0 B6R0.1 C#CC(=O)CCC MCULE-8990254228 [0,0,0,0,0,0|1,0,1]=2 1 B6R0.1 C#CC(=O)NCC MCULE-3703208943 [0,0,0,0,0,0|2,0,1]=3 2 B6R0.1 C#CC(=O)OCC MCULE-3783424133 [0,0,0,0,0,0|2,0,1]=3 3 B6R0.1 C#CC(N)CCC MCULE-1649795667 [0,0,0,0,0,0|2,0,2]=4 4 B6R0.1 C#CC(N)CCC MCULE-4074347601 [0,0,0,0,0,0|2,0,2]=4 5 B6R0.1 C#CC(O)CCC MCULE-6152066005 [0,0,0,0,0,0|1,0,3]=4 6 B6R0.1 C#CCC(=O)OC MCULE-8097491486 [0,0,0,0,0,0|0,0,2]=2 7 B6R0.1 C(=C/C(=O)CC)\C MCULE-9250312874 [0,0,0,0,0,0|1,0,2]=3 8 B6R0.1 C/C=C/C(=O)OC MCULE-8935178488 [0,0,0,0,0,0|0,0,2]=2 9 B6R0.1 C=C(CC)CCO MCULE-5317656776 [0,0,0,0,0,0|3,0,0]=3 10 B6R0.1 C=C=CC(=O)OC MCULE-7885631451 [0,0,0,0,0,0|0,0,3]=3 11 B6R0.1 C=CC(=O)CCC MCULE-9373104880 [0,0,0,0,0,0|1,0,1]=2 12 B6R0.1 C=CC(=O)COC MCULE-1933195578 [0,0,0,0,0,0|2,0,1]=3 13 B6R0.1 C=CC(=O)NCC MCULE-3515057147 [0,0,0,0,0,0|2,0,1]=3 14 B6R0.1 C=CC(=O)NCO MCULE-3627112877 [0,0,0,0,0,0|3,0,1]=4 15 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [0,0,0,0,0,0|2,0,1]=3 16 B6R0.1 C=CC(C)CCC MCULE-2692803387 [0,0,0,0,0,0|2,0,2]=4 17 B6R0.1 C=CC(O)CCC MCULE-3664453040 [0,0,0,0,0,0|1,0,3]=4 18 B6R0.1 C=CCC(=O)CN MCULE-3960819679 [0,0,0,0,0,0|2,0,2]=4 19 B6R0.1 C=CCC(=O)CN MCULE-8089375331 [0,0,0,0,0,0|2,0,2]=4 20 B6R0.1 C=CCC(=O)NC MCULE-4823208577 [0,0,0,0,0,0|1,0,2]=3 21 B6R0.1 C=CCC(=O)OC MCULE-5546680906 [0,0,0,0,0,0|0,0,2]=2 22 B6R0.1 C=COC(=O)CC MCULE-7662621547 [0,0,0,0,0,0|2,0,2]=4 23 B6R0.1 CC#CC(=O)NN MCULE-2475728417 [0,0,0,0,0,0|2,0,2]=4 24 B6R0.1 CC#CC(=O)OC MCULE-6108678475 [0,0,0,0,0,0|0,0,2]=2 25 B6R0.1 CC/C=C(\C)/C=O MCULE-6692882718 [0,0,0,0,0,0|3,0,1]=4 26 B6R0.1 CC=CC(=O)CC MCULE-5948495959 [0,0,0,0,0,0|1,0,2]=3 27 B6R0.1 CC=CC(=O)OC MCULE-1093700917 [0,0,0,0,0,0|0,0,2]=2 28 B6R0.1 CCC(=CCO)C MCULE-5264054153 [0,0,0,0,0,0|3,0,1]=4 29 B6R0.1 CCC(=O)CC#N MCULE-6150629588 [0,0,0,0,0,0|2,0,1]=3 30 B6R0.1 CCC(=O)CNC MCULE-3030105640 [0,0,0,0,0,0|2,0,0]=2 31 B6R0.1 CCC(=O)CNC MCULE-6945295017 [0,0,0,0,0,0|2,0,0]=2 32 B6R0.1 CCC(=O)COC MCULE-1087802011 [0,0,0,0,0,0|2,0,0]=2 33 B6R0.1 CCC(=O)CSC MCULE-3230433182 [0,0,0,0,0,0|2,0,0]=2 34 B6R0.1 CCC(=O)NOC MCULE-4440074406 [0,0,0,0,0,0|3,0,0]=3 35 B6R0.1 CCC(=O)OCCl MCULE-6975707373 [0,0,0,0,0,0|3,0,0]=3 36 B6R0.1 CCC(Br)COC MCULE-7942540965 [0,0,0,0,0,0|3,0,1]=4 37 B6R0.1 CCC(C)CCBr MCULE-6033010731 [0,0,0,0,0,0|3,0,1]=4 38 B6R0.1 CCC(C)CCCl MCULE-2069721626 [0,0,0,0,0,0|3,0,1]=4 39 B6R0.1 CCC(C)CCN MCULE-4140800594 [0,0,0,0,0,0|3,0,1]=4 40 B6R0.1 CCC(C)CCN MCULE-5509248218 [0,0,0,0,0,0|3,0,1]=4 41 B6R0.1 CCC(C)CCO MCULE-6482427735 [0,0,0,0,0,0|3,0,1]=4 42 B6R0.1 CCC(C)CNC MCULE-1998406301 [0,0,0,0,0,0|3,0,1]=4 43 B6R0.1 CCC(C)CNC MCULE-5957910094 [0,0,0,0,0,0|3,0,1]=4 44 B6R0.1 CCC(N)CCN MCULE-8956610037 [0,0,0,0,0,0|3,0,1]=4 45 B6R0.1 CCC(N)CCO MCULE-1511155206 [0,0,0,0,0,0|3,0,1]=4 46 B6R0.1 CCC(N)CCO MCULE-5525302643 [0,0,0,0,0,0|3,0,1]=4 47 B6R0.1 CCC(N)COC MCULE-2103613859 [0,0,0,0,0,0|3,0,1]=4 48 B6R0.1 CCC(N)COC MCULE-5835446359 [0,0,0,0,0,0|3,0,1]=4 49 B6R0.1 CCC(N)CSC MCULE-9145513729 [0,0,0,0,0,0|3,0,1]=4 50 B6R0.1 CCC(O)CCN MCULE-5387303971 [0,0,0,0,0,0|2,0,2]=4 51 B6R0.1 CCC(O)CCO MCULE-5156075792 [0,0,0,0,0,0|2,0,2]=4 52 B6R0.1 CCC(O)CNC MCULE-2490431367 [0,0,0,0,0,0|2,0,2]=4 53 B6R0.1 CCC(O)COC MCULE-6751000060 [0,0,0,0,0,0|2,0,2]=4 54 B6R0.1 CCC(O)CSC MCULE-3582683720 [0,0,0,0,0,0|2,0,2]=4 55 B6R0.1 CCC(S)CCO MCULE-4193788852 [0,0,0,0,0,0|2,1,1]=4 56 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [0,0,0,0,0,0|3,0,0]=3 57 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [0,0,0,0,0,0|3,0,0]=3 58 B6R0.1 CCC=C(C)C=O MCULE-1636090264 [0,0,0,0,0,0|3,0,1]=4 59 B6R0.1 CCCC(=NO)C MCULE-6437787263 [0,0,0,0,0,0|3,0,0]=3 60 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [0,0,0,0,0,0|2,0,0]=2 61 B6R0.1 CCCC(=O)CC MCULE-7121523805 [0,0,0,0,0,0|1,0,0]=1 62 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [0,0,0,0,0,0|2,0,0]=2 63 B6R0.1 CCCC(=O)CN MCULE-4663263123 [0,0,0,0,0,0|2,0,0]=2 64 B6R0.1 CCCC(=O)CN MCULE-6326368932 [0,0,0,0,0,0|2,0,0]=2 65 B6R0.1 CCCC(=O)CO MCULE-6518249412 [0,0,0,0,0,0|2,0,0]=2 66 B6R0.1 CCCC(=O)NC MCULE-5770149071 [0,0,0,0,0,0|1,0,0]=1 67 B6R0.1 CCCC(=O)NN MCULE-3660167295 [0,0,0,0,0,0|2,0,0]=2 68 B6R0.1 CCCC(=O)NO MCULE-8710375368 [0,0,0,0,0,0|2,0,0]=2 69 B6R0.1 CCCC(=O)OC MCULE-1092030267 [0,0,0,0,0,0|0,0,0]=0 70 B6R0.1 CCCC(=O)SC MCULE-1490654381 [0,0,0,0,0,0|0,1,0]=1 71 B6R0.1 CCCC(=S)OC MCULE-8125476093 [0,0,0,0,0,0|0,1,0]=1 72 B6R0.1 CCCC(Br)CC MCULE-9116433502 [0,0,0,0,0,0|2,0,1]=3 73 B6R0.1 CCCC(C)C#N MCULE-2492294131 [0,0,0,0,0,0|3,0,1]=4 74 B6R0.1 CCCC(C)C=O MCULE-9756444218 [0,0,0,0,0,0|3,0,1]=4 75 B6R0.1 CCCC(C)CBr MCULE-3437352091 [0,0,0,0,0,0|3,0,1]=4 76 B6R0.1 CCCC(C)CC MCULE-7082933967 [0,0,0,0,0,0|2,0,1]=3 77 B6R0.1 CCCC(C)CCl MCULE-2381010454 [0,0,0,0,0,0|3,0,1]=4 78 B6R0.1 CCCC(C)CN MCULE-9552289739 [0,0,0,0,0,0|3,0,1]=4 79 B6R0.1 CCCC(C)CO MCULE-9777250826 [0,0,0,0,0,0|3,0,1]=4 80 B6R0.1 CCCC(C)NC MCULE-1560121168 [0,0,0,0,0,0|2,0,1]=3 81 B6R0.1 CCCC(C)NC MCULE-2169396338 [0,0,0,0,0,0|2,0,1]=3 82 B6R0.1 CCCC(Cl)CC MCULE-1581617529 [0,0,0,0,0,0|2,0,1]=3 83 B6R0.1 CCCC(Cl)CCl MCULE-9464139069 [0,0,0,0,0,0|3,0,1]=4 84 B6R0.1 CCCC(N)C#N MCULE-6830545935 [0,0,0,0,0,0|3,0,1]=4 85 B6R0.1 CCCC(N)C#N MCULE-9818121096 [0,0,0,0,0,0|3,0,1]=4 86 B6R0.1 CCCC(N)CC MCULE-5349906741 [0,0,0,0,0,0|2,0,1]=3 87 B6R0.1 CCCC(N)CC MCULE-7172418373 [0,0,0,0,0,0|2,0,1]=3 88 B6R0.1 CCCC(N)CN MCULE-8606218569 [0,0,0,0,0,0|3,0,1]=4 89 B6R0.1 CCCC(N)CO MCULE-3404967504 [0,0,0,0,0,0|3,0,1]=4 90 B6R0.1 CCCC(N)CO MCULE-3802448518 [0,0,0,0,0,0|3,0,1]=4 91 B6R0.1 CCCC(N)CO MCULE-4259078445 [0,0,0,0,0,0|3,0,1]=4 92 B6R0.1 CCCC(N)CO MCULE-6425025734 [0,0,0,0,0,0|3,0,1]=4 93 B6R0.1 CCCC(O)C#N MCULE-7017059503 [0,0,0,0,0,0|2,0,2]=4 94 B6R0.1 CCCC(O)CBr MCULE-5186252424 [0,0,0,0,0,0|2,0,2]=4 95 B6R0.1 CCCC(O)CC MCULE-9504041935 [0,0,0,0,0,0|1,0,2]=3 96 B6R0.1 CCCC(O)CCl MCULE-4737360217 [0,0,0,0,0,0|2,0,2]=4 97 B6R0.1 CCCC(O)CN MCULE-9402934997 [0,0,0,0,0,0|2,0,2]=4 98 B6R0.1 CCCC(O)CO MCULE-5124107719 [0,0,0,0,0,0|2,0,2]=4 99 B6R0.1 CCCC(S)CC MCULE-1322481338 [0,0,0,0,0,0|1,1,1]=3 100 B6R0.1 CCC[C@@H](N)CF MCULE-4702552251 [0,0,0,0,0,0|3,0,1]=4 101 B6R0.1 CCC[C@@H](N)CF MCULE-8118043624 [0,0,0,0,0,0|3,0,1]=4 102 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [0,0,0,0,0,0|3,0,1]=4 103 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [0,0,0,0,0,0|3,0,1]=4 104 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [0,0,0,0,0,0|3,0,1]=4 105 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [0,0,0,0,0,0|1,0,2]=3 106 B6R0.1 CCC[C@H](N)CF MCULE-7192744944 [0,0,0,0,0,0|3,0,1]=4 107 B6R0.1 CCC[C@H](N)CF MCULE-7441387613 [0,0,0,0,0,0|3,0,1]=4 108 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [0,0,0,0,0,0|3,0,1]=4 109 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [0,0,0,0,0,0|3,0,1]=4 110 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [0,0,0,0,0,0|3,0,1]=4 111 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [0,0,0,0,0,0|3,0,1]=4 112 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [0,0,0,0,0,0|1,0,2]=3 113 B6R0.1 CCN(C)CCCl MCULE-4264927085 [0,0,0,0,0,0|4,0,0]=4 114 B6R0.1 CCN(C)CCCl MCULE-8125659652 [0,0,0,0,0,0|4,0,0]=4 115 B6R0.1 CCN(C)CCN MCULE-9503910262 [0,0,0,0,0,0|4,0,0]=4 116 B6R0.1 CCN(C)CCO MCULE-5519271145 [0,0,0,0,0,0|4,0,0]=4 117 B6R0.1 CCN(C)CCS MCULE-9974758531 [0,0,0,0,0,0|4,0,0]=4 118 B6R0.1 CCN(N)CCO MCULE-7988723724 [0,0,0,0,0,0|4,0,0]=4 119 B6R0.1 CCNC(=O)CBr MCULE-5393521747 [0,0,0,0,0,0|3,0,0]=3 120 B6R0.1 CCNC(=O)CC MCULE-8820594723 [0,0,0,0,0,0|2,0,0]=2 121 B6R0.1 CCNC(=O)CCl MCULE-7288703153 [0,0,0,0,0,0|3,0,0]=3 122 B6R0.1 CCNC(=O)CN MCULE-1913543460 [0,0,0,0,0,0|3,0,0]=3 123 B6R0.1 CCNC(=O)CN MCULE-5473845751 [0,0,0,0,0,0|3,0,0]=3 124 B6R0.1 CCNC(=O)CO MCULE-1386307800 [0,0,0,0,0,0|3,0,0]=3 125 B6R0.1 CCNC(=O)NC MCULE-7197803115 [0,0,0,0,0,0|2,0,0]=2 126 B6R0.1 CCNC(=O)NN MCULE-9055200574 [0,0,0,0,0,0|3,0,0]=3 127 B6R0.1 CCNC(=O)NO MCULE-3264850022 [0,0,0,0,0,0|3,0,0]=3 128 B6R0.1 CCNC(=O)OC MCULE-7110705188 [0,0,0,0,0,0|1,0,0]=1 129 B6R0.1 CCNC(=S)NN MCULE-9599210899 [0,0,0,0,0,0|3,1,0]=4 130 B6R0.1 CCNC(C)CC MCULE-1017617081 [0,0,0,0,0,0|3,0,1]=4 131 B6R0.1 CCNC(C)CC MCULE-2691229640 [0,0,0,0,0,0|3,0,1]=4 132 B6R0.1 CCO/C(=N/O)/C MCULE-2336241507 [0,0,0,0,0,0|4,0,0]=4 133 B6R0.1 CCO/C(=N\O)/C MCULE-7101376522 [0,0,0,0,0,0|4,0,0]=4 134 B6R0.1 CCOC(=N)CC MCULE-4645506860 [0,0,0,0,0,0|3,0,0]=3 135 B6R0.1 CCOC(=N)CC MCULE-9526837631 [0,0,0,0,0,0|3,0,0]=3 136 B6R0.1 CCOC(=N)CCl MCULE-6291047852 [0,0,0,0,0,0|4,0,0]=4 137 B6R0.1 CCOC(=N)CCl MCULE-9207251975 [0,0,0,0,0,0|4,0,0]=4 138 B6R0.1 CCOC(=NO)C MCULE-6964305821 [0,0,0,0,0,0|4,0,0]=4 139 B6R0.1 CCOC(=O)C#N MCULE-4506452376 [0,0,0,0,0,0|3,0,0]=3 140 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [0,0,0,0,0,0|3,0,0]=3 141 B6R0.1 CCOC(=O)CBr MCULE-1369687761 [0,0,0,0,0,0|3,0,0]=3 142 B6R0.1 CCOC(=O)CC MCULE-1639864693 [0,0,0,0,0,0|2,0,0]=2 143 B6R0.1 CCOC(=O)CCl MCULE-2200524105 [0,0,0,0,0,0|3,0,0]=3 144 B6R0.1 CCOC(=O)CF MCULE-1926097423 [0,0,0,0,0,0|3,0,0]=3 145 B6R0.1 CCOC(=O)CI MCULE-9898762324 [0,0,0,0,0,0|3,0,0]=3 146 B6R0.1 CCOC(=O)CN MCULE-2185173056 [0,0,0,0,0,0|3,0,0]=3 147 B6R0.1 CCOC(=O)CN MCULE-2628607025 [0,0,0,0,0,0|3,0,0]=3 148 B6R0.1 CCOC(=O)CO MCULE-8121340151 [0,0,0,0,0,0|3,0,0]=3 149 B6R0.1 CCOC(=O)CS MCULE-3354026239 [0,0,0,0,0,0|3,0,0]=3 150 B6R0.1 CCOC(=O)NC MCULE-5506841198 [0,0,0,0,0,0|2,0,0]=2 151 B6R0.1 CCOC(=O)NN MCULE-9872948119 [0,0,0,0,0,0|3,0,0]=3 152 B6R0.1 CCOC(=O)NO MCULE-4701193610 [0,0,0,0,0,0|3,0,0]=3 153 B6R0.1 CCOC(=O)OC MCULE-1185162684 [0,0,0,0,0,0|1,0,0]=1 154 B6R0.1 CCOC(=S)SC MCULE-6959447720 [0,0,0,0,0,0|1,2,0]=3 155 B6R0.1 CCOC(C)CC MCULE-5049998907 [0,0,0,0,0,0|3,0,1]=4 156 B6R0.1 CCOS(=O)CC MCULE-4858180441 [0,0,0,0,0,0|3,0,0]=3 157 B6R0.1 CCS(=O)CCCl MCULE-1910591721 [0,0,0,0,0,0|3,0,0]=3 158 B6R0.1 CCS(=O)CCN MCULE-7201812983 [0,0,0,0,0,0|3,0,0]=3 159 B6R0.1 CCS(=O)CCN MCULE-7831905163 [0,0,0,0,0,0|3,0,0]=3 160 B6R0.1 CCS(=O)CCO MCULE-8290368918 [0,0,0,0,0,0|3,0,0]=3 161 B6R0.1 CCSC(=O)CC MCULE-6361738004 [0,0,0,0,0,0|2,0,0]=2 162 B6R0.1 CC[C@@H](N)COC MCULE-2231338404 [0,0,0,0,0,0|3,0,1]=4 163 B6R0.1 CC[C@@H](N)COC MCULE-2931188781 [0,0,0,0,0,0|3,0,1]=4 164 B6R0.1 CC[C@@H](N)COC MCULE-5773677141 [0,0,0,0,0,0|3,0,1]=4 165 B6R0.1 CC[C@@H](N)COC MCULE-5939905142 [0,0,0,0,0,0|3,0,1]=4 166 B6R0.1 CC[C@H](C)CCO MCULE-1190203828 [0,0,0,0,0,0|3,0,1]=4 167 B6R0.1 CC[C@H](C)CCO MCULE-8460710173 [0,0,0,0,0,0|3,0,1]=4 168 B6R0.1 CC[C@H](N)COC MCULE-1115072226 [0,0,0,0,0,0|3,0,1]=4 169 B6R0.1 CC[C@H](N)COC MCULE-3917835289 [0,0,0,0,0,0|3,0,1]=4 170 B6R0.1 CC[C@H](N)COC MCULE-8706423122 [0,0,0,0,0,0|3,0,1]=4 171 B6R0.1 CC[C@H](N)COC MCULE-9406311547 [0,0,0,0,0,0|3,0,1]=4 172 B6R0.1 CNC(=O)CC#N MCULE-2970000161 [0,0,0,0,0,0|2,0,1]=3 173 B6R0.1 CNC(=O)CCBr MCULE-9239224841 [0,0,0,0,0,0|2,0,0]=2 174 B6R0.1 CNC(=O)CCCl MCULE-7130866366 [0,0,0,0,0,0|2,0,0]=2 175 B6R0.1 CNC(=O)CCN MCULE-1374127264 [0,0,0,0,0,0|2,0,0]=2 176 B6R0.1 CNC(=O)CCN MCULE-3948893656 [0,0,0,0,0,0|2,0,0]=2 177 B6R0.1 CNC(=O)CCO MCULE-3222339741 [0,0,0,0,0,0|2,0,0]=2 178 B6R0.1 CNC(=O)CCS MCULE-2385806944 [0,0,0,0,0,0|2,0,0]=2 179 B6R0.1 CNC(=O)CON MCULE-6451598359 [0,0,0,0,0,0|3,0,0]=3 180 B6R0.1 CNC(=O)CON MCULE-8743298594 [0,0,0,0,0,0|3,0,0]=3 181 B6R0.1 CNC(=S)NCO MCULE-2829573844 [0,0,0,0,0,0|3,1,0]=4 182 B6R0.1 CNC(C)CCO MCULE-4722422254 [0,0,0,0,0,0|3,0,1]=4 183 B6R0.1 CNC(C)COC MCULE-6864731576 [0,0,0,0,0,0|3,0,1]=4 184 B6R0.1 CNC(C)COC MCULE-9135013355 [0,0,0,0,0,0|3,0,1]=4 185 B6R0.1 CNC(C)CSC MCULE-8293407208 [0,0,0,0,0,0|3,0,1]=4 186 B6R0.1 CNCC(=O)NC MCULE-4579550577 [0,0,0,0,0,0|2,0,0]=2 187 B6R0.1 CNCC(=O)NC MCULE-7833395637 [0,0,0,0,0,0|2,0,0]=2 188 B6R0.1 CNCC(=O)NN MCULE-8639164023 [0,0,0,0,0,0|3,0,0]=3 189 B6R0.1 CNCC(=O)OC MCULE-1667683926 [0,0,0,0,0,0|1,0,0]=1 190 B6R0.1 CNCC(=O)OC MCULE-5530863658 [0,0,0,0,0,0|1,0,0]=1 191 B6R0.1 CNCC(C)OC MCULE-6977139114 [0,0,0,0,0,0|2,0,1]=3 192 B6R0.1 CNCC(C)OC MCULE-8216810034 [0,0,0,0,0,0|2,0,1]=3 193 B6R0.1 CNN(C)CCN MCULE-3863653213 [0,0,0,0,0,0|4,0,0]=4 194 B6R0.1 CNNC(=O)OC MCULE-4763095719 [0,0,0,0,0,0|2,0,0]=2 195 B6R0.1 CO/C(=N/C#N)/C MCULE-8775744872 [0,0,0,0,0,0|3,0,1]=4 196 B6R0.1 COC(=N)CC#N MCULE-1828487034 [0,0,0,0,0,0|2,0,1]=3 197 B6R0.1 COC(=N)CC#N MCULE-5000327296 [0,0,0,0,0,0|2,0,1]=3 198 B6R0.1 COC(=N)CCCl MCULE-1997539408 [0,0,0,0,0,0|2,0,0]=2 199 B6R0.1 COC(=N)CCCl MCULE-2235564076 [0,0,0,0,0,0|2,0,0]=2 200 B6R0.1 COC(=N)CCO MCULE-1904978557 [0,0,0,0,0,0|2,0,0]=2 201 B6R0.1 COC(=N)CCO MCULE-8146089973 [0,0,0,0,0,0|2,0,0]=2 202 B6R0.1 COC(=NC#N)C MCULE-9412459367 [0,0,0,0,0,0|3,0,1]=4 203 B6R0.1 COC(=O)/C=C/Br MCULE-8282646495 [0,0,0,0,0,0|1,0,2]=3 204 B6R0.1 COC(=O)/C=C/I MCULE-2652779390 [0,0,0,0,0,0|1,0,2]=3 205 B6R0.1 COC(=O)/C=C\Br MCULE-8147758029 [0,0,0,0,0,0|1,0,2]=3 206 B6R0.1 COC(=O)/C=C\I MCULE-9091408550 [0,0,0,0,0,0|1,0,2]=3 207 B6R0.1 COC(=O)C#CBr MCULE-2452280844 [0,0,0,0,0,0|1,0,2]=3 208 B6R0.1 COC(=O)C#CI MCULE-2688506741 [0,0,0,0,0,0|1,0,2]=3 209 B6R0.1 COC(=O)C=CBr MCULE-6878439912 [0,0,0,0,0,0|1,0,2]=3 210 B6R0.1 COC(=O)C=CCl MCULE-6895925134 [0,0,0,0,0,0|1,0,2]=3 211 B6R0.1 COC(=O)C=CI MCULE-1616048599 [0,0,0,0,0,0|1,0,2]=3 212 B6R0.1 COC(=O)C=CN MCULE-4685220707 [0,0,0,0,0,0|1,0,2]=3 213 B6R0.1 COC(=O)CC#N MCULE-2699345092 [0,0,0,0,0,0|1,0,1]=2 214 B6R0.1 COC(=O)CC=O MCULE-6624474559 [0,0,0,0,0,0|1,0,1]=2 215 B6R0.1 COC(=O)CCBr MCULE-3565567444 [0,0,0,0,0,0|1,0,0]=1 216 B6R0.1 COC(=O)CCCl MCULE-5034007224 [0,0,0,0,0,0|1,0,0]=1 217 B6R0.1 COC(=O)CCI MCULE-5984806612 [0,0,0,0,0,0|1,0,0]=1 218 B6R0.1 COC(=O)CCN MCULE-2306060188 [0,0,0,0,0,0|1,0,0]=1 219 B6R0.1 COC(=O)CCN MCULE-8245275833 [0,0,0,0,0,0|1,0,0]=1 220 B6R0.1 COC(=O)CCO MCULE-8538834260 [0,0,0,0,0,0|1,0,0]=1 221 B6R0.1 COC(=O)CCS MCULE-1695345183 [0,0,0,0,0,0|1,0,0]=1 222 B6R0.1 COC(=O)CNN MCULE-3287579794 [0,0,0,0,0,0|2,0,0]=2 223 B6R0.1 COC(=O)CNN MCULE-3838874166 [0,0,0,0,0,0|2,0,0]=2 224 B6R0.1 COC(=O)CON MCULE-4799038238 [0,0,0,0,0,0|2,0,0]=2 225 B6R0.1 COC(=O)CSC MCULE-6735536033 [0,0,0,0,0,0|1,0,0]=1 226 B6R0.1 COC(=O)N=C=S MCULE-2981767233 [0,0,0,0,0,0|2,0,1]=3 227 B6R0.1 COC(=O)NC=O MCULE-9852632340 [0,0,0,0,0,0|2,0,1]=3 228 B6R0.1 COC(=O)OCCl MCULE-7856529986 [0,0,0,0,0,0|2,0,0]=2 229 B6R0.1 COC(=O)OCF MCULE-4705008675 [0,0,0,0,0,0|2,0,0]=2 230 B6R0.1 COC(=O)OCI MCULE-8692720175 [0,0,0,0,0,0|2,0,0]=2 231 B6R0.1 COC(C)CC=O MCULE-7243333697 [0,0,0,0,0,0|2,0,2]=4 232 B6R0.1 COC(C)CCN MCULE-8081876282 [0,0,0,0,0,0|2,0,1]=3 233 B6R0.1 COC(C)CCN MCULE-8892057529 [0,0,0,0,0,0|2,0,1]=3 234 B6R0.1 COC(C)CCO MCULE-7396381165 [0,0,0,0,0,0|2,0,1]=3 235 B6R0.1 COC/C(=N/O)/N MCULE-8214035702 [0,0,0,0,0,0|4,0,0]=4 236 B6R0.1 COCC(=N)OC MCULE-2350779439 [0,0,0,0,0,0|2,0,0]=2 237 B6R0.1 COCC(=N)OC MCULE-7810421458 [0,0,0,0,0,0|2,0,0]=2 238 B6R0.1 COCC(=O)CCl MCULE-7542636020 [0,0,0,0,0,0|3,0,0]=3 239 B6R0.1 COCC(=O)NN MCULE-4127487886 [0,0,0,0,0,0|3,0,0]=3 240 B6R0.1 COCC(=O)OC MCULE-8337685268 [0,0,0,0,0,0|1,0,0]=1 241 B6R0.1 COCC(C)OC MCULE-1583498700 [0,0,0,0,0,0|2,0,1]=3 242 B6R0.1 CON(C)CCN MCULE-9318319159 [0,0,0,0,0,0|3,0,0]=3 243 B6R0.1 CONC(=O)OC MCULE-9304532248 [0,0,0,0,0,0|2,0,0]=2 244 B6R0.1 CSC(C)CCN MCULE-5474458753 [0,0,0,0,0,0|2,1,1]=4 245 B6R0.1 CSC(C)CCO MCULE-4317600086 [0,0,0,0,0,0|2,1,1]=4 246 B6R0.1 CSC/C(=N/O)/N MCULE-9599823795 [0,0,0,0,0,0|4,0,0]=4 247 B6R0.1 CSCC(=O)NN MCULE-8151954663 [0,0,0,0,0,0|3,0,0]=3 248 B6R0.1 N#CCC(=O)NN MCULE-9203133961 [0,0,0,0,0,0|3,0,1]=4 249 B6R0.1 N/C(=N\O)/CCO MCULE-1794050637 [0,0,0,0,0,0|4,0,0]=4 250 B6R0.1 N=C(CCCl)NO MCULE-1713601074 [0,0,0,0,0,0|4,0,0]=4 251 B6R0.1 NCC/C(=N/O)/N MCULE-6349866821 [0,0,0,0,0,0|4,0,0]=4 252 B6R0.1 NCCC(=O)CN MCULE-3906468943 [0,0,0,0,0,0|3,0,0]=3 253 B6R0.1 NCCC(=O)CN MCULE-9593243702 [0,0,0,0,0,0|3,0,0]=3 254 B6R0.1 NNC(=O)CCO MCULE-6184351353 [0,0,0,0,0,0|3,0,0]=3 255 B6R0.1 NNC(=O)CCS MCULE-9322963076 [0,0,0,0,0,0|3,0,0]=3 256 B6R0.1 O=C(CCCl)NO MCULE-5569658108 [0,0,0,0,0,0|3,0,0]=3 257 B6R0.1 O=C(CCl)CCCl MCULE-6460902474 [0,0,0,0,0,0|3,0,0]=3 258 B6R0.1 O=C(CCl)NCO MCULE-9960585064 [0,0,0,0,0,0|4,0,0]=4 259 B5R0.1 C#CCC(=O)O MCULE-4680699666 [1,0,0,0,0,0|0,0,2]=3 260 B5R0.1 C(C)(N)CCC MCULE-4800297905 [1,0,0,0,0,0|1,0,1]=3 261 B5R0.1 C(C)(N)CCC MCULE-7674864567 [1,0,0,0,0,0|1,0,1]=3 262 B5R0.1 C(C)(N)CCO MCULE-5545469271 [1,0,0,0,0,0|2,0,1]=4 263 B5R0.1 C/C(=C/CI)/I MCULE-4907089043 [1,0,0,0,0,0|2,0,1]=4 264 B5R0.1 C/C(=C/CN)/Cl MCULE-1091573118 [1,0,0,0,0,0|2,0,1]=4 265 B5R0.1 C/C(=C/CN)/Cl MCULE-8112023611 [1,0,0,0,0,0|2,0,1]=4 266 B5R0.1 C/C(=C\CCl)/Cl MCULE-6679259233 [1,0,0,0,0,0|2,0,1]=4 267 B5R0.1 C/C=C/C(=O)C MCULE-2109656516 [1,0,0,0,0,0|0,0,2]=3 268 B5R0.1 C/C=C/C(=O)Cl MCULE-8378824386 [1,0,0,0,0,0|1,0,2]=4 269 B5R0.1 C/C=C/C(=O)N MCULE-2532228624 [1,0,0,0,0,0|1,0,2]=4 270 B5R0.1 C/C=C/C(=O)O MCULE-6937494852 [1,0,0,0,0,0|0,0,2]=3 271 B5R0.1 C=C(Br)CCBr MCULE-7638627279 [1,0,0,0,0,0|2,0,1]=4 272 B5R0.1 C=C(Br)CCO MCULE-3743908958 [1,0,0,0,0,0|2,0,1]=4 273 B5R0.1 C=C(Br)COC MCULE-5349428431 [1,0,0,0,0,0|2,0,1]=4 274 B5R0.1 C=C(C)CCBr MCULE-3439794005 [1,0,0,0,0,0|2,0,0]=3 275 B5R0.1 C=C(C)CCC MCULE-8225129744 [1,0,0,0,0,0|1,0,0]=2 276 B5R0.1 C=C(C)CCCl MCULE-2816016781 [1,0,0,0,0,0|2,0,0]=3 277 B5R0.1 C=C(C)CCI MCULE-6317205481 [1,0,0,0,0,0|2,0,0]=3 278 B5R0.1 C=C(C)CCN MCULE-4037025602 [1,0,0,0,0,0|2,0,0]=3 279 B5R0.1 C=C(C)CCN MCULE-5001503744 [1,0,0,0,0,0|2,0,0]=3 280 B5R0.1 C=C(C)CCO MCULE-2689800711 [1,0,0,0,0,0|2,0,0]=3 281 B5R0.1 C=C(C)CNC MCULE-6783886553 [1,0,0,0,0,0|2,0,0]=3 282 B5R0.1 C=C(C)CNC MCULE-8292313282 [1,0,0,0,0,0|2,0,0]=3 283 B5R0.1 C=C(C)CNN MCULE-1117931770 [1,0,0,0,0,0|3,0,0]=4 284 B5R0.1 C=C(C)CON MCULE-2773974323 [1,0,0,0,0,0|3,0,0]=4 285 B5R0.1 C=C(C)CON MCULE-5978680243 [1,0,0,0,0,0|3,0,0]=4 286 B5R0.1 C=C(C)OCC MCULE-5303468686 [1,0,0,0,0,0|2,0,0]=3 287 B5R0.1 C=CCC(=C)C MCULE-6294070836 [1,0,0,0,0,0|1,0,2]=4 288 B5R0.1 C=CCC(=O)Cl MCULE-6033189203 [1,0,0,0,0,0|1,0,2]=4 289 B5R0.1 C=CCC(=O)N MCULE-1205335257 [1,0,0,0,0,0|1,0,2]=4 290 B5R0.1 C=CCC(=O)O MCULE-6288979337 [1,0,0,0,0,0|0,0,2]=3 291 B5R0.1 C=CNC(=O)C MCULE-1260296806 [1,0,0,0,0,0|1,0,2]=4 292 B5R0.1 C=COC(=O)C MCULE-7626795765 [1,0,0,0,0,0|1,0,2]=4 293 B5R0.1 C=NCC(=O)N MCULE-7609497329 [1,0,0,0,0,0|2,0,1]=4 294 B5R0.1 CC#CC(=O)C MCULE-4083248904 [1,0,0,0,0,0|0,0,2]=3 295 B5R0.1 CC#CC(=O)Cl MCULE-6807810093 [1,0,0,0,0,0|1,0,2]=4 296 B5R0.1 CC#CC(=O)O MCULE-9994142213 [1,0,0,0,0,0|0,0,2]=3 297 B5R0.1 CC(=CCBr)C MCULE-7961276795 [1,0,0,0,0,0|2,0,1]=4 298 B5R0.1 CC(=CCCl)C MCULE-1110417103 [1,0,0,0,0,0|2,0,1]=4 299 B5R0.1 CC(=CCCl)Cl MCULE-9735045489 [1,0,0,0,0,0|2,0,1]=4 300 B5R0.1 CC(=CCI)I MCULE-4204968539 [1,0,0,0,0,0|2,0,1]=4 301 B5R0.1 CC(=CCN)C MCULE-7220252581 [1,0,0,0,0,0|2,0,1]=4 302 B5R0.1 CC(=CCN)C MCULE-8394581250 [1,0,0,0,0,0|2,0,1]=4 303 B5R0.1 CC(=CCN)Cl MCULE-1749173363 [1,0,0,0,0,0|2,0,1]=4 304 B5R0.1 CC(=CCN)Cl MCULE-5722512850 [1,0,0,0,0,0|2,0,1]=4 305 B5R0.1 CC(=CCO)C MCULE-3984123588 [1,0,0,0,0,0|2,0,1]=4 306 B5R0.1 CC(=CCO)Cl MCULE-6459066496 [1,0,0,0,0,0|2,0,1]=4 307 B5R0.1 CC(=CCO)I MCULE-4600854759 [1,0,0,0,0,0|2,0,1]=4 308 B5R0.1 CC(=CCS)C MCULE-4180446913 [1,0,0,0,0,0|2,0,1]=4 309 B5R0.1 CC(=O)/C=N/O MCULE-5424156575 [1,0,0,0,0,0|2,0,1]=4 310 B5R0.1 CC(=O)/C=N\O MCULE-9083768531 [1,0,0,0,0,0|2,0,1]=4 311 B5R0.1 CC(=O)C=C=O MCULE-4335598177 [1,0,0,0,0,0|1,0,2]=4 312 B5R0.1 CC(=O)C=NO MCULE-5513006918 [1,0,0,0,0,0|2,0,1]=4 313 B5R0.1 CC(=O)CC#N MCULE-7203242552 [1,0,0,0,0,0|1,0,1]=3 314 B5R0.1 CC(=O)CCBr MCULE-2615300206 [1,0,0,0,0,0|1,0,0]=2 315 B5R0.1 CC(=O)CCCl MCULE-8019748964 [1,0,0,0,0,0|1,0,0]=2 316 B5R0.1 CC(=O)CCN MCULE-7550348751 [1,0,0,0,0,0|1,0,0]=2 317 B5R0.1 CC(=O)CCN MCULE-9519063810 [1,0,0,0,0,0|1,0,0]=2 318 B5R0.1 CC(=O)CCO MCULE-6328537335 [1,0,0,0,0,0|1,0,0]=2 319 B5R0.1 CC(=O)N=C=S MCULE-7540453687 [1,0,0,0,0,0|2,0,1]=4 320 B5R0.1 CC(=O)N=S=O MCULE-1420371815 [1,0,0,0,0,0|3,0,0]=4 321 B5R0.1 CC(=O)NC#N MCULE-8444599659 [1,0,0,0,0,0|2,0,1]=4 322 B5R0.1 CC(=O)NCO MCULE-4563335540 [1,0,0,0,0,0|2,0,0]=3 323 B5R0.1 CC(=O)OCBr MCULE-9842804945 [1,0,0,0,0,0|2,0,0]=3 324 B5R0.1 CC(=O)OCCl MCULE-6822222026 [1,0,0,0,0,0|2,0,0]=3 325 B5R0.1 CC(=O)SCBr MCULE-9794607323 [1,0,0,0,0,0|2,0,0]=3 326 B5R0.1 CC(Br)CCBr MCULE-1045475402 [1,0,0,0,0,0|2,0,1]=4 327 B5R0.1 CC(C)CCBr MCULE-7163010428 [1,0,0,0,0,0|2,0,1]=4 328 B5R0.1 CC(C)CCCl MCULE-8360122696 [1,0,0,0,0,0|2,0,1]=4 329 B5R0.1 CC(C)CCCl MCULE-9017922949 [1,0,0,0,0,0|2,0,1]=4 330 B5R0.1 CC(C)CCI MCULE-4934529500 [1,0,0,0,0,0|2,0,1]=4 331 B5R0.1 CC(C)CCN MCULE-3081003576 [1,0,0,0,0,0|2,0,1]=4 332 B5R0.1 CC(C)CCN MCULE-5118782389 [1,0,0,0,0,0|2,0,1]=4 333 B5R0.1 CC(C)CCN MCULE-5217981670 [1,0,0,0,0,0|2,0,1]=4 334 B5R0.1 CC(C)CCN MCULE-6280940933 [1,0,0,0,0,0|2,0,1]=4 335 B5R0.1 CC(C)CCO MCULE-7411270401 [1,0,0,0,0,0|2,0,1]=4 336 B5R0.1 CC(C)CCS MCULE-7115473363 [1,0,0,0,0,0|2,0,1]=4 337 B5R0.1 CC(Cl)CCCl MCULE-3656498608 [1,0,0,0,0,0|2,0,1]=4 338 B5R0.1 CC(Cl)CCO MCULE-1955496242 [1,0,0,0,0,0|2,0,1]=4 339 B5R0.1 CC(F)CCBr MCULE-3035340901 [1,0,0,0,0,0|2,0,1]=4 340 B5R0.1 CC(F)CCI MCULE-6469250150 [1,0,0,0,0,0|2,0,1]=4 341 B5R0.1 CC(F)CCN MCULE-2805813131 [1,0,0,0,0,0|2,0,1]=4 342 B5R0.1 CC(F)CCN MCULE-5849913362 [1,0,0,0,0,0|2,0,1]=4 343 B5R0.1 CC(N)CCN MCULE-5308134596 [1,0,0,0,0,0|2,0,1]=4 344 B5R0.1 CC(N)CCN MCULE-5880045507 [1,0,0,0,0,0|2,0,1]=4 345 B5R0.1 CC(N)CCN MCULE-7827515430 [1,0,0,0,0,0|2,0,1]=4 346 B5R0.1 CC(N)CCO MCULE-1771399942 [1,0,0,0,0,0|2,0,1]=4 347 B5R0.1 CC(N)CCO MCULE-7239872808 [1,0,0,0,0,0|2,0,1]=4 348 B5R0.1 CC(O)CCBr MCULE-7983169885 [1,0,0,0,0,0|1,0,2]=4 349 B5R0.1 CC(O)CCCl MCULE-2952545606 [1,0,0,0,0,0|1,0,2]=4 350 B5R0.1 CC(O)CCN MCULE-6836791276 [1,0,0,0,0,0|1,0,2]=4 351 B5R0.1 CC(O)CCN MCULE-7186260925 [1,0,0,0,0,0|1,0,2]=4 352 B5R0.1 CC(O)CCO MCULE-1694239851 [1,0,0,0,0,0|1,0,2]=4 353 B5R0.1 CC(O)CCO MCULE-7784884948 [1,0,0,0,0,0|1,0,2]=4 354 B5R0.1 CC(S)CCO MCULE-5702212503 [1,0,0,0,0,0|1,1,1]=4 355 B5R0.1 CC=CC(=O)C MCULE-4826977340 [1,0,0,0,0,0|0,0,2]=3 356 B5R0.1 CC=CC(=O)Cl MCULE-2747622237 [1,0,0,0,0,0|1,0,2]=4 357 B5R0.1 CC=CC(=O)N MCULE-9693879476 [1,0,0,0,0,0|1,0,2]=4 358 B5R0.1 CC=CC(=O)O MCULE-7970410217 [1,0,0,0,0,0|0,0,2]=3 359 B5R0.1 CCC=C(C)C MCULE-2405063894 [1,0,0,0,0,0|1,0,1]=3 360 B5R0.1 CCC=C(F)F MCULE-5180612061 [1,0,0,0,0,0|2,0,1]=4 361 B5R0.1 CCCB(O)O MCULE-4994980798 [1,0,0,0,0,0|1,0,1]=3 362 B5R0.1 CCCC(=N)N MCULE-5974105638 [1,0,0,0,0,0|2,0,0]=3 363 B5R0.1 CCCC(=N)N MCULE-9230704591 [1,0,0,0,0,0|2,0,0]=3 364 B5R0.1 CCCC(=O)C MCULE-7174095676 [1,0,0,0,0,0|0,0,0]=1 365 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [1,0,0,0,0,0|1,0,0]=2 366 B5R0.1 CCCC(=O)N MCULE-2712067671 [1,0,0,0,0,0|1,0,0]=2 367 B5R0.1 CCCC(=O)O MCULE-4116382006 [1,0,0,0,0,0|0,0,0]=1 368 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [1,0,0,0,0,0|0,0,1]=2 369 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [1,0,0,0,0,0|0,0,1]=2 370 B5R0.1 CCCC(=S)N MCULE-3529335988 [1,0,0,0,0,0|1,1,0]=3 371 B5R0.1 CCCC(=S)O MCULE-3382199964 [1,0,0,0,0,0|0,1,0]=2 372 B5R0.1 CCCC(C)Br MCULE-3178073667 [1,0,0,0,0,0|1,0,1]=3 373 B5R0.1 CCCC(C)C MCULE-9604552974 [1,0,0,0,0,0|1,0,1]=3 374 B5R0.1 CCCC(C)N MCULE-2640298430 [1,0,0,0,0,0|1,0,1]=3 375 B5R0.1 CCCC(C)N MCULE-7225905167 [1,0,0,0,0,0|1,0,1]=3 376 B5R0.1 CCCC(C)O MCULE-8205906299 [1,0,0,0,0,0|0,0,2]=3 377 B5R0.1 CCCC(C)S MCULE-1649095713 [1,0,0,0,0,0|0,1,1]=3 378 B5R0.1 CCCC(O)Cl MCULE-3188577082 [1,0,0,0,0,0|1,0,1]=3 379 B5R0.1 CCCN(=O)=O MCULE-5615753372 [1,0,0,0,0,0|1,0,1]=3 380 B5R0.1 CCCN(C)C MCULE-8702643596 [1,0,0,0,0,0|2,0,0]=3 381 B5R0.1 CCCS(=O)[O-] MCULE-4306915022 [1,0,0,0,0,0|1,0,1]=3 382 B5R0.1 CCCS(=O)[O-] MCULE-9775151913 [1,0,0,0,0,0|1,0,1]=3 383 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [1,0,0,0,0,0|1,0,1]=3 384 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [1,0,0,0,0,0|1,0,1]=3 385 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [1,0,0,0,0,0|1,0,1]=3 386 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [1,0,0,0,0,0|1,0,1]=3 387 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [1,0,0,0,0,0|0,0,2]=3 388 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [1,0,0,0,0,0|1,0,1]=3 389 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [1,0,0,0,0,0|1,0,1]=3 390 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [1,0,0,0,0,0|1,0,1]=3 391 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [1,0,0,0,0,0|1,0,1]=3 392 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [1,0,0,0,0,0|0,0,2]=3 393 B5R0.1 CCNC(=N)N MCULE-4729418155 [1,0,0,0,0,0|3,0,0]=4 394 B5R0.1 CCNC(=N)N MCULE-5123343071 [1,0,0,0,0,0|3,0,0]=4 395 B5R0.1 CCNC(=O)C MCULE-7543656350 [1,0,0,0,0,0|1,0,0]=2 396 B5R0.1 CCNC(=O)Cl MCULE-5831262934 [1,0,0,0,0,0|2,0,0]=3 397 B5R0.1 CCNC(=O)N MCULE-1913599861 [1,0,0,0,0,0|2,0,0]=3 398 B5R0.1 CCNC(=S)N MCULE-3849517146 [1,0,0,0,0,0|2,1,0]=4 399 B5R0.1 CCNC(C)C MCULE-8064118469 [1,0,0,0,0,0|2,0,1]=4 400 B5R0.1 CCOC(=N)C MCULE-3060267072 [1,0,0,0,0,0|2,0,0]=3 401 B5R0.1 CCOC(=N)C MCULE-3943786182 [1,0,0,0,0,0|2,0,0]=3 402 B5R0.1 CCOC(=N)N MCULE-3570858508 [1,0,0,0,0,0|3,0,0]=4 403 B5R0.1 CCOC(=N)N MCULE-6061063856 [1,0,0,0,0,0|3,0,0]=4 404 B5R0.1 CCOC(=O)C MCULE-6628539781 [1,0,0,0,0,0|1,0,0]=2 405 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [1,0,0,0,0,0|2,0,0]=3 406 B5R0.1 CCOC(=O)N MCULE-1776877276 [1,0,0,0,0,0|2,0,0]=3 407 B5R0.1 CCOC(=S)C MCULE-3358897597 [1,0,0,0,0,0|1,1,0]=3 408 B5R0.1 CCOC(=S)N MCULE-4649285010 [1,0,0,0,0,0|2,1,0]=4 409 B5R0.1 CCOC(=S)[S-] MCULE-6247969567 [1,0,0,0,0,0|1,2,0]=4 410 B5R0.1 CCOC(=S)[S-] MCULE-6902289618 [1,0,0,0,0,0|1,2,0]=4 411 B5R0.1 CCOC(=S)[S-] MCULE-9105300958 [1,0,0,0,0,0|1,2,0]=4 412 B5R0.1 CCOC(C)C MCULE-1934548340 [1,0,0,0,0,0|2,0,1]=4 413 B5R0.1 CCOC(C)Cl MCULE-8486994638 [1,0,0,0,0,0|2,0,1]=4 414 B5R0.1 CCSC(=N)N MCULE-2161729152 [1,0,0,0,0,0|3,0,0]=4 415 B5R0.1 CCSC(=N)N MCULE-2547252984 [1,0,0,0,0,0|3,0,0]=4 416 B5R0.1 CCSC(=O)C MCULE-8015440229 [1,0,0,0,0,0|1,0,0]=2 417 B5R0.1 CCSC(=S)C MCULE-1502137460 [1,0,0,0,0,0|1,1,0]=3 418 B5R0.1 CCSC(=S)[S-] MCULE-2573650807 [1,0,0,0,0,0|1,2,0]=4 419 B5R0.1 CCSC(=S)[S-] MCULE-6172057982 [1,0,0,0,0,0|1,2,0]=4 420 B5R0.1 CCSC(C)C MCULE-3738251898 [1,0,0,0,0,0|2,0,1]=4 421 B5R0.1 CC[NH2+]C(=N)N MCULE-1701852752 [1,0,0,0,0,0|3,0,0]=4 422 B5R0.1 CC[O+]=C(N)N MCULE-2484225131 [1,0,0,0,0,0|3,0,0]=4 423 B5R0.1 CC[O+]=C(N)N MCULE-6688774534 [1,0,0,0,0,0|3,0,0]=4 424 B5R0.1 CN(C)CCBr MCULE-4844398053 [1,0,0,0,0,0|3,0,0]=4 425 B5R0.1 CN(C)CCCl MCULE-4297554717 [1,0,0,0,0,0|3,0,0]=4 426 B5R0.1 CN(C)CCCl MCULE-4465544992 [1,0,0,0,0,0|3,0,0]=4 427 B5R0.1 CN(C)CCI MCULE-4687894526 [1,0,0,0,0,0|3,0,0]=4 428 B5R0.1 CN(C)CCI MCULE-7464680246 [1,0,0,0,0,0|3,0,0]=4 429 B5R0.1 CN(C)CCI MCULE-9051868668 [1,0,0,0,0,0|3,0,0]=4 430 B5R0.1 CN(C)CCN MCULE-6693759372 [1,0,0,0,0,0|3,0,0]=4 431 B5R0.1 CN(C)CCN MCULE-6929925748 [1,0,0,0,0,0|3,0,0]=4 432 B5R0.1 CN(C)CCN MCULE-7881547574 [1,0,0,0,0,0|3,0,0]=4 433 B5R0.1 CN(C)CCO MCULE-5715813465 [1,0,0,0,0,0|3,0,0]=4 434 B5R0.1 CN(C)CCO MCULE-7567469160 [1,0,0,0,0,0|3,0,0]=4 435 B5R0.1 CN(C)CCO MCULE-9024108074 [1,0,0,0,0,0|3,0,0]=4 436 B5R0.1 CN(C)CCS MCULE-4356815596 [1,0,0,0,0,0|3,0,0]=4 437 B5R0.1 CN(C)CCS MCULE-4611688723 [1,0,0,0,0,0|3,0,0]=4 438 B5R0.1 CN(C)CCS MCULE-6259585517 [1,0,0,0,0,0|3,0,0]=4 439 B5R0.1 CN(N)CCN MCULE-2782966878 [1,0,0,0,0,0|3,0,0]=4 440 B5R0.1 CNCC(=O)C MCULE-3695443024 [1,0,0,0,0,0|1,0,0]=2 441 B5R0.1 CNCC(=O)C MCULE-7402723072 [1,0,0,0,0,0|1,0,0]=2 442 B5R0.1 CNCC(=O)N MCULE-2328887394 [1,0,0,0,0,0|2,0,0]=3 443 B5R0.1 CNCC(=O)N MCULE-3031605853 [1,0,0,0,0,0|2,0,0]=3 444 B5R0.1 CNCC(=O)N MCULE-7300977677 [1,0,0,0,0,0|2,0,0]=3 445 B5R0.1 CNCC(=O)O MCULE-3448356048 [1,0,0,0,0,0|1,0,0]=2 446 B5R0.1 CNCC(=O)O MCULE-4484444573 [1,0,0,0,0,0|1,0,0]=2 447 B5R0.1 CNCC(=O)[O-] MCULE-7993701866 [1,0,0,0,0,0|1,0,1]=3 448 B5R0.1 CNCC(C)C MCULE-6582386339 [1,0,0,0,0,0|2,0,1]=4 449 B5R0.1 CNCC(C)C MCULE-6856717783 [1,0,0,0,0,0|2,0,1]=4 450 B5R0.1 CNCC(C)F MCULE-4381138647 [1,0,0,0,0,0|2,0,1]=4 451 B5R0.1 CNCC(C)F MCULE-9018181183 [1,0,0,0,0,0|2,0,1]=4 452 B5R0.1 CNCC(C)O MCULE-3671071529 [1,0,0,0,0,0|1,0,2]=4 453 B5R0.1 CNCC(C)O MCULE-4171705304 [1,0,0,0,0,0|1,0,2]=4 454 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [1,0,0,0,0,0|1,0,2]=4 455 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [1,0,0,0,0,0|1,0,2]=4 456 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [1,0,0,0,0,0|1,0,2]=4 457 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [1,0,0,0,0,0|1,0,2]=4 458 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [1,0,0,0,0,0|1,0,2]=4 459 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [1,0,0,0,0,0|1,0,2]=4 460 B5R0.1 CNN=C(C)C MCULE-6307375856 [1,0,0,0,0,0|3,0,0]=4 461 B5R0.1 CNOC(=O)C MCULE-1464426541 [1,0,0,0,0,0|2,0,0]=3 462 B5R0.1 CNOC(=O)C MCULE-2976282666 [1,0,0,0,0,0|2,0,0]=3 463 B5R0.1 COC=C(C)C MCULE-6348538911 [1,0,0,0,0,0|2,0,1]=4 464 B5R0.1 COCC(=N)N MCULE-4711728356 [1,0,0,0,0,0|3,0,0]=4 465 B5R0.1 COCC(=N)N MCULE-7163250467 [1,0,0,0,0,0|3,0,0]=4 466 B5R0.1 COCC(=O)C MCULE-7262197587 [1,0,0,0,0,0|1,0,0]=2 467 B5R0.1 COCC(=O)Cl MCULE-5449267495 [1,0,0,0,0,0|2,0,0]=3 468 B5R0.1 COCC(=O)N MCULE-6674958132 [1,0,0,0,0,0|2,0,0]=3 469 B5R0.1 COCC(=O)O MCULE-3945589151 [1,0,0,0,0,0|1,0,0]=2 470 B5R0.1 COCC(=S)N MCULE-2046809269 [1,0,0,0,0,0|2,1,0]=4 471 B5R0.1 COCC(C)Br MCULE-6850689931 [1,0,0,0,0,0|2,0,1]=4 472 B5R0.1 COCC(C)I MCULE-8608265714 [1,0,0,0,0,0|2,0,1]=4 473 B5R0.1 COCC(C)N MCULE-1896873634 [1,0,0,0,0,0|2,0,1]=4 474 B5R0.1 COCC(C)N MCULE-2549420211 [1,0,0,0,0,0|2,0,1]=4 475 B5R0.1 COCC(C)N MCULE-3490410444 [1,0,0,0,0,0|2,0,1]=4 476 B5R0.1 COCC(C)N MCULE-7089888882 [1,0,0,0,0,0|2,0,1]=4 477 B5R0.1 COCC(C)O MCULE-4022733014 [1,0,0,0,0,0|1,0,2]=4 478 B5R0.1 COCC(C)O MCULE-7513310960 [1,0,0,0,0,0|1,0,2]=4 479 B5R0.1 COCN(C)C MCULE-1963225930 [1,0,0,0,0,0|3,0,0]=4 480 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [1,0,0,0,0,0|2,0,1]=4 481 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [1,0,0,0,0,0|2,0,1]=4 482 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [1,0,0,0,0,0|2,0,1]=4 483 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [1,0,0,0,0,0|2,0,1]=4 484 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [1,0,0,0,0,0|1,0,2]=4 485 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [1,0,0,0,0,0|1,0,2]=4 486 B5R0.1 COC[C@H](C)N MCULE-2465679418 [1,0,0,0,0,0|2,0,1]=4 487 B5R0.1 COC[C@H](C)N MCULE-2998593539 [1,0,0,0,0,0|2,0,1]=4 488 B5R0.1 COC[C@H](C)N MCULE-3161045661 [1,0,0,0,0,0|2,0,1]=4 489 B5R0.1 COC[C@H](C)N MCULE-9550165578 [1,0,0,0,0,0|2,0,1]=4 490 B5R0.1 COC[C@H](C)O MCULE-5908531683 [1,0,0,0,0,0|1,0,2]=4 491 B5R0.1 COC[C@H](C)O MCULE-8619138238 [1,0,0,0,0,0|1,0,2]=4 492 B5R0.1 CONC(=O)C MCULE-6601866630 [1,0,0,0,0,0|2,0,0]=3 493 B5R0.1 CONC(=O)N MCULE-3063713861 [1,0,0,0,0,0|3,0,0]=4 494 B5R0.1 CONC(=S)C MCULE-1876042939 [1,0,0,0,0,0|2,1,0]=4 495 B5R0.1 CS(=O)CC#N MCULE-1246621507 [1,0,0,0,0,0|2,0,1]=4 496 B5R0.1 CS(=O)CCBr MCULE-7846126230 [1,0,0,0,0,0|2,0,0]=3 497 B5R0.1 CS(=O)CCCl MCULE-7012781505 [1,0,0,0,0,0|2,0,0]=3 498 B5R0.1 CS(=O)CCN MCULE-6497874560 [1,0,0,0,0,0|2,0,0]=3 499 B5R0.1 CS(=O)CCN MCULE-8275663766 [1,0,0,0,0,0|2,0,0]=3 500 B5R0.1 CS(=O)CCN MCULE-8330490290 [1,0,0,0,0,0|2,0,0]=3 501 B5R0.1 CS(=O)CCO MCULE-8331553582 [1,0,0,0,0,0|2,0,0]=3 502 B5R0.1 CSCC(=N)N MCULE-7800929509 [1,0,0,0,0,0|3,0,0]=4 503 B5R0.1 CSCC(=N)N MCULE-8499985777 [1,0,0,0,0,0|3,0,0]=4 504 B5R0.1 CSCC(=O)C MCULE-4131794172 [1,0,0,0,0,0|1,0,0]=2 505 B5R0.1 CSCC(=O)Cl MCULE-9750052685 [1,0,0,0,0,0|2,0,0]=3 506 B5R0.1 CSCC(=O)N MCULE-4865579476 [1,0,0,0,0,0|2,0,0]=3 507 B5R0.1 CSCC(=O)O MCULE-7003418159 [1,0,0,0,0,0|1,0,0]=2 508 B5R0.1 CSCC(=S)N MCULE-5029100305 [1,0,0,0,0,0|2,1,0]=4 509 B5R0.1 CSCC(C)N MCULE-7985946030 [1,0,0,0,0,0|2,0,1]=4 510 B5R0.1 CSCC(C)O MCULE-2227652351 [1,0,0,0,0,0|1,0,2]=4 511 B5R0.1 CSCN(C)C MCULE-2931143051 [1,0,0,0,0,0|3,0,0]=4 512 B5R0.1 CSCS(=O)C MCULE-3167702486 [1,0,0,0,0,0|2,0,0]=3 513 B5R0.1 CSNC(=O)C MCULE-7350061514 [1,0,0,0,0,0|2,0,0]=3 514 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [1,0,0,0,0,0|2,0,1]=4 515 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [1,0,0,0,0,0|2,0,1]=4 516 B5R0.1 C[C@@H](O)CCN MCULE-7588849994 [1,0,0,0,0,0|1,0,2]=4 517 B5R0.1 C[C@@H](O)CCN MCULE-7895006310 [1,0,0,0,0,0|1,0,2]=4 518 B5R0.1 C[C@@H](O)CCN MCULE-9071323255 [1,0,0,0,0,0|1,0,2]=4 519 B5R0.1 C[C@@H](O)CCN MCULE-9627550610 [1,0,0,0,0,0|1,0,2]=4 520 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [1,0,0,0,0,0|1,0,2]=4 521 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [1,0,0,0,0,0|1,0,2]=4 522 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [1,0,0,0,0,0|2,0,1]=4 523 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [1,0,0,0,0,0|2,0,1]=4 524 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [1,0,0,0,0,0|2,0,1]=4 525 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [1,0,0,0,0,0|2,0,1]=4 526 B5R0.1 C[C@H](O)CCN MCULE-7570743309 [1,0,0,0,0,0|1,0,2]=4 527 B5R0.1 C[C@H](O)CCN MCULE-9428853702 [1,0,0,0,0,0|1,0,2]=4 528 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [1,0,0,0,0,0|1,0,2]=4 529 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [1,0,0,0,0,0|1,0,2]=4 530 B5R0.1 C[NH+](C)CCBr MCULE-4990293495 [1,0,0,0,0,0|3,0,0]=4 531 B5R0.1 C[S+](C)CCCl MCULE-1305595131 [1,0,0,0,0,0|3,0,0]=4 532 B5R0.1 C[S+](C)CCCl MCULE-9761617787 [1,0,0,0,0,0|3,0,0]=4 533 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [1,0,0,0,0,0|2,0,0]=3 534 B5R0.1 N#CCC(=O)Cl MCULE-7971055738 [1,0,0,0,0,0|2,0,1]=4 535 B5R0.1 N#CCC(=O)N MCULE-8538286230 [1,0,0,0,0,0|2,0,1]=4 536 B5R0.1 N#CCC(=O)O MCULE-3440765061 [1,0,0,0,0,0|1,0,1]=3 537 B5R0.1 N#CCC(=O)[O-] MCULE-2598625909 [1,0,0,0,0,0|1,0,2]=4 538 B5R0.1 N#CCC(=O)[O-] MCULE-3532110520 [1,0,0,0,0,0|1,0,2]=4 539 B5R0.1 N=C(N)CCCl MCULE-2314996365 [1,0,0,0,0,0|3,0,0]=4 540 B5R0.1 N=C(N)CCCl