0 B7R0.1 BrCCCCCCBr MCULE-5187406804 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.1 BrCCSSCCBr MCULE-6795645587 [0,0,0,0,0,0|2,0,0]=2 2 B7R0.1 C#CCCCCCC MCULE-4406928583 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.1 C#CCNCCCC MCULE-4241072719 [0,0,0,0,0,0|2,0,2]=4 4 B7R0.1 C/C=C/CCCCC MCULE-6911363331 [0,0,0,0,0,0|2,0,2]=4 5 B7R0.1 C/C=C\CCCCC MCULE-9470036254 [0,0,0,0,0,0|2,0,2]=4 6 B7R0.1 C=CCC=CCCC MCULE-5753699682 [0,0,0,0,0,0|2,0,2]=4 7 B7R0.1 C=CCCCCCC MCULE-6867393536 [0,0,0,0,0,0|2,0,2]=4 8 B7R0.1 C=CCCSCCN MCULE-5541844264 [0,0,0,0,0,0|2,0,2]=4 9 B7R0.1 C=CCOCCCC MCULE-2214755289 [0,0,0,0,0,0|1,1,2]=4 10 B7R0.1 C=CCSCCCC MCULE-4868736488 [0,0,0,0,0,0|1,0,2]=3 11 B7R0.1 C=CCSSCC=C MCULE-7486690483 [0,0,0,0,0,0|0,0,4]=4 12 B7R0.1 C=CCSSCCC MCULE-1309818617 [0,0,0,0,0,0|0,0,2]=2 13 B7R0.1 CC#CCCCCC MCULE-3651650902 [0,0,0,0,0,0|2,0,2]=4 14 B7R0.1 CC/C=C/CCCC MCULE-7439146649 [0,0,0,0,0,0|2,0,1]=3 15 B7R0.1 CC/C=C\CCCO MCULE-7890119012 [0,0,0,0,0,0|3,0,1]=4 16 B7R0.1 CC=CCCCCC MCULE-7111489659 [0,0,0,0,0,0|2,0,2]=4 17 B7R0.1 CCC#CC#CCC MCULE-5268023674 [0,0,0,0,0,0|2,0,2]=4 18 B7R0.1 CCC#CCCCC MCULE-5815218275 [0,0,0,0,0,0|2,0,1]=3 19 B7R0.1 CCC#CCOCC MCULE-8576147807 [0,0,0,0,0,0|3,0,1]=4 20 B7R0.1 CCC/C=C/CCC MCULE-4580411068 [0,0,0,0,0,0|2,0,0]=2 21 B7R0.1 CCC/C=C\CCC MCULE-3832748741 [0,0,0,0,0,0|2,0,0]=2 22 B7R0.1 CCC=CCCCC MCULE-9716720293 [0,0,0,0,0,0|2,0,1]=3 23 B7R0.1 CCC=CCCCO MCULE-9620732691 [0,0,0,0,0,0|3,0,1]=4 24 B7R0.1 CCCC#CCCC MCULE-7777692011 [0,0,0,0,0,0|2,0,0]=2 25 B7R0.1 CCCC#CCCO MCULE-7581204382 [0,0,0,0,0,0|3,0,0]=3 26 B7R0.1 CCCC/C=C/CO MCULE-5404793542 [0,0,0,0,0,0|3,0,1]=4 27 B7R0.1 CCCC=CCCC MCULE-6897310592 [0,0,0,0,0,0|2,0,0]=2 28 B7R0.1 CCCC=CCCCl MCULE-5580394901 [0,0,0,0,0,0|3,0,0]=3 29 B7R0.1 CCCCC#CCO MCULE-9057096480 [0,0,0,0,0,0|3,0,1]=4 30 B7R0.1 CCCCC=CCBr MCULE-2427659057 [0,0,0,0,0,0|3,0,1]=4 31 B7R0.1 CCCCC=CCO MCULE-7891403223 [0,0,0,0,0,0|3,0,1]=4 32 B7R0.1 CCCCCCC#N MCULE-7652123212 [0,0,0,0,0,0|3,0,1]=4 33 B7R0.1 CCCCCCC=O MCULE-5251820425 [0,0,0,0,0,0|3,0,1]=4 34 B7R0.1 CCCCCCCBr MCULE-8042829299 [0,0,0,0,0,0|3,0,0]=3 35 B7R0.1 CCCCCCCC MCULE-3248084959 [0,0,0,0,0,0|2,0,0]=2 36 B7R0.1 CCCCCCCCl MCULE-6286146566 [0,0,0,0,0,0|3,0,0]=3 37 B7R0.1 CCCCCCCF MCULE-9794868174 [0,0,0,0,0,0|3,0,0]=3 38 B7R0.1 CCCCCCCI MCULE-2930393920 [0,0,0,0,0,0|3,0,0]=3 39 B7R0.1 CCCCCCCN MCULE-1126747714 [0,0,0,0,0,0|3,0,0]=3 40 B7R0.1 CCCCCCCO MCULE-5882959353 [0,0,0,0,0,0|3,0,0]=3 41 B7R0.1 CCCCCCCS MCULE-3901364910 [0,0,0,0,0,0|3,0,0]=3 42 B7R0.1 CCCCCCNC MCULE-1828296852 [0,0,0,0,0,0|3,0,0]=3 43 B7R0.1 CCCCCCNN MCULE-5116098983 [0,0,0,0,0,0|4,0,0]=4 44 B7R0.1 CCCCCCNO MCULE-4175875706 [0,0,0,0,0,0|4,0,0]=4 45 B7R0.1 CCCCCCNO MCULE-8719557426 [0,0,0,0,0,0|4,0,0]=4 46 B7R0.1 CCCCCCOC MCULE-7148964901 [0,0,0,0,0,0|3,0,0]=3 47 B7R0.1 CCCCCCON MCULE-1836746134 [0,0,0,0,0,0|4,0,0]=4 48 B7R0.1 CCCCCCON MCULE-9566158736 [0,0,0,0,0,0|4,0,0]=4 49 B7R0.1 CCCCCOCC MCULE-6346670527 [0,0,0,0,0,0|3,0,0]=3 50 B7R0.1 CCCCNCC#N MCULE-1687580908 [0,0,0,0,0,0|3,0,1]=4 51 B7R0.1 CCCCNCCC MCULE-6342731867 [0,0,0,0,0,0|2,0,0]=2 52 B7R0.1 CCCCNCCN MCULE-3865190511 [0,0,0,0,0,0|3,0,0]=3 53 B7R0.1 CCCCNCCO MCULE-3582031814 [0,0,0,0,0,0|3,0,0]=3 54 B7R0.1 CCCCNCCS MCULE-6926403617 [0,0,0,0,0,0|3,0,0]=3 55 B7R0.1 CCCCOCCBr MCULE-5314812532 [0,0,0,0,0,0|2,1,0]=3 56 B7R0.1 CCCCOCCCl MCULE-9147804479 [0,0,0,0,0,0|2,1,0]=3 57 B7R0.1 CCCCOCCI MCULE-3571589392 [0,0,0,0,0,0|2,1,0]=3 58 B7R0.1 CCCCOCCN MCULE-1817743996 [0,0,0,0,0,0|2,1,0]=3 59 B7R0.1 CCCCOCCN MCULE-3658840205 [0,0,0,0,0,0|2,1,0]=3 60 B7R0.1 CCCCOCCO MCULE-1727546427 [0,0,0,0,0,0|2,1,0]=3 61 B7R0.1 CCCCOCCO MCULE-4417721312 [0,0,0,0,0,0|2,1,0]=3 62 B7R0.1 CCCCOCCS MCULE-7419398753 [0,0,0,0,0,0|2,1,0]=3 63 B7R0.1 CCCCSCC#N MCULE-9529960668 [0,0,0,0,0,0|2,0,1]=3 64 B7R0.1 CCCCSCCC MCULE-3137952516 [0,0,0,0,0,0|1,0,0]=1 65 B7R0.1 CCCCSCCN MCULE-3521818954 [0,0,0,0,0,0|2,0,0]=2 66 B7R0.1 CCCCSCCN MCULE-5281011566 [0,0,0,0,0,0|2,0,0]=2 67 B7R0.1 CCCCSCCO MCULE-8791357083 [0,0,0,0,0,0|2,0,0]=2 68 B7R0.1 CCCCSCCS MCULE-4109311315 [0,0,0,0,0,0|2,0,0]=2 69 B7R0.1 CCCNCCC#N MCULE-4350757262 [0,0,0,0,0,0|3,0,1]=4 70 B7R0.1 CCCNCCCN MCULE-6668094176 [0,0,0,0,0,0|3,0,0]=3 71 B7R0.1 CCCNCCCO MCULE-4366982860 [0,0,0,0,0,0|3,0,0]=3 72 B7R0.1 CCCNCCNC MCULE-3857593384 [0,0,0,0,0,0|3,0,0]=3 73 B7R0.1 CCCNCCOC MCULE-4425567647 [0,0,0,0,0,0|3,0,0]=3 74 B7R0.1 CCCNNCCC MCULE-1099710970 [0,0,0,0,0,0|2,0,0]=2 75 B7R0.1 CCCNNCCC MCULE-3763521244 [0,0,0,0,0,0|2,0,0]=2 76 B7R0.1 CCCOCCCN MCULE-5875738973 [0,0,0,0,0,0|2,1,0]=3 77 B7R0.1 CCCSCCCN MCULE-2911445961 [0,0,0,0,0,0|2,0,0]=2 78 B7R0.1 CCCSSCCC MCULE-2667977107 [0,0,0,0,0,0|0,0,0]=0 79 B7R0.1 CCNCCCCO MCULE-4851249509 [0,0,0,0,0,0|4,0,0]=4 80 B7R0.1 CCNCCNCC MCULE-2663126630 [0,0,0,0,0,0|4,0,0]=4 81 B7R0.1 CCNCCNCC MCULE-8627955138 [0,0,0,0,0,0|4,0,0]=4 82 B7R0.1 CCNCCNCC MCULE-9858982602 [0,0,0,0,0,0|4,0,0]=4 83 B7R0.1 CCNCCOCC MCULE-8895991816 [0,0,0,0,0,0|4,0,0]=4 84 B7R0.1 CCOCCCCN MCULE-6583734908 [0,0,0,0,0,0|4,0,0]=4 85 B7R0.1 CCOCCCCO MCULE-9986213119 [0,0,0,0,0,0|4,0,0]=4 86 B7R0.1 CCOCCOCC MCULE-5593873009 [0,0,0,0,0,0|4,0,0]=4 87 B7R0.1 CCONCCOC MCULE-2883736672 [0,0,0,0,0,0|4,0,0]=4 88 B7R0.1 CCONCCOC MCULE-8885999080 [0,0,0,0,0,0|4,0,0]=4 89 B7R0.1 CCSCCCCN MCULE-7961306984 [0,0,0,0,0,0|4,0,0]=4 90 B7R0.1 CCSCCCCO MCULE-1712194349 [0,0,0,0,0,0|4,0,0]=4 91 B7R0.1 CCSCCSCC MCULE-2178899960 [0,0,0,0,0,0|4,0,0]=4 92 B7R0.1 CNCCCCCN MCULE-8023367999 [0,0,0,0,0,0|4,0,0]=4 93 B7R0.1 CNCCCCCO MCULE-2988249730 [0,0,0,0,0,0|4,0,0]=4 94 B7R0.1 CNCCCCCO MCULE-8033733525 [0,0,0,0,0,0|4,0,0]=4 95 B7R0.1 CNCCCCNC MCULE-4466243376 [0,0,0,0,0,0|4,0,0]=4 96 B7R0.1 CNCCCCOC MCULE-3203262011 [0,0,0,0,0,0|4,0,0]=4 97 B7R0.1 CNCCNCCN MCULE-6347214757 [0,0,0,0,0,0|4,0,0]=4 98 B7R0.1 CNCCNCCN MCULE-8600289461 [0,0,0,0,0,0|4,0,0]=4 99 B7R0.1 CNCCOCCCl MCULE-4700720996 [0,0,0,0,0,0|3,1,0]=4 100 B7R0.1 CNCCOCCCl MCULE-6741879544 [0,0,0,0,0,0|3,1,0]=4 101 B7R0.1 CNCCOCCN MCULE-8077914280 [0,0,0,0,0,0|3,1,0]=4 102 B7R0.1 CNCCOCCO MCULE-7869540361 [0,0,0,0,0,0|3,1,0]=4 103 B7R0.1 COCC#CCOC MCULE-7228915705 [0,0,0,0,0,0|4,0,0]=4 104 B7R0.1 COCCCCCBr MCULE-9843465236 [0,0,0,0,0,0|4,0,0]=4 105 B7R0.1 COCCCCCCl MCULE-6956815361 [0,0,0,0,0,0|4,0,0]=4 106 B7R0.1 COCCCCCN MCULE-2109050097 [0,0,0,0,0,0|4,0,0]=4 107 B7R0.1 COCCCCCO MCULE-6003118644 [0,0,0,0,0,0|4,0,0]=4 108 B7R0.1 COCCCCOC MCULE-3614881304 [0,0,0,0,0,0|4,0,0]=4 109 B7R0.1 COCCNCCF MCULE-1482164073 [0,0,0,0,0,0|4,0,0]=4 110 B7R0.1 COCCNCCF MCULE-4419696614 [0,0,0,0,0,0|4,0,0]=4 111 B7R0.1 COCCNCCN MCULE-4860380919 [0,0,0,0,0,0|4,0,0]=4 112 B7R0.1 COCCNCCN MCULE-8558629867 [0,0,0,0,0,0|4,0,0]=4 113 B7R0.1 COCCNCCO MCULE-3082225541 [0,0,0,0,0,0|4,0,0]=4 114 B7R0.1 COCCOCCBr MCULE-7766640443 [0,0,0,0,0,0|3,1,0]=4 115 B7R0.1 COCCOCCCl MCULE-5502842762 [0,0,0,0,0,0|3,1,0]=4 116 B7R0.1 COCCOCCI MCULE-4051748367 [0,0,0,0,0,0|3,1,0]=4 117 B7R0.1 COCCOCCN MCULE-7016705271 [0,0,0,0,0,0|3,1,0]=4 118 B7R0.1 COCCOCCO MCULE-4230242952 [0,0,0,0,0,0|3,1,0]=4 119 B7R0.1 COCCOCCS MCULE-5015015605 [0,0,0,0,0,0|3,1,0]=4 120 B7R0.1 COCCSCCO MCULE-5057235828 [0,0,0,0,0,0|3,0,0]=3 121 B7R0.1 COCOCCCN MCULE-4340598730 [0,0,0,0,0,0|3,1,0]=4 122 B7R0.1 CSCCCCCN MCULE-8771942873 [0,0,0,0,0,0|4,0,0]=4 123 B7R0.1 CSCCCCCO MCULE-3422729293 [0,0,0,0,0,0|4,0,0]=4 124 B7R0.1 ClCCCCCCBr MCULE-7471712605 [0,0,0,0,0,0|4,0,0]=4 125 B7R0.1 ClCCCCCCCl MCULE-2423183693 [0,0,0,0,0,0|4,0,0]=4 126 B7R0.1 ClCCCCCCI MCULE-2662361744 [0,0,0,0,0,0|4,0,0]=4 127 B7R0.1 ClCCCNCCCl MCULE-1885721760 [0,0,0,0,0,0|4,0,0]=4 128 B7R0.1 ClCCCNCCCl MCULE-9511755738 [0,0,0,0,0,0|4,0,0]=4 129 B7R0.1 ClCCSSCCCl MCULE-5314855118 [0,0,0,0,0,0|2,0,0]=2 130 B7R0.1 FCCCCCCBr MCULE-9238324978 [0,0,0,0,0,0|4,0,0]=4 131 B7R0.1 ICCCCCCI MCULE-1005202656 [0,0,0,0,0,0|4,0,0]=4 132 B7R0.1 N#CCCSCCO MCULE-6168568089 [0,0,0,0,0,0|3,0,1]=4 133 B7R0.1 N#CCSCCCCl MCULE-8808144163 [0,0,0,0,0,0|3,0,1]=4 134 B7R0.1 NCCCCCCBr MCULE-4017495581 [0,0,0,0,0,0|4,0,0]=4 135 B7R0.1 NCCCCCCBr MCULE-4048883510 [0,0,0,0,0,0|4,0,0]=4 136 B7R0.1 NCCCCCCN MCULE-1038764376 [0,0,0,0,0,0|4,0,0]=4 137 B7R0.1 NCCCCCCN MCULE-3766020930 [0,0,0,0,0,0|4,0,0]=4 138 B7R0.1 NCCCCCCN MCULE-9535729200 [0,0,0,0,0,0|4,0,0]=4 139 B7R0.1 NCCCCCCO MCULE-2264326846 [0,0,0,0,0,0|4,0,0]=4 140 B7R0.1 NCCCCCCS MCULE-3764839885 [0,0,0,0,0,0|4,0,0]=4 141 B7R0.1 NCCCCCCS MCULE-5822376723 [0,0,0,0,0,0|4,0,0]=4 142 B7R0.1 NCCCNCCBr MCULE-3804557930 [0,0,0,0,0,0|4,0,0]=4 143 B7R0.1 NCCCNCCBr MCULE-7533614613 [0,0,0,0,0,0|4,0,0]=4 144 B7R0.1 NCCCNCCBr MCULE-9607733996 [0,0,0,0,0,0|4,0,0]=4 145 B7R0.1 NCCCNCCN MCULE-4817006723 [0,0,0,0,0,0|4,0,0]=4 146 B7R0.1 NCCCNCCO MCULE-1084481336 [0,0,0,0,0,0|4,0,0]=4 147 B7R0.1 NCCCNCCS MCULE-2204209594 [0,0,0,0,0,0|4,0,0]=4 148 B7R0.1 NCCCNCCS MCULE-8506055366 [0,0,0,0,0,0|4,0,0]=4 149 B7R0.1 NCCCOCCO MCULE-7244821044 [0,0,0,0,0,0|3,1,0]=4 150 B7R0.1 NCCNCCCO MCULE-6476789217 [0,0,0,0,0,0|4,0,0]=4 151 B7R0.1 NCCOCCCO MCULE-2435588099 [0,0,0,0,0,0|3,1,0]=4 152 B7R0.1 NCCOCCCO MCULE-9188421727 [0,0,0,0,0,0|3,1,0]=4 153 B7R0.1 NCCSCCCO MCULE-1578023056 [0,0,0,0,0,0|3,0,0]=3 154 B7R0.1 NCCSSCCN MCULE-4713604405 [0,0,0,0,0,0|2,0,0]=2 155 B7R0.1 NCCSSCCN MCULE-4801024099 [0,0,0,0,0,0|2,0,0]=2 156 B7R0.1 NCCSSCCN MCULE-9351804410 [0,0,0,0,0,0|2,0,0]=2 157 B7R0.1 NCCSSCCO MCULE-1512873976 [0,0,0,0,0,0|2,0,0]=2 158 B7R0.1 NCC[Se][Se]CCN MCULE-3008791235 [0,0,0,0,0,0|2,2,0]=4 159 B7R0.1 NCC[Se][Se]CCN MCULE-9995399290 [0,0,0,0,0,0|2,2,0]=4 160 B7R0.1 OCCC=CCCO MCULE-7933051592 [0,0,0,0,0,0|4,0,0]=4 161 B7R0.1 OCCCCCCBr MCULE-3500356936 [0,0,0,0,0,0|4,0,0]=4 162 B7R0.1 OCCCCCCCl MCULE-4507452440 [0,0,0,0,0,0|4,0,0]=4 163 B7R0.1 OCCCCCCF MCULE-7082491218 [0,0,0,0,0,0|4,0,0]=4 164 B7R0.1 OCCCCCCI MCULE-3710706648 [0,0,0,0,0,0|4,0,0]=4 165 B7R0.1 OCCCCCCO MCULE-8817570517 [0,0,0,0,0,0|4,0,0]=4 166 B7R0.1 OCCCCCCS MCULE-9135853131 [0,0,0,0,0,0|4,0,0]=4 167 B7R0.1 OCCCNCCO MCULE-1959450493 [0,0,0,0,0,0|4,0,0]=4 168 B7R0.1 OCCCOCCCl MCULE-9172390990 [0,0,0,0,0,0|3,1,0]=4 169 B7R0.1 OCCNNCCO MCULE-5335815164 [0,0,0,0,0,0|4,0,0]=4 170 B7R0.1 OCCOCCCBr MCULE-3397483886 [0,0,0,0,0,0|3,1,0]=4 171 B7R0.1 OCCSSCCO MCULE-9443383082 [0,0,0,0,0,0|2,0,0]=2 172 B7R0.1 SCCCCCCS MCULE-2873828857 [0,0,0,0,0,0|4,0,0]=4 173 B7R0.1 [NH3+]CCCCCC[NH3+] MCULE-2211304471 [0,0,0,0,0,0|4,0,0]=4 174 B7R0.1 [NH3+]CCC[NH2+]CCS MCULE-5394269788 [0,0,0,0,0,0|4,0,0]=4 175 B7R0.1 [NH3+]CCSSCC[NH3+] MCULE-3814449504 [0,0,0,0,0,0|2,0,0]=2 176 B6R0.6 BrCCCCCBr MCULE-7929769310 [1,0,0,0,0,0|3,0,0]=4 177 B6R0.6 BrCCNCCBr MCULE-8656215402 [1,0,0,0,0,0|3,0,0]=4 178 B6R0.6 BrCCOCCBr MCULE-7971589019 [1,0,0,0,0,0|2,1,0]=4 179 B6R0.6 BrCCSCCBr MCULE-9680858393 [1,0,0,0,0,0|2,0,0]=3 180 B6R0.6 BrCC[NH2+]CCBr MCULE-8263104784 [1,0,0,0,0,0|3,0,0]=4 181 B6R0.6 C#CCCCCC MCULE-7776756434 [1,0,0,0,0,0|1,0,2]=4 182 B6R0.6 C#CCCSCC MCULE-1094584940 [1,0,0,0,0,0|1,0,2]=4 183 B6R0.6 C#CCNCCC MCULE-7880884278 [1,0,0,0,0,0|1,0,2]=4 184 B6R0.6 C#CCNCCC MCULE-8975069665 [1,0,0,0,0,0|1,0,2]=4 185 B6R0.6 C#CCSCCN MCULE-2934790818 [1,0,0,0,0,0|1,0,2]=4 186 B6R0.6 C#CCSCCN MCULE-8370704639 [1,0,0,0,0,0|1,0,2]=4 187 B6R0.6 C#CCSCCO MCULE-6167723961 [1,0,0,0,0,0|1,0,2]=4 188 B6R0.6 C(=C/CCC)\CO MCULE-6491762150 [1,0,0,0,0,0|2,0,1]=4 189 B6R0.6 C/C=C/CCCC MCULE-6900331316 [1,0,0,0,0,0|1,0,2]=4 190 B6R0.6 C/C=C\CCCC MCULE-8426867799 [1,0,0,0,0,0|1,0,2]=4 191 B6R0.6 C=CCCCCC MCULE-5868303078 [1,0,0,0,0,0|1,0,2]=4 192 B6R0.6 C=CCNCCC MCULE-4239068147 [1,0,0,0,0,0|1,0,2]=4 193 B6R0.6 C=CCNCCC MCULE-9778489216 [1,0,0,0,0,0|1,0,2]=4 194 B6R0.6 C=CCSCCC MCULE-3855352363 [1,0,0,0,0,0|0,0,2]=3 195 B6R0.6 C=CCSCCN MCULE-3972995930 [1,0,0,0,0,0|1,0,2]=4 196 B6R0.6 C=CCSCCN MCULE-9922932955 [1,0,0,0,0,0|1,0,2]=4 197 B6R0.6 CC#CCCCC MCULE-1899332515 [1,0,0,0,0,0|1,0,2]=4 198 B6R0.6 CC/C=C/CCC MCULE-5222700461 [1,0,0,0,0,0|1,0,1]=3 199 B6R0.6 CC/C=C/CCO MCULE-9853729917 [1,0,0,0,0,0|2,0,1]=4 200 B6R0.6 CC/C=C\CCO MCULE-9206958060 [1,0,0,0,0,0|2,0,1]=4 201 B6R0.6 CC=CCCCC MCULE-7277981733 [1,0,0,0,0,0|1,0,2]=4 202 B6R0.6 CC=CSCCC MCULE-3534082442 [1,0,0,0,0,0|0,0,2]=3 203 B6R0.6 CCC#CCCBr MCULE-2188447221 [1,0,0,0,0,0|2,0,1]=4 204 B6R0.6 CCC#CCCC MCULE-9615607532 [1,0,0,0,0,0|1,0,1]=3 205 B6R0.6 CCC#CCCO MCULE-1699744538 [1,0,0,0,0,0|2,0,1]=4 206 B6R0.6 CCC=CCCBr MCULE-7873583643 [1,0,0,0,0,0|2,0,1]=4 207 B6R0.6 CCC=CCCC MCULE-3739501724 [1,0,0,0,0,0|1,0,1]=3 208 B6R0.6 CCC=CCCI MCULE-9416216252 [1,0,0,0,0,0|2,0,1]=4 209 B6R0.6 CCC=CCCO MCULE-1781375433 [1,0,0,0,0,0|2,0,1]=4 210 B6R0.6 CCC=COCC MCULE-1991976030 [1,0,0,0,0,0|1,1,1]=4 211 B6R0.6 CCCC#CCO MCULE-8352024607 [1,0,0,0,0,0|2,0,1]=4 212 B6R0.6 CCCC=CCBr MCULE-2474104566 [1,0,0,0,0,0|2,0,1]=4 213 B6R0.6 CCCC=CCO MCULE-3204738641 [1,0,0,0,0,0|2,0,1]=4 214 B6R0.6 CCCCCC#N MCULE-7596791521 [1,0,0,0,0,0|2,0,1]=4 215 B6R0.6 CCCCCC=O MCULE-6770578514 [1,0,0,0,0,0|2,0,1]=4 216 B6R0.6 CCCCCCBr MCULE-6022503394 [1,0,0,0,0,0|2,0,0]=3 217 B6R0.6 CCCCCCC MCULE-5817084747 [1,0,0,0,0,0|1,0,0]=2 218 B6R0.6 CCCCCCCl MCULE-3706149525 [1,0,0,0,0,0|2,0,0]=3 219 B6R0.6 CCCCCCF MCULE-4320903575 [1,0,0,0,0,0|2,0,0]=3 220 B6R0.6 CCCCCCI MCULE-1021236615 [1,0,0,0,0,0|2,0,0]=3 221 B6R0.6 CCCCCCN MCULE-2944455155 [1,0,0,0,0,0|2,0,0]=3 222 B6R0.6 CCCCCCN MCULE-6014217174 [1,0,0,0,0,0|2,0,0]=3 223 B6R0.6 CCCCCCN MCULE-6021451227 [1,0,0,0,0,0|2,0,0]=3 224 B6R0.6 CCCCCCO MCULE-4299150163 [1,0,0,0,0,0|2,0,0]=3 225 B6R0.6 CCCCCCS MCULE-5962964855 [1,0,0,0,0,0|2,0,0]=3 226 B6R0.6 CCCCCNC MCULE-8082703734 [1,0,0,0,0,0|2,0,0]=3 227 B6R0.6 CCCCCNN MCULE-5089668540 [1,0,0,0,0,0|3,0,0]=4 228 B6R0.6 CCCCCNN MCULE-7265120524 [1,0,0,0,0,0|3,0,0]=4 229 B6R0.6 CCCCCOC MCULE-3370181741 [1,0,0,0,0,0|2,0,0]=3 230 B6R0.6 CCCCCON MCULE-5372426564 [1,0,0,0,0,0|3,0,0]=4 231 B6R0.6 CCCCCON MCULE-8557641459 [1,0,0,0,0,0|3,0,0]=4 232 B6R0.6 CCCCCSC MCULE-6566108868 [1,0,0,0,0,0|2,0,0]=3 233 B6R0.6 CCCCNCC MCULE-8816750429 [1,0,0,0,0,0|2,0,0]=3 234 B6R0.6 CCCCNOC MCULE-4265481432 [1,0,0,0,0,0|3,0,0]=4 235 B6R0.6 CCCCOCC MCULE-5662731951 [1,0,0,0,0,0|1,1,0]=3 236 B6R0.6 CCCCOCCl MCULE-5282964693 [1,0,0,0,0,0|2,1,0]=4 237 B6R0.6 CCCCSC#N MCULE-4585387956 [1,0,0,0,0,0|2,0,1]=4 238 B6R0.6 CCCCSCC MCULE-4832924468 [1,0,0,0,0,0|1,0,0]=2 239 B6R0.6 CCCCSCCl MCULE-4907770015 [1,0,0,0,0,0|2,0,0]=3 240 B6R0.6 CCCNCC#N MCULE-3452380054 [1,0,0,0,0,0|2,0,1]=4 241 B6R0.6 CCCNCCC MCULE-1452672638 [1,0,0,0,0,0|1,0,0]=2 242 B6R0.6 CCCNCCC MCULE-6223802621 [1,0,0,0,0,0|1,0,0]=2 243 B6R0.6 CCCNCCC MCULE-6789654118 [1,0,0,0,0,0|1,0,0]=2 244 B6R0.6 CCCNCCN MCULE-2288945868 [1,0,0,0,0,0|2,0,0]=3 245 B6R0.6 CCCNCCO MCULE-4813687741 [1,0,0,0,0,0|2,0,0]=3 246 B6R0.6 CCCNOCC MCULE-1349462426 [1,0,0,0,0,0|1,1,0]=3 247 B6R0.6 CCCNOCC MCULE-7159087335 [1,0,0,0,0,0|1,1,0]=3 248 B6R0.6 CCCOCC#N MCULE-7011471802 [1,0,0,0,0,0|1,1,1]=4 249 B6R0.6 CCCOCCC MCULE-1390130917 [1,0,0,0,0,0|0,1,0]=2 250 B6R0.6 CCCOCCCl MCULE-6561613708 [1,0,0,0,0,0|1,1,0]=3 251 B6R0.6 CCCOCCI MCULE-5330098176 [1,0,0,0,0,0|1,1,0]=3 252 B6R0.6 CCCOCCN MCULE-1987261931 [1,0,0,0,0,0|1,1,0]=3 253 B6R0.6 CCCOCCN MCULE-9033871038 [1,0,0,0,0,0|1,1,0]=3 254 B6R0.6 CCCOCCO MCULE-3263526264 [1,0,0,0,0,0|1,1,0]=3 255 B6R0.6 CCCSCCC MCULE-5531652471 [1,0,0,0,0,0|0,0,0]=1 256 B6R0.6 CCCSCCN MCULE-3934428121 [1,0,0,0,0,0|1,0,0]=2 257 B6R0.6 CCCSCCN MCULE-5705755172 [1,0,0,0,0,0|1,0,0]=2 258 B6R0.6 CCCSCCO MCULE-8371796663 [1,0,0,0,0,0|1,0,0]=2 259 B6R0.6 CCCSSCC MCULE-7192921435 [1,0,0,0,0,0|0,0,0]=1 260 B6R0.6 CCNCCCN MCULE-5811169148 [1,0,0,0,0,0|3,0,0]=4 261 B6R0.6 CCNCCCO MCULE-3251610052 [1,0,0,0,0,0|3,0,0]=4 262 B6R0.6 CCNCCNC MCULE-9372339393 [1,0,0,0,0,0|3,0,0]=4 263 B6R0.6 CCNCCOC MCULE-1476772953 [1,0,0,0,0,0|3,0,0]=4 264 B6R0.6 CCNCCOC MCULE-6652489795 [1,0,0,0,0,0|3,0,0]=4 265 B6R0.6 CCNCCSC MCULE-1736157320 [1,0,0,0,0,0|3,0,0]=4 266 B6R0.6 CCNCCSC MCULE-9369049891 [1,0,0,0,0,0|3,0,0]=4 267 B6R0.6 CCOCCCBr MCULE-6544747281 [1,0,0,0,0,0|2,1,0]=4 268 B6R0.6 CCOCCCCl MCULE-8523618681 [1,0,0,0,0,0|2,1,0]=4 269 B6R0.6 CCOCCCI MCULE-6640732668 [1,0,0,0,0,0|2,1,0]=4 270 B6R0.6 CCOCCCN MCULE-3491529722 [1,0,0,0,0,0|2,1,0]=4 271 B6R0.6 CCOCCCO MCULE-3077567484 [1,0,0,0,0,0|2,1,0]=4 272 B6R0.6 CCOCCNC MCULE-5244682559 [1,0,0,0,0,0|2,1,0]=4 273 B6R0.6 CCOCCNC MCULE-9344296133 [1,0,0,0,0,0|2,1,0]=4 274 B6R0.6 CCOCCOC MCULE-2753000412 [1,0,0,0,0,0|2,1,0]=4 275 B6R0.6 CCOCOCC MCULE-3885854108 [1,0,0,0,0,0|2,1,0]=4 276 B6R0.6 CCSCCC=O MCULE-2493452950 [1,0,0,0,0,0|2,0,1]=4 277 B6R0.6 CCSCCCBr MCULE-5143634954 [1,0,0,0,0,0|2,0,0]=3 278 B6R0.6 CCSCCCN MCULE-4566450606 [1,0,0,0,0,0|2,0,0]=3 279 B6R0.6 CCSCCCO MCULE-6719011943 [1,0,0,0,0,0|2,0,0]=3 280 B6R0.6 CCSCCNC MCULE-6159594076 [1,0,0,0,0,0|2,0,0]=3 281 B6R0.6 CCSCCNC MCULE-6696154047 [1,0,0,0,0,0|2,0,0]=3 282 B6R0.6 CCSCSCC MCULE-6005869091 [1,0,0,0,0,0|2,0,0]=3 283 B6R0.6 CCSSSCC MCULE-7754450209 [1,0,0,0,0,0|1,0,0]=2 284 B6R0.6 CNCCCCBr MCULE-4148452640 [1,0,0,0,0,0|3,0,0]=4 285 B6R0.6 CNCCCCBr MCULE-8686440557 [1,0,0,0,0,0|3,0,0]=4 286 B6R0.6 CNCCCCCl MCULE-1170786568 [1,0,0,0,0,0|3,0,0]=4 287 B6R0.6 CNCCCCCl MCULE-1726466829 [1,0,0,0,0,0|3,0,0]=4 288 B6R0.6 CNCCCCN MCULE-2542685963 [1,0,0,0,0,0|3,0,0]=4 289 B6R0.6 CNCCCCN MCULE-7925344560 [1,0,0,0,0,0|3,0,0]=4 290 B6R0.6 CNCCCCO MCULE-9264393637 [1,0,0,0,0,0|3,0,0]=4 291 B6R0.6 CNCCCNC MCULE-3840224541 [1,0,0,0,0,0|3,0,0]=4 292 B6R0.6 CNCCCOC MCULE-4057126907 [1,0,0,0,0,0|3,0,0]=4 293 B6R0.6 CNCCCOC MCULE-8552551858 [1,0,0,0,0,0|3,0,0]=4 294 B6R0.6 CNCCCSC MCULE-6553998750 [1,0,0,0,0,0|3,0,0]=4 295 B6R0.6 COCCCCBr MCULE-7500019583 [1,0,0,0,0,0|3,0,0]=4 296 B6R0.6 COCCCCCl MCULE-3863170338 [1,0,0,0,0,0|3,0,0]=4 297 B6R0.6 COCCCCN MCULE-9584631056 [1,0,0,0,0,0|3,0,0]=4 298 B6R0.6 COCCCCO MCULE-2543196930 [1,0,0,0,0,0|3,0,0]=4 299 B6R0.6 COCCCCO MCULE-8659106280 [1,0,0,0,0,0|3,0,0]=4 300 B6R0.6 COCCCOC MCULE-5003816236 [1,0,0,0,0,0|3,0,0]=4 301 B6R0.6 COCOCCBr MCULE-8856323357 [1,0,0,0,0,0|2,1,0]=4 302 B6R0.6 COCOCCI MCULE-4444019738 [1,0,0,0,0,0|2,1,0]=4 303 B6R0.6 COCOCCN MCULE-7974740048 [1,0,0,0,0,0|2,1,0]=4 304 B6R0.6 COCOCCO MCULE-8093241209 [1,0,0,0,0,0|2,1,0]=4 305 B6R0.6 COCOCOC MCULE-9183615159 [1,0,0,0,0,0|2,1,0]=4 306 B6R0.6 CSCCCCN MCULE-2391033479 [1,0,0,0,0,0|3,0,0]=4 307 B6R0.6 CSCCCCO MCULE-1045422424 [1,0,0,0,0,0|3,0,0]=4 308 B6R0.6 CSCCCSC MCULE-6993538101 [1,0,0,0,0,0|3,0,0]=4 309 B6R0.6 ClCCCCCBr MCULE-6767883252 [1,0,0,0,0,0|3,0,0]=4 310 B6R0.6 ClCCCCCCl MCULE-9302388009 [1,0,0,0,0,0|3,0,0]=4 311 B6R0.6 ClCCCCCI MCULE-2173931817 [1,0,0,0,0,0|3,0,0]=4 312 B6R0.6 ClCCNCCCl MCULE-2453447059 [1,0,0,0,0,0|3,0,0]=4 313 B6R0.6 ClCCOCCCl MCULE-2189904184 [1,0,0,0,0,0|2,1,0]=4 314 B6R0.6 ClCCOCCI MCULE-8666203040 [1,0,0,0,0,0|2,1,0]=4 315 B6R0.6 FCCCCCBr MCULE-1314383985 [1,0,0,0,0,0|3,0,0]=4 316 B6R0.6 ICCCCCI MCULE-2889089700 [1,0,0,0,0,0|3,0,0]=4 317 B6R0.6 ICCOCCI MCULE-8427607007 [1,0,0,0,0,0|2,1,0]=4 318 B6R0.6 NCCCCCBr MCULE-3577483607 [1,0,0,0,0,0|3,0,0]=4 319 B6R0.6 NCCCCCBr MCULE-7572691537 [1,0,0,0,0,0|3,0,0]=4 320 B6R0.6 NCCCCCF MCULE-1057270243 [1,0,0,0,0,0|3,0,0]=4 321 B6R0.6 NCCCCCN MCULE-3785554987 [1,0,0,0,0,0|3,0,0]=4 322 B6R0.6 NCCCCCN MCULE-5173983982 [1,0,0,0,0,0|3,0,0]=4 323 B6R0.6 NCCCCCO MCULE-8877250712 [1,0,0,0,0,0|3,0,0]=4 324 B6R0.6 NCCCCCS MCULE-1813104379 [1,0,0,0,0,0|3,0,0]=4 325 B6R0.6 NCCCCCS MCULE-6081835870 [1,0,0,0,0,0|3,0,0]=4 326 B6R0.6 NCCNCCCl MCULE-8909584172 [1,0,0,0,0,0|3,0,0]=4 327 B6R0.6 NCCNCCCl MCULE-9412103836 [1,0,0,0,0,0|3,0,0]=4 328 B6R0.6 NCCNCCN MCULE-4710767146 [1,0,0,0,0,0|3,0,0]=4 329 B6R0.6 NCCNCCN MCULE-4803305991 [1,0,0,0,0,0|3,0,0]=4 330 B6R0.6 NCCNCCO MCULE-2112359407 [1,0,0,0,0,0|3,0,0]=4 331 B6R0.6 NCCOCCBr MCULE-6520580224 [1,0,0,0,0,0|2,1,0]=4 332 B6R0.6 NCCOCCCl MCULE-1975521529 [1,0,0,0,0,0|2,1,0]=4 333 B6R0.6 NCCOCCCl MCULE-9715175348 [1,0,0,0,0,0|2,1,0]=4 334 B6R0.6 NCCOCCF MCULE-4126568309 [1,0,0,0,0,0|2,1,0]=4 335 B6R0.6 NCCOCCF MCULE-4641621710 [1,0,0,0,0,0|2,1,0]=4 336 B6R0.6 NCCOCCN MCULE-1630934305 [1,0,0,0,0,0|2,1,0]=4 337 B6R0.6 NCCOCCN MCULE-3282393357 [1,0,0,0,0,0|2,1,0]=4 338 B6R0.6 NCCOCCN MCULE-3788231540 [1,0,0,0,0,0|2,1,0]=4 339 B6R0.6 NCCOCCO MCULE-1073574088 [1,0,0,0,0,0|2,1,0]=4 340 B6R0.6 NCCSCCN MCULE-4317147284 [1,0,0,0,0,0|2,0,0]=3 341 B6R0.6 NCCSCCN MCULE-5449033874 [1,0,0,0,0,0|2,0,0]=3 342 B6R0.6 NCCSCCO MCULE-1475378446 [1,0,0,0,0,0|2,0,0]=3 343 B6R0.6 OCCCCCBr MCULE-1444733196 [1,0,0,0,0,0|3,0,0]=4 344 B6R0.6 OCCCCCCl MCULE-5666058059 [1,0,0,0,0,0|3,0,0]=4 345 B6R0.6 OCCCCCF MCULE-9253204275 [1,0,0,0,0,0|3,0,0]=4 346 B6R0.6 OCCCCCI MCULE-8707758496 [1,0,0,0,0,0|3,0,0]=4 347 B6R0.6 OCCCCCO MCULE-1044076048 [1,0,0,0,0,0|3,0,0]=4 348 B6R0.6 OCCNCCCl MCULE-7809492267 [1,0,0,0,0,0|3,0,0]=4 349 B6R0.6 OCCNCCCl MCULE-9007709158 [1,0,0,0,0,0|3,0,0]=4 350 B6R0.6 OCCNCCO MCULE-9183096746 [1,0,0,0,0,0|3,0,0]=4 351 B6R0.6 OCCNCCO MCULE-9803420258 [1,0,0,0,0,0|3,0,0]=4 352 B6R0.6 OCCOCCBr MCULE-2641000270 [1,0,0,0,0,0|2,1,0]=4 353 B6R0.6 OCCOCCCl MCULE-7320539957 [1,0,0,0,0,0|2,1,0]=4 354 B6R0.6 OCCOCCF MCULE-1780385479 [1,0,0,0,0,0|2,1,0]=4 355 B6R0.6 OCCOCCI MCULE-1083607130 [1,0,0,0,0,0|2,1,0]=4 356 B6R0.6 OCCOCCO MCULE-1531783732 [1,0,0,0,0,0|2,1,0]=4 357 B6R0.6 OCCSCCO MCULE-5502656030 [1,0,0,0,0,0|2,0,0]=3 358 B6R0.6 OCCSCCS MCULE-4418561990 [1,0,0,0,0,0|2,0,0]=3 359 B6R0.6 SCCCCCS MCULE-4899719552 [1,0,0,0,0,0|3,0,0]=4 360 B6R0.6 SCCOCCS MCULE-6659110232 [1,0,0,0,0,0|2,1,0]=4 361 B6R0.6 SCCSCCS MCULE-1219600644 [1,0,0,0,0,0|2,0,0]=3 362 B6R0.6 [NH2+](CCCl)CCCl MCULE-9020671822 [1,0,0,0,0,0|3,0,0]=4 363 B8R0.1 CCCC(=O)NCCN MCULE-1372911866 [0,1,0,0,0,0|3,0,0]=4 364 B8R0.1 CCCC(=O)OCCCl MCULE-8469083528 [0,1,0,0,0,0|2,1,0]=4 365 B8R0.1 CCCC(=O)OCCO MCULE-5942976945 [0,1,0,0,0,0|2,1,0]=4 