1,0,0|3,0,0]=4 2289 B7R1.20 O=S([O-])CC1CC1 MCULE-5174157846 [0,0,0,1,0,0|3,0,0]=4 2290 B7R1.20 O=S([O-])CC1CC1 MCULE-8367574745 [0,0,0,1,0,0|3,0,0]=4 2291 B7R1.23 CC1(OC1CBr)C MCULE-1797899499 [0,0,0,1,0,0|2,0,1]=4 2292 B7R1.23 CC1(OC1CCl)C MCULE-6494110934 [0,0,0,1,0,0|2,0,1]=4 2293 B7R1.23 CC1(OC1CO)C MCULE-5147602353 [0,0,0,1,0,0|2,0,1]=4 2294 B4R0.1 C#CC(=O)C MCULE-1296030711 [2,0,0,0,0,0|0,0,2]=4 2295 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [2,0,0,0,0,0|1,0,1]=4 2296 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [2,0,0,0,0,0|1,0,1]=4 2297 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [2,0,0,0,0,0|1,0,1]=4 2298 B4R0.1 C=C(Br)CC MCULE-6271946451 [2,0,0,0,0,0|1,0,1]=4 2299 B4R0.1 C=C(C)CBr MCULE-1361893863 [2,0,0,0,0,0|2,0,0]=4 2300 B4R0.1 C=C(C)CCl MCULE-5586406339 [2,0,0,0,0,0|2,0,0]=4 2301 B4R0.1 C=C(C)CI MCULE-3678124406 [2,0,0,0,0,0|2,0,0]=4 2302 B4R0.1 C=C(C)CN MCULE-1033495975 [2,0,0,0,0,0|2,0,0]=4 2303 B4R0.1 C=C(C)CN MCULE-8730181300 [2,0,0,0,0,0|2,0,0]=4 2304 B4R0.1 C=C(C)CO MCULE-8641288398 [2,0,0,0,0,0|2,0,0]=4 2305 B4R0.1 C=C(C)CS MCULE-5174170431 [2,0,0,0,0,0|2,0,0]=4 2306 B4R0.1 C=C(C)OC MCULE-7344104255 [2,0,0,0,0,0|1,0,0]=3 2307 B4R0.1 C=CC(=O)C MCULE-4924646293 [2,0,0,0,0,0|0,0,2]=4 2308 B4R0.1 CC(=O)C#N MCULE-6317771757 [2,0,0,0,0,0|1,0,1]=4 2309 B4R0.1 CC(=O)C=O MCULE-2718961814 [2,0,0,0,0,0|1,0,1]=4 2310 B4R0.1 CC(=O)CBr MCULE-7812920675 [2,0,0,0,0,0|1,0,0]=3 2311 B4R0.1 CC(=O)CCl MCULE-2501365933 [2,0,0,0,0,0|1,0,0]=3 2312 B4R0.1 CC(=O)CF MCULE-7417279999 [2,0,0,0,0,0|1,0,0]=3 2313 B4R0.1 CC(=O)CN MCULE-2715277783 [2,0,0,0,0,0|1,0,0]=3 2314 B4R0.1 CC(=O)CN MCULE-6004541862 [2,0,0,0,0,0|1,0,0]=3 2315 B4R0.1 CC(=O)CO MCULE-2989526028 [2,0,0,0,0,0|1,0,0]=3 2316 B4R0.1 CC(=O)CS MCULE-9736174016 [2,0,0,0,0,0|1,0,0]=3 2317 B4R0.1 CC(=O)NBr MCULE-6502070876 [2,0,0,0,0,0|2,0,0]=4 2318 B4R0.1 CC(=O)NN MCULE-9183467120 [2,0,0,0,0,0|2,0,0]=4 2319 B4R0.1 CC(=O)NO MCULE-2682231025 [2,0,0,0,0,0|2,0,0]=4 2320 B4R0.1 CC(=O)OO MCULE-6028338742 [2,0,0,0,0,0|1,0,0]=3 2321 B4R0.1 CC=C(C)Br MCULE-1371905211 [2,0,0,0,0,0|1,0,1]=4 2322 B4R0.1 CC=C(C)C MCULE-4230157245 [2,0,0,0,0,0|1,0,1]=4 2323 B4R0.1 CC=C(C)Cl MCULE-3844314543 [2,0,0,0,0,0|1,0,1]=4 2324 B4R0.1 CCC(=N)N MCULE-1856575742 [2,0,0,0,0,0|2,0,0]=4 2325 B4R0.1 CCC(=N)N MCULE-2534386807 [2,0,0,0,0,0|2,0,0]=4 2326 B4R0.1 CCC(=O)Br MCULE-7870678619 [2,0,0,0,0,0|1,0,0]=3 2327 B4R0.1 CCC(=O)C MCULE-8276670748 [2,0,0,0,0,0|0,0,0]=2 2328 B4R0.1 CCC(=O)Cl MCULE-3081874391 [2,0,0,0,0,0|1,0,0]=3 2329 B4R0.1 CCC(=O)F MCULE-8783887670 [2,0,0,0,0,0|1,0,0]=3 2330 B4R0.1 CCC(=O)N MCULE-3730796130 [2,0,0,0,0,0|1,0,0]=3 2331 B4R0.1 CCC(=O)O MCULE-2199051150 [2,0,0,0,0,0|1,0,0]=3 2332 B4R0.1 CCC(=O)O MCULE-9800054040 [2,0,0,0,0,0|1,0,0]=3 2333 B4R0.1 CCC(=O)S MCULE-3392119766 [2,0,0,0,0,0|1,0,0]=3 2334 B4R0.1 CCC(=O)[O-] MCULE-6321502767 [2,0,0,0,0,0|1,0,0]=3 2335 B4R0.1 CCC(=S)N MCULE-3921479699 [2,0,0,0,0,0|1,1,0]=4 2336 B4R0.1 CCC(C)Br MCULE-9661620259 [2,0,0,0,0,0|1,0,1]=4 2337 B4R0.1 CCC(C)C MCULE-5376105936 [2,0,0,0,0,0|1,0,1]=4 2338 B4R0.1 CCC(C)Cl MCULE-2954418486 [2,0,0,0,0,0|1,0,1]=4 2339 B4R0.1 CCC(C)I MCULE-5239699587 [2,0,0,0,0,0|1,0,1]=4 2340 B4R0.1 CCC(C)N MCULE-5041676035 [2,0,0,0,0,0|1,0,1]=4 2341 B4R0.1 CCC(C)N MCULE-5835091553 [2,0,0,0,0,0|1,0,1]=4 2342 B4R0.1 CCC(C)N MCULE-6631606230 [2,0,0,0,0,0|1,0,1]=4 2343 B4R0.1 CCC(C)N MCULE-8165681721 [2,0,0,0,0,0|1,0,1]=4 2344 B4R0.1 CCC(C)O MCULE-4099350806 [2,0,0,0,0,0|0,0,2]=4 2345 B4R0.1 CCC(C)O MCULE-5005120003 [2,0,0,0,0,0|0,0,2]=4 2346 B4R0.1 CCC(C)S MCULE-4988033753 [2,0,0,0,0,0|0,1,1]=4 2347 B4R0.1 CCN(=O)=O MCULE-6603591614 [2,0,0,0,0,0|2,0,0]=4 2348 B4R0.1 CCN(C)C MCULE-5825033552 [2,0,0,0,0,0|2,0,0]=4 2349 B4R0.1 CCN(C)N MCULE-2279492356 [2,0,0,0,0,0|2,0,0]=4 2350 B4R0.1 CCN(C)N MCULE-5660338703 [2,0,0,0,0,0|2,0,0]=4 2351 B4R0.1 CCN(C)N MCULE-9839987578 [2,0,0,0,0,0|2,0,0]=4 2352 B4R0.1 CCS(=O)C MCULE-4400935745 [2,0,0,0,0,0|1,0,0]=3 2353 B4R0.1 CCS(=O)O MCULE-9872932319 [2,0,0,0,0,0|2,0,0]=4 2354 B4R0.1 CCS(=O)[O-] MCULE-4386198822 [2,0,0,0,0,0|2,0,0]=4 2355 B4R0.1 CC[C@@H](C)N MCULE-2017255826 [2,0,0,0,0,0|1,0,1]=4 2356 B4R0.1 CC[C@@H](C)N MCULE-3555707512 [2,0,0,0,0,0|1,0,1]=4 2357 B4R0.1 CC[C@@H](C)N MCULE-6783735598 [2,0,0,0,0,0|1,0,1]=4 2358 B4R0.1 CC[C@@H](C)N MCULE-7004219201 [2,0,0,0,0,0|1,0,1]=4 2359 B4R0.1 CC[C@@H](C)O MCULE-2661481448 [2,0,0,0,0,0|0,0,2]=4 2360 B4R0.1 CC[C@@H](C)O MCULE-6785232833 [2,0,0,0,0,0|0,0,2]=4 2361 B4R0.1 CC[C@H](C)N MCULE-2450201533 [2,0,0,0,0,0|1,0,1]=4 2362 B4R0.1 CC[C@H](C)N MCULE-2998961427 [2,0,0,0,0,0|1,0,1]=4 2363 B4R0.1 CC[C@H](C)N MCULE-6692190471 [2,0,0,0,0,0|1,0,1]=4 2364 B4R0.1 CC[C@H](C)N MCULE-6904795465 [2,0,0,0,0,0|1,0,1]=4 2365 B4R0.1 CC[C@H](C)O MCULE-3700911573 [2,0,0,0,0,0|0,0,2]=4 2366 B4R0.1 CC[C@H](C)O MCULE-6063716138 [2,0,0,0,0,0|0,0,2]=4 2367 B4R0.1 CNC(=O)C MCULE-2612997941 [2,0,0,0,0,0|1,0,0]=3 2368 B4R0.1 CNC(=O)Cl MCULE-7743744606 [2,0,0,0,0,0|2,0,0]=4 2369 B4R0.1 CNC(=O)N MCULE-6422331704 [2,0,0,0,0,0|2,0,0]=4 2370 B4R0.1 CNC(=S)C MCULE-8699171591 [2,0,0,0,0,0|1,1,0]=4 2371 B4R0.1 COC(=N)C MCULE-2752794913 [2,0,0,0,0,0|1,0,0]=3 2372 B4R0.1 COC(=N)C MCULE-2904991083 [2,0,0,0,0,0|1,0,0]=3 2373 B4R0.1 COC(=N)N MCULE-1611076737 [2,0,0,0,0,0|2,0,0]=4 2374 B4R0.1 COC(=N)N MCULE-4923904579 [2,0,0,0,0,0|2,0,0]=4 2375 B4R0.1 COC(=N)N MCULE-6696789855 [2,0,0,0,0,0|2,0,0]=4 2376 B4R0.1 COC(=N)N MCULE-9171600210 [2,0,0,0,0,0|2,0,0]=4 2377 B4R0.1 COC(=O)C MCULE-7368066093 [2,0,0,0,0,0|0,0,0]=2 2378 B4R0.1 COC(=O)Cl MCULE-8022274771 [2,0,0,0,0,0|1,0,0]=3 2379 B4R0.1 COC(=O)N MCULE-4070607369 [2,0,0,0,0,0|1,0,0]=3 2380 B4R0.1 COC(=S)N MCULE-9414558443 [2,0,0,0,0,0|1,1,0]=4 2381 B4R0.1 COC(=S)[S-] MCULE-4829872223 [2,0,0,0,0,0|1,1,0]=4 2382 B4R0.1 COC(=S)[S-] MCULE-6509496630 [2,0,0,0,0,0|1,1,0]=4 2383 B4R0.1 COC(C)Cl MCULE-9043930044 [2,0,0,0,0,0|1,0,1]=4 2384 B4R0.1 CSC(=O)C MCULE-7061634598 [2,0,0,0,0,0|0,1,0]=3 2385 B4R0.1 CSC(=S)C MCULE-4836153374 [2,0,0,0,0,0|0,2,0]=4 2386 B4R0.1 CSS(=O)C MCULE-6515592458 [2,0,0,0,0,0|1,1,0]=4 2387 B4R0.1 NC(=O)CBr MCULE-9306090536 [2,0,0,0,0,0|2,0,0]=4 2388 B4R0.1 NC(=O)CCl MCULE-3241549842 [2,0,0,0,0,0|2,0,0]=4 2389 B4R0.1 NC(=O)CF MCULE-3344212657 [2,0,0,0,0,0|2,0,0]=4 2390 B4R0.1 NC(=O)CI MCULE-4217973413 [2,0,0,0,0,0|2,0,0]=4 2391 B4R0.1 NC(=O)CO MCULE-2739878376 [2,0,0,0,0,0|2,0,0]=4 2392 B4R0.1 NC(=O)CS MCULE-2639305532 [2,0,0,0,0,0|2,0,0]=4 2393 B4R0.1 NCC(=O)N MCULE-1048848056 [2,0,0,0,0,0|2,0,0]=4 2394 B4R0.1 NCC(=O)N MCULE-2174395809 [2,0,0,0,0,0|2,0,0]=4 2395 B4R0.1 NCC(=O)N MCULE-6113166250 [2,0,0,0,0,0|2,0,0]=4 2396 B4R0.1 NCC(=O)O MCULE-2415764032 [2,0,0,0,0,0|2,0,0]=4 2397 B4R0.1 NCC(=O)O MCULE-3643110755 [2,0,0,0,0,0|2,0,0]=4 2398 B4R0.1 NCC(=O)O MCULE-4349255299 [2,0,0,0,0,0|2,0,0]=4 2399 B4R0.1 NCC(=O)O MCULE-9146223615 [2,0,0,0,0,0|2,0,0]=4 2400 B4R0.1 NCC(=O)O MCULE-9701991737 [2,0,0,0,0,0|2,0,0]=4 2401 B4R0.1 NCC(=O)S MCULE-9837799864 [2,0,0,0,0,0|2,0,0]=4 2402 B4R0.1 NCC(=O)[O-] MCULE-5975202378 [2,0,0,0,0,0|2,0,0]=4 2403 B4R0.1 O=C(Br)CBr MCULE-6031858200 [2,0,0,0,0,0|2,0,0]=4 2404 B4R0.1 O=C(Cl)CBr MCULE-7684029984 [2,0,0,0,0,0|2,0,0]=4 2405 B4R0.1 O=C(Cl)CCl MCULE-7076914635 [2,0,0,0,0,0|2,0,0]=4 2406 B4R0.1 O=C(Cl)CF MCULE-7182087882 [2,0,0,0,0,0|2,0,0]=4 2407 B4R0.1 O=C(Cl)CI MCULE-5719121455 [2,0,0,0,0,0|2,0,0]=4 2408 B4R0.1 O=C(O)CBr MCULE-1503716137 [2,0,0,0,0,0|2,0,0]=4 2409 B4R0.1 O=C(O)CCl MCULE-9228754880 [2,0,0,0,0,0|2,0,0]=4 2410 B4R0.1 O=C(O)CF MCULE-6584094437 [2,0,0,0,0,0|2,0,0]=4 2411 B4R0.1 O=C(O)CI MCULE-3146792857 [2,0,0,0,0,0|2,0,0]=4 2412 B4R0.1 O=C(O)CO MCULE-9792551388 [2,0,0,0,0,0|2,0,0]=4 2413 B4R0.1 O=C(O)CS MCULE-8097997001 [2,0,0,0,0,0|2,0,0]=4 2414 B4R0.1 O=C([O-])CF MCULE-8428965857 [2,0,0,0,0,0|2,0,0]=4 2415 B4R0.1 O=C([O-])CO MCULE-2780567509 [2,0,0,0,0,0|2,0,0]=4 2416 B4R0.1 O=C([O-])CS MCULE-3314809220 [2,0,0,0,0,0|2,0,0]=4 2417 B4R0.1 O=C([O-])CS MCULE-5989133747 [2,0,0,0,0,0|2,0,0]=4 2418 B4R0.1 [NH3+]C(C)CC MCULE-3066898055 [2,0,0,0,0,0|1,0,1]=4 2419 B4R0.2 C#CCCC MCULE-1233806896 [2,0,0,0,0,0|0,0,2]=4 2420 B4R0.2 C#CCOC MCULE-9172422462 [2,0,0,0,0,0|0,0,2]=4 2421 B4R0.2 C#COCC MCULE-1522528824 [2,0,0,0,0,0|0,0,2]=4 2422 B4R0.2 C/C=C/C=O MCULE-9924705308 [2,0,0,0,0,0|0,0,2]=4 2423 B4R0.2 C/C=C/CCl MCULE-9977493525 [2,0,0,0,0,0|1,0,1]=4 2424 B4R0.2 C/C=C/CO MCULE-2383161163 [2,0,0,0,0,0|1,0,1]=4 2425 B4R0.2 C/C=C/OC MCULE-3906920304 [2,0,0,0,0,0|0,0,2]=4 2426 B4R0.2 C/C=C\CO MCULE-5924662327 [2,0,0,0,0,0|1,0,1]=4 2427 B4R0.2 C=C=CCC MCULE-6123315571 [2,0,0,0,0,0|1,0,1]=4 2428 B4R0.2 C=CCCBr MCULE-2890129103 [2,0,0,0,0,0|1,0,1]=4 2429 B4R0.2 C=CCCC MCULE-8386546337 [2,0,0,0,0,0|0,0,1]=3 2430 B4R0.2 C=CCCCl MCULE-5903789900 [2,0,0,0,0,0|1,0,1]=4 2431 B4R0.2 C=CCCI MCULE-1055671394 [2,0,0,0,0,0|1,0,1]=4 2432 B4R0.2 C=CCCN MCULE-2471716627 [2,0,0,0,0,0|1,0,1]=4 2433 B4R0.2 C=CCCN MCULE-2881108697 [2,0,0,0,0,0|1,0,1]=4 2434 B4R0.2 C=CCCO MCULE-4582400839 [2,0,0,0,0,0|1,0,1]=4 2435 B4R0.2 C=CCNC MCULE-3335720336 [2,0,0,0,0,0|1,0,1]=4 2436 B4R0.2 C=CCOC MCULE-3321225771 [2,0,0,0,0,0|0,0,2]=4 2437 B4R0.2 C=CCSC MCULE-4452023915 [2,0,0,0,0,0|1,0,1]=4 2438 B4R0.2 C=COCC MCULE-2569047033 [2,0,0,0,0,0|0,0,1]=3 2439 B4R0.2 C=CSCC MCULE-8927374165 [2,0,0,0,0,0|0,1,1]=4 2440 B4R0.2 CC#CC=O MCULE-9270622693 [2,0,0,0,0,0|0,0,2]=4 2441 B4R0.2 CC#CCC MCULE-8848779220 [2,0,0,0,0,0|0,0,2]=4 2442 B4R0.2 CC=CC=O MCULE-2497362981 [2,0,0,0,0,0|0,0,2]=4 2443 B4R0.2 CC=CCBr MCULE-7855581866 [2,0,0,0,0,0|1,0,1]=4 2444 B4R0.2 CC=CCC MCULE-5931905453 [2,0,0,0,0,0|0,0,1]=3 2445 B4R0.2 CC=CCCl MCULE-3941962217 [2,0,0,0,0,0|1,0,1]=4 2446 B4R0.2 CC=CCO MCULE-7490725844 [2,0,0,0,0,0|1,0,1]=4 2447 B4R0.2 CC=COC MCULE-6712403535 [2,0,0,0,0,0|0,0,2]=4 2448 B4R0.2 CC=CSC MCULE-5921906156 [2,0,0,0,0,0|1,0,1]=4 2449 B4R0.2 CCC=CBr MCULE-4471551501 [2,0,0,0,0,0|1,0,1]=4 2450 B4R0.2 CCCC#N MCULE-8571076087 [2,0,0,0,0,0|1,0,1]=4 2451 B4R0.2 CCCC=O MCULE-8530391347 [2,0,0,0,0,0|0,0,0]=2 2452 B4R0.2 CCCCBr MCULE-3390217131 [2,0,0,0,0,0|1,0,1]=4 2453 B4R0.2 CCCCC MCULE-4643148765 [2,0,0,0,0,0|0,0,1]=3 2454 B4R0.2 CCCCCl MCULE-5329900290 [2,0,0,0,0,0|1,0,1]=4 2455 B4R0.2 CCCCF MCULE-7225760858 [2,0,0,0,0,0|1,0,1]=4 2456 B4R0.2 CCCCI MCULE-1160974720 [2,0,0,0,0,0|1,0,1]=4 2457 B4R0.2 CCCCN MCULE-1731874934 [2,0,0,0,0,0|1,0,1]=4 2458 B4R0.2 CCCCN MCULE-4233278050 [2,0,0,0,0,0|1,0,1]=4 2459 B4R0.2 CCCCN MCULE-5242069370 [2,0,0,0,0,0|1,0,1]=4 2460 B4R0.2 CCCCN MCULE-7343835253 [2,0,0,0,0,0|1,0,1]=4 2461 B4R0.2 CCCCO MCULE-1571156443 [2,0,0,0,0,0|0,0,2]=4 2462 B4R0.2 CCCCS MCULE-9441213933 [2,0,0,0,0,0|0,1,1]=4 2463 B4R0.2 CCCNC MCULE-2266616259 [2,0,0,0,0,0|1,0,0]=3 2464 B4R0.2 CCCNC MCULE-7722796872 [2,0,0,0,0,0|1,0,0]=3 2465 B4R0.2 CCCNN MCULE-4121438775 [2,0,0,0,0,0|2,0,0]=4 2466 B4R0.2 CCCNN MCULE-5875592228 [2,0,0,0,0,0|2,0,0]=4 2467 B4R0.2 CCCNN MCULE-9585694661 [2,0,0,0,0,0|2,0,0]=4 2468 B4R0.2 CCCOC MCULE-5854067718 [2,0,0,0,0,0|0,0,0]=2 2469 B4R0.2 CCCON MCULE-4800172637 [2,0,0,0,0,0|1,0,0]=3 2470 B4R0.2 CCCON MCULE-7988781002 [2,0,0,0,0,0|1,0,0]=3 2471 B4R0.2 CCCSC MCULE-8387041737 [2,0,0,0,0,0|0,1,0]=3 2472 B4R0.2 CCN=C=O MCULE-6522145601 [2,0,0,0,0,0|1,0,1]=4 2473 B4R0.2 CCNC=O MCULE-9309926274 [2,0,0,0,0,0|1,0,0]=3 2474 B4R0.2 CCNCC MCULE-3395060353 [2,0,0,0,0,0|1,0,1]=4 2475 B4R0.2 CCNCC MCULE-4374609736 [2,0,0,0,0,0|1,0,1]=4 2476 B4R0.2 CCNCC MCULE-4555901025 [2,0,0,0,0,0|1,0,1]=4 2477 B4R0.2 CCNCC MCULE-6895602113 [2,0,0,0,0,0|1,0,1]=4 2478 B4R0.2 CCNOC MCULE-4797714235 [2,0,0,0,0,0|1,0,0]=3 2479 B4R0.2 CCNOC MCULE-6486167423 [2,0,0,0,0,0|1,0,0]=3 2480 B4R0.2 CCOC=N MCULE-5321655909 [2,0,0,0,0,0|1,0,0]=3 2481 B4R0.2 CCOC=N MCULE-8158357614 [2,0,0,0,0,0|1,0,0]=3 2482 B4R0.2 CCOC=O MCULE-6245072161 [2,0,0,0,0,0|0,0,0]=2 2483 B4R0.2 CCOCBr MCULE-6644755987 [2,0,0,0,0,0|1,0,1]=4 2484 B4R0.2 CCOCC MCULE-5665709021 [2,0,0,0,0,0|0,0,1]=3 2485 B4R0.2 CCOCCl MCULE-5087992840 [2,0,0,0,0,0|1,0,1]=4 2486 B4R0.2 CCONC MCULE-5446312516 [2,0,0,0,0,0|1,0,0]=3 2487 B4R0.2 CCONC MCULE-7976027802 [2,0,0,0,0,0|1,0,0]=3 2488 B4R0.2 CCSCC MCULE-6480710239 [2,0,0,0,0,0|0,1,1]=4 2489 B4R0.2 CCSSC MCULE-9430585714 [2,0,0,0,0,0|1,1,0]=4 2490 B4R0.2 CC[NH2+]CC MCULE-9899430356 [2,0,0,0,0,0|1,0,1]=4 2491 B4R0.2 CNCCBr MCULE-3708780806 [2,0,0,0,0,0|2,0,0]=4 2492 B4R0.2 CNCCBr MCULE-6840755559 [2,0,0,0,0,0|2,0,0]=4 2493 B4R0.2 CNCCCl MCULE-1666345560 [2,0,0,0,0,0|2,0,0]=4 2494 B4R0.2 CNCCCl MCULE-8215813413 [2,0,0,0,0,0|2,0,0]=4 2495 B4R0.2 CNCCF MCULE-3719880423 [2,0,0,0,0,0|2,0,0]=4 2496 B4R0.2 CNCCF MCULE-3751701745 [2,0,0,0,0,0|2,0,0]=4 2497 B4R0.2 CNCCI MCULE-7026781832 [2,0,0,0,0,0|2,0,0]=4 2498 B4R0.2 CNCCI MCULE-8892686580 [2,0,0,0,0,0|2,0,0]=4 2499 B4R0.2 CNCCN MCULE-2881688448 [2,0,0,0,0,0|2,0,0]=4 2500 B4R0.2 CNCCN MCULE-7199403269 [2,0,0,0,0,0|2,0,0]=4 2501 B4R0.2 CNCCO MCULE-7051900771 [2,0,0,0,0,0|2,0,0]=4 2502 B4R0.2 CNCCO MCULE-7934732981 [2,0,0,0,0,0|2,0,0]=4 2503 B4R0.2 CNCCS MCULE-6430516369 [2,0,0,0,0,0|2,0,0]=4 2504 B4R0.2 COCC#N MCULE-9178522865 [2,0,0,0,0,0|1,0,1]=4 2505 B4R0.2 COCC=O MCULE-9427361019 [2,0,0,0,0,0|1,0,0]=3 2506 B4R0.2 COCCBr MCULE-8316331262 [2,0,0,0,0,0|1,0,0]=3 2507 B4R0.2 COCCCl MCULE-8886627413 [2,0,0,0,0,0|1,0,0]=3 2508 B4R0.2 COCCI MCULE-9391124374 [2,0,0,0,0,0|1,0,0]=3 2509 B4R0.2 COCCN MCULE-5051556646 [2,0,0,0,0,0|1,0,0]=3 2510 B4R0.2 COCCN MCULE-7519068386 [2,0,0,0,0,0|1,0,0]=3 2511 B4R0.2 COCCO MCULE-4751927883 [2,0,0,0,0,0|1,0,0]=3 2512 B4R0.2 COCCS MCULE-7803276094 [2,0,0,0,0,0|1,0,0]=3 2513 B4R0.2 COCOC MCULE-8559076702 [2,0,0,0,0,0|1,0,0]=3 2514 B4R0.2 COCON MCULE-6032854331 [2,0,0,0,0,0|2,0,0]=4 2515 B4R0.2 CSCCBr MCULE-1684461541 [2,0,0,0,0,0|1,1,0]=4 2516 B4R0.2 CSCCCl MCULE-8593103756 [2,0,0,0,0,0|1,1,0]=4 2517 B4R0.2 CSCCN MCULE-5168245255 [2,0,0,0,0,0|1,1,0]=4 2518 B4R0.2 CSCCN MCULE-6275285732 [2,0,0,0,0,0|1,1,0]=4 2519 B4R0.2 CSCCO MCULE-9706874325 [2,0,0,0,0,0|1,1,0]=4 2520 B4R0.2 CSCSC MCULE-5603964020 [2,0,0,0,0,0|1,1,0]=4 2521 B4R0.2 NCCON MCULE-3613980902 [2,0,0,0,0,0|2,0,0]=4 2522 B4R0.2 NCCON MCULE-7030217952 [2,0,0,0,0,0|2,0,0]=4 2523 B4R0.2 NCCON MCULE-8959912781 [2,0,0,0,0,0|2,0,0]=4 2524 B4R0.2 NOCCBr MCULE-2796346082 [2,0,0,0,0,0|2,0,0]=4 2525 B4R0.2 NOCCBr MCULE-5636354898 [2,0,0,0,0,0|2,0,0]=4 2526 B4R0.2 NOCCCl MCULE-5981688956 [2,0,0,0,0,0|2,0,0]=4 2527 B4R0.2 NOCCF MCULE-1813481600 [2,0,0,0,0,0|2,0,0]=4 2528 B4R0.2 NOCCF MCULE-2993254805 [2,0,0,0,0,0|2,0,0]=4 2529 B4R0.2 NOCCO MCULE-2545004367 [2,0,0,0,0,0|2,0,0]=4 2530 B4R0.2 O=CCCBr MCULE-4107157458 [2,0,0,0,0,0|1,0,0]=3 2531 B4R0.2 O=CCCCl MCULE-5863929313 [2,0,0,0,0,0|1,0,0]=3 2532 B4R0.2 O=CCCI MCULE-9771140462 [2,0,0,0,0,0|1,0,0]=3 2533 B4R0.2 O=CCCO MCULE-1685289763 [2,0,0,0,0,0|1,0,0]=3 2534 B4R0.2 O=COC=O MCULE-6311384332 [2,0,0,0,0,0|1,0,1]=4 2535 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [2,0,0,0,0,0|1,0,1]=4 2536 B6R0.1 C#CC(=O)CCC MCULE-8990254228 [1,1,0,0,0,0|0,0,1]=3 2537 B6R0.1 C#CC(=O)NCC MCULE-3703208943 [1,1,0,0,0,0|1,0,1]=4 2538 B6R0.1 C#CC(=O)OCC MCULE-3783424133 [1,1,0,0,0,0|0,0,1]=3 2539 B6R0.1 C#CCC(=O)OC MCULE-8097491486 [1,1,0,0,0,0|0,0,2]=4 2540 B6R0.1 C(=C/C(=O)CC)\C MCULE-9250312874 [1,1,0,0,0,0|0,0,2]=4 2541 B6R0.1 C/C=C/C(=O)OC MCULE-8935178488 [1,1,0,0,0,0|0,0,2]=4 2542 B6R0.1 C=C(CC)CCO MCULE-5317656776 [1,1,0,0,0,0|2,0,0]=4 2543 B6R0.1 C=CC(=O)CCC MCULE-9373104880 [1,1,0,0,0,0|0,0,1]=3 2544 B6R0.1 C=CC(=O)COC MCULE-1933195578 [1,1,0,0,0,0|1,0,1]=4 2545 B6R0.1 C=CC(=O)NCC MCULE-3515057147 [1,1,0,0,0,0|1,0,1]=4 2546 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [1,1,0,0,0,0|0,0,1]=3 2547 B6R0.1 C=CC(C)CCC MCULE-2692803387 [1,1,0,0,0,0|1,0,1]=4 2548 B6R0.1 C=CCC(=O)CN MCULE-3960819679 [1,1,0,0,0,0|0,0,2]=4 2549 B6R0.1 C=CCC(=O)CN MCULE-8089375331 [1,1,0,0,0,0|0,0,2]=4 2550 B6R0.1 C=CCC(=O)NC MCULE-4823208577 [1,1,0,0,0,0|0,0,2]=4 2551 B6R0.1 C=CCC(=O)OC MCULE-5546680906 [1,1,0,0,0,0|0,0,2]=4 2552 B6R0.1 C=COC(=O)CC MCULE-7662621547 [1,1,0,0,0,0|0,0,2]=4 2553 B6R0.1 C=COC(=O)CCl MCULE-7675766105 [1,1,0,0,0,0|0,0,2]=4 2554 B6R0.1 CC#CC(=O)OC MCULE-6108678475 [1,1,0,0,0,0|0,0,2]=4 2555 B6R0.1 CC/C=C(\C)/C=O MCULE-6692882718 [1,1,0,0,0,0|0,0,1]=3 2556 B6R0.1 CC=CC(=O)CC MCULE-5948495959 [1,1,0,0,0,0|0,0,2]=4 2557 B6R0.1 CC=CC(=O)OC MCULE-1093700917 [1,1,0,0,0,0|0,0,2]=4 2558 B6R0.1 CCC(=O)CC#N MCULE-6150629588 [1,1,0,0,0,0|1,0,1]=4 2559 B6R0.1 CCC(=O)CNC MCULE-3030105640 [1,1,0,0,0,0|1,0,0]=3 2560 B6R0.1 CCC(=O)CNC MCULE-6945295017 [1,1,0,0,0,0|1,0,0]=3 2561 B6R0.1 CCC(=O)COC MCULE-1087802011 [1,1,0,0,0,0|1,0,0]=3 2562 B6R0.1 CCC(=O)CSC MCULE-3230433182 [1,1,0,0,0,0|1,0,0]=3 2563 B6R0.1 CCC(=O)NOC MCULE-4440074406 [1,1,0,0,0,0|2,0,0]=4 2564 B6R0.1 CCC(=O)OCCl MCULE-6975707373 [1,1,0,0,0,0|1,0,0]=3 2565 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [1,1,0,0,0,0|1,0,1]=4 2566 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [1,1,0,0,0,0|1,0,1]=4 2567 B6R0.1 CCC=C(C)C=O MCULE-1636090264 [1,1,0,0,0,0|0,0,1]=3 2568 B6R0.1 CCCC(=NO)C MCULE-6437787263 [1,1,0,0,0,0|0,0,1]=3 2569 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [1,1,0,0,0,0|0,0,0]=2 2570 B6R0.1 CCCC(=O)CC MCULE-7121523805 [1,1,0,0,0,0|0,0,0]=2 2571 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [1,1,0,0,0,0|0,0,0]=2 2572 B6R0.1 CCCC(=O)CN MCULE-4663263123 [1,1,0,0,0,0|0,0,0]=2 2573 B6R0.1 CCCC(=O)CN MCULE-6326368932 [1,1,0,0,0,0|0,0,0]=2 2574 B6R0.1 CCCC(=O)CO MCULE-6518249412 [1,1,0,0,0,0|0,0,0]=2 2575 B6R0.1 CCCC(=O)NC MCULE-5770149071 [1,1,0,0,0,0|0,0,0]=2 2576 B6R0.1 CCCC(=O)NN MCULE-3660167295 [1,1,0,0,0,0|1,0,0]=3 2577 B6R0.1 CCCC(=O)NO MCULE-8710375368 [1,1,0,0,0,0|1,0,0]=3 2578 B6R0.1 CCCC(=O)OC MCULE-1092030267 [1,1,0,0,0,0|0,0,0]=2 2579 B6R0.1 CCCC(=O)SC MCULE-1490654381 [1,1,0,0,0,0|0,0,0]=2 2580 B6R0.1 CCCC(=S)OC MCULE-8125476093 [1,1,0,0,0,0|0,1,0]=3 2581 B6R0.1 CCCC(Br)CC MCULE-9116433502 [1,1,0,0,0,0|1,0,1]=4 2582 B6R0.1 CCCC(C)C#N MCULE-2492294131 [1,1,0,0,0,0|1,0,1]=4 2583 B6R0.1 CCCC(C)C=O MCULE-9756444218 [1,1,0,0,0,0|0,0,1]=3 2584 B6R0.1 CCCC(C)CBr MCULE-3437352091 [1,1,0,0,0,0|1,0,1]=4 2585 B6R0.1 CCCC(C)CC MCULE-7082933967 [1,1,0,0,0,0|1,0,1]=4 2586 B6R0.1 CCCC(C)CCl MCULE-2381010454 [1,1,0,0,0,0|1,0,1]=4 2587 B6R0.1 CCCC(C)CN MCULE-9552289739 [1,1,0,0,0,0|1,0,1]=4 2588 B6R0.1 CCCC(C)CO MCULE-9777250826 [1,1,0,0,0,0|0,0,2]=4 2589 B6R0.1 CCCC(C)NC MCULE-1560121168 [1,1,0,0,0,0|1,0,1]=4 2590 B6R0.1 CCCC(C)NC MCULE-2169396338 [1,1,0,0,0,0|1,0,1]=4 2591 B6R0.1 CCCC(Cl)CC MCULE-1581617529 [1,1,0,0,0,0|1,0,1]=4 2592 B6R0.1 CCCC(Cl)CCl MCULE-9464139069 [1,1,0,0,0,0|1,0,1]=4 2593 B6R0.1 CCCC(N)CC MCULE-5349906741 [1,1,0,0,0,0|1,0,1]=4 2594 B6R0.1 CCCC(N)CC MCULE-7172418373 [1,1,0,0,0,0|1,0,1]=4 2595 B6R0.1 CCCC(N)CN MCULE-8606218569 [1,1,0,0,0,0|1,0,1]=4 2596 B6R0.1 CCCC(N)CO MCULE-3404967504 [1,1,0,0,0,0|1,0,1]=4 2597 B6R0.1 CCCC(N)CO MCULE-3802448518 [1,1,0,0,0,0|1,0,1]=4 2598 B6R0.1 CCCC(N)CO MCULE-4259078445 [1,1,0,0,0,0|1,0,1]=4 2599 B6R0.1 CCCC(N)CO MCULE-6425025734 [1,1,0,0,0,0|1,0,1]=4 2600 B6R0.1 CCCC(O)CBr MCULE-5186252424 [1,1,0,0,0,0|0,0,2]=4 2601 B6R0.1 CCCC(O)CC MCULE-9504041935 [1,1,0,0,0,0|0,0,2]=4 2602 B6R0.1 CCCC(O)CCl MCULE-4737360217 [1,1,0,0,0,0|0,0,2]=4 2603 B6R0.1 CCCC(O)CN MCULE-9402934997 [1,1,0,0,0,0|0,0,2]=4 2604 B6R0.1 CCCC(O)CO MCULE-5124107719 [1,1,0,0,0,0|0,0,2]=4 2605 B6R0.1 CCCC(S)CC MCULE-1322481338 [1,1,0,0,0,0|0,1,1]=4 2606 B6R0.1 CCC[C@@H](N)CF MCULE-4702552251 [1,1,0,0,0,0|1,0,1]=4 2607 B6R0.1 CCC[C@@H](N)CF MCULE-8118043624 [1,1,0,0,0,0|1,0,1]=4 2608 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [1,1,0,0,0,0|1,0,1]=4 2609 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [1,1,0,0,0,0|1,0,1]=4 2610 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [1,1,0,0,0,0|1,0,1]=4 2611 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [1,1,0,0,0,0|0,0,2]=4 2612 B6R0.1 CCC[C@H](N)CF MCULE-7192744944 [1,1,0,0,0,0|1,0,1]=4 2613 B6R0.1 CCC[C@H](N)CF MCULE-7441387613 [1,1,0,0,0,0|1,0,1]=4 2614 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [1,1,0,0,0,0|1,0,1]=4 2615 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [1,1,0,0,0,0|1,0,1]=4 2616 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [1,1,0,0,0,0|1,0,1]=4 2617 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [1,1,0,0,0,0|1,0,1]=4 2618 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [1,1,0,0,0,0|0,0,2]=4 2619 B6R0.1 CCNC(=O)CBr MCULE-5393521747 [1,1,0,0,0,0|1,0,0]=3 2620 B6R0.1 CCNC(=O)CC MCULE-8820594723 [1,1,0,0,0,0|1,0,0]=3 2621 B6R0.1 CCNC(=O)CCl MCULE-7288703153 [1,1,0,0,0,0|1,0,0]=3 2622 B6R0.1 CCNC(=O)CN MCULE-1913543460 [1,1,0,0,0,0|1,0,0]=3 2623 B6R0.1 CCNC(=O)CN MCULE-5473845751 [1,1,0,0,0,0|1,0,0]=3 2624 B6R0.1 CCNC(=O)CO MCULE-1386307800 [1,1,0,0,0,0|1,0,0]=3 2625 B6R0.1 CCNC(=O)NC MCULE-7197803115 [1,1,0,0,0,0|1,0,0]=3 2626 B6R0.1 CCNC(=O)NN MCULE-9055200574 [1,1,0,0,0,0|2,0,0]=4 2627 B6R0.1 CCNC(=O)NO MCULE-3264850022 [1,1,0,0,0,0|2,0,0]=4 2628 B6R0.1 CCNC(=O)OC MCULE-7110705188 [1,1,0,0,0,0|1,0,0]=3 2629 B6R0.1 CCO/C(=N/O)/C MCULE-2336241507 [1,1,0,0,0,0|0,0,1]=3 2630 B6R0.1 CCO/C(=N\O)/C MCULE-7101376522 [1,1,0,0,0,0|0,0,1]=3 2631 B6R0.1 CCOC(=N)CC MCULE-4645506860 [1,1,0,0,0,0|1,0,0]=3 2632 B6R0.1 CCOC(=N)CC MCULE-9526837631 [1,1,0,0,0,0|1,0,0]=3 2633 B6R0.1 CCOC(=N)CCl MCULE-6291047852 [1,1,0,0,0,0|1,0,0]=3 2634 B6R0.1 CCOC(=N)CCl MCULE-9207251975 [1,1,0,0,0,0|1,0,0]=3 2635 B6R0.1 CCOC(=NO)C MCULE-6964305821 [1,1,0,0,0,0|0,0,1]=3 2636 B6R0.1 CCOC(=O)C#N MCULE-4506452376 [1,1,0,0,0,0|0,0,1]=3 2637 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [1,1,0,0,0,0|0,0,1]=3 2638 B6R0.1 CCOC(=O)CBr MCULE-1369687761 [1,1,0,0,0,0|0,0,0]=2 2639 B6R0.1 CCOC(=O)CC MCULE-1639864693 [1,1,0,0,0,0|0,0,0]=2 2640 B6R0.1 CCOC(=O)CCl MCULE-2200524105 [1,1,0,0,0,0|0,0,0]=2 2641 B6R0.1 CCOC(=O)CF MCULE-1926097423 [1,1,0,0,0,0|0,0,0]=2 2642 B6R0.1 CCOC(=O)CI MCULE-9898762324 [1,1,0,0,0,0|0,0,0]=2 2643 B6R0.1 CCOC(=O)CN MCULE-2185173056 [1,1,0,0,0,0|0,0,0]=2 2644 B6R0.1 CCOC(=O)CN MCULE-2628607025 [1,1,0,0,0,0|0,0,0]=2 2645 B6R0.1 CCOC(=O)CO MCULE-8121340151 [1,1,0,0,0,0|0,0,0]=2 2646 B6R0.1 CCOC(=O)CS MCULE-3354026239 [1,1,0,0,0,0|0,0,0]=2 2647 B6R0.1 CCOC(=O)NC MCULE-5506841198 [1,1,0,0,0,0|0,0,0]=2 2648 B6R0.1 CCOC(=O)NN MCULE-9872948119 [1,1,0,0,0,0|1,0,0]=3 2649 B6R0.1 CCOC(=O)NO MCULE-4701193610 [1,1,0,0,0,0|1,0,0]=3 2650 B6R0.1 CCOC(=O)OC MCULE-1185162684 [1,1,0,0,0,0|0,0,0]=2 2651 B6R0.1 CCOC(=S)SC MCULE-6959447720 [1,1,0,0,0,0|0,1,0]=3 2652 B6R0.1 CCOC(C)CC MCULE-5049998907 [1,1,0,0,0,0|1,0,1]=4 2653 B6R0.1 CCOC(C)CN MCULE-2322112215 [1,1,0,0,0,0|1,0,1]=4 2654 B6R0.1 CCOC(C)CN MCULE-7307949125 [1,1,0,0,0,0|1,0,1]=4 2655 B6R0.1 CCOC(C)CO MCULE-1592146913 [1,1,0,0,0,0|0,0,2]=4 2656 B6R0.1 CCOC(Cl)CCl MCULE-2309448343 [1,1,0,0,0,0|1,0,1]=4 2657 B6R0.1 CCOS(=O)CC MCULE-4858180441 [1,1,0,0,0,0|1,0,0]=3 2658 B6R0.1 CCS(=O)CCCl MCULE-1910591721 [1,1,0,0,0,0|2,0,0]=4 2659 B6R0.1 CCS(=O)CCN MCULE-7201812983 [1,1,0,0,0,0|2,0,0]=4 2660 B6R0.1 CCS(=O)CCN MCULE-7831905163 [1,1,0,0,0,0|2,0,0]=4 2661 B6R0.1 CCS(=O)CCO MCULE-8290368918 [1,1,0,0,0,0|2,0,0]=4 2662 B6R0.1 CCSC(=O)CC MCULE-6361738004 [1,1,0,0,0,0|0,1,0]=3 2663 B6R0.1 CN(C=O)CCO MCULE-3588371476 [1,1,0,0,0,0|2,0,0]=4 2664 B6R0.1 CN(CCO)N=O MCULE-3975606321 [1,1,0,0,0,0|2,0,0]=4 2665 B6R0.1 CNC(=O)CC#N MCULE-2970000161 [1,1,0,0,0,0|1,0,1]=4 2666 B6R0.1 CNC(=O)CCBr MCULE-9239224841 [1,1,0,0,0,0|1,0,0]=3 2667 B6R0.1 CNC(=O)CCCl MCULE-7130866366 [1,1,0,0,0,0|1,0,0]=3 2668 B6R0.1 CNC(=O)CCN MCULE-1374127264 [1,1,0,0,0,0|1,0,0]=3 2669 B6R0.1 CNC(=O)CCN MCULE-3948893656 [1,1,0,0,0,0|1,0,0]=3 2670 B6R0.1 CNC(=O)CCO MCULE-3222339741 [1,1,0,0,0,0|1,0,0]=3 2671 B6R0.1 CNC(=O)CCS MCULE-2385806944 [1,1,0,0,0,0|1,0,0]=3 2672 B6R0.1 CNC(=O)CON MCULE-6451598359 [1,1,0,0,0,0|2,0,0]=4 2673 B6R0.1 CNC(=O)CON MCULE-8743298594 [1,1,0,0,0,0|2,0,0]=4 2674 B6R0.1 CNCC(=O)NC MCULE-4579550577 [1,1,0,0,0,0|1,0,0]=3 2675 B6R0.1 CNCC(=O)NC MCULE-7833395637 [1,1,0,0,0,0|1,0,0]=3 2676 B6R0.1 CNCC(=O)NN MCULE-8639164023 [1,1,0,0,0,0|2,0,0]=4 2677 B6R0.1 CNCC(=O)OC MCULE-1667683926 [1,1,0,0,0,0|1,0,0]=3 2678 B6R0.1 CNCC(=O)OC MCULE-5530863658 [1,1,0,0,0,0|1,0,0]=3 2679 B6R0.1 CNNC(=O)OC MCULE-4763095719 [1,1,0,0,0,0|2,0,0]=4 2680 B6R0.1 COC(=N)CCCl MCULE-1997539408 [1,1,0,0,0,0|2,0,0]=4 2681 B6R0.1 COC(=N)CCCl MCULE-2235564076 [1,1,0,0,0,0|2,0,0]=4 2682 B6R0.1 COC(=N)CCO MCULE-1904978557 [1,1,0,0,0,0|2,0,0]=4 2683 B6R0.1 COC(=N)CCO MCULE-8146089973 [1,1,0,0,0,0|2,0,0]=4 2684 B6R0.1 COC(=O)CC#N MCULE-2699345092 [1,1,0,0,0,0|1,0,1]=4 2685 B6R0.1 COC(=O)CC=O MCULE-6624474559 [1,1,0,0,0,0|1,0,1]=4 2686 B6R0.1 COC(=O)CCBr MCULE-3565567444 [1,1,0,0,0,0|1,0,0]=3 2687 B6R0.1 COC(=O)CCCl MCULE-5034007224 [1,1,0,0,0,0|1,0,0]=3 2688 B6R0.1 COC(=O)CCI MCULE-5984806612 [1,1,0,0,0,0|1,0,0]=3 2689 B6R0.1 COC(=O)CCN MCULE-2306060188 [1,1,0,0,0,0|1,0,0]=3 2690 B6R0.1 COC(=O)CCN MCULE-8245275833 [1,1,0,0,0,0|1,0,0]=3 2691 B6R0.1 COC(=O)CCO MCULE-8538834260 [1,1,0,0,0,0|1,0,0]=3 2692 B6R0.1 COC(=O)CCS MCULE-1695345183 [1,1,0,0,0,0|1,0,0]=3 2693 B6R0.1 COC(=O)CNN MCULE-3287579794 [1,1,0,0,0,0|2,0,0]=4 2694 B6R0.1 COC(=O)CNN MCULE-3838874166 [1,1,0,0,0,0|2,0,0]=4 2695 B6R0.1 COC(=O)CON MCULE-4799038238 [1,1,0,0,0,0|2,0,0]=4 2696 B6R0.1 COC(=O)CSC MCULE-6735536033 [1,1,0,0,0,0|1,0,0]=3 2697 B6R0.1 COC(=O)OCCl MCULE-7856529986 [1,1,0,0,0,0|1,0,0]=3 2698 B6R0.1 COC(=O)OCF MCULE-4705008675 [1,1,0,0,0,0|1,0,0]=3 2699 B6R0.1 COC(=O)OCI MCULE-8692720175 [1,1,0,0,0,0|1,0,0]=3 2700 B6R0.1 COCC(=N)OC MCULE-2350779439 [1,1,0,0,0,0|2,0,0]=4 2701 B6R0.1 COCC(=N)OC MCULE-7810421458 [1,1,0,0,0,0|2,0,0]=4 2702 B6R0.1 COCC(=O)CCl MCULE-7542636020 [1,1,0,0,0,0|1,0,0]=3 2703 B6R0.1 COCC(=O)NN MCULE-4127487886 [1,1,0,0,0,0|2,0,0]=4 2704 B6R0.1 COCC(=O)OC MCULE-8337685268 [1,1,0,0,0,0|1,0,0]=3 2705 B6R0.1 COCC(C)C=O MCULE-7679332713 [1,1,0,0,0,0|1,0,1]=4 2706 B6R0.1 CONC(=O)OC MCULE-9304532248 [1,1,0,0,0,0|2,0,0]=4 2707 B6R0.1 CSCC(=O)NN MCULE-8151954663 [1,1,0,0,0,0|2,0,0]=4 2708 B6R0.1 NCCC(=O)CN MCULE-3906468943 [1,1,0,0,0,0|1,0,0]=3 2709 B6R0.1 NCCC(=O)CN MCULE-9593243702 [1,1,0,0,0,0|1,0,0]=3 2710 B6R0.1 NNC(=O)CCO MCULE-6184351353 [1,1,0,0,0,0|2,0,0]=4 2711 B6R0.1 NNC(=O)CCS MCULE-9322963076 [1,1,0,0,0,0|2,0,0]=4 2712 B6R0.1 O=C(CCCl)NO MCULE-5569658108 [1,1,0,0,0,0|2,0,0]=4 2713 B6R0.1 O=C(CCl)CCCl MCULE-6460902474 [1,1,0,0,0,0|1,0,0]=3 2714 B6R0.1 O=C(CCl)NCO MCULE-9960585064 [1,1,0,0,0,0|2,0,0]=4 2715 B6R0.2 C=C(C)CC(=O)C MCULE-3534735279 [1,1,0,0,0,0|0,0,1]=3 2716 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [1,1,0,0,0,0|1,0,1]=4 2717 B6R0.2 C=C(C)CC(C)C MCULE-5553118538 [1,1,0,0,0,0|1,0,0]=3 2718 B6R0.2 C=C(C)C[C@@H](C)O MCULE-8518319636 [1,1,0,0,0,0|1,0,0]=3 2719 B6R0.2 C=C(C)C[C@H](C)O MCULE-7139115019 [1,1,0,0,0,0|1,0,0]=3 2720 B6R0.2 C=C(C)OC(=O)C MCULE-9345377025 [1,1,0,0,0,0|0,0,1]=3 2721 B6R0.2 CC(=CC(C)C)C MCULE-5460531772 [1,1,0,0,0,0|1,0,1]=4 2722 B6R0.2 CC(=CC(C)O)C MCULE-5270694894 [1,1,0,0,0,0|1,0,1]=4 2723 B6R0.2 CC(=N)CC(=O)C MCULE-4678643052 [1,1,0,0,0,0|0,0,1]=3 2724 B6R0.2 CC(=NC(C)C)C MCULE-4174313497 [1,1,0,0,0,0|2,0,0]=4 2725 B6R0.2 CC(=O)/C=C(/C)\N MCULE-1235186190 [1,1,0,0,0,0|0,0,2]=4 2726 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-3445340105 [1,1,0,0,0,0|0,0,2]=4 2727 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-7833799417 [1,1,0,0,0,0|0,0,2]=4 2728 B6R0.2 CC(=O)/C=C(\C)/N MCULE-6412393370 [1,1,0,0,0,0|0,0,2]=4 2729 B6R0.2 CC(=O)C=C(C)C MCULE-4922478422 [1,1,0,0,0,0|0,0,2]=4 2730 B6R0.2 CC(=O)C=C(C)N MCULE-2247743178 [1,1,0,0,0,0|0,0,2]=4 2731 B6R0.2 CC(=O)C=C(C)O MCULE-7345258397 [1,1,0,0,0,0|0,0,2]=4 2732 B6R0.2 CC(=O)C=C(C)[O-] MCULE-7733093724 [1,1,0,0,0,0|0,0,2]=4 2733 B6R0.2 CC(=O)CC(=O)C MCULE-6481204381 [1,1,0,0,0,0|0,0,1]=3 2734 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [1,1,0,0,0,0|1,0,1]=4 2735 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [1,1,0,0,0,0|1,0,1]=4 2736 B6R0.2 CC(=O)CC(=O)[O-] MCULE-6317885864 [1,1,0,0,0,0|1,0,1]=4 2737 B6R0.2 CC(=O)CC(=O)[O-] MCULE-8448177875 [1,1,0,0,0,0|1,0,1]=4 2738 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [1,1,0,0,0,0|0,0,0]=2 2739 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [1,1,0,0,0,0|0,0,0]=2 2740 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [1,1,0,0,0,0|0,0,0]=2 2741 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [1,1,0,0,0,0|0,0,0]=2 2742 B6R0.2 CC(=O)CN(=O)=O MCULE-3153232896 [1,1,0,0,0,0|2,0,0]=4 2743 B6R0.2 CC(=O)CN(C)C MCULE-8561521241 [1,1,0,0,0,0|1,0,0]=3 2744 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [1,1,0,0,0,0|0,0,0]=2 2745 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [1,1,0,0,0,0|0,0,0]=2 2746 B6R0.2 CC(=O)NC(=O)C MCULE-3040534108 [1,1,0,0,0,0|1,0,1]=4 2747 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [1,1,0,0,0,0|1,0,0]=3 2748 B6R0.2 CC(=O)NN(C)C MCULE-3444969121 [1,1,0,0,0,0|2,0,0]=4 2749 B6R0.2 CC(=O)NN(C)C MCULE-5383938091 [1,1,0,0,0,0|2,0,0]=4 2750 B6R0.2 CC(=O)OC(=O)C MCULE-9184217748 [1,1,0,0,0,0|0,0,1]=3 2751 B6R0.2 CC(=O)OC(C)Br MCULE-6494616843 [1,1,0,0,0,0|0,0,0]=2 2752 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [1,1,0,0,0,0|0,0,0]=2 2753 B6R0.2 CC(=O)OC(C)Cl MCULE-3738479003 [1,1,0,0,0,0|0,0,0]=2 2754 B6R0.2 CC(=O)SC(=O)C MCULE-5749449964 [1,1,0,0,0,0|0,1,1]=4 2755 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-4855074933 [1,1,0,0,0,0|0,0,2]=4 2756 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-6905854247 [1,1,0,0,0,0|0,0,2]=4 2757 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [1,1,0,0,0,0|1,0,0]=3 2758 B6R0.2 CC(Br)CC(=S)N MCULE-3013222937 [1,1,0,0,0,0|1,1,0]=4 2759 B6R0.2 CC(Br)CC(C)Br MCULE-1139583334 [1,1,0,0,0,0|1,0,1]=4 2760 B6R0.2 CC(C)CC(=N)N MCULE-1578322850 [1,1,0,0,0,0|2,0,0]=4 2761 B6R0.2 CC(C)CC(=N)N MCULE-1643115412 [1,1,0,0,0,0|2,0,0]=4 2762 B6R0.2 CC(C)CC(=N)N MCULE-9650824038 [1,1,0,0,0,0|2,0,0]=4 2763 B6R0.2 CC(C)CC(=O)Cl MCULE-8821231794 [1,1,0,0,0,0|1,0,0]=3 2764 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [1,1,0,0,0,0|1,0,0]=3 2765 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [1,1,0,0,0,0|1,0,0]=3 2766 B6R0.2 CC(C)CC(=S)N MCULE-7704222819 [1,1,0,0,0,0|1,1,0]=4 2767 B6R0.2 CC(C)CC(C)Br MCULE-1549882864 [1,1,0,0,0,0|1,0,1]=4 2768 B6R0.2 CC(C)CC(C)C MCULE-1646863110 [1,1,0,0,0,0|1,0,1]=4 2769 B6R0.2 CC(C)CC(C)I MCULE-6965017338 [1,1,0,0,0,0|1,0,1]=4 2770 B6R0.2 CC(C)CC(C)N MCULE-1144229692 [1,1,0,0,0,0|1,0,1]=4 2771 B6R0.2 CC(C)CC(C)N MCULE-5992377656 [1,1,0,0,0,0|1,0,1]=4 2772 B6R0.2 CC(C)CC(C)O MCULE-9223768698 [1,1,0,0,0,0|0,0,2]=4 2773 B6R0.2 CC(C)CN(=O)=O MCULE-1357840093 [1,1,0,0,0,0|2,0,0]=4 2774 B6R0.2 CC(C)CS(=O)[O-] MCULE-3716652382 [1,1,0,0,0,0|2,0,0]=4 2775 B6R0.2 CC(C)CS(=O)[O-] MCULE-7111094918 [1,1,0,0,0,0|2,0,0]=4 2776 B6R0.2 CC(C)C[C@@H](C)N MCULE-5902933285 [1,1,0,0,0,0|1,0,1]=4 2777 B6R0.2 CC(C)C[C@@H](C)N MCULE-7208228535 [1,1,0,0,0,0|1,0,1]=4 2778 B6R0.2 CC(C)C[C@@H](C)O MCULE-3150675602 [1,1,0,0,0,0|0,0,2]=4 2779 B6R0.2 CC(C)C[C@@H](C)O MCULE-4011042896 [1,1,0,0,0,0|0,0,2]=4 2780 B6R0.2 CC(C)NC(=O)N MCULE-2725741897 [1,1,0,0,0,0|2,0,0]=4 2781 B6R0.2 CC(C)OC(=N)N MCULE-3607061697 [1,1,0,0,0,0|2,0,0]=4 2782 B6R0.2 CC(C)OC(=N)N MCULE-6662387960 [1,1,0,0,0,0|2,0,0]=4 2783 B6R0.2 CC(C)OC(=O)Cl MCULE-3303340398 [1,1,0,0,0,0|1,0,0]=3 2784 B6R0.2 CC(C)OC(=O)N MCULE-9996500963 [1,1,0,0,0,0|1,0,0]=3 2785 B6R0.2 CC(C)OC(=S)[S-] MCULE-2902588510 [1,1,0,0,0,0|1,1,0]=4 2786 B6R0.2 CC(C)OC(=S)[S-] MCULE-9078070002 [1,1,0,0,0,0|1,1,0]=4 2787 B6R0.2 CC(C)OC(=S)[S-] MCULE-9949285618 [1,1,0,0,0,0|1,1,0]=4 2788 B6R0.2 CC(C)OC(C)C MCULE-2250230766 [1,1,0,0,0,0|1,0,1]=4 2789 B6R0.2 CC(C)ON(=O)=O MCULE-8820340461 [1,1,0,0,0,0|2,0,0]=4 2790 B6R0.2 CC(C)SC(=O)Cl MCULE-9803882280 [1,1,0,0,0,0|1,1,0]=4 2791 B6R0.2 CC(Cl)CC(=O)Cl MCULE-3323045052 [1,1,0,0,0,0|1,0,0]=3 2792 