MCULE-3129838313 [1,0,0,0,0,0|3,0,0]=4 541 B5R0.1 N=C(N)CCO MCULE-4567824707 [1,0,0,0,0,0|3,0,0]=4 542 B5R0.1 N=C(N)CCO MCULE-7139693715 [1,0,0,0,0,0|3,0,0]=4 543 B5R0.1 NC(=O)CCBr MCULE-3930714776 [1,0,0,0,0,0|2,0,0]=3 544 B5R0.1 NC(=O)CCCl MCULE-8300320959 [1,0,0,0,0,0|2,0,0]=3 545 B5R0.1 NC(=O)CCO MCULE-4026170350 [1,0,0,0,0,0|2,0,0]=3 546 B5R0.1 NC(=O)CCS MCULE-7451827717 [1,0,0,0,0,0|2,0,0]=3 547 B5R0.1 NC(=O)NCO MCULE-7403641101 [1,0,0,0,0,0|3,0,0]=4 548 B5R0.1 NCCC(=O)Cl MCULE-1298355499 [1,0,0,0,0,0|2,0,0]=3 549 B5R0.1 NCCC(=O)N MCULE-2899414135 [1,0,0,0,0,0|2,0,0]=3 550 B5R0.1 NCCC(=O)N MCULE-6993286668 [1,0,0,0,0,0|2,0,0]=3 551 B5R0.1 NCCC(=O)O MCULE-1344289084 [1,0,0,0,0,0|1,0,0]=2 552 B5R0.1 NCCC(=O)O MCULE-2298605337 [1,0,0,0,0,0|1,0,0]=2 553 B5R0.1 NCCC(=O)O MCULE-9375577631 [1,0,0,0,0,0|1,0,0]=2 554 B5R0.1 NCCC(=O)[O-] MCULE-2492250086 [1,0,0,0,0,0|1,0,1]=3 555 B5R0.1 NCCN(=O)=O MCULE-8137427440 [1,0,0,0,0,0|2,0,1]=4 556 B5R0.1 NCCP(=O)O MCULE-7093964616 [1,0,0,0,0,0|2,0,0]=3 557 B5R0.1 NCCS(=O)O MCULE-4372248641 [1,0,0,0,0,0|2,0,0]=3 558 B5R0.1 NNCC(=O)N MCULE-2794619708 [1,0,0,0,0,0|3,0,0]=4 559 B5R0.1 NNCC(=O)N MCULE-6773156087 [1,0,0,0,0,0|3,0,0]=4 560 B5R0.1 NNCC(=O)O MCULE-4908184724 [1,0,0,0,0,0|2,0,0]=3 561 B5R0.1 NNCC(=O)O MCULE-6315598774 [1,0,0,0,0,0|2,0,0]=3 562 B5R0.1 NOCC(=O)O MCULE-4566186819 [1,0,0,0,0,0|2,0,0]=3 563 B5R0.1 NOCC(=O)O MCULE-4824237418 [1,0,0,0,0,0|2,0,0]=3 564 B5R0.1 NOCC(=O)O MCULE-8132180423 [1,0,0,0,0,0|2,0,0]=3 565 B5R0.1 O=C(Cl)CCBr MCULE-4659506608 [1,0,0,0,0,0|2,0,0]=3 566 B5R0.1 O=C(Cl)CCCl MCULE-3313924878 [1,0,0,0,0,0|2,0,0]=3 567 B5R0.1 O=C(Cl)CCF MCULE-3316397790 [1,0,0,0,0,0|2,0,0]=3 568 B5R0.1 O=C(Cl)OCCl MCULE-2130588147 [1,0,0,0,0,0|3,0,0]=4 569 B5R0.1 O=C(O)/C=C/Br MCULE-7284519266 [1,0,0,0,0,0|1,0,2]=4 570 B5R0.1 O=C(O)/C=C/Cl MCULE-1625781671 [1,0,0,0,0,0|1,0,2]=4 571 B5R0.1 O=C(O)/C=C/I MCULE-3339607379 [1,0,0,0,0,0|1,0,2]=4 572 B5R0.1 O=C(O)/C=C\Br MCULE-6149049313 [1,0,0,0,0,0|1,0,2]=4 573 B5R0.1 O=C(O)/C=C\Cl MCULE-1221996674 [1,0,0,0,0,0|1,0,2]=4 574 B5R0.1 O=C(O)/C=C\I MCULE-3065405012 [1,0,0,0,0,0|1,0,2]=4 575 B5R0.1 O=C(O)/C=N/O MCULE-2471349844 [1,0,0,0,0,0|2,0,1]=4 576 B5R0.1 O=C(O)C#CBr MCULE-1997285471 [1,0,0,0,0,0|1,0,2]=4 577 B5R0.1 O=C(O)C=CBr MCULE-2956464856 [1,0,0,0,0,0|1,0,2]=4 578 B5R0.1 O=C(O)C=CCl MCULE-6369812151 [1,0,0,0,0,0|1,0,2]=4 579 B5R0.1 O=C(O)C=CI MCULE-7162332129 [1,0,0,0,0,0|1,0,2]=4 580 B5R0.1 O=C(O)C=NO MCULE-2039309679 [1,0,0,0,0,0|2,0,1]=4 581 B5R0.1 O=C(O)CCBr MCULE-2816055853 [1,0,0,0,0,0|1,0,0]=2 582 B5R0.1 O=C(O)CCCl MCULE-8511144183 [1,0,0,0,0,0|1,0,0]=2 583 B5R0.1 O=C(O)CCF MCULE-4382025684 [1,0,0,0,0,0|1,0,0]=2 584 B5R0.1 O=C(O)CCI MCULE-3371354708 [1,0,0,0,0,0|1,0,0]=2 585 B5R0.1 O=C(O)CCO MCULE-3428604829 [1,0,0,0,0,0|1,0,0]=2 586 B5R0.1 O=C(O)CCS MCULE-3211932163 [1,0,0,0,0,0|1,0,0]=2 587 B5R0.1 O=C(O)CNO MCULE-4437067339 [1,0,0,0,0,0|2,0,0]=3 588 B5R0.1 O=C([O-])CCO MCULE-4429611588 [1,0,0,0,0,0|1,0,1]=3 589 B5R0.1 O=N(=O)CCO MCULE-2060841405 [1,0,0,0,0,0|2,0,1]=4 590 B5R0.1 O=N(=O)CCS MCULE-4845430658 [1,0,0,0,0,0|2,0,1]=4 591 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [1,0,0,0,0,0|0,0,2]=3 592 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [1,0,0,0,0,0|1,0,2]=4 593 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [1,0,0,0,0,0|0,0,2]=3 594 B5R0.2 C#CCCCC MCULE-5706969297 [1,0,0,0,0,0|1,0,2]=4 595 B5R0.2 C#CCCOC MCULE-7152168835 [1,0,0,0,0,0|0,0,3]=4 596 B5R0.2 C#CCNOC MCULE-3336529831 [1,0,0,0,0,0|1,0,2]=4 597 B5R0.2 C#CCNOC MCULE-7807129420 [1,0,0,0,0,0|1,0,2]=4 598 B5R0.2 C/C=C/C=C/C MCULE-9400628806 [1,0,0,0,0,0|1,0,2]=4 599 B5R0.2 C/C=C/CC#N MCULE-3707973146 [1,0,0,0,0,0|2,0,1]=4 600 B5R0.2 C/C=C/CCC MCULE-9851656818 [1,0,0,0,0,0|1,0,0]=2 601 B5R0.2 C/C=C/CCO MCULE-3952855392 [1,0,0,0,0,0|2,0,0]=3 602 B5R0.2 C/C=C/OCC MCULE-2891896400 [1,0,0,0,0,0|2,0,0]=3 603 B5R0.2 C/C=C\CCC MCULE-1013657748 [1,0,0,0,0,0|1,0,0]=2 604 B5R0.2 C=C/C=C/CC MCULE-5996202716 [1,0,0,0,0,0|1,0,2]=4 605 B5R0.2 C=C=CCCBr MCULE-5561919067 [1,0,0,0,0,0|2,0,1]=4 606 B5R0.2 C=C=CCCI MCULE-7583015374 [1,0,0,0,0,0|2,0,1]=4 607 B5R0.2 C=C=CCCN MCULE-5814175873 [1,0,0,0,0,0|2,0,1]=4 608 B5R0.2 C=C=CCCN MCULE-8177198091 [1,0,0,0,0,0|2,0,1]=4 609 B5R0.2 C=C=CCCO MCULE-1054355649 [1,0,0,0,0,0|2,0,1]=4 610 B5R0.2 C=CC/C=C/C MCULE-8732875285 [1,0,0,0,0,0|1,0,2]=4 611 B5R0.2 C=CCC=CC MCULE-8643449832 [1,0,0,0,0,0|1,0,2]=4 612 B5R0.2 C=CCCCC MCULE-4750698031 [1,0,0,0,0,0|1,0,2]=4 613 B5R0.2 C=CCCOC MCULE-4681354270 [1,0,0,0,0,0|0,0,3]=4 614 B5R0.2 C=COCCC MCULE-4423853666 [1,0,0,0,0,0|2,0,1]=4 615 B5R0.2 CC#CCCBr MCULE-5650557113 [1,0,0,0,0,0|2,0,1]=4 616 B5R0.2 CC#CCCC MCULE-8179328151 [1,0,0,0,0,0|1,0,1]=3 617 B5R0.2 CC#CCCN MCULE-2130545109 [1,0,0,0,0,0|2,0,1]=4 618 B5R0.2 CC#CCCN MCULE-7156357315 [1,0,0,0,0,0|2,0,1]=4 619 B5R0.2 CC#CCCO MCULE-9400138491 [1,0,0,0,0,0|2,0,1]=4 620 B5R0.2 CC#CCNC MCULE-3549759323 [1,0,0,0,0,0|2,0,1]=4 621 B5R0.2 CC#CCNC MCULE-7250319597 [1,0,0,0,0,0|2,0,1]=4 622 B5R0.2 CC/C=C/C=O MCULE-5102906061 [1,0,0,0,0,0|2,0,1]=4 623 B5R0.2 CC/C=C/CC MCULE-6762040186 [1,0,0,0,0,0|1,0,1]=3 624 B5R0.2 CC/C=C\C#N MCULE-2648641382 [1,0,0,0,0,0|2,0,1]=4 625 B5R0.2 CC/C=C\CC MCULE-9418110460 [1,0,0,0,0,0|1,0,1]=3 626 B5R0.2 CC/C=C\CO MCULE-5480473249 [1,0,0,0,0,0|2,0,1]=4 627 B5R0.2 CC=CC=CC MCULE-7702675183 [1,0,0,0,0,0|1,0,2]=4 628 B5R0.2 CC=CCC#N MCULE-6960681395 [1,0,0,0,0,0|2,0,1]=4 629 B5R0.2 CC=CCCBr MCULE-7329159278 [1,0,0,0,0,0|2,0,0]=3 630 B5R0.2 CC=CCCC MCULE-8736231124 [1,0,0,0,0,0|1,0,0]=2 631 B5R0.2 CC=CCCN MCULE-5129102475 [1,0,0,0,0,0|2,0,0]=3 632 B5R0.2 CC=CCCN MCULE-8500001929 [1,0,0,0,0,0|2,0,0]=3 633 B5R0.2 CC=CCCO MCULE-4302367089 [1,0,0,0,0,0|2,0,0]=3 634 B5R0.2 CC=COCC MCULE-1473170404 [1,0,0,0,0,0|2,0,0]=3 635 B5R0.2 CC=CSSC MCULE-2442770677 [1,0,0,0,0,0|3,0,0]=4 636 B5R0.2 CCC#CCC MCULE-2027962178 [1,0,0,0,0,0|1,0,2]=4 637 B5R0.2 CCC=CC#N MCULE-1091834842 [1,0,0,0,0,0|2,0,1]=4 638 B5R0.2 CCC=CC=O MCULE-1318250395 [1,0,0,0,0,0|2,0,1]=4 639 B5R0.2 CCC=CCBr MCULE-5326763881 [1,0,0,0,0,0|2,0,1]=4 640 B5R0.2 CCC=CCC MCULE-5435957422 [1,0,0,0,0,0|1,0,1]=3 641 B5R0.2 CCC=CCO MCULE-5633399984 [1,0,0,0,0,0|2,0,1]=4 642 B5R0.2 CCCC#CI MCULE-5016901652 [1,0,0,0,0,0|2,0,1]=4 643 B5R0.2 CCCC=NO MCULE-7364375780 [1,0,0,0,0,0|2,0,0]=3 644 B5R0.2 CCCCC#N MCULE-4015236167 [1,0,0,0,0,0|2,0,1]=4 645 B5R0.2 CCCCC=O MCULE-4736782822 [1,0,0,0,0,0|2,0,1]=4 646 B5R0.2 CCCCCBr MCULE-8513521912 [1,0,0,0,0,0|2,0,1]=4 647 B5R0.2 CCCCCC MCULE-3465692202 [1,0,0,0,0,0|1,0,1]=3 648 B5R0.2 CCCCCCl MCULE-4412759460 [1,0,0,0,0,0|2,0,1]=4 649 B5R0.2 CCCCCF MCULE-6399883281 [1,0,0,0,0,0|2,0,1]=4 650 B5R0.2 CCCCCI MCULE-4590300793 [1,0,0,0,0,0|2,0,1]=4 651 B5R0.2 CCCCCN MCULE-3371742982 [1,0,0,0,0,0|2,0,1]=4 652 B5R0.2 CCCCCN MCULE-4371067300 [1,0,0,0,0,0|2,0,1]=4 653 B5R0.2 CCCCCN MCULE-6547961798 [1,0,0,0,0,0|2,0,1]=4 654 B5R0.2 CCCCCN MCULE-7483248760 [1,0,0,0,0,0|2,0,1]=4 655 B5R0.2 CCCCCO MCULE-8714292632 [1,0,0,0,0,0|2,0,1]=4 656 B5R0.2 CCCCCS MCULE-5476379340 [1,0,0,0,0,0|2,0,1]=4 657 B5R0.2 CCCCNC MCULE-9321610906 [1,0,0,0,0,0|1,0,1]=3 658 B5R0.2 CCCCNN MCULE-6681305566 [1,0,0,0,0,0|2,0,1]=4 659 B5R0.2 CCCCNN MCULE-6890760890 [1,0,0,0,0,0|2,0,1]=4 660 B5R0.2 CCCCNN MCULE-7362497327 [1,0,0,0,0,0|2,0,1]=4 661 B5R0.2 CCCCNN MCULE-8463623644 [1,0,0,0,0,0|2,0,1]=4 662 B5R0.2 CCCCNO MCULE-1911206569 [1,0,0,0,0,0|2,0,1]=4 663 B5R0.2 CCCCNO MCULE-3820646216 [1,0,0,0,0,0|2,0,1]=4 664 B5R0.2 CCCCOC MCULE-9814272675 [1,0,0,0,0,0|0,0,1]=2 665 B5R0.2 CCCCON MCULE-7582349983 [1,0,0,0,0,0|1,0,1]=3 666 B5R0.2 CCCCON MCULE-8175627798 [1,0,0,0,0,0|1,0,1]=3 667 B5R0.2 CCCCSC MCULE-2799775567 [1,0,0,0,0,0|0,1,1]=3 668 B5R0.2 CCCN=C=O MCULE-9014468293 [1,0,0,0,0,0|3,0,0]=4 669 B5R0.2 CCCN=C=S MCULE-7947940355 [1,0,0,0,0,0|3,0,0]=4 670 B5R0.2 CCCNC=O MCULE-6344556391 [1,0,0,0,0,0|3,0,0]=4 671 B5R0.2 CCCNCC MCULE-7948828264 [1,0,0,0,0,0|2,0,0]=3 672 B5R0.2 CCCNCC MCULE-9107549207 [1,0,0,0,0,0|2,0,0]=3 673 B5R0.2 CCCOC=O MCULE-3133604529 [1,0,0,0,0,0|3,0,0]=4 674 B5R0.2 CCCOCBr MCULE-3585683043 [1,0,0,0,0,0|3,0,0]=4 675 B5R0.2 CCCOCC MCULE-9971916790 [1,0,0,0,0,0|2,0,0]=3 676 B5R0.2 CCCOCCl MCULE-1932627202 [1,0,0,0,0,0|3,0,0]=4 677 B5R0.2 CCCSC#N MCULE-9018157774 [1,0,0,0,0,0|3,0,0]=4 678 B5R0.2 CCCSCC MCULE-4547385568 [1,0,0,0,0,0|2,0,0]=3 679 B5R0.2 CCCSSC MCULE-3127072032 [1,0,0,0,0,0|1,1,0]=3 680 B5R0.2 CCNCCCl MCULE-2589770119 [1,0,0,0,0,0|3,0,0]=4 681 B5R0.2 CCNCCCl MCULE-3098032672 [1,0,0,0,0,0|3,0,0]=4 682 B5R0.2 CCNCCN MCULE-7854769899 [1,0,0,0,0,0|3,0,0]=4 683 B5R0.2 CCNCCO MCULE-2537734730 [1,0,0,0,0,0|3,0,0]=4 684 B5R0.2 CCNCCO MCULE-3738714907 [1,0,0,0,0,0|3,0,0]=4 685 B5R0.2 CCNNCC MCULE-4789314801 [1,0,0,0,0,0|3,0,0]=4 686 B5R0.2 CCNNCC MCULE-9060220585 [1,0,0,0,0,0|3,0,0]=4 687 B5R0.2 CCO/C=C\Br MCULE-7396084973 [1,0,0,0,0,0|3,0,0]=4 688 B5R0.2 CCOC=CBr MCULE-5241125671 [1,0,0,0,0,0|3,0,0]=4 689 B5R0.2 CCOCCBr MCULE-4818900555 [1,0,0,0,0,0|3,0,0]=4 690 B5R0.2 CCOCCCl MCULE-1290576729 [1,0,0,0,0,0|3,0,0]=4 691 B5R0.2 CCOCCI MCULE-1833092968 [1,0,0,0,0,0|3,0,0]=4 692 B5R0.2 CCOCCN MCULE-1254431240 [1,0,0,0,0,0|3,0,0]=4 693 B5R0.2 CCOCCN MCULE-4039110889 [1,0,0,0,0,0|3,0,0]=4 694 B5R0.2 CCOCCN MCULE-4400456933 [1,0,0,0,0,0|3,0,0]=4 695 B5R0.2 CCOCCO MCULE-4311513289 [1,0,0,0,0,0|3,0,0]=4 696 B5R0.2 CCOCCS MCULE-3968740645 [1,0,0,0,0,0|3,0,0]=4 697 B5R0.2 CCSCCBr MCULE-9449933342 [1,0,0,0,0,0|3,0,0]=4 698 B5R0.2 CCSCCCl MCULE-4057847237 [1,0,0,0,0,0|3,0,0]=4 699 B5R0.2 CCSCCN MCULE-3375644872 [1,0,0,0,0,0|3,0,0]=4 700 B5R0.2 CCSCCN MCULE-4466279976 [1,0,0,0,0,0|3,0,0]=4 701 B5R0.2 CCSCCO MCULE-3557086162 [1,0,0,0,0,0|3,0,0]=4 702 B5R0.2 CCSCCS MCULE-4583054157 [1,0,0,0,0,0|3,0,0]=4 703 B5R0.2 CCSSCC MCULE-7989926475 [1,0,0,0,0,0|3,0,0]=4 704 B5R0.2 CC[Se][Se]CC MCULE-2725282576 [1,0,0,0,0,0|3,0,0]=4 705 B5R0.2 CNCCCBr MCULE-3376600253 [1,0,0,0,0,0|2,0,1]=4 706 B5R0.2 CNCCCBr MCULE-6212326106 [1,0,0,0,0,0|2,0,1]=4 707 B5R0.2 CNCCCCl MCULE-1007719210 [1,0,0,0,0,0|2,0,1]=4 708 B5R0.2 CNCCCCl MCULE-6146901643 [1,0,0,0,0,0|2,0,1]=4 709 B5R0.2 CNCCCF MCULE-7647417887 [1,0,0,0,0,0|2,0,1]=4 710 B5R0.2 CNCCCN MCULE-1736081896 [1,0,0,0,0,0|2,0,1]=4 711 B5R0.2 CNCCCO MCULE-9530478547 [1,0,0,0,0,0|2,0,1]=4 712 B5R0.2 CNCCNC MCULE-1378979868 [1,0,0,0,0,0|2,0,1]=4 713 B5R0.2 CNCCNC MCULE-3281508478 [1,0,0,0,0,0|2,0,1]=4 714 B5R0.2 CNCCOC MCULE-2857904484 [1,0,0,0,0,0|1,0,1]=3 715 B5R0.2 CNCCOC MCULE-5342712496 [1,0,0,0,0,0|1,0,1]=3 716 B5R0.2 CNCCSC MCULE-2812984399 [1,0,0,0,0,0|1,1,1]=4 717 B5R0.2 CNCCSC MCULE-2942435951 [1,0,0,0,0,0|1,1,1]=4 718 B5R0.2 CNOCCN MCULE-3163962093 [1,0,0,0,0,0|3,0,0]=4 719 B5R0.2 CNOCCN MCULE-7379538500 [1,0,0,0,0,0|3,0,0]=4 720 B5R0.2 COC=CC#N MCULE-4212629233 [1,0,0,0,0,0|1,0,2]=4 721 B5R0.2 COCCC#N MCULE-3009737584 [1,0,0,0,0,0|1,0,2]=4 722 B5R0.2 COCCC=O MCULE-2812117208 [1,0,0,0,0,0|1,0,2]=4 723 B5R0.2 COCCCBr MCULE-6489536401 [1,0,0,0,0,0|1,0,1]=3 724 B5R0.2 COCCCCl MCULE-9192274624 [1,0,0,0,0,0|1,0,1]=3 725 B5R0.2 COCCCF MCULE-5055725246 [1,0,0,0,0,0|1,0,1]=3 726 B5R0.2 COCCCI MCULE-9111605439 [1,0,0,0,0,0|1,0,1]=3 727 B5R0.2 COCCCN MCULE-1421362990 [1,0,0,0,0,0|1,0,1]=3 728 B5R0.2 COCCCN MCULE-4783132205 [1,0,0,0,0,0|1,0,1]=3 729 B5R0.2 COCCCO MCULE-4041418048 [1,0,0,0,0,0|1,0,1]=3 730 B5R0.2 COCCCS MCULE-2371333731 [1,0,0,0,0,0|1,0,1]=3 731 B5R0.2 COCCNN MCULE-2086510453 [1,0,0,0,0,0|2,0,1]=4 732 B5R0.2 COCCNN MCULE-4830987822 [1,0,0,0,0,0|2,0,1]=4 733 B5R0.2 COCCNN MCULE-8361975855 [1,0,0,0,0,0|2,0,1]=4 734 B5R0.2 COCCOC MCULE-7572196731 [1,0,0,0,0,0|1,0,1]=3 735 B5R0.2 COCCON MCULE-3507489398 [1,0,0,0,0,0|2,0,1]=4 736 B5R0.2 COCCON MCULE-8506879697 [1,0,0,0,0,0|2,0,1]=4 737 B5R0.2 COCCSC MCULE-5362054021 [1,0,0,0,0,0|1,0,1]=3 738 B5R0.2 CONCCN MCULE-3332727097 [1,0,0,0,0,0|2,0,0]=3 739 B5R0.2 CONCCN MCULE-5066538639 [1,0,0,0,0,0|2,0,0]=3 740 B5R0.2 CONCCO MCULE-9787830121 [1,0,0,0,0,0|2,0,0]=3 741 B5R0.2 CSCCCBr MCULE-8399851816 [1,0,0,0,0,0|1,1,1]=4 742 B5R0.2 CSCCCCl MCULE-1829120476 [1,0,0,0,0,0|1,1,1]=4 743 B5R0.2 CSCCCN MCULE-1030938424 [1,0,0,0,0,0|1,1,1]=4 744 B5R0.2 CSCCCN MCULE-4664984921 [1,0,0,0,0,0|1,1,1]=4 745 B5R0.2 CSCCCO MCULE-9232413185 [1,0,0,0,0,0|1,1,1]=4 746 B5R0.2 CSCCCS MCULE-8405766359 [1,0,0,0,0,0|1,1,1]=4 747 B5R0.2 CSCCON MCULE-9125601960 [1,0,0,0,0,0|2,0,1]=4 748 B5R0.2 CSSCCN MCULE-7065189564 [1,0,0,0,0,0|2,1,0]=4 749 B5R0.2 CSSCCN MCULE-8654200268 [1,0,0,0,0,0|2,1,0]=4 750 B5R0.2 NCCCON MCULE-1071170242 [1,0,0,0,0,0|2,0,1]=4 751 B5R0.2 NCCCON MCULE-7767315563 [1,0,0,0,0,0|2,0,1]=4 752 B5R0.2 NOCCCO MCULE-1072312935 [1,0,0,0,0,0|2,0,1]=4 753 B5R0.2 NOCCCO MCULE-3715520109 [1,0,0,0,0,0|2,0,1]=4 754 B5R0.2 NOCCCS MCULE-2063976508 [1,0,0,0,0,0|2,0,1]=4 755 B5R0.2 NOCCCS MCULE-3464018652 [1,0,0,0,0,0|2,0,1]=4 756 B5R0.2 OC=CCCBr MCULE-3964604828 [1,0,0,0,0,0|3,0,0]=4 757 B5R0.2 OC=CCCBr MCULE-5728835735 [1,0,0,0,0,0|3,0,0]=4 758 B5R0.3 C#CC(=O)CC MCULE-1563732373 [1,0,0,0,0,0|1,0,1]=3 759 B5R0.3 C#CC(=O)NC MCULE-8852565705 [1,0,0,0,0,0|1,0,2]=4 760 B5R0.3 C#CC(=O)OC MCULE-5108326717 [1,0,0,0,0,0|0,0,2]=3 761 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [1,0,0,0,0,0|2,0,0]=3 762 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [1,0,0,0,0,0|2,0,0]=3 763 B5R0.3 C/N=C(\N)/SC MCULE-1114021101 [1,0,0,0,0,0|2,1,0]=4 764 B5R0.3 C/N=C(\N)/SC MCULE-4249574209 [1,0,0,0,0,0|2,1,0]=4 765 B5R0.3 C=C(C=O)CC MCULE-2875154067 [1,0,0,0,0,0|3,0,0]=4 766 B5R0.3 C=C(CC)CBr MCULE-1652422688 [1,0,0,0,0,0|3,0,0]=4 767 B5R0.3 C=C(CC)CC MCULE-9174509622 [1,0,0,0,0,0|2,0,0]=3 768 B5R0.3 C=C(CC)CN MCULE-2269385026 [1,0,0,0,0,0|3,0,0]=4 769 B5R0.3 C=C(CC)CN MCULE-3033447984 [1,0,0,0,0,0|3,0,0]=4 770 B5R0.3 C=C(CC)CO MCULE-8127766352 [1,0,0,0,0,0|3,0,0]=4 771 B5R0.3 C=C(SC)SC MCULE-8497326619 [1,0,0,0,0,0|2,1,0]=4 772 B5R0.3 C=CC(=O)CC MCULE-7277696617 [1,0,0,0,0,0|1,0,1]=3 773 B5R0.3 C=CC(=O)NC MCULE-5619481947 [1,0,0,0,0,0|1,0,2]=4 774 B5R0.3 C=CC(=O)OC MCULE-6010665978 [1,0,0,0,0,0|0,0,2]=3 775 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [1,0,0,0,0,0|3,0,0]=4 776 B5R0.3 CC/C(=N/O)/N MCULE-2794748611 [1,0,0,0,0,0|3,0,0]=4 777 B5R0.3 CC/C(=N/O)/N MCULE-7162577220 [1,0,0,0,0,0|3,0,0]=4 778 B5R0.3 CC=C(C)CC MCULE-5790494157 [1,0,0,0,0,0|2,0,0]=3 779 B5R0.3 CC=C(C)CCl MCULE-2444762050 [1,0,0,0,0,0|3,0,0]=4 780 B5R0.3 CCC(=N)OC MCULE-4123543795 [1,0,0,0,0,0|1,0,0]=2 781 B5R0.3 CCC(=N)OC MCULE-5346320805 [1,0,0,0,0,0|1,0,0]=2 782 B5R0.3 CCC(=NO)C MCULE-1859652505 [1,0,0,0,0,0|3,0,0]=4 783 B5R0.3 CCC(=O)CBr MCULE-7825573294 [1,0,0,0,0,0|2,0,0]=3 784 B5R0.3 CCC(=O)CC MCULE-8236549739 [1,0,0,0,0,0|1,0,0]=2 785 B5R0.3 CCC(=O)CCl MCULE-9019890380 [1,0,0,0,0,0|2,0,0]=3 786 B5R0.3 CCC(=O)CN MCULE-1863418812 [1,0,0,0,0,0|2,0,0]=3 787 B5R0.3 CCC(=O)CN MCULE-5831164340 [1,0,0,0,0,0|2,0,0]=3 788 B5R0.3 CCC(=O)CO MCULE-8674894820 [1,0,0,0,0,0|2,0,0]=3 789 B5R0.3 CCC(=O)NC MCULE-5612060170 [1,0,0,0,0,0|1,0,0]=2 790 B5R0.3 CCC(=O)NN MCULE-1803705917 [1,0,0,0,0,0|2,0,0]=3 791 B5R0.3 CCC(=O)NO MCULE-1033164448 [1,0,0,0,0,0|2,0,0]=3 792 B5R0.3 CCC(=O)OC MCULE-7384824725 [1,0,0,0,0,0|0,0,0]=1 793 B5R0.3 CCC(=O)SC MCULE-9712192191 [1,0,0,0,0,0|0,1,0]=2 794 B5R0.3 CCC(Br)CC MCULE-7435628721 [1,0,0,0,0,0|2,0,1]=4 795 B5R0.3 CCC(C)CC MCULE-2542807917 [1,0,0,0,0,0|2,0,1]=4 796 B5R0.3 CCC(C)NC MCULE-2676584804 [1,0,0,0,0,0|2,0,1]=4 797 B5R0.3 CCC(C)NC MCULE-6158046887 [1,0,0,0,0,0|2,0,1]=4 798 B5R0.3 CCC(C)OC MCULE-7354431606 [1,0,0,0,0,0|1,0,1]=3 799 B5R0.3 CCC(C)ON MCULE-2907890438 [1,0,0,0,0,0|2,0,1]=4 800 B5R0.3 CCC(C)ON MCULE-4364205813 [1,0,0,0,0,0|2,0,1]=4 801 B5R0.3 CCC(I)CC MCULE-1119844552 [1,0,0,0,0,0|2,0,1]=4 802 B5R0.3 CCC(N)CC MCULE-4261937519 [1,0,0,0,0,0|2,0,1]=4 803 B5R0.3 CCC(N)CC MCULE-5899128891 [1,0,0,0,0,0|2,0,1]=4 804 B5R0.3 CCC(O)CC MCULE-5553645045 [1,0,0,0,0,0|1,0,2]=4 805 B5R0.3 CCC(S)CC MCULE-2556259434 [1,0,0,0,0,0|1,1,1]=4 806 B5R0.3 CCN(C)CC MCULE-7207964917 [1,0,0,0,0,0|3,0,0]=4 807 B5R0.3 CCN(N)CC MCULE-9853386945 [1,0,0,0,0,0|3,0,0]=4 808 B5R0.3 CCN(N)CC MCULE-9962617398 [1,0,0,0,0,0|3,0,0]=4 809 B5R0.3 CCN(O)CC MCULE-6022935768 [1,0,0,0,0,0|2,0,1]=4 810 B5R0.3 CCP(=O)CC MCULE-2216184595 [1,0,0,0,0,0|2,0,0]=3 811 B5R0.3 CCP(Cl)CC MCULE-4484529264 [1,0,0,0,0,0|3,0,0]=4 812 B5R0.3 CCS(=O)CC MCULE-5102735179 [1,0,0,0,0,0|2,0,0]=3 813 B5R0.3 CNC(=N)CO MCULE-3239749882 [1,0,0,0,0,0|3,0,0]=4 814 B5R0.3 CNC(=N)NC MCULE-7703075263 [1,0,0,0,0,0|3,0,0]=4 815 B5R0.3 CNC(=O)CBr MCULE-1439209307 [1,0,0,0,0,0|2,0,0]=3 816 B5R0.3 CNC(=O)CCl MCULE-1437904095 [1,0,0,0,0,0|2,0,0]=3 817 B5R0.3 CNC(=O)CI MCULE-1687694185 [1,0,0,0,0,0|2,0,0]=3 818 B5R0.3 CNC(=O)CN MCULE-1901033297 [1,0,0,0,0,0|2,0,0]=3 819 B5R0.3 CNC(=O)CN MCULE-8532774234 [1,0,0,0,0,0|2,0,0]=3 820 B5R0.3 CNC(=O)CO MCULE-5899226107 [1,0,0,0,0,0|2,0,0]=3 821 B5R0.3 CNC(=O)CS MCULE-7032391129 [1,0,0,0,0,0|2,0,0]=3 822 B5R0.3 CNC(=O)NC MCULE-5319497155 [1,0,0,0,0,0|2,0,0]=3 823 B5R0.3 CNC(=O)NN MCULE-2093843774 [1,0,0,0,0,0|3,0,0]=4 824 B5R0.3 CNC(=O)OC MCULE-1162861376 [1,0,0,0,0,0|1,0,0]=2 825 B5R0.3 CNC(=S)NC MCULE-7998520647 [1,0,0,0,0,0|2,1,0]=4 826 B5R0.3 COC(=N)CCl MCULE-2713131753 [1,0,0,0,0,0|2,0,0]=3 827 B5R0.3 COC(=N)CCl MCULE-6471252676 [1,0,0,0,0,0|2,0,0]=3 828 B5R0.3 COC(=O)C#N MCULE-8762838190 [1,0,0,0,0,0|1,0,1]=3 829 B5R0.3 COC(=O)C=O MCULE-2685327079 [1,0,0,0,0,0|1,0,1]=3 830 B5R0.3 COC(=O)CBr MCULE-2684954408 [1,0,0,0,0,0|1,0,0]=2 831 B5R0.3 COC(=O)CCl MCULE-5886832940 [1,0,0,0,0,0|1,0,0]=2 832 B5R0.3 COC(=O)CF MCULE-4367430175 [1,0,0,0,0,0|1,0,0]=2 833 B5R0.3 COC(=O)CI MCULE-9545584156 [1,0,0,0,0,0|1,0,0]=2 834 B5R0.3 COC(=O)CN MCULE-7462799100 [1,0,0,0,0,0|1,0,0]=2 835 B5R0.3 COC(=O)CN MCULE-8887061469 [1,0,0,0,0,0|1,0,0]=2 836 B5R0.3 COC(=O)CO MCULE-8734582763 [1,0,0,0,0,0|1,0,0]=2 837 B5R0.3 COC(=O)CS MCULE-3020830180 [1,0,0,0,0,0|1,0,0]=2 838 B5R0.3 COC(=O)NN MCULE-2637794839 [1,0,0,0,0,0|2,0,0]=3 839 B5R0.3 COC(=O)OC MCULE-7488725621 [1,0,0,0,0,0|1,0,0]=2 840 B5R0.3 COC(=O)SCl MCULE-1018411491 [1,0,0,0,0,0|2,0,0]=3 841 B5R0.3 COC(=S)NN MCULE-8717505617 [1,0,0,0,0,0|2,1,0]=4 842 B5R0.3 COC(=S)SC MCULE-7665194168 [1,0,0,0,0,0|1,1,0]=3 843 B5R0.3 COC(C)CBr MCULE-6831960550 [1,0,0,0,0,0|2,0,1]=4 844 B5R0.3 COC(C)CCl MCULE-6614968111 [1,0,0,0,0,0|2,0,1]=4 845 B5R0.3 COC(C)CI MCULE-9561627722 [1,0,0,0,0,0|2,0,1]=4 846 B5R0.3 COC(C)CN MCULE-1378513525 [1,0,0,0,0,0|2,0,1]=4 847 B5R0.3 COC(C)CN MCULE-6114730248 [1,0,0,0,0,0|2,0,1]=4 848 B5R0.3 COC(C)CN MCULE-7516064224 [1,0,0,0,0,0|2,0,1]=4 849 B5R0.3 COC(C)CN MCULE-8277408054 [1,0,0,0,0,0|2,0,1]=4 850 B5R0.3 COC(C)CO MCULE-5269990702 [1,0,0,0,0,0|2,0,1]=4 851 B5R0.3 COC(C)CO MCULE-7173093332 [1,0,0,0,0,0|2,0,1]=4 852 B5R0.3 COC(C)OC MCULE-8241616143 [1,0,0,0,0,0|2,0,1]=4 853 B5R0.3 COS(=O)OC MCULE-9352053920 [1,0,0,0,0,0|2,0,0]=3 854 B5R0.3 CO[C@@H](C)CN MCULE-1448950160 [1,0,0,0,0,0|2,0,1]=4 855 B5R0.3 CO[C@@H](C)CN MCULE-3784073249 [1,0,0,0,0,0|2,0,1]=4 856 B5R0.3 CO[C@@H](C)CN MCULE-6073633931 [1,0,0,0,0,0|2,0,1]=4 857 B5R0.3 CO[C@@H](C)CN MCULE-9516756218 [1,0,0,0,0,0|2,0,1]=4 858 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [1,0,0,0,0,0|2,0,1]=4 859 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [1,0,0,0,0,0|2,0,1]=4 860 B5R0.3 CO[C@H](C)CN MCULE-4143562009 [1,0,0,0,0,0|2,0,1]=4 861 B5R0.3 CO[C@H](C)CN MCULE-4184510827 [1,0,0,0,0,0|2,0,1]=4 862 B5R0.3 CO[C@H](C)CN MCULE-9625722424 [1,0,0,0,0,0|2,0,1]=4 863 B5R0.3 CO[C@H](C)CN MCULE-9882567615 [1,0,0,0,0,0|2,0,1]=4 864 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [1,0,0,0,0,0|2,0,1]=4 865 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [1,0,0,0,0,0|2,0,1]=4 866 B5R0.3 CSC(=O)SC MCULE-7167992573 [1,0,0,0,0,0|1,1,0]=3 867 B5R0.3 CSC(=S)SC MCULE-5023087703 [1,0,0,0,0,0|1,2,0]=4 868 B5R0.3 NCC(=O)CN MCULE-2420991481 [1,0,0,0,0,0|3,0,0]=4 869 B5R0.3 NCC(=O)CN MCULE-8626789745 [1,0,0,0,0,0|3,0,0]=4 870 B5R0.3 NCC(=O)NN MCULE-2318099199 [1,0,0,0,0,0|3,0,0]=4 871 B5R0.3 NCC(=O)NN MCULE-3392354502 [1,0,0,0,0,0|3,0,0]=4 872 B5R0.3 NCC(=O)NO MCULE-5417617455 [1,0,0,0,0,0|3,0,0]=4 873 B5R0.3 NNC(=O)CCl MCULE-2158347473 [1,0,0,0,0,0|3,0,0]=4 874 B5R0.3 NNC(=O)CCl MCULE-9762553206 [1,0,0,0,0,0|3,0,0]=4 875 B5R0.3 NNC(=O)CO MCULE-8443636349 [1,0,0,0,0,0|3,0,0]=4 876 B5R0.3 NNC(=O)CS MCULE-4913925166 [1,0,0,0,0,0|3,0,0]=4 877 B5R0.3 O=C(CBr)CBr MCULE-5262523719 [1,0,0,0,0,0|3,0,0]=4 878 B5R0.3 O=C(CCl)CCl MCULE-2048636813 [1,0,0,0,0,0|3,0,0]=4 879 B5R0.3 O=C(CF)CF MCULE-8790300272 [1,0,0,0,0,0|3,0,0]=4 880 B5R0.3 O=C(CO)CO MCULE-7188810449 [1,0,0,0,0,0|3,0,0]=4 881 B5R0.3 O=CC(=O)CO MCULE-7273475675 [1,0,0,0,0,0|3,0,0]=4 882 B5R0.3 P(=O)(OC)OC MCULE-7918891029 [1,0,0,0,0,0|2,0,0]=3 883 B7R0.2 C#CC(=O)OC(C)C MCULE-2260869211 [0,1,0,0,0,0|2,0,1]=4 884 B7R0.2 C/C(=N\O)/CC(C)C MCULE-1223937315 [0,1,0,0,0,0|3,0,0]=4 885 B7R0.2 C=CC(=O)CC(C)C MCULE-2912404970 [0,1,0,0,0,0|1,0,1]=3 886 B7R0.2 C=CC(=O)NC(C)C MCULE-1145721543 [0,1,0,0,0,0|2,0,1]=4 887 B7R0.2 C=CC(=O)OC(C)C MCULE-8852781082 [0,1,0,0,0,0|2,0,1]=4 888 B7R0.2 CC(=NO)CC(C)C MCULE-1446840557 [0,1,0,0,0,0|3,0,0]=4 889 B7R0.2 CC(C)C/C(=N/O)/N MCULE-1815154611 [0,1,0,0,0,0|3,0,0]=4 890 B7R0.2 CC(C)CC(=O)C#N MCULE-7628756423 [0,1,0,0,0,0|2,0,0]=3 891 B7R0.2 CC(C)CC(=O)CBr MCULE-3556695745 [0,1,0,0,0,0|2,0,0]=3 892 B7R0.2 CC(C)CC(=O)CCl MCULE-6858533367 [0,1,0,0,0,0|2,0,0]=3 893 B7R0.2 CC(C)CC(=O)CN MCULE-2435223768 [0,1,0,0,0,0|2,0,0]=3 894 B7R0.2 CC(C)CC(=O)CN MCULE-7131454463 [0,1,0,0,0,0|2,0,0]=3 895 B7R0.2 CC(C)CC(=O)NN MCULE-7719387931 [0,1,0,0,0,0|2,0,0]=3 896 B7R0.2 CC(C)NC(=O)CBr MCULE-1272363222 [0,1,0,0,0,0|3,0,0]=4 897 B7R0.2 CC(C)NC(=O)CCl MCULE-8342964960 [0,1,0,0,0,0|3,0,0]=4 898 B7R0.2 CC(C)NC(=O)CI MCULE-8316056040 [0,1,0,0,0,0|3,0,0]=4 899 B7R0.2 CC(C)NC(=O)CN MCULE-7188824856 [0,1,0,0,0,0|3,0,0]=4 900 B7R0.2 CC(C)NC(=O)CN MCULE-8867435369 [0,1,0,0,0,0|3,0,0]=4 901 B7R0.2 CC(C)NC(=O)CO MCULE-5386700783 [0,1,0,0,0,0|3,0,0]=4 902 B7R0.2 CC(C)OC(=O)CBr MCULE-1610339208 [0,1,0,0,0,0|3,0,0]=4 903 B7R0.2 CC(C)OC(=O)CCl MCULE-3017211046 [0,1,0,0,0,0|3,0,0]=4 904 B7R0.2 CC(C)OC(=O)CN MCULE-4475626262 [0,1,0,0,0,0|3,0,0]=4 905 B7R0.2 CC(C)OC(=O)CN MCULE-5696337645 [0,1,0,0,0,0|3,0,0]=4 906 B7R0.2 CC(C)OC(=O)CO MCULE-4694316703 [0,1,0,0,0,0|3,0,0]=4 907 B7R0.2 CC(C)OC(=O)CS MCULE-5298940210 [0,1,0,0,0,0|3,0,0]=4 908 B7R0.2 CC(C)OC(=O)NN MCULE-5311288998 [0,1,0,0,0,0|3,0,0]=4 909 B7R0.2 CC(O)CC(=O)NN MCULE-2521784411 [0,1,0,0,0,0|2,0,0]=3 910 B7R0.2 CCC(=CC(C)C)C MCULE-7337557698 [0,1,0,0,0,0|2,0,1]=4 911 B7R0.2 CCC(=O)CC(=O)C MCULE-1892470405 [0,1,0,0,0,0|1,0,1]=3 912 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [0,1,0,0,0,0|2,0,1]=4 913 B7R0.2 CCC(=O)CC(C)C MCULE-8378320990 [0,1,0,0,0,0|1,0,0]=2 914 B7R0.2 CCC(=O)NC(C)C MCULE-3565002235 [0,1,0,0,0,0|2,0,0]=3 915 B7R0.2 CCC(=O)OC(=O)C MCULE-8264492254 [0,1,0,0,0,0|2,0,1]=4 916 B7R0.2 CCC(=O)OC(C)C MCULE-6546381101 [0,1,0,0,0,0|2,0,0]=3 917 B7R0.2 CCC(C)CC(C)C MCULE-9492683095 [0,1,0,0,0,0|2,0,1]=4 918 B7R0.2 CCC(C)CC(C)N MCULE-2633957870 [0,1,0,0,0,0|2,0,1]=4 919 B7R0.2 CCC(C)CC(C)N MCULE-5740038174 [0,1,0,0,0,0|2,0,1]=4 920 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [0,1,0,0,0,0|2,0,1]=4 921 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [0,1,0,0,0,0|1,0,2]=4 922 B7R0.2 CN(C)CC(=O)NN MCULE-4271340398 [0,1,0,0,0,0|3,0,0]=4 923 B7R0.2 CN(C)CC(=O)NN MCULE-8010840162 [0,1,0,0,0,0|3,0,0]=4 924 B7R0.2 CN(C)CC(=O)NN MCULE-9920503081 [0,1,0,0,0,0|3,0,0]=4 925 B7R0.2 CNC(=O)CC(=N)N MCULE-4798896062 [0,1,0,0,0,0|2,0,1]=4 926 B7R0.2 CNC(=O)CC(=N)N MCULE-6994336455 [0,1,0,0,0,0|2,0,1]=4 927 B7R0.2 CNC(=O)CC(=O)C MCULE-4316009681 [0,1,0,0,0,0|1,0,1]=3 928 B7R0.2 CNC(=O)CC(=O)O MCULE-3506871336 [0,1,0,0,0,0|2,0,1]=4 929 B7R0.2 CNC(=O)CC(=S)N MCULE-1637389152 [0,1,0,0,0,0|2,0,1]=4 930 B7R0.2 CNC(=O)CC(C)C MCULE-2303112628 [0,1,0,0,0,0|1,0,0]=2 931 B7R0.2 CNC(=O)CC(C)N MCULE-7773306348 [0,1,0,0,0,0|1,0,0]=2 932 B7R0.2 CNC(=O)CC(C)N MCULE-8658175271 [0,1,0,0,0,0|1,0,0]=2 933 B7R0.2 CNC(=O)CN(=O)=O MCULE-2253664059 [0,1,0,0,0,0|3,0,0]=4 934 B7R0.2 CNC(=O)NC(=O)C MCULE-9100713966 [0,1,0,0,0,0|2,0,1]=4 935 B7R0.2 CNC(C)CC(C)C MCULE-4458579180 [0,1,0,0,0,0|2,0,1]=4 936 B7R0.2 CNC(C)CC(C)C MCULE-9768203107 [0,1,0,0,0,0|2,0,1]=4 937 B7R0.2 COC(=CC(=O)C)C MCULE-1939113485 [0,1,0,0,0,0|1,0,2]=4 938 B7R0.2 COC(=N)CC(C)C MCULE-4603041381 [0,1,0,0,0,0|1,0,0]=2 939 B7R0.2 COC(=N)CC(C)C MCULE-5838686710 [0,1,0,0,0,0|1,0,0]=2 940 B7R0.2 COC(=O)/C=C(/C)\N MCULE-2378404457 [0,1,0,0,0,0|0,0,2]=3 941 B7R0.2 COC(=O)/C=C(\C)/N MCULE-7223502425 [0,1,0,0,0,0|0,0,2]=3 942 B7R0.2 COC(=O)C=C(C)C MCULE-9357284649 [0,1,0,0,0,0|0,0,2]=3 943 B7R0.2 COC(=O)C=C(C)N MCULE-8452012306 [0,1,0,0,0,0|0,0,2]=3 944 B7R0.2 COC(=O)C=C(C)[O-] MCULE-2706789496 [0,1,0,0,0,0|0,0,2]=3 945 B7R0.2 COC(=O)C=C(C)[O-] MCULE-4482386969 [0,1,0,0,0,0|0,0,2]=3 946 B7R0.2 COC(=O)CC(=N)N MCULE-3622266378 [0,1,0,0,0,0|1,0,1]=3 947 B7R0.2 COC(=O)CC(=N)N MCULE-8717458518 [0,1,0,0,0,0|1,0,1]=3 948 B7R0.2 COC(=O)CC(=O)C MCULE-1265364784 [0,1,0,0,0,0|0,0,1]=2 949 B7R0.2 COC(=O)CC(=O)Cl MCULE-5016603273 [0,1,0,0,0,0|1,0,1]=3 950 B7R0.2 COC(=O)CC(=O)N MCULE-7129379910 [0,1,0,0,0,0|1,0,1]=3 951 B7R0.2 COC(=O)CC(=O)O MCULE-7983457925 [0,1,0,0,0,0|1,0,1]=3 952 B7R0.2 COC(=O)CC(=O)[O-] MCULE-4316322156 [0,1,0,0,0,0|1,0,1]=3 953 B7R0.2 COC(=O)CC(=S)N MCULE-3325362226 [0,1,0,0,0,0|1,0,1]=3 954 B7R0.2 COC(=O)CC(C)Br MCULE-4193147778 [0,1,0,0,0,0|0,0,0]=1 955 B7R0.2 COC(=O)CC(C)C MCULE-2808202854 [0,1,0,0,0,0|0,0,0]=1 956 B7R0.2 COC(=O)CC(C)Cl MCULE-2734734940 [0,1,0,0,0,0|0,0,0]=1 957 B7R0.2 COC(=O)CC(C)N MCULE-2402304310 [0,1,0,0,0,0|0,0,0]=1 958 B7R0.2 COC(=O)CC(C)N MCULE-3520358398 [0,1,0,0,0,0|0,0,0]=1 959 B7R0.2 COC(=O)CC(C)N MCULE-4044567169 [0,1,0,0,0,0|0,0,0]=1 960 B7R0.2 COC(=O)CC(C)N MCULE-5962991844 [0,1,0,0,0,0|0,0,0]=1 961 B7R0.2 COC(=O)CC(C)O MCULE-7542131760 [0,1,0,0,0,0|0,0,0]=1 962 B7R0.2 COC(=O)CC(C)O MCULE-7559608260 [0,1,0,0,0,0|0,0,0]=1 963 B7R0.2 COC(=O)CC(C)S MCULE-8423856471 [0,1,0,0,0,0|0,0,0]=1 964 B7R0.2 COC(=O)CN(=O)=O MCULE-9778666398 [0,1,0,0,0,0|2,0,0]=3 965 B7R0.2 COC(=O)CN(C)C MCULE-2035644817 [0,1,0,0,0,0|1,0,0]=2 966 B7R0.2 COC(=O)CN(C)C MCULE-2356820620 [0,1,0,0,0,0|1,0,0]=2 967 B7R0.2 COC(=O)CS(=O)C MCULE-6286293391 [0,1,0,0,0,0|1,0,0]=2 968 B7R0.2 COC(=O)C[C@@H](C)N MCULE-1483636974 [0,1,0,0,0,0|0,0,0]=1 969 B7R0.2 COC(=O)C[C@@H](C)N MCULE-4260923997 [0,1,0,0,0,0|0,0,0]=1 970 B7R0.2 COC(=O)C[C@@H](C)N MCULE-6569883717 [0,1,0,0,0,0|0,0,0]=1 971 B7R0.2 COC(=O)C[C@@H](C)N MCULE-9853158708 [0,1,0,0,0,0|0,0,0]=1 972 B7R0.2 COC(=O)C[C@@H](C)O MCULE-1647366037 [0,1,0,0,0,0|0,0,0]=1 973 B7R0.2 COC(=O)C[C@@H](C)O MCULE-7832771936 [0,1,0,0,0,0|0,0,0]=1 974 B7R0.2 COC(=O)C[C@H](C)N MCULE-1385999778 [0,1,0,0,0,0|0,0,0]=1 975 B7R0.2 COC(=O)C[C@H](C)N MCULE-1446150641 [0,1,0,0,0,0|0,0,0]=1 976 B7R0.2 COC(=O)C[C@H](C)N MCULE-2979603570 [0,1,0,0,0,0|0,0,0]=1 977 B7R0.2 COC(=O)C[C@H](C)N MCULE-7679126750 [0,1,0,0,0,0|0,0,0]=1 978 B7R0.2 COC(=O)C[C@H](C)O MCULE-5154734951 [0,1,0,0,0,0|0,0,0]=1 979 B7R0.2 COC(=O)C[C@H](C)O MCULE-7031738180 [0,1,0,0,0,0|0,0,0]=1 980 B7R0.2 COC(=O)NC(C)C MCULE-4552685948 [0,1,0,0,0,0|1,0,0]=2 981 B7R0.2 COC(=O)OC(C)C MCULE-4462394604 [0,1,0,0,0,0|1,0,0]=2 982 B7R0.2 COC(=O)SC(C)C MCULE-9908884347 [0,1,0,0,0,0|1,0,0]=2 983 B7R0.2 COC(C)CC(C)O MCULE-3635789827 [0,1,0,0,0,0|1,0,1]=3 984 B7R0.2 CSC(=O)CC(C)C MCULE-5433173038 [0,1,0,0,0,0|0,1,0]=2 985 B7R0.3 C#CCCC(=O)OC MCULE-8778440511 [0,1,0,0,0,0|0,0,1]=2 986 B7R0.3 C#CCNC(=O)CC MCULE-2258533582 [0,1,0,0,0,0|1,0,2]=4 987 B7R0.3 C#CCNC(=O)NC MCULE-5171868572 [0,1,0,0,0,0|1,0,2]=4 988 B7R0.3 C#CCNC(=O)OC MCULE-3058580094 [0,1,0,0,0,0|0,0,2]=3 989 B7R0.3 C#CCOC(=O)CC MCULE-9368945481 [0,1,0,0,0,0|1,0,2]=4 990 B7R0.3 C#CCOC(=O)OC MCULE-7912235498 [0,1,0,0,0,0|0,0,2]=3 991 B7R0.3 C/C=C/CC(=O)OC MCULE-7204157194 [0,1,0,0,0,0|0,0,1]=2 992 B7R0.3 C=C(C=O)CCCC MCULE-4974026399 [0,1,0,0,0,0|3,0,0]=4 993 B7R0.3 C=C(CC)CCCC MCULE-5118701402 [0,1,0,0,0,0|2,0,0]=3 994 B7R0.3 C=CC(=C)CCCO MCULE-3558306961 [0,1,0,0,0,0|2,0,1]=4 995 B7R0.3 C=CC(=O)CCCCl MCULE-7188402172 [0,1,0,0,0,0|1,0,1]=3 996 B7R0.3 C=CC(=O)NCCC MCULE-5704500398 [0,1,0,0,0,0|1,0,1]=3 997 B7R0.3 C=CC(=O)NCCN MCULE-5552021639 [0,1,0,0,0,0|2,0,1]=4 998 B7R0.3 C=CC(=O)NCCN MCULE-6417335153 [0,1,0,0,0,0|2,0,1]=4 999 B7R0.3 C=CC(=O)NCCO MCULE-2036150536 [0,1,0,0,0,0|2,0,1]=4 1000 B7R0.3 C=CC(=O)OCCBr MCULE-3258133915 [0,1,0,0,0,0|2,0,1]=4 1001 B7R0.3 C=CC(=O)OCCC MCULE-5292603407 [0,1,0,0,0,0|1,0,1]=3 1002 B7R0.3 C=CC(=O)OCCCl MCULE-6902160724 [0,1,0,0,0,0|2,0,1]=4 1003 B7R0.3 C=CC(=O)OCCF MCULE-6798260659 [0,1,0,0,0,0|2,0,1]=4 1004 B7R0.3 C=CC(=O)OCCN MCULE-9056583453 [0,1,0,0,0,0|2,0,1]=4 1005 B7R0.3 C=CC(=O)OCCO MCULE-3147939665 [0,1,0,0,0,0|2,0,1]=4 1006 B7R0.3 C=CC=CC(=O)OC MCULE-1940821537 [0,1,0,0,0,0|0,0,3]=4 1007 B7R0.3 C=CCCC(=O)CBr MCULE-8443541398 [0,1,0,0,0,0|2,0,1]=4 1008 B7R0.3 C=CCCC(=O)CC MCULE-7933484898 [0,1,0,0,0,0|1,0,1]=3 1009 B7R0.3 C=CCCC(=O)CCl MCULE-4669619111 [0,1,0,0,0,0|2,0,1]=4 1010 B7R0.3 C=CCCC(=O)NC MCULE-9859680580 [0,1,0,0,0,0|1,0,1]=3 1011 B7R0.3 C=CCCC(=O)NN MCULE-1170308182 [0,1,0,0,0,0|2,0,1]=4 1012 B7R0.3 C=CCCC(=O)OC MCULE-8671478952 [0,1,0,0,0,0|0,0,1]=2 1013 B7R0.3 C=CCCC(=S)OC MCULE-4709907145 [0,1,0,0,0,0|0,1,1]=3 1014 B7R0.3 C=CCOC(=O)OC MCULE-9416609870 [0,1,0,0,0,0|0,0,2]=3 1015 B7R0.3 CC#CCC(=O)OC MCULE-4727663716 [0,1,0,0,0,0|0,0,1]=2 1016 B7R0.3 CC/C=C/C(=O)OC MCULE-5661442711 [0,1,0,0,0,0|0,0,1]=2 1017 B7R0.3 CC=CCC(=O)OC MCULE-9658428283 [0,1,0,0,0,0|0,0,1]=2 1018 B7R0.3 CCC(=O)CCCBr MCULE-3298679210 [0,1,0,0,0,0|1,0,0]=2 1019 B7R0.3 CCC(=O)CCCCl MCULE-3397599793 [0,1,0,0,0,0|1,0,0]=2 1020 B7R0.3 CCC(=O)NCCN MCULE-3384406070 [0,1,0,0,0,0|2,0,0]=3 1021 B7R0.3 CCC(=O)NCCN MCULE-3992696592 [0,1,0,0,0,0|2,0,0]=3 1022 B7R0.3 CCC(=O)NCCN MCULE-4556462042 [0,1,0,0,0,0|2,0,0]=3 1023 B7R0.3 CCC(=O)NCCO MCULE-7351790148 [0,1,0,0,0,0|2,0,0]=3 1024 B7R0.3 CCC(=O)OCCCl MCULE-7825392065 [0,1,0,0,0,0|2,0,0]=3 1025 B7R0.3 CCC(=O)OCCO MCULE-6019276519 [0,1,0,0,0,0|2,0,0]=3 1026 B7R0.3 CCC(=O)OCOC MCULE-8101176829 [0,1,0,0,0,0|2,0,0]=3 1027 B7R0.3 CCC(C)CCCO MCULE-2323419626 [0,1,0,0,0,0|2,0,1]=4 1028 B7R0.3 CCC(Cl)CCCCl MCULE-6770226574 [0,1,0,0,0,0|2,0,1]=4 1029 B7R0.3 CCC(N)CCCO MCULE-3868205501 [0,1,0,0,0,0|2,0,1]=4 1030 B7R0.3 CCC(N)CCOC MCULE-8279767210 [0,1,0,0,0,0|2,0,1]=4 1031 B7R0.3 CCC(O)CCCN MCULE-1491163174 [0,1,0,0,0,0|1,0,2]=4 1032 B7R0.3 CCC(O)CCCN MCULE-5150508895 [0,1,0,0,0,0|1,0,2]=4 1033 B7R0.3 CCC(O)CCCO MCULE-1099760826 [0,1,0,0,0,0|1,0,2]=4 1034 B7R0.3 CCC(O)CCOC MCULE-1245099360 [0,1,0,0,0,0|1,0,2]=4 1035 B7R0.3 CCC=CC(=O)OC MCULE-2390679048 [0,1,0,0,0,0|0,0,1]=2 1036 B7R0.3 CCCC/C(=N/O)/N MCULE-2186271962 [0,1,0,0,0,0|3,0,0]=4 1037 B7R0.3 CCCC=C(C)CC MCULE-4699949699 [0,1,0,0,0,0|2,0,0]=3 1038 B7R0.3 CCCCC(=N)OC MCULE-3917139857 [0,1,0,0,0,0|1,0,0]=2 1039 B7R0.3 CCCCC(=N)OC MCULE-8394549097 [0,1,0,0,0,0|1,0,0]=2 1040 B7R0.3 CCCCC(=NO)C MCULE-8239265636 [0,1,0,0,0,0|3,0,0]=4 1041 B7R0.3 CCCCC(=O)CBr MCULE-5866288227 [0,1,0,0,0,0|2,0,0]=3 1042 B7R0.3 CCCCC(=O)CC MCULE-7758340382 [0,1,0,0,0,0|1,0,0]=2 1043 B7R0.3 CCCCC(=O)CCl MCULE-9673190063 [0,1,0,0,0,0|2,0,0]=3 1044 B7R0.3 CCCCC(=O)NC MCULE-6810865419 [0,1,0,0,0,0|1,0,0]=2 1045 B7R0.3 CCCCC(=O)NN MCULE-9535710488 [0,1,0,0,0,0|2,0,0]=3 1046 B7R0.3 CCCCC(=O)OC MCULE-8635651818 [0,1,0,0,0,0|0,0,0]=1 1047 B7R0.3 CCCCC(Br)CC MCULE-3813549657 [0,1,0,0,0,0|2,0,1]=4 1048 B7R0.3 CCCCC(C)CC MCULE-9471981954 [0,1,0,0,0,0|2,0,1]=4 1049 B7R0.3 CCCCC(C)NC MCULE-7492621121 [0,1,0,0,0,0|2,0,1]=4 1050 B7R0.3 CCCCC(N)CC MCULE-1353863738 [0,1,0,0,0,0|2,0,1]=4 1051 B7R0.3 CCCCC(N)CC MCULE-9870475040 [0,1,0,0,0,0|2,0,1]=4 1052 B7R0.3 CCCCC(O)CC MCULE-3912386534 [0,1,0,0,0,0|1,0,2]=4 1053 B7R0.3 CCCCN(C)CC MCULE-7723007145 [0,1,0,0,0,0|3,0,0]=4 1054 B7R0.3 CCCNC(=O)CBr MCULE-3357000060 [0,1,0,0,0,0|2,0,0]=3 1055 B7R0.3 CCCNC(=O)CCl MCULE-3171078913 [0,1,0,0,0,0|2,0,0]=3 1056 B7R0.3 CCCNC(=O)CN MCULE-2964958967 [0,1,0,0,0,0|2,0,0]=3 1057 B7R0.3 CCCNC(=O)CN MCULE-4880764199 [0,1,0,0,0,0|2,0,0]=3 1058 B7R0.3 CCCNC(=O)NN MCULE-9369722445 [0,1,0,0,0,0|2,0,0]=3 1059 B7R0.3 CCCNC(=S)NN MCULE-3677693813 [0,1,0,0,0,0|2,1,0]=4 1060 B7R0.3 CCCNC(C)CC MCULE-8533643430 [0,1,0,0,0,0|2,0,1]=4 1061 B7R0.3 CCCOC(=O)CBr MCULE-9392658897 [0,1,0,0,0,0|2,0,0]=3 1062 B7R0.3 CCCOC(=O)CC MCULE-2749425161 [0,1,0,0,0,0|1,0,0]=2 1063 B7R0.3 CCCOC(=O)CCl MCULE-4900509903 [0,1,0,0,0,0|2,0,0]=3 1064 B7R0.3 CCCOC(=O)CN MCULE-5016724090 [0,1,0,0,0,0|2,0,0]=3 1065 B7R0.3 CCCOC(=O)CN MCULE-9899563764 [0,1,0,0,0,0|2,0,0]=3 1066 B7R0.3 CCCOC(=O)CS MCULE-7918412380 [0,1,0,0,0,0|2,0,0]=3 1067 B7R0.3 CCCOC(=O)OC MCULE-7254829881 [0,1,0,0,0,0|0,0,0]=1 1068 B7R0.3 CCN(C)CCCCl MCULE-3619674048 [0,1,0,0,0,0|3,0,0]=4 1069 B7R0.3 CCN(C)CCCCl MCULE-3845564178 [0,1,0,0,0,0|3,0,0]=4 1070 B7R0.3 CCN(C)CCCN MCULE-2231565296 [0,1,0,0,0,0|3,0,0]=4 1071 B7R0.3 CCN(C)CCCO MCULE-9090885474 [0,1,0,0,0,0|3,0,0]=4 1072 B7R0.3 CCN(C)CCNC MCULE-3001815120 [0,1,0,0,0,0|3,0,0]=4 1073 B7R0.3 CCNCC(=O)NC MCULE-6292959559 [0,1,0,0,0,0|1,0,0]=2 1074 B7R0.3 CCNCC(=O)OC MCULE-7988488004 [0,1,0,0,0,0|0,0,0]=1 1075 B7R0.3 CCNCC(=O)OC MCULE-9483901468 [0,1,0,0,0,0|0,0,0]=1 1076 B7R0.3 CCNCC(C)CC MCULE-8768620428 [0,1,0,0,0,0|2,0,1]=4 1077 B7R0.3 CCNCC(C)CC MCULE-9491990692 [0,1,0,0,0,0|2,0,1]=4 1078 B7R0.3 CCNCC(C)OC MCULE-9115511555 [0,1,0,0,0,0|1,0,1]=3 1079 B7R0.3 CCNCC(N)NC MCULE-1380874674 [0,1,0,0,0,0|2,0,1]=4 1080 B7R0.3 CCNCC(O)CC MCULE-9820144398 [0,1,0,0,0,0|1,0,2]=4 1081 B7R0.3 CCOCC(=O)CCl MCULE-3495077500 [0,1,0,0,0,0|2,0,0]=3 1082 B7R0.3 CCOCC(=O)NN MCULE-1157330147 [0,1,0,0,0,0|2,0,0]=3 1083 B7R0.3 CCOCC(=O)NN MCULE-3371253482 [0,1,0,0,0,0|2,0,0]=3 1084 B7R0.3 CCOCC(=O)OC MCULE-5158396979 [0,1,0,0,0,0|0,0,0]=1 1085 B7R0.3 CCOCC(N)CC MCULE-2793834769 [0,1,0,0,0,0|2,0,1]=4 1086 B7R0.3 CCOCC(N)CC MCULE-5142543434 [0,1,0,0,0,0|2,0,1]=4 1087 B7R0.3 CCONC(=O)CN MCULE-8014418978 [0,1,0,0,0,0|3,0,0]=4 1088 B7R0.3 CCONC(=O)CN MCULE-9229677559 [0,1,0,0,0,0|3,0,0]=4 1089 B7R0.3 