366 B8R0.1 CCCC(C)CCCBr MCULE-3368342552 [0,1,0,0,0,0|3,0,0]=4 367 B8R0.1 CCCC(C)CCCO MCULE-9229761768 [0,1,0,0,0,0|3,0,0]=4 368 B8R0.1 CCCC(O)CCCO MCULE-4169738114 [0,1,0,0,0,0|3,0,0]=4 369 B8R0.1 CCCC(O)CCCS MCULE-9595771348 [0,1,0,0,0,0|3,0,0]=4 370 B8R0.1 CCCCC(=N)OCC MCULE-3866961773 [0,1,0,0,0,0|3,0,0]=4 371 B8R0.1 CCCCC(=N)OCC MCULE-6116145724 [0,1,0,0,0,0|3,0,0]=4 372 B8R0.1 CCCCC(=O)CCC MCULE-5459540473 [0,1,0,0,0,0|2,0,0]=3 373 B8R0.1 CCCCC(=O)COC MCULE-7059597173 [0,1,0,0,0,0|3,0,0]=4 374 B8R0.1 CCCCC(=O)OCC MCULE-1219537918 [0,1,0,0,0,0|3,0,0]=4 375 B8R0.1 CCCCC(Br)CCC MCULE-1998636531 [0,1,0,0,0,0|2,0,0]=3 376 B8R0.1 CCCCC(C)CCO MCULE-7796394440 [0,1,0,0,0,0|3,0,0]=4 377 B8R0.1 CCCCC(N)CCC MCULE-5245074866 [0,1,0,0,0,0|2,0,0]=3 378 B8R0.1 CCCCC(N)CCO MCULE-1718868981 [0,1,0,0,0,0|3,0,0]=4 379 B8R0.1 CCCCC(N)CCO MCULE-6967408250 [0,1,0,0,0,0|3,0,0]=4 380 B8R0.1 CCCCC(N)CCO MCULE-7169926590 [0,1,0,0,0,0|3,0,0]=4 381 B8R0.1 CCCCC(N)CCO MCULE-7195068070 [0,1,0,0,0,0|3,0,0]=4 382 B8R0.1 CCCCC(N)COC MCULE-6869672438 [0,1,0,0,0,0|3,0,0]=4 383 B8R0.1 CCCCC(O)CCC MCULE-6030672439 [0,1,0,0,0,0|2,0,0]=3 384 B8R0.1 CCCCC(O)CCO MCULE-1527111701 [0,1,0,0,0,0|3,0,0]=4 385 B8R0.1 CCCCN(C)CCCl MCULE-1630310554 [0,1,0,0,0,0|3,0,0]=4 386 B8R0.1 CCCCN(C)CCCl MCULE-9938629831 [0,1,0,0,0,0|3,0,0]=4 387 B8R0.1 CCCCN(C)CCN MCULE-9574296650 [0,1,0,0,0,0|3,0,0]=4 388 B8R0.1 CCCCN(C)CCO MCULE-9224761648 [0,1,0,0,0,0|3,0,0]=4 389 B8R0.1 CCCCS(=O)CCO MCULE-9422446521 [0,1,0,0,0,0|2,0,1]=4 390 B8R0.1 CCCC[C@H](N)CCO MCULE-1556286414 [0,1,0,0,0,0|3,0,0]=4 391 B8R0.1 CCCC[C@H](N)CCO MCULE-5421326968 [0,1,0,0,0,0|3,0,0]=4 392 B8R0.1 CCCC[C@H](N)CCO MCULE-8706513986 [0,1,0,0,0,0|3,0,0]=4 393 B8R0.1 CCCNC(=O)CCC MCULE-2578933218 [0,1,0,0,0,0|2,0,0]=3 394 B8R0.1 CCCNC(=O)CCN MCULE-9343291828 [0,1,0,0,0,0|3,0,0]=4 395 B8R0.1 CCCNC(=O)CCN MCULE-9397624395 [0,1,0,0,0,0|3,0,0]=4 396 B8R0.1 CCCNC(=O)CNC MCULE-3183907339 [0,1,0,0,0,0|3,0,0]=4 397 B8R0.1 CCCNC(=O)CNC MCULE-9204845590 [0,1,0,0,0,0|3,0,0]=4 398 B8R0.1 CCCNC(=O)NCC MCULE-5842395608 [0,1,0,0,0,0|3,0,0]=4 399 B8R0.1 CCCOC(=O)CCC MCULE-7673125406 [0,1,0,0,0,0|1,1,0]=3 400 B8R0.1 CCCOC(=O)CCN MCULE-1345071747 [0,1,0,0,0,0|2,1,0]=4 401 B8R0.1 CCCOC(=O)CCN MCULE-3861690448 [0,1,0,0,0,0|2,1,0]=4 402 B8R0.1 CCCOC(=O)CCO MCULE-7390309329 [0,1,0,0,0,0|2,1,0]=4 403 B8R0.4 BrCCCCCCCBr MCULE-4094304263 [0,1,0,0,0,0|3,0,0]=4 404 B8R0.4 BrCCCOCCCBr MCULE-7546792867 [0,1,0,0,0,0|2,1,0]=4 405 B8R0.4 C#CCCCCCCC MCULE-5881425113 [0,1,0,0,0,0|2,0,1]=4 406 B8R0.4 C=CCCCCCCC MCULE-8103203416 [0,1,0,0,0,0|2,0,1]=4 407 B8R0.4 C=CCSSSCCC MCULE-9939190592 [0,1,0,0,0,0|0,0,2]=3 408 B8R0.4 CC#CCNCCCC MCULE-7004509106 [0,1,0,0,0,0|2,0,1]=4 409 B8R0.4 CC#CCNCCCC MCULE-8350527005 [0,1,0,0,0,0|2,0,1]=4 410 B8R0.4 CC=CCCCCCC MCULE-2766900913 [0,1,0,0,0,0|2,0,1]=4 411 B8R0.4 CC=CCSCCCC MCULE-7318808486 [0,1,0,0,0,0|1,0,1]=3 412 B8R0.4 CCC#CCCCCC MCULE-3250800871 [0,1,0,0,0,0|2,0,1]=4 413 B8R0.4 CCC/C=C\CCCC MCULE-1534641855 [0,1,0,0,0,0|2,0,0]=3 414 B8R0.4 CCC=CCCCCO MCULE-2496486842 [0,1,0,0,0,0|2,0,1]=4 415 B8R0.4 CCCC/C=C\CCO MCULE-5021089657 [0,1,0,0,0,0|2,0,1]=4 416 B8R0.4 CCCC=CCCCC MCULE-6609949802 [0,1,0,0,0,0|2,0,0]=3 417 B8R0.4 CCCCBCCCC MCULE-3163100787 [0,1,0,0,0,0|2,0,0]=3 418 B8R0.4 CCCCBCCCC MCULE-6578781762 [0,1,0,0,0,0|2,0,0]=3 419 B8R0.4 CCCCC#CCCO MCULE-6156677538 [0,1,0,0,0,0|2,0,1]=4 420 B8R0.4 CCCCC=CCCO MCULE-5187523035 [0,1,0,0,0,0|2,0,1]=4 421 B8R0.4 CCCCCCCC#N MCULE-3399476727 [0,1,0,0,0,0|2,0,1]=4 422 B8R0.4 CCCCCCCC=O MCULE-7111365457 [0,1,0,0,0,0|2,0,1]=4 423 B8R0.4 CCCCCCCCBr MCULE-7484248707 [0,1,0,0,0,0|2,0,0]=3 424 B8R0.4 CCCCCCCCC MCULE-1865327912 [0,1,0,0,0,0|2,0,0]=3 425 B8R0.4 CCCCCCCCCl MCULE-5953637232 [0,1,0,0,0,0|2,0,0]=3 426 B8R0.4 CCCCCCCCF MCULE-5641912511 [0,1,0,0,0,0|2,0,0]=3 427 B8R0.4 CCCCCCCCI MCULE-7304806902 [0,1,0,0,0,0|2,0,0]=3 428 B8R0.4 CCCCCCCCN MCULE-6095227778 [0,1,0,0,0,0|2,0,0]=3 429 B8R0.4 CCCCCCCCN MCULE-7012389700 [0,1,0,0,0,0|2,0,0]=3 430 B8R0.4 CCCCCCCCN MCULE-7076053015 [0,1,0,0,0,0|2,0,0]=3 431 B8R0.4 CCCCCCCCO MCULE-2656577895 [0,1,0,0,0,0|2,0,0]=3 432 B8R0.4 CCCCCCCCS MCULE-5212273874 [0,1,0,0,0,0|2,0,0]=3 433 B8R0.4 CCCCCCCNC MCULE-1143610772 [0,1,0,0,0,0|2,0,0]=3 434 B8R0.4 CCCCCCCNN MCULE-7800659587 [0,1,0,0,0,0|3,0,0]=4 435 B8R0.4 CCCCCCCON MCULE-6380236924 [0,1,0,0,0,0|3,0,0]=4 436 B8R0.4 CCCCCCCON MCULE-6581043184 [0,1,0,0,0,0|3,0,0]=4 437 B8R0.4 CCCCCCCSC MCULE-5211260102 [0,1,0,0,0,0|2,0,0]=3 438 B8R0.4 CCCCCCSCC MCULE-1449428108 [0,1,0,0,0,0|2,0,0]=3 439 B8R0.4 CCCCCNCCC MCULE-7697830316 [0,1,0,0,0,0|2,0,0]=3 440 B8R0.4 CCCCCNCCN MCULE-5873419228 [0,1,0,0,0,0|3,0,0]=4 441 B8R0.4 CCCCCNCCO MCULE-7662965930 [0,1,0,0,0,0|3,0,0]=4 442 B8R0.4 CCCCCNOCC MCULE-5426574695 [0,1,0,0,0,0|3,0,0]=4 443 B8R0.4 CCCCCNOCC MCULE-6155853359 [0,1,0,0,0,0|3,0,0]=4 444 B8R0.4 CCCCCOCCO MCULE-3393695257 [0,1,0,0,0,0|2,1,0]=4 445 B8R0.4 CCCCCSCCCl MCULE-7680431310 [0,1,0,0,0,0|2,0,0]=3 446 B8R0.4 CCCCCSCCO MCULE-1239137782 [0,1,0,0,0,0|2,0,0]=3 447 B8R0.4 CCCCNCCC#N MCULE-1395411662 [0,1,0,0,0,0|2,0,1]=4 448 B8R0.4 CCCCNCCCC MCULE-1338595384 [0,1,0,0,0,0|2,0,0]=3 449 B8R0.4 CCCCNCCCC MCULE-4720016177 [0,1,0,0,0,0|2,0,0]=3 450 B8R0.4 CCCCNCCCC MCULE-6002936904 [0,1,0,0,0,0|2,0,0]=3 451 B8R0.4 CCCCNCCCC MCULE-8673755112 [0,1,0,0,0,0|2,0,0]=3 452 B8R0.4 CCCCNCCCCl MCULE-6595599220 [0,1,0,0,0,0|2,0,0]=3 453 B8R0.4 CCCCNCCCCl MCULE-8225115019 [0,1,0,0,0,0|2,0,0]=3 454 B8R0.4 CCCCNCCCN MCULE-6098022466 [0,1,0,0,0,0|2,0,0]=3 455 B8R0.4 CCCCNCCCO MCULE-7171357018 [0,1,0,0,0,0|2,0,0]=3 456 B8R0.4 CCCCNCCOC MCULE-5142206385 [0,1,0,0,0,0|2,0,0]=3 457 B8R0.4 CCCCOCCC#N MCULE-6848830768 [0,1,0,0,0,0|1,1,1]=4 458 B8R0.4 CCCCOCCCC MCULE-8568026186 [0,1,0,0,0,0|1,1,0]=3 459 B8R0.4 CCCCOCCCN MCULE-2107763231 [0,1,0,0,0,0|1,1,0]=3 460 B8R0.4 CCCCOCCCO MCULE-2797403638 [0,1,0,0,0,0|1,1,0]=3 461 B8R0.4 CCCCOCCOC MCULE-4497601798 [0,1,0,0,0,0|1,1,0]=3 462 B8R0.4 CCCCSCCCC MCULE-3121918458 [0,1,0,0,0,0|1,0,0]=2 463 B8R0.4 CCCCSCCCN MCULE-6519812920 [0,1,0,0,0,0|1,0,0]=2 464 B8R0.4 CCCC[NH2+]CCCC MCULE-4333811997 [0,1,0,0,0,0|2,0,0]=3 465 B8R0.4 CCCC[NH2+]CCCC MCULE-8030655880 [0,1,0,0,0,0|2,0,0]=3 466 B8R0.4 CCCNCCCCN MCULE-1576152293 [0,1,0,0,0,0|2,0,0]=3 467 B8R0.4 CCCNCCCCN MCULE-2764845788 [0,1,0,0,0,0|2,0,0]=3 468 B8R0.4 CCCNCCCNC MCULE-5061364734 [0,1,0,0,0,0|2,0,0]=3 469 B8R0.4 CCCSCCCCN MCULE-7923615539 [0,1,0,0,0,0|1,0,0]=2 470 B8R0.4 CCCSSSCCC MCULE-8234539570 [0,1,0,0,0,0|0,0,0]=1 471 B8R0.4 CCNCCCCCN MCULE-1094310455 [0,1,0,0,0,0|3,0,0]=4 472 B8R0.4 CCNCCCNCC MCULE-6294880102 [0,1,0,0,0,0|3,0,0]=4 473 B8R0.4 CCNCCOCCN MCULE-7419143110 [0,1,0,0,0,0|2,1,0]=4 474 B8R0.4 CCNCCOCCO MCULE-3581305931 [0,1,0,0,0,0|2,1,0]=4 475 B8R0.4 CCOCCOCCBr MCULE-9030593043 [0,1,0,0,0,0|2,1,0]=4 476 B8R0.4 CCOCCOCCCl MCULE-5739255923 [0,1,0,0,0,0|2,1,0]=4 477 B8R0.4 CCOCCOCCN MCULE-5375263489 [0,1,0,0,0,0|2,1,0]=4 478 B8R0.4 CCOCCOCCN MCULE-5713936875 [0,1,0,0,0,0|2,1,0]=4 479 B8R0.4 CCOCCOCCO MCULE-8940886567 [0,1,0,0,0,0|2,1,0]=4 480 B8R0.4 CCSCCOCCO MCULE-6785870605 [0,1,0,0,0,0|2,1,0]=4 481 B8R0.4 CNCCCCCCN MCULE-3241182046 [0,1,0,0,0,0|3,0,0]=4 482 B8R0.4 CNCCCCCCO MCULE-2582847385 [0,1,0,0,0,0|3,0,0]=4 483 B8R0.4 CNCCNCCNC MCULE-3744209310 [0,1,0,0,0,0|3,0,0]=4 484 B8R0.4 CNCCNCCNC MCULE-8147596206 [0,1,0,0,0,0|3,0,0]=4 485 B8R0.4 CNCCOCCNC MCULE-3244205178 [0,1,0,0,0,0|2,1,0]=4 486 B8R0.4 CNCCOCCOC MCULE-7587397318 [0,1,0,0,0,0|2,1,0]=4 487 B8R0.4 COCCCCCCBr MCULE-8590853100 [0,1,0,0,0,0|3,0,0]=4 488 B8R0.4 COCCCCCCO MCULE-5454628686 [0,1,0,0,0,0|3,0,0]=4 489 B8R0.4 COCCCCCOC MCULE-5066626930 [0,1,0,0,0,0|3,0,0]=4 490 B8R0.4 COCCCNCCN MCULE-6697775895 [0,1,0,0,0,0|3,0,0]=4 491 B8R0.4 COCCCNCCO MCULE-3069731145 [0,1,0,0,0,0|3,0,0]=4 492 B8R0.4 COCCCOCCO MCULE-7280677606 [0,1,0,0,0,0|2,1,0]=4 493 B8R0.4 COCCNCCCN MCULE-7319591268 [0,1,0,0,0,0|3,0,0]=4 494 B8R0.4 COCCNCCCO MCULE-9359795449 [0,1,0,0,0,0|3,0,0]=4 495 B8R0.4 COCCNCCOC MCULE-4979724092 [0,1,0,0,0,0|3,0,0]=4 496 B8R0.4 COCCOCCCBr MCULE-1854114779 [0,1,0,0,0,0|2,1,0]=4 497 B8R0.4 COCCOCCCN MCULE-8835423066 [0,1,0,0,0,0|2,1,0]=4 498 B8R0.4 COCCOCCCO MCULE-7732325457 [0,1,0,0,0,0|2,1,0]=4 499 B8R0.4 COCCOCCOC MCULE-8598811835 [0,1,0,0,0,0|2,1,0]=4 500 B8R0.4 COCCSCCCBr MCULE-9034574998 [0,1,0,0,0,0|2,0,0]=3 501 B8R0.4 CSCCCCCCN MCULE-3785645703 [0,1,0,0,0,0|3,0,0]=4 502 B8R0.4 CSCCCCCCO MCULE-1590282643 [0,1,0,0,0,0|3,0,0]=4 503 B8R0.4 CSCCCCCSC MCULE-3097194542 [0,1,0,0,0,0|3,0,0]=4 504 B8R0.4 ClCCCCCCCBr MCULE-6518226792 [0,1,0,0,0,0|3,0,0]=4 505 B8R0.4 ClCCCCCCCCl MCULE-9270407250 [0,1,0,0,0,0|3,0,0]=4 506 B8R0.4 ClCCCOCCCCl MCULE-9363066168 [0,1,0,0,0,0|2,1,0]=4 507 B8R0.4 NCCCCCCCBr MCULE-2103124315 [0,1,0,0,0,0|3,0,0]=4 508 B8R0.4 NCCCCCCCBr MCULE-9591138313 [0,1,0,0,0,0|3,0,0]=4 509 B8R0.4 NCCCCCCCN MCULE-3408586405 [0,1,0,0,0,0|3,0,0]=4 510 B8R0.4 NCCCCCCCO MCULE-6098435698 [0,1,0,0,0,0|3,0,0]=4 511 B8R0.4 NCCCCCCCO MCULE-8352830275 [0,1,0,0,0,0|3,0,0]=4 512 B8R0.4 NCCCCNCCO MCULE-5679490980 [0,1,0,0,0,0|3,0,0]=4 513 B8R0.4 NCCCNCCCN MCULE-3936851596 [0,1,0,0,0,0|3,0,0]=4 514 B8R0.4 NCCCNCCCO MCULE-1085206494 [0,1,0,0,0,0|3,0,0]=4 515 B8R0.4 NCCCOCCCN MCULE-5378554478 [0,1,0,0,0,0|2,1,0]=4 516 B8R0.4 NCCCOCCCO MCULE-9489688996 [0,1,0,0,0,0|2,1,0]=4 517 B8R0.4 NCCNCCCCO MCULE-1668134399 [0,1,0,0,0,0|3,0,0]=4 518 B8R0.4 NCCNCCCCO MCULE-8060063829 [0,1,0,0,0,0|3,0,0]=4 519 B8R0.4 OCCCCCCCBr MCULE-2559114853 [0,1,0,0,0,0|3,0,0]=4 520 B8R0.4 OCCCCCCCCl MCULE-4143586059 [0,1,0,0,0,0|3,0,0]=4 521 B8R0.4 OCCCCCCCI MCULE-3420024644 [0,1,0,0,0,0|3,0,0]=4 522 B8R0.4 OCCCCCCCO MCULE-1201837142 [0,1,0,0,0,0|3,0,0]=4 523 B8R0.4 OCCCNCCCO MCULE-1813882908 [0,1,0,0,0,0|3,0,0]=4 524 B8R0.4 OCCCNCCCO MCULE-4567401301 [0,1,0,0,0,0|3,0,0]=4 525 B8R0.4 OCCCOCCCCl MCULE-9999003892 [0,1,0,0,0,0|2,1,0]=4 526 B8R0.4 OCCCOCCCO MCULE-2894245516 [0,1,0,0,0,0|2,1,0]=4 527 B8R0.4 OCCCSCCCO MCULE-2025331376 [0,1,0,0,0,0|2,0,0]=3 528 B8R0.4 OCCSCSCCO MCULE-5909808862 [0,1,0,0,0,0|2,0,0]=3 529 B8R0.6 CCC#CCC(O)CC MCULE-9738694630 [0,1,0,0,0,0|2,0,1]=4 530 B8R0.6 CCC(C)CCCCO MCULE-9107164434 [0,1,0,0,0,0|3,0,0]=4 531 B8R0.6 CCC(C)NCCCN MCULE-5686538506 [0,1,0,0,0,0|3,0,0]=4 532 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [0,1,0,0,0,0|2,0,1]=4 533 B8R0.6 CCCCCC(Br)CBr MCULE-6200544642 [0,1,0,0,0,0|3,0,0]=4 534 B8R0.6 CCCCCC(C)CC MCULE-8343490845 [0,1,0,0,0,0|2,0,0]=3 535 B8R0.6 CCCCCC(C)CO MCULE-4884757032 [0,1,0,0,0,0|3,0,0]=4 536 B8R0.6 CCCCCC(O)CC MCULE-6682377557 [0,1,0,0,0,0|2,0,0]=3 537 B8R0.6 CCCCCC(O)CCl MCULE-5610334497 [0,1,0,0,0,0|3,0,0]=4 538 B8R0.6 CCCCCC(O)CN MCULE-6091710122 [0,1,0,0,0,0|3,0,0]=4 539 B8R0.6 CCCCCC(O)CO MCULE-4124719814 [0,1,0,0,0,0|3,0,0]=4 540 B8R0.6 CCCCNC(=O)CC MCULE-3176114265 [0,1,0,0,0,0|2,0,1]=4 541 B8R0.6 CCCCNC(C)CC MCULE-9849866712 [0,1,0,0,0,0|2,0,0]=3 542 B8R0.6 CCCCOC(=O)CC MCULE-4622389592 [0,1,0,0,0,0|1,1,1]=4 543 B8R0.6 CCCNCC(O)CO MCULE-1611893086 [0,1,0,0,0,0|3,0,0]=4 544 B8R0.6 CCCOCC(C)CO MCULE-8326797774 [0,1,0,0,0,0|2,1,0]=4 545 B8R0.6 CCCOCC(O)CO MCULE-8815613620 [0,1,0,0,0,0|2,1,0]=4 546 B8R0.6 CCCOC[C@H](O)CO MCULE-7750792134 [0,1,0,0,0,0|2,1,0]=4 547 B8R0.6 CCCSCC(=O)OC MCULE-3865642484 [0,1,0,0,0,0|2,0,1]=4 548 B8R0.6 CC[C@H](C)CCCCO MCULE-2674922341 [0,1,0,0,0,0|3,0,0]=4 549 B8R0.6 CC[C@H](C)CCCCO MCULE-7482991055 [0,1,0,0,0,0|3,0,0]=4 550 B8R0.6 COC(=O)SSCCN MCULE-2854223096 [0,1,0,0,0,0|2,0,1]=4 551 B8R0.6 [C@H](O)(CC)CCCCC MCULE-7121730436 [0,1,0,0,0,0|2,0,0]=3 552 B8R0.7 C=C(C)CCCCCC MCULE-2243788093 [0,1,0,0,0,0|2,0,1]=4 553 B8R0.7 C=C(C)CSCCCC MCULE-7053589995 [0,1,0,0,0,0|1,0,1]=3 554 B8R0.7 CC(Br)C[NH2+]CCC[NH3+] MCULE-6319897150 [0,1,0,0,0,0|3,0,0]=4 555 B8R0.7 CC(Br)C[NH2+]CCC[NH3+] MCULE-9507534494 [0,1,0,0,0,0|3,0,0]=4 556 B8R0.7 CC(C)CCCCCBr MCULE-6339659463 [0,1,0,0,0,0|3,0,0]=4 557 B8R0.7 CC(C)CCCCCN MCULE-4764798524 [0,1,0,0,0,0|3,0,0]=4 558 B8R0.7 CC(C)CCCCCO MCULE-2133434329 [0,1,0,0,0,0|3,0,0]=4 559 B8R0.7 CC(C)CCNCCBr MCULE-2670026363 [0,1,0,0,0,0|3,0,0]=4 560 B8R0.7 CC(C)CCNCCBr MCULE-8753554915 [0,1,0,0,0,0|3,0,0]=4 561 B8R0.7 CC(C)CCNCCN MCULE-3917899793 [0,1,0,0,0,0|3,0,0]=4 562 B8R0.7 CC(C)CCNCCO MCULE-7584613000 [0,1,0,0,0,0|3,0,0]=4 563 B8R0.7 CC(C)CCOCCCl MCULE-6456640636 [0,1,0,0,0,0|2,1,0]=4 564 B8R0.7 CC(C)CCOCCN MCULE-2357363560 [0,1,0,0,0,0|2,1,0]=4 565 B8R0.7 CC(C)CCOCCO MCULE-2905905370 [0,1,0,0,0,0|2,1,0]=4 566 B8R0.7 CC(C)CNCCCO MCULE-2271519808 [0,1,0,0,0,0|3,0,0]=4 567 B8R0.7 CC(C)COCCCN MCULE-1113222381 [0,1,0,0,0,0|2,1,0]=4 568 B8R0.7 CC(C)COCCCO MCULE-8827861403 [0,1,0,0,0,0|2,1,0]=4 569 B8R0.7 CC(C)CSCCCCl MCULE-4611281209 [0,1,0,0,0,0|2,0,0]=3 570 B8R0.7 CC(C)CSCCCN MCULE-7842745549 [0,1,0,0,0,0|2,0,0]=3 571 B8R0.7 CC(C)CSCCCO MCULE-8186559992 [0,1,0,0,0,0|2,0,0]=3 572 B8R0.7 CCCCCCC(=O)C MCULE-1152821440 [0,1,0,0,0,0|2,0,1]=4 573 B8R0.7 CCCCCCC(Br)Br MCULE-5790254532 [0,1,0,0,0,0|3,0,0]=4 574 B8R0.7 CCCCCCC(C)Br MCULE-1528804584 [0,1,0,0,0,0|2,0,0]=3 575 B8R0.7 CCCCCCC(C)C MCULE-5799144994 [0,1,0,0,0,0|2,0,0]=3 576 B8R0.7 CCCCCCC(C)I MCULE-1825555561 [0,1,0,0,0,0|2,0,0]=3 577 B8R0.7 CCCCCCC(C)N MCULE-9884342317 [0,1,0,0,0,0|2,0,0]=3 578 B8R0.7 CCCCCCC(C)O MCULE-4635370769 [0,1,0,0,0,0|2,0,0]=3 579 B8R0.7 CCCCCCC(C)O MCULE-5095200181 [0,1,0,0,0,0|2,0,0]=3 580 B8R0.7 CCCCCCN(C)C MCULE-4445968611 [0,1,0,0,0,0|3,0,0]=4 581 B8R0.7 CCCCCC[C@@H](C)N MCULE-1174114183 [0,1,0,0,0,0|2,0,0]=3 582 B8R0.7 CCCCCC[C@@H](C)N MCULE-2566479481 [0,1,0,0,0,0|2,0,0]=3 583 B8R0.7 CCCCCC[C@@H](C)N MCULE-9213725375 [0,1,0,0,0,0|2,0,0]=3 584 B8R0.7 CCCCCC[C@@H](C)O MCULE-5245235461 [0,1,0,0,0,0|2,0,0]=3 585 B8R0.7 CCCCCC[C@@H](C)O MCULE-8537503782 [0,1,0,0,0,0|2,0,0]=3 586 B8R0.7 CCCCCC[C@H](C)N MCULE-1870649953 [0,1,0,0,0,0|2,0,0]=3 587 B8R0.7 CCCCCC[C@H](C)N MCULE-1893221172 [0,1,0,0,0,0|2,0,0]=3 588 B8R0.7 CCCCCC[C@H](C)N MCULE-7722036180 [0,1,0,0,0,0|2,0,0]=3 589 B8R0.7 CCCCCC[C@H](C)O MCULE-2655815413 [0,1,0,0,0,0|2,0,0]=3 590 B8R0.7 CCCCCC[C@H](C)O MCULE-7784149103 [0,1,0,0,0,0|2,0,0]=3 591 B8R0.7 CCCCCNC(C)C MCULE-7953510120 [0,1,0,0,0,0|3,0,0]=4 592 B8R0.7 CCCCNCC(C)C MCULE-9792329369 [0,1,0,0,0,0|2,0,0]=3 593 B8R0.7 CCCCNCC(C)O MCULE-3151408580 [0,1,0,0,0,0|2,0,0]=3 594 B8R0.7 CCCCOCC(C)O MCULE-6350800869 [0,1,0,0,0,0|1,1,0]=3 595 B8R0.7 CCCCSCC(=N)N MCULE-5468671942 [0,1,0,0,0,0|2,0,1]=4 596 B8R0.7 CCCCSCC(=O)O MCULE-3580384865 [0,1,0,0,0,0|2,0,1]=4 597 B8R0.7 CCCCSCC(C)C MCULE-3062170002 [0,1,0,0,0,0|1,0,0]=2 598 B8R0.7 CCCNCCN(C)C MCULE-1838736190 [0,1,0,0,0,0|3,0,0]=4 599 B8R0.7 CCCNCCN(C)C MCULE-5165444564 [0,1,0,0,0,0|3,0,0]=4 600 B8R0.7 CCCSCCC(=O)O MCULE-6454518290 [0,1,0,0,0,0|2,0,1]=4 601 B8R0.7 COCCNCC(C)C MCULE-3557260758 [0,1,0,0,0,0|3,0,0]=4 602 B8R0.7 COCCOCC(C)N MCULE-5569346034 [0,1,0,0,0,0|2,1,0]=4 603 B8R0.7 COCCOCC(C)N MCULE-8825273341 [0,1,0,0,0,0|2,1,0]=4 604 B8R0.7 [NH2+](CCCC)CC(C)C MCULE-7018223822 [0,1,0,0,0,0|2,0,0]=3 605 B8R1.2 BrCC1C=CCCC1 MCULE-3497010416 [0,0,0,1,0,0|3,0,0]=4 606 B8R1.2 BrCC1CCCCC1 MCULE-1732610761 [0,0,0,1,0,0|3,0,0]=4 607 B8R1.2 BrCC1CCCCN1 MCULE-2625695671 [0,0,0,1,0,0|3,0,0]=4 608 B8R1.2 BrCC1CCCCN1 MCULE-9807498006 [0,0,0,1,0,0|3,0,0]=4 609 B8R1.2 BrCC1CCCCO1 MCULE-7555024882 [0,0,0,1,0,0|2,1,0]=4 610 B8R1.2 BrCC1CCCNC1 MCULE-1688987947 [0,0,0,1,0,0|3,0,0]=4 611 B8R1.2 BrCC1CCCNC1 MCULE-4639020810 [0,0,0,1,0,0|3,0,0]=4 612 B8R1.2 BrCC1CCCNC1 MCULE-8872043199 [0,0,0,1,0,0|3,0,0]=4 613 B8R1.2 BrCC1CCCOC1 MCULE-8233955986 [0,0,0,1,0,0|2,1,0]=4 614 B8R1.2 BrC[C@H]1CCCOC1 MCULE-4617251201 [0,0,0,1,0,0|2,1,0]=4 615 B8R1.2 C1(CCCCN1)CO MCULE-7414417382 [0,0,0,1,0,0|3,0,0]=4 616 B8R1.2 C1(CCCCO1)CC MCULE-5189391029 [0,0,0,1,0,0|1,1,0]=3 617 B8R1.2 C1(CCCNC1)OC MCULE-1114013355 [0,0,0,1,0,0|3,0,0]=4 618 B8R1.2 C1(CCCNC1)OC MCULE-4203507585 [0,0,0,1,0,0|3,0,0]=4 619 B8R1.2 C1(CCCOC1)CN MCULE-9009856435 [0,0,0,1,0,0|2,1,0]=4 620 B8R1.2 C1(CNCCN1)CC MCULE-2886979448 [0,0,0,1,0,0|3,0,0]=4 621 B8R1.2 CCC1=NCCCC1 MCULE-5828184755 [0,0,0,1,0,0|2,0,1]=4 622 B8R1.2 CCC1CCCCC1 MCULE-9302115958 [0,0,0,1,0,0|2,0,0]=3 623 B8R1.2 CCC1CCCCN1 MCULE-1463828922 [0,0,0,1,0,0|2,0,0]=3 624 B8R1.2 CCC1CCCCN1 MCULE-4345537199 [0,0,0,1,0,0|2,0,0]=3 625 B8R1.2 CCC1CCCCN1 MCULE-4598810496 [0,0,0,1,0,0|2,0,0]=3 626 B8R1.2 CCC1CCCCN1 MCULE-6373382965 [0,0,0,1,0,0|2,0,0]=3 627 B8R1.2 CCC1CCCNC1 MCULE-1867940470 [0,0,0,1,0,0|2,0,0]=3 628 B8R1.2 CCC1CCCNC1 MCULE-4023638399 [0,0,0,1,0,0|2,0,0]=3 629 B8R1.2 CCC1CCNCC1 MCULE-3584183153 [0,0,0,1,0,0|3,0,0]=4 630 B8R1.2 CCC1CCNCC1 MCULE-6344088971 [0,0,0,1,0,0|3,0,0]=4 631 B8R1.2 CCC1CNCCN1 MCULE-1309315605 [0,0,0,1,0,0|3,0,0]=4 632 B8R1.2 CCC1CNCCN1 MCULE-3991328634 [0,0,0,1,0,0|3,0,0]=4 633 B8R1.2 CCC1CNCCN1 MCULE-5654677429 [0,0,0,1,0,0|3,0,0]=4 634 B8R1.2 CCC1CNCCN1 MCULE-7054869584 [0,0,0,1,0,0|3,0,0]=4 635 B8R1.2 CCC1CNCCO1 MCULE-1491754999 [0,0,0,1,0,0|2,1,0]=4 636 B8R1.2 CCC1CNCCO1 MCULE-2804411387 [0,0,0,1,0,0|2,1,0]=4 637 B8R1.2 CCC1CNCCS1 MCULE-4342438029 [0,0,0,1,0,0|2,0,0]=3 638 B8R1.2 CCC1COCCN1 MCULE-1485236181 [0,0,0,1,0,0|2,1,0]=4 639 B8R1.2 CCC1COCCN1 MCULE-4870702180 [0,0,0,1,0,0|2,1,0]=4 640 B8R1.2 CCC1COCCN1 MCULE-5742976431 [0,0,0,1,0,0|2,1,0]=4 641 B8R1.2 CCC1COCCN1 MCULE-5859529267 [0,0,0,1,0,0|2,1,0]=4 642 B8R1.2 CCC1COCCN1 MCULE-6635542159 [0,0,0,1,0,0|2,1,0]=4 643 B8R1.2 CCC1COCCN1 MCULE-7278745800 [0,0,0,1,0,0|2,1,0]=4 644 B8R1.2 CCN1CCCCC1 MCULE-4079252361 [0,0,0,1,0,0|3,0,0]=4 645 B8R1.2 CC[C@@H]1CCCCN1 MCULE-1012550179 [0,0,0,1,0,0|2,0,0]=3 646 B8R1.2 CC[C@@H]1CCCCN1 MCULE-6669069574 [0,0,0,1,0,0|2,0,0]=3 647 B8R1.2 CC[C@@H]1CCCCN1 MCULE-7355467130 [0,0,0,1,0,0|2,0,0]=3 648 B8R1.2 CC[C@@H]1CCCCN1 MCULE-7542229673 [0,0,0,1,0,0|2,0,0]=3 649 B8R1.2 CC[C@@H]1CNCCN1 MCULE-5846905567 [0,0,0,1,0,0|3,0,0]=4 650 B8R1.2 CC[C@@H]1CNCCN1 MCULE-7624605206 [0,0,0,1,0,0|3,0,0]=4 651 B8R1.2 CC[C@@H]1CNCCN1 MCULE-9661707516 [0,0,0,1,0,0|3,0,0]=4 652 B8R1.2 CC[C@@H]1CNCCN1 MCULE-9767062288 [0,0,0,1,0,0|3,0,0]=4 653 B8R1.2 CC[C@@H]1CNCCO1 MCULE-5576287129 [0,0,0,1,0,0|2,1,0]=4 654 B8R1.2 CC[C@@H]1CNCCO1 MCULE-7329824991 [0,0,0,1,0,0|2,1,0]=4 655 B8R1.2 CC[C@@H]1COCCN1 MCULE-1811299877 [0,0,0,1,0,0|2,1,0]=4 656 B8R1.2 CC[C@@H]1COCCN1 MCULE-3459096398 [0,0,0,1,0,0|2,1,0]=4 657 B8R1.2 CC[C@@H]1COCCN1 MCULE-7028956931 [0,0,0,1,0,0|2,1,0]=4 658 B8R1.2 CC[C@@H]1COCCN1 MCULE-9503018858 [0,0,0,1,0,0|2,1,0]=4 659 B8R1.2 CC[C@H]1CCCCN1 MCULE-2554275022 [0,0,0,1,0,0|2,0,0]=3 660 B8R1.2 CC[C@H]1CCCCN1 MCULE-3433938348 [0,0,0,1,0,0|2,0,0]=3 661 B8R1.2 CC[C@H]1CCCCN1 MCULE-5134937129 [0,0,0,1,0,0|2,0,0]=3 662 B8R1.2 CC[C@H]1CCCCN1 MCULE-9567977241 [0,0,0,1,0,0|2,0,0]=3 663 B8R1.2 CC[C@H]1CNCCN1 MCULE-1904360840 [0,0,0,1,0,0|3,0,0]=4 664 B8R1.2 CC[C@H]1CNCCN1 MCULE-3445783000 [0,0,0,1,0,0|3,0,0]=4 665 B8R1.2 CC[C@H]1CNCCN1 MCULE-3843396321 [0,0,0,1,0,0|3,0,0]=4 666 B8R1.2 CC[C@H]1CNCCN1 MCULE-8055405480 [0,0,0,1,0,0|3,0,0]=4 667 B8R1.2 CC[C@H]1CNCCO1 MCULE-1213088635 [0,0,0,1,0,0|2,1,0]=4 668 B8R1.2 CC[C@H]1CNCCO1 MCULE-1732774154 [0,0,0,1,0,0|2,1,0]=4 669 B8R1.2 CC[C@H]1CNCCO1 MCULE-2604595853 [0,0,0,1,0,0|2,1,0]=4 670 B8R1.2 CC[C@H]1CNCCO1 MCULE-6508226283 [0,0,0,1,0,0|2,1,0]=4 671 B8R1.2 CC[C@H]1COCCN1 MCULE-2034781343 [0,0,0,1,0,0|2,1,0]=4 672 B8R1.2 CC[C@H]1COCCN1 MCULE-3202863048 [0,0,0,1,0,0|2,1,0]=4 673 B8R1.2 CC[C@H]1COCCN1 MCULE-5482717232 [0,0,0,1,0,0|2,1,0]=4 674 B8R1.2 CC[C@H]1COCCN1 MCULE-6933747469 [0,0,0,1,0,0|2,1,0]=4 675 B8R1.2 CNC1CCCCC1 MCULE-8593678924 [0,0,0,1,0,0|3,0,0]=4 676 B8R1.2 CNC1CCCNC1 MCULE-4055178365 [0,0,0,1,0,0|3,0,0]=4 677 B8R1.2 CNC1CCCNC1 MCULE-6973115629 [0,0,0,1,0,0|3,0,0]=4 678 B8R1.2 CNC1CCCNC1 MCULE-8798931831 [0,0,0,1,0,0|3,0,0]=4 679 B8R1.2 CNC1CCCOC1 MCULE-5347484719 [0,0,0,1,0,0|2,1,0]=4 680 B8R1.2 CNC1CCCOC1 MCULE-9684329786 [0,0,0,1,0,0|2,1,0]=4 681 B8R1.2 CNC1CCCSC1 MCULE-1133400404 [0,0,0,1,0,0|2,0,0]=3 682 B8R1.2 CNC1CCCSC1 MCULE-7973096065 [0,0,0,1,0,0|2,0,0]=3 683 B8R1.2 CN[C@@H]1CCCOC1 MCULE-4540841602 [0,0,0,1,0,0|2,1,0]=4 684 B8R1.2 CN[C@@H]1CCCOC1 MCULE-6421899072 [0,0,0,1,0,0|2,1,0]=4 685 B8R1.2 CN[C@H]1CCCNC1 MCULE-5028194287 [0,0,0,1,0,0|3,0,0]=4 686 B8R1.2 CN[C@H]1CCCNC1 MCULE-5432117284 [0,0,0,1,0,0|3,0,0]=4 687 B8R1.2 CN[C@H]1CCCNC1 MCULE-8038385178 [0,0,0,1,0,0|3,0,0]=4 688 B8R1.2 CN[C@H]1CCCOC1 MCULE-2085945812 [0,0,0,1,0,0|2,1,0]=4 689 B8R1.2 CN[C@H]1CCCOC1 MCULE-3537766000 [0,0,0,1,0,0|2,1,0]=4 690 B8R1.2 COC1C=CCCC1 MCULE-4692829014 [0,0,0,1,0,0|3,0,0]=4 691 B8R1.2 COC1CCCCC1 MCULE-2340244681 [0,0,0,1,0,0|3,0,0]=4 692 B8R1.2 COC1CCCCO1 MCULE-5586923898 [0,0,0,1,0,0|2,1,0]=4 693 B8R1.2 COC1CCCNC1 MCULE-2428257033 [0,0,0,1,0,0|3,0,0]=4 694 B8R1.2 COC1CCCNC1 MCULE-8656248481 [0,0,0,1,0,0|3,0,0]=4 695 B8R1.2 CO[C@@H]1CCCNC1 MCULE-1593626348 [0,0,0,1,0,0|3,0,0]=4 696 B8R1.2 CO[C@@H]1CCCNC1 MCULE-4085125909 [0,0,0,1,0,0|3,0,0]=4 697 B8R1.2 CO[C@@H]1CCCNC1 MCULE-6313387662 [0,0,0,1,0,0|3,0,0]=4 698 B8R1.2 CO[C@@H]1CCCNC1 MCULE-8494307603 [0,0,0,1,0,0|3,0,0]=4 699 B8R1.2 CO[C@H]1CCCNC1 MCULE-1042411558 [0,0,0,1,0,0|3,0,0]=4 700 B8R1.2 CO[C@H]1CCCNC1 MCULE-3363706345 [0,0,0,1,0,0|3,0,0]=4 701 B8R1.2 CO[C@H]1CCCNC1 MCULE-3745051847 [0,0,0,1,0,0|3,0,0]=4 702 B8R1.2 CO[C@H]1CCCNC1 MCULE-6475889306 [0,0,0,1,0,0|3,0,0]=4 703 B8R1.2 CSC1CCCCC1 MCULE-5570458252 [0,0,0,1,0,0|3,0,0]=4 704 B8R1.2 CSC1CCCNC1 MCULE-3462764875 [0,0,0,1,0,0|3,0,0]=4 705 B8R1.2 CSC1CCCNC1 MCULE-6182151720 [0,0,0,1,0,0|3,0,0]=4 706 B8R1.2 ClCC1CCCCC1 MCULE-2364408988 [0,0,0,1,0,0|3,0,0]=4 707 B8R1.2 ClCC1CCCCN1 MCULE-3215583581 [0,0,0,1,0,0|3,0,0]=4 708 B8R1.2 ClCC1CCCCN1 MCULE-8949714419 [0,0,0,1,0,0|3,0,0]=4 709 B8R1.2 ClCC1CCCCO1 MCULE-7493119643 [0,0,0,1,0,0|2,1,0]=4 710 B8R1.2 ClCC1CCCNC1 MCULE-5655173642 [0,0,0,1,0,0|3,0,0]=4 711 B8R1.2 ClCC1CCCNC1 MCULE-6782147187 [0,0,0,1,0,0|3,0,0]=4 712 B8R1.2 ClCC1CCCOC1 MCULE-8502008950 [0,0,0,1,0,0|2,1,0]=4 713 B8R1.2 