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [1,1,0,0,0,0|1,0,0]=3 2793 B6R0.2 CC(Cl)CN(C)C MCULE-6738916847 [1,1,0,0,0,0|2,0,0]=4 2794 B6R0.2 CC(Cl)CN(C)C MCULE-7074789151 [1,1,0,0,0,0|2,0,0]=4 2795 B6R0.2 CC(Cl)OC(=O)Cl MCULE-8020850544 [1,1,0,0,0,0|1,0,0]=3 2796 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [1,1,0,0,0,0|1,0,0]=3 2797 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [1,1,0,0,0,0|1,0,0]=3 2798 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [1,1,0,0,0,0|1,0,0]=3 2799 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [1,1,0,0,0,0|1,0,0]=3 2800 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [1,1,0,0,0,0|1,0,0]=3 2801 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [1,1,0,0,0,0|1,0,0]=3 2802 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [1,1,0,0,0,0|1,0,0]=3 2803 B6R0.2 CC(N)CC(C)O MCULE-7772080010 [1,1,0,0,0,0|0,0,2]=4 2804 B6R0.2 CC(N)CN(C)C MCULE-4834268309 [1,1,0,0,0,0|2,0,0]=4 2805 B6R0.2 CC(N)CN(C)C MCULE-9601630435 [1,1,0,0,0,0|2,0,0]=4 2806 B6R0.2 CC(N)CS(=O)C MCULE-1278482312 [1,1,0,0,0,0|1,0,0]=3 2807 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [1,1,0,0,0,0|1,0,0]=3 2808 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [1,1,0,0,0,0|1,0,0]=3 2809 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [1,1,0,0,0,0|1,0,0]=3 2810 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [1,1,0,0,0,0|1,0,0]=3 2811 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [1,1,0,0,0,0|1,0,0]=3 2812 B6R0.2 CC(O)CC(C)O MCULE-1652556328 [1,1,0,0,0,0|0,0,2]=4 2813 B6R0.2 CC(O)CN(=O)=O MCULE-1592317283 [1,1,0,0,0,0|2,0,0]=4 2814 B6R0.2 CC(O)CN(C)C MCULE-6531222530 [1,1,0,0,0,0|2,0,0]=4 2815 B6R0.2 CC(O)CN(C)C MCULE-7127620454 [1,1,0,0,0,0|2,0,0]=4 2816 B6R0.2 CC(O)CN(C)N MCULE-6197492770 [1,1,0,0,0,0|2,0,0]=4 2817 B6R0.2 CC(O)CS(=O)C MCULE-2365161952 [1,1,0,0,0,0|1,0,0]=3 2818 B6R0.2 CN(C)CC(=O)Cl MCULE-2168217529 [1,1,0,0,0,0|2,0,0]=4 2819 B6R0.2 CN(C)CC(=O)Cl MCULE-6810056185 [1,1,0,0,0,0|2,0,0]=4 2820 B6R0.2 CN(C)CC(=O)N MCULE-3894706713 [1,1,0,0,0,0|2,0,0]=4 2821 B6R0.2 CN(C)CC(=O)O MCULE-2303978039 [1,1,0,0,0,0|2,0,0]=4 2822 B6R0.2 CN(C)CC(=O)O MCULE-3368936600 [1,1,0,0,0,0|2,0,0]=4 2823 B6R0.2 CN(C)CC(=O)[O-] MCULE-3077067854 [1,1,0,0,0,0|2,0,0]=4 2824 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [1,1,0,0,0,0|1,0,0]=3 2825 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [1,1,0,0,0,0|1,0,0]=3 2826 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [1,1,0,0,0,0|1,0,0]=3 2827 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [1,1,0,0,0,0|1,0,0]=3 2828 B6R0.2 C[C@@H](N)CN(C)C MCULE-2034828409 [1,1,0,0,0,0|2,0,0]=4 2829 B6R0.2 C[C@@H](N)CN(C)C MCULE-2147556460 [1,1,0,0,0,0|2,0,0]=4 2830 B6R0.2 C[C@@H](N)CN(C)C MCULE-6097836560 [1,1,0,0,0,0|2,0,0]=4 2831 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [1,1,0,0,0,0|1,0,0]=3 2832 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [1,1,0,0,0,0|1,0,0]=3 2833 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [1,1,0,0,0,0|1,0,0]=3 2834 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [1,1,0,0,0,0|1,0,0]=3 2835 B6R0.2 C[C@@H](O)CN(C)C MCULE-3114172439 [1,1,0,0,0,0|2,0,0]=4 2836 B6R0.2 C[C@@H](O)CN(C)C MCULE-9927679143 [1,1,0,0,0,0|2,0,0]=4 2837 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-3504626196 [1,1,0,0,0,0|0,0,2]=4 2838 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-4671148975 [1,1,0,0,0,0|0,0,2]=4 2839 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-8345849773 [1,1,0,0,0,0|0,0,2]=4 2840 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [1,1,0,0,0,0|1,0,0]=3 2841 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [1,1,0,0,0,0|1,0,0]=3 2842 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [1,1,0,0,0,0|1,0,0]=3 2843 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [1,1,0,0,0,0|1,0,0]=3 2844 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [1,1,0,0,0,0|1,0,0]=3 2845 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [1,1,0,0,0,0|1,0,0]=3 2846 B6R0.2 C[C@H](N)CN(C)C MCULE-2526118342 [1,1,0,0,0,0|2,0,0]=4 2847 B6R0.2 C[C@H](N)CN(C)C MCULE-3902055308 [1,1,0,0,0,0|2,0,0]=4 2848 B6R0.2 C[C@H](N)CN(C)C MCULE-4292583182 [1,1,0,0,0,0|2,0,0]=4 2849 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [1,1,0,0,0,0|1,0,0]=3 2850 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [1,1,0,0,0,0|1,0,0]=3 2851 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [1,1,0,0,0,0|1,0,0]=3 2852 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [1,1,0,0,0,0|1,0,0]=3 2853 B6R0.2 C[C@H](O)CN(C)C MCULE-4542650002 [1,1,0,0,0,0|2,0,0]=4 2854 B6R0.2 C[C@H](O)CN(C)C MCULE-4717676519 [1,1,0,0,0,0|2,0,0]=4 2855 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-1267135444 [1,1,0,0,0,0|0,0,2]=4 2856 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-5878966333 [1,1,0,0,0,0|0,0,2]=4 2857 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-1975585935 [1,1,0,0,0,0|2,0,0]=4 2858 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-7679949306 [1,1,0,0,0,0|2,0,0]=4 2859 B6R0.2 NC(F)CC(=O)O MCULE-1563194776 [1,1,0,0,0,0|2,0,0]=4 2860 B6R0.2 NC(F)CC(=O)O MCULE-1655564430 [1,1,0,0,0,0|2,0,0]=4 2861 B6R0.2 O=C(O)CC(F)F MCULE-9388620099 [1,1,0,0,0,0|2,0,0]=4 2862 B6R0.2 P(=O)([O-])OC(C)C MCULE-5865480150 [1,1,0,0,0,0|2,0,0]=4 2863 B6R0.2 P(=O)([O-])OC(C)C MCULE-7393903455 [1,1,0,0,0,0|2,0,0]=4 2864 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [1,1,0,0,0,0|2,0,0]=4 2865 B6R0.3 C(N)(CO)C(=O)N MCULE-5512645571 [1,1,0,0,0,0|2,0,0]=4 2866 B6R0.3 C(N)(CO)C(=O)N MCULE-5852943337 [1,1,0,0,0,0|2,0,0]=4 2867 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [1,1,0,0,0,0|1,0,0]=3 2868 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [1,1,0,0,0,0|1,0,1]=4 2869 B6R0.3 CC(=O)C(=O)CBr MCULE-8560925164 [1,1,0,0,0,0|1,0,1]=4 2870 B6R0.3 CC(=O)C(=O)CCl MCULE-2778551811 [1,1,0,0,0,0|1,0,1]=4 2871 B6R0.3 CC(=O)C(Br)C=O MCULE-6904531970 [1,1,0,0,0,0|1,0,1]=4 2872 B6R0.3 CC(=O)C(C)C#N MCULE-3849364002 [1,1,0,0,0,0|1,0,1]=4 2873 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [1,1,0,0,0,0|1,0,1]=4 2874 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [1,1,0,0,0,0|1,0,0]=3 2875 B6R0.3 CC(=O)C(Cl)C#N MCULE-7984925847 [1,1,0,0,0,0|1,0,1]=4 2876 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [1,1,0,0,0,0|1,0,0]=3 2877 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [1,1,0,0,0,0|1,0,0]=3 2878 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [1,1,0,0,0,0|2,0,0]=4 2879 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [1,1,0,0,0,0|2,0,0]=4 2880 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [1,1,0,0,0,0|2,0,0]=4 2881 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [1,1,0,0,0,0|2,0,0]=4 2882 B6R0.3 CC(CN)S(=O)C MCULE-9048112625 [1,1,0,0,0,0|2,0,0]=4 2883 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [1,1,0,0,0,0|2,0,0]=4 2884 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [1,1,0,0,0,0|2,0,0]=4 2885 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [1,1,0,0,0,0|2,0,0]=4 2886 B6R0.3 CC=C(C)C(=O)C MCULE-8950290711 [1,1,0,0,0,0|0,0,2]=4 2887 B6R0.3 CCC(=C(C)C)C MCULE-7258057243 [1,1,0,0,0,0|1,0,1]=4 2888 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [1,1,0,0,0,0|0,0,1]=3 2889 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [1,1,0,0,0,0|1,0,1]=4 2890 B6R0.3 CCC(=O)C(=O)[O-] MCULE-7571698792 [1,1,0,0,0,0|1,0,1]=4 2891 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [1,1,0,0,0,0|1,0,0]=3 2892 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [1,1,0,0,0,0|0,0,0]=2 2893 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [1,1,0,0,0,0|1,0,0]=3 2894 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [1,1,0,0,0,0|1,0,0]=3 2895 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [1,1,0,0,0,0|1,0,0]=3 2896 B6R0.3 CCC(C)C(=N)N MCULE-4070060089 [1,1,0,0,0,0|2,0,0]=4 2897 B6R0.3 CCC(C)C(=N)N MCULE-7020524406 [1,1,0,0,0,0|2,0,0]=4 2898 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [1,1,0,0,0,0|0,0,0]=2 2899 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [1,1,0,0,0,0|1,0,0]=3 2900 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [1,1,0,0,0,0|1,0,0]=3 2901 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [1,1,0,0,0,0|1,0,0]=3 2902 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [1,1,0,0,0,0|1,0,0]=3 2903 B6R0.3 CCC(C)C(=S)N MCULE-9682279721 [1,1,0,0,0,0|1,1,0]=4 2904 B6R0.3 CCC(C)C(C)Br MCULE-5368409335 [1,1,0,0,0,0|1,0,1]=4 2905 B6R0.3 CCC(C)C(C)C MCULE-9189749509 [1,1,0,0,0,0|1,0,1]=4 2906 B6R0.3 CCC(C)C(C)Cl MCULE-2663176330 [1,1,0,0,0,0|1,0,1]=4 2907 B6R0.3 CCC(C)C(C)N MCULE-1056466337 [1,1,0,0,0,0|1,0,1]=4 2908 B6R0.3 CCC(C)C(C)N MCULE-1503543126 [1,1,0,0,0,0|1,0,1]=4 2909 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [1,1,0,0,0,0|0,0,2]=4 2910 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [1,1,0,0,0,0|1,0,0]=3 2911 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [1,1,0,0,0,0|1,0,0]=3 2912 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [1,1,0,0,0,0|1,0,0]=3 2913 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [1,1,0,0,0,0|1,0,0]=3 2914 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [1,1,0,0,0,0|1,0,0]=3 2915 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [1,1,0,0,0,0|1,0,0]=3 2916 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [1,1,0,0,0,0|1,0,0]=3 2917 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [1,1,0,0,0,0|1,0,0]=3 2918 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [1,1,0,0,0,0|1,0,0]=3 2919 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [1,1,0,0,0,0|1,0,0]=3 2920 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [1,1,0,0,0,0|1,0,0]=3 2921 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [1,1,0,0,0,0|1,0,0]=3 2922 B6R0.3 CCC(N)C(C)C MCULE-3624338196 [1,1,0,0,0,0|1,0,1]=4 2923 B6R0.3 CCC(N)C(C)C MCULE-4491326477 [1,1,0,0,0,0|1,0,1]=4 2924 B6R0.3 CCC(N)C(C)O MCULE-2752432664 [1,1,0,0,0,0|0,0,2]=4 2925 B6R0.3 CCC(N)C(C)O MCULE-6087590428 [1,1,0,0,0,0|0,0,2]=4 2926 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [1,1,0,0,0,0|1,0,0]=3 2927 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [1,1,0,0,0,0|1,0,0]=3 2928 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [1,1,0,0,0,0|1,0,0]=3 2929 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [1,1,0,0,0,0|1,0,0]=3 2930 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [1,1,0,0,0,0|1,0,0]=3 2931 B6R0.3 CCC(O)C(C)C MCULE-1130775455 [1,1,0,0,0,0|1,0,1]=4 2932 B6R0.3 CCC(O)C(C)N MCULE-4027170059 [1,1,0,0,0,0|1,0,1]=4 2933 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [1,1,0,0,0,0|0,0,2]=4 2934 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [1,1,0,0,0,0|0,0,0]=2 2935 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [1,1,0,0,0,0|1,0,0]=3 2936 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [1,1,0,0,0,0|1,0,0]=3 2937 B6R0.3 CCN(C)C(=O)Cl MCULE-3697487267 [1,1,0,0,0,0|2,0,0]=4 2938 B6R0.3 CCN(N)C(=O)N MCULE-8674876262 [1,1,0,0,0,0|2,0,0]=4 2939 B6R0.3 CCN(O)C(=O)C MCULE-8547381969 [1,1,0,0,0,0|1,0,0]=3 2940 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [1,1,0,0,0,0|1,0,0]=3 2941 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [1,1,0,0,0,0|1,0,0]=3 2942 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [1,1,0,0,0,0|1,0,0]=3 2943 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [1,1,0,0,0,0|1,0,0]=3 2944 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [1,1,0,0,0,0|1,0,0]=3 2945 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [1,1,0,0,0,0|1,0,0]=3 2946 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [1,1,0,0,0,0|1,0,0]=3 2947 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [1,1,0,0,0,0|1,0,0]=3 2948 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [1,1,0,0,0,0|1,0,0]=3 2949 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [1,1,0,0,0,0|1,0,0]=3 2950 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [1,1,0,0,0,0|1,0,0]=3 2951 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [1,1,0,0,0,0|1,0,0]=3 2952 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [1,1,0,0,0,0|1,0,0]=3 2953 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [1,1,0,0,0,0|1,0,0]=3 2954 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [1,1,0,0,0,0|1,0,0]=3 2955 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [1,1,0,0,0,0|1,0,0]=3 2956 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-8294520512 [1,1,0,0,0,0|0,0,2]=4 2957 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-9521001934 [1,1,0,0,0,0|0,0,2]=4 2958 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [1,1,0,0,0,0|1,0,0]=3 2959 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [1,1,0,0,0,0|1,0,0]=3 2960 B6R0.3 CC[C@@H](O)C(C)C MCULE-3684327261 [1,1,0,0,0,0|1,0,1]=4 2961 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [1,1,0,0,0,0|1,0,0]=3 2962 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [1,1,0,0,0,0|1,0,0]=3 2963 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [1,1,0,0,0,0|1,0,0]=3 2964 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [1,1,0,0,0,0|1,0,0]=3 2965 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [1,1,0,0,0,0|1,0,0]=3 2966 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [1,1,0,0,0,0|1,0,0]=3 2967 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [1,1,0,0,0,0|1,0,0]=3 2968 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [1,1,0,0,0,0|1,0,0]=3 2969 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [1,1,0,0,0,0|1,0,0]=3 2970 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [1,1,0,0,0,0|1,0,0]=3 2971 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [1,1,0,0,0,0|1,0,0]=3 2972 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [1,1,0,0,0,0|1,0,0]=3 2973 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [1,1,0,0,0,0|1,0,0]=3 2974 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [1,1,0,0,0,0|1,0,1]=4 2975 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [1,1,0,0,0,0|1,0,1]=4 2976 B6R0.3 CC[C@H](N)C(C)C MCULE-3200638239 [1,1,0,0,0,0|1,0,1]=4 2977 B6R0.3 CC[C@H](N)C(C)C MCULE-4973720203 [1,1,0,0,0,0|1,0,1]=4 2978 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-1930738992 [1,1,0,0,0,0|0,0,2]=4 2979 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-4226147180 [1,1,0,0,0,0|0,0,2]=4 2980 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-7445496718 [1,1,0,0,0,0|0,0,2]=4 2981 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-9770959398 [1,1,0,0,0,0|0,0,2]=4 2982 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-3878355824 [1,1,0,0,0,0|0,0,2]=4 2983 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-4791160457 [1,1,0,0,0,0|0,0,2]=4 2984 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [1,1,0,0,0,0|1,0,0]=3 2985 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [1,1,0,0,0,0|1,0,0]=3 2986 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [1,1,0,0,0,0|1,0,0]=3 2987 B6R0.3 CC[C@H](O)C(C)C MCULE-9659963395 [1,1,0,0,0,0|1,0,1]=4 2988 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [1,1,0,0,0,0|2,0,0]=4 2989 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [1,1,0,0,0,0|2,0,0]=4 2990 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [1,1,0,0,0,0|2,0,0]=4 2991 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [1,1,0,0,0,0|2,0,0]=4 2992 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [1,1,0,0,0,0|2,0,0]=4 2993 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [1,1,0,0,0,0|2,0,0]=4 2994 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [1,1,0,0,0,0|2,0,0]=4 2995 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [1,1,0,0,0,0|2,0,0]=4 2996 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [1,1,0,0,0,0|2,0,0]=4 2997 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [1,1,0,0,0,0|2,0,0]=4 2998 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [1,1,0,0,0,0|2,0,0]=4 2999 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [1,1,0,0,0,0|2,0,0]=4 3000 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [1,1,0,0,0,0|2,0,0]=4 3001 B6R0.3 COC(=O)C(=O)C MCULE-5423483210 [1,1,0,0,0,0|1,0,1]=4 3002 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [1,1,0,0,0,0|1,0,0]=3 3003 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [1,1,0,0,0,0|2,0,0]=4 3004 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [1,1,0,0,0,0|1,0,0]=3 3005 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [1,1,0,0,0,0|2,0,0]=4 3006 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [1,1,0,0,0,0|2,0,0]=4 3007 B6R0.3 CON(C)C(=O)C MCULE-8559238750 [1,1,0,0,0,0|2,0,0]=4 3008 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [1,1,0,0,0,0|2,0,0]=4 3009 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [1,1,0,0,0,0|2,0,0]=4 3010 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [1,1,0,0,0,0|2,0,0]=4 3011 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [1,1,0,0,0,0|2,0,0]=4 3012 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [1,1,0,0,0,0|2,0,0]=4 3013 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [1,1,0,0,0,0|1,0,0]=3 3014 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [1,1,0,0,0,0|2,0,0]=4 3015 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [1,1,0,0,0,0|2,0,0]=4 3016 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [1,1,0,0,0,0|2,0,0]=4 3017 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [1,1,0,0,0,0|2,0,0]=4 3018 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [1,1,0,0,0,0|2,0,0]=4 3019 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [1,1,0,0,0,0|2,0,0]=4 3020 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [1,1,0,0,0,0|2,0,0]=4 3021 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [1,1,0,0,0,0|2,0,0]=4 3022 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [1,1,0,0,0,0|2,0,0]=4 3023 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [1,1,0,0,0,0|2,0,0]=4 3024 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [1,1,0,0,0,0|2,0,0]=4 3025 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [1,1,0,0,0,0|2,0,0]=4 3026 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [1,1,0,0,0,0|2,0,0]=4 3027 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [1,1,0,0,0,0|2,0,0]=4 3028 B6R0.3 NC(=O)C(Br)CBr MCULE-3438242131 [1,1,0,0,0,0|2,0,0]=4 3029 B6R0.3 NC(=O)C(Cl)CCl MCULE-9549750186 [1,1,0,0,0,0|2,0,0]=4 3030 B6R0.3 NC(=O)C(N)CO MCULE-4842751232 [1,1,0,0,0,0|2,0,0]=4 3031 B6R0.3 NC(=O)C(N)CO MCULE-6854366147 [1,1,0,0,0,0|2,0,0]=4 3032 B6R0.3 NC(=O)C(N)CS MCULE-3144051628 [1,1,0,0,0,0|2,0,0]=4 3033 B6R0.3 NC(=O)C(N)CS MCULE-7739536595 [1,1,0,0,0,0|2,0,0]=4 3034 B6R0.3 NC(=O)[C@@H](N)CO MCULE-2185844038 [1,1,0,0,0,0|2,0,0]=4 3035 B6R0.3 NC(=O)[C@@H](N)CO MCULE-3623516041 [1,1,0,0,0,0|2,0,0]=4 3036 B6R0.3 NC(=O)[C@@H](N)CO MCULE-6218638108 [1,1,0,0,0,0|2,0,0]=4 3037 B6R0.3 NC(=O)[C@@H](N)CS MCULE-9790378691 [1,1,0,0,0,0|2,0,0]=4 3038 B6R0.3 NC(=O)[C@H](N)CO MCULE-2061645482 [1,1,0,0,0,0|2,0,0]=4 3039 B6R0.3 NC(=O)[C@H](N)CO MCULE-5920366137 [1,1,0,0,0,0|2,0,0]=4 3040 B6R0.3 NC(=O)[C@H](N)CO MCULE-7612340519 [1,1,0,0,0,0|2,0,0]=4 3041 B6R0.3 NC(=O)[C@H](N)CO MCULE-7734326153 [1,1,0,0,0,0|2,0,0]=4 3042 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [1,1,0,0,0,0|2,0,0]=4 3043 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [1,1,0,0,0,0|2,0,0]=4 3044 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [1,1,0,0,0,0|2,0,0]=4 3045 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [1,1,0,0,0,0|2,0,0]=4 3046 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [1,1,0,0,0,0|2,0,0]=4 3047 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [1,1,0,0,0,0|2,0,0]=4 3048 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [1,1,0,0,0,0|2,0,0]=4 3049 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [1,1,0,0,0,0|2,0,0]=4 3050 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [1,1,0,0,0,0|2,0,0]=4 3051 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [1,1,0,0,0,0|2,0,0]=4 3052 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [1,1,0,0,0,0|2,0,0]=4 3053 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [1,1,0,0,0,0|2,0,0]=4 3054 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [1,1,0,0,0,0|2,0,0]=4 3055 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [1,1,0,0,0,0|2,0,0]=4 3056 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [1,1,0,0,0,0|2,0,0]=4 3057 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [1,1,0,0,0,0|2,0,0]=4 3058 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [1,1,0,0,0,0|2,0,0]=4 3059 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [1,1,0,0,0,0|2,0,0]=4 3060 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [1,1,0,0,0,0|2,0,0]=4 3061 B6R0.3 NCC(O)C(=O)N MCULE-1543465850 [1,1,0,0,0,0|2,0,0]=4 3062 B6R0.3 NCC(O)C(=O)N MCULE-9574499203 [1,1,0,0,0,0|2,0,0]=4 3063 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [1,1,0,0,0,0|2,0,0]=4 3064 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [1,1,0,0,0,0|2,0,0]=4 3065 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [1,1,0,0,0,0|2,0,0]=4 3066 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [1,1,0,0,0,0|2,0,0]=4 3067 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [1,1,0,0,0,0|2,0,0]=4 3068 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [1,1,0,0,0,0|2,0,0]=4 3069 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [1,1,0,0,0,0|2,0,0]=4 3070 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [1,1,0,0,0,0|2,0,0]=4 3071 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [1,1,0,0,0,0|2,0,0]=4 3072 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [1,1,0,0,0,0|2,0,0]=4 3073 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [1,1,0,0,0,0|2,0,0]=4 3074 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [1,1,0,0,0,0|2,0,0]=4 3075 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [1,1,0,0,0,0|2,0,0]=4 3076 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [1,1,0,0,0,0|2,0,0]=4 3077 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [1,1,0,0,0,0|2,0,0]=4 3078 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [1,1,0,0,0,0|2,0,0]=4 3079 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [1,1,0,0,0,0|2,0,0]=4 3080 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [1,1,0,0,0,0|2,0,0]=4 3081 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [1,1,0,0,0,0|2,0,0]=4 3082 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [1,1,0,0,0,0|2,0,0]=4 3083 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [1,1,0,0,0,0|2,0,0]=4 3084 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [1,1,0,0,0,0|2,0,0]=4 3085 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [1,1,0,0,0,0|2,0,0]=4 3086 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [1,1,0,0,0,0|2,0,0]=4 3087 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [1,1,0,0,0,0|2,0,0]=4 3088 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [1,1,0,0,0,0|2,0,0]=4 3089 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [1,1,0,0,0,0|2,0,0]=4 3090 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [1,1,0,0,0,0|2,0,0]=4 3091 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [1,1,0,0,0,0|2,0,0]=4 3092 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [1,1,0,0,0,0|2,0,0]=4 3093 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [1,1,0,0,0,0|2,0,0]=4 3094 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [1,1,0,0,0,0|2,0,0]=4 3095 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [1,1,0,0,0,0|2,0,0]=4 3096 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [1,1,0,0,0,0|2,0,0]=4 3097 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [1,1,0,0,0,0|2,0,0]=4 3098 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [1,1,0,0,0,0|2,0,0]=4 3099 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [1,1,0,0,0,0|2,0,0]=4 3100 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [1,1,0,0,0,0|2,0,0]=4 3101 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [1,1,0,0,0,0|2,0,0]=4 3102 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [1,1,0,0,0,0|2,0,0]=4 3103 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [1,1,0,0,0,0|2,0,0]=4 3104 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [1,1,0,0,0,0|2,0,0]=4 3105 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [1,1,0,0,0,0|2,0,0]=4 3106 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [1,1,0,0,0,0|2,0,0]=4 3107 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [1,1,0,0,0,0|2,0,0]=4 3108 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [1,1,0,0,0,0|2,0,0]=4 3109 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [1,1,0,0,0,0|2,0,0]=4 3110 B6R0.3 O=C(Cl)C(Br)CBr MCULE-8490174834 [1,1,0,0,0,0|2,0,0]=4 3111 B6R0.3 O=C(Cl)C(Cl)CCl MCULE-5571003994 [1,1,0,0,0,0|2,0,0]=4 3112 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [1,1,0,0,0,0|2,0,0]=4 3113 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [1,1,0,0,0,0|2,0,0]=4 3114 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [1,1,0,0,0,0|2,0,0]=4 3115 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [1,1,0,0,0,0|2,0,0]=4 3116 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [1,1,0,0,0,0|2,0,0]=4 3117 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [1,1,0,0,0,0|2,0,0]=4 3118 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [1,1,0,0,0,0|2,0,0]=4 3119 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [1,1,0,0,0,0|2,0,0]=4 3120 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [1,1,0,0,0,0|2,0,0]=4 3121 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [1,1,0,0,0,0|2,0,0]=4 3122 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [1,1,0,0,0,0|2,0,0]=4 3123 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [1,1,0,0,0,0|2,0,0]=4 3124 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [1,1,0,0,0,0|2,0,0]=4 3125 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [1,1,0,0,0,0|2,0,0]=4 3126 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [1,1,0,0,0,0|2,0,0]=4 3127 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [1,1,0,0,0,0|2,0,0]=4 3128 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [1,1,0,0,0,0|2,0,0]=4 3129 B6R0.3 O=C([O-])[C@@H](O)CO MCULE-4498291090 [1,1,0,0,0,0|2,0,0]=4 3130 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [1,1,0,0,0,0|2,0,0]=4 3131 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [1,1,0,0,0,0|2,0,0]=4 3132 B6R0.3 [C@H](N)(CO)C(=O)N MCULE-2792784400 [1,1,0,0,0,0|2,0,0]=4 3133 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [1,1,0,0,0,0|1,0,0]=3 3134 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [1,1,0,0,0,0|2,0,0]=4 3135 B6R0.5 CCCC(C)(C)C MCULE-2309229328 [1,1,0,0,0,0|1,0,1]=4 3136 B6R0.5 CCCC(C)(C)Cl MCULE-1426018824 [1,1,0,0,0,0|1,0,1]=4 3137 B6R0.5 CCCC(C)(C)N MCULE-2670535144 [1,1,0,0,0,0|1,0,1]=4 3138 B6R0.5 CCCC(C)(C)N MCULE-4533125677 [1,1,0,0,0,0|1,0,1]=4 3139 B6R0.5 CCCC(C)(C)O MCULE-2647276101 [1,1,0,0,0,0|0,0,2]=4 3140 B6R0.5 CCCP(=O)(O)O MCULE-3928382731 [1,1,0,0,0,0|2,0,0]=4 3141 B6R0.5 CCCS(=O)(=O)Cl MCULE-4980552385 [1,1,0,0,0,0|2,0,0]=4 3142 B6R0.5 CCCS(=O)(=O)F MCULE-7811564151 [1,1,0,0,0,0|2,0,0]=4 3143 B6R0.5 CCCS(=O)(=O)N MCULE-1554874611 [1,1,0,0,0,0|2,0,0]=4 3144 B6R0.5 CCCS(=O)(=O)O MCULE-5213264344 [1,1,0,0,0,0|2,0,0]=4 3145 B6R0.5 CCCS(=O)(=O)[O-] MCULE-5970988364 [1,1,0,0,0,0|2,0,0]=4 3146 B6R0.5 CCC[N+](C)(C)C MCULE-4840113179 [1,1,0,0,0,0|2,0,0]=4 3147 B6R0.5 CCC[N+](C)(C)C MCULE-6374165176 [1,1,0,0,0,0|2,0,0]=4 3148 B6R0.5 CCC[N+](C)(C)C MCULE-6861938722 [1,1,0,0,0,0|2,0,0]=4 3149 B6R0.5 CCC[Si](C)(C)Cl MCULE-2174562638 [1,1,0,0,0,0|1,1,0]=4 3150 B6R0.5 CCC[Si](C)(Cl)Cl MCULE-9758606777 [1,1,0,0,0,0|1,1,0]=4 3151 B6R0.5 CCNS(=O)(=O)C MCULE-7880259383 [1,1,0,0,0,0|2,0,0]=4 3152 B6R0.5 CCOC(C)(C)C MCULE-7572618089 [1,1,0,0,0,0|1,0,1]=4 3153 B6R0.5 CCOP(=O)(C)S MCULE-4864782374 [1,1,0,0,0,0|1,0,0]=3 3154 B6R0.5 CCOP(=O)(Cl)Cl MCULE-7927319323 [1,1,0,0,0,0|2,0,0]=4 3155 B6R0.5 CCOP(=S)(C)[O-] MCULE-9404531218 [1,1,0,0,0,0|1,0,1]=4 3156 B6R0.5 CCOS(=O)(=O)C MCULE-7269389229 [1,1,0,0,0,0|1,0,0]=3 3157 B6R0.5 CCOS(=O)(=O)Cl MCULE-5545793001 [1,1,0,0,0,0|2,0,0]=4 3158 B6R0.5 CCOS(=O)(=O)N MCULE-5392957728 [1,1,0,0,0,0|2,0,0]=4 3159 B6R0.5 CCO[Si](C)(C)C MCULE-5246306540 [1,1,0,0,0,0|1,1,0]=4 3160 B6R0.5 CS(=N)(=O)CCO MCULE-8018746796 [1,1,0,0,0,0|2,0,0]=4 3161 B6R0.5 CS(=O)(=O)CCBr MCULE-8646670232 [1,1,0,0,0,0|2,0,0]=4 3162 B6R0.5 CS(=O)(=O)CCCl MCULE-2793702743 [1,1,0,0,0,0|2,0,0]=4 3163 B6R0.5 CS(=O)(=O)CCN MCULE-1321841891 [1,1,0,0,0,0|2,0,0]=4 3164 B6R0.5 CS(=O)(=O)CCN MCULE-2288346161 [1,1,0,0,0,0|2,0,0]=4 3165 B6R0.5 CS(=O)(=O)CCN MCULE-7691141389 [1,1,0,0,0,0|2,0,0]=4 3166 B6R0.5 CS(=O)(=O)CCO MCULE-1589351176 [1,1,0,0,0,0|2,0,0]=4 3167 B6R0.5 CS(=O)(=O)CCS MCULE-9115674422 [1,1,0,0,0,0|2,0,0]=4 3168 B6R0.5 CS(=O)(=S)OCBr MCULE-7749578002 [1,1,0,0,0,0|2,0,0]=4 3169 B6R0.6 BrCCOCCBr MCULE-7971589019 [1,1,0,0,0,0|1,0,1]=4 3170 B6R0.6 C#CCCCC=O MCULE-4075029417 [1,1,0,0,0,0|1,0,1]=4 3171 B6R0.6 C(=C/CCC)\CO MCULE-6491762150 [1,1,0,0,0,0|1,0,0]=3 3172 B6R0.6 C/C=C/CCCC MCULE-6900331316 [1,1,0,0,0,0|1,0,0]=3 3173 B6R0.6 C/C=C/CCCO MCULE-9865436125 [1,1,0,0,0,0|1,0,0]=3 3174 B6R0.6 C/C=C\CCCC MCULE-8426867799 [1,1,0,0,0,0|1,0,0]=3 3175 B6R0.6 C/C=C\CCCO MCULE-3169839661 [1,1,0,0,0,0|1,0,0]=3 3176 B6R0.6 C=CCC/C=C/C MCULE-3936427871 [1,1,0,0,0,0|1,0,1]=4 3177 B6R0.6 C=CCCC=CC MCULE-6481809840 [1,1,0,0,0,0|1,0,1]=4 3178 B6R0.6 C=CCCCC=O MCULE-8676840281 [1,1,0,0,0,0|1,0,1]=4 3179 B6R0.6 C=CCCCCBr MCULE-4313298656 [1,1,0,0,0,0|1,0,1]=4 3180 B6R0.6 C=CCCCCC MCULE-5868303078 [1,1,0,0,0,0|1,0,1]=4 3181 B6R0.6 C=CCCCCCl MCULE-7600727876 [1,1,0,0,0,0|1,0,1]=4 3182 B6R0.6 C=CCCCCI MCULE-5694143061 [1,1,0,0,0,0|1,0,1]=4 3183 B6R0.6 C=CCCCCN MCULE-1489231988 [1,1,0,0,0,0|1,0,1]=4 3184 B6R0.6 C=CCCCCN MCULE-4288584778 [1,1,0,0,0,0|1,0,1]=4 3185 B6R0.6 C=CCCCCO MCULE-3631432277 [1,1,0,0,0,0|1,0,1]=4 3186 B6R0.6 C=CCCCNC MCULE-6696525157 [1,1,0,0,0,0|1,0,1]=4 3187 B6R0.6 C=CCCCNC MCULE-7417274044 [1,1,0,0,0,0|1,0,1]=4 3188 B6R0.6 C=CCNCCC MCULE-4239068147 [1,1,0,0,0,0|1,0,1]=4 3189 B6R0.6 C=CCNCCC MCULE-9778489216 [1,1,0,0,0,0|1,0,1]=4 3190 B6R0.6 C=CCOCC=O MCULE-8507800253 [1,1,0,0,0,0|0,0,2]=4 3191 B6R0.6 C=CCOCCBr MCULE-7565992230 [1,1,0,0,0,0|1,0,1]=4 3192 B6R0.6 C=CCOCCCl MCULE-1353236332 [1,1,0,0,0,0|1,0,1]=4 3193 B6R0.6 C=CCOCCI MCULE-8468439129 [1,1,0,0,0,0|1,0,1]=4 3194 B6R0.6 C=CCOCCN MCULE-5411259412 [1,1,0,0,0,0|1,0,1]=4 3195 B6R0.6 C=CCOCCN MCULE-9798285838 [1,1,0,0,0,0|1,0,1]=4 3196 B6R0.6 C=CCOCCO MCULE-5718868633 [1,1,0,0,0,0|1,0,1]=4 3197 B6R0.6 C=CCOCOC MCULE-6553342654 [1,1,0,0,0,0|1,0,1]=4 3198 B6R0.6 C=CCSCCC MCULE-3855352363 [1,1,0,0,0,0|0,1,1]=4 3199 B6R0.6 C=COCCCC MCULE-2025922328 [1,1,0,0,0,0|0,0,1]=3 3200 B6R0.6 C=COCCCN MCULE-1669664157 [1,1,0,0,0,0|0,0,1]=3 3201 B6R0.6 C=COCCCO MCULE-8325617945 [1,1,0,0,0,0|0,0,1]=3 3202 B6R0.6 C=COCCOC MCULE-6845218696 [1,1,0,0,0,0|0,0,1]=3 3203 B6R0.6 C=COCCON MCULE-8247202981 [1,1,0,0,0,0|1,0,1]=4 3204 B6R0.6 CC#CCCCBr MCULE-8545908172 [1,1,0,0,0,0|1,0,1]=4 3205 B6R0.6 CC#CCCCC MCULE-1899332515 [1,1,0,0,0,0|1,0,1]=4 3206 B6R0.6 CC#CCCCO MCULE-6502564684 [1,1,0,0,0,0|1,0,1]=4 3207 B6R0.6 CC/C=C/CCC MCULE-5222700461 [1,1,0,0,0,0|1,0,0]=3 3208 B6R0.6 CC/C=C/CCO MCULE-9853729917 [1,1,0,0,0,0|2,0,0]=4 3209 B6R0.6 CC/C=C\CC=O MCULE-1715953159 [1,1,0,0,0,0|1,0,1]=4 3210 B6R0.6 CC/C=C\CCO MCULE-9206958060 [1,1,0,0,0,0|2,0,0]=4 3211 B6R0.6 CC=CCCCBr MCULE-1109208969 [1,1,0,0,0,0|1,0,0]=3 3212 B6R0.6 CC=CCCCC MCULE-7277981733 [1,1,0,0,0,0|1,0,0]=3 3213 B6R0.6 CC=CCCCCl MCULE-7487798637 [1,1,0,0,0,0|1,0,0]=3 3214 B6R0.6 CC=CCCCO MCULE-1401303632 [1,1,0,0,0,0|1,0,0]=3 3215 B6R0.6 CC=CSCCC MCULE-3534082442 [1,1,0,0,0,0|0,1,0]=3 3216 B6R0.6 CCC#CCC=O MCULE-4049790039 [1,1,0,0,0,0|1,0,1]=4 3217 B6R0.6 CCC#CCCC MCULE-9615607532 [1,1,0,0,0,0|1,0,1]=4 3218 B6R0.6 CCC/C=C/C=O MCULE-3059768922 [1,1,0,0,0,0|1,0,0]=3 3219 B6R0.6 CCC=CCC=O MCULE-5764198290 [1,1,0,0,0,0|1,0,1]=4 3220 B6R0.6 CCC=CCCBr MCULE-7873583643 [1,1,0,0,0,0|2,0,0]=4 3221 B6R0.6 CCC=CCCC MCULE-3739501724 [1,1,0,0,0,0|1,0,0]=3 3222 B6R0.6 CCC=CCCI MCULE-9416216252 [1,1,0,0,0,0|2,0,0]=4 3223 B6R0.6 CCC=CCCO MCULE-1781375433 [1,1,0,0,0,0|2,0,0]=4 3224 B6R0.6 CCC=COCC MCULE-1991976030 [1,1,0,0,0,0|0,0,2]=4 3225 B6R0.6 CCCC#CCO MCULE-8352024607 [1,1,0,0,0,0|1,0,1]=4 3226 B6R0.6 CCCC=CC=O MCULE-5273169296 [1,1,0,0,0,0|1,0,0]=3 3227 B6R0.6 CCCC=CCBr MCULE-2474104566 [1,1,0,0,0,0|1,0,0]=3 3228 B6R0.6 CCCC=CCO MCULE-3204738641 [1,1,0,0,0,0|1,0,0]=3 3229 B6R0.6 CCCCCC=O MCULE-6770578514 [1,1,0,0,0,0|1,0,0]=3 3230 B6R0.6 CCCCCCBr MCULE-6022503394 [1,1,0,0,0,0|1,0,1]=4 3231 B6R0.6 CCCCCCC MCULE-5817084747 [1,1,0,0,0,0|1,0,1]=4 3232 B6R0.6 CCCCCCCl MCULE-3706149525 [1,1,0,0,0,0|1,0,1]=4 3233 B6R0.6 CCCCCCF MCULE-4320903575 [1,1,0,0,0,0|1,0,1]=4 3234 B6R0.6 CCCCCCI MCULE-1021236615 [1,1,0,0,0,0|1,0,1]=4 3235 B6R0.6 CCCCCCN MCULE-2944455155 [1,1,0,0,0,0|1,0,1]=4 3236 B6R0.6 CCCCCCN MCULE-6014217174 [1,1,0,0,0,0|1,0,1]=4 3237 B6R0.6 CCCCCCN MCULE-6021451227 [1,1,0,0,0,0|1,0,1]=4 3238 B6R0.6 CCCCCCO MCULE-4299150163 [1,1,0,0,0,0|1,0,1]=4 3239 B6R0.6 CCCCCCS MCULE-5962964855 [1,1,0,0,0,0|1,0,1]=4 3240 B6R0.6 CCCCCNC MCULE-8082703734 [1,1,0,0,0,0|1,0,1]=4 3241 B6R0.6 CCCCCOC MCULE-3370181741 [1,1,0,0,0,0|1,0,1]=4 3242 B6R0.6 CCCCCSC MCULE-6566108868 [1,1,0,0,0,0|1,0,1]=4 3243 B6R0.6 CCCCN=C=O MCULE-3381327717 [1,1,0,0,0,0|1,0,1]=4 3244 B6R0.6 CCCCNC=O MCULE-8821792924 [1,1,0,0,0,0|1,0,0]=3 3245 B6R0.6 CCCCNCC MCULE-8816750429 [1,1,0,0,0,0|1,0,1]=4 3246 B6R0.6 CCCCNOC MCULE-4265481432 [1,1,0,0,0,0|2,0,0]=4 3247 B6R0.6 CCCCOC=O MCULE-4633421026 [1,1,0,0,0,0|0,0,0]=2 3248 B6R0.6 CCCCOCC MCULE-5662731951 [1,1,0,0,0,0|0,0,1]=3 3249 B6R0.6 CCCCOCCl MCULE-5282964693 [1,1,0,0,0,0|1,0,1]=4 3250 B6R0.6 CCCCON=O MCULE-9992790020 [1,1,0,0,0,0|1,0,0]=3 3251 B6R0.6 CCCCSCC MCULE-4832924468 [1,1,0,0,0,0|0,1,1]=4 3252 B6R0.6 CCCCSCCl MCULE-4907770015 [1,1,0,0,0,0|2,0,0]=4 3253 B6R0.6 CCCNCCC MCULE-1452672638 [1,1,0,0,0,0|1,0,1]=4 3254 B6R0.6 CCCNCCC MCULE-6223802621 [1,1,0,0,0,0|1,0,1]=4 3255 B6R0.6 CCCNCCC MCULE-6789654118 [1,1,0,0,0,0|1,0,1]=4 3256 B6R0.6 CCCNCCN MCULE-2288945868 [1,1,0,0,0,0|1,0,1]=4 3257 B6R0.6 CCCNCCO MCULE-4813687741 [1,1,0,0,0,0|1,0,1]=4 3258 B6R0.6 CCCNOCC MCULE-1349462426 [1,1,0,0,0,0|0,0,1]=3 3259 B6R0.6 CCCNOCC MCULE-7159087335 [1,1,0,0,0,0|0,0,1]=3 3260 B6R0.6 CCCOCC#N MCULE-7011471802 [1,1,0,0,0,0|0,0,2]=4 3261 B6R0.6 CCCOCCC MCULE-1390130917 [1,1,0,0,0,0|0,0,1]=3 3262 B6R0.6 CCCOCCCl MCULE-6561613708 [1,1,0,0,0,0|0,0,1]=3 3263 B6R0.6 CCCOCCI MCULE-5330098176 [1,1,0,0,0,0|0,0,1]=3 3264 B6R0.6 CCCOCCN MCULE-1987261931 [1,1,0,0,0,0|0,0,1]=3 3265 B6R0.6 CCCOCCN MCULE-9033871038 [1,1,0,0,0,0|0,0,1]=3 3266 B6R0.6 CCCOCCO MCULE-3263526264 [1,1,0,0,0,0|0,0,1]=3 3267 B6R0.6 CCCSCCC MCULE-5531652471 [1,1,0,0,0,0|0,1,1]=4 3268 B6R0.6 CCCSCCN MCULE-3934428121 [1,1,0,0,0,0|0,1,1]=4 3269 B6R0.6 CCCSCCN MCULE-5705755172 [1,1,0,0,0,0|0,1,1]=4 3270 B6R0.6 CCCSCCO MCULE-8371796663 [1,1,0,0,0,0|0,1,1]=4 3271 B6R0.6 CCCSSCC MCULE-7192921435 [1,1,0,0,0,0|0,1,1]=4 3272 B6R0.6 CCNCCCN MCULE-5811169148 [1,1,0,0,0,0|1,0,1]=4 3273 B6R0.6 CCNCCCO MCULE-3251610052 [1,1,0,0,0,0|1,0,1]=4 3274 B6R0.6 CCNCCNC MCULE-9372339393 [1,1,0,0,0,0|1,0,1]=4 3275 B6R0.6 CCNCCOC MCULE-1476772953 [1,1,0,0,0,0|1,0,1]=4 3276 B6R0.6 CCNCCOC MCULE-6652489795 [1,1,0,0,0,0|1,0,1]=4 3277 B6R0.6 CCNCCSC MCULE-1736157320 [1,1,0,0,0,0|1,0,1]=4 3278 B6R0.6 CCNCCSC MCULE-9369049891 [1,1,0,0,0,0|1,0,1]=4 3279 B6R0.6 CCOCCC#N MCULE-4907543374 [1,1,0,0,0,0|0,0,2]=4 3280 B6R0.6 CCOCCC=O MCULE-1664130148 [1,1,0,0,0,0|1,0,0]=3 3281 B6R0.6 CCOCCCBr MCULE-6544747281 [1,1,0,0,0,0|0,0,1]=3 3282 B6R0.6 CCOCCCCl MCULE-8523618681 [1,1,0,0,0,0|0,0,1]=3 3283 B6R0.6 CCOCCCI MCULE-6640732668 [1,1,0,0,0,0|0,0,1]=3 3284 B6R0.6 CCOCCCN MCULE-3491529722 [1,1,0,0,0,0|0,0,1]=3 3285 B6R0.6 CCOCCCO MCULE-3077567484 [1,1,0,0,0,0|0,0,1]=3 3286 B6R0.6 CCOCCNC MCULE-5244682559 [1,1,0,0,0,0|0,0,1]=3 3287 B6R0.6 CCOCCNC MCULE-9344296133 [1,1,0,0,0,0|0,0,1]=3 3288 B6R0.6 CCOCCNN MCULE-2995792378 [1,1,0,0,0,0|1,0,1]=4 3289 B6R0.6 CCOCCNN MCULE-7756116612 [1,1,0,0,0,0|1,0,1]=4 3290 B6R0.6 CCOCCOC MCULE-2753000412 [1,1,0,0,0,0|0,0,1]=3 3291 B6R0.6 CCOCCON MCULE-6072859154 [1,1,0,0,0,0|1,0,1]=4 3292 B6R0.6 CCOCCON MCULE-7716477934 [1,1,0,0,0,0|1,0,1]=4 3293 B6R0.6 CCOCOCC MCULE-3885854108 [1,1,0,0,0,0|0,0,1]=3 3294 B6R0.6 CCSCCC=O MCULE-2493452950 [1,1,0,0,0,0|1,0,0]=3 3295 B6R0.6 CCSCCCBr MCULE-5143634954 [1,1,0,0,0,0|0,1,1]=4 3296 B6R0.6 CCSCCCN MCULE-4566450606 [1,1,0,0,0,0|0,1,1]=4 3297 B6R0.6 CCSCCCO MCULE-6719011943 [1,1,0,0,0,0|0,1,1]=4 3298 B6R0.6 CCSCCNC MCULE-6159594076 [1,1,0,0,0,0|0,1,1]=4 3299 B6R0.6 CCSCCNC MCULE-6696154047 [1,1,0,0,0,0|0,1,1]=4 3300 B6R0.6 CCSCSCC MCULE-6005869091 [1,1,0,0,0,0|0,1,1]=4 3301 B6R0.6 CNCCCCBr MCULE-4148452640 [1,1,0,0,0,0|2,0,0]=4 3302 B6R0.6 CNCCCCBr MCULE-8686440557 [1,1,0,0,0,0|2,0,0]=4 3303 B6R0.6 CNCCCCCl MCULE-1170786568 [1,1,0,0,0,0|2,0,0]=4 3304 B6R0.6 CNCCCCCl MCULE-1726466829 [1,1,0,0,0,0|2,0,0]=4 3305 B6R0.6 CNCCCCN MCULE-2542685963 [1,1,0,0,0,0|2,0,0]=4 3306 B6R0.6 CNCCCCN MCULE-7925344560 [1,1,0,0,0,0|2,0,0]=4 3307 B6R0.6 CNCCCCO MCULE-9264393637 [1,1,0,0,0,0|2,0,0]=4 3308 B6R0.6 CNCCCNC MCULE-3840224541 [1,1,0,0,0,0|2,0,0]=4 3309 B6R0.6 CNCCCOC MCULE-4057126907 [1,1,0,0,0,0|2,0,0]=4 3310 B6R0.6 CNCCCOC MCULE-8552551858 [1,1,0,0,0,0|2,0,0]=4 3311 B6R0.6 CNCCCSC MCULE-6553998750 [1,1,0,0,0,0|2,0,0]=4 3312 B6R0.6 CNOCCOC MCULE-2652662364 [1,1,0,0,0,0|1,0,0]=3 3313 B6R0.6 CNOCCOC MCULE-3394597000 [1,1,0,0,0,0|1,0,0]=3 3314 B6R0.6 COCCCC=O MCULE-2055914202 [1,1,0,0,0,0|1,0,0]=3 3315 B6R0.6 COCCCCBr MCULE-7500019583 [1,1,0,0,0,0|2,0,0]=4 3316 B6R0.6 COCCCCCl MCULE-3863170338 [1,1,0,0,0,0|2,0,0]=4 3317 B6R0.6 COCCCCN MCULE-9584631056 [1,1,0,0,0,0|2,0,0]=4 3318 B6R0.6 COCCCCO MCULE-2543196930 [1,1,0,0,0,0|2,0,0]=4 3319 B6R0.6 COCCCCO MCULE-8659106280 [1,1,0,0,0,0|2,0,0]=4 3320 B6R0.6 COCCCOC MCULE-5003816236 [1,1,0,0,0,0|2,0,0]=4 3321 B6R0.6 COCCN=C=O MCULE-7139432642 [1,1,0,0,0,0|1,0,1]=4 3322 B6R0.6 COCCNC=O MCULE-9003279073 [1,1,0,0,0,0|1,0,0]=3 3323 B6R0.6 COCCOCCl MCULE-6701095927 [1,1,0,0,0,0|1,0,1]=4 3324 B6R0.6 COCOCCBr MCULE-8856323357 [1,1,0,0,0,0|1,0,1]=4 3325 B6R0.6 COCOCCI MCULE-4444019738 [1,1,0,0,0,0|1,0,1]=4 3326 B6R0.6 COCOCCN MCULE-7974740048 [1,1,0,0,0,0|1,0,1]=4 3327 B6R0.6 COCOCCO MCULE-8093241209 [1,1,0,0,0,0|1,0,1]=4 3328 B6R0.6 COCOCOC MCULE-9183615159 [1,1,0,0,0,0|1,0,1]=4 3329 B6R0.6 CONCCCN MCULE-4780444103 [1,1,0,0,0,0|2,0,0]=4 3330 B6R0.6 CONCCCN MCULE-6095720673 [1,1,0,0,0,0|2,0,0]=4 3331 B6R0.6 CONCCCN MCULE-9121351484 [1,1,0,0,0,0|2,0,0]=4 3332 B6R0.6 CSCCCC=O MCULE-6353729217 [1,1,0,0,0,0|1,0,0]=3 3333 B6R0.6 CSCCCCN MCULE-2391033479 [1,1,0,0,0,0|2,0,0]=4 3334 B6R0.6 CSCCCCO MCULE-1045422424 [1,1,0,0,0,0|2,0,0]=4 3335 B6R0.6 CSCCCSC MCULE-6993538101 [1,1,0,0,0,0|2,0,0]=4 3336 B6R0.6 CSCCN=C=O MCULE-4217751051 [1,1,0,0,0,0|1,0,1]=4 3337 B6R0.6 ClCCOCCCl MCULE-2189904184 [1,1,0,0,0,0|1,0,1]=4 3338 B6R0.6 ClCCOCCI MCULE-8666203040 [1,1,0,0,0,0|1,0,1]=4 3339 B6R0.6 ICCOCCI MCULE-8427607007 [1,1,0,0,0,0|1,0,1]=4 3340 B6R0.6 NCC=CCCN MCULE-5058870063 [1,1,0,0,0,0|2,0,0]=4 3341 B6R0.6 NCC=CCCN MCULE-6332692206 [1,1,0,0,0,0|2,0,0]=4 3342 B6R0.6 NCCCNC=O MCULE-9651299205 [1,1,0,0,0,0|1,0,0]=3 3343 B6R0.6 NCCOCCBr MCULE-6520580224 [1,1,0,0,0,0|1,0,1]=4 3344 B6R0.6 NCCOCCCl MCULE-1975521529 [1,1,0,0,0,0|1,0,1]=4 3345 B6R0.6 NCCOCCCl MCULE-9715175348 [1,1,0,0,0,0|1,0,1]=4 3346 B6R0.6 NCCOCCF MCULE-4126568309 [1,1,0,0,0,0|1,0,1]=4 3347 B6R0.6 NCCOCCF MCULE-4641621710 [1,1,0,0,0,0|1,0,1]=4 3348 B6R0.6 NCCOCCN MCULE-1630934305 [1,1,0,0,0,0|1,0,1]=4 3349 B6R0.6 NCCOCCN MCULE-3282393357 [1,1,0,0,0,0|1,0,1]=4 3350 B6R0.6 NCCOCCN MCULE-3788231540 [1,1,0,0,0,0|1,0,1]=4 3351 B6R0.6 NCCOCCO MCULE-1073574088 [1,1,0,0,0,0|1,0,1]=4 3352 B6R0.6 O=C=NCCCCl MCULE-4158367269 [1,1,0,0,0,0|1,0,1]=4 3353 B6R0.6 O=CCCCC=O MCULE-6802048757 [1,1,0,0,0,0|1,0,1]=4 3354 B6R0.6 O=CCCCCCl MCULE-1257670284 [1,1,0,0,0,0|1,0,0]=3 3355 B6R0.6 O=CCCCCO MCULE-7959082228 [1,1,0,0,0,0|1,0,0]=3 3356 B6R0.6 O=CNCCCO MCULE-7926485528 [1,1,0,0,0,0|1,0,0]=3 3357 B6R0.6 OCCOCCBr MCULE-2641000270 [1,1,0,0,0,0|1,0,1]=4 3358 B6R0.6 OCCOCCCl MCULE-7320539957 [1,1,0,0,0,0|1,0,1]=4 3359 B6R0.6 OCCOCCF MCULE-1780385479 [1,1,0,0,0,0|1,0,1]=4 3360 B6R0.6 OCCOCCI MCULE-1083607130 [1,1,0,0,0,0|1,0,1]=4 3361 B6R0.6 OCCOCCO MCULE-1531783732 [1,1,0,0,0,0|1,0,1]=4 3362 B6R0.6 SCCOCCS MCULE-6659110232 [1,1,0,0,0,0|1,0,1]=4 3363 B8R0.2 CC(=O)C(O)C(O)CO MCULE-1853649042 [0,2,0,0,0,0|2,0,0]=4 3364 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO MCULE-9565941206 [0,2,0,0,0,0|2,0,0]=4 3365 B8R0.2 CCC(C)C(=O)C(=O)O MCULE-2376245949 [0,2,0,0,0,0|2,0,0]=4 3366 B8R0.2 CCC(C)C(=O)C(=O)[O-] MCULE-9099284149 [0,2,0,0,0,0|2,0,0]=4 3367 B8R0.2 CCC(C)C(Br)C(=O)O MCULE-1124609284 [0,2,0,0,0,0|2,0,0]=4 3368 B8R0.2 CCC(C)C(C)C(=O)C MCULE-4030096724 [0,2,0,0,0,0|1,0,0]=3 3369 B8R0.2 CCC(C)C(C)C(=O)O MCULE-9360443230 [0,2,0,0,0,0|2,0,0]=4 3370 B8R0.2 CCC(C)C(N)C(=O)N MCULE-7314175276 [0,2,0,0,0,0|2,0,0]=4 3371 B8R0.2 CCC(C)C(N)C(=O)N MCULE-8895055670 [0,2,0,0,0,0|2,0,0]=4 3372 B8R0.2 CCC(C)C(N)C(=O)O MCULE-9861955295 [0,2,0,0,0,0|2,0,0]=4 3373 B8R0.2 CCC(C)C(O)C(=O)N MCULE-2649023234 [0,2,0,0,0,0|2,0,0]=4 3374 B8R0.2 CCC(C)C(O)C(=O)O MCULE-4300622531 [0,2,0,0,0,0|2,0,0]=4 3375 B8R0.2 CCC(O)C(C)C(=O)O MCULE-7278088016 [0,2,0,0,0,0|2,0,0]=4 3376 B8R0.2 CCC(O)C(N)C(=O)O MCULE-5277569808 [0,2,0,0,0,0|2,0,0]=4 3377 B8R0.2 CCC(O)[C@H](N)C(=O)O MCULE-7480930876 [0,2,0,0,0,0|2,0,0]=4 3378 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-1413119398 [0,2,0,0,0,0|2,0,0]=4 3379 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-5186925599 [0,2,0,0,0,0|2,0,0]=4 3380 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O MCULE-5041492133 [0,2,0,0,0,0|2,0,0]=4 3381 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-2706440971 [0,2,0,0,0,0|2,0,0]=4 3382 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-8101207882 [0,2,0,0,0,0|2,0,0]=4 3383 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-1048734191 [0,2,0,0,0,0|2,0,0]=4 3384 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-1935827385 [0,2,0,0,0,0|2,0,0]=4 3385 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-8753855708 [0,2,0,0,0,0|2,0,0]=4 3386 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-9854510560 [0,2,0,0,0,0|2,0,0]=4 3387 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1200159118 [0,2,0,0,0,0|2,0,0]=4 3388 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1359318144 [0,2,0,0,0,0|2,0,0]=4 3389 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-9629903099 [0,2,0,0,0,0|2,0,0]=4 3390 B8R0.2 CC[C@H](C)[C@@H](O)C(=O)O MCULE-6017510763 [0,2,0,0,0,0|2,0,0]=4 3391 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-1760352503 [0,2,0,0,0,0|2,0,0]=4 3392 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-2341573677 [0,2,0,0,0,0|2,0,0]=4 3393 B8R0.2 CC[C@H](C)[C@H](N)C(=O)N MCULE-3415036603 [0,2,0,0,0,0|2,0,0]=4 3394 B8R0.2 CC[C@H](C)[C@H](N)C(=O)N MCULE-9677139342 [0,2,0,0,0,0|2,0,0]=4 3395 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-2215911951 [0,2,0,0,0,0|2,0,0]=4 3396 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-3217669453 [0,2,0,0,0,0|2,0,0]=4 3397 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-2804875804 [0,2,0,0,0,0|2,0,0]=4 3398 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-4272353967 [0,2,0,0,0,0|2,0,0]=4 3399 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-6087026464 [0,2,0,0,0,0|2,0,0]=4 3400 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-2118005753 [0,2,0,0,0,0|2,0,0]=4 3401 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-2420221886 [0,2,0,0,0,0|2,0,0]=4 3402 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-7168739287 [0,2,0,0,0,0|2,0,0]=4 3403 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-7351381830 [0,2,0,0,0,0|2,0,0]=4 3404 B8R0.2 [C@H](C)(CC)[C@H](N)C(=O)N MCULE-1416545198 [0,2,0,0,0,0|2,0,0]=4 3405 B8R0.2 [C@H](C)(CC)[C@H](N)C(=O)N MCULE-1950370478 [0,2,0,0,0,0|2,0,0]=4 3406 B8R0.5 C=C(C)CC(C)CCC MCULE-7442491404 [0,2,0,0,0,0|2,0,0]=4 3407 B8R0.5 C=C(CCC)CC(=O)O MCULE-5240115049 [0,2,0,0,0,0|2,0,0]=4 3408 B8R0.5 CC(=O)CN(C)CCO MCULE-4972701308 [0,2,0,0,0,0|2,0,0]=4 3409 B8R0.5 CCC/C(=C/C(=O)O)/C MCULE-2055195599 [0,2,0,0,0,0|2,0,0]=4 3410 B8R0.5 CCCC(=CC(=O)O)C MCULE-9033187683 [0,2,0,0,0,0|2,0,0]=4 3411 B8R0.5 CCCC(=O)CC(=O)C MCULE-1126963023 [0,2,0,0,0,0|1,0,0]=3 3412 B8R0.5 CCCC(=O)CC(=O)O MCULE-8977313826 [0,2,0,0,0,0|2,0,0]=4 3413 B8R0.5 CCCC(=O)OC(C)C MCULE-1932528429 [0,2,0,0,0,0|1,0,1]=4 3414 B8R0.5 CCCC(C)CC(=O)C MCULE-7925360299 [0,2,0,0,0,0|1,0,0]=3 3415 B8R0.5 CCCC(C)CC(=O)O MCULE-6002154473 [0,2,0,0,0,0|2,0,0]=4 3416 B8R0.5 CCCC(C)OC(=O)C MCULE-2841775696 [0,2,0,0,0,0|0,0,0]=2 3417 B8R0.5 CCCC(C)OC(=O)Cl MCULE-8719460411 [0,2,0,0,0,0|1,0,0]=3 3418 B8R0.5 CCCC(C)OC(=O)N MCULE-5471819133 [0,2,0,0,0,0|1,0,0]=3 3419 B8R0.5 CCCC(N)CC(=O)O MCULE-1356349547 [0,2,0,0,0,0|2,0,0]=4 3420 B8R0.5 CCCC(N)CC(=O)O MCULE-4946770886 [0,2,0,0,0,0|2,0,0]=4 3421 B8R0.5 CCCC(N)CC(=O)O MCULE-5502250330 [0,2,0,0,0,0|2,0,0]=4 3422 B8R0.5 CCCC(N)CC(=O)O MCULE-9959180111 [0,2,0,0,0,0|2,0,0]=4 3423 B8R0.5 CCCC(O)CC(=O)O MCULE-3158579605 [0,2,0,0,0,0|2,0,0]=4 3424 B8R0.5 CCCN(C)CC(=O)O MCULE-2690950295 [0,2,0,0,0,0|2,0,0]=4 3425 B8R0.5 CCCN(C)CC(=O)O MCULE-9588106269 [0,2,0,0,0,0|2,0,0]=4 3426 B8R0.5 CCCS(=O)CC(=O)O MCULE-4278595326 [0,2,0,0,0,0|1,1,0]=4 3427 B8R0.5 CCC[C@@H](N)CC(=O)O MCULE-9961668094 [0,2,0,0,0,0|2,0,0]=4 3428 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-1726586898 [0,2,0,0,0,0|2,0,0]=4 3429 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5359238908 [0,2,0,0,0,0|2,0,0]=4 3430 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5593873511 [0,2,0,0,0,0|2,0,0]=4 3431 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-7588873691 [0,2,0,0,0,0|2,0,0]=4 3432 B8R0.5 CCNC(=CC(=O)C)C MCULE-8804688598 [0,2,0,0,0,0|1,0,1]=4 3433 B8R0.5 CCNC(C)CC(=O)O MCULE-2938286546 [0,2,0,0,0,0|2,0,0]=4 3434 B8R0.5 CCNC(C)CC(=O)O MCULE-4848873654 [0,2,0,0,0,0|2,0,0]=4 3435 B8R0.5 CCOC(=O)CC(=O)C MCULE-8615117086 [0,2,0,0,0,0|1,0,1]=4 3436 B8R0.5 CCOC(=O)NC(=O)C MCULE-8711109897 [0,2,0,0,0,0|1,0,1]=4 3437 B8R0.5 CCOC(C)SC(=O)C MCULE-7308480995 [0,2,0,0,0,0|0,1,0]=3 3438 B8R0.5 CCSC(C)CC(=O)O MCULE-9735540046 [0,2,0,0,0,0|2,0,0]=4 3439 B8R0.5 CNCC(O)CC(=O)O MCULE-4502865855 [0,2,0,0,0,0|2,0,0]=4 3440 B8R0.5 CNCC(O)CC(=O)O MCULE-5628718703 [0,2,0,0,0,0|2,0,0]=4 3441 B8R0.5 COCC(=O)CC(=O)C MCULE-8600900987 [0,2,0,0,0,0|1,0,1]=4 3442 B8R0.5 COCC(C)CC(=O)O MCULE-7551495663 [0,2,0,0,0,0|2,0,0]=4 3443 B8R0.5 COCC(C)NC(=O)N MCULE-1001849810 [0,2,0,0,0,0|2,0,0]=4 3444 B8R0.5 COCC(C)OC(=O)C MCULE-8540773364 [0,2,0,0,0,0|0,0,0]=2 3445 B8R0.5 COCC(C)OC(=O)Cl MCULE-3426225357 [0,2,0,0,0,0|1,0,0]=3 3446 B8R0.5 NCCC(O)CC(=O)O MCULE-3095949832 [0,2,0,0,0,0|2,0,0]=4 3447 B8R0.5 NCCC(O)CC(=O)O MCULE-8864780829 [0,2,0,0,0,0|2,0,0]=4 3448 B8R0.16 C=CC(C#N)OC(=O)C MCULE-3859679310 [0,2,0,0,0,0|0,0,2]=4 3449 B8R0.16 C=CC(CC)CC(=O)O MCULE-3976460208 [0,2,0,0,0,0|2,0,0]=4 3450 B8R0.16 C=CC(CC)OC(=O)C MCULE-4764266837 [0,2,0,0,0,0|0,0,0]=2 3451 B8R0.16 CC(=O)NC(CO)CO MCULE-5276694510 [0,2,0,0,0,0|2,0,0]=4 3452 B8R0.16 CC(=O)OC(C#N)C#N MCULE-9192287495 [0,2,0,0,0,0|1,0,1]=4 3453 B8R0.16 CCC(CC(=O)N)OC MCULE-9685044533 [0,2,0,0,0,0|2,0,0]=4 3454 B8R0.16 CCC(CC(=O)O)OC MCULE-7066116722 [0,2,0,0,0,0|2,0,0]=4 3455 B8R0.16 CCC(CC(=O)O)SC MCULE-6546556452 [0,2,0,0,0,0|2,0,0]=4 3456 B8R0.16 CCC(CC)CC(=O)C MCULE-6127320575 [0,2,0,0,0,0|1,0,0]=3 3457 B8R0.16 CCC(CC)CC(=O)N MCULE-7974720854 [0,2,0,0,0,0|2,0,0]=4 3458 B8R0.16 CCC(CC)CC(=O)O MCULE-1604696319 [0,2,0,0,0,0|2,0,0]=4 3459 B8R0.16 CCC(CO)NC(=O)C MCULE-9868176705 [0,2,0,0,0,0|1,0,0]=3 3460 B8R0.16 CCN(CC)CC(=O)C MCULE-9148873435 [0,2,0,0,0,0|2,0,0]=4 3461 B8R0.16 CC[C@@H](CO)NC(=O)C MCULE-2664687963 [0,2,0,0,0,0|1,0,0]=3 3462 B8R0.16 CC[C@@H](CO)NC(=O)C MCULE-6485833206 [0,2,0,0,0,0|1,0,0]=3 3463 B8R0.16 COC(CC(=O)C)OC MCULE-4638877505 [0,2,0,0,0,0|2,0,0]=4 3464 B8R0.19 C(O)(CC)CC(=O)OC MCULE-6615199457 [0,2,0,0,0,0|1,0,0]=3 3465 B8R0.19 CC(CO)NC(=O)CCl MCULE-8321254604 [0,2,0,0,0,0|2,0,0]=4 3466 B8R0.19 CCC(=O)CC(=O)CC MCULE-9368471361 [0,2,0,0,0,0|1,0,1]=4 3467 B8R0.19 CCC(=O)CC(=O)OC MCULE-1605349915 [0,2,0,0,0,0|1,0,1]=4 3468 B8R0.19 CCC(=O)CC(C)CC MCULE-8568086135 [0,2,0,0,0,0|1,0,0]=3 3469 B8R0.19 CCC(=O)OC(=O)CC MCULE-4790806387 [0,2,0,0,0,0|0,0,1]=3 3470 B8R0.19 CCC(=O)OC(C)CC MCULE-9589388650 [0,2,0,0,0,0|0,0,0]=2 3471 B8R0.19 CCC(C)CC(=O)OC MCULE-6040162942 [0,2,0,0,0,0|1,0,0]=3 3472 B8R0.19 CCC(C)NC(=O)CBr MCULE-1471524055 [0,2,0,0,0,0|1,0,0]=3 3473 B8R0.19 CCC(C)NC(=O)CCl MCULE-1032516079 [0,2,0,0,0,0|1,0,0]=3 3474 B8R0.19 CCC(C)NC(=O)CN MCULE-2235248545 [0,2,0,0,0,0|1,0,0]=3 3475 B8R0.19 CCC(C)NC(=O)CN MCULE-5232759952 [0,2,0,0,0,0|1,0,0]=3 3476 B8R0.19 CCC(C)NC(=S)NC MCULE-5202176198 [0,2,0,0,0,0|1,1,0]=4 3477 B8R0.19 CCC(C)OC(=O)NN MCULE-8409912635 [0,2,0,0,0,0|1,0,0]=3 3478 B8R0.19 CCC(C)OC(C)CC MCULE-7742835008 [0,2,0,0,0,0|1,0,1]=4 3479 B8R0.19 CCC(N)CC(=O)OC MCULE-4861062224 [0,2,0,0,0,0|1,0,0]=3 3480 B8R0.19 CCC(N)CC(=O)OC MCULE-5474414259 [0,2,0,0,0,0|1,0,0]=3 3481 B8R0.19 CCC(N)CC(=O)OC MCULE-6614411962 [0,2,0,0,0,0|1,0,0]=3 3482 B8R0.19 CCC(N)CC(=O)OC MCULE-8833088600 [0,2,0,0,0,0|1,0,0]=3 3483 B8R0.19 CCC(O)OC(O)CC MCULE-9298226682 [0,2,0,0,0,0|0,0,2]=4 3484 B8R0.19 CC[C@@H](N)CC(=O)OC MCULE-2253918492 [0,2,0,0,0,0|1,0,0]=3 3485 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-7264527834 [0,2,0,0,0,0|1,0,0]=3 3486 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-8077794874 [0,2,0,0,0,0|1,0,0]=3 3487 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-1636989319 [0,2,0,0,0,0|1,0,0]=3 3488 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-6253948831 [0,2,0,0,0,0|1,0,0]=3 3489 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-7924708820 [0,2,0,0,0,0|1,0,0]=3 3490 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-8911472049 [0,2,0,0,0,0|1,0,0]=3 3491 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-3861554927 [0,2,0,0,0,0|1,0,0]=3 3492 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-6307000918 [0,2,0,0,0,0|1,0,0]=3 3493 B8R0.19 CNC(=O)CC(C)NC MCULE-8409395532 [0,2,0,0,0,0|2,0,0]=4 3494 B8R0.19 CNC(=O)CC(C)NC MCULE-9311295772 [0,2,0,0,0,0|2,0,0]=4 3495 B8R0.19 CNC(C)CC(=O)OC MCULE-1039195486 [0,2,0,0,0,0|2,0,0]=4 3496 B8R0.19 COC(=O)CC(C)CBr MCULE-9170421446 [0,2,0,0,0,0|2,0,0]=4 3497 B8R0.19 COC(=O)CC(C)SC MCULE-9425584839 [0,2,0,0,0,0|2,0,0]=4 3498 B8R0.19 COC(=O)CC(N)CN MCULE-3079708048 [0,2,0,0,0,0|2,0,0]=4 3499 B8R0.19 COC(=O)CC(N)CN MCULE-5046271852 [0,2,0,0,0,0|2,0,0]=4 3500 B8R0.19 COC(=O)CC(N)CO MCULE-4803123890 [0,2,0,0,0,0|2,0,0]=4 3501 B8R0.19 COC(=O)CC(N)CO MCULE-5372024399 [0,2,0,0,0,0|2,0,0]=4 3502 B8R0.19 COC(=O)CC(O)CCl MCULE-3924993874 [0,2,0,0,0,0|2,0,0]=4 3503 B8R0.19 COC(=O)CC(O)CN MCULE-6633164904 [0,2,0,0,0,0|2,0,0]=4 3504 B8R0.19 COC(=O)CC(O)CN MCULE-6973205945 [0,2,0,0,0,0|2,0,0]=4 3505 B8R0.19 COC(=O)CC(O)CO MCULE-1721395490 [0,2,0,0,0,0|2,0,0]=4 3506 B8R0.19 COC(=O)CC(O)CO MCULE-7578547932 [0,2,0,0,0,0|2,0,0]=4 3507 B8R0.19 COC(=O)C[C@@H](O)CCl MCULE-2437500598 [0,2,0,0,0,0|2,0,0]=4 3508 B8R0.19 COC(=O)C[C@@H](O)CCl MCULE-2535323310 [0,2,0,0,0,0|2,0,0]=4 3509 B8R0.19 COC(=O)C[C@H](O)CCl MCULE-2232290900 [0,2,0,0,0,0|2,0,0]=4 3510 B8R0.19 COC(=O)C[C@H](O)CCl MCULE-2298624118 [0,2,0,0,0,0|2,0,0]=4 3511 B8R0.19 COC(=O)C[C@H](O)CO MCULE-3243102477 [0,2,0,0,0,0|2,0,0]=4 3512 B8R0.19 COC(=O)C[C@H](O)CO MCULE-7538479392 [0,2,0,0,0,0|2,0,0]=4 3513 B8R0.19 COC(=O)NC(C)CN MCULE-4563927308 [0,2,0,0,0,0|2,0,0]=4 3514 B8R0.19 COC(=O)NC(C)CN MCULE-8813177733 [0,2,0,0,0,0|2,0,0]=4 3515 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-1533957902 [0,2,0,0,0,0|2,0,0]=4 3516 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-7036214898 [0,2,0,0,0,0|2,0,0]=4 3517 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-8908212489 [0,2,0,0,0,0|2,0,0]=4 3518 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-9526857370 [0,2,0,0,0,0|2,0,0]=4 3519 B8R0.19 COC(=O)OC(=O)OC MCULE-4144943626 [0,2,0,0,0,0|1,0,1]=4 3520 B8R0.19 CSC(=O)NC(C)CBr MCULE-5023672306 [0,2,0,0,0,0|2,0,0]=4 3521 B8R0.19 CSC(=O)NC(C)CCl MCULE-7349275493 [0,2,0,0,0,0|2,0,0]=4 3522 B8R0.19 O=C(CBr)OC(=O)CBr MCULE-1083667755 [0,2,0,0,0,0|1,0,1]=4 3523 B8R0.19 O=C(CCl)OC(=O)CCl MCULE-6955528870 [0,2,0,0,0,0|1,0,1]=4 3524 B8R0.19 O=C(CF)OC(=O)CF MCULE-4441128823 [0,2,0,0,0,0|1,0,1]=4 3525 B8R0.19 O=C(CI)OC(=O)CI MCULE-6629478677 [0,2,0,0,0,0|1,0,1]=4 3526 B8R0.19 O=C(CO)CC(O)CO MCULE-2853556664 [0,2,0,0,0,0|2,0,0]=4 3527 B8R0.19 [C@@H](N)(CC)CC(=O)OC MCULE-3287738066 [0,2,0,0,0,0|1,0,0]=3 3528 B8R0.23 C(N)(CC(C)C)C(=O)O MCULE-7664540924 [0,2,0,0,0,0|2,0,0]=4 3529 B8R0.23 C=C(CC(C)C)C(=O)C MCULE-3118173847 [0,2,0,0,0,0|1,0,0]=3 3530 B8R0.23 C=C(CC(C)C)C(=O)O MCULE-5929811654 [0,2,0,0,0,0|2,0,0]=4 3531 B8R0.23 CC(=O)C(=O)CC(C)C MCULE-9490612135 [0,2,0,0,0,0|1,0,0]=3 3532 B8R0.23 CC(=O)C(=O)OC(C)C MCULE-5022020155 [0,2,0,0,0,0|2,0,0]=4 3533 B8R0.23 CC(=O)C(C)CC(C)C MCULE-9956513410 [0,2,0,0,0,0|1,0,0]=3 3534 B8R0.23 CC(=O)C(N)CC(C)C MCULE-2548441556 [0,2,0,0,0,0|1,0,0]=3 3535 B8R0.23 CC(=O)CC(=O)C(C)C MCULE-9885161576 [0,2,0,0,0,0|1,0,1]=4 3536 B8R0.23 CC(=O)CC(O)C(=O)C MCULE-3447949844 [0,2,0,0,0,0|1,0,1]=4 3537 B8R0.23 CC(=O)CC(O)[C@H](C)N MCULE-3417979643 [0,2,0,0,0,0|1,0,0]=3 3538 B8R0.23 CC(=O)CN(C)C(C)C MCULE-2905536744 [0,2,0,0,0,0|2,0,0]=4 3539 B8R0.23 CC(=O)CN(C)C(C)C MCULE-7902012708 [0,2,0,0,0,0|2,0,0]=4 3540 B8R0.23 CC(=O)NC(C)C(=O)C MCULE-4672583112 [0,2,0,0,0,0|1,0,1]=4 3541 B8R0.23 CC(=O)NC(O)C(Cl)Cl MCULE-3137859785 [0,2,0,0,0,0|2,0,0]=4 3542 B8R0.23 CC(=O)OC(C)C(=O)C MCULE-7403314261 [0,2,0,0,0,0|0,0,1]=3 3543 B8R0.23 CC(=O)OC(C)C(=O)Cl MCULE-9987734584 [0,2,0,0,0,0|1,0,1]=4 3544 B8R0.23 CC(=O)OC(C)C(=O)O MCULE-6745958064 [0,2,0,0,0,0|1,0,1]=4 3545 B8R0.23 CC(=O)OC(C)C(=O)O MCULE-8940501529 [0,2,0,0,0,0|1,0,1]=4 3546 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl MCULE-6842776649 [0,2,0,0,0,0|1,0,1]=4 3547 B8R0.23 CC(=O)O[C@@H](C)C(=O)Cl MCULE-9564324053 [0,2,0,0,0,0|1,0,1]=4 3548 B8R0.23 CC(=O)O[C@@H](C)C(=O)O MCULE-7850132202 [0,2,0,0,0,0|1,0,1]=4 3549 B8R0.23 CC(=O)O[C@@H](C)C(=O)O MCULE-9087871033 [0,2,0,0,0,0|1,0,1]=4 3550 B8R0.23 CC(=O)O[C@@H](C)C(=S)N MCULE-3286144331 [0,2,0,0,0,0|1,0,1]=4 3551 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl MCULE-4690787544 [0,2,0,0,0,0|1,0,1]=4 3552 B8R0.23 CC(=O)O[C@H](C)C(=O)Cl MCULE-6415823129 [0,2,0,0,0,0|1,0,1]=4 3553 B8R0.23 CC(=O)O[C@H](C)C(=O)O MCULE-3788243723 [0,2,0,0,0,0|1,0,1]=4 3554 B8R0.23 CC(=O)O[C@H](C)C(=O)O MCULE-8696299139 [0,2,0,0,0,0|1,0,1]=4 3555 B8R0.23 CC(C)C(C)CC(=O)O MCULE-8256978568 [0,2,0,0,0,0|2,0,0]=4 3556 B8R0.23 CC(C)C(Cl)OC(=O)Cl MCULE-5733683700 [0,2,0,0,0,0|1,0,0]=3 3557 B8R0.23 CC(C)C(N)CC(=O)O MCULE-1591106639 [0,2,0,0,0,0|2,0,0]=4 3558 B8R0.23 CC(C)C(N)CC(=O)O MCULE-2785677086 [0,2,0,0,0,0|2,0,0]=4 3559 B8R0.23 CC(C)C(N)CC(=O)O MCULE-7741390676 [0,2,0,0,0,0|2,0,0]=4 3560 B8R0.23 CC(C)C(N)CC(=O)O MCULE-7820976140 [0,2,0,0,0,0|2,0,0]=4 3561 B8R0.23 CC(C)C(O)CC(=O)O MCULE-2577623422 [0,2,0,0,0,0|2,0,0]=4 3562 B8R0.23 CC(C)CC(=O)C(=O)O MCULE-4155006996 [0,2,0,0,0,0|2,0,0]=4 3563 B8R0.23 CC(C)CC(=O)C(=O)[O-] MCULE-1379368650 [0,2,0,0,0,0|2,0,0]=4 3564 B8R0.23 CC(C)CC(=O)C(=O)[O-] MCULE-8698784345 [0,2,0,0,0,0|2,0,0]=4 3565 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-2778142655 [0,2,0,0,0,0|2,0,0]=4 3566 B8R0.23 CC(C)CC(Br)C(=O)O MCULE-7689846956 [0,2,0,0,0,0|2,0,0]=4 3567 B8R0.23 CC(C)CC(C)C(=O)O MCULE-7217536279 [0,2,0,0,0,0|2,0,0]=4 3568 B8R0.23 CC(C)CC(Cl)C(=O)O MCULE-6347367806 [0,2,0,0,0,0|2,0,0]=4 3569 B8R0.23 CC(C)CC(F)C(=O)O MCULE-6908911956 [0,2,0,0,0,0|2,0,0]=4 3570 B8R0.23 CC(C)CC(N)C(=O)N MCULE-8974870406 [0,2,0,0,0,0|2,0,0]=4 3571 B8R0.23 CC(C)CC(N)C(=O)N MCULE-9193295179 [0,2,0,0,0,0|2,0,0]=4 3572 B8R0.23 CC(C)CC(N)C(=O)O MCULE-2550986320 [0,2,0,0,0,0|2,0,0]=4 3573 B8R0.23 CC(C)CC(N)C(=O)O MCULE-7657212416 [0,2,0,0,0,0|2,0,0]=4 3574 B8R0.23 CC(C)CC(O)C(=O)O MCULE-3638762911 [0,2,0,0,0,0|2,0,0]=4 3575 B8R0.23 CC(C)CC(O)C(=O)O MCULE-4315013875 [0,2,0,0,0,0|2,0,0]=4 3576 B8R0.23 CC(C)CN(C)C(=O)Cl MCULE-8402254804 [0,2,0,0,0,0|2,0,0]=4 3577 B8R0.23 CC(C)C[C@@H](Br)C(=O)O MCULE-2325122781 [0,2,0,0,0,0|2,0,0]=4 3578 B8R0.23 CC(C)C[C@@H](Cl)C(=O)O MCULE-6797937420 [0,2,0,0,0,0|2,0,0]=4 3579 B8R0.23 CC(C)C[C@@H](N)C(=O)N MCULE-6195005494 [0,2,0,0,0,0|2,0,0]=4 3580 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-3041792060 [0,2,0,0,0,0|2,0,0]=4 3581 B8R0.23 CC(C)C[C@@H](N)C(=O)O MCULE-8280206722 [0,2,0,0,0,0|2,0,0]=4 3582 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-4108530385 [0,2,0,0,0,0|2,0,0]=4 3583 B8R0.23 CC(C)C[C@@H](O)C(=O)O MCULE-5253943571 [0,2,0,0,0,0|2,0,0]=4 3584 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-4423121396 [0,2,0,0,0,0|2,0,0]=4 3585 B8R0.23 CC(C)C[C@H](Br)C(=O)O MCULE-7601821889 [0,2,0,0,0,0|2,0,0]=4 3586 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-1038344796 [0,2,0,0,0,0|2,0,0]=4 3587 B8R0.23 CC(C)C[C@H](Cl)C(=O)O MCULE-9007168250 [0,2,0,0,0,0|2,0,0]=4 3588 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-3907393760 [0,2,0,0,0,0|2,0,0]=4 3589 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-5393472198 [0,2,0,0,0,0|2,0,0]=4 3590 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-7425207205 [0,2,0,0,0,0|2,0,0]=4 3591 B8R0.23 CC(C)C[C@H](N)C(=O)N MCULE-8093463847 [0,2,0,0,0,0|2,0,0]=4 3592 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4718215038 [0,2,0,0,0,0|2,0,0]=4 3593 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-4930237913 [0,2,0,0,0,0|2,0,0]=4 3594 B8R0.23 CC(C)C[C@H](N)C(=O)O MCULE-8722899457 [0,2,0,0,0,0|2,0,0]=4 3595 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-1740362996 [0,2,0,0,0,0|2,0,0]=4 3596 B8R0.23 CC(C)C[C@H](O)C(=O)O MCULE-4466965907 [0,2,0,0,0,0|2,0,0]=4 3597 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-4128027229 [0,2,0,0,0,0|2,0,0]=4 3598 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-5111030586 [0,2,0,0,0,0|2,0,0]=4 3599 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-7447469347 [0,2,0,0,0,0|2,0,0]=4 3600 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-8228659608 [0,2,0,0,0,0|2,0,0]=4 3601 B8R0.23 CC(C)[C@@H](O)CC(=O)O MCULE-6946774834 [0,2,0,0,0,0|2,0,0]=4 3602 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-2362404476 [0,2,0,0,0,0|2,0,0]=4 3603 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-4006103633 [0,2,0,0,0,0|2,0,0]=4 3604 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-8085621397 [0,2,0,0,0,0|2,0,0]=4 3605 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-8783742568 [0,2,0,0,0,0|2,0,0]=4 3606 B8R0.23 CC(O)C(N)CC(=O)O MCULE-5161755443 [0,2,0,0,0,0|2,0,0]=4 3607 B8R0.23 CC(O)C(N)CC(=O)O MCULE-6370326858 [0,2,0,0,0,0|2,0,0]=4 3608 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-1416044737 [0,2,0,0,0,0|2,0,0]=4 3609 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-2990511228 [0,2,0,0,0,0|2,0,0]=4 3610 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-3178455647 [0,2,0,0,0,0|2,0,0]=4 3611 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-4413833682 [0,2,0,0,0,0|2,0,0]=4 3612 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7332826518 [0,2,0,0,0,0|2,0,0]=4 3613 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7552978009 [0,2,0,0,0,0|2,0,0]=4 3614 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5195061270 [0,2,0,0,0,0|2,0,0]=4 3615 B8R0.23 C[C@H](Cl)C[C@H](N)C(=O)O MCULE-5975065356 [0,2,0,0,0,0|2,0,0]=4 3616 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O MCULE-8673070329 [0,2,0,0,0,0|2,0,0]=4 3617 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-4796212792 [0,2,0,0,0,0|2,0,0]=4 3618 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-7620299780 [0,2,0,0,0,0|2,0,0]=4 3619 B8R0.23 [C@@H](N)(CC(C)C)C(=O)N MCULE-8990653324 [0,2,0,0,0,0|2,0,0]=4 3620 B8R0.24 CCC(C)OC(C)(C)C MCULE-8483349931 [0,2,0,0,0,0|1,0,1]=4 3621 B8R0.24 CCC(C)OS(=O)(=O)C MCULE-5827224085 [0,2,0,0,0,0|1,0,0]=3 3622 B8R0.24 CC[C@@H](C)OS(=O)(=O)C MCULE-9422532115 [0,2,0,0,0,0|1,0,0]=3 3623 B8R0.24 CC[C@H](C)OS(=O)(=O)C MCULE-7282251602 [0,2,0,0,0,0|1,0,0]=3 3624 B8R0.24 CC[C@H](C)OS(=O)(=O)C MCULE-8910858041 [0,2,0,0,0,0|1,0,0]=3 3625 B8R0.34 C#CC(C)(C)OC(=O)C MCULE-1021904450 [0,2,0,0,0,0|0,0,2]=4 3626 B8R0.34 C=C(C)CC(C)(C)CC MCULE-9469757352 [0,2,0,0,0,0|2,0,0]=4 3627 B8R0.34 CC(=O)NC(C)(C)CO MCULE-7854801131 [0,2,0,0,0,0|2,0,0]=4 3628 B8R0.34 CC(=O)OC(C)(C)CO MCULE-6739454773 [0,2,0,0,0,0|1,0,0]=3 3629 B8R0.34 CCC(C)(C)CC(=O)C MCULE-9050476347 [0,2,0,0,0,0|1,0,0]=3 3630 B8R0.34 CCC(C)(C)CC(=O)O MCULE-7231252497 [0,2,0,0,0,0|2,0,0]=4 3631 B8R0.34 CCC(C)(C)NC(=O)C MCULE-4494448055 [0,2,0,0,0,0|1,0,0]=3 3632 B8R0.34 CCC(C)(C)OC(=O)C MCULE-9920396593 [0,2,0,0,0,0|0,0,0]=2 3633 B8R0.34 CCC(C)(O)CC(=O)O MCULE-2487477968 [0,2,0,0,0,0|2,0,0]=4 3634 B8R0.34 CCC(F)(F)CC(=O)O MCULE-6139996682 [0,2,0,0,0,0|2,0,0]=4 3635 B8R0.34 CCS(=O)(=O)CC(=O)C MCULE-7362448391 [0,2,0,0,0,0|2,0,0]=4 3636 B8R0.34 COC(C)(C)CC(=O)C MCULE-7283878436 [0,2,0,0,0,0|2,0,0]=4 3637 B8R0.34 CSC(C)(C)CC(=O)C MCULE-8630996828 [0,2,0,0,0,0|2,0,0]=4 3638 B8R0.1 C/C=C/C(=O)CCCC MCULE-6753420308 [0,2,0,0,0,0|1,0,0]=3 3639 B8R0.1 C=CCC(=O)CCCC MCULE-4100882049 [0,2,0,0,0,0|1,0,0]=3 3640 B8R0.1 C=CCOC(=O)/C=C/C MCULE-8988055269 [0,2,0,0,0,0|0,0,2]=4 3641 B8R0.1 C=CCOC(=O)CC#N MCULE-6302930659 [0,2,0,0,0,0|0,0,2]=4 3642 B8R0.1 C=CCOC(=O)CCC MCULE-7209016839 [0,2,0,0,0,0|0,0,2]=4 3643 B8R0.1 C=CCOC(=O)OCC MCULE-4897941593 [0,2,0,0,0,0|0,0,2]=4 3644 B8R0.1 CC/C=C/C(=O)OCC MCULE-6281513551 [0,2,0,0,0,0|1,0,1]=4 3645 B8R0.1 CC=CC(=O)CCCC MCULE-2281679965 [0,2,0,0,0,0|1,0,0]=3 3646 B8R0.1 CCC#CC(=O)OCC MCULE-2785923283 [0,2,0,0,0,0|1,0,1]=4 3647 B8R0.1 CCC=CC(=O)OCC MCULE-2840510617 [0,2,0,0,0,0|1,0,1]=4 3648 B8R0.1 CCCC(=O)NCCN MCULE-1372911866 [0,2,0,0,0,0|2,0,0]=4 3649 B8R0.1 CCCC(=O)OCCCl MCULE-8469083528 [0,2,0,0,0,0|1,0,0]=3 3650 B8R0.1 CCCC(=O)OCCO MCULE-5942976945 [0,2,0,0,0,0|1,0,0]=3 3651 B8R0.1 CCCCC(=N)OCC MCULE-3866961773 [0,2,0,0,0,0|2,0,0]=4 3652 B8R0.1 CCCCC(=N)OCC MCULE-6116145724 [0,2,0,0,0,0|2,0,0]=4 3653 B8R0.1 CCCCC(=O)CCC MCULE-5459540473 [0,2,0,0,0,0|1,0,0]=3 3654 B8R0.1 CCCCC(=O)COC MCULE-7059597173 [0,2,0,0,0,0|1,0,0]=3 3655 B8R0.1 CCCCC(=O)OCC MCULE-1219537918 [0,2,0,0,0,0|1,0,0]=3 3656 B8R0.1 CCCCC(=O)OCCl MCULE-1974449433 [0,2,0,0,0,0|1,0,0]=3 3657 B8R0.1 CCCCS(=O)CCO MCULE-9422446521 [0,2,0,0,0,0|2,0,0]=4 3658 B8R0.1 CCCNC(=O)CC#N MCULE-5659894723 [0,2,0,0,0,0|1,0,0]=3 3659 B8R0.1 CCCNC(=O)CCC MCULE-2578933218 [0,2,0,0,0,0|1,0,0]=3 3660 B8R0.1 CCCNC(=O)CCN MCULE-9343291828 [0,2,0,0,0,0|1,0,0]=3 3661 B8R0.1 CCCNC(=O)CCN MCULE-9397624395 [0,2,0,0,0,0|1,0,0]=3 3662 B8R0.1 CCCNC(=O)CNC MCULE-3183907339 [0,2,0,0,0,0|1,0,0]=3 3663 B8R0.1 CCCNC(=O)CNC MCULE-9204845590 [0,2,0,0,0,0|1,0,0]=3 3664 B8R0.1 CCCNC(=O)NCC MCULE-5842395608 [0,2,0,0,0,0|1,0,0]=3 3665 B8R0.1 CCCOC(=O)CC#N MCULE-6051640060 [0,2,0,0,0,0|0,0,0]=2 3666 B8R0.1 CCCOC(=O)CCC MCULE-7673125406 [0,2,0,0,0,0|0,0,0]=2 3667 B8R0.1 CCCOC(=O)CCN MCULE-1345071747 [0,2,0,0,0,0|0,0,0]=2 3668 B8R0.1 CCCOC(=O)CCN MCULE-3861690448 [0,2,0,0,0,0|0,0,0]=2 3669 B8R0.1 CCCOC(=O)CCO MCULE-7390309329 [0,2,0,0,0,0|0,0,0]=2 3670 B8R0.1 CCCOC(=O)OCCl MCULE-7435813375 [0,2,0,0,0,0|0,0,0]=2 3671 B8R0.1 CCNC(=O)NCCN MCULE-2782056393 [0,2,0,0,0,0|2,0,0]=4 3672 B8R0.1 CCNC(=O)NCCN MCULE-3018091453 [0,2,0,0,0,0|2,0,0]=4 3673 B8R0.1 CCNC(=O)NCCO MCULE-1039035778 [0,2,0,0,0,0|2,0,0]=4 3674 B8R0.1 CCNCC(=O)NCC MCULE-2852589977 [0,2,0,0,0,0|2,0,0]=4 3675 B8R0.1 CCNCC(=O)OCC MCULE-7972358572 [0,2,0,0,0,0|2,0,0]=4 3676 B8R0.1 CCNCC(=O)OCC MCULE-8893227629 [0,2,0,0,0,0|2,0,0]=4 3677 B8R0.1 CCOC(=O)CCCBr MCULE-5001503693 [0,2,0,0,0,0|2,0,0]=4 3678 B8R0.1 CCOC(=O)CCCCl MCULE-4945067440 [0,2,0,0,0,0|2,0,0]=4 3679 B8R0.1 CCOC(=O)CCCI MCULE-3229549270 [0,2,0,0,0,0|2,0,0]=4 3680 B8R0.1 CCOC(=O)CCCN MCULE-3396270547 [0,2,0,0,0,0|2,0,0]=4 3681 B8R0.1 CCOC(=O)CCCO MCULE-6165580365 [0,2,0,0,0,0|2,0,0]=4 3682 B8R0.1 CCOC(=O)CCCS MCULE-6616511520 [0,2,0,0,0,0|2,0,0]=4 3683 B8R0.1 CCOC(=O)CCC[NH3+] MCULE-4462126494 [0,2,0,0,0,0|2,0,0]=4 3684 B8R0.1 CCOC(=O)CCNC MCULE-2052970996 [0,2,0,0,0,0|2,0,0]=4 3685 B8R0.1 CCOC(=O)CCNC MCULE-5442289273 [0,2,0,0,0,0|2,0,0]=4 3686 B8R0.1 CCOC(=O)CCOC MCULE-5983048130 [0,2,0,0,0,0|2,0,0]=4 3687 B8R0.1 CCOC(=O)CCSC MCULE-6834820952 [0,2,0,0,0,0|2,0,0]=4 3688 B8R0.1 CCOC(=O)CSCC MCULE-5930366300 [0,2,0,0,0,0|2,0,0]=4 3689 B8R0.1 CCOC(=O)NCCBr MCULE-4386850032 [0,2,0,0,0,0|2,0,0]=4 3690 B8R0.1 CCOC(=O)NCCCl MCULE-5545666176 [0,2,0,0,0,0|2,0,0]=4 3691 B8R0.1 CCOC(=O)NCCN MCULE-1497223307 [0,2,0,0,0,0|2,0,0]=4 3692 B8R0.1 CCOC(=O)NCCN MCULE-3733943315 [0,2,0,0,0,0|2,0,0]=4 3693 B8R0.1 CCOC(=O)NCCO MCULE-7625780069 [0,2,0,0,0,0|2,0,0]=4 3694 B8R0.1 CCOC(=O)OCCBr MCULE-4627499799 [0,2,0,0,0,0|1,0,0]=3 3695 B8R0.1 CCOCC(=O)OCC MCULE-5439289896 [0,2,0,0,0,0|2,0,0]=4 3696 B8R0.1 CNCC(=O)NCCO MCULE-3176678829 [0,2,0,0,0,0|2,0,0]=4 3697 B8R0.1 CNCC(=O)NCCO MCULE-6959810810 [0,2,0,0,0,0|2,0,0]=4 3698 B8R0.1 COCC(=O)NCCN MCULE-2273634996 [0,2,0,0,0,0|2,0,0]=4 3699 B8R0.1 COCC(=O)NCCO MCULE-3232862916 [0,2,0,0,0,0|2,0,0]=4 3700 B8R0.1 COCCC(=O)CC#N MCULE-3904176449 [0,2,0,0,0,0|2,0,0]=4 3701 B8R0.1 COCCC(=O)COC MCULE-3111860636 [0,2,0,0,0,0|2,0,0]=4 3702 B8R0.1 N#CCC(=O)NCCO MCULE-9086923364 [0,2,0,0,0,0|2,0,0]=4 3703 B8R0.1 NCCC(=O)NCCO MCULE-6631262210 [0,2,0,0,0,0|2,0,0]=4 3704 B8R0.1 NCCC(=O)NCCO MCULE-7004874938 [0,2,0,0,0,0|2,0,0]=4 3705 B8R0.1 NCCC(=O)NCCS MCULE-3035249090 [0,2,0,0,0,0|2,0,0]=4 3706 B8R0.1 O=C(CCS)OCCO MCULE-8554625892 [0,2,0,0,0,0|1,0,0]=3 3707 B8R0.1 O=C(NCO)NCCO MCULE-2347245416 [0,2,0,0,0,0|2,0,0]=4 3708 B8R0.1 P(=O)(C=C=C)OCCC MCULE-7200080667 [0,2,0,0,0,0|1,0,1]=4 3709 B8R0.3 C=C(COC)C(=O)OC MCULE-7593559443 [0,2,0,0,0,0|2,0,0]=4 3710 B8R0.3 CCC=C(C)C(=O)OC MCULE-1695208139 [0,2,0,0,0,0|1,0,1]=4 3711 B8R0.3 CCCC(=O)C(=O)OC MCULE-5789275467 [0,2,0,0,0,0|1,0,0]=3 3712 B8R0.3 CCCC(Br)C(=O)OC MCULE-2779995445 [0,2,0,0,0,0|1,0,0]=3 3713 B8R0.3 CCCC(C)C(=O)CC MCULE-9990200653 [0,2,0,0,0,0|1,0,0]=3 3714 B8R0.3 CCCC(C)C(=O)OC MCULE-6953134216 [0,2,0,0,0,0|1,0,0]=3 3715 B8R0.3 CCCC(N)C(=O)NC MCULE-3980097421 [0,2,0,0,0,0|1,0,0]=3 3716 B8R0.3 CCCC(N)C(=O)NO MCULE-2069838283 [0,2,0,0,0,0|2,0,0]=4 3717 B8R0.3 CCCC(N)C(=O)OC MCULE-1453218994 [0,2,0,0,0,0|1,0,0]=3 3718 B8R0.3 CCCC(N)C(=O)OC MCULE-4171872835 [0,2,0,0,0,0|1,0,0]=3 3719 B8R0.3 CCCC(N)C(=O)OC MCULE-4324009425 [0,2,0,0,0,0|1,0,0]=3 3720 B8R0.3 CCCC(N)C(=O)OC MCULE-9533158990 [0,2,0,0,0,0|1,0,0]=3 3721 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-1310673609 [0,2,0,0,0,0|1,0,0]=3 3722 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5850698619 [0,2,0,0,0,0|1,0,0]=3 3723 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5854286766 [0,2,0,0,0,0|1,0,0]=3 3724 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-9793822862 [0,2,0,0,0,0|1,0,0]=3 3725 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-2009036281 [0,2,0,0,0,0|1,0,0]=3 3726 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5609199650 [0,2,0,0,0,0|1,0,0]=3 3727 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5628439347 [0,2,0,0,0,0|1,0,0]=3 3728 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-8724830592 [0,2,0,0,0,0|1,0,0]=3 3729 B8R0.3 CCNC(=O)C(=O)NC MCULE-1033646355 [0,2,0,0,0,0|2,0,0]=4 3730 B8R0.3 CCNC(C)C(=O)OC MCULE-3289750233 [0,2,0,0,0,0|2,0,0]=4 3731 B8R0.3 CCNC(C)C(=O)OC MCULE-6862987622 [0,2,0,0,0,0|2,0,0]=4 3732 B8R0.3 CCN[C@@H](C)C(=O)OC MCULE-5663920756 [0,2,0,0,0,0|2,0,0]=4 3733 B8R0.3 CCOC(=O)C(=O)CBr MCULE-1292003261 [0,2,0,0,0,0|2,0,0]=4 3734 B8R0.3 CCOC(=O)C(=O)CC MCULE-6268795804 [0,2,0,0,0,0|2,0,0]=4 3735 B8R0.3 CCOC(=O)C(=O)NC MCULE-7000353340 [0,2,0,0,0,0|2,0,0]=4 3736 B8R0.3 CCON(C)C(=O)CN MCULE-5915406823 [0,2,0,0,0,0|2,0,0]=4 3737 B8R0.3 CCON(C)C(=O)CN MCULE-6850903466 [0,2,0,0,0,0|2,0,0]=4 3738 B8R0.3 CN(CCO)C(=O)CN MCULE-1038481465 [0,2,0,0,0,0|2,0,0]=4 3739 B8R0.3 CN(CCO)C(=O)CN MCULE-9274946911 [0,2,0,0,0,0|2,0,0]=4 3740 B8R0.3 CNCC(Br)C(=O)OC MCULE-2818400613 [0,2,0,0,0,0|2,0,0]=4 3741 B8R0.3 CNCC(Br)C(=O)OC MCULE-5823314810 [0,2,0,0,0,0|2,0,0]=4 3742 B8R0.3 CNCC(C)C(=O)NC MCULE-2413275831 [0,2,0,0,0,0|2,0,0]=4 3743 B8R0.3 CNCC(C)C(=O)OC MCULE-5525958870 [0,2,0,0,0,0|2,0,0]=4 3744 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-6377659413 [0,2,0,0,0,0|2,0,0]=4 3745 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-9611469994 [0,2,0,0,0,0|2,0,0]=4 3746 B8R0.3 COC(=O)C(Br)CCBr MCULE-4290973865 [0,2,0,0,0,0|2,0,0]=4 3747 B8R0.3 COC(=O)C(C)CCBr MCULE-7970722391 [0,2,0,0,0,0|2,0,0]=4 3748 B8R0.3 COC(=O)C(C)CCCl MCULE-3423199485 [0,2,0,0,0,0|2,0,0]=4 3749 B8R0.3 COC(=O)C(C)CCN MCULE-4788413403 [0,2,0,0,0,0|2,0,0]=4 3750 B8R0.3 COC(=O)C(C)CCN MCULE-6075427964 [0,2,0,0,0,0|2,0,0]=4 3751 B8R0.3 COC(=O)C(N)CCBr MCULE-5668145888 [0,2,0,0,0,0|2,0,0]=4 3752 B8R0.3 COC(=O)C(N)CCBr MCULE-5831054247 [0,2,0,0,0,0|2,0,0]=4 3753 B8R0.3 COC(=O)C(N)CCF MCULE-3356013030 [0,2,0,0,0,0|2,0,0]=4 3754 B8R0.3 COC(=O)C(N)CCF MCULE-6443244944 [0,2,0,0,0,0|2,0,0]=4 3755 B8R0.3 COC(=O)C(N)CCS MCULE-8178229832 [0,2,0,0,0,0|2,0,0]=4 3756 B8R0.3 COC(=O)C(N)CSC MCULE-6702025743 [0,2,0,0,0,0|2,0,0]=4 3757 B8R0.3 COC(=O)C(N)CSC MCULE-7180641175 [0,2,0,0,0,0|2,0,0]=4 3758 B8R0.3 COC(=O)C(O)CCN MCULE-7139144229 [0,2,0,0,0,0|2,0,0]=4 3759 B8R0.3 COC(=O)N(C)CCN MCULE-5241430588 [0,2,0,0,0,0|2,0,0]=4 3760 B8R0.3 COC(=O)N(C)CCN MCULE-6970201742 [0,2,0,0,0,0|2,0,0]=4 3761 B8R0.3 COC(=O)N(C)CCO MCULE-3282195016 [0,2,0,0,0,0|2,0,0]=4 3762 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-1252477377 [0,2,0,0,0,0|2,0,0]=4 3763 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-6780159971 [0,2,0,0,0,0|2,0,0]=4 3764 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-8129635461 [0,2,0,0,0,0|2,0,0]=4 3765 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-9824385803 [0,2,0,0,0,0|2,0,0]=4 3766 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-5345736899 [0,2,0,0,0,0|2,0,0]=4 3767 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-8434362314 [0,2,0,0,0,0|2,0,0]=4 3768 B8R0.3 COC(=O)[C@@H](N)CCS MCULE-1895611205 [0,2,0,0,0,0|2,0,0]=4 3769 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-2532401863 [0,2,0,0,0,0|2,0,0]=4 3770 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-3321267517 [0,2,0,0,0,0|2,0,0]=4 3771 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-5693942065 [0,2,0,0,0,0|2,0,0]=4 3772 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-7597642447 [0,2,0,0,0,0|2,0,0]=4 3773 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-1204029497 [0,2,0,0,0,0|2,0,0]=4 3774 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-2464186416 [0,2,0,0,0,0|2,0,0]=4 3775 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-4887582087 [0,2,0,0,0,0|2,0,0]=4 3776 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-8785450046 [0,2,0,0,0,0|2,0,0]=4 3777 B8R0.3 COC(=O)[C@H](N)CCN MCULE-1821826306 [0,2,0,0,0,0|2,0,0]=4 3778 B8R0.3 COC(=O)[C@H](N)CCN MCULE-8161776969 [0,2,0,0,0,0|2,0,0]=4 3779 B8R0.3 COC(=O)[C@H](N)CCO MCULE-1194830786 [0,2,0,0,0,0|2,0,0]=4 3780 B8R0.3 COC(=O)[C@H](N)CCO MCULE-2532522705 [0,2,0,0,0,0|2,0,0]=4 3781 B8R0.3 COC(=O)[C@H](N)CCS MCULE-8558179208 [0,2,0,0,0,0|2,0,0]=4 3782 B8R0.3 COCC(Br)C(=O)OC MCULE-5792855565 [0,2,0,0,0,0|2,0,0]=4 3783 B8R0.3 COCC(C)C(=O)OC MCULE-4110856609 [0,2,0,0,0,0|2,0,0]=4 3784 B8R0.3 COCC(N)C(=O)OC MCULE-1717271658 [0,2,0,0,0,0|2,0,0]=4 3785 B8R0.3 COCC(N)C(=O)OC MCULE-4567479747 [0,2,0,0,0,0|2,0,0]=4 3786 B8R0.3 COCC(N)C(=O)OC MCULE-4859095599 [0,2,0,0,0,0|2,0,0]=4 3787 B8R0.3 COCC(N)C(=O)OC MCULE-8125210840 [0,2,0,0,0,0|2,0,0]=4 3788 B8R0.3 COCC(O)C(=O)OC MCULE-6071304250 [0,2,0,0,0,0|2,0,0]=4 3789 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-2867072950 [0,2,0,0,0,0|2,0,0]=4 3790 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-5445193744 [0,2,0,0,0,0|2,0,0]=4 3791 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8505505456 [0,2,0,0,0,0|2,0,0]=4 3792 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8525451378 [0,2,0,0,0,0|2,0,0]=4 3793 B8R0.6 C#CC(=O)NCCOC MCULE-6198532487 [0,2,0,0,0,0|1,0,1]=4 3794 B8R0.6 C#CCCCC(=O)OC MCULE-1834140672 [0,2,0,0,0,0|1,0,1]=4 3795 B8R0.6 C#CCCNC(=O)OC MCULE-4643907894 [0,2,0,0,0,0|1,0,1]=4 3796 B8R0.6 C#CCOCC(=O)OC MCULE-8743984162 [0,2,0,0,0,0|0,0,2]=4 3797 B8R0.6 C=CC(=O)CCCCC MCULE-9094274880 [0,2,0,0,0,0|1,0,1]=4 3798 B8R0.6 C=CC(=O)NCCCC MCULE-9365109925 [0,2,0,0,0,0|1,0,1]=4 3799 B8R0.6 C=CC(=O)NCCOC MCULE-1939884493 [0,2,0,0,0,0|1,0,1]=4 3800 B8R0.6 C=CC(=O)OCCC#N MCULE-1691059992 [0,2,0,0,0,0|0,0,2]=4 3801 B8R0.6 C=CC(=O)OCCCC MCULE-6944090543 [0,2,0,0,0,0|0,0,1]=3 3802 B8R0.6 C=CC(=O)OCCCO MCULE-7957370216 [0,2,0,0,0,0|0,0,1]=3 3803 B8R0.6 C=CC(=O)OCCOC MCULE-6865078247 [0,2,0,0,0,0|0,0,1]=3 3804 B8R0.6 C=CCCCC(=O)OC MCULE-4913183131 [0,2,0,0,0,0|1,0,1]=4 3805 B8R0.6 C=CCCOC(=O)CN MCULE-8632791952 [0,2,0,0,0,0|0,0,1]=3 3806 B8R0.6 C=CCOCC(=O)OC MCULE-7670885186 [0,2,0,0,0,0|0,0,2]=4 3807 B8R0.6 CCC/C=C/C(=O)OC MCULE-6273561448 [0,2,0,0,0,0|1,0,0]=3 3808 B8R0.6 CCC=CCC(=O)OC MCULE-6432541061 [0,2,0,0,0,0|1,0,1]=4 3809 B8R0.6 CCCC#CC(=O)OC MCULE-1573744334 [0,2,0,0,0,0|1,0,0]=3 3810 B8R0.6 CCCC=CC(=O)OC MCULE-1227063444 [0,2,0,0,0,0|1,0,0]=3 3811 B8R0.6 CCCCCC(=O)CBr MCULE-6642335283 [0,2,0,0,0,0|1,0,0]=3 3812 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [0,2,0,0,0,0|1,0,0]=3 3813 B8R0.6 CCCCCC(=O)NN MCULE-3138841743 [0,2,0,0,0,0|2,0,0]=4 3814 B8R0.6 CCCCCC(=O)NO MCULE-8432990947 [0,2,0,0,0,0|2,0,0]=4 3815 B8R0.6 CCCCCC(=O)OC MCULE-2317616388 [0,2,0,0,0,0|1,0,0]=3 3816 B8R0.6 CCCCCN(C)N=O MCULE-6706578173 [0,2,0,0,0,0|2,0,0]=4 3817 B8R0.6 CCCCNC(=O)CBr MCULE-4128795630 [0,2,0,0,0,0|1,0,0]=3 3818 B8R0.6 CCCCNC(=O)CC MCULE-3176114265 [0,2,0,0,0,0|1,0,0]=3 3819 B8R0.6 CCCCNC(=O)CCl MCULE-6162581938 [0,2,0,0,0,0|1,0,0]=3 3820 B8R0.6 CCCCNC(=O)CN MCULE-2730890796 [0,2,0,0,0,0|1,0,0]=3 3821 B8R0.6 CCCCNC(=O)CN MCULE-8794795131 [0,2,0,0,0,0|1,0,0]=3 3822 B8R0.6 CCCCNC(=O)NC MCULE-7920588549 [0,2,0,0,0,0|1,0,0]=3 3823 B8R0.6 CCCCNC(=O)NN MCULE-2049505984 [0,2,0,0,0,0|2,0,0]=4 3824 B8R0.6 CCCCOC(=O)C=O MCULE-1707513945 [0,2,0,0,0,0|0,0,1]=3 3825 B8R0.6 CCCCOC(=O)CBr MCULE-8883996630 [0,2,0,0,0,0|0,0,0]=2 3826 B8R0.6 CCCCOC(=O)CC MCULE-4622389592 [0,2,0,0,0,0|0,0,0]=2 3827 B8R0.6 CCCCOC(=O)CCl MCULE-1608118057 [0,2,0,0,0,0|0,0,0]=2 3828 B8R0.6 CCCCOC(=O)CF MCULE-1355274212 [0,2,0,0,0,0|0,0,0]=2 3829 B8R0.6 CCCCOC(=O)CN MCULE-9168260466 [0,2,0,0,0,0|0,0,0]=2 3830 B8R0.6 CCCCOC(=O)CN MCULE-9585888268 [0,2,0,0,0,0|0,0,0]=2 3831 B8R0.6 CCCCOC(=O)CO MCULE-4016266350 [0,2,0,0,0,0|0,0,0]=2 3832 B8R0.6 CCCCOC(=O)CS MCULE-4331308025 [0,2,0,0,0,0|0,0,0]=2 3833 B8R0.6 CCCNCC(=O)NC MCULE-4750972571 [0,2,0,0,0,0|1,0,0]=3 3834 B8R0.6 CCCNCC(=O)OC MCULE-3321545319 [0,2,0,0,0,0|1,0,0]=3 3835 B8R0.6 CCCNCC(=O)OC MCULE-5989619684 [0,2,0,0,0,0|1,0,0]=3 3836 B8R0.6 CCCOCC(C)CO MCULE-8326797774 [0,2,0,0,0,0|0,0,2]=4 3837 B8R0.6 CCCOCC(O)CO MCULE-8815613620 [0,2,0,0,0,0|0,0,2]=4 3838 B8R0.6 CCCOC[C@H](O)CO MCULE-7750792134 [0,2,0,0,0,0|0,0,2]=4 3839 B8R0.6 CCCSCC(=O)OC MCULE-3865642484 [0,2,0,0,0,0|0,1,0]=3 3840 B8R0.6 CCNCCC(=O)NC MCULE-8230774906 [0,2,0,0,0,0|1,0,0]=3 3841 B8R0.6 CCNCCC(=O)NC MCULE-9131674592 [0,2,0,0,0,0|1,0,0]=3 3842 B8R0.6 CCNCCC(=O)NN MCULE-8224878393 [0,2,0,0,0,0|2,0,0]=4 3843 B8R0.6 CCNCCC(=O)OC MCULE-4846173976 [0,2,0,0,0,0|1,0,0]=3 3844 B8R0.6 CCOCCC(=N)OC MCULE-1143058685 [0,2,0,0,0,0|2,0,0]=4 3845 B8R0.6 CCOCCC(=N)OC MCULE-1528455249 [0,2,0,0,0,0|2,0,0]=4 3846 B8R0.6 CCOCCC(=O)NN MCULE-2571001026 [0,2,0,0,0,0|2,0,0]=4 3847 B8R0.6 CCSCCC(=O)OC MCULE-5773388371 [0,2,0,0,0,0|1,0,0]=3 3848 B8R0.6 CNC(=O)CCCON MCULE-8352787831 [0,2,0,0,0,0|2,0,0]=4 3849 B8R0.6 CNC(=O)NCCCO MCULE-3093590717 [0,2,0,0,0,0|1,0,0]=3 3850 B8R0.6 CNCCCC(=O)NN MCULE-9999287103 [0,2,0,0,0,0|2,0,0]=4 3851 B8R0.6 CNCCCC(=O)OC MCULE-2437073705 [0,2,0,0,0,0|1,0,0]=3 3852 B8R0.6 CNCCCC(=O)OC MCULE-6776715081 [0,2,0,0,0,0|1,0,0]=3 3853 B8R0.6 CNCCNC(=O)NC MCULE-2973659795 [0,2,0,0,0,0|1,0,0]=3 3854 B8R0.6 COC(=O)CCCC#N MCULE-9088492518 [0,2,0,0,0,0|1,0,1]=4 3855 B8R0.6 COC(=O)CCCC=O MCULE-2183669341 [0,2,0,0,0,0|1,0,1]=4 3856 B8R0.6 COC(=O)CCCCBr MCULE-8354790214 [0,2,0,0,0,0|1,0,0]=3 3857 B8R0.6 COC(=O)CCCCCl MCULE-7057883989 [0,2,0,0,0,0|1,0,0]=3 3858 B8R0.6 COC(=O)CCCCI MCULE-1527923255 [0,2,0,0,0,0|1,0,0]=3 3859 B8R0.6 COC(=O)CCCCN MCULE-3452725442 [0,2,0,0,0,0|1,0,0]=3 3860 B8R0.6 COC(=O)CCCCN MCULE-8816545129 [0,2,0,0,0,0|1,0,0]=3 3861 B8R0.6 COC(=O)CCCCO MCULE-2443996181 [0,2,0,0,0,0|1,0,0]=3 3862 B8R0.6 COC(=O)CCCCS MCULE-5194099368 [0,2,0,0,0,0|1,0,0]=3 3863 B8R0.6 COC(=O)CCCON MCULE-1522874324 [0,2,0,0,0,0|2,0,0]=4 3864 B8R0.6 COC(=O)CCCON MCULE-4748610058 [0,2,0,0,0,0|2,0,0]=4 3865 B8R0.6 COC(=O)CCCSC MCULE-7320944174 [0,2,0,0,0,0|1,0,0]=3 3866 B8R0.6 COC(=O)COCCCl MCULE-4344602258 [0,2,0,0,0,0|1,0,0]=3 3867 B8R0.6 COC(=O)COCCN MCULE-5090944064 [0,2,0,0,0,0|1,0,0]=3 3868 B8R0.6 COC(=O)COCCN MCULE-6748820855 [0,2,0,0,0,0|1,0,0]=3 3869 B8R0.6 COC(=O)COCCO MCULE-7869619911 [0,2,0,0,0,0|1,0,0]=3 3870 B8R0.6 COC(=O)CSCCN MCULE-5578128958 [0,2,0,0,0,0|1,1,0]=4 3871 B8R0.6 COC(=O)CSCCN MCULE-6891143571 [0,2,0,0,0,0|1,1,0]=4 3872 B8R0.6 COC(=O)NCCC#N MCULE-9903533731 [0,2,0,0,0,0|1,0,1]=4 3873 B8R0.6 COC(=O)SSCCN MCULE-2854223096 [0,2,0,0,0,0|1,1,0]=4 3874 B8R0.6 COC/C=C/C(=O)OC MCULE-5611593935 [0,2,0,0,0,0|1,0,1]=4 3875 B8R0.6 COCC=CC(=O)OC MCULE-1098723055 [0,2,0,0,0,0|1,0,1]=4 3876 B8R0.6 COCCCC(=O)OC MCULE-4109110804 [0,2,0,0,0,0|1,0,0]=3 3877 B8R0.6 COCCNC(=O)CBr MCULE-3132647741 [0,2,0,0,0,0|1,0,0]=3 3878 B8R0.6 COCCNC(=O)CCl MCULE-3082598915 [0,2,0,0,0,0|1,0,0]=3 3879 B8R0.6 COCCNC(=O)CN MCULE-6007531067 [0,2,0,0,0,0|1,0,0]=3 3880 B8R0.6 COCCNC(=O)CN MCULE-6629249444 [0,2,0,0,0,0|1,0,0]=3 3881 B8R0.6 COCCNC(=O)NN MCULE-8505538693 [0,2,0,0,0,0|2,0,0]=4 3882 B8R0.6 COCCOC(=O)CBr MCULE-3194439093 [0,2,0,0,0,0|0,0,0]=2 3883 B8R0.6 COCCOC(=O)CCl MCULE-1894420315 [0,2,0,0,0,0|0,0,0]=2 3884 B8R0.6 COCCOC(=O)CS MCULE-9869840399 [0,2,0,0,0,0|0,0,0]=2 3885 B8R0.6 CONCCC(=O)OC MCULE-8622619087 [0,2,0,0,0,0|2,0,0]=4 3886 B8R0.6 N#CCCNC(=O)CCl MCULE-7007330126 [0,2,0,0,0,0|1,0,1]=4 3887 B8R0.6 NCC(=O)NCCCO MCULE-3346996357 [0,2,0,0,0,0|1,0,0]=3 3888 B8R0.6 NCC(=O)NCCCO MCULE-5088922472 [0,2,0,0,0,0|1,0,0]=3 3889 B8R0.6 NNC(=O)COCCO MCULE-8424164288 [0,2,0,0,0,0|2,0,0]=4 3890 B8R0.6 O=C(CCl)NCCCO MCULE-7154051707 [0,2,0,0,0,0|1,0,0]=3 3891 B8R0.8 C#CCOC(=O)C(=C)C MCULE-3718147564 [0,2,0,0,0,0|0,0,2]=4 3892 B8R0.8 C(N)(CCCC)C(=O)N MCULE-1406613793 [0,2,0,0,0,0|2,0,0]=4 3893 B8R0.8 C(N)(CCCC)C(=O)N MCULE-4692008742 [0,2,0,0,0,0|2,0,0]=4 3894 B8R0.8 C=C(C)C(=O)NCCN MCULE-4919659895 [0,2,0,0,0,0|2,0,0]=4 3895 B8R0.8 C=C(C)C(=O)NCCN MCULE-8762138825 [0,2,0,0,0,0|2,0,0]=4 3896 B8R0.8 C=C(C)C(=O)NCCO MCULE-3517470957 [0,2,0,0,0,0|2,0,0]=4 3897 B8R0.8 C=C(C)C(=O)NCOC MCULE-1355341818 [0,2,0,0,0,0|2,0,0]=4 3898 B8R0.8 C=C(C)C(=O)OCCBr MCULE-2338171938 [0,2,0,0,0,0|1,0,0]=3 3899 B8R0.8 C=C(C)C(=O)OCCC MCULE-3202968176 [0,2,0,0,0,0|0,0,0]=2 3900 B8R0.8 C=C(C)C(=O)OCCCl MCULE-1588137861 [0,2,0,0,0,0|1,0,0]=3 3901 B8R0.8 C=C(C)C(=O)OCCF MCULE-6402794071 [0,2,0,0,0,0|1,0,0]=3 3902 B8R0.8 C=C(C)C(=O)OCCN MCULE-1298883252 [0,2,0,0,0,0|1,0,0]=3 3903 B8R0.8 C=C(C)C(=O)OCCN MCULE-8628486692 [0,2,0,0,0,0|1,0,0]=3 3904 B8R0.8 C=C(C)C(=O)OCCO MCULE-7874353357 [0,2,0,0,0,0|1,0,0]=3 3905 B8R0.8 C=CCOC(=O)C(=C)C MCULE-8654465635 [0,2,0,0,0,0|0,0,2]=4 3906 B8R0.8 C=CCOC(=O)C(C)C MCULE-7473828450 [0,2,0,0,0,0|0,0,2]=4 3907 B8R0.8 C=CCOC(=O)C(C)N MCULE-3891765808 [0,2,0,0,0,0|0,0,2]=4 3908 B8R0.8 C=CCOC(=O)C(C)N MCULE-6751373941 [0,2,0,0,0,0|0,0,2]=4 3909 B8R0.8 C=CCOC(=O)C(C)N MCULE-9186591126 [0,2,0,0,0,0|0,0,2]=4 3910 B8R0.8 C=CCOC(=O)[C@H](C)N MCULE-5935483168 [0,2,0,0,0,0|0,0,2]=4 3911 B8R0.8 C=CCOC(=O)[C@H](C)N MCULE-6863590099 [0,2,0,0,0,0|0,0,2]=4 3912 B8R0.8 C=CCOC(=O)[C@H](C)N MCULE-7917821783 [0,2,0,0,0,0|0,0,2]=4 3913 B8R0.8 C=CCOC(=O)[C@H](C)N MCULE-9585751363 [0,2,0,0,0,0|0,0,2]=4 3914 B8R0.8 CC(=O)C(C)CCC#N MCULE-1571826766 [0,2,0,0,0,0|1,0,1]=4 3915 B8R0.8 CC(=O)N(C)CCC#N MCULE-9291041883 [0,2,0,0,0,0|1,0,1]=4 3916 B8R0.8 CC(C)C(=O)CCCCl MCULE-7442882082 [0,2,0,0,0,0|2,0,0]=4 3917 B8R0.8 CC(C)C(=O)NCCN MCULE-8671421121 [0,2,0,0,0,0|2,0,0]=4 3918 B8R0.8 CC(C)C(=O)NCCN MCULE-9934200854 [0,2,0,0,0,0|2,0,0]=4 3919 B8R0.8 CC(C)C(=O)NCCO MCULE-8748737436 [0,2,0,0,0,0|2,0,0]=4 3920 B8R0.8 CC(C)C(=O)OCCO MCULE-1495755417 [0,2,0,0,0,0|1,0,0]=3 3921 B8R0.8 CC(CCCCl)C(=O)O MCULE-6504631587 [0,2,0,0,0,0|2,0,0]=4 3922 B8R0.8 CC(Cl)C(=O)NCCO MCULE-5321948590 [0,2,0,0,0,0|2,0,0]=4 3923 B8R0.8 CC(N)C(=O)NCCF MCULE-2386057618 [0,2,0,0,0,0|2,0,0]=4 3924 B8R0.8 CC(N)C(=O)NCCF MCULE-6631244596 [0,2,0,0,0,0|2,0,0]=4 3925 B8R0.8 CC(N)C(=O)NCCO MCULE-8762343384 [0,2,0,0,0,0|2,0,0]=4 3926 B8R0.8 CC(N)C(=O)NCCO MCULE-9848656207 [0,2,0,0,0,0|2,0,0]=4 3927 B8R0.8 CC(O)C(=O)NCCO MCULE-2938685957 [0,2,0,0,0,0|2,0,0]=4 3928 B8R0.8 CC(O)C(=O)OCCO MCULE-9321822945 [0,2,0,0,0,0|1,0,0]=3 3929 B8R0.8 CC(OCCN)C(=O)O MCULE-4117277894 [0,2,0,0,0,0|1,0,1]=4 3930 B8R0.8 CC(OCCN)C(=O)O MCULE-6407651037 [0,2,0,0,0,0|1,0,1]=4 3931 B8R0.8 CC(OCCO)C(=O)O MCULE-4305620136 [0,2,0,0,0,0|1,0,1]=4 3932 B8R0.8 CCC/C=C(\C)/C(=O)O MCULE-4080682767 [0,2,0,0,0,0|1,0,0]=3 3933 B8R0.8 CCCC=C(C)C(=O)O MCULE-1072900673 [0,2,0,0,0,0|1,0,0]=3 3934 B8R0.8 CCCCC(=O)C(=O)C MCULE-5957201570 [0,2,0,0,0,0|1,0,0]=3 3935 B8R0.8 CCCCC(=O)C(=O)O MCULE-7796922508 [0,2,0,0,0,0|1,0,1]=4 3936 B8R0.8 CCCCC(=O)C(=O)[O-] MCULE-4575533706 [0,2,0,0,0,0|1,0,1]=4 3937 B8R0.8 CCCCC(=O)C(C)C MCULE-1905176805 [0,2,0,0,0,0|1,0,0]=3 3938 B8R0.8 CCCCC(=O)C(C)N MCULE-1316684028 [0,2,0,0,0,0|1,0,0]=3 3939 B8R0.8 CCCCC(=O)C(C)N MCULE-1846818051 [0,2,0,0,0,0|1,0,0]=3 3940 B8R0.8 CCCCC(=O)C(C)N MCULE-6223994385 [0,2,0,0,0,0|1,0,0]=3 3941 B8R0.8 CCCCC(=O)C(C)N MCULE-8594054065 [0,2,0,0,0,0|1,0,0]=3 3942 B8R0.8 CCCCC(=O)N(C)C MCULE-1521248911 [0,2,0,0,0,0|1,0,0]=3 3943 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-4202397833 [0,2,0,0,0,0|1,0,0]=3 3944 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-8156418445 [0,2,0,0,0,0|1,0,0]=3 3945 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-8186118680 [0,2,0,0,0,0|1,0,0]=3 3946 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-9214507863 [0,2,0,0,0,0|1,0,0]=3 3947 B8R0.8 CCCCC(Br)C(=O)N MCULE-9831415558 [0,2,0,0,0,0|2,0,0]=4 3948 B8R0.8 CCCCC(Br)C(=O)O MCULE-5428502537 [0,2,0,0,0,0|2,0,0]=4 3949 B8R0.8 CCCCC(C)C(=O)C MCULE-2303839464 [0,2,0,0,0,0|1,0,0]=3 3950 B8R0.8 CCCCC(C)C(=O)Cl MCULE-1718383314 [0,2,0,0,0,0|1,0,1]=4 3951 B8R0.8 CCCCC(C)C(=O)N MCULE-6062124512 [0,2,0,0,0,0|1,0,1]=4 3952 B8R0.8 CCCCC(C)C(=O)O MCULE-7933263354 [0,2,0,0,0,0|1,0,1]=4 3953 B8R0.8 CCCCC(F)C(=O)O MCULE-2276381656 [0,2,0,0,0,0|2,0,0]=4 3954 B8R0.8 CCCCC(N)C(=O)C MCULE-2471947344 [0,2,0,0,0,0|1,0,0]=3 3955 B8R0.8 CCCCC(N)C(=O)C MCULE-4947552776 [0,2,0,0,0,0|1,0,0]=3 3956 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [0,2,0,0,0,0|2,0,0]=4 3957 B8R0.8 CCCCC(O)C(=O)N MCULE-1063256537 [0,2,0,0,0,0|2,0,0]=4 3958 B8R0.8 CCCCC(O)C(=O)O MCULE-2557585903 [0,2,0,0,0,0|2,0,0]=4 3959 B8R0.8 CCCCN(C)C(=O)Cl MCULE-6884962631 [0,2,0,0,0,0|2,0,0]=4 3960 B8R0.8 CCCC[C@@H](C)C(=O)O MCULE-3454696473 [0,2,0,0,0,0|1,0,1]=4 3961 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [0,2,0,0,0,0|2,0,0]=4 3962 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [0,2,0,0,0,0|2,0,0]=4 3963 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9016844851 [0,2,0,0,0,0|1,0,1]=4 3964 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9437190196 [0,2,0,0,0,0|1,0,1]=4 3965 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-1555661156 [0,2,0,0,0,0|2,0,0]=4 3966 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9202467107 [0,2,0,0,0,0|2,0,0]=4 3967 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9573872199 [0,2,0,0,0,0|2,0,0]=4 3968 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9773159994 [0,2,0,0,0,0|2,0,0]=4 3969 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [0,2,0,0,0,0|2,0,0]=4 3970 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [0,2,0,0,0,0|2,0,0]=4 3971 B8R0.8 CCCNC(=O)C(=O)O MCULE-6074987864 [0,2,0,0,0,0|1,0,1]=4 3972 B8R0.8 CCCNC(=O)C(C)Br MCULE-7756965972 [0,2,0,0,0,0|1,0,0]=3 3973 B8R0.8 CCCNC(=O)C(C)Cl MCULE-7279909731 [0,2,0,0,0,0|1,0,0]=3 3974 B8R0.8 CCCNC(=O)C(C)N MCULE-2829232879 [0,2,0,0,0,0|1,0,0]=3 3975 B8R0.8 CCCNC(=O)C(C)N MCULE-5579383254 [0,2,0,0,0,0|1,0,0]=3 3976 B8R0.8 CCCNC(=O)C(Cl)Cl MCULE-8764104239 [0,2,0,0,0,0|1,0,0]=3 3977 B8R0.8 CCCNC(=O)[C@@H](C)N MCULE-4345277738 [0,2,0,0,0,0|1,0,0]=3 3978 B8R0.8 CCCNC(=O)[C@@H](C)N MCULE-8221598088 [0,2,0,0,0,0|1,0,0]=3 3979 B8R0.8 CCCOC(=O)C(C)C MCULE-8112640762 [0,2,0,0,0,0|0,0,0]=2 3980 B8R0.8 CCCOC(=O)C(C)Cl MCULE-6753282934 [0,2,0,0,0,0|0,0,0]=2 3981 B8R0.8 CCCOC(=O)C(C)N MCULE-6692040810 [0,2,0,0,0,0|0,0,0]=2 3982 B8R0.8 CCCOC(=O)C(C)N MCULE-9142364939 [0,2,0,0,0,0|0,0,0]=2 3983 B8R0.8 CCCOC(=O)C(C)O MCULE-8240669472 [0,2,0,0,0,0|0,0,0]=2 3984 B8R0.8 CCCOC(=O)[C@H](C)N MCULE-2973724539 [0,2,0,0,0,0|0,0,0]=2 3985 B8R0.8 CCCOC(=O)[C@H](C)N MCULE-7427167899 [0,2,0,0,0,0|0,0,0]=2 3986 B8R0.8 CCCOC(=O)[C@H](C)O MCULE-4150275631 [0,2,0,0,0,0|0,0,0]=2 3987 B8R0.8 CCCOC(C)C(=O)O MCULE-4477829415 [0,2,0,0,0,0|0,0,1]=3 3988 B8R0.8 CCNCC(=O)N(C)C MCULE-7864141414 [0,2,0,0,0,0|2,0,0]=4 3989 B8R0.8 CCNCC(C)C(=O)O MCULE-3863191122 [0,2,0,0,0,0|2,0,0]=4 3990 B8R0.8 CCNCC(C)C(=O)O MCULE-4164323563 [0,2,0,0,0,0|2,0,0]=4 3991 B8R0.8 CCOCC(C)C(=O)O MCULE-5346959026 [0,2,0,0,0,0|2,0,0]=4 3992 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9199053225 [0,2,0,0,0,0|2,0,0]=4 3993 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9684903914 [0,2,0,0,0,0|2,0,0]=4 3994 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-6351196285 [0,2,0,0,0,0|2,0,0]=4 3995 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-7653589662 [0,2,0,0,0,0|2,0,0]=4 3996 B8R0.8 CCSCC(N)C(=O)O MCULE-9449250733 [0,2,0,0,0,0|2,0,0]=4 3997 B8R0.8 CN(C)C(=O)CCCCl MCULE-1395271076 [0,2,0,0,0,0|2,0,0]=4 3998 B8R0.8 CN(C)C(=O)CCCN MCULE-3574617538 [0,2,0,0,0,0|2,0,0]=4 3999 B8R0.8 CN(C)C(=O)CCCN MCULE-6145958264 [0,2,0,0,0,0|2,0,0]=4 4000 B8R0.8 CN(C)C(=O)CCCO MCULE-2835364374 [0,2,0,0,0,0|2,0,0]=4 4001 B8R0.8 CN(C)C(=O)NCCN MCULE-8853309533 [0,2,0,0,0,0|2,0,0]=4 4002 B8R0.8 CN(C)C(=O)NCCO MCULE-1871590361 [0,2,0,0,0,0|2,0,0]=4 4003 B8R0.8 CN(C)C(=O)OCCBr MCULE-6277675119 [0,2,0,0,0,0|1,0,0]=3 4004 B8R0.8 CN(C)C(=O)OCCN MCULE-5799128416 [0,2,0,0,0,0|1,0,0]=3 4005 B8R0.8 CN(C)C(=O)OCCN MCULE-7701325921 [0,2,0,0,0,0|1,0,0]=3 4006 B8R0.8 CN(C)C(=O)SCCO MCULE-5599478558 [0,2,0,0,0,0|1,1,0]=4 4007 B8R0.8 CNCCC(=O)N(C)C MCULE-6256018690 [0,2,0,0,0,0|2,0,0]=4 4008 B8R0.8 CNCCC(=O)N(C)C MCULE-9074335618 [0,2,0,0,0,0|2,0,0]=4 4009 B8R0.8 CNCCN(C)C(=O)C MCULE-7429681700 [0,2,0,0,0,0|1,0,0]=3 4010 B8R0.8 COCCC(=O)C(C)C MCULE-8480801762 [0,2,0,0,0,0|2,0,0]=4 4011 B8R0.8 COCCC(=O)N(C)C MCULE-3658554853 [0,2,0,0,0,0|2,0,0]=4 4012 B8R0.8 COCCC(C)C(=O)O MCULE-5066180613 [0,2,0,0,0,0|2,0,0]=4 4013 B8R0.8 COCCC(N)C(=O)N MCULE-4212561129 [0,2,0,0,0,0|2,0,0]=4 4014 B8R0.8 COCCC(N)C(=O)N MCULE-5370323024 [0,2,0,0,0,0|2,0,0]=4 4015 B8R0.8 COCCC(N)C(=O)O MCULE-3018605108 [0,2,0,0,0,0|2,0,0]=4 4016 B8R0.8 COCC[C@H](N)C(=O)O MCULE-6748608543 [0,2,0,0,0,0|2,0,0]=4 4017 B8R0.8 COCC[C@H](N)C(=O)O MCULE-8586358852 [0,2,0,0,0,0|2,0,0]=4 4018 B8R0.8 COCNC(=O)N(C)C MCULE-2879447245 [0,2,0,0,0,0|2,0,0]=4 4019 B8R0.8 CSCCC(=O)C(=O)O MCULE-6752350933 [0,2,0,0,0,0|2,0,0]=4 4020 B8R0.8 CSCCC(=O)C(=O)[O-] MCULE-4931776455 [0,2,0,0,0,0|2,0,0]=4 4021 B8R0.8 CSCCC(N)C(=O)N MCULE-8379409756 [0,2,0,0,0,0|2,0,0]=4 4022 B8R0.8 CSCCC(N)C(=O)N MCULE-9130755274 [0,2,0,0,0,0|2,0,0]=4 4023 B8R0.8 CSCCC(N)C(=O)N MCULE-9536539093 [0,2,0,0,0,0|2,0,0]=4 4024 B8R0.8 CSCCC(N)C(=O)N MCULE-9630072876 [0,2,0,0,0,0|2,0,0]=4 4025 B8R0.8 CSCCC(N)C(=O)O MCULE-5626142345 [0,2,0,0,0,0|2,0,0]=4 4026 B8R0.8 CSCCC(O)C(=O)N MCULE-9019971815 [0,2,0,0,0,0|2,0,0]=4 4027 B8R0.8 CSCCC(O)C(=O)O MCULE-3684026487 [0,2,0,0,0,0|2,0,0]=4 4028 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-2209985195 [0,2,0,0,0,0|2,0,0]=4 4029 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-9944164883 [0,2,0,0,0,0|2,0,0]=4 4030 B8R0.8 CSCC[C@@H](N)C(=O)[O-] MCULE-2405585602 [0,2,0,0,0,0|2,0,0]=4 4031 B8R0.8 CSCC[C@@H](N)C(=O)[O-] MCULE-6869616866 [0,2,0,0,0,0|2,0,0]=4 4032 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-1318828477 [0,2,0,0,0,0|2,0,0]=4 4033 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-2645914311 [0,2,0,0,0,0|2,0,0]=4 4034 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-4676970409 [0,2,0,0,0,0|2,0,0]=4 4035 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-6619857551 [0,2,0,0,0,0|2,0,0]=4 4036 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-3383932641 [0,2,0,0,0,0|2,0,0]=4 4037 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-4603455639 [0,2,0,0,0,0|2,0,0]=4 4038 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-7228063662 [0,2,0,0,0,0|2,0,0]=4 4039 B8R0.8 C[Se]CCC(N)C(=O)O MCULE-9212969564 [0,2,0,0,0,0|2,0,0]=4 4040 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5333020269 [0,2,0,0,0,0|2,0,0]=4 4041 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5980340572 [0,2,0,0,0,0|2,0,0]=4 4042 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [0,2,0,0,0,0|2,0,0]=4 4043 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [0,2,0,0,0,0|2,0,0]=4 4044 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [0,2,0,0,0,0|2,0,0]=4 4045 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [0,2,0,0,0,0|2,0,0]=4 4046 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [0,2,0,0,0,0|2,0,0]=4 4047 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [0,2,0,0,0,0|2,0,0]=4 4048 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [0,2,0,0,0,0|2,0,0]=4 4049 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [0,2,0,0,0,0|2,0,0]=4 4050 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [0,2,0,0,0,0|2,0,0]=4 4051 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [0,2,0,0,0,0|2,0,0]=4 4052 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [0,2,0,0,0,0|2,0,0]=4 4053 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [0,2,0,0,0,0|2,0,0]=4 4054 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [0,2,0,0,0,0|2,0,0]=4 4055 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [0,2,0,0,0,0|2,0,0]=4 4056 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [0,2,0,0,0,0|2,0,0]=4 4057 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [0,2,0,0,0,0|2,0,0]=4 4058 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [0,2,0,0,0,0|2,0,0]=4 4059 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [0,2,0,0,0,0|2,0,0]=4 4060 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [0,2,0,0,0,0|2,0,0]=4 4061 B8R0.8 O=C(NCCCl)C(Cl)Cl MCULE-8585437335 [0,2,0,0,0,0|2,0,0]=4 4062 B8R0.8 O=C(NCCO)C(Cl)Cl MCULE-9484937965 [0,2,0,0,0,0|2,0,0]=4 4063 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [0,2,0,0,0,0|2,0,0]=4 4064 B8R0.8 O=C([O-])C(O)CCCO MCULE-5137868319 [0,2,0,0,0,0|2,0,0]=4 4065 B8R0.9 C/C(=N\O)/CCC(C)C MCULE-6160318624 [0,2,0,0,0,0|1,0,1]=4 4066 B8R0.9 C=CC(=O)COC(=O)C MCULE-1008872923 [0,2,0,0,0,0|0,0,2]=4 4067 B8R0.9 C=CC(=O)NCC(C)O MCULE-7092700588 [0,2,0,0,0,0|1,0,1]=4 4068 B8R0.9 C=CC(=O)OCC(C)C MCULE-9738172155 [0,2,0,0,0,0|0,0,1]=3 4069 B8R0.9 C=CC(=O)OCC(C)O MCULE-5600840983 [0,2,0,0,0,0|0,0,1]=3 4070 B8R0.9 CC(=NO)CCC(C)C MCULE-1275882348 [0,2,0,0,0,0|1,0,1]=4 4071 B8R0.9 CC(=O)CCN(C)N=O MCULE-9992314796 [0,2,0,0,0,0|2,0,0]=4 4072 B8R0.9 CC(=O)NCC(C)CN MCULE-6305271563 [0,2,0,0,0,0|1,0,0]=3 4073 B8R0.9 CC(=O)NCC(O)CCl MCULE-4912177314 [0,2,0,0,0,0|1,0,0]=3 4074 B8R0.9 CC(=O)NC[C@H](O)CCl MCULE-5027407972 [0,2,0,0,0,0|1,0,0]=3 4075 B8R0.9 CC(=O)OCC(=O)CCl MCULE-5422965047 [0,2,0,0,0,0|0,0,1]=3 4076 B8R0.9 CC(=O)OCC(C)CBr MCULE-5776578434 [0,2,0,0,0,0|0,0,0]=2 4077 B8R0.9 CC(=O)OCC(N)CO MCULE-3133254167 [0,2,0,0,0,0|0,0,0]=2 4078 B8R0.9 CC(=O)OCC(N)CO MCULE-4867842020 [0,2,0,0,0,0|0,0,0]=2 4079 B8R0.9 CC(=O)OCC(O)CCl MCULE-3591995437 [0,2,0,0,0,0|0,0,0]=2 4080 B8R0.9 CC(=O)OCC(O)CO MCULE-7518673015 [0,2,0,0,0,0|0,0,0]=2 4081 B8R0.9 CC(=O)OC[C@H](C)CO MCULE-2650760220 [0,2,0,0,0,0|0,0,0]=2 4082 B8R0.9 CC(=O)OC[C@H](C)CO MCULE-7616916740 [0,2,0,0,0,0|0,0,0]=2 4083 B8R0.9 CC(=O)SCC(C)CCl MCULE-2266172098 [0,2,0,0,0,0|0,1,0]=3 4084 B8R0.9 CC(C#N)CCC(=O)O MCULE-6867167636 [0,2,0,0,0,0|2,0,0]=4 4085 B8R0.9 CC(C)CCC(=O)CCl MCULE-7122163926 [0,2,0,0,0,0|1,0,0]=3 4086 B8R0.9 CC(C)CCC(=O)CN MCULE-2601333978 [0,2,0,0,0,0|1,0,0]=3 4087 B8R0.9 CC(C)CCC(=O)CN MCULE-9600279855 [0,2,0,0,0,0|1,0,0]=3 4088 B8R0.9 CC(C)CNC(=O)CBr MCULE-8912739616 [0,2,0,0,0,0|1,0,0]=3 4089 B8R0.9 CC(C)CNC(=O)CCl MCULE-6480983342 [0,2,0,0,0,0|1,0,0]=3 4090 B8R0.9 CC(C)CNC(=O)CN MCULE-3593523223 [0,2,0,0,0,0|1,0,0]=3 4091 B8R0.9 CC(C)CNC(=O)CN MCULE-9338504001 [0,2,0,0,0,0|1,0,0]=3 4092 B8R0.9 CC(C)COC(=O)CBr MCULE-3596274514 [0,2,0,0,0,0|0,0,0]=2 4093 B8R0.9 CC(C)COC(=O)CCl MCULE-8531893041 [0,2,0,0,0,0|0,0,0]=2 4094 B8R0.9 CC(C)COC(=O)CS MCULE-6380142851 [0,2,0,0,0,0|0,0,0]=2 4095 B8R0.9 CC(C)COC(C)CO MCULE-5746553586 [0,2,0,0,0,0|0,0,2]=4 4096 B8R0.9 CC(C)OCC(O)CCl MCULE-4441637540 [0,2,0,0,0,0|1,0,1]=4 4097 B8R0.9 CC(C)OCC(O)CI MCULE-7852993488 [0,2,0,0,0,0|1,0,1]=4 4098 B8R0.9 CC(C)OCC(O)CN MCULE-4268894257 [0,2,0,0,0,0|1,0,1]=4 4099 B8R0.9 CC(CCl)CCC(=O)Cl MCULE-3716923938 [0,2,0,0,0,0|2,0,0]=4 4100 B8R0.9 CC(Cl)CNC(=O)CCl MCULE-1131103741 [0,2,0,0,0,0|1,0,0]=3 4101 B8R0.9 CC(O)CCC(=O)NN MCULE-3743680204 [0,2,0,0,0,0|2,0,0]=4 4102 B8R0.9 CC(O)COC(C)CO MCULE-7544702364 [0,2,0,0,0,0|0,0,2]=4 4103 B8R0.9 CCC(=O)CCC(=O)C MCULE-7923444653 [0,2,0,0,0,0|1,0,0]=3 4104 B8R0.9 CCC(=O)CCC(=O)O MCULE-4505750030 [0,2,0,0,0,0|2,0,0]=4 4105 B8R0.9 CCC(=O)CCC(C)C MCULE-3065298823 [0,2,0,0,0,0|1,0,0]=3 4106 B8R0.9 CCC(=O)COC(=O)C MCULE-4876335377 [0,2,0,0,0,0|0,0,0]=2 4107 B8R0.9 CCC(=O)NCC(C)C MCULE-3079187120 [0,2,0,0,0,0|1,0,0]=3 4108 B8R0.9 CCC(=O)OCC(C)Br MCULE-7344958033 [0,2,0,0,0,0|0,0,0]=2 4109 B8R0.9 CCC(=O)OCC(C)C MCULE-4196106578 [0,2,0,0,0,0|0,0,0]=2 4110 B8R0.9 CCC(C)CCC(=O)C MCULE-6498666006 [0,2,0,0,0,0|1,0,0]=3 4111 B8R0.9 CCC(C)CCC(=O)O MCULE-9270270979 [0,2,0,0,0,0|2,0,0]=4 4112 B8R0.9 CCC(C)COC(=O)C MCULE-1846190306 [0,2,0,0,0,0|0,0,0]=2 4113 B8R0.9 CCC(C)COC(=O)Cl MCULE-7986633908 [0,2,0,0,0,0|1,0,0]=3 4114 B8R0.9 CCC(C)NCC(=O)O MCULE-1578825700 [0,2,0,0,0,0|2,0,0]=4 4115 B8R0.9 CCC(C)NCC(=O)O MCULE-8981987872 [0,2,0,0,0,0|2,0,0]=4 4116 B8R0.9 CCC(C)OCC(=O)O MCULE-8235265405 [0,2,0,0,0,0|1,0,0]=3 4117 B8R0.9 CCC(Cl)CCC(=O)Cl MCULE-3849391288 [0,2,0,0,0,0|2,0,0]=4 4118 B8R0.9 CCC(N)CCC(=O)O MCULE-3116763773 [0,2,0,0,0,0|2,0,0]=4 4119 B8R0.9 CCC(N)CCC(=O)O MCULE-9126260921 [0,2,0,0,0,0|2,0,0]=4 4120 B8R0.9 CCC(O)CCC(=O)O MCULE-1512608136 [0,2,0,0,0,0|2,0,0]=4 4121 B8R0.9 CCC(O)CCC(=O)[O-] MCULE-6831827135 [0,2,0,0,0,0|2,0,0]=4 4122 B8R0.9 CCN(C)CCC(=O)O MCULE-2510720087 [0,2,0,0,0,0|2,0,0]=4 4123 B8R0.9 CCN(C)CCC(=O)O MCULE-4192684079 [0,2,0,0,0,0|2,0,0]=4 4124 B8R0.9 CCS(=O)CCC(=O)O MCULE-4027618720 [0,2,0,0,0,0|2,0,0]=4 4125 B8R0.9 