CCSCC(=O)NN MCULE-2532030709 [0,1,0,0,0,0|2,0,0]=3 1090 B7R0.3 CCSCC(=O)OC MCULE-2538182357 [0,1,0,0,0,0|0,0,0]=1 1091 B7R0.3 CCSCC(C)NC MCULE-6245105657 [0,1,0,0,0,0|2,0,1]=4 1092 B7R0.3 CC[C@H](C)CCCO MCULE-1760153718 [0,1,0,0,0,0|2,0,1]=4 1093 B7R0.3 CC[C@H](C)CCCO MCULE-3488695651 [0,1,0,0,0,0|2,0,1]=4 1094 B7R0.3 CNC(=O)C=CCN MCULE-3646722223 [0,1,0,0,0,0|1,0,2]=4 1095 B7R0.3 CNC(=O)C=CCN MCULE-6988679780 [0,1,0,0,0,0|1,0,2]=4 1096 B7R0.3 CNC(=O)CCCCl MCULE-9460684794 [0,1,0,0,0,0|1,0,0]=2 1097 B7R0.3 CNC(=O)CCCN MCULE-4766031038 [0,1,0,0,0,0|1,0,0]=2 1098 B7R0.3 CNC(=O)CCCN MCULE-8992476653 [0,1,0,0,0,0|1,0,0]=2 1099 B7R0.3 CNC(=O)CCCO MCULE-2592655912 [0,1,0,0,0,0|1,0,0]=2 1100 B7R0.3 CNC(=O)CCOC MCULE-1263122933 [0,1,0,0,0,0|1,0,0]=2 1101 B7R0.3 CNC(=O)CN=N#N MCULE-3027813188 [0,1,0,0,0,0|3,0,0]=4 1102 B7R0.3 CNC(=O)NCCN MCULE-4075769099 [0,1,0,0,0,0|2,0,0]=3 1103 B7R0.3 CNC(=O)NCCN MCULE-9668937902 [0,1,0,0,0,0|2,0,0]=3 1104 B7R0.3 CNC(=O)NCCO MCULE-7936045962 [0,1,0,0,0,0|2,0,0]=3 1105 B7R0.3 CNC(=O)OCCCl MCULE-9946450406 [0,1,0,0,0,0|2,0,0]=3 1106 B7R0.3 CNC(=O)OCCO MCULE-7181085118 [0,1,0,0,0,0|2,0,0]=3 1107 B7R0.3 CNC(C)CCSC MCULE-2095620023 [0,1,0,0,0,0|2,0,1]=4 1108 B7R0.3 CNCC/C(=N/O)/N MCULE-5663392892 [0,1,0,0,0,0|3,0,0]=4 1109 B7R0.3 CNCC/C(=N/O)/N MCULE-9276854772 [0,1,0,0,0,0|3,0,0]=4 1110 B7R0.3 CNCCC(=O)NC MCULE-1793457920 [0,1,0,0,0,0|1,0,0]=2 1111 B7R0.3 CNCCC(=O)NC MCULE-7089073664 [0,1,0,0,0,0|1,0,0]=2 1112 B7R0.3 CNCCC(=O)OC MCULE-5657949377 [0,1,0,0,0,0|0,0,0]=1 1113 B7R0.3 CNCCC(=O)OC MCULE-9145127599 [0,1,0,0,0,0|0,0,0]=1 1114 B7R0.3 CNOCC(=O)OC MCULE-1491246414 [0,1,0,0,0,0|1,0,0]=2 1115 B7R0.3 CNOCC(=O)OC MCULE-2119135006 [0,1,0,0,0,0|1,0,0]=2 1116 B7R0.3 CO/C=C/C(=O)OC MCULE-8858181328 [0,1,0,0,0,0|0,0,2]=3 1117 B7R0.3 COC(=N)CCCCl MCULE-3704020642 [0,1,0,0,0,0|1,0,0]=2 1118 B7R0.3 COC(=N)CCCCl MCULE-6282500757 [0,1,0,0,0,0|1,0,0]=2 1119 B7R0.3 COC(=O)/C=C/CBr MCULE-5511432414 [0,1,0,0,0,0|0,0,2]=3 1120 B7R0.3 COC(=O)/C=C/CN MCULE-6249542756 [0,1,0,0,0,0|0,0,2]=3 1121 B7R0.3 COC(=O)/C=C/CN MCULE-7014993899 [0,1,0,0,0,0|0,0,2]=3 1122 B7R0.3 COC(=O)/C=C\CBr MCULE-5925439397 [0,1,0,0,0,0|0,0,2]=3 1123 B7R0.3 COC(=O)C#CCN MCULE-5567960811 [0,1,0,0,0,0|0,0,2]=3 1124 B7R0.3 COC(=O)C#CCN MCULE-9518684465 [0,1,0,0,0,0|0,0,2]=3 1125 B7R0.3 COC(=O)C#CCO MCULE-5683806193 [0,1,0,0,0,0|0,0,2]=3 1126 B7R0.3 COC(=O)C=CC=O MCULE-3663456611 [0,1,0,0,0,0|0,0,3]=4 1127 B7R0.3 COC(=O)C=CCBr MCULE-1558782396 [0,1,0,0,0,0|0,0,2]=3 1128 B7R0.3 COC(=O)C=CCN MCULE-4573398613 [0,1,0,0,0,0|0,0,2]=3 1129 B7R0.3 COC(=O)C=CCN MCULE-4807348004 [0,1,0,0,0,0|0,0,2]=3 1130 B7R0.3 COC(=O)C=CCN MCULE-7751483147 [0,1,0,0,0,0|0,0,2]=3 1131 B7R0.3 COC(=O)CCC#N MCULE-3476013569 [0,1,0,0,0,0|0,0,1]=2 1132 B7R0.3 COC(=O)CCC=O MCULE-2572188002 [0,1,0,0,0,0|0,0,1]=2 1133 B7R0.3 COC(=O)CCCBr MCULE-3856139347 [0,1,0,0,0,0|0,0,0]=1 1134 B7R0.3 COC(=O)CCCCl MCULE-9725150748 [0,1,0,0,0,0|0,0,0]=1 1135 B7R0.3 COC(=O)CCCI MCULE-6607823615 [0,1,0,0,0,0|0,0,0]=1 1136 B7R0.3 COC(=O)CCCN MCULE-2399653885 [0,1,0,0,0,0|0,0,0]=1 1137 B7R0.3 COC(=O)CCCN MCULE-7745643244 [0,1,0,0,0,0|0,0,0]=1 1138 B7R0.3 COC(=O)CCCO MCULE-6149839873 [0,1,0,0,0,0|0,0,0]=1 1139 B7R0.3 COC(=O)CCCS MCULE-6897052882 [0,1,0,0,0,0|0,0,0]=1 1140 B7R0.3 COC(=O)CCSC MCULE-8525618169 [0,1,0,0,0,0|0,0,0]=1 1141 B7R0.3 COC(=O)CN=C=O MCULE-4495056254 [0,1,0,0,0,0|1,0,1]=3 1142 B7R0.3 COC(=O)CN=C=S MCULE-6944178765 [0,1,0,0,0,0|1,0,1]=3 1143 B7R0.3 COC(=O)CN=N#N MCULE-8257278223 [0,1,0,0,0,0|2,0,0]=3 1144 B7R0.3 COC(=O)CNC=O MCULE-1485317532 [0,1,0,0,0,0|1,0,1]=3 1145 B7R0.3 COC(=O)NCCN MCULE-4816806580 [0,1,0,0,0,0|1,0,0]=2 1146 B7R0.3 COC(=O)NCCN MCULE-9765640123 [0,1,0,0,0,0|1,0,0]=2 1147 B7R0.3 COC(=O)NCCO MCULE-7141835204 [0,1,0,0,0,0|1,0,0]=2 1148 B7R0.3 COC=CC(=O)OC MCULE-3167643214 [0,1,0,0,0,0|0,0,2]=3 1149 B7R0.3 COCC/C(=N\O)/N MCULE-3175892655 [0,1,0,0,0,0|3,0,0]=4 1150 B7R0.3 COCC/C(=N\O)/N MCULE-8002911611 [0,1,0,0,0,0|3,0,0]=4 1151 B7R0.3 COCCC(=O)CCl MCULE-2918704994 [0,1,0,0,0,0|2,0,0]=3 1152 B7R0.3 COCCC(=O)NN MCULE-6895114863 [0,1,0,0,0,0|2,0,0]=3 1153 B7R0.3 COCCC(=O)OC MCULE-5918489580 [0,1,0,0,0,0|0,0,0]=1 1154 B7R0.3 N=C(CCCBr)NO MCULE-4204101118 [0,1,0,0,0,0|3,0,0]=4 1155 B7R0.3 NCC(=O)NCCF MCULE-1969796129 [0,1,0,0,0,0|3,0,0]=4 1156 B7R0.3 NCC(=O)NCCF MCULE-9924478230 [0,1,0,0,0,0|3,0,0]=4 1157 B7R0.3 NCC(=O)NCCO MCULE-3809178129 [0,1,0,0,0,0|3,0,0]=4 1158 B7R0.3 NCC(=O)NCCO MCULE-7057019123 [0,1,0,0,0,0|3,0,0]=4 1159 B7R0.3 NCC(=O)OCCCl MCULE-7924059164 [0,1,0,0,0,0|3,0,0]=4 1160 B7R0.3 NCC(=O)OCCCl MCULE-9260214783 [0,1,0,0,0,0|3,0,0]=4 1161 B7R0.3 NCCNC(=O)CCl MCULE-6059411085 [0,1,0,0,0,0|3,0,0]=4 1162 B7R0.3 NCCNC(=O)CCl MCULE-7545329795 [0,1,0,0,0,0|3,0,0]=4 1163 B7R0.3 NNC(=O)CCCCl MCULE-9370062145 [0,1,0,0,0,0|2,0,0]=3 1164 B7R0.3 NNC(=O)CCCO MCULE-4131007358 [0,1,0,0,0,0|2,0,0]=3 1165 B7R0.3 NNC(=O)OCCCl MCULE-1796161427 [0,1,0,0,0,0|3,0,0]=4 1166 B7R0.3 NNC(=O)OCCCl MCULE-3977269565 [0,1,0,0,0,0|3,0,0]=4 1167 B7R0.3 NNC(=O)OCCO MCULE-9375766063 [0,1,0,0,0,0|3,0,0]=4 1168 B7R0.3 O=C(CCl)CCCCl MCULE-2362491395 [0,1,0,0,0,0|2,0,0]=3 1169 B7R0.3 O=C(CCl)NCCCl MCULE-2029189763 [0,1,0,0,0,0|3,0,0]=4 1170 B7R0.3 O=C(CCl)NCCO MCULE-2803332455 [0,1,0,0,0,0|3,0,0]=4 1171 B7R0.3 O=C(CCl)OCCCl MCULE-7706105725 [0,1,0,0,0,0|3,0,0]=4 1172 B7R0.3 O=C(CO)NCCO MCULE-8933511918 [0,1,0,0,0,0|3,0,0]=4 1173 B7R0.5 C=C(Br)C(=O)OCC MCULE-3441307956 [0,1,0,0,0,0|2,0,1]=4 1174 B7R0.5 C=C(C)C(=O)NCO MCULE-2758821094 [0,1,0,0,0,0|3,0,0]=4 1175 B7R0.5 C=C(C)C(=O)OCC MCULE-9496497565 [0,1,0,0,0,0|2,0,0]=3 1176 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [0,1,0,0,0,0|3,0,0]=4 1177 B7R0.5 CC(C)C(=O)CC#N MCULE-1573579728 [0,1,0,0,0,0|2,0,1]=4 1178 B7R0.5 CC(C)C(=O)CCN MCULE-1638964690 [0,1,0,0,0,0|2,0,0]=3 1179 B7R0.5 CC(C)C(=O)CCN MCULE-5188027669 [0,1,0,0,0,0|2,0,0]=3 1180 B7R0.5 CC(C)C(=O)NCO MCULE-4279406951 [0,1,0,0,0,0|3,0,0]=4 1181 B7R0.5 CC(C)C(=O)OCBr MCULE-3276711258 [0,1,0,0,0,0|3,0,0]=4 1182 B7R0.5 CC(C)C(=O)OCCl MCULE-2226037128 [0,1,0,0,0,0|3,0,0]=4 1183 B7R0.5 CCCC(=C(F)F)F MCULE-1831306144 [0,1,0,0,0,0|3,0,0]=4 1184 B7R0.5 CCCC(=O)C(=O)C MCULE-8267463586 [0,1,0,0,0,0|1,0,0]=2 1185 B7R0.5 CCCC(=O)C(=O)N MCULE-6625605588 [0,1,0,0,0,0|2,0,0]=3 1186 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [0,1,0,0,0,0|2,0,0]=3 1187 B7R0.5 CCCC(=O)C(C)Br MCULE-8743472868 [0,1,0,0,0,0|1,0,0]=2 1188 B7R0.5 CCCC(=O)C(C)C MCULE-7690543374 [0,1,0,0,0,0|1,0,0]=2 1189 B7R0.5 CCCC(=O)N(C)C MCULE-8154537620 [0,1,0,0,0,0|1,0,0]=2 1190 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [0,1,0,0,0,0|2,0,1]=4 1191 B7R0.5 CCCC(Br)C(C)Br MCULE-4740207556 [0,1,0,0,0,0|2,0,1]=4 1192 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [0,1,0,0,0,0|2,0,1]=4 1193 B7R0.5 CCCC(C)C(C)C MCULE-1008931357 [0,1,0,0,0,0|2,0,1]=4 1194 B7R0.5 CCCC(C)C(C)N MCULE-3555650010 [0,1,0,0,0,0|2,0,1]=4 1195 B7R0.5 CCCC(C)C(C)N MCULE-8637319249 [0,1,0,0,0,0|2,0,1]=4 1196 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [0,1,0,0,0,0|2,0,1]=4 1197 B7R0.5 CCCC(O)C(C)C MCULE-8942406791 [0,1,0,0,0,0|1,0,2]=4 1198 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [0,1,0,0,0,0|3,0,0]=4 1199 B7R0.5 CCNC(=O)C(C)Br MCULE-4342500989 [0,1,0,0,0,0|2,0,0]=3 1200 B7R0.5 CCNC(=O)C(C)Cl MCULE-2094375104 [0,1,0,0,0,0|2,0,0]=3 1201 B7R0.5 CCNC(=O)C(C)N MCULE-7767946644 [0,1,0,0,0,0|2,0,0]=3 1202 B7R0.5 CCNC(=O)C(C)N MCULE-8324775088 [0,1,0,0,0,0|2,0,0]=3 1203 B7R0.5 CCNC(=O)C(C)N MCULE-9028977052 [0,1,0,0,0,0|2,0,0]=3 1204 B7R0.5 CCNC(=O)N(C)N MCULE-4378383472 [0,1,0,0,0,0|2,0,0]=3 1205 B7R0.5 CCNC(=O)[C@H](C)N MCULE-1043080386 [0,1,0,0,0,0|2,0,0]=3 1206 B7R0.5 CCNC(=O)[C@H](C)O MCULE-9098995292 [0,1,0,0,0,0|2,0,0]=3 1207 B7R0.5 CCNC(=S)N(C)N MCULE-5791702760 [0,1,0,0,0,0|2,1,0]=4 1208 B7R0.5 CCOC(=N)C(C)C MCULE-3425518673 [0,1,0,0,0,0|3,0,0]=4 1209 B7R0.5 CCOC(=N)C(C)C MCULE-9982777491 [0,1,0,0,0,0|3,0,0]=4 1210 B7R0.5 CCOC(=N)C(C)O MCULE-4906645723 [0,1,0,0,0,0|3,0,0]=4 1211 B7R0.5 CCOC(=N)C(C)O MCULE-6342692176 [0,1,0,0,0,0|3,0,0]=4 1212 B7R0.5 CCOC(=O)C(=N)N MCULE-4853735680 [0,1,0,0,0,0|3,0,0]=4 1213 B7R0.5 CCOC(=O)C(=N)N MCULE-9212797796 [0,1,0,0,0,0|3,0,0]=4 1214 B7R0.5 CCOC(=O)C(=O)C MCULE-5817261721 [0,1,0,0,0,0|2,0,0]=3 1215 B7R0.5 CCOC(=O)C(=O)Cl MCULE-6454421959 [0,1,0,0,0,0|3,0,0]=4 1216 B7R0.5 CCOC(=O)C(=O)N MCULE-2968497645 [0,1,0,0,0,0|3,0,0]=4 1217 B7R0.5 CCOC(=O)C(=O)O MCULE-2368024441 [0,1,0,0,0,0|3,0,0]=4 1218 B7R0.5 CCOC(=O)C(=O)[O-] MCULE-1807862684 [0,1,0,0,0,0|3,0,0]=4 1219 B7R0.5 CCOC(=O)C(=S)N MCULE-3285821799 [0,1,0,0,0,0|3,0,0]=4 1220 B7R0.5 CCOC(=O)C(Br)Br MCULE-8701615311 [0,1,0,0,0,0|3,0,0]=4 1221 B7R0.5 CCOC(=O)C(C)Br MCULE-3184697988 [0,1,0,0,0,0|2,0,0]=3 1222 B7R0.5 CCOC(=O)C(C)C MCULE-7190269066 [0,1,0,0,0,0|2,0,0]=3 1223 B7R0.5 CCOC(=O)C(C)Cl MCULE-8192833024 [0,1,0,0,0,0|2,0,0]=3 1224 B7R0.5 CCOC(=O)C(C)F MCULE-5743308430 [0,1,0,0,0,0|2,0,0]=3 1225 B7R0.5 CCOC(=O)C(C)I MCULE-5895787216 [0,1,0,0,0,0|2,0,0]=3 1226 B7R0.5 CCOC(=O)C(C)N MCULE-1694144423 [0,1,0,0,0,0|2,0,0]=3 1227 B7R0.5 CCOC(=O)C(C)N MCULE-4073874506 [0,1,0,0,0,0|2,0,0]=3 1228 B7R0.5 CCOC(=O)C(C)N MCULE-4082731166 [0,1,0,0,0,0|2,0,0]=3 1229 B7R0.5 CCOC(=O)C(C)N MCULE-5175870607 [0,1,0,0,0,0|2,0,0]=3 1230 B7R0.5 CCOC(=O)C(C)O MCULE-8057202883 [0,1,0,0,0,0|2,0,0]=3 1231 B7R0.5 CCOC(=O)C(C)O MCULE-9679398205 [0,1,0,0,0,0|2,0,0]=3 1232 B7R0.5 CCOC(=O)C(C)S MCULE-7890942953 [0,1,0,0,0,0|2,0,0]=3 1233 B7R0.5 CCOC(=O)C(Cl)Cl MCULE-3838429635 [0,1,0,0,0,0|3,0,0]=4 1234 B7R0.5 CCOC(=O)C(F)Br MCULE-5661791694 [0,1,0,0,0,0|3,0,0]=4 1235 B7R0.5 CCOC(=O)C(F)Cl MCULE-4260692293 [0,1,0,0,0,0|3,0,0]=4 1236 B7R0.5 CCOC(=O)C(F)F MCULE-6388513707 [0,1,0,0,0,0|3,0,0]=4 1237 B7R0.5 CCOC(=O)C(F)I MCULE-4681224874 [0,1,0,0,0,0|3,0,0]=4 1238 B7R0.5 CCOC(=O)N(C)C MCULE-8344568471 [0,1,0,0,0,0|2,0,0]=3 1239 B7R0.5 CCOC(=O)N(C)N MCULE-3043289486 [0,1,0,0,0,0|2,0,0]=3 1240 B7R0.5 CCOC(=O)N(Cl)Cl MCULE-5524945489 [0,1,0,0,0,0|3,0,0]=4 1241 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1032359164 [0,1,0,0,0,0|2,0,0]=3 1242 B7R0.5 CCOC(=O)[C@@H](C)F MCULE-1087923626 [0,1,0,0,0,0|2,0,0]=3 1243 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-1553164105 [0,1,0,0,0,0|2,0,0]=3 1244 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-2294196196 [0,1,0,0,0,0|2,0,0]=3 1245 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-4613491627 [0,1,0,0,0,0|2,0,0]=3 1246 B7R0.5 CCOC(=O)[C@@H](C)N MCULE-8190900780 [0,1,0,0,0,0|2,0,0]=3 1247 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-3372948910 [0,1,0,0,0,0|2,0,0]=3 1248 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-5795033916 [0,1,0,0,0,0|2,0,0]=3 1249 B7R0.5 CCOC(=O)[C@H](C)F MCULE-3258014155 [0,1,0,0,0,0|2,0,0]=3 1250 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4397919899 [0,1,0,0,0,0|2,0,0]=3 1251 B7R0.5 CCOC(=O)[C@H](C)N MCULE-4404274511 [0,1,0,0,0,0|2,0,0]=3 1252 B7R0.5 CCOC(=O)[C@H](C)N MCULE-7626045082 [0,1,0,0,0,0|2,0,0]=3 1253 B7R0.5 CCOC(=O)[C@H](C)N MCULE-8333235087 [0,1,0,0,0,0|2,0,0]=3 1254 B7R0.5 CCOC(=O)[C@H](C)O MCULE-4333545760 [0,1,0,0,0,0|2,0,0]=3 1255 B7R0.5 CCOC(=O)[C@H](C)O MCULE-8787861948 [0,1,0,0,0,0|2,0,0]=3 1256 B7R0.5 CCSC(=O)C(C)N MCULE-3205133332 [0,1,0,0,0,0|2,0,0]=3 1257 B7R0.5 CCSC(=O)C(C)N MCULE-4228316337 [0,1,0,0,0,0|2,0,0]=3 1258 B7R0.5 CCSC(=O)[C@H](C)N MCULE-3136283874 [0,1,0,0,0,0|2,0,0]=3 1259 B7R0.5 CCSC(=O)[C@H](C)N MCULE-7218618193 [0,1,0,0,0,0|2,0,0]=3 1260 B7R0.5 CCSC(=O)[C@H](C)N MCULE-8421179745 [0,1,0,0,0,0|2,0,0]=3 1261 B7R0.5 CCSC(=O)[C@H](C)N MCULE-9872171069 [0,1,0,0,0,0|2,0,0]=3 1262 B7R0.5 CN(C)C(=O)CC#N MCULE-2778522530 [0,1,0,0,0,0|2,0,1]=4 1263 B7R0.5 CN(C)C(=O)CCBr MCULE-5913033830 [0,1,0,0,0,0|2,0,0]=3 1264 B7R0.5 CN(C)C(=O)CCCl MCULE-3291912562 [0,1,0,0,0,0|2,0,0]=3 1265 B7R0.5 CN(C)C(=O)CCN MCULE-1852673058 [0,1,0,0,0,0|2,0,0]=3 1266 B7R0.5 CN(C)C(=O)CCN MCULE-6281328637 [0,1,0,0,0,0|2,0,0]=3 1267 B7R0.5 CN(C)C(=O)CCO MCULE-8849440937 [0,1,0,0,0,0|2,0,0]=3 1268 B7R0.5 CN(C)C(=O)CON MCULE-4400747484 [0,1,0,0,0,0|3,0,0]=4 1269 B7R0.5 CN(C)C(=O)OCCl MCULE-5918090090 [0,1,0,0,0,0|3,0,0]=4 1270 B7R0.5 CNCC(=O)N(C)C MCULE-2332172341 [0,1,0,0,0,0|2,0,0]=3 1271 B7R0.5 CNCC(=O)N(C)C MCULE-6934800093 [0,1,0,0,0,0|2,0,0]=3 1272 B7R0.5 COCC(=O)C(C)C MCULE-8251961368 [0,1,0,0,0,0|2,0,0]=3 1273 B7R0.5 COCC(=O)N(C)C MCULE-4175778673 [0,1,0,0,0,0|2,0,0]=3 1274 B7R0.7 C#CCC(=O)OCC MCULE-2012473321 [0,1,0,0,0,0|0,0,2]=3 1275 B7R0.7 C/C=C/C(=O)OCC MCULE-8433823264 [0,1,0,0,0,0|0,0,2]=3 1276 B7R0.7 C=C(CCBr)CCBr MCULE-2280580612 [0,1,0,0,0,0|3,0,0]=4 1277 B7R0.7 C=C(CCC)CCO MCULE-1774943854 [0,1,0,0,0,0|2,0,0]=3 1278 B7R0.7 C=C(OCC)OCC MCULE-5191107236 [0,1,0,0,0,0|2,0,0]=3 1279 B7R0.7 C=C=CC(=O)OCC MCULE-9108726418 [0,1,0,0,0,0|0,0,3]=4 1280 B7R0.7 C=CCC(=O)OCC MCULE-2006542536 [0,1,0,0,0,0|0,0,2]=3 1281 B7R0.7 C=COC(=O)/C=C/C MCULE-3646996165 [0,1,0,0,0,0|0,0,3]=4 1282 B7R0.7 C=COC(=O)C=CC MCULE-7917602280 [0,1,0,0,0,0|0,0,3]=4 1283 B7R0.7 C=COC(=O)CCC MCULE-2764567967 [0,1,0,0,0,0|0,0,1]=2 1284 B7R0.7 CC#CC(=O)OCC MCULE-3358315498 [0,1,0,0,0,0|0,0,2]=3 1285 B7R0.7 CC=CC(=O)OCC MCULE-1904771513 [0,1,0,0,0,0|0,0,2]=3 1286 B7R0.7 CC=CC(O)CCC MCULE-2375824505 [0,1,0,0,0,0|1,0,2]=4 1287 B7R0.7 CCCC(=N)OCC MCULE-5551107242 [0,1,0,0,0,0|1,0,0]=2 1288 B7R0.7 CCCC(=N)OCC MCULE-7790310067 [0,1,0,0,0,0|1,0,0]=2 1289 B7R0.7 CCCC(=O)CC#N MCULE-7580308812 [0,1,0,0,0,0|1,0,1]=3 1290 B7R0.7 CCCC(=O)CCC MCULE-1621649928 [0,1,0,0,0,0|1,0,0]=2 1291 B7R0.7 CCCC(=O)OCC MCULE-9977024136 [0,1,0,0,0,0|0,0,0]=1 1292 B7R0.7 CCCC(=O)OCCl MCULE-5186069317 [0,1,0,0,0,0|0,0,0]=1 1293 B7R0.7 CCCC(Br)CCBr MCULE-7954993658 [0,1,0,0,0,0|2,0,1]=4 1294 B7R0.7 CCCC(Br)CCC MCULE-4124374663 [0,1,0,0,0,0|2,0,1]=4 1295 B7R0.7 CCCC(C)CCC MCULE-5291190768 [0,1,0,0,0,0|2,0,1]=4 1296 B7R0.7 CCCC(C)CCO MCULE-6887128167 [0,1,0,0,0,0|2,0,1]=4 1297 B7R0.7 CCCC(C)NCC MCULE-3443551812 [0,1,0,0,0,0|2,0,1]=4 1298 B7R0.7 CCCC(C)NCC MCULE-7227087576 [0,1,0,0,0,0|2,0,1]=4 1299 B7R0.7 CCCC(C)OCC MCULE-2678814077 [0,1,0,0,0,0|1,0,1]=3 1300 B7R0.7 CCCC(N)CCC MCULE-1003038397 [0,1,0,0,0,0|2,0,1]=4 1301 B7R0.7 CCCC(N)CCC MCULE-3454953409 [0,1,0,0,0,0|2,0,1]=4 1302 B7R0.7 CCCC(N)CCO MCULE-3641094890 [0,1,0,0,0,0|2,0,1]=4 1303 B7R0.7 CCCC(N)CCO MCULE-5323991138 [0,1,0,0,0,0|2,0,1]=4 1304 B7R0.7 CCCC(N)CCO MCULE-6597027417 [0,1,0,0,0,0|2,0,1]=4 1305 B7R0.7 CCCC(N)CCO MCULE-8093709628 [0,1,0,0,0,0|2,0,1]=4 1306 B7R0.7 CCCC(O)CCC MCULE-1942797307 [0,1,0,0,0,0|1,0,2]=4 1307 B7R0.7 CCCC(O)CCN MCULE-3796998426 [0,1,0,0,0,0|1,0,2]=4 1308 B7R0.7 CCCC(O)CCO MCULE-6957178966 [0,1,0,0,0,0|1,0,2]=4 1309 B7R0.7 CCCC(S)CCC MCULE-4775274873 [0,1,0,0,0,0|1,1,1]=4 1310 B7R0.7 CCCC(S)CCO MCULE-7972451905 [0,1,0,0,0,0|1,1,1]=4 1311 B7R0.7 CCCN(C)CCC MCULE-9743961087 [0,1,0,0,0,0|3,0,0]=4 1312 B7R0.7 CCC[C@@H](N)CCO MCULE-1862127512 [0,1,0,0,0,0|2,0,1]=4 1313 B7R0.7 CCC[C@@H](N)CCO MCULE-3031366486 [0,1,0,0,0,0|2,0,1]=4 1314 B7R0.7 CCC[C@@H](N)CCO MCULE-4433535200 [0,1,0,0,0,0|2,0,1]=4 1315 B7R0.7 CCC[C@@H](N)CCO MCULE-8325506694 [0,1,0,0,0,0|2,0,1]=4 1316 B7R0.7 CCC[C@H](N)CCO MCULE-3164100995 [0,1,0,0,0,0|2,0,1]=4 1317 B7R0.7 CCC[C@H](N)CCO MCULE-3262978007 [0,1,0,0,0,0|2,0,1]=4 1318 B7R0.7 CCC[C@H](N)CCO MCULE-3382311889 [0,1,0,0,0,0|2,0,1]=4 1319 B7R0.7 CCC[C@H](N)CCO MCULE-4865013919 [0,1,0,0,0,0|2,0,1]=4 1320 B7R0.7 CCNC(=O)CC#N MCULE-4756290560 [0,1,0,0,0,0|2,0,1]=4 1321 B7R0.7 CCNC(=O)CCCl MCULE-3246776319 [0,1,0,0,0,0|2,0,0]=3 1322 B7R0.7 CCNC(=O)CCN MCULE-2856252531 [0,1,0,0,0,0|2,0,0]=3 1323 B7R0.7 CCNC(=O)CCN MCULE-3929666209 [0,1,0,0,0,0|2,0,0]=3 1324 B7R0.7 CCNC(=O)CCO MCULE-3624072697 [0,1,0,0,0,0|2,0,0]=3 1325 B7R0.7 CCNC(=O)CNC MCULE-1939824251 [0,1,0,0,0,0|2,0,0]=3 1326 B7R0.7 CCNC(=O)CNC MCULE-2815515396 [0,1,0,0,0,0|2,0,0]=3 1327 B7R0.7 CCNC(=O)NCC MCULE-2253571388 [0,1,0,0,0,0|2,0,0]=3 1328 B7R0.7 CCNC(=O)OCC MCULE-3910060770 [0,1,0,0,0,0|1,0,0]=2 1329 B7R0.7 CCNC(=S)NCC MCULE-8237270311 [0,1,0,0,0,0|2,1,0]=4 1330 B7R0.7 CCNC(C)COC MCULE-3519332383 [0,1,0,0,0,0|2,0,1]=4 1331 B7R0.7 CCNC(C)COC MCULE-9226487666 [0,1,0,0,0,0|2,0,1]=4 1332 B7R0.7 CCOC(=N)CC#N MCULE-3997647151 [0,1,0,0,0,0|2,0,1]=4 1333 B7R0.7 CCOC(=N)CC#N MCULE-6574650764 [0,1,0,0,0,0|2,0,1]=4 1334 B7R0.7 CCOC(=N)CCCl MCULE-3462649487 [0,1,0,0,0,0|2,0,0]=3 1335 B7R0.7 CCOC(=N)CCCl MCULE-7130199135 [0,1,0,0,0,0|2,0,0]=3 1336 B7R0.7 CCOC(=N)CCO MCULE-8135932013 [0,1,0,0,0,0|2,0,0]=3 1337 B7R0.7 CCOC(=N)CCO MCULE-9125708150 [0,1,0,0,0,0|2,0,0]=3 1338 B7R0.7 CCOC(=N)COC MCULE-1358920023 [0,1,0,0,0,0|2,0,0]=3 1339 B7R0.7 CCOC(=N)COC MCULE-8494947544 [0,1,0,0,0,0|2,0,0]=3 1340 B7R0.7 CCOC(=O)/C=C/I MCULE-4105665503 [0,1,0,0,0,0|1,0,2]=4 1341 B7R0.7 CCOC(=O)/C=C/O MCULE-1984925411 [0,1,0,0,0,0|1,0,2]=4 1342 B7R0.7 CCOC(=O)/C=C/[O-] MCULE-5625833261 [0,1,0,0,0,0|1,0,2]=4 1343 B7R0.7 CCOC(=O)/C=C\Br MCULE-7525620721 [0,1,0,0,0,0|1,0,2]=4 1344 B7R0.7 CCOC(=O)/C=C\I MCULE-4741067503 [0,1,0,0,0,0|1,0,2]=4 1345 B7R0.7 CCOC(=O)/C=C\N MCULE-1135242139 [0,1,0,0,0,0|1,0,2]=4 1346 B7R0.7 CCOC(=O)C#CBr MCULE-5306962165 [0,1,0,0,0,0|1,0,2]=4 1347 B7R0.7 CCOC(=O)C=CBr MCULE-3778834856 [0,1,0,0,0,0|1,0,2]=4 1348 B7R0.7 CCOC(=O)C=CI MCULE-9930784067 [0,1,0,0,0,0|1,0,2]=4 1349 B7R0.7 CCOC(=O)C=CO MCULE-2570791221 [0,1,0,0,0,0|1,0,2]=4 1350 B7R0.7 CCOC(=O)C=C[O-] MCULE-8425740727 [0,1,0,0,0,0|1,0,2]=4 1351 B7R0.7 CCOC(=O)C=NN MCULE-5132323904 [0,1,0,0,0,0|2,0,1]=4 1352 B7R0.7 CCOC(=O)C=NN MCULE-5899717314 [0,1,0,0,0,0|2,0,1]=4 1353 B7R0.7 CCOC(=O)C=NO MCULE-8888029932 [0,1,0,0,0,0|2,0,1]=4 1354 B7R0.7 CCOC(=O)CC#N MCULE-3161671261 [0,1,0,0,0,0|1,0,1]=3 1355 B7R0.7 CCOC(=O)CC=O MCULE-5042552247 [0,1,0,0,0,0|1,0,1]=3 1356 B7R0.7 CCOC(=O)CCBr MCULE-1898467026 [0,1,0,0,0,0|1,0,0]=2 1357 B7R0.7 CCOC(=O)CCCl MCULE-2623656770 [0,1,0,0,0,0|1,0,0]=2 1358 B7R0.7 CCOC(=O)CCI MCULE-9651397551 [0,1,0,0,0,0|1,0,0]=2 1359 B7R0.7 CCOC(=O)CCN MCULE-4383008445 [0,1,0,0,0,0|1,0,0]=2 1360 B7R0.7 CCOC(=O)CCN MCULE-6873709061 [0,1,0,0,0,0|1,0,0]=2 1361 B7R0.7 CCOC(=O)CCO MCULE-3972081033 [0,1,0,0,0,0|1,0,0]=2 1362 B7R0.7 CCOC(=O)CCS MCULE-3955367746 [0,1,0,0,0,0|1,0,0]=2 1363 B7R0.7 CCOC(=O)CNC MCULE-3219895330 [0,1,0,0,0,0|1,0,0]=2 1364 B7R0.7 CCOC(=O)CNC MCULE-6164649520 [0,1,0,0,0,0|1,0,0]=2 1365 B7R0.7 CCOC(=O)CNN MCULE-2832319636 [0,1,0,0,0,0|2,0,0]=3 1366 B7R0.7 CCOC(=O)CNN MCULE-3479623348 [0,1,0,0,0,0|2,0,0]=3 1367 B7R0.7 CCOC(=O)CNN MCULE-5066106273 [0,1,0,0,0,0|2,0,0]=3 1368 B7R0.7 CCOC(=O)COC MCULE-7739678079 [0,1,0,0,0,0|1,0,0]=2 1369 B7R0.7 CCOC(=O)CON MCULE-4924818206 [0,1,0,0,0,0|2,0,0]=3 1370 B7R0.7 CCOC(=O)CSC MCULE-5199209389 [0,1,0,0,0,0|1,0,0]=2 1371 B7R0.7 CCOC(=O)N=C=O MCULE-6030513409 [0,1,0,0,0,0|2,0,1]=4 1372 B7R0.7 CCOC(=O)N=C=S MCULE-1259119752 [0,1,0,0,0,0|2,0,1]=4 1373 B7R0.7 CCOC(=O)N=S=O MCULE-2418866175 [0,1,0,0,0,0|2,1,0]=4 1374 B7R0.7 CCOC(=O)NCCl MCULE-9646468987 [0,1,0,0,0,0|2,0,0]=3 1375 B7R0.7 CCOC(=O)NCO MCULE-1265242244 [0,1,0,0,0,0|2,0,0]=3 1376 B7R0.7 CCOC(=O)NNC MCULE-8689837834 [0,1,0,0,0,0|2,0,0]=3 1377 B7R0.7 CCOC(=O)NOC MCULE-2256963329 [0,1,0,0,0,0|1,0,0]=2 1378 B7R0.7 CCOC(=O)OCC MCULE-1394890550 [0,1,0,0,0,0|1,0,0]=2 1379 B7R0.7 CCOC(=O)OCCl MCULE-9723292956 [0,1,0,0,0,0|1,0,0]=2 1380 B7R0.7 CCOC(=O)OCI MCULE-7994621582 [0,1,0,0,0,0|1,0,0]=2 1381 B7R0.7 CCOC(=O)[CH-]C=O MCULE-1944484299 [0,1,0,0,0,0|1,0,2]=4 1382 B7R0.7 CCOC(=O)[CH-]C=O MCULE-5022028224 [0,1,0,0,0,0|1,0,2]=4 1383 B7R0.7 CCOC(=S)SCC MCULE-9637505732 [0,1,0,0,0,0|1,1,0]=3 1384 B7R0.7 CCOC(C)CNC MCULE-9630095723 [0,1,0,0,0,0|2,0,1]=4 1385 B7R0.7 CCOC(C)OCC MCULE-7152410134 [0,1,0,0,0,0|2,0,1]=4 1386 B7R0.7 CCOP(C)OCC MCULE-2299160311 [0,1,0,0,0,0|3,0,0]=4 1387 B7R0.7 CCOP(Cl)OCC MCULE-5522995801 [0,1,0,0,0,0|3,0,0]=4 1388 B7R0.7 CCOS(=O)OCC MCULE-6252684995 [0,1,0,0,0,0|2,0,0]=3 1389 B7R0.7 CCSC(=O)SCC MCULE-7783165279 [0,1,0,0,0,0|1,1,0]=3 1390 B7R0.7 CNCC(O)COC MCULE-8497493216 [0,1,0,0,0,0|1,0,2]=4 1391 B7R0.7 COCC(=CCBr)C MCULE-6258296852 [0,1,0,0,0,0|2,0,1]=4 1392 B7R0.7 COCC(=O)CC#N MCULE-7023614757 [0,1,0,0,0,0|1,0,1]=3 1393 B7R0.7 COCC(=O)COC MCULE-5119511792 [0,1,0,0,0,0|1,0,0]=2 1394 B7R0.7 COCC(Br)COC MCULE-8590528928 [0,1,0,0,0,0|2,0,1]=4 1395 B7R0.7 COCC(C)CCO MCULE-6812981556 [0,1,0,0,0,0|2,0,1]=4 1396 B7R0.7 COCC(Cl)COC MCULE-1871071718 [0,1,0,0,0,0|2,0,1]=4 1397 B7R0.7 COCC(N)CCO MCULE-2569422233 [0,1,0,0,0,0|2,0,1]=4 1398 B7R0.7 COCC(N)COC MCULE-3531117264 [0,1,0,0,0,0|2,0,1]=4 1399 B7R0.7 COCC(N)COC MCULE-3609597955 [0,1,0,0,0,0|2,0,1]=4 1400 B7R0.7 COCC(O)CCN MCULE-9524454931 [0,1,0,0,0,0|1,0,2]=4 1401 B7R0.7 COCC(O)COC MCULE-5364514636 [0,1,0,0,0,0|1,0,2]=4 1402 B7R0.7 O=C(CCBr)CCBr MCULE-4794296091 [0,1,0,0,0,0|2,0,0]=3 1403 B7R0.7 O=C(CCCl)CCCl MCULE-1408529874 [0,1,0,0,0,0|2,0,0]=3 1404 B7R0.7 O=C(CCO)CCO MCULE-8765223516 [0,1,0,0,0,0|2,0,0]=3 1405 B7R0.7 O=C(NCO)NCO MCULE-8625819432 [0,1,0,0,0,0|3,0,0]=4 1406 B7R0.7 O=S(CCO)CCO MCULE-3068452870 [0,1,0,0,0,0|3,0,0]=4 1407 B7R0.7 P(=O)(OCC)OCC MCULE-8519301551 [0,1,0,0,0,0|2,0,0]=3 1408 B7R0.7 P(=S)(OCC)OCC MCULE-9585241913 [0,1,0,0,0,0|2,1,0]=4 1409 B7R0.10 C/C=C(/C)\C(=O)OC MCULE-6490619453 [0,1,0,0,0,0|0,0,2]=3 1410 B7R0.10 C/C=C(\C)/C(=O)OC MCULE-2521624465 [0,1,0,0,0,0|0,0,2]=3 1411 B7R0.10 C=C(C#N)C(=O)OC MCULE-4928080553 [0,1,0,0,0,0|1,0,2]=4 1412 B7R0.10 C=C(CBr)C(=O)OC MCULE-7991860093 [0,1,0,0,0,0|1,0,1]=3 1413 B7R0.10 C=C(CC)C(=O)OC MCULE-2064145693 [0,1,0,0,0,0|0,0,1]=2 1414 B7R0.10 C=C(CCl)C(=O)OC MCULE-8356509776 [0,1,0,0,0,0|1,0,1]=3 1415 B7R0.10 C=C(CO)C(=O)OC MCULE-8888105984 [0,1,0,0,0,0|1,0,1]=3 1416 B7R0.10 C=C(OC)C(=O)OC MCULE-3256769494 [0,1,0,0,0,0|1,0,1]=3 1417 B7R0.10 C=CC(=O)N(C)CC MCULE-8629361048 [0,1,0,0,0,0|2,0,1]=4 1418 B7R0.10 C=CC(Cl)C(=O)OC MCULE-8371197919 [0,1,0,0,0,0|0,0,2]=3 1419 B7R0.10 C=CC(N)C(=O)OC MCULE-6449924585 [0,1,0,0,0,0|0,0,2]=3 1420 B7R0.10 C=CC(N)C(=O)OC MCULE-8138684326 [0,1,0,0,0,0|0,0,2]=3 1421 B7R0.10 C=CC(O)C(=O)OC MCULE-8475572887 [0,1,0,0,0,0|0,0,2]=3 1422 B7R0.10 CC=C(Br)C(=O)OC MCULE-8210439839 [0,1,0,0,0,0|0,0,2]=3 1423 B7R0.10 CC=C(C)C(=O)OC MCULE-7431996149 [0,1,0,0,0,0|0,0,2]=3 1424 B7R0.10 CCC(=O)C(=O)CC MCULE-4346857339 [0,1,0,0,0,0|1,0,1]=3 1425 B7R0.10 CCC(=O)C(=O)OC MCULE-6526576267 [0,1,0,0,0,0|0,0,1]=2 1426 B7R0.10 CCC(=O)C(C)C#N MCULE-5937845036 [0,1,0,0,0,0|2,0,1]=4 1427 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [0,1,0,0,0,0|1,0,0]=2 1428 B7R0.10 CCC(=O)N(C)CC MCULE-1764457516 [0,1,0,0,0,0|2,0,0]=3 1429 B7R0.10 CCC(=O)N(C)OC MCULE-7450696534 [0,1,0,0,0,0|2,0,1]=4 1430 B7R0.10 CCC(Br)C(=O)NC MCULE-5335067622 [0,1,0,0,0,0|1,0,0]=2 1431 B7R0.10 CCC(Br)C(=O)OC MCULE-2335527491 [0,1,0,0,0,0|0,0,0]=1 1432 B7R0.10 CCC(C)/C(=N/O)/N MCULE-3220820796 [0,1,0,0,0,0|3,0,0]=4 1433 B7R0.10 CCC(C)/C(=N/O)/N MCULE-6860766298 [0,1,0,0,0,0|3,0,0]=4 1434 B7R0.10 CCC(C)C(=O)CBr MCULE-7022126762 [0,1,0,0,0,0|2,0,0]=3 1435 B7R0.10 CCC(C)C(=O)CCl MCULE-6800466655 [0,1,0,0,0,0|2,0,0]=3 1436 B7R0.10 CCC(C)C(=O)NC MCULE-5599095900 [0,1,0,0,0,0|1,0,0]=2 1437 B7R0.10 CCC(C)C(=O)NN MCULE-4144584435 [0,1,0,0,0,0|2,0,0]=3 1438 B7R0.10 CCC(C)C(=O)OC MCULE-9845747952 [0,1,0,0,0,0|0,0,0]=1 1439 B7R0.10 CCC(C)C(C)CC MCULE-8164178184 [0,1,0,0,0,0|2,0,1]=4 1440 B7R0.10 CCC(C)C(O)CC MCULE-3936368693 [0,1,0,0,0,0|1,0,2]=4 1441 B7R0.10 CCC(Cl)C(=O)OC MCULE-4773486285 [0,1,0,0,0,0|0,0,0]=1 1442 B7R0.10 CCC(N)C(=O)NC MCULE-7274856339 [0,1,0,0,0,0|1,0,0]=2 1443 B7R0.10 CCC(N)C(=O)NC MCULE-9912780545 [0,1,0,0,0,0|1,0,0]=2 1444 B7R0.10 CCC(N)C(=O)NO MCULE-9162328479 [0,1,0,0,0,0|2,0,0]=3 1445 B7R0.10 CCC(N)C(=O)OC MCULE-1569242271 [0,1,0,0,0,0|0,0,0]=1 1446 B7R0.10 CCC(N)C(=O)OC MCULE-3183954116 [0,1,0,0,0,0|0,0,0]=1 1447 B7R0.10 CCC(N)C(=O)OC MCULE-4045754117 [0,1,0,0,0,0|0,0,0]=1 1448 B7R0.10 CCC(N)C(=O)OC MCULE-5328984047 [0,1,0,0,0,0|0,0,0]=1 1449 B7R0.10 CCC(N)C(O)CC MCULE-3578258801 [0,1,0,0,0,0|1,0,2]=4 1450 B7R0.10 CCC(O)C(=O)OC MCULE-8768500574 [0,1,0,0,0,0|0,0,0]=1 1451 B7R0.10 CCN(C)C(=O)CBr MCULE-4444194334 [0,1,0,0,0,0|3,0,0]=4 1452 B7R0.10 CCN(C)C(=O)CCl MCULE-7762522604 [0,1,0,0,0,0|3,0,0]=4 1453 B7R0.10 CCN(N)C(=S)NC MCULE-9798319933 [0,1,0,0,0,0|2,1,0]=4 1454 B7R0.10 CC[C@@H](Br)C(=O)OC MCULE-2676798410 [0,1,0,0,0,0|0,0,0]=1 1455 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6794991435 [0,1,0,0,0,0|0,0,0]=1 1456 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6825672331 [0,1,0,0,0,0|0,0,0]=1 1457 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-7307663817 [0,1,0,0,0,0|0,0,0]=1 1458 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-8717527808 [0,1,0,0,0,0|0,0,0]=1 1459 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-6916010003 [0,1,0,0,0,0|0,0,0]=1 1460 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-9376722018 [0,1,0,0,0,0|0,0,0]=1 1461 B7R0.10 CC[C@H](Br)C(=O)OC MCULE-5490793206 [0,1,0,0,0,0|0,0,0]=1 1462 B7R0.10 CC[C@H](N)C(=O)OC MCULE-2336816190 [0,1,0,0,0,0|0,0,0]=1 1463 B7R0.10 CC[C@H](N)C(=O)OC MCULE-3480066740 [0,1,0,0,0,0|0,0,0]=1 1464 B7R0.10 CC[C@H](N)C(=O)OC MCULE-4883083558 [0,1,0,0,0,0|0,0,0]=1 1465 B7R0.10 CC[C@H](N)C(=O)OC MCULE-6241184216 [0,1,0,0,0,0|0,0,0]=1 1466 B7R0.10 CC[C@H](O)C(=O)OC MCULE-5873092635 [0,1,0,0,0,0|0,0,0]=1 1467 B7R0.10 CC[C@H](O)C(=O)OC MCULE-8209874812 [0,1,0,0,0,0|0,0,0]=1 1468 B7R0.10 CNC(=O)C(=O)NC MCULE-5993874240 [0,1,0,0,0,0|2,0,1]=4 1469 B7R0.10 CNC(=O)C(=O)OC MCULE-1771479923 [0,1,0,0,0,0|1,0,1]=3 1470 B7R0.10 CNC(=O)C(C)CN MCULE-6853199259 [0,1,0,0,0,0|2,0,0]=3 1471 B7R0.10 CNC(=O)C(C)CN MCULE-9315732080 [0,1,0,0,0,0|2,0,0]=3 1472 B7R0.10 CNC(=O)C(C)NC MCULE-5788965533 [0,1,0,0,0,0|2,0,0]=3 1473 B7R0.10 CNC(=O)C(N)CO MCULE-1507161216 [0,1,0,0,0,0|2,0,0]=3 1474 B7R0.10 CNC(=O)C(O)CN MCULE-4650373222 [0,1,0,0,0,0|2,0,0]=3 1475 B7R0.10 CNC(=O)C(O)CN MCULE-8978952332 [0,1,0,0,0,0|2,0,0]=3 1476 B7R0.10 CNC(=O)[C@H](C)NC MCULE-4236618966 [0,1,0,0,0,0|2,0,0]=3 1477 B7R0.10 CNC(=O)[C@H](C)NC MCULE-9974564724 [0,1,0,0,0,0|2,0,0]=3 1478 B7R0.10 CNC(C)C(=O)OC MCULE-1524259113 [0,1,0,0,0,0|1,0,0]=2 1479 B7R0.10 CNC(C)C(=O)OC MCULE-2414146201 [0,1,0,0,0,0|1,0,0]=2 1480 B7R0.10 CNC(C)C(=O)OC MCULE-3192973771 [0,1,0,0,0,0|1,0,0]=2 1481 B7R0.10 CNC(C)C(=O)OC MCULE-9929257431 [0,1,0,0,0,0|1,0,0]=2 1482 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-1271745038 [0,1,0,0,0,0|1,0,0]=2 1483 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-3018199319 [0,1,0,0,0,0|1,0,0]=2 1484 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3420184809 [0,1,0,0,0,0|1,0,0]=2 1485 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3818454089 [0,1,0,0,0,0|1,0,0]=2 1486 B7R0.10 CN[C@H](C)C(=O)OC MCULE-8297775033 [0,1,0,0,0,0|1,0,0]=2 1487 B7R0.10 CN[C@H](C)C(=O)OC MCULE-9637759835 [0,1,0,0,0,0|1,0,0]=2 1488 B7R0.10 COC(=O)/C(=C/Br)/C MCULE-9213242172 [0,1,0,0,0,0|1,0,2]=4 1489 B7R0.10 COC(=O)/C(=C/Cl)/Cl MCULE-7181141754 [0,1,0,0,0,0|1,0,2]=4 1490 B7R0.10 COC(=O)/C(=C/[O-])/Cl MCULE-5795286951 [0,1,0,0,0,0|1,0,2]=4 1491 B7R0.10 COC(=O)/C(=C/[O-])/Cl MCULE-6102470934 [0,1,0,0,0,0|1,0,2]=4 1492 B7R0.10 COC(=O)/C(=N/O)/N MCULE-6279341489 [0,1,0,0,0,0|2,0,1]=4 1493 B7R0.10 COC(=O)C(=CBr)C MCULE-2452279572 [0,1,0,0,0,0|1,0,2]=4 1494 B7R0.10 COC(=O)C(=O)CBr MCULE-7596502094 [0,1,0,0,0,0|1,0,1]=3 1495 B7R0.10 COC(=O)C(=O)NN MCULE-7834741474 [0,1,0,0,0,0|2,0,1]=4 1496 B7R0.10 COC(=O)C(=O)OC MCULE-5018268642 [0,1,0,0,0,0|1,0,1]=3 1497 B7R0.10 COC(=O)C(Br)CBr MCULE-7056048789 [0,1,0,0,0,0|1,0,0]=2 1498 B7R0.10 COC(=O)C(Br)CF MCULE-4013908914 [0,1,0,0,0,0|1,0,0]=2 1499 B7R0.10 COC(=O)C(Br)CO MCULE-1678765423 [0,1,0,0,0,0|1,0,0]=2 1500 B7R0.10 COC(=O)C(Br)CO MCULE-8437488397 [0,1,0,0,0,0|1,0,0]=2 1501 B7R0.10 COC(=O)C(Br)OC MCULE-5672396067 [0,1,0,0,0,0|1,0,0]=2 1502 B7R0.10 COC(=O)C(C)C#N MCULE-3764857061 [0,1,0,0,0,0|1,0,1]=3 1503 B7R0.10 COC(=O)C(C)C=O MCULE-8461987901 [0,1,0,0,0,0|1,0,1]=3 1504 B7R0.10 COC(=O)C(C)CBr MCULE-5887558960 [0,1,0,0,0,0|1,0,0]=2 1505 B7R0.10 COC(=O)C(C)CBr MCULE-9291707503 [0,1,0,0,0,0|1,0,0]=2 1506 B7R0.10 COC(=O)C(C)CN MCULE-8139628698 [0,1,0,0,0,0|1,0,0]=2 1507 B7R0.10 COC(=O)C(C)CN MCULE-8839292519 [0,1,0,0,0,0|1,0,0]=2 1508 B7R0.10 COC(=O)C(C)CO MCULE-1168600238 [0,1,0,0,0,0|1,0,0]=2 1509 B7R0.10 COC(=O)C(C)CO MCULE-9207150786 [0,1,0,0,0,0|1,0,0]=2 1510 B7R0.10 COC(=O)C(C)CS MCULE-2870797526 [0,1,0,0,0,0|1,0,0]=2 1511 B7R0.10 COC(=O)C(C)OC MCULE-3274761391 [0,1,0,0,0,0|1,0,0]=2 1512 B7R0.10 COC(=O)C(C)ON MCULE-1829014190 [0,1,0,0,0,0|2,0,0]=3 1513 B7R0.10 COC(=O)C(C)ON MCULE-4104938309 [0,1,0,0,0,0|2,0,0]=3 1514 B7R0.10 COC(=O)C(C)SC MCULE-6914204626 [0,1,0,0,0,0|1,0,0]=2 1515 B7R0.10 COC(=O)C(Cl)C=O MCULE-1767241035 [0,1,0,0,0,0|1,0,1]=3 1516 B7R0.10 COC(=O)C(Cl)CCl MCULE-3086208783 [0,1,0,0,0,0|1,0,0]=2 1517 B7R0.10 COC(=O)C(Cl)CO MCULE-9496750776 [0,1,0,0,0,0|1,0,0]=2 1518 B7R0.10 COC(=O)C(Cl)OC MCULE-8296320773 [0,1,0,0,0,0|1,0,0]=2 1519 B7R0.10 COC(=O)C(F)CN MCULE-3089053107 [0,1,0,0,0,0|1,0,0]=2 1520 B7R0.10 COC(=O)C(F)CN MCULE-5618581260 [0,1,0,0,0,0|1,0,0]=2 1521 B7R0.10 COC(=O)C(F)CO MCULE-2188518229 [0,1,0,0,0,0|1,0,0]=2 1522 B7R0.10 COC(=O)C(N)C#N MCULE-9016686741 [0,1,0,0,0,0|1,0,1]=3 1523 B7R0.10 COC(=O)C(N)CCl MCULE-2253564316 [0,1,0,0,0,0|1,0,0]=2 1524 B7R0.10 COC(=O)C(N)CCl MCULE-3851909822 [0,1,0,0,0,0|1,0,0]=2 1525 B7R0.10 COC(=O)C(N)CCl MCULE-4649966066 [0,1,0,0,0,0|1,0,0]=2 1526 B7R0.10 COC(=O)C(N)CCl MCULE-9193407415 [0,1,0,0,0,0|1,0,0]=2 1527 B7R0.10 COC(=O)C(N)CF MCULE-2617218019 [0,1,0,0,0,0|1,0,0]=2 1528 B7R0.10 COC(=O)C(N)CF MCULE-3926207531 [0,1,0,0,0,0|1,0,0]=2 1529 B7R0.10 COC(=O)C(N)CN MCULE-7949926265 [0,1,0,0,0,0|1,0,0]=2 1530 B7R0.10 COC(=O)C(N)CN MCULE-9215212479 [0,1,0,0,0,0|1,0,0]=2 1531 B7R0.10 COC(=O)C(N)CO MCULE-1874204534 [0,1,0,0,0,0|1,0,0]=2 1532 B7R0.10 COC(=O)C(N)CO MCULE-1907797317 [0,1,0,0,0,0|1,0,0]=2 1533 B7R0.10 COC(=O)C(N)CO MCULE-3851022091 [0,1,0,0,0,0|1,0,0]=2 1534 B7R0.10 COC(=O)C(N)CO MCULE-9875856930 [0,1,0,0,0,0|1,0,0]=2 1535 B7R0.10 COC(=O)C(N)CS MCULE-5131519605 [0,1,0,0,0,0|1,0,0]=2 1536 B7R0.10 COC(=O)C(N)CS MCULE-5561205392 [0,1,0,0,0,0|1,0,0]=2 1537 B7R0.10 COC(=O)C(N)CS MCULE-9291008448 [0,1,0,0,0,0|1,0,0]=2 1538 B7R0.10 COC(=O)C(N)CS MCULE-9963292576 [0,1,0,0,0,0|1,0,0]=2 1539 B7R0.10 COC(=O)C(O)C#N MCULE-2296440580 [0,1,0,0,0,0|1,0,1]=3 1540 B7R0.10 COC(=O)C(O)CCl MCULE-1480405341 [0,1,0,0,0,0|1,0,0]=2 1541 B7R0.10 COC(=O)C(O)CN MCULE-1003241246 [0,1,0,0,0,0|1,0,0]=2 1542 B7R0.10 COC(=O)C(O)CN MCULE-9006804473 [0,1,0,0,0,0|1,0,0]=2 1543 B7R0.10 COC(=O)C(O)CO MCULE-1234820163 [0,1,0,0,0,0|1,0,0]=2 1544 B7R0.10 COC(=O)C(O)CO MCULE-2142801284 [0,1,0,0,0,0|1,0,0]=2 1545 B7R0.10 COC(=O)C(O)OC MCULE-5465190164 [0,1,0,0,0,0|1,0,0]=2 1546 B7R0.10 COC(=O)N(C)CCl MCULE-8717315487 [0,1,0,0,0,0|2,0,0]=3 1547 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8075978888 [0,1,0,0,0,0|1,0,0]=2 1548 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8903256620 [0,1,0,0,0,0|1,0,0]=2 1549 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-5530851181 [0,1,0,0,0,0|1,0,0]=2 1550 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-8885621324 [0,1,0,0,0,0|1,0,0]=2 1551 B7R0.10 COC(=O)[C@@H](C)CN MCULE-7205157481 [0,1,0,0,0,0|1,0,0]=2 1552 B7R0.10 COC(=O)[C@@H](C)CN MCULE-9885299909 [0,1,0,0,0,0|1,0,0]=2 1553 B7R0.10 COC(=O)[C@@H](C)CO MCULE-6738074317 [0,1,0,0,0,0|1,0,0]=2 1554 B7R0.10 COC(=O)[C@@H](C)CO MCULE-9697255968 [0,1,0,0,0,0|1,0,0]=2 1555 B7R0.10 COC(=O)[C@@H](F)CN MCULE-2209395189 [0,1,0,0,0,0|1,0,0]=2 1556 B7R0.10 COC(=O)[C@@H](F)CN MCULE-2951378763 [0,1,0,0,0,0|1,0,0]=2 1557 B7R0.10 COC(=O)[C@@H](F)CN MCULE-4599856185 [0,1,0,0,0,0|1,0,0]=2 1558 B7R0.10 COC(=O)[C@@H](F)CN MCULE-5571914049 [0,1,0,0,0,0|1,0,0]=2 1559 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-1649684135 [0,1,0,0,0,0|1,0,0]=2 1560 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-4803192908 [0,1,0,0,0,0|1,0,0]=2 1561 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-6514033613 [0,1,0,0,0,0|1,0,0]=2 1562 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-7997387565 [0,1,0,0,0,0|1,0,0]=2 1563 B7R0.10 COC(=O)[C@@H](N)CN MCULE-4407014418 [0,1,0,0,0,0|1,0,0]=2 1564 B7R0.10 COC(=O)[C@@H](N)CN MCULE-4854066134 [0,1,0,0,0,0|1,0,0]=2 1565 B7R0.10 COC(=O)[C@@H](N)CN MCULE-5060962890 [0,1,0,0,0,0|1,0,0]=2 1566 B7R0.10 COC(=O)[C@@H](N)CN MCULE-8572432694 [0,1,0,0,0,0|1,0,0]=2 1567 B7R0.10 COC(=O)[C@@H](N)CO MCULE-2171593224 [0,1,0,0,0,0|1,0,0]=2 1568 B7R0.10 COC(=O)[C@@H](N)CO MCULE-3393088985 [0,1,0,0,0,0|1,0,0]=2 1569 B7R0.10 COC(=O)[C@@H](N)CO MCULE-5476910845 [0,1,0,0,0,0|1,0,0]=2 1570 B7R0.10 COC(=O)[C@@H](N)CO MCULE-9984439264 [0,1,0,0,0,0|1,0,0]=2 1571 B7R0.10 COC(=O)[C@@H](N)CS MCULE-2560943261 [0,1,0,0,0,0|1,0,0]=2 1572 B7R0.10 COC(=O)[C@@H](N)CS MCULE-3682774490 [0,1,0,0,0,0|1,0,0]=2 1573 B7R0.10 COC(=O)[C@@H](N)CS MCULE-6613123984 [0,1,0,0,0,0|1,0,0]=2 1574 B7R0.10 COC(=O)[C@@H](N)CS MCULE-7354291938 [0,1,0,0,0,0|1,0,0]=2 1575 B7R0.10 COC(=O)[C@@H](O)CN MCULE-1265508864 [0,1,0,0,0,0|1,0,0]=2 1576 B7R0.10 COC(=O)[C@@H](O)CN MCULE-2334791448 [0,1,0,0,0,0|1,0,0]=2 1577 B7R0.10 COC(=O)[C@@H](O)CN MCULE-6207278824 [0,1,0,0,0,0|1,0,0]=2 1578 B7R0.10 COC(=O)[C@@H](O)CN MCULE-6634004594 [0,1,0,0,0,0|1,0,0]=2 1579 B7R0.10 COC(=O)[C@@H](O)CO MCULE-3655137528 [0,1,0,0,0,0|1,0,0]=2 1580 B7R0.10 COC(=O)[C@@H](O)CO MCULE-5801355812 [0,1,0,0,0,0|1,0,0]=2 1581 B7R0.10 COC(=O)[C@H](Br)CO MCULE-8230787734 [0,1,0,0,0,0|1,0,0]=2 1582 B7R0.10 COC(=O)[C@H](C)C=O MCULE-9841785503 [0,1,0,0,0,0|1,0,1]=3 1583 B7R0.10 COC(=O)[C@H](C)CBr MCULE-3829202918 [0,1,0,0,0,0|1,0,0]=2 1584 B7R0.10 COC(=O)[C@H](C)CBr MCULE-4931737781 [0,1,0,0,0,0|1,0,0]=2 1585 B7R0.10 COC(=O)[C@H](C)CN MCULE-4694019206 [0,1,0,0,0,0|1,0,0]=2 1586 B7R0.10 COC(=O)[C@H](C)CN MCULE-9113866081 [0,1,0,0,0,0|1,0,0]=2 1587 B7R0.10 COC(=O)[C@H](C)CO MCULE-5719676432 [0,1,0,0,0,0|1,0,0]=2 1588 B7R0.10 COC(=O)[C@H](C)CO MCULE-8479546806 [0,1,0,0,0,0|1,0,0]=2 1589 B7R0.10 COC(=O)[C@H](C)OC MCULE-3095326114 [0,1,0,0,0,0|1,0,0]=2 1590 B7R0.10 COC(=O)[C@H](N)CCl MCULE-1199425954 [0,1,0,0,0,0|1,0,0]=2 1591 B7R0.10 COC(=O)[C@H](N)CCl MCULE-2611523756 [0,1,0,0,0,0|1,0,0]=2 