FCC1CCCCN1 MCULE-4091234595 [0,0,0,1,0,0|3,0,0]=4 714 B8R1.2 FCC1CCCCN1 MCULE-7748360337 [0,0,0,1,0,0|3,0,0]=4 715 B8R1.2 FCC1CCCNC1 MCULE-4910890691 [0,0,0,1,0,0|3,0,0]=4 716 B8R1.2 FCC1CCCNC1 MCULE-9227191637 [0,0,0,1,0,0|3,0,0]=4 717 B8R1.2 FC[C@@H]1CCCCN1 MCULE-2249718416 [0,0,0,1,0,0|3,0,0]=4 718 B8R1.2 FC[C@@H]1CCCCN1 MCULE-2335185919 [0,0,0,1,0,0|3,0,0]=4 719 B8R1.2 FC[C@@H]1CCCCN1 MCULE-7515953101 [0,0,0,1,0,0|3,0,0]=4 720 B8R1.2 FC[C@@H]1CCCCN1 MCULE-8096430166 [0,0,0,1,0,0|3,0,0]=4 721 B8R1.2 ICC1CCCCC1 MCULE-7820192716 [0,0,0,1,0,0|3,0,0]=4 722 B8R1.2 ICC1CCCCN1 MCULE-5434926156 [0,0,0,1,0,0|3,0,0]=4 723 B8R1.2 ICC1CCCCN1 MCULE-5785133159 [0,0,0,1,0,0|3,0,0]=4 724 B8R1.2 ICC1CCCCO1 MCULE-4630701067 [0,0,0,1,0,0|2,1,0]=4 725 B8R1.2 ICC1CCCNC1 MCULE-6140804596 [0,0,0,1,0,0|3,0,0]=4 726 B8R1.2 ICC1CCCNC1 MCULE-7111371001 [0,0,0,1,0,0|3,0,0]=4 727 B8R1.2 ICC1CCCOC1 MCULE-7706519514 [0,0,0,1,0,0|2,1,0]=4 728 B8R1.2 N#CC1CCCCS1 MCULE-3643161044 [0,0,0,1,0,0|2,0,1]=4 729 B8R1.2 NCC1CCCCC1 MCULE-3156148976 [0,0,0,1,0,0|3,0,0]=4 730 B8R1.2 NCC1CCCCC1 MCULE-7375566253 [0,0,0,1,0,0|3,0,0]=4 731 B8R1.2 NCC1CCCCC1 MCULE-8029432210 [0,0,0,1,0,0|3,0,0]=4 732 B8R1.2 NCC1CCCCN1 MCULE-5628582900 [0,0,0,1,0,0|3,0,0]=4 733 B8R1.2 NCC1CCCCN1 MCULE-7762336274 [0,0,0,1,0,0|3,0,0]=4 734 B8R1.2 NCC1CCCCO1 MCULE-2644735894 [0,0,0,1,0,0|2,1,0]=4 735 B8R1.2 NCC1CCCCO1 MCULE-5042678896 [0,0,0,1,0,0|2,1,0]=4 736 B8R1.2 NCC1CCCCS1 MCULE-1705875111 [0,0,0,1,0,0|2,0,0]=3 737 B8R1.2 NCC1CCCNC1 MCULE-3758525803 [0,0,0,1,0,0|3,0,0]=4 738 B8R1.2 NCC1CCCNC1 MCULE-4215149964 [0,0,0,1,0,0|3,0,0]=4 739 B8R1.2 NCC1CCCOC1 MCULE-2859652493 [0,0,0,1,0,0|2,1,0]=4 740 B8R1.2 NCC1CCCOC1 MCULE-5411442728 [0,0,0,1,0,0|2,1,0]=4 741 B8R1.2 NCC1CCCOC1 MCULE-6616131288 [0,0,0,1,0,0|2,1,0]=4 742 B8R1.2 NCC1CCCOC1 MCULE-9893994601 [0,0,0,1,0,0|2,1,0]=4 743 B8R1.2 NCC1CCCSC1 MCULE-1894328803 [0,0,0,1,0,0|2,0,0]=3 744 B8R1.2 NCC1CSCCN1 MCULE-2206802895 [0,0,0,1,0,0|3,0,0]=4 745 B8R1.2 NCC1CSCCS1 MCULE-8020891732 [0,0,0,1,0,0|3,0,0]=4 746 B8R1.2 NC[C@@H]1CCCCN1 MCULE-2094976900 [0,0,0,1,0,0|3,0,0]=4 747 B8R1.2 NC[C@@H]1CCCCN1 MCULE-3736890217 [0,0,0,1,0,0|3,0,0]=4 748 B8R1.2 NC[C@@H]1CCCCO1 MCULE-1435985280 [0,0,0,1,0,0|2,1,0]=4 749 B8R1.2 NC[C@@H]1CCCCO1 MCULE-4778440271 [0,0,0,1,0,0|2,1,0]=4 750 B8R1.2 NC[C@@H]1CCCCO1 MCULE-6014338525 [0,0,0,1,0,0|2,1,0]=4 751 B8R1.2 NC[C@@H]1CCCCO1 MCULE-9488694680 [0,0,0,1,0,0|2,1,0]=4 752 B8R1.2 NC[C@@H]1CCCNC1 MCULE-4700132151 [0,0,0,1,0,0|3,0,0]=4 753 B8R1.2 NC[C@@H]1CCCNC1 MCULE-4826798446 [0,0,0,1,0,0|3,0,0]=4 754 B8R1.2 NC[C@@H]1CCCNC1 MCULE-5621058783 [0,0,0,1,0,0|3,0,0]=4 755 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5314997557 [0,0,0,1,0,0|2,1,0]=4 756 B8R1.2 NC[C@@H]1CCCOC1 MCULE-5553412637 [0,0,0,1,0,0|2,1,0]=4 757 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6349833867 [0,0,0,1,0,0|2,1,0]=4 758 B8R1.2 NC[C@@H]1CCCOC1 MCULE-6463109886 [0,0,0,1,0,0|2,1,0]=4 759 B8R1.2 NC[C@H]1CCCCN1 MCULE-2124027272 [0,0,0,1,0,0|3,0,0]=4 760 B8R1.2 NC[C@H]1CCCCN1 MCULE-5815797207 [0,0,0,1,0,0|3,0,0]=4 761 B8R1.2 NC[C@H]1CCCCO1 MCULE-2835389541 [0,0,0,1,0,0|2,1,0]=4 762 B8R1.2 NC[C@H]1CCCCO1 MCULE-4500797236 [0,0,0,1,0,0|2,1,0]=4 763 B8R1.2 NC[C@H]1CCCCO1 MCULE-5990717573 [0,0,0,1,0,0|2,1,0]=4 764 B8R1.2 NC[C@H]1CCCCO1 MCULE-7362278601 [0,0,0,1,0,0|2,1,0]=4 765 B8R1.2 NC[C@H]1CCCNC1 MCULE-1544884485 [0,0,0,1,0,0|3,0,0]=4 766 B8R1.2 NC[C@H]1CCCNC1 MCULE-1869159747 [0,0,0,1,0,0|3,0,0]=4 767 B8R1.2 NC[C@H]1CCCNC1 MCULE-5445972707 [0,0,0,1,0,0|3,0,0]=4 768 B8R1.2 NC[C@H]1CCCNC1 MCULE-5734934526 [0,0,0,1,0,0|3,0,0]=4 769 B8R1.2 NC[C@H]1CCCNC1 MCULE-9259563350 [0,0,0,1,0,0|3,0,0]=4 770 B8R1.2 NC[C@H]1CCCOC1 MCULE-1996808023 [0,0,0,1,0,0|2,1,0]=4 771 B8R1.2 NC[C@H]1CCCOC1 MCULE-8044635428 [0,0,0,1,0,0|2,1,0]=4 772 B8R1.2 NC[C@H]1CCCOC1 MCULE-8246511133 [0,0,0,1,0,0|2,1,0]=4 773 B8R1.2 NC[C@H]1CCCOC1 MCULE-8378816563 [0,0,0,1,0,0|2,1,0]=4 774 B8R1.2 NNC1CCCSC1 MCULE-2745263925 [0,0,0,1,0,0|3,0,0]=4 775 B8R1.2 NNC1CCCSC1 MCULE-3788828042 [0,0,0,1,0,0|3,0,0]=4 776 B8R1.2 O=CC1CCCSC1 MCULE-8369808876 [0,0,0,1,0,0|2,0,1]=4 777 B8R1.2 OCC1C=CCCC1 MCULE-3264381346 [0,0,0,1,0,0|3,0,0]=4 778 B8R1.2 OCC1CCCCC1 MCULE-6571547092 [0,0,0,1,0,0|3,0,0]=4 779 B8R1.2 OCC1CCCCN1 MCULE-1839660028 [0,0,0,1,0,0|3,0,0]=4 780 B8R1.2 OCC1CCCCN1 MCULE-5190999833 [0,0,0,1,0,0|3,0,0]=4 781 B8R1.2 OCC1CCCCO1 MCULE-2390789074 [0,0,0,1,0,0|2,1,0]=4 782 B8R1.2 OCC1CCCCO1 MCULE-7483291767 [0,0,0,1,0,0|2,1,0]=4 783 B8R1.2 OCC1CCCCS1 MCULE-8533707311 [0,0,0,1,0,0|2,0,0]=3 784 B8R1.2 OCC1CCCNC1 MCULE-1126180349 [0,0,0,1,0,0|3,0,0]=4 785 B8R1.2 OCC1CCCNC1 MCULE-1796388857 [0,0,0,1,0,0|3,0,0]=4 786 B8R1.2 OCC1CCCNC1 MCULE-3885962581 [0,0,0,1,0,0|3,0,0]=4 787 B8R1.2 OCC1CCCNC1 MCULE-9246039906 [0,0,0,1,0,0|3,0,0]=4 788 B8R1.2 OCC1CCCOC1 MCULE-6464024960 [0,0,0,1,0,0|2,1,0]=4 789 B8R1.2 OCC1CCCOC1 MCULE-9624599290 [0,0,0,1,0,0|2,1,0]=4 790 B8R1.2 OCC1CCCSC1 MCULE-1730158244 [0,0,0,1,0,0|2,0,0]=3 791 B8R1.2 OCC1CSCCN1 MCULE-9615907863 [0,0,0,1,0,0|3,0,0]=4 792 B8R1.2 OC[C@@H]1CCCCN1 MCULE-6170192975 [0,0,0,1,0,0|3,0,0]=4 793 B8R1.2 OC[C@@H]1CCCCN1 MCULE-7805438267 [0,0,0,1,0,0|3,0,0]=4 794 B8R1.2 OC[C@@H]1CCCCN1 MCULE-8160671578 [0,0,0,1,0,0|3,0,0]=4 795 B8R1.2 OC[C@@H]1CCCCO1 MCULE-5978396739 [0,0,0,1,0,0|2,1,0]=4 796 B8R1.2 OC[C@@H]1CCCCO1 MCULE-8715909099 [0,0,0,1,0,0|2,1,0]=4 797 B8R1.2 OC[C@@H]1CCCNC1 MCULE-1362591489 [0,0,0,1,0,0|3,0,0]=4 798 B8R1.2 OC[C@@H]1CCCNC1 MCULE-2943211570 [0,0,0,1,0,0|3,0,0]=4 799 B8R1.2 OC[C@@H]1CCCNC1 MCULE-8452110091 [0,0,0,1,0,0|3,0,0]=4 800 B8R1.2 OC[C@@H]1CCCNC1 MCULE-9511978382 [0,0,0,1,0,0|3,0,0]=4 801 B8R1.2 OC[C@@H]1CCCOC1 MCULE-5580637299 [0,0,0,1,0,0|2,1,0]=4 802 B8R1.2 OC[C@@H]1CCCOC1 MCULE-9673827278 [0,0,0,1,0,0|2,1,0]=4 803 B8R1.2 OC[C@H]1CCCCN1 MCULE-1585224164 [0,0,0,1,0,0|3,0,0]=4 804 B8R1.2 OC[C@H]1CCCCN1 MCULE-2860177964 [0,0,0,1,0,0|3,0,0]=4 805 B8R1.2 OC[C@H]1CCCCO1 MCULE-4700719427 [0,0,0,1,0,0|2,1,0]=4 806 B8R1.2 OC[C@H]1CCCCO1 MCULE-7990169259 [0,0,0,1,0,0|2,1,0]=4 807 B8R1.2 OC[C@H]1CCCNC1 MCULE-3504380705 [0,0,0,1,0,0|3,0,0]=4 808 B8R1.2 OC[C@H]1CCCNC1 MCULE-6518143765 [0,0,0,1,0,0|3,0,0]=4 809 B8R1.2 OC[C@H]1CCCNC1 MCULE-6752674060 [0,0,0,1,0,0|3,0,0]=4 810 B8R1.2 OC[C@H]1CCCNC1 MCULE-9392193352 [0,0,0,1,0,0|3,0,0]=4 811 B8R1.2 OC[C@H]1CCCOC1 MCULE-8066618329 [0,0,0,1,0,0|2,1,0]=4 812 B8R1.2 OC[C@H]1CCCOC1 MCULE-8831105119 [0,0,0,1,0,0|2,1,0]=4 813 B8R1.2 SCC1CCCCC1 MCULE-4073711524 [0,0,0,1,0,0|3,0,0]=4 814 B8R1.2 SCC1CCCOC1 MCULE-1197721149 [0,0,0,1,0,0|2,1,0]=4 815 B8R1.5 C1(CNCCN1C)C MCULE-7298788210 [0,0,0,1,0,0|3,0,0]=4 816 B8R1.5 C1(CNCCN1C)C MCULE-9473957667 [0,0,0,1,0,0|3,0,0]=4 817 B8R1.5 CC1CC=CCC1C MCULE-9305523958 [0,0,0,1,0,0|2,0,0]=3 818 B8R1.5 CC1CCCCC1C MCULE-9841432259 [0,0,0,1,0,0|2,0,0]=3 819 B8R1.5 CC1CCCCC1N MCULE-3041016580 [0,0,0,1,0,0|3,0,0]=4 820 B8R1.5 CC1CCCCC1N MCULE-4294403075 [0,0,0,1,0,0|3,0,0]=4 821 B8R1.5 CC1CCCCC1O MCULE-2704647488 [0,0,0,1,0,0|3,0,0]=4 822 B8R1.5 CC1CCCCN1C MCULE-8197728941 [0,0,0,1,0,0|3,0,0]=4 823 B8R1.5 CC1CCCNC1C MCULE-4611965577 [0,0,0,1,0,0|3,0,0]=4 824 B8R1.5 CC1CCCNC1C MCULE-5766379292 [0,0,0,1,0,0|3,0,0]=4 825 B8R1.5 CC1CCCNC1C MCULE-6191112458 [0,0,0,1,0,0|3,0,0]=4 826 B8R1.5 CC1CCNCC1C MCULE-5683848513 [0,0,0,1,0,0|2,0,0]=3 827 B8R1.5 CC1CCNCC1F MCULE-2423279658 [0,0,0,1,0,0|3,0,0]=4 828 B8R1.5 CC1CCNCC1F MCULE-3345403654 [0,0,0,1,0,0|3,0,0]=4 829 B8R1.5 CC1CCNCC1O MCULE-5450375148 [0,0,0,1,0,0|3,0,0]=4 830 B8R1.5 CC1CCNCC1O MCULE-5649027214 [0,0,0,1,0,0|3,0,0]=4 831 B8R1.5 CC1CNCCC1N MCULE-4288510851 [0,0,0,1,0,0|3,0,0]=4 832 B8R1.5 CC1CNCCC1N MCULE-7264043917 [0,0,0,1,0,0|3,0,0]=4 833 B8R1.5 CC1CNCCC1O MCULE-1960718296 [0,0,0,1,0,0|3,0,0]=4 834 B8R1.5 CC1CNCCC1O MCULE-8434519185 [0,0,0,1,0,0|3,0,0]=4 835 B8R1.5 CC1CNCCN1C MCULE-6819150286 [0,0,0,1,0,0|3,0,0]=4 836 B8R1.5 CC1CNCCN1C MCULE-7498903385 [0,0,0,1,0,0|3,0,0]=4 837 B8R1.5 CC1COCCC1N MCULE-6236890728 [0,0,0,1,0,0|2,1,0]=4 838 B8R1.5 CC1COCCC1N MCULE-7497946239 [0,0,0,1,0,0|2,1,0]=4 839 B8R1.5 CC1COCCC1O MCULE-9430778912 [0,0,0,1,0,0|2,1,0]=4 840 B8R1.5 CC1CSCCC1=O MCULE-4565033608 [0,0,0,1,0,0|2,0,1]=4 841 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-2207912311 [0,0,0,1,0,0|3,0,0]=4 842 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-3227199256 [0,0,0,1,0,0|3,0,0]=4 843 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-4948677049 [0,0,0,1,0,0|3,0,0]=4 844 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-6377741621 [0,0,0,1,0,0|3,0,0]=4 845 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-8426223529 [0,0,0,1,0,0|3,0,0]=4 846 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-9542068395 [0,0,0,1,0,0|3,0,0]=4 847 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-3547716632 [0,0,0,1,0,0|3,0,0]=4 848 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-9259793572 [0,0,0,1,0,0|3,0,0]=4 849 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-2021817746 [0,0,0,1,0,0|3,0,0]=4 850 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-3944837592 [0,0,0,1,0,0|3,0,0]=4 851 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-1550031816 [0,0,0,1,0,0|3,0,0]=4 852 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-6650080658 [0,0,0,1,0,0|3,0,0]=4 853 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-6715745499 [0,0,0,1,0,0|3,0,0]=4 854 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-7283977917 [0,0,0,1,0,0|3,0,0]=4 855 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-6946702609 [0,0,0,1,0,0|3,0,0]=4 856 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-7899767253 [0,0,0,1,0,0|3,0,0]=4 857 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-9159305922 [0,0,0,1,0,0|3,0,0]=4 858 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-9391376462 [0,0,0,1,0,0|3,0,0]=4 859 B8R1.5 C[C@@H]1CCNC[C@H]1F MCULE-1681100584 [0,0,0,1,0,0|3,0,0]=4 860 B8R1.5 C[C@@H]1CCNC[C@H]1F MCULE-2733502904 [0,0,0,1,0,0|3,0,0]=4 861 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-4706073937 [0,0,0,1,0,0|3,0,0]=4 862 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-5188621987 [0,0,0,1,0,0|3,0,0]=4 863 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-6031430878 [0,0,0,1,0,0|3,0,0]=4 864 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-8311134495 [0,0,0,1,0,0|3,0,0]=4 865 B8R1.5 C[C@@H]1CNCCN1C MCULE-4245576564 [0,0,0,1,0,0|3,0,0]=4 866 B8R1.5 C[C@@H]1CNCCN1C MCULE-5117246567 [0,0,0,1,0,0|3,0,0]=4 867 B8R1.5 C[C@@H]1CNCCN1C MCULE-6852418533 [0,0,0,1,0,0|3,0,0]=4 868 B8R1.5 C[C@@H]1CNCCN1C MCULE-8377240136 [0,0,0,1,0,0|3,0,0]=4 869 B8R1.5 C[C@@H]1CNCC[C@@H]1N MCULE-1733727000 [0,0,0,1,0,0|3,0,0]=4 870 B8R1.5 C[C@@H]1CNCC[C@@H]1N MCULE-5971884774 [0,0,0,1,0,0|3,0,0]=4 871 B8R1.5 C[C@@H]1CNCC[C@H]1N MCULE-4381780061 [0,0,0,1,0,0|3,0,0]=4 872 B8R1.5 C[C@@H]1CNCC[C@H]1N MCULE-7332887720 [0,0,0,1,0,0|3,0,0]=4 873 B8R1.5 C[C@@H]1CNCC[C@H]1O MCULE-1211656855 [0,0,0,1,0,0|3,0,0]=4 874 B8R1.5 C[C@@H]1CNCC[C@H]1O MCULE-8887033073 [0,0,0,1,0,0|3,0,0]=4 875 B8R1.5 C[C@@H]1COCC[C@@H]1N MCULE-1854737385 [0,0,0,1,0,0|2,1,0]=4 876 B8R1.5 C[C@@H]1COCC[C@@H]1N MCULE-5272955365 [0,0,0,1,0,0|2,1,0]=4 877 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-1385721208 [0,0,0,1,0,0|2,1,0]=4 878 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-1584947952 [0,0,0,1,0,0|2,1,0]=4 879 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-3448920251 [0,0,0,1,0,0|2,1,0]=4 880 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-7256484712 [0,0,0,1,0,0|2,1,0]=4 881 B8R1.5 C[C@H]1CCCC[C@@H]1C MCULE-3536263334 [0,0,0,1,0,0|2,0,0]=3 882 B8R1.5 C[C@H]1CCCC[C@@H]1C MCULE-5867798019 [0,0,0,1,0,0|2,0,0]=3 883 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-3841584035 [0,0,0,1,0,0|3,0,0]=4 884 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-4158219749 [0,0,0,1,0,0|3,0,0]=4 885 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-8973971252 [0,0,0,1,0,0|3,0,0]=4 886 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-9885453921 [0,0,0,1,0,0|3,0,0]=4 887 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-4879328575 [0,0,0,1,0,0|3,0,0]=4 888 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-7331434797 [0,0,0,1,0,0|3,0,0]=4 889 B8R1.5 C[C@H]1CCCC[C@H]1C MCULE-9131794520 [0,0,0,1,0,0|2,0,0]=3 890 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-1533998857 [0,0,0,1,0,0|3,0,0]=4 891 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5254242664 [0,0,0,1,0,0|3,0,0]=4 892 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5432486645 [0,0,0,1,0,0|3,0,0]=4 893 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-7149509445 [0,0,0,1,0,0|3,0,0]=4 894 B8R1.5 C[C@H]1CCNC[C@@H]1F MCULE-4761102749 [0,0,0,1,0,0|3,0,0]=4 895 B8R1.5 C[C@H]1CCNC[C@@H]1F MCULE-8933374788 [0,0,0,1,0,0|3,0,0]=4 896 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-2413866964 [0,0,0,1,0,0|3,0,0]=4 897 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-3541397142 [0,0,0,1,0,0|3,0,0]=4 898 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-4524645861 [0,0,0,1,0,0|3,0,0]=4 899 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-4989324272 [0,0,0,1,0,0|3,0,0]=4 900 B8R1.5 C[C@H]1CCNC[C@H]1F MCULE-4253107784 [0,0,0,1,0,0|3,0,0]=4 901 B8R1.5 C[C@H]1CCNC[C@H]1F MCULE-5700696523 [0,0,0,1,0,0|3,0,0]=4 902 B8R1.5 C[C@H]1CCNC[C@H]1O MCULE-6149485279 [0,0,0,1,0,0|3,0,0]=4 903 B8R1.5 C[C@H]1CCNC[C@H]1O MCULE-9609136161 [0,0,0,1,0,0|3,0,0]=4 904 B8R1.5 C[C@H]1CNCCN1C MCULE-2247489661 [0,0,0,1,0,0|3,0,0]=4 905 B8R1.5 C[C@H]1CNCCN1C MCULE-2710257203 [0,0,0,1,0,0|3,0,0]=4 906 B8R1.5 C[C@H]1CNCCN1C MCULE-4486771855 [0,0,0,1,0,0|3,0,0]=4 907 B8R1.5 C[C@H]1CNCCN1C MCULE-8285859555 [0,0,0,1,0,0|3,0,0]=4 908 B8R1.5 C[C@H]1CNCC[C@@H]1N MCULE-1222815331 [0,0,0,1,0,0|3,0,0]=4 909 B8R1.5 C[C@H]1CNCC[C@@H]1N MCULE-1657518091 [0,0,0,1,0,0|3,0,0]=4 910 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-1418189839 [0,0,0,1,0,0|3,0,0]=4 911 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-2162007646 [0,0,0,1,0,0|3,0,0]=4 912 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-4884869364 [0,0,0,1,0,0|3,0,0]=4 913 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-9707177849 [0,0,0,1,0,0|3,0,0]=4 914 B8R1.5 C[C@H]1CNCC[C@H]1N MCULE-2604448103 [0,0,0,1,0,0|3,0,0]=4 915 B8R1.5 C[C@H]1CNCC[C@H]1N MCULE-4549710847 [0,0,0,1,0,0|3,0,0]=4 916 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-1909814972 [0,0,0,1,0,0|3,0,0]=4 917 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-8202226496 [0,0,0,1,0,0|3,0,0]=4 918 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-9674887824 [0,0,0,1,0,0|3,0,0]=4 919 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-9888495251 [0,0,0,1,0,0|3,0,0]=4 920 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-3420685614 [0,0,0,1,0,0|2,1,0]=4 921 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-4495690357 [0,0,0,1,0,0|2,1,0]=4 922 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-9724547988 [0,0,0,1,0,0|2,1,0]=4 923 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-9889716251 [0,0,0,1,0,0|2,1,0]=4 924 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-3075216082 [0,0,0,1,0,0|2,1,0]=4 925 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-4276602047 [0,0,0,1,0,0|2,1,0]=4 926 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-6090606114 [0,0,0,1,0,0|2,1,0]=4 927 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-6610603811 [0,0,0,1,0,0|2,1,0]=4 928 B8R1.5 OC1CSSCC1O MCULE-3716589710 [0,0,0,1,0,0|2,0,0]=3 929 B8R1.5 O[C@@H]1CSSC[C@H]1O MCULE-2981026113 [0,0,0,1,0,0|2,0,0]=3 930 B8R1.5 O[C@H]1CSSC[C@@H]1O MCULE-2785197932 [0,0,0,1,0,0|2,0,0]=3 931 B8R1.5 O[C@H]1CSSC[C@@H]1O MCULE-5975753187 [0,0,0,1,0,0|2,0,0]=3 932 B8R1.5 [C@@H]1(CCNC[C@H]1O)C MCULE-2307148539 [0,0,0,1,0,0|3,0,0]=4 933 B8R1.5 [C@@H]1(CCNC[C@H]1O)C MCULE-7550947729 [0,0,0,1,0,0|3,0,0]=4 934 B8R1.5 [C@H]1(CNCC[C@H]1C)F MCULE-5914413594 [0,0,0,1,0,0|3,0,0]=4 935 B8R1.5 [C@H]1(CNCC[C@H]1C)F MCULE-6184399583 [0,0,0,1,0,0|3,0,0]=4 936 B8R1.5 [C@H]1(CNCC[C@H]1C)O MCULE-8053222550 [0,0,0,1,0,0|3,0,0]=4 937 B8R1.5 [C@H]1(CNCC[C@H]1C)O MCULE-9640568177 [0,0,0,1,0,0|3,0,0]=4 938 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-1419969909 [0,0,0,1,0,0|3,0,0]=4 939 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-1584116117 [0,0,0,1,0,0|3,0,0]=4 940 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-2275992252 [0,0,0,1,0,0|3,0,0]=4 941 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-4151833845 [0,0,0,1,0,0|3,0,0]=4 942 B8R1.5 [C@H]1(COCC[C@H]1N)C MCULE-2786096186 [0,0,0,1,0,0|2,1,0]=4 943 B8R1.5 [C@H]1(COCC[C@H]1N)C MCULE-3516272365 [0,0,0,1,0,0|2,1,0]=4 944 B8R1.8 BrCCC1CCCC1 MCULE-2388060322 [0,0,0,1,0,0|3,0,0]=4 945 B8R1.8 BrCCC1CCCN1 MCULE-2232238063 [0,0,0,1,0,0|3,0,0]=4 946 B8R1.8 BrCCC1CCCN1 MCULE-4566190828 [0,0,0,1,0,0|3,0,0]=4 947 B8R1.8 BrCCC1CCCO1 MCULE-6674503285 [0,0,0,1,0,0|2,1,0]=4 948 B8R1.8 BrCCC1SCCS1 MCULE-4354448086 [0,0,0,1,0,0|3,0,0]=4 949 B8R1.8 BrCCN1CCCC1 MCULE-2990538836 [0,0,0,1,0,0|3,0,0]=4 950 B8R1.8 BrCCN1CCCC1 MCULE-5221056964 [0,0,0,1,0,0|3,0,0]=4 951 B8R1.8 BrCCN1CCCC1 MCULE-6489204087 [0,0,0,1,0,0|3,0,0]=4 952 B8R1.8 C1(CCCN1)COC MCULE-7740200307 [0,0,0,1,0,0|3,0,0]=4 953 B8R1.8 CC/N=C\1/NCCS1 MCULE-5372424971 [0,0,0,1,0,0|3,0,0]=4 954 B8R1.8 CCCC1=NCCN1 MCULE-9254537375 [0,0,0,1,0,0|3,0,0]=4 955 B8R1.8 CCCC1=NCCO1 MCULE-4941877816 [0,0,0,1,0,0|2,1,0]=4 956 B8R1.8 CCCC1=NCCS1 MCULE-8191971237 [0,0,0,1,0,0|2,0,0]=3 957 B8R1.8 CCCC1C=CCC1 MCULE-9112058760 [0,0,0,1,0,0|2,0,1]=4 958 B8R1.8 CCCC1CCCN1 MCULE-5407564403 [0,0,0,1,0,0|2,0,0]=3 959 B8R1.8 CCCC1CCCN1 MCULE-7322918348 [0,0,0,1,0,0|2,0,0]=3 960 B8R1.8 CCCC1CCNC1 MCULE-1009147377 [0,0,0,1,0,0|3,0,0]=4 961 B8R1.8 CCCC1CCNC1 MCULE-4463468269 [0,0,0,1,0,0|3,0,0]=4 962 B8R1.8 CCCC1NCCS1 MCULE-7735624510 [0,0,0,1,0,0|2,0,0]=3 963 B8R1.8 CCCC1NCCS1 MCULE-9746675529 [0,0,0,1,0,0|2,0,0]=3 964 B8R1.8 CCCC1OCCO1 MCULE-1064235053 [0,0,0,1,0,0|2,1,0]=4 965 B8R1.8 CCCC1OCCS1 MCULE-4434497484 [0,0,0,1,0,0|2,0,0]=3 966 B8R1.8 CCNC1CCCC1 MCULE-2445860551 [0,0,0,1,0,0|3,0,0]=4 967 B8R1.8 CCNC1CCCC1 MCULE-7166348416 [0,0,0,1,0,0|3,0,0]=4 968 B8R1.8 CCOC1=NCCC1 MCULE-7392104128 [0,0,0,1,0,0|3,0,0]=4 969 B8R1.8 CCOC1CCCO1 MCULE-8408094445 [0,0,0,1,0,0|2,1,0]=4 970 B8R1.8 CNCC1CCCC1 MCULE-4663524039 [0,0,0,1,0,0|3,0,0]=4 971 B8R1.8 CNCC1CCCC1 MCULE-9254222767 [0,0,0,1,0,0|3,0,0]=4 972 B8R1.8 CNCC1CCCN1 MCULE-4712712967 [0,0,0,1,0,0|3,0,0]=4 973 B8R1.8 CNCC1CCCN1 MCULE-5324951635 [0,0,0,1,0,0|3,0,0]=4 974 B8R1.8 CNCC1CCCO1 MCULE-9343447516 [0,0,0,1,0,0|2,1,0]=4 975 B8R1.8 CNC[C@@H]1CCCN1 MCULE-5179827632 [0,0,0,1,0,0|3,0,0]=4 976 B8R1.8 CNC[C@@H]1CCCN1 MCULE-5716678959 [0,0,0,1,0,0|3,0,0]=4 977 B8R1.8 CNC[C@@H]1CCCN1 MCULE-5978107840 [0,0,0,1,0,0|3,0,0]=4 978 B8R1.8 CNC[C@H]1CCCN1 MCULE-1238692148 [0,0,0,1,0,0|3,0,0]=4 979 B8R1.8 CNC[C@H]1CCCN1 MCULE-8720393230 [0,0,0,1,0,0|3,0,0]=4 980 B8R1.8 CNC[C@H]1CCCO1 MCULE-4511797485 [0,0,0,1,0,0|2,1,0]=4 981 B8R1.8 COCC1=NCCS1 MCULE-6899503116 [0,0,0,1,0,0|3,0,0]=4 982 B8R1.8 COCC1CCCN1 MCULE-3490399589 [0,0,0,1,0,0|3,0,0]=4 983 B8R1.8 COCC1CCCN1 MCULE-7671263939 [0,0,0,1,0,0|3,0,0]=4 984 B8R1.8 COC[C@@H]1CCCN1 MCULE-2033169765 [0,0,0,1,0,0|3,0,0]=4 985 B8R1.8 COC[C@@H]1CCCN1 MCULE-2588521588 [0,0,0,1,0,0|3,0,0]=4 986 B8R1.8 COC[C@@H]1CCCN1 MCULE-9107605896 [0,0,0,1,0,0|3,0,0]=4 987 B8R1.8 COC[C@@H]1CCCN1 MCULE-9163912821 [0,0,0,1,0,0|3,0,0]=4 988 B8R1.8 COC[C@H]1CCCN1 MCULE-4066409185 [0,0,0,1,0,0|3,0,0]=4 989 B8R1.8 COC[C@H]1CCCN1 MCULE-4591980137 [0,0,0,1,0,0|3,0,0]=4 990 B8R1.8 COC[C@H]1CCCN1 MCULE-4935200138 [0,0,0,1,0,0|3,0,0]=4 991 B8R1.8 COC[C@H]1CCCN1 MCULE-7300265857 [0,0,0,1,0,0|3,0,0]=4 992 B8R1.8 CSCC1CCCN1 MCULE-9005961775 [0,0,0,1,0,0|3,0,0]=4 993 B8R1.8 ClCCC1CCCC1 MCULE-1599799155 [0,0,0,1,0,0|3,0,0]=4 994 B8R1.8 ClCCC1CCCO1 MCULE-5564811515 [0,0,0,1,0,0|2,1,0]=4 995 B8R1.8 ClCCN1CCCC1 MCULE-4566854185 [0,0,0,1,0,0|3,0,0]=4 996 B8R1.8 ClCCN1CCCC1 MCULE-4726707884 [0,0,0,1,0,0|3,0,0]=4 997 B8R1.8 ICCC1CCCC1 MCULE-8881590696 [0,0,0,1,0,0|3,0,0]=4 998 B8R1.8 ICCN1CCCC1 MCULE-8312907762 [0,0,0,1,0,0|3,0,0]=4 999 B8R1.8 ICCN1CCCC1 MCULE-9169612289 [0,0,0,1,0,0|3,0,0]=4 1000 B8R1.8 NCCC1CCCC1 MCULE-1321612615 [0,0,0,1,0,0|3,0,0]=4 1001 B8R1.8 NCCC1CCCC1 MCULE-2815985200 [0,0,0,1,0,0|3,0,0]=4 1002 B8R1.8 NCCC1CCCC1 MCULE-4452900288 [0,0,0,1,0,0|3,0,0]=4 1003 B8R1.8 NCCC1CCCN1 MCULE-3948200302 [0,0,0,1,0,0|3,0,0]=4 1004 B8R1.8 NCCC1CCCN1 MCULE-8874469745 [0,0,0,1,0,0|3,0,0]=4 1005 B8R1.8 NCCC1CCCO1 MCULE-3914619069 [0,0,0,1,0,0|2,1,0]=4 1006 B8R1.8 NCCC1CCCS1 MCULE-7458730281 [0,0,0,1,0,0|2,0,0]=3 1007 B8R1.8 NCCC1CCCS1 MCULE-8525017759 [0,0,0,1,0,0|2,0,0]=3 1008 B8R1.8 NCCC1SCCS1 MCULE-3353609705 [0,0,0,1,0,0|3,0,0]=4 1009 B8R1.8 NCCN1CCCC1 MCULE-3440987582 [0,0,0,1,0,0|3,0,0]=4 1010 B8R1.8 NCCN1CCCC1 MCULE-7056026855 [0,0,0,1,0,0|3,0,0]=4 1011 B8R1.8 NCC[C@H]1CCCO1 MCULE-2485674670 [0,0,0,1,0,0|2,1,0]=4 1012 B8R1.8 NCC[C@H]1CCCO1 MCULE-3778854223 [0,0,0,1,0,0|2,1,0]=4 1013 B8R1.8 OCCC1CCCC1 MCULE-3680571056 [0,0,0,1,0,0|3,0,0]=4 1014 B8R1.8 OCCC1CCCN1 MCULE-3516684599 [0,0,0,1,0,0|3,0,0]=4 1015 B8R1.8 OCCC1CCCN1 MCULE-7335032539 [0,0,0,1,0,0|3,0,0]=4 1016 B8R1.8 OCCC1CCCO1 MCULE-4437776676 [0,0,0,1,0,0|2,1,0]=4 1017 B8R1.8 OCCN1CCCC1 MCULE-5922471274 [0,0,0,1,0,0|3,0,0]=4 1018 B8R1.8 OCCN1CCCC1 MCULE-7598437595 [0,0,0,1,0,0|3,0,0]=4 1019 B8R1.8 OCC[C@@H]1CCCN1 MCULE-5399846336 [0,0,0,1,0,0|3,0,0]=4 1020 B8R1.8 OCC[C@H]1CCCN1 MCULE-9442938016 [0,0,0,1,0,0|3,0,0]=4 1021 B8R1.8 SCCN1CCCC1 MCULE-6946048852 [0,0,0,1,0,0|3,0,0]=4 1022 B8R1.10 BrCCCC1CCC1 MCULE-7589486180 [0,0,0,1,0,0|3,0,0]=4 1023 B8R1.10 BrCCOC1CCC1 MCULE-8940967037 [0,0,0,1,0,0|2,1,0]=4 1024 B8R1.10 CCCCC1CNC1 MCULE-2618835987 [0,0,0,1,0,0|3,0,0]=4 1025 B8R1.10 