CC[C@H](N)C=CC(=O)O MCULE-8933495159 [0,2,0,0,0,0|2,0,0]=4 4126 B8R0.9 CNC(=O)CNC(=O)C MCULE-3508245247 [0,2,0,0,0,0|1,0,1]=4 4127 B8R0.9 COC(=O)/C=C/C(C)C MCULE-3160224452 [0,2,0,0,0,0|1,0,1]=4 4128 B8R0.9 COC(=O)C=CC(C)C MCULE-8333658639 [0,2,0,0,0,0|1,0,1]=4 4129 B8R0.9 COC(=O)CCC(=O)C MCULE-6324755148 [0,2,0,0,0,0|1,0,1]=4 4130 B8R0.9 COC(=O)CCC(F)F MCULE-4602374642 [0,2,0,0,0,0|2,0,0]=4 4131 B8R0.9 COC(=O)CCN(C)C MCULE-5967397518 [0,2,0,0,0,0|2,0,0]=4 4132 B8R0.9 COC(=O)CNC(=O)C MCULE-3795072377 [0,2,0,0,0,0|1,0,1]=4 4133 B8R0.9 COC(=O)CNC(C)C MCULE-7232154394 [0,2,0,0,0,0|2,0,0]=4 4134 B8R0.9 COC(=O)COC(C)C MCULE-8327092817 [0,2,0,0,0,0|2,0,0]=4 4135 B8R0.9 COC(=O)CSC(C)C MCULE-9054714022 [0,2,0,0,0,0|2,0,0]=4 4136 B8R0.9 COC(=O)NCC(=O)C MCULE-1043877696 [0,2,0,0,0,0|1,0,1]=4 4137 B8R0.9 COC(=O)NCC(C)O MCULE-3862167665 [0,2,0,0,0,0|1,0,0]=3 4138 B8R0.9 COC(=O)OCC(F)F MCULE-9403543035 [0,2,0,0,0,0|1,0,0]=3 4139 B8R0.9 COC(C)CCC(=O)O MCULE-5873043454 [0,2,0,0,0,0|2,0,0]=4 4140 B8R0.9 COC(C)COC(=O)C MCULE-7948047479 [0,2,0,0,0,0|0,0,0]=2 4141 B8R0.9 COC(C)OCC(C)C MCULE-2144427762 [0,2,0,0,0,0|0,0,2]=4 4142 B8R0.9 CSC(C)CCC(=O)O MCULE-3505570511 [0,2,0,0,0,0|2,0,0]=4 4143 B8R0.9 NCC(=O)NCC(F)F MCULE-2424685367 [0,2,0,0,0,0|2,0,0]=4 4144 B8R0.9 NCC(=O)NCC(F)F MCULE-9297989555 [0,2,0,0,0,0|2,0,0]=4 4145 B8R0.9 NCC(N)CCC(=O)O MCULE-1054409990 [0,2,0,0,0,0|2,0,0]=4 4146 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-2916881042 [0,2,0,0,0,0|2,0,0]=4 4147 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-7249154843 [0,2,0,0,0,0|2,0,0]=4 4148 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-1233079264 [0,2,0,0,0,0|2,0,0]=4 4149 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-8091475267 [0,2,0,0,0,0|2,0,0]=4 4150 B8R0.9 O=C(CBr)NCC(F)F MCULE-2776688161 [0,2,0,0,0,0|2,0,0]=4 4151 B8R0.9 O=C(O)COC(=O)CO MCULE-4022202206 [0,2,0,0,0,0|1,0,1]=4 4152 B8R0.11 CCC/C=C(/C=O)\CC MCULE-6598454196 [0,2,0,0,0,0|1,0,0]=3 4153 B8R0.11 CCCC=C(C=O)CC MCULE-9099763598 [0,2,0,0,0,0|1,0,0]=3 4154 B8R0.11 CCCC=C(CC)CO MCULE-5047095723 [0,2,0,0,0,0|1,0,1]=4 4155 B8R0.11 CCCCC(C=O)CC MCULE-1141216024 [0,2,0,0,0,0|1,0,1]=4 4156 B8R0.11 CCCOC(CC)CN MCULE-9936594334 [0,2,0,0,0,0|1,0,1]=4 4157 B8R0.11 CCO/C=C(\C=O)/CC MCULE-4972624375 [0,2,0,0,0,0|2,0,0]=4 4158 B8R0.11 CCOC=C(C=O)CC MCULE-2067466903 [0,2,0,0,0,0|2,0,0]=4 4159 B8R0.25 CCCCC(C)(C)C=O MCULE-2890084431 [0,2,0,0,0,0|1,0,1]=4 4160 B8R0.25 CCCCS(=O)(=O)CCl MCULE-8736210504 [0,2,0,0,0,0|2,0,0]=4 4161 B8R0.25 CCS(=O)(=O)OCCF MCULE-6717748095 [0,2,0,0,0,0|2,0,0]=4 4162 B8R0.7 C#CCCCCC(=O)O MCULE-5828767633 [0,2,0,0,0,0|2,0,0]=4 4163 B8R0.7 C#CCCCOC(=O)C MCULE-5113085970 [0,2,0,0,0,0|0,0,0]=2 4164 B8R0.7 C#CCCOCC(=O)O MCULE-5200842540 [0,2,0,0,0,0|1,0,1]=4 4165 B8R0.7 C=C(C)CCCCC#N MCULE-5170658288 [0,2,0,0,0,0|2,0,0]=4 4166 B8R0.7 C=C(C)CCCCCC MCULE-2243788093 [0,2,0,0,0,0|2,0,0]=4 4167 B8R0.7 C=C(C)CCCCCCl MCULE-5646492015 [0,2,0,0,0,0|2,0,0]=4 4168 B8R0.7 C=C(C)CSCCCC MCULE-7053589995 [0,2,0,0,0,0|1,1,0]=4 4169 B8R0.7 C=CCCCCC(=O)C MCULE-4268619428 [0,2,0,0,0,0|1,0,0]=3 4170 B8R0.7 C=CCCCCC(=O)O MCULE-1991116122 [0,2,0,0,0,0|2,0,0]=4 4171 B8R0.7 C=CCCCOC(=O)C MCULE-2972695808 [0,2,0,0,0,0|0,0,0]=2 4172 B8R0.7 C=CCCOCC(=O)O MCULE-8626594933 [0,2,0,0,0,0|1,0,1]=4 4173 B8R0.7 CC#CCCCC(=O)C MCULE-4297141774 [0,2,0,0,0,0|1,0,0]=3 4174 B8R0.7 CC#CCCCC(=O)O MCULE-2531382210 [0,2,0,0,0,0|2,0,0]=4 4175 B8R0.7 CC(=NOCCC#N)C MCULE-8681362079 [0,2,0,0,0,0|1,0,1]=4 4176 B8R0.7 CC(=O)CCCCC#N MCULE-2841814511 [0,2,0,0,0,0|1,0,0]=3 4177 B8R0.7 CC(=O)CCCCCBr MCULE-8946921118 [0,2,0,0,0,0|1,0,0]=3 4178 B8R0.7 CC(=O)CCCCCN MCULE-3568024595 [0,2,0,0,0,0|1,0,0]=3 4179 B8R0.7 CC(=O)CCCCCN MCULE-9938894581 [0,2,0,0,0,0|1,0,0]=3 4180 B8R0.7 CC(=O)CCCN=N#N MCULE-4708169857 [0,2,0,0,0,0|2,0,0]=4 4181 B8R0.7 CC(=O)CCCOC=O MCULE-7473574321 [0,2,0,0,0,0|1,0,1]=4 4182 B8R0.7 CC(=O)NCCCCN MCULE-6666803790 [0,2,0,0,0,0|1,0,0]=3 4183 B8R0.7 CC(=O)NCCCCN MCULE-8971714473 [0,2,0,0,0,0|1,0,0]=3 4184 B8R0.7 CC(=O)NCCCCO MCULE-5119895862 [0,2,0,0,0,0|1,0,0]=3 4185 B8R0.7 CC(=O)OC=CCC#N MCULE-5325483419 [0,2,0,0,0,0|0,0,2]=4 4186 B8R0.7 CC(=O)OCC#CCCl MCULE-2578774233 [0,2,0,0,0,0|0,0,1]=3 4187 B8R0.7 CC(=O)OCCCCBr MCULE-6081921662 [0,2,0,0,0,0|0,0,0]=2 4188 B8R0.7 CC(=O)OCCCCCl MCULE-3999602136 [0,2,0,0,0,0|0,0,0]=2 4189 B8R0.7 CC(=O)OCCCCI MCULE-6699791525 [0,2,0,0,0,0|0,0,0]=2 4190 B8R0.7 CC(=O)OCCCCO MCULE-7064721476 [0,2,0,0,0,0|0,0,0]=2 4191 B8R0.7 CC(=O)OCCOCCl MCULE-2565061276 [0,2,0,0,0,0|0,0,0]=2 4192 B8R0.7 CC(=O)SCCCCBr MCULE-1636667997 [0,2,0,0,0,0|0,1,0]=3 4193 B8R0.7 CC(=O)SCCCCN MCULE-2425585672 [0,2,0,0,0,0|0,1,0]=3 4194 B8R0.7 CC(=O)SCCCCN MCULE-9899884734 [0,2,0,0,0,0|0,1,0]=3 4195 B8R0.7 CC(C)COCCCN MCULE-1113222381 [0,2,0,0,0,0|1,0,1]=4 4196 B8R0.7 CC(C)COCCCO MCULE-8827861403 [0,2,0,0,0,0|1,0,1]=4 4197 B8R0.7 CC(C)OCCCC#N MCULE-4911501527 [0,2,0,0,0,0|1,0,1]=4 4198 B8R0.7 CC(C)OCCCCN MCULE-1961317000 [0,2,0,0,0,0|1,0,1]=4 4199 B8R0.7 CC(C)OCCCCO MCULE-7834967841 [0,2,0,0,0,0|1,0,1]=4 4200 B8R0.7 CC=CCCCC(=O)C MCULE-7957571875 [0,2,0,0,0,0|1,0,0]=3 4201 B8R0.7 CC=CCCCC(=O)O MCULE-3300087433 [0,2,0,0,0,0|2,0,0]=4 4202 B8R0.7 CCCC/C=C/C(=O)C MCULE-1532446839 [0,2,0,0,0,0|1,0,0]=3 4203 B8R0.7 CCCC/C=C/C(=O)O MCULE-6916224344 [0,2,0,0,0,0|2,0,0]=4 4204 B8R0.7 CCCC=CCC(=O)O MCULE-3879649411 [0,2,0,0,0,0|2,0,0]=4 4205 B8R0.7 CCCCC#CC(=O)O MCULE-4160128187 [0,2,0,0,0,0|2,0,0]=4 4206 B8R0.7 CCCCC=CC(=O)C MCULE-6026245958 [0,2,0,0,0,0|1,0,0]=3 4207 B8R0.7 CCCCC=CC(=O)Cl MCULE-3883159938 [0,2,0,0,0,0|2,0,0]=4 4208 B8R0.7 CCCCC=CC(=O)O MCULE-6837768730 [0,2,0,0,0,0|2,0,0]=4 4209 B8R0.7 CCCCCCC(=O)C MCULE-1152821440 [0,2,0,0,0,0|1,0,0]=3 4210 B8R0.7 CCCCCCC(=O)Cl MCULE-8559884798 [0,2,0,0,0,0|2,0,0]=4 4211 B8R0.7 CCCCCCC(=O)N MCULE-1210996881 [0,2,0,0,0,0|2,0,0]=4 4212 B8R0.7 CCCCCCC(=O)O MCULE-1489137568 [0,2,0,0,0,0|2,0,0]=4 4213 B8R0.7 CCCCCCC(=O)[O-] MCULE-1711655800 [0,2,0,0,0,0|2,0,0]=4 4214 B8R0.7 CCCCCNC(=O)N MCULE-3139270247 [0,2,0,0,0,0|2,0,0]=4 4215 B8R0.7 CCCCCOC(=O)C MCULE-4911325533 [0,2,0,0,0,0|0,0,0]=2 4216 B8R0.7 CCCCCOC(=O)Cl MCULE-2896207255 [0,2,0,0,0,0|1,0,0]=3 4217 B8R0.7 CCCCCOC(=S)[S-] MCULE-2950713727 [0,2,0,0,0,0|1,1,0]=4 4218 B8R0.7 CCCCCOC(=S)[S-] MCULE-3707330245 [0,2,0,0,0,0|1,1,0]=4 4219 B8R0.7 CCCCCON(=O)=O MCULE-5516967908 [0,2,0,0,0,0|2,0,0]=4 4220 B8R0.7 CCCCNCC(=O)N MCULE-1276341431 [0,2,0,0,0,0|2,0,0]=4 4221 B8R0.7 CCCCNCC(=O)N MCULE-6579402071 [0,2,0,0,0,0|2,0,0]=4 4222 B8R0.7 CCCCNCC(=O)O MCULE-4725221957 [0,2,0,0,0,0|2,0,0]=4 4223 B8R0.7 CCCCOCC(=O)O MCULE-9634255761 [0,2,0,0,0,0|1,0,0]=3 4224 B8R0.7 CCCCOCC(C)O MCULE-6350800869 [0,2,0,0,0,0|0,0,2]=4 4225 B8R0.7 CCCCSCC(=O)O MCULE-3580384865 [0,2,0,0,0,0|1,1,0]=4 4226 B8R0.7 CCCNCCC(=O)N MCULE-2654608736 [0,2,0,0,0,0|2,0,0]=4 4227 B8R0.7 CCCNCCC(=O)N MCULE-2683588523 [0,2,0,0,0,0|2,0,0]=4 4228 B8R0.7 CCCNCCC(=O)O MCULE-3144740259 [0,2,0,0,0,0|2,0,0]=4 4229 B8R0.7 CCCNCCC(=O)O MCULE-3866165037 [0,2,0,0,0,0|2,0,0]=4 4230 B8R0.7 CCCOCCC(=O)O MCULE-1927238608 [0,2,0,0,0,0|1,0,0]=3 4231 B8R0.7 CCCSC=CC(=O)O MCULE-3074287995 [0,2,0,0,0,0|1,1,0]=4 4232 B8R0.7 CCCSC=CC(=O)[O-] MCULE-9917981235 [0,2,0,0,0,0|1,1,0]=4 4233 B8R0.7 CCCSCCC(=O)O MCULE-6454518290 [0,2,0,0,0,0|1,1,0]=4 4234 B8R0.7 CCNCCCC(=O)O MCULE-7019386199 [0,2,0,0,0,0|2,0,0]=4 4235 B8R0.7 CCNCCCC(=O)O MCULE-8568253592 [0,2,0,0,0,0|2,0,0]=4 4236 B8R0.7 CCOCCCC(=O)O MCULE-9064011886 [0,2,0,0,0,0|2,0,0]=4 4237 B8R0.7 CCOCCNC(=O)N MCULE-7568793312 [0,2,0,0,0,0|2,0,0]=4 4238 B8R0.7 CCOCCOC(=O)C MCULE-3053452981 [0,2,0,0,0,0|0,0,0]=2 4239 B8R0.7 CCOCCOC(=O)Cl MCULE-9683410173 [0,2,0,0,0,0|1,0,0]=3 4240 B8R0.7 CNCCCCC(=O)O MCULE-4298567521 [0,2,0,0,0,0|2,0,0]=4 4241 B8R0.7 CNCCCCC(=O)O MCULE-5688320983 [0,2,0,0,0,0|2,0,0]=4 4242 B8R0.7 CNCCCNC(=O)C MCULE-2682619502 [0,2,0,0,0,0|1,0,0]=3 4243 B8R0.7 CNCCCNC(=O)C MCULE-3477977807 [0,2,0,0,0,0|1,0,0]=3 4244 B8R0.7 CNCCCOC(C)C MCULE-5549073656 [0,2,0,0,0,0|1,0,1]=4 4245 B8R0.7 CNCCCOC(C)C MCULE-5985260047 [0,2,0,0,0,0|1,0,1]=4 4246 B8R0.7 CNCCOCC(=O)O MCULE-5408672373 [0,2,0,0,0,0|1,0,0]=3 4247 B8R0.7 COCCCCC(=O)O MCULE-1268596288 [0,2,0,0,0,0|2,0,0]=4 4248 B8R0.7 COCCCNC(=O)C MCULE-4149128250 [0,2,0,0,0,0|1,0,0]=3 4249 B8R0.7 COCCCNC(=O)N MCULE-4038737956 [0,2,0,0,0,0|2,0,0]=4 4250 B8R0.7 COCCNCC(=O)N MCULE-2300508230 [0,2,0,0,0,0|2,0,0]=4 4251 B8R0.7 COCCNCC(=O)N MCULE-7059174365 [0,2,0,0,0,0|2,0,0]=4 4252 B8R0.7 COCCNCC(=O)O MCULE-2703110743 [0,2,0,0,0,0|2,0,0]=4 4253 B8R0.7 COCCNCC(=O)O MCULE-5854004501 [0,2,0,0,0,0|2,0,0]=4 4254 B8R0.7 COCCOCC(=O)C MCULE-5956367525 [0,2,0,0,0,0|0,0,0]=2 4255 B8R0.7 COCCOCC(=O)Cl MCULE-9321414156 [0,2,0,0,0,0|1,0,0]=3 4256 B8R0.7 COCCOCC(=O)N MCULE-8987780803 [0,2,0,0,0,0|1,0,0]=3 4257 B8R0.7 COCCOCC(=O)O MCULE-2561278418 [0,2,0,0,0,0|1,0,0]=3 4258 B8R0.7 COCCOCC(C)N MCULE-5569346034 [0,2,0,0,0,0|1,0,1]=4 4259 B8R0.7 COCCOCC(C)N MCULE-8825273341 [0,2,0,0,0,0|1,0,1]=4 4260 B8R0.7 COCCSCC(=O)O MCULE-2908610834 [0,2,0,0,0,0|1,1,0]=4 4261 B8R0.7 CS(=O)CCCCC#N MCULE-1279378713 [0,2,0,0,0,0|2,0,0]=4 4262 B8R0.7 CSCCCCC(=O)O MCULE-4498129620 [0,2,0,0,0,0|2,0,0]=4 4263 B8R0.7 CSCCCOC(=O)C MCULE-4403232519 [0,2,0,0,0,0|0,0,0]=2 4264 B8R0.7 CSCCNCC(=O)O MCULE-1747724833 [0,2,0,0,0,0|2,0,0]=4 4265 B8R0.7 CSCCNCC(=O)O MCULE-9991325079 [0,2,0,0,0,0|2,0,0]=4 4266 B8R0.7 CSCCOCC(=O)O MCULE-2038020159 [0,2,0,0,0,0|1,0,0]=3 4267 B8R0.7 CSSCCCC(=O)O MCULE-7947744639 [0,2,0,0,0,0|2,0,0]=4 4268 B8R0.7 N#CCCCCC(=O)N MCULE-7791035164 [0,2,0,0,0,0|2,0,0]=4 4269 B8R0.7 N#CCCCCC(=O)O MCULE-1900756226 [0,2,0,0,0,0|2,0,0]=4 4270 B8R0.7 NC(=O)CCCCCBr MCULE-6938202710 [0,2,0,0,0,0|2,0,0]=4 4271 B8R0.7 NC(=O)CCCCCO MCULE-2654184294 [0,2,0,0,0,0|2,0,0]=4 4272 B8R0.7 NC(=O)CCNCCS MCULE-4682566242 [0,2,0,0,0,0|2,0,0]=4 4273 B8R0.7 NCCCCCC(=O)N MCULE-1692086577 [0,2,0,0,0,0|2,0,0]=4 4274 B8R0.7 NCCCCCC(=O)N MCULE-2191237198 [0,2,0,0,0,0|2,0,0]=4 4275 B8R0.7 NCCCCCC(=O)O MCULE-3640363033 [0,2,0,0,0,0|2,0,0]=4 4276 B8R0.7 NCCCCCC(=O)O MCULE-6389520144 [0,2,0,0,0,0|2,0,0]=4 4277 B8R0.7 NCCCCCC(=O)[O-] MCULE-7336458907 [0,2,0,0,0,0|2,0,0]=4 4278 B8R0.7 NCCCCNC(=O)N MCULE-6339634491 [0,2,0,0,0,0|2,0,0]=4 4279 B8R0.7 NCCCCNC(=O)N MCULE-8210849027 [0,2,0,0,0,0|2,0,0]=4 4280 B8R0.7 NCCCNCC(=O)O MCULE-6526080048 [0,2,0,0,0,0|2,0,0]=4 4281 B8R0.7 NCCCNCC(=O)O MCULE-6762903438 [0,2,0,0,0,0|2,0,0]=4 4282 B8R0.7 NCCCOCC(=O)O MCULE-6428539436 [0,2,0,0,0,0|1,0,0]=3 4283 B8R0.7 NCCNCCC(=O)O MCULE-6596967912 [0,2,0,0,0,0|2,0,0]=4 4284 B8R0.7 NCCNCCC(=O)[O-] MCULE-8896439746 [0,2,0,0,0,0|2,0,0]=4 4285 B8R0.7 NCCOCCC(=O)O MCULE-8535110656 [0,2,0,0,0,0|2,0,0]=4 4286 B8R0.7 NCCOCCC(=O)O MCULE-9124828795 [0,2,0,0,0,0|2,0,0]=4 4287 B8R0.7 NCCSCCC(=O)O MCULE-5309234181 [0,2,0,0,0,0|2,0,0]=4 4288 B8R0.7 NOCCCCC(=O)O MCULE-2022616022 [0,2,0,0,0,0|2,0,0]=4 4289 B8R0.7 NOCCCCC(=O)O MCULE-9375312454 [0,2,0,0,0,0|2,0,0]=4 4290 B8R0.7 O=C(Cl)CCCCCBr MCULE-4314610726 [0,2,0,0,0,0|2,0,0]=4 4291 B8R0.7 O=C(Cl)CCCCCCl MCULE-4526081631 [0,2,0,0,0,0|2,0,0]=4 4292 B8R0.7 O=C(Cl)OCCCCCl MCULE-4992919323 [0,2,0,0,0,0|1,0,0]=3 4293 B8R0.7 O=C(O)CCCCCBr MCULE-2086088700 [0,2,0,0,0,0|2,0,0]=4 4294 B8R0.7 O=C(O)CCCCCCl MCULE-3419329115 [0,2,0,0,0,0|2,0,0]=4 4295 B8R0.7 O=C(O)CCCCCF MCULE-6736431365 [0,2,0,0,0,0|2,0,0]=4 4296 B8R0.7 O=C(O)CCCCCO MCULE-9202536119 [0,2,0,0,0,0|2,0,0]=4 4297 B8R0.7 O=C(O)CCCCCS MCULE-1414350107 [0,2,0,0,0,0|2,0,0]=4 4298 B8R0.7 O=C(O)CCNCCO MCULE-6594831168 [0,2,0,0,0,0|2,0,0]=4 4299 B8R0.7 O=C(O)CCOCCBr MCULE-8991363781 [0,2,0,0,0,0|2,0,0]=4 4300 B8R0.7 O=C(O)CCOCCO MCULE-7271806926 [0,2,0,0,0,0|2,0,0]=4 4301 B8R0.7 O=C(O)CCOCCS MCULE-2136117046 [0,2,0,0,0,0|2,0,0]=4 4302 B8R0.7 O=C(O)CCSCCO MCULE-4689447674 [0,2,0,0,0,0|2,0,0]=4 4303 B8R0.7 O=C(O)COCCCBr MCULE-2393807719 [0,2,0,0,0,0|1,0,0]=3 4304 B8R0.7 O=C([O-])CCCCCCl MCULE-7341419838 [0,2,0,0,0,0|2,0,0]=4 4305 B8R0.7 O=C([O-])CCCCCO MCULE-5897469112 [0,2,0,0,0,0|2,0,0]=4 4306 B8R0.7 O=C([O-])CCCCCO MCULE-9397608140 [0,2,0,0,0,0|2,0,0]=4 4307 B8R0.7 O=CCCCCC(=O)O MCULE-8762346998 [0,2,0,0,0,0|2,0,0]=4 4308 B8R0.7 O=N(=O)OCCCCO MCULE-8113401389 [0,2,0,0,0,0|2,0,0]=4 4309 B8R0.7 P(=O)([O-])OCCOCC MCULE-4656015143 [0,2,0,0,0,0|2,0,0]=4 4310 B8R0.21 C#CCCOS(=O)(=O)C MCULE-6797018059 [0,2,0,0,0,0|1,0,1]=4 4311 B8R0.21 CC(C)(C)OCCCBr MCULE-8201130964 [0,2,0,0,0,0|1,0,1]=4 4312 B8R0.21 CC(C)(C)OCCCN MCULE-1556496850 [0,2,0,0,0,0|1,0,1]=4 4313 B8R0.21 CC(C)(C)OCCCN MCULE-8410807707 [0,2,0,0,0,0|1,0,1]=4 4314 B8R0.21 CC(C)(C)OCCCO MCULE-9923433921 [0,2,0,0,0,0|1,0,1]=4 4315 B8R0.21 CCCCOC(C)(C)C MCULE-7244985912 [0,2,0,0,0,0|1,0,1]=4 4316 B8R0.21 CCCCOP(=O)(O)O MCULE-7637624598 [0,2,0,0,0,0|2,0,0]=4 4317 B8R0.21 CCCCOS(=O)(=O)C MCULE-3406688787 [0,2,0,0,0,0|1,0,0]=3 4318 B8R0.21 CCNCCS(=O)(=O)C MCULE-2627541965 [0,2,0,0,0,0|2,0,0]=4 4319 B8R0.21 CNCCNS(=O)(=O)C MCULE-5555636642 [0,2,0,0,0,0|2,0,0]=4 4320 B8R0.21 CNCCNS(=O)(=O)C MCULE-6617648988 [0,2,0,0,0,0|2,0,0]=4 4321 B8R0.21 CNCCOC(C)(C)C MCULE-6703104052 [0,2,0,0,0,0|1,0,1]=4 4322 B8R0.21 CNCCOS(=O)(=O)C MCULE-7536697713 [0,2,0,0,0,0|1,0,0]=3 4323 B8R0.21 CNCCOS(=O)(=O)C MCULE-7603920524 [0,2,0,0,0,0|1,0,0]=3 4324 B8R0.21 COCCOS(=O)(=O)C MCULE-6807363319 [0,2,0,0,0,0|1,0,0]=3 4325 B8R0.21 CS(=O)(=O)CCCCBr MCULE-1708524802 [0,2,0,0,0,0|2,0,0]=4 4326 B8R0.21 CS(=O)(=O)CCCCCl MCULE-1449012481 [0,2,0,0,0,0|2,0,0]=4 4327 B8R0.21 CS(=O)(=O)CCCCI MCULE-8458880808 [0,2,0,0,0,0|2,0,0]=4 4328 B8R0.21 CS(=O)(=O)CCCCN MCULE-2550166149 [0,2,0,0,0,0|2,0,0]=4 4329 B8R0.21 CS(=O)(=O)CCCCN MCULE-9182498058 [0,2,0,0,0,0|2,0,0]=4 4330 B8R0.21 CS(=O)(=O)CCCCO MCULE-5624209550 [0,2,0,0,0,0|2,0,0]=4 4331 B8R0.21 CS(=O)(=O)NCCCBr MCULE-9124256244 [0,2,0,0,0,0|2,0,0]=4 4332 B8R0.21 CS(=O)(=O)NCCCCl MCULE-7901114669 [0,2,0,0,0,0|2,0,0]=4 4333 B8R0.21 CS(=O)(=O)NCCCN MCULE-4464694896 [0,2,0,0,0,0|2,0,0]=4 4334 B8R0.21 CS(=O)(=O)NCCCO MCULE-6490455184 [0,2,0,0,0,0|2,0,0]=4 4335 B8R0.21 CS(=O)(=O)OCCC#N MCULE-5524515814 [0,2,0,0,0,0|1,0,1]=4 4336 B8R0.21 CS(=O)(=O)OCCCF MCULE-7336267082 [0,2,0,0,0,0|1,0,0]=3 4337 B8R0.21 CS(=O)(=O)SCCCN MCULE-1087705865 [0,2,0,0,0,0|1,1,0]=4 4338 B8R0.21 CS(=O)(=O)SCCCN MCULE-6478844765 [0,2,0,0,0,0|1,1,0]=4 4339 B8R0.21 C[Si](C)(C)OCCCI MCULE-5099723725 [0,2,0,0,0,0|1,1,0]=4 4340 B8R0.21 C[Si](C)(C)OCCCN MCULE-1239724631 [0,2,0,0,0,0|1,1,0]=4 4341 B8R0.28 C=C(C)CCCC(=O)O MCULE-1282031449 [0,2,0,0,0,0|2,0,0]=4 4342 B8R0.28 C=C(C)CCCC(C)C MCULE-5830488183 [0,2,0,0,0,0|2,0,0]=4 4343 B8R0.28 CC(=CCCC(C)C)Br MCULE-8539278626 [0,2,0,0,0,0|2,0,0]=4 4344 B8R0.28 CC(=CCCC(C)N)C MCULE-4339510061 [0,2,0,0,0,0|2,0,0]=4 4345 B8R0.28 CC(=CCCC(C)O)C MCULE-6046871097 [0,2,0,0,0,0|2,0,0]=4 4346 B8R0.28 CC(=CCC[C@@H](C)O)C MCULE-5913564496 [0,2,0,0,0,0|2,0,0]=4 4347 B8R0.28 CC(=CCC[C@@H](C)O)C MCULE-8239445037 [0,2,0,0,0,0|2,0,0]=4 4348 B8R0.28 CC(=CCC[C@H](C)O)C MCULE-3685132186 [0,2,0,0,0,0|2,0,0]=4 4349 B8R0.28 CC(=CCC[C@H](C)O)C MCULE-7339160655 [0,2,0,0,0,0|2,0,0]=4 4350 B8R0.28 CC(=O)/C=C/CC(C)C MCULE-3347834086 [0,2,0,0,0,0|1,0,0]=3 4351 B8R0.28 CC(=O)C=CCC(C)C MCULE-7397904120 [0,2,0,0,0,0|1,0,0]=3 4352 B8R0.28 CC(=O)CC=CC(C)C MCULE-1638476368 [0,2,0,0,0,0|1,0,1]=4 4353 B8R0.28 CC(=O)CCC=C(C)C MCULE-3832720881 [0,2,0,0,0,0|1,0,1]=4 4354 B8R0.28 CC(=O)CCCC(=O)C MCULE-9250637004 [0,2,0,0,0,0|1,0,0]=3 4355 B8R0.28 CC(=O)CCCC(=O)N MCULE-8753142022 [0,2,0,0,0,0|1,0,1]=4 4356 B8R0.28 CC(=O)CCCC(=O)O MCULE-2498129200 [0,2,0,0,0,0|1,0,1]=4 4357 B8R0.28 CC(=O)CCCC(C)C MCULE-7256575819 [0,2,0,0,0,0|1,0,0]=3 4358 B8R0.28 CC(=O)CCCN(C)C MCULE-8876627134 [0,2,0,0,0,0|1,0,0]=3 4359 B8R0.28 CC(=O)CCOC(=O)C MCULE-5123903575 [0,2,0,0,0,0|0,0,0]=2 4360 B8R0.28 CC(=O)CCOC(C)C MCULE-5907441510 [0,2,0,0,0,0|1,0,0]=3 4361 B8R0.28 CC(=O)CNCC(C)C MCULE-3943786157 [0,2,0,0,0,0|1,0,0]=3 4362 B8R0.28 CC(=O)CNCC(C)C MCULE-9329085422 [0,2,0,0,0,0|1,0,0]=3 4363 B8R0.28 CC(=O)COCC(=O)C MCULE-1945925794 [0,2,0,0,0,0|0,0,1]=3 4364 B8R0.28 CC(=O)CSCC(C)C MCULE-1710631404 [0,2,0,0,0,0|0,1,0]=3 4365 B8R0.28 CC(=O)NCCC(=O)N MCULE-6090839432 [0,2,0,0,0,0|1,0,1]=4 4366 B8R0.28 CC(=O)NCCC(=O)O MCULE-8867286578 [0,2,0,0,0,0|1,0,1]=4 4367 B8R0.28 CC(=O)NCCC(C)C MCULE-7572826846 [0,2,0,0,0,0|1,0,0]=3 4368 B8R0.28 CC(=O)NCCS(=O)C MCULE-1283027669 [0,2,0,0,0,0|1,0,0]=3 4369 B8R0.28 CC(=O)NCNC(=O)C MCULE-3469911833 [0,2,0,0,0,0|1,0,1]=4 4370 B8R0.28 CC(=O)OCC=C(C)C MCULE-1590395935 [0,2,0,0,0,0|0,0,1]=3 4371 B8R0.28 CC(=O)OCCC(=O)O MCULE-6617841906 [0,2,0,0,0,0|0,0,1]=3 4372 B8R0.28 CC(=O)OCCC(C)C MCULE-3274854886 [0,2,0,0,0,0|0,0,0]=2 4373 B8R0.28 CC(=O)OCCN(C)C MCULE-2915953466 [0,2,0,0,0,0|0,0,0]=2 4374 B8R0.28 CC(=O)OCOC(=O)C MCULE-9458993444 [0,2,0,0,0,0|0,0,1]=3 4375 B8R0.28 CC(=O)SCCC(=O)Cl MCULE-7772328654 [0,2,0,0,0,0|0,1,1]=4 4376 B8R0.28 CC(=O)SCCC(=O)O MCULE-2263963171 [0,2,0,0,0,0|0,1,1]=4 4377 B8R0.28 CC(C)CC=CC(=O)O MCULE-4966710694 [0,2,0,0,0,0|2,0,0]=4 4378 B8R0.28 CC(C)CCCC(=O)O MCULE-3645348479 [0,2,0,0,0,0|2,0,0]=4 4379 B8R0.28 CC(C)CCNC(=O)N MCULE-7857218878 [0,2,0,0,0,0|2,0,0]=4 4380 B8R0.28 CC(C)CCOC(=O)Cl MCULE-1140125816 [0,2,0,0,0,0|1,0,0]=3 4381 B8R0.28 CC(C)CCOC(=S)[S-] MCULE-5735238485 [0,2,0,0,0,0|1,1,0]=4 4382 B8R0.28 CC(C)CCOC(=S)[S-] MCULE-6041602768 [0,2,0,0,0,0|1,1,0]=4 4383 B8R0.28 CC(C)CCON(=O)=O MCULE-4421216319 [0,2,0,0,0,0|2,0,0]=4 4384 B8R0.28 CC(C)CNCC(=O)N MCULE-6834225327 [0,2,0,0,0,0|2,0,0]=4 4385 B8R0.28 CC(C)CNCC(=O)N MCULE-8464570977 [0,2,0,0,0,0|2,0,0]=4 4386 B8R0.28 CC(C)CNCC(=O)O MCULE-4695293444 [0,2,0,0,0,0|2,0,0]=4 4387 B8R0.28 CC(C)CNCC(=O)O MCULE-9936739681 [0,2,0,0,0,0|2,0,0]=4 4388 B8R0.28 CC(C)COCC(=O)N MCULE-8148336060 [0,2,0,0,0,0|1,0,0]=3 4389 B8R0.28 CC(C)COCC(=O)O MCULE-8643896966 [0,2,0,0,0,0|1,0,0]=3 4390 B8R0.28 CC(C)COCC(C)C MCULE-5674609142 [0,2,0,0,0,0|1,0,1]=4 4391 B8R0.28 CC(C)COCC(C)O MCULE-2243697829 [0,2,0,0,0,0|0,0,2]=4 4392 B8R0.28 CC(C)CSCC(=O)O MCULE-5182400762 [0,2,0,0,0,0|1,1,0]=4 4393 B8R0.28 CC(C)NCCC(=O)N MCULE-4812986605 [0,2,0,0,0,0|2,0,0]=4 4394 B8R0.28 CC(C)NCCC(=O)O MCULE-2087792459 [0,2,0,0,0,0|2,0,0]=4 4395 B8R0.28 CC(C)NCCC(=O)O MCULE-6893587807 [0,2,0,0,0,0|2,0,0]=4 4396 B8R0.28 CC(C)OCCC(=O)O MCULE-6533666992 [0,2,0,0,0,0|2,0,0]=4 4397 B8R0.28 CC(C)OCOC(C)C MCULE-4287954144 [0,2,0,0,0,0|1,0,1]=4 4398 B8R0.28 CC(C)SCCC(=O)O MCULE-1434094352 [0,2,0,0,0,0|2,0,0]=4 4399 B8R0.28 CC(Cl)CCCC(=O)Cl MCULE-6993455396 [0,2,0,0,0,0|2,0,0]=4 4400 B8R0.28 CC(O)CCCC(=O)O MCULE-6696855762 [0,2,0,0,0,0|2,0,0]=4 4401 B8R0.28 CC(O)CCCC(=O)[O-] MCULE-7722587632 [0,2,0,0,0,0|2,0,0]=4 4402 B8R0.28 CC(O)COCC(C)O MCULE-9464290948 [0,2,0,0,0,0|0,0,2]=4 4403 B8R0.28 CN(C)CCCC(=O)Cl MCULE-4211417336 [0,2,0,0,0,0|2,0,0]=4 4404 B8R0.28 CN(C)CCCC(=O)Cl MCULE-6854328742 [0,2,0,0,0,0|2,0,0]=4 4405 B8R0.28 CN(C)CCCC(=O)O MCULE-5562283434 [0,2,0,0,0,0|2,0,0]=4 4406 B8R0.28 CN(C)CCCC(=O)O MCULE-5657963851 [0,2,0,0,0,0|2,0,0]=4 4407 B8R0.28 CN(C)CCNC(=O)N MCULE-5420989663 [0,2,0,0,0,0|2,0,0]=4 4408 B8R0.28 CN(C)CCNC(=O)N MCULE-6784836791 [0,2,0,0,0,0|2,0,0]=4 4409 B8R0.28 O=C(O)CCCC(F)F MCULE-1906281877 [0,2,0,0,0,0|2,0,0]=4 4410 B8R0.28 O=C(O)COCC(F)F MCULE-2599944385 [0,2,0,0,0,0|2,0,0]=4 4411 B8R0.12 CCCC(C)(C)C(=O)C MCULE-3472590451 [0,2,0,0,0,0|1,0,0]=3 4412 B8R0.12 CCCC(C)(C)C(=O)Cl MCULE-1035499713 [0,2,0,0,0,0|2,0,0]=4 4413 B8R0.12 CCCC(C)(C)C(=O)O MCULE-7950118630 [0,2,0,0,0,0|2,0,0]=4 4414 B8R0.12 CCCC(C)(N)C(=O)O MCULE-3079931045 [0,2,0,0,0,0|2,0,0]=4 4415 B8R0.12 CCCC(C)(O)C(=O)N MCULE-5398805490 [0,2,0,0,0,0|2,0,0]=4 4416 B8R0.12 CCCC(C)(O)C(=O)O MCULE-5292180056 [0,2,0,0,0,0|2,0,0]=4 4417 B8R0.12 CCCC(F)(F)C(=O)O MCULE-9926038462 [0,2,0,0,0,0|2,0,0]=4 4418 B8R0.12 CCC[C@](C)(N)C(=O)O MCULE-8569302783 [0,2,0,0,0,0|2,0,0]=4 4419 B8R0.15 CCCC(=NO)C(=O)N MCULE-4974052536 [0,2,0,0,0,0|2,0,0]=4 4420 B8R0.15 CCCC(C#N)C(=O)O MCULE-8231205596 [0,2,0,0,0,0|2,0,0]=4 4421 B8R0.15 CCCC(CC)C(=O)C MCULE-3483794250 [0,2,0,0,0,0|1,0,0]=3 4422 B8R0.15 CCCC(CC)C(=O)O MCULE-2070546888 [0,2,0,0,0,0|2,0,0]=4 4423 B8R0.15 CCCC(CO)C(=O)O MCULE-2653026260 [0,2,0,0,0,0|2,0,0]=4 4424 B8R0.15 CCCC(NC)C(=O)O MCULE-5292420123 [0,2,0,0,0,0|2,0,0]=4 4425 B8R0.15 CCCC(NC)C(=O)O MCULE-5734283547 [0,2,0,0,0,0|2,0,0]=4 4426 B8R0.15 CCCC(NC)C(=O)O MCULE-9559460593 [0,2,0,0,0,0|2,0,0]=4 4427 B8R0.15 CCCC(NO)C(=O)O MCULE-7484331195 [0,2,0,0,0,0|2,0,0]=4 4428 B8R0.15 CCCC(OC)C(=O)O MCULE-6875744280 [0,2,0,0,0,0|2,0,0]=4 4429 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-3394704356 [0,2,0,0,0,0|2,0,0]=4 4430 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-8140893147 [0,2,0,0,0,0|2,0,0]=4 4431 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-1805025355 [0,2,0,0,0,0|2,0,0]=4 4432 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-3449491143 [0,2,0,0,0,0|2,0,0]=4 4433 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-1028689544 [0,2,0,0,0,0|2,0,0]=4 4434 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-4848752673 [0,2,0,0,0,0|2,0,0]=4 4435 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-5585839502 [0,2,0,0,0,0|2,0,0]=4 4436 B8R0.15 CCC[C@H](NO)C(=O)O MCULE-7455558431 [0,2,0,0,0,0|2,0,0]=4 4437 B8R0.29 CC(=CCC(C)(C)C)C MCULE-8778760588 [0,2,0,0,0,0|2,0,0]=4 4438 B8R0.29 CC(=O)CCC(C)(C)C MCULE-2192082949 [0,2,0,0,0,0|1,0,0]=3 4439 B8R0.29 CC(=O)CCC(C)(C)O MCULE-8412947781 [0,2,0,0,0,0|1,0,0]=3 4440 B8R0.29 CC(=O)CCC(F)(F)F MCULE-6225123181 [0,2,0,0,0,0|2,0,0]=4 4441 B8R0.29 CC(=O)CCS(=O)(=O)C MCULE-3749048069 [0,2,0,0,0,0|2,0,0]=4 4442 B8R0.29 CC(=O)CNC(C)(C)C MCULE-4059953007 [0,2,0,0,0,0|2,0,0]=4 4443 B8R0.29 CC(=O)CNC(C)(C)C MCULE-9982398249 [0,2,0,0,0,0|2,0,0]=4 4444 B8R0.29 CC(=O)COC(C)(C)C MCULE-1842651618 [0,2,0,0,0,0|2,0,0]=4 4445 B8R0.29 CC(=O)COS(=O)(=O)C MCULE-9016144725 [0,2,0,0,0,0|1,0,1]=4 4446 B8R0.29 CC(=O)CSC(C)(C)C MCULE-8055514434 [0,2,0,0,0,0|2,0,0]=4 4447 B8R0.29 CC(=O)OCC(Cl)(Cl)Cl MCULE-4813272079 [0,2,0,0,0,0|1,0,0]=3 4448 B8R0.29 CC(=O)OCC(F)(F)F MCULE-5284489738 [0,2,0,0,0,0|1,0,0]=3 4449 B8R0.29 CC(=O)OC[B-](F)(F)F MCULE-6082277304 [0,2,0,0,0,0|2,0,0]=4 4450 B8R0.29 CC(=O)OC[B-](F)(F)F MCULE-6414091668 [0,2,0,0,0,0|2,0,0]=4 4451 B8R0.29 CC(=O)OC[Si](C)(C)C MCULE-2980282217 [0,2,0,0,0,0|0,1,0]=3 4452 B8R0.29 CC(=O)ONC(C)(C)C MCULE-1992189414 [0,2,0,0,0,0|1,0,0]=3 4453 B8R0.29 CC(=O)ONC(C)(C)C MCULE-5238660928 [0,2,0,0,0,0|1,0,0]=3 4454 B8R0.29 CC(Br)CO[Si](C)(C)C MCULE-7486182158 [0,2,0,0,0,0|1,1,0]=4 4455 B8R0.29 CC(C)(C)CCC(=O)O MCULE-8929874481 [0,2,0,0,0,0|2,0,0]=4 4456 B8R0.29 CC(C)(C)CNC(=O)N MCULE-1062244536 [0,2,0,0,0,0|2,0,0]=4 4457 B8R0.29 CC(C)(C)COC(=O)Cl MCULE-8215596189 [0,2,0,0,0,0|1,0,0]=3 4458 B8R0.29 CC(C)(N)CCC(=O)O MCULE-1195501366 [0,2,0,0,0,0|2,0,0]=4 4459 B8R0.29 CC(C)(N)CCC(=O)O MCULE-3901764815 [0,2,0,0,0,0|2,0,0]=4 4460 B8R0.29 CC(C)(N)CNC(=O)N MCULE-6198119290 [0,2,0,0,0,0|2,0,0]=4 4461 B8R0.29 CC(C)(N)CNC(=O)N MCULE-9211662894 [0,2,0,0,0,0|2,0,0]=4 4462 B8R0.29 CC(C)(O)CCC(=O)[O-] MCULE-1599861039 [0,2,0,0,0,0|2,0,0]=4 4463 B8R0.29 CC(C)(O)CCC(=O)[O-] MCULE-4576125997 [0,2,0,0,0,0|2,0,0]=4 4464 B8R0.29 CC(C)(O)CCC(=O)[O-] MCULE-9770985354 [0,2,0,0,0,0|2,0,0]=4 4465 B8R0.29 CC(C)(S)CCC(=O)O MCULE-7771494478 [0,2,0,0,0,0|2,0,0]=4 4466 B8R0.29 CC(C)CNS(=O)(=O)C MCULE-5073468949 [0,2,0,0,0,0|2,0,0]=4 4467 B8R0.29 CC(C)COC(C)(C)C MCULE-8537560104 [0,2,0,0,0,0|1,0,1]=4 4468 B8R0.29 CC(C)COS(=O)(=O)C MCULE-9403792571 [0,2,0,0,0,0|1,0,0]=3 4469 B8R0.29 CC(C)OCC(C)(C)N MCULE-4038447909 [0,2,0,0,0,0|1,0,1]=4 4470 B8R0.29 CC(C)OCC(C)(C)N MCULE-4860356722 [0,2,0,0,0,0|1,0,1]=4 4471 B8R0.29 CC(F)(F)CCC(=O)O MCULE-6694097155 [0,2,0,0,0,0|2,0,0]=4 4472 B8R0.29 CC(F)(F)COC(=O)Cl MCULE-7630962366 [0,2,0,0,0,0|1,0,0]=3 4473 B8R0.29 CC(N)CCS(=O)(=O)C MCULE-1699976156 [0,2,0,0,0,0|2,0,0]=4 4474 B8R0.29 CC(N)COS(=O)(=O)O MCULE-2792477868 [0,2,0,0,0,0|2,0,0]=4 4475 B8R0.29 CC(O)CCS(=O)(=O)C MCULE-4963897023 [0,2,0,0,0,0|2,0,0]=4 4476 B8R0.29 CC(O)CNS(=O)(=O)C MCULE-5781741609 [0,2,0,0,0,0|2,0,0]=4 4477 B8R0.29 CC(O)COC(C)(C)C MCULE-1266093393 [0,2,0,0,0,0|1,0,1]=4 4478 B8R0.29 CS(=O)(=O)OCC(F)F MCULE-7890585497 [0,2,0,0,0,0|2,0,0]=4 4479 B8R0.29 C[C@@H](N)COC(C)(C)C MCULE-7985925969 [0,2,0,0,0,0|1,0,1]=4 4480 B8R0.29 C[C@@H](O)CNS(=O)(=O)C MCULE-1338093262 [0,2,0,0,0,0|2,0,0]=4 4481 B8R0.29 C[C@@H](O)COC(C)(C)C MCULE-4985771313 [0,2,0,0,0,0|1,0,1]=4 4482 B8R0.29 NC(=O)OCC(F)(F)F MCULE-7154769234 [0,2,0,0,0,0|2,0,0]=4 4483 B8R0.29 O=C(Cl)OCC(Cl)(Cl)Cl MCULE-9945642167 [0,2,0,0,0,0|2,0,0]=4 4484 B8R0.29 O=C(Cl)OCC(F)(F)F MCULE-8565966972 [0,2,0,0,0,0|2,0,0]=4 4485 B8R0.29 [C@H](C)(O)COC(C)(C)C MCULE-6966087832 [0,2,0,0,0,0|1,0,1]=4 4486 B6R1.2 BrC1=CCCC1 MCULE-1008379150 [1,0,0,1,0,0|1,0,1]=4 4487 B6R1.2 BrC1CCCC1 MCULE-9383923023 [1,0,0,1,0,0|1,0,1]=4 4488 B6R1.2 C=C1CCCC1 MCULE-4115373196 [1,0,0,1,0,0|1,0,0]=3 4489 B6R1.2 C=C1CCNC1 MCULE-7982953073 [1,0,0,1,0,0|2,0,0]=4 4490 B6R1.2 C=C1CCNC1 MCULE-8428731599 [1,0,0,1,0,0|2,0,0]=4 4491 B6R1.2 C=C1CCSC1 MCULE-7042571473 [1,0,0,1,0,0|2,0,0]=4 4492 B6R1.2 CC1=CCCC1 MCULE-8508688474 [1,0,0,1,0,0|1,0,0]=3 4493 B6R1.2 CC1=CCCO1 MCULE-7276659214 [1,0,0,1,0,0|1,0,0]=3 4494 B6R1.2 CC1=CCNC1 MCULE-5892113847 [1,0,0,1,0,0|2,0,0]=4 4495 B6R1.2 CC1=CCNC1 MCULE-9225220351 [1,0,0,1,0,0|2,0,0]=4 4496 B6R1.2 CC1=NCCC1 MCULE-5009170423 [1,0,0,1,0,0|1,0,0]=3 4497 B6R1.2 CC1=NCCN1 MCULE-4787238872 [1,0,0,1,0,0|2,0,0]=4 4498 B6R1.2 CC1=NCCO1 MCULE-8564633040 [1,0,0,1,0,0|1,0,0]=3 4499 B6R1.2 CC1=NCCS1 MCULE-1701303405 [1,0,0,1,0,0|1,1,0]=4 4500 B6R1.2 CC1=NNCC1 MCULE-1758510182 [1,0,0,1,0,0|2,0,0]=4 4501 B6R1.2 CC1CCCC1 MCULE-4702116068 [1,0,0,1,0,0|1,0,1]=4 4502 B6R1.2 CC1CCCN1 MCULE-4853624560 [1,0,0,1,0,0|1,0,1]=4 4503 B6R1.2 CC1CCCN1 MCULE-5939948024 [1,0,0,1,0,0|1,0,1]=4 4504 B6R1.2 CC1CCCN1 MCULE-6020011445 [1,0,0,1,0,0|1,0,1]=4 4505 B6R1.2 CC1CCCN1 MCULE-7855346849 [1,0,0,1,0,0|1,0,1]=4 4506 B6R1.2 CC1CCCO1 MCULE-2526138687 [1,0,0,1,0,0|0,0,2]=4 4507 B6R1.2 CC1CCCS1 MCULE-8372499972 [1,0,0,1,0,0|0,1,1]=4 4508 B6R1.2 CC1OCCO1 MCULE-2943809591 [1,0,0,1,0,0|0,0,2]=4 4509 B6R1.2 CN1CCCC1 MCULE-5387702231 [1,0,0,1,0,0|2,0,0]=4 4510 B6R1.2 C[C@@H]1CCCN1 MCULE-1038329474 [1,0,0,1,0,0|1,0,1]=4 4511 B6R1.2 C[C@@H]1CCCN1 MCULE-1829999308 [1,0,0,1,0,0|1,0,1]=4 4512 B6R1.2 C[C@@H]1CCCN1 MCULE-8644278041 [1,0,0,1,0,0|1,0,1]=4 4513 B6R1.2 C[C@@H]1CCCN1 MCULE-9243990647 [1,0,0,1,0,0|1,0,1]=4 4514 B6R1.2 C[C@H]1CCCN1 MCULE-2078024663 [1,0,0,1,0,0|1,0,1]=4 4515 B6R1.2 C[C@H]1CCCN1 MCULE-3113877345 [1,0,0,1,0,0|1,0,1]=4 4516 B6R1.2 C[C@H]1CCCN1 MCULE-3426869473 [1,0,0,1,0,0|1,0,1]=4 4517 B6R1.2 C[C@H]1CCCN1 MCULE-5093266679 [1,0,0,1,0,0|1,0,1]=4 4518 B6R1.2 C[S+]1CCCC1 MCULE-6294888335 [1,0,0,1,0,0|2,0,0]=4 4519 B6R1.2 C[S+]1CCCC1 MCULE-8432227262 [1,0,0,1,0,0|2,0,0]=4 4520 B6R1.2 ClC1=CCCC1 MCULE-7680993065 [1,0,0,1,0,0|1,0,1]=4 4521 B6R1.2 ClC1CCCC1 MCULE-3285928655 [1,0,0,1,0,0|1,0,1]=4 4522 B6R1.2 FC1CCCC1 MCULE-1416016970 [1,0,0,1,0,0|1,0,1]=4 4523 B6R1.2 IC1=CCCC1 MCULE-5953451970 [1,0,0,1,0,0|1,0,1]=4 4524 B6R1.2 IC1CCCC1 MCULE-2705379744 [1,0,0,1,0,0|1,0,1]=4 4525 B6R1.2 N=C1CCCS1 MCULE-4228855265 [1,0,0,1,0,0|1,1,0]=4 4526 B6R1.2 N=C1CCCS1 MCULE-7496124035 [1,0,0,1,0,0|1,1,0]=4 4527 B6R1.2 NC1=NCCC1 MCULE-6089369366 [1,0,0,1,0,0|2,0,0]=4 4528 B6R1.2 NC1=NCCC1 MCULE-8979618464 [1,0,0,1,0,0|2,0,0]=4 4529 B6R1.2 NC1=NCCO1 MCULE-1257431295 [1,0,0,1,0,0|2,0,0]=4 4530 B6R1.2 NC1=NCCO1 MCULE-9912511107 [1,0,0,1,0,0|2,0,0]=4 4531 B6R1.2 NC1CCCC1 MCULE-2292038009 [1,0,0,1,0,0|1,0,1]=4 4532 B6R1.2 NN1CCCC1 MCULE-1562593919 [1,0,0,1,0,0|2,0,0]=4 4533 B6R1.2 NN1CCCC1 MCULE-2311855036 [1,0,0,1,0,0|2,0,0]=4 4534 B6R1.2 NN1CCCC1 MCULE-5484008222 [1,0,0,1,0,0|2,0,0]=4 4535 B6R1.2 O=C1C=CCC1 MCULE-1844779047 [1,0,0,1,0,0|0,0,2]=4 4536 B6R1.2 O=C1C=CCO1 MCULE-4296503663 [1,0,0,1,0,0|0,0,2]=4 4537 B6R1.2 O=C1CC=CC1 MCULE-7606670114 [1,0,0,1,0,0|0,0,2]=4 4538 B6R1.2 O=C1CCCC1 MCULE-9455227735 [1,0,0,1,0,0|0,0,0]=2 4539 B6R1.2 O=C1CCCN1 MCULE-3061780794 [1,0,0,1,0,0|1,0,0]=3 4540 B6R1.2 O=C1CCCO1 MCULE-6795890265 [1,0,0,1,0,0|0,0,0]=2 4541 B6R1.2 O=C1CCCS1 MCULE-5361654550 [1,0,0,1,0,0|0,1,0]=3 4542 B6R1.2 O=C1CCNC1 MCULE-2947789259 [1,0,0,1,0,0|1,0,0]=3 4543 B6R1.2 O=C1CCNC1 MCULE-7192595052 [1,0,0,1,0,0|1,0,0]=3 4544 B6R1.2 O=C1CCNN1 MCULE-7030953666 [1,0,0,1,0,0|2,0,0]=4 4545 B6R1.2 O=C1CCOC1 MCULE-2031733910 [1,0,0,1,0,0|1,0,0]=3 4546 B6R1.2 O=C1CCON1 MCULE-6799359324 [1,0,0,1,0,0|2,0,0]=4 4547 B6R1.2 O=C1CCSC1 MCULE-2059655624 [1,0,0,1,0,0|1,0,0]=3 4548 B6R1.2 O=C1CC[NH2+]N1 MCULE-5327505055 [1,0,0,1,0,0|2,0,0]=4 4549 B6R1.2 O=C1CNCN1 MCULE-2645891847 [1,0,0,1,0,0|2,0,0]=4 4550 B6R1.2 O=C1CNCN1 MCULE-9269137129 [1,0,0,1,0,0|2,0,0]=4 4551 B6R1.2 O=C1CSCN1 MCULE-3946660854 [1,0,0,1,0,0|2,0,0]=4 4552 B6R1.2 O=C1NCCN1 MCULE-9806791551 [1,0,0,1,0,0|2,0,0]=4 4553 B6R1.2 O=C1NCCO1 MCULE-3934923008 [1,0,0,1,0,0|1,0,0]=3 4554 B6R1.2 O=C1NCCS1 MCULE-6732478086 [1,0,0,1,0,0|1,1,0]=4 4555 B6R1.2 O=C1OCCO1 MCULE-9493253045 [1,0,0,1,0,0|1,0,0]=3 4556 B6R1.2 O=S1CCCC1 MCULE-2442126780 [1,0,0,1,0,0|1,0,0]=3 4557 B6R1.2 O=S1OCCO1 MCULE-5773173321 [1,0,0,1,0,0|2,0,0]=4 4558 B6R1.2 OC1CCCC1 MCULE-1758440264 [1,0,0,1,0,0|0,0,2]=4 4559 B6R1.2 OC1CCCO1 MCULE-9632627344 [1,0,0,1,0,0|0,0,2]=4 4560 B6R1.2 P1(=O)OCCO1 MCULE-3753821837 [1,0,0,1,0,0|2,0,0]=4 4561 B6R1.2 S=C1CCCN1 MCULE-1089290822 [1,0,0,1,0,0|1,1,0]=4 4562 B6R1.2 SC1=NCCO1 MCULE-6684545723 [1,0,0,1,0,0|1,1,0]=4 4563 B6R1.2 SC1CCCC1 MCULE-5932400506 [1,0,0,1,0,0|0,1,1]=4 4564 B6R1.3 CCCC1CO1 MCULE-5080039224 [1,0,0,1,0,0|0,0,2]=4 4565 B6R1.3 CCC[C@@H]1CO1 MCULE-1815222100 [1,0,0,1,0,0|0,0,2]=4 4566 B6R1.3 CCC[C@H]1CO1 MCULE-9952368131 [1,0,0,1,0,0|0,0,2]=4 4567 B6R1.5 C=C1CC(=O)O1 MCULE-7149487095 [1,0,0,1,0,0|0,0,2]=4 4568 B6R1.5 C=C1CC(C1)N MCULE-4635717695 [1,0,0,1,0,0|2,0,0]=4 4569 B6R1.5 C=C1CC(C1)N MCULE-6992894696 [1,0,0,1,0,0|2,0,0]=4 4570 B6R1.5 CC1CC(=O)C1 MCULE-2159393653 [1,0,0,1,0,0|0,0,0]=2 4571 B6R1.5 CC1CC(=O)N1 MCULE-6139592633 [1,0,0,1,0,0|1,0,0]=3 4572 B6R1.5 CC1CC(=O)O1 MCULE-9285847382 [1,0,0,1,0,0|0,0,0]=2 4573 B6R1.5 CC1CC(C1)N MCULE-5323299846 [1,0,0,1,0,0|1,0,1]=4 4574 B6R1.5 CC1CC(C1)N MCULE-9940885824 [1,0,0,1,0,0|1,0,1]=4 4575 B6R1.5 CC1CC(C1)O MCULE-8612661286 [1,0,0,1,0,0|0,0,2]=4 4576 B6R1.5 CC1CC(N1)C MCULE-2112479012 [1,0,0,1,0,0|1,0,1]=4 4577 B6R1.5 CC1CC(N1)C MCULE-4224653730 [1,0,0,1,0,0|1,0,1]=4 4578 B6R1.5 CN1CC(=O)C1 MCULE-1685267969 [1,0,0,1,0,0|1,0,0]=3 4579 B6R1.5 CN1CC(=O)C1 MCULE-2242594777 [1,0,0,1,0,0|1,0,0]=3 4580 B6R1.5 C[C@@H]1CC(=O)O1 MCULE-3257475519 [1,0,0,1,0,0|0,0,0]=2 4581 B6R1.5 C[C@@H]1C[C@H](N1)C MCULE-1994890312 [1,0,0,1,0,0|1,0,1]=4 4582 B6R1.5 C[C@@H]1C[C@H](N1)C MCULE-7235151096 [1,0,0,1,0,0|1,0,1]=4 4583 B6R1.5 C[C@H]1C[C@@H](C1)N MCULE-1535311916 [1,0,0,1,0,0|1,0,1]=4 4584 B6R1.5 C[C@H]1C[C@@H](C1)N MCULE-2831484375 [1,0,0,1,0,0|1,0,1]=4 4585 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-4062075526 [1,0,0,1,0,0|1,0,1]=4 4586 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-8779826872 [1,0,0,1,0,0|1,0,1]=4 4587 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-9842353775 [1,0,0,1,0,0|1,0,1]=4 4588 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-9945333960 [1,0,0,1,0,0|1,0,1]=4 4589 B6R1.5 C[C@H]1C[C@H](C1)N MCULE-7323273959 [1,0,0,1,0,0|1,0,1]=4 4590 B6R1.5 C[C@H]1C[C@H](C1)N MCULE-9517005721 [1,0,0,1,0,0|1,0,1]=4 4591 B6R1.5 C[C@H]1C[C@H](C1)O MCULE-9757332081 [1,0,0,1,0,0|0,0,2]=4 4592 B6R1.5 C[C@H]1C[C@H](N1)C MCULE-1014047015 [1,0,0,1,0,0|1,0,1]=4 4593 B6R1.5 C[C@H]1C[C@H](N1)C MCULE-9280852387 [1,0,0,1,0,0|1,0,1]=4 4594 B6R1.5 NC1CC(=O)C1 MCULE-3450860282 [1,0,0,1,0,0|1,0,0]=3 4595 B6R1.5 NC1CC(=O)C1 MCULE-5974961836 [1,0,0,1,0,0|1,0,0]=3 4596 B6R1.5 O=C1CC(C1)Br MCULE-1715982282 [1,0,0,1,0,0|1,0,0]=3 4597 B6R1.5 O=C1CC(C1)F MCULE-2541516698 [1,0,0,1,0,0|1,0,0]=3 4598 B6R1.5 O=C1CC(C1)O MCULE-7099112258 [1,0,0,1,0,0|1,0,0]=3 4599 B6R1.8 C=C1CC1CO MCULE-4338601055 [1,0,0,1,0,0|2,0,0]=4 4600 B6R1.8 CCC1CC1N MCULE-6304873051 [1,0,0,1,0,0|1,0,1]=4 4601 B6R1.8 CC[C@@H]1C[C@@H]1N MCULE-9218626187 [1,0,0,1,0,0|1,0,1]=4 4602 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-5365117215 [1,0,0,1,0,0|1,0,1]=4 4603 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-9993971387 [1,0,0,1,0,0|1,0,1]=4 4604 B6R1.8 CC[C@H]1C[C@@H]1N MCULE-5971477946 [1,0,0,1,0,0|1,0,1]=4 4605 B6R1.8 CC[C@H]1C[C@H]1N MCULE-4387456908 [1,0,0,1,0,0|1,0,1]=4 4606 B6R1.9 CC1CC1(C)N MCULE-2748884505 [1,0,0,1,0,0|1,0,1]=4 4607 B6R1.9 CC1CC1(C)N MCULE-6309103404 [1,0,0,1,0,0|1,0,1]=4 4608 B6R1.9 CC1OC1(C)C MCULE-6556425885 [1,0,0,1,0,0|1,0,1]=4 4609 B6R1.10 CC1(CCC1)N MCULE-1932351179 [1,0,0,1,0,0|1,0,1]=4 4610 B6R1.10 CC1(CCC1)N MCULE-9177696302 [1,0,0,1,0,0|1,0,1]=4 4611 B6R1.10 CC1(CCC1)O MCULE-4021675717 [1,0,0,1,0,0|0,0,2]=4 4612 B6R1.10 C[Si]1(CCC1)C MCULE-9944003023 [1,0,0,1,0,0|1,1,0]=4 4613 B6R1.10 C[Si]1(CCC1)Cl MCULE-2261277636 [1,0,0,1,0,0|1,1,0]=4 4614 B6R1.10 N=S1(=O)CCC1 MCULE-7690864417 [1,0,0,1,0,0|2,0,0]=4 4615 B6R1.10 O=S1(=O)CCC1 MCULE-7796411172 [1,0,0,1,0,0|2,0,0]=4 4616 B6R1.11 C=C(C)C1CO1 MCULE-3656533343 [1,0,0,1,0,0|2,0,0]=4 4617 B6R1.11 CC(=O)C1CC1 MCULE-3846146416 [1,0,0,1,0,0|0,0,0]=2 4618 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [1,0,0,1,0,0|1,0,0]=3 4619 B6R1.11 CC(Cl)C1CC1 MCULE-7361335709 [1,0,0,1,0,0|1,0,1]=4 4620 B6R1.11 CC(N)C1CC1 MCULE-2052303800 [1,0,0,1,0,0|1,0,1]=4 4621 B6R1.11 CC(N)C1CC1 MCULE-3007763115 [1,0,0,1,0,0|1,0,1]=4 4622 B6R1.11 CC(N)C1CC1 MCULE-3459276996 [1,0,0,1,0,0|1,0,1]=4 4623 B6R1.11 CC(N)C1CC1 MCULE-6761961556 [1,0,0,1,0,0|1,0,1]=4 4624 B6R1.11 CC(O)C1CC1 MCULE-8628810684 [1,0,0,1,0,0|0,0,2]=4 4625 B6R1.11 CN(C)C1CC1 MCULE-5891640069 [1,0,0,1,0,0|2,0,0]=4 4626 B6R1.11 CN(C)C1CC1 MCULE-6751529979 [1,0,0,1,0,0|2,0,0]=4 4627 B6R1.11 CN(N)C1CC1 MCULE-4590166937 [1,0,0,1,0,0|2,0,0]=4 4628 B6R1.11 CN(N)C1CC1 MCULE-7317282450 [1,0,0,1,0,0|2,0,0]=4 4629 B6R1.11 C[C@@H](N)C1CC1 MCULE-2097889079 [1,0,0,1,0,0|1,0,1]=4 4630 B6R1.11 C[C@@H](N)C1CC1 MCULE-3667125695 [1,0,0,1,0,0|1,0,1]=4 4631 B6R1.11 C[C@@H](N)C1CC1 MCULE-4529741221 [1,0,0,1,0,0|1,0,1]=4 4632 B6R1.11 C[C@@H](N)C1CC1 MCULE-4996656085 [1,0,0,1,0,0|1,0,1]=4 4633 B6R1.11 C[C@@H](O)C1CC1 MCULE-8359847821 [1,0,0,1,0,0|0,0,2]=4 4634 B6R1.11 C[C@H](N)C1CC1 MCULE-5080052640 [1,0,0,1,0,0|1,0,1]=4 4635 B6R1.11 C[C@H](N)C1CC1 MCULE-8331040870 [1,0,0,1,0,0|1,0,1]=4 4636 B6R1.11 C[C@H](N)C1CC1 MCULE-8367240790 [1,0,0,1,0,0|1,0,1]=4 4637 B6R1.11 C[C@H](N)C1CC1 MCULE-8726268701 [1,0,0,1,0,0|1,0,1]=4 4638 B6R1.11 C[C@H](O)C1CC1 MCULE-2458075152 [1,0,0,1,0,0|0,0,2]=4 4639 B6R1.11 N=C(N)C1CC1 MCULE-1244673727 [1,0,0,1,0,0|2,0,0]=4 4640 B6R1.11 N=C(N)C1CC1 MCULE-2494860413 [1,0,0,1,0,0|2,0,0]=4 4641 B6R1.11 NC(=O)C1CC1 MCULE-9911054913 [1,0,0,1,0,0|1,0,0]=3 4642 B6R1.11 NC(=O)C1CO1 MCULE-6911744868 [1,0,0,1,0,0|2,0,0]=4 4643 B6R1.11 NC(=S)C1CC1 MCULE-7304936539 [1,0,0,1,0,0|1,1,0]=4 4644 B6R1.11 O=C(Cl)C1CC1 MCULE-8675746452 [1,0,0,1,0,0|1,0,0]=3 4645 B6R1.11 O=C(O)C1CC1 MCULE-4677373694 [1,0,0,1,0,0|1,0,0]=3 4646 B6R1.11 O=C(O)C1CN1 MCULE-3236125597 [1,0,0,1,0,0|2,0,0]=4 4647 B6R1.11 O=C(O)C1CO1 MCULE-2152916793 [1,0,0,1,0,0|2,0,0]=4 4648 B6R1.11 O=C(O)[C@@H]1CN1 MCULE-4363753412 [1,0,0,1,0,0|2,0,0]=4 4649 B6R1.11 O=C(O)[C@H]1CN1 MCULE-4830347195 [1,0,0,1,0,0|2,0,0]=4 4650 B6R1.11 O=C(O)[C@H]1CO1 MCULE-5204459723 [1,0,0,1,0,0|2,0,0]=4 4651 B6R1.11 O=C(O)[C@H]1CO1 MCULE-6983707093 [1,0,0,1,0,0|2,0,0]=4 4652 B6R1.11 O=C([O-])C1CN1 MCULE-6490437892 [1,0,0,1,0,0|2,0,0]=4 4653 B6R1.11 O=C([O-])C1CO1 MCULE-4586459966 [1,0,0,1,0,0|2,0,0]=4 4654 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1647975669 [1,0,0,1,0,0|2,0,0]=4 4655 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1906997950 [1,0,0,1,0,0|2,0,0]=4 4656 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-4899800766 [1,0,0,1,0,0|2,0,0]=4 4657 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-9148170094 [1,0,0,1,0,0|2,0,0]=4 4658 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-6663734494 [1,0,0,1,0,0|2,0,0]=4 4659 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-8580451361 [1,0,0,1,0,0|2,0,0]=4 4660 B6R1.11 O=S(O)C1CC1 MCULE-1616243918 [1,0,0,1,0,0|2,0,0]=4 4661 B6R1.11 O=S([O-])C1CC1 MCULE-9446364072 [1,0,0,1,0,0|2,0,0]=4 4662 B6R1.1 C1=CCCCC1 MCULE-3564016252 [1,0,0,1,0,0|1,0,0]=3 4663 B6R1.1 C1=CCNCC1 MCULE-4850984502 [1,0,0,1,0,0|2,0,0]=4 4664 B6R1.1 C1=CCNCC1 MCULE-9744767398 [1,0,0,1,0,0|2,0,0]=4 4665 B6R1.1 C1=CCOCC1 MCULE-7723901693 [1,0,0,1,0,0|2,0,0]=4 4666 B6R1.1 C1=COCCC1 MCULE-1260841717 [1,0,0,1,0,0|0,0,1]=3 4667 B6R1.1 C1=COCCO1 MCULE-2562788031 [1,0,0,1,0,0|1,0,1]=4 4668 B6R1.1 C1=COCOC1 MCULE-9916358884 [1,0,0,1,0,0|1,0,1]=4 4669 B6R1.1 C1=NCCCC1 MCULE-7101012273 [1,0,0,1,0,0|1,0,0]=3 4670 B6R1.1 C1=NCCCN1 MCULE-8199642953 [1,0,0,1,0,0|2,0,0]=4 4671 B6R1.1 C1CCCCC1 MCULE-3136361765 [1,0,0,1,0,0|1,0,1]=4 4672 B6R1.1 C1CCNCC1 MCULE-4094049864 [1,0,0,1,0,0|1,0,1]=4 4673 B6R1.1 C1CCNNC1 MCULE-6440414301 [1,0,0,1,0,0|2,0,0]=4 4674 B6R1.1 C1CCNNC1 MCULE-6764314654 [1,0,0,1,0,0|2,0,0]=4 4675 B6R1.1 C1CCOCC1 MCULE-6904583049 [1,0,0,1,0,0|0,0,1]=3 4676 B6R1.1 C1CCONC1 MCULE-4106728300 [1,0,0,1,0,0|1,0,0]=3 4677 B6R1.1 C1CCONC1 MCULE-7653057344 [1,0,0,1,0,0|1,0,0]=3 4678 B6R1.1 C1CCSCC1 MCULE-5775966946 [1,0,0,1,0,0|0,1,1]=4 4679 B6R1.1 C1CNCOC1 MCULE-7862832103 [1,0,0,1,0,0|1,0,1]=4 4680 B6R1.1 C1COCCN1 MCULE-2533030492 [1,0,0,1,0,0|1,0,1]=4 4681 B6R1.1 C1COCCN1 MCULE-4684386765 [1,0,0,1,0,0|1,0,1]=4 4682 B6R1.1 C1COCCN1 MCULE-8040983584 [1,0,0,1,0,0|1,0,1]=4 4683 B6R1.1 C1COCCO1 MCULE-5088019198 [1,0,0,1,0,0|1,0,1]=4 4684 B6R1.1 C1COCC[NH2+]1 MCULE-5238323153 [1,0,0,1,0,0|1,0,1]=4 4685 B6R1.1 C1COCOC1 MCULE-3698539550 [1,0,0,1,0,0|0,0,2]=4 4686 B6R1.1 C1CSCCO1 MCULE-5803800470 [1,0,0,1,0,0|1,0,1]=4 4687 B6R1.4 CC1CCC1=O MCULE-4548181715 [1,0,0,1,0,0|1,0,0]=3 4688 B6R1.4 CC1CNC1=O MCULE-5523309752 [1,0,0,1,0,0|1,0,0]=3 4689 B6R1.4 CC1CNC1C MCULE-6217110869 [1,0,0,1,0,0|1,0,1]=4 4690 B6R1.4 CC1CNC1C MCULE-8966220604 [1,0,0,1,0,0|1,0,1]=4 4691 B6R1.4 CC1COC1=O MCULE-9711165188 [1,0,0,1,0,0|0,0,0]=2 4692 B6R1.4 CC1OCC1=O MCULE-7718609686 [1,0,0,1,0,0|2,0,0]=4 4693 B6R1.4 CC1OCC1O MCULE-1893283492 [1,0,0,1,0,0|1,0,1]=4 4694 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-5099590573 [1,0,0,1,0,0|1,0,1]=4 4695 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-6754257002 [1,0,0,1,0,0|1,0,1]=4 4696 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-7084262632 [1,0,0,1,0,0|1,0,1]=4 4697 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-9147724667 [1,0,0,1,0,0|1,0,1]=4 4698 B6R1.4 NC1CCC1=O MCULE-3868209809 [1,0,0,1,0,0|2,0,0]=4 4699 B6R1.4 NC1CCC1=O MCULE-9741389143 [1,0,0,1,0,0|2,0,0]=4 4700 B6R1.4 NC1CNC1=O MCULE-2761616663 [1,0,0,1,0,0|2,0,0]=4 4701 B6R1.4 NC1CNC1=O MCULE-3021306383 [1,0,0,1,0,0|2,0,0]=4 4702 B6R1.4 NC1CNC1=O MCULE-3943057121 [1,0,0,1,0,0|2,0,0]=4 4703 B6R1.4 NC1COC1=O MCULE-6998565452 [1,0,0,1,0,0|1,0,0]=3 4704 B6R1.4 N[C@@H]1CNC1=O MCULE-3645662662 [1,0,0,1,0,0|2,0,0]=4 4705 B6R1.4 N[C@@H]1CNC1=O MCULE-4399212271 [1,0,0,1,0,0|2,0,0]=4 4706 B6R1.4 N[C@@H]1CNC1=O MCULE-6332076219 [1,0,0,1,0,0|2,0,0]=4 4707 B6R1.4 N[C@@H]1CNC1=O MCULE-6365012530 [1,0,0,1,0,0|2,0,0]=4 4708 B6R1.4 N[C@@H]1COC1=O MCULE-8080548213 [1,0,0,1,0,0|1,0,0]=3 4709 B6R1.4 N[C@@H]1COC1=O MCULE-9370092691 [1,0,0,1,0,0|1,0,0]=3 4710 B6R1.4 N[C@H]1CNC1=O MCULE-2792436534 [1,0,0,1,0,0|2,0,0]=4 4711 B6R1.4 N[C@H]1CNC1=O MCULE-6881316562 [1,0,0,1,0,0|2,0,0]=4 4712 B6R1.4 N[C@H]1CNC1=O MCULE-8864053661 [1,0,0,1,0,0|2,0,0]=4 4713 B6R1.4 N[C@H]1CNC1=O MCULE-9014449253 [1,0,0,1,0,0|2,0,0]=4 4714 B6R1.4 N[C@H]1COC1=O MCULE-4812631526 [1,0,0,1,0,0|1,0,0]=3 4715 B6R1.4 O=C1CCC1Br MCULE-1088592133 [1,0,0,1,0,0|2,0,0]=4 4716 B6R1.4 O=C1CCC1F MCULE-6197375881 [1,0,0,1,0,0|2,0,0]=4 4717 B6R1.4 O=C1CCC1O MCULE-1248327203 [1,0,0,1,0,0|2,0,0]=4 4718 B6R1.4 O=C1CC[C@@H]1Br MCULE-3455449754 [1,0,0,1,0,0|2,0,0]=4 4719 B6R1.4 [C@@H]1(COC1=O)N MCULE-7456320845 [1,0,0,1,0,0|1,0,0]=3 4720 B6R1.6 BrCC1CCO1 MCULE-8997197221 [1,0,0,1,0,0|1,0,1]=4 4721 B6R1.6 BrC[C@@H]1CCO1 MCULE-5332541596 [1,0,0,1,0,0|1,0,1]=4 4722 B6R1.6 BrC[C@H]1CCO1 MCULE-4327725094 [1,0,0,1,0,0|1,0,1]=4 4723 B6R1.6 BrC[C@H]1CCO1 MCULE-5319595119 [1,0,0,1,0,0|1,0,1]=4 4724 B6R1.6 CCC1CCN1 MCULE-2791335818 [1,0,0,1,0,0|1,0,1]=4 4725 B6R1.6 CCC1CCN1 MCULE-3929810240 [1,0,0,1,0,0|1,0,1]=4 4726 B6R1.6 CCC1CNC1 MCULE-5314495230 [1,0,0,1,0,0|2,0,0]=4 4727 B6R1.6 CCC1CNC1 MCULE-6675770601 [1,0,0,1,0,0|2,0,0]=4 4728 B6R1.6 CNC1CCC1 MCULE-1364608179 [1,0,0,1,0,0|2,0,0]=4 4729 B6R1.6 CNC1CCC1 MCULE-2951993315 [1,0,0,1,0,0|2,0,0]=4 4730 B6R1.6 ClCC1CCO1 MCULE-3809712491 [1,0,0,1,0,0|1,0,1]=4 4731 B6R1.6 ICC1CCO1 MCULE-4132798336 [1,0,0,1,0,0|1,0,1]=4 4732 B6R1.6 NCC1CCO1 MCULE-4478591600 [1,0,0,1,0,0|1,0,1]=4 4733 B6R1.6 NC[C@@H]1CCO1 MCULE-2375359339 [1,0,0,1,0,0|1,0,1]=4 4734 B6R1.6 NC[C@@H]1CCO1 MCULE-4004256578 [1,0,0,1,0,0|1,0,1]=4 4735 B6R1.6 NC[C@H]1CCO1 MCULE-2811111103 [1,0,0,1,0,0|1,0,1]=4 4736 B6R1.6 NC[C@H]1CCO1 MCULE-4329808216 [1,0,0,1,0,0|1,0,1]=4 4737 B6R1.6 NC[C@H]1CCO1 MCULE-9974781002 [1,0,0,1,0,0|1,0,1]=4 4738 B6R1.6 O=CC1CCC1 MCULE-8678026416 [1,0,0,1,0,0|1,0,0]=3 4739 B6R1.6 O=CC1COC1 MCULE-3773699476 [1,0,0,1,0,0|2,0,0]=4 4740 B6R1.6 O=CC1CSC1 MCULE-2648443908 [1,0,0,1,0,0|2,0,0]=4 4741 B6R1.6 OCC1CCO1 MCULE-7120761203 [1,0,0,1,0,0|1,0,1]=4 4742 B6R1.6 OCC1CCO1 MCULE-7517577386 [1,0,0,1,0,0|1,0,1]=4 4743 B6R1.6 OC[C@@H]1CCO1 MCULE-7613449097 [1,0,0,1,0,0|1,0,1]=4 4744 B6R1.6 OC[C@@H]1CCO1 MCULE-9444003682 [1,0,0,1,0,0|1,0,1]=4 4745 B6R1.6 OC[C@H]1CCO1 MCULE-1446169257 [1,0,0,1,0,0|1,0,1]=4 4746 B6R1.6 OC[C@H]1CCO1 MCULE-2929052431 [1,0,0,1,0,0|1,0,1]=4 4747 B8R1.1 C#CC1COC(=O)N1 MCULE-7019791209 [0,1,0,1,0,0|1,0,1]=4 4748 B8R1.1 C#C[C@@H]1COC(=O)N1 MCULE-3103635703 [0,1,0,1,0,0|1,0,1]=4 4749 B8R1.1 C#C[C@@H]1COC(=O)N1 MCULE-7796064143 [0,1,0,1,0,0|1,0,1]=4 4750 B8R1.1 C#C[C@H]1COC(=O)N1 MCULE-4375742729 [0,1,0,1,0,0|1,0,1]=4 4751 B8R1.1 C#C[C@H]1COC(=O)N1 MCULE-5542662617 [0,1,0,1,0,0|1,0,1]=4 4752 B8R1.1 C1(CCC(=O)N1)CBr MCULE-4451864575 [0,1,0,1,0,0|2,0,0]=4 4753 B8R1.1 C1(CCC(=O)N1)CN MCULE-3169700074 [0,1,0,1,0,0|2,0,0]=4 4754 B8R1.1 C1(CCC(=O)N1)CO MCULE-8513534447 [0,1,0,1,0,0|2,0,0]=4 4755 B8R1.1 C1(CNC(=O)C1)CN MCULE-6663370335 [0,1,0,1,0,0|1,0,0]=3 4756 B8R1.1 C1(CNC(=O)C1)CN MCULE-8237162259 [0,1,0,1,0,0|1,0,0]=3 4757 B8R1.1 C1(CNC(=O)O1)CO MCULE-2451079587 [0,1,0,1,0,0|1,0,0]=3 4758 B8R1.1 C=CC1COC(=O)C1 MCULE-5888906344 [0,1,0,1,0,0|0,0,1]=3 4759 B8R1.1 C=CC1COC(=O)C1 MCULE-8602073759 [0,1,0,1,0,0|0,0,1]=3 4760 B8R1.1 C=CC1COC(=O)O1 MCULE-3470962220 [0,1,0,1,0,0|0,0,2]=4 4761 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-1274088394 [0,1,0,1,0,0|0,0,1]=3 4762 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-3162707973 [0,1,0,1,0,0|0,0,1]=3 4763 B8R1.1 C=C[C@@H]1COC(=O)N1 MCULE-1532767336 [0,1,0,1,0,0|1,0,1]=4 4764 B8R1.1 C=C[C@@H]1COC(=O)N1 MCULE-3932839401 [0,1,0,1,0,0|1,0,1]=4 4765 B8R1.1 C=C[C@H]1COC(=O)N1 MCULE-3492854139 [0,1,0,1,0,0|1,0,1]=4 4766 B8R1.1 C=C[C@H]1COC(=O)N1 MCULE-9796474747 [0,1,0,1,0,0|1,0,1]=4 4767 B8R1.1 CC1=NC(CO1)CBr MCULE-4046707435 [0,1,0,1,0,0|1,0,0]=3 4768 B8R1.1 CC1=NOC(C1)CBr MCULE-4979515850 [0,1,0,1,0,0|2,0,0]=4 4769 B8R1.1 CC1=NOC(C1)CCl MCULE-1284024148 [0,1,0,1,0,0|2,0,0]=4 4770 B8R1.1 CC1=NOC(C1)CN MCULE-6359035571 [0,1,0,1,0,0|2,0,0]=4 4771 B8R1.1 CC1=NOC(C1)CN MCULE-8767310256 [0,1,0,1,0,0|2,0,0]=4 4772 B8R1.1 CC1=NOC(C1)CO MCULE-8599237142 [0,1,0,1,0,0|2,0,0]=4 4773 B8R1.1 CC1CCC(C1)C=O MCULE-9381232427 [0,1,0,1,0,0|1,0,1]=4 4774 B8R1.1 CC1COC(C1)CO MCULE-4511313299 [0,1,0,1,0,0|0,0,2]=4 4775 B8R1.1 CC1OCC(O1)CO MCULE-1328866429 [0,1,0,1,0,0|0,0,2]=4 4776 B8R1.1 CCC1=CC(=O)CC1 MCULE-6681801286 [0,1,0,1,0,0|1,0,1]=4 4777 B8R1.1 CCC1=CC=C(O1)C MCULE-5132828893 [0,1,0,1,0,0|1,0,1]=4 4778 B8R1.1 CCC1=NC(CN1)C MCULE-6333019212 [0,1,0,1,0,0|2,0,0]=4 4779 B8R1.1 CCC1=NNC(=O)C1 MCULE-8387854697 [0,1,0,1,0,0|1,0,1]=4 4780 B8R1.1 CCC1C=CC(=O)O1 MCULE-8058927851 [0,1,0,1,0,0|0,0,1]=3 4781 B8R1.1 CCC1CC(=O)CO1 MCULE-7105024194 [0,1,0,1,0,0|0,0,0]=2 4782 B8R1.1 CCC1CCC(=O)C1 MCULE-8455504217 [0,1,0,1,0,0|1,0,0]=3 4783 B8R1.1 CCC1CCC(=O)N1 MCULE-6150249637 [0,1,0,1,0,0|1,0,0]=3 4784 B8R1.1 CCC1CCC(=O)O1 MCULE-5161861312 [0,1,0,1,0,0|0,0,0]=2 4785 B8R1.1 CCC1CNC(=O)C1 MCULE-1800672545 [0,1,0,1,0,0|1,0,0]=3 4786 B8R1.1 CCC1CNC(=O)O1 MCULE-9388725409 [0,1,0,1,0,0|0,0,0]=2 4787 B8R1.1 CCC1COC(=N1)C MCULE-1406641220 [0,1,0,1,0,0|1,0,0]=3 4788 B8R1.1 CCC1COC(=O)C1 MCULE-1996435734 [0,1,0,1,0,0|0,0,0]=2 4789 B8R1.1 CCC1COC(=O)N1 MCULE-4345668230 [0,1,0,1,0,0|1,0,0]=3 4790 B8R1.1 CCC1COC(=O)O1 MCULE-5743084846 [0,1,0,1,0,0|0,0,0]=2 4791 B8R1.1 CCC1CSC(=N1)C MCULE-4393928745 [0,1,0,1,0,0|1,1,0]=4 4792 B8R1.1 CCC1OCC(O1)C MCULE-6723875164 [0,1,0,1,0,0|0,0,2]=4 4793 B8R1.1 CCN1CCC(=O)C1 MCULE-5806094458 [0,1,0,1,0,0|1,0,0]=3 4794 B8R1.1 CC[C@@H]1CCC(=O)C1 MCULE-7687801028 [0,1,0,1,0,0|1,0,0]=3 4795 B8R1.1 CC[C@@H]1CCC(=O)O1 MCULE-9831904901 [0,1,0,1,0,0|0,0,0]=2 4796 B8R1.1 CC[C@H]1CCC(=O)C1 MCULE-6479003670 [0,1,0,1,0,0|1,0,0]=3 4797 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-2443615902 [0,1,0,1,0,0|1,0,0]=3 4798 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-9191549724 [0,1,0,1,0,0|1,0,0]=3 4799 B8R1.1 CNC1=NCC(S1)C MCULE-2475573763 [0,1,0,1,0,0|1,1,0]=4 4800 B8R1.1 CNC1CNC(=O)C1 MCULE-1673491824 [0,1,0,1,0,0|1,0,0]=3 4801 B8R1.1 CN[C@H]1CNC(=O)C1 MCULE-7859463391 [0,1,0,1,0,0|1,0,0]=3 4802 B8R1.1 COC1=CC(=O)OC1 MCULE-9199919492 [0,1,0,1,0,0|0,0,2]=4 4803 B8R1.1 COC1C=CC(=O)C1 MCULE-3904672515 [0,1,0,1,0,0|1,0,1]=4 4804 B8R1.1 COC1CCC(=O)C1 MCULE-3259977239 [0,1,0,1,0,0|1,0,0]=3 4805 B8R1.1 COC1CCC(=O)N1 MCULE-9661875090 [0,1,0,1,0,0|2,0,0]=4 4806 B8R1.1 COC1CNC(=O)C1 MCULE-2023546447 [0,1,0,1,0,0|1,0,0]=3 4807 B8R1.1 CSC1=NC(CN1)C MCULE-5363773569 [0,1,0,1,0,0|2,0,0]=4 4808 B8R1.1 CSC1=NC(CN1)C MCULE-7884427745 [0,1,0,1,0,0|2,0,0]=4 4809 B8R1.1 CSC1=NC(CS1)C MCULE-7229347458 [0,1,0,1,0,0|1,1,0]=4 4810 B8R1.1 N#CC1CCC(=O)C1 MCULE-3783981366 [0,1,0,1,0,0|1,0,1]=4 4811 B8R1.1 N#CC1CNC(=O)C1 MCULE-7040868747 [0,1,0,1,0,0|1,0,1]=4 4812 B8R1.1 N#CC1COC(=O)O1 MCULE-7635108167 [0,1,0,1,0,0|1,0,1]=4 4813 B8R1.1 N#C[C@@H]1CCC(=O)C1 MCULE-1506687355 [0,1,0,1,0,0|1,0,1]=4 4814 B8R1.1 N#C[C@H]1CCC(=O)C1 MCULE-3791390646 [0,1,0,1,0,0|1,0,1]=4 4815 B8R1.1 NC1=NCC(O1)CBr MCULE-8408311546 [0,1,0,1,0,0|2,0,0]=4 4816 B8R1.1 NC1=NCC(O1)CBr MCULE-9513559204 [0,1,0,1,0,0|2,0,0]=4 4817 B8R1.1 NCC1CC(=NO1)Br MCULE-2454032123 [0,1,0,1,0,0|2,0,0]=4 4818 B8R1.1 NCC1CCC(=O)N1 MCULE-2195138544 [0,1,0,1,0,0|2,0,0]=4 4819 B8R1.1 NCC1CCC(=O)N1 MCULE-5064964559 [0,1,0,1,0,0|2,0,0]=4 4820 B8R1.1 NCC1CCC(=O)N1 MCULE-9686422256 [0,1,0,1,0,0|2,0,0]=4 4821 B8R1.1 NCC1CCC(=O)N1 MCULE-9973113927 [0,1,0,1,0,0|2,0,0]=4 4822 B8R1.1 NCC1CCC(=O)O1 MCULE-5413792723 [0,1,0,1,0,0|1,0,0]=3 4823 B8R1.1 NCC1CCC(=O)O1 MCULE-8312895206 [0,1,0,1,0,0|1,0,0]=3 4824 B8R1.1 NCC1CNC(=O)C1 MCULE-2522987651 [0,1,0,1,0,0|1,0,0]=3 4825 B8R1.1 NCC1CNC(=O)C1 MCULE-7249550892 [0,1,0,1,0,0|1,0,0]=3 4826 B8R1.1 NCC1CNC(=O)C1 MCULE-7253893960 [0,1,0,1,0,0|1,0,0]=3 4827 B8R1.1 NCC1CNC(=O)O1 MCULE-3940030823 [0,1,0,1,0,0|1,0,0]=3 4828 B8R1.1 NCC1CNC(=O)O1 MCULE-7671055394 [0,1,0,1,0,0|1,0,0]=3 4829 B8R1.1 NCC1COC(=O)N1 MCULE-8454292565 [0,1,0,1,0,0|1,0,0]=3 4830 B8R1.1 NCC1COC(=O)N1 MCULE-9068275563 [0,1,0,1,0,0|1,0,0]=3 4831 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-5772277021 [0,1,0,1,0,0|2,0,0]=4 4832 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-6147061481 [0,1,0,1,0,0|2,0,0]=4 4833 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-7644508115 [0,1,0,1,0,0|2,0,0]=4 4834 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-7782108755 [0,1,0,1,0,0|2,0,0]=4 4835 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-1184474214 [0,1,0,1,0,0|1,0,0]=3 4836 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-2421452869 [0,1,0,1,0,0|1,0,0]=3 4837 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-3903743084 [0,1,0,1,0,0|1,0,0]=3 4838 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-9080425518 [0,1,0,1,0,0|1,0,0]=3 4839 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-1463241001 [0,1,0,1,0,0|1,0,0]=3 4840 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-3217887113 [0,1,0,1,0,0|1,0,0]=3 4841 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-5423398321 [0,1,0,1,0,0|1,0,0]=3 4842 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-9322185538 [0,1,0,1,0,0|1,0,0]=3 4843 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-1485902199 [0,1,0,1,0,0|2,0,0]=4 4844 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-1751255260 [0,1,0,1,0,0|2,0,0]=4 4845 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-3641870628 [0,1,0,1,0,0|2,0,0]=4 4846 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-9839264859 [0,1,0,1,0,0|2,0,0]=4 4847 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-7212975165 [0,1,0,1,0,0|1,0,0]=3 4848 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8203034485 [0,1,0,1,0,0|1,0,0]=3 4849 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8803246698 [0,1,0,1,0,0|1,0,0]=3 4850 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-9580224880 [0,1,0,1,0,0|1,0,0]=3 4851 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-1224919034 [0,1,0,1,0,0|1,0,0]=3 4852 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-6003746665 [0,1,0,1,0,0|1,0,0]=3 4853 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-6937146715 [0,1,0,1,0,0|1,0,0]=3 4854 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-9419881517 [0,1,0,1,0,0|1,0,0]=3 4855 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-1988909942 [0,1,0,1,0,0|1,0,0]=3 4856 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-9340310155 [0,1,0,1,0,0|1,0,0]=3 4857 B8R1.1 O=C1C=C(CO1)CBr MCULE-1493137482 [0,1,0,1,0,0|0,0,2]=4 4858 B8R1.1 O=C1C=C(CO1)CI MCULE-7834471824 [0,1,0,1,0,0|0,0,2]=4 4859 B8R1.1 O=C1C=C(CO1)CO MCULE-9263407854 [0,1,0,1,0,0|0,0,2]=4 4860 B8R1.1 O=C1C=CC(O1)CBr MCULE-5454606396 [0,1,0,1,0,0|1,0,1]=4 4861 B8R1.1 O=C1C=CC(O1)CO MCULE-4249850069 [0,1,0,1,0,0|1,0,1]=4 4862 B8R1.1 O=C1C=C[C@H](O1)CO MCULE-3027706549 [0,1,0,1,0,0|1,0,1]=4 4863 B8R1.1 O=C1C=C[C@H](O1)CO MCULE-5764400462 [0,1,0,1,0,0|1,0,1]=4 4864 B8R1.1 O=C1CC(CN1)CBr MCULE-1780879209 [0,1,0,1,0,0|1,0,0]=3 4865 B8R1.1 O=C1CC(CN1)CO MCULE-8619053563 [0,1,0,1,0,0|1,0,0]=3 4866 B8R1.1 O=C1CC(CO1)CO MCULE-7403068263 [0,1,0,1,0,0|0,0,0]=2 4867 B8R1.1 O=C1CCC(C1)CF MCULE-9077358027 [0,1,0,1,0,0|1,0,0]=3 4868 B8R1.1 O=C1CCC(C1)CO MCULE-7524267942 [0,1,0,1,0,0|1,0,0]=3 4869 B8R1.1 O=C1CCC(N1)CBr MCULE-7024022934 [0,1,0,1,0,0|2,0,0]=4 4870 B8R1.1 O=C1CCC(N1)CI MCULE-6956070937 [0,1,0,1,0,0|2,0,0]=4 4871 B8R1.1 O=C1CCC(N1)CO MCULE-1498000761 [0,1,0,1,0,0|2,0,0]=4 4872 B8R1.1 O=C1CCC(O1)CBr MCULE-9370722806 [0,1,0,1,0,0|1,0,0]=3 4873 B8R1.1 O=C1CCC(O1)CCl MCULE-3199749385 [0,1,0,1,0,0|1,0,0]=3 4874 B8R1.1 O=C1CCC(O1)CI MCULE-4432096360 [0,1,0,1,0,0|1,0,0]=3 4875 B8R1.1 O=C1CCC(O1)CO MCULE-3178999726 [0,1,0,1,0,0|1,0,0]=3 4876 B8R1.1 O=C1CCC(O1)CO MCULE-4390773734 [0,1,0,1,0,0|1,0,0]=3 4877 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-2590805877 [0,1,0,1,0,0|1,0,0]=3 4878 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-7134607780 [0,1,0,1,0,0|1,0,0]=3 4879 B8R1.1 O=C1CC[C@@H](N1)CBr MCULE-4537645558 [0,1,0,1,0,0|2,0,0]=4 4880 B8R1.1 O=C1CC[C@@H](N1)CBr MCULE-6830001458 [0,1,0,1,0,0|2,0,0]=4 4881 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3021506643 [0,1,0,1,0,0|2,0,0]=4 4882 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3659077476 [0,1,0,1,0,0|2,0,0]=4 4883 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-1532290348 [0,1,0,1,0,0|1,0,0]=3 4884 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-3600746831 [0,1,0,1,0,0|1,0,0]=3 4885 B8R1.1 O=C1CC[C@H](N1)CBr MCULE-1684731751 [0,1,0,1,0,0|2,0,0]=4 4886 B8R1.1 O=C1CC[C@H](N1)CBr MCULE-4479348379 [0,1,0,1,0,0|2,0,0]=4 4887 B8R1.1 O=C1CC[C@H](N1)CO MCULE-4532009930 [0,1,0,1,0,0|2,0,0]=4 4888 B8R1.1 O=C1CC[C@H](N1)CO MCULE-6466848372 [0,1,0,1,0,0|2,0,0]=4 4889 B8R1.1 O=C1CC[C@H](O1)CO MCULE-1675076625 [0,1,0,1,0,0|1,0,0]=3 4890 B8R1.1 O=C1CC[C@H](O1)CO MCULE-6265569115 [0,1,0,1,0,0|1,0,0]=3 4891 B8R1.1 O=C1C[C@@H](CN1)CO MCULE-5572559100 [0,1,0,1,0,0|1,0,0]=3 4892 B8R1.1 O=C1C[C@H](CN1)CO MCULE-4450345453 [0,1,0,1,0,0|1,0,0]=3 4893 B8R1.1 O=C1NC(CO1)CI MCULE-3725463438 [0,1,0,1,0,0|1,0,0]=3 4894 B8R1.1 O=C1NC(CO1)CI MCULE-8271591026 [0,1,0,1,0,0|1,0,0]=3 4895 B8R1.1 O=C1NC(CO1)CO MCULE-8296379772 [0,1,0,1,0,0|1,0,0]=3 4896 B8R1.1 O=C1NC(CO1)CO MCULE-9797812862 [0,1,0,1,0,0|1,0,0]=3 4897 B8R1.1 O=C1NCC(O1)CBr MCULE-3294572412 [0,1,0,1,0,0|1,0,0]=3 4898 B8R1.1 O=C1NCC(O1)CCl MCULE-6711754093 [0,1,0,1,0,0|1,0,0]=3 4899 B8R1.1 O=C1NCC(O1)CCl MCULE-6847066968 [0,1,0,1,0,0|1,0,0]=3 4900 B8R1.1 O=C1NCC(O1)CO MCULE-8225938772 [0,1,0,1,0,0|1,0,0]=3 4901 B8R1.1 O=C1NCC(S1)CBr MCULE-9963419555 [0,1,0,1,0,0|1,1,0]=4 4902 B8R1.1 O=C1NC[C@@H](O1)CCl MCULE-4606501061 [0,1,0,1,0,0|1,0,0]=3 4903 B8R1.1 O=C1NC[C@@H](O1)CO MCULE-4749906822 [0,1,0,1,0,0|1,0,0]=3 4904 B8R1.1 O=C1NC[C@@H](O1)CO MCULE-7879354917 [0,1,0,1,0,0|1,0,0]=3 4905 B8R1.1 O=C1NC[C@H](O1)CCl MCULE-1912687608 [0,1,0,1,0,0|1,0,0]=3 4906 B8R1.1 O=C1NC[C@H](O1)CO MCULE-2698871687 [0,1,0,1,0,0|1,0,0]=3 4907 B8R1.1 O=C1NC[C@H](O1)CO MCULE-5771560221 [0,1,0,1,0,0|1,0,0]=3 4908 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-2270288938 [0,1,0,1,0,0|1,0,0]=3 4909 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-5533745846 [0,1,0,1,0,0|1,0,0]=3 4910 B8R1.1 O=C1N[C@H](CO1)CI MCULE-5817468950 [0,1,0,1,0,0|1,0,0]=3 4911 B8R1.1 O=C1N[C@H](CO1)CI MCULE-6940377154 [0,1,0,1,0,0|1,0,0]=3 4912 B8R1.1 O=C1N[C@H](CO1)CO MCULE-3186572246 [0,1,0,1,0,0|1,0,0]=3 4913 B8R1.1 O=C1N[C@H](CO1)CO MCULE-4534112642 [0,1,0,1,0,0|1,0,0]=3 4914 B8R1.1 O=C1OCC(O1)CCl MCULE-7212643481 [0,1,0,1,0,0|1,0,0]=3 4915 B8R1.1 O=C1OCC(O1)CF MCULE-2066386250 [0,1,0,1,0,0|1,0,0]=3 4916 B8R1.1 O=C1OCC(O1)CO MCULE-1831262013 [0,1,0,1,0,0|1,0,0]=3 4917 B8R1.1 O=CC1COC(=O)C1 MCULE-7312168752 [0,1,0,1,0,0|0,0,1]=3 4918 B8R1.1 [C@@H]1(COC(=O)C1)C=C MCULE-1356778810 [0,1,0,1,0,0|0,0,1]=3 4919 B8R1.1 [C@H]1(CNC(=O)O1)CCl MCULE-6032247892 [0,1,0,1,0,0|1,0,0]=3 4920 B8R1.4 C1(CC(=O)CCN1)C MCULE-1061296374 [0,1,0,1,0,0|1,0,0]=3 4921 B8R1.4 C1(CC(=O)CCN1)C MCULE-4465075512 [0,1,0,1,0,0|1,0,0]=3 4922 B8R1.4 C1(CC(=O)CCN1)C MCULE-9958407361 [0,1,0,1,0,0|1,0,0]=3 4923 B8R1.4 C1(CNCC(=O)N1)C MCULE-3246707428 [0,1,0,1,0,0|2,0,0]=4 4924 B8R1.4 C=C1CCCC(=O)O1 MCULE-1342678884 [0,1,0,1,0,0|0,0,1]=3 4925 B8R1.4 CC1=CC(=O)CCC1 MCULE-6849313207 [0,1,0,1,0,0|1,0,1]=4 4926 B8R1.4 CC1=CC(=O)OCC1 MCULE-1467184061 [0,1,0,1,0,0|0,0,1]=3 4927 B8R1.4 CC1=CC(CCC1)O MCULE-3389687006 [0,1,0,1,0,0|2,0,0]=4 4928 B8R1.4 CC1=CC(CNC1)C MCULE-4673363753 [0,1,0,1,0,0|2,0,0]=4 4929 B8R1.4 CC1=CC(CNC1)C MCULE-8321555834 [0,1,0,1,0,0|2,0,0]=4 4930 B8R1.4 CC1=CCCC(=O)C1 MCULE-8078773996 [0,1,0,1,0,0|1,0,1]=4 4931 B8R1.4 CC1=CCCC(=O)O1 MCULE-1590433845 [0,1,0,1,0,0|0,0,2]=4 4932 B8R1.4 CC1CC(=O)CCN1 MCULE-3306158037 [0,1,0,1,0,0|1,0,0]=3 4933 B8R1.4 CC1CC(=O)CCN1 MCULE-4556824309 [0,1,0,1,0,0|1,0,0]=3 4934 B8R1.4 CC1CC(=O)CCN1 MCULE-6103506996 [0,1,0,1,0,0|1,0,0]=3 4935 B8R1.4 CC1CC(=O)CCN1 MCULE-9670943852 [0,1,0,1,0,0|1,0,0]=3 4936 B8R1.4 CC1CC(=O)CCO1 MCULE-3051168755 [0,1,0,1,0,0|1,0,0]=3 4937 B8R1.4 CC1CC(CCO1)N MCULE-6804148880 [0,1,0,1,0,0|1,0,1]=4 4938 B8R1.4 CC1CC(CCO1)N MCULE-8648516718 [0,1,0,1,0,0|1,0,1]=4 4939 B8R1.4 CC1CC(CCO1)O MCULE-4865141445 [0,1,0,1,0,0|1,0,1]=4 4940 B8R1.4 CC1CC=CC(=O)O1 MCULE-3191839185 [0,1,0,1,0,0|0,0,2]=4 4941 B8R1.4 CC1CCCC(=O)C1 MCULE-6473963111 [0,1,0,1,0,0|1,0,0]=3 4942 B8R1.4 CC1CCCC(=O)C1 MCULE-9918051823 [0,1,0,1,0,0|1,0,0]=3 4943 B8R1.4 CC1CCCC(=O)N1 MCULE-3851963076 [0,1,0,1,0,0|1,0,0]=3 4944 B8R1.4 CC1CCCC(=O)O1 MCULE-4000069856 [0,1,0,1,0,0|0,0,0]=2 4945 B8R1.4 CC1CCNC(=N)C1 MCULE-2615774284 [0,1,0,1,0,0|2,0,0]=4 4946 B8R1.4 CC1CCNC(=N)C1 MCULE-9034088725 [0,1,0,1,0,0|2,0,0]=4 4947 B8R1.4 CC1CCNC(=O)C1 MCULE-8903018599 [0,1,0,1,0,0|1,0,0]=3 4948 B8R1.4 CC1CCNC(=O)N1 MCULE-6491047836 [0,1,0,1,0,0|2,0,0]=4 4949 B8R1.4 CC1CCOC(=O)C1 MCULE-2682865017 [0,1,0,1,0,0|0,0,0]=2 4950 B8R1.4 CC1CCOC(=O)O1 MCULE-5929311811 [0,1,0,1,0,0|1,0,0]=3 4951 B8R1.4 CC1CCOC(O1)C MCULE-1813287934 [0,1,0,1,0,0|0,0,2]=4 4952 B8R1.4 CC1CCOS(=O)O1 MCULE-8688981983 [0,1,0,1,0,0|2,0,0]=4 4953 B8R1.4 CC1CNCC(=O)N1 MCULE-5727167900 [0,1,0,1,0,0|2,0,0]=4 4954 B8R1.4 CC1CNCC(=O)N1 MCULE-9599432640 [0,1,0,1,0,0|2,0,0]=4 4955 B8R1.4 CC1COCC(=O)N1 MCULE-4768427051 [0,1,0,1,0,0|1,0,0]=3 4956 B8R1.4 CC1COCC(=O)N1 MCULE-5909800781 [0,1,0,1,0,0|1,0,0]=3 4957 B8R1.4 CC1COCC(N1)C MCULE-4328769074 [0,1,0,1,0,0|1,0,1]=4 4958 B8R1.4 CC1COCC(N1)C MCULE-5344050444 [0,1,0,1,0,0|1,0,1]=4 4959 B8R1.4 CC1CS(=O)CCN1 MCULE-1283703183 [0,1,0,1,0,0|2,0,0]=4 4960 B8R1.4 CN1CCC=C(C1)Br MCULE-2257933393 [0,1,0,1,0,0|2,0,0]=4 4961 B8R1.4 CN1CCC=C(C1)Br MCULE-5744160461 [0,1,0,1,0,0|2,0,0]=4 4962 B8R1.4 CN1CCCC(=O)C1 MCULE-1067967474 [0,1,0,1,0,0|1,0,0]=3 4963 B8R1.4 CN1CCCC(=O)C1 MCULE-4816876030 [0,1,0,1,0,0|1,0,0]=3 4964 B8R1.4 CN1CCNC(=O)C1 MCULE-5564854834 [0,1,0,1,0,0|1,0,0]=3 4965 B8R1.4 CN1CCOC(=O)C1 MCULE-2224720964 [0,1,0,1,0,0|0,0,0]=2 4966 B8R1.4 CN1CCOC(=O)C1 MCULE-9163078129 [0,1,0,1,0,0|0,0,0]=2 4967 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7688577280 [0,1,0,1,0,0|1,0,0]=3 4968 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7762440526 [0,1,0,1,0,0|1,0,0]=3 4969 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-8158589956 [0,1,0,1,0,0|1,0,0]=3 4970 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-9544551566 [0,1,0,1,0,0|1,0,0]=3 4971 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-4878813100 [0,1,0,1,0,0|1,0,0]=3 4972 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-7917159022 [0,1,0,1,0,0|1,0,0]=3 4973 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-1868776628 [0,1,0,1,0,0|1,0,0]=3 4974 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-6973928430 [0,1,0,1,0,0|1,0,0]=3 4975 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-2050655386 [0,1,0,1,0,0|1,0,0]=3 4976 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-7049359933 [0,1,0,1,0,0|1,0,0]=3 4977 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-6306078053 [0,1,0,1,0,0|0,0,0]=2 4978 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-7616070208 [0,1,0,1,0,0|0,0,0]=2 4979 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-3378865379 [0,1,0,1,0,0|2,0,0]=4 4980 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-5740698320 [0,1,0,1,0,0|2,0,0]=4 4981 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-7692987274 [0,1,0,1,0,0|2,0,0]=4 4982 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-8897582822 [0,1,0,1,0,0|2,0,0]=4 4983 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-1758598852 [0,1,0,1,0,0|1,0,0]=3 4984 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-2011395384 [0,1,0,1,0,0|1,0,0]=3 4985 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-2736879628 [0,1,0,1,0,0|1,0,1]=4 4986 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-6480700093 [0,1,0,1,0,0|1,0,1]=4 4987 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-7175758116 [0,1,0,1,0,0|1,0,1]=4 4988 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-8111856201 [0,1,0,1,0,0|1,0,1]=4 4989 B8R1.4 C[C@@H]1COC[C@H](N1)C MCULE-9185751584 [0,1,0,1,0,0|1,0,1]=4 4990 B8R1.4 C[C@@H]1C[C@@H](CCO1)N MCULE-5401313109 [0,1,0,1,0,0|1,0,1]=4 4991 B8R1.4 C[C@@H]1C[C@@H](CCO1)N MCULE-6369939467 [0,1,0,1,0,0|1,0,1]=4 4992 B8R1.4 C[C@@H]1C[C@@H](CCO1)O MCULE-6251959536 [0,1,0,1,0,0|1,0,1]=4 4993 B8R1.4 C[C@@H]1C[C@H](CCO1)Br MCULE-5055630042 [0,1,0,1,0,0|1,0,1]=4 4994 B8R1.4 C[C@@H]1C[C@H](CCO1)N MCULE-3414529082 [0,1,0,1,0,0|1,0,1]=4 4995 B8R1.4 C[C@@H]1C[C@H](CCO1)N MCULE-9424615508 [0,1,0,1,0,0|1,0,1]=4 4996 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-1599463757 [0,1,0,1,0,0|1,0,0]=3 4997 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-4580048332 [0,1,0,1,0,0|1,0,0]=3 4998 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5356496154 [0,1,0,1,0,0|1,0,0]=3 4999 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5733481696 [0,1,0,1,0,0|1,0,0]=3 5000 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-6641640616 [0,1,0,1,0,0|1,0,0]=3 5001 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-8001129555 [0,1,0,1,0,0|1,0,0]=3 5002 B8R1.4 C[C@H]1CC(=O)CCO1 MCULE-7799394182 [0,1,0,1,0,0|1,0,0]=3 5003 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-4643975445 [0,1,0,1,0,0|1,0,0]=3 5004 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-6122391840 [0,1,0,1,0,0|1,0,0]=3 5005 B8R1.4 C[C@H]1CCNC(=O)C1 MCULE-7120988665 [0,1,0,1,0,0|1,0,0]=3 5006 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3182538973 [0,1,0,1,0,0|2,0,0]=4 5007 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3207104811 [0,1,0,1,0,0|2,0,0]=4 5008 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-5895954143 [0,1,0,1,0,0|2,0,0]=4 5009 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-6535652978 [0,1,0,1,0,0|2,0,0]=4 5010 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-5693624195 [0,1,0,1,0,0|1,0,0]=3 5011 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-8476323396 [0,1,0,1,0,0|1,0,0]=3 5012 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-1719904204 [0,1,0,1,0,0|1,0,1]=4 5013 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-4982848827 [0,1,0,1,0,0|1,0,1]=4 5014 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-5187697554 [0,1,0,1,0,0|1,0,1]=4 5015 B8R1.4 C[C@H]1COC[C@@H](N1)C MCULE-5502522190 [0,1,0,1,0,0|1,0,1]=4 5016 B8R1.4 C[C@H]1COC[C@H](N1)C MCULE-1213066303 [0,1,0,1,0,0|1,0,1]=4 5017 B8R1.4 C[C@H]1COC[C@H](N1)C MCULE-4127485214 [0,1,0,1,0,0|1,0,1]=4 5018 B8R1.4 C[C@H]1C[C@@H](CCO1)N MCULE-1731421927 [0,1,0,1,0,0|1,0,1]=4 5019 B8R1.4 C[C@H]1C[C@@H](CCO1)O MCULE-3846187212 [0,1,0,1,0,0|1,0,1]=4 5020 B8R1.4 C[C@H]1C[C@H](CCO1)N MCULE-6954386064 [0,1,0,1,0,0|1,0,1]=4 5021 B8R1.4 C[C@H]1C[C@H](CCO1)O MCULE-3007764630 [0,1,0,1,0,0|1,0,1]=4 5022 B8R1.4 NC1=CC(=O)CCC1 MCULE-3362548403 [0,1,0,1,0,0|1,0,1]=4 5023 B8R1.4 NC1C=C(CCC1)F MCULE-7477602128 [0,1,0,1,0,0|2,0,0]=4 5024 B8R1.4 NC1CCCC(=O)C1 MCULE-3659606498 [0,1,0,1,0,0|1,0,0]=3 5025 B8R1.4 NC1CCCC(=O)C1 MCULE-8815445353 [0,1,0,1,0,0|1,0,0]=3 5026 B8R1.4 NC1CCNC(=O)C1 MCULE-2185303732 [0,1,0,1,0,0|1,0,0]=3 5027 B8R1.4 NC1CCNC(=O)C1 MCULE-4290135082 [0,1,0,1,0,0|1,0,0]=3 5028 B8R1.4 NC1CCNC(=O)C1 MCULE-6525283699 [0,1,0,1,0,0|1,0,0]=3 5029 B8R1.4 NC1CCNC(=O)C1 MCULE-8080194775 [0,1,0,1,0,0|1,0,0]=3 5030 B8R1.4 NC1COCC(=O)C1 MCULE-4958107203 [0,1,0,1,0,0|1,0,0]=3 5031 B8R1.4 NC1COCC(=O)C1 MCULE-9645630994 [0,1,0,1,0,0|1,0,0]=3 5032 B8R1.4 N[C@@H]1CCCC(=O)C1 MCULE-4006583256 [0,1,0,1,0,0|1,0,0]=3 5033 B8R1.4 N[C@@H]1CCNC(=O)C1 MCULE-8276559925 [0,1,0,1,0,0|1,0,0]=3 5034 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-3299834957 [0,1,0,1,0,0|1,0,0]=3 5035 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-6683156371 [0,1,0,1,0,0|1,0,0]=3 5036 B8R1.4 N[C@H]1CCCC(=O)C1 MCULE-9786035316 [0,1,0,1,0,0|1,0,0]=3 5037 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-1641151984 [0,1,0,1,0,0|1,0,0]=3 5038 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-2042394403 [0,1,0,1,0,0|1,0,0]=3 5039 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-6400271298 [0,1,0,1,0,0|1,0,0]=3 5040 B8R1.4 O=C1C=C(CCC1)Br MCULE-3733885681 [0,1,0,1,0,0|1,0,1]=4 5041 B8R1.4 O=C1C=C(CCC1)Cl MCULE-9612484193 [0,1,0,1,0,0|1,0,1]=4 5042 B8R1.4 O=C1C=C(CCC1)I MCULE-4085762002 [0,1,0,1,0,0|1,0,1]=4 5043 B8R1.4 O=C1C=C(CCC1)O MCULE-5615245957 [0,1,0,1,0,0|1,0,1]=4 5044 B8R1.4 O=C1CC(CCN1)F MCULE-3828280868 [0,1,0,1,0,0|1,0,0]=3 5045 B8R1.4 O=C1CC(CCN1)F MCULE-8150833328 [0,1,0,1,0,0|1,0,0]=3 5046 B8R1.4 O=C1CC(CCN1)O MCULE-5400068518 [0,1,0,1,0,0|1,0,0]=3 5047 B8R1.4 O=C1CC(CCN1)O MCULE-8702086069 [0,1,0,1,0,0|1,0,0]=3 5048 B8R1.4 O=C1CCCC(=O)C1 MCULE-7494421285 [0,1,0,1,0,0|1,0,1]=4 5049 B8R1.4 O=C1CCCC(=O)N1 MCULE-7505150579 [0,1,0,1,0,0|1,0,1]=4 5050 B8R1.4 O=C1CCCC(=O)O1 MCULE-4866925975 [0,1,0,1,0,0|0,0,1]=3 5051 B8R1.4 O=C1CCCC(C1)O MCULE-3100717907 [0,1,0,1,0,0|1,0,0]=3 5052 B8R1.4 O=C1CCC[C@@H](C1)O MCULE-3841179351 [0,1,0,1,0,0|1,0,0]=3 5053 B8R1.4 O=C1CCNC(=O)C1 MCULE-7662080105 [0,1,0,1,0,0|1,0,1]=4 5054 B8R1.4 O=C1CCNC(=O)O1 MCULE-8298722634 [0,1,0,1,0,0|1,0,1]=4 5055 B8R1.4 O=C1CCOC(=O)C1 MCULE-3134133687 [0,1,0,1,0,0|0,0,1]=3 5056 B8R1.4 O=C1COCC(=O)C1 MCULE-1763175933 [0,1,0,1,0,0|1,0,1]=4 5057 B8R1.4 O=C1COCC(=O)O1 MCULE-7640970930 [0,1,0,1,0,0|1,0,1]=4 5058 B8R1.4 O=C1COCC(C1)O MCULE-6056926421 [0,1,0,1,0,0|1,0,0]=3 5059 B8R1.4 O=C1CSCC(=O)O1 MCULE-6767203470 [0,1,0,1,0,0|1,0,1]=4 5060 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-8279613188 [0,1,0,1,0,0|1,0,0]=3 5061 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-9911849866 [0,1,0,1,0,0|1,0,0]=3 5062 B8R1.4 O=C1C[C@H](CCN1)O MCULE-3843806479 [0,1,0,1,0,0|1,0,0]=3 5063 B8R1.4 O=C1C[C@H](CCN1)O MCULE-9127195212 [0,1,0,1,0,0|1,0,0]=3 5064 B8R1.4 [C@@H]1(CCCC(=O)N1)C MCULE-8906937588 [0,1,0,1,0,0|1,0,0]=3 5065 B8R1.4 [C@H]1(COC[C@H](N1)C)C MCULE-9060251275 [0,1,0,1,0,0|1,0,1]=4 5066 B8R1.18 C=C1CC(OC1=O)C MCULE-4610228867 [0,1,0,1,0,0|2,0,0]=4 5067 B8R1.18 CC1=CC(=O)CC1C MCULE-9587444246 [0,1,0,1,0,0|1,0,1]=4 5068 B8R1.18 CC1=CC(=O)OC1O MCULE-2111708862 [0,1,0,1,0,0|0,0,2]=4 5069 B8R1.18 CC1=CC(=O)O[C@@H]1O MCULE-3894053073 [0,1,0,1,0,0|0,0,2]=4 5070 B8R1.18 CC1=NC(C(S1)C)C MCULE-1424136465 [0,1,0,1,0,0|1,1,0]=4 5071 B8R1.18 CC1CC(=O)C(O1)C MCULE-9648127298 [0,1,0,1,0,0|2,0,0]=4 5072 B8R1.18 CC1CC(=O)CN1C MCULE-3142275674 [0,1,0,1,0,0|2,0,0]=4 5073 B8R1.18 CC1CC(=O)N(C1)C MCULE-2164356802 [0,1,0,1,0,0|1,0,0]=3 5074 B8R1.18 CC1CC(=O)N(N1)C MCULE-3951114099 [0,1,0,1,0,0|2,0,0]=4 5075 B8R1.18 CC1CC(=O)NC1=O MCULE-2962850802 [0,1,0,1,0,0|1,0,1]=4 5076 B8R1.18 CC1CC(=O)OC1=O MCULE-6043315810 [0,1,0,1,0,0|0,0,1]=3 5077 B8R1.18 CC1CC(=O)OC1C MCULE-3906254123 [0,1,0,1,0,0|0,0,0]=2 5078 B8R1.18 CC1CC(=O)OC1O MCULE-7140241012 [0,1,0,1,0,0|0,0,0]=2 5079 B8R1.18 CC1CC(C(=O)O1)Br MCULE-3628819780 [0,1,0,1,0,0|2,0,0]=4 5080 B8R1.18 CC1CC(C(=O)O1)N MCULE-4414809681 [0,1,0,1,0,0|2,0,0]=4 5081 B8R1.18 CC1CC(C(=O)O1)N MCULE-7247771680 [0,1,0,1,0,0|2,0,0]=4 5082 B8R1.18 CC1CN(CC1=O)C MCULE-3780339739 [0,1,0,1,0,0|2,0,0]=4 5083 B8R1.18 CC1NC(=O)CC1O MCULE-6370955032 [0,1,0,1,0,0|2,0,0]=4 5084 B8R1.18 CC1NC(=O)OC1=O MCULE-5437194910 [0,1,0,1,0,0|1,0,1]=4 5085 B8R1.18 CC1NC(=O)OC1=O MCULE-6711218397 [0,1,0,1,0,0|1,0,1]=4 5086 B8R1.18 CC1NC(=O)OC1C MCULE-5204749893 [0,1,0,1,0,0|1,0,0]=3 5087 B8R1.18 CC1OC(=O)OC1C MCULE-1302025126 [0,1,0,1,0,0|1,0,0]=3 5088 B8R1.18 CC1OS(=O)OC1C MCULE-8578188591 [0,1,0,1,0,0|2,0,0]=4 5089 B8R1.18 CN1CC(=O)OC1=O MCULE-7537862268 [0,1,0,1,0,0|1,0,1]=4 5090 B8R1.18 CN1CC(CC1=O)I MCULE-4945824576 [0,1,0,1,0,0|2,0,0]=4 5091 B8R1.18 CN1CC(CC1=O)N MCULE-2463085778 [0,1,0,1,0,0|2,0,0]=4 5092 B8R1.18 CN1CC(CC1=O)N MCULE-2958084133 [0,1,0,1,0,0|2,0,0]=4 5093 B8R1.18 CN1CC(CC1=O)O MCULE-3900359646 [0,1,0,1,0,0|2,0,0]=4 5094 B8R1.18 CN1C[C@@H](CC1=O)N MCULE-5898871508 [0,1,0,1,0,0|2,0,0]=4 5095 B8R1.18 CN1C[C@@H](CC1=O)O MCULE-6983684031 [0,1,0,1,0,0|2,0,0]=4 5096 B8R1.18 CN1C[C@@H](CC1=O)O MCULE-9036883490 [0,1,0,1,0,0|2,0,0]=4 5097 B8R1.18 CN1C[C@H](CC1=O)N MCULE-6260844558 [0,1,0,1,0,0|2,0,0]=4 5098 B8R1.18 CN1C[C@H](CC1=O)N MCULE-9464195407 [0,1,0,1,0,0|2,0,0]=4 5099 B8R1.18 CN1C[C@H](CC1=O)O MCULE-1129246553 [0,1,0,1,0,0|2,0,0]=4 5100 B8R1.18 CN1C[C@H](CC1=O)O MCULE-3762455862 [0,1,0,1,0,0|2,0,0]=4 5101 B8R1.18 C[C@@H]1CC(=O)NC1=O MCULE-9043552998 [0,1,0,1,0,0|1,0,1]=4 5102 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1O MCULE-5647492108 [0,1,0,1,0,0|2,0,0]=4 5103 B8R1.18 C[C@@H]1NC(=O)OC1=O MCULE-3338806314 [0,1,0,1,0,0|1,0,1]=4 5104 B8R1.18 C[C@@H]1NC(=O)OC1=O MCULE-9892061668 [0,1,0,1,0,0|1,0,1]=4 5105 B8R1.18 C[C@H]1CC(=O)OC1=O MCULE-7764909201 [0,1,0,1,0,0|0,0,1]=3 5106 B8R1.18 C[C@H]1CC(=O)O[C@H]1C MCULE-7756599719 [0,1,0,1,0,0|0,0,0]=2 5107 B8R1.18 C[C@H]1NC(=O)OC1=O MCULE-2658468572 [0,1,0,1,0,0|1,0,1]=4 5108 B8R1.18 C[C@H]1NC(=O)OC1=O MCULE-9205776561 [0,1,0,1,0,0|1,0,1]=4 5109 B8R1.18 NC1CC(=O)OC1=O MCULE-1406790351 [0,1,0,1,0,0|1,0,1]=4 5110 B8R1.18 NC1CC(=O)OC1=O MCULE-2807590870 [0,1,0,1,0,0|1,0,1]=4 5111 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-1937927503 [0,1,0,1,0,0|1,0,1]=4 5112 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-2080587685 [0,1,0,1,0,0|1,0,1]=4 5113 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-8793349665 [0,1,0,1,0,0|1,0,1]=4 5114 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-9640337170 [0,1,0,1,0,0|1,0,1]=4 5115 B8R1.18 N[C@H]1CC(=O)OC1=O MCULE-3191926438 [0,1,0,1,0,0|1,0,1]=4 5116 B8R1.18 N[C@H]1CC(=O)OC1=O MCULE-4503342222 [0,1,0,1,0,0|1,0,1]=4 5117 B8R1.18 O=C1OC(C(O1)Cl)Cl MCULE-2346794223 [0,1,0,1,0,0|2,0,0]=4 5118 B8R1.18 O=C1O[C@@H]([C@H](O1)F)F MCULE-7614704509 [0,1,0,1,0,0|2,0,0]=4 5119 B8R1.20 CC1CC1CC(=O)O MCULE-3151390667 [0,1,0,1,0,0|2,0,0]=4 5120 B8R1.31 C1(CCN1C)C(=O)O MCULE-3478640390 [0,1,0,1,0,0|2,0,0]=4 5121 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C MCULE-1543129128 [0,1,0,1,0,0|1,0,0]=3 5122 B8R1.31 CC1CCC1C(=O)O MCULE-2755332087 [0,1,0,1,0,0|2,0,0]=4 5123 B8R1.31 CC1CNC1C(=O)O MCULE-4084486339 [0,1,0,1,0,0|2,0,0]=4 5124 B8R1.31 CC1NCC1C(=O)O MCULE-3701314568 [0,1,0,1,0,0|2,0,0]=4 5125 B8R1.31 CN1CCC1C(=O)O MCULE-5037838055 [0,1,0,1,0,0|2,0,0]=4 5126 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-3293015609 [0,1,0,1,0,0|2,0,0]=4 5127 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-6726499104 [0,1,0,1,0,0|2,0,0]=4 5128 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-1519401164 [0,1,0,1,0,0|2,0,0]=4 5129 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-2682368839 [0,1,0,1,0,0|2,0,0]=4 5130 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-6870930523 [0,1,0,1,0,0|2,0,0]=4 5131 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-9495962068 [0,1,0,1,0,0|2,0,0]=4 5132 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-4996743185 [0,1,0,1,0,0|2,0,0]=4 5133 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-5548697786 [0,1,0,1,0,0|2,0,0]=4 5134 B8R1.31 NC1CCC1C(=O)O MCULE-1271890671 [0,1,0,1,0,0|2,0,0]=4 5135 B8R1.31 NC1CCC1C(=O)O MCULE-6203451123 [0,1,0,1,0,0|2,0,0]=4 5136 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O MCULE-7309195085 [0,1,0,1,0,0|2,0,0]=4 5137 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-1231832702 [0,1,0,1,0,0|2,0,0]=4 5138 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-4120413857 [0,1,0,1,0,0|2,0,0]=4 5139 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-7581321099 [0,1,0,1,0,0|2,0,0]=4 5140 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-8814127531 [0,1,0,1,0,0|2,0,0]=4 5141 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O MCULE-1877122488 [0,1,0,1,0,0|2,0,0]=4 5142 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-2323153571 [0,1,0,1,0,0|2,0,0]=4 5143 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3627026930 [0,1,0,1,0,0|2,0,0]=4 5144 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3814908416 [0,1,0,1,0,0|2,0,0]=4 5145 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-8552378194 [0,1,0,1,0,0|2,0,0]=4 5146 B8R1.31 O=C(O)C1CCC1F MCULE-6928594613 [0,1,0,1,0,0|2,0,0]=4 5147 B8R1.31 O=C(O)C1CCC1O MCULE-5612797663 [0,1,0,1,0,0|2,0,0]=4 5148 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O MCULE-4502275905 [0,1,0,1,0,0|2,0,0]=4 5149 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O MCULE-1446557503 [0,1,0,1,0,0|2,0,0]=4 5150 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-3693378535 [0,1,0,1,0,0|2,0,0]=4 5151 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-4998471402 [0,1,0,1,0,0|2,0,0]=4 5152 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-1179436878 [0,1,0,1,0,0|2,0,0]=4 5153 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-6666180327 [0,1,0,1,0,0|2,0,0]=4 5154 B8R1.31 [C@@H]1(NC[C@H]1C)C(=O)O MCULE-4107819391 [0,1,0,1,0,0|2,0,0]=4 5155 B8R1.34 CC(=O)C=C1CCC1 MCULE-5198652682 [0,1,0,1,0,0|1,0,0]=3 5156 B8R1.34 CC(=O)C=C1COC1 MCULE-2230856373 [0,1,0,1,0,0|1,0,1]=4 5157 B8R1.34 CC(=O)CC1CCC1 MCULE-8119711389 [0,1,0,1,0,0|1,0,0]=3 5158 B8R1.34 CC(=O)CC1COC1 MCULE-8127220146 [0,1,0,1,0,0|1,0,0]=3 5159 B8R1.34 CC(=O)NC1CNC1 MCULE-8262716671 [0,1,0,1,0,0|1,0,0]=3 5160 B8R1.34 CC(=O)NC1CNC1 MCULE-9475906960 [0,1,0,1,0,0|1,0,0]=3 5161 B8R1.34 CC(=O)OC1CNC1 MCULE-1464943134 [0,1,0,1,0,0|0,0,0]=2 5162 B8R1.34 CC(=O)OC1CNC1 MCULE-2801618495 [0,1,0,1,0,0|0,0,0]=2 5163 B8R1.34 CC(=O)OC1CNC1 MCULE-5204587569 [0,1,0,1,0,0|0,0,0]=2 5164 B8R1.34 CC(=O)SC1CNC1 MCULE-7804874855 [0,1,0,1,0,0|0,1,0]=3 5165 B8R1.34 CC(=O)SC1COC1 MCULE-1737712664 [0,1,0,1,0,0|0,1,0]=3 5166 B8R1.34 CC(C)OC1CNC1 MCULE-1191257602 [0,1,0,1,0,0|1,0,1]=4 5167 B8R1.34 CC(C)OC1CNC1 MCULE-4820782033 [0,1,0,1,0,0|1,0,1]=4 5168 B8R1.34 CC(C)OC1CNC1 MCULE-8714785842 [0,1,0,1,0,0|1,0,1]=4 5169 B8R1.34 NC(=O)CC1CNC1 MCULE-3085452095 [0,1,0,1,0,0|2,0,0]=4 5170 B8R1.34 NC(=O)CC1CNC1 MCULE-7868797282 [0,1,0,1,0,0|2,0,0]=4 5171 B8R1.34 NC(=O)NC1CCC1 MCULE-4153424610 [0,1,0,1,0,0|2,0,0]=4 5172 B8R1.34 NC(=O)OC1CNC1 MCULE-1968679475 [0,1,0,1,0,0|1,0,0]=3 5173 B8R1.34 NC(=O)OC1CNC1 MCULE-9969958473 [0,1,0,1,0,0|1,0,0]=3 5174 B8R1.34 O=C(Cl)CC1CCC1 MCULE-4282346796 [0,1,0,1,0,0|2,0,0]=4 5175 B8R1.34 O=C(O)C=C1CCC1 MCULE-7015909117 [0,1,0,1,0,0|2,0,0]=4 5176 B8R1.34 O=C(O)CC1CCC1 MCULE-3720911045 [0,1,0,1,0,0|2,0,0]=4 5177 B8R1.34 O=C(O)CC1CCN1 MCULE-4161960358 [0,1,0,1,0,0|2,0,0]=4 5178 B8R1.34 O=C(O)CC1CCO1 MCULE-7021545652 [0,1,0,1,0,0|2,0,0]=4 5179 B8R1.34 O=C(O)CC1CNC1 MCULE-4671495498 [0,1,0,1,0,0|2,0,0]=4 5180 B8R1.34 O=C(O)CC1CNC1 MCULE-5456583939 [0,1,0,1,0,0|2,0,0]=4 5181 B8R1.34 O=C(O)CC1CNC1 MCULE-9655427403 [0,1,0,1,0,0|2,0,0]=4 5182 B8R1.34 O=C(O)CC1COC1 MCULE-1090518485 [0,1,0,1,0,0|2,0,0]=4 5183 B8R1.34 O=C(O)CC1CSC1 MCULE-1573505481 [0,1,0,1,0,0|2,0,0]=4 5184 B8R1.34 O=C(O)CN1CCC1 MCULE-2649525817 [0,1,0,1,0,0|2,0,0]=4 5185 B8R1.34 O=C(O)CN1CCC1 MCULE-6889274435 [0,1,0,1,0,0|2,0,0]=4 5186 B8R1.34 O=C([O-])CC1COC1 MCULE-8848528767 [0,1,0,1,0,0|2,0,0]=4 5187 B8R1.40 C=CC(=O)CC1CC1 MCULE-2286262087 [0,1,0,1,0,0|1,0,1]=4 5188 B8R1.40 C=CC(=O)NC1CC1 MCULE-2482571861 [0,1,0,1,0,0|1,0,1]=4 5189 B8R1.40 CCC(=O)CC1CC1 MCULE-7991524982 [0,1,0,1,0,0|1,0,0]=3 5190 B8R1.40 CNC(=O)NC1CC1 MCULE-7333117512 [0,1,0,1,0,0|1,0,0]=3 5191 B8R1.40 CNC(=S)NC1CC1 MCULE-3030208665 [0,1,0,1,0,0|1,1,0]=4 5192 B8R1.40 COC(=O)C=C1CC1 MCULE-9046312556 [0,1,0,1,0,0|1,0,1]=4 5193 B8R1.40 COC(=O)CC1CC1 MCULE-5556326610 [0,1,0,1,0,0|1,0,0]=3 5194 B8R1.40 COC(=O)CC1CO1 MCULE-1978729257 [0,1,0,1,0,0|2,0,0]=4 5195 B8R1.40 COC(=O)C[C@@H]1CO1 MCULE-5425441463 [0,1,0,1,0,0|2,0,0]=4 5196 B8R1.40 NCC(=O)CC1CC1 MCULE-2543196441 [0,1,0,1,0,0|1,0,0]=3 5197 B8R1.40 NCC(=O)CC1CC1 MCULE-5112659326 [0,1,0,1,0,0|1,0,0]=3 5198 B8R1.40 NCC(=O)NC1CC1 MCULE-2762684805 [0,1,0,1,0,0|1,0,0]=3 5199 B8R1.40 NCC(=O)NC1CC1 MCULE-4322562048 [0,1,0,1,0,0|1,0,0]=3 5200 B8R1.40 NCC(=O)OC1CC1 MCULE-9881697631 [0,1,0,1,0,0|0,0,0]=2 5201 B8R1.40 NNC(=O)CC1CC1 MCULE-5050226429 [0,1,0,1,0,0|2,0,0]=4 5202 B8R1.40 NNC(=O)NC1CC1 MCULE-4098919000 [0,1,0,1,0,0|2,0,0]=4 5203 B8R1.40 O=C(CBr)CC1CC1 MCULE-2483365582 [0,1,0,1,0,0|1,0,0]=3 5204 B8R1.40 O=C(CBr)NC1CC1 MCULE-4062220255 [0,1,0,1,0,0|1,0,0]=3 5205 B8R1.40 O=C(CCl)NC1CC1 MCULE-3538029068 [0,1,0,1,0,0|1,0,0]=3 5206 B8R1.40 O=C(CO)NC1CC1 MCULE-8403900056 [0,1,0,1,0,0|1,0,0]=3 5207 B8R1.40 O=C(CS)NC1CC1 MCULE-1359704742 [0,1,0,1,0,0|1,0,0]=3 5208 B8R1.42 CC(=O)CC1(CC1)C MCULE-3117561505 [0,1,0,1,0,0|1,0,0]=3 5209 B8R1.42 CC(=O)OC1(CC1)C MCULE-8484243192 [0,1,0,1,0,0|0,0,0]=2 5210 B8R1.42 CC1(CC1)CC(=O)O MCULE-1590977154 [0,1,0,1,0,0|2,0,0]=4 5211 B8R1.42 CC1(CC1)NC(=O)N MCULE-2689884910 [0,1,0,1,0,0|2,0,0]=4 5212 B8R1.42 NC1(CC1)CC(=O)O MCULE-3593224967 [0,1,0,1,0,0|2,0,0]=4 5213 B8R1.42 NC1(CC1)CC(=O)O MCULE-8049209917 [0,1,0,1,0,0|2,0,0]=4 5214 B8R1.42 O=C(O)CC1(CC1)O MCULE-1745399123 [0,1,0,1,0,0|2,0,0]=4 5215 B8R1.43 CCC1CC1C(=O)O MCULE-2993174891 [0,1,0,1,0,0|2,0,0]=4 5216 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O MCULE-8944777861 [0,1,0,1,0,0|2,0,0]=4 5217 B8R1.43 COC1CC1C(=O)O MCULE-8490015991 [0,1,0,1,0,0|2,0,0]=4 5218 B8R1.43 NC(=O)C1CC1CO MCULE-3191620985 [0,1,0,1,0,0|2,0,0]=4 5219 B8R1.43 NCC1CC1C(=O)O MCULE-8216751454 [0,1,0,1,0,0|2,0,0]=4 5220 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-3415372050 [0,1,0,1,0,0|2,0,0]=4 5221 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-6765918556 [0,1,0,1,0,0|2,0,0]=4 5222 B8R1.43 O=C(O)C1CC1CCl MCULE-8596410287 [0,1,0,1,0,0|2,0,0]=4 5223 B8R1.43 O=C(O)C1CC1CF MCULE-8263605468 [0,1,0,1,0,0|2,0,0]=4 5224 B8R1.43 O=C(O)C1CC1CO MCULE-5433690867 [0,1,0,1,0,0|2,0,0]=4 5225 B8R1.43 O=C(O)[C@@H]1C[C@H]1CCl MCULE-7560724994 [0,1,0,1,0,0|2,0,0]=4 5226 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO MCULE-9657133495 [0,1,0,1,0,0|2,0,0]=4 5227 B8R1.43 O=C(O)[C@H]1C[C@@H]1CO MCULE-1395497386 [0,1,0,1,0,0|2,0,0]=4 5228 B8R1.51 CC1(C=CC(=O)C1)C MCULE-2691948275 [0,1,0,1,0,0|1,0,1]=4 5229 B8R1.51 CC1(CC(=O)CN1)C MCULE-3002354818 [0,1,0,1,0,0|2,0,0]=4 5230 B8R1.51 CC1(CC(=O)CO1)C MCULE-3813236339 [0,1,0,1,0,0|2,0,0]=4 5231 B8R1.51 CC1(CC(=O)CS1)C MCULE-8119393989 [0,1,0,1,0,0|2,0,0]=4 5232 B8R1.51 CC1(CC(=O)NN1)C MCULE-3949987986 [0,1,0,1,0,0|2,0,0]=4 5233 B8R1.51 CC1(CC(=O)NO1)C MCULE-2107007864 [0,1,0,1,0,0|2,0,0]=4 5234 B8R1.51 CC1(CC(CO1)Br)C MCULE-6264816299 [0,1,0,1,0,0|1,0,1]=4 5235 B8R1.51 CC1(CC(CO1)N)C MCULE-7633375889 [0,1,0,1,0,0|1,0,1]=4 5236 B8R1.51 CC1(CC(CO1)N)C MCULE-7644576148 [0,1,0,1,0,0|1,0,1]=4 5237 B8R1.51 CC1(CC(CO1)O)C MCULE-6020499551 [0,1,0,1,0,0|1,0,1]=4 5238 B8R1.51 CC1(CC(CO1)S)C MCULE-1857889655 [0,1,0,1,0,0|1,0,1]=4 5239 B8R1.51 CC1(CCC(=O)C1)C MCULE-9814375082 [0,1,0,1,0,0|1,0,0]=3 5240 B8R1.51 CC1(CCC(=O)N1)C MCULE-2538104334 [0,1,0,1,0,0|2,0,0]=4 5241 B8R1.51 CC1(CCC(=O)O1)C MCULE-3069658569 [0,1,0,1,0,0|2,0,0]=4 5242 B8R1.51 CC1(CCC(O1)O)C MCULE-7092868347 [0,1,0,1,0,0|1,0,1]=4 5243 B8R1.51 CC1(CN=C(C1)N)C MCULE-2728105590 [0,1,0,1,0,0|2,0,0]=4 5244 B8R1.51 CC1(CN=C(C1)N)C MCULE-9014086278 [0,1,0,1,0,0|2,0,0]=4 5245 B8R1.51 CC1(CNC(=O)C1)C MCULE-1184902754 [0,1,0,1,0,0|1,0,0]=3 5246 B8R1.51 CC1(CNC(=O)C1)O MCULE-3317128471 [0,1,0,1,0,0|1,0,0]=3 5247 B8R1.51 CC1(CNC(=O)N1)C MCULE-2885809296 [0,1,0,1,0,0|2,0,0]=4 5248 B8R1.51 CC1(CNC(=O)O1)C MCULE-9188826896 [0,1,0,1,0,0|2,0,0]=4 5249 B8R1.51 CC1(COC(=N1)N)C MCULE-6966870092 [0,1,0,1,0,0|2,0,0]=4 5250 B8R1.51 CC1(COC(=O)C1)C MCULE-2810911497 [0,1,0,1,0,0|0,0,0]=2 5251 B8R1.51 CC1(COC(=O)N1)C MCULE-9709457440 [0,1,0,1,0,0|1,0,0]=3 5252 B8R1.51 CC1(COC(=S)N1)C MCULE-2461637364 [0,1,0,1,0,0|1,1,0]=4 5253 B8R1.51 CC1=NC(CO1)(C)C MCULE-5229270650 [0,1,0,1,0,0|1,0,0]=3 5254 B8R1.51 CC1=NC(CS1)(C)C MCULE-4639517834 [0,1,0,1,0,0|1,1,0]=4 5255 B8R1.51 CC1CCS(=O)(=O)C1 MCULE-8205416735 [0,1,0,1,0,0|2,0,0]=4 5256 B8R1.51 CC1CCS(=O)(=O)O1 MCULE-3194494728 [0,1,0,1,0,0|2,0,0]=4 5257 B8R1.51 CC1CNS(=O)(=O)C1 MCULE-2299608411 [0,1,0,1,0,0|2,0,0]=4 5258 B8R1.51 CC1COC(O1)(C)C MCULE-2118300632 [0,1,0,1,0,0|0,0,2]=4 5259 B8R1.51 CC1COS(=O)(=O)C1 MCULE-3208476537 [0,1,0,1,0,0|1,0,0]=3 5260 B8R1.51 CC1COS(=O)(=O)O1 MCULE-1582385826 [0,1,0,1,0,0|2,0,0]=4 5261 B8R1.51 CP1(=O)CCC(=O)O1 MCULE-3689691243 [0,1,0,1,0,0|1,0,1]=4 5262 B8R1.51 C[C@@H]1COS(=O)(=O)O1 MCULE-8592617135 [0,1,0,1,0,0|2,0,0]=4 5263 B8R1.51 C[C@@H]1COS(=O)(=O)O1 MCULE-8834088750 [0,1,0,1,0,0|2,0,0]=4 5264 B8R1.51 C[C@H]1COS(=O)(=O)O1 MCULE-3969026002 [0,1,0,1,0,0|2,0,0]=4 5265 B8R1.51 C[C@H]1COS(=O)(=O)O1 MCULE-5192877040 [0,1,0,1,0,0|2,0,0]=4 5266 B8R1.51 O=C1CC(CN1)(F)F MCULE-5899183897 [0,1,0,1,0,0|2,0,0]=4 5267 B8R1.51 O=S1(=O)CC(CO1)Br MCULE-9410616687 [0,1,0,1,0,0|2,0,0]=4 5268 B8R1.51 O=S1(=O)CCC(O1)F MCULE-7853949290 [0,1,0,1,0,0|2,0,0]=4 5269 B8R1.62 CC1(CC(=O)C1)CO MCULE-4643412830 [0,1,0,1,0,0|2,0,0]=4 5270 B8R1.62 CC1(CC(=O)N1)CCl MCULE-7182920776 [0,1,0,1,0,0|2,0,0]=4 5271 B8R1.67 C[C@H]1[C@H]([C@@H]1C(=O)O)C MCULE-2637094670 [0,1,0,1,0,0|2,0,0]=4 5272 B8R1.83 CC1CC1C(=O)CCl MCULE-1203840849 [0,1,0,1,0,0|1,0,0]=3 5273 B8R1.83 CC1CC1C(=O)NN MCULE-3813713819 [0,1,0,1,0,0|2,0,0]=4 5274 B8R1.83 CCC(=O)C1CC1C MCULE-4552256059 [0,1,0,1,0,0|1,0,0]=3 5275 B8R1.83 COC(=O)C1CC1Br MCULE-8891645401 [0,1,0,1,0,0|2,0,0]=4 5276 B8R1.83 COC(=O)C1CC1C MCULE-9202068586 [0,1,0,1,0,0|1,0,0]=3 5277 B8R1.83 COC(=O)[C@@H]1C[C@@H]1Br MCULE-3965032710 [0,1,0,1,0,0|2,0,0]=4 5278 B8R1.83 COC(=O)[C@H]1C[C@@H]1Br MCULE-9083522272 [0,1,0,1,0,0|2,0,0]=4 5279 B8R1.2 BrC=C1CCCCC1 MCULE-1203677785 [0,1,0,1,0,0|2,0,0]=4 5280 B8R1.2 BrCC1=CCCCC1 MCULE-4196033923 [0,1,0,1,0,0|2,0,0]=4 5281 B8R1.2 BrCC1CCCCO1 MCULE-7555024882 [0,1,0,1,0,0|1,0,1]=4 5282 B8R1.2 C#CC1=CCCCC1 MCULE-2729587527 [0,1,0,1,0,0|2,0,0]=4 5283 B8R1.2 C#CC1CCCCO1 MCULE-3115070208 [0,1,0,1,0,0|1,0,1]=4 5284 B8R1.2 C/N=C\1/[NH2+]CCCS1 MCULE-7599934566 [0,1,0,1,0,0|1,1,0]=4 5285 B8R1.2 C1(CCCCO1)CC MCULE-5189391029 [0,1,0,1,0,0|1,0,1]=4 5286 B8R1.2 CC=C1CCCCC1 MCULE-6327883518 [0,1,0,1,0,0|2,0,0]=4 5287 B8R1.2 CCC1=NCCCC1 MCULE-5828184755 [0,1,0,1,0,0|2,0,0]=4 5288 B8R1.2 COC1=CCCCC1 MCULE-9079372045 [0,1,0,1,0,0|1,0,1]=4 5289 B8R1.2 COC1=NCCCC1 MCULE-3080988027 [0,1,0,1,0,0|1,0,1]=4 5290 B8R1.2 COC1CCCCO1 MCULE-5586923898 [0,1,0,1,0,0|0,0,2]=4 5291 B8R1.2 COP1OCCCO1 MCULE-2903353416 [0,1,0,1,0,0|1,0,1]=4 5292 B8R1.2 CSC1=NCCCN1 MCULE-4252949660 [0,1,0,1,0,0|2,0,0]=4 5293 B8R1.2 CSC1=NCCCN1 MCULE-4367422216 [0,1,0,1,0,0|2,0,0]=4 5294 B8R1.2 CSC1=NCCCN1 MCULE-7320602045 [0,1,0,1,0,0|2,0,0]=4 5295 B8R1.2 CSC1=NCCCS1 MCULE-6353934403 [0,1,0,1,0,0|1,1,0]=4 5296 B8R1.2 ClCC1CCCCO1 MCULE-7493119643 [0,1,0,1,0,0|1,0,1]=4 5297 B8R1.2 ClCC1OCCCO1 MCULE-7396357867 [0,1,0,1,0,0|0,0,2]=4 5298 B8R1.2 ClN=C1CCCCC1 MCULE-6786339883 [0,1,0,1,0,0|2,0,0]=4 5299 B8R1.2 IC=C1CCCCC1 MCULE-9165742833 [0,1,0,1,0,0|2,0,0]=4 5300 B8R1.2 ICC1CCCCO1 MCULE-4630701067 [0,1,0,1,0,0|1,0,1]=4 5301 B8R1.2 N#CC1=CCCCC1 MCULE-7215745635 [0,1,0,1,0,0|2,0,0]=4 5302 B8R1.2 N#CC1=CCCCO1 MCULE-5646992777 [0,1,0,1,0,0|1,0,1]=4 5303 B8R1.2 N#CC1CCCCO1 MCULE-3506953632 [0,1,0,1,0,0|1,0,1]=4 5304 B8R1.2 NCC1=CCCCC1 MCULE-3951635533 [0,1,0,1,0,0|2,0,0]=4 5305 B8R1.2 NCC1=CCCCC1 MCULE-4923330324 [0,1,0,1,0,0|2,0,0]=4 5306 B8R1.2 NCC1=NCCCN1 MCULE-3240095476 [0,1,0,1,0,0|2,0,0]=4 5307 B8R1.2 NCC1=NCCCN1 MCULE-7557068134 [0,1,0,1,0,0|2,0,0]=4 5308 B8R1.2 NCC1CCCCO1 MCULE-2644735894 [0,1,0,1,0,0|1,0,1]=4 5309 B8R1.2 NCC1CCCCO1 MCULE-5042678896 [0,1,0,1,0,0|1,0,1]=4 5310 B8R1.2 NCC1OCCCO1 MCULE-8138335107 [0,1,0,1,0,0|0,0,2]=4 5311 B8R1.2 NC[C@@H]1CCCCO1 MCULE-1435985280 [0,1,0,1,0,0|1,0,1]=4 5312 B8R1.2 NC[C@@H]1CCCCO1 MCULE-4778440271 [0,1,0,1,0,0|1,0,1]=4 5313 B8R1.2 NC[C@@H]1CCCCO1 MCULE-6014338525 [0,1,0,1,0,0|1,0,1]=4 5314 B8R1.2 NC[C@@H]1CCCCO1 MCULE-9488694680 [0,1,0,1,0,0|1,0,1]=4 5315 B8R1.2 NC[C@H]1CCCCO1 MCULE-2835389541 [0,1,0,1,0,0|1,0,1]=4 5316 B8R1.2 NC[C@H]1CCCCO1 MCULE-4500797236 [0,1,0,1,0,0|1,0,1]=4 5317 B8R1.2 NC[C@H]1CCCCO1 MCULE-5990717573 [0,1,0,1,0,0|1,0,1]=4 5318 B8R1.2 NC[C@H]1CCCCO1 MCULE-7362278601 [0,1,0,1,0,0|1,0,1]=4 5319 B8R1.2 NOC1CCCCO1 MCULE-2818785498 [0,1,0,1,0,0|0,0,2]=4 5320 B8R1.2 O=CC1=CCCCC1 MCULE-6209420256 [0,1,0,1,0,0|1,0,0]=3 5321 B8R1.2 O=CC1=CCCOC1 MCULE-5495935874 [0,1,0,1,0,0|2,0,0]=4 5322 B8R1.2 O=CC1=CCCSC1 MCULE-9611960845 [0,1,0,1,0,0|2,0,0]=4 5323 B8R1.2 O=CC1=COCCC1 MCULE-5246467858 [0,1,0,1,0,0|2,0,0]=4 5324 B8R1.2 O=CC1=COCCO1 MCULE-4502742368 [0,1,0,1,0,0|1,0,1]=4 5325 B8R1.2 O=CC1CCCCC1 MCULE-7345097178 [0,1,0,1,0,0|1,0,1]=4 5326 B8R1.2 O=CC1CCCCN1 MCULE-7681438476 [0,1,0,1,0,0|1,0,1]=4 5327 B8R1.2 O=CC1CCCCN1 MCULE-9370686295 [0,1,0,1,0,0|1,0,1]=4 5328 B8R1.2 O=CC1CCCCO1 MCULE-6497412510 [0,1,0,1,0,0|0,0,1]=3 5329 B8R1.2 O=CC1COCCO1 MCULE-3817488986 [0,1,0,1,0,0|1,0,1]=4 5330 B8R1.2 O=CN1CCCCC1 MCULE-3028605826 [0,1,0,1,0,0|2,0,0]=4 5331 B8R1.2 O=NN1CCCCC1 MCULE-6180064865 [0,1,0,1,0,0|2,0,0]=4 5332 B8R1.2 OCC1=CCCCC1 MCULE-2422738199 [0,1,0,1,0,0|1,0,1]=4 5333 B8R1.2 OCC1=CCCCO1 MCULE-1995059172 [0,1,0,1,0,0|1,0,0]=3 5334 B8R1.2 OCC1CCCCO1 MCULE-2390789074 [0,1,0,1,0,0|0,0,2]=4 5335 B8R1.2 OCC1CCCCO1 MCULE-7483291767 [0,1,0,1,0,0|0,0,2]=4 5336 B8R1.2 OCC1OCCCO1 MCULE-6150110813 [0,1,0,1,0,0|0,0,2]=4 5337 B8R1.2 OC[C@@H]1CCCCO1 MCULE-5978396739 [0,1,0,1,0,0|0,0,2]=4 5338 B8R1.2 OC[C@@H]1CCCCO1 MCULE-8715909099 [0,1,0,1,0,0|0,0,2]=4 5339 B8R1.2 OC[C@H]1CCCCO1 MCULE-4700719427 [0,1,0,1,0,0|0,0,2]=4 5340 B8R1.2 OC[C@H]1CCCCO1 MCULE-7990169259 [0,1,0,1,0,0|0,0,2]=4 5341 B8R1.2 ON=C1CCCCC1 MCULE-4628080057 [0,1,0,1,0,0|1,0,1]=4 5342 B8R1.3 C1(CNC(=O)CN1)C MCULE-9891046463 [0,1,0,1,0,0|1,0,0]=3 5343 B8R1.3 C=C1CCC(=O)CC1 MCULE-8766071389 [0,1,0,1,0,0|1,0,1]=4 5344 B8R1.3 C=C1CCC(CC1)C MCULE-8335929583 [0,1,0,1,0,0|2,0,0]=4 5345 B8R1.3 C=C1CCC(CC1)N MCULE-3488509161 [0,1,0,1,0,0|2,0,0]=4 5346 B8R1.3 C=C1CCC(CC1)N MCULE-4928995581 [0,1,0,1,0,0|2,0,0]=4 5347 B8R1.3 CC1=CCC(=O)CC1 MCULE-5396065385 [0,1,0,1,0,0|1,0,1]=4 5348 B8R1.3 CC1=CCC(CC1)N MCULE-2698586518 [0,1,0,1,0,0|2,0,0]=4 5349 B8R1.3 CC1C=CC(=O)CC1 MCULE-6972928704 [0,1,0,1,0,0|1,0,1]=4 5350 B8R1.3 CC1CC=C(CC1)Cl MCULE-9255462781 [0,1,0,1,0,0|2,0,0]=4 5351 B8R1.3 CC1CCC(=O)CC1 MCULE-5534475096 [0,1,0,1,0,0|1,0,0]=3 5352 B8R1.3 CC1CCC(=O)CC1 MCULE-9038467737 [0,1,0,1,0,0|1,0,0]=3 5353 B8R1.3 CC1CCC(=O)CN1 MCULE-1285022466 [0,1,0,1,0,0|1,0,0]=3 5354 B8R1.3 CC1CCC(=O)CN1 MCULE-9314433387 [0,1,0,1,0,0|1,0,0]=3 5355 B8R1.3 CC1CCC(=O)CO1 MCULE-8334906567 [0,1,0,1,0,0|1,0,0]=3 5356 B8R1.3 CC1CCC(=O)CS1 MCULE-9188619559 [0,1,0,1,0,0|1,0,0]=3 5357 B8R1.3 CC1CCC(=O)NC1 MCULE-1307751847 [0,1,0,1,0,0|1,0,0]=3 5358 B8R1.3 CC1CCC(CO1)O MCULE-8416383333 [0,1,0,1,0,0|1,0,1]=4 5359 B8R1.3 CC1CNC(=O)CN1 MCULE-2050820306 [0,1,0,1,0,0|1,0,0]=3 5360 B8R1.3 CC1CNC(=O)CN1 MCULE-9509469557 [0,1,0,1,0,0|1,0,0]=3 5361 B8R1.3 CC1CNC(=O)CO1 MCULE-6817757578 [0,1,0,1,0,0|1,0,0]=3 5362 B8R1.3 CC1COC(=O)OC1 MCULE-6795228051 [0,1,0,1,0,0|0,0,0]=2 5363 B8R1.3 CC1COC(CN1)C MCULE-4975068364 [0,1,0,1,0,0|1,0,1]=4 5364 B8R1.3 CC1COC(CN1)C MCULE-6443209935 [0,1,0,1,0,0|1,0,1]=4 5365 B8R1.3 CN1CCC(=O)CC1 MCULE-3370577555 [0,1,0,1,0,0|2,0,0]=4 5366 B8R1.3 CN1CCC(=O)CC1 MCULE-5364011649 [0,1,0,1,0,0|2,0,0]=4 5367 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-4693797730 [0,1,0,1,0,0|1,0,0]=3 5368 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-5991774380 [0,1,0,1,0,0|1,0,0]=3 5369 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-6484213897 [0,1,0,1,0,0|1,0,0]=3 5370 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-7346191190 [0,1,0,1,0,0|1,0,0]=3 5371 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-1088991552 [0,1,0,1,0,0|1,0,0]=3 5372 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-1952714815 [0,1,0,1,0,0|1,0,0]=3 5373 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-3350871833 [0,1,0,1,0,0|1,0,0]=3 5374 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-9637742350 [0,1,0,1,0,0|1,0,0]=3 5375 B8R1.3 C[C@@H]1CNC(=O)CO1 MCULE-7192421297 [0,1,0,1,0,0|1,0,0]=3 5376 B8R1.3 C[C@@H]1CNC(=O)CO1 MCULE-7394512903 [0,1,0,1,0,0|1,0,0]=3 5377 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-1103945502 [0,1,0,1,0,0|1,0,1]=4 5378 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-1391537108 [0,1,0,1,0,0|1,0,1]=4 5379 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-1946095385 [0,1,0,1,0,0|1,0,1]=4 5380 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-4549349129 [0,1,0,1,0,0|1,0,1]=4 5381 B8R1.3 C[C@H]1CCC(=O)CN1 MCULE-6334939841 [0,1,0,1,0,0|1,0,0]=3 5382 B8R1.3 C[C@H]1CCC(=O)CN1 MCULE-8476307649 [0,1,0,1,0,0|1,0,0]=3 5383 B8R1.3 C[C@H]1CCC(=O)NC1 MCULE-5712112445 [0,1,0,1,0,0|1,0,0]=3 5384 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-3373819559 [0,1,0,1,0,0|1,0,0]=3 5385 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-4486681671 [0,1,0,1,0,0|1,0,0]=3 5386 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-7180229103 [0,1,0,1,0,0|1,0,0]=3 5387 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-9466864223 [0,1,0,1,0,0|1,0,0]=3 5388 B8R1.3 C[C@H]1CNC(=O)CO1 MCULE-6169535590 [0,1,0,1,0,0|1,0,0]=3 5389 B8R1.3 C[C@H]1CNC(=O)CO1 MCULE-8876635175 [0,1,0,1,0,0|1,0,0]=3 5390 B8R1.3 C[C@H]1CN[C@@H](CO1)C MCULE-4621250808 [0,1,0,1,0,0|1,0,1]=4 5391 B8R1.3 C[C@H]1CN[C@@H](CO1)C MCULE-7331563103 [0,1,0,1,0,0|1,0,1]=4 5392 B8R1.3 C[C@H]1CO[C@@H](CN1)C MCULE-5045303209 [0,1,0,1,0,0|1,0,1]=4 5393 B8R1.3 C[C@H]1CO[C@@H](CN1)C MCULE-8352332219 [0,1,0,1,0,0|1,0,1]=4 5394 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-1410633938 [0,1,0,1,0,0|1,0,1]=4 5395 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-1498993915 [0,1,0,1,0,0|1,0,1]=4 5396 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-3545205619 [0,1,0,1,0,0|1,0,1]=4 5397 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-5064602423 [0,1,0,1,0,0|1,0,1]=4 5398 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-5773597642 [0,1,0,1,0,0|1,0,1]=4 5399 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-6073716335 [0,1,0,1,0,0|1,0,1]=4 5400 B8R1.3 NC1CC=C(CC1)F MCULE-2544035375 [0,1,0,1,0,0|2,0,0]=4 5401 B8R1.3 NC1CC=C(CC1)F MCULE-8564869491 [0,1,0,1,0,0|2,0,0]=4 5402 B8R1.3 NC1CCC(=O)CC1 MCULE-5825363145 [0,1,0,1,0,0|1,0,0]=3 5403 B8R1.3 NC1CCC(=O)CC1 MCULE-6212878324 [0,1,0,1,0,0|1,0,0]=3 5404 B8R1.3 NC1CCC(=O)NC1 MCULE-2677675224 [0,1,0,1,0,0|1,0,0]=3 5405 B8R1.3 NC1CCC(=O)NC1 MCULE-8711968877 [0,1,0,1,0,0|1,0,0]=3 5406 B8R1.3 NC1CCC(=O)NC1 MCULE-8915391016 [0,1,0,1,0,0|1,0,0]=3 5407 B8R1.3 NC1CCS(=O)CC1 MCULE-3451996362 [0,1,0,1,0,0|2,0,0]=4 5408 B8R1.3 NC1CCS(=O)CC1 MCULE-4019175019 [0,1,0,1,0,0|2,0,0]=4 5409 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-5372893548 [0,1,0,1,0,0|1,0,0]=3 5410 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-6411408704 [0,1,0,1,0,0|1,0,0]=3 5411 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-6771263407 [0,1,0,1,0,0|1,0,0]=3 5412 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-9035818807 [0,1,0,1,0,0|1,0,0]=3 5413 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-1921494480 [0,1,0,1,0,0|1,0,0]=3 5414 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-4843708987 [0,1,0,1,0,0|1,0,0]=3 5415 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-6599794889 [0,1,0,1,0,0|1,0,0]=3 5416 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-7112568050 [0,1,0,1,0,0|1,0,0]=3 5417 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-9053885307 [0,1,0,1,0,0|1,0,0]=3 5418 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-9780118077 [0,1,0,1,0,0|1,0,0]=3 5419 B8R1.3 O=C1CCC(=O)CC1 MCULE-5432049567 [0,1,0,1,0,0|1,0,1]=4 5420 B8R1.3 O=C1CCC(=O)NC1 MCULE-8297515560 [0,1,0,1,0,0|1,0,1]=4 5421 B8R1.3 O=C1CCC(=O)OC1 MCULE-5478039984 [0,1,0,1,0,0|0,0,1]=3 5422 B8R1.3 O=C1CCC(CC1)Br MCULE-1177789896 [0,1,0,1,0,0|1,0,0]=3 5423 B8R1.3 O=C1CCC(CC1)Cl MCULE-3647406761 [0,1,0,1,0,0|1,0,0]=3 5424 B8R1.3 O=C1CCC(CC1)F MCULE-5757540710 [0,1,0,1,0,0|1,0,0]=3 5425 B8R1.3 O=C1CCC(CC1)O MCULE-7247867750 [0,1,0,1,0,0|1,0,0]=3 5426 B8R1.3 O=C1CCC(CN1)F MCULE-1848493447 [0,1,0,1,0,0|1,0,0]=3 5427 B8R1.3 O=C1CCC(CN1)O MCULE-4501886280 [0,1,0,1,0,0|1,0,0]=3 5428 B8R1.3 O=C1CCC(CO1)O MCULE-6372408261 [0,1,0,1,0,0|0,0,0]=2 5429 B8R1.3 O=C1CCS(=O)CC1 MCULE-5385870019 [0,1,0,1,0,0|2,0,0]=4 5430 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-3426407148 [0,1,0,1,0,0|1,0,0]=3 5431 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-9592320749 [0,1,0,1,0,0|1,0,0]=3 5432 B8R1.3 O=C1CC[C@H](CN1)O MCULE-1500705916 [0,1,0,1,0,0|1,0,0]=3 5433 B8R1.3 O=C1CC[C@H](CN1)O MCULE-9578240246 [0,1,0,1,0,0|1,0,0]=3 5434 B8R1.3 O=C1COC(=O)CN1 MCULE-4171313774 [0,1,0,1,0,0|1,0,1]=4 5435 B8R1.3 O=C1COC(=O)CO1 MCULE-8927291216 [0,1,0,1,0,0|1,0,1]=4 5436 B8R1.3 O=C1NCC(CN1)O MCULE-7019603243 [0,1,0,1,0,0|2,0,0]=4 5437 B8R1.3 O=S1CCC(CC1)O MCULE-7693506009 [0,1,0,1,0,0|2,0,0]=4 5438 B8R1.3 [C@@H]1(CN[C@@H](CO1)C)C MCULE-3712952908 [0,1,0,1,0,0|1,0,1]=4 5439 B8R1.5 BrC1=C(CCCC1)Br MCULE-3043011492 [0,1,0,1,0,0|2,0,0]=4 5440 B8R1.5 BrC1=CCCCC1Br MCULE-4680116883 [0,1,0,1,0,0|2,0,0]=4 5441 B8R1.5 BrC1CCCOC1Br MCULE-5122148511 [0,1,0,1,0,0|1,0,1]=4 5442 B8R1.5 C=C1CCCCC1O MCULE-3853228524 [0,1,0,1,0,0|2,0,0]=4 5443 B8R1.5 C=C1CCCCC1O MCULE-5911864977 [0,1,0,1,0,0|2,0,0]=4 5444 B8R1.5 C=C1CCCNC1=O MCULE-1867993758 [0,1,0,1,0,0|1,0,1]=4 5445 B8R1.5 CC1=CCCCC1=O MCULE-6245248136 [0,1,0,1,0,0|1,0,0]=3 5446 B8R1.5 CC1=NCCCN1C MCULE-1598225464 [0,1,0,1,0,0|2,0,0]=4 5447 B8R1.5 CC1CCCCC1=O MCULE-6363555535 [0,1,0,1,0,0|1,0,0]=3 5448 B8R1.5 CC1CCCNC1=O MCULE-5295531632 [0,1,0,1,0,0|1,0,0]=3 5449 B8R1.5 CC1CCCOC1=O MCULE-5926029136 [0,1,0,1,0,0|0,0,0]=2 5450 B8R1.5 CC1CCNCC1=O MCULE-8618050685 [0,1,0,1,0,0|2,0,0]=4 5451 B8R1.5 CC1CCNCC1=O MCULE-9238977073 [0,1,0,1,0,0|2,0,0]=4 5452 B8R1.5 CC1CCOCC1=O MCULE-2481965177 [0,1,0,1,0,0|2,0,0]=4 5453 B8R1.5 CC1CNCCC1=O MCULE-6306655160 [0,1,0,1,0,0|2,0,0]=4 5454 B8R1.5 CC1CNCCC1=O MCULE-9018912988 [0,1,0,1,0,0|2,0,0]=4 5455 B8R1.5 CC1COCCC1=O MCULE-2694187526 [0,1,0,1,0,0|2,0,0]=4 5456 B8R1.5 CC1CSCCC1=O MCULE-4565033608 [0,1,0,1,0,0|2,0,0]=4 5457 B8R1.5 CC1NCCCC1=O MCULE-1303642695 [0,1,0,1,0,0|1,0,1]=4 5458 B8R1.5 CC1NCCCC1=O MCULE-6618358169 [0,1,0,1,0,0|1,0,1]=4 5459 B8R1.5 CC1NCCNC1=O MCULE-3078767867 [0,1,0,1,0,0|2,0,0]=4 5460 B8R1.5 CC1NCCNC1=O MCULE-9884862705 [0,1,0,1,0,0|2,0,0]=4 5461 B8R1.5 CC1OCCNC1=O MCULE-8812176499 [0,1,0,1,0,0|1,0,1]=4 5462 B8R1.5 CC1SCCCC1=O MCULE-7641066964 [0,1,0,1,0,0|0,1,1]=4 5463 B8R1.5 CC1SCCNC1=O MCULE-1825894745 [0,1,0,1,0,0|2,0,0]=4 5464 B8R1.5 CN1CCCCC1=O MCULE-9619129797 [0,1,0,1,0,0|1,0,0]=3 5465 B8R1.5 CN1CCCNC1=O MCULE-3141639397 [0,1,0,1,0,0|1,0,0]=3 5466 B8R1.5 CN1CCCNC1=S MCULE-2262321761 [0,1,0,1,0,0|1,1,0]=4 5467 B8R1.5 CN1CCNCC1=O MCULE-4783963074 [0,1,0,1,0,0|2,0,0]=4 5468 B8R1.5 CN1CCNCC1=O MCULE-7251084542 [0,1,0,1,0,0|2,0,0]=4 5469 B8R1.5 CN1CCNCC1=O MCULE-9201460493 [0,1,0,1,0,0|2,0,0]=4 5470 B8R1.5 CN1CCNCC1=O MCULE-9789420240 [0,1,0,1,0,0|2,0,0]=4 5471 B8R1.5 CN1CCOCC1=O MCULE-8864378597 [0,1,0,1,0,0|2,0,0]=4 5472 B8R1.5 C[C@@H]1NCCNC1=O MCULE-1719923601 [0,1,0,1,0,0|2,0,0]=4 5473 B8R1.5 C[C@@H]1NCCNC1=O MCULE-3211216058 [0,1,0,1,0,0|2,0,0]=4 5474 B8R1.5 C[C@@H]1NCCNC1=O MCULE-4268624973 [0,1,0,1,0,0|2,0,0]=4 5475 B8R1.5 C[C@H]1CNCCC1=O MCULE-8062269317 [0,1,0,1,0,0|2,0,0]=4 5476 B8R1.5 C[C@H]1CNCCC1=O MCULE-9510433313 [0,1,0,1,0,0|2,0,0]=4 5477 B8R1.5 C[C@H]1COCCC1=O MCULE-3103478095 [0,1,0,1,0,0|2,0,0]=4 5478 B8R1.5 C[C@H]1NCCNC1=O MCULE-1350777729 [0,1,0,1,0,0|2,0,0]=4 5479 B8R1.5 C[C@H]1NCCNC1=O MCULE-3433713206 [0,1,0,1,0,0|2,0,0]=4 5480 B8R1.5 C[C@H]1NCCNC1=O MCULE-6014092524 [0,1,0,1,0,0|2,0,0]=4 5481 B8R1.5 FC1=C(CCCC1)Br MCULE-1560441134 [0,1,0,1,0,0|2,0,0]=4 5482 B8R1.5 NC1CCCCC1=O MCULE-2382898926 [0,1,0,1,0,0|1,0,0]=3 5483 B8R1.5 NC1CCCCC1=O MCULE-9230455128 [0,1,0,1,0,0|1,0,0]=3 5484 B8R1.5 NC1CCCNC1=O MCULE-2560564171 [0,1,0,1,0,0|1,0,0]=3 5485 B8R1.5 NC1CCCNC1=O MCULE-4494449620 [0,1,0,1,0,0|1,0,0]=3 5486 B8R1.5 NC1CCCNC1=O MCULE-7473475906 [0,1,0,1,0,0|1,0,0]=3 5487 B8R1.5 NC1CCCNC1=O MCULE-8288645102 [0,1,0,1,0,0|1,0,0]=3 5488 B8R1.5 NC1COCCC1=O MCULE-2621905094 [0,1,0,1,0,0|2,0,0]=4 5489 B8R1.5 NC1COCCC1=O MCULE-5417580672 [0,1,0,1,0,0|2,0,0]=4 5490 B8R1.5 NN1CCCCC1=O MCULE-3663308028 [0,1,0,1,0,0|1,0,0]=3 5491 B8R1.5 NN1CCCCC1=O