1592 B7R0.10 COC(=O)[C@H](N)CCl MCULE-6503487325 [0,1,0,0,0,0|1,0,0]=2 1593 B7R0.10 COC(=O)[C@H](N)CCl MCULE-8714444412 [0,1,0,0,0,0|1,0,0]=2 1594 B7R0.10 COC(=O)[C@H](N)CO MCULE-4463451892 [0,1,0,0,0,0|1,0,0]=2 1595 B7R0.10 COC(=O)[C@H](N)CO MCULE-5622938569 [0,1,0,0,0,0|1,0,0]=2 1596 B7R0.10 COC(=O)[C@H](N)CO MCULE-6021580541 [0,1,0,0,0,0|1,0,0]=2 1597 B7R0.10 COC(=O)[C@H](N)CO MCULE-8237708167 [0,1,0,0,0,0|1,0,0]=2 1598 B7R0.10 COC(=O)[C@H](N)CS MCULE-1845308816 [0,1,0,0,0,0|1,0,0]=2 1599 B7R0.10 COC(=O)[C@H](N)CS MCULE-3480554390 [0,1,0,0,0,0|1,0,0]=2 1600 B7R0.10 COC(=O)[C@H](N)CS MCULE-4432617084 [0,1,0,0,0,0|1,0,0]=2 1601 B7R0.10 COC(=O)[C@H](N)CS MCULE-5747217193 [0,1,0,0,0,0|1,0,0]=2 1602 B7R0.10 COC(=O)[C@H](O)CN MCULE-5902729244 [0,1,0,0,0,0|1,0,0]=2 1603 B7R0.10 COC(=O)[C@H](O)CN MCULE-9252373981 [0,1,0,0,0,0|1,0,0]=2 1604 B7R0.10 COC(=O)[C@H](O)CO MCULE-4219956218 [0,1,0,0,0,0|1,0,0]=2 1605 B7R0.10 COC(=O)[C@H](O)CO MCULE-8891571940 [0,1,0,0,0,0|1,0,0]=2 1606 B7R0.10 COC(C)C(=O)NN MCULE-7263059210 [0,1,0,0,0,0|3,0,0]=4 1607 B7R0.10 COC(Cl)C(Cl)OC MCULE-4404338670 [0,1,0,0,0,0|2,0,1]=4 1608 B7R0.10 NC(CCl)C(=O)NO MCULE-8256545065 [0,1,0,0,0,0|3,0,0]=4 1609 B7R0.10 NNC(=O)C(N)CO MCULE-3324075598 [0,1,0,0,0,0|3,0,0]=4 1610 B7R0.10 NNC(=O)C(N)CO MCULE-6651241883 [0,1,0,0,0,0|3,0,0]=4 1611 B7R0.10 NNC(=O)[C@@H](N)CS MCULE-9375468264 [0,1,0,0,0,0|3,0,0]=4 1612 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [0,1,0,0,0,0|3,0,0]=4 1613 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [0,1,0,0,0,0|3,0,0]=4 1614 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [0,1,0,0,0,0|3,0,0]=4 1615 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [0,1,0,0,0,0|3,0,0]=4 1616 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-1799930850 [0,1,0,0,0,0|1,0,0]=2 1617 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-5931188957 [0,1,0,0,0,0|1,0,0]=2 1618 B7R0.11 CCCC(C)(C)CC MCULE-6673337989 [0,1,0,0,0,0|2,0,1]=4 1619 B7R0.11 CCCC(C)(O)CC MCULE-9155096022 [0,1,0,0,0,0|1,0,2]=4 1620 B7R0.11 CCC[Si](C)(C)OC MCULE-9871586607 [0,1,0,0,0,0|1,1,0]=3 1621 B7R0.11 CCOS(=O)(=O)CC MCULE-8806858417 [0,1,0,0,0,0|3,0,0]=4 1622 B7R0.11 CCS(=O)(=O)CCBr MCULE-3576808746 [0,1,0,0,0,0|3,0,0]=4 1623 B7R0.11 CCS(=O)(=O)CCCl MCULE-4470053655 [0,1,0,0,0,0|3,0,0]=4 1624 B7R0.11 CCS(=O)(=O)CCN MCULE-6944259667 [0,1,0,0,0,0|3,0,0]=4 1625 B7R0.11 CCS(=O)(=O)CCN MCULE-8804123313 [0,1,0,0,0,0|3,0,0]=4 1626 B7R0.11 CCS(=O)(=O)CCO MCULE-1810929722 [0,1,0,0,0,0|3,0,0]=4 1627 B7R0.11 CCSS(=O)(=O)CC MCULE-6956455911 [0,1,0,0,0,0|3,0,0]=4 1628 B7R0.11 CN=S(=O)(C)CCN MCULE-5404036517 [0,1,0,0,0,0|3,0,0]=4 1629 B7R0.11 CN=S(=O)(C)CCN MCULE-5743557868 [0,1,0,0,0,0|3,0,0]=4 1630 B7R0.11 CNS(=O)(=O)CCBr MCULE-5061010018 [0,1,0,0,0,0|3,0,0]=4 1631 B7R0.11 CNS(=O)(=O)CCN MCULE-1982465814 [0,1,0,0,0,0|3,0,0]=4 1632 B7R0.11 CNS(=O)(=O)CCN MCULE-4756669449 [0,1,0,0,0,0|3,0,0]=4 1633 B7R0.11 COC(C)(C)CCBr MCULE-4991560289 [0,1,0,0,0,0|2,0,1]=4 1634 B7R0.11 COC(C)(C)CCN MCULE-7302419141 [0,1,0,0,0,0|2,0,1]=4 1635 B7R0.11 COC(C)(C)CCN MCULE-8717421395 [0,1,0,0,0,0|2,0,1]=4 1636 B7R0.11 COC(C)(C)CCO MCULE-4448949329 [0,1,0,0,0,0|2,0,1]=4 1637 B7R0.12 CCCC(C#N)NC MCULE-1865924335 [0,1,0,0,0,0|2,0,1]=4 1638 B7R0.12 CCCC(C#N)NC MCULE-4445984378 [0,1,0,0,0,0|2,0,1]=4 1639 B7R0.12 CCCC(C#N)OC MCULE-8004262029 [0,1,0,0,0,0|1,0,1]=3 1640 B7R0.12 CCCC(CN)OC MCULE-6456891707 [0,1,0,0,0,0|1,0,1]=3 1641 B7R0.12 CCCC(CO)OC MCULE-9427398002 [0,1,0,0,0,0|0,0,2]=3 1642 B7R0.12 CCCC(OC)OC MCULE-9755419351 [0,1,0,0,0,0|0,0,2]=3 1643 B7R0.12 CCCN(CC)CC MCULE-4397223277 [0,1,0,0,0,0|3,0,0]=4 1644 B7R0.12 CCN(CCO)N=O MCULE-3100234015 [0,1,0,0,0,0|3,0,0]=4 1645 B7R0.12 CNCC(OC)OC MCULE-4492281270 [0,1,0,0,0,0|1,0,2]=4 1646 B7R0.12 COC(C#N)CCN MCULE-5270955180 [0,1,0,0,0,0|2,0,1]=4 1647 B7R0.12 COC(CCBr)OC MCULE-4690008517 [0,1,0,0,0,0|1,0,2]=4 1648 B7R0.12 COC(CCCl)OC MCULE-1101836062 [0,1,0,0,0,0|1,0,2]=4 1649 B7R0.12 COC(CN)CCN MCULE-6044078562 [0,1,0,0,0,0|2,0,1]=4 1650 B7R0.12 COC(CO)CCN MCULE-1177905249 [0,1,0,0,0,0|1,0,2]=4 1651 B7R0.12 COC(CSC)OC MCULE-7367035915 [0,1,0,0,0,0|1,0,2]=4 1652 B7R0.12 COCC(C#N)OC MCULE-4608647789 [0,1,0,0,0,0|2,0,1]=4 1653 B7R0.12 COCC(CBr)OC MCULE-9551672317 [0,1,0,0,0,0|2,0,1]=4 1654 B7R0.12 COCC(CN)OC MCULE-4660699329 [0,1,0,0,0,0|2,0,1]=4 1655 B7R0.12 COCC(CO)OC MCULE-6775038884 [0,1,0,0,0,0|1,0,2]=4 1656 B7R0.12 COCC(OC)OC MCULE-1839791643 [0,1,0,0,0,0|1,0,2]=4 1657 B7R0.12 COC[C@@H](CO)OC MCULE-7098934437 [0,1,0,0,0,0|1,0,2]=4 1658 B7R0.12 COC[C@H](CN)OC MCULE-7911151873 [0,1,0,0,0,0|2,0,1]=4 1659 B7R1.1 BrCC1=CCCC1 MCULE-9208619526 [0,0,0,1,0,0|3,0,0]=4 1660 B7R1.1 C1(CCNC1)OC MCULE-4107032989 [0,0,0,1,0,0|2,0,1]=4 1661 B7R1.1 C1(CCNC1)OC MCULE-7879953493 [0,0,0,1,0,0|2,0,1]=4 1662 B7R1.1 CC=C1CCCC1 MCULE-9763131004 [0,0,0,1,0,0|2,0,0]=3 1663 B7R1.1 CC=C1CCNC1 MCULE-9077980338 [0,0,0,1,0,0|3,0,0]=4 1664 B7R1.1 CC=C1CCNC1 MCULE-9519724391 [0,0,0,1,0,0|3,0,0]=4 1665 B7R1.1 CCC1=CCCC1 MCULE-5154730597 [0,0,0,1,0,0|2,0,0]=3 1666 B7R1.1 CCC1=NCCN1 MCULE-4105881010 [0,0,0,1,0,0|3,0,0]=4 1667 B7R1.1 CCC1=NCCO1 MCULE-3838550511 [0,0,0,1,0,0|2,0,1]=4 1668 B7R1.1 CCC1CCCC1 MCULE-1974854934 [0,0,0,1,0,0|2,0,1]=4 1669 B7R1.1 CCC1CCCN1 MCULE-1775351089 [0,0,0,1,0,0|2,0,1]=4 1670 B7R1.1 CCC1CCCN1 MCULE-2065682250 [0,0,0,1,0,0|2,0,1]=4 1671 B7R1.1 CCC1CCCN1 MCULE-8326168982 [0,0,0,1,0,0|2,0,1]=4 1672 B7R1.1 CCC1CCCN1 MCULE-9831560442 [0,0,0,1,0,0|2,0,1]=4 1673 B7R1.1 CCN1CCCC1 MCULE-3590039255 [0,0,0,1,0,0|3,0,0]=4 1674 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [0,0,0,1,0,0|2,0,1]=4 1675 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [0,0,0,1,0,0|2,0,1]=4 1676 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [0,0,0,1,0,0|2,0,1]=4 1677 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [0,0,0,1,0,0|2,0,1]=4 1678 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [0,0,0,1,0,0|2,0,1]=4 1679 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [0,0,0,1,0,0|2,0,1]=4 1680 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [0,0,0,1,0,0|2,0,1]=4 1681 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [0,0,0,1,0,0|2,0,1]=4 1682 B7R1.1 CNC1=NCCN1 MCULE-8411755728 [0,0,0,1,0,0|3,0,0]=4 1683 B7R1.1 CNC1=NCCN1 MCULE-9337116685 [0,0,0,1,0,0|3,0,0]=4 1684 B7R1.1 CNC1CCCC1 MCULE-1391832163 [0,0,0,1,0,0|2,0,1]=4 1685 B7R1.1 CNC1CCCC1 MCULE-8242451793 [0,0,0,1,0,0|2,0,1]=4 1686 B7R1.1 COC1=CCCC1 MCULE-6260649761 [0,0,0,1,0,0|1,0,0]=2 1687 B7R1.1 COC1=CCCN1 MCULE-6283476666 [0,0,0,1,0,0|1,0,1]=3 1688 B7R1.1 COC1=NCCC1 MCULE-2625712954 [0,0,0,1,0,0|1,0,0]=2 1689 B7R1.1 COC1=NCCN1 MCULE-4640802770 [0,0,0,1,0,0|2,0,0]=3 1690 B7R1.1 COC1CCCC1 MCULE-7539347010 [0,0,0,1,0,0|1,0,1]=3 1691 B7R1.1 COC1CCCO1 MCULE-8363423240 [0,0,0,1,0,0|0,0,2]=3 1692 B7R1.1 COC1CCNC1 MCULE-1194889067 [0,0,0,1,0,0|2,0,1]=4 1693 B7R1.1 COC1CCNC1 MCULE-2551543855 [0,0,0,1,0,0|2,0,1]=4 1694 B7R1.1 COC1OCCO1 MCULE-9935127218 [0,0,0,1,0,0|1,0,2]=4 1695 B7R1.1 CO[C@@H]1CCNC1 MCULE-1457133388 [0,0,0,1,0,0|2,0,1]=4 1696 B7R1.1 CO[C@@H]1CCNC1 MCULE-5592053485 [0,0,0,1,0,0|2,0,1]=4 1697 B7R1.1 CO[C@@H]1CCNC1 MCULE-9586958523 [0,0,0,1,0,0|2,0,1]=4 1698 B7R1.1 CO[C@@H]1CCNC1 MCULE-9627985971 [0,0,0,1,0,0|2,0,1]=4 1699 B7R1.1 CO[C@H]1CCNC1 MCULE-4011037765 [0,0,0,1,0,0|2,0,1]=4 1700 B7R1.1 CO[C@H]1CCNC1 MCULE-6371005292 [0,0,0,1,0,0|2,0,1]=4 1701 B7R1.1 CO[C@H]1CCNC1 MCULE-6820243921 [0,0,0,1,0,0|2,0,1]=4 1702 B7R1.1 CO[C@H]1CCNC1 MCULE-9345557765 [0,0,0,1,0,0|2,0,1]=4 1703 B7R1.1 CSC1=NCCN1 MCULE-2508776031 [0,0,0,1,0,0|2,1,0]=4 1704 B7R1.1 CSC1=NCCN1 MCULE-3552473411 [0,0,0,1,0,0|2,1,0]=4 1705 B7R1.1 CSC1=NCCN1 MCULE-6313819915 [0,0,0,1,0,0|2,1,0]=4 1706 B7R1.1 CSC1=NCCS1 MCULE-1809491558 [0,0,0,1,0,0|1,2,0]=4 1707 B7R1.1 CSC1=NCCS1 MCULE-6651129000 [0,0,0,1,0,0|1,2,0]=4 1708 B7R1.1 N#CC1=CCCC1 MCULE-5654080085 [0,0,0,1,0,0|3,0,0]=4 1709 B7R1.1 NOC1CCCC1 MCULE-1504814106 [0,0,0,1,0,0|2,0,1]=4 1710 B7R1.1 NOC1CCCC1 MCULE-1973418119 [0,0,0,1,0,0|2,0,1]=4 1711 B7R1.1 O/N=C/1\CCCN1 MCULE-9494233692 [0,0,0,1,0,0|3,0,0]=4 1712 B7R1.1 O=CC1=CCCC1 MCULE-2270030217 [0,0,0,1,0,0|3,0,0]=4 1713 B7R1.1 OCC1=CCCC1 MCULE-8850570361 [0,0,0,1,0,0|3,0,0]=4 1714 B7R1.1 ON=C1CCCC1 MCULE-9338449832 [0,0,0,1,0,0|3,0,0]=4 1715 B7R1.2 C1(CNC(=O)C1)N MCULE-6663942203 [0,0,0,1,0,0|2,0,0]=3 1716 B7R1.2 C1(CNC(=O)C1)N MCULE-7862049809 [0,0,0,1,0,0|2,0,0]=3 1717 B7R1.2 C1(CNC(=O)C1)O MCULE-5557473335 [0,0,0,1,0,0|2,0,0]=3 1718 B7R1.2 C1(COC(=O)N1)C MCULE-2821940224 [0,0,0,1,0,0|1,0,0]=2 1719 B7R1.2 CC1=CC(=O)CC1 MCULE-5496838191 [0,0,0,1,0,0|1,0,2]=4 1720 B7R1.2 CC1=CC(=O)OC1 MCULE-6549202383 [0,0,0,1,0,0|0,0,2]=3 1721 B7R1.2 CC1=NC(CC1)C MCULE-9630685459 [0,0,0,1,0,0|3,0,0]=4 1722 B7R1.2 CC1=NC(CO1)C MCULE-2489340707 [0,0,0,1,0,0|2,0,0]=3 1723 B7R1.2 CC1=NC(CS1)C MCULE-8843957654 [0,0,0,1,0,0|2,1,0]=4 1724 B7R1.2 CC1=NNC(=O)C1 MCULE-2406140611 [0,0,0,1,0,0|2,0,1]=4 1725 B7R1.2 CC1=NOC(=O)C1 MCULE-2665741338 [0,0,0,1,0,0|1,0,1]=3 1726 B7R1.2 CC1=NOC(=O)C1 MCULE-3084424307 [0,0,0,1,0,0|1,0,1]=3 1727 B7R1.2 CC1=NOC(=O)O1 MCULE-5416417255 [0,0,0,1,0,0|2,0,1]=4 1728 B7R1.2 CC1C=CC(=O)O1 MCULE-7172637771 [0,0,0,1,0,0|2,0,1]=4 1729 B7R1.2 CC1CC(=NO1)N MCULE-8353889650 [0,0,0,1,0,0|3,0,0]=4 1730 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [0,0,0,1,0,0|2,0,0]=3 1731 B7R1.2 CC1CC(=O)CS1 MCULE-7518365363 [0,0,0,1,0,0|2,0,0]=3 1732 B7R1.2 CC1CC(=O)NN1 MCULE-2056748401 [0,0,0,1,0,0|2,0,0]=3 1733 B7R1.2 CC1CC(=O)NN1 MCULE-8107476665 [0,0,0,1,0,0|2,0,0]=3 1734 B7R1.2 CC1CC(CO1)N MCULE-5031195609 [0,0,0,1,0,0|2,0,1]=4 1735 B7R1.2 CC1CC(CO1)N MCULE-6627149239 [0,0,0,1,0,0|2,0,1]=4 1736 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [0,0,0,1,0,0|2,0,1]=4 1737 B7R1.2 CC1CCC(=N1)N MCULE-3470792627 [0,0,0,1,0,0|3,0,0]=4 1738 B7R1.2 CC1CCC(=N1)N MCULE-7952001291 [0,0,0,1,0,0|3,0,0]=4 1739 B7R1.2 CC1CCC(=O)C1 MCULE-6716533429 [0,0,0,1,0,0|1,0,0]=2 1740 B7R1.2 CC1CCC(=O)N1 MCULE-8928464449 [0,0,0,1,0,0|2,0,0]=3 1741 B7R1.2 CC1CCC(=O)N1 MCULE-9236321365 [0,0,0,1,0,0|2,0,0]=3 1742 B7R1.2 CC1CCC(=O)O1 MCULE-3014789527 [0,0,0,1,0,0|2,0,0]=3 1743 B7R1.2 CC1CCC(C1)Br MCULE-3834311364 [0,0,0,1,0,0|2,0,1]=4 1744 B7R1.2 CC1CCC(C1)Cl MCULE-7669391571 [0,0,0,1,0,0|2,0,1]=4 1745 B7R1.2 CC1CCC(C1)N MCULE-3681457592 [0,0,0,1,0,0|2,0,1]=4 1746 B7R1.2 CC1CCC(C1)N MCULE-8238390084 [0,0,0,1,0,0|2,0,1]=4 1747 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [0,0,0,1,0,0|1,0,2]=4 1748 B7R1.2 CC1CN=C(O1)N MCULE-2936787754 [0,0,0,1,0,0|3,0,0]=4 1749 B7R1.2 CC1CN=C(O1)N MCULE-5542499755 [0,0,0,1,0,0|3,0,0]=4 1750 B7R1.2 CC1CN=C(S1)N MCULE-5641549444 [0,0,0,1,0,0|3,0,0]=4 1751 B7R1.2 CC1CN=C(S1)N MCULE-9229369376 [0,0,0,1,0,0|3,0,0]=4 1752 B7R1.2 CC1CNC(=O)C1 MCULE-7180589009 [0,0,0,1,0,0|1,0,0]=2 1753 B7R1.2 CC1CNC(=O)N1 MCULE-3789430210 [0,0,0,1,0,0|2,0,0]=3 1754 B7R1.2 CC1CNC(=O)O1 MCULE-1288358267 [0,0,0,1,0,0|2,0,0]=3 1755 B7R1.2 CC1CNC(=S)N1 MCULE-5305006156 [0,0,0,1,0,0|2,1,0]=4 1756 B7R1.2 CC1CNC(=S)S1 MCULE-1131079445 [0,0,0,1,0,0|2,1,0]=4 1757 B7R1.2 CC1CNC(C1)C MCULE-3051496448 [0,0,0,1,0,0|2,0,1]=4 1758 B7R1.2 CC1CNC(C1)C MCULE-9324057254 [0,0,0,1,0,0|2,0,1]=4 1759 B7R1.2 CC1COC(=O)C1 MCULE-7226555218 [0,0,0,1,0,0|0,0,0]=1 1760 B7R1.2 CC1COC(=O)N1 MCULE-5787960105 [0,0,0,1,0,0|1,0,0]=2 1761 B7R1.2 CC1COC(=O)O1 MCULE-9055336051 [0,0,0,1,0,0|1,0,0]=2 1762 B7R1.2 CC1COC(=S)N1 MCULE-4793665300 [0,0,0,1,0,0|1,1,0]=3 1763 B7R1.2 CC1COC(O1)C MCULE-5670718739 [0,0,0,1,0,0|2,0,1]=4 1764 B7R1.2 CC1COS(=O)O1 MCULE-7795249539 [0,0,0,1,0,0|2,0,0]=3 1765 B7R1.2 CC1CSC(=O)S1 MCULE-5074098161 [0,0,0,1,0,0|1,1,0]=3 1766 B7R1.2 CC1CSC(=S)N1 MCULE-9334196132 [0,0,0,1,0,0|1,2,0]=4 1767 B7R1.2 CC1NCC(=O)N1 MCULE-9790180398 [0,0,0,1,0,0|3,0,0]=4 1768 B7R1.2 CN1CCC(=O)C1 MCULE-4017029823 [0,0,0,1,0,0|2,0,0]=3 1769 B7R1.2 CN1CCC(=O)C1 MCULE-8684002131 [0,0,0,1,0,0|2,0,0]=3 1770 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-1621276410 [0,0,0,1,0,0|2,0,0]=3 1771 B7R1.2 C[C@@H]1CC(=O)CN1 MCULE-8721208019 [0,0,0,1,0,0|2,0,0]=3 1772 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-2915942259 [0,0,0,1,0,0|2,0,0]=3 1773 B7R1.2 C[C@@H]1CCC(=O)N1 MCULE-8123247569 [0,0,0,1,0,0|2,0,0]=3 1774 B7R1.2 C[C@@H]1CCC(=O)O1 MCULE-5934008113 [0,0,0,1,0,0|2,0,0]=3 1775 B7R1.2 C[C@@H]1CC[C@@H](C1)N MCULE-9471729241 [0,0,0,1,0,0|2,0,1]=4 1776 B7R1.2 C[C@@H]1CC[C@H](C1)N MCULE-5368765184 [0,0,0,1,0,0|2,0,1]=4 1777 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-2439559922 [0,0,0,1,0,0|1,0,0]=2 1778 B7R1.2 C[C@@H]1CNC(=O)C1 MCULE-7246323100 [0,0,0,1,0,0|1,0,0]=2 1779 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-8336717940 [0,0,0,1,0,0|2,0,0]=3 1780 B7R1.2 C[C@@H]1CNC(=O)O1 MCULE-9661080313 [0,0,0,1,0,0|2,0,0]=3 1781 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1121808555 [0,0,0,1,0,0|0,0,0]=1 1782 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1627827491 [0,0,0,1,0,0|0,0,0]=1 1783 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-2439588002 [0,0,0,1,0,0|1,0,0]=2 1784 B7R1.2 C[C@@H]1COC(=O)N1 MCULE-5329850427 [0,0,0,1,0,0|1,0,0]=2 1785 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-3187800510 [0,0,0,1,0,0|1,0,0]=2 1786 B7R1.2 C[C@@H]1COC(=O)O1 MCULE-6719271655 [0,0,0,1,0,0|1,0,0]=2 1787 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-3272300487 [0,0,0,1,0,0|2,0,0]=3 1788 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-4583858198 [0,0,0,1,0,0|2,0,0]=3 1789 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-5135895304 [0,0,0,1,0,0|2,0,0]=3 1790 B7R1.2 C[C@H]1CC(=O)CN1 MCULE-6058896534 [0,0,0,1,0,0|2,0,0]=3 1791 B7R1.2 C[C@H]1CCC(=O)C1 MCULE-7319626625 [0,0,0,1,0,0|1,0,0]=2 1792 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-2618122031 [0,0,0,1,0,0|2,0,0]=3 1793 B7R1.2 C[C@H]1CCC(=O)N1 MCULE-6630066118 [0,0,0,1,0,0|2,0,0]=3 1794 B7R1.2 C[C@H]1CCC(=O)O1 MCULE-5274272771 [0,0,0,1,0,0|2,0,0]=3 1795 B7R1.2 C[C@H]1CC[C@@H](C1)N MCULE-1080493056 [0,0,0,1,0,0|2,0,1]=4 1796 B7R1.2 C[C@H]1CC[C@H](C1)C MCULE-8059507758 [0,0,0,1,0,0|2,0,1]=4 1797 B7R1.2 C[C@H]1CC[C@H](C1)N MCULE-7070775136 [0,0,0,1,0,0|2,0,1]=4 1798 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-3395896178 [0,0,0,1,0,0|1,0,0]=2 1799 B7R1.2 C[C@H]1CNC(=O)C1 MCULE-8492971593 [0,0,0,1,0,0|1,0,0]=2 1800 B7R1.2 C[C@H]1COC(=O)C1 MCULE-6050720348 [0,0,0,1,0,0|0,0,0]=1 1801 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7240884474 [0,0,0,1,0,0|1,0,0]=2 1802 B7R1.2 C[C@H]1COC(=O)N1 MCULE-7811823319 [0,0,0,1,0,0|1,0,0]=2 1803 B7R1.2 C[C@H]1COC(=O)O1 MCULE-2416711374 [0,0,0,1,0,0|1,0,0]=2 1804 B7R1.2 C[C@H]1COC(=O)O1 MCULE-4223856214 [0,0,0,1,0,0|1,0,0]=2 1805 B7R1.2 C[C@H]1CSC(=S)N1 MCULE-6690407523 [0,0,0,1,0,0|1,2,0]=4 1806 B7R1.2 NC1CCC(=O)C1 MCULE-5102535286 [0,0,0,1,0,0|2,0,0]=3 1807 B7R1.2 NC1CCC(=O)C1 MCULE-7722818264 [0,0,0,1,0,0|2,0,0]=3 1808 B7R1.2 NC1CCC(=O)N1 MCULE-1843033026 [0,0,0,1,0,0|3,0,0]=4 1809 B7R1.2 NC1CCC(=O)N1 MCULE-7671057220 [0,0,0,1,0,0|3,0,0]=4 1810 B7R1.2 NC1CCS(=O)C1 MCULE-7416029311 [0,0,0,1,0,0|3,0,0]=4 1811 B7R1.2 NC1CCS(=O)C1 MCULE-8914660363 [0,0,0,1,0,0|3,0,0]=4 1812 B7R1.2 NC1CNC(=O)C1 MCULE-1690074091 [0,0,0,1,0,0|2,0,0]=3 1813 B7R1.2 NC1CNC(=O)C1 MCULE-2563813057 [0,0,0,1,0,0|2,0,0]=3 1814 B7R1.2 NC1CNC(=O)C1 MCULE-5332234739 [0,0,0,1,0,0|2,0,0]=3 1815 B7R1.2 NC1CNC(=O)C1 MCULE-9955937074 [0,0,0,1,0,0|2,0,0]=3 1816 B7R1.2 NC1COC(=O)C1 MCULE-1027386953 [0,0,0,1,0,0|1,0,0]=2 1817 B7R1.2 NC1COC(=O)C1 MCULE-1493825051 [0,0,0,1,0,0|1,0,0]=2 1818 B7R1.2 NC1COC(=O)C1 MCULE-3118610284 [0,0,0,1,0,0|1,0,0]=2 1819 B7R1.2 NC1COC(=O)C1 MCULE-8194840985 [0,0,0,1,0,0|1,0,0]=2 1820 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-1502944618 [0,0,0,1,0,0|2,0,0]=3 1821 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-2444469131 [0,0,0,1,0,0|2,0,0]=3 1822 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-7277309874 [0,0,0,1,0,0|2,0,0]=3 1823 B7R1.2 N[C@@H]1CNC(=O)C1 MCULE-8533160250 [0,0,0,1,0,0|2,0,0]=3 1824 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-2437548952 [0,0,0,1,0,0|1,0,0]=2 1825 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4215135536 [0,0,0,1,0,0|1,0,0]=2 1826 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-4884145743 [0,0,0,1,0,0|1,0,0]=2 1827 B7R1.2 N[C@@H]1COC(=O)C1 MCULE-9276068415 [0,0,0,1,0,0|1,0,0]=2 1828 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-1884894725 [0,0,0,1,0,0|2,0,0]=3 1829 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-2130809002 [0,0,0,1,0,0|2,0,0]=3 1830 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-3881338264 [0,0,0,1,0,0|2,0,0]=3 1831 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-4324375667 [0,0,0,1,0,0|2,0,0]=3 1832 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-5900761307 [0,0,0,1,0,0|2,0,0]=3 1833 B7R1.2 N[C@H]1CNC(=O)C1 MCULE-6007209179 [0,0,0,1,0,0|2,0,0]=3 1834 B7R1.2 N[C@H]1COC(=O)C1 MCULE-2936782126 [0,0,0,1,0,0|1,0,0]=2 1835 B7R1.2 N[C@H]1COC(=O)C1 MCULE-4255876921 [0,0,0,1,0,0|1,0,0]=2 1836 B7R1.2 N[C@H]1COC(=O)C1 MCULE-5377151477 [0,0,0,1,0,0|1,0,0]=2 1837 B7R1.2 N[C@H]1COC(=O)C1 MCULE-6406960509 [0,0,0,1,0,0|1,0,0]=2 1838 B7R1.2 O=C1C=C(CO1)Br MCULE-8883097432 [0,0,0,1,0,0|1,0,2]=4 1839 B7R1.2 O=C1C=C(CO1)O MCULE-5095558101 [0,0,0,1,0,0|1,0,2]=4 1840 B7R1.2 O=C1C=CC(C1)O MCULE-6464451546 [0,0,0,1,0,0|2,0,1]=4 1841 B7R1.2 O=C1C=C[C@@H](C1)O MCULE-4535052390 [0,0,0,1,0,0|2,0,1]=4 1842 B7R1.2 O=C1C=C[C@H](C1)O MCULE-9347047598 [0,0,0,1,0,0|2,0,1]=4 1843 B7R1.2 O=C1CC(=CO1)O MCULE-3691688750 [0,0,0,1,0,0|1,0,2]=4 1844 B7R1.2 O=C1CC(CN1)O MCULE-8498039777 [0,0,0,1,0,0|2,0,0]=3 1845 B7R1.2 O=C1CC(CN1)S MCULE-3257609096 [0,0,0,1,0,0|2,0,0]=3 1846 B7R1.2 O=C1CC(CO1)O MCULE-3779919332 [0,0,0,1,0,0|1,0,0]=2 1847 B7R1.2 O=C1CC(CO1)O MCULE-5609071664 [0,0,0,1,0,0|1,0,0]=2 1848 B7R1.2 O=C1CCC(=O)C1 MCULE-6436831689 [0,0,0,1,0,0|2,0,1]=4 1849 B7R1.2 O=C1CCC(C1)F MCULE-9585894610 [0,0,0,1,0,0|2,0,0]=3 1850 B7R1.2 O=C1CCC(C1)I MCULE-5558007377 [0,0,0,1,0,0|2,0,0]=3 1851 B7R1.2 O=C1CCC(C1)O MCULE-8500536547 [0,0,0,1,0,0|2,0,0]=3 1852 B7R1.2 O=C1CCC(N1)O MCULE-1790956080 [0,0,0,1,0,0|3,0,0]=4 1853 B7R1.2 O=C1CCC(O1)F MCULE-6874239017 [0,0,0,1,0,0|3,0,0]=4 1854 B7R1.2 O=C1CCC(O1)O MCULE-5296344468 [0,0,0,1,0,0|3,0,0]=4 1855 B7R1.2 O=C1CNC(=O)C1 MCULE-6981924013 [0,0,0,1,0,0|2,0,1]=4 1856 B7R1.2 O=C1COC(=O)C1 MCULE-3258090872 [0,0,0,1,0,0|1,0,1]=3 1857 B7R1.2 O=C1COC(=O)N1 MCULE-3103815953 [0,0,0,1,0,0|2,0,1]=4 1858 B7R1.2 O=C1COC(=O)[N-]1 MCULE-2786348217 [0,0,0,1,0,0|2,0,1]=4 1859 B7R1.2 O=C1C[C@@H](CN1)O MCULE-2016792324 [0,0,0,1,0,0|2,0,0]=3 1860 B7R1.2 O=C1C[C@@H](CN1)O MCULE-9756194758 [0,0,0,1,0,0|2,0,0]=3 1861 B7R1.2 O=C1C[C@@H](CO1)O MCULE-1467506377 [0,0,0,1,0,0|1,0,0]=2 1862 B7R1.2 O=C1C[C@@H](CO1)O MCULE-3668466479 [0,0,0,1,0,0|1,0,0]=2 1863 B7R1.2 O=C1C[C@H](CN1)O MCULE-2017150152 [0,0,0,1,0,0|2,0,0]=3 1864 B7R1.2 O=C1C[C@H](CN1)O MCULE-5168961542 [0,0,0,1,0,0|2,0,0]=3 1865 B7R1.2 O=C1C[C@H](CN1)S MCULE-6980612759 [0,0,0,1,0,0|2,0,0]=3 1866 B7R1.2 O=C1C[C@H](CN1)S MCULE-7205538285 [0,0,0,1,0,0|2,0,0]=3 1867 B7R1.2 O=C1C[C@H](CO1)O MCULE-5756899897 [0,0,0,1,0,0|1,0,0]=2 1868 B7R1.2 O=C1C[C@H](CO1)O MCULE-6247095672 [0,0,0,1,0,0|1,0,0]=2 1869 B7R1.2 O=C1OCC(O1)Cl MCULE-4046020713 [0,0,0,1,0,0|2,0,0]=3 1870 B7R1.2 O=C1OCC(O1)F MCULE-7198712298 [0,0,0,1,0,0|2,0,0]=3 1871 B7R1.2 [C@H]1(CCC(=O)C1)C MCULE-3827565169 [0,0,0,1,0,0|1,0,0]=2 1872 B7R1.3 BrC1=CCCCC1 MCULE-6137796305 [0,0,0,1,0,0|2,0,0]=3 1873 B7R1.3 BrC1=CCCNC1 MCULE-1016336040 [0,0,0,1,0,0|3,0,0]=4 1874 B7R1.3 BrC1=CCCNC1 MCULE-9845052592 [0,0,0,1,0,0|3,0,0]=4 1875 B7R1.3 BrC1=CCOCC1 MCULE-7609274912 [0,0,0,1,0,0|3,0,0]=4 1876 B7R1.3 BrC1=CCSCC1 MCULE-6964400494 [0,0,0,1,0,0|3,0,0]=4 1877 B7R1.3 BrC1=COCCC1 MCULE-7754503978 [0,0,0,1,0,0|3,0,0]=4 1878 B7R1.3 BrC1CCCCC1 MCULE-7879113781 [0,0,0,1,0,0|2,0,1]=4 1879 B7R1.3 BrC1CCCCN1 MCULE-3863852230 [0,0,0,1,0,0|2,0,1]=4 1880 B7R1.3 BrC1CCCCO1 MCULE-3659439382 [0,0,0,1,0,0|1,0,1]=3 1881 B7R1.3 C1(CNCCO1)C MCULE-2805380245 [0,0,0,1,0,0|2,0,1]=4 1882 B7R1.3 C1(CNCCO1)C MCULE-3532041523 [0,0,0,1,0,0|2,0,1]=4 1883 B7R1.3 C=C1CCCCC1 MCULE-9812236661 [0,0,0,1,0,0|2,0,0]=3 1884 B7R1.3 C=C1CCCCN1 MCULE-8375354748 [0,0,0,1,0,0|2,0,0]=3 1885 B7R1.3 C=C1CCCNC1 MCULE-2588575300 [0,0,0,1,0,0|3,0,0]=4 1886 B7R1.3 C=C1CCCNC1 MCULE-9758065019 [0,0,0,1,0,0|3,0,0]=4 1887 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [0,0,0,1,0,0|3,0,0]=4 1888 B7R1.3 C=C1CCNCC1 MCULE-4460895436 [0,0,0,1,0,0|3,0,0]=4 1889 B7R1.3 C=C1CCNCC1 MCULE-6605411269 [0,0,0,1,0,0|3,0,0]=4 1890 B7R1.3 C=C1CCNCC1 MCULE-6729798105 [0,0,0,1,0,0|3,0,0]=4 1891 B7R1.3 C=C1CCOCC1 MCULE-2744722311 [0,0,0,1,0,0|3,0,0]=4 1892 B7R1.3 CB1OCCCO1 MCULE-5692862103 [0,0,0,1,0,0|3,0,0]=4 1893 B7R1.3 CC1=CCCCC1 MCULE-2795172496 [0,0,0,1,0,0|2,0,0]=3 1894 B7R1.3 CC1=CCCNC1 MCULE-8145216779 [0,0,0,1,0,0|3,0,0]=4 1895 B7R1.3 CC1=CCCNC1 MCULE-9021954061 [0,0,0,1,0,0|3,0,0]=4 1896 B7R1.3 CC1=CCNCC1 MCULE-1503915992 [0,0,0,1,0,0|3,0,0]=4 1897 B7R1.3 CC1=CCNCC1 MCULE-3349815065 [0,0,0,1,0,0|3,0,0]=4 1898 B7R1.3 CC1=NCCNC1 MCULE-2066788449 [0,0,0,1,0,0|3,0,0]=4 1899 B7R1.3 CC1CCCCC1 MCULE-3843525768 [0,0,0,1,0,0|2,0,1]=4 1900 B7R1.3 CC1CCCCN1 MCULE-1741870990 [0,0,0,1,0,0|2,0,1]=4 1901 B7R1.3 CC1CCCCN1 MCULE-4453126703 [0,0,0,1,0,0|2,0,1]=4 1902 B7R1.3 CC1CCCCN1 MCULE-6620063962 [0,0,0,1,0,0|2,0,1]=4 1903 B7R1.3 CC1CCCCN1 MCULE-6838766744 [0,0,0,1,0,0|2,0,1]=4 1904 B7R1.3 CC1CCCCN1 MCULE-9227931620 [0,0,0,1,0,0|2,0,1]=4 1905 B7R1.3 CC1CCCCO1 MCULE-4439683294 [0,0,0,1,0,0|1,0,1]=3 1906 B7R1.3 CC1CCOCO1 MCULE-5013590651 [0,0,0,1,0,0|2,0,1]=4 1907 B7R1.3 CC1CNCCO1 MCULE-3071497485 [0,0,0,1,0,0|2,0,1]=4 1908 B7R1.3 CC1CNCCO1 MCULE-7956728736 [0,0,0,1,0,0|2,0,1]=4 1909 B7R1.3 CC1NCCCO1 MCULE-2236660860 [0,0,0,1,0,0|2,0,1]=4 1910 B7R1.3 CN1CCCCC1 MCULE-3308944277 [0,0,0,1,0,0|3,0,0]=4 1911 B7R1.3 CN1CCCCO1 MCULE-4407617276 [0,0,0,1,0,0|2,0,0]=3 1912 B7R1.3 CN1CCCCO1 MCULE-6297284655 [0,0,0,1,0,0|2,0,0]=3 1913 B7R1.3 C[C@@H]1CCCCN1 MCULE-1372285636 [0,0,0,1,0,0|2,0,1]=4 1914 B7R1.3 C[C@@H]1CCCCN1 MCULE-1676908545 [0,0,0,1,0,0|2,0,1]=4 1915 B7R1.3 C[C@@H]1CCCCN1 MCULE-4298634468 [0,0,0,1,0,0|2,0,1]=4 1916 B7R1.3 C[C@@H]1CCCCN1 MCULE-6629826210 [0,0,0,1,0,0|2,0,1]=4 1917 B7R1.3 C[C@@H]1CNCCO1 MCULE-1787977539 [0,0,0,1,0,0|2,0,1]=4 1918 B7R1.3 C[C@@H]1CNCCO1 MCULE-2608004746 [0,0,0,1,0,0|2,0,1]=4 1919 B7R1.3 C[C@@H]1CNCCO1 MCULE-5447097956 [0,0,0,1,0,0|2,0,1]=4 1920 B7R1.3 C[C@@H]1CNCCO1 MCULE-9396954187 [0,0,0,1,0,0|2,0,1]=4 1921 B7R1.3 C[C@H]1CCCCN1 MCULE-3586455704 [0,0,0,1,0,0|2,0,1]=4 1922 B7R1.3 C[C@H]1CCCCN1 MCULE-5638638213 [0,0,0,1,0,0|2,0,1]=4 1923 B7R1.3 C[C@H]1CCCCN1 MCULE-5867717461 [0,0,0,1,0,0|2,0,1]=4 1924 B7R1.3 C[C@H]1CCCCN1 MCULE-7106826493 [0,0,0,1,0,0|2,0,1]=4 1925 B7R1.3 C[C@H]1CNCCO1 MCULE-3158147539 [0,0,0,1,0,0|2,0,1]=4 1926 B7R1.3 C[C@H]1CNCCO1 MCULE-5193705878 [0,0,0,1,0,0|2,0,1]=4 1927 B7R1.3 C[C@H]1CNCCO1 MCULE-8337677707 [0,0,0,1,0,0|2,0,1]=4 1928 B7R1.3 C[C@H]1CNCCO1 MCULE-9425432414 [0,0,0,1,0,0|2,0,1]=4 1929 B7R1.3 ClC1=CCCCC1 MCULE-6882712527 [0,0,0,1,0,0|2,0,0]=3 1930 B7R1.3 ClC1=CCCNC1 MCULE-2132976242 [0,0,0,1,0,0|3,0,0]=4 1931 B7R1.3 ClC1=CCCNC1 MCULE-9013141821 [0,0,0,1,0,0|3,0,0]=4 1932 B7R1.3 ClC1CCCCC1 MCULE-9519865350 [0,0,0,1,0,0|2,0,1]=4 1933 B7R1.3 ClC1CCCCO1 MCULE-3251653488 [0,0,0,1,0,0|1,0,1]=3 1934 B7R1.3 FC1=CCCNC1 MCULE-5131057553 [0,0,0,1,0,0|3,0,0]=4 1935 B7R1.3 FC1=CCCNC1 MCULE-8459145085 [0,0,0,1,0,0|3,0,0]=4 1936 B7R1.3 FC1=CCNCC1 MCULE-5573410633 [0,0,0,1,0,0|3,0,0]=4 1937 B7R1.3 FC1=CCNCC1 MCULE-9755070929 [0,0,0,1,0,0|3,0,0]=4 1938 B7R1.3 FC1CCCCC1 MCULE-4555555520 [0,0,0,1,0,0|2,0,1]=4 1939 B7R1.3 FC1CCCCO1 MCULE-8724227177 [0,0,0,1,0,0|1,0,1]=3 1940 B7R1.3 IC1CCCCC1 MCULE-4499971048 [0,0,0,1,0,0|2,0,1]=4 1941 B7R1.3 N=C1NCCCO1 MCULE-4713912893 [0,0,0,1,0,0|2,0,0]=3 1942 B7R1.3 N=C1NCCCS1 MCULE-5425383221 [0,0,0,1,0,0|2,1,0]=4 1943 B7R1.3 NC1=NCCCC1 MCULE-1020722938 [0,0,0,1,0,0|2,0,0]=3 1944 B7R1.3 NC1=NCCCC1 MCULE-9735306041 [0,0,0,1,0,0|2,0,0]=3 1945 B7R1.3 NC1=NCCCN1 MCULE-1407334516 [0,0,0,1,0,0|3,0,0]=4 1946 B7R1.3 NC1=NCCCN1 MCULE-1674112662 [0,0,0,1,0,0|3,0,0]=4 1947 B7R1.3 NC1=NCCCO1 MCULE-1909217779 [0,0,0,1,0,0|2,0,0]=3 1948 B7R1.3 NC1=NCCCS1 MCULE-2157831645 [0,0,0,1,0,0|2,1,0]=4 1949 B7R1.3 NC1=NCCCS1 MCULE-7522126566 [0,0,0,1,0,0|2,1,0]=4 1950 B7R1.3 NC1=NCCSC1 MCULE-4272591822 [0,0,0,1,0,0|3,0,0]=4 1951 B7R1.3 NC1CCCCC1 MCULE-1274688385 [0,0,0,1,0,0|2,0,1]=4 1952 B7R1.3 NC1CCCCC1 MCULE-6218418825 [0,0,0,1,0,0|2,0,1]=4 1953 B7R1.3 NC1CCCCC1 MCULE-7654331405 [0,0,0,1,0,0|2,0,1]=4 1954 B7R1.3 NC1CCCCC1 MCULE-9211684304 [0,0,0,1,0,0|2,0,1]=4 1955 B7R1.3 NC1CCCCN1 MCULE-8429969520 [0,0,0,1,0,0|2,0,1]=4 1956 B7R1.3 NN1CCCCC1 MCULE-2078041523 [0,0,0,1,0,0|3,0,0]=4 1957 B7R1.3 NN1CCCCC1 MCULE-3853977450 [0,0,0,1,0,0|3,0,0]=4 1958 B7R1.3 O=C1C=CCCC1 MCULE-5207755083 [0,0,0,1,0,0|1,0,1]=3 1959 B7R1.3 O=C1C=CCCN1 MCULE-9815380990 [0,0,0,1,0,0|1,0,2]=4 1960 B7R1.3 O=C1C=CCCO1 MCULE-2962791770 [0,0,0,1,0,0|0,0,2]=3 1961 B7R1.3 O=C1C=CCOC1 MCULE-4817981961 [0,0,0,1,0,0|2,0,1]=4 1962 B7R1.3 O=C1C=COCC1 MCULE-2954829305 [0,0,0,1,0,0|2,0,1]=4 1963 B7R1.3 O=C1CC=CCN1 MCULE-7370958955 [0,0,0,1,0,0|1,0,2]=4 1964 B7R1.3 O=C1CCCCC1 MCULE-5664385838 [0,0,0,1,0,0|1,0,0]=2 1965 B7R1.3 O=C1CCCCN1 MCULE-9168245534 [0,0,0,1,0,0|1,0,0]=2 1966 B7R1.3 O=C1CCCCO1 MCULE-4682307363 [0,0,0,1,0,0|0,0,0]=1 1967 B7R1.3 O=C1CCCCS1 MCULE-5383777119 [0,0,0,1,0,0|0,1,0]=2 1968 B7R1.3 O=C1CCCNC1 MCULE-2774326662 [0,0,0,1,0,0|2,0,0]=3 1969 B7R1.3 O=C1CCCNC1 MCULE-8149766009 [0,0,0,1,0,0|2,0,0]=3 1970 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [0,0,0,1,0,0|2,0,0]=3 1971 B7R1.3 O=C1CCCSC1 MCULE-1649390503 [0,0,0,1,0,0|2,0,0]=3 1972 B7R1.3 O=C1CCNCC1 MCULE-7526186270 [0,0,0,1,0,0|2,0,0]=3 1973 B7R1.3 O=C1CCNCC1 MCULE-9761063200 [0,0,0,1,0,0|2,0,0]=3 1974 B7R1.3 O=C1CCNCN1 MCULE-5793765281 [0,0,0,1,0,0|2,0,0]=3 1975 B7R1.3 O=C1CCOCC1 MCULE-6728095514 [0,0,0,1,0,0|2,0,0]=3 1976 B7R1.3 O=C1CCSCC1 MCULE-8638366518 [0,0,0,1,0,0|2,0,0]=3 1977 B7R1.3 O=C1CNCCN1 MCULE-5599978871 [0,0,0,1,0,0|2,0,0]=3 1978 B7R1.3 O=C1CNCCO1 MCULE-2634056082 [0,0,0,1,0,0|1,0,0]=2 1979 B7R1.3 O=C1CNCCO1 MCULE-6420255529 [0,0,0,1,0,0|1,0,0]=2 1980 B7R1.3 O=C1COCCN1 MCULE-8242898041 [0,0,0,1,0,0|2,0,0]=3 1981 B7R1.3 O=C1COCCO1 MCULE-5754504096 [0,0,0,1,0,0|1,0,0]=2 1982 B7R1.3 O=C1CSCCN1 MCULE-1492056440 [0,0,0,1,0,0|2,0,0]=3 1983 B7R1.3 O=C1CSCSC1 MCULE-8034252746 [0,0,0,1,0,0|3,0,0]=4 1984 B7R1.3 O=C1NCCCN1 MCULE-4876148406 [0,0,0,1,0,0|2,0,0]=3 1985 B7R1.3 O=C1NCCCO1 MCULE-9333383492 [0,0,0,1,0,0|1,0,0]=2 1986 B7R1.3 O=C1NNCCO1 MCULE-2913818828 [0,0,0,1,0,0|2,0,0]=3 1987 B7R1.3 O=C1OCCCO1 MCULE-7728322911 [0,0,0,1,0,0|1,0,0]=2 1988 B7R1.3 O=P1OCCCO1 MCULE-9154920312 [0,0,0,1,0,0|2,0,0]=3 1989 B7R1.3 O=S1CCCCC1 MCULE-1275253796 [0,0,0,1,0,0|2,0,0]=3 1990 B7R1.3 O=S1CCCSC1 MCULE-5552019770 [0,0,0,1,0,0|3,0,0]=4 1991 B7R1.3 O=S1CCNCC1 MCULE-1812570930 [0,0,0,1,0,0|3,0,0]=4 1992 B7R1.3 O=S1CCNCC1 MCULE-9878649050 [0,0,0,1,0,0|3,0,0]=4 1993 B7R1.3 O=S1CCOCC1 MCULE-4979531002 [0,0,0,1,0,0|3,0,0]=4 1994 B7R1.3 O=S1OCCCO1 MCULE-4755606100 [0,0,0,1,0,0|2,0,0]=3 1995 B7R1.3 OB1OCCCO1 MCULE-7976289917 [0,0,0,1,0,0|2,0,1]=4 1996 B7R1.3 OC1CCCCC1 MCULE-8217921343 [0,0,0,1,0,0|1,0,2]=4 1997 B7R1.3 OC1CCCCN1 MCULE-7168605870 [0,0,0,1,0,0|1,0,2]=4 1998 B7R1.3 OC1CCCCN1 MCULE-9833825308 [0,0,0,1,0,0|1,0,2]=4 1999 B7R1.3 OC1CCCCO1 MCULE-1415784498 [0,0,0,1,0,0|0,0,2]=3 2000 B7R1.3 OC1CNCCO1 MCULE-7048275202 [0,0,0,1,0,0|1,0,2]=4 2001 B7R1.3 OC1CNCCO1 MCULE-9716087824 [0,0,0,1,0,0|1,0,2]=4 2002 B7R1.3 ON1CCCCC1 MCULE-5529301217 [0,0,0,1,0,0|2,0,1]=4 2003 B7R1.3 S=C1CCCCC1 MCULE-6072375043 [0,0,0,1,0,0|1,1,0]=3 2004 B7R1.3 S=C1CCCCN1 MCULE-2004608075 [0,0,0,1,0,0|1,1,0]=3 2005 B7R1.3 S=C1COCCN1 MCULE-1743172522 [0,0,0,1,0,0|2,1,0]=4 2006 B7R1.3 S=C1NCCCN1 MCULE-6601711997 [0,0,0,1,0,0|2,1,0]=4 2007 B7R1.3 S=C1NCCCO1 MCULE-2364674450 [0,0,0,1,0,0|1,1,0]=3 2008 B7R1.3 S=C1NCCCS1 MCULE-8898215455 [0,0,0,1,0,0|1,2,0]=4 2009 B7R1.3 SC1CCCCC1 MCULE-2644288416 [0,0,0,1,0,0|1,1,1]=4 2010 B7R1.3 [NH3+]C1CCCCC1 MCULE-7876724648 [0,0,0,1,0,0|2,0,1]=4 2011 B7R1.4 BrC1=C(CCC1)Br MCULE-2617233515 [0,0,0,1,0,0|3,0,0]=4 2012 B7R1.4 C1(CCNC1=O)N MCULE-4906952813 [0,0,0,1,0,0|3,0,0]=4 2013 B7R1.4 C1(CCNC1=O)N MCULE-9500853209 [0,0,0,1,0,0|3,0,0]=4 2014 B7R1.4 C=C1CCCC1O MCULE-3026250203 [0,0,0,1,0,0|3,0,0]=4 2015 B7R1.4 C=C1CCNC1=O MCULE-2729105523 [0,0,0,1,0,0|2,0,1]=4 2016 B7R1.4 C=C1CCOC1=O MCULE-5907828600 [0,0,0,1,0,0|2,0,1]=4 2017 B7R1.4 CC1=CCCC1=O MCULE-3713655264 [0,0,0,1,0,0|1,0,1]=3 2018 B7R1.4 CC1=CCOC1=O MCULE-9785490540 [0,0,0,1,0,0|2,0,1]=4 2019 B7R1.4 CC1CCCC1=O MCULE-3710290162 [0,0,0,1,0,0|1,0,0]=2 2020 B7R1.4 CC1CCCC1Br MCULE-7816907673 [0,0,0,1,0,0|2,0,1]=4 2021 B7R1.4 CC1CCCC1N MCULE-4318156403 [0,0,0,1,0,0|2,0,1]=4 2022 B7R1.4 CC1CCCC1N MCULE-4434172193 [0,0,0,1,0,0|2,0,1]=4 2023 B7R1.4 CC1CCCC1O MCULE-1288711765 [0,0,0,1,0,0|1,0,2]=4 2024 B7R1.4 CC1CCNC1=O MCULE-7799644249 [0,0,0,1,0,0|2,0,0]=3 2025 B7R1.4 CC1CCOC1=O MCULE-2223078294 [0,0,0,1,0,0|2,0,0]=3 2026 B7R1.4 CC1CNCC1=O MCULE-2728909327 [0,0,0,1,0,0|2,0,0]=3 2027 B7R1.4 CC1CNCC1=O MCULE-9172381840 [0,0,0,1,0,0|2,0,0]=3 2028 B7R1.4 CC1COCC1=O MCULE-8115238635 [0,0,0,1,0,0|2,0,0]=3 2029 B7R1.4 CC1CSCC1=O MCULE-5611423322 [0,0,0,1,0,0|2,0,0]=3 2030 B7R1.4 CC1NCCC1=O MCULE-4206844406 [0,0,0,1,0,0|2,0,0]=3 2031 B7R1.4 CC1NCCC1=O MCULE-7025918222 [0,0,0,1,0,0|2,0,0]=3 2032 B7R1.4 CC1OCCC1=O MCULE-8278816952 [0,0,0,1,0,0|2,0,0]=3 2033 B7R1.4 CC1SCCC1=O MCULE-5264322365 [0,0,0,1,0,0|2,0,0]=3 2034 B7R1.4 CN1CC=CC1=O MCULE-7879549885 [0,0,0,1,0,0|1,0,2]=4 2035 B7R1.4 CN1CCCC1=O MCULE-1381506705 [0,0,0,1,0,0|1,0,0]=2 2036 B7R1.4 CN1CCCC1=S MCULE-1990879544 [0,0,0,1,0,0|1,1,0]=3 2037 B7R1.4 CN1CCN=C1N MCULE-2837197751 [0,0,0,1,0,0|3,0,0]=4 2038 B7R1.4 CN1CCN=C1N MCULE-3453498956 [0,0,0,1,0,0|3,0,0]=4 2039 B7R1.4 CN1CCN=C1N MCULE-5148335318 [0,0,0,1,0,0|3,0,0]=4 2040 B7R1.4 CN1CCNC1=O MCULE-9774864412 [0,0,0,1,0,0|2,0,0]=3 2041 B7R1.4 CN1CCNC1=S MCULE-5960493935 [0,0,0,1,0,0|2,1,0]=4 2042 B7R1.4 CN1CCOC1=O MCULE-7467321799 [0,0,0,1,0,0|2,0,0]=3 2043 B7R1.4 CN1CCSC1=N MCULE-4301061048 [0,0,0,1,0,0|3,0,0]=4 2044 B7R1.4 CN1CCSC1=N MCULE-6525392774 [0,0,0,1,0,0|3,0,0]=4 2045 B7R1.4 CN1CCSC1=S MCULE-4468510205 [0,0,0,1,0,0|2,1,0]=4 2046 B7R1.4 CN1CNCC1=O MCULE-2252466841 [0,0,0,1,0,0|2,0,0]=3 2047 B7R1.4 CN1N=CCC1=O MCULE-2362806196 [0,0,0,1,0,0|2,0,1]=4 2048 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-6206070680 [0,0,0,1,0,0|2,0,1]=4 2049 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-9964938082 [0,0,0,1,0,0|2,0,1]=4 2050 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [0,0,0,1,0,0|1,0,2]=4 2051 B7R1.4 C[C@@H]1CCC[C@H]1N MCULE-8385969474 [0,0,0,1,0,0|2,0,1]=4 2052 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [0,0,0,1,0,0|1,0,2]=4 2053 B7R1.4 C[C@@H]1CCNC1=O MCULE-1037883660 [0,0,0,1,0,0|2,0,0]=3 2054 B7R1.4 C[C@H]1CCC[C@@H]1N MCULE-4150988023 [0,0,0,1,0,0|2,0,1]=4 2055 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [0,0,0,1,0,0|1,0,2]=4 2056 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [0,0,0,1,0,0|1,0,2]=4 2057 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-3329868072 [0,0,0,1,0,0|2,0,1]=4 2058 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-4186145172 [0,0,0,1,0,0|2,0,1]=4 2059 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [0,0,0,1,0,0|1,0,2]=4 2060 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [0,0,0,1,0,0|1,0,2]=4 2061 B7R1.4 C[C@H]1CCNC1=O MCULE-9500360544 [0,0,0,1,0,0|2,0,0]=3 2062 B7R1.4 NC1CCCC1=O MCULE-3654949473 [0,0,0,1,0,0|2,0,0]=3 2063 B7R1.4 NC1CCCC1=O MCULE-6579965788 [0,0,0,1,0,0|2,0,0]=3 2064 B7R1.4 NC1CCNC1=O MCULE-2061829370 [0,0,0,1,0,0|3,0,0]=4 2065 B7R1.4 NC1CCNC1=O MCULE-4272585488 [0,0,0,1,0,0|3,0,0]=4 2066 B7R1.4 NC1CCOC1=O MCULE-1011670330 [0,0,0,1,0,0|3,0,0]=4 2067 B7R1.4 NC1CCOC1=O MCULE-1366805966 [0,0,0,1,0,0|3,0,0]=4 2068 B7R1.4 NC1CCOC1=O MCULE-1874490478 [0,0,0,1,0,0|3,0,0]=4 2069 B7R1.4 NC1CCOC1=O MCULE-4434379753 [0,0,0,1,0,0|3,0,0]=4 2070 B7R1.4 NC1CCOC1=O MCULE-7302633352 [0,0,0,1,0,0|3,0,0]=4 2071 B7R1.4 NC1CCOC1=O MCULE-8009953591 [0,0,0,1,0,0|3,0,0]=4 2072 B7R1.4 NC1CCSC1=O MCULE-5181497015 [0,0,0,1,0,0|3,0,0]=4 2073 B7R1.4 NC1CCSC1=O MCULE-8775141567 [0,0,0,1,0,0|3,0,0]=4 2074 B7R1.4 NN1CCCC1=O MCULE-2994786381 [0,0,0,1,0,0|2,0,0]=3 2075 B7R1.4 NN1CCCC1=O MCULE-5599329775 [0,0,0,1,0,0|2,0,0]=3 2076 B7R1.4 NN1CCNC1=O MCULE-9094725216 [0,0,0,1,0,0|3,0,0]=4 2077 B7R1.4 NN1CCOC1=O MCULE-7407834106 [0,0,0,1,0,0|3,0,0]=4 2078 B7R1.4 NN1CCOC1=O MCULE-8091613930 [0,0,0,1,0,0|3,0,0]=4 2079 B7R1.4 N[C@@H]1CCNC1=O MCULE-2357766642 [0,0,0,1,0,0|3,0,0]=4 2080 B7R1.4 N[C@@H]1CCNC1=O MCULE-9089591546 [0,0,0,1,0,0|3,0,0]=4 2081 B7R1.4 N[C@@H]1CCNC1=O MCULE-9558758567 [0,0,0,1,0,0|3,0,0]=4 2082 B7R1.4 N[C@@H]1CCNC1=O MCULE-9668255740 [0,0,0,1,0,0|3,0,0]=4 2083 B7R1.4 N[C@@H]1CCOC1=O MCULE-1027751896 [0,0,0,1,0,0|3,0,0]=4 2084 B7R1.4 N[C@@H]1CCOC1=O MCULE-4034349263 [0,0,0,1,0,0|3,0,0]=4 2085 B7R1.4 N[C@@H]1CCOC1=O MCULE-8790782772 [0,0,0,1,0,0|3,0,0]=4 2086 B7R1.4 N[C@@H]1CCOC1=O MCULE-9300265861 [0,0,0,1,0,0|3,0,0]=4 2087 B7R1.4 N[C@@H]1CCSC1=O MCULE-1269968791 [0,0,0,1,0,0|3,0,0]=4 2088 B7R1.4 N[C@@H]1CCSC1=O MCULE-5374422420 [0,0,0,1,0,0|3,0,0]=4 2089 B7R1.4 N[C@@H]1CCSC1=O MCULE-8203732076 [0,0,0,1,0,0|3,0,0]=4 2090 B7R1.4 N[C@@H]1CCSC1=O MCULE-8418670804 [0,0,0,1,0,0|3,0,0]=4 2091 B7R1.4 N[C@H]1CCNC1=O MCULE-2327147408 [0,0,0,1,0,0|3,0,0]=4 2092 B7R1.4 N[C@H]1CCNC1=O MCULE-2923469662 [0,0,0,1,0,0|3,0,0]=4 2093 B7R1.4 N[C@H]1CCNC1=O MCULE-5882745021 [0,0,0,1,0,0|3,0,0]=4 2094 B7R1.4 N[C@H]1CCNC1=O MCULE-7846724738 [0,0,0,1,0,0|3,0,0]=4 2095 B7R1.4 N[C@H]1CCOC1=O MCULE-4393293388 [0,0,0,1,0,0|3,0,0]=4 2096 B7R1.4 N[C@H]1CCOC1=O MCULE-4751602783 [0,0,0,1,0,0|3,0,0]=4 2097 B7R1.4 N[C@H]1CCOC1=O MCULE-7924572479 [0,0,0,1,0,0|3,0,0]=4 2098 B7R1.4 N[C@H]1CCOC1=O MCULE-8545644747 [0,0,0,1,0,0|3,0,0]=4 2099 B7R1.4 N[C@H]1CCOC1=O MCULE-8634641228 [0,0,0,1,0,0|3,0,0]=4 2100 B7R1.4 N[C@H]1CCSC1=O MCULE-4497814170 [0,0,0,1,0,0|3,0,0]=4 2101 B7R1.4 N[C@H]1CCSC1=O MCULE-6209097230 [0,0,0,1,0,0|3,0,0]=4 2102 B7R1.4 N[C@H]1CCSC1=O MCULE-6419348515 [0,0,0,1,0,0|3,0,0]=4 2103 B7R1.4 N[C@H]1CCSC1=O MCULE-9091827364 [0,0,0,1,0,0|3,0,0]=4 2104 B7R1.4 O=C1CCC=C1Br MCULE-1509582125 [0,0,0,1,0,0|2,0,1]=4 2105 B7R1.4 O=C1CCC=C1I MCULE-2710048446 [0,0,0,1,0,0|2,0,1]=4 2106 B7R1.4 O=C1CCC=C1O MCULE-8745661989 [0,0,0,1,0,0|2,0,1]=4 2107 B7R1.4 O=C1CCCC1=O MCULE-8040167119 [0,0,0,1,0,0|2,0,0]=3 2108 B7R1.4 O=C1CCCC1Br MCULE-3651373380 [0,0,0,1,0,0|2,0,0]=3 2109 B7R1.4 O=C1CCCC1Cl MCULE-7745647260 [0,0,0,1,0,0|2,0,0]=3 2110 B7R1.4 O=C1CCCC1F MCULE-8001765295 [0,0,0,1,0,0|2,0,0]=3 2111 B7R1.4 O=C1CCCC1O MCULE-6795188798 [0,0,0,1,0,0|2,0,0]=3 2112 B7R1.4 O=C1CCNC1=O MCULE-6243503430 [0,0,0,1,0,0|3,0,0]=4 2113 B7R1.4 O=C1NCCC1Br MCULE-5321265801 [0,0,0,1,0,0|3,0,0]=4 2114 B7R1.4 O=C1NCCC1Cl MCULE-1663035789 [0,0,0,1,0,0|3,0,0]=4 2115 B7R1.4 O=C1NCCC1F MCULE-2209899044 [0,0,0,1,0,0|3,0,0]=4 2116 B7R1.4 O=C1NCCC1O MCULE-8818841339 [0,0,0,1,0,0|3,0,0]=4 2117 B7R1.4 O=C1NCCC1O MCULE-9662824811 [0,0,0,1,0,0|3,0,0]=4 2118 B7R1.4 O=C1NCC[C@@H]1O MCULE-3212474164 [0,0,0,1,0,0|3,0,0]=4 2119 B7R1.4 O=C1NCC[C@@H]1O MCULE-7816291255 [0,0,0,1,0,0|3,0,0]=4 2120 B7R1.4 O=C1NCC[C@H]1O MCULE-1281835510 [0,0,0,1,0,0|3,0,0]=4 2121 B7R1.4 O=C1NCC[C@H]1O MCULE-6809356348 [0,0,0,1,0,0|3,0,0]=4 2122 B7R1.4 O=C1OCCC1Br MCULE-8316114331 [0,0,0,1,0,0|3,0,0]=4 2123 B7R1.4 O=C1OCCC1O MCULE-2144002601 [0,0,0,1,0,0|3,0,0]=4 2124 B7R1.4 O=C1OCCC1S MCULE-2130434062 [0,0,0,1,0,0|3,0,0]=4 2125 B7R1.4 O=C1OCC[C@@H]1O MCULE-7764011790 [0,0,0,1,0,0|3,0,0]=4 2126 B7R1.4 O=C1OCC[C@@H]1O MCULE-9001729998 [0,0,0,1,0,0|3,0,0]=4 2127 B7R1.4 O=C1OCC[C@H]1O MCULE-6949645282 [0,0,0,1,0,0|3,0,0]=4 2128 B7R1.4 O=C1OCC[C@H]1O MCULE-7110242636 [0,0,0,1,0,0|3,0,0]=4 2129 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-2430440513 [0,0,0,1,0,0|2,0,1]=4 2130 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-8503171996 [0,0,0,1,0,0|2,0,1]=4 2131 B7R1.4 [NH3+][C@H]1CCOC1=O MCULE-8903471982 [0,0,0,1,0,0|3,0,0]=4 2132 B7R1.5 CCCC1ON1C MCULE-8959342998 [0,0,0,1,0,0|1,0,2]=4 2133 B7R1.6 BrCCC1CCO1 MCULE-2777479085 [0,0,0,1,0,0|2,0,1]=4 2134 B7R1.6 CCCC1CCN1 MCULE-7330412999 [0,0,0,1,0,0|2,0,1]=4 2135 B7R1.6 CNCC1CCO1 MCULE-5990606434 [0,0,0,1,0,0|2,0,1]=4 2136 B7R1.6 ICCC1CCO1 MCULE-3778448773 [0,0,0,1,0,0|2,0,1]=4 2137 B7R1.6 NCCC1CCO1 MCULE-3619983020 [0,0,0,1,0,0|2,0,1]=4 2138 B7R1.6 NCC[C@@H]1CCO1 MCULE-5442768835 [0,0,0,1,0,0|2,0,1]=4 2139 B7R1.6 OCCC1CCO1 MCULE-3323265996 [0,0,0,1,0,0|2,0,1]=4 2140 B7R1.6 OCC[C@@H]1CCO1 MCULE-6606073727 [0,0,0,1,0,0|2,0,1]=4 2141 B7R1.6 OCC[C@H]1CCO1 MCULE-4848994972 [0,0,0,1,0,0|2,0,1]=4 2142 B7R1.6 OCC[C@H]1CCO1 MCULE-9787306242 [0,0,0,1,0,0|2,0,1]=4 2143 B7R1.8 CCC1CCC1=O MCULE-5109615435 [0,0,0,1,0,0|1,0,0]=2 2144 B7R1.8 COC1CCC1=O MCULE-6511996246 [0,0,0,1,0,0|2,0,0]=3 2145 B7R1.8 CSC1CCC1=O MCULE-3892720319 [0,0,0,1,0,0|2,0,0]=3 2146 B7R1.8 N#CC1CCC1=O MCULE-3371494435 [0,0,0,1,0,0|2,0,1]=4 2147 B7R1.8 O=C1CCC1CO MCULE-5501600764 [0,0,0,1,0,0|2,0,0]=3 2148 B7R1.8 O=C1CC[C@@H]1CO MCULE-9840363539 [0,0,0,1,0,0|2,0,0]=3 2149 B7R1.10 CNC1CC(C1)C MCULE-5081801744 [0,0,0,1,0,0|2,0,1]=4 2150 B7R1.10 CNC1CC(C1)C MCULE-9449007216 [0,0,0,1,0,0|2,0,1]=4 2151 B7R1.10 COC1CC(C1)Br MCULE-8691368603 [0,0,0,1,0,0|2,0,1]=4 2152 B7R1.10 COC1CC(C1)N MCULE-1660819417 [0,0,0,1,0,0|2,0,1]=4 2153 B7R1.10 COC1CC(C1)N MCULE-8999221377 [0,0,0,1,0,0|2,0,1]=4 2154 B7R1.10 COC1CC(C1)O MCULE-6762585493 [0,0,0,1,0,0|2,0,1]=4 2155 B7R1.10 CO[C@H]1C[C@@H](C1)Br MCULE-1579786868 [0,0,0,1,0,0|2,0,1]=4 2156 B7R1.10 CO[C@H]1C[C@@H](C1)N MCULE-7191327129 [0,0,0,1,0,0|2,0,1]=4 2157 B7R1.10 CO[C@H]1C[C@@H](C1)N MCULE-8453539406 [0,0,0,1,0,0|2,0,1]=4 2158 B7R1.10 CO[C@H]1C[C@@H](C1)O MCULE-8355585959 [0,0,0,1,0,0|2,0,1]=4 2159 B7R1.10 CO[C@H]1C[C@H](C1)N MCULE-1470713902 [0,0,0,1,0,0|2,0,1]=4 2160 B7R1.10 CO[C@H]1C[C@H](C1)N MCULE-7213635913 [0,0,0,1,0,0|2,0,1]=4 2161 B7R1.10 CO[C@H]1C[C@H](C1)O MCULE-4960775262 [0,0,0,1,0,0|2,0,1]=4 2162 B7R1.15 CC1CC(=O)C1C MCULE-1068922218 [0,0,0,1,0,0|1,0,0]=2 2163 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2032555036 [0,0,0,1,0,0|3,0,0]=4 2164 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2738127555 [0,0,0,1,0,0|3,0,0]=4 2165 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-5044901082 [0,0,0,1,0,0|3,0,0]=4 2166 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-7632990759 [0,0,0,1,0,0|3,0,0]=4 2167 B7R1.21 CCCC1(CC1)N MCULE-2015286161 [0,0,0,1,0,0|2,0,1]=4 2168 B7R1.21 CCCC1(CC1)N MCULE-9864007655 [0,0,0,1,0,0|2,0,1]=4 2169 B7R1.21 COCC1(CO1)C MCULE-8694642597 [0,0,0,1,0,0|2,0,1]=4 2170 B7R1.22 C/C(=N/O)/C1CC1 MCULE-9504873944 [0,0,0,1,0,0|3,0,0]=4 2171 B7R1.22 C1(CO1)C(=O)OC MCULE-1350193594 [0,0,0,1,0,0|1,0,0]=2 2172 B7R1.22 C=CC(=O)C1CC1 MCULE-4167270466 [0,0,0,1,0,0|1,0,1]=3 2173 B7R1.22 CC(=NO)C1CC1 MCULE-2639658638 [0,0,0,1,0,0|3,0,0]=4 2174 B7R1.22 CC(ON)C1CC1 MCULE-7159103218 [0,0,0,1,0,0|2,0,1]=4 2175 B7R1.22 CC(ON)C1CC1 MCULE-9475793465 [0,0,0,1,0,0|2,0,1]=4 2176 B7R1.22 CCC(=O)C1CC1 MCULE-6231785303 [0,0,0,1,0,0|1,0,0]=2 2177 B7R1.22 CCC(N)C1CC1 MCULE-2935155085 [0,0,0,1,0,0|2,0,1]=4 2178 B7R1.22 CCC(N)C1CC1 MCULE-7295156418 [0,0,0,1,0,0|2,0,1]=4 2179 B7R1.22 CCC(O)C1CC1 MCULE-5753196768 [0,0,0,1,0,0|1,0,2]=4 2180 B7R1.22 CC[C@@H](N)C1CC1 MCULE-8184175332 [0,0,0,1,0,0|2,0,1]=4 2181 B7R1.22 CC[C@H](N)C1CC1 MCULE-5395953598 [0,0,0,1,0,0|2,0,1]=4 2182 B7R1.22 CC[C@H](N)C1CC1 MCULE-6843001585 [0,0,0,1,0,0|2,0,1]=4 2183 B7R1.22 CC[C@H](N)C1CC1 MCULE-8773009184 [0,0,0,1,0,0|2,0,1]=4 2184 B7R1.22 CNC(=O)C1CC1 MCULE-5799863193 [0,0,0,1,0,0|1,0,0]=2 2185 B7R1.22 CNC(C)C1CC1 MCULE-3862123004 [0,0,0,1,0,0|2,0,1]=4 2186 B7R1.22 CNC(C)C1CC1 MCULE-5338638792 [0,0,0,1,0,0|2,0,1]=4 2187 B7R1.22 COC(=N)C1CC1 MCULE-3594886802 [0,0,0,1,0,0|1,0,0]=2 2188 B7R1.22 COC(=N)C1CC1 MCULE-6548060912 [0,0,0,1,0,0|1,0,0]=2 2189 B7R1.22 COC(=O)C1CC1 MCULE-3338113454 [0,0,0,1,0,0|0,0,0]=1 2190 B7R1.22 COC(=O)C1CN1 MCULE-2166427972 [0,0,0,1,0,0|1,0,0]=2 2191 B7R1.22 COC(=O)C1CO1 MCULE-1745412030 [0,0,0,1,0,0|1,0,0]=2 2192 B7R1.22 COC(=O)N1CC1 MCULE-2788788116 [0,0,0,1,0,0|1,0,0]=2 2193 B7R1.22 COC(=O)[C@@H]1CN1 MCULE-1955059175 [0,0,0,1,0,0|1,0,0]=2 2194 B7R1.22 COC(=O)[C@@H]1CN1 MCULE-5011635876 [0,0,0,1,0,0|1,0,0]=2 2195 B7R1.22 COC(=O)[C@@H]1CO1 MCULE-2259836812 [0,0,0,1,0,0|1,0,0]=2 2196 B7R1.22 COC(=O)[C@H]1CN1 MCULE-5882979938 [0,0,0,1,0,0|1,0,0]=2 2197 B7R1.22 COC(=O)[C@H]1CN1 MCULE-8601280412 [0,0,0,1,0,0|1,0,0]=2 2198 B7R1.22 COC(=O)[C@H]1CO1 MCULE-5568309714 [0,0,0,1,0,0|1,0,0]=2 2199 B7R1.22 COC(=O)[C@H]1CO1 MCULE-9432053348 [0,0,0,1,0,0|1,0,0]=2 2200 B7R1.22 N/C(=N\O)/C1CC1 MCULE-1839060575 [0,0,0,1,0,0|3,0,0]=4 2201 B7R1.22 N/C(=N\O)/C1CC1 MCULE-7991254390 [0,0,0,1,0,0|3,0,0]=4 2202 B7R1.22 N=C(NN)C1CC1 MCULE-3706372467 [0,0,0,1,0,0|3,0,0]=4 2203 B7R1.22 NCC(=O)C1CC1 MCULE-1927654168 [0,0,0,1,0,0|2,0,0]=3 2204 B7R1.22 NCC(=O)C1CC1 MCULE-4415662894 [0,0,0,1,0,0|2,0,0]=3 2205 B7R1.22 NNC(=O)C1CC1 MCULE-3608531301 [0,0,0,1,0,0|2,0,0]=3 2206 B7R1.22 O=C(CBr)C1CC1 MCULE-1037373080 [0,0,0,1,0,0|2,0,0]=3 2207 B7R1.22 O=C(CCl)C1CC1 MCULE-9791345328 [0,0,0,1,0,0|2,0,0]=3 2208 B7R1.22 O=C(CCl)N1CC1 MCULE-3092013537 [0,0,0,1,0,0|3,0,0]=4 2209 B7R1.22 O=C(CO)C1CC1 MCULE-4276266642 [0,0,0,1,0,0|2,0,0]=3 2210 B7R1.22 O=C(NO)C1CC1 MCULE-2299815322 [0,0,0,1,0,0|2,0,0]=3 2211 B7R1.22 [C@H]1(CO1)C(=O)OC MCULE-2114123664 [0,0,0,1,0,0|1,0,0]=2 2212 B7R1.25 CCC1(CCC1)N MCULE-5053916607 [0,0,0,1,0,0|2,0,1]=4 2213 B7R1.25 CCC1(CCC1)N MCULE-5413278315 [0,0,0,1,0,0|2,0,1]=4 2214 B7R1.25 COC1(CNC1)C MCULE-6665716453 [0,0,0,1,0,0|2,0,1]=4 2215 B7R1.25 COC1(CNC1)C MCULE-9047074177 [0,0,0,1,0,0|2,0,1]=4 2216 B7R1.27 COC1(CC1N)C MCULE-2779937239 [0,0,0,1,0,0|2,0,1]=4 2217 B4R0.1 C#CC(=O)C MCULE-1296030711 [2,0,0,0,0,0|0,0,2]=4 2218 B4R0.1 C#CC(=O)O MCULE-8764256624 [2,0,0,0,0,0|0,0,2]=4 2219 B4R0.1 C/C=C(/C)\Cl MCULE-6841426098 [2,0,0,0,0,0|1,0,1]=4 2220 B4R0.1 C/C=C(\C)/Br MCULE-3045523462 [2,0,0,0,0,0|1,0,1]=4 2221 B4R0.1 C/C=C(\C)/Cl MCULE-4683862502 [2,0,0,0,0,0|1,0,1]=4 2222 B4R0.1 C=C(Br)CC MCULE-6271946451 [2,0,0,0,0,0|1,0,1]=4 2223 B4R0.1 C=C(C)CBr MCULE-1361893863 [2,0,0,0,0,0|2,0,0]=4 2224 B4R0.1 C=C(C)CCl MCULE-5586406339 [2,0,0,0,0,0|2,0,0]=4 2225 B4R0.1 C=C(C)CI MCULE-3678124406 [2,0,0,0,0,0|2,0,0]=4 2226 B4R0.1 C=C(C)CN MCULE-1033495975 [2,0,0,0,0,0|2,0,0]=4 2227 B4R0.1 C=C(C)CN MCULE-8730181300 [2,0,0,0,0,0|2,0,0]=4 2228 B4R0.1 C=C(C)CO MCULE-8641288398 [2,0,0,0,0,0|2,0,0]=4 2229 B4R0.1 C=C(C)CS MCULE-5174170431 [2,0,0,0,0,0|2,0,0]=4 2230 B4R0.1 C=C(C)OC MCULE-7344104255 [2,0,0,0,0,0|1,0,0]=3 2231 B4R0.1 C=CC(=O)C MCULE-4924646293 [2,0,0,0,0,0|0,0,2]=4 2232 B4R0.1 C=CC(=O)O MCULE-9352227082 [2,0,0,0,0,0|0,0,2]=4 2233 B4R0.1 CC(=O)C#N MCULE-6317771757 [2,0,0,0,0,0|1,0,1]=4 2234 B4R0.1 CC(=O)C=O MCULE-2718961814 [2,0,0,0,0,0|1,0,1]=4 2235 B4R0.1 CC(=O)CBr MCULE-7812920675 [2,0,0,0,0,0|1,0,0]=3 2236 B4R0.1 CC(=O)CCl MCULE-2501365933 [2,0,0,0,0,0|1,0,0]=3 2237 B4R0.1 CC(=O)CF MCULE-7417279999 [2,0,0,0,0,0|1,0,0]=3 2238 B4R0.1 CC(=O)CN MCULE-2715277783 [2,0,0,0,0,0|1,0,0]=3 2239 B4R0.1 CC(=O)CN MCULE-6004541862 [2,0,0,0,0,0|1,0,0]=3 2240 B4R0.1 CC(=O)CO MCULE-2989526028 [2,0,0,0,0,0|1,0,0]=3 2241 B4R0.1 CC(=O)CS MCULE-9736174016 [2,0,0,0,0,0|1,0,0]=3 2242 B4R0.1 CC(=O)NBr MCULE-6502070876 [2,0,0,0,0,0|2,0,0]=4 2243 B4R0.1 CC(=O)NN MCULE-9183467120 [2,0,0,0,0,0|2,0,0]=4 2244 B4R0.1 CC(=O)NO MCULE-2682231025 [2,0,0,0,0,0|2,0,0]=4 2245 B4R0.1 CC(=O)OO MCULE-6028338742 [2,0,0,0,0,0|1,0,0]=3 2246 B4R0.1 CC=C(C)Br MCULE-1371905211 [2,0,0,0,0,0|1,0,1]=4 2247 B4R0.1 CC=C(C)C MCULE-4230157245 [2,0,0,0,0,0|1,0,1]=4 2248 B4R0.1 CC=C(C)Cl MCULE-3844314543 [2,0,0,0,0,0|1,0,1]=4 2249 B4R0.1 CCB(O)O MCULE-1650960999 [2,0,0,0,0,0|1,0,1]=4 2250 B4R0.1 CCC(=N)N MCULE-1856575742 [2,0,0,0,0,0|2,0,0]=4 2251 B4R0.1 CCC(=N)N MCULE-2534386807 [2,0,0,0,0,0|2,0,0]=4 2252 B4R0.1 CCC(=O)Br MCULE-7870678619 [2,0,0,0,0,0|1,0,0]=3 2253 B4R0.1 CCC(=O)C MCULE-8276670748 [2,0,0,0,0,0|0,0,0]=2 2254 B4R0.1 CCC(=O)Cl MCULE-3081874391 [2,0,0,0,0,0|1,0,0]=3 2255 B4R0.1 CCC(=O)F MCULE-8783887670 [2,0,0,0,0,0|1,0,0]=3 2256 B4R0.1 CCC(=O)N MCULE-3730796130 [2,0,0,0,0,0|1,0,0]=3 2257 B4R0.1 CCC(=O)O MCULE-2199051150 [2,0,0,0,0,0|0,0,0]=2 2258 B4R0.1 CCC(=O)O MCULE-9800054040 [2,0,0,0,0,0|0,0,0]=2 2259 B4R0.1 CCC(=O)S MCULE-3392119766 [2,0,0,0,0,0|0,1,0]=3 2260 B4R0.1 CCC(=O)[O-] MCULE-6321502767 [2,0,0,0,0,0|0,0,1]=3 2261 B4R0.1 CCC(=S)N MCULE-3921479699 [2,0,0,0,0,0|1,1,0]=4 2262 B4R0.1 CCC(C)Br MCULE-9661620259 [2,0,0,0,0,0|1,0,1]=4 2263 B4R0.1 CCC(C)C MCULE-5376105936 [2,0,0,0,0,0|1,0,1]=4 2264 B4R0.1 CCC(C)Cl MCULE-2954418486 [2,0,0,0,0,0|1,0,1]=4 2265 B4R0.1 CCC(C)I MCULE-5239699587 [2,0,0,0,0,0|1,0,1]=4 2266 B4R0.1 CCC(C)N MCULE-5041676035 [2,0,0,0,0,0|1,0,1]=4 2267 B4R0.1 CCC(C)N MCULE-5835091553 [2,0,0,0,0,0|1,0,1]=4 2268 B4R0.1 CCC(C)N MCULE-6631606230 [2,0,0,0,0,0|1,0,1]=4 2269 B4R0.1 CCC(C)N MCULE-8165681721 [2,0,0,0,0,0|1,0,1]=4 2270 B4R0.1 CCC(C)O MCULE-4099350806 [2,0,0,0,0,0|0,0,2]=4 2271 B4R0.1 CCC(C)O MCULE-5005120003 [2,0,0,0,0,0|0,0,2]=4 2272 B4R0.1 CCC(C)S MCULE-4988033753 [2,0,0,0,0,0|0,1,1]=4 2273 B4R0.1 CCN(=O)=O MCULE-6603591614 [2,0,0,0,0,0|1,0,1]=4 2274 B4R0.1 CCN(C)C MCULE-5825033552 [2,0,0,0,0,0|2,0,0]=4 2275 B4R0.1 CCN(C)N MCULE-2279492356 [2,0,0,0,0,0|2,0,0]=4 2276 B4R0.1 CCN(C)N MCULE-5660338703 [2,0,0,0,0,0|2,0,0]=4 2277 B4R0.1 CCN(C)N MCULE-9839987578 [2,0,0,0,0,0|2,0,0]=4 2278 B4R0.1 CCS(=O)C MCULE-4400935745 [2,0,0,0,0,0|1,0,0]=3 2279 B4R0.1 CCS(=O)O MCULE-9872932319 [2,0,0,0,0,0|1,0,0]=3 2280 B4R0.1 CCS(=O)[O-] MCULE-4386198822 [2,0,0,0,0,0|1,0,1]=4 2281 B4R0.1 CC[C@@H](C)N MCULE-2017255826 [2,0,0,0,0,0|1,0,1]=4 2282 B4R0.1 CC[C@@H](C)N MCULE-3555707512 [2,0,0,0,0,0|1,0,1]=4 2283 B4R0.1 CC[C@@H](C)N MCULE-6783735598 [2,0,0,0,0,0|1,0,1]=4 2284 B4R0.1 CC[C@@H](C)N MCULE-7004219201 [2,0,0,0,0,0|1,0,1]=4 2285 B4R0.1 CC[C@@H](C)O MCULE-2661481448 [2,0,0,0,0,0|0,0,2]=4 2286 B4R0.1 CC[C@@H](C)O MCULE-6785232833 [2,0,0,0,0,0|0,0,2]=4 2287 B4R0.1 CC[C@H](C)N MCULE-2450201533 [2,0,0,0,0,0|1,0,1]=4 2288 B4R0.1 CC[C@H](C)N MCULE-2998961427 [2,0,0,0,0,0|1,0,1]=4 2289 B4R0.1 CC[C@H](C)N MCULE-6692190471 [2,0,0,0,0,0|1,0,1]=4 2290 B4R0.1 CC[C@H](C)N MCULE-6904795465 [2,0,0,0,0,0|1,0,1]=4 2291 B4R0.1 CC[C@H](C)O MCULE-3700911573 [2,0,0,0,0,0|0,0,2]=4 2292 B4R0.1 CC[C@H](C)O MCULE-6063716138 [2,0,0,0,0,0|0,0,2]=4 2293 B4R0.1 CNC(=O)C MCULE-2612997941 [2,0,0,0,0,0|1,0,0]=3 2294 B4R0.1 CNC(=O)Cl MCULE-7743744606 [2,0,0,0,0,0|2,0,0]=4 2295 B4R0.1 CNC(=O)N MCULE-6422331704 [2,0,0,0,0,0|2,0,0]=4 2296 B4R0.1 CNC(=S)C MCULE-8699171591 [2,0,0,0,0,0|1,1,0]=4 2297 B4R0.1 COC(=N)C MCULE-2752794913 [2,0,0,0,0,0|1,0,0]=3 2298 B4R0.1 COC(=N)C MCULE-2904991083 [2,0,0,0,0,0|1,0,0]=3 2299 B4R0.1 COC(=N)N MCULE-1611076737 [2,0,0,0,0,0|2,0,0]=4 2300 B4R0.1 COC(=N)N MCULE-4923904579 [2,0,0,0,0,0|2,0,0]=4 2301 B4R0.1 COC(=N)N MCULE-6696789855 [2,0,0,0,0,0|2,0,0]=4 2302 B4R0.1 COC(=N)N MCULE-9171600210 [2,0,0,0,0,0|2,0,0]=4 2303 B4R0.1 COC(=O)C MCULE-7368066093 [2,0,0,0,0,0|0,0,0]=2 2304 B4R0.1 COC(=O)Cl MCULE-8022274771 [2,0,0,0,0,0|1,0,0]=3 2305 B4R0.1 COC(=O)N MCULE-4070607369 [2,0,0,0,0,0|1,0,0]=3 2306 B4R0.1 COC(=S)N MCULE-9414558443 [2,0,0,0,0,0|1,1,0]=4 2307 B4R0.1 COC(=S)[S-] MCULE-4829872223 [2,0,0,0,0,0|1,1,0]=4 2308 B4R0.1 COC(=S)[S-] MCULE-6509496630 [2,0,0,0,0,0|1,1,0]=4 2309 B4R0.1 COC(C)Cl MCULE-9043930044 [2,0,0,0,0,0|1,0,1]=4 2310 B4R0.1 CSC(=O)C MCULE-7061634598 [2,0,0,0,0,0|0,1,0]=3 2311 B4R0.1 CSC(=S)C MCULE-4836153374 [2,0,0,0,0,0|0,2,0]=4 2312 B4R0.1 CSS(=O)C MCULE-6515592458 [2,0,0,0,0,0|1,1,0]=4 2313 B4R0.1 NC(=O)CBr MCULE-9306090536 [2,0,0,0,0,0|2,0,0]=4 2314 B4R0.1 NC(=O)CCl MCULE-3241549842 [2,0,0,0,0,0|2,0,0]=4 2315 B4R0.1 NC(=O)CF MCULE-3344212657 [2,0,0,0,0,0|2,0,0]=4 2316 B4R0.1 NC(=O)CI MCULE-4217973413 [2,0,0,0,0,0|2,0,0]=4 2317 B4R0.1 NC(=O)CO MCULE-2739878376 [2,0,0,0,0,0|2,0,0]=4 2318 B4R0.1 NC(=O)CS MCULE-2639305532 [2,0,0,0,0,0|2,0,0]=4 2319 B4R0.1 NCC(=O)N MCULE-1048848056 [2,0,0,0,0,0|2,0,0]=4 2320 B4R0.1 NCC(=O)N MCULE-2174395809 [2,0,0,0,0,0|2,0,0]=4 2321 B4R0.1 NCC(=O)N MCULE-6113166250 [2,0,0,0,0,0|2,0,0]=4 2322 B4R0.1 NCC(=O)O MCULE-2415764032 [2,0,0,0,0,0|1,0,0]=3 2323 B4R0.1 NCC(=O)O MCULE-3643110755 [2,0,0,0,0,0|1,0,0]=3 2324 B4R0.1 NCC(=O)O MCULE-4349255299 [2,0,0,0,0,0|1,0,0]=3 2325 B4R0.1 NCC(=O)O MCULE-9146223615 [2,0,0,0,0,0|1,0,0]=3 2326 B4R0.1 NCC(=O)O MCULE-9701991737 [2,0,0,0,0,0|1,0,0]=3 2327 B4R0.1 NCC(=O)S MCULE-9837799864 [2,0,0,0,0,0|1,1,0]=4 2328 B4R0.1 NCC(=O)[O-] MCULE-5975202378 [2,0,0,0,0,0|1,0,1]=4 2329 B4R0.1 O=C(Br)CBr MCULE-6031858200 [2,0,0,0,0,0|2,0,0]=4 2330 B4R0.1 O=C(Cl)CBr MCULE-7684029984 [2,0,0,0,0,0|2,0,0]=4 2331 B4R0.1 O=C(Cl)CCl MCULE-7076914635 [2,0,0,0,0,0|2,0,0]=4 2332 B4R0.1 O=C(Cl)CF MCULE-7182087882 [2,0,0,0,0,0|2,0,0]=4 2333 B4R0.1 O=C(Cl)CI MCULE-5719121455 [2,0,0,0,0,0|2,0,0]=4 2334 B4R0.1 O=C(O)CBr MCULE-1503716137 [2,0,0,0,0,0|1,0,0]=3 2335 B4R0.1 O=C(O)CCl MCULE-9228754880 [2,0,0,0,0,0|1,0,0]=3 2336 B4R0.1 O=C(O)CF MCULE-6584094437 [2,0,0,0,0,0|1,0,0]=3 2337 B4R0.1 O=C(O)CI MCULE-3146792857 [2,0,0,0,0,0|1,0,0]=3 2338 B4R0.1 O=C(O)CO MCULE-9792551388 [2,0,0,0,0,0|1,0,0]=3 2339 B4R0.1 O=C(O)CS MCULE-8097997001 [2,0,0,0,0,0|1,0,0]=3 2340 B4R0.1 O=C([O-])CF MCULE-8428965857 [2,0,0,0,0,0|1,0,1]=4 2341 B4R0.1 O=C([O-])CO MCULE-2780567509 [2,0,0,0,0,0|1,0,1]=4 2342 B4R0.1 O=C([O-])CS MCULE-3314809220 [2,0,0,0,0,0|1,0,1]=4 2343 B4R0.1 O=C([O-])CS MCULE-5989133747 [2,0,0,0,0,0|1,0,1]=4 2344 B4R0.1 O=CC(=O)O MCULE-5307898766 [2,0,0,0,0,0|1,0,1]=4 2345 B4R0.1 O=S(O)CO MCULE-4195832185 [2,0,0,0,0,0|2,0,0]=4 2346 B4R0.1 P(=O)(O)CN MCULE-5441171864 [2,0,0,0,0,0|2,0,0]=4 2347 B4R0.1 [NH3+]C(C)CC MCULE-3066898055 [2,0,0,0,0,0|1,0,1]=4 2348 B4R0.2 C#CCCC MCULE-1233806896 [2,0,0,0,0,0|0,0,2]=4 2349 B4R0.2 C#CCOC MCULE-9172422462 [2,0,0,0,0,0|0,0,2]=4 2350 B4R0.2 C/C=C/C=O MCULE-9924705308 [2,0,0,0,0,0|0,0,2]=4 2351 B4R0.2 C/C=C/CCl MCULE-9977493525 [2,0,0,0,0,0|1,0,1]=4 2352 B4R0.2 C/C=C/CO MCULE-2383161163 [2,0,0,0,0,0|1,0,1]=4 2353 B4R0.2 C/C=C/OC MCULE-3906920304 [2,0,0,0,0,0|0,0,1]=3 2354 B4R0.2 C/C=C\CO MCULE-5924662327 [2,0,0,0,0,0|1,0,1]=4 2355 B4R0.2 C=C=CCC MCULE-6123315571 [2,0,0,0,0,0|1,0,1]=4 2356 B4R0.2 C=CCCBr MCULE-2890129103 [2,0,0,0,0,0|1,0,1]=4 2357 B4R0.2 C=CCCC MCULE-8386546337 [2,0,0,0,0,0|0,0,1]=3 2358 B4R0.2 C=CCCCl MCULE-5903789900 [2,0,0,0,0,0|1,0,1]=4 2359 B4R0.2 C=CCCI MCULE-1055671394 [2,0,0,0,0,0|1,0,1]=4 2360 B4R0.2 C=CCCN MCULE-2471716627 [2,0,0,0,0,0|1,0,1]=4 2361 B4R0.2 C=CCCN MCULE-2881108697 [2,0,0,0,0,0|1,0,1]=4 2362 B4R0.2 C=CCCO MCULE-4582400839 [2,0,0,0,0,0|1,0,1]=4 2363 B4R0.2 C=CCNC MCULE-3335720336 [2,0,0,0,0,0|1,0,1]=4 2364 B4R0.2 C=CCOC MCULE-3321225771 [2,0,0,0,0,0|0,0,2]=4 2365 B4R0.2 C=CCSC MCULE-4452023915 [2,0,0,0,0,0|1,0,1]=4 2366 B4R0.2 C=COCC MCULE-2569047033 [2,0,0,0,0,0|1,0,1]=4 2367 B4R0.2 C=CSCC MCULE-8927374165 [2,0,0,0,0,0|1,0,1]=4 2368 B4R0.2 CC#CC=O MCULE-9270622693 [2,0,0,0,0,0|0,0,2]=4 2369 B4R0.2 CC#CCC MCULE-8848779220 [2,0,0,0,0,0|0,0,2]=4 2370 B4R0.2 CC=CC=O MCULE-2497362981 [2,0,0,0,0,0|0,0,2]=4 2371 B4R0.2 CC=CCBr MCULE-7855581866 [2,0,0,0,0,0|1,0,1]=4 2372 B4R0.2 CC=CCC MCULE-5931905453 [2,0,0,0,0,0|0,0,1]=3 2373 B4R0.2 CC=CCCl MCULE-3941962217 [2,0,0,0,0,0|1,0,1]=4 2374 B4R0.2 CC=CCO MCULE-7490725844 [2,0,0,0,0,0|1,0,1]=4 2375 B4R0.2 CC=COC MCULE-6712403535 [2,0,0,0,0,0|0,0,1]=3 2376 B4R0.2 CC=CSC MCULE-5921906156 [2,0,0,0,0,0|0,1,1]=4 2377 B4R0.2 CCC=CBr MCULE-4471551501 [2,0,0,0,0,0|1,0,1]=4 2378 B4R0.2 CCC=NO MCULE-9457280654 [2,0,0,0,0,0|1,0,1]=4 2379 B4R0.2 CCCC#N MCULE-8571076087 [2,0,0,0,0,0|1,0,1]=4 2380 B4R0.2 CCCC=O MCULE-8530391347 [2,0,0,0,0,0|0,0,0]=2 2381 B4R0.2 CCCCBr MCULE-3390217131 [2,0,0,0,0,0|1,0,1]=4 2382 B4R0.2 CCCCC MCULE-4643148765 [2,0,0,0,0,0|0,0,1]=3 2383 B4R0.2 CCCCCl MCULE-5329900290 [2,0,0,0,0,0|1,0,1]=4 2384 B4R0.2 CCCCF MCULE-7225760858 [2,0,0,0,0,0|1,0,1]=4 2385 B4R0.2 CCCCI MCULE-1160974720 [2,0,0,0,0,0|1,0,1]=4 2386 B4R0.2 CCCCN MCULE-1731874934 [2,0,0,0,0,0|1,0,1]=4 2387 B4R0.2 CCCCN MCULE-4233278050 [2,0,0,0,0,0|1,0,1]=4 2388 B4R0.2 CCCCN MCULE-5242069370 [2,0,0,0,0,0|1,0,1]=4 2389 B4R0.2 CCCCN MCULE-7343835253 [2,0,0,0,0,0|1,0,1]=4 2390 B4R0.2 CCCCO MCULE-1571156443 [2,0,0,0,0,0|0,0,1]=3 2391 B4R0.2 CCCCS MCULE-9441213933 [2,0,0,0,0,0|0,1,1]=4 2392 B4R0.2 CCCNC MCULE-2266616259 [2,0,0,0,0,0|1,0,0]=3 2393 B4R0.2 CCCNC MCULE-7722796872 [2,0,0,0,0,0|1,0,0]=3 2394 B4R0.2 CCCNN MCULE-4121438775 [2,0,0,0,0,0|2,0,0]=4 2395 B4R0.2 CCCNN MCULE-5875592228 [2,0,0,0,0,0|2,0,0]=4 2396 B4R0.2 CCCNN MCULE-9585694661 [2,0,0,0,0,0|2,0,0]=4 2397 B4R0.2 CCCOC MCULE-5854067718 [2,0,0,0,0,0|0,0,0]=2 2398 B4R0.2 CCCON MCULE-4800172637 [2,0,0,0,0,0|1,0,0]=3 2399 B4R0.2 CCCON MCULE-7988781002 [2,0,0,0,0,0|1,0,0]=3 2400 B4R0.2 CCCSC MCULE-8387041737 [2,0,0,0,0,0|0,1,0]=3 2401 B4R0.2 CCN=C=O MCULE-6522145601 [2,0,0,0,0,0|1,0,1]=4 2402 B4R0.2 CCNC=O MCULE-9309926274 [2,0,0,0,0,0|1,0,0]=3 2403 B4R0.2 CCNCC MCULE-3395060353 [2,0,0,0,0,0|1,0,1]=4 2404 B4R0.2 CCNCC MCULE-4374609736 [2,0,0,0,0,0|1,0,1]=4 2405 B4R0.2 CCNCC MCULE-4555901025 [2,0,0,0,0,0|1,0,1]=4 2406 B4R0.2 CCNCC MCULE-6895602113 [2,0,0,0,0,0|1,0,1]=4 2407 B4R0.2 CCNOC MCULE-4797714235 [2,0,0,0,0,0|1,0,0]=3 2408 B4R0.2 CCNOC MCULE-6486167423 [2,0,0,0,0,0|1,0,0]=3 2409 B4R0.2 CCOC=N MCULE-5321655909 [2,0,0,0,0,0|2,0,0]=4 2410 B4R0.2 CCOC=N MCULE-8158357614 [2,0,0,0,0,0|2,0,0]=4 2411 B4R0.2 CCOC=O MCULE-6245072161 [2,0,0,0,0,0|1,0,0]=3 2412 B4R0.2 CCOCC MCULE-5665709021 [2,0,0,0,0,0|1,0,1]=4 2413 B4R0.2 CCONC MCULE-5446312516 [2,0,0,0,0,0|2,0,0]=4 2414 B4R0.2 CCONC MCULE-7976027802 [2,0,0,0,0,0|2,0,0]=4 2415 B4R0.2 CCSCC MCULE-6480710239 [2,0,0,0,0,0|1,0,1]=4 2416 B4R0.2 CCSSC MCULE-9430585714 [2,0,0,0,0,0|1,1,0]=4 2417 B4R0.2 CC[NH2+]CC MCULE-9899430356 [2,0,0,0,0,0|1,0,1]=4 2418 B4R0.2 CNCCBr MCULE-3708780806 [2,0,0,0,0,0|2,0,0]=4 2419 B4R0.2 CNCCBr MCULE-6840755559 [2,0,0,0,0,0|2,0,0]=4 2420 B4R0.2 CNCCCl MCULE-1666345560 [2,0,0,0,0,0|2,0,0]=4 2421 B4R0.2 CNCCCl MCULE-8215813413 [2,0,0,0,0,0|2,0,0]=4 2422 B4R0.2 CNCCF MCULE-3719880423 [2,0,0,0,0,0|2,0,0]=4 2423 B4R0.2 CNCCF MCULE-3751701745 [2,0,0,0,0,0|2,0,0]=4 2424 B4R0.2 CNCCI MCULE-7026781832 [2,0,0,0,0,0|2,0,0]=4 2425 B4R0.2 CNCCI MCULE-8892686580 [2,0,0,0,0,0|2,0,0]=4 2426 B4R0.2 CNCCN MCULE-2881688448 [2,0,0,0,0,0|2,0,0]=4 2427 B4R0.2 CNCCN MCULE-7199403269 [2,0,0,0,0,0|2,0,0]=4 2428 B4R0.2 CNCCO MCULE-7051900771 [2,0,0,0,0,0|1,0,1]=4 2429 B4R0.2 CNCCO MCULE-7934732981 [2,0,0,0,0,0|1,0,1]=4 2430 B4R0.2 CNCCS MCULE-6430516369 [2,0,0,0,0,0|2,0,0]=4 2431 B4R0.2 COCC#N MCULE-9178522865 [2,0,0,0,0,0|1,0,1]=4 2432 B4R0.2 COCC=O MCULE-9427361019 [2,0,0,0,0,0|1,0,0]=3 2433 B4R0.2 COCCBr MCULE-8316331262 [2,0,0,0,0,0|1,0,0]=3 2434 B4R0.2 COCCCl MCULE-8886627413 [2,0,0,0,0,0|1,0,0]=3 2435 B4R0.2 COCCI MCULE-9391124374 [2,0,0,0,0,0|1,0,0]=3 2436 B4R0.2 COCCN MCULE-5051556646 [2,0,0,0,0,0|1,0,0]=3 2437 B4R0.2 COCCN MCULE-7519068386 [2,0,0,0,0,0|1,0,0]=3 2438 B4R0.2 COCCO MCULE-4751927883 [2,0,0,0,0,0|1,0,0]=3 2439 B4R0.2 COCCS MCULE-7803276094 [2,0,0,0,0,0|1,0,0]=3 2440 B4R0.2 COCOC MCULE-8559076702 [2,0,0,0,0,0|1,0,0]=3 2441 B4R0.2 COCON MCULE-6032854331 [2,0,0,0,0,0|2,0,0]=4 2442 B4R0.2 CSCCBr MCULE-1684461541 [2,0,0,0,0,0|1,1,0]=4 2443 B4R0.2 CSCCCl MCULE-8593103756 [2,0,0,0,0,0|1,1,0]=4 2444 B4R0.2 CSCCN MCULE-5168245255 [2,0,0,0,0,0|1,1,0]=4 2445 B4R0.2 CSCCN MCULE-6275285732 [2,0,0,0,0,0|1,1,0]=4 2446 B4R0.2 CSCCO MCULE-9706874325 [2,0,0,0,0,0|1,0,1]=4 2447 B4R0.2 CSCSC MCULE-5603964020 [2,0,0,0,0,0|1,1,0]=4 2448 B4R0.2 NCCCO MCULE-2851278356 [2,0,0,0,0,0|1,0,1]=4 2449 B4R0.2 NCCCO MCULE-9698089092 [2,0,0,0,0,0|1,0,1]=4 2450 B4R0.2 NCCON MCULE-3613980902 [2,0,0,0,0,0|2,0,0]=4 2451 B4R0.2 NCCON MCULE-7030217952 [2,0,0,0,0,0|2,0,0]=4 2452 B4R0.2 NCCON MCULE-8959912781 [2,0,0,0,0,0|2,0,0]=4 2453 B4R0.2 NOCCBr MCULE-2796346082 [2,0,0,0,0,0|2,0,0]=4 2454 B4R0.2 NOCCBr MCULE-5636354898 [2,0,0,0,0,0|2,0,0]=4 2455 B4R0.2 NOCCCl MCULE-5981688956 [2,0,0,0,0,0|2,0,0]=4 2456 B4R0.2 NOCCF MCULE-1813481600 [2,0,0,0,0,0|2,0,0]=4 2457 B4R0.2 NOCCF MCULE-2993254805 [2,0,0,0,0,0|2,0,0]=4 2458 B4R0.2 NOCCO MCULE-2545004367 [2,0,0,0,0,0|2,0,0]=4 2459 B4R0.2 O=CCCBr MCULE-4107157458 [2,0,0,0,0,0|1,0,0]=3 2460 B4R0.2 O=CCCCl MCULE-5863929313 [2,0,0,0,0,0|1,0,0]=3 2461 B4R0.2 O=CCCI MCULE-9771140462 [2,0,0,0,0,0|1,0,0]=3 2462 B4R0.2 O=CCCO MCULE-1685289763 [2,0,0,0,0,0|1,0,0]=3 2463 B4R0.2 OC=CCCl MCULE-4750991393 [2,0,0,0,0,0|1,0,1]=4 2464 B4R0.2 OCCCBr MCULE-3450011527 [2,0,0,0,0,0|1,0,1]=4 2465 B4R0.2 OCCCCl MCULE-2319230957 [2,0,0,0,0,0|1,0,1]=4 2466 B4R0.2 OCCCF MCULE-2347934403 [2,0,0,0,0,0|1,0,1]=4 2467 B4R0.2 OCCCI MCULE-5200713967 [2,0,0,0,0,0|1,0,1]=4 2468 B4R0.2 OCCCO MCULE-5166824786 [2,0,0,0,0,0|1,0,1]=4 2469 B4R0.2 OCCCS MCULE-7930164048 [2,0,0,0,0,0|1,0,1]=4 2470 B4R0.2 [NH2+](CC)CC MCULE-1192179232 [2,0,0,0,0,0|1,0,1]=4 2471 B6R0.2 C=C(C)CC(=O)C MCULE-3534735279 [1,1,0,0,0,0|0,0,1]=3 2472 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [1,1,0,0,0,0|0,0,1]=3 2473 B6R0.2 C=C(C)CC(C)C MCULE-5553118538 [1,1,0,0,0,0|1,0,0]=3 2474 B6R0.2 C=C(C)C[C@@H](C)O MCULE-8518319636 [1,1,0,0,0,0|1,0,0]=3 2475 B6R0.2 C=C(C)C[C@H](C)O MCULE-7139115019 [1,1,0,0,0,0|1,0,0]=3 2476 B6R0.2 C=C(C)OC(=O)C MCULE-9345377025 [1,1,0,0,0,0|1,0,1]=4 2477 B6R0.2 C=C(I)CC(=O)O MCULE-3849925169 [1,1,0,0,0,0|0,0,2]=4 2478 B6R0.2 CC(=CC(=O)O)C MCULE-4772426340 [1,1,0,0,0,0|0,0,2]=4 2479 B6R0.2 CC(=CC(=O)O)Cl MCULE-7503760292 [1,1,0,0,0,0|0,0,2]=4 2480 B6R0.2 CC(=CC(=O)O)I MCULE-2652373771 [1,1,0,0,0,0|0,0,2]=4 2481 B6R0.2 CC(=CC(=O)O)N MCULE-5894724848 [1,1,0,0,0,0|0,0,2]=4 2482 B6R0.2 CC(=CC(C)C)C MCULE-5460531772 [1,1,0,0,0,0|1,0,1]=4 2483 B6R0.2 CC(=CC(C)O)C MCULE-5270694894 [1,1,0,0,0,0|1,0,1]=4 2484 B6R0.2 CC(=N)CC(=O)C MCULE-4678643052 [1,1,0,0,0,0|0,0,1]=3 2485 B6R0.2 CC(=NC(C)C)C MCULE-4174313497 [1,1,0,0,0,0|2,0,0]=4 2486 B6R0.2 CC(=O)/C=C(/C)\N MCULE-1235186190 [1,1,0,0,0,0|0,0,2]=4 2487 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-3445340105 [1,1,0,0,0,0|0,0,2]=4 2488 B6R0.2 CC(=O)/C=C(/C)\[O-] MCULE-7833799417 [1,1,0,0,0,0|0,0,2]=4 2489 B6R0.2 CC(=O)/C=C(\C)/N MCULE-6412393370 [1,1,0,0,0,0|0,0,2]=4 2490 B6R0.2 CC(=O)C=C(C)C MCULE-4922478422 [1,1,0,0,0,0|0,0,2]=4 2491 B6R0.2 CC(=O)C=C(C)N MCULE-2247743178 [1,1,0,0,0,0|0,0,2]=4 2492 B6R0.2 CC(=O)C=C(C)O MCULE-7345258397 [1,1,0,0,0,0|0,0,2]=4 2493 B6R0.2 CC(=O)C=C(C)[O-] MCULE-7733093724 [1,1,0,0,0,0|0,0,2]=4 2494 B6R0.2 CC(=O)CC(=O)C MCULE-6481204381 [1,1,0,0,0,0|0,0,1]=3 2495 B6R0.2 CC(=O)CC(=O)N MCULE-1618058771 [1,1,0,0,0,0|1,0,1]=4 2496 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [1,1,0,0,0,0|0,0,1]=3 2497 B6R0.2 CC(=O)CC(=O)[O-] MCULE-6317885864 [1,1,0,0,0,0|0,0,2]=4 2498 B6R0.2 CC(=O)CC(=O)[O-] MCULE-8448177875 [1,1,0,0,0,0|0,0,2]=4 2499 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [1,1,0,0,0,0|0,0,0]=2 2500 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [1,1,0,0,0,0|0,0,0]=2 2501 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [1,1,0,0,0,0|0,0,0]=2 2502 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [1,1,0,0,0,0|0,0,0]=2 2503 B6R0.2 CC(=O)CN(=O)=O MCULE-3153232896 [1,1,0,0,0,0|2,0,0]=4 2504 B6R0.2 CC(=O)CN(C)C MCULE-8561521241 [1,1,0,0,0,0|1,0,0]=3 2505 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [1,1,0,0,0,0|0,0,0]=2 2506 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [1,1,0,0,0,0|0,0,0]=2 2507 B6R0.2 CC(=O)NC(=O)C MCULE-3040534108 [1,1,0,0,0,0|1,0,1]=4 2508 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [1,1,0,0,0,0|1,0,0]=3 2509 B6R0.2 CC(=O)NN(C)C MCULE-3444969121 [1,1,0,0,0,0|2,0,0]=4 2510 B6R0.2 CC(=O)NN(C)C MCULE-5383938091 [1,1,0,0,0,0|2,0,0]=4 2511 B6R0.2 CC(=O)OC(=O)C MCULE-9184217748 [1,1,0,0,0,0|1,0,1]=4 2512 B6R0.2 CC(=O)OC(C)Br MCULE-6494616843 [1,1,0,0,0,0|1,0,0]=3 2513 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [1,1,0,0,0,0|1,0,0]=3 2514 B6R0.2 CC(=O)OC(C)Cl MCULE-3738479003 [1,1,0,0,0,0|1,0,0]=3 2515 B6R0.2 CC(=O)SC(=O)C MCULE-5749449964 [1,1,0,0,0,0|1,0,1]=4 2516 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-4855074933 [1,1,0,0,0,0|0,0,2]=4 2517 B6R0.2 CC(=O)[CH-]C(=O)C MCULE-6905854247 [1,1,0,0,0,0|0,0,2]=4 2518 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [1,1,0,0,0,0|0,0,0]=2 2519 B6R0.2 CC(Br)CC(=S)N MCULE-3013222937 [1,1,0,0,0,0|1,1,0]=4 2520 B6R0.2 CC(Br)CC(C)Br MCULE-1139583334 [1,1,0,0,0,0|1,0,1]=4 2521 B6R0.2 CC(C)CB(O)O MCULE-9748327681 [1,1,0,0,0,0|1,0,1]=4 2522 B6R0.2 CC(C)CC(=N)N MCULE-1578322850 [1,1,0,0,0,0|2,0,0]=4 2523 B6R0.2 CC(C)CC(=N)N MCULE-1643115412 [1,1,0,0,0,0|2,0,0]=4 2524 B6R0.2 CC(C)CC(=N)N MCULE-9650824038 [1,1,0,0,0,0|2,0,0]=4 2525 B6R0.2 CC(C)CC(=O)Cl MCULE-8821231794 [1,1,0,0,0,0|1,0,0]=3 2526 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [1,1,0,0,0,0|1,0,0]=3 2527 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [1,1,0,0,0,0|0,0,0]=2 2528 B6R0.2 CC(C)CC(=S)N MCULE-7704222819 [1,1,0,0,0,0|1,1,0]=4 2529 B6R0.2 CC(C)CC(C)Br MCULE-1549882864 [1,1,0,0,0,0|1,0,1]=4 2530 B6R0.2 CC(C)CC(C)C MCULE-1646863110 [1,1,0,0,0,0|1,0,1]=4 2531 B6R0.2 CC(C)CC(C)I MCULE-6965017338 [1,1,0,0,0,0|1,0,1]=4 2532 B6R0.2 CC(C)CC(C)N MCULE-1144229692 [1,1,0,0,0,0|1,0,1]=4 2533 B6R0.2 CC(C)CC(C)N MCULE-5992377656 [1,1,0,0,0,0|1,0,1]=4 2534 B6R0.2 CC(C)CC(C)O MCULE-9223768698 [1,1,0,0,0,0|0,0,2]=4 2535 B6R0.2 CC(C)CN(=O)=O MCULE-1357840093 [1,1,0,0,0,0|1,0,1]=4 2536 B6R0.2 CC(C)CS(=O)[O-] MCULE-3716652382 [1,1,0,0,0,0|1,0,1]=4 2537 B6R0.2 CC(C)CS(=O)[O-] MCULE-7111094918 [1,1,0,0,0,0|1,0,1]=4 2538 B6R0.2 CC(C)C[C@@H](C)N MCULE-5902933285 [1,1,0,0,0,0|1,0,1]=4 2539 B6R0.2 CC(C)C[C@@H](C)N MCULE-7208228535 [1,1,0,0,0,0|1,0,1]=4 2540 B6R0.2 CC(C)C[C@@H](C)O MCULE-3150675602 [1,1,0,0,0,0|0,0,2]=4 2541 B6R0.2 CC(C)C[C@@H](C)O MCULE-4011042896 [1,1,0,0,0,0|0,0,2]=4 2542 B6R0.2 CC(C)NC(=O)N MCULE-2725741897 [1,1,0,0,0,0|2,0,0]=4 2543 B6R0.2 CC(C)OC(=O)Cl MCULE-3303340398 [1,1,0,0,0,0|2,0,0]=4 2544 B6R0.2 CC(C)OC(=O)N MCULE-9996500963 [1,1,0,0,0,0|2,0,0]=4 2545 B6R0.2 CC(C)SC(=O)Cl MCULE-9803882280 [1,1,0,0,0,0|2,0,0]=4 2546 B6R0.2 CC(Cl)CC(=O)Cl MCULE-3323045052 [1,1,0,0,0,0|1,0,0]=3 2547 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [1,1,0,0,0,0|0,0,0]=2 2548 B6R0.2 CC(Cl)CN(C)C MCULE-6738916847 [1,1,0,0,0,0|2,0,0]=4 2549 B6R0.2 CC(Cl)CN(C)C MCULE-7074789151 [1,1,0,0,0,0|2,0,0]=4 2550 B6R0.2 CC(Cl)OC(=O)Cl MCULE-8020850544 [1,1,0,0,0,0|2,0,0]=4 2551 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [1,1,0,0,0,0|0,0,0]=2 2552 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [1,1,0,0,0,0|1,0,0]=3 2553 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [1,1,0,0,0,0|1,0,0]=3 2554 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [1,1,0,0,0,0|0,0,0]=2 2555 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [1,1,0,0,0,0|0,0,0]=2 2556 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [1,1,0,0,0,0|0,0,0]=2 2557 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [1,1,0,0,0,0|0,0,0]=2 2558 B6R0.2 CC(N)CC(C)O MCULE-7772080010 [1,1,0,0,0,0|0,0,2]=4 2559 B6R0.2 CC(N)CN(C)C MCULE-4834268309 [1,1,0,0,0,0|2,0,0]=4 2560 B6R0.2 CC(N)CN(C)C MCULE-9601630435 [1,1,0,0,0,0|2,0,0]=4 2561 B6R0.2 CC(N)CS(=O)C MCULE-1278482312 [1,1,0,0,0,0|1,0,0]=3 2562 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [1,1,0,0,0,0|1,0,0]=3 2563 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [1,1,0,0,0,0|0,0,0]=2 2564 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [1,1,0,0,0,0|0,0,0]=2 2565 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [1,1,0,0,0,0|0,0,1]=3 2566 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [1,1,0,0,0,0|0,0,1]=3 2567 B6R0.2 CC(O)CC(C)O MCULE-1652556328 [1,1,0,0,0,0|0,0,2]=4 2568 B6R0.2 CC(O)CN(=O)=O MCULE-1592317283 [1,1,0,0,0,0|1,0,1]=4 2569 B6R0.2 CC(O)CN(C)C MCULE-6531222530 [1,1,0,0,0,0|2,0,0]=4 2570 B6R0.2 CC(O)CN(C)C MCULE-7127620454 [1,1,0,0,0,0|2,0,0]=4 2571 B6R0.2 CC(O)CN(C)N MCULE-6197492770 [1,1,0,0,0,0|2,0,0]=4 2572 B6R0.2 CC(O)CS(=O)C MCULE-2365161952 [1,1,0,0,0,0|1,0,0]=3 2573 B6R0.2 CN(C)CC(=O)Cl MCULE-2168217529 [1,1,0,0,0,0|2,0,0]=4 2574 B6R0.2 CN(C)CC(=O)Cl MCULE-6810056185 [1,1,0,0,0,0|2,0,0]=4 2575 B6R0.2 CN(C)CC(=O)N MCULE-3894706713 [1,1,0,0,0,0|2,0,0]=4 2576 B6R0.2 CN(C)CC(=O)O MCULE-2303978039 [1,1,0,0,0,0|1,0,0]=3 2577 B6R0.2 CN(C)CC(=O)O MCULE-3368936600 [1,1,0,0,0,0|1,0,0]=3 2578 B6R0.2 CN(C)CC(=O)[O-] MCULE-3077067854 [1,1,0,0,0,0|1,0,1]=4 2579 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [1,1,0,0,0,0|0,0,0]=2 2580 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [1,1,0,0,0,0|0,0,0]=2 2581 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [1,1,0,0,0,0|0,0,0]=2 2582 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [1,1,0,0,0,0|0,0,0]=2 2583 B6R0.2 C[C@@H](N)CN(C)C MCULE-2034828409 [1,1,0,0,0,0|2,0,0]=4 2584 B6R0.2 C[C@@H](N)CN(C)C MCULE-2147556460 [1,1,0,0,0,0|2,0,0]=4 2585 B6R0.2 C[C@@H](N)CN(C)C MCULE-6097836560 [1,1,0,0,0,0|2,0,0]=4 2586 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [1,1,0,0,0,0|0,0,0]=2 2587 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [1,1,0,0,0,0|0,0,0]=2 2588 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [1,1,0,0,0,0|0,0,1]=3 2589 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [1,1,0,0,0,0|0,0,1]=3 2590 B6R0.2 C[C@@H](O)CN(C)C MCULE-3114172439 [1,1,0,0,0,0|2,0,0]=4 2591 B6R0.2 C[C@@H](O)CN(C)C MCULE-9927679143 [1,1,0,0,0,0|2,0,0]=4 2592 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-3504626196 [1,1,0,0,0,0|0,0,2]=4 2593 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-4671148975 [1,1,0,0,0,0|0,0,2]=4 2594 B6R0.2 C[C@@H](O)C[C@@H](C)O MCULE-8345849773 [1,1,0,0,0,0|0,0,2]=4 2595 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [1,1,0,0,0,0|0,0,0]=2 2596 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [1,1,0,0,0,0|0,0,0]=2 2597 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [1,1,0,0,0,0|0,0,0]=2 2598 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [1,1,0,0,0,0|0,0,0]=2 2599 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [1,1,0,0,0,0|0,0,0]=2 2600 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [1,1,0,0,0,0|0,0,0]=2 2601 B6R0.2 C[C@H](N)CN(C)C MCULE-2526118342 [1,1,0,0,0,0|2,0,0]=4 2602 B6R0.2 C[C@H](N)CN(C)C MCULE-3902055308 [1,1,0,0,0,0|2,0,0]=4 2603 B6R0.2 C[C@H](N)CN(C)C MCULE-4292583182 [1,1,0,0,0,0|2,0,0]=4 2604 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [1,1,0,0,0,0|0,0,0]=2 2605 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [1,1,0,0,0,0|0,0,0]=2 2606 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [1,1,0,0,0,0|0,0,1]=3 2607 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [1,1,0,0,0,0|0,0,1]=3 2608 B6R0.2 C[C@H](O)CN(C)C MCULE-4542650002 [1,1,0,0,0,0|2,0,0]=4 2609 B6R0.2 C[C@H](O)CN(C)C MCULE-4717676519 [1,1,0,0,0,0|2,0,0]=4 2610 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-1267135444 [1,1,0,0,0,0|0,0,2]=4 2611 B6R0.2 C[C@H](O)C[C@H](C)O MCULE-5878966333 [1,1,0,0,0,0|0,0,2]=4 2612 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-1975585935 [1,1,0,0,0,0|1,0,1]=4 2613 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-7679949306 [1,1,0,0,0,0|1,0,1]=4 2614 B6R0.2 NC(=O)CC(=O)O MCULE-1168254626 [1,1,0,0,0,0|1,0,1]=4 2615 B6R0.2 NC(F)CC(=O)O MCULE-1563194776 [1,1,0,0,0,0|1,0,0]=3 2616 B6R0.2 NC(F)CC(=O)O MCULE-1655564430 [1,1,0,0,0,0|1,0,0]=3 2617 B6R0.2 O=C(O)CB(O)O MCULE-6408403753 [1,1,0,0,0,0|2,0,0]=4 2618 B6R0.2 O=C(O)CC(=O)O MCULE-5893043131 [1,1,0,0,0,0|1,0,1]=4 2619 B6R0.2 O=C(O)CC(F)F MCULE-9388620099 [1,1,0,0,0,0|1,0,0]=3 2620 B6R0.2 O=C(O)CN(=O)=O MCULE-4962751453 [1,1,0,0,0,0|2,0,0]=4 2621 B6R0.3 C#CC(O)C(=O)O MCULE-4214673632 [1,1,0,0,0,0|0,0,2]=4 2622 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [1,1,0,0,0,0|1,0,0]=3 2623 B6R0.3 C(N)(CO)C(=O)N MCULE-5512645571 [1,1,0,0,0,0|2,0,0]=4 2624 B6R0.3 C(N)(CO)C(=O)N