CCCCC1CNC1 MCULE-9205198054 [0,0,0,1,0,0|3,0,0]=4 1026 B8R1.10 CCCOC1CNC1 MCULE-3244679891 [0,0,0,1,0,0|2,1,0]=4 1027 B8R1.10 CCCOC1CNC1 MCULE-7869061148 [0,0,0,1,0,0|2,1,0]=4 1028 B8R1.10 CCCOC1CNC1 MCULE-8082413973 [0,0,0,1,0,0|2,1,0]=4 1029 B8R1.10 CCNCC1CCC1 MCULE-3023922128 [0,0,0,1,0,0|3,0,0]=4 1030 B8R1.10 CCNCC1CCC1 MCULE-6528199463 [0,0,0,1,0,0|3,0,0]=4 1031 B8R1.10 CNCCC1CCC1 MCULE-2745819281 [0,0,0,1,0,0|3,0,0]=4 1032 B8R1.10 CNCCC1CCC1 MCULE-3567323475 [0,0,0,1,0,0|3,0,0]=4 1033 B8R1.10 ClCCOC1CCC1 MCULE-3820991249 [0,0,0,1,0,0|2,1,0]=4 1034 B8R1.10 NCCCC1CCC1 MCULE-7549286728 [0,0,0,1,0,0|3,0,0]=4 1035 B8R1.10 NCCCN1CCC1 MCULE-5482943088 [0,0,0,1,0,0|3,0,0]=4 1036 B8R1.10 NCCNC1CCC1 MCULE-4412823273 [0,0,0,1,0,0|3,0,0]=4 1037 B8R1.10 NCCOC1CCC1 MCULE-2392487192 [0,0,0,1,0,0|2,1,0]=4 1038 B8R1.10 NCCOC1CCC1 MCULE-4376171315 [0,0,0,1,0,0|2,1,0]=4 1039 B8R1.10 OCCCC1CCC1 MCULE-1577610703 [0,0,0,1,0,0|3,0,0]=4 1040 B8R1.10 OCCCN1CCC1 MCULE-3262554415 [0,0,0,1,0,0|3,0,0]=4 1041 B8R1.10 OCCNC1CCC1 MCULE-1766558913 [0,0,0,1,0,0|3,0,0]=4 1042 B8R1.10 OCCOC1CCC1 MCULE-9865514831 [0,0,0,1,0,0|2,1,0]=4 1043 B8R1.11 CC1CCCC1CN MCULE-3896736641 [0,0,0,1,0,0|3,0,0]=4 1044 B8R1.11 CC1CCCC1CN MCULE-8678978716 [0,0,0,1,0,0|3,0,0]=4 1045 B8R1.11 CC1CCCC1CO MCULE-9356546543 [0,0,0,1,0,0|3,0,0]=4 1046 B8R1.11 CC1CCNC1CO MCULE-3727613396 [0,0,0,1,0,0|3,0,0]=4 1047 B8R1.11 CC1CNCC1CN MCULE-3155679753 [0,0,0,1,0,0|3,0,0]=4 1048 B8R1.11 CC1CNCC1CN MCULE-9411859132 [0,0,0,1,0,0|3,0,0]=4 1049 B8R1.11 CC1CNCC1CO MCULE-2423357421 [0,0,0,1,0,0|3,0,0]=4 1050 B8R1.11 CC1CNCC1CO MCULE-9628020162 [0,0,0,1,0,0|3,0,0]=4 1051 B8R1.11 CC1COCC1CO MCULE-7218606126 [0,0,0,1,0,0|2,1,0]=4 1052 B8R1.11 CCC1CCCC1N MCULE-3368757457 [0,0,0,1,0,0|3,0,0]=4 1053 B8R1.11 CCC1CCNC1C MCULE-7900435915 [0,0,0,1,0,0|3,0,0]=4 1054 B8R1.11 CCC1CCNC1C MCULE-8779336209 [0,0,0,1,0,0|3,0,0]=4 1055 B8R1.11 CCC1CNCC1O MCULE-2095082658 [0,0,0,1,0,0|3,0,0]=4 1056 B8R1.11 CCC1COCC1N MCULE-2113082654 [0,0,0,1,0,0|2,1,0]=4 1057 B8R1.11 CCC1NCCC1C MCULE-2665209322 [0,0,0,1,0,0|2,0,0]=3 1058 B8R1.11 CCC1NCCC1C MCULE-2699257293 [0,0,0,1,0,0|2,0,0]=3 1059 B8R1.11 CCC1NCCC1O MCULE-6141963287 [0,0,0,1,0,0|3,0,0]=4 1060 B8R1.11 CCC1NCCC1O MCULE-9283391049 [0,0,0,1,0,0|3,0,0]=4 1061 B8R1.11 CCN1N=CCC1C MCULE-5040548749 [0,0,0,1,0,0|3,0,0]=4 1062 B8R1.11 CC[C@@H]1CCC[C@H]1N MCULE-6461151240 [0,0,0,1,0,0|3,0,0]=4 1063 B8R1.11 CC[C@@H]1OCC[C@H]1N MCULE-6631183888 [0,0,0,1,0,0|2,1,0]=4 1064 B8R1.11 C[C@@H]1CCN[C@@H]1CO MCULE-7458696223 [0,0,0,1,0,0|3,0,0]=4 1065 B8R1.11 C[C@@H]1CCN[C@H]1CO MCULE-7407237429 [0,0,0,1,0,0|3,0,0]=4 1066 B8R1.11 C[C@@H]1CNC[C@H]1CO MCULE-9810701855 [0,0,0,1,0,0|3,0,0]=4 1067 B8R1.11 C[C@H]1CCN[C@@H]1CO MCULE-9913318158 [0,0,0,1,0,0|3,0,0]=4 1068 B8R1.11 C[C@H]1CCN[C@H]1CO MCULE-4322110368 [0,0,0,1,0,0|3,0,0]=4 1069 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-2024872524 [0,0,0,1,0,0|3,0,0]=4 1070 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-3327012262 [0,0,0,1,0,0|3,0,0]=4 1071 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-4174376777 [0,0,0,1,0,0|3,0,0]=4 1072 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-4680966874 [0,0,0,1,0,0|3,0,0]=4 1073 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-8985861060 [0,0,0,1,0,0|3,0,0]=4 1074 B8R1.22 BrC1CCCCCC1 MCULE-4670856107 [0,0,0,1,0,0|3,0,0]=4 1075 B8R1.22 BrC1CCCOCC1 MCULE-4342557066 [0,0,0,1,0,0|2,1,0]=4 1076 B8R1.22 CC1CCCCCN1 MCULE-2095896439 [0,0,0,1,0,0|3,0,0]=4 1077 B8R1.22 CC1CCCCCN1 MCULE-5848089936 [0,0,0,1,0,0|3,0,0]=4 1078 B8R1.22 CC1CCCCNC1 MCULE-4872471007 [0,0,0,1,0,0|2,0,0]=3 1079 B8R1.22 CC1CCCCNC1 MCULE-6320007925 [0,0,0,1,0,0|2,0,0]=3 1080 B8R1.22 CC1CCCNCC1 MCULE-1361067252 [0,0,0,1,0,0|2,0,0]=3 1081 B8R1.22 CC1CCCNCC1 MCULE-8866871990 [0,0,0,1,0,0|2,0,0]=3 1082 B8R1.22 CC1CCNCCN1 MCULE-2481820949 [0,0,0,1,0,0|3,0,0]=4 1083 B8R1.22 CC1CCNCCN1 MCULE-6114208492 [0,0,0,1,0,0|3,0,0]=4 1084 B8R1.22 CC1CCNCCS1 MCULE-7102025211 [0,0,0,1,0,0|3,0,0]=4 1085 B8R1.22 CC1CCOCCN1 MCULE-5979047775 [0,0,0,1,0,0|2,1,0]=4 1086 B8R1.22 CC1CCOCCN1 MCULE-7762447328 [0,0,0,1,0,0|2,1,0]=4 1087 B8R1.22 CC1CCSCCN1 MCULE-1424931121 [0,0,0,1,0,0|2,0,0]=3 1088 B8R1.22 CC1CCSCCN1 MCULE-7513516501 [0,0,0,1,0,0|2,0,0]=3 1089 B8R1.22 CC1CNCCCN1 MCULE-4765039625 [0,0,0,1,0,0|3,0,0]=4 1090 B8R1.22 CC1CNCCCO1 MCULE-6836650488 [0,0,0,1,0,0|3,0,0]=4 1091 B8R1.22 CC1CNCCCO1 MCULE-8246520743 [0,0,0,1,0,0|3,0,0]=4 1092 B8R1.22 CC1CNCCNC1 MCULE-8657576639 [0,0,0,1,0,0|3,0,0]=4 1093 B8R1.22 CC1CNCCOC1 MCULE-3266198031 [0,0,0,1,0,0|2,1,0]=4 1094 B8R1.22 CC1CNCCOC1 MCULE-7683724120 [0,0,0,1,0,0|2,1,0]=4 1095 B8R1.22 CC1CNCCSC1 MCULE-6522611117 [0,0,0,1,0,0|2,0,0]=3 1096 B8R1.22 CC1COCCCN1 MCULE-5522410500 [0,0,0,1,0,0|2,1,0]=4 1097 B8R1.22 CC1CSCCCN1 MCULE-1217955281 [0,0,0,1,0,0|2,0,0]=3 1098 B8R1.22 CC1CSCCCN1 MCULE-1651941633 [0,0,0,1,0,0|2,0,0]=3 1099 B8R1.22 CN1CCCNCC1 MCULE-6335715537 [0,0,0,1,0,0|3,0,0]=4 1100 B8R1.22 CN1CCCNCC1 MCULE-7300334035 [0,0,0,1,0,0|3,0,0]=4 1101 B8R1.22 C[C@@H]1CCCCCN1 MCULE-6288089261 [0,0,0,1,0,0|3,0,0]=4 1102 B8R1.22 C[C@@H]1CCCCCN1 MCULE-9958468096 [0,0,0,1,0,0|3,0,0]=4 1103 B8R1.22 C[C@@H]1CCNCCN1 MCULE-8809324856 [0,0,0,1,0,0|3,0,0]=4 1104 B8R1.22 C[C@@H]1CCNCCO1 MCULE-4706490422 [0,0,0,1,0,0|3,0,0]=4 1105 B8R1.22 C[C@@H]1CCNCCO1 MCULE-7769149413 [0,0,0,1,0,0|3,0,0]=4 1106 B8R1.22 C[C@H]1CCCCCN1 MCULE-2291249179 [0,0,0,1,0,0|3,0,0]=4 1107 B8R1.22 C[C@H]1CCCCCN1 MCULE-2695293080 [0,0,0,1,0,0|3,0,0]=4 1108 B8R1.22 C[C@H]1CCNCCN1 MCULE-9762617477 [0,0,0,1,0,0|3,0,0]=4 1109 B8R1.22 ClC1CCCCCC1 MCULE-9172347842 [0,0,0,1,0,0|3,0,0]=4 1110 B8R1.22 FC1CCCCNC1 MCULE-5480487921 [0,0,0,1,0,0|3,0,0]=4 1111 B8R1.22 FC1CCCCNC1 MCULE-5782030002 [0,0,0,1,0,0|3,0,0]=4 1112 B8R1.22 FC1CCCNCC1 MCULE-2724514050 [0,0,0,1,0,0|3,0,0]=4 1113 B8R1.22 FC1CCCNCC1 MCULE-3808617764 [0,0,0,1,0,0|3,0,0]=4 1114 B8R1.22 F[C@H]1CCCNCC1 MCULE-5787198940 [0,0,0,1,0,0|3,0,0]=4 1115 B8R1.22 F[C@H]1CCCNCC1 MCULE-8736460913 [0,0,0,1,0,0|3,0,0]=4 1116 B8R1.22 NC1CCCCCC1 MCULE-6214185878 [0,0,0,1,0,0|3,0,0]=4 1117 B8R1.22 NC1CCCCNC1 MCULE-9702629623 [0,0,0,1,0,0|3,0,0]=4 1118 B8R1.22 NC1CCCCNC1 MCULE-9973726441 [0,0,0,1,0,0|3,0,0]=4 1119 B8R1.22 NC1CCCNCC1 MCULE-5600391911 [0,0,0,1,0,0|3,0,0]=4 1120 B8R1.22 NC1CCCNCC1 MCULE-7390953649 [0,0,0,1,0,0|3,0,0]=4 1121 B8R1.22 NC1CCCOCC1 MCULE-2817475859 [0,0,0,1,0,0|2,1,0]=4 1122 B8R1.22 NC1CCCSCC1 MCULE-1327827987 [0,0,0,1,0,0|2,0,0]=3 1123 B8R1.22 N[C@@H]1CCCCNC1 MCULE-4063472101 [0,0,0,1,0,0|3,0,0]=4 1124 B8R1.22 N[C@@H]1CCCCNC1 MCULE-6734296273 [0,0,0,1,0,0|3,0,0]=4 1125 B8R1.22 N[C@@H]1CCCNCC1 MCULE-5614702075 [0,0,0,1,0,0|3,0,0]=4 1126 B8R1.22 N[C@H]1CCCCNC1 MCULE-2962012084 [0,0,0,1,0,0|3,0,0]=4 1127 B8R1.22 N[C@H]1CCCCNC1 MCULE-4348209410 [0,0,0,1,0,0|3,0,0]=4 1128 B8R1.22 N[C@H]1CCCCNC1 MCULE-5018449571 [0,0,0,1,0,0|3,0,0]=4 1129 B8R1.22 N[C@H]1CCCCNC1 MCULE-6428493067 [0,0,0,1,0,0|3,0,0]=4 1130 B8R1.22 N[C@H]1CCCCNC1 MCULE-9621520180 [0,0,0,1,0,0|3,0,0]=4 1131 B8R1.22 N[C@H]1CCCNCC1 MCULE-1653914126 [0,0,0,1,0,0|3,0,0]=4 1132 B8R1.22 O=C1CCCSCC1 MCULE-9359592851 [0,0,0,1,0,0|2,0,1]=4 1133 B8R1.22 OC1CCCCCC1 MCULE-2514105258 [0,0,0,1,0,0|3,0,0]=4 1134 B8R1.22 OC1CCCCNC1 MCULE-1190427956 [0,0,0,1,0,0|3,0,0]=4 1135 B8R1.22 OC1CCCCNC1 MCULE-1421732173 [0,0,0,1,0,0|3,0,0]=4 1136 B8R1.22 OC1CCCNCC1 MCULE-1004110838 [0,0,0,1,0,0|3,0,0]=4 1137 B8R1.22 OC1CCCNCC1 MCULE-3791515829 [0,0,0,1,0,0|3,0,0]=4 1138 B8R1.22 OC1CCCOCC1 MCULE-6712544119 [0,0,0,1,0,0|2,1,0]=4 1139 B8R1.22 O[C@@H]1CCCCNC1 MCULE-1012232836 [0,0,0,1,0,0|3,0,0]=4 1140 B8R1.22 O[C@@H]1CCCCNC1 MCULE-8021135676 [0,0,0,1,0,0|3,0,0]=4 1141 B8R1.22 O[C@@H]1CCCNCC1 MCULE-4750880036 [0,0,0,1,0,0|3,0,0]=4 1142 B8R1.22 O[C@@H]1CCCNCC1 MCULE-7818554188 [0,0,0,1,0,0|3,0,0]=4 1143 B8R1.22 O[C@H]1CCCCNC1 MCULE-3979929214 [0,0,0,1,0,0|3,0,0]=4 1144 B8R1.22 O[C@H]1CCCCNC1 MCULE-8051415954 [0,0,0,1,0,0|3,0,0]=4 1145 B8R1.22 O[C@H]1CCCNCC1 MCULE-3288930041 [0,0,0,1,0,0|3,0,0]=4 1146 B8R1.22 O[C@H]1CCCNCC1 MCULE-4775727156 [0,0,0,1,0,0|3,0,0]=4 1147 B8R1.22 O[C@H]1CCCNCC1 MCULE-9319578978 [0,0,0,1,0,0|3,0,0]=4 1148 B8R1.22 O[C@H]1CCCNCC1 MCULE-9853151234 [0,0,0,1,0,0|3,0,0]=4 1149 B8R1.22 SC1CCCCCC1 MCULE-7667420050 [0,0,0,1,0,0|3,0,0]=4 1150 B8R1.36 BrCCCCC1CC1 MCULE-7569356786 [0,0,0,1,0,0|3,0,0]=4 1151 B8R1.36 BrCCOCC1CC1 MCULE-4323218556 [0,0,0,1,0,0|2,1,0]=4 1152 B8R1.36 CCCCCC1CO1 MCULE-2249864409 [0,0,0,1,0,0|3,0,0]=4 1153 B8R1.36 CCCCNC1CC1 MCULE-3040464978 [0,0,0,1,0,0|2,0,0]=3 1154 B8R1.36 CCCCNC1CC1 MCULE-4270884589 [0,0,0,1,0,0|2,0,0]=3 1155 B8R1.36 CCCNCC1CC1 MCULE-4638806969 [0,0,0,1,0,0|2,0,0]=3 1156 B8R1.36 CCCNCC1CC1 MCULE-7330549554 [0,0,0,1,0,0|2,0,0]=3 1157 B8R1.36 CCCOCC1CO1 MCULE-2437381651 [0,0,0,1,0,0|2,1,0]=4 1158 B8R1.36 CCNCCC1CC1 MCULE-4405308784 [0,0,0,1,0,0|3,0,0]=4 1159 B8R1.36 CNCCNC1CC1 MCULE-3729391085 [0,0,0,1,0,0|3,0,0]=4 1160 B8R1.36 CNCCOC1CC1 MCULE-4547624840 [0,0,0,1,0,0|2,1,0]=4 1161 B8R1.36 COCCNC1CC1 MCULE-2261976508 [0,0,0,1,0,0|3,0,0]=4 1162 B8R1.36 NCCCCC1CC1 MCULE-8530038799 [0,0,0,1,0,0|3,0,0]=4 1163 B8R1.36 NCCNCC1CC1 MCULE-7166395823 [0,0,0,1,0,0|3,0,0]=4 1164 B8R1.36 NCCNCC1CC1 MCULE-9853127767 [0,0,0,1,0,0|3,0,0]=4 1165 B8R1.36 NCCOCC1CC1 MCULE-4047349006 [0,0,0,1,0,0|2,1,0]=4 1166 B8R1.36 NCCSCC1CC1 MCULE-5143437882 [0,0,0,1,0,0|2,0,0]=3 1167 B8R1.36 OCCCCC1CC1 MCULE-6334640431 [0,0,0,1,0,0|3,0,0]=4 1168 B8R1.36 OCCCNC1CC1 MCULE-6018017423 [0,0,0,1,0,0|3,0,0]=4 1169 B8R1.36 OCCCSC1CC1 MCULE-6589388271 [0,0,0,1,0,0|2,0,0]=3 1170 B8R1.36 OCCNCC1CC1 MCULE-8212551918 [0,0,0,1,0,0|3,0,0]=4 1171 B8R1.36 OCCNCC1CC1 MCULE-9676786904 [0,0,0,1,0,0|3,0,0]=4 1172 B8R1.36 OCCOCC1CC1 MCULE-5378966893 [0,0,0,1,0,0|2,1,0]=4 1173 B8R1.49 C1=CCCCCCC1 MCULE-9704495201 [0,0,0,1,0,0|2,0,0]=3 1174 B8R1.49 C1=CCCCCCC1 MCULE-9874244790 [0,0,0,1,0,0|2,0,0]=3 1175 B8R1.49 C1CCCCCCC1 MCULE-2574589959 [0,0,0,1,0,0|2,0,0]=3 1176 B8R1.49 C1CCCNCCC1 MCULE-5976326835 [0,0,0,1,0,0|2,0,0]=3 1177 B8R1.49 C1CCCNCCC1 MCULE-9979746026 [0,0,0,1,0,0|2,0,0]=3 1178 B8R1.49 C1CCOCCNC1 MCULE-9906602095 [0,0,0,1,0,0|2,1,0]=4 1179 B8R1.49 C1CNCCCNC1 MCULE-7495479807 [0,0,0,1,0,0|3,0,0]=4 1180 B8R1.49 C1CNCCCNC1 MCULE-9561892339 [0,0,0,1,0,0|3,0,0]=4 1181 B8R1.49 C1CNCCCOC1 MCULE-8227528433 [0,0,0,1,0,0|2,1,0]=4 1182 B5R0.2 BrCCCCBr MCULE-5088378536 [2,0,0,0,0,0|2,0,0]=4 1183 B5R0.2 C#CCCCC MCULE-5706969297 [2,0,0,0,0,0|0,0,2]=4 1184 B5R0.2 C#CCSCC MCULE-5718021970 [2,0,0,0,0,0|0,0,2]=4 1185 B5R0.2 C/C=C/CCC MCULE-9851656818 [2,0,0,0,0,0|0,0,2]=4 1186 B5R0.2 C/C=C\CCC MCULE-1013657748 [2,0,0,0,0,0|0,0,2]=4 1187 B5R0.2 C=CCCCC MCULE-4750698031 [2,0,0,0,0,0|0,0,2]=4 1188 B5R0.2 C=CCSCC MCULE-3816911529 [2,0,0,0,0,0|0,0,2]=4 1189 B5R0.2 C=CCSSC MCULE-8417830164 [2,0,0,0,0,0|0,0,2]=4 1190 B5R0.2 CC#CCCC MCULE-8179328151 [2,0,0,0,0,0|0,0,2]=4 1191 B5R0.2 CC/C=C/CC MCULE-6762040186 [2,0,0,0,0,0|0,0,2]=4 1192 B5R0.2 CC/C=C\CC MCULE-9418110460 [2,0,0,0,0,0|0,0,2]=4 1193 B5R0.2 CC=CCCC MCULE-8736231124 [2,0,0,0,0,0|0,0,2]=4 1194 B5R0.2 CC=CSSC MCULE-2442770677 [2,0,0,0,0,0|0,0,2]=4 1195 B5R0.2 CCC#CCC MCULE-2027962178 [2,0,0,0,0,0|0,0,2]=4 1196 B5R0.2 CCC=CCC MCULE-5435957422 [2,0,0,0,0,0|0,0,2]=4 1197 B5R0.2 CCCCC#N MCULE-4015236167 [2,0,0,0,0,0|1,0,1]=4 1198 B5R0.2 CCCCC=O MCULE-4736782822 [2,0,0,0,0,0|1,0,1]=4 1199 B5R0.2 CCCCCBr MCULE-8513521912 [2,0,0,0,0,0|1,0,0]=3 1200 B5R0.2 CCCCCC MCULE-3465692202 [2,0,0,0,0,0|0,0,0]=2 1201 B5R0.2 CCCCCCl MCULE-4412759460 [2,0,0,0,0,0|1,0,0]=3 1202 B5R0.2 CCCCCF MCULE-6399883281 [2,0,0,0,0,0|1,0,0]=3 1203 B5R0.2 CCCCCI MCULE-4590300793 [2,0,0,0,0,0|1,0,0]=3 1204 B5R0.2 CCCCCN MCULE-3371742982 [2,0,0,0,0,0|1,0,0]=3 1205 B5R0.2 CCCCCN MCULE-4371067300 [2,0,0,0,0,0|1,0,0]=3 1206 B5R0.2 CCCCCN MCULE-6547961798 [2,0,0,0,0,0|1,0,0]=3 1207 B5R0.2 CCCCCN MCULE-7483248760 [2,0,0,0,0,0|1,0,0]=3 1208 B5R0.2 CCCCCO MCULE-8714292632 [2,0,0,0,0,0|1,0,0]=3 1209 B5R0.2 CCCCCS MCULE-5476379340 [2,0,0,0,0,0|1,0,0]=3 1210 B5R0.2 CCCCNC MCULE-9321610906 [2,0,0,0,0,0|1,0,0]=3 1211 B5R0.2 CCCCNN MCULE-6681305566 [2,0,0,0,0,0|2,0,0]=4 1212 B5R0.2 CCCCNN MCULE-6890760890 [2,0,0,0,0,0|2,0,0]=4 1213 B5R0.2 CCCCNN MCULE-7362497327 [2,0,0,0,0,0|2,0,0]=4 1214 B5R0.2 CCCCNN MCULE-8463623644 [2,0,0,0,0,0|2,0,0]=4 1215 B5R0.2 CCCCNO MCULE-1911206569 [2,0,0,0,0,0|2,0,0]=4 1216 B5R0.2 CCCCNO MCULE-3820646216 [2,0,0,0,0,0|2,0,0]=4 1217 B5R0.2 CCCCOC MCULE-9814272675 [2,0,0,0,0,0|1,0,0]=3 1218 B5R0.2 CCCCON MCULE-7582349983 [2,0,0,0,0,0|2,0,0]=4 1219 B5R0.2 CCCCON MCULE-8175627798 [2,0,0,0,0,0|2,0,0]=4 1220 B5R0.2 CCCCSC MCULE-2799775567 [2,0,0,0,0,0|1,0,0]=3 1221 B5R0.2 CCCNCC MCULE-7948828264 [2,0,0,0,0,0|1,0,0]=3 1222 B5R0.2 CCCNCC MCULE-9107549207 [2,0,0,0,0,0|1,0,0]=3 1223 B5R0.2 CCCOCBr MCULE-3585683043 [2,0,0,0,0,0|1,1,0]=4 1224 B5R0.2 CCCOCC MCULE-9971916790 [2,0,0,0,0,0|0,1,0]=3 1225 B5R0.2 CCCOCCl MCULE-1932627202 [2,0,0,0,0,0|1,1,0]=4 1226 B5R0.2 CCCSC#N MCULE-9018157774 [2,0,0,0,0,0|1,0,1]=4 1227 B5R0.2 CCCSCC MCULE-4547385568 [2,0,0,0,0,0|0,0,0]=2 1228 B5R0.2 CCCSSC MCULE-3127072032 [2,0,0,0,0,0|0,0,0]=2 1229 B5R0.2 CCNCCCl MCULE-2589770119 [2,0,0,0,0,0|2,0,0]=4 1230 B5R0.2 CCNCCCl MCULE-3098032672 [2,0,0,0,0,0|2,0,0]=4 1231 B5R0.2 CCNCCN MCULE-7854769899 [2,0,0,0,0,0|2,0,0]=4 1232 B5R0.2 CCNCCO MCULE-2537734730 [2,0,0,0,0,0|2,0,0]=4 1233 B5R0.2 CCNCCO MCULE-3738714907 [2,0,0,0,0,0|2,0,0]=4 1234 B5R0.2 CCNNCC MCULE-4789314801 [2,0,0,0,0,0|2,0,0]=4 1235 B5R0.2 CCNNCC MCULE-9060220585 [2,0,0,0,0,0|2,0,0]=4 1236 B5R0.2 CCOCCBr MCULE-4818900555 [2,0,0,0,0,0|1,1,0]=4 1237 B5R0.2 CCOCCCl MCULE-1290576729 [2,0,0,0,0,0|1,1,0]=4 1238 B5R0.2 CCOCCI MCULE-1833092968 [2,0,0,0,0,0|1,1,0]=4 1239 B5R0.2 CCOCCN MCULE-1254431240 [2,0,0,0,0,0|1,1,0]=4 1240 B5R0.2 CCOCCN MCULE-4039110889 [2,0,0,0,0,0|1,1,0]=4 1241 B5R0.2 CCOCCN MCULE-4400456933 [2,0,0,0,0,0|1,1,0]=4 1242 B5R0.2 CCOCCO MCULE-4311513289 [2,0,0,0,0,0|1,1,0]=4 1243 B5R0.2 CCOCCS MCULE-3968740645 [2,0,0,0,0,0|1,1,0]=4 1244 B5R0.2 CCSCC#N MCULE-4093791055 [2,0,0,0,0,0|1,0,1]=4 1245 B5R0.2 CCSCC=O MCULE-8069035019 [2,0,0,0,0,0|1,0,1]=4 1246 B5R0.2 CCSCCBr MCULE-9449933342 [2,0,0,0,0,0|1,0,0]=3 1247 B5R0.2 CCSCCCl MCULE-4057847237 [2,0,0,0,0,0|1,0,0]=3 1248 B5R0.2 CCSCCN MCULE-3375644872 [2,0,0,0,0,0|1,0,0]=3 1249 B5R0.2 CCSCCN MCULE-4466279976 [2,0,0,0,0,0|1,0,0]=3 1250 B5R0.2 CCSCCO MCULE-3557086162 [2,0,0,0,0,0|1,0,0]=3 1251 B5R0.2 CCSCCS MCULE-4583054157 [2,0,0,0,0,0|1,0,0]=3 1252 B5R0.2 CCSSCC MCULE-7989926475 [2,0,0,0,0,0|0,0,0]=2 1253 B5R0.2 CC[Se][Se]CC MCULE-2725282576 [2,0,0,0,0,0|0,2,0]=4 1254 B5R0.2 CNCCCBr MCULE-3376600253 [2,0,0,0,0,0|2,0,0]=4 1255 B5R0.2 CNCCCBr MCULE-6212326106 [2,0,0,0,0,0|2,0,0]=4 1256 B5R0.2 CNCCCCl MCULE-1007719210 [2,0,0,0,0,0|2,0,0]=4 1257 B5R0.2 CNCCCCl MCULE-6146901643 [2,0,0,0,0,0|2,0,0]=4 1258 B5R0.2 CNCCCF MCULE-7647417887 [2,0,0,0,0,0|2,0,0]=4 1259 B5R0.2 CNCCCN MCULE-1736081896 [2,0,0,0,0,0|2,0,0]=4 1260 B5R0.2 CNCCCO MCULE-9530478547 [2,0,0,0,0,0|2,0,0]=4 1261 B5R0.2 CNCCNC MCULE-1378979868 [2,0,0,0,0,0|2,0,0]=4 1262 B5R0.2 CNCCNC MCULE-3281508478 [2,0,0,0,0,0|2,0,0]=4 1263 B5R0.2 CNCCOC MCULE-2857904484 [2,0,0,0,0,0|2,0,0]=4 1264 B5R0.2 CNCCOC MCULE-5342712496 [2,0,0,0,0,0|2,0,0]=4 1265 B5R0.2 CNCCSC MCULE-2812984399 [2,0,0,0,0,0|2,0,0]=4 1266 B5R0.2 CNCCSC MCULE-2942435951 [2,0,0,0,0,0|2,0,0]=4 1267 B5R0.2 COCCCBr MCULE-6489536401 [2,0,0,0,0,0|2,0,0]=4 1268 B5R0.2 COCCCCl MCULE-9192274624 [2,0,0,0,0,0|2,0,0]=4 1269 B5R0.2 COCCCF MCULE-5055725246 [2,0,0,0,0,0|2,0,0]=4 1270 B5R0.2 COCCCI MCULE-9111605439 [2,0,0,0,0,0|2,0,0]=4 1271 B5R0.2 COCCCN MCULE-1421362990 [2,0,0,0,0,0|2,0,0]=4 1272 B5R0.2 COCCCN MCULE-4783132205 [2,0,0,0,0,0|2,0,0]=4 1273 B5R0.2 COCCCO MCULE-4041418048 [2,0,0,0,0,0|2,0,0]=4 1274 B5R0.2 COCCCS MCULE-2371333731 [2,0,0,0,0,0|2,0,0]=4 1275 B5R0.2 COCCOC MCULE-7572196731 [2,0,0,0,0,0|2,0,0]=4 1276 B5R0.2 COCCSC MCULE-5362054021 [2,0,0,0,0,0|2,0,0]=4 1277 B5R0.2 CSCCCBr MCULE-8399851816 [2,0,0,0,0,0|2,0,0]=4 1278 B5R0.2 CSCCCCl MCULE-1829120476 [2,0,0,0,0,0|2,0,0]=4 1279 B5R0.2 CSCCCN MCULE-1030938424 [2,0,0,0,0,0|2,0,0]=4 1280 B5R0.2 CSCCCN MCULE-4664984921 [2,0,0,0,0,0|2,0,0]=4 1281 B5R0.2 CSCCCO MCULE-9232413185 [2,0,0,0,0,0|2,0,0]=4 1282 B5R0.2 CSCCCS MCULE-8405766359 [2,0,0,0,0,0|2,0,0]=4 1283 B5R0.2 CSSCCN MCULE-7065189564 [2,0,0,0,0,0|1,0,0]=3 1284 B5R0.2 CSSCCN MCULE-8654200268 [2,0,0,0,0,0|1,0,0]=3 1285 B5R0.2 ClCCCCBr MCULE-7973194927 [2,0,0,0,0,0|2,0,0]=4 1286 B5R0.2 ClCCCCCl MCULE-4863501782 [2,0,0,0,0,0|2,0,0]=4 1287 B5R0.2 ClCCCCI MCULE-4303507089 [2,0,0,0,0,0|2,0,0]=4 1288 B5R0.2 FCCCCBr MCULE-8408956872 [2,0,0,0,0,0|2,0,0]=4 1289 B5R0.2 FCCCCF MCULE-1347438150 [2,0,0,0,0,0|2,0,0]=4 1290 B5R0.2 ICCCCI MCULE-1390457250 [2,0,0,0,0,0|2,0,0]=4 1291 B5R0.2 NCCCCBr MCULE-7095299053 [2,0,0,0,0,0|2,0,0]=4 1292 B5R0.2 NCCCCBr MCULE-7716027825 [2,0,0,0,0,0|2,0,0]=4 1293 B5R0.2 NCCCCCl MCULE-8484381726 [2,0,0,0,0,0|2,0,0]=4 1294 B5R0.2 NCCCCCl MCULE-9917306082 [2,0,0,0,0,0|2,0,0]=4 1295 B5R0.2 NCCCCF MCULE-4260727945 [2,0,0,0,0,0|2,0,0]=4 1296 B5R0.2 NCCCCF MCULE-7716720921 [2,0,0,0,0,0|2,0,0]=4 1297 B5R0.2 NCCCCN MCULE-3098044935 [2,0,0,0,0,0|2,0,0]=4 1298 B5R0.2 NCCCCN MCULE-7898833229 [2,0,0,0,0,0|2,0,0]=4 1299 B5R0.2 NCCCCN MCULE-8029479697 [2,0,0,0,0,0|2,0,0]=4 1300 B5R0.2 NCCCCN MCULE-8509656776 [2,0,0,0,0,0|2,0,0]=4 1301 B5R0.2 NCCCCO MCULE-7395674091 [2,0,0,0,0,0|2,0,0]=4 1302 B5R0.2 NCCCCS MCULE-4353910418 [2,0,0,0,0,0|2,0,0]=4 1303 B5R0.2 NCCCCS MCULE-9812416858 [2,0,0,0,0,0|2,0,0]=4 1304 B5R0.2 OCCCCBr MCULE-9231591925 [2,0,0,0,0,0|2,0,0]=4 1305 B5R0.2 OCCCCCl MCULE-3507644812 [2,0,0,0,0,0|2,0,0]=4 1306 B5R0.2 OCCCCF MCULE-9242285588 [2,0,0,0,0,0|2,0,0]=4 1307 B5R0.2 OCCCCI MCULE-8723720522 [2,0,0,0,0,0|2,0,0]=4 1308 B5R0.2 OCCCCO MCULE-2010022287 [2,0,0,0,0,0|2,0,0]=4 1309 B5R0.2 OCCCCO MCULE-6551106098 [2,0,0,0,0,0|2,0,0]=4 1310 B5R0.2 OCCCCS MCULE-8169490949 [2,0,0,0,0,0|2,0,0]=4 1311 B5R0.2 SCCCCS MCULE-6695609899 [2,0,0,0,0,0|2,0,0]=4 1312 B7R0.3 C=C(CC)CCCC MCULE-5118701402 [1,1,0,0,0,0|1,0,1]=4 1313 B7R0.3 CC/C=C/C(C)CC MCULE-2438890702 [1,1,0,0,0,0|1,0,1]=4 1314 B7R0.3 CCC(C)CCCO MCULE-2323419626 [1,1,0,0,0,0|2,0,0]=4 1315 B7R0.3 CCC(C)NCCO MCULE-1340916666 [1,1,0,0,0,0|2,0,0]=4 1316 B7R0.3 CCC(Cl)CCCCl MCULE-6770226574 [1,1,0,0,0,0|2,0,0]=4 1317 B7R0.3 CCC(N)CCCO MCULE-3868205501 [1,1,0,0,0,0|2,0,0]=4 1318 B7R0.3 CCC(N)CCOC MCULE-8279767210 [1,1,0,0,0,0|2,0,0]=4 1319 B7R0.3 CCC(O)CCCN MCULE-1491163174 [1,1,0,0,0,0|2,0,0]=4 1320 B7R0.3 CCC(O)CCCN MCULE-5150508895 [1,1,0,0,0,0|2,0,0]=4 1321 B7R0.3 CCC(O)CCCO MCULE-1099760826 [1,1,0,0,0,0|2,0,0]=4 1322 B7R0.3 CCC(O)CCOC MCULE-1245099360 [1,1,0,0,0,0|2,0,0]=4 1323 B7R0.3 CCC=CC(C)CC MCULE-8910467842 [1,1,0,0,0,0|1,0,1]=4 1324 B7R0.3 CCCC=C(C)CC MCULE-4699949699 [1,1,0,0,0,0|1,0,1]=4 1325 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [1,1,0,0,0,0|1,0,1]=4 1326 B7R0.3 CCCCC(Br)CBr MCULE-9142273359 [1,1,0,0,0,0|2,0,0]=4 1327 B7R0.3 CCCCC(Br)CC MCULE-3813549657 [1,1,0,0,0,0|1,0,0]=3 1328 B7R0.3 CCCCC(C)CC MCULE-9471981954 [1,1,0,0,0,0|1,0,0]=3 1329 B7R0.3 CCCCC(C)NC MCULE-7492621121 [1,1,0,0,0,0|2,0,0]=4 1330 B7R0.3 CCCCC(Cl)CCl MCULE-6681580076 [1,1,0,0,0,0|2,0,0]=4 1331 B7R0.3 CCCCC(N)CC MCULE-1353863738 [1,1,0,0,0,0|1,0,0]=3 1332 B7R0.3 CCCCC(N)CC MCULE-9870475040 [1,1,0,0,0,0|1,0,0]=3 1333 B7R0.3 CCCCC(N)CN MCULE-2038464943 [1,1,0,0,0,0|2,0,0]=4 1334 B7R0.3 CCCCC(N)CO MCULE-1874423109 [1,1,0,0,0,0|2,0,0]=4 1335 B7R0.3 CCCCC(N)CO MCULE-2041767659 [1,1,0,0,0,0|2,0,0]=4 1336 B7R0.3 CCCCC(N)CO MCULE-4533575851 [1,1,0,0,0,0|2,0,0]=4 1337 B7R0.3 CCCCC(N)CO MCULE-7141990411 [1,1,0,0,0,0|2,0,0]=4 1338 B7R0.3 CCCCC(O)CBr MCULE-8416535559 [1,1,0,0,0,0|2,0,0]=4 1339 B7R0.3 CCCCC(O)CC MCULE-3912386534 [1,1,0,0,0,0|1,0,0]=3 1340 B7R0.3 CCCCC(O)CN MCULE-1383380728 [1,1,0,0,0,0|2,0,0]=4 1341 B7R0.3 CCCCC(O)CO MCULE-6903923961 [1,1,0,0,0,0|2,0,0]=4 1342 B7R0.3 CCCCN(C)CC MCULE-7723007145 [1,1,0,0,0,0|2,0,0]=4 1343 B7R0.3 CCCC[C@@H](N)CO MCULE-1379297850 [1,1,0,0,0,0|2,0,0]=4 1344 B7R0.3 CCCC[C@@H](N)CO MCULE-5016786633 [1,1,0,0,0,0|2,0,0]=4 1345 B7R0.3 CCCC[C@@H](N)CO MCULE-6669873658 [1,1,0,0,0,0|2,0,0]=4 1346 B7R0.3 CCCC[C@@H](N)CO MCULE-6809294141 [1,1,0,0,0,0|2,0,0]=4 1347 B7R0.3 CCCC[C@H](N)CO MCULE-3277509271 [1,1,0,0,0,0|2,0,0]=4 1348 B7R0.3 CCCC[C@H](N)CO MCULE-5867397890 [1,1,0,0,0,0|2,0,0]=4 1349 B7R0.3 CCCNC(C)CC MCULE-8533643430 [1,1,0,0,0,0|1,0,0]=3 1350 B7R0.3 CCCNC(C)CO MCULE-6575712324 [1,1,0,0,0,0|2,0,0]=4 1351 B7R0.3 CCCOC(=O)CC MCULE-2749425161 [1,1,0,0,0,0|0,1,1]=4 1352 B7R0.3 CCCOC(C)CN MCULE-2816840734 [1,1,0,0,0,0|1,1,0]=4 1353 B7R0.3 CCCOC(C)CN MCULE-6461157704 [1,1,0,0,0,0|1,1,0]=4 1354 B7R0.3 CCNCC(C)CC MCULE-8768620428 [1,1,0,0,0,0|2,0,0]=4 1355 B7R0.3 CCNCC(C)CC MCULE-9491990692 [1,1,0,0,0,0|2,0,0]=4 1356 B7R0.3 CCNCC(O)CC MCULE-9820144398 [1,1,0,0,0,0|2,0,0]=4 1357 B7R0.3 CCOCC(N)CC MCULE-2793834769 [1,1,0,0,0,0|1,1,0]=4 1358 B7R0.3 CCOCC(N)CC MCULE-5142543434 [1,1,0,0,0,0|1,1,0]=4 1359 B7R0.3 CCSCC(C)NC MCULE-6245105657 [1,1,0,0,0,0|2,0,0]=4 1360 B7R0.3 CC[C@H](C)CCCO MCULE-1760153718 [1,1,0,0,0,0|2,0,0]=4 1361 B7R0.3 CC[C@H](C)CCCO MCULE-3488695651 [1,1,0,0,0,0|2,0,0]=4 1362 B7R0.4 C=C(C)CCCCC MCULE-6108413722 [1,1,0,0,0,0|1,0,1]=4 1363 B7R0.4 CC(=O)CSCCF MCULE-8129308816 [1,1,0,0,0,0|1,0,1]=4 1364 B7R0.4 CC(Br)CCCCO MCULE-2106751856 [1,1,0,0,0,0|2,0,0]=4 1365 B7R0.4 CC(C)CCCCBr MCULE-9236389539 [1,1,0,0,0,0|2,0,0]=4 1366 B7R0.4 CC(C)CCCCCl MCULE-5223516486 [1,1,0,0,0,0|2,0,0]=4 1367 B7R0.4 CC(C)CCCCN MCULE-3591523204 [1,1,0,0,0,0|2,0,0]=4 1368 B7R0.4 CC(C)CCCCO MCULE-9053698607 [1,1,0,0,0,0|2,0,0]=4 1369 B7R0.4 CC(C)CNCCN MCULE-3059280265 [1,1,0,0,0,0|2,0,0]=4 1370 B7R0.4 CC(C)CNCCO MCULE-3948234461 [1,1,0,0,0,0|2,0,0]=4 1371 B7R0.4 CC(C)CNCCO MCULE-6673201049 [1,1,0,0,0,0|2,0,0]=4 