MCULE-9929233745 [0,1,0,1,0,0|1,0,0]=3 5492 B8R1.5 NN1CCCNC1=O MCULE-1690172508 [0,1,0,1,0,0|2,0,0]=4 5493 B8R1.5 NN1CCCOC1=O MCULE-6942418314 [0,1,0,1,0,0|1,0,0]=3 5494 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2058435105 [0,1,0,1,0,0|1,0,0]=3 5495 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2444659445 [0,1,0,1,0,0|1,0,0]=3 5496 B8R1.5 N[C@@H]1CCCNC1=O MCULE-3005560472 [0,1,0,1,0,0|1,0,0]=3 5497 B8R1.5 N[C@@H]1CCCNC1=O MCULE-6935410876 [0,1,0,1,0,0|1,0,0]=3 5498 B8R1.5 N[C@H]1CCCNC1=O MCULE-1247931890 [0,1,0,1,0,0|1,0,0]=3 5499 B8R1.5 N[C@H]1CCCNC1=O MCULE-2425510086 [0,1,0,1,0,0|1,0,0]=3 5500 B8R1.5 N[C@H]1CCCNC1=O MCULE-6121950966 [0,1,0,1,0,0|1,0,0]=3 5501 B8R1.5 N[C@H]1CCCNC1=O MCULE-7701042199 [0,1,0,1,0,0|1,0,0]=3 5502 B8R1.5 O=C1CCCC=C1Br MCULE-3661382076 [0,1,0,1,0,0|1,0,1]=4 5503 B8R1.5 O=C1CCCC=C1I MCULE-5006563152 [0,1,0,1,0,0|1,0,1]=4 5504 B8R1.5 O=C1CCCCC1=O MCULE-5770827130 [0,1,0,1,0,0|1,0,0]=3 5505 B8R1.5 O=C1CCCCC1Br MCULE-9356057483 [0,1,0,1,0,0|1,0,0]=3 5506 B8R1.5 O=C1CCCCC1Cl MCULE-1580566298 [0,1,0,1,0,0|1,0,0]=3 5507 B8R1.5 O=C1CCCCC1F MCULE-6406930837 [0,1,0,1,0,0|1,0,0]=3 5508 B8R1.5 O=C1CCCCC1O MCULE-7509366699 [0,1,0,1,0,0|1,0,0]=3 5509 B8R1.5 O=C1CCCNC1=O MCULE-3369124759 [0,1,0,1,0,0|1,0,1]=4 5510 B8R1.5 O=C1CCNCC1Br MCULE-1607524353 [0,1,0,1,0,0|2,0,0]=4 5511 B8R1.5 O=C1CCNCC1Br MCULE-2623420651 [0,1,0,1,0,0|2,0,0]=4 5512 B8R1.5 O=C1CCNCC1Br MCULE-9921456309 [0,1,0,1,0,0|2,0,0]=4 5513 B8R1.5 O=C1CCNCC1F MCULE-4156323292 [0,1,0,1,0,0|2,0,0]=4 5514 B8R1.5 O=C1CCNCC1F MCULE-5488977269 [0,1,0,1,0,0|2,0,0]=4 5515 B8R1.5 O=C1CCNC[C@@H]1F MCULE-1703177711 [0,1,0,1,0,0|2,0,0]=4 5516 B8R1.5 O=C1CCNC[C@@H]1F MCULE-2722101377 [0,1,0,1,0,0|2,0,0]=4 5517 B8R1.5 O=C1CCNC[C@@H]1F MCULE-3843083136 [0,1,0,1,0,0|2,0,0]=4 5518 B8R1.5 O=C1CCNC[C@@H]1F MCULE-8423259867 [0,1,0,1,0,0|2,0,0]=4 5519 B8R1.5 O=C1CCNC[C@H]1F MCULE-4893691455 [0,1,0,1,0,0|2,0,0]=4 5520 B8R1.5 O=C1CCNC[C@H]1F MCULE-7014608979 [0,1,0,1,0,0|2,0,0]=4 5521 B8R1.5 O=C1CCOCC1Br MCULE-1103002154 [0,1,0,1,0,0|2,0,0]=4 5522 B8R1.5 O=C1CCOCC1Cl MCULE-6926183930 [0,1,0,1,0,0|2,0,0]=4 5523 B8R1.5 O=C1CCOCC1F MCULE-8590362767 [0,1,0,1,0,0|2,0,0]=4 5524 B8R1.5 O=C1CCOCC1O MCULE-7032874317 [0,1,0,1,0,0|2,0,0]=4 5525 B8R1.5 O=C1CCOC[C@@H]1Br MCULE-8729201111 [0,1,0,1,0,0|2,0,0]=4 5526 B8R1.5 O=C1CCOC[C@@H]1F MCULE-3075219245 [0,1,0,1,0,0|2,0,0]=4 5527 B8R1.5 O=C1NCCCC1Br MCULE-1860833784 [0,1,0,1,0,0|1,0,0]=3 5528 B8R1.5 O=C1NCCCC1O MCULE-4922755542 [0,1,0,1,0,0|1,0,0]=3 5529 B8R1.5 O=C1NCCC[C@@H]1O MCULE-2813817931 [0,1,0,1,0,0|1,0,0]=3 5530 B8R1.5 O=C1NCCC[C@@H]1O MCULE-3354550946 [0,1,0,1,0,0|1,0,0]=3 5531 B8R1.5 O=C1NCCC[C@H]1O MCULE-2892218765 [0,1,0,1,0,0|1,0,0]=3 5532 B8R1.5 O=C1NCCC[C@H]1O MCULE-8394704933 [0,1,0,1,0,0|1,0,0]=3 5533 B8R1.5 O=C1NCCOC1=O MCULE-5092732656 [0,1,0,1,0,0|1,0,1]=4 5534 B8R1.5 O=C1OCCC=C1Br MCULE-6619697801 [0,1,0,1,0,0|0,0,2]=4 5535 B8R1.5 O=C1OCCCC1Br MCULE-4407787541 [0,1,0,1,0,0|0,0,0]=2 5536 B8R1.5 O=C1OCCCC1O MCULE-3021418071 [0,1,0,1,0,0|0,0,0]=2 5537 B8R1.5 OC1CCCC=C1Br MCULE-1040444564 [0,1,0,1,0,0|2,0,0]=4 5538 B8R1.5 O[C@@H]1CCCC=C1Br MCULE-9847748740 [0,1,0,1,0,0|2,0,0]=4 5539 B8R1.10 CCCOC1CNC1 MCULE-3244679891 [0,1,0,1,0,0|1,0,1]=4 5540 B8R1.10 CCCOC1CNC1 MCULE-7869061148 [0,1,0,1,0,0|1,0,1]=4 5541 B8R1.10 CCCOC1CNC1 MCULE-8082413973 [0,1,0,1,0,0|1,0,1]=4 5542 B8R1.13 CCCC1CCC1=O MCULE-7626165824 [0,1,0,1,0,0|1,0,0]=3 5543 B8R1.13 O=C1CCC1CCCl MCULE-1577834742 [0,1,0,1,0,0|2,0,0]=4 5544 B8R1.22 BrC1=CCCCCC1 MCULE-1629255872 [0,1,0,1,0,0|2,0,0]=4 5545 B8R1.22 C=C1CCCNCC1 MCULE-2798255197 [0,1,0,1,0,0|2,0,0]=4 5546 B8R1.22 C=C1CCCNCC1 MCULE-4874852480 [0,1,0,1,0,0|2,0,0]=4 5547 B8R1.22 C=C1CNCCOC1 MCULE-6114191545 [0,1,0,1,0,0|2,0,0]=4 5548 B8R1.22 C=C1CNCCOC1 MCULE-6722705565 [0,1,0,1,0,0|2,0,0]=4 5549 B8R1.22 C=C1COCCOC1 MCULE-3194930888 [0,1,0,1,0,0|2,0,0]=4 5550 B8R1.22 C=C1OCCCCO1 MCULE-8283334358 [0,1,0,1,0,0|1,0,0]=3 5551 B8R1.22 CC1CNCCCO1 MCULE-6836650488 [0,1,0,1,0,0|1,0,1]=4 5552 B8R1.22 CC1CNCCCO1 MCULE-8246520743 [0,1,0,1,0,0|1,0,1]=4 5553 B8R1.22 CC1COCCCN1 MCULE-5522410500 [0,1,0,1,0,0|1,0,1]=4 5554 B8R1.22 C[C@@H]1CCNCCO1 MCULE-4706490422 [0,1,0,1,0,0|1,0,1]=4 5555 B8R1.22 C[C@@H]1CCNCCO1 MCULE-7769149413 [0,1,0,1,0,0|1,0,1]=4 5556 B8R1.22 NC1=NCCCCC1 MCULE-2757008672 [0,1,0,1,0,0|2,0,0]=4 5557 B8R1.22 NC1=NCCCCC1 MCULE-7781415779 [0,1,0,1,0,0|2,0,0]=4 5558 B8R1.22 O=C1C=CCCCC1 MCULE-5281461360 [0,1,0,1,0,0|1,0,0]=3 5559 B8R1.22 O=C1C=CCCCN1 MCULE-6257739832 [0,1,0,1,0,0|1,0,1]=4 5560 B8R1.22 O=C1CCC=CCC1 MCULE-5704984437 [0,1,0,1,0,0|1,0,1]=4 5561 B8R1.22 O=C1CCCCCC1 MCULE-3507111924 [0,1,0,1,0,0|1,0,0]=3 5562 B8R1.22 O=C1CCCCCN1 MCULE-4544579564 [0,1,0,1,0,0|1,0,0]=3 5563 B8R1.22 O=C1CCCCCO1 MCULE-3051096014 [0,1,0,1,0,0|0,0,0]=2 5564 B8R1.22 O=C1CCCCNC1 MCULE-8257380915 [0,1,0,1,0,0|1,0,0]=3 5565 B8R1.22 O=C1CCCCNC1 MCULE-8344538815 [0,1,0,1,0,0|1,0,0]=3 5566 B8R1.22 O=C1CCCNCC1 MCULE-3201401906 [0,1,0,1,0,0|1,0,0]=3 5567 B8R1.22 O=C1CCCNCC1 MCULE-8264253371 [0,1,0,1,0,0|1,0,0]=3 5568 B8R1.22 O=C1CCCOCC1 MCULE-9595066384 [0,1,0,1,0,0|1,0,0]=3 5569 B8R1.22 O=C1CCCSCC1 MCULE-9359592851 [0,1,0,1,0,0|1,0,0]=3 5570 B8R1.22 O=C1CCNCCN1 MCULE-1678306131 [0,1,0,1,0,0|1,0,0]=3 5571 B8R1.22 O=C1CCNCCN1 MCULE-1867860146 [0,1,0,1,0,0|1,0,0]=3 5572 B8R1.22 O=C1CCOCCN1 MCULE-6881734685 [0,1,0,1,0,0|1,0,0]=3 5573 B8R1.22 O=C1CCOCCO1 MCULE-1433837187 [0,1,0,1,0,0|0,0,0]=2 5574 B8R1.22 O=C1CCSCCN1 MCULE-9445131358 [0,1,0,1,0,0|1,0,0]=3 5575 B8R1.22 O=C1CNCCCN1 MCULE-6106237928 [0,1,0,1,0,0|1,0,0]=3 5576 B8R1.22 O=C1CNCCCN1 MCULE-9943393784 [0,1,0,1,0,0|1,0,0]=3 5577 B8R1.22 O=C1CNCCNC1 MCULE-2450825992 [0,1,0,1,0,0|2,0,0]=4 5578 B8R1.22 O=C1CNCCNC1 MCULE-7379420394 [0,1,0,1,0,0|2,0,0]=4 5579 B8R1.22 O=C1CNCCOC1 MCULE-7546546158 [0,1,0,1,0,0|1,0,0]=3 5580 B8R1.22 O=C1CNCCOC1 MCULE-9183427962 [0,1,0,1,0,0|1,0,0]=3 5581 B8R1.22 O=C1COCCCN1 MCULE-1471963909 [0,1,0,1,0,0|1,0,0]=3 5582 B8R1.22 O=C1COCCOC1 MCULE-4481438739 [0,1,0,1,0,0|1,0,0]=3 5583 B8R1.22 O=C1CSCCSC1 MCULE-5039848738 [0,1,0,1,0,0|1,1,0]=4 5584 B8R1.22 O=C1OCCCCO1 MCULE-1107419276 [0,1,0,1,0,0|0,0,0]=2 5585 B8R1.22 O=S1CCCNCC1 MCULE-1954952183 [0,1,0,1,0,0|2,0,0]=4 5586 B8R1.22 O=S1CCCNCC1 MCULE-2035316359 [0,1,0,1,0,0|2,0,0]=4 5587 B8R1.22 O=S1OCCCCO1 MCULE-6898726705 [0,1,0,1,0,0|1,0,0]=3 5588 B8R1.22 S=C1CCCCCN1 MCULE-6573611309 [0,1,0,1,0,0|1,1,0]=4 5589 B8R1.22 S=C1NCCCCN1 MCULE-5312414479 [0,1,0,1,0,0|1,1,0]=4 5590 B8R1.38 C#CC(=O)C1CCC1 MCULE-7044839324 [0,1,0,1,0,0|1,0,1]=4 5591 B8R1.38 C1(CCN1)C(=O)OC MCULE-4001628620 [0,1,0,1,0,0|2,0,0]=4 5592 B8R1.38 C1(CCN1)C(=O)OC MCULE-6304194058 [0,1,0,1,0,0|2,0,0]=4 5593 B8R1.38 C=CC(=O)N1CCC1 MCULE-5467836720 [0,1,0,1,0,0|1,0,1]=4 5594 B8R1.38 CC(C=O)C1CCC1 MCULE-5860376202 [0,1,0,1,0,0|1,0,1]=4 5595 B8R1.38 CCC(=O)C1CCC1 MCULE-2054282062 [0,1,0,1,0,0|1,0,0]=3 5596 B8R1.38 CCC(=O)C1COC1 MCULE-2036532813 [0,1,0,1,0,0|2,0,0]=4 5597 B8R1.38 CNC(=O)C1CCC1 MCULE-7934051142 [0,1,0,1,0,0|1,0,0]=3 5598 B8R1.38 CNC(=O)C1CNC1 MCULE-1757312789 [0,1,0,1,0,0|2,0,0]=4 5599 B8R1.38 CNC(=O)C1CNC1 MCULE-5774189315 [0,1,0,1,0,0|2,0,0]=4 5600 B8R1.38 CNC(=O)C1CNC1 MCULE-8342593933 [0,1,0,1,0,0|2,0,0]=4 5601 B8R1.38 COC(=O)C1=CCC1 MCULE-5016158090 [0,1,0,1,0,0|1,0,1]=4 5602 B8R1.38 COC(=O)C1CCC1 MCULE-2900002276 [0,1,0,1,0,0|1,0,0]=3 5603 B8R1.38 COC(=O)C1CCN1 MCULE-2766647683 [0,1,0,1,0,0|2,0,0]=4 5604 B8R1.38 COC(=O)C1CCN1 MCULE-6440918459 [0,1,0,1,0,0|2,0,0]=4 5605 B8R1.38 COC(=O)C1CCN1 MCULE-6964468849 [0,1,0,1,0,0|2,0,0]=4 5606 B8R1.38 COC(=O)C1CCO1 MCULE-7860079290 [0,1,0,1,0,0|2,0,0]=4 5607 B8R1.38 COC(=O)C1CNC1 MCULE-5731952071 [0,1,0,1,0,0|2,0,0]=4 5608 B8R1.38 COC(=O)C1CNC1 MCULE-9436948908 [0,1,0,1,0,0|2,0,0]=4 5609 B8R1.38 COC(=O)C1COC1 MCULE-8897565340 [0,1,0,1,0,0|2,0,0]=4 5610 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-4539844768 [0,1,0,1,0,0|2,0,0]=4 5611 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-5257592845 [0,1,0,1,0,0|2,0,0]=4 5612 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-7483834256 [0,1,0,1,0,0|2,0,0]=4 5613 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-7502882004 [0,1,0,1,0,0|2,0,0]=4 5614 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-1944761309 [0,1,0,1,0,0|2,0,0]=4 5615 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-2075005250 [0,1,0,1,0,0|2,0,0]=4 5616 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-5626630564 [0,1,0,1,0,0|2,0,0]=4 5617 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-8309542560 [0,1,0,1,0,0|2,0,0]=4 5618 B8R1.38 NCC(=O)C1CCC1 MCULE-2102604629 [0,1,0,1,0,0|1,0,0]=3 5619 B8R1.38 NCC(=O)C1CCC1 MCULE-5571071703 [0,1,0,1,0,0|1,0,0]=3 5620 B8R1.38 NCC(=O)N1CCC1 MCULE-3850014745 [0,1,0,1,0,0|1,0,0]=3 5621 B8R1.38 NNC(=O)C1CCC1 MCULE-3104625459 [0,1,0,1,0,0|2,0,0]=4 5622 B8R1.38 O=C(CBr)C1CCC1 MCULE-7056136632 [0,1,0,1,0,0|1,0,0]=3 5623 B8R1.38 O=C(CBr)N1CCC1 MCULE-2341003437 [0,1,0,1,0,0|1,0,0]=3 5624 B8R1.38 O=C(CCl)C1CCC1 MCULE-9286559827 [0,1,0,1,0,0|1,0,0]=3 5625 B8R1.38 O=C(CCl)N1CCC1 MCULE-1485330958 [0,1,0,1,0,0|1,0,0]=3 5626 B8R1.38 O=C(NO)C1CCC1 MCULE-5722727330 [0,1,0,1,0,0|2,0,0]=4 5627 B8R1.50 CC1=C(C(=O)CC1)C MCULE-6370073595 [0,1,0,1,0,0|1,0,1]=4 5628 B8R1.50 CC1=C(C(=O)NC1)C MCULE-4444366984 [0,1,0,1,0,0|1,0,1]=4 5629 B8R1.50 CC1=C(C(=O)OC1)O MCULE-7870847121 [0,1,0,1,0,0|0,0,2]=4 5630 B8R1.50 CC1=C(COC1=O)Br MCULE-6953448957 [0,1,0,1,0,0|1,0,1]=4 5631 B8R1.50 CC1=C(COC1=O)O MCULE-4822806082 [0,1,0,1,0,0|1,0,1]=4 5632 B8R1.50 CC1=NOC(=O)C1C MCULE-6668573558 [0,1,0,1,0,0|1,0,1]=4 5633 B8R1.50 CC1C(=O)CCN1C MCULE-8191851293 [0,1,0,1,0,0|2,0,0]=4 5634 B8R1.50 CC1C(=O)COC1=O MCULE-4188541096 [0,1,0,1,0,0|1,0,1]=4 5635 B8R1.50 CC1CCC(=O)C1=O MCULE-7649396652 [0,1,0,1,0,0|1,0,1]=4 5636 B8R1.50 CC1CCC(=O)N1C MCULE-7405072604 [0,1,0,1,0,0|1,0,0]=3 5637 B8R1.50 CC1CCC(C1=O)C MCULE-1473375660 [0,1,0,1,0,0|1,0,1]=4 5638 B8R1.50 CC1CCN(C1=O)C MCULE-1499213360 [0,1,0,1,0,0|2,0,0]=4 5639 B8R1.50 CC1CNC(=O)C1C MCULE-7439537346 [0,1,0,1,0,0|1,0,0]=3 5640 B8R1.50 CC1OCC(=O)C1C MCULE-5834923125 [0,1,0,1,0,0|2,0,0]=4 5641 B8R1.50 CN1C(=O)CCC1O MCULE-1070053575 [0,1,0,1,0,0|2,0,0]=4 5642 B8R1.50 CN1C(=O)COC1=O MCULE-1190604947 [0,1,0,1,0,0|1,0,1]=4 5643 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O MCULE-6840872048 [0,1,0,1,0,0|2,0,0]=4 5644 B8R1.50 O=C1COC(=O)C1Br MCULE-7458581655 [0,1,0,1,0,0|1,0,1]=4 5645 B8R1.50 O=C1COC(=O)C1Cl MCULE-1326411169 [0,1,0,1,0,0|1,0,1]=4 5646 B8R1.50 O=C1OCC(C1O)O MCULE-9766741798 [0,1,0,1,0,0|1,0,0]=3 5647 B8R1.50 O=C1OC[C@@H]([C@@H]1Br)O MCULE-5447777048 [0,1,0,1,0,0|1,0,0]=3 5648 B8R1.50 O=C1OC[C@@H]([C@@H]1Br)O MCULE-8691985034 [0,1,0,1,0,0|1,0,0]=3 5649 B8R1.50 O=C1OC[C@@H]([C@@H]1O)O MCULE-8629460196 [0,1,0,1,0,0|1,0,0]=3 5650 B8R1.50 O=C1OC[C@@H]([C@H]1O)O MCULE-7303431003 [0,1,0,1,0,0|1,0,0]=3 5651 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-4704805755 [0,1,0,1,0,0|1,0,0]=3 5652 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7070309718 [0,1,0,1,0,0|1,0,0]=3 5653 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7824820688 [0,1,0,1,0,0|1,0,0]=3 5654 B8R1.52 C#CC1(CCCO1)C MCULE-7216729961 [0,1,0,1,0,0|1,0,1]=4 5655 B8R1.52 CC1(CCCC1)C=O MCULE-2794420297 [0,1,0,1,0,0|1,0,1]=4 5656 B8R1.52 CC1(CCCO1)C#N MCULE-1273023182 [0,1,0,1,0,0|1,0,1]=4 5657 B8R1.52 CC1(CCCO1)C=O MCULE-4619641299 [0,1,0,1,0,0|0,0,1]=3 5658 B8R1.52 CC1(CCCO1)CN MCULE-2071513677 [0,1,0,1,0,0|1,0,1]=4 5659 B8R1.52 CC1(CCCO1)CN MCULE-4256725320 [0,1,0,1,0,0|1,0,1]=4 5660 B8R1.52 CC1(CCCO1)CO MCULE-9259109857 [0,1,0,1,0,0|0,0,2]=4 5661 B8R1.52 CC1(CCCS1)C=O MCULE-9560124012 [0,1,0,1,0,0|0,1,1]=4 5662 B8R1.52 C[C@@]1(CCCO1)CN MCULE-1372081592 [0,1,0,1,0,0|1,0,1]=4 5663 B8R1.52 C[C@@]1(CCCO1)CN MCULE-6512781753 [0,1,0,1,0,0|1,0,1]=4 5664 B8R1.6 CCCC1CC(=O)C1 MCULE-8820429798 [0,1,0,1,0,0|1,0,0]=3 5665 B8R1.6 COCC1CC(=O)C1 MCULE-2514529767 [0,1,0,1,0,0|1,0,0]=3 5666 B8R1.6 N#CCC1CC(=O)C1 MCULE-7117602408 [0,1,0,1,0,0|1,0,1]=4 5667 B8R1.7 C1(CCCN1)C(=O)N MCULE-2539007211 [0,1,0,1,0,0|2,0,0]=4 5668 B8R1.7 C1(CCCN1)C(=O)N MCULE-7289713183 [0,1,0,1,0,0|2,0,0]=4 5669 B8R1.7 C1(CCNC1)C(=O)N MCULE-4476688014 [0,1,0,1,0,0|2,0,0]=4 5670 B8R1.7 C1(CCNC1)C(=O)N MCULE-8592806332 [0,1,0,1,0,0|2,0,0]=4 5671 B8R1.7 C1(CCNC1)C(=O)O MCULE-3210241958 [0,1,0,1,0,0|2,0,0]=4 5672 B8R1.7 C1(CCNC1)C(=O)O MCULE-6517290754 [0,1,0,1,0,0|2,0,0]=4 5673 B8R1.7 C1(CCOC1)C(=O)O MCULE-4859263225 [0,1,0,1,0,0|2,0,0]=4 5674 B8R1.7 C=C(C)C1=NCCO1 MCULE-8164273045 [0,1,0,1,0,0|2,0,0]=4 5675 B8R1.7 CC(=O)C1=CCCC1 MCULE-9623046872 [0,1,0,1,0,0|1,0,0]=3 5676 B8R1.7 CC(=O)C1=NCCS1 MCULE-8548990347 [0,1,0,1,0,0|1,1,0]=4 5677 B8R1.7 CC(=O)C1CCC=N1 MCULE-5434976735 [0,1,0,1,0,0|1,0,1]=4 5678 B8R1.7 CC(=O)C1CCCC1 MCULE-7952211819 [0,1,0,1,0,0|1,0,0]=3 5679 B8R1.7 CC(=O)C1CCCN1 MCULE-2528977871 [0,1,0,1,0,0|1,0,0]=3 5680 B8R1.7 CC(=O)C1CCCN1 MCULE-9222880225 [0,1,0,1,0,0|1,0,0]=3 5681 B8R1.7 CC(=O)C1CCCO1 MCULE-7518147693 [0,1,0,1,0,0|0,0,0]=2 5682 B8R1.7 CC(=O)C1CCNC1 MCULE-2147779518 [0,1,0,1,0,0|1,0,0]=3 5683 B8R1.7 CC(=O)C1CCNC1 MCULE-2964372059 [0,1,0,1,0,0|1,0,0]=3 5684 B8R1.7 CC(=O)C1CCOC1 MCULE-2105633909 [0,1,0,1,0,0|1,0,0]=3 5685 B8R1.7 CC(=O)C1NCCS1 MCULE-4092674646 [0,1,0,1,0,0|1,1,0]=4 5686 B8R1.7 CC(=O)C1NCCS1 MCULE-8660367055 [0,1,0,1,0,0|1,1,0]=4 5687 B8R1.7 CC(=O)N1CCCC1 MCULE-6839528034 [0,1,0,1,0,0|1,0,0]=3 5688 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-1290635339 [0,1,0,1,0,0|1,0,0]=3 5689 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2855198659 [0,1,0,1,0,0|1,0,0]=3 5690 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2944662012 [0,1,0,1,0,0|1,0,0]=3 5691 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-4806473466 [0,1,0,1,0,0|1,0,0]=3 5692 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-2015960170 [0,1,0,1,0,0|0,0,0]=2 5693 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-3381319090 [0,1,0,1,0,0|0,0,0]=2 5694 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-2095368644 [0,1,0,1,0,0|1,0,0]=3 5695 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-5460066005 [0,1,0,1,0,0|1,0,0]=3 5696 B8R1.7 CC(=O)[C@H]1CCCO1 MCULE-5637204370 [0,1,0,1,0,0|0,0,0]=2 5697 B8R1.7 CC(N)C1CCCO1 MCULE-2883137296 [0,1,0,1,0,0|1,0,1]=4 5698 B8R1.7 CC(N)C1CCCO1 MCULE-3041511194 [0,1,0,1,0,0|1,0,1]=4 5699 B8R1.7 CC(O)C1CCCO1 MCULE-2804362263 [0,1,0,1,0,0|0,0,2]=4 5700 B8R1.7 C[C@@H](O)[C@H]1CCCO1 MCULE-6393902221 [0,1,0,1,0,0|0,0,2]=4 5701 B8R1.7 C[C@H](N)C1CCCO1 MCULE-6245058799 [0,1,0,1,0,0|1,0,1]=4 5702 B8R1.7 C[C@H](N)C1CCCO1 MCULE-6470683195 [0,1,0,1,0,0|1,0,1]=4 5703 B8R1.7 C[C@H](O)C1CCCO1 MCULE-5402066981 [0,1,0,1,0,0|0,0,2]=4 5704 B8R1.7 C[C@H](O)[C@@H]1CCCO1 MCULE-3917713920 [0,1,0,1,0,0|0,0,2]=4 5705 B8R1.7 N=C(N)C1CCCO1 MCULE-1348627071 [0,1,0,1,0,0|2,0,0]=4 5706 B8R1.7 N=C(N)C1CCCO1 MCULE-4359589378 [0,1,0,1,0,0|2,0,0]=4 5707 B8R1.7 NC(=O)C1CCCC1 MCULE-3900666396 [0,1,0,1,0,0|2,0,0]=4 5708 B8R1.7 NC(=O)C1CCCN1 MCULE-4159463416 [0,1,0,1,0,0|2,0,0]=4 5709 B8R1.7 NC(=O)C1CCCN1 MCULE-4804910089 [0,1,0,1,0,0|2,0,0]=4 5710 B8R1.7 NC(=O)C1CCCO1 MCULE-9101921416 [0,1,0,1,0,0|1,0,0]=3 5711 B8R1.7 NC(=O)C1CCNC1 MCULE-6035608651 [0,1,0,1,0,0|2,0,0]=4 5712 B8R1.7 NC(=O)C1CCNC1 MCULE-8602888952 [0,1,0,1,0,0|2,0,0]=4 5713 B8R1.7 NC(=O)C1CCOC1 MCULE-7120435380 [0,1,0,1,0,0|2,0,0]=4 5714 B8R1.7 NC(=O)N1CCCC1 MCULE-2282948234 [0,1,0,1,0,0|2,0,0]=4 5715 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2635874022 [0,1,0,1,0,0|2,0,0]=4 5716 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2652734118 [0,1,0,1,0,0|2,0,0]=4 5717 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-4692992308 [0,1,0,1,0,0|2,0,0]=4 5718 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-6463625531 [0,1,0,1,0,0|2,0,0]=4 5719 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-3181755658 [0,1,0,1,0,0|1,0,0]=3 5720 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-9348376356 [0,1,0,1,0,0|1,0,0]=3 5721 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1320057579 [0,1,0,1,0,0|2,0,0]=4 5722 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-1678228480 [0,1,0,1,0,0|2,0,0]=4 5723 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-3340066069 [0,1,0,1,0,0|2,0,0]=4 5724 B8R1.7 NC(=O)[C@@H]1CCNC1 MCULE-8833406496 [0,1,0,1,0,0|2,0,0]=4 5725 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-1391877694 [0,1,0,1,0,0|2,0,0]=4 5726 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-2636422628 [0,1,0,1,0,0|2,0,0]=4 5727 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-3135852117 [0,1,0,1,0,0|2,0,0]=4 5728 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-9661392945 [0,1,0,1,0,0|2,0,0]=4 5729 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-1673594093 [0,1,0,1,0,0|2,0,0]=4 5730 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-6725123306 [0,1,0,1,0,0|2,0,0]=4 5731 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-7222756259 [0,1,0,1,0,0|2,0,0]=4 5732 B8R1.7 NC(=O)[C@H]1CCNC1 MCULE-8100234071 [0,1,0,1,0,0|2,0,0]=4 5733 B8R1.7 NC(=O)[C@H]1CCOC1 MCULE-1231475693 [0,1,0,1,0,0|2,0,0]=4 5734 B8R1.7 NC(=S)C1CCCO1 MCULE-7906949480 [0,1,0,1,0,0|1,1,0]=4 5735 B8R1.7 O=C(Cl)C1CCCC1 MCULE-1337538941 [0,1,0,1,0,0|2,0,0]=4 5736 B8R1.7 O=C(Cl)C1CCCO1 MCULE-9691919934 [0,1,0,1,0,0|1,0,0]=3 5737 B8R1.7 O=C(Cl)C1CCOC1 MCULE-9071234830 [0,1,0,1,0,0|2,0,0]=4 5738 B8R1.7 O=C(Cl)N1CCCC1 MCULE-2201729080 [0,1,0,1,0,0|2,0,0]=4 5739 B8R1.7 O=C(O)C1=CCCC1 MCULE-2928571993 [0,1,0,1,0,0|2,0,0]=4 5740 B8R1.7 O=C(O)C1=CCCO1 MCULE-8380391200 [0,1,0,1,0,0|1,0,1]=4 5741 B8R1.7 O=C(O)C1=NCCC1 MCULE-2664768755 [0,1,0,1,0,0|2,0,0]=4 5742 B8R1.7 O=C(O)C1CCCC1 MCULE-6415159340 [0,1,0,1,0,0|2,0,0]=4 5743 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [0,1,0,1,0,0|2,0,0]=4 5744 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [0,1,0,1,0,0|2,0,0]=4 5745 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [0,1,0,1,0,0|2,0,0]=4 5746 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [0,1,0,1,0,0|2,0,0]=4 5747 B8R1.7 O=C(O)C1CCCO1 MCULE-1952289090 [0,1,0,1,0,0|1,0,0]=3 5748 B8R1.7 O=C(O)C1CCCO1 MCULE-5387481824 [0,1,0,1,0,0|1,0,0]=3 5749 B8R1.7 O=C(O)C1CCCS1 MCULE-7760686042 [0,1,0,1,0,0|1,1,0]=4 5750 B8R1.7 O=C(O)C1CCNC1 MCULE-4976520029 [0,1,0,1,0,0|2,0,0]=4 5751 B8R1.7 O=C(O)C1CCNC1 MCULE-5937045785 [0,1,0,1,0,0|2,0,0]=4 5752 B8R1.7 O=C(O)C1CCNC1 MCULE-6983695276 [0,1,0,1,0,0|2,0,0]=4 5753 B8R1.7 O=C(O)C1CCOC1 MCULE-3567941338 [0,1,0,1,0,0|2,0,0]=4 5754 B8R1.7 O=C(O)C1CCSC1 MCULE-7898686734 [0,1,0,1,0,0|2,0,0]=4 5755 B8R1.7 O=C(O)N1CCCC1 MCULE-7984061130 [0,1,0,1,0,0|2,0,0]=4 5756 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [0,1,0,1,0,0|2,0,0]=4 5757 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [0,1,0,1,0,0|2,0,0]=4 5758 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [0,1,0,1,0,0|2,0,0]=4 5759 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [0,1,0,1,0,0|2,0,0]=4 5760 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-5193388500 [0,1,0,1,0,0|1,0,0]=3 5761 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-8181760406 [0,1,0,1,0,0|1,0,0]=3 5762 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-3068007507 [0,1,0,1,0,0|2,0,0]=4 5763 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4477578687 [0,1,0,1,0,0|2,0,0]=4 5764 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4524201006 [0,1,0,1,0,0|2,0,0]=4 5765 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4868292658 [0,1,0,1,0,0|2,0,0]=4 5766 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-4807765276 [0,1,0,1,0,0|2,0,0]=4 5767 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-7912413581 [0,1,0,1,0,0|2,0,0]=4 5768 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [0,1,0,1,0,0|2,0,0]=4 5769 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [0,1,0,1,0,0|2,0,0]=4 5770 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-2258024439 [0,1,0,1,0,0|1,0,0]=3 5771 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-5143953192 [0,1,0,1,0,0|1,0,0]=3 5772 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2003400674 [0,1,0,1,0,0|2,0,0]=4 5773 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2851087395 [0,1,0,1,0,0|2,0,0]=4 5774 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7223432888 [0,1,0,1,0,0|2,0,0]=4 5775 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7610384670 [0,1,0,1,0,0|2,0,0]=4 5776 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-3213766488 [0,1,0,1,0,0|2,0,0]=4 5777 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-9627397250 [0,1,0,1,0,0|2,0,0]=4 5778 B8R1.7 O=C([O-])C1CCCN1 MCULE-9155494525 [0,1,0,1,0,0|2,0,0]=4 5779 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-2694821396 [0,1,0,1,0,0|2,0,0]=4 5780 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-8353601451 [0,1,0,1,0,0|2,0,0]=4 5781 B8R1.19 CC1(OCCC1N)C MCULE-6592845715 [0,1,0,1,0,0|1,0,1]=4 5782 B8R1.19 CC1(OCCC1N)C MCULE-6909756281 [0,1,0,1,0,0|1,0,1]=4 5783 B8R1.19 CC1CCOS1(=O)=O MCULE-6608589153 [0,1,0,1,0,0|2,0,0]=4 5784 B8R1.19 CC1COCC1(C)O MCULE-8635665597 [0,1,0,1,0,0|0,0,2]=4 5785 B8R1.19 CN1CCOS1(=O)=O MCULE-3125124642 [0,1,0,1,0,0|2,0,0]=4 5786 B8R1.19 C[C@@H]1COC[C@]1(C)O MCULE-2882517612 [0,1,0,1,0,0|0,0,2]=4 5787 B8R1.19 C[C@H]1COC[C@@]1(C)O MCULE-6225656472 [0,1,0,1,0,0|0,0,2]=4 5788 B8R1.19 [C@@H]1(COC[C@@]1(C)O)C MCULE-5554336121 [0,1,0,1,0,0|0,0,2]=4 5789 B8R1.35 CC(=O)CCC1CC1 MCULE-1674877061 [0,1,0,1,0,0|1,0,0]=3 5790 B8R1.35 CC(=O)NCC1CC1 MCULE-1770864212 [0,1,0,1,0,0|1,0,0]=3 5791 B8R1.35 CC(=O)NCC1CO1 MCULE-8864606081 [0,1,0,1,0,0|1,0,0]=3 5792 B8R1.35 CC(C)OCC1CO1 MCULE-5300797105 [0,1,0,1,0,0|1,0,1]=4 5793 B8R1.35 CC(C)OC[C@@H]1CO1 MCULE-4211264263 [0,1,0,1,0,0|1,0,1]=4 5794 B8R1.35 CC(C)OC[C@H]1CO1 MCULE-8109473880 [0,1,0,1,0,0|1,0,1]=4 5795 B8R1.35 NC(=O)CNC1CC1 MCULE-1569675703 [0,1,0,1,0,0|2,0,0]=4 5796 B8R1.35 NC(=O)CNC1CC1 MCULE-2912062351 [0,1,0,1,0,0|2,0,0]=4 5797 B8R1.35 NC(=O)NCC1CC1 MCULE-9526171923 [0,1,0,1,0,0|2,0,0]=4 5798 B8R1.35 O=C(Cl)OCC1CC1 MCULE-5850240668 [0,1,0,1,0,0|1,0,0]=3 5799 B8R1.35 O=C(O)/C=C/C1CC1 MCULE-2218783834 [0,1,0,1,0,0|2,0,0]=4 5800 B8R1.35 O=C(O)C#CC1CC1 MCULE-8494271998 [0,1,0,1,0,0|2,0,0]=4 5801 B8R1.35 O=C(O)C=CC1CC1 MCULE-9706214568 [0,1,0,1,0,0|2,0,0]=4 5802 B8R1.35 O=C(O)CCC1CC1 MCULE-1377442346 [0,1,0,1,0,0|2,0,0]=4 5803 B8R1.35 O=C(O)CCC1CO1 MCULE-1859826371 [0,1,0,1,0,0|2,0,0]=4 5804 B8R1.35 O=C(O)CNC1CC1 MCULE-7811029224 [0,1,0,1,0,0|2,0,0]=4 5805 B8R1.35 O=C(O)CNC1CC1 MCULE-9104732369 [0,1,0,1,0,0|2,0,0]=4 5806 B8R1.35 O=C(O)COC1CC1 MCULE-2555477617 [0,1,0,1,0,0|1,0,0]=3 5807 B8R1.35 O=C(O)CSC1CC1 MCULE-7890561094 [0,1,0,1,0,0|1,1,0]=4 5808 B8R1.35 O=N(=O)OCC1CO1 MCULE-8843628447 [0,1,0,1,0,0|2,0,0]=4 5809 B8R1.36 CCCOCC1CO1 MCULE-2437381651 [0,1,0,1,0,0|0,0,2]=4 5810 B8R1.36 CNCCOC1CC1 MCULE-4547624840 [0,1,0,1,0,0|1,0,1]=4 5811 B8R1.72 CC1(CCCOC1)N MCULE-3473263481 [0,1,0,1,0,0|1,0,1]=4 5812 B8R1.72 CC1(CCCOC1)N MCULE-9650675850 [0,1,0,1,0,0|1,0,1]=4 5813 B8R1.72 CC1(CCOCO1)C MCULE-7025894167 [0,1,0,1,0,0|1,0,1]=4 5814 B8R1.72 CC1(CNCCO1)C MCULE-1093588178 [0,1,0,1,0,0|1,0,1]=4 5815 B8R1.72 CC1(CNCCO1)C MCULE-1377070600 [0,1,0,1,0,0|1,0,1]=4 5816 B8R1.72 CP1(=O)CCNCC1 MCULE-2481700354 [0,1,0,1,0,0|2,0,0]=4 5817 B8R1.72 CP1(=O)CCNCC1 MCULE-7659597614 [0,1,0,1,0,0|2,0,0]=4 5818 B8R1.72 C[C@@]1(CCCOC1)N MCULE-6911571931 [0,1,0,1,0,0|1,0,1]=4 5819 B8R1.72 C[C@@]1(CCCOC1)N MCULE-7022092346 [0,1,0,1,0,0|1,0,1]=4 5820 B8R1.72 C[C@]1(CCCOC1)N MCULE-2192532317 [0,1,0,1,0,0|1,0,1]=4 5821 B8R1.72 C[C@]1(CCCOC1)N MCULE-9979909776 [0,1,0,1,0,0|1,0,1]=4 5822 B8R1.72 C[Si]1(CCCCO1)C MCULE-8051030048 [0,1,0,1,0,0|1,1,0]=4 5823 B8R1.72 N=S1(=O)CCCCC1 MCULE-8920208485 [0,1,0,1,0,0|2,0,0]=4 5824 B8R1.72 O=S1(=O)CCCCN1 MCULE-6296400181 [0,1,0,1,0,0|2,0,0]=4 5825 B8R1.72 O=S1(=O)CCCCO1 MCULE-8722166220 [0,1,0,1,0,0|1,0,0]=3 5826 B8R1.72 O=S1(=O)OCCCO1 MCULE-8391650877 [0,1,0,1,0,0|2,0,0]=4 5827 B8R1.23 C=C1CC(C1)C(=O)C MCULE-4738657819 [0,1,0,1,0,0|1,0,1]=4 5828 B8R1.23 CC(=O)C1CC(C1)O MCULE-1249992642 [0,1,0,1,0,0|1,0,0]=3 5829 B8R1.23 CC(=O)N1CC(=O)C1 MCULE-4555368577 [0,1,0,1,0,0|1,0,1]=4 5830 B8R1.23 CC(=O)N1CC(C1)N MCULE-2365148708 [0,1,0,1,0,0|1,0,0]=3 5831 B8R1.23 CC(=O)N1CC(C1)N MCULE-7213807824 [0,1,0,1,0,0|1,0,0]=3 5832 B8R1.23 CC(=O)N1CC(C1)N MCULE-9513131334 [0,1,0,1,0,0|1,0,0]=3 5833 B8R1.23 CC(=O)N1CC(C1)O MCULE-5379013327 [0,1,0,1,0,0|1,0,0]=3 5834 B8R1.23 CC(C)C1CC(=O)C1 MCULE-1288547159 [0,1,0,1,0,0|1,0,0]=3 5835 B8R1.23 CC(C)C1CC(=O)N1 MCULE-9034089552 [0,1,0,1,0,0|1,0,0]=3 5836 B8R1.23 CC(C)[C@@H]1CC(=O)N1 MCULE-4005923993 [0,1,0,1,0,0|1,0,0]=3 5837 B8R1.23 CC1CC(C1)C(=O)O MCULE-2185016477 [0,1,0,1,0,0|2,0,0]=4 5838 B8R1.23 CC1CC(N1)C(=O)O MCULE-2803934033 [0,1,0,1,0,0|2,0,0]=4 5839 B8R1.23 CN(C)C1CC(=O)C1 MCULE-6018790008 [0,1,0,1,0,0|2,0,0]=4 5840 B8R1.23 C[C@@H]1C[C@H](N1)C(=O)O MCULE-6318758002 [0,1,0,1,0,0|2,0,0]=4 5841 B8R1.23 C[C@H]1C[C@@H](C1)C(=O)O MCULE-1777784731 [0,1,0,1,0,0|2,0,0]=4 5842 B8R1.23 C[C@H]1C[C@H](C1)C(=O)O MCULE-8951813405 [0,1,0,1,0,0|2,0,0]=4 5843 B8R1.23 C[C@H]1C[C@H](N1)C(=O)O MCULE-2969381793 [0,1,0,1,0,0|2,0,0]=4 5844 B8R1.23 NC(=O)C1CC(C1)N MCULE-5148844906 [0,1,0,1,0,0|2,0,0]=4 5845 B8R1.23 NC(=O)C1CC(C1)N MCULE-6769121107 [0,1,0,1,0,0|2,0,0]=4 5846 B8R1.23 NC(=O)C1CC(C1)O MCULE-5735068093 [0,1,0,1,0,0|2,0,0]=4 5847 B8R1.23 NC(=O)N1CC(C1)F MCULE-7038677987 [0,1,0,1,0,0|2,0,0]=4 5848 B8R1.23 NC(=O)N1CC(C1)O MCULE-8624777593 [0,1,0,1,0,0|2,0,0]=4 5849 B8R1.23 NC1CC(C1)C(=O)O MCULE-8750839632 [0,1,0,1,0,0|2,0,0]=4 5850 B8R1.23 NC1CC(C1)C(=O)O MCULE-9051964103 [0,1,0,1,0,0|2,0,0]=4 5851 B8R1.23 N[C@H]1C[C@@H](C1)C(=O)O MCULE-1844060803 [0,1,0,1,0,0|2,0,0]=4 5852 B8R1.23 N[C@H]1C[C@@H](C1)C(=O)O MCULE-2707924504 [0,1,0,1,0,0|2,0,0]=4 5853 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O MCULE-3847725342 [0,1,0,1,0,0|2,0,0]=4 5854 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O MCULE-4578532365 [0,1,0,1,0,0|2,0,0]=4 5855 B8R1.23 O=C(O)C1CC(C1)Br MCULE-8162503332 [0,1,0,1,0,0|2,0,0]=4 5856 B8R1.23 O=C(O)C1CC(C1)Cl MCULE-7489933597 [0,1,0,1,0,0|2,0,0]=4 5857 B8R1.23 O=C(O)C1CC(C1)F MCULE-7905028761 [0,1,0,1,0,0|2,0,0]=4 5858 B8R1.23 O=C(O)C1CC(C1)O MCULE-4341192467 [0,1,0,1,0,0|2,0,0]=4 5859 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)Br MCULE-1173253398 [0,1,0,1,0,0|2,0,0]=4 5860 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)F MCULE-4909435716 [0,1,0,1,0,0|2,0,0]=4 5861 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)O MCULE-9908072079 [0,1,0,1,0,0|2,0,0]=4 5862 B8R1.23 O=C(O)[C@H]1C[C@H](C1)Br MCULE-9142067708 [0,1,0,1,0,0|2,0,0]=4 5863 B8R1.23 O=C(O)[C@H]1C[C@H](C1)F MCULE-7816380416 [0,1,0,1,0,0|2,0,0]=4 5864 B8R1.23 O=C(O)[C@H]1C[C@H](C1)O MCULE-5181925767 [0,1,0,1,0,0|2,0,0]=4 5865 B8R1.23 O=C1CC(C1)C(F)F MCULE-9534663831 [0,1,0,1,0,0|2,0,0]=4 5866 B8R1.23 O=C1CC(O1)C(=O)O MCULE-1791104685 [0,1,0,1,0,0|1,0,1]=4 5867 B8R1.23 [C@@H]1(C[C@@H](C1)C(=O)O)Cl MCULE-4605935494 [0,1,0,1,0,0|2,0,0]=4 5868 B8R1.30 CC1CC1(C)C(=O)O MCULE-8330983425 [0,1,0,1,0,0|2,0,0]=4 5869 B8R1.54 C(N)(C(=O)O)C1CC1 MCULE-4833544032 [0,1,0,1,0,0|2,0,0]=4 5870 B8R1.54 C=C(C(=O)O)C1CC1 MCULE-9531805422 [0,1,0,1,0,0|2,0,0]=4 5871 B8R1.54 CC(=O)C(=O)C1CC1 MCULE-6206613019 [0,1,0,1,0,0|1,0,0]=3 5872 B8R1.54 CC(=O)C(C)C1CC1 MCULE-9797389889 [0,1,0,1,0,0|1,0,0]=3 5873 B8R1.54 CC(C(=O)O)C1CC1 MCULE-9343385076 [0,1,0,1,0,0|2,0,0]=4 5874 B8R1.54 NC(=O)C(N)C1CC1 MCULE-5863587661 [0,1,0,1,0,0|2,0,0]=4 5875 B8R1.54 NC(=O)C(N)C1CC1 MCULE-5987826744 [0,1,0,1,0,0|2,0,0]=4 5876 B8R1.54 NC(=O)C(O)C1CC1 MCULE-4055290448 [0,1,0,1,0,0|2,0,0]=4 5877 B8R1.54 NC(C(=O)O)C1CC1 MCULE-1974514713 [0,1,0,1,0,0|2,0,0]=4 5878 B8R1.54 NC(C(=O)O)C1CC1 MCULE-3126466096 [0,1,0,1,0,0|2,0,0]=4 5879 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-5662004537 [0,1,0,1,0,0|2,0,0]=4 5880 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-9004548949 [0,1,0,1,0,0|2,0,0]=4 5881 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-4323013494 [0,1,0,1,0,0|2,0,0]=4 5882 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-9475774396 [0,1,0,1,0,0|2,0,0]=4 5883 B8R1.54 O=C(O)C(=O)C1CC1 MCULE-2935818452 [0,1,0,1,0,0|2,0,0]=4 5884 B8R1.54 O=C(O)C(F)C1CC1 MCULE-4799246955 [0,1,0,1,0,0|2,0,0]=4 5885 B8R1.54 O=C(O)C(O)C1CC1 MCULE-9945035089 [0,1,0,1,0,0|2,0,0]=4 5886 B8R1.54 O=C(O)[C@@H](O)C1CC1 MCULE-2409990996 [0,1,0,1,0,0|2,0,0]=4 5887 B8R1.54 O=C(O)[C@H](O)C1CC1 MCULE-2255829314 [0,1,0,1,0,0|2,0,0]=4 5888 B8R1.54 O=C([O-])C(=O)C1CC1 MCULE-3173453359 [0,1,0,1,0,0|2,0,0]=4 5889 B8R1.78 CC(=O)C1(CCC1)C MCULE-7668067765 [0,1,0,1,0,0|1,0,0]=3 5890 B8R1.78 CC(=O)C1(CCC1)O MCULE-9112690180 [0,1,0,1,0,0|1,0,0]=3 5891 B8R1.78 CC(=O)C1(CNC1)F MCULE-3665722852 [0,1,0,1,0,0|2,0,0]=4 5892 B8R1.78 CC(=O)C1(CNC1)F MCULE-6096163194 [0,1,0,1,0,0|2,0,0]=4 5893 B8R1.78 CC(=O)C1(COC1)C MCULE-3650835000 [0,1,0,1,0,0|2,0,0]=4 5894 B8R1.78 CC1(CCC1)C(=O)Cl MCULE-4438397604 [0,1,0,1,0,0|2,0,0]=4 5895 B8R1.78 CC1(CCC1)C(=O)O MCULE-8539228760 [0,1,0,1,0,0|2,0,0]=4 5896 B8R1.78 NC(=O)C1(CCC1)Br MCULE-3386940591 [0,1,0,1,0,0|2,0,0]=4 5897 B8R1.78 NC(=O)C1(CCC1)N MCULE-1043802844 [0,1,0,1,0,0|2,0,0]=4 5898 B8R1.78 NC(=O)C1(CCC1)N MCULE-8757108427 [0,1,0,1,0,0|2,0,0]=4 5899 B8R1.78 NC(=O)C1(CCC1)O MCULE-9017924933 [0,1,0,1,0,0|2,0,0]=4 5900 B8R1.78 NC1(CCC1)C(=O)Cl MCULE-4330568570 [0,1,0,1,0,0|2,0,0]=4 5901 B8R1.78 NC1(CCC1)C(=O)Cl MCULE-9506658674 [0,1,0,1,0,0|2,0,0]=4 5902 B8R1.78 NC1(CCC1)C(=O)O MCULE-7741753062 [0,1,0,1,0,0|2,0,0]=4 5903 B8R1.78 NC1(CCC1)C(=O)O MCULE-8986168461 [0,1,0,1,0,0|2,0,0]=4 5904 B8R1.78 O=C(O)C1(CCC1)Br MCULE-2468093858 [0,1,0,1,0,0|2,0,0]=4 5905 B8R1.78 O=C(O)C1(CCC1)F MCULE-5784376163 [0,1,0,1,0,0|2,0,0]=4 5906 B8R1.78 O=C(O)C1(CCC1)O MCULE-3418659917 [0,1,0,1,0,0|2,0,0]=4 5907 B8R1.77 C1(CC1(C)C)C(=O)N MCULE-5718477060 [0,1,0,1,0,0|2,0,0]=4 5908 B8R1.77 CC(=O)C1CC1(C)C MCULE-5036637605 [0,1,0,1,0,0|1,0,0]=3 5909 B8R1.77 CC(=O)C1CC1(F)F MCULE-1936405426 [0,1,0,1,0,0|2,0,0]=4 5910 B8R1.77 CC1(CC1C(=O)Cl)C MCULE-4090499692 [0,1,0,1,0,0|2,0,0]=4 5911 B8R1.77 CC1(CC1C(=O)N)C MCULE-5357702152 [0,1,0,1,0,0|2,0,0]=4 5912 B8R1.77 CC1(CC1C(=O)O)Br MCULE-8354202393 [0,1,0,1,0,0|2,0,0]=4 5913 B8R1.77 CC1(CC1C(=O)O)C MCULE-1018303180 [0,1,0,1,0,0|2,0,0]=4 5914 B8R1.77 CC1(C[C@@H]1C(=O)N)C MCULE-5378835991 [0,1,0,1,0,0|2,0,0]=4 5915 B8R1.77 CC1(C[C@@H]1C(=O)N)C MCULE-9161411761 [0,1,0,1,0,0|2,0,0]=4 5916 B8R1.77 CC1(C[C@@H]1C(=O)O)C MCULE-8058233700 [0,1,0,1,0,0|2,0,0]=4 5917 B8R1.77 CC1(C[C@@H]1C(=O)O)C MCULE-8306311088 [0,1,0,1,0,0|2,0,0]=4 5918 B8R1.77 CC1(C[C@H]1C(=O)O)C MCULE-1908265175 [0,1,0,1,0,0|2,0,0]=4 5919 B8R1.77 [C@H]1(CC1(C)C)C(=O)N MCULE-6467459637 [0,1,0,1,0,0|2,0,0]=4 5920 B8R1.56 CS(=N)(=O)NC1CC1 MCULE-7216986821 [0,1,0,1,0,0|2,0,0]=4 5921 B8R1.56 CS(=O)(=O)NC1CC1 MCULE-4061012159 [0,1,0,1,0,0|2,0,0]=4 5922 B8R2.4 O=C1CC2CC1C2 MCULE-5372379094 [0,0,0,2,0,0|1,0,0]=3 5923 B8R2.18 O=C1CC2CC2C1 MCULE-4411193370 [0,0,0,2,0,0|1,0,0]=3 5924 B8R2.18 O=C1CC2CC2N1 MCULE-6301280583 [0,0,0,2,0,0|1,0,0]=3 5925 B8R2.18 O=C1CC2OC2C1 MCULE-2497020989 [0,0,0,2,0,0|2,0,0]=4 5926 B8R2.18 O=C1C[C@@H]2C[C@@H]2C1 MCULE-3069760916 [0,0,0,2,0,0|1,0,0]=3 5927 B8R2.38 O=C1CCC2C1C2 MCULE-4714285285 [0,0,0,2,0,0|1,0,0]=3 5928 B8R2.38 O=C1CCC2C1O2 MCULE-5532735099 [0,0,0,2,0,0|2,0,0]=4 5929 B8R2.38 O=C1CC[C@@H]2[C@H]1C2 MCULE-7728867768 [0,0,0,2,0,0|1,0,0]=3 5930 B8R2.38 O=C1CC[C@H]2[C@@H]1C2 MCULE-1007541778 [0,0,0,2,0,0|1,0,0]=3 5931 B8R2.38 O=C1CC[C@H]2[C@@H]1C2 MCULE-8077752466 [0,0,0,2,0,0|1,0,0]=3 5932 B8R2.38 O=C1NCC2C1C2 MCULE-5593114305 [0,0,0,2,0,0|1,0,0]=3 5933 B8R2.38 O=C1NC[C@H]2[C@@H]1C2 MCULE-6438081695 [0,0,0,2,0,0|1,0,0]=3 5934 B8R2.2 CC12CCCC1O2 MCULE-5518981528 [0,0,0,2,0,0|1,0,1]=4 5935 B8R2.53 O=C1CC2(C1)CC2 MCULE-9599930498 [0,0,0,2,0,0|1,0,0]=3