MCULE-5852943337 [1,1,0,0,0,0|2,0,0]=4 2625 B6R0.3 C/C=C(/C)\C(=O)O MCULE-2116066534 [1,1,0,0,0,0|0,0,2]=4 2626 B6R0.3 C/C=C(\Br)/C(=O)O MCULE-5940308548 [1,1,0,0,0,0|0,0,2]=4 2627 B6R0.3 C/C=C(\C)/C(=O)O MCULE-4890719796 [1,1,0,0,0,0|0,0,2]=4 2628 B6R0.3 C/C=C(\O)/C(=O)O MCULE-9596699660 [1,1,0,0,0,0|0,0,2]=4 2629 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [1,1,0,0,0,0|1,0,0]=3 2630 B6R0.3 C=C(CBr)C(=O)O MCULE-7257367588 [1,1,0,0,0,0|1,0,1]=4 2631 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [1,1,0,0,0,0|0,0,1]=3 2632 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [1,1,0,0,0,0|1,0,1]=4 2633 B6R0.3 C=C(OC)C(=O)O MCULE-9965334560 [1,1,0,0,0,0|1,0,1]=4 2634 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [1,1,0,0,0,0|0,0,2]=4 2635 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [1,1,0,0,0,0|0,0,2]=4 2636 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [1,1,0,0,0,0|0,0,2]=4 2637 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [1,1,0,0,0,0|0,0,2]=4 2638 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [1,1,0,0,0,0|0,0,2]=4 2639 B6R0.3 C=CC(O)C(=O)O MCULE-3847595710 [1,1,0,0,0,0|0,0,2]=4 2640 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [1,1,0,0,0,0|0,0,2]=4 2641 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [1,1,0,0,0,0|0,0,2]=4 2642 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [1,1,0,0,0,0|0,0,2]=4 2643 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [1,1,0,0,0,0|0,0,2]=4 2644 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [1,1,0,0,0,0|0,0,2]=4 2645 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [1,1,0,0,0,0|0,0,2]=4 2646 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [1,1,0,0,0,0|0,0,2]=4 2647 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [1,1,0,0,0,0|0,0,2]=4 2648 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [1,1,0,0,0,0|0,0,2]=4 2649 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [1,1,0,0,0,0|0,0,2]=4 2650 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [1,1,0,0,0,0|0,0,2]=4 2651 B6R0.3 CC(=O)C(=O)CBr MCULE-8560925164 [1,1,0,0,0,0|1,0,1]=4 2652 B6R0.3 CC(=O)C(=O)CCl MCULE-2778551811 [1,1,0,0,0,0|1,0,1]=4 2653 B6R0.3 CC(=O)C(Br)C=O MCULE-6904531970 [1,1,0,0,0,0|1,0,1]=4 2654 B6R0.3 CC(=O)C(C)C#N MCULE-3849364002 [1,1,0,0,0,0|1,0,1]=4 2655 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [1,1,0,0,0,0|1,0,1]=4 2656 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [1,1,0,0,0,0|1,0,0]=3 2657 B6R0.3 CC(=O)C(Cl)C#N MCULE-7984925847 [1,1,0,0,0,0|1,0,1]=4 2658 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [1,1,0,0,0,0|1,0,0]=3 2659 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [1,1,0,0,0,0|1,0,0]=3 2660 B6R0.3 CC(C#N)C(=O)O MCULE-3302580561 [1,1,0,0,0,0|1,0,1]=4 2661 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [1,1,0,0,0,0|1,0,0]=3 2662 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [1,1,0,0,0,0|1,0,0]=3 2663 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [1,1,0,0,0,0|1,0,0]=3 2664 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [1,1,0,0,0,0|1,0,0]=3 2665 B6R0.3 CC(CN)S(=O)C MCULE-9048112625 [1,1,0,0,0,0|2,0,0]=4 2666 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [1,1,0,0,0,0|1,0,0]=3 2667 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [1,1,0,0,0,0|1,0,1]=4 2668 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [1,1,0,0,0,0|1,0,0]=3 2669 B6R0.3 CC(ON)C(=O)O MCULE-1969235976 [1,1,0,0,0,0|2,0,0]=4 2670 B6R0.3 CC(ON)C(=O)O MCULE-4318537884 [1,1,0,0,0,0|2,0,0]=4 2671 B6R0.3 CC(ON)C(=O)O MCULE-4455753863 [1,1,0,0,0,0|2,0,0]=4 2672 B6R0.3 CC(ON)C(=O)O MCULE-8893009712 [1,1,0,0,0,0|2,0,0]=4 2673 B6R0.3 CC=C(Br)C(=O)O MCULE-5368794596 [1,1,0,0,0,0|0,0,2]=4 2674 B6R0.3 CC=C(C)C(=O)C MCULE-8950290711 [1,1,0,0,0,0|0,0,2]=4 2675 B6R0.3 CC=C(C)C(=O)O MCULE-2390677360 [1,1,0,0,0,0|0,0,2]=4 2676 B6R0.3 CC=C(Cl)C(=O)O MCULE-5827690088 [1,1,0,0,0,0|0,0,2]=4 2677 B6R0.3 CC=C(F)C(=O)O MCULE-5053310707 [1,1,0,0,0,0|0,0,2]=4 2678 B6R0.3 CC=C(O)C(=O)O MCULE-7886990963 [1,1,0,0,0,0|0,0,2]=4 2679 B6R0.3 CCC(=C(C)C)C MCULE-7258057243 [1,1,0,0,0,0|1,0,1]=4 2680 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [1,1,0,0,0,0|0,0,1]=3 2681 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [1,1,0,0,0,0|0,0,1]=3 2682 B6R0.3 CCC(=O)C(=O)[O-] MCULE-7571698792 [1,1,0,0,0,0|0,0,2]=4 2683 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [1,1,0,0,0,0|1,0,0]=3 2684 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [1,1,0,0,0,0|0,0,0]=2 2685 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [1,1,0,0,0,0|1,0,0]=3 2686 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [1,1,0,0,0,0|1,0,0]=3 2687 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [1,1,0,0,0,0|0,0,0]=2 2688 B6R0.3 CCC(C)B(O)O MCULE-7544159454 [1,1,0,0,0,0|1,0,1]=4 2689 B6R0.3 CCC(C)C(=N)N MCULE-4070060089 [1,1,0,0,0,0|2,0,0]=4 2690 B6R0.3 CCC(C)C(=N)N MCULE-7020524406 [1,1,0,0,0,0|2,0,0]=4 2691 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [1,1,0,0,0,0|0,0,0]=2 2692 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [1,1,0,0,0,0|1,0,0]=3 2693 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [1,1,0,0,0,0|1,0,0]=3 2694 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [1,1,0,0,0,0|0,0,0]=2 2695 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [1,1,0,0,0,0|0,0,0]=2 2696 B6R0.3 CCC(C)C(=S)N MCULE-9682279721 [1,1,0,0,0,0|1,1,0]=4 2697 B6R0.3 CCC(C)C(C)Br MCULE-5368409335 [1,1,0,0,0,0|1,0,1]=4 2698 B6R0.3 CCC(C)C(C)C MCULE-9189749509 [1,1,0,0,0,0|1,0,1]=4 2699 B6R0.3 CCC(C)C(C)Cl MCULE-2663176330 [1,1,0,0,0,0|1,0,1]=4 2700 B6R0.3 CCC(C)C(C)N MCULE-1056466337 [1,1,0,0,0,0|1,0,1]=4 2701 B6R0.3 CCC(C)C(C)N MCULE-1503543126 [1,1,0,0,0,0|1,0,1]=4 2702 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [1,1,0,0,0,0|0,0,2]=4 2703 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [1,1,0,0,0,0|1,0,0]=3 2704 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [1,1,0,0,0,0|1,0,0]=3 2705 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [1,1,0,0,0,0|0,0,0]=2 2706 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [1,1,0,0,0,0|0,0,0]=2 2707 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [1,1,0,0,0,0|1,0,0]=3 2708 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [1,1,0,0,0,0|1,0,0]=3 2709 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [1,1,0,0,0,0|1,0,0]=3 2710 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [1,1,0,0,0,0|1,0,0]=3 2711 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [1,1,0,0,0,0|0,0,0]=2 2712 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [1,1,0,0,0,0|0,0,0]=2 2713 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [1,1,0,0,0,0|0,0,0]=2 2714 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [1,1,0,0,0,0|0,0,0]=2 2715 B6R0.3 CCC(N)C(C)C MCULE-3624338196 [1,1,0,0,0,0|1,0,1]=4 2716 B6R0.3 CCC(N)C(C)C MCULE-4491326477 [1,1,0,0,0,0|1,0,1]=4 2717 B6R0.3 CCC(N)C(C)O MCULE-2752432664 [1,1,0,0,0,0|0,0,2]=4 2718 B6R0.3 CCC(N)C(C)O MCULE-6087590428 [1,1,0,0,0,0|0,0,2]=4 2719 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [1,1,0,0,0,0|1,0,0]=3 2720 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [1,1,0,0,0,0|0,0,0]=2 2721 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [1,1,0,0,0,0|0,0,0]=2 2722 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [1,1,0,0,0,0|0,0,1]=3 2723 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [1,1,0,0,0,0|0,0,1]=3 2724 B6R0.3 CCC(O)C(C)C MCULE-1130775455 [1,1,0,0,0,0|1,0,1]=4 2725 B6R0.3 CCC(O)C(C)N MCULE-4027170059 [1,1,0,0,0,0|1,0,1]=4 2726 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [1,1,0,0,0,0|0,0,2]=4 2727 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [1,1,0,0,0,0|0,0,0]=2 2728 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [1,1,0,0,0,0|0,0,0]=2 2729 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [1,1,0,0,0,0|1,0,0]=3 2730 B6R0.3 CCN(C)C(=O)Cl MCULE-3697487267 [1,1,0,0,0,0|2,0,0]=4 2731 B6R0.3 CCN(N)C(=O)N MCULE-8674876262 [1,1,0,0,0,0|2,0,0]=4 2732 B6R0.3 CCN(O)C(=O)C MCULE-8547381969 [1,1,0,0,0,0|1,0,0]=3 2733 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [1,1,0,0,0,0|0,0,0]=2 2734 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [1,1,0,0,0,0|0,0,0]=2 2735 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [1,1,0,0,0,0|1,0,0]=3 2736 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [1,1,0,0,0,0|1,0,0]=3 2737 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [1,1,0,0,0,0|0,0,0]=2 2738 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [1,1,0,0,0,0|0,0,0]=2 2739 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [1,1,0,0,0,0|0,0,0]=2 2740 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [1,1,0,0,0,0|0,0,0]=2 2741 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [1,1,0,0,0,0|1,0,0]=3 2742 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [1,1,0,0,0,0|1,0,0]=3 2743 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [1,1,0,0,0,0|1,0,0]=3 2744 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [1,1,0,0,0,0|1,0,0]=3 2745 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [1,1,0,0,0,0|0,0,0]=2 2746 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [1,1,0,0,0,0|0,0,0]=2 2747 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [1,1,0,0,0,0|0,0,0]=2 2748 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [1,1,0,0,0,0|0,0,0]=2 2749 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-8294520512 [1,1,0,0,0,0|0,0,2]=4 2750 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-9521001934 [1,1,0,0,0,0|0,0,2]=4 2751 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [1,1,0,0,0,0|0,0,0]=2 2752 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [1,1,0,0,0,0|0,0,0]=2 2753 B6R0.3 CC[C@@H](O)C(C)C MCULE-3684327261 [1,1,0,0,0,0|1,0,1]=4 2754 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [1,1,0,0,0,0|0,0,0]=2 2755 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [1,1,0,0,0,0|0,0,0]=2 2756 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [1,1,0,0,0,0|0,0,0]=2 2757 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [1,1,0,0,0,0|0,0,0]=2 2758 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [1,1,0,0,0,0|0,0,0]=2 2759 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [1,1,0,0,0,0|1,0,0]=3 2760 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [1,1,0,0,0,0|1,0,0]=3 2761 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [1,1,0,0,0,0|1,0,0]=3 2762 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [1,1,0,0,0,0|1,0,0]=3 2763 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [1,1,0,0,0,0|0,0,0]=2 2764 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [1,1,0,0,0,0|0,0,0]=2 2765 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [1,1,0,0,0,0|0,0,0]=2 2766 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [1,1,0,0,0,0|0,0,0]=2 2767 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [1,1,0,0,0,0|0,1,0]=3 2768 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [1,1,0,0,0,0|0,1,0]=3 2769 B6R0.3 CC[C@H](N)C(C)C MCULE-3200638239 [1,1,0,0,0,0|1,0,1]=4 2770 B6R0.3 CC[C@H](N)C(C)C MCULE-4973720203 [1,1,0,0,0,0|1,0,1]=4 2771 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-1930738992 [1,1,0,0,0,0|0,0,2]=4 2772 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-4226147180 [1,1,0,0,0,0|0,0,2]=4 2773 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-7445496718 [1,1,0,0,0,0|0,0,2]=4 2774 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-9770959398 [1,1,0,0,0,0|0,0,2]=4 2775 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-3878355824 [1,1,0,0,0,0|0,0,2]=4 2776 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-4791160457 [1,1,0,0,0,0|0,0,2]=4 2777 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [1,1,0,0,0,0|0,0,0]=2 2778 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [1,1,0,0,0,0|0,0,0]=2 2779 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [1,1,0,0,0,0|0,0,1]=3 2780 B6R0.3 CC[C@H](O)C(C)C MCULE-9659963395 [1,1,0,0,0,0|1,0,1]=4 2781 B6R0.3 CNC(=O)C(=O)O MCULE-5436132271 [1,1,0,0,0,0|1,0,1]=4 2782 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [1,1,0,0,0,0|2,0,0]=4 2783 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [1,1,0,0,0,0|2,0,0]=4 2784 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [1,1,0,0,0,0|1,0,0]=3 2785 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [1,1,0,0,0,0|1,0,0]=3 2786 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [1,1,0,0,0,0|1,0,0]=3 2787 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [1,1,0,0,0,0|2,0,0]=4 2788 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [1,1,0,0,0,0|1,0,0]=3 2789 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [1,1,0,0,0,0|1,0,0]=3 2790 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [1,1,0,0,0,0|1,0,0]=3 2791 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [1,1,0,0,0,0|1,0,0]=3 2792 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [1,1,0,0,0,0|1,0,0]=3 2793 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [1,1,0,0,0,0|1,0,0]=3 2794 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [1,1,0,0,0,0|1,0,0]=3 2795 B6R0.3 COC(=O)C(=O)C MCULE-5423483210 [1,1,0,0,0,0|1,0,1]=4 2796 B6R0.3 COC(=O)C(=O)O MCULE-8527842270 [1,1,0,0,0,0|1,0,1]=4 2797 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [1,1,0,0,0,0|1,0,0]=3 2798 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [1,1,0,0,0,0|1,0,0]=3 2799 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [1,1,0,0,0,0|1,0,0]=3 2800 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [1,1,0,0,0,0|2,0,0]=4 2801 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [1,1,0,0,0,0|1,0,0]=3 2802 B6R0.3 CON(C)C(=O)C MCULE-8559238750 [1,1,0,0,0,0|2,0,0]=4 2803 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [1,1,0,0,0,0|2,0,0]=4 2804 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [1,1,0,0,0,0|1,0,0]=3 2805 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [1,1,0,0,0,0|1,0,0]=3 2806 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [1,1,0,0,0,0|1,0,0]=3 2807 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [1,1,0,0,0,0|1,0,0]=3 2808 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [1,1,0,0,0,0|1,0,0]=3 2809 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [1,1,0,0,0,0|1,0,0]=3 2810 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [1,1,0,0,0,0|1,0,0]=3 2811 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [1,1,0,0,0,0|1,0,0]=3 2812 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [1,1,0,0,0,0|1,0,0]=3 2813 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [1,1,0,0,0,0|1,0,0]=3 2814 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [1,1,0,0,0,0|1,0,0]=3 2815 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [1,1,0,0,0,0|1,0,0]=3 2816 B6R0.3 C[C@@H](ON)C(=O)O MCULE-1538722507 [1,1,0,0,0,0|2,0,0]=4 2817 B6R0.3 C[C@@H](ON)C(=O)O MCULE-3835402446 [1,1,0,0,0,0|2,0,0]=4 2818 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [1,1,0,0,0,0|1,0,0]=3 2819 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [1,1,0,0,0,0|1,0,0]=3 2820 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [1,1,0,0,0,0|1,0,0]=3 2821 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [1,1,0,0,0,0|1,0,0]=3 2822 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [1,1,0,0,0,0|1,0,0]=3 2823 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [1,1,0,0,0,0|1,0,0]=3 2824 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [1,1,0,0,0,0|1,0,1]=4 2825 B6R0.3 C[C@H](ON)C(=O)O MCULE-3327889540 [1,1,0,0,0,0|2,0,0]=4 2826 B6R0.3 C[C@H](ON)C(=O)O MCULE-4523264650 [1,1,0,0,0,0|2,0,0]=4 2827 B6R0.3 NC(=O)C(Br)CBr MCULE-3438242131 [1,1,0,0,0,0|2,0,0]=4 2828 B6R0.3 NC(=O)C(Cl)CCl MCULE-9549750186 [1,1,0,0,0,0|2,0,0]=4 2829 B6R0.3 NC(=O)C(N)CO MCULE-4842751232 [1,1,0,0,0,0|2,0,0]=4 2830 B6R0.3 NC(=O)C(N)CO MCULE-6854366147 [1,1,0,0,0,0|2,0,0]=4 2831 B6R0.3 NC(=O)C(N)CS MCULE-3144051628 [1,1,0,0,0,0|2,0,0]=4 2832 B6R0.3 NC(=O)C(N)CS MCULE-7739536595 [1,1,0,0,0,0|2,0,0]=4 2833 B6R0.3 NC(=O)[C@@H](N)CO MCULE-2185844038 [1,1,0,0,0,0|2,0,0]=4 2834 B6R0.3 NC(=O)[C@@H](N)CO MCULE-3623516041 [1,1,0,0,0,0|2,0,0]=4 2835 B6R0.3 NC(=O)[C@@H](N)CO MCULE-6218638108 [1,1,0,0,0,0|2,0,0]=4 2836 B6R0.3 NC(=O)[C@@H](N)CS MCULE-9790378691 [1,1,0,0,0,0|2,0,0]=4 2837 B6R0.3 NC(=O)[C@H](N)CO MCULE-2061645482 [1,1,0,0,0,0|2,0,0]=4 2838 B6R0.3 NC(=O)[C@H](N)CO MCULE-5920366137 [1,1,0,0,0,0|2,0,0]=4 2839 B6R0.3 NC(=O)[C@H](N)CO MCULE-7612340519 [1,1,0,0,0,0|2,0,0]=4 2840 B6R0.3 NC(=O)[C@H](N)CO MCULE-7734326153 [1,1,0,0,0,0|2,0,0]=4 2841 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [1,1,0,0,0,0|1,0,0]=3 2842 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [1,1,0,0,0,0|1,0,0]=3 2843 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [1,1,0,0,0,0|1,0,0]=3 2844 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [1,1,0,0,0,0|1,0,0]=3 2845 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [1,1,0,0,0,0|1,0,0]=3 2846 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [1,1,0,0,0,0|1,0,0]=3 2847 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [1,1,0,0,0,0|1,0,0]=3 2848 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [1,1,0,0,0,0|1,0,0]=3 2849 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [1,1,0,0,0,0|1,0,0]=3 2850 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [1,1,0,0,0,0|1,0,0]=3 2851 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [1,1,0,0,0,0|1,0,0]=3 2852 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [1,1,0,0,0,0|1,0,0]=3 2853 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [1,1,0,0,0,0|1,0,0]=3 2854 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [1,1,0,0,0,0|1,0,0]=3 2855 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [1,1,0,0,0,0|1,0,0]=3 2856 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [1,1,0,0,0,0|1,0,0]=3 2857 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [1,1,0,0,0,0|1,0,0]=3 2858 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [1,1,0,0,0,0|1,0,0]=3 2859 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [1,1,0,0,0,0|1,0,0]=3 2860 B6R0.3 NCC(O)C(=O)N MCULE-1543465850 [1,1,0,0,0,0|2,0,0]=4 2861 B6R0.3 NCC(O)C(=O)N MCULE-9574499203 [1,1,0,0,0,0|2,0,0]=4 2862 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [1,1,0,0,0,0|1,0,0]=3 2863 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [1,1,0,0,0,0|1,0,0]=3 2864 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [1,1,0,0,0,0|1,0,0]=3 2865 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [1,1,0,0,0,0|1,0,0]=3 2866 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [1,1,0,0,0,0|1,0,0]=3 2867 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [1,1,0,0,0,0|1,0,0]=3 2868 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [1,1,0,0,0,0|1,0,0]=3 2869 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [1,1,0,0,0,0|1,0,0]=3 2870 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [1,1,0,0,0,0|1,0,0]=3 2871 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [1,1,0,0,0,0|1,0,0]=3 2872 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [1,1,0,0,0,0|1,0,0]=3 2873 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [1,1,0,0,0,0|1,0,0]=3 2874 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [1,1,0,0,0,0|1,0,0]=3 2875 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [1,1,0,0,0,0|1,0,0]=3 2876 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [1,1,0,0,0,0|1,0,0]=3 2877 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [1,1,0,0,0,0|1,0,0]=3 2878 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [1,1,0,0,0,0|1,0,0]=3 2879 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [1,1,0,0,0,0|1,0,0]=3 2880 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [1,1,0,0,0,0|1,0,0]=3 2881 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [1,1,0,0,0,0|1,0,0]=3 2882 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [1,1,0,0,0,0|1,0,0]=3 2883 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [1,1,0,0,0,0|1,0,0]=3 2884 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [1,1,0,0,0,0|1,0,0]=3 2885 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [1,1,0,0,0,0|1,0,0]=3 2886 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [1,1,0,0,0,0|1,0,0]=3 2887 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [1,1,0,0,0,0|1,0,0]=3 2888 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [1,1,0,0,0,0|1,0,0]=3 2889 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [1,1,0,0,0,0|1,0,0]=3 2890 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [1,1,0,0,0,0|1,0,0]=3 2891 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [1,1,0,0,0,0|1,0,0]=3 2892 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [1,1,0,0,0,0|1,0,0]=3 2893 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [1,1,0,0,0,0|1,0,0]=3 2894 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [1,1,0,0,0,0|1,0,0]=3 2895 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [1,1,0,0,0,0|1,0,0]=3 2896 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [1,1,0,0,0,0|1,0,0]=3 2897 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [1,1,0,0,0,0|1,0,0]=3 2898 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [1,1,0,0,0,0|1,0,0]=3 2899 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [1,1,0,0,0,0|1,0,0]=3 2900 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [1,1,0,0,0,0|1,0,0]=3 2901 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [1,1,0,0,0,0|1,0,0]=3 2902 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [1,1,0,0,0,0|1,0,0]=3 2903 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [1,1,0,0,0,0|1,0,0]=3 2904 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [1,1,0,0,0,0|1,0,0]=3 2905 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [1,1,0,0,0,0|1,0,0]=3 2906 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [1,1,0,0,0,0|1,0,0]=3 2907 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [1,1,0,0,0,0|1,0,0]=3 2908 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [1,1,0,0,0,0|1,0,0]=3 2909 B6R0.3 O=C(Cl)C(Br)CBr MCULE-8490174834 [1,1,0,0,0,0|2,0,0]=4 2910 B6R0.3 O=C(Cl)C(Cl)CCl MCULE-5571003994 [1,1,0,0,0,0|2,0,0]=4 2911 B6R0.3 O=C(O)C(=O)CBr MCULE-4768170572 [1,1,0,0,0,0|1,0,1]=4 2912 B6R0.3 O=C(O)C(=O)CCl MCULE-7853426045 [1,1,0,0,0,0|1,0,1]=4 2913 B6R0.3 O=C(O)C(=O)CF MCULE-5884987827 [1,1,0,0,0,0|1,0,1]=4 2914 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [1,1,0,0,0,0|1,0,1]=4 2915 B6R0.3 O=C(O)C(=O)CS MCULE-7466669113 [1,1,0,0,0,0|1,0,1]=4 2916 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [1,1,0,0,0,0|1,0,0]=3 2917 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [1,1,0,0,0,0|1,0,0]=3 2918 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [1,1,0,0,0,0|1,0,0]=3 2919 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [1,1,0,0,0,0|1,0,0]=3 2920 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [1,1,0,0,0,0|1,0,0]=3 2921 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [1,1,0,0,0,0|1,0,0]=3 2922 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [1,1,0,0,0,0|1,0,0]=3 2923 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [1,1,0,0,0,0|1,0,0]=3 2924 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [1,1,0,0,0,0|1,0,0]=3 2925 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [1,1,0,0,0,0|1,0,0]=3 2926 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [1,1,0,0,0,0|1,0,0]=3 2927 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [1,1,0,0,0,0|1,0,0]=3 2928 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [1,1,0,0,0,0|1,0,0]=3 2929 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [1,1,0,0,0,0|1,0,0]=3 2930 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [1,1,0,0,0,0|1,0,0]=3 2931 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [1,1,0,0,0,0|1,0,0]=3 2932 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [1,1,0,0,0,0|1,0,0]=3 2933 B6R0.3 O=C([O-])[C@@H](O)CO MCULE-4498291090 [1,1,0,0,0,0|1,0,1]=4 2934 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [1,1,0,0,0,0|0,0,2]=4 2935 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [1,1,0,0,0,0|1,0,0]=3 2936 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [1,1,0,0,0,0|1,0,0]=3 2937 B6R0.3 [C@H](N)(CO)C(=O)N MCULE-2792784400 [1,1,0,0,0,0|2,0,0]=4 2938 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [1,1,0,0,0,0|0,0,0]=2 2939 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [1,1,0,0,0,0|1,0,0]=3 2940 B6R0.4 C#CCCC(=O)C MCULE-8723638688 [1,1,0,0,0,0|0,0,1]=3 2941 B6R0.4 C#CCCC(=O)Cl MCULE-5720262741 [1,1,0,0,0,0|1,0,1]=4 2942 B6R0.4 C#CCCC(=O)N MCULE-4490482235 [1,1,0,0,0,0|1,0,1]=4 2943 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [1,1,0,0,0,0|0,0,1]=3 2944 B6R0.4 C#CCCC(=O)[O-] MCULE-2972869840 [1,1,0,0,0,0|0,0,2]=4 2945 B6R0.4 C#CCNC(=O)C MCULE-1159984782 [1,1,0,0,0,0|0,0,2]=4 2946 B6R0.4 C#CCOC(=O)C MCULE-5002994323 [1,1,0,0,0,0|0,0,2]=4 2947 B6R0.4 C/C=C/CC(=O)Cl MCULE-5377125313 [1,1,0,0,0,0|1,0,1]=4 2948 B6R0.4 C/C=C/CC(=O)N MCULE-1942934157 [1,1,0,0,0,0|1,0,1]=4 2949 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [1,1,0,0,0,0|0,0,1]=3 2950 B6R0.4 C=C(C)CCC#N MCULE-9953519474 [1,1,0,0,0,0|1,0,1]=4 2951 B6R0.4 C=C(C)CCCBr MCULE-5063918467 [1,1,0,0,0,0|1,0,0]=3 2952 B6R0.4 C=C(C)CCCC MCULE-1010177756 [1,1,0,0,0,0|1,0,0]=3 2953 B6R0.4 C=C(C)CCCO MCULE-4629274490 [1,1,0,0,0,0|1,0,0]=3 2954 B6R0.4 C=C(C)CNCC MCULE-2237759977 [1,1,0,0,0,0|1,0,0]=3 2955 B6R0.4 C=C(Cl)CCCCl MCULE-5713882356 [1,1,0,0,0,0|1,0,1]=4 2956 B6R0.4 C=C(F)CCCO MCULE-1688645687 [1,1,0,0,0,0|1,0,1]=4 2957 B6R0.4 C=C=CCC(=O)O MCULE-2611659307 [1,1,0,0,0,0|0,0,2]=4 2958 B6R0.4 C=CCCC(=C)C MCULE-2323382963 [1,1,0,0,0,0|1,0,1]=4 2959 B6R0.4 C=CCCC(=O)C MCULE-9598399930 [1,1,0,0,0,0|0,0,1]=3 2960 B6R0.4 C=CCCC(=O)Cl MCULE-7378353157 [1,1,0,0,0,0|1,0,1]=4 2961 B6R0.4 C=CCCC(=O)N MCULE-7202462484 [1,1,0,0,0,0|1,0,1]=4 2962 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [1,1,0,0,0,0|0,0,1]=3 2963 B6R0.4 C=CCNC(=O)C MCULE-7903624915 [1,1,0,0,0,0|0,0,2]=4 2964 B6R0.4 C=CCOC(=O)C MCULE-9991130828 [1,1,0,0,0,0|0,0,2]=4 2965 B6R0.4 C=CNCC(=O)O MCULE-5142273921 [1,1,0,0,0,0|0,0,2]=4 2966 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [1,1,0,0,0,0|0,0,1]=3 2967 B6R0.4 CC(=CCCBr)C MCULE-9403575147 [1,1,0,0,0,0|1,0,1]=4 2968 B6R0.4 CC(=CCCN)C MCULE-9185531904 [1,1,0,0,0,0|1,0,1]=4 2969 B6R0.4 CC(=CCCO)C MCULE-2493404466 [1,1,0,0,0,0|1,0,1]=4 2970 B6R0.4 CC(=CCCO)C MCULE-8497528596 [1,1,0,0,0,0|1,0,1]=4 2971 B6R0.4 CC(=O)CCC#N MCULE-6810756363 [1,1,0,0,0,0|0,0,1]=3 2972 B6R0.4 CC(=O)CCC=O MCULE-4767690464 [1,1,0,0,0,0|0,0,1]=3 2973 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [1,1,0,0,0,0|0,0,0]=2 2974 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [1,1,0,0,0,0|0,0,0]=2 2975 B6R0.4 CC(=O)CCCO MCULE-1335342150 [1,1,0,0,0,0|0,0,0]=2 2976 B6R0.4 CC(=O)CSC#N MCULE-5774397655 [1,1,0,0,0,0|1,0,1]=4 2977 B6R0.4 CC(=O)NCC#N MCULE-2345227602 [1,1,0,0,0,0|1,0,1]=4 2978 B6R0.4 CC(=O)NCCCl MCULE-7865062188 [1,1,0,0,0,0|1,0,0]=3 2979 B6R0.4 CC(=O)NCCN MCULE-2230084818 [1,1,0,0,0,0|1,0,0]=3 2980 B6R0.4 CC(=O)NCCO MCULE-5968518415 [1,1,0,0,0,0|1,0,0]=3 2981 B6R0.4 CC(=O)NCCS MCULE-3345813615 [1,1,0,0,0,0|1,0,0]=3 2982 B6R0.4 CC(=O)OCC#N MCULE-4866082576 [1,1,0,0,0,0|1,0,1]=4 2983 B6R0.4 CC(=O)OCCBr MCULE-3760449773 [1,1,0,0,0,0|1,0,0]=3 2984 B6R0.4 CC(=O)OCCCl MCULE-4570139017 [1,1,0,0,0,0|1,0,0]=3 2985 B6R0.4 CC(=O)OCCN MCULE-4530529900 [1,1,0,0,0,0|1,0,0]=3 2986 B6R0.4 CC(=O)OCCN MCULE-6854340494 [1,1,0,0,0,0|1,0,0]=3 2987 B6R0.4 CC(=O)OCCO MCULE-1251660436 [1,1,0,0,0,0|1,0,0]=3 2988 B6R0.4 CC(=O)SCC#N MCULE-5864559051 [1,1,0,0,0,0|1,0,1]=4 2989 B6R0.4 CC(=O)SCCBr MCULE-1786480878 [1,1,0,0,0,0|1,0,0]=3 2990 B6R0.4 CC(=O)SCCN MCULE-3819903256 [1,1,0,0,0,0|1,0,0]=3 2991 B6R0.4 CC(=O)SCCN MCULE-4872130470 [1,1,0,0,0,0|1,0,0]=3 2992 B6R0.4 CC(=O)SCCN MCULE-7084821345 [1,1,0,0,0,0|1,0,0]=3 2993 B6R0.4 CC(Br)CCCBr MCULE-8808667049 [1,1,0,0,0,0|1,0,1]=4 2994 B6R0.4 CC(C)CCCBr MCULE-2045625937 [1,1,0,0,0,0|1,0,1]=4 2995 B6R0.4 CC(C)CCCCl MCULE-4841628592 [1,1,0,0,0,0|1,0,1]=4 2996 B6R0.4 CC(C)CCCI MCULE-4035616717 [1,1,0,0,0,0|1,0,1]=4 2997 B6R0.4 CC(C)CCCN MCULE-2232715676 [1,1,0,0,0,0|1,0,1]=4 2998 B6R0.4 CC(C)CCCN MCULE-7121372197 [1,1,0,0,0,0|1,0,1]=4 2999 B6R0.4 CC(C)CCCO MCULE-5797993948 [1,1,0,0,0,0|1,0,1]=4 3000 B6R0.4 CC(C)CCCS MCULE-8417191578 [1,1,0,0,0,0|1,0,1]=4 3001 B6R0.4 CC(Cl)CCCCl MCULE-9382073752 [1,1,0,0,0,0|1,0,1]=4 3002 B6R0.4 CC(Cl)CCCO MCULE-2554250532 [1,1,0,0,0,0|1,0,1]=4 3003 B6R0.4 CC(N)CCCN MCULE-4857113826 [1,1,0,0,0,0|1,0,1]=4 3004 B6R0.4 CC(N)CCCN MCULE-4899798325 [1,1,0,0,0,0|1,0,1]=4 3005 B6R0.4 CC(N)CCCO MCULE-6629535696 [1,1,0,0,0,0|1,0,1]=4 3006 B6R0.4 CC(O)CCCBr MCULE-5477662754 [1,1,0,0,0,0|0,0,2]=4 3007 B6R0.4 CC(O)CCCCl MCULE-6993728810 [1,1,0,0,0,0|0,0,2]=4 3008 B6R0.4 CC(O)CCCN MCULE-3754805134 [1,1,0,0,0,0|0,0,2]=4 3009 B6R0.4 CC(O)CCCO MCULE-6580326052 [1,1,0,0,0,0|0,0,2]=4 3010 B6R0.4 CC/C=C/C(=O)Cl MCULE-8929214872 [1,1,0,0,0,0|1,0,1]=4 3011 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [1,1,0,0,0,0|0,0,1]=3 3012 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [1,1,0,0,0,0|0,0,1]=3 3013 B6R0.4 CCC#CC(=O)C MCULE-7788224704 [1,1,0,0,0,0|0,0,1]=3 3014 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [1,1,0,0,0,0|0,0,1]=3 3015 B6R0.4 CCC=CC(=O)C MCULE-2986269826 [1,1,0,0,0,0|0,0,1]=3 3016 B6R0.4 CCC=CC(=O)Cl MCULE-5159865849 [1,1,0,0,0,0|1,0,1]=4 3017 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [1,1,0,0,0,0|0,0,1]=3 3018 B6R0.4 CCCC=C(C)C MCULE-2110588796 [1,1,0,0,0,0|1,0,0]=3 3019 B6R0.4 CCCCB(O)O MCULE-9002672645 [1,1,0,0,0,0|1,0,1]=4 3020 B6R0.4 CCCCC(=N)N MCULE-3271993509 [1,1,0,0,0,0|2,0,0]=4 3021 B6R0.4 CCCCC(=N)N MCULE-3935017760 [1,1,0,0,0,0|2,0,0]=4 3022 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [1,1,0,0,0,0|1,0,0]=3 3023 B6R0.4 CCCCC(=O)C MCULE-3554390184 [1,1,0,0,0,0|0,0,0]=2 3024 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [1,1,0,0,0,0|1,0,0]=3 3025 B6R0.4 CCCCC(=O)N MCULE-6419483436 [1,1,0,0,0,0|1,0,0]=3 3026 B6R0.4 CCCCC(=O)O MCULE-2333640078 [1,1,0,0,0,0|0,0,0]=2 3027 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [1,1,0,0,0,0|0,0,1]=3 3028 B6R0.4 CCCCC(=S)N MCULE-8236760762 [1,1,0,0,0,0|1,1,0]=4 3029 B6R0.4 CCCCC(C)Br MCULE-3252474574 [1,1,0,0,0,0|1,0,1]=4 3030 B6R0.4 CCCCC(C)C MCULE-7568461039 [1,1,0,0,0,0|1,0,1]=4 3031 B6R0.4 CCCCC(C)Cl MCULE-4825682003 [1,1,0,0,0,0|1,0,1]=4 3032 B6R0.4 CCCCC(C)N MCULE-5349371506 [1,1,0,0,0,0|1,0,1]=4 3033 B6R0.4 CCCCC(C)N MCULE-6696490028 [1,1,0,0,0,0|1,0,1]=4 3034 B6R0.4 CCCCC(C)O MCULE-6558228722 [1,1,0,0,0,0|0,0,2]=4 3035 B6R0.4 CCCCC(C)S MCULE-4791681848 [1,1,0,0,0,0|0,1,1]=4 3036 B6R0.4 CCCCN(=O)=O MCULE-7679767771 [1,1,0,0,0,0|1,0,1]=4 3037 B6R0.4 CCCCN(C)C MCULE-7202077639 [1,1,0,0,0,0|2,0,0]=4 3038 B6R0.4 CCCCN(C)N MCULE-7927159797 [1,1,0,0,0,0|2,0,0]=4 3039 B6R0.4 CCCCS(=O)[O-] MCULE-4347348762 [1,1,0,0,0,0|1,0,1]=4 3040 B6R0.4 CCCCS(=O)[O-] MCULE-8153578421 [1,1,0,0,0,0|1,0,1]=4 3041 B6R0.4 CCCC[C@@H](C)N MCULE-2673058676 [1,1,0,0,0,0|1,0,1]=4 3042 B6R0.4 CCCC[C@@H](C)N MCULE-7666196055 [1,1,0,0,0,0|1,0,1]=4 3043 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [1,1,0,0,0,0|0,0,2]=4 3044 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [1,1,0,0,0,0|0,0,2]=4 3045 B6R0.4 CCCC[C@H](C)N MCULE-6212068145 [1,1,0,0,0,0|1,0,1]=4 3046 B6R0.4 CCCC[C@H](C)N MCULE-7818513999 [1,1,0,0,0,0|1,0,1]=4 3047 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [1,1,0,0,0,0|0,0,2]=4 3048 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [1,1,0,0,0,0|0,0,2]=4 3049 B6R0.4 CCCNC(=N)N MCULE-6381843991 [1,1,0,0,0,0|2,0,0]=4 3050 B6R0.4 CCCNC(=N)N MCULE-8286774592 [1,1,0,0,0,0|2,0,0]=4 3051 B6R0.4 CCCNC(=O)C MCULE-5899703886 [1,1,0,0,0,0|0,0,0]=2 3052 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [1,1,0,0,0,0|1,0,0]=3 3053 B6R0.4 CCCNC(=O)N MCULE-8528844765 [1,1,0,0,0,0|1,0,0]=3 3054 B6R0.4 CCCNC(=S)N MCULE-3142756488 [1,1,0,0,0,0|1,1,0]=4 3055 B6R0.4 CCCNC(C)C MCULE-7475023734 [1,1,0,0,0,0|1,0,1]=4 3056 B6R0.4 CCCOC(=O)C MCULE-7327042566 [1,1,0,0,0,0|0,0,0]=2 3057 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [1,1,0,0,0,0|1,0,0]=3 3058 B6R0.4 CCCOC(=O)N MCULE-2760622567 [1,1,0,0,0,0|1,0,0]=3 3059 B6R0.4 CCCOC(=S)[S-] MCULE-9126934993 [1,1,0,0,0,0|0,2,0]=4 3060 B6R0.4 CCCOC(=S)[S-] MCULE-9566804941 [1,1,0,0,0,0|0,2,0]=4 3061 B6R0.4 CCCON(=O)=O MCULE-3372904250 [1,1,0,0,0,0|1,0,1]=4 3062 B6R0.4 CCCSC(=N)N MCULE-4777505658 [1,1,0,0,0,0|2,0,0]=4 3063 B6R0.4 CCCSC(=N)N MCULE-8873393921 [1,1,0,0,0,0|2,0,0]=4 3064 B6R0.4 CCCSC(=O)C MCULE-4329646671 [1,1,0,0,0,0|0,0,0]=2 3065 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [1,1,0,0,0,0|1,0,0]=3 3066 B6R0.4 CCCSC(=[NH2+])N MCULE-6759252204 [1,1,0,0,0,0|2,0,0]=4 3067 B6R0.4 CCCSC(C)C MCULE-2233656285 [1,1,0,0,0,0|1,0,1]=4 3068 B6R0.4 CCNCC(=O)C MCULE-5799315547 [1,1,0,0,0,0|0,0,0]=2 3069 B6R0.4 CCNCC(=O)C MCULE-9258294157 [1,1,0,0,0,0|0,0,0]=2 3070 B6R0.4 CCNCC(=O)N MCULE-1787248899 [1,1,0,0,0,0|1,0,0]=3 3071 B6R0.4 CCNCC(=O)N MCULE-3821700273 [1,1,0,0,0,0|1,0,0]=3 3072 B6R0.4 CCNCC(=O)O MCULE-5989480216 [1,1,0,0,0,0|0,0,0]=2 3073 B6R0.4 CCNCC(=O)O MCULE-8087863397 [1,1,0,0,0,0|0,0,0]=2 3074 B6R0.4 CCNCC(C)C MCULE-1625905125 [1,1,0,0,0,0|1,0,1]=4 3075 B6R0.4 CCNCC(C)C MCULE-3527739859 [1,1,0,0,0,0|1,0,1]=4 3076 B6R0.4 CCNCC(C)O MCULE-5078068369 [1,1,0,0,0,0|0,0,2]=4 3077 B6R0.4 CCNC[C@@H](C)O MCULE-4291219061 [1,1,0,0,0,0|0,0,2]=4 3078 B6R0.4 CCNC[C@@H](C)O MCULE-8603386701 [1,1,0,0,0,0|0,0,2]=4 3079 B6R0.4 CCNC[C@H](C)O MCULE-7173470231 [1,1,0,0,0,0|0,0,2]=4 3080 B6R0.4 CCNC[C@H](C)O MCULE-9651301254 [1,1,0,0,0,0|0,0,2]=4 3081 B6R0.4 CCOCC(=N)N MCULE-3232806707 [1,1,0,0,0,0|2,0,0]=4 3082 B6R0.4 CCOCC(=N)N MCULE-4996987536 [1,1,0,0,0,0|2,0,0]=4 3083 B6R0.4 CCOCC(=O)C MCULE-2825677443 [1,1,0,0,0,0|0,0,0]=2 3084 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [1,1,0,0,0,0|1,0,0]=3 3085 B6R0.4 CCOCC(=O)O MCULE-1726530898 [1,1,0,0,0,0|0,0,0]=2 3086 B6R0.4 CCOCC(=S)N MCULE-7064672670 [1,1,0,0,0,0|1,1,0]=4 3087 B6R0.4 