1372 B7R0.4 CC(C)COCCBr MCULE-7232103778 [1,1,0,0,0,0|1,1,0]=4 1373 B7R0.4 CC(C)COCCN MCULE-9238454281 [1,1,0,0,0,0|1,1,0]=4 1374 B7R0.4 CC(C)COCCN MCULE-9987398976 [1,1,0,0,0,0|1,1,0]=4 1375 B7R0.4 CC(C)COCCO MCULE-2997702641 [1,1,0,0,0,0|1,1,0]=4 1376 B7R0.4 CC(C)CSCCCl MCULE-1798266957 [1,1,0,0,0,0|1,0,0]=3 1377 B7R0.4 CC(C)CSCCN MCULE-6100886830 [1,1,0,0,0,0|1,0,0]=3 1378 B7R0.4 CC(C)CSCCN MCULE-8368453687 [1,1,0,0,0,0|1,0,0]=3 1379 B7R0.4 CC(C)CSCCO MCULE-5481216581 [1,1,0,0,0,0|1,0,0]=3 1380 B7R0.4 CC(C)SCCCN MCULE-6322440113 [1,1,0,0,0,0|2,0,0]=4 1381 B7R0.4 CC(C)SCCCO MCULE-4296249117 [1,1,0,0,0,0|2,0,0]=4 1382 B7R0.4 CC(Cl)CCCCCl MCULE-4829013540 [1,1,0,0,0,0|2,0,0]=4 1383 B7R0.4 CC(Cl)CNCCCl MCULE-2269449058 [1,1,0,0,0,0|2,0,0]=4 1384 B7R0.4 CC(Cl)CNCCCl MCULE-4107266640 [1,1,0,0,0,0|2,0,0]=4 1385 B7R0.4 CC(Cl)COCCCl MCULE-5744839272 [1,1,0,0,0,0|1,1,0]=4 1386 B7R0.4 CC(N)CCCCN MCULE-3497267062 [1,1,0,0,0,0|2,0,0]=4 1387 B7R0.4 CC(N)CCCCN MCULE-9887360104 [1,1,0,0,0,0|2,0,0]=4 1388 B7R0.4 CC(N)CCCCO MCULE-7039935081 [1,1,0,0,0,0|2,0,0]=4 1389 B7R0.4 CC(N)CCCCO MCULE-8167834378 [1,1,0,0,0,0|2,0,0]=4 1390 B7R0.4 CC(O)CCCCO MCULE-3790969400 [1,1,0,0,0,0|2,0,0]=4 1391 B7R0.4 CC(O)CNCCN MCULE-3904214677 [1,1,0,0,0,0|2,0,0]=4 1392 B7R0.4 CC(O)CNCCO MCULE-4873845500 [1,1,0,0,0,0|2,0,0]=4 1393 B7R0.4 CC(O)CSCCO MCULE-8885458360 [1,1,0,0,0,0|1,0,0]=3 1394 B7R0.4 CCC#CCC(C)O MCULE-4633396611 [1,1,0,0,0,0|1,0,1]=4 1395 B7R0.4 CCC=CCC(C)C MCULE-6798729321 [1,1,0,0,0,0|1,0,1]=4 1396 B7R0.4 CCCC#CC(C)O MCULE-4333844811 [1,1,0,0,0,0|1,0,1]=4 1397 B7R0.4 CCCC=CC(C)C MCULE-6546702510 [1,1,0,0,0,0|1,0,1]=4 1398 B7R0.4 CCCCCC(=O)C MCULE-6017828463 [1,1,0,0,0,0|1,0,1]=4 1399 B7R0.4 CCCCCC(C)Br MCULE-4688847972 [1,1,0,0,0,0|1,0,0]=3 1400 B7R0.4 CCCCCC(C)C MCULE-9815158757 [1,1,0,0,0,0|1,0,0]=3 1401 B7R0.4 CCCCCC(C)Cl MCULE-1461261404 [1,1,0,0,0,0|1,0,0]=3 1402 B7R0.4 CCCCCC(C)N MCULE-1307982487 [1,1,0,0,0,0|1,0,0]=3 1403 B7R0.4 CCCCCC(C)N MCULE-8625441795 [1,1,0,0,0,0|1,0,0]=3 1404 B7R0.4 CCCCCC(C)N MCULE-9791654909 [1,1,0,0,0,0|1,0,0]=3 1405 B7R0.4 CCCCCC(C)O MCULE-2463855771 [1,1,0,0,0,0|1,0,0]=3 1406 B7R0.4 CCCCCC(C)S MCULE-3173115736 [1,1,0,0,0,0|1,0,0]=3 1407 B7R0.4 CCCCC[C@@H](C)N MCULE-2460238945 [1,1,0,0,0,0|1,0,0]=3 1408 B7R0.4 CCCCC[C@@H](C)N MCULE-6386771130 [1,1,0,0,0,0|1,0,0]=3 1409 B7R0.4 CCCCC[C@@H](C)N MCULE-6470246577 [1,1,0,0,0,0|1,0,0]=3 1410 B7R0.4 CCCCC[C@@H](C)O MCULE-1984852239 [1,1,0,0,0,0|1,0,0]=3 1411 B7R0.4 CCCCC[C@@H](C)O MCULE-2769933740 [1,1,0,0,0,0|1,0,0]=3 1412 B7R0.4 CCCCC[C@H](C)N MCULE-8119988811 [1,1,0,0,0,0|1,0,0]=3 1413 B7R0.4 CCCCC[C@H](C)N MCULE-9987283826 [1,1,0,0,0,0|1,0,0]=3 1414 B7R0.4 CCCCC[C@H](C)O MCULE-2305379902 [1,1,0,0,0,0|1,0,0]=3 1415 B7R0.4 CCCCC[C@H](C)O MCULE-5898721044 [1,1,0,0,0,0|1,0,0]=3 1416 B7R0.4 CCCCNC(C)C MCULE-2695970517 [1,1,0,0,0,0|2,0,0]=4 1417 B7R0.4 CCCCNC(C)C MCULE-9973816117 [1,1,0,0,0,0|2,0,0]=4 1418 B7R0.4 CCCCOC(C)C MCULE-1504269570 [1,1,0,0,0,0|1,1,0]=4 1419 B7R0.4 CCCCSC(=O)C MCULE-2653182488 [1,1,0,0,0,0|1,0,1]=4 1420 B7R0.4 CCCNCC(C)C MCULE-2869656642 [1,1,0,0,0,0|1,0,0]=3 1421 B7R0.4 CCCNCC(C)O MCULE-8110237473 [1,1,0,0,0,0|1,0,0]=3 1422 B7R0.4 CCCNCC(F)F MCULE-5407680209 [1,1,0,0,0,0|2,0,0]=4 1423 B7R0.4 CCCNCC(F)F MCULE-9676670786 [1,1,0,0,0,0|2,0,0]=4 1424 B7R0.4 CCCOCC(C)O MCULE-9214840563 [1,1,0,0,0,0|0,1,0]=3 1425 B7R0.4 CCCSCC(=O)C MCULE-8321448629 [1,1,0,0,0,0|0,0,1]=3 1426 B7R0.4 CCCSCC(=O)O MCULE-7463688573 [1,1,0,0,0,0|1,0,1]=4 1427 B7R0.4 CCONCC(C)C MCULE-3595879270 [1,1,0,0,0,0|1,1,0]=4 1428 B7R0.4 CCONCC(C)C MCULE-6329996438 [1,1,0,0,0,0|1,1,0]=4 1429 B7R0.4 CCSCCC(C)N MCULE-6854502332 [1,1,0,0,0,0|1,0,0]=3 1430 B7R0.4 CNCCCC(C)C MCULE-1784678333 [1,1,0,0,0,0|2,0,0]=4 1431 B7R0.4 COCCCC(C)N MCULE-4298611846 [1,1,0,0,0,0|2,0,0]=4 1432 B7R0.4 COCCCC(C)N MCULE-8139434838 [1,1,0,0,0,0|2,0,0]=4 1433 B7R0.4 COCCCC(C)O MCULE-4190294636 [1,1,0,0,0,0|2,0,0]=4 1434 B7R0.4 NCCSCC(F)F MCULE-2643130155 [1,1,0,0,0,0|2,0,0]=4 1435 B7R0.7 C=C(CCC)CCO MCULE-1774943854 [1,1,0,0,0,0|2,0,0]=4 1436 B7R0.7 CCCC(=N)OCC MCULE-5551107242 [1,1,0,0,0,0|1,1,0]=4 1437 B7R0.7 CCCC(=N)OCC MCULE-7790310067 [1,1,0,0,0,0|1,1,0]=4 1438 B7R0.7 CCCC(=O)CCC MCULE-1621649928 [1,1,0,0,0,0|1,0,0]=3 1439 B7R0.7 CCCC(=O)OCC MCULE-9977024136 [1,1,0,0,0,0|1,1,0]=4 1440 B7R0.7 CCCC(Br)CCBr MCULE-7954993658 [1,1,0,0,0,0|2,0,0]=4 1441 B7R0.7 CCCC(Br)CCC MCULE-4124374663 [1,1,0,0,0,0|1,0,0]=3 1442 B7R0.7 CCCC(C)CCC MCULE-5291190768 [1,1,0,0,0,0|1,0,0]=3 1443 B7R0.7 CCCC(C)CCO MCULE-6887128167 [1,1,0,0,0,0|2,0,0]=4 1444 B7R0.7 CCCC(C)NCC MCULE-3443551812 [1,1,0,0,0,0|2,0,0]=4 1445 B7R0.7 CCCC(C)NCC MCULE-7227087576 [1,1,0,0,0,0|2,0,0]=4 1446 B7R0.7 CCCC(C)OCC MCULE-2678814077 [1,1,0,0,0,0|1,1,0]=4 1447 B7R0.7 CCCC(N)CCC MCULE-1003038397 [1,1,0,0,0,0|1,0,0]=3 1448 B7R0.7 CCCC(N)CCC MCULE-3454953409 [1,1,0,0,0,0|1,0,0]=3 1449 B7R0.7 CCCC(N)CCO MCULE-3641094890 [1,1,0,0,0,0|2,0,0]=4 1450 B7R0.7 CCCC(N)CCO MCULE-5323991138 [1,1,0,0,0,0|2,0,0]=4 1451 B7R0.7 CCCC(N)CCO MCULE-6597027417 [1,1,0,0,0,0|2,0,0]=4 1452 B7R0.7 CCCC(N)CCO MCULE-8093709628 [1,1,0,0,0,0|2,0,0]=4 1453 B7R0.7 CCCC(O)CCC MCULE-1942797307 [1,1,0,0,0,0|1,0,0]=3 1454 B7R0.7 CCCC(O)CCN MCULE-3796998426 [1,1,0,0,0,0|2,0,0]=4 1455 B7R0.7 CCCC(O)CCO MCULE-6957178966 [1,1,0,0,0,0|2,0,0]=4 1456 B7R0.7 CCCC(S)CCC MCULE-4775274873 [1,1,0,0,0,0|1,0,0]=3 1457 B7R0.7 CCCC(S)CCO MCULE-7972451905 [1,1,0,0,0,0|2,0,0]=4 1458 B7R0.7 CCCN(C)CCC MCULE-9743961087 [1,1,0,0,0,0|1,0,0]=3 1459 B7R0.7 CCC[C@@H](N)CCO MCULE-1862127512 [1,1,0,0,0,0|2,0,0]=4 1460 B7R0.7 CCC[C@@H](N)CCO MCULE-3031366486 [1,1,0,0,0,0|2,0,0]=4 1461 B7R0.7 CCC[C@@H](N)CCO MCULE-4433535200 [1,1,0,0,0,0|2,0,0]=4 1462 B7R0.7 CCC[C@@H](N)CCO MCULE-8325506694 [1,1,0,0,0,0|2,0,0]=4 1463 B7R0.7 CCC[C@H](N)CCO MCULE-3164100995 [1,1,0,0,0,0|2,0,0]=4 1464 B7R0.7 CCC[C@H](N)CCO MCULE-3262978007 [1,1,0,0,0,0|2,0,0]=4 1465 B7R0.7 CCC[C@H](N)CCO MCULE-3382311889 [1,1,0,0,0,0|2,0,0]=4 1466 B7R0.7 CCC[C@H](N)CCO MCULE-4865013919 [1,1,0,0,0,0|2,0,0]=4 1467 B7R0.7 CCOC(=S)SCC MCULE-9637505732 [1,1,0,0,0,0|2,0,0]=4 1468 B7R0.7 CCSC(=O)SCC MCULE-7783165279 [1,1,0,0,0,0|2,0,0]=4 1469 B9R0.4 CCCCC(=O)CC(C)C MCULE-5810585247 [0,2,0,0,0,0|2,0,0]=4 1470 B9R0.4 CCCCC(C)CC(C)C MCULE-5058808542 [0,2,0,0,0,0|2,0,0]=4 1471 B9R0.4 CCCCN(C)CC(C)N MCULE-1104627387 [0,2,0,0,0,0|2,0,0]=4 1472 B9R0.4 CCCCN(C)C[C@@H](C)N MCULE-4305813032 [0,2,0,0,0,0|2,0,0]=4 1473 B9R0.4 CCCCN(C)C[C@H](C)N MCULE-9350523814 [0,2,0,0,0,0|2,0,0]=4 1474 B9R0.4 CCCOC(=O)CC(C)C MCULE-5746319400 [0,2,0,0,0,0|1,1,0]=4 1475 B9R0.5 CCCC(=O)NCCSC MCULE-3226358337 [0,2,0,0,0,0|2,0,0]=4 1476 B9R0.5 CCCCCC(=O)CCC MCULE-5706146235 [0,2,0,0,0,0|2,0,0]=4 1477 B9R0.5 CCCCCC(C)CCBr MCULE-7502279942 [0,2,0,0,0,0|2,0,0]=4 1478 B9R0.5 CCCCCC(C)CCC MCULE-5749911992 [0,2,0,0,0,0|2,0,0]=4 1479 B9R0.5 CCCCCC(C)CCO MCULE-6787638248 [0,2,0,0,0,0|2,0,0]=4 1480 B9R0.5 CCCCCC(O)CCC MCULE-8117002289 [0,2,0,0,0,0|2,0,0]=4 1481 B9R0.5 CCCCCC(O)CCO MCULE-7307683143 [0,2,0,0,0,0|2,0,0]=4 1482 B9R0.5 CCCCNC(=O)CCC MCULE-7141834161 [0,2,0,0,0,0|2,0,0]=4 1483 B9R0.5 CCCCOC(=O)CCC MCULE-3979612740 [0,2,0,0,0,0|1,1,0]=4 1484 B9R0.5 CCCCOC(C)OCC MCULE-5544493274 [0,2,0,0,0,0|1,1,0]=4 1485 B9R0.5 CCCCSC(C)CCN MCULE-2976322552 [0,2,0,0,0,0|1,0,0]=3 1486 B9R0.8 CCCCC(=O)C(C)CC MCULE-4208435581 [0,2,0,0,0,0|2,0,0]=4 1487 B9R0.8 CCCCC(C)C(C)CC MCULE-4441142939 [0,2,0,0,0,0|2,0,0]=4 1488 B9R0.8 CCCNC(=O)C(Br)CC MCULE-3744702710 [0,2,0,0,0,0|2,0,0]=4 1489 B9R0.8 CCCNC(=O)C(N)CC MCULE-5211144002 [0,2,0,0,0,0|2,0,0]=4 1490 B9R0.8 CCCNC(=O)[C@@H](N)CC MCULE-5473492504 [0,2,0,0,0,0|2,0,0]=4 1491 B9R0.8 CCCNC(=O)[C@@H](N)CC MCULE-7680643292 [0,2,0,0,0,0|2,0,0]=4 1492 B9R0.8 CCCOC(=O)C(C)CC MCULE-6816621931 [0,2,0,0,0,0|1,1,0]=4 1493 B9R0.8 CCCOC(=O)C(Cl)CC MCULE-4551358042 [0,2,0,0,0,0|1,1,0]=4 1494 B9R0.18 CCCCC(=O)CCCC MCULE-6886826396 [0,2,0,0,0,0|2,0,0]=4 1495 B9R0.18 CCCCC(=O)OCCC MCULE-9801353359 [0,2,0,0,0,0|1,1,0]=4 1496 B9R0.18 CCCCC(C)CCCC MCULE-8127947187 [0,2,0,0,0,0|2,0,0]=4 1497 B9R0.18 CCCCC(N)CCCC MCULE-6345811578 [0,2,0,0,0,0|2,0,0]=4 1498 B9R0.18 CCCCC(O)CCCC MCULE-4443702940 [0,2,0,0,0,0|2,0,0]=4 1499 B9R0.18 CCCCC(O)CCCO MCULE-8337847504 [0,2,0,0,0,0|2,0,0]=4 1500 B9R0.18 CCCCN(C)CCCC MCULE-3403478694 [0,2,0,0,0,0|2,0,0]=4 1501 B9R0.18 CCCCN(C)CCCN MCULE-5569531246 [0,2,0,0,0,0|2,0,0]=4 1502 B9R0.18 CCCCP(=O)CCCC MCULE-5667541179 [0,2,0,0,0,0|2,0,0]=4 1503 B9R0.18 CCCCS(=O)CCCC MCULE-7738371145 [0,2,0,0,0,0|1,0,1]=4 1504 B9R0.18 CCCNC(=O)CCCCl MCULE-1473811039 [0,2,0,0,0,0|2,0,0]=4 1505 B9R0.18 CCCNC(=O)NCCC MCULE-6353018646 [0,2,0,0,0,0|2,0,0]=4 1506 B9R0.18 CCCNC(=S)NCCC MCULE-1162997436 [0,2,0,0,0,0|2,0,0]=4 1507 B9R0.18 CCCOC(=O)OCCC MCULE-9166999585 [0,2,0,0,0,0|0,2,0]=4 1508 B9R0.18 CCCOC(C)OCCC MCULE-5937479015 [0,2,0,0,0,0|0,2,0]=4 1509 B9R0.18 CCCOP(O)OCCC MCULE-5332440386 [0,2,0,0,0,0|0,2,0]=4 1510 B9R0.18 CCCOS(=O)OCCC MCULE-3361401597 [0,2,0,0,0,0|0,1,1]=4 1511 B9R0.34 CCCC(=O)OC(C)CC MCULE-2445269271 [0,2,0,0,0,0|1,1,0]=4 1512 B9R0.34 CCCC(C)CC(C)CC MCULE-6332739976 [0,2,0,0,0,0|2,0,0]=4 1513 B9R0.35 CCCC(=O)C(O)CCC MCULE-8800884172 [0,2,0,0,0,0|2,0,0]=4 1514 B9R0.35 CCCC(C)C(C)CCC MCULE-6352331898 [0,2,0,0,0,0|2,0,0]=4 1515 B9R0.35 CCCC(C)C(O)CCC MCULE-9443004795 [0,2,0,0,0,0|2,0,0]=4 1516 B9R0.40 CCCCC(C=O)CCC MCULE-8456289921 [0,2,0,0,0,0|2,0,0]=4 1517 B9R0.40 CCCCC(CN)CCC MCULE-6624177155 [0,2,0,0,0,0|2,0,0]=4 1518 B9R0.48 CCCC(=O)OCC(C)C MCULE-5762939087 [0,2,0,0,0,0|1,1,0]=4 1519 B9R0.66 CCCCC(C)(C)CCC MCULE-2470156995 [0,2,0,0,0,0|2,0,0]=4 1520 B9R0.66 CCCSS(=O)(=O)CCC MCULE-5698313917 [0,2,0,0,0,0|0,0,1]=3 1521 B9R0.2 C=C(C)CCCCCCC MCULE-6074571960 [0,2,0,0,0,0|2,0,0]=4 1522 B9R0.2 CC(C)CCCCCCBr MCULE-1608789467 [0,2,0,0,0,0|2,0,0]=4 1523 B9R0.2 CC(C)CCCCCCN MCULE-5169278674 [0,2,0,0,0,0|2,0,0]=4 1524 B9R0.2 CC(C)CCCCCCO MCULE-1311865208 [0,2,0,0,0,0|2,0,0]=4 1525 B9R0.2 CC(C)CCOCCCN MCULE-8121420339 [0,2,0,0,0,0|1,1,0]=4 1526 B9R0.2 CC(C)CSCCCCN MCULE-2450122241 [0,2,0,0,0,0|1,0,0]=3 1527 B9R0.2 CCCCCCCC(=O)C MCULE-9635928766 [0,2,0,0,0,0|2,0,0]=4 1528 B9R0.2 CCCCCCCC(C)Br MCULE-1086603851 [0,2,0,0,0,0|2,0,0]=4 1529 B9R0.2 CCCCCCCC(C)C MCULE-6606361985 [0,2,0,0,0,0|2,0,0]=4 1530 B9R0.2 CCCCCCCC(C)N MCULE-7510062756 [0,2,0,0,0,0|2,0,0]=4 1531 B9R0.2 CCCCCCCC(C)O MCULE-5218382339 [0,2,0,0,0,0|2,0,0]=4 1532 B9R0.2 CCCCCCCN(C)C MCULE-8135887454 [0,2,0,0,0,0|2,0,0]=4 1533 B9R0.2 CCCCCCC[C@@H](C)N MCULE-4735169409 [0,2,0,0,0,0|2,0,0]=4 1534 B9R0.2 CCCCCCC[C@H](C)O MCULE-6211597611 [0,2,0,0,0,0|2,0,0]=4 1535 B9R0.2 CCCCSCCC(=O)O MCULE-7414288717 [0,2,0,0,0,0|1,0,1]=4 1536 B9R0.2 CCCNCCCN(C)C MCULE-7614476673 [0,2,0,0,0,0|2,0,0]=4 1537 B9R0.2 CCCSCCCC(=O)O MCULE-9850452520 [0,2,0,0,0,0|1,0,1]=4 1538 B9R0.2 CCOCCOCC(C)O MCULE-4621055001 [0,2,0,0,0,0|1,1,0]=4 1539 B9R0.2 NCCSSCCC(=O)O MCULE-2378332819 [0,2,0,0,0,0|1,0,1]=4 1540 B9R0.2 NCCSSCCC(=O)O MCULE-4249865017 [0,2,0,0,0,0|1,0,1]=4 1541 B9R0.45 BrCCCCCCCCBr MCULE-7960475988 [0,2,0,0,0,0|2,0,0]=4 1542 B9R0.45 C#CCCCCCCCC MCULE-3452683648 [0,2,0,0,0,0|2,0,0]=4 1543 B9R0.45 C=CCCCCCCCC MCULE-1391753135 [0,2,0,0,0,0|2,0,0]=4 1544 B9R0.45 CC#CCCCCCCC MCULE-9888604196 [0,2,0,0,0,0|2,0,0]=4 1545 B9R0.45 CC=CCCCCCCC MCULE-6461098537 [0,2,0,0,0,0|2,0,0]=4 1546 B9R0.45 CCC#CCCCCCC MCULE-2394718279 [0,2,0,0,0,0|2,0,0]=4 1547 B9R0.45 CCCC#CC#CCCC MCULE-6690888620 [0,2,0,0,0,0|2,0,0]=4 1548 B9R0.45 CCCC#CCCCCC MCULE-7200051907 [0,2,0,0,0,0|2,0,0]=4 1549 B9R0.45 CCCC/C=C/CCCC MCULE-5215613168 [0,2,0,0,0,0|2,0,0]=4 1550 B9R0.45 CCCC/C=C\CCCC MCULE-7961413462 [0,2,0,0,0,0|2,0,0]=4 1551 B9R0.45 CCCCC#CCCCC MCULE-8619108623 [0,2,0,0,0,0|2,0,0]=4 1552 B9R0.45 CCCCC#CCCCCl MCULE-2340213018 [0,2,0,0,0,0|2,0,0]=4 1553 B9R0.45 CCCCC#CCCCO MCULE-1298739911 [0,2,0,0,0,0|2,0,0]=4 1554 B9R0.45 CCCCC=CCCCC MCULE-4261429100 [0,2,0,0,0,0|2,0,0]=4 1555 B9R0.45 CCCCCCCCC#N MCULE-9980153452 [0,2,0,0,0,0|2,0,0]=4 1556 B9R0.45 CCCCCCCCC=O MCULE-9888879952 [0,2,0,0,0,0|2,0,0]=4 1557 B9R0.45 CCCCCCCCCBr MCULE-1405697483 [0,2,0,0,0,0|2,0,0]=4 1558 B9R0.45 CCCCCCCCCC MCULE-6071426098 [0,2,0,0,0,0|2,0,0]=4 1559 B9R0.45 CCCCCCCCCCl MCULE-6711902685 [0,2,0,0,0,0|2,0,0]=4 1560 B9R0.45 CCCCCCCCCF MCULE-9584148452 [0,2,0,0,0,0|2,0,0]=4 1561 B9R0.45 CCCCCCCCCI MCULE-8717337450 [0,2,0,0,0,0|2,0,0]=4 1562 B9R0.45 CCCCCCCCCN MCULE-5395407299 [0,2,0,0,0,0|2,0,0]=4 1563 B9R0.45 CCCCCCCCCO MCULE-4020281400 [0,2,0,0,0,0|2,0,0]=4 1564 B9R0.45 CCCCCCCCCS MCULE-1070515106 [0,2,0,0,0,0|2,0,0]=4 1565 B9R0.45 CCCCCCCCNC MCULE-6996288442 [0,2,0,0,0,0|2,0,0]=4 1566 B9R0.45 CCCCCCCCOC MCULE-4646070035 [0,2,0,0,0,0|2,0,0]=4 1567 B9R0.45 CCCCCCCCSC MCULE-5517176664 [0,2,0,0,0,0|2,0,0]=4 1568 B9R0.45 CCCCCCCNCC MCULE-3055645322 [0,2,0,0,0,0|2,0,0]=4 1569 B9R0.45 CCCCCCNCCN MCULE-2521807905 [0,2,0,0,0,0|2,0,0]=4 1570 B9R0.45 CCCCCCNCCN MCULE-5886608711 [0,2,0,0,0,0|2,0,0]=4 1571 B9R0.45 CCCCCCNCCO MCULE-6828996225 [0,2,0,0,0,0|2,0,0]=4 1572 B9R0.45 CCCCCCNOCC MCULE-7230044709 [0,2,0,0,0,0|2,0,0]=4 1573 B9R0.45 CCCCCCNOCC MCULE-8309226243 [0,2,0,0,0,0|2,0,0]=4 1574 B9R0.45 CCCCCCOCCCl MCULE-5675234570 [0,2,0,0,0,0|2,0,0]=4 1575 B9R0.45 CCCCCCOCCO MCULE-1339769602 [0,2,0,0,0,0|2,0,0]=4 1576 B9R0.45 CCCCCCSCCO MCULE-3331753796 [0,2,0,0,0,0|2,0,0]=4 1577 B9R0.45 CCCCCNCCCC MCULE-4324738465 [0,2,0,0,0,0|2,0,0]=4 1578 B9R0.45 CCCCCNCCNC MCULE-3521145032 [0,2,0,0,0,0|2,0,0]=4 1579 B9R0.45 CCCCCOCCCO MCULE-3048029561 [0,2,0,0,0,0|1,1,0]=4 1580 B9R0.45 CCCCNCCCCO MCULE-1748671401 [0,2,0,0,0,0|2,0,0]=4 1581 B9R0.45 CCCCNCCOCC MCULE-5585133594 [0,2,0,0,0,0|2,0,0]=4 1582 B9R0.45 CCCCOCCCCO MCULE-1926189258 [0,2,0,0,0,0|1,1,0]=4 1583 B9R0.45 CCCCSCCOCC MCULE-4700764338 [0,2,0,0,0,0|1,0,0]=3 1584 B9R0.45 CCCCSSCCCC MCULE-5887157893 [0,2,0,0,0,0|0,0,0]=2 1585 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2045714641 [0,2,0,0,0,0|2,0,0]=4 1586 B9R0.45 CCCC[NH2+]CCCCCl MCULE-2222567485 [0,2,0,0,0,0|2,0,0]=4 1587 B9R0.45 CCCNCCCNCC MCULE-1018165528 [0,2,0,0,0,0|2,0,0]=4 1588 B9R0.45 CCCNCCNCCC MCULE-7703644113 [0,2,0,0,0,0|2,0,0]=4 1589 B9R0.45 CCCNCCOCCO MCULE-9598749389 [0,2,0,0,0,0|2,0,0]=4 1590 B9R0.45 CCCOCCOCCCl MCULE-1639946093 [0,2,0,0,0,0|1,1,0]=4 1591 B9R0.45 CCCOCCOCCO MCULE-8416880348 [0,2,0,0,0,0|1,1,0]=4 1592 B9R0.45 CCNCC#CCNCC MCULE-2555047297 [0,2,0,0,0,0|2,0,0]=4 1593 B9R0.45 CCNCC=CCNCC MCULE-8435967986 [0,2,0,0,0,0|2,0,0]=4 1594 B9R0.45 CCNCCOCCOC MCULE-7366180249 [0,2,0,0,0,0|1,1,0]=4 1595 B9R0.45 CCOCCCCOCC MCULE-5008558328 [0,2,0,0,0,0|2,0,0]=4 1596 B9R0.45 CCOCCOCCNC MCULE-9368096258 [0,2,0,0,0,0|1,1,0]=4 1597 B9R0.45 CCOCCOCCOC MCULE-8877803293 [0,2,0,0,0,0|1,1,0]=4 1598 B9R0.45 CCSCCCCSCC MCULE-9432415547 [0,2,0,0,0,0|2,0,0]=4 1599 B9R0.45 CNCCCCCCNC MCULE-8440815147 [0,2,0,0,0,0|2,0,0]=4 1600 B9R0.45 CNCCCNCCCO MCULE-9778642064 [0,2,0,0,0,0|2,0,0]=4 1601 B9R0.45 CNCCCNCCOC MCULE-3649953785 [0,2,0,0,0,0|2,0,0]=4 1602 B9R0.45 CNCCOCCCOC MCULE-5420619528 [0,2,0,0,0,0|1,1,0]=4 1603 B9R0.45 CNCCSSCCNC MCULE-2429624269 [0,2,0,0,0,0|0,0,0]=2 1604 B9R0.45 CNCCSSCCNC MCULE-5017829129 [0,2,0,0,0,0|0,0,0]=2 1605 B9R0.45 CNCCSSCCNC MCULE-6816320273 [0,2,0,0,0,0|0,0,0]=2 1606 B9R0.45 COCCCCCCOC MCULE-8796987038 [0,2,0,0,0,0|2,0,0]=4 1607 B9R0.45 COCCCNCCCN MCULE-2970161939 [0,2,0,0,0,0|2,0,0]=4 1608 B9R0.45 COCCCNCCOC MCULE-6284699375 [0,2,0,0,0,0|2,0,0]=4 1609 B9R0.45 COCCCOCCCO MCULE-6516268580 [0,2,0,0,0,0|1,1,0]=4 1610 B9R0.45 COCCNCCCCO MCULE-8413188192 [0,2,0,0,0,0|2,0,0]=4 1611 B9R0.45 COCCOCCCCN MCULE-3477207788 [0,2,0,0,0,0|1,1,0]=4 1612 B9R0.45 ClCCCCCCCCCl MCULE-7522868799 [0,2,0,0,0,0|2,0,0]=4 1613 B9R0.45 ICCCCCCCCI MCULE-6544838106 [0,2,0,0,0,0|2,0,0]=4 1614 B9R0.45 N#CCCSSCCC#N MCULE-7136632942 [0,2,0,0,0,0|0,0,2]=4 1615 B9R0.45 N#N=NCCSSCCN MCULE-3347434775 [0,2,0,0,0,0|2,0,0]=4 1616 B9R0.45 N#N=NCCSSCCO MCULE-6409044088 [0,2,0,0,0,0|2,0,0]=4 1617 B9R0.45 NCCCCCCCCBr MCULE-6623783968 [0,2,0,0,0,0|2,0,0]=4 1618 B9R0.45 NCCCCCCCCBr MCULE-9911947498 [0,2,0,0,0,0|2,0,0]=4 1619 B9R0.45 NCCCCCCCCN MCULE-1106731228 [0,2,0,0,0,0|2,0,0]=4 1620 B9R0.45 NCCCCCCCCN MCULE-9889097856 [0,2,0,0,0,0|2,0,0]=4 1621 B9R0.45 NCCCCCCCCO MCULE-1230018398 [0,2,0,0,0,0|2,0,0]=4 1622 B9R0.45 NCCCCNCCCN MCULE-1390030323 [0,2,0,0,0,0|2,0,0]=4 1623 B9R0.45 NCCCCNCCCN MCULE-4146689208 [0,2,0,0,0,0|2,0,0]=4 1624 B9R0.45 NCCCCNCCCN MCULE-4688641416 [0,2,0,0,0,0|2,0,0]=4 1625 B9R0.45 NCCCCNCCCN MCULE-6635730810 [0,2,0,0,0,0|2,0,0]=4 1626 B9R0.45 NCCCCNCCCN MCULE-8096530192 [0,2,0,0,0,0|2,0,0]=4 1627 B9R0.45 NCCCSSCCCN MCULE-8001928940 [0,2,0,0,0,0|0,0,0]=2 1628 B9R0.45 NCCCSSCCCN MCULE-8970942490 [0,2,0,0,0,0|0,0,0]=2 1629 B9R0.45 OCCCCCCCCBr MCULE-2005797184 [0,2,0,0,0,0|2,0,0]=4 1630 B9R0.45 OCCCCCCCCCl MCULE-8776830410 [0,2,0,0,0,0|2,0,0]=4 1631 B9R0.45 OCCCCCCCCI MCULE-7793639517 [0,2,0,0,0,0|2,0,0]=4 1632 B9R0.45 OCCCCCCCCO MCULE-7897417838 [0,2,0,0,0,0|2,0,0]=4 1633 B9R0.45 OCCCCCCCCS MCULE-8372814979 [0,2,0,0,0,0|2,0,0]=4 1634 B9R0.45 OCCCSSCCCO MCULE-9381854953 [0,2,0,0,0,0|0,0,0]=2 1635 B9R0.45 OCCSCCSCCO MCULE-4836365698 [0,2,0,0,0,0|2,0,0]=4 1636 B9R0.45 SCCCCCCCCS MCULE-5325130158 [0,2,0,0,0,0|2,0,0]=4 1637 B9R0.45 SCCSCCSCCS MCULE-3731117649 [0,2,0,0,0,0|2,0,0]=4 1638 B9R0.45 [NH2+](CCCC)CCCCC MCULE-5314318531 [0,2,0,0,0,0|2,0,0]=4 1639 B9R0.46 CCC(C)CCCCCO MCULE-2502680966 [0,2,0,0,0,0|2,0,0]=4 1640 B9R0.46 CCC(C)NCCCNC MCULE-3630027564 [0,2,0,0,0,0|2,0,0]=4 1641 B9R0.46 CCCCCCC(=O)CC MCULE-6606139631 [0,2,0,0,0,0|2,0,0]=4 1642 B9R0.46 CCCCCCC(Br)CBr MCULE-3379995276 [0,2,0,0,0,0|2,0,0]=4 1643 B9R0.46 CCCCCCC(C)C#N MCULE-9341747817 [0,2,0,0,0,0|2,0,0]=4 1644 B9R0.46 CCCCCCC(C)C=O MCULE-4073561137 [0,2,0,0,0,0|2,0,0]=4 1645 B9R0.46 CCCCCCC(C)CBr MCULE-4123455914 [0,2,0,0,0,0|2,0,0]=4 1646 B9R0.46 CCCCCCC(C)CC MCULE-3624776298 [0,2,0,0,0,0|2,0,0]=4 1647 B9R0.46 CCCCCCC(C)CO MCULE-7202468291 [0,2,0,0,0,0|2,0,0]=4 1648 B9R0.46 CCCCCCC(C)NN MCULE-7546667258 [0,2,0,0,0,0|2,0,0]=4 1649 B9R0.46 CCCCCCC(C)NN MCULE-9220046974 [0,2,0,0,0,0|2,0,0]=4 1650 B9R0.46 CCCCCCC(Cl)CCl MCULE-7909703582 [0,2,0,0,0,0|2,0,0]=4 1651 B9R0.46 CCCCCCC(O)CBr MCULE-4248488641 [0,2,0,0,0,0|2,0,0]=4 1652 B9R0.46 CCCCCCC(O)CC MCULE-7543978401 [0,2,0,0,0,0|2,0,0]=4 1653 B9R0.46 CCCCCCC(O)CO MCULE-7396593748 [0,2,0,0,0,0|2,0,0]=4 1654 B9R0.46 CCCCCC[C@@H](O)CO MCULE-9540453574 [0,2,0,0,0,0|2,0,0]=4 1655 B9R0.46 CCCCCC[C@H](O)CO MCULE-8481484883 [0,2,0,0,0,0|2,0,0]=4 1656 B9R0.46 CCCCOCC(O)CC MCULE-2411357752 [0,2,0,0,0,0|1,1,0]=4 1657 B9R0.46 CCCCOCC(O)CCl MCULE-6855689044 [0,2,0,0,0,0|1,1,0]=4 1658 B9R0.46 CCCCOCC(O)CN MCULE-1971283908 [0,2,0,0,0,0|1,1,0]=4 1659 B9R0.46 CCCCOCC(O)CO MCULE-8662748140 [0,2,0,0,0,0|1,1,0]=4 1660 B9R0.46 CCCCSCC(=O)OC MCULE-1208944064 [0,2,0,0,0,0|1,0,1]=4 1661 B9R0.46 CCCCSCC(O)CO MCULE-8665487683 [0,2,0,0,0,0|1,0,0]=3 1662 B9R0.46 CC[C@H](C)CCCCCO MCULE-2345749211 [0,2,0,0,0,0|2,0,0]=4 1663 B9R0.46 CC[C@H](C)CCCCCO MCULE-9450083737 [0,2,0,0,0,0|2,0,0]=4 1664 B9R0.46 COC(=O)CSSCCO MCULE-3590920745 [0,2,0,0,0,0|1,0,1]=4 1665 B9R0.1 CCC(C)CCCC(C)C MCULE-1067814067 [0,2,0,0,0,0|2,0,0]=4 1666 B9R0.20 CCCCCC(C)(C)CC MCULE-1624392380 [0,2,0,0,0,0|2,0,0]=4 1667 B9R0.20 CCCCCC(C)(O)CC MCULE-1815029739 [0,2,0,0,0,0|2,0,0]=4 1668 B9R0.24 CC(CN)SSC(C)CN MCULE-8738567618 [0,2,0,0,0,0|2,0,0]=4 1669 B9R0.24 CC(C[NH3+])SSC(C)C[NH3+] MCULE-9106167822 [0,2,0,0,0,0|2,0,0]=4 1670 B9R0.24 CCC(C)SSC(C)CC MCULE-6317169760 [0,2,0,0,0,0|0,0,0]=2 1671 B9R0.24 CCC(O)CCC(O)CC MCULE-1642680986 [0,2,0,0,0,0|2,0,0]=4 1672 B9R0.24 CC[C@@H](O)CC[C@H](O)CC MCULE-1865073881 [0,2,0,0,0,0|2,0,0]=4 1673 B9R0.24 CC[C@@H](O)CC[C@H](O)CC MCULE-3722023249 [0,2,0,0,0,0|2,0,0]=4 1674 B9R0.24 CC[C@H](O)CC[C@@H](O)CC MCULE-2960364022 [0,2,0,0,0,0|2,0,0]=4 1675 B9R0.24 CC[C@H](O)CC[C@@H](O)CC MCULE-6575186172 [0,2,0,0,0,0|2,0,0]=4 1676 B9R0.47 CCCCCC(C)C(C)C MCULE-2636833283 [0,2,0,0,0,0|2,0,0]=4 1677 B9R0.47 CCCCCC(Cl)C(C)Cl MCULE-3130271642 [0,2,0,0,0,0|2,0,0]=4 1678 B9R0.47 CCCCCC(O)C(C)C MCULE-1365333754 [0,2,0,0,0,0|2,0,0]=4 1679 B9R0.47 CCCOCC(N)C(C)C MCULE-6320176513 [0,2,0,0,0,0|1,1,0]=4 1680 B9R0.47 CCCOCC(N)C(C)C MCULE-7805441914 [0,2,0,0,0,0|1,1,0]=4 1681 B9R0.50 CCCCCC(C=O)CC MCULE-2036961521 [0,2,0,0,0,0|2,0,0]=4 1682 B9R0.50 CCCCCC(CC)CC MCULE-6306174845 [0,2,0,0,0,0|2,0,0]=4 1683 B9R0.38 CCCCCCC(C)(C)C MCULE-9273320974 [0,2,0,0,0,0|2,0,0]=4 1684 B9R0.38 CCCCCCC(C)(C)O MCULE-4930467845 [0,2,0,0,0,0|2,0,0]=4 1685 B9R0.38 CCCCCCC(C)(C)S MCULE-9664015973 [0,2,0,0,0,0|2,0,0]=4 1686 B9R0.55 CC(C)CCCCC(C)C MCULE-2916402516 [0,2,0,0,0,0|2,0,0]=4 1687 B9R0.55 CC(C)CSSCC(C)C MCULE-4516632846 [0,2,0,0,0,0|0,0,0]=2 1688 B9R0.55 CC(N)CCCCC(C)N MCULE-6403395102 [0,2,0,0,0,0|2,0,0]=4 1689 B7R1.1 BrCC1CCCC1 MCULE-2472505847 [1,0,0,1,0,0|2,0,0]=4 1690 B7R1.1 BrCC1CCCN1 MCULE-2152950124 [1,0,0,1,0,0|2,0,0]=4 1691 B7R1.1 BrCC1CCCN1 MCULE-6083580584 [1,0,0,1,0,0|2,0,0]=4 1692 B7R1.1 BrCC1CCCN1 MCULE-8116807965 [1,0,0,1,0,0|2,0,0]=4 1693 B7R1.1 BrCC1CCCO1 MCULE-6801721633 [1,0,0,1,0,0|1,1,0]=4 1694 B7R1.1 BrC[C@@H]1CCCN1 MCULE-2609238545 [1,0,0,1,0,0|2,0,0]=4 1695 B7R1.1 BrC[C@@H]1CCCN1 MCULE-4300877722 [1,0,0,1,0,0|2,0,0]=4 1696 B7R1.1 BrC[C@@H]1CCCN1 MCULE-7501559292 [1,0,0,1,0,0|2,0,0]=4 1697 B7R1.1 BrC[C@@H]1CCCN1 MCULE-9528927495 [1,0,0,1,0,0|2,0,0]=4 1698 B7R1.1 BrC[C@H]1CCCO1 MCULE-3468061610 [1,0,0,1,0,0|1,1,0]=4 1699 B7R1.1 BrC[C@H]1CCCO1 MCULE-9305844681 [1,0,0,1,0,0|1,1,0]=4 1700 B7R1.1 C1(CCCN1)CF MCULE-2705678622 [1,0,0,1,0,0|2,0,0]=4 1701 B7R1.1 C1(CCCN1)CF MCULE-3175080744 [1,0,0,1,0,0|2,0,0]=4 1702 B7R1.1 C1(CCCN1)CN MCULE-3568349121 [1,0,0,1,0,0|2,0,0]=4 1703 B7R1.1 C1(CCCN1)CN MCULE-9944820727 [1,0,0,1,0,0|2,0,0]=4 1704 B7R1.1 C1(CCCN1)CO MCULE-7277085817 [1,0,0,1,0,0|2,0,0]=4 1705 B7R1.1 C1(CCNC1)CC MCULE-1733412139 [1,0,0,1,0,0|2,0,0]=4 1706 B7R1.1 C1(CCNC1)CC MCULE-9295480110 [1,0,0,1,0,0|2,0,0]=4 1707 B7R1.1 CCC1=CCCC1 MCULE-5154730597 [1,0,0,1,0,0|1,0,1]=4 1708 B7R1.1 CCC1CCCC1 MCULE-1974854934 [1,0,0,1,0,0|1,0,0]=3 1709 B7R1.1 CCC1CCCN1 MCULE-1775351089 [1,0,0,1,0,0|1,0,0]=3 1710 B7R1.1 CCC1CCCN1 MCULE-2065682250 [1,0,0,1,0,0|1,0,0]=3 1711 B7R1.1 CCC1CCCN1 MCULE-8326168982 [1,0,0,1,0,0|1,0,0]=3 1712 B7R1.1 CCC1CCCN1 MCULE-9831560442 [1,0,0,1,0,0|1,0,0]=3 1713 B7R1.1 CCC1CCNC1 MCULE-1558031098 [1,0,0,1,0,0|2,0,0]=4 1714 B7R1.1 CCC1CCNC1 MCULE-1877930466 [1,0,0,1,0,0|2,0,0]=4 1715 B7R1.1 CCC1OCCO1 MCULE-3434568584 [1,0,0,1,0,0|1,1,0]=4 1716 B7R1.1 CCN1CCCC1 MCULE-3590039255 [1,0,0,1,0,0|2,0,0]=4 1717 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [1,0,0,1,0,0|1,0,0]=3 1718 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [1,0,0,1,0,0|1,0,0]=3 1719 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [1,0,0,1,0,0|1,0,0]=3 1720 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [1,0,0,1,0,0|1,0,0]=3 1721 B7R1.1 CC[C@@H]1CCNC1 MCULE-1468303255 [1,0,0,1,0,0|2,0,0]=4 1722 B7R1.1 CC[C@@H]1CCNC1 MCULE-2434021547 [1,0,0,1,0,0|2,0,0]=4 1723 B7R1.1 CC[C@@H]1CCNC1 MCULE-4288710106 [1,0,0,1,0,0|2,0,0]=4 1724 B7R1.1 CC[C@@H]1CCNC1 MCULE-5295271815 [1,0,0,1,0,0|2,0,0]=4 1725 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [1,0,0,1,0,0|1,0,0]=3 1726 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [1,0,0,1,0,0|1,0,0]=3 1727 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [1,0,0,1,0,0|1,0,0]=3 1728 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [1,0,0,1,0,0|1,0,0]=3 1729 B7R1.1 CC[C@H]1CCNC1 MCULE-5122116015 [1,0,0,1,0,0|2,0,0]=4 1730 B7R1.1 CC[C@H]1CCNC1 MCULE-5302237772 [1,0,0,1,0,0|2,0,0]=4 1731 B7R1.1 CC[C@H]1CCNC1 MCULE-9447387540 [1,0,0,1,0,0|2,0,0]=4 1732 B7R1.1 CC[C@H]1CCNC1 MCULE-9743799071 [1,0,0,1,0,0|2,0,0]=4 1733 B7R1.1 CNC1CCCC1 MCULE-1391832163 [1,0,0,1,0,0|2,0,0]=4 1734 B7R1.1 CNC1CCCC1 MCULE-8242451793 [1,0,0,1,0,0|2,0,0]=4 1735 B7R1.1 CNC1CCSC1 MCULE-1603222229 [1,0,0,1,0,0|2,0,0]=4 1736 B7R1.1 CNC1CCSC1 MCULE-5376977039 [1,0,0,1,0,0|2,0,0]=4 1737 B7R1.1 CNC1CCSC1 MCULE-9789640029 [1,0,0,1,0,0|2,0,0]=4 1738 B7R1.1 COC1CCCC1 MCULE-7539347010 [1,0,0,1,0,0|2,0,0]=4 1739 B7R1.1 COC1CCCO1 MCULE-8363423240 [1,0,0,1,0,0|1,1,0]=4 1740 B7R1.1 ClCC1CCCC1 MCULE-7652893931 [1,0,0,1,0,0|2,0,0]=4 1741 B7R1.1 ClCC1CCCN1 MCULE-3656101962 [1,0,0,1,0,0|2,0,0]=4 1742 B7R1.1 ClCC1CCCN1 MCULE-9792407426 [1,0,0,1,0,0|2,0,0]=4 1743 B7R1.1 ClCC1CCCO1 MCULE-9816764842 [1,0,0,1,0,0|1,1,0]=4 1744 B7R1.1 ClC[C@@H]1CCCN1 MCULE-1712418178 [1,0,0,1,0,0|2,0,0]=4 1745 B7R1.1 ClC[C@@H]1CCCN1 MCULE-2092217865 [1,0,0,1,0,0|2,0,0]=4 1746 B7R1.1 ClC[C@@H]1CCCN1 MCULE-4473753787 [1,0,0,1,0,0|2,0,0]=4 1747 B7R1.1 ClC[C@@H]1CCCN1 MCULE-9545872560 [1,0,0,1,0,0|2,0,0]=4 1748 B7R1.1 ClC[C@H]1CCCN1 MCULE-1186865731 [1,0,0,1,0,0|2,0,0]=4 1749 B7R1.1 ClC[C@H]1CCCN1 MCULE-3107383611 [1,0,0,1,0,0|2,0,0]=4 1750 B7R1.1 FCC1CCCN1 MCULE-3216030316 [1,0,0,1,0,0|2,0,0]=4 1751 B7R1.1 FCC1CCCN1 MCULE-4540803550 [1,0,0,1,0,0|2,0,0]=4 1752 B7R1.1 FC[C@@H]1CCCN1 MCULE-2463314208 [1,0,0,1,0,0|2,0,0]=4 1753 B7R1.1 FC[C@@H]1CCCN1 MCULE-3740139569 [1,0,0,1,0,0|2,0,0]=4 1754 B7R1.1 FC[C@@H]1CCCN1 MCULE-6899304468 [1,0,0,1,0,0|2,0,0]=4 1755 B7R1.1 FC[C@@H]1CCCN1 MCULE-9916936373 [1,0,0,1,0,0|2,0,0]=4 1756 B7R1.1 FC[C@H]1CCCN1 MCULE-1380365453 [1,0,0,1,0,0|2,0,0]=4 1757 B7R1.1 FC[C@H]1CCCN1 MCULE-1512160666 [1,0,0,1,0,0|2,0,0]=4 1758 B7R1.1 FC[C@H]1CCCN1 MCULE-2904385734 [1,0,0,1,0,0|2,0,0]=4 1759 B7R1.1 FC[C@H]1CCCN1 MCULE-9837641384 [1,0,0,1,0,0|2,0,0]=4 1760 B7R1.1 ICC1CCCC1 MCULE-5940886897 [1,0,0,1,0,0|2,0,0]=4 1761 B7R1.1 ICC1CCCN1 MCULE-3467617934 [1,0,0,1,0,0|2,0,0]=4 1762 B7R1.1 ICC1CCCN1 MCULE-7784862806 [1,0,0,1,0,0|2,0,0]=4 1763 B7R1.1 ICC1CCCO1 MCULE-3981288245 [1,0,0,1,0,0|1,1,0]=4 1764 B7R1.1 IC[C@@H]1CCCN1 MCULE-4843756038 [1,0,0,1,0,0|2,0,0]=4 1765 B7R1.1 IC[C@@H]1CCCN1 MCULE-8213667136 [1,0,0,1,0,0|2,0,0]=4 1766 B7R1.1 N#CC1CCCS1 MCULE-6372148360 [1,0,0,1,0,0|1,0,1]=4 1767 B7R1.1 NCC1CCCC1 MCULE-3629796849 [1,0,0,1,0,0|2,0,0]=4 1768 B7R1.1 NCC1CCCC1 MCULE-8453900433 [1,0,0,1,0,0|2,0,0]=4 1769 B7R1.1 NCC1CCCN1 MCULE-4764684364 [1,0,0,1,0,0|2,0,0]=4 1770 B7R1.1 NCC1CCCN1 MCULE-8971980286 [1,0,0,1,0,0|2,0,0]=4 1771 B7R1.1 NCC1CCCO1 MCULE-2797516262 [1,0,0,1,0,0|1,1,0]=4 1772 B7R1.1 NCC1CCCO1 MCULE-5970677903 [1,0,0,1,0,0|1,1,0]=4 1773 B7R1.1 NCC1CCCO1 MCULE-6166235034 [1,0,0,1,0,0|1,1,0]=4 1774 B7R1.1 NCC1CCCS1 MCULE-5278325816 [1,0,0,1,0,0|1,0,0]=3 1775 B7R1.1 NCC1CCSC1 MCULE-6868901477 [1,0,0,1,0,0|2,0,0]=4 1776 B7R1.1 NCC1SCCS1 MCULE-1964630168 [1,0,0,1,0,0|2,0,0]=4 1777 B7R1.1 NCC1SCCS1 MCULE-6937478627 [1,0,0,1,0,0|2,0,0]=4 1778 B7R1.1 NC[C@@H]1CCCN1 MCULE-4726727563 [1,0,0,1,0,0|2,0,0]=4 1779 B7R1.1 NC[C@@H]1CCCN1 MCULE-7513400460 [1,0,0,1,0,0|2,0,0]=4 1780 B7R1.1 NC[C@@H]1CCCN1 MCULE-7622329174 [1,0,0,1,0,0|2,0,0]=4 1781 B7R1.1 NC[C@@H]1CCCN1 MCULE-8573395464 [1,0,0,1,0,0|2,0,0]=4 1782 B7R1.1 NC[C@@H]1CCCO1 MCULE-1103643839 [1,0,0,1,0,0|1,1,0]=4 1783 B7R1.1 NC[C@@H]1CCCO1 MCULE-1402571993 [1,0,0,1,0,0|1,1,0]=4 1784 B7R1.1 NC[C@@H]1CCCO1 MCULE-1448381041 [1,0,0,1,0,0|1,1,0]=4 1785 B7R1.1 NC[C@@H]1CCCO1 MCULE-6664501749 [1,0,0,1,0,0|1,1,0]=4 1786 B7R1.1 NC[C@H]1CCCN1 MCULE-2813912286 [1,0,0,1,0,0|2,0,0]=4 1787 B7R1.1 NC[C@H]1CCCN1 MCULE-5505144820 [1,0,0,1,0,0|2,0,0]=4 1788 B7R1.1 NC[C@H]1CCCN1 MCULE-7325312327 [1,0,0,1,0,0|2,0,0]=4 1789 B7R1.1 NC[C@H]1CCCN1 MCULE-7708925831 [1,0,0,1,0,0|2,0,0]=4 1790 B7R1.1 NC[C@H]1CCCO1 MCULE-1196018690 [1,0,0,1,0,0|1,1,0]=4 1791 B7R1.1 NC[C@H]1CCCO1 MCULE-2037746017 [1,0,0,1,0,0|1,1,0]=4 1792 B7R1.1 NC[C@H]1CCCO1 MCULE-3470426685 [1,0,0,1,0,0|1,1,0]=4 1793 B7R1.1 NC[C@H]1CCCO1 MCULE-9918683284 [1,0,0,1,0,0|1,1,0]=4 1794 B7R1.1 OCC1CCCC1 MCULE-2985338933 [1,0,0,1,0,0|2,0,0]=4 1795 B7R1.1 OCC1CCCN1 MCULE-1016922679 [1,0,0,1,0,0|2,0,0]=4 1796 B7R1.1 OCC1CCCN1 MCULE-8224535891 [1,0,0,1,0,0|2,0,0]=4 1797 B7R1.1 OCC1CCCO1 MCULE-5877114547 [1,0,0,1,0,0|1,1,0]=4 1798 B7R1.1 OCC1CCCO1 MCULE-5884880244 [1,0,0,1,0,0|1,1,0]=4 1799 B7R1.1 OCC1CCCS1 MCULE-6106081414 [1,0,0,1,0,0|1,0,0]=3 1800 B7R1.1 OCC1CCSC1 MCULE-2226132734 [1,0,0,1,0,0|2,0,0]=4 1801 B7R1.1 OC[C@@H]1CCCN1 MCULE-1791547752 [1,0,0,1,0,0|2,0,0]=4 1802 B7R1.1 OC[C@@H]1CCCN1 MCULE-6448856585 [1,0,0,1,0,0|2,0,0]=4 1803 B7R1.1 OC[C@@H]1CCCN1 MCULE-7214801659 [1,0,0,1,0,0|2,0,0]=4 1804 B7R1.1 OC[C@@H]1CCCN1 MCULE-7248451975 [1,0,0,1,0,0|2,0,0]=4 1805 B7R1.1 OC[C@@H]1CCCO1 MCULE-1788377708 [1,0,0,1,0,0|1,1,0]=4 1806 B7R1.1 OC[C@@H]1CCCO1 MCULE-3533553137 [1,0,0,1,0,0|1,1,0]=4 1807 B7R1.1 OC[C@H]1CCCN1 MCULE-1266532697 [1,0,0,1,0,0|2,0,0]=4 1808 B7R1.1 OC[C@H]1CCCN1 MCULE-1724166794 [1,0,0,1,0,0|2,0,0]=4 1809 B7R1.1 OC[C@H]1CCCN1 MCULE-7513431964 [1,0,0,1,0,0|2,0,0]=4 1810 B7R1.1 OC[C@H]1CCCN1 MCULE-8398083695 [1,0,0,1,0,0|2,0,0]=4 1811 B7R1.1 OC[C@H]1CCCO1 MCULE-3501680239 [1,0,0,1,0,0|1,1,0]=4 1812 B7R1.1 OC[C@H]1CCCO1 MCULE-4925106568 [1,0,0,1,0,0|1,1,0]=4 1813 B7R1.1 SCC1CCCC1 MCULE-7973872166 [1,0,0,1,0,0|2,0,0]=4 1814 B7R1.1 SCC1CCCO1 MCULE-5962232488 [1,0,0,1,0,0|1,1,0]=4 1815 B7R1.3 BrC1CCCCC1 MCULE-7879113781 [1,0,0,1,0,0|2,0,0]=4 1816 B7R1.3 BrC1CCCNC1 MCULE-5734359694 [1,0,0,1,0,0|2,0,0]=4 1817 B7R1.3 BrC1CCCNC1 MCULE-8772964999 [1,0,0,1,0,0|2,0,0]=4 1818 B7R1.3 BrC1CCCNC1 MCULE-9975168983 [1,0,0,1,0,0|2,0,0]=4 1819 B7R1.3 BrC1CCCOC1 MCULE-5781416415 [1,0,0,1,0,0|1,1,0]=4 1820 B7R1.3 BrC1CCSCC1 MCULE-1239956252 [1,0,0,1,0,0|2,0,0]=4 1821 B7R1.3 C1(CCCNC1)F MCULE-2873742972 [1,0,0,1,0,0|2,0,0]=4 1822 B7R1.3 C1(CCCNC1)F MCULE-8247715411 [1,0,0,1,0,0|2,0,0]=4 1823 B7R1.3 C1(CCCNC1)N MCULE-2184623611 [1,0,0,1,0,0|2,0,0]=4 1824 B7R1.3 C1(CCCNC1)N MCULE-6177601832 [1,0,0,1,0,0|2,0,0]=4 1825 B7R1.3 C1(CCCNC1)O MCULE-5944071030 [1,0,0,1,0,0|2,0,0]=4 1826 B7R1.3 C1(CCCNC1)O MCULE-9769032939 [1,0,0,1,0,0|2,0,0]=4 1827 B7R1.3 C1(CCCOC1)N MCULE-7160456966 [1,0,0,1,0,0|1,1,0]=4 1828 B7R1.3 C1(CCCOC1)N MCULE-9418657332 [1,0,0,1,0,0|1,1,0]=4 1829 B7R1.3 C1(CNCCN1)C MCULE-7759957935 [1,0,0,1,0,0|2,0,0]=4 1830 B7R1.3 C1(CNCCO1)C MCULE-2805380245 [1,0,0,1,0,0|2,0,0]=4 1831 B7R1.3 C1(CNCCO1)C MCULE-3532041523 [1,0,0,1,0,0|2,0,0]=4 1832 B7R1.3 CC1C=CCCC1 MCULE-8057302830 [1,0,0,1,0,0|1,0,1]=4 1833 B7R1.3 CC1CC=CCC1 MCULE-6343106785 [1,0,0,1,0,0|1,0,1]=4 1834 B7R1.3 CC1CCCCC1 MCULE-3843525768 [1,0,0,1,0,0|1,0,0]=3 1835 B7R1.3 CC1CCCCN1 MCULE-1741870990 [1,0,0,1,0,0|2,0,0]=4 1836 B7R1.3 CC1CCCCN1 MCULE-4453126703 [1,0,0,1,0,0|2,0,0]=4 1837 B7R1.3 CC1CCCCN1 MCULE-6620063962 [1,0,0,1,0,0|2,0,0]=4 1838 B7R1.3 CC1CCCCN1 MCULE-6838766744 [1,0,0,1,0,0|2,0,0]=4 1839 B7R1.3 CC1CCCCN1 MCULE-9227931620 [1,0,0,1,0,0|2,0,0]=4 1840 B7R1.3 CC1CCCCO1 MCULE-4439683294 [1,0,0,1,0,0|1,1,0]=4 1841 B7R1.3 CC1CCCNC1 MCULE-3344207132 [1,0,0,1,0,0|1,0,0]=3 1842 B7R1.3 CC1CCCNC1 MCULE-5707832183 [1,0,0,1,0,0|1,0,0]=3 1843 B7R1.3 CC1CCCNC1 MCULE-7033850891 [1,0,0,1,0,0|1,0,0]=3 1844 B7R1.3 CC1CCCNC1 MCULE-7153943487 [1,0,0,1,0,0|1,0,0]=3 1845 B7R1.3 CC1CCNCC1 MCULE-5873723365 [1,0,0,1,0,0|2,0,0]=4 1846 B7R1.3 CC1CCNCC1 MCULE-6994675149 [1,0,0,1,0,0|2,0,0]=4 1847 B7R1.3 CC1CCNCC1 MCULE-9043030659 [1,0,0,1,0,0|2,0,0]=4 1848 B7R1.3 CC1CCOCC1 MCULE-8623581625 [1,0,0,1,0,0|1,1,0]=4 1849 B7R1.3 CC1CNCCN1 MCULE-2536395443 [1,0,0,1,0,0|2,0,0]=4 1850 B7R1.3 CC1CNCCN1 MCULE-6313957247 [1,0,0,1,0,0|2,0,0]=4 1851 B7R1.3 CC1CNCCO1 MCULE-3071497485 [1,0,0,1,0,0|2,0,0]=4 1852 B7R1.3 CC1CNCCO1 MCULE-7956728736 [1,0,0,1,0,0|2,0,0]=4 1853 B7R1.3 CC1CNCCS1 MCULE-7391261862 [1,0,0,1,0,0|2,0,0]=4 1854 B7R1.3 CC1COCCN1 MCULE-1305824409 [1,0,0,1,0,0|1,1,0]=4 1855 B7R1.3 CC1COCCN1 MCULE-4570632464 [1,0,0,1,0,0|1,1,0]=4 1856 B7R1.3 CC1COCCN1 MCULE-6275555682 [1,0,0,1,0,0|1,1,0]=4 1857 B7R1.3 CC1COCCN1 MCULE-8711024794 [1,0,0,1,0,0|1,1,0]=4 1858 B7R1.3 CC1CSCCN1 MCULE-2923436126 [1,0,0,1,0,0|1,0,0]=3 1859 B7R1.3 CC1SCCCS1 MCULE-8431698431 [1,0,0,1,0,0|2,0,0]=4 1860 B7R1.3 CN1CCCCC1 MCULE-3308944277 [1,0,0,1,0,0|2,0,0]=4 1861 B7R1.3 CN1CCSCC1 MCULE-9816739759 [1,0,0,1,0,0|2,0,0]=4 1862 B7R1.3 CN1CSCSC1 MCULE-8189192675 [1,0,0,1,0,0|2,0,0]=4 1863 B7R1.3 C[C@@H]1CCCCN1 MCULE-1372285636 [1,0,0,1,0,0|2,0,0]=4 1864 B7R1.3 C[C@@H]1CCCCN1 MCULE-1676908545 [1,0,0,1,0,0|2,0,0]=4 1865 B7R1.3 C[C@@H]1CCCCN1 MCULE-4298634468 [1,0,0,1,0,0|2,0,0]=4 1866 B7R1.3 C[C@@H]1CCCCN1 MCULE-6629826210 [1,0,0,1,0,0|2,0,0]=4 1867 B7R1.3 C[C@@H]1CCCNC1 MCULE-1079173995 [1,0,0,1,0,0|1,0,0]=3 1868 B7R1.3 C[C@@H]1CCCNC1 MCULE-1230145662 [1,0,0,1,0,0|1,0,0]=3 1869 B7R1.3 C[C@@H]1CCCNC1 MCULE-3423787676 [1,0,0,1,0,0|1,0,0]=3 1870 B7R1.3 C[C@@H]1CCCNC1 MCULE-9303264483 [1,0,0,1,0,0|1,0,0]=3 1871 B7R1.3 C[C@@H]1CNCCN1 MCULE-2959336973 [1,0,0,1,0,0|2,0,0]=4 1872 B7R1.3 C[C@@H]1CNCCN1 MCULE-3870060141 [1,0,0,1,0,0|2,0,0]=4 1873 B7R1.3 C[C@@H]1CNCCN1 MCULE-4214817913 [1,0,0,1,0,0|2,0,0]=4 1874 B7R1.3 C[C@@H]1CNCCN1 MCULE-4368092239 [1,0,0,1,0,0|2,0,0]=4 1875 B7R1.3 C[C@@H]1CNCCO1 MCULE-1787977539 [1,0,0,1,0,0|2,0,0]=4 1876 B7R1.3 C[C@@H]1CNCCO1 MCULE-2608004746 [1,0,0,1,0,0|2,0,0]=4 1877 B7R1.3 C[C@@H]1CNCCO1 MCULE-5447097956 [1,0,0,1,0,0|2,0,0]=4 1878 B7R1.3 C[C@@H]1CNCCO1 MCULE-9396954187 [1,0,0,1,0,0|2,0,0]=4 1879 B7R1.3 C[C@@H]1COCCN1 MCULE-2750151013 [1,0,0,1,0,0|1,1,0]=4 1880 B7R1.3 C[C@@H]1COCCN1 MCULE-4003273424 [1,0,0,1,0,0|1,1,0]=4 1881 B7R1.3 C[C@@H]1COCCN1 MCULE-4627627990 [1,0,0,1,0,0|1,1,0]=4 1882 B7R1.3 C[C@@H]1COCCN1 MCULE-8600287111 [1,0,0,1,0,0|1,1,0]=4 1883 B7R1.3 C[C@@H]1CSCCN1 MCULE-2613889704 [1,0,0,1,0,0|1,0,0]=3 1884 B7R1.3 C[C@H]1CCCCN1 MCULE-3586455704 [1,0,0,1,0,0|2,0,0]=4 1885 B7R1.3 C[C@H]1CCCCN1 MCULE-5638638213 [1,0,0,1,0,0|2,0,0]=4 1886 B7R1.3 C[C@H]1CCCCN1 MCULE-5867717461 [1,0,0,1,0,0|2,0,0]=4 1887 B7R1.3 C[C@H]1CCCCN1 MCULE-7106826493 [1,0,0,1,0,0|2,0,0]=4 1888 B7R1.3 C[C@H]1CCCNC1 MCULE-3372852932 [1,0,0,1,0,0|1,0,0]=3 1889 B7R1.3 C[C@H]1CCCNC1 MCULE-5146147676 [1,0,0,1,0,0|1,0,0]=3 1890 B7R1.3 C[C@H]1CCCNC1 MCULE-7894943546 [1,0,0,1,0,0|1,0,0]=3 1891 B7R1.3 C[C@H]1CCCNC1 MCULE-8016414984 [1,0,0,1,0,0|1,0,0]=3 1892 B7R1.3 C[C@H]1CNCCN1 MCULE-1403559972 [1,0,0,1,0,0|2,0,0]=4 1893 B7R1.3 C[C@H]1CNCCN1 MCULE-5769724060 [1,0,0,1,0,0|2,0,0]=4 1894 B7R1.3 C[C@H]1CNCCO1 MCULE-3158147539 [1,0,0,1,0,0|2,0,0]=4 1895 B7R1.3 C[C@H]1CNCCO1 MCULE-5193705878 [1,0,0,1,0,0|2,0,0]=4 1896 B7R1.3 C[C@H]1CNCCO1 MCULE-8337677707 [1,0,0,1,0,0|2,0,0]=4 1897 B7R1.3 C[C@H]1CNCCO1 MCULE-9425432414 [1,0,0,1,0,0|2,0,0]=4 1898 B7R1.3 C[C@H]1COCCN1 MCULE-1467834624 [1,0,0,1,0,0|1,1,0]=4 1899 B7R1.3 C[C@H]1COCCN1 MCULE-3486079226 [1,0,0,1,0,0|1,1,0]=4 1900 B7R1.3 C[C@H]1COCCN1 MCULE-5726525044 [1,0,0,1,0,0|1,1,0]=4 1901 B7R1.3 C[C@H]1COCCN1 MCULE-9977133603 [1,0,0,1,0,0|1,1,0]=4 1902 B7R1.3 C[C@H]1CSCCN1 MCULE-4076273874 [1,0,0,1,0,0|1,0,0]=3 1903 B7R1.3 ClC1CCCCC1 MCULE-9519865350 [1,0,0,1,0,0|2,0,0]=4 1904 B7R1.3 ClC1CCCNC1 MCULE-3870722463 [1,0,0,1,0,0|2,0,0]=4 1905 B7R1.3 ClC1CCCNC1 MCULE-8461718443 [1,0,0,1,0,0|2,0,0]=4 1906 B7R1.3 ClC1CCCOC1 MCULE-5733907796 [1,0,0,1,0,0|1,1,0]=4 1907 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-1513190720 [1,0,0,1,0,0|2,0,0]=4 1908 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-4702442384 [1,0,0,1,0,0|2,0,0]=4 1909 B7R1.3 Cl[C@H]1CCCNC1 MCULE-1906196638 [1,0,0,1,0,0|2,0,0]=4 1910 B7R1.3 Cl[C@H]1CCCNC1 MCULE-5435721723 [1,0,0,1,0,0|2,0,0]=4 1911 B7R1.3 FC1CCCCC1 MCULE-4555555520 [1,0,0,1,0,0|2,0,0]=4 1912 B7R1.3 FC1CCCNC1 MCULE-1207637035 [1,0,0,1,0,0|2,0,0]=4 1913 B7R1.3 FC1CCCNC1 MCULE-8874983109 [1,0,0,1,0,0|2,0,0]=4 1914 B7R1.3 FC1CCCOC1 MCULE-9003204358 [1,0,0,1,0,0|1,1,0]=4 1915 B7R1.3 F[C@@H]1CCCNC1 MCULE-1015853975 [1,0,0,1,0,0|2,0,0]=4 1916 B7R1.3 F[C@@H]1CCCNC1 MCULE-2442101978 [1,0,0,1,0,0|2,0,0]=4 1917 B7R1.3 F[C@@H]1CCCNC1 MCULE-3088687742 [1,0,0,1,0,0|2,0,0]=4 1918 B7R1.3 F[C@@H]1CCCNC1 MCULE-3298158493 [1,0,0,1,0,0|2,0,0]=4 1919 B7R1.3 F[C@H]1CCCNC1 MCULE-5863769143 [1,0,0,1,0,0|2,0,0]=4 1920 B7R1.3 F[C@H]1CCCNC1 MCULE-9142728260 [1,0,0,1,0,0|2,0,0]=4 1921 B7R1.3 F[C@H]1CCCNC1 MCULE-9496728832 [1,0,0,1,0,0|2,0,0]=4 1922 B7R1.3 F[C@H]1CCCNC1 MCULE-9795686850 [1,0,0,1,0,0|2,0,0]=4 1923 B7R1.3 IC1CCCCC1 MCULE-4499971048 [1,0,0,1,0,0|2,0,0]=4 1924 B7R1.3 IC1CCSCC1 MCULE-6684613275 [1,0,0,1,0,0|2,0,0]=4 1925 B7R1.3 NC1CCCCC1 MCULE-1274688385 [1,0,0,1,0,0|2,0,0]=4 1926 B7R1.3 NC1CCCCC1 MCULE-6218418825 [1,0,0,1,0,0|2,0,0]=4 1927 B7R1.3 NC1CCCCC1 MCULE-7654331405 [1,0,0,1,0,0|2,0,0]=4 1928 B7R1.3 NC1CCCCC1 MCULE-9211684304 [1,0,0,1,0,0|2,0,0]=4 1929 B7R1.3 NC1CCCNC1 MCULE-2846077424 [1,0,0,1,0,0|2,0,0]=4 1930 B7R1.3 NC1CCCNC1 MCULE-6762552983 [1,0,0,1,0,0|2,0,0]=4 1931 B7R1.3 NC1CCCNC1 MCULE-8978449052 [1,0,0,1,0,0|2,0,0]=4 1932 B7R1.3 NC1CCCOC1 MCULE-3002610862 [1,0,0,1,0,0|1,1,0]=4 1933 B7R1.3 NC1CCCOC1 MCULE-8678558313 [1,0,0,1,0,0|1,1,0]=4 1934 B7R1.3 NC1CCCSC1 MCULE-5361360271 [1,0,0,1,0,0|1,0,0]=3 1935 B7R1.3 NC1CCCSC1 MCULE-5652416535 [1,0,0,1,0,0|1,0,0]=3 1936 B7R1.3 NC1CCSCC1 MCULE-1077822824 [1,0,0,1,0,0|2,0,0]=4 1937 B7R1.3 NC1CCSCC1 MCULE-7148332202 [1,0,0,1,0,0|2,0,0]=4 1938 B7R1.3 N[C@@H]1CCCNC1 MCULE-1539406556 [1,0,0,1,0,0|2,0,0]=4 1939 B7R1.3 N[C@@H]1CCCNC1 MCULE-3403472114 [1,0,0,1,0,0|2,0,0]=4 1940 B7R1.3 N[C@@H]1CCCNC1 MCULE-6313396868 [1,0,0,1,0,0|2,0,0]=4 1941 B7R1.3 N[C@@H]1CCCNC1 MCULE-8281902784 [1,0,0,1,0,0|2,0,0]=4 1942 B7R1.3 N[C@@H]1CCCOC1 MCULE-3329999118 [1,0,0,1,0,0|1,1,0]=4 1943 B7R1.3 N[C@@H]1CCCOC1 MCULE-5434456311 [1,0,0,1,0,0|1,1,0]=4 1944 B7R1.3 N[C@@H]1CCCOC1 MCULE-8416525332 [1,0,0,1,0,0|1,1,0]=4 1945 B7R1.3 N[C@@H]1CCCOC1 MCULE-9941756618 [1,0,0,1,0,0|1,1,0]=4 1946 B7R1.3 N[C@H]1CCCNC1 MCULE-1133561466 [1,0,0,1,0,0|2,0,0]=4 1947 B7R1.3 N[C@H]1CCCNC1 MCULE-3601314617 [1,0,0,1,0,0|2,0,0]=4 1948 B7R1.3 N[C@H]1CCCNC1 MCULE-4741120465 [1,0,0,1,0,0|2,0,0]=4 1949 B7R1.3 N[C@H]1CCCNC1 MCULE-5291619589 [1,0,0,1,0,0|2,0,0]=4 1950 B7R1.3 N[C@H]1CCCNC1 MCULE-8831721515 [1,0,0,1,0,0|2,0,0]=4 1951 B7R1.3 N[C@H]1CCCOC1 MCULE-1619050625 [1,0,0,1,0,0|1,1,0]=4 1952 B7R1.3 N[C@H]1CCCOC1 MCULE-4275969826 [1,0,0,1,0,0|1,1,0]=4 1953 B7R1.3 N[C@H]1CCCOC1 MCULE-4421099383 [1,0,0,1,0,0|1,1,0]=4 1954 B7R1.3 N[C@H]1CCCOC1 MCULE-9281030983 [1,0,0,1,0,0|1,1,0]=4 1955 B7R1.3 O=C1CCCSC1 MCULE-1649390503 [1,0,0,1,0,0|1,0,1]=4 1956 B7R1.3 O=S1CCCSC1 MCULE-5552019770 [1,0,0,1,0,0|2,0,0]=4 1957 B7R1.3 OC1CCCCC1 MCULE-8217921343 [1,0,0,1,0,0|2,0,0]=4 1958 B7R1.3 OC1CCCNC1 MCULE-4557845355 [1,0,0,1,0,0|2,0,0]=4 1959 B7R1.3 OC1CCCNC1 MCULE-6040312691 [1,0,0,1,0,0|2,0,0]=4 1960 B7R1.3 OC1CCCOC1 MCULE-3820663957 [1,0,0,1,0,0|1,1,0]=4 1961 B7R1.3 OC1CCCOC1 MCULE-4349250540 [1,0,0,1,0,0|1,1,0]=4 1962 B7R1.3 OC1CCCSC1 MCULE-1448781710 [1,0,0,1,0,0|1,0,0]=3 1963 B7R1.3 OC1CCSCC1 MCULE-6056663037 [1,0,0,1,0,0|2,0,0]=4 1964 B7R1.3 O[C@@H]1CCCNC1 MCULE-3395625072 [1,0,0,1,0,0|2,0,0]=4 1965 B7R1.3 O[C@@H]1CCCNC1 MCULE-5041834047 [1,0,0,1,0,0|2,0,0]=4 1966 B7R1.3 O[C@@H]1CCCNC1 MCULE-5939951996 [1,0,0,1,0,0|2,0,0]=4 1967 B7R1.3 O[C@@H]1CCCNC1 MCULE-8822637089 [1,0,0,1,0,0|2,0,0]=4 1968 B7R1.3 O[C@@H]1CCCOC1 MCULE-1439860824 [1,0,0,1,0,0|1,1,0]=4 1969 B7R1.3 O[C@@H]1CCCOC1 MCULE-5515107963 [1,0,0,1,0,0|1,1,0]=4 1970 B7R1.3 O[C@H]1CCCNC1 MCULE-3813591488 [1,0,0,1,0,0|2,0,0]=4 1971 B7R1.3 O[C@H]1CCCNC1 MCULE-5223055424 [1,0,0,1,0,0|2,0,0]=4 1972 B7R1.3 O[C@H]1CCCNC1 MCULE-7646198322 [1,0,0,1,0,0|2,0,0]=4 1973 B7R1.3 O[C@H]1CCCNC1 MCULE-7875547684 [1,0,0,1,0,0|2,0,0]=4 1974 B7R1.3 O[C@H]1CCCOC1 MCULE-2228949296 [1,0,0,1,0,0|1,1,0]=4 1975 B7R1.3 O[C@H]1CCCOC1 MCULE-6500179909 [1,0,0,1,0,0|1,1,0]=4 1976 B7R1.3 SC1CCCCC1 MCULE-2644288416 [1,0,0,1,0,0|2,0,0]=4 1977 B7R1.3 SC1CCCNC1 MCULE-4464031027 [1,0,0,1,0,0|2,0,0]=4 1978 B7R1.3 SC1CCCNC1 MCULE-5566651293 [1,0,0,1,0,0|2,0,0]=4 1979 B7R1.3 SC1CCCOC1 MCULE-9540212924 [1,0,0,1,0,0|1,1,0]=4 1980 B7R1.3 SC1CCSCC1 MCULE-8741596394 [1,0,0,1,0,0|2,0,0]=4 1981 B7R1.3 S[C@H]1CCCNC1 MCULE-5377455102 [1,0,0,1,0,0|2,0,0]=4 1982 B7R1.3 S[C@H]1CCCNC1 MCULE-9668422285 [1,0,0,1,0,0|2,0,0]=4 1983 B7R1.3 [NH3+]C1CCCCC1 MCULE-7876724648 [1,0,0,1,0,0|2,0,0]=4 1984 B7R1.4 CC1CCCC1Br MCULE-7816907673 [1,0,0,1,0,0|2,0,0]=4 1985 B7R1.4 CC1CCCC1N MCULE-4318156403 [1,0,0,1,0,0|2,0,0]=4 1986 B7R1.4 CC1CCCC1N MCULE-4434172193 [1,0,0,1,0,0|2,0,0]=4 1987 B7R1.4 CC1CCCC1O MCULE-1288711765 [1,0,0,1,0,0|2,0,0]=4 1988 B7R1.4 CC1CCNC1C MCULE-2184586167 [1,0,0,1,0,0|2,0,0]=4 1989 B7R1.4 CC1CNCC1C MCULE-5821391512 [1,0,0,1,0,0|1,0,0]=3 1990 B7R1.4 CC1CNCC1C MCULE-6626101399 [1,0,0,1,0,0|1,0,0]=3 1991 B7R1.4 CC1CNCC1F MCULE-4834888455 [1,0,0,1,0,0|2,0,0]=4 1992 B7R1.4 CC1CNCC1F MCULE-7766072724 [1,0,0,1,0,0|2,0,0]=4 1993 B7R1.4 CC1CNCC1N MCULE-2314973615 [1,0,0,1,0,0|2,0,0]=4 1994 B7R1.4 CC1CNCC1N MCULE-8542352354 [1,0,0,1,0,0|2,0,0]=4 1995 B7R1.4 CC1CNCC1O MCULE-3308447861 [1,0,0,1,0,0|2,0,0]=4 1996 B7R1.4 CC1CNCC1O MCULE-8526879323 [1,0,0,1,0,0|2,0,0]=4 1997 B7R1.4 CC1COCC1N MCULE-5453471722 [1,0,0,1,0,0|1,1,0]=4 1998 B7R1.4 CC1COCC1N MCULE-6647217023 [1,0,0,1,0,0|1,1,0]=4 1999 B7R1.4 CC1COCC1O MCULE-5925280081 [1,0,0,1,0,0|1,1,0]=4 2000 B7R1.4 CC1CSCC1=O MCULE-5611423322 [1,0,0,1,0,0|1,0,1]=4 2001 B7R1.4 CC1CSCC1N MCULE-5628200403 [1,0,0,1,0,0|1,0,0]=3 2002 B7R1.4 CC1SCCC1N MCULE-5160182865 [1,0,0,1,0,0|2,0,0]=4 2003 B7R1.4 CC1SCCC1N MCULE-8827106279 [1,0,0,1,0,0|2,0,0]=4 2004 B7R1.4 CC1SCCC1O MCULE-4342593310 [1,0,0,1,0,0|2,0,0]=4 2005 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-6206070680 [1,0,0,1,0,0|2,0,0]=4 2006 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-9964938082 [1,0,0,1,0,0|2,0,0]=4 2007 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [1,0,0,1,0,0|2,0,0]=4 2008 B7R1.4 C[C@@H]1CCC[C@H]1N MCULE-8385969474 [1,0,0,1,0,0|2,0,0]=4 2009 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [1,0,0,1,0,0|2,0,0]=4 2010 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-4592161485 [1,0,0,1,0,0|1,0,0]=3 2011 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-5506149631 [1,0,0,1,0,0|1,0,0]=3 2012 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-4204399527 [1,0,0,1,0,0|2,0,0]=4 2013 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-8451199903 [1,0,0,1,0,0|2,0,0]=4 2014 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2290594563 [1,0,0,1,0,0|2,0,0]=4 2015 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2611807697 [1,0,0,1,0,0|2,0,0]=4 2016 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-3707409979 [1,0,0,1,0,0|2,0,0]=4 2017 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-4317636252 [1,0,0,1,0,0|2,0,0]=4 2018 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-2015388080 [1,0,0,1,0,0|2,0,0]=4 2019 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-3625149028 [1,0,0,1,0,0|2,0,0]=4 2020 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-5773404554 [1,0,0,1,0,0|2,0,0]=4 2021 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6014391902 [1,0,0,1,0,0|2,0,0]=4 2022 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6476104556 [1,0,0,1,0,0|2,0,0]=4 2023 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6537028059 [1,0,0,1,0,0|2,0,0]=4 2024 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-2567871968 [1,0,0,1,0,0|1,0,0]=3 2025 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-5626188867 [1,0,0,1,0,0|1,0,0]=3 2026 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-7438009663 [1,0,0,1,0,0|1,0,0]=3 2027 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-8649896095 [1,0,0,1,0,0|1,0,0]=3 2028 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-4207581523 [1,0,0,1,0,0|2,0,0]=4 2029 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-6158474994 [1,0,0,1,0,0|2,0,0]=4 2030 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7380960276 [1,0,0,1,0,0|2,0,0]=4 2031 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7589629864 [1,0,0,1,0,0|2,0,0]=4 2032 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [1,0,0,1,0,0|1,1,0]=4 2033 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-1145772262 [1,0,0,1,0,0|1,1,0]=4 2034 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-6639849267 [1,0,0,1,0,0|1,1,0]=4 2035 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-9659959713 [1,0,0,1,0,0|1,1,0]=4 2036 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [1,0,0,1,0,0|1,1,0]=4 2037 B7R1.4 C[C@H]1CCC[C@@H]1N MCULE-4150988023 [1,0,0,1,0,0|2,0,0]=4 2038 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [1,0,0,1,0,0|2,0,0]=4 2039 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [1,0,0,1,0,0|2,0,0]=4 2040 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-3329868072 [1,0,0,1,0,0|2,0,0]=4 2041 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-4186145172 [1,0,0,1,0,0|2,0,0]=4 2042 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [1,0,0,1,0,0|2,0,0]=4 2043 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [1,0,0,1,0,0|2,0,0]=4 2044 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7622265949 [1,0,0,1,0,0|2,0,0]=4 2045 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7686056776 [1,0,0,1,0,0|2,0,0]=4 2046 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2214344957 [1,0,0,1,0,0|1,0,0]=3 2047 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2877312650 [1,0,0,1,0,0|1,0,0]=3 2048 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2282810666 [1,0,0,1,0,0|2,0,0]=4 2049 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2772361871 [1,0,0,1,0,0|2,0,0]=4 2050 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3274154422 [1,0,0,1,0,0|2,0,0]=4 2051 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3608199633 [1,0,0,1,0,0|2,0,0]=4 2052 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-6069899229 [1,0,0,1,0,0|2,0,0]=4 2053 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-8539137579 [1,0,0,1,0,0|2,0,0]=4 2054 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-1988679936 [1,0,0,1,0,0|2,0,0]=4 2055 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-3451477960 [1,0,0,1,0,0|2,0,0]=4 2056 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-4396463600 [1,0,0,1,0,0|2,0,0]=4 2057 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-7975653844 [1,0,0,1,0,0|2,0,0]=4 2058 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [1,0,0,1,0,0|1,1,0]=4 2059 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [1,0,0,1,0,0|1,1,0]=4 2060 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [1,0,0,1,0,0|1,1,0]=4 2061 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [1,0,0,1,0,0|1,1,0]=4 2062 B7R1.4 NC1CSCC1O MCULE-4474934833 [1,0,0,1,0,0|2,0,0]=4 2063 B7R1.4 NC1CSCC1O MCULE-5059305463 [1,0,0,1,0,0|2,0,0]=4 2064 B7R1.4 NC1CSCC1O MCULE-8633680588 [1,0,0,1,0,0|2,0,0]=4 2065 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-4507133192 [1,0,0,1,0,0|2,0,0]=4 2066 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-9327920188 [1,0,0,1,0,0|2,0,0]=4 2067 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-5323319055 [1,0,0,1,0,0|2,0,0]=4 2068 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-8008053411 [1,0,0,1,0,0|2,0,0]=4 2069 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-2430440513 [1,0,0,1,0,0|2,0,0]=4 2070 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-8503171996 [1,0,0,1,0,0|2,0,0]=4 2071 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-5920046767 [1,0,0,1,0,0|1,1,0]=4 2072 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-6282053067 [1,0,0,1,0,0|1,1,0]=4 2073 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-8432332245 [1,0,0,1,0,0|1,1,0]=4 2074 B7R1.4 [NH3+][C@@H]1CSC[C@@H]1O MCULE-5747970201 [1,0,0,1,0,0|2,0,0]=4 2075 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O MCULE-4897701746 [1,0,0,1,0,0|2,0,0]=4 2076 B7R1.5 CCCC1CC1N MCULE-6204339829 [1,0,0,1,0,0|2,0,0]=4 2077 B7R1.5 CNCC1CC1C MCULE-9748636910 [1,0,0,1,0,0|2,0,0]=4 2078 B7R1.6 BrCCC1CCC1 MCULE-8124070706 [1,0,0,1,0,0|2,0,0]=4 2079 B7R1.6 BrCCN1CCC1 MCULE-1886791890 [1,0,0,1,0,0|2,0,0]=4 2080 B7R1.6 BrCCN1CCC1 MCULE-2174275052 [1,0,0,1,0,0|2,0,0]=4 2081 B7R1.6 CCCC1CCN1 MCULE-7330412999 [1,0,0,1,0,0|2,0,0]=4 2082 B7R1.6 CCCC1CNC1 MCULE-4374477641 [1,0,0,1,0,0|2,0,0]=4 2083 B7R1.6 CCCC1CNC1 MCULE-8036298863 [1,0,0,1,0,0|2,0,0]=4 2084 B7R1.6 CCNC1CCC1 MCULE-2055959297 [1,0,0,1,0,0|2,0,0]=4 2085 B7R1.6 CCNC1CCC1 MCULE-2989731173 [1,0,0,1,0,0|2,0,0]=4 2086 B7R1.6 CNCC1CCC1 MCULE-3632390845 [1,0,0,1,0,0|2,0,0]=4 2087 B7R1.6 CNCC1CCC1 MCULE-4932211047 [1,0,0,1,0,0|2,0,0]=4 2088 B7R1.6 ClCCN1CCC1 MCULE-1047861643 [1,0,0,1,0,0|2,0,0]=4 2089 B7R1.6 ClCCN1CCC1 MCULE-8627041760 [1,0,0,1,0,0|2,0,0]=4 2090 B7R1.6 NCCC1CCC1 MCULE-2620603238 [1,0,0,1,0,0|2,0,0]=4 2091 B7R1.6 NCCC1CCC1 MCULE-8653518690 [1,0,0,1,0,0|2,0,0]=4 2092 B7R1.6 NCCN1CCC1 MCULE-8622841145 [1,0,0,1,0,0|2,0,0]=4 2093 B7R1.6 OCCC1CCC1 MCULE-1014969390 [1,0,0,1,0,0|2,0,0]=4 2094 B7R1.6 OCCN1CCC1 MCULE-5517552533 [1,0,0,1,0,0|2,0,0]=4 2095 B7R1.7 BrCCCC1CC1 MCULE-1359115765 [1,0,0,1,0,0|2,0,0]=4 2096 B7R1.7 BrCCOC1CC1 MCULE-5137842235 [1,0,0,1,0,0|1,1,0]=4 2097 B7R1.7 CCCCC1CO1 MCULE-8403189539 [1,0,0,1,0,0|2,0,0]=4 2098 B7R1.7 CCCNC1CC1 MCULE-7033521193 [1,0,0,1,0,0|1,0,0]=3 2099 B7R1.7 CCCNC1CC1 MCULE-8227176324 [1,0,0,1,0,0|1,0,0]=3 2100 B7R1.7 CCNCC1CC1 MCULE-3070053773 [1,0,0,1,0,0|2,0,0]=4 2101 B7R1.7 CCNCC1CC1 MCULE-5997221486 [1,0,0,1,0,0|2,0,0]=4 2102 B7R1.7 CCONC1CC1 MCULE-5199479207 [1,0,0,1,0,0|1,1,0]=4 2103 B7R1.7 CCONC1CC1 MCULE-5905564764 [1,0,0,1,0,0|1,1,0]=4 2104 B7R1.7 CNCCC1CC1 MCULE-2375777124 [1,0,0,1,0,0|2,0,0]=4 2105 B7R1.7 CNCCC1CC1 MCULE-9913761675 [1,0,0,1,0,0|2,0,0]=4 2106 B7R1.7 COCNC1CC1 MCULE-6233934333 [1,0,0,1,0,0|2,0,0]=4 2107 B7R1.7 ClCCOC1CC1 MCULE-1732267732 [1,0,0,1,0,0|1,1,0]=4 2108 B7R1.7 NCCCC1CC1 MCULE-1579218471 [1,0,0,1,0,0|2,0,0]=4 2109 B7R1.7 NCCCC1CC1 MCULE-8160460213 [1,0,0,1,0,0|2,0,0]=4 2110 B7R1.7 NCCNC1CC1 MCULE-9756738460 [1,0,0,1,0,0|2,0,0]=4 2111 B7R1.7 NCCOC1CC1 MCULE-2021686793 [1,0,0,1,0,0|1,1,0]=4 2112 B7R1.7 NCCOC1CC1 MCULE-9123639402 [1,0,0,1,0,0|1,1,0]=4 2113 B7R1.7 OCCCC1CC1 MCULE-5336501479 [1,0,0,1,0,0|2,0,0]=4 2114 B7R1.7 OCCNC1CC1 MCULE-2068668434 [1,0,0,1,0,0|2,0,0]=4 2115 B7R1.7 OCCOC1CC1 MCULE-8583841482 [1,0,0,1,0,0|1,1,0]=4 2116 B7R1.8 CC1CCC1CO MCULE-4677269341 [1,0,0,1,0,0|2,0,0]=4 2117 B7R1.9 CCC1CC1CN MCULE-6264158284 [1,0,0,1,0,0|2,0,0]=4 2118 B7R1.9 CCC1CC1CN MCULE-7047201371 [1,0,0,1,0,0|2,0,0]=4 2119 B7R1.9 CCC1CC1CO MCULE-3342087238 [1,0,0,1,0,0|2,0,0]=4 2120 B7R1.24 C1=CCCCCC1 MCULE-4514853156 [1,0,0,1,0,0|1,0,1]=4 2121 B7R1.24 C1CCCCCC1 MCULE-5257270866 [1,0,0,1,0,0|1,0,0]=3 2122 B7R1.24 C1CCCNCC1 MCULE-6467465155 [1,0,0,1,0,0|1,0,0]=3 2123 B7R1.24 C1CCCOCC1 MCULE-9994899395 [1,0,0,1,0,0|0,1,0]=3 2124 B7R1.24 C1CCNCNC1 MCULE-9023922794 [1,0,0,1,0,0|2,0,0]=4 2125 B7R1.24 C1CCNNCC1 MCULE-1174944539 [1,0,0,1,0,0|2,0,0]=4 2126 B7R1.24 C1CCNNCC1 MCULE-8518491960 [1,0,0,1,0,0|2,0,0]=4 2127 B7R1.24 C1CCNOCC1 MCULE-7242354366 [1,0,0,1,0,0|1,1,0]=4 2128 B7R1.24 C1CCNOCC1 MCULE-7451936178 [1,0,0,1,0,0|1,1,0]=4 2129 B7R1.24 C1CCOCOC1 MCULE-4779745094 [1,0,0,1,0,0|1,1,0]=4 2130 B7R1.24 C1CNCCNC1 MCULE-8878366291 [1,0,0,1,0,0|2,0,0]=4 2131 B7R1.24 C1CNCCOC1 MCULE-9147617519 [1,0,0,1,0,0|1,1,0]=4 2132 B7R1.24 C1CNCCOC1 MCULE-9722986943 [1,0,0,1,0,0|1,1,0]=4 2133 B7R1.24 C1CNCCSC1 MCULE-3091366568 [1,0,0,1,0,0|1,0,0]=3 2134 B7R1.24 C1CNCCSC1 MCULE-7881506212 [1,0,0,1,0,0|1,0,0]=3 2135 B7R1.24 C1CSSCCN1 MCULE-1533838386 [1,0,0,1,0,0|1,0,0]=3 2136 B9R1.2 CCC1CC(CCN1)O MCULE-4953737441 [0,1,0,1,0,0|2,0,0]=4 2137 B9R1.2 CCC1CC(CCN1)O MCULE-9634837614 [0,1,0,1,0,0|2,0,0]=4 2138 B9R1.2 CCC1CC(CCO1)N MCULE-4187863149 [0,1,0,1,0,0|1,1,0]=4 2139 B9R1.2 CCC1CC(CCO1)O MCULE-2215415390 [0,1,0,1,0,0|1,1,0]=4 2140 B9R1.2 CCC1CCCC(=O)C1 MCULE-2309757845 [0,1,0,1,0,0|2,0,0]=4 2141 B9R1.2 CCC1CCCC(=O)N1 MCULE-7034650517 [0,1,0,1,0,0|2,0,0]=4 2142 B9R1.2 CCC1CCCC(C1)C MCULE-6755768980 [0,1,0,1,0,0|2,0,0]=4 2143 B9R1.2 CCC1CCCC(C1)N MCULE-8754064896 [0,1,0,1,0,0|2,0,0]=4 2144 B9R1.2 CCC1CCCC(C1)O MCULE-5149394080 [0,1,0,1,0,0|2,0,0]=4 2145 B9R1.2 CCC1CNCC(O1)C MCULE-6402129304 [0,1,0,1,0,0|2,0,0]=4 2146 B9R1.2 CCC1COCC(N1)C MCULE-1227991263 [0,1,0,1,0,0|1,1,0]=4 2147 B9R1.2 CC[C@@H]1CCCC(=O)C1 MCULE-3781767777 [0,1,0,1,0,0|2,0,0]=4 2148 B9R1.2 CC[C@@H]1CCC[C@@H](N1)C MCULE-4368459266 [0,1,0,1,0,0|2,0,0]=4 2149 B9R1.2 CC[C@@H]1CNC[C@@H](N1)C MCULE-8386790724 [0,1,0,1,0,0|2,0,0]=4 2150 B9R1.2 CC[C@@H]1C[C@@H](CCN1)O MCULE-1934337871 [0,1,0,1,0,0|2,0,0]=4 2151 B9R1.2 CC[C@@H]1C[C@@H](CCN1)O MCULE-5295834203 [0,1,0,1,0,0|2,0,0]=4 2152 B9R1.2 CC[C@H]1CCCC(=O)C1 MCULE-5055612080 [0,1,0,1,0,0|2,0,0]=4 2153 B9R1.2 CC[C@H]1CNC[C@H](O1)C MCULE-1726802726 [0,1,0,1,0,0|2,0,0]=4 2154 B9R1.7 CCCC1=NC(CS1)C MCULE-9100002900 [0,1,0,1,0,0|1,0,0]=3 2155 B9R1.7 CCCC1OCC(O1)C MCULE-3762914452 [0,1,0,1,0,0|1,1,0]=4 2156 B9R1.7 CCCN1CCC(C1)N MCULE-2610775729 [0,1,0,1,0,0|2,0,0]=4 2157 B9R1.7 CCCN1CCC(C1)N MCULE-8678024266 [0,1,0,1,0,0|2,0,0]=4 2158 B9R1.8 BrCCC1CCCCC1 MCULE-9299250705 [0,1,0,1,0,0|2,0,0]=4 2159 B9R1.8 BrCCC1CCCCN1 MCULE-1500097659 [0,1,0,1,0,0|2,0,0]=4 2160 B9R1.8 BrCCC1CCCCN1 MCULE-3711942593 [0,1,0,1,0,0|2,0,0]=4 2161 B9R1.8 BrCCC1CCCCN1 MCULE-7767580351 [0,1,0,1,0,0|2,0,0]=4 2162 B9R1.8 BrCCC1CCCCO1 MCULE-4230649212 [0,1,0,1,0,0|1,1,0]=4 2163 B9R1.8 BrCCC1CCCNC1 MCULE-2519817553 [0,1,0,1,0,0|2,0,0]=4 2164 B9R1.8 BrCCC1CCCNC1 MCULE-7320613897 [0,1,0,1,0,0|2,0,0]=4 2165 B9R1.8 BrCCC1CCCOC1 MCULE-5741308473 [0,1,0,1,0,0|1,1,0]=4 2166 B9R1.8 CCCC1CCCCC1 MCULE-7477053795 [0,1,0,1,0,0|2,0,0]=4 2167 B9R1.8 CCCC1CCCCN1 MCULE-1476155918 [0,1,0,1,0,0|2,0,0]=4 2168 B9R1.8 CCCC1CCCCN1 MCULE-1672724119 [0,1,0,1,0,0|2,0,0]=4 2169 B9R1.8 CCCC1CCCCN1 MCULE-5635587568 [0,1,0,1,0,0|2,0,0]=4 2170 B9R1.8 CCCC1CCCCN1 MCULE-7901233025 [0,1,0,1,0,0|2,0,0]=4 2171 B9R1.8 CCCC1CCCCN1 MCULE-8248346628 [0,1,0,1,0,0|2,0,0]=4 2172 B9R1.8 CCCC1CCCNC1 MCULE-4630550411 [0,1,0,1,0,0|2,0,0]=4 2173 B9R1.8 CCCC1CCCNC1 MCULE-6458267050 [0,1,0,1,0,0|2,0,0]=4 2174 B9R1.8 CCCC1CCNCC1 MCULE-2518589445 [0,1,0,1,0,0|2,0,0]=4 2175 B9R1.8 CCCC1CCNCC1 MCULE-4448725528 [0,1,0,1,0,0|2,0,0]=4 2176 B9R1.8 CCCC1CNCCN1 MCULE-7073466124 [0,1,0,1,0,0|2,0,0]=4 2177 B9R1.8 CCCC1CNCCO1 MCULE-9447741986 [0,1,0,1,0,0|1,1,0]=4 2178 B9R1.8 CCCC1COCCN1 MCULE-4391950653 [0,1,0,1,0,0|2,0,0]=4 2179 B9R1.8 CCCC1OCCCO1 MCULE-8359246042 [0,1,0,1,0,0|1,1,0]=4 2180 B9R1.8 CCCN1CCCCC1 MCULE-1219970936 [0,1,0,1,0,0|2,0,0]=4 2181 B9R1.8 CCCN1CCCCC1 MCULE-1933753818 [0,1,0,1,0,0|2,0,0]=4 2182 B9R1.8 CCCN1CCNCC1 MCULE-6448911998 [0,1,0,1,0,0|2,0,0]=4 2183 B9R1.8 CCCN1CCNCC1 MCULE-7547775138 [0,1,0,1,0,0|2,0,0]=4 2184 B9R1.8 CCCN1CCNCC1 MCULE-9065536618 [0,1,0,1,0,0|2,0,0]=4 2185 B9R1.8 CCCN1CCOCC1 MCULE-4877240053 [0,1,0,1,0,0|2,0,0]=4 2186 B9R1.8 CCC[C@@H]1CCCCN1 MCULE-6770891257 [0,1,0,1,0,0|2,0,0]=4 2187 B9R1.8 CCC[C@@H]1CCCCN1 MCULE-7954142000 [0,1,0,1,0,0|2,0,0]=4 2188 B9R1.8 CCC[C@H]1CCCCN1 MCULE-2517558052 [0,1,0,1,0,0|2,0,0]=4 2189 B9R1.8 CCC[C@H]1CCCCN1 MCULE-8255238091 [0,1,0,1,0,0|2,0,0]=4 2190 B9R1.8 CCC[C@H]1CCCCN1 MCULE-8429691236 [0,1,0,1,0,0|2,0,0]=4 2191 B9R1.8 CCC[C@H]1CCCCN1 MCULE-9434683135 [0,1,0,1,0,0|2,0,0]=4 2192 B9R1.8 CCNC1CCCCC1 MCULE-1079828121 [0,1,0,1,0,0|2,0,0]=4 2193 B9R1.8 CCNC1CCCCC1 MCULE-5943281030 [0,1,0,1,0,0|2,0,0]=4 2194 B9R1.8 CCNC1CCCNC1 MCULE-3184224037 [0,1,0,1,0,0|2,0,0]=4 2195 B9R1.8 CCNC1CCCNC1 MCULE-8130828966 [0,1,0,1,0,0|2,0,0]=4 2196 B9R1.8 CCNC1CCCOC1 MCULE-5265086206 [0,1,0,1,0,0|1,1,0]=4 2197 B9R1.8 CCNC1CCCOC1 MCULE-6797333075 [0,1,0,1,0,0|1,1,0]=4 2198 B9R1.8 CCN[C@@H]1CCCNC1 MCULE-1697574363 [0,1,0,1,0,0|2,0,0]=4 2199 B9R1.8 CCN[C@@H]1CCCNC1 MCULE-7855596165 [0,1,0,1,0,0|2,0,0]=4 2200 B9R1.8 CCOC1CCCNC1 MCULE-3782616420 [0,1,0,1,0,0|2,0,0]=4 2201 B9R1.8 CCOC1CCCNC1 MCULE-7785802954 [0,1,0,1,0,0|2,0,0]=4 2202 B9R1.8 CCO[C@H]1CCCNC1 MCULE-5762359795 [0,1,0,1,0,0|2,0,0]=4 2203 B9R1.8 CNCC1CCCCC1 MCULE-3140944607 [0,1,0,1,0,0|2,0,0]=4 2204 B9R1.8 CNCC1CCCCC1 MCULE-3915957758 [0,1,0,1,0,0|2,0,0]=4 2205 B9R1.8 CNCC1CCCCO1 MCULE-2559251364 [0,1,0,1,0,0|1,1,0]=4 2206 B9R1.8 CNCC1CCCCO1 MCULE-2931965460 [0,1,0,1,0,0|1,1,0]=4 2207 B9R1.8 CNCC1CCCNC1 MCULE-4603624281 [0,1,0,1,0,0|2,0,0]=4 2208 B9R1.8 CNCC1CCCNC1 MCULE-7471110706 [0,1,0,1,0,0|2,0,0]=4 2209 B9R1.8 CNCC1CCCOC1 MCULE-5011038425 [0,1,0,1,0,0|1,1,0]=4 2210 B9R1.8 CNCC1CCCOC1 MCULE-7542618002 [0,1,0,1,0,0|1,1,0]=4 2211 B9R1.8 CNC[C@@H]1CCCCN1 MCULE-4321064733 [0,1,0,1,0,0|2,0,0]=4 2212 B9R1.8 CNC[C@@H]1CCCCN1 MCULE-9313891572 [0,1,0,1,0,0|2,0,0]=4 2213 B9R1.8 CNC[C@@H]1CCCNC1 MCULE-6751100332 [0,1,0,1,0,0|2,0,0]=4 2214 B9R1.8 CNC[C@@H]1CCCNC1 MCULE-9736061388 [0,1,0,1,0,0|2,0,0]=4 2215 B9R1.8 CNC[C@H]1CCCCN1 MCULE-1546664766 [0,1,0,1,0,0|2,0,0]=4 2216 B9R1.8 CNC[C@H]1CCCCN1 MCULE-7467254233 [0,1,0,1,0,0|2,0,0]=4 2217 B9R1.8 CNC[C@H]1CCCOC1 MCULE-5780813168 [0,1,0,1,0,0|1,1,0]=4 2218 B9R1.8 CNC[C@H]1CCCOC1 MCULE-6139348870 [0,1,0,1,0,0|1,1,0]=4 2219 B9R1.8 COCC1CCCCN1 MCULE-1947273818 [0,1,0,1,0,0|2,0,0]=4 2220 B9R1.8 COCC1CCCCN1 MCULE-5179816472 [0,1,0,1,0,0|2,0,0]=4 2221 B9R1.8 COCC1CCCNC1 MCULE-4680480363 [0,1,0,1,0,0|2,0,0]=4 2222 B9R1.8 COCC1CCCNC1 MCULE-6787404650 [0,1,0,1,0,0|2,0,0]=4 2223 B9R1.8 COC[C@@H]1CCCCN1 MCULE-2798950485 [0,1,0,1,0,0|2,0,0]=4 2224 B9R1.8 COC[C@@H]1CCCCN1 MCULE-8642793821 [0,1,0,1,0,0|2,0,0]=4 2225 B9R1.8 COC[C@H]1CCCCN1 MCULE-3580108507 [0,1,0,1,0,0|2,0,0]=4 2226 B9R1.8 COC[C@H]1CCCCN1 MCULE-4232708572 [0,1,0,1,0,0|2,0,0]=4 2227 B9R1.8 COC[C@H]1CCCNC1 MCULE-3011341019 [0,1,0,1,0,0|2,0,0]=4 2228 B9R1.8 COC[C@H]1CCCNC1 MCULE-4883513899 [0,1,0,1,0,0|2,0,0]=4 2229 B9R1.8 COC[C@H]1CCCNC1 MCULE-7083332172 [0,1,0,1,0,0|2,0,0]=4 2230 B9R1.8 CSCC1CCCCN1 MCULE-2012373064 [0,1,0,1,0,0|2,0,0]=4 2231 B9R1.8 CSCC1CCCCN1 MCULE-9083698079 [0,1,0,1,0,0|2,0,0]=4 2232 B9R1.8 CSCC1CCCNC1 MCULE-3636743256 [0,1,0,1,0,0|2,0,0]=4 2233 B9R1.8 CSCC1CCCNC1 MCULE-4931875681 [0,1,0,1,0,0|2,0,0]=4 2234 B9R1.8 ClCCC1CCCCC1 MCULE-9726073749 [0,1,0,1,0,0|2,0,0]=4 2235 B9R1.8 ClCCC1CCCCN1 MCULE-3550163742 [0,1,0,1,0,0|2,0,0]=4 2236 B9R1.8 ClCCC1CCCCN1 MCULE-4587156712 [0,1,0,1,0,0|2,0,0]=4 2237 B9R1.8 FCCC1CCCNC1 MCULE-2308514802 [0,1,0,1,0,0|2,0,0]=4 2238 B9R1.8 FCCC1CCCNC1 MCULE-7436132702 [0,1,0,1,0,0|2,0,0]=4 2239 B9R1.8 ICCC1CCCCC1 MCULE-8795138408 [0,1,0,1,0,0|2,0,0]=4 2240 B9R1.8 NCCC1C=CCCC1 MCULE-9825958353 [0,1,0,1,0,0|2,0,0]=4 2241 B9R1.8 NCCC1CCCCC1 MCULE-3912289573 [0,1,0,1,0,0|2,0,0]=4 2242 B9R1.8 NCCC1CCCCC1 MCULE-8270155473 [0,1,0,1,0,0|2,0,0]=4 2243 B9R1.8 NCCC1CCCCN1 MCULE-3796829641 [0,1,0,1,0,0|2,0,0]=4 2244 B9R1.8 NCCC1CCCCN1 MCULE-8953940837 [0,1,0,1,0,0|2,0,0]=4 2245 B9R1.8 NCCC1CCCCO1 MCULE-3942491369 [0,1,0,1,0,0|1,1,0]=4 2246 B9R1.8 NCCC1CCCCO1 MCULE-8718659242 [0,1,0,1,0,0|1,1,0]=4 2247 B9R1.8 NCCC1CCCNC1 MCULE-2317830825 [0,1,0,1,0,0|2,0,0]=4 2248 B9R1.8 NCCC1CCCNC1 MCULE-7843131930 [0,1,0,1,0,0|2,0,0]=4 2249 B9R1.8 NCCC1CCCOC1 MCULE-6749080914 [0,1,0,1,0,0|1,1,0]=4 2250 B9R1.8 OCCC1C=CCCC1 MCULE-4423636846 [0,1,0,1,0,0|2,0,0]=4 2251 B9R1.8 OCCC1CCCCC1 MCULE-1419875265 [0,1,0,1,0,0|2,0,0]=4 2252 B9R1.8 OCCC1CCCCN1 MCULE-5358571234 [0,1,0,1,0,0|2,0,0]=4 2253 B9R1.8 OCCC1CCCCN1 MCULE-6316167724 [0,1,0,1,0,0|2,0,0]=4 2254 B9R1.8 OCCC1CCCCN1 MCULE-6383343166 [0,1,0,1,0,0|2,0,0]=4 2255 B9R1.8 OCCC1CCCCN1 MCULE-8192447369 [0,1,0,1,0,0|2,0,0]=4 2256 B9R1.8 OCCC1CCCCO1 MCULE-8834615080 [0,1,0,1,0,0|1,1,0]=4 2257 B9R1.8 OCCC1CCCNC1 MCULE-1585744813 [0,1,0,1,0,0|2,0,0]=4 2258 B9R1.8 OCCC1CCCNC1 MCULE-2334553785 [0,1,0,1,0,0|2,0,0]=4 2259 B9R1.8 OCCC1CCCOC1 MCULE-3721207963 [0,1,0,1,0,0|1,1,0]=4 2260 B9R1.8 OCCC1CSCCN1 MCULE-2529715107 [0,1,0,1,0,0|2,0,0]=4 2261 B9R1.8 OCCC1SCCCS1 MCULE-5450372948 [0,1,0,1,0,0|2,0,0]=4 2262 B9R1.8 OCC[C@@H]1CCCCN1 MCULE-1411975903 [0,1,0,1,0,0|2,0,0]=4 2263 B9R1.8 OCC[C@@H]1CCCCN1 MCULE-1687945599 [0,1,0,1,0,0|2,0,0]=4 2264 B9R1.8 OCC[C@@H]1CCCCN1 MCULE-4768860231 [0,1,0,1,0,0|2,0,0]=4 2265 B9R1.8 OCC[C@H]1CCCCN1 MCULE-1159412973 [0,1,0,1,0,0|2,0,0]=4 2266 B9R1.8 OCC[C@H]1CCCCN1 MCULE-7155911761 [0,1,0,1,0,0|2,0,0]=4 2267 B9R1.8 OCC[C@H]1CCCCN1 MCULE-8194139814 [0,1,0,1,0,0|2,0,0]=4 2268 B9R1.8 OCC[C@H]1CCCCN1 MCULE-9431208414 [0,1,0,1,0,0|2,0,0]=4 2269 B9R1.8 OCC[C@H]1CCCNC1 MCULE-7415878358 [0,1,0,1,0,0|2,0,0]=4 2270 B9R1.8 SCCC1CCCCC1 MCULE-4338002677 [0,1,0,1,0,0|2,0,0]=4 2271 B9R1.8 [C@H]1(CCCCN1)CCO MCULE-4666239626 [0,1,0,1,0,0|2,0,0]=4 2272 B9R1.12 BrCCCC1CCCC1 MCULE-8917652864 [0,1,0,1,0,0|2,0,0]=4 2273 B9R1.12 BrCCCN1CCCC1 MCULE-3876092057 [0,1,0,1,0,0|2,0,0]=4 2274 B9R1.12 BrCCCN1CCCC1 MCULE-9403473496 [0,1,0,1,0,0|2,0,0]=4 2275 B9R1.12 CCCCC1CCCN1 MCULE-1125287156 [0,1,0,1,0,0|2,0,0]=4 2276 B9R1.12 CCCCC1CCCN1 MCULE-9488507483 [0,1,0,1,0,0|2,0,0]=4 2277 B9R1.12 CCCCC1CCCO1 MCULE-6226220964 [0,1,0,1,0,0|1,1,0]=4 2278 B9R1.12 CCCCC1CCNC1 MCULE-3000104007 [0,1,0,1,0,0|2,0,0]=4 2279 B9R1.12 CCCCC1CCNC1 MCULE-5937287599 [0,1,0,1,0,0|2,0,0]=4 2280 B9R1.12 CCCCN1CCCC1 MCULE-2222043743 [0,1,0,1,0,0|2,0,0]=4 2281 B9R1.12 CCCNC1CCCC1 MCULE-1907915360 [0,1,0,1,0,0|2,0,0]=4 2282 B9R1.12 CCCNC1CCCC1 MCULE-7444605982 [0,1,0,1,0,0|2,0,0]=4 2283 B9R1.12 CCCOC1CCNC1 MCULE-2537216700 [0,1,0,1,0,0|1,1,0]=4 2284 B9R1.12 CCCOC1CCNC1 MCULE-4555797423 [0,1,0,1,0,0|1,1,0]=4 2285 B9R1.12 CCCO[C@@H]1CCNC1 MCULE-1739671899 [0,1,0,1,0,0|1,1,0]=4 2286 B9R1.12 CCCO[C@H]1CCNC1 MCULE-8837532175 [0,1,0,1,0,0|1,1,0]=4 2287 B9R1.12 CCNCC1CCCC1 MCULE-7055093528 [0,1,0,1,0,0|2,0,0]=4 2288 B9R1.12 CCNCC1CCCO1 MCULE-6762362230 [0,1,0,1,0,0|1,1,0]=4 2289 B9R1.12 CCNCC1CCCO1 MCULE-6799465904 [0,1,0,1,0,0|1,1,0]=4 2290 B9R1.12 CCOCC1CCCN1 MCULE-9596857478 [0,1,0,1,0,0|2,0,0]=4 2291 B9R1.12 CCOCC1CCCO1 MCULE-8991933635 [0,1,0,1,0,0|1,1,0]=4 2292 B9R1.12 CNCCC1CCCC1 MCULE-1793791278 [0,1,0,1,0,0|2,0,0]=4 2293 B9R1.12 CNCCC1CCCC1 MCULE-3968080543 [0,1,0,1,0,0|2,0,0]=4 2294 B9R1.12 CNCCC1CCCO1 MCULE-7311615257 [0,1,0,1,0,0|1,1,0]=4 2295 B9R1.12 CNCCC1CCCO1 MCULE-8833199856 [0,1,0,1,0,0|1,1,0]=4 2296 B9R1.12 CNCCN1CCCC1 MCULE-5415915780 [0,1,0,1,0,0|2,0,0]=4 2297 B9R1.12 CNCCN1CCCC1 MCULE-6484693678 [0,1,0,1,0,0|2,0,0]=4 2298 B9R1.12 COCCC1CCCN1 MCULE-8497546481 [0,1,0,1,0,0|2,0,0]=4 2299 B9R1.12 COCC[C@H]1CCCN1 MCULE-8245777352 [0,1,0,1,0,0|2,0,0]=4 2300 B9R1.12 ClCCCC1CCCC1 MCULE-5161283359 [0,1,0,1,0,0|2,0,0]=4 2301 B9R1.12 ClCCCN1CCCC1 MCULE-1815298239 [0,1,0,1,0,0|2,0,0]=4 2302 B9R1.12 ClCCCN1CCCC1 MCULE-5315327481 [0,1,0,1,0,0|2,0,0]=4 2303 B9R1.12 ClCCCN1CCCC1 MCULE-8262445040 [0,1,0,1,0,0|2,0,0]=4 2304 B9R1.12 ClCCSC1CCOC1 MCULE-2811911460 [0,1,0,1,0,0|2,0,0]=4 2305 B9R1.12 ICCCC1CCCC1 MCULE-3866409284 [0,1,0,1,0,0|2,0,0]=4 2306 B9R1.12 NCCCC1=CCCC1 MCULE-2116381621 [0,1,0,1,0,0|2,0,0]=4 2307 B9R1.12 NCCCC1CCCC1 MCULE-7501106700 [0,1,0,1,0,0|2,0,0]=4 2308 B9R1.12 NCCCC1CCCC1 MCULE-8651093743 [0,1,0,1,0,0|2,0,0]=4 2309 B9R1.12 NCCCN1CCCC1 MCULE-4697605807 [0,1,0,1,0,0|2,0,0]=4 2310 B9R1.12 NCCSC1=NCCS1 MCULE-2775312318 [0,1,0,1,0,0|2,0,0]=4 2311 B9R1.12 NCCSC1CCCC1 MCULE-3319599022 [0,1,0,1,0,0|2,0,0]=4 2312 B9R1.12 NCCSC1CCCC1 MCULE-9295988589 [0,1,0,1,0,0|2,0,0]=4 2313 B9R1.12 OCCCC1CCCC1 MCULE-9661108637 [0,1,0,1,0,0|2,0,0]=4 2314 B9R1.12 OCCCC1CCCN1 MCULE-4973252647 [0,1,0,1,0,0|2,0,0]=4 2315 B9R1.12 OCCCC1CCCO1 MCULE-9721808816 [0,1,0,1,0,0|1,1,0]=4 2316 B9R1.12 OCCCN1CCCC1 MCULE-5527047033 [0,1,0,1,0,0|2,0,0]=4 2317 B9R1.12 OCCCN1CCCC1 MCULE-6648445240 [0,1,0,1,0,0|2,0,0]=4 2318 B9R1.12 [NH3+]CCSC1=[NH+]CCS1 MCULE-3933111091 [0,1,0,1,0,0|2,0,0]=4 2319 B9R1.15 CC1CC=CCC1CO MCULE-7534551137 [0,1,0,1,0,0|2,0,0]=4 2320 B9R1.15 CC1CCCCC1CBr MCULE-8034060072 [0,1,0,1,0,0|2,0,0]=4 2321 B9R1.15 CC1CCCCC1CN MCULE-2749107040 [0,1,0,1,0,0|2,0,0]=4 2322 B9R1.15 CC1CCNCC1CO MCULE-7653018616 [0,1,0,1,0,0|2,0,0]=4 2323 B9R1.15 CC1COCCC1CN MCULE-3656342813 [0,1,0,1,0,0|1,1,0]=4 2324 B9R1.15 CCC1CCCCC1=O MCULE-2493543558 [0,1,0,1,0,0|2,0,0]=4 2325 B9R1.15 CCC1CCCCC1Br MCULE-1178311442 [0,1,0,1,0,0|2,0,0]=4 2326 B9R1.15 CCC1CCCCC1C MCULE-1792942786 [0,1,0,1,0,0|2,0,0]=4 2327 B9R1.15 CCC1CCCCC1N MCULE-3637799906 [0,1,0,1,0,0|2,0,0]=4 2328 B9R1.15 CCC1CCCCC1O MCULE-7514335194 [0,1,0,1,0,0|2,0,0]=4 2329 B9R1.15 CCC1CCCNC1=O MCULE-9899311713 [0,1,0,1,0,0|2,0,0]=4 2330 B9R1.15 CCC1CCCOC1=O MCULE-7711682964 [0,1,0,1,0,0|1,1,0]=4 2331 B9R1.15 CCC1CNCCN1C MCULE-1868671893 [0,1,0,1,0,0|2,0,0]=4 2332 B9R1.15 CCC1CNCCN1C MCULE-7509012326 [0,1,0,1,0,0|2,0,0]=4 2333 B9R1.15 CCC1COCCC1N MCULE-9616117607 [0,1,0,1,0,0|1,1,0]=4 2334 B9R1.15 CCC1COCCC1O MCULE-9521346817 [0,1,0,1,0,0|1,1,0]=4 2335 B9R1.15 CCN1CCNCC1C MCULE-3056588703 [0,1,0,1,0,0|2,0,0]=4 2336 B9R1.15 CCN1CCNCC1C MCULE-8623277370 [0,1,0,1,0,0|2,0,0]=4 2337 B9R1.15 CCN1CCNC[C@@H]1C MCULE-1407433368 [0,1,0,1,0,0|2,0,0]=4 2338 B9R1.15 CCN1CCNC[C@@H]1C MCULE-6554231611 [0,1,0,1,0,0|2,0,0]=4 2339 B9R1.15 CCN1CCNC[C@@H]1C MCULE-9253004293 [0,1,0,1,0,0|2,0,0]=4 2340 B9R1.15 CCN1CCNC[C@@H]1C MCULE-9397762933 [0,1,0,1,0,0|2,0,0]=4 2341 B9R1.15 CCN1CCNC[C@H]1C MCULE-7228445759 [0,1,0,1,0,0|2,0,0]=4 2342 B9R1.15 CCN1CCNC[C@H]1C MCULE-8432749639 [0,1,0,1,0,0|2,0,0]=4 2343 B9R1.15 CC[C@@H]1CNCCN1C MCULE-1000331069 [0,1,0,1,0,0|2,0,0]=4 2344 B9R1.15 CC[C@@H]1CNCCN1C MCULE-5298337784 [0,1,0,1,0,0|2,0,0]=4 2345 B9R1.15 CC[C@@H]1CNCCN1C MCULE-5453017237 [0,1,0,1,0,0|2,0,0]=4 2346 B9R1.15 CC[C@@H]1CNCCN1C MCULE-8354240129 [0,1,0,1,0,0|2,0,0]=4 2347 B9R1.15 CC[C@H]1CNCCN1C MCULE-2554087946 [0,1,0,1,0,0|2,0,0]=4 2348 B9R1.15 CC[C@H]1CNCCN1C MCULE-5024689384 [0,1,0,1,0,0|2,0,0]=4 2349 B9R1.15 CC[C@H]1CNCCN1C MCULE-8437686865 [0,1,0,1,0,0|2,0,0]=4 2350 B9R1.15 CC[C@H]1CNCCN1C MCULE-9437406245 [0,1,0,1,0,0|2,0,0]=4 2351 B9R1.15 CNC1CCCCC1C MCULE-2012338656 [0,1,0,1,0,0|2,0,0]=4 2352 B9R1.15 CNC1CCCCC1C MCULE-4226953987 [0,1,0,1,0,0|2,0,0]=4 2353 B9R1.15 CN[C@@H]1CCCC[C@@H]1C MCULE-5411502617 [0,1,0,1,0,0|2,0,0]=4 2354 B9R1.15 CN[C@H]1CCCC[C@H]1C MCULE-9095592965 [0,1,0,1,0,0|2,0,0]=4 2355 B9R1.15 COC1CCNCC1C MCULE-6572363150 [0,1,0,1,0,0|2,0,0]=4 2356 B9R1.15 COC1CCNCC1C MCULE-9231668375 [0,1,0,1,0,0|2,0,0]=4 2357 B9R1.15 COC1CNCCC1C MCULE-7419288321 [0,1,0,1,0,0|2,0,0]=4 2358 B9R1.15 COC1CNCCC1C MCULE-8027196152 [0,1,0,1,0,0|2,0,0]=4 2359 B9R1.15 CO[C@@H]1CCNC[C@@H]1C MCULE-6937999613 [0,1,0,1,0,0|2,0,0]=4 2360 B9R1.15 CO[C@@H]1CCNC[C@H]1C MCULE-3269567126 [0,1,0,1,0,0|2,0,0]=4 2361 B9R1.15 CO[C@@H]1CNCC[C@@H]1C MCULE-7888271922 [0,1,0,1,0,0|2,0,0]=4 2362 B9R1.15 CO[C@@H]1CNCC[C@@H]1C MCULE-9709371025 [0,1,0,1,0,0|2,0,0]=4 2363 B9R1.15 CO[C@@H]1CNCC[C@H]1C MCULE-2338099561 [0,1,0,1,0,0|2,0,0]=4 2364 B9R1.15 CO[C@@H]1CNCC[C@H]1C MCULE-5997296248 [0,1,0,1,0,0|2,0,0]=4 2365 B9R1.15 CO[C@H]1CCNC[C@@H]1C MCULE-4739410328 [0,1,0,1,0,0|2,0,0]=4 2366 B9R1.15 CO[C@H]1CCNC[C@H]1C MCULE-7934229731 [0,1,0,1,0,0|2,0,0]=4 2367 B9R1.15 CO[C@H]1CNCC[C@@H]1C MCULE-2481587773 [0,1,0,1,0,0|2,0,0]=4 2368 B9R1.15 CO[C@H]1CNCC[C@@H]1C MCULE-8312413940 [0,1,0,1,0,0|2,0,0]=4 2369 B9R1.15 CO[C@H]1CNCC[C@H]1C MCULE-3369664933 [0,1,0,1,0,0|2,0,0]=4 2370 B9R1.15 CO[C@H]1CNCC[C@H]1C MCULE-6381125186 [0,1,0,1,0,0|2,0,0]=4 2371 B9R1.27 CCC1C(=O)NCC1C MCULE-6984020668 [0,1,0,1,0,0|2,0,0]=4 2372 B9R1.33 CC1CCCC1CCO MCULE-1752596263 [0,1,0,1,0,0|2,0,0]=4 2373 B9R1.33 CCCC1CCCC1=O MCULE-6186440440 [0,1,0,1,0,0|2,0,0]=4 2374 B9R1.33 CCCN1CCCC1=O MCULE-4645322719 [0,1,0,1,0,0|2,0,0]=4 2375 B9R1.33 COCC1CNCC1C MCULE-2188367533 [0,1,0,1,0,0|2,0,0]=4 2376 B9R1.33 COCC1CNCC1C MCULE-6945846357 [0,1,0,1,0,0|2,0,0]=4 2377 B9R1.48 CC1CCCCC(=O)C1 MCULE-5791948972 [0,1,0,1,0,0|2,0,0]=4 2378 B9R1.48 CC1CCCCC(N1)C MCULE-5797406782 [0,1,0,1,0,0|2,0,0]=4 2379 B9R1.48 C[C@@H]1CCCC[C@H](N1)C MCULE-7954748247 [0,1,0,1,0,0|2,0,0]=4 2380 B9R1.48 C[C@H]1CCCC[C@@H](N1)C MCULE-2719547061 [0,1,0,1,0,0|2,0,0]=4 2381 B9R1.48 C[C@H]1CCCC[C@H](N1)C MCULE-7122277223 [0,1,0,1,0,0|2,0,0]=4 2382 B9R1.49 CC1CCCC(=O)CC1 MCULE-8026581790 [0,1,0,1,0,0|2,0,0]=4 2383 B9R1.49 CC1CCCC(CC1)N MCULE-7634847223 [0,1,0,1,0,0|2,0,0]=4 2384 B9R1.49 CC1CCCC(NC1)C MCULE-1631903049 [0,1,0,1,0,0|2,0,0]=4 2385 B9R1.50 BrC1=CCCCCCC1 MCULE-5795272491 [0,1,0,1,0,0|2,0,0]=4 2386 B9R1.50 BrC1=CCCCCCC1 MCULE-6505985509 [0,1,0,1,0,0|2,0,0]=4 2387 B9R1.50 BrC1C=CCCCCC1 MCULE-8233462837 [0,1,0,1,0,0|2,0,0]=4 2388 B9R1.50 BrC1CCC=CCCC1 MCULE-5430929676 [0,1,0,1,0,0|2,0,0]=4 2389 B9R1.50 BrC1CCC=CCCC1 MCULE-8399394388 [0,1,0,1,0,0|2,0,0]=4 2390 B9R1.50 BrC1CCCCCCC1 MCULE-9261673111 [0,1,0,1,0,0|2,0,0]=4 2391 B9R1.50 NC1C=CCCCCC1 MCULE-1781220815 [0,1,0,1,0,0|2,0,0]=4 2392 B9R1.50 NC1C=CCCCCC1 MCULE-9435374048 [0,1,0,1,0,0|2,0,0]=4 2393 B9R1.50 NC1CCC=CCCC1 MCULE-2669632697 [0,1,0,1,0,0|2,0,0]=4 2394 B9R1.50 NC1CCC=CCCC1 MCULE-6356073341 [0,1,0,1,0,0|2,0,0]=4 2395 B9R1.50 NC1CCCCCCC1 MCULE-6537375543 [0,1,0,1,0,0|2,0,0]=4 2396 B9R1.50 NC1CCCCCNC1 MCULE-8217686828 [0,1,0,1,0,0|2,0,0]=4 2397 B9R1.50 O=C1CCCCCCC1 MCULE-1352803313 [0,1,0,1,0,0|2,0,0]=4 2398 B9R1.50 O=C1CCCCCCN1 MCULE-4051743080 [0,1,0,1,0,0|2,0,0]=4 2399 B9R1.50 O=C1CCCCCCO1 MCULE-5149380112 [0,1,0,1,0,0|1,1,0]=4 2400 B9R1.50 OC1C=CCCCCC1 MCULE-1181214133 [0,1,0,1,0,0|2,0,0]=4 2401 B9R1.50 OC1CCC=CCCC1 MCULE-1736825337 [0,1,0,1,0,0|2,0,0]=4 2402 B9R1.50 OC1CCC=CCCC1 MCULE-6297988885 [0,1,0,1,0,0|2,0,0]=4 2403 B9R1.50 OC1CCCCCCC1 MCULE-7379371136 [0,1,0,1,0,0|2,0,0]=4 2404 B9R1.50 OC1CSCCCSC1 MCULE-8296129342 [0,1,0,1,0,0|2,0,0]=4 2405 B9R1.50 O[C@@H]1CCC=CCCC1 MCULE-2143953157 [0,1,0,1,0,0|2,0,0]=4 2406 B9R1.50 O[C@H]1CCC=CCCC1 MCULE-9747750449 [0,1,0,1,0,0|2,0,0]=4 2407 B9R1.69 CC1CCC(=O)CC1C MCULE-5304188182 [0,1,0,1,0,0|2,0,0]=4 2408 B9R1.69 CC1CCC(C(C1)C)C MCULE-8423605383 [0,1,0,1,0,0|2,0,0]=4 2409 B9R1.69 CC1CCC(CC1C)N MCULE-1561023388 [0,1,0,1,0,0|2,0,0]=4 2410 B9R1.69 CC1CCC(CC1C)O MCULE-6171532647 [0,1,0,1,0,0|2,0,0]=4 2411 B9R1.73 CCCC(=O)C1CCC1 MCULE-2367300877 [0,1,0,1,0,0|2,0,0]=4 2412 B9R1.73 CCCC(N)C1CCC1 MCULE-2304710158 [0,1,0,1,0,0|2,0,0]=4 2413 B9R1.100 CCCNC(=O)C1CC1 MCULE-8406372716 [0,1,0,1,0,0|2,0,0]=4 2414 B9R1.134 CCCC1(CCCC1)O MCULE-5471676226 [0,1,0,1,0,0|2,0,0]=4 2415 B9R1.134 CCC[N+]1(CCCC1)C MCULE-5762058586 [0,1,0,1,0,0|2,0,0]=4 2416 B9R1.134 CCC[N+]1(CCCC1)C MCULE-6175058230 [0,1,0,1,0,0|2,0,0]=4 2417 B9R1.5 CC1CCCCCC1N MCULE-5854491023 [0,1,0,1,0,0|2,0,0]=4 2418 B9R1.5 CC1CCCNCC1C MCULE-3413141564 [0,1,0,1,0,0|2,0,0]=4 2419 B9R1.5 CC1CCCNCC1C MCULE-6316766408 [0,1,0,1,0,0|2,0,0]=4 2420 B9R1.5 CC1CCNCCC1O MCULE-2014482309 [0,1,0,1,0,0|2,0,0]=4 2421 B9R1.5 CC1CCNCCC1O MCULE-7020970444 [0,1,0,1,0,0|2,0,0]=4 2422 B9R1.5 CC1CCNCCN1C MCULE-1971240463 [0,1,0,1,0,0|2,0,0]=4 2423 B9R1.5 CC1CNCCCC1O MCULE-7042298511 [0,1,0,1,0,0|2,0,0]=4 2424 B9R1.5 CC1CNCCCC1O MCULE-8658161534 [0,1,0,1,0,0|2,0,0]=4 2425 B9R1.5 CC1CNCCCN1C MCULE-6889525948 [0,1,0,1,0,0|2,0,0]=4 2426 B9R1.14 CCC1CCCC1CN MCULE-1703862248 [0,1,0,1,0,0|2,0,0]=4 2427 B9R1.14 CCC1CNCC1CC MCULE-7269079242 [0,1,0,1,0,0|2,0,0]=4 2428 B9R1.14 CCC1CNCC1CO MCULE-2035722014 [0,1,0,1,0,0|2,0,0]=4 2429 B9R1.14 CCC1NCCC1CO MCULE-7281322099 [0,1,0,1,0,0|2,0,0]=4 2430 B9R1.14 CC[C@H]1CNC[C@@H]1CO MCULE-1076286750 [0,1,0,1,0,0|2,0,0]=4 2431 B9R1.14 CC[C@H]1CNC[C@@H]1CO MCULE-9319128709 [0,1,0,1,0,0|2,0,0]=4 2432 B9R1.17 BrCCCOC1CCC1 MCULE-1795381815 [0,1,0,1,0,0|1,1,0]=4 2433 B9R1.17 CCCCCC1CNC1 MCULE-1187200413 [0,1,0,1,0,0|2,0,0]=4 2434 B9R1.17 CCCCCC1CNC1 MCULE-2508948694 [0,1,0,1,0,0|2,0,0]=4 2435 B9R1.17 CCCCOC1CNC1 MCULE-3133093097 [0,1,0,1,0,0|1,1,0]=4 2436 B9R1.17 CCCCOC1CNC1 MCULE-3942188925 [0,1,0,1,0,0|1,1,0]=4 2437 B9R1.17 CCCOCC1CNC1 MCULE-5727289236 [0,1,0,1,0,0|1,1,0]=4 2438 B9R1.17 NCCCCN1CCC1 MCULE-4009925572 [0,1,0,1,0,0|2,0,0]=4 2439 B9R1.17 NCCCOC1CCC1 MCULE-2258599306 [0,1,0,1,0,0|1,1,0]=4 2440 B9R1.17 OCCCNC1CCC1 MCULE-6573690465 [0,1,0,1,0,0|2,0,0]=4 2441 B9R1.17 OCCCOC1CCC1 MCULE-8275221962 [0,1,0,1,0,0|1,1,0]=4 2442 B9R1.83 BrCCCCCC1CC1 MCULE-9842709492 [0,1,0,1,0,0|2,0,0]=4 2443 B9R1.83 BrCCCOCC1CC1 MCULE-9124002570 [0,1,0,1,0,0|1,1,0]=4 2444 B9R1.83 CCCCCCC1CO1 MCULE-5253323325 [0,1,0,1,0,0|2,0,0]=4 2445 B9R1.83 CCCCCC[C@H]1CO1 MCULE-2693826692 [0,1,0,1,0,0|2,0,0]=4 2446 B9R1.83 CCCCOCC1CO1 MCULE-6294765769 [0,1,0,1,0,0|1,1,0]=4 2447 B9R1.83 CNCCOCC1CC1 MCULE-1852290259 [0,1,0,1,0,0|1,1,0]=4 2448 B9R1.83 COCCNCC1CC1 MCULE-9282017953 [0,1,0,1,0,0|2,0,0]=4 2449 B9R1.83 NCCCOCC1CC1 MCULE-8775774364 [0,1,0,1,0,0|1,1,0]=4 2450 B9R1.83 OCCCCNC1CC1 MCULE-7073557287 [0,1,0,1,0,0|2,0,0]=4 2451 B9R1.83 OCCCNCC1CC1 MCULE-4930726062 [0,1,0,1,0,0|2,0,0]=4 2452 B9R1.83 OCCCOCC1CC1 MCULE-1186093976 [0,1,0,1,0,0|1,1,0]=4 2453 B9R1.83 OCCCSCC1CC1 MCULE-6467928586 [0,1,0,1,0,0|1,0,0]=3 2454 B9R1.89 BrCC1CCCCCC1 MCULE-3804149088 [0,1,0,1,0,0|2,0,0]=4 2455 B9R1.89 CCC1CCCCCN1 MCULE-9043964617 [0,1,0,1,0,0|2,0,0]=4 2456 B9R1.89 CCC1CCCNCC1 MCULE-1208066309 [0,1,0,1,0,0|2,0,0]=4 2457 B9R1.89 CCC1CNCCCO1 MCULE-5736441757 [0,1,0,1,0,0|1,1,0]=4 2458 B9R1.89 CCC1CNCCOC1 MCULE-8196044665 [0,1,0,1,0,0|1,1,0]=4 2459 B9R1.89 CCN1CCCCCC1 MCULE-1193924766 [0,1,0,1,0,0|2,0,0]=4 2460 B9R1.89 CCN1CCCNCC1 MCULE-2109702115 [0,1,0,1,0,0|2,0,0]=4 2461 B9R1.89 CCN1CCCNCC1 MCULE-2398077226 [0,1,0,1,0,0|2,0,0]=4 2462 B9R1.89 CNC1CCCCCC1 MCULE-3477928342 [0,1,0,1,0,0|2,0,0]=4 2463 B9R1.89 CNC1CCCCCC1 MCULE-9182986806 [0,1,0,1,0,0|2,0,0]=4 2464 B9R1.89 CNC1CCCCNC1 MCULE-4863452887 [0,1,0,1,0,0|2,0,0]=4 2465 B9R1.89 CNC1CCCNCC1 MCULE-5093645225 [0,1,0,1,0,0|2,0,0]=4 2466 B9R1.89 COC1CCCNCC1 MCULE-3865112637 [0,1,0,1,0,0|2,0,0]=4 2467 B9R1.89 COC1CCCNCC1 MCULE-8695975811 [0,1,0,1,0,0|2,0,0]=4 2468 B9R1.89 CO[C@@H]1CCCNCC1 MCULE-7843793451 [0,1,0,1,0,0|2,0,0]=4 2469 B9R1.89 CO[C@@H]1CCCNCC1 MCULE-8658047616 [0,1,0,1,0,0|2,0,0]=4 2470 B9R1.89 CO[C@H]1CCCNCC1 MCULE-3812820732 [0,1,0,1,0,0|2,0,0]=4 2471 B9R1.89 CO[C@H]1CCCNCC1 MCULE-5564803880 [0,1,0,1,0,0|2,0,0]=4 2472 B9R1.89 CO[C@H]1CCCNCC1 MCULE-7219983991 [0,1,0,1,0,0|2,0,0]=4 2473 B9R1.89 CO[C@H]1CCCNCC1 MCULE-9051418657 [0,1,0,1,0,0|2,0,0]=4 2474 B9R1.89 CSC1CCCNCC1 MCULE-9991697550 [0,1,0,1,0,0|2,0,0]=4 2475 B9R1.89 ClCC1SCCCCS1 MCULE-2929531834 [0,1,0,1,0,0|2,0,0]=4 2476 B9R1.89 NCC1CCCCCC1 MCULE-6071072186 [0,1,0,1,0,0|2,0,0]=4 2477 B9R1.89 NCC1CCCCCC1 MCULE-8981470928 [0,1,0,1,0,0|2,0,0]=4 2478 B9R1.89 NCC1CCCCNC1 MCULE-7705035602 [0,1,0,1,0,0|2,0,0]=4 2479 B9R1.89 NCC1CCCCNC1 MCULE-8170909949 [0,1,0,1,0,0|2,0,0]=4 2480 B9R1.89 OCC1CCCCCC1 MCULE-1749370417 [0,1,0,1,0,0|2,0,0]=4 2481 B9R1.89 OCC1CCCCCC1 MCULE-2629813419 [0,1,0,1,0,0|2,0,0]=4 2482 B9R1.89 OCC1CCCCNC1 MCULE-1649629703 [0,1,0,1,0,0|2,0,0]=4 2483 B9R1.89 OCC1CCCCNC1 MCULE-6297064506 [0,1,0,1,0,0|2,0,0]=4 2484 B9R1.89 OCC1CCCNCC1 MCULE-1276268438 [0,1,0,1,0,0|2,0,0]=4 2485 B9R1.89 OCC1CCCNCC1 MCULE-6937244427 [0,1,0,1,0,0|2,0,0]=4 2486 B9R1.103 C1CCCCNCCC1 MCULE-3201088280 [0,1,0,1,0,0|2,0,0]=4 2487 B9R1.103 C1CSCCSCCS1 MCULE-3373587421 [0,1,0,1,0,0|2,0,0]=4 2488 B9R1.1 CCC1CCC(CC1)C MCULE-2653372010 [0,1,0,1,0,0|2,0,0]=4 2489 B9R1.1 CCC1CCC(CC1)N MCULE-3699342075 [0,1,0,1,0,0|2,0,0]=4 2490 B9R1.1 CCC1CCC(CC1)N MCULE-8941706723 [0,1,0,1,0,0|2,0,0]=4 2491 B9R1.1 CCC1CCC(CC1)O MCULE-8097752772 [0,1,0,1,0,0|2,0,0]=4 2492 B9R1.1 CCC1CCC(NC1)C MCULE-9037446160 [0,1,0,1,0,0|2,0,0]=4 2493 B9R1.1 CC[C@H]1CC[C@@H](CC1)N MCULE-4018920391 [0,1,0,1,0,0|2,0,0]=4 2494 B9R1.1 CC[C@H]1CC[C@@H](CC1)N MCULE-6650148008 [0,1,0,1,0,0|2,0,0]=4 2495 B9R1.1 CC[C@H]1CC[C@@H](CC1)O MCULE-2707983247 [0,1,0,1,0,0|2,0,0]=4 2496 B9R1.1 CC[C@H]1CC[C@H](CC1)N MCULE-9970355250 [0,1,0,1,0,0|2,0,0]=4 2497 B9R1.1 CC[C@H]1CC[C@H](CC1)O MCULE-2491233696 [0,1,0,1,0,0|2,0,0]=4 2498 B9R1.3 CC1CCCC(C1C)C MCULE-9375072995 [0,1,0,1,0,0|2,0,0]=4 2499 B9R1.3 CC1CCCC(C1C)N MCULE-7085283833 [0,1,0,1,0,0|2,0,0]=4 2500 B9R1.3 CC1CCCC(C1C)O MCULE-1285216829 [0,1,0,1,0,0|2,0,0]=4 2501 B9R1.3 CC1CSCC(C1N)C MCULE-8942533897 [0,1,0,1,0,0|2,0,0]=4 2502 B9R1.11 CCC(C)C1=NCCS1 MCULE-5440756916 [0,1,0,1,0,0|2,0,0]=4 2503 B9R1.11 CCC(C)C1CCCN1 MCULE-6263276107 [0,1,0,1,0,0|2,0,0]=4 2504 B9R1.11 CCC(N)C1CCCC1 MCULE-2018376160 [0,1,0,1,0,0|2,0,0]=4 2505 B9R1.11 CCC(N)C1CCCO1 MCULE-7946594021 [0,1,0,1,0,0|1,1,0]=4 2506 B9R1.11 CC[C@@H](C)C1=NCCS1 MCULE-6896500555 [0,1,0,1,0,0|2,0,0]=4 2507 B9R1.11 [C@H](C)(CC)C1=NCCS1 MCULE-2800029343 [0,1,0,1,0,0|2,0,0]=4 2508 B9R1.80 CCC(C)CNC1CC1 MCULE-2512139294 [0,1,0,1,0,0|2,0,0]=4 2509 B9R1.80 CCC(C)CNC1CC1 MCULE-4348094564 [0,1,0,1,0,0|2,0,0]=4 2510 B9R1.80 CCC(C)NCC1CC1 MCULE-5989144815 [0,1,0,1,0,0|2,0,0]=4 2511 B9R1.118 CCC1(CCCCC1)Cl MCULE-5513648578 [0,1,0,1,0,0|2,0,0]=4 2512 B9R1.118 CCC1(CCCCC1)N MCULE-3886661042 [0,1,0,1,0,0|2,0,0]=4 2513 B9R1.118 CCC1(CCCCC1)N MCULE-3921643203 [0,1,0,1,0,0|2,0,0]=4 2514 B9R1.118 CCC1(CCCCC1)O MCULE-9314704343 [0,1,0,1,0,0|2,0,0]=4 2515 B9R1.118 CCC1(CCCNC1)C MCULE-4065109647 [0,1,0,1,0,0|2,0,0]=4 2516 B9R1.118 CCC1(CCCNC1)C MCULE-8427718856 [0,1,0,1,0,0|2,0,0]=4 2517 B9R1.118 CCC1(CCCNC1)O MCULE-2359766186 [0,1,0,1,0,0|2,0,0]=4 2518 B9R1.118 CCC1(CCCNC1)O MCULE-4654641315 [0,1,0,1,0,0|2,0,0]=4 2519 B9R1.6 CC(Br)C1CCCCC1 MCULE-5485461450 [0,1,0,1,0,0|2,0,0]=4 2520 B9R1.6 CC(C)C1CCCCC1 MCULE-6669359076 [0,1,0,1,0,0|2,0,0]=4 2521 B9R1.6 CC(C)C1CCCCN1 MCULE-3649476695 [0,1,0,1,0,0|2,0,0]=4 2522 B9R1.6 CC(C)C1CCCCN1 MCULE-8304532068 [0,1,0,1,0,0|2,0,0]=4 2523 B9R1.6 CC(C)C1CCCNC1 MCULE-3359180558 [0,1,0,1,0,0|2,0,0]=4 2524 B9R1.6 CC(C)C1CCCNC1 MCULE-3374264203 [0,1,0,1,0,0|2,0,0]=4 2525 B9R1.6 CC(C)C1CNCCS1 MCULE-3005004947 [0,1,0,1,0,0|2,0,0]=4 2526 B9R1.6 CC(N)C1CCCCC1 MCULE-1505914332 [0,1,0,1,0,0|2,0,0]=4 2527 B9R1.6 CC(N)C1CCCCC1 MCULE-2391650892 [0,1,0,1,0,0|2,0,0]=4 2528 B9R1.6 CC(N)C1CCCCC1 MCULE-4413711215 [0,1,0,1,0,0|2,0,0]=4 2529 B9R1.6 CC(N)C1CCCCN1 MCULE-2177574791 [0,1,0,1,0,0|2,0,0]=4 2530 B9R1.6 CC(N)C1CCCCO1 MCULE-8387374309 [0,1,0,1,0,0|1,1,0]=4 2531 B9R1.6 CC(N)C1CCCCO1 MCULE-9971513933 [0,1,0,1,0,0|1,1,0]=4 2532 B9R1.6 CC(N)C1CCCNC1 MCULE-8605982838 [0,1,0,1,0,0|2,0,0]=4 2533 B9R1.6 CC(O)C1CCCCC1 MCULE-5078012753 [0,1,0,1,0,0|2,0,0]=4 2534 B9R1.6 CC(O)C1CCCCN1 MCULE-2559324365 [0,1,0,1,0,0|2,0,0]=4 2535 B9R1.6 CC(O)C1CCCNC1 MCULE-2671166499 [0,1,0,1,0,0|2,0,0]=4 2536 B9R1.6 CC(O)C1CCCNC1 MCULE-3528761801 [0,1,0,1,0,0|2,0,0]=4 2537 B9R1.6 CC(S)C1CCCCC1 MCULE-3622234308 [0,1,0,1,0,0|2,0,0]=4 2538 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-3071844374 [0,1,0,1,0,0|2,0,0]=4 2539 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-6526660266 [0,1,0,1,0,0|2,0,0]=4 2540 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-8321480556 [0,1,0,1,0,0|2,0,0]=4 2541 B9R1.6 C[C@@H](N)C1CCCCC1 MCULE-8767179050 [0,1,0,1,0,0|2,0,0]=4 2542 B9R1.6 C[C@@H](N)C1CCCCO1 MCULE-3320469003 [0,1,0,1,0,0|1,1,0]=4 2543 B9R1.6 C[C@@H](N)C1CCCCO1 MCULE-9895193081 [0,1,0,1,0,0|1,1,0]=4 2544 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-4304404236 [0,1,0,1,0,0|2,0,0]=4 2545 B9R1.6 C[C@@H](O)C1CCCCC1 MCULE-7854211857 [0,1,0,1,0,0|2,0,0]=4 2546 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-1031735669 [0,1,0,1,0,0|2,0,0]=4 2547 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-3061879771 [0,1,0,1,0,0|2,0,0]=4 2548 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-7933942708 [0,1,0,1,0,0|2,0,0]=4 2549 B9R1.6 C[C@H](N)C1CCCCC1 MCULE-8070329731 [0,1,0,1,0,0|2,0,0]=4 2550 B9R1.6 C[C@H](O)C1CCCCC1 MCULE-9702860419 [0,1,0,1,0,0|2,0,0]=4 2551 B9R1.13 CC(C)CC1CCCN1 MCULE-1997095742 [0,1,0,1,0,0|2,0,0]=4 2552 B9R1.13 CC(C)CC1CCCN1 MCULE-6128010231 [0,1,0,1,0,0|2,0,0]=4 2553 B9R1.13 CC(N)CC1CCCC1 MCULE-7070144052 [0,1,0,1,0,0|2,0,0]=4 2554 B9R1.13 CC(N)CC1CCCO1 MCULE-7603248274 [0,1,0,1,0,0|1,1,0]=4 2555 B9R1.13 CC(N)CN1CCCC1 MCULE-3580195064 [0,1,0,1,0,0|2,0,0]=4 2556 B9R1.13 CC(N)CN1CCCC1 MCULE-8859795461 [0,1,0,1,0,0|2,0,0]=4 2557 B9R1.13 CC(O)CC1CCCN1 MCULE-7800705257 [0,1,0,1,0,0|2,0,0]=4 2558 B9R1.13 CC(O)CN1CCCC1 MCULE-9204952142 [0,1,0,1,0,0|2,0,0]=4 2559 B9R1.13 C[C@H](N)CN1CCCC1 MCULE-3878391581 [0,1,0,1,0,0|2,0,0]=4 2560 B9R1.13 C[C@H](N)CN1CCCC1 MCULE-9482061465 [0,1,0,1,0,0|2,0,0]=4 2561 B9R1.13 C[C@H](O)CN1CCCC1 MCULE-5532103843 [0,1,0,1,0,0|2,0,0]=4 2562 B9R1.40 CC1CCCCC1(C)N MCULE-4488389841 [0,1,0,1,0,0|2,0,0]=4 2563 B9R1.40 CC1CCNCC1(C)C MCULE-9805063465 [0,1,0,1,0,0|2,0,0]=4 2564 B9R1.40 CC1CCNCC1(C)O MCULE-6091048331 [0,1,0,1,0,0|2,0,0]=4 2565 B9R1.40 CC1CCNCC1(C)O MCULE-7827878467 [0,1,0,1,0,0|2,0,0]=4 2566 B9R1.40 CC1CNCCC1(C)O MCULE-3050558506 [0,1,0,1,0,0|2,0,0]=4 2567 B9R1.40 CC1CNCCC1(C)O MCULE-7122670765 [0,1,0,1,0,0|2,0,0]=4 2568 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O MCULE-2566777989 [0,1,0,1,0,0|2,0,0]=4 2569 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O MCULE-7280139378 [0,1,0,1,0,0|2,0,0]=4 2570 B9R1.40 C[C@@H]1CCNC[C@]1(C)O MCULE-1559795322 [0,1,0,1,0,0|2,0,0]=4 2571 B9R1.40 C[C@@H]1CCNC[C@]1(C)O MCULE-6569914928 [0,1,0,1,0,0|2,0,0]=4 2572 B9R1.40 C[C@H]1CCNC[C@@]1(C)O MCULE-1130241051 [0,1,0,1,0,0|2,0,0]=4 2573 B9R1.40 C[C@H]1CCNC[C@@]1(C)O MCULE-3222740777 [0,1,0,1,0,0|2,0,0]=4 2574 B9R1.40 C[C@H]1CCNC[C@]1(C)O MCULE-1911925525 [0,1,0,1,0,0|2,0,0]=4 2575 B9R1.40 C[C@H]1CCNC[C@]1(C)O MCULE-9810022632 [0,1,0,1,0,0|2,0,0]=4 2576 B9R1.85 CC(C)CCNC1CC1 MCULE-5912195683 [0,1,0,1,0,0|2,0,0]=4 2577 B9R1.85 CC(C)CCNC1CC1 MCULE-6493421017 [0,1,0,1,0,0|2,0,0]=4 2578 B9R1.85 CC(C)CNCC1CC1 MCULE-2546937575 [0,1,0,1,0,0|2,0,0]=4 2579 B9R1.85 CC(C)CNCC1CC1 MCULE-3801277935 [0,1,0,1,0,0|2,0,0]=4 2580 B9R1.85 CC(N)COCC1CC1 MCULE-9401123532 [0,1,0,1,0,0|1,1,0]=4 2581 B9R1.148 CC1(CCCCCC1)N MCULE-1779116362 [0,1,0,1,0,0|2,0,0]=4 2582 B9R1.148 CC1(CCCCCC1)N MCULE-5391477735 [0,1,0,1,0,0|2,0,0]=4 2583 B9R1.148 CC1(CCCCCC1)O MCULE-5108307354 [0,1,0,1,0,0|2,0,0]=4 2584 B9R1.148 CC1(CCCCNC1)C MCULE-5568533519 [0,1,0,1,0,0|2,0,0]=4 2585 B9R1.148 CC1(CCCCNC1)F MCULE-2828709987 [0,1,0,1,0,0|2,0,0]=4 2586 B9R1.148 CC1(CCCCNC1)F MCULE-5791441123 [0,1,0,1,0,0|2,0,0]=4 2587 B9R1.148 CC1(CCCCNC1)O MCULE-3442956887 [0,1,0,1,0,0|2,0,0]=4 2588 B9R1.148 CC1(CCCCNC1)O MCULE-8578810557 [0,1,0,1,0,0|2,0,0]=4 2589 B9R1.148 CC1(CCCNCC1)C MCULE-6478466697 [0,1,0,1,0,0|2,0,0]=4 2590 B9R1.148 CC1(CCCNCC1)C MCULE-8225608765 [0,1,0,1,0,0|2,0,0]=4 2591 B9R1.148 CC1(CCCNCC1)F MCULE-7938264867 [0,1,0,1,0,0|2,0,0]=4 2592 B9R1.148 CC1(CCCNCC1)F MCULE-8871866901 [0,1,0,1,0,0|2,0,0]=4 2593 B9R1.148 CC1(CCCNCC1)O MCULE-5871089190 [0,1,0,1,0,0|2,0,0]=4 2594 B9R1.148 CC1(CCCNCC1)O MCULE-9618304213 [0,1,0,1,0,0|2,0,0]=4 2595 B9R1.148 C[C@@]1(CCCNCC1)O MCULE-2380155794 [0,1,0,1,0,0|2,0,0]=4 2596 B9R1.148 C[C@@]1(CCCNCC1)O MCULE-8167005767 [0,1,0,1,0,0|2,0,0]=4 2597 B9R2.49 C12CCC(CC1)NC2 MCULE-5378947956 [0,0,0,2,0,0|2,0,0]=4 2598 B9R2.49 C1CC2CCC1CN2 MCULE-1608637741 [0,0,0,2,0,0|2,0,0]=4 2599 B9R2.49 C1CC2CCC1CN2 MCULE-7057871790 [0,0,0,2,0,0|2,0,0]=4 2600 B9R2.49 C1CC2CCC1NO2 MCULE-4140193508 [0,0,0,2,0,0|1,1,0]=4 2601 B9R2.49 C1CC2CCC1NO2 MCULE-8213101233 [0,0,0,2,0,0|1,1,0]=4 2602 B9R2.50 C1CCC2NCC2C1 MCULE-8742032434 [0,0,0,2,0,0|2,0,0]=4 2603 B9R2.50 C1CC[C@H]2NC[C@H]2C1 MCULE-6463847774 [0,0,0,2,0,0|2,0,0]=4 2604 B9R2.50 C1CSC2CCC2N1 MCULE-5189356660 [0,0,0,2,0,0|2,0,0]=4 2605 B9R2.50 C1CSC2CCC2N1 MCULE-5638401651 [0,0,0,2,0,0|2,0,0]=4 2606 B9R2.56 CCC12CNCC1C2 MCULE-4892494743 [0,0,0,2,0,0|2,0,0]=4 2607 B9R2.56 CCC12CNCC1C2 MCULE-9372840219 [0,0,0,2,0,0|2,0,0]=4 2608 B9R2.56 CC[C@]12CNC[C@H]1C2 MCULE-6315765450 [0,0,0,2,0,0|2,0,0]=4 2609 B9R2.68 C1=CC2CCC(C1)C2 MCULE-8992637581 [0,0,0,2,0,0|2,0,0]=4 2610 B9R2.68 C1CC2CCC(C1)N2 MCULE-4168667116 [0,0,0,2,0,0|2,0,0]=4 2611 B9R2.68 C1CC2CCC(C1)N2 MCULE-7236821450 [0,0,0,2,0,0|2,0,0]=4 2612 B9R2.68 C1CC2CCC(C2)N1 MCULE-4183302228 [0,0,0,2,0,0|2,0,0]=4 2613 B9R2.68 C1CC2CNC(C1)C2 MCULE-9303917223 [0,0,0,2,0,0|2,0,0]=4 2614 B9R2.68 C1CC2CNCC1C2 MCULE-4832064037 [0,0,0,2,0,0|2,0,0]=4 2615 B9R2.68 C1CC2CNCC1C2 MCULE-5527128917 [0,0,0,2,0,0|2,0,0]=4 2616 B9R2.68 C1CC2CSCC1N2 MCULE-3835664527 [0,0,0,2,0,0|2,0,0]=4 2617 B9R2.68 C1CC2CSCC1N2 MCULE-7790056871 [0,0,0,2,0,0|2,0,0]=4 2618 B9R2.68 C1C[C@@H]2CC[C@@H](C1)N2 MCULE-5766645012 [0,0,0,2,0,0|2,0,0]=4 2619 B9R2.68 C1C[C@@H]2CC[C@@H](C1)N2 MCULE-7351504566 [0,0,0,2,0,0|2,0,0]=4 2620 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 MCULE-3223751153 [0,0,0,2,0,0|2,0,0]=4 2621 B9R2.68 C1C[C@H]2CNC[C@@H]1C2 MCULE-9016762675 [0,0,0,2,0,0|2,0,0]=4 2622 B9R2.68 [C@@H]12C=CC[C@@H](C1)CC2 MCULE-3286132303 [0,0,0,2,0,0|2,0,0]=4 2623 B9R2.68 [C@@H]12C=CC[C@@H](C1)CC2 MCULE-8863392768 [0,0,0,2,0,0|2,0,0]=4 2624 B9R2.68 [C@@H]12CCC[C@@H](N1)CC2 MCULE-7591609146 [0,0,0,2,0,0|2,0,0]=4 2625 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-1467331283 [0,0,0,2,0,0|2,0,0]=4 2626 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-2418052547 [0,0,0,2,0,0|2,0,0]=4 2627 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-6209165116 [0,0,0,2,0,0|2,0,0]=4 2628 B9R2.68 [C@H]12CCC[C@H](C1)NC2 MCULE-8532594937 [0,0,0,2,0,0|2,0,0]=4 2629 B9R2.174 C1CCC2(CC2)NC1 MCULE-5869251937 [0,0,0,2,0,0|2,0,0]=4 2630 B9R2.174 C1CCC2(CC2)NC1 MCULE-7736659784 [0,0,0,2,0,0|2,0,0]=4 2631 B9R2.174 C1CNCC2(C1)CC2 MCULE-5445117072 [0,0,0,2,0,0|2,0,0]=4 2632 B9R2.174 C1CNCC2(C1)CC2 MCULE-7383631601 [0,0,0,2,0,0|2,0,0]=4 2633 B9R2.6 CC12CCNCC1C2 MCULE-3852242839 [0,0,0,2,0,0|2,0,0]=4 2634 B9R2.6 CC12CCNCC1C2 MCULE-7139431712 [0,0,0,2,0,0|2,0,0]=4 2635 B9R2.2 C1CNC(C1)C2CC2 MCULE-4065582142 [0,0,0,2,0,0|2,0,0]=4 2636 B9R2.2 C1CNC(C1)C2CC2 MCULE-5455340854 [0,0,0,2,0,0|2,0,0]=4 2637 B9R2.2 C1CN[C@@H](C1)C2CC2 MCULE-7221097628 [0,0,0,2,0,0|2,0,0]=4 2638 B9R2.2 C1CN[C@H](C1)C2CC2 MCULE-5794661860 [0,0,0,2,0,0|2,0,0]=4 2639 B9R2.2 C1CN[C@H](C1)C2CC2 MCULE-6439311289 [0,0,0,2,0,0|2,0,0]=4 2640 B9R2.3 C12CNCC1CSC2 MCULE-4209187762 [0,0,0,2,0,0|2,0,0]=4 2641 B9R2.3 C1CC2=[N+](C1)CCC2 MCULE-1930488265 [0,0,0,2,0,0|2,0,0]=4 2642 B9R2.3 C1CC2=[N+](C1)CCC2 MCULE-9945987839 [0,0,0,2,0,0|2,0,0]=4 2643 B9R2.3 C1CC2CCCN2C1 MCULE-6728135230 [0,0,0,2,0,0|2,0,0]=4 2644 B9R2.3 C1CC2CCNC2C1 MCULE-5515150209 [0,0,0,2,0,0|2,0,0]=4 2645 B9R2.3 C1CC2CCNC2C1 MCULE-5871309108 [0,0,0,2,0,0|2,0,0]=4 2646 B9R2.3 C1CC2CNCC2C1 MCULE-3990530688 [0,0,0,2,0,0|2,0,0]=4 2647 B9R2.3 C1CC2CNCC2C1 MCULE-7336505089 [0,0,0,2,0,0|2,0,0]=4 2648 B9R2.3 C1C[C@@H]2CNC[C@@H]2C1 MCULE-1442161488 [0,0,0,2,0,0|2,0,0]=4 2649 B9R2.3 C1C[C@@H]2CNC[C@@H]2C1 MCULE-8304704842 [0,0,0,2,0,0|2,0,0]=4 2650 B9R2.3 C1C[C@H]2CNC[C@@H]2C1 MCULE-3619853039 [0,0,0,2,0,0|2,0,0]=4 2651 B9R2.3 C1C[C@H]2CNC[C@@H]2C1 MCULE-8709026258 [0,0,0,2,0,0|2,0,0]=4 2652 B9R2.3 C1NCC2C1CSC2 MCULE-9926766990 [0,0,0,2,0,0|2,0,0]=4 2653 B9R2.3 C1NC[C@H]2[C@@H]1CSC2 MCULE-9780028056 [0,0,0,2,0,0|2,0,0]=4 2654 B9R2.3 [C@@H]12CNC[C@@H]1CSC2 MCULE-7060007573 [0,0,0,2,0,0|2,0,0]=4 2655 B9R2.3 [C@H]12CCC[C@@H]1CNC2 MCULE-2983694048 [0,0,0,2,0,0|2,0,0]=4 2656 B9R2.3 [C@H]12CCC[C@H]1NCC2 MCULE-5749214212 [0,0,0,2,0,0|2,0,0]=4 2657 B9R2.3 [C@H]12CCC[C@H]1NCC2 MCULE-5820731225 [0,0,0,2,0,0|2,0,0]=4 2658 B9R2.173 C1CC2(C1)NCCS2 MCULE-3700316415 [0,0,0,2,0,0|2,0,0]=4 2659 B9R2.173 C1CNC2(C1)CCC2 MCULE-2687541892 [0,0,0,2,0,0|2,0,0]=4 2660 B9R2.173 C1CNC2(C1)CCC2 MCULE-3520517610 [0,0,0,2,0,0|2,0,0]=4 2661 B9R2.173 C1CNC2(C1)CCC2 MCULE-3744982863 [0,0,0,2,0,0|2,0,0]=4 2662 B9R2.173 C1CNC2(C1)CCC2 MCULE-3979119270 [0,0,0,2,0,0|2,0,0]=4 2663 B9R2.173 C1CNC2(C1)CCC2 MCULE-8598781957 [0,0,0,2,0,0|2,0,0]=4 2664 B9R2.21 CC1CCC2OC2C1 MCULE-6465413460 [0,0,0,2,0,0|1,1,0]=4 2665 B9R2.52 C1CC2CC2CCN1 MCULE-6717611395 [0,0,0,2,0,0|2,0,0]=4 2666 B9R2.52 C1CCC2OC2CC1 MCULE-7174861520 [0,0,0,2,0,0|1,1,0]=4 2667 B9R2.52 C1CNCC2CC2C1 MCULE-9824117173 [0,0,0,2,0,0|2,0,0]=4 2668 B9R2.51 C1CC2CC(N2)CS1 MCULE-4729108885 [0,0,0,2,0,0|2,0,0]=4 2669 B9R2.157 C1CC(C1)NC2CC2 MCULE-3509788550 [0,0,0,2,0,0|2,0,0]=4 2670 B9R2.157 C1CC(C1)NC2CC2 MCULE-4496609945 [0,0,0,2,0,0|2,0,0]=4 2671 B9R2.69 C1CC1CNC2CC2 MCULE-5501616715 [0,0,0,2,0,0|2,0,0]=4