CCOCC(C)C MCULE-7986128672 [1,1,0,0,0,0|1,0,1]=4 3088 B6R0.4 CCOCC(C)N MCULE-8540668261 [1,1,0,0,0,0|1,0,1]=4 3089 B6R0.4 CCOCC(C)N MCULE-8720228996 [1,1,0,0,0,0|1,0,1]=4 3090 B6R0.4 CCOCC(C)O MCULE-6224339526 [1,1,0,0,0,0|0,0,2]=4 3091 B6R0.4 CCOC[C@@H](C)N MCULE-7053460047 [1,1,0,0,0,0|1,0,1]=4 3092 B6R0.4 CCOC[C@@H](C)N MCULE-9865800502 [1,1,0,0,0,0|1,0,1]=4 3093 B6R0.4 CCOC[C@@H](C)O MCULE-9075407512 [1,1,0,0,0,0|0,0,2]=4 3094 B6R0.4 CCOC[C@H](C)N MCULE-2897416804 [1,1,0,0,0,0|1,0,1]=4 3095 B6R0.4 CCOC[C@H](C)N MCULE-6799267946 [1,1,0,0,0,0|1,0,1]=4 3096 B6R0.4 CCSCC(=O)C MCULE-9872082780 [1,1,0,0,0,0|0,0,0]=2 3097 B6R0.4 CCSCC(=O)O MCULE-7471335718 [1,1,0,0,0,0|0,0,0]=2 3098 B6R0.4 CCSCC(C)N MCULE-3399255190 [1,1,0,0,0,0|1,0,1]=4 3099 B6R0.4 CN(C)CCCBr MCULE-2862944726 [1,1,0,0,0,0|2,0,0]=4 3100 B6R0.4 CN(C)CCCBr MCULE-4596026048 [1,1,0,0,0,0|2,0,0]=4 3101 B6R0.4 CN(C)CCCBr MCULE-7515880350 [1,1,0,0,0,0|2,0,0]=4 3102 B6R0.4 CN(C)CCCCl MCULE-1347366200 [1,1,0,0,0,0|2,0,0]=4 3103 B6R0.4 CN(C)CCCCl MCULE-3767329555 [1,1,0,0,0,0|2,0,0]=4 3104 B6R0.4 CN(C)CCCI MCULE-2134226049 [1,1,0,0,0,0|2,0,0]=4 3105 B6R0.4 CN(C)CCCI MCULE-2999516061 [1,1,0,0,0,0|2,0,0]=4 3106 B6R0.4 CN(C)CCCN MCULE-3882436382 [1,1,0,0,0,0|2,0,0]=4 3107 B6R0.4 CN(C)CCCN MCULE-4415270662 [1,1,0,0,0,0|2,0,0]=4 3108 B6R0.4 CN(C)CCCN MCULE-4624916051 [1,1,0,0,0,0|2,0,0]=4 3109 B6R0.4 CN(C)CCCN MCULE-4749435878 [1,1,0,0,0,0|2,0,0]=4 3110 B6R0.4 CN(C)CCCN MCULE-9301668058 [1,1,0,0,0,0|2,0,0]=4 3111 B6R0.4 CN(C)CCCO MCULE-7408728427 [1,1,0,0,0,0|2,0,0]=4 3112 B6R0.4 CN(C)CCCS MCULE-7945161812 [1,1,0,0,0,0|2,0,0]=4 3113 B6R0.4 CNCCC(=O)N MCULE-1118876220 [1,1,0,0,0,0|1,0,0]=3 3114 B6R0.4 CNCCC(=O)N MCULE-6679713144 [1,1,0,0,0,0|1,0,0]=3 3115 B6R0.4 CNCCC(=O)O MCULE-3627988097 [1,1,0,0,0,0|0,0,0]=2 3116 B6R0.4 CNCCC(=O)O MCULE-9858204248 [1,1,0,0,0,0|0,0,0]=2 3117 B6R0.4 CNCCC(C)C MCULE-3679914556 [1,1,0,0,0,0|1,0,1]=4 3118 B6R0.4 CNCCC(C)C MCULE-9679972004 [1,1,0,0,0,0|1,0,1]=4 3119 B6R0.4 CNCCC(C)N MCULE-5955505029 [1,1,0,0,0,0|1,0,1]=4 3120 B6R0.4 CNCCC(C)N MCULE-8933967952 [1,1,0,0,0,0|1,0,1]=4 3121 B6R0.4 CNCCC(C)O MCULE-1615526002 [1,1,0,0,0,0|0,0,2]=4 3122 B6R0.4 CNCCN(C)C MCULE-3324857553 [1,1,0,0,0,0|2,0,0]=4 3123 B6R0.4 CNCCN(C)C MCULE-8014008412 [1,1,0,0,0,0|2,0,0]=4 3124 B6R0.4 CNCCN(C)C MCULE-9954339750 [1,1,0,0,0,0|2,0,0]=4 3125 B6R0.4 CNCC[C@@H](C)N MCULE-6024494304 [1,1,0,0,0,0|1,0,1]=4 3126 B6R0.4 CNCC[C@H](C)N MCULE-5449372796 [1,1,0,0,0,0|1,0,1]=4 3127 B6R0.4 CNCC[C@H](C)N MCULE-8157402351 [1,1,0,0,0,0|1,0,1]=4 3128 B6R0.4 CO/C=C/C(=O)C MCULE-1215649803 [1,1,0,0,0,0|0,0,2]=4 3129 B6R0.4 CO/C=C/C(=O)O MCULE-3681049176 [1,1,0,0,0,0|0,0,2]=4 3130 B6R0.4 COC=CC(=O)C MCULE-4868833764 [1,1,0,0,0,0|0,0,2]=4 3131 B6R0.4 COC=CC(=O)O MCULE-4252899122 [1,1,0,0,0,0|0,0,2]=4 3132 B6R0.4 COCCC(=N)N MCULE-8118559492 [1,1,0,0,0,0|2,0,0]=4 3133 B6R0.4 COCCC(=N)N MCULE-9000138086 [1,1,0,0,0,0|2,0,0]=4 3134 B6R0.4 COCCC(=O)C MCULE-5939812376 [1,1,0,0,0,0|0,0,0]=2 3135 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [1,1,0,0,0,0|1,0,0]=3 3136 B6R0.4 COCCC(=O)N MCULE-7556483675 [1,1,0,0,0,0|1,0,0]=3 3137 B6R0.4 COCCC(=O)O MCULE-3436347115 [1,1,0,0,0,0|0,0,0]=2 3138 B6R0.4 COCCC(C)Br MCULE-6529807745 [1,1,0,0,0,0|1,0,1]=4 3139 B6R0.4 COCCC(C)C MCULE-8727768886 [1,1,0,0,0,0|1,0,1]=4 3140 B6R0.4 COCCC(C)N MCULE-6183216923 [1,1,0,0,0,0|1,0,1]=4 3141 B6R0.4 COCCC(C)O MCULE-6536001437 [1,1,0,0,0,0|0,0,2]=4 3142 B6R0.4 COCCN(C)C MCULE-5323166567 [1,1,0,0,0,0|2,0,0]=4 3143 B6R0.4 COCCN(C)N MCULE-9480733049 [1,1,0,0,0,0|2,0,0]=4 3144 B6R0.4 COCC[C@H](C)N MCULE-6163336851 [1,1,0,0,0,0|1,0,1]=4 3145 B6R0.4 COCC[C@H](C)N MCULE-6363449253 [1,1,0,0,0,0|1,0,1]=4 3146 B6R0.4 COCNC(=O)N MCULE-8367032240 [1,1,0,0,0,0|2,0,0]=4 3147 B6R0.4 COCOC(=O)C MCULE-8876091916 [1,1,0,0,0,0|1,0,0]=3 3148 B6R0.4 CON=CC(=O)O MCULE-6800819509 [1,1,0,0,0,0|1,0,1]=4 3149 B6R0.4 CS(=O)CCCN MCULE-1124989526 [1,1,0,0,0,0|1,0,0]=3 3150 B6R0.4 CS(=O)CCCN MCULE-8758903495 [1,1,0,0,0,0|1,0,0]=3 3151 B6R0.4 CSCCC(=N)N MCULE-3926353306 [1,1,0,0,0,0|2,0,0]=4 3152 B6R0.4 CSCCC(=N)N MCULE-4451485733 [1,1,0,0,0,0|2,0,0]=4 3153 B6R0.4 CSCCC(=O)C MCULE-6178663156 [1,1,0,0,0,0|0,0,0]=2 3154 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [1,1,0,0,0,0|1,0,0]=3 3155 B6R0.4 CSCCC(=O)N MCULE-7105035733 [1,1,0,0,0,0|1,0,0]=3 3156 B6R0.4 CSCCC(=O)O MCULE-9550032941 [1,1,0,0,0,0|0,0,0]=2 3157 B6R0.4 CSCCC(C)N MCULE-3925048385 [1,1,0,0,0,0|1,0,1]=4 3158 B6R0.4 CSCCC(C)O MCULE-5934844952 [1,1,0,0,0,0|0,0,2]=4 3159 B6R0.4 CSCCN(C)C MCULE-2148124964 [1,1,0,0,0,0|2,0,0]=4 3160 B6R0.4 CSCCN(C)C MCULE-5176242697 [1,1,0,0,0,0|2,0,0]=4 3161 B6R0.4 CSCOC(=O)C MCULE-1498769347 [1,1,0,0,0,0|1,0,0]=3 3162 B6R0.4 CSSCC(=O)O MCULE-5829510166 [1,1,0,0,0,0|1,0,0]=3 3163 B6R0.4 C[C@@H](N)CCCO MCULE-8313291415 [1,1,0,0,0,0|1,0,1]=4 3164 B6R0.4 C[C@@H](O)CCCO MCULE-1658231016 [1,1,0,0,0,0|0,0,2]=4 3165 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [1,1,0,0,0,0|0,0,1]=3 3166 B6R0.4 N#C[Se]CC(=O)O MCULE-1382907788 [1,1,0,0,0,0|1,0,1]=4 3167 B6R0.4 N#N=NCC(=O)O MCULE-3031425162 [1,1,0,0,0,0|2,0,0]=4 3168 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [1,1,0,0,0,0|1,0,0]=3 3169 B6R0.4 NC(=O)CCCO MCULE-3779341561 [1,1,0,0,0,0|1,0,0]=3 3170 B6R0.4 NC(=O)NCCCl MCULE-6117142945 [1,1,0,0,0,0|2,0,0]=4 3171 B6R0.4 NC(=O)NCCF MCULE-9526714989 [1,1,0,0,0,0|2,0,0]=4 3172 B6R0.4 NC(=O)NCCO MCULE-2353513655 [1,1,0,0,0,0|2,0,0]=4 3173 B6R0.4 NC(=O)OCCCl MCULE-4259077420 [1,1,0,0,0,0|2,0,0]=4 3174 B6R0.4 NC(=O)OCCO MCULE-7565460845 [1,1,0,0,0,0|2,0,0]=4 3175 B6R0.4 NC(=S)CCCO MCULE-8951145487 [1,1,0,0,0,0|1,1,0]=4 3176 B6R0.4 NC/C=C/C(=O)O MCULE-1249244912 [1,1,0,0,0,0|0,0,2]=4 3177 B6R0.4 NCC#CC(=O)O MCULE-8511125702 [1,1,0,0,0,0|0,0,2]=4 3178 B6R0.4 NCC=CC(=O)O MCULE-3049811576 [1,1,0,0,0,0|0,0,2]=4 3179 B6R0.4 NCC=CC(=O)O MCULE-5171717036 [1,1,0,0,0,0|0,0,2]=4 3180 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [1,1,0,0,0,0|1,0,0]=3 3181 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [1,1,0,0,0,0|1,0,0]=3 3182 B6R0.4 NCCCC(=O)N MCULE-8039142092 [1,1,0,0,0,0|1,0,0]=3 3183 B6R0.4 NCCCC(=O)N MCULE-8262250872 [1,1,0,0,0,0|1,0,0]=3 3184 B6R0.4 NCCCC(=O)O MCULE-3615304273 [1,1,0,0,0,0|0,0,0]=2 3185 B6R0.4 NCCCC(=O)O MCULE-7613134021 [1,1,0,0,0,0|0,0,0]=2 3186 B6R0.4 NCCNC(=O)N MCULE-1197396950 [1,1,0,0,0,0|2,0,0]=4 3187 B6R0.4 NCCNC(=O)N MCULE-2171700183 [1,1,0,0,0,0|2,0,0]=4 3188 B6R0.4 NCCNC(=O)N MCULE-3799764813 [1,1,0,0,0,0|2,0,0]=4 3189 B6R0.4 NCCOC(=O)N MCULE-4144808257 [1,1,0,0,0,0|2,0,0]=4 3190 B6R0.4 NCCOC(=O)N MCULE-5815053840 [1,1,0,0,0,0|2,0,0]=4 3191 B6R0.4 NOCCC(=O)O MCULE-1529492904 [1,1,0,0,0,0|1,0,0]=3 3192 B6R0.4 NOCCC(=O)O MCULE-6297331357 [1,1,0,0,0,0|1,0,0]=3 3193 B6R0.4 O=C(Cl)CCCBr MCULE-1389049838 [1,1,0,0,0,0|1,0,0]=3 3194 B6R0.4 O=C(Cl)CCCCl MCULE-5885932072 [1,1,0,0,0,0|1,0,0]=3 3195 B6R0.4 O=C(Cl)OCCBr MCULE-6758010852 [1,1,0,0,0,0|2,0,0]=4 3196 B6R0.4 O=C(Cl)OCCCl MCULE-1505786385 [1,1,0,0,0,0|2,0,0]=4 3197 B6R0.4 O=C(Cl)OCCF MCULE-5233366139 [1,1,0,0,0,0|2,0,0]=4 3198 B6R0.4 O=C(O)/C=C/CBr MCULE-2012997584 [1,1,0,0,0,0|0,0,2]=4 3199 B6R0.4 O=C(O)/C=C/CCl MCULE-5651159998 [1,1,0,0,0,0|0,0,2]=4 3200 B6R0.4 O=C(O)/C=C/CO MCULE-1612823053 [1,1,0,0,0,0|0,0,2]=4 3201 B6R0.4 O=C(O)C#CCCl MCULE-6341675394 [1,1,0,0,0,0|0,0,2]=4 3202 B6R0.4 O=C(O)C#CCF MCULE-8744045229 [1,1,0,0,0,0|0,0,2]=4 3203 B6R0.4 O=C(O)C#CCO MCULE-1849362182 [1,1,0,0,0,0|0,0,2]=4 3204 B6R0.4 O=C(O)C=CCBr MCULE-3029375430 [1,1,0,0,0,0|0,0,2]=4 3205 B6R0.4 O=C(O)C=CCCl MCULE-1050913038 [1,1,0,0,0,0|0,0,2]=4 3206 B6R0.4 O=C(O)C=CCO MCULE-3375515425 [1,1,0,0,0,0|0,0,2]=4 3207 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [1,1,0,0,0,0|0,0,0]=2 3208 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [1,1,0,0,0,0|0,0,0]=2 3209 B6R0.4 O=C(O)CCCF MCULE-2415675768 [1,1,0,0,0,0|0,0,0]=2 3210 B6R0.4 O=C(O)CCCI MCULE-7794841553 [1,1,0,0,0,0|0,0,0]=2 3211 B6R0.4 O=C(O)CCCS MCULE-3352840152 [1,1,0,0,0,0|0,0,0]=2 3212 B6R0.4 O=C(O)CNCO MCULE-4092998319 [1,1,0,0,0,0|1,0,0]=3 3213 B6R0.4 O=C([O-])CCCCl MCULE-4131322715 [1,1,0,0,0,0|0,0,1]=3 3214 B6R0.4 O=C([O-])CNCO MCULE-2804068565 [1,1,0,0,0,0|1,0,1]=4 3215 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [1,1,0,0,0,0|0,0,1]=3 3216 B6R0.4 O=CNCC(=O)O MCULE-3251128290 [1,1,0,0,0,0|1,0,1]=4 3217 B6R0.4 O=N(=O)CCCBr MCULE-7541604704 [1,1,0,0,0,0|1,0,1]=4 3218 B6R0.4 O=N(=O)CCCCl MCULE-3635255631 [1,1,0,0,0,0|1,0,1]=4 3219 B6R0.4 O=N(=O)CCCO MCULE-5021681032 [1,1,0,0,0,0|1,0,1]=4 3220 B6R0.4 P(=O)([O-])OCCC MCULE-3877591764 [1,1,0,0,0,0|1,0,1]=4 3221 B6R0.5 CCCC(C)(C)C MCULE-2309229328 [1,1,0,0,0,0|1,0,1]=4 3222 B6R0.5 CCCC(C)(C)Cl MCULE-1426018824 [1,1,0,0,0,0|1,0,1]=4 3223 B6R0.5 CCCC(C)(C)N MCULE-2670535144 [1,1,0,0,0,0|1,0,1]=4 3224 B6R0.5 CCCC(C)(C)N MCULE-4533125677 [1,1,0,0,0,0|1,0,1]=4 3225 B6R0.5 CCCC(C)(C)O MCULE-2647276101 [1,1,0,0,0,0|0,0,2]=4 3226 B6R0.5 CCCP(=O)(O)O MCULE-3928382731 [1,1,0,0,0,0|1,0,0]=3 3227 B6R0.5 CCCS(=O)(=O)Cl MCULE-4980552385 [1,1,0,0,0,0|1,0,1]=4 3228 B6R0.5 CCCS(=O)(=O)F MCULE-7811564151 [1,1,0,0,0,0|1,0,1]=4 3229 B6R0.5 CCCS(=O)(=O)N MCULE-1554874611 [1,1,0,0,0,0|1,0,1]=4 3230 B6R0.5 CCCS(=O)(=O)O MCULE-5213264344 [1,1,0,0,0,0|1,0,0]=3 3231 B6R0.5 CCCS(=O)(=O)[O-] MCULE-5970988364 [1,1,0,0,0,0|1,0,1]=4 3232 B6R0.5 CCC[N+](C)(C)C MCULE-4840113179 [1,1,0,0,0,0|2,0,0]=4 3233 B6R0.5 CCC[N+](C)(C)C MCULE-6374165176 [1,1,0,0,0,0|2,0,0]=4 3234 B6R0.5 CCC[N+](C)(C)C MCULE-6861938722 [1,1,0,0,0,0|2,0,0]=4 3235 B6R0.5 CCC[Si](C)(C)Cl MCULE-2174562638 [1,1,0,0,0,0|1,1,0]=4 3236 B6R0.5 CCC[Si](C)(Cl)Cl MCULE-9758606777 [1,1,0,0,0,0|1,1,0]=4 3237 B6R0.5 CCNS(=O)(=O)C MCULE-7880259383 [1,1,0,0,0,0|2,0,0]=4 3238 B6R0.5 CCNS(=O)(=O)O MCULE-8674266317 [1,1,0,0,0,0|2,0,0]=4 3239 B6R0.5 CCOP(=O)(C)S MCULE-4864782374 [1,1,0,0,0,0|2,0,0]=4 3240 B6R0.5 CCOS(=O)(=O)C MCULE-7269389229 [1,1,0,0,0,0|2,0,0]=4 3241 B6R0.5 CNCP(=O)(O)O MCULE-6684762988 [1,1,0,0,0,0|2,0,0]=4 3242 B6R0.5 CS(=N)(=O)CCO MCULE-8018746796 [1,1,0,0,0,0|2,0,0]=4 3243 B6R0.5 CS(=O)(=O)CCBr MCULE-8646670232 [1,1,0,0,0,0|2,0,0]=4 3244 B6R0.5 CS(=O)(=O)CCCl MCULE-2793702743 [1,1,0,0,0,0|2,0,0]=4 3245 B6R0.5 CS(=O)(=O)CCN MCULE-1321841891 [1,1,0,0,0,0|2,0,0]=4 3246 B6R0.5 CS(=O)(=O)CCN MCULE-2288346161 [1,1,0,0,0,0|2,0,0]=4 3247 B6R0.5 CS(=O)(=O)CCN MCULE-7691141389 [1,1,0,0,0,0|2,0,0]=4 3248 B6R0.5 CS(=O)(=O)CCO MCULE-1589351176 [1,1,0,0,0,0|2,0,0]=4 3249 B6R0.5 CS(=O)(=O)CCS MCULE-9115674422 [1,1,0,0,0,0|2,0,0]=4 3250 B6R0.5 NCCP(=O)(O)O MCULE-6030069631 [1,1,0,0,0,0|2,0,0]=4 3251 B6R0.5 NCCP(=O)(O)O MCULE-7710471805 [1,1,0,0,0,0|2,0,0]=4 3252 B6R0.5 NCCS(=O)(=O)O MCULE-6041857208 [1,1,0,0,0,0|2,0,0]=4 3253 B6R0.5 O=P(O)(O)CCBr MCULE-3355549967 [1,1,0,0,0,0|2,0,0]=4 3254 B6R0.5 O=P(O)(O)CCCl MCULE-4131416773 [1,1,0,0,0,0|2,0,0]=4 3255 B6R0.5 O=P(O)(O)CCO MCULE-9752100956 [1,1,0,0,0,0|2,0,0]=4 3256 B6R0.5 O=S(=O)(O)CCBr MCULE-3291252302 [1,1,0,0,0,0|2,0,0]=4 3257 B6R0.5 O=S(=O)(O)CCCl MCULE-9043359543 [1,1,0,0,0,0|2,0,0]=4 3258 B6R0.5 O=S(=O)(O)CCO MCULE-8075949368 [1,1,0,0,0,0|2,0,0]=4 3259 B6R0.5 O=S(=O)(O)CCS MCULE-1073050356 [1,1,0,0,0,0|2,0,0]=4 3260 B6R0.6 C#CCCCOC MCULE-3174650949 [1,1,0,0,0,0|0,0,2]=4 3261 B6R0.6 C(=C/CCC)\CO MCULE-6491762150 [1,1,0,0,0,0|1,0,0]=3 3262 B6R0.6 C/C=C/CCCC MCULE-6900331316 [1,1,0,0,0,0|1,0,0]=3 3263 B6R0.6 C/C=C/CCCO MCULE-9865436125 [1,1,0,0,0,0|1,0,0]=3 3264 B6R0.6 C/C=C\CCCC MCULE-8426867799 [1,1,0,0,0,0|1,0,0]=3 3265 B6R0.6 C/C=C\CCCO MCULE-3169839661 [1,1,0,0,0,0|1,0,0]=3 3266 B6R0.6 C=CCC/C=C/C MCULE-3936427871 [1,1,0,0,0,0|1,0,1]=4 3267 B6R0.6 C=CCCC=CC MCULE-6481809840 [1,1,0,0,0,0|1,0,1]=4 3268 B6R0.6 C=COCCCC MCULE-2025922328 [1,1,0,0,0,0|0,0,2]=4 3269 B6R0.6 CC#CCCCBr MCULE-8545908172 [1,1,0,0,0,0|1,0,1]=4 3270 B6R0.6 CC#CCCCC MCULE-1899332515 [1,1,0,0,0,0|1,0,1]=4 3271 B6R0.6 CC#CCCCO MCULE-6502564684 [1,1,0,0,0,0|1,0,1]=4 3272 B6R0.6 CC/C=C/CCC MCULE-5222700461 [1,1,0,0,0,0|1,0,0]=3 3273 B6R0.6 CC/C=C/CCO MCULE-9853729917 [1,1,0,0,0,0|1,0,1]=4 3274 B6R0.6 CC/C=C\CCO MCULE-9206958060 [1,1,0,0,0,0|1,0,1]=4 3275 B6R0.6 CC=CCCCBr MCULE-1109208969 [1,1,0,0,0,0|1,0,0]=3 3276 B6R0.6 CC=CCCCC MCULE-7277981733 [1,1,0,0,0,0|1,0,0]=3 3277 B6R0.6 CC=CCCCCl MCULE-7487798637 [1,1,0,0,0,0|1,0,0]=3 3278 B6R0.6 CC=CCCCO MCULE-1401303632 [1,1,0,0,0,0|1,0,0]=3 3279 B6R0.6 CC=CSCCC MCULE-3534082442 [1,1,0,0,0,0|1,0,0]=3 3280 B6R0.6 CCC#CCCC MCULE-9615607532 [1,1,0,0,0,0|1,0,1]=4 3281 B6R0.6 CCC/C=C/C=O MCULE-3059768922 [1,1,0,0,0,0|1,0,1]=4 3282 B6R0.6 CCC=CCCBr MCULE-7873583643 [1,1,0,0,0,0|1,0,1]=4 3283 B6R0.6 CCC=CCCC MCULE-3739501724 [1,1,0,0,0,0|1,0,0]=3 3284 B6R0.6 CCC=CCCI MCULE-9416216252 [1,1,0,0,0,0|1,0,1]=4 3285 B6R0.6 CCC=CCCO MCULE-1781375433 [1,1,0,0,0,0|1,0,1]=4 3286 B6R0.6 CCC=COCC MCULE-1991976030 [1,1,0,0,0,0|0,0,1]=3 3287 B6R0.6 CCCC#CCO MCULE-8352024607 [1,1,0,0,0,0|1,0,1]=4 3288 B6R0.6 CCCC=CC=O MCULE-5273169296 [1,1,0,0,0,0|1,0,1]=4 3289 B6R0.6 CCCC=CCBr MCULE-2474104566 [1,1,0,0,0,0|1,0,0]=3 3290 B6R0.6 CCCC=CCO MCULE-3204738641 [1,1,0,0,0,0|1,0,0]=3 3291 B6R0.6 CCCCCCBr MCULE-6022503394 [1,1,0,0,0,0|1,0,1]=4 3292 B6R0.6 CCCCCCC MCULE-5817084747 [1,1,0,0,0,0|1,0,1]=4 3293 B6R0.6 CCCCCCCl MCULE-3706149525 [1,1,0,0,0,0|1,0,1]=4 3294 B6R0.6 CCCCCCF MCULE-4320903575 [1,1,0,0,0,0|1,0,1]=4 3295 B6R0.6 CCCCCCI MCULE-1021236615 [1,1,0,0,0,0|1,0,1]=4 3296 B6R0.6 CCCCCCN MCULE-2944455155 [1,1,0,0,0,0|1,0,1]=4 3297 B6R0.6 CCCCCCN MCULE-6014217174 [1,1,0,0,0,0|1,0,1]=4 3298 B6R0.6 CCCCCCN MCULE-6021451227 [1,1,0,0,0,0|1,0,1]=4 3299 B6R0.6 CCCCCCO MCULE-4299150163 [1,1,0,0,0,0|1,0,1]=4 3300 B6R0.6 CCCCCCS MCULE-5962964855 [1,1,0,0,0,0|1,0,1]=4 3301 B6R0.6 CCCCCNC MCULE-8082703734 [1,1,0,0,0,0|1,0,1]=4 3302 B6R0.6 CCCCCOC MCULE-3370181741 [1,1,0,0,0,0|0,0,1]=3 3303 B6R0.6 CCCCCON MCULE-5372426564 [1,1,0,0,0,0|1,0,1]=4 3304 B6R0.6 CCCCCON MCULE-8557641459 [1,1,0,0,0,0|1,0,1]=4 3305 B6R0.6 CCCCCSC MCULE-6566108868 [1,1,0,0,0,0|0,1,1]=4 3306 B6R0.6 CCCCNCC MCULE-8816750429 [1,1,0,0,0,0|1,0,1]=4 3307 B6R0.6 CCCCNOC MCULE-4265481432 [1,1,0,0,0,0|0,0,1]=3 3308 B6R0.6 CCCCOC=O MCULE-4633421026 [1,1,0,0,0,0|0,0,2]=4 3309 B6R0.6 CCCCOCC MCULE-5662731951 [1,1,0,0,0,0|0,0,1]=3 3310 B6R0.6 CCCCOCCl MCULE-5282964693 [1,1,0,0,0,0|0,0,1]=3 3311 B6R0.6 CCCCON=O MCULE-9992790020 [1,1,0,0,0,0|1,0,1]=4 3312 B6R0.6 CCCCSCC MCULE-4832924468 [1,1,0,0,0,0|0,1,1]=4 3313 B6R0.6 CCCCSCCl MCULE-4907770015 [1,1,0,0,0,0|0,1,1]=4 3314 B6R0.6 CCCNCCC MCULE-1452672638 [1,1,0,0,0,0|1,0,1]=4 3315 B6R0.6 CCCNCCC MCULE-6223802621 [1,1,0,0,0,0|1,0,1]=4 3316 B6R0.6 CCCNCCC MCULE-6789654118 [1,1,0,0,0,0|1,0,1]=4 3317 B6R0.6 CCCNCCN MCULE-2288945868 [1,1,0,0,0,0|2,0,0]=4 3318 B6R0.6 CCCNCCO MCULE-4813687741 [1,1,0,0,0,0|2,0,0]=4 3319 B6R0.6 CCCNOCC MCULE-1349462426 [1,1,0,0,0,0|1,0,0]=3 3320 B6R0.6 CCCNOCC MCULE-7159087335 [1,1,0,0,0,0|1,0,0]=3 3321 B6R0.6 CCCOCCC MCULE-1390130917 [1,1,0,0,0,0|1,0,1]=4 3322 B6R0.6 CCCOCCCl MCULE-6561613708 [1,1,0,0,0,0|2,0,0]=4 3323 B6R0.6 CCCOCCI MCULE-5330098176 [1,1,0,0,0,0|2,0,0]=4 3324 B6R0.6 CCCOCCN MCULE-1987261931 [1,1,0,0,0,0|2,0,0]=4 3325 B6R0.6 CCCOCCN MCULE-9033871038 [1,1,0,0,0,0|2,0,0]=4 3326 B6R0.6 CCCOCCO MCULE-3263526264 [1,1,0,0,0,0|2,0,0]=4 3327 B6R0.6 CCCSCCC MCULE-5531652471 [1,1,0,0,0,0|1,0,1]=4 3328 B6R0.6 CCCSCCN MCULE-3934428121 [1,1,0,0,0,0|2,0,0]=4 3329 B6R0.6 CCCSCCN MCULE-5705755172 [1,1,0,0,0,0|2,0,0]=4 3330 B6R0.6 CCCSCCO MCULE-8371796663 [1,1,0,0,0,0|2,0,0]=4 3331 B6R0.6 CCCSSCC MCULE-7192921435 [1,1,0,0,0,0|1,1,0]=4 3332 B6R0.6 CCNCCCN MCULE-5811169148 [1,1,0,0,0,0|2,0,0]=4 3333 B6R0.6 CCNCCCO MCULE-3251610052 [1,1,0,0,0,0|2,0,0]=4 3334 B6R0.6 CCNCCNC MCULE-9372339393 [1,1,0,0,0,0|1,0,1]=4 3335 B6R0.6 CCNCCOC MCULE-1476772953 [1,1,0,0,0,0|0,0,1]=3 3336 B6R0.6 CCNCCOC MCULE-6652489795 [1,1,0,0,0,0|0,0,1]=3 3337 B6R0.6 CCNCCSC MCULE-1736157320 [1,1,0,0,0,0|0,1,1]=4 3338 B6R0.6 CCNCCSC MCULE-9369049891 [1,1,0,0,0,0|0,1,1]=4 3339 B6R0.6 CCOCCCBr MCULE-6544747281 [1,1,0,0,0,0|1,0,1]=4 3340 B6R0.6 CCOCCCCl MCULE-8523618681 [1,1,0,0,0,0|1,0,1]=4 3341 B6R0.6 CCOCCCI MCULE-6640732668 [1,1,0,0,0,0|1,0,1]=4 3342 B6R0.6 CCOCCCN MCULE-3491529722 [1,1,0,0,0,0|1,0,1]=4 3343 B6R0.6 CCOCCCO MCULE-3077567484 [1,1,0,0,0,0|1,0,1]=4 3344 B6R0.6 CCOCCNC MCULE-5244682559 [1,1,0,0,0,0|1,0,1]=4 3345 B6R0.6 CCOCCNC MCULE-9344296133 [1,1,0,0,0,0|1,0,1]=4 3346 B6R0.6 CCOCCOC MCULE-2753000412 [1,1,0,0,0,0|0,0,1]=3 3347 B6R0.6 CCOCCON MCULE-6072859154 [1,1,0,0,0,0|1,0,1]=4 3348 B6R0.6 CCOCCON MCULE-7716477934 [1,1,0,0,0,0|1,0,1]=4 3349 B6R0.6 CCOCOCC MCULE-3885854108 [1,1,0,0,0,0|1,0,1]=4 3350 B6R0.6 CCSCCCBr MCULE-5143634954 [1,1,0,0,0,0|2,0,0]=4 3351 B6R0.6 CCSCCCN MCULE-4566450606 [1,1,0,0,0,0|2,0,0]=4 3352 B6R0.6 CCSCCCO MCULE-6719011943 [1,1,0,0,0,0|2,0,0]=4 3353 B6R0.6 CCSCCNC MCULE-6159594076 [1,1,0,0,0,0|1,0,1]=4 3354 B6R0.6 CCSCCNC MCULE-6696154047 [1,1,0,0,0,0|1,0,1]=4 3355 B6R0.6 CCSCSCC MCULE-6005869091 [1,1,0,0,0,0|2,0,0]=4 3356 B6R0.6 CNCCCCBr MCULE-4148452640 [1,1,0,0,0,0|1,0,1]=4 3357 B6R0.6 CNCCCCBr MCULE-8686440557 [1,1,0,0,0,0|1,0,1]=4 3358 B6R0.6 CNCCCCCl MCULE-1170786568 [1,1,0,0,0,0|1,0,1]=4 3359 B6R0.6 CNCCCCCl MCULE-1726466829 [1,1,0,0,0,0|1,0,1]=4 3360 B6R0.6 CNCCCCN MCULE-2542685963 [1,1,0,0,0,0|1,0,1]=4 3361 B6R0.6 CNCCCCN MCULE-7925344560 [1,1,0,0,0,0|1,0,1]=4 3362 B6R0.6 CNCCCCO MCULE-9264393637 [1,1,0,0,0,0|1,0,1]=4 3363 B6R0.6 CNCCCNC MCULE-3840224541 [1,1,0,0,0,0|1,0,1]=4 3364 B6R0.6 CNCCCOC MCULE-4057126907 [1,1,0,0,0,0|0,0,1]=3 3365 B6R0.6 CNCCCOC MCULE-8552551858 [1,1,0,0,0,0|0,0,1]=3 3366 B6R0.6 CNCCCSC MCULE-6553998750 [1,1,0,0,0,0|0,1,1]=4 3367 B6R0.6 CNOCCOC MCULE-2652662364 [1,1,0,0,0,0|1,0,1]=4 3368 B6R0.6 CNOCCOC MCULE-3394597000 [1,1,0,0,0,0|1,0,1]=4 3369 B6R0.6 CO/N=C/NOC MCULE-8041255040 [1,1,0,0,0,0|2,0,0]=4 3370 B6R0.6 COC=CCC#N MCULE-8939260341 [1,1,0,0,0,0|0,0,2]=4 3371 B6R0.6 COCCCC#N MCULE-8739581354 [1,1,0,0,0,0|0,0,2]=4 3372 B6R0.6 COCCCC=O MCULE-2055914202 [1,1,0,0,0,0|0,0,2]=4 3373 B6R0.6 COCCCCBr MCULE-7500019583 [1,1,0,0,0,0|0,0,1]=3 3374 B6R0.6 COCCCCCl MCULE-3863170338 [1,1,0,0,0,0|0,0,1]=3 3375 B6R0.6 COCCCCN MCULE-9584631056 [1,1,0,0,0,0|0,0,1]=3 3376 B6R0.6 COCCCCO MCULE-2543196930 [1,1,0,0,0,0|0,0,1]=3 3377 B6R0.6 COCCCCO MCULE-8659106280 [1,1,0,0,0,0|0,0,1]=3 3378 B6R0.6 COCCCNN MCULE-5097653856 [1,1,0,0,0,0|1,0,1]=4 3379 B6R0.6 COCCCNN MCULE-7758841774 [1,1,0,0,0,0|1,0,1]=4 3380 B6R0.6 COCCCOC MCULE-5003816236 [1,1,0,0,0,0|0,0,1]=3 3381 B6R0.6 COCCCON MCULE-3859091617 [1,1,0,0,0,0|1,0,1]=4 3382 B6R0.6 COCCCON MCULE-4419390097 [1,1,0,0,0,0|1,0,1]=4 3383 B6R0.6 COCCOCCl MCULE-6701095927 [1,1,0,0,0,0|1,0,1]=4 3384 B6R0.6 COCOCCBr MCULE-8856323357 [1,1,0,0,0,0|1,0,1]=4 3385 B6R0.6 COCOCCI MCULE-4444019738 [1,1,0,0,0,0|1,0,1]=4 3386 B6R0.6 COCOCCN MCULE-7974740048 [1,1,0,0,0,0|1,0,1]=4 3387 B6R0.6 COCOCCO MCULE-8093241209 [1,1,0,0,0,0|1,0,1]=4 3388 B6R0.6 COCOCOC MCULE-9183615159 [1,1,0,0,0,0|1,0,1]=4 3389 B6R0.6 CONCCCN MCULE-4780444103 [1,1,0,0,0,0|1,0,0]=3 3390 B6R0.6 CONCCCN MCULE-6095720673 [1,1,0,0,0,0|1,0,0]=3 3391 B6R0.6 CONCCCN MCULE-9121351484 [1,1,0,0,0,0|1,0,0]=3 3392 B6R0.6 CSCCCCN MCULE-2391033479 [1,1,0,0,0,0|0,1,1]=4 3393 B6R0.6 CSCCCCO MCULE-1045422424 [1,1,0,0,0,0|0,1,1]=4 3394 B6R0.6 CSCCCON MCULE-2543326517 [1,1,0,0,0,0|1,0,1]=4 3395 B6R0.6 CSCCCSC MCULE-6993538101 [1,1,0,0,0,0|0,1,1]=4 3396 B6R0.6 NCC=CCCN MCULE-5058870063 [1,1,0,0,0,0|2,0,0]=4 3397 B6R0.6 NCC=CCCN MCULE-6332692206 [1,1,0,0,0,0|2,0,0]=4 3398 B6R0.8 CCC(C)(C)OC MCULE-3328037871 [1,1,0,0,0,0|1,0,1]=4 3399 B6R0.8 CCP(=O)(O)CC MCULE-3198153356 [1,1,0,0,0,0|2,0,0]=4 3400 B6R0.8 CCS(=N)(=O)CC MCULE-1377380719 [1,1,0,0,0,0|2,0,0]=4 3401 B6R0.8 CCS(=O)(=O)CC MCULE-5339813362 [1,1,0,0,0,0|2,0,0]=4 3402 B6R0.8 CCS(=O)(=O)NC MCULE-6063674993 [1,1,0,0,0,0|2,0,0]=4 3403 B6R0.8 CCS(=O)(=O)OC MCULE-7196280359 [1,1,0,0,0,0|1,0,0]=3 3404 B6R0.8 COP(=O)(C)OC MCULE-7555071260 [1,1,0,0,0,0|2,0,0]=4 3405 B6R0.8 COP(=O)(Cl)OC MCULE-6641992442 [1,1,0,0,0,0|2,0,0]=4 3406 B6R0.8 COP(=O)(O)OC MCULE-4893199912 [1,1,0,0,0,0|2,0,0]=4 3407 B6R0.8 COP(=O)([O-])OC MCULE-8674997571 [1,1,0,0,0,0|2,0,0]=4 3408 B6R0.8 COP(=O)([S-])OC MCULE-9104059418 [1,1,0,0,0,0|2,0,0]=4 3409 B6R0.8 COS(=O)(=O)OC MCULE-2861298645 [1,1,0,0,0,0|2,0,0]=4 3410 B6R0.9 C/C=C(/C=O)\CC MCULE-4811305564 [1,1,0,0,0,0|1,0,0]=3 3411 B6R0.9 CC=C(C#N)CC MCULE-7873183675 [1,1,0,0,0,0|2,0,0]=4 3412 B6R0.9 CC=C(C=O)CC MCULE-3354209980 [1,1,0,0,0,0|1,0,0]=3 3413 B6R0.9 CC=C(CC)CC MCULE-5609717261 [1,1,0,0,0,0|2,0,0]=4 3414 B6R0.9 CCB(CC)OC MCULE-5839415433 [1,1,0,0,0,0|2,0,0]=4 3415 B6R0.9 CCC(=CO)CC MCULE-4973169590 [1,1,0,0,0,0|1,0,1]=4 3416 B6R0.9 CCC(=CO)CC MCULE-8459100577 [1,1,0,0,0,0|1,0,1]=4 3417 B6R0.9 CCC(C=O)CC MCULE-3529464122 [1,1,0,0,0,0|1,0,1]=4 3418 B6R0.9 CCC(CBr)OC MCULE-1656817461 [1,1,0,0,0,0|1,0,1]=4 3419 B6R0.9 CCC(CN)OC MCULE-2981477258 [1,1,0,0,0,0|1,0,1]=4 3420 B6R0.9 CCC(CN)OC MCULE-5102774189 [1,1,0,0,0,0|1,0,1]=4 3421 B6R0.9 CCC(CO)OC MCULE-3822452142 [1,1,0,0,0,0|0,0,2]=4 3422 B6R0.9 CCC(OC)OC MCULE-8987892974 [1,1,0,0,0,0|0,0,2]=4 3423 B6R0.9 CCN(C=O)CC MCULE-9053231156 [1,1,0,0,0,0|2,0,0]=4 3424 B6R0.9 CCN(CC)N=O MCULE-8931177297 [1,1,0,0,0,0|2,0,0]=4 3425 B6R0.9 COC(C=O)OC MCULE-7354932286 [1,1,0,0,0,0|1,0,1]=4 3426 B8R0.2 C=C(C(=O)OC)C(C)C MCULE-2572436258 [0,2,0,0,0,0|0,0,1]=3 3427 B8R0.2 C=C(C(=O)OC)C(C)O MCULE-5811418696 [0,2,0,0,0,0|0,0,1]=3 3428 B8R0.2 C=C(C)C(Cl)C(=O)OC MCULE-1665283862 [0,2,0,0,0,0|0,0,1]=3 3429 B8R0.2 C=C(N)C(N)C(=O)OC MCULE-5118385991 [0,2,0,0,0,0|0,0,2]=4 3430 B8R0.2 C=C(N)C(N)C(=O)OC MCULE-7419562140 [0,2,0,0,0,0|0,0,2]=4 3431 B8R0.2 C=C(N)C(N)C(=O)OC MCULE-8416732356 [0,2,0,0,0,0|0,0,2]=4 3432 B8R0.2 CC(C)C(N)C(=O)NN MCULE-8012264701 [0,2,0,0,0,0|2,0,0]=4 3433 B8R0.2 CC(C)C(N)C(=O)NN MCULE-8846048643 [0,2,0,0,0,0|2,0,0]=4 3434 B8R0.2 CC(C)C(N)C(=O)NO MCULE-1312472877 [0,2,0,0,0,0|2,0,0]=4 3435 B8R0.2 CC(C)C(N)C(=O)NO MCULE-1522587562 [0,2,0,0,0,0|2,0,0]=4 3436 B8R0.2 CC(C)[C@H](N)C(=O)CCl MCULE-2056415429 [0,2,0,0,0,0|2,0,0]=4 3437 B8R0.2 CC(C)[C@H](N)C(=O)CCl MCULE-2548722350 [0,2,0,0,0,0|2,0,0]=4 3438 B8R0.2 CC(C)[C@H](N)C(=O)CCl MCULE-4998965736 [0,2,0,0,0,0|2,0,0]=4 3439 B8R0.2 CC(C)[C@H](N)C(=O)CCl MCULE-8283580118 [0,2,0,0,0,0|2,0,0]=4 3440 B8R0.2 CCC(Br)C(=O)N(C)C MCULE-4967079536 [0,2,0,0,0,0|1,0,0]=3 3441 B8R0.2 CCC(C)C(=O)C(=O)O MCULE-2376245949 [0,2,0,0,0,0|2,0,0]=4 3442 B8R0.2 CCC(C)C(=O)C(=O)[O-] MCULE-9099284149 [0,2,0,0,0,0|2,0,0]=4 3443 B8R0.2 CCC(C)C(=O)C(C)C MCULE-5036699104 [0,2,0,0,0,0|1,0,0]=3 3444 B8R0.2 CCC(N)C(=O)N(C)C MCULE-7436417019 [0,2,0,0,0,0|1,0,0]=3 3445 B8R0.2 CCN(C)C(=O)C(C)Br MCULE-3591775660 [0,2,0,0,0,0|2,0,0]=4 3446 B8R0.2 CCN(C)C(=O)C(C)N MCULE-1338723028 [0,2,0,0,0,0|2,0,0]=4 3447 B8R0.2 CCN(C)C(=O)C(C)N MCULE-7082141732 [0,2,0,0,0,0|2,0,0]=4 3448 B8R0.2 CC[C@@H](N)C(=O)N(C)C MCULE-7595904175 [0,2,0,0,0,0|1,0,0]=3 3449 B8R0.2 CC[C@@H](N)C(=O)N(C)C MCULE-8778722434 [0,2,0,0,0,0|1,0,0]=3 3450 B8R0.2 CNC(=O)C(Cl)C(=O)C MCULE-7816149596 [0,2,0,0,0,0|1,0,1]=4 3451 B8R0.2 CNC(=O)C(N)C(C)C MCULE-5039980272 [0,2,0,0,0,0|1,0,0]=3 3452 B8R0.2 CNC(=O)C(N)C(C)C MCULE-6250670183 [0,2,0,0,0,0|1,0,0]=3 3453 B8R0.2 CNC(=O)C(N)C(C)O MCULE-1025476590 [0,2,0,0,0,0|1,0,0]=3 3454 B8R0.2 CNC(=O)C(N)C(C)O MCULE-6101866105 [0,2,0,0,0,0|1,0,0]=3 3455 B8R0.2 CNC(=O)[C@@H](N)C(C)C MCULE-2019787073 [0,2,0,0,0,0|1,0,0]=3 3456 B8R0.2 CNC(=O)[C@@H](N)C(C)C MCULE-4411063508 [0,2,0,0,0,0|1,0,0]=3 3457 B8R0.2 CNC(=O)[C@@H](N)C(C)C MCULE-4541405149 [0,2,0,0,0,0|1,0,0]=3 3458 B8R0.2 CNC(=O)[C@@H](N)C(C)C MCULE-6209151629 [0,2,0,0,0,0|1,0,0]=3 3459 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O MCULE-1326924990 [0,2,0,0,0,0|1,0,0]=3 3460 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O MCULE-5094760218 [0,2,0,0,0,0|1,0,0]=3 3461 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O MCULE-9454209271 [0,2,0,0,0,0|1,0,0]=3 3462 B8R0.2 CNC(=O)[C@@H](N)[C@@H](C)O MCULE-9558878758 [0,2,0,0,0,0|1,0,0]=3 3463 B8R0.2 CNC(C)C(=O)N(C)C MCULE-8857921885 [0,2,0,0,0,0|2,0,0]=4 3464 B8R0.2 CN[C@@H](C)C(=O)N(C)C MCULE-5765231303 [0,2,0,0,0,0|2,0,0]=4 3465 B8R0.2 CN[C@@H](C)C(=O)N(C)C MCULE-9148770350 [0,2,0,0,0,0|2,0,0]=4 3466 B8R0.2 COC(=O)C(=C(C)C)Br MCULE-8636120575 [0,2,0,0,0,0|0,0,2]=4 3467 B8R0.2 COC(=O)C(=O)C(C)Br MCULE-1006616025 [0,2,0,0,0,0|0,0,1]=3 3468 B8R0.2 COC(=O)C(=O)C(C)C MCULE-5411002089 [0,2,0,0,0,0|0,0,1]=3 3469 B8R0.2 COC(=O)C(=O)C(C)Cl MCULE-1746484890 [0,2,0,0,0,0|0,0,1]=3 3470 B8R0.2 COC(=O)C(=O)C(F)F MCULE-4830388166 [0,2,0,0,0,0|1,0,1]=4 3471 B8R0.2 COC(=O)C(=O)N(C)C MCULE-3358727731 [0,2,0,0,0,0|1,0,1]=4 3472 B8R0.2 COC(=O)C(Br)C(=O)C MCULE-4571030586 [0,2,0,0,0,0|0,0,1]=3 3473 B8R0.2 COC(=O)C(Br)C(C)Br MCULE-1209772107 [0,2,0,0,0,0|0,0,0]=2 3474 B8R0.2 COC(=O)C(Br)C(C)C MCULE-2879214598 [0,2,0,0,0,0|0,0,0]=2 3475 B8R0.2 COC(=O)C(C)C(=O)C MCULE-7473005493 [0,2,0,0,0,0|0,0,1]=3 3476 B8R0.2 COC(=O)C(C)C(=O)N MCULE-7480268767 [0,2,0,0,0,0|1,0,1]=4 3477 B8R0.2 COC(=O)C(C)C(=O)O MCULE-6548116408 [0,2,0,0,0,0|1,0,1]=4 3478 B8R0.2 COC(=O)C(C)C(C)O MCULE-1377857651 [0,2,0,0,0,0|0,0,0]=2 3479 B8R0.2 COC(=O)C(C)C(C)S MCULE-8090305970 [0,2,0,0,0,0|0,0,0]=2 3480 B8R0.2 COC(=O)C(C)N(=O)=O MCULE-1508014455 [0,2,0,0,0,0|2,0,0]=4 3481 B8R0.2 COC(=O)C(Cl)C(=O)C MCULE-8703201551 [0,2,0,0,0,0|0,0,1]=3 3482 B8R0.2 COC(=O)C(Cl)C(C)Cl MCULE-8079111955 [0,2,0,0,0,0|0,0,0]=2 3483 B8R0.2 COC(=O)C(N)C(=O)C MCULE-6003738013 [0,2,0,0,0,0|0,0,1]=3 3484 B8R0.2 COC(=O)C(N)C(=O)C MCULE-6286319401 [0,2,0,0,0,0|0,0,1]=3 3485 B8R0.2 COC(=O)C(N)C(=O)O MCULE-2696171130 [0,2,0,0,0,0|1,0,1]=4 3486 B8R0.2 COC(=O)C(N)C(=O)O MCULE-7192453479 [0,2,0,0,0,0|1,0,1]=4 3487 B8R0.2 COC(=O)C(N)C(C)C MCULE-2054930909 [0,2,0,0,0,0|0,0,0]=2 3488 B8R0.2 COC(=O)C(N)C(C)C MCULE-2312805449 [0,2,0,0,0,0|0,0,0]=2 3489 B8R0.2 COC(=O)C(N)C(C)C MCULE-4433456538 [0,2,0,0,0,0|0,0,0]=2 3490 B8R0.2 COC(=O)C(N)C(C)C MCULE-4595803138 [0,2,0,0,0,0|0,0,0]=2 3491 B8R0.2 COC(=O)C(N)C(C)Cl MCULE-6074076208 [0,2,0,0,0,0|0,0,0]=2 3492 B8R0.2 COC(=O)C(N)C(C)Cl MCULE-6154308704 [0,2,0,0,0,0|0,0,0]=2 3493 B8R0.2 COC(=O)C(N)C(C)O MCULE-4054504482 [0,2,0,0,0,0|0,0,0]=2 3494 B8R0.2 COC(=O)C(N)C(C)O MCULE-5137175004 [0,2,0,0,0,0|0,0,0]=2 3495 B8R0.2 COC(=O)C(O)C(C)Br MCULE-7007726043 [0,2,0,0,0,0|0,0,0]=2 3496 B8R0.2 COC(=O)C(O)C(C)C MCULE-8424293497 [0,2,0,0,0,0|0,0,0]=2 3497 B8R0.2 COC(=O)C(O)C(C)N MCULE-7579168292 [0,2,0,0,0,0|0,0,0]=2 3498 B8R0.2 COC(=O)C(S)C(C)C MCULE-4177105598 [0,2,0,0,0,0|0,0,0]=2 3499 B8R0.2 COC(=O)[C@@H](N)C(=O)O MCULE-3813999303 [0,2,0,0,0,0|1,0,1]=4 3500 B8R0.2 COC(=O)[C@@H](N)C(=O)O MCULE-7475117362 [0,2,0,0,0,0|1,0,1]=4 3501 B8R0.2 COC(=O)[C@@H](N)C(C)C MCULE-1961120276 [0,2,0,0,0,0|0,0,0]=2 3502 B8R0.2 COC(=O)[C@@H](N)C(C)C MCULE-7694873432 [0,2,0,0,0,0|0,0,0]=2 3503 B8R0.2 COC(=O)[C@@H](N)C(C)C MCULE-9509659105 [0,2,0,0,0,0|0,0,0]=2 3504 B8R0.2 COC(=O)[C@@H](N)C(C)C MCULE-9828778245 [0,2,0,0,0,0|0,0,0]=2 3505 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-3396042563 [0,2,0,0,0,0|0,0,0]=2 3506 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-3984373535 [0,2,0,0,0,0|0,0,0]=2 3507 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-5105961994 [0,2,0,0,0,0|0,0,0]=2 3508 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-6341068916 [0,2,0,0,0,0|0,0,0]=2 3509 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-6365007520 [0,2,0,0,0,0|0,0,0]=2 3510 B8R0.2 COC(=O)[C@@H](N)[C@@H](C)O MCULE-9648470447 [0,2,0,0,0,0|0,0,0]=2 3511 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-1344493357 [0,2,0,0,0,0|0,0,0]=2 3512 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-2707639795 [0,2,0,0,0,0|0,0,0]=2 3513 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-5310976879 [0,2,0,0,0,0|0,0,0]=2 3514 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-5466279343 [0,2,0,0,0,0|0,0,0]=2 3515 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-7651050243 [0,2,0,0,0,0|0,0,0]=2 3516 B8R0.2 COC(=O)[C@@H](N)[C@H](C)O MCULE-9066216802 [0,2,0,0,0,0|0,0,0]=2 3517 B8R0.2 COC(=O)[C@@H](O)C(C)C MCULE-5130677971 [0,2,0,0,0,0|0,0,0]=2 3518 B8R0.2 COC(=O)[C@@H](O)C(C)C MCULE-7282119938 [0,2,0,0,0,0|0,0,0]=2 3519 B8R0.2 COC(=O)[C@H](C)[C@@H](C)N MCULE-1711341812 [0,2,0,0,0,0|0,0,0]=2 3520 B8R0.2 COC(=O)[C@H](C)[C@@H](C)N MCULE-1867656873 [0,2,0,0,0,0|0,0,0]=2 3521 B8R0.2 COC(=O)[C@H](C)[C@@H](C)N MCULE-3450004076 [0,2,0,0,0,0|0,0,0]=2 3522 B8R0.2 COC(=O)[C@H](C)[C@@H](C)N MCULE-7295638242 [0,2,0,0,0,0|0,0,0]=2 3523 B8R0.2 COC(=O)[C@H](N)C(C)C MCULE-2129476798 [0,2,0,0,0,0|0,0,0]=2 3524 B8R0.2 COC(=O)[C@H](N)C(C)C MCULE-5614881016 [0,2,0,0,0,0|0,0,0]=2 3525 B8R0.2 COC(=O)[C@H](N)C(C)C MCULE-5653129894 [0,2,0,0,0,0|0,0,0]=2 3526 B8R0.2 COC(=O)[C@H](N)C(C)C MCULE-7878824190 [0,2,0,0,0,0|0,0,0]=2 3527 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O MCULE-5915481519 [0,2,0,0,0,0|0,0,0]=2 3528 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O MCULE-6143392922 [0,2,0,0,0,0|0,0,0]=2 3529 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O MCULE-8582390480 [0,2,0,0,0,0|0,0,0]=2 3530 B8R0.2 COC(=O)[C@H](N)[C@@H](C)O MCULE-8654293763 [0,2,0,0,0,0|0,0,0]=2 3531 B8R0.2 COC(=O)[C@H](N)[C@H](C)O MCULE-1159030229 [0,2,0,0,0,0|0,0,0]=2 3532 B8R0.2 COC(=O)[C@H](N)[C@H](C)O MCULE-3519054990 [0,2,0,0,0,0|0,0,0]=2 3533 B8R0.2 COC(=O)[C@H](N)[C@H](C)O MCULE-9015310634 [0,2,0,0,0,0|0,0,0]=2 3534 B8R0.2 COC(=O)[C@H](N)[C@H](C)O MCULE-9519182030 [0,2,0,0,0,0|0,0,0]=2 3535 B8R0.2 COC(=O)[C@H](O)C(C)C MCULE-2046755935 [0,2,0,0,0,0|0,0,0]=2 3536 B8R0.2 COC(=O)[C@H](O)C(C)C MCULE-7450255928 [0,2,0,0,0,0|0,0,0]=2 3537 B8R0.5 C/C=C/C(=O)OC(C)C MCULE-1616974622 [0,2,0,0,0,0|0,0,2]=4 3538 B8R0.5 C=C(Br)CC(=O)OCC MCULE-2786450044 [0,2,0,0,0,0|0,0,2]=4 3539 B8R0.5 CC(C)CC(=O)CC#N MCULE-2694593001 [0,2,0,0,0,0|1,0,1]=4 3540 B8R0.5 CC(C)CC(=O)OCCl MCULE-3506308902 [0,2,0,0,0,0|0,0,0]=2 3541 B8R0.5 CC(C)CC(=O)OCI MCULE-8217025108 [0,2,0,0,0,0|0,0,0]=2 3542 B8R0.5 CC(C)NC(=O)CCBr MCULE-9236552754 [0,2,0,0,0,0|2,0,0]=4 3543 B8R0.5 CC(C)NC(=O)CCCl MCULE-8307702410 [0,2,0,0,0,0|2,0,0]=4 3544 B8R0.5 CC(C)NC(=O)CCN MCULE-5092379026 [0,2,0,0,0,0|2,0,0]=4 3545 B8R0.5 CC(C)NC(=O)CCN MCULE-7853792621 [0,2,0,0,0,0|2,0,0]=4 3546 B8R0.5 CC(C)NC(=O)CCO MCULE-2988622710 [0,2,0,0,0,0|2,0,0]=4 3547 B8R0.5 CC(C)NC(=O)OCCl MCULE-9464097550 [0,2,0,0,0,0|1,0,0]=3 3548 B8R0.5 CC(C)OC(=O)CC#N MCULE-7936509362 [0,2,0,0,0,0|1,0,1]=4 3549 B8R0.5 CC(C)OC(=O)CCBr MCULE-2382797929 [0,2,0,0,0,0|1,0,0]=3 3550 B8R0.5 CC(C)OC(=O)CCCl MCULE-7655932888 [0,2,0,0,0,0|1,0,0]=3 3551 B8R0.5 CC(C)OC(=O)CCN MCULE-8590072190 [0,2,0,0,0,0|1,0,0]=3 3552 B8R0.5 CC(C)OC(=O)CCS MCULE-6681403441 [0,2,0,0,0,0|1,0,0]=3 3553 B8R0.5 CC(C)OC(=O)OCCl MCULE-6987085424 [0,2,0,0,0,0|1,0,0]=3 3554 B8R0.5 CC(C)OC(=O)OCI MCULE-7199284723 [0,2,0,0,0,0|1,0,0]=3 3555 B8R0.5 CC=CC(=O)OC(C)C MCULE-1964573167 [0,2,0,0,0,0|0,0,2]=4 3556 B8R0.5 CCCC(=O)CC(=O)C MCULE-1126963023 [0,2,0,0,0,0|1,0,0]=3 3557 B8R0.5 CCCC(=O)CC(=O)O MCULE-8977313826 [0,2,0,0,0,0|1,0,1]=4 3558 B8R0.5 CCCC(=O)CC(C)C MCULE-1475988710 [0,2,0,0,0,0|1,0,0]=3 3559 B8R0.5 CCCC(=O)NC(C)C MCULE-1125409776 [0,2,0,0,0,0|1,0,0]=3 3560 B8R0.5 CCCC(=O)OC(C)C MCULE-1932528429 [0,2,0,0,0,0|0,0,0]=2 3561 B8R0.5 CCCC(C)OC(=O)C MCULE-2841775696 [0,2,0,0,0,0|1,0,1]=4 3562 B8R0.5 CCNC(=O)CC(C)O MCULE-1959743741 [0,2,0,0,0,0|1,0,0]=3 3563 B8R0.5 CCNC(=S)OC(C)C MCULE-9062760119 [0,2,0,0,0,0|1,1,0]=4 3564 B8R0.5 CCOC(=N)CC(C)C MCULE-4196552764 [0,2,0,0,0,0|1,0,0]=3 3565 B8R0.5 CCOC(=N)CC(C)C MCULE-7556709104 [0,2,0,0,0,0|1,0,0]=3 3566 B8R0.5 CCOC(=O)/C=C(/C)\I MCULE-5085340581 [0,2,0,0,0,0|0,0,2]=4 3567 B8R0.5 CCOC(=O)/C=C(/C)\N MCULE-2741839757 [0,2,0,0,0,0|0,0,2]=4 3568 B8R0.5 CCOC(=O)/C=C(/C)\[O-] MCULE-8926472469 [0,2,0,0,0,0|0,0,2]=4 3569 B8R0.5 CCOC(=O)/C=C(/C)\[O-] MCULE-9996122453 [0,2,0,0,0,0|0,0,2]=4 3570 B8R0.5 CCOC(=O)/C=C(\C)/N MCULE-2531351299 [0,2,0,0,0,0|0,0,2]=4 3571 B8R0.5 CCOC(=O)C=C(C)C MCULE-2935651341 [0,2,0,0,0,0|0,0,2]=4 3572 B8R0.5 CCOC(=O)C=C(C)I MCULE-4319141798 [0,2,0,0,0,0|0,0,2]=4 3573 B8R0.5 CCOC(=O)C=C(C)N MCULE-5559390637 [0,2,0,0,0,0|0,0,2]=4 3574 B8R0.5 CCOC(=O)CC(=N)N MCULE-2205626178 [0,2,0,0,0,0|1,0,1]=4 3575 B8R0.5 CCOC(=O)CC(=N)N MCULE-7102889149 [0,2,0,0,0,0|1,0,1]=4 3576 B8R0.5 CCOC(=O)CC(=O)C MCULE-8615117086 [0,2,0,0,0,0|0,0,1]=3 3577 B8R0.5 CCOC(=O)CC(=O)Cl MCULE-2946486230 [0,2,0,0,0,0|1,0,1]=4 3578 B8R0.5 CCOC(=O)CC(=O)N MCULE-7799038725 [0,2,0,0,0,0|1,0,1]=4 3579 B8R0.5 CCOC(=O)CC(=O)O MCULE-9495505919 [0,2,0,0,0,0|1,0,1]=4 3580 B8R0.5 CCOC(=O)CC(=O)[O-] MCULE-6229774103 [0,2,0,0,0,0|1,0,1]=4 3581 B8R0.5 CCOC(=O)CC(=S)N MCULE-8264583697 [0,2,0,0,0,0|1,0,1]=4 3582 B8R0.5 CCOC(=O)CC(C)Br MCULE-4224246188 [0,2,0,0,0,0|0,0,0]=2 3583 B8R0.5 CCOC(=O)CC(C)C MCULE-1409113611 [0,2,0,0,0,0|0,0,0]=2 3584 B8R0.5 CCOC(=O)CC(C)N MCULE-1243805331 [0,2,0,0,0,0|0,0,0]=2 3585 B8R0.5 CCOC(=O)CC(C)N MCULE-5115744093 [0,2,0,0,0,0|0,0,0]=2 3586 B8R0.5 CCOC(=O)CC(C)N MCULE-5865270424 [0,2,0,0,0,0|0,0,0]=2 3587 B8R0.5 CCOC(=O)CC(C)N MCULE-7563274819 [0,2,0,0,0,0|0,0,0]=2 3588 B8R0.5 CCOC(=O)CC(C)O MCULE-5738582973 [0,2,0,0,0,0|0,0,0]=2 3589 B8R0.5 CCOC(=O)CC(C)O MCULE-7412227285 [0,2,0,0,0,0|0,0,0]=2 3590 B8R0.5 CCOC(=O)CC(C)S MCULE-1321603394 [0,2,0,0,0,0|0,0,0]=2 3591 B8R0.5 CCOC(=O)CC(F)F MCULE-9099238197 [0,2,0,0,0,0|1,0,0]=3 3592 B8R0.5 CCOC(=O)CN(=O)=O MCULE-2325981285 [0,2,0,0,0,0|2,0,0]=4 3593 B8R0.5 CCOC(=O)CN(C)C MCULE-7481726803 [0,2,0,0,0,0|1,0,0]=3 3594 B8R0.5 CCOC(=O)C[C@@H](C)N MCULE-1945272442 [0,2,0,0,0,0|0,0,0]=2 3595 B8R0.5 CCOC(=O)C[C@@H](C)N MCULE-2760267862 [0,2,0,0,0,0|0,0,0]=2 3596 B8R0.5 CCOC(=O)C[C@@H](C)N MCULE-3046196442 [0,2,0,0,0,0|0,0,0]=2 3597 B8R0.5 CCOC(=O)C[C@@H](C)N MCULE-8919184785 [0,2,0,0,0,0|0,0,0]=2 3598 B8R0.5 CCOC(=O)C[C@@H](C)O MCULE-2482059514 [0,2,0,0,0,0|0,0,0]=2 3599 B8R0.5 CCOC(=O)C[C@@H](C)O MCULE-7632639859 [0,2,0,0,0,0|0,0,0]=2 3600 B8R0.5 CCOC(=O)C[C@H](C)N MCULE-2736239635 [0,2,0,0,0,0|0,0,0]=2 3601 B8R0.5 CCOC(=O)C[C@H](C)N MCULE-4857755885 [0,2,0,0,0,0|0,0,0]=2 3602 B8R0.5 CCOC(=O)C[C@H](C)N MCULE-8001518919 [0,2,0,0,0,0|0,0,0]=2 3603 B8R0.5 CCOC(=O)C[C@H](C)N MCULE-9141489226 [0,2,0,0,0,0|0,0,0]=2 3604 B8R0.5 CCOC(=O)C[C@H](C)O MCULE-7934535288 [0,2,0,0,0,0|0,0,0]=2 3605 B8R0.5 CCOC(=O)C[C@H](C)O MCULE-8099928659 [0,2,0,0,0,0|0,0,0]=2 3606 B8R0.5 CCOC(=O)C[S+](C)C MCULE-6931339935 [0,2,0,0,0,0|1,0,0]=3 3607 B8R0.5 CCOC(=O)C[S+](C)C MCULE-7075454926 [0,2,0,0,0,0|1,0,0]=3 3608 B8R0.5 CCOC(=O)NC(=O)C MCULE-8711109897 [0,2,0,0,0,0|1,0,1]=4 3609 B8R0.5 CCOC(=O)NC(C)C MCULE-1540464163 [0,2,0,0,0,0|1,0,0]=3 3610 B8R0.5 CCOC(=O)OC(C)Cl MCULE-6170131499 [0,2,0,0,0,0|1,0,0]=3 3611 B8R0.5 CNCC(=O)NC(C)C MCULE-3564656726 [0,2,0,0,0,0|2,0,0]=4 3612 B8R0.5 CNCC(=O)NC(C)C MCULE-7083002433 [0,2,0,0,0,0|2,0,0]=4 3613 B8R0.5 COCC(=O)CC(=O)C MCULE-8600900987 [0,2,0,0,0,0|0,0,1]=3 3614 B8R0.5 COCC(=O)CC(C)C MCULE-3040467675 [0,2,0,0,0,0|0,0,0]=2 3615 B8R0.5 COCC(=O)OC(C)C MCULE-3543304597 [0,2,0,0,0,0|1,0,0]=3 3616 B8R0.5 COCC(O)CC(C)C MCULE-8774838486 [0,2,0,0,0,0|0,0,2]=4 3617 B8R0.5 COC[C@H](N)CC(C)C MCULE-2740362594 [0,2,0,0,0,0|1,0,1]=4 3618 B8R0.16 CO/C(=C/N(C)C)/C=O MCULE-7624417388 [0,2,0,0,0,0|1,0,1]=4 3619 B8R0.16 COC(=CN(C)C)C=O MCULE-9451220083 [0,2,0,0,0,0|1,0,1]=4 3620 B8R0.16 COC(C=O)CC(C)C MCULE-3050869989 [0,2,0,0,0,0|0,0,1]=3 3621 B8R0.16 COC(CBr)CC(C)C MCULE-9677392653 [0,2,0,0,0,0|1,0,1]=4 3622 B8R0.16 COC(CC(C)O)OC MCULE-7166834512 [0,2,0,0,0,0|0,0,2]=4 3623 B8R0.16 COC(CN)CC(C)C MCULE-1093186897 [0,2,0,0,0,0|1,0,1]=4 3624 B8R0.19 C(O)(CC)CC(=O)OC MCULE-6615199457 [0,2,0,0,0,0|0,0,0]=2 3625 B8R0.19 C=C(C#N)CC(=O)OC MCULE-6170444323 [0,2,0,0,0,0|0,0,2]=4 3626 B8R0.19 C=C(CCl)CC(=O)OC MCULE-3436182948 [0,2,0,0,0,0|0,0,1]=3 3627 B8R0.19 CCC(=O)CC(=O)CC MCULE-9368471361 [0,2,0,0,0,0|1,0,0]=3 3628 B8R0.19 CCC(=O)CC(=O)OC MCULE-1605349915 [0,2,0,0,0,0|0,0,0]=2 3629 B8R0.19 CCC(=O)CC(C)CC MCULE-8568086135 [0,2,0,0,0,0|1,0,0]=3 3630 B8R0.19 CCC(=O)NC(C)C#N MCULE-2045424973 [0,2,0,0,0,0|2,0,0]=4 3631 B8R0.19 CCC(=O)OC(=O)CC MCULE-4790806387 [0,2,0,0,0,0|1,0,1]=4 3632 B8R0.19 CCC(=O)OC(C)CC MCULE-9589388650 [0,2,0,0,0,0|1,0,0]=3 3633 B8R0.19 CCC(C)CC(=O)OC MCULE-6040162942 [0,2,0,0,0,0|0,0,0]=2 3634 B8R0.19 CCC(C)NC(=O)CBr MCULE-1471524055 [0,2,0,0,0,0|2,0,0]=4 3635 B8R0.19 CCC(C)NC(=O)CCl MCULE-1032516079 [0,2,0,0,0,0|2,0,0]=4 3636 B8R0.19 CCC(C)NC(=O)CN MCULE-2235248545 [0,2,0,0,0,0|2,0,0]=4 3637 B8R0.19 CCC(C)NC(=O)CN MCULE-5232759952 [0,2,0,0,0,0|2,0,0]=4 3638 B8R0.19 CCC(C)NC(=S)NC MCULE-5202176198 [0,2,0,0,0,0|1,1,0]=4 3639 B8R0.19 CCC(C)OC(=O)NN MCULE-8409912635 [0,2,0,0,0,0|2,0,0]=4 3640 B8R0.19 CCC(N)CC(=O)OC MCULE-4861062224 [0,2,0,0,0,0|0,0,0]=2 3641 B8R0.19 CCC(N)CC(=O)OC MCULE-5474414259 [0,2,0,0,0,0|0,0,0]=2 3642 B8R0.19 CCC(N)CC(=O)OC MCULE-6614411962 [0,2,0,0,0,0|0,0,0]=2 3643 B8R0.19 CCC(N)CC(=O)OC MCULE-8833088600 [0,2,0,0,0,0|0,0,0]=2 3644 B8R0.19 CCN(C)CC(=O)NN MCULE-1832911721 [0,2,0,0,0,0|2,0,0]=4 3645 B8R0.19 CCN(C)CC(=O)NN MCULE-2865164993 [0,2,0,0,0,0|2,0,0]=4 3646 B8R0.19 CCN(C)CC(=O)NN MCULE-7681557684 [0,2,0,0,0,0|2,0,0]=4 3647 B8R0.19 CC[C@@H](N)CC(=O)OC MCULE-2253918492 [0,2,0,0,0,0|0,0,0]=2 3648 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-7264527834 [0,2,0,0,0,0|0,0,0]=2 3649 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-8077794874 [0,2,0,0,0,0|0,0,0]=2 3650 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-1636989319 [0,2,0,0,0,0|0,0,0]=2 3651 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-6253948831 [0,2,0,0,0,0|0,0,0]=2 3652 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-7924708820 [0,2,0,0,0,0|0,0,0]=2 3653 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-8911472049 [0,2,0,0,0,0|0,0,0]=2 3654 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-3861554927 [0,2,0,0,0,0|0,0,0]=2 3655 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-6307000918 [0,2,0,0,0,0|0,0,0]=2 3656 B8R0.19 CN/C(=C/C(=O)OC)/C MCULE-6748104823 [0,2,0,0,0,0|0,0,2]=4 3657 B8R0.19 CN/C(=C\C(=O)OC)/C MCULE-6583518879 [0,2,0,0,0,0|0,0,2]=4 3658 B8R0.19 CNC(=CC(=O)OC)C MCULE-1607524183 [0,2,0,0,0,0|0,0,2]=4 3659 B8R0.19 CNC(=O)CC(=O)NC MCULE-9228601964 [0,2,0,0,0,0|1,0,1]=4 3660 B8R0.19 CNC(=O)CC(C)NC MCULE-8409395532 [0,2,0,0,0,0|1,0,0]=3 3661 B8R0.19 CNC(=O)CC(C)NC MCULE-9311295772 [0,2,0,0,0,0|1,0,0]=3 3662 B8R0.19 CNC(C)CC(=O)OC MCULE-1039195486 [0,2,0,0,0,0|0,0,0]=2 3663 B8R0.19 COC(=N)CC(=N)OC MCULE-4595570584 [0,2,0,0,0,0|1,0,1]=4 3664 B8R0.19 COC(=N)CC(=N)OC MCULE-4616387451 [0,2,0,0,0,0|1,0,1]=4 3665 B8R0.19 COC(=N)CC(=O)OC MCULE-2416316391 [0,2,0,0,0,0|0,0,1]=3 3666 B8R0.19 COC(=N)CC(=O)OC MCULE-9193442551 [0,2,0,0,0,0|0,0,1]=3 3667 B8R0.19 COC(=O)/C=C(\C)/OC MCULE-8813923973 [0,2,0,0,0,0|0,0,2]=4 3668 B8R0.19 COC(=O)C=C(C)C=O MCULE-8776671343 [0,2,0,0,0,0|0,0,2]=4 3669 B8R0.19 COC(=O)C=C(C)OC MCULE-1610055087 [0,2,0,0,0,0|0,0,2]=4 3670 B8R0.19 COC(=O)C=C(N)CF MCULE-6823347436 [0,2,0,0,0,0|0,0,2]=4 3671 B8R0.19 COC(=O)CC(=O)CCl MCULE-1683633113 [0,2,0,0,0,0|0,0,1]=3 3672 B8R0.19 COC(=O)CC(=O)OC MCULE-1727448163 [0,2,0,0,0,0|0,0,1]=3 3673 B8R0.19 COC(=O)CC(C)C=O MCULE-1183479071 [0,2,0,0,0,0|0,0,0]=2 3674 B8R0.19 COC(=O)CC(C)CBr MCULE-9170421446 [0,2,0,0,0,0|0,0,0]=2 3675 B8R0.19 COC(=O)CC(C)SC MCULE-9425584839 [0,2,0,0,0,0|0,0,0]=2 3676 B8R0.19 COC(=O)CC(N)CN MCULE-3079708048 [0,2,0,0,0,0|0,0,0]=2 3677 B8R0.19 COC(=O)CC(N)CN MCULE-5046271852 [0,2,0,0,0,0|0,0,0]=2 3678 B8R0.19 COC(=O)CC(N)CO MCULE-4803123890 [0,2,0,0,0,0|0,0,0]=2 3679 B8R0.19 COC(=O)CC(N)CO MCULE-5372024399 [0,2,0,0,0,0|0,0,0]=2 3680 B8R0.19 COC(=O)CC(O)CCl MCULE-3924993874 [0,2,0,0,0,0|0,0,0]=2 3681 B8R0.19 COC(=O)CC(O)CN MCULE-6633164904 [0,2,0,0,0,0|0,0,0]=2 3682 B8R0.19 COC(=O)CC(O)CN MCULE-6973205945 [0,2,0,0,0,0|0,0,0]=2 3683 B8R0.19 COC(=O)CC(O)CO MCULE-1721395490 [0,2,0,0,0,0|0,0,0]=2 3684 B8R0.19 COC(=O)CC(O)CO MCULE-7578547932 [0,2,0,0,0,0|0,0,0]=2 3685 B8R0.19 COC(=O)CN(C)C=O MCULE-9266775990 [0,2,0,0,0,0|1,0,0]=3 3686 B8R0.19 COC(=O)C[C@@H](O)CCl MCULE-2437500598 [0,2,0,0,0,0|0,0,0]=2 3687 B8R0.19 COC(=O)C[C@@H](O)CCl MCULE-2535323310 [0,2,0,0,0,0|0,0,0]=2 3688 B8R0.19 COC(=O)C[C@H](O)CCl MCULE-2232290900 [0,2,0,0,0,0|0,0,0]=2 3689 B8R0.19 COC(=O)C[C@H](O)CCl MCULE-2298624118 [0,2,0,0,0,0|0,0,0]=2 3690 B8R0.19 COC(=O)C[C@H](O)CO MCULE-3243102477 [0,2,0,0,0,0|0,0,0]=2 3691 B8R0.19 COC(=O)C[C@H](O)CO MCULE-7538479392 [0,2,0,0,0,0|0,0,0]=2 3692 B8R0.19 COC(=O)NC(=O)CCl MCULE-6558463162 [0,2,0,0,0,0|1,0,1]=4 3693 B8R0.19 COC(=O)NC(C)CN MCULE-4563927308 [0,2,0,0,0,0|1,0,0]=3 3694 B8R0.19 COC(=O)NC(C)CN MCULE-8813177733 [0,2,0,0,0,0|1,0,0]=3 3695 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-1533957902 [0,2,0,0,0,0|1,0,0]=3 3696 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-7036214898 [0,2,0,0,0,0|1,0,0]=3 3697 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-8908212489 [0,2,0,0,0,0|1,0,0]=3 3698 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-9526857370 [0,2,0,0,0,0|1,0,0]=3 3699 B8R0.19 COC(=O)OC(=O)OC MCULE-4144943626 [0,2,0,0,0,0|1,0,1]=4 3700 B8R0.19 CSC(=O)NC(C)CBr MCULE-5023672306 [0,2,0,0,0,0|1,1,0]=4 3701 B8R0.19 CSC(=O)NC(C)CCl MCULE-7349275493 [0,2,0,0,0,0|1,1,0]=4 3702 B8R0.19 NNC(=O)CC(O)CCl MCULE-4502390137 [0,2,0,0,0,0|2,0,0]=4 3703 B8R0.19 O=C(CO)CC(O)CO MCULE-2853556664 [0,2,0,0,0,0|2,0,0]=4 3704 B8R0.19 [C@@H](N)(CC)CC(=O)OC MCULE-3287738066 [0,2,0,0,0,0|0,0,0]=2 3705 B8R0.23 C=C(C)C(=O)NC(C)C MCULE-6969715832 [0,2,0,0,0,0|2,0,0]=4 3706 B8R0.23 C=C(C)C(=O)OC(C)C MCULE-7412492861 [0,2,0,0,0,0|2,0,0]=4 3707 B8R0.23 C=C(CC(C)C)C(=O)C MCULE-3118173847 [0,2,0,0,0,0|2,0,0]=4 3708 B8R0.23 CC(=O)C(=O)CC(C)C MCULE-9490612135 [0,2,0,0,0,0|1,0,0]=3 3709 B8R0.23 CC(=O)C(=O)OC(C)C MCULE-5022020155 [0,2,0,0,0,0|2,0,0]=4 3710 B8R0.23 CC(=O)CC(=O)C(C)C MCULE-9885161576 [0,2,0,0,0,0|1,0,1]=4 3711 B8R0.23 CC(=O)CC(=O)N(C)C MCULE-7573334456 [0,2,0,0,0,0|1,0,1]=4 3712 B8R0.23 CC(C)CC(=O)C(=O)O MCULE-4155006996 [0,2,0,0,0,0|2,0,0]=4 3713 B8R0.23 CC(C)CC(=O)C(=O)[O-] MCULE-1379368650 [0,2,0,0,0,0|2,0,0]=4 3714 B8R0.23 CC(C)CC(=O)C(=O)[O-] MCULE-8698784345 [0,2,0,0,0,0|2,0,0]=4 3715 B8R0.23 CC(C)CC(=O)C(C)C MCULE-4667603330 [0,2,0,0,0,0|1,0,0]=3 3716 B8R0.23 CC(C)CC(=O)N(C)C MCULE-4436370176 [0,2,0,0,0,0|1,0,0]=3 3717 B8R0.23 CC(C)NC(=O)C(C)Br MCULE-2705104987 [0,2,0,0,0,0|2,0,0]=4 3718 B8R0.23 CC(C)NC(=O)C(C)C MCULE-9364554322 [0,2,0,0,0,0|2,0,0]=4 3719 B8R0.23 CC(C)NC(=O)C(C)Cl MCULE-1123470019 [0,2,0,0,0,0|2,0,0]=4 3720 B8R0.23 CC(C)NC(=O)C(C)N MCULE-4756966315 [0,2,0,0,0,0|2,0,0]=4 3721 B8R0.23 CC(C)NC(=O)C(C)N MCULE-9539692293 [0,2,0,0,0,0|2,0,0]=4 3722 B8R0.23 CC(C)NC(=O)C(C)O MCULE-5960769473 [0,2,0,0,0,0|2,0,0]=4 3723 B8R0.23 CC(C)OC(=O)C(C)Br MCULE-6497706811 [0,2,0,0,0,0|2,0,0]=4 3724 B8R0.23 CC(C)OC(=O)C(C)C MCULE-6600918499 [0,2,0,0,0,0|2,0,0]=4 3725 B8R0.23 CC(C)OC(=O)C(C)N MCULE-1348323004 [0,2,0,0,0,0|2,0,0]=4 3726 B8R0.23 CC(C)OC(=O)C(C)N MCULE-1795700258 [0,2,0,0,0,0|2,0,0]=4 3727 B8R0.23 CC(C)OC(=O)C(C)N MCULE-4316512376 [0,2,0,0,0,0|2,0,0]=4 3728 B8R0.23 CC(C)OC(=O)C(C)N MCULE-9367187198 [0,2,0,0,0,0|2,0,0]=4 3729 B8R0.23 CC(C)OC(=O)N(C)C MCULE-9193649781 [0,2,0,0,0,0|2,0,0]=4 3730 B8R0.23 CC(C)OC(=O)[C@@H](C)N MCULE-2922878846 [0,2,0,0,0,0|2,0,0]=4 3731 B8R0.23 CC(C)OC(=O)[C@@H](C)N MCULE-6865398945 [0,2,0,0,0,0|2,0,0]=4 3732 B8R0.23 CC(C)OC(=O)[C@@H](C)N MCULE-6991704132 [0,2,0,0,0,0|2,0,0]=4 3733 B8R0.23 CC(C)OC(=O)[C@@H](C)N MCULE-7311326252 [0,2,0,0,0,0|2,0,0]=4 3734 B8R0.23 CC(C)OC(=O)[C@H](C)N MCULE-1976586999 [0,2,0,0,0,0|2,0,0]=4 3735 B8R0.23 CC(C)OC(=O)[C@H](C)N MCULE-2644914807 [0,2,0,0,0,0|2,0,0]=4 3736 B8R0.23 CC(C)OC(=O)[C@H](C)N MCULE-2911837562 [0,2,0,0,0,0|2,0,0]=4 3737 B8R0.23 CC(C)OC(=O)[C@H](C)N MCULE-6075128478 [0,2,0,0,0,0|2,0,0]=4 3738 B8R0.23 CC(C)OC(=O)[C@H](C)O MCULE-9709197677 [0,2,0,0,0,0|2,0,0]=4 3739 B8R0.23 CC(Cl)OC(=O)C(C)C MCULE-7266303253 [0,2,0,0,0,0|2,0,0]=4 3740 B8R0.23 CN(C)CC(=O)N(C)O MCULE-4554994791 [0,2,0,0,0,0|2,0,0]=4 3741 B8R0.23 C[C@H](O)CC(=O)N(C)C MCULE-1249894790 [0,2,0,0,0,0|1,0,0]=3 3742 B8R0.24 CC(C)(C)CC(=O)CBr MCULE-3003238476 [0,2,0,0,0,0|2,0,0]=4 3743 B8R0.24 CC(C)(C)CC(=O)NN MCULE-2447850618 [0,2,0,0,0,0|2,0,0]=4 3744 B8R0.24 CC(C)(C)CC(=O)NN MCULE-4899801536 [0,2,0,0,0,0|2,0,0]=4 3745 B8R0.24 CC(C)(C)CC(=O)NO MCULE-7851302505 [0,2,0,0,0,0|2,0,0]=4 3746 B8R0.24 CCC(=O)NC(C)(C)C MCULE-1912132197 [0,2,0,0,0,0|2,0,0]=4 3747 B8R0.24 CCC(=O)OC(C)(C)C MCULE-1989062577 [0,2,0,0,0,0|2,0,0]=4 3748 B8R0.24 CNC(=O)CS(=O)(=O)C MCULE-7688916364 [0,2,0,0,0,0|2,0,0]=4 3749 B8R0.24 CNC(=O)OC(C)(C)C MCULE-6409542037 [0,2,0,0,0,0|2,0,0]=4 3750 B8R0.24 COC(=O)CC(C)(C)Br MCULE-8991861071 [0,2,0,0,0,0|0,0,0]=2 3751 B8R0.24 COC(=O)CC(C)(C)C MCULE-3411402706 [0,2,0,0,0,0|0,0,0]=2 3752 B8R0.24 COC(=O)CC(C)(C)N MCULE-1261823146 [0,2,0,0,0,0|0,0,0]=2 3753 B8R0.24 COC(=O)CC(C)(C)N MCULE-9654641564 [0,2,0,0,0,0|0,0,0]=2 3754 B8R0.24 COC(=O)CC(C)(C)O MCULE-7166479769 [0,2,0,0,0,0|0,0,0]=2 3755 B8R0.24 COC(=O)CC(C)(F)F MCULE-7009111440 [0,2,0,0,0,0|0,0,0]=2 3756 B8R0.24 COC(=O)CC(F)(F)F MCULE-6904688197 [0,2,0,0,0,0|1,0,0]=3 3757 B8R0.24 COC(=O)CP(=O)(O)O MCULE-7218551741 [0,2,0,0,0,0|2,0,0]=4 3758 B8R0.24 COC(=O)CS(=O)(=O)C MCULE-8613714610 [0,2,0,0,0,0|1,0,0]=3 3759 B8R0.24 COC(=O)CS(=O)(=O)Cl MCULE-1243995626 [0,2,0,0,0,0|2,0,0]=4 3760 B8R0.24 COC(=O)CS(=O)(=O)F MCULE-7680738509 [0,2,0,0,0,0|2,0,0]=4 3761 B8R0.24 COC(=O)CS(=O)(=O)N MCULE-3798914658 [0,2,0,0,0,0|2,0,0]=4 3762 B8R0.24 COC(=O)CS(=O)(=O)O MCULE-8404555176 [0,2,0,0,0,0|2,0,0]=4 3763 B8R0.24 COC(=O)CS(=O)(=O)[O-] MCULE-1512976061 [0,2,0,0,0,0|2,0,0]=4 3764 B8R0.24 COC(=O)C[Si](C)(C)C MCULE-5804507255 [0,2,0,0,0,0|0,1,0]=3 3765 B8R0.24 COC(=O)NC(C)(C)C MCULE-9651721607 [0,2,0,0,0,0|1,0,0]=3 3766 B8R0.24 COC(=O)N[Si](C)(C)C MCULE-4344729633 [0,2,0,0,0,0|1,1,0]=4 3767 B8R0.24 COC(=O)OC(C)(C)C MCULE-4865384314 [0,2,0,0,0,0|1,0,0]=3 3768 B8R0.24 CSC(=O)NC(C)(C)C MCULE-8665286741 [0,2,0,0,0,0|1,1,0]=4 3769 B8R0.34 CCS(=O)(=O)CC(C)N MCULE-1312189926 [0,2,0,0,0,0|2,0,0]=4 3770 B8R0.34 CCS(=O)(=O)CC(C)N MCULE-2496866937 [0,2,0,0,0,0|2,0,0]=4 3771 B8R0.34 COC(C)(C)CC(C)N MCULE-7937293688 [0,2,0,0,0,0|1,0,1]=4 3772 B8R0.34 COC(C)(C)CC(C)O MCULE-8363298229 [0,2,0,0,0,0|1,0,1]=4 3773 B8R0.34 COP(=O)(C)OC(C)C MCULE-6197542101 [0,2,0,0,0,0|2,0,0]=4 3774 B8R0.1 C#CCCC(=O)CCO MCULE-7809473412 [0,2,0,0,0,0|1,0,1]=4 3775 B8R0.1 C#CCCC(=O)OCC MCULE-9456160977 [0,2,0,0,0,0|0,0,1]=3 3776 B8R0.1 C#CCNC(=O)CCC MCULE-4710217959 [0,2,0,0,0,0|1,0,0]=3 3777 B8R0.1 C#CCNC(=O)CCCl MCULE-7578201303 [0,2,0,0,0,0|2,0,0]=4 3778 B8R0.1 C#CCNC(=O)COC MCULE-4159755429 [0,2,0,0,0,0|0,0,2]=4 3779 B8R0.1 C/C=C/C(=O)CCCC MCULE-6753420308 [0,2,0,0,0,0|1,0,0]=3 3780 B8R0.1 C=CCC(=O)CCCC MCULE-4100882049 [0,2,0,0,0,0|1,0,1]=4 3781 B8R0.1 C=CCCC(=O)CCC MCULE-9846709255 [0,2,0,0,0,0|1,0,0]=3 3782 B8R0.1 C=CCCC(=O)OCC MCULE-4147956319 [0,2,0,0,0,0|0,0,1]=3 3783 B8R0.1 C=CCNC(=O)CCCl MCULE-6677973884 [0,2,0,0,0,0|2,0,0]=4 3784 B8R0.1 C=CCNC(=O)CCN MCULE-3047926848 [0,2,0,0,0,0|2,0,0]=4 3785 B8R0.1 C=CCNC(=O)CCN MCULE-3311649144 [0,2,0,0,0,0|2,0,0]=4 3786 B8R0.1 C=CCNC(=O)CNC MCULE-3751200138 [0,2,0,0,0,0|2,0,0]=4 3787 B8R0.1 C=CCNC(=O)CNC MCULE-7358806932 [0,2,0,0,0,0|2,0,0]=4 3788 B8R0.1 C=CCOC(=O)/C=C/C MCULE-8988055269 [0,2,0,0,0,0|0,0,2]=4 3789 B8R0.1 C=CCOC(=O)CC#N MCULE-6302930659 [0,2,0,0,0,0|1,0,1]=4 3790 B8R0.1 C=CCOC(=O)CCC MCULE-7209016839 [0,2,0,0,0,0|0,0,0]=2 3791 B8R0.1 C=CCOC(=O)OCC MCULE-4897941593 [0,2,0,0,0,0|1,0,0]=3 3792 B8R0.1 CC#CCC(=O)OCC MCULE-3108892964 [0,2,0,0,0,0|0,0,1]=3 3793 B8R0.1 CC/C=C/C(=O)OCC MCULE-6281513551 [0,2,0,0,0,0|0,0,1]=3 3794 B8R0.1 CC=CC(=O)CCCC MCULE-2281679965 [0,2,0,0,0,0|1,0,0]=3 3795 B8R0.1 CCC#CC(=O)OCC MCULE-2785923283 [0,2,0,0,0,0|0,0,1]=3 3796 B8R0.1 CCC=CC(=O)OCC MCULE-2840510617 [0,2,0,0,0,0|0,0,1]=3 3797 B8R0.1 CCCC(=O)NCCN MCULE-1372911866 [0,2,0,0,0,0|1,0,0]=3 3798 B8R0.1 CCCC(=O)OCCCl MCULE-8469083528 [0,2,0,0,0,0|0,0,0]=2 3799 B8R0.1 CCCC(=O)OCCO MCULE-5942976945 [0,2,0,0,0,0|0,0,0]=2 3800 B8R0.1 CCCCC(=N)OCC MCULE-3866961773 [0,2,0,0,0,0|1,0,0]=3 3801 B8R0.1 CCCCC(=N)OCC MCULE-6116145724 [0,2,0,0,0,0|1,0,0]=3 3802 B8R0.1 CCCCC(=O)CCC MCULE-5459540473 [0,2,0,0,0,0|1,0,0]=3 3803 B8R0.1 CCCCC(=O)COC MCULE-7059597173 [0,2,0,0,0,0|0,0,0]=2 3804 B8R0.1 CCCCC(=O)OCC MCULE-1219537918 [0,2,0,0,0,0|0,0,0]=2 3805 B8R0.1 CCCCC(=O)OCCl MCULE-1974449433 [0,2,0,0,0,0|0,0,0]=2 3806 B8R0.1 CCCCC(N)COC MCULE-6869672438 [0,2,0,0,0,0|1,0,1]=4 3807 B8R0.1 CCCCS(=O)CCO MCULE-9422446521 [0,2,0,0,0,0|2,0,0]=4 3808 B8R0.1 CCCNC(=O)CC#N MCULE-5659894723 [0,2,0,0,0,0|1,0,1]=4 3809 B8R0.1 CCCNC(=O)CCC MCULE-2578933218 [0,2,0,0,0,0|1,0,0]=3 3810 B8R0.1 CCCNC(=O)CCN MCULE-9343291828 [0,2,0,0,0,0|1,0,0]=3 3811 B8R0.1 CCCNC(=O)CCN MCULE-9397624395 [0,2,0,0,0,0|1,0,0]=3 3812 B8R0.1 CCCNC(=O)CNC MCULE-3183907339 [0,2,0,0,0,0|1,0,0]=3 3813 B8R0.1 CCCNC(=O)CNC MCULE-9204845590 [0,2,0,0,0,0|1,0,0]=3 3814 B8R0.1 CCCNC(=O)NCC MCULE-5842395608 [0,2,0,0,0,0|1,0,0]=3 3815 B8R0.1 CCCOC(=O)CC#N MCULE-6051640060 [0,2,0,0,0,0|1,0,1]=4 3816 B8R0.1 CCCOC(=O)CCC MCULE-7673125406 [0,2,0,0,0,0|0,0,0]=2 3817 B8R0.1 CCCOC(=O)CCN MCULE-1345071747 [0,2,0,0,0,0|1,0,0]=3 3818 B8R0.1 CCCOC(=O)CCN MCULE-3861690448 [0,2,0,0,0,0|1,0,0]=3 3819 B8R0.1 CCCOC(=O)CCO MCULE-7390309329 [0,2,0,0,0,0|1,0,0]=3 3820 B8R0.1 CCCOC(=O)OCCl MCULE-7435813375 [0,2,0,0,0,0|0,0,0]=2 3821 B8R0.1 CCNC(=O)NCCN MCULE-2782056393 [0,2,0,0,0,0|2,0,0]=4 3822 B8R0.1 CCNC(=O)NCCN MCULE-3018091453 [0,2,0,0,0,0|2,0,0]=4 3823 B8R0.1 CCNC(=O)NCCO MCULE-1039035778 [0,2,0,0,0,0|2,0,0]=4 3824 B8R0.1 CCNCC(=O)NCC MCULE-2852589977 [0,2,0,0,0,0|1,0,0]=3 3825 B8R0.1 CCNCC(=O)OCC MCULE-7972358572 [0,2,0,0,0,0|0,0,0]=2 3826 B8R0.1 CCNCC(=O)OCC MCULE-8893227629 [0,2,0,0,0,0|0,0,0]=2 3827 B8R0.1 CCOC(=N)CCCBr MCULE-1694733128 [0,2,0,0,0,0|1,0,0]=3 3828 B8R0.1 CCOC(=N)CCCBr MCULE-5188406239 [0,2,0,0,0,0|1,0,0]=3 3829 B8R0.1 CCOC(=N)CCCCl MCULE-2912870166 [0,2,0,0,0,0|1,0,0]=3 3830 B8R0.1 CCOC(=N)CCCCl MCULE-6562903266 [0,2,0,0,0,0|1,0,0]=3 3831 B8R0.1 CCOC(=N)CCOC MCULE-8187493489 [0,2,0,0,0,0|1,0,0]=3 3832 B8R0.1 CCOC(=N)CCOC MCULE-9185956666 [0,2,0,0,0,0|1,0,0]=3 3833 B8R0.1 CCOC(=O)/C=C/CBr MCULE-5352661836 [0,2,0,0,0,0|0,0,2]=4 3834 B8R0.1 CCOC(=O)/C=C/CO MCULE-7879343808 [0,2,0,0,0,0|0,0,2]=4 3835 B8R0.1 CCOC(=O)/C=N/NC MCULE-1711872477 [0,2,0,0,0,0|1,0,1]=4 3836 B8R0.1 CCOC(=O)/C=N/OC MCULE-3959533877 [0,2,0,0,0,0|1,0,0]=3 3837 B8R0.1 CCOC(=O)C#CCO MCULE-5094094961 [0,2,0,0,0,0|0,0,2]=4 3838 B8R0.1 CCOC(=O)C=CCBr MCULE-6455444227 [0,2,0,0,0,0|0,0,2]=4 3839 B8R0.1 CCOC(=O)C=CCCl MCULE-7995326623 [0,2,0,0,0,0|0,0,2]=4 3840 B8R0.1 CCOC(=O)C=CCN MCULE-4129018658 [0,2,0,0,0,0|0,0,2]=4 3841 B8R0.1 CCOC(=O)C=CCN MCULE-5635501690 [0,2,0,0,0,0|0,0,2]=4 3842 B8R0.1 CCOC(=O)C=CCN MCULE-9641729290 [0,2,0,0,0,0|0,0,2]=4 3843 B8R0.1 CCOC(=O)C=CCO MCULE-7710620250 [0,2,0,0,0,0|0,0,2]=4 3844 B8R0.1 CCOC(=O)CCC#N MCULE-9221721525 [0,2,0,0,0,0|0,0,1]=3 3845 B8R0.1 CCOC(=O)CCC=O MCULE-2891201608 [0,2,0,0,0,0|0,0,1]=3 3846 B8R0.1 CCOC(=O)CCCBr MCULE-5001503693 [0,2,0,0,0,0|0,0,0]=2 3847 B8R0.1 CCOC(=O)CCCCl MCULE-4945067440 [0,2,0,0,0,0|0,0,0]=2 3848 B8R0.1 CCOC(=O)CCCI MCULE-3229549270 [0,2,0,0,0,0|0,0,0]=2 3849 B8R0.1 CCOC(=O)CCCN MCULE-3396270547 [0,2,0,0,0,0|0,0,0]=2 3850 B8R0.1 CCOC(=O)CCCO MCULE-6165580365 [0,2,0,0,0,0|0,0,0]=2 3851 B8R0.1 CCOC(=O)CCCS MCULE-6616511520 [0,2,0,0,0,0|0,0,0]=2 3852 B8R0.1 CCOC(=O)CCC[NH3+] MCULE-4462126494 [0,2,0,0,0,0|0,0,0]=2 3853 B8R0.1 CCOC(=O)CCNC MCULE-2052970996 [0,2,0,0,0,0|0,0,0]=2 3854 B8R0.1 CCOC(=O)CCNC MCULE-5442289273 [0,2,0,0,0,0|0,0,0]=2 3855 B8R0.1 CCOC(=O)CCNN MCULE-6880821012 [0,2,0,0,0,0|1,0,0]=3 3856 B8R0.1 CCOC(=O)CCNN MCULE-9638408107 [0,2,0,0,0,0|1,0,0]=3 3857 B8R0.1 CCOC(=O)CCOC MCULE-5983048130 [0,2,0,0,0,0|0,0,0]=2 3858 B8R0.1 CCOC(=O)CCSC MCULE-6834820952 [0,2,0,0,0,0|0,0,0]=2 3859 B8R0.1 CCOC(=O)CN=C=O MCULE-3309838122 [0,2,0,0,0,0|1,0,1]=4 3860 B8R0.1 CCOC(=O)CN=C=S MCULE-5376687416 [0,2,0,0,0,0|1,0,1]=4 3861 B8R0.1 CCOC(=O)CN=N#N MCULE-1525622937 [0,2,0,0,0,0|2,0,0]=4 3862 B8R0.1 CCOC(=O)CNC=O MCULE-7904243111 [0,2,0,0,0,0|1,0,1]=4 3863 B8R0.1 CCOC(=O)CSC#N MCULE-2930248382 [0,2,0,0,0,0|1,0,1]=4 3864 B8R0.1 CCOC(=O)CSCC MCULE-5930366300 [0,2,0,0,0,0|0,0,0]=2 3865 B8R0.1 CCOC(=O)NCC#N MCULE-3639279920 [0,2,0,0,0,0|1,0,1]=4 3866 B8R0.1 CCOC(=O)NCCBr MCULE-4386850032 [0,2,0,0,0,0|1,0,0]=3 3867 B8R0.1 CCOC(=O)NCCCl MCULE-5545666176 [0,2,0,0,0,0|1,0,0]=3 3868 B8R0.1 CCOC(=O)NCCN MCULE-1497223307 [0,2,0,0,0,0|1,0,0]=3 3869 B8R0.1 CCOC(=O)NCCN MCULE-3733943315 [0,2,0,0,0,0|1,0,0]=3 3870 B8R0.1 CCOC(=O)NCCO MCULE-7625780069 [0,2,0,0,0,0|1,0,0]=3 3871 B8R0.1 CCOC(=O)OCCBr MCULE-4627499799 [0,2,0,0,0,0|1,0,0]=3 3872 B8R0.1 CCOCC(=O)OCC MCULE-5439289896 [0,2,0,0,0,0|0,0,0]=2 3873 B8R0.1 CCOCC(C)OCC MCULE-9619057787 [0,2,0,0,0,0|1,0,1]=4 3874 B8R0.1 CNCC(=O)NCCO MCULE-3176678829 [0,2,0,0,0,0|2,0,0]=4 3875 B8R0.1 CNCC(=O)NCCO MCULE-6959810810 [0,2,0,0,0,0|2,0,0]=4 3876 B8R0.1 COCC(=O)NCCN MCULE-2273634996 [0,2,0,0,0,0|1,0,0]=3 3877 B8R0.1 COCC(=O)NCCO MCULE-3232862916 [0,2,0,0,0,0|1,0,0]=3 3878 B8R0.1 COCCC(=O)CC#N MCULE-3904176449 [0,2,0,0,0,0|1,0,1]=4 3879 B8R0.1 COCCC(=O)COC MCULE-3111860636 [0,2,0,0,0,0|0,0,0]=2 3880 B8R0.1 COCCC(N)COC MCULE-7022239439 [0,2,0,0,0,0|1,0,1]=4 3881 B8R0.1 NCCC(=O)NCCO MCULE-6631262210 [0,2,0,0,0,0|2,0,0]=4 3882 B8R0.1 NCCC(=O)NCCO MCULE-7004874938 [0,2,0,0,0,0|2,0,0]=4 3883 B8R0.1 NCCC(=O)NCCS MCULE-3035249090 [0,2,0,0,0,0|2,0,0]=4 3884 B8R0.1 O=C(CCS)OCCO MCULE-8554625892 [0,2,0,0,0,0|1,0,0]=3 3885 B8R0.1 O=C(NCO)NCCO MCULE-2347245416 [0,2,0,0,0,0|2,0,0]=4 3886 B8R0.3 C#CC(O)C(=O)OCC MCULE-8771410618 [0,2,0,0,0,0|0,0,2]=4 3887 B8R0.3 C#CCC(C)C(=O)OC MCULE-6858702149 [0,2,0,0,0,0|0,0,1]=3 3888 B8R0.3 C#CCC(N)C(=O)OC MCULE-2178950640 [0,2,0,0,0,0|0,0,1]=3 3889 B8R0.3 C#CCC(N)C(=O)OC MCULE-6758978147 [0,2,0,0,0,0|0,0,1]=3 3890 B8R0.3 C#CC[C@@H](N)C(=O)OC MCULE-1974908886 [0,2,0,0,0,0|0,0,1]=3 3891 B8R0.3 C#CC[C@@H](N)C(=O)OC MCULE-4511622416 [0,2,0,0,0,0|0,0,1]=3 3892 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-1519824425 [0,2,0,0,0,0|0,0,1]=3 3893 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-2744971317 [0,2,0,0,0,0|0,0,1]=3 3894 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-4813964115 [0,2,0,0,0,0|0,0,1]=3 3895 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-6433911913 [0,2,0,0,0,0|0,0,1]=3 3896 B8R0.3 C/C=C(\C)/C(=O)OCC MCULE-1104279471 [0,2,0,0,0,0|0,0,2]=4 3897 B8R0.3 C/C=C/C(=O)C(C)CC MCULE-6778188943 [0,2,0,0,0,0|1,0,0]=3 3898 B8R0.3 C=C(CBr)C(=O)OCC MCULE-6501442073 [0,2,0,0,0,0|1,0,1]=4 3899 B8R0.3 C=C(CC)C(=O)OCC MCULE-9081813283 [0,2,0,0,0,0|0,0,1]=3 3900 B8R0.3 C=C(CCl)C(=O)OCC MCULE-4468934608 [0,2,0,0,0,0|1,0,1]=4 3901 B8R0.3 C=C(CO)C(=O)OCC MCULE-6343981167 [0,2,0,0,0,0|1,0,1]=4 3902 B8R0.3 C=C(COC)C(=O)OC MCULE-7593559443 [0,2,0,0,0,0|0,0,1]=3 3903 B8R0.3 C=CC(C)C(=O)OCC MCULE-4071009556 [0,2,0,0,0,0|0,0,2]=4 3904 B8R0.3 C=CC(O)C(=O)OCC MCULE-6322032023 [0,2,0,0,0,0|0,0,2]=4 3905 B8R0.3 C=CCC(Cl)C(=O)OC MCULE-6530091518 [0,2,0,0,0,0|0,0,1]=3 3906 B8R0.3 C=CCC(N)C(=O)OC MCULE-1390503391 [0,2,0,0,0,0|0,0,1]=3 3907 B8R0.3 C=CCC(N)C(=O)OC MCULE-6527008669 [0,2,0,0,0,0|0,0,1]=3 3908 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1188632168 [0,2,0,0,0,0|0,0,1]=3 3909 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1561172370 [0,2,0,0,0,0|0,0,1]=3 3910 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1592773442 [0,2,0,0,0,0|0,0,1]=3 3911 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-2928833845 [0,2,0,0,0,0|0,0,1]=3 3912 B8R0.3 C=CC[C@@H](O)C(=O)OC MCULE-5528424936 [0,2,0,0,0,0|0,0,1]=3 3913 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-1184647267 [0,2,0,0,0,0|0,0,1]=3 3914 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-6782970786 [0,2,0,0,0,0|0,0,1]=3 3915 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-7213365607 [0,2,0,0,0,0|0,0,1]=3 3916 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-9811834405 [0,2,0,0,0,0|0,0,1]=3 3917 B8R0.3 CC=C(C)C(=O)OCC MCULE-1202888826 [0,2,0,0,0,0|0,0,2]=4 3918 B8R0.3 CC=CC(=O)C(C)CC MCULE-2922799117 [0,2,0,0,0,0|1,0,0]=3 3919 B8R0.3 CCC(C)C(=O)CC#N MCULE-5049787821 [0,2,0,0,0,0|1,0,1]=4 3920 B8R0.3 CCC(C)C(=O)OCCl MCULE-6202928203 [0,2,0,0,0,0|0,0,0]=2 3921 B8R0.3 CCC=C(C)C(=O)OC MCULE-1695208139 [0,2,0,0,0,0|0,0,1]=3 3922 B8R0.3 CCCC(=O)C(=O)OC MCULE-5789275467 [0,2,0,0,0,0|0,0,0]=2 3923 B8R0.3 CCCC(=O)C(Br)CC MCULE-6260182699 [0,2,0,0,0,0|1,0,0]=3 3924 B8R0.3 CCCC(=O)C(C)CC MCULE-7559638932 [0,2,0,0,0,0|1,0,0]=3 3925 B8R0.3 CCCC(=O)C(N)CO MCULE-4196745965 [0,2,0,0,0,0|1,0,0]=3 3926 B8R0.3 CCCC(=O)C(N)CO MCULE-9001126199 [0,2,0,0,0,0|1,0,0]=3 3927 B8R0.3 CCCC(=O)N(C)OC MCULE-7871714953 [0,2,0,0,0,0|0,0,0]=2 3928 B8R0.3 CCCC(Br)C(=O)OC MCULE-2779995445 [0,2,0,0,0,0|0,0,0]=2 3929 B8R0.3 CCCC(C)C(=O)CC MCULE-9990200653 [0,2,0,0,0,0|1,0,0]=3 3930 B8R0.3 CCCC(C)C(=O)OC MCULE-6953134216 [0,2,0,0,0,0|0,0,0]=2 3931 B8R0.3 CCCC(N)C(=O)NC MCULE-3980097421 [0,2,0,0,0,0|1,0,0]=3 3932 B8R0.3 CCCC(N)C(=O)NO MCULE-2069838283 [0,2,0,0,0,0|2,0,0]=4 3933 B8R0.3 CCCC(N)C(=O)OC MCULE-1453218994 [0,2,0,0,0,0|0,0,0]=2 3934 B8R0.3 CCCC(N)C(=O)OC MCULE-4171872835 [0,2,0,0,0,0|0,0,0]=2 3935 B8R0.3 CCCC(N)C(=O)OC MCULE-4324009425 [0,2,0,0,0,0|0,0,0]=2 3936 B8R0.3 CCCC(N)C(=O)OC MCULE-9533158990 [0,2,0,0,0,0|0,0,0]=2 3937 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-1310673609 [0,2,0,0,0,0|0,0,0]=2 3938 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5850698619 [0,2,0,0,0,0|0,0,0]=2 3939 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5854286766 [0,2,0,0,0,0|0,0,0]=2 3940 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-9793822862 [0,2,0,0,0,0|0,0,0]=2 3941 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-2009036281 [0,2,0,0,0,0|0,0,0]=2 3942 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5609199650 [0,2,0,0,0,0|0,0,0]=2 3943 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5628439347 [0,2,0,0,0,0|0,0,0]=2 3944 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-8724830592 [0,2,0,0,0,0|0,0,0]=2 3945 B8R0.3 CCNC(=O)C(=O)NC MCULE-1033646355 [0,2,0,0,0,0|1,0,1]=4 3946 B8R0.3 CCNC(=O)C(N)CC MCULE-2664739052 [0,2,0,0,0,0|1,0,0]=3 3947 B8R0.3 CCNC(=O)[C@@H](N)CC MCULE-2776960278 [0,2,0,0,0,0|1,0,0]=3 3948 B8R0.3 CCNC(=O)[C@@H](N)CC MCULE-4327862853 [0,2,0,0,0,0|1,0,0]=3 3949 B8R0.3 CCNC(C)C(=O)OC MCULE-3289750233 [0,2,0,0,0,0|0,0,0]=2 3950 B8R0.3 CCNC(C)C(=O)OC MCULE-6862987622 [0,2,0,0,0,0|0,0,0]=2 3951 B8R0.3 CCN[C@@H](C)C(=O)OC MCULE-5663920756 [0,2,0,0,0,0|0,0,0]=2 3952 B8R0.3 CCOC(=O)C(=N)SC MCULE-1399563180 [0,2,0,0,0,0|1,0,1]=4 3953 B8R0.3 CCOC(=O)C(=NC)Cl MCULE-1326218878 [0,2,0,0,0,0|1,0,1]=4 3954 B8R0.3 CCOC(=O)C(=NO)C MCULE-5698950336 [0,2,0,0,0,0|2,0,0]=4 3955 B8R0.3 CCOC(=O)C(=O)CBr MCULE-1292003261 [0,2,0,0,0,0|1,0,1]=4 3956 B8R0.3 CCOC(=O)C(=O)CC MCULE-6268795804 [0,2,0,0,0,0|0,0,1]=3 3957 B8R0.3 CCOC(=O)C(=O)NC MCULE-7000353340 [0,2,0,0,0,0|1,0,1]=4 3958 B8R0.3 CCOC(=O)C(Br)C#N MCULE-9930540852 [0,2,0,0,0,0|1,0,1]=4 3959 B8R0.3 CCOC(=O)C(Br)CBr MCULE-3811489890 [0,2,0,0,0,0|1,0,0]=3 3960 B8R0.3 CCOC(=O)C(Br)CC MCULE-2467634064 [0,2,0,0,0,0|0,0,0]=2 3961 B8R0.3 CCOC(=O)C(C)C#N MCULE-8318656227 [0,2,0,0,0,0|1,0,1]=4 3962 B8R0.3 CCOC(=O)C(C)C=O MCULE-9226849500 [0,2,0,0,0,0|1,0,1]=4 3963 B8R0.3 CCOC(=O)C(C)CBr MCULE-9513285816 [0,2,0,0,0,0|1,0,0]=3 3964 B8R0.3 CCOC(=O)C(C)CC MCULE-3895639860 [0,2,0,0,0,0|0,0,0]=2 3965 B8R0.3 CCOC(=O)C(C)CCl MCULE-9783842448 [0,2,0,0,0,0|1,0,0]=3 3966 B8R0.3 CCOC(=O)C(C)CN MCULE-6123639141 [0,2,0,0,0,0|1,0,0]=3 3967 B8R0.3 CCOC(=O)C(C)CN MCULE-6716626093 [0,2,0,0,0,0|1,0,0]=3 3968 B8R0.3 CCOC(=O)C(C)CO MCULE-7936560025 [0,2,0,0,0,0|1,0,0]=3 3969 B8R0.3 CCOC(=O)C(C)NC MCULE-3023497472 [0,2,0,0,0,0|1,0,0]=3 3970 B8R0.3 CCOC(=O)C(C)SC MCULE-5858818190 [0,2,0,0,0,0|1,0,0]=3 3971 B8R0.3 CCOC(=O)C(Cl)C=O MCULE-7751421571 [0,2,0,0,0,0|1,0,1]=4 3972 B8R0.3 CCOC(=O)C(Cl)CCl MCULE-3086938360 [0,2,0,0,0,0|1,0,0]=3 3973 B8R0.3 CCOC(=O)C(Cl)SC MCULE-3290320839 [0,2,0,0,0,0|1,0,0]=3 3974 B8R0.3 CCOC(=O)C(N)C#N MCULE-3893668766 [0,2,0,0,0,0|1,0,1]=4 3975 B8R0.3 CCOC(=O)C(N)C#N MCULE-4201771605 [0,2,0,0,0,0|1,0,1]=4 3976 B8R0.3 CCOC(=O)C(N)C#N MCULE-5860664428 [0,2,0,0,0,0|1,0,1]=4 3977 B8R0.3 CCOC(=O)C(N)C#N MCULE-5957058937 [0,2,0,0,0,0|1,0,1]=4 3978 B8R0.3 CCOC(=O)C(N)C#N MCULE-6898947047 [0,2,0,0,0,0|1,0,1]=4 3979 B8R0.3 CCOC(=O)C(N)CC MCULE-1078770122 [0,2,0,0,0,0|0,0,0]=2 3980 B8R0.3 CCOC(=O)C(N)CC MCULE-4005480919 [0,2,0,0,0,0|0,0,0]=2 3981 B8R0.3 CCOC(=O)C(N)CC MCULE-7008098270 [0,2,0,0,0,0|0,0,0]=2 3982 B8R0.3 CCOC(=O)C(N)CC MCULE-9698514597 [0,2,0,0,0,0|0,0,0]=2 3983 B8R0.3 CCOC(=O)C(N)CO MCULE-1666659750 [0,2,0,0,0,0|1,0,0]=3 3984 B8R0.3 CCOC(=O)C(N)CO MCULE-1998512614 [0,2,0,0,0,0|1,0,0]=3 3985 B8R0.3 CCOC(=O)C(N)CO MCULE-2382743439 [0,2,0,0,0,0|1,0,0]=3 3986 B8R0.3 CCOC(=O)C(N)CO MCULE-8735565522 [0,2,0,0,0,0|1,0,0]=3 3987 B8R0.3 CCOC(=O)C(N)CS MCULE-1346857927 [0,2,0,0,0,0|1,0,0]=3 3988 B8R0.3 CCOC(=O)C(N)CS MCULE-2778317647 [0,2,0,0,0,0|1,0,0]=3 3989 B8R0.3 CCOC(=O)C(N)CS MCULE-4631330176 [0,2,0,0,0,0|1,0,0]=3 3990 B8R0.3 CCOC(=O)C(N)CS MCULE-9332095158 [0,2,0,0,0,0|1,0,0]=3 3991 B8R0.3 CCOC(=O)C(O)CC MCULE-7418568069 [0,2,0,0,0,0|0,0,0]=2 3992 B8R0.3 CCOC(=O)C(S)CC MCULE-8709451175 [0,2,0,0,0,0|0,0,0]=2 3993 B8R0.3 CCOC(=O)C([Na])C=O MCULE-2917644984 [0,2,0,0,0,0|1,0,1]=4 3994 B8R0.3 CCOC(=O)N(C)CC MCULE-7562822763 [0,2,0,0,0,0|1,0,0]=3 3995 B8R0.3 CCOC(=O)N(C)N=O MCULE-4955058570 [0,2,0,0,0,0|2,0,0]=4 3996 B8R0.3 CCOC(=O)N(C)OC MCULE-2061988934 [0,2,0,0,0,0|1,0,0]=3 3997 B8R0.3 CCOC(=O)[C@@H](C)OC MCULE-6015342828 [0,2,0,0,0,0|1,0,0]=3 3998 B8R0.3 CCOC(=O)[C@@H](C)OC MCULE-9016823576 [0,2,0,0,0,0|1,0,0]=3 3999 B8R0.3 CCOC(=O)[C@@H](N)CC MCULE-3295720196 [0,2,0,0,0,0|0,0,0]=2 4000 B8R0.3 CCOC(=O)[C@@H](N)CC MCULE-3974992068 [0,2,0,0,0,0|0,0,0]=2 4001 B8R0.3 CCOC(=O)[C@@H](N)CC MCULE-6812206052 [0,2,0,0,0,0|0,0,0]=2 4002 B8R0.3 CCOC(=O)[C@@H](N)CC MCULE-7278573962 [0,2,0,0,0,0|0,0,0]=2 4003 B8R0.3 CCOC(=O)[C@@H](N)CN MCULE-3992415653 [0,2,0,0,0,0|1,0,0]=3 4004 B8R0.3 CCOC(=O)[C@@H](N)CN MCULE-5633443221 [0,2,0,0,0,0|1,0,0]=3 4005 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-3922789205 [0,2,0,0,0,0|1,0,0]=3 4006 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-4123182744 [0,2,0,0,0,0|1,0,0]=3 4007 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-9348155020 [0,2,0,0,0,0|1,0,0]=3 4008 B8R0.3 CCOC(=O)[C@@H](N)CS MCULE-4155299626 [0,2,0,0,0,0|1,0,0]=3 4009 B8R0.3 CCOC(=O)[C@@H](N)CS MCULE-5221844279 [0,2,0,0,0,0|1,0,0]=3 4010 B8R0.3 CCOC(=O)[C@@H](N)CS MCULE-7483061356 [0,2,0,0,0,0|1,0,0]=3 4011 B8R0.3 CCOC(=O)[C@@H](N)CS MCULE-9958458010 [0,2,0,0,0,0|1,0,0]=3 4012 B8R0.3 CCOC(=O)[C@@H](O)CC MCULE-5702747043 [0,2,0,0,0,0|0,0,0]=2 4013 B8R0.3 CCOC(=O)[C@@H](O)CC MCULE-6151562245 [0,2,0,0,0,0|0,0,0]=2 4014 B8R0.3 CCOC(=O)[C@H](C)NC MCULE-1179895928 [0,2,0,0,0,0|1,0,0]=3 4015 B8R0.3 CCOC(=O)[C@H](C)NC MCULE-6687011613 [0,2,0,0,0,0|1,0,0]=3 4016 B8R0.3 CCOC(=O)[C@H](N)CC MCULE-6501312525 [0,2,0,0,0,0|0,0,0]=2 4017 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-5633972344 [0,2,0,0,0,0|1,0,0]=3 4018 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-6411527516 [0,2,0,0,0,0|1,0,0]=3 4019 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-9780267969 [0,2,0,0,0,0|1,0,0]=3 4020 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-9929488925 [0,2,0,0,0,0|1,0,0]=3 4021 B8R0.3 CCOC(=O)[C@H](N)CS MCULE-3111652654 [0,2,0,0,0,0|1,0,0]=3 4022 B8R0.3 CCOC(=O)[C@H](N)CS MCULE-5156842229 [0,2,0,0,0,0|1,0,0]=3 4023 B8R0.3 CCOC(=O)[C@H](N)CS MCULE-7914546483 [0,2,0,0,0,0|1,0,0]=3 4024 B8R0.3 CCOC(=O)[C@H](N)CS MCULE-8471951192 [0,2,0,0,0,0|1,0,0]=3 4025 B8R0.3 CCOC(=O)[C@H](O)CC MCULE-8200594440 [0,2,0,0,0,0|0,0,0]=2 4026 B8R0.3 CCOC(C)C(=O)NN MCULE-1066133056 [0,2,0,0,0,0|2,0,0]=4 4027 B8R0.3 CCOC(C)C(=O)NN MCULE-9272616432 [0,2,0,0,0,0|2,0,0]=4 4028 B8R0.3 CNCC(Br)C(=O)OC MCULE-2818400613 [0,2,0,0,0,0|0,0,0]=2 4029 B8R0.3 CNCC(Br)C(=O)OC MCULE-5823314810 [0,2,0,0,0,0|0,0,0]=2 4030 B8R0.3 CNCC(C)C(=O)NC MCULE-2413275831 [0,2,0,0,0,0|1,0,0]=3 4031 B8R0.3 CNCC(C)C(=O)OC MCULE-5525958870 [0,2,0,0,0,0|0,0,0]=2 4032 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-6377659413 [0,2,0,0,0,0|0,0,0]=2 4033 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-9611469994 [0,2,0,0,0,0|0,0,0]=2 4034 B8R0.3 CO/C=C(\I)/C(=O)OC MCULE-2050459356 [0,2,0,0,0,0|0,0,2]=4 4035 B8R0.3 CO/N=C(\Cl)/C(=O)OC MCULE-8885098005 [0,2,0,0,0,0|1,0,1]=4 4036 B8R0.3 COC(=O)C(=CCCl)C MCULE-4648119495 [0,2,0,0,0,0|0,0,2]=4 4037 B8R0.3 COC(=O)C(=CCO)C MCULE-7930614060 [0,2,0,0,0,0|0,0,2]=4 4038 B8R0.3 COC(=O)C(Br)CCBr MCULE-4290973865 [0,2,0,0,0,0|0,0,0]=2 4039 B8R0.3 COC(=O)C(C)CCBr MCULE-7970722391 [0,2,0,0,0,0|0,0,0]=2 4040 B8R0.3 COC(=O)C(C)CCCl MCULE-3423199485 [0,2,0,0,0,0|0,0,0]=2 4041 B8R0.3 COC(=O)C(C)CCN MCULE-4788413403 [0,2,0,0,0,0|0,0,0]=2 4042 B8R0.3 COC(=O)C(C)CCN MCULE-6075427964 [0,2,0,0,0,0|0,0,0]=2 4043 B8R0.3 COC(=O)C(C)N=C=O MCULE-2210895956 [0,2,0,0,0,0|1,0,1]=4 4044 B8R0.3 COC(=O)C(C)N=C=S MCULE-6150810434 [0,2,0,0,0,0|1,0,1]=4 4045 B8R0.3 COC(=O)C(C)N=N#N MCULE-7689671689 [0,2,0,0,0,0|2,0,0]=4 4046 B8R0.3 COC(=O)C(C)NC=O MCULE-7583002028 [0,2,0,0,0,0|1,0,1]=4 4047 B8R0.3 COC(=O)C(N)CCBr MCULE-5668145888 [0,2,0,0,0,0|0,0,0]=2 4048 B8R0.3 COC(=O)C(N)CCBr MCULE-5831054247 [0,2,0,0,0,0|0,0,0]=2 4049 B8R0.3 COC(=O)C(N)CCF MCULE-3356013030 [0,2,0,0,0,0|0,0,0]=2 4050 B8R0.3 COC(=O)C(N)CCF MCULE-6443244944 [0,2,0,0,0,0|0,0,0]=2 4051 B8R0.3 COC(=O)C(N)CCS MCULE-8178229832 [0,2,0,0,0,0|0,0,0]=2 4052 B8R0.3 COC(=O)C(N)CSC MCULE-6702025743 [0,2,0,0,0,0|0,0,0]=2 4053 B8R0.3 COC(=O)C(N)CSC MCULE-7180641175 [0,2,0,0,0,0|0,0,0]=2 4054 B8R0.3 COC(=O)C(O)CCN MCULE-7139144229 [0,2,0,0,0,0|0,0,0]=2 4055 B8R0.3 COC(=O)N(C)CCN MCULE-5241430588 [0,2,0,0,0,0|1,0,0]=3 4056 B8R0.3 COC(=O)N(C)CCN MCULE-6970201742 [0,2,0,0,0,0|1,0,0]=3 4057 B8R0.3 COC(=O)N(C)CCO MCULE-3282195016 [0,2,0,0,0,0|1,0,0]=3 4058 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-1252477377 [0,2,0,0,0,0|0,0,0]=2 4059 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-6780159971 [0,2,0,0,0,0|0,0,0]=2 4060 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-8129635461 [0,2,0,0,0,0|0,0,0]=2 4061 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-9824385803 [0,2,0,0,0,0|0,0,0]=2 4062 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-5345736899 [0,2,0,0,0,0|0,0,0]=2 4063 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-8434362314 [0,2,0,0,0,0|0,0,0]=2 4064 B8R0.3 COC(=O)[C@@H](N)CCS MCULE-1895611205 [0,2,0,0,0,0|0,0,0]=2 4065 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-2532401863 [0,2,0,0,0,0|0,0,0]=2 4066 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-3321267517 [0,2,0,0,0,0|0,0,0]=2 4067 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-5693942065 [0,2,0,0,0,0|0,0,0]=2 4068 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-7597642447 [0,2,0,0,0,0|0,0,0]=2 4069 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-1204029497 [0,2,0,0,0,0|0,0,0]=2 4070 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-2464186416 [0,2,0,0,0,0|0,0,0]=2 4071 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-4887582087 [0,2,0,0,0,0|0,0,0]=2 4072 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-8785450046 [0,2,0,0,0,0|0,0,0]=2 4073 B8R0.3 COC(=O)[C@H](C)N=C=O MCULE-1937226226 [0,2,0,0,0,0|1,0,1]=4 4074 B8R0.3 COC(=O)[C@H](C)N=C=O MCULE-2565419113 [0,2,0,0,0,0|1,0,1]=4 4075 B8R0.3 COC(=O)[C@H](C)N=C=S MCULE-5279412916 [0,2,0,0,0,0|1,0,1]=4 4076 B8R0.3 COC(=O)[C@H](C)NC=O MCULE-3891029916 [0,2,0,0,0,0|1,0,1]=4 4077 B8R0.3 COC(=O)[C@H](C)NC=O MCULE-5938491065 [0,2,0,0,0,0|1,0,1]=4 4078 B8R0.3 COC(=O)[C@H](N)CCN MCULE-1821826306 [0,2,0,0,0,0|0,0,0]=2 4079 B8R0.3 COC(=O)[C@H](N)CCN MCULE-8161776969 [0,2,0,0,0,0|0,0,0]=2 4080 B8R0.3 COC(=O)[C@H](N)CCO MCULE-1194830786 [0,2,0,0,0,0|0,0,0]=2 4081 B8R0.3 COC(=O)[C@H](N)CCO MCULE-2532522705 [0,2,0,0,0,0|0,0,0]=2 4082 B8R0.3 COC(=O)[C@H](N)CCS MCULE-8558179208 [0,2,0,0,0,0|0,0,0]=2 4083 B8R0.3 COC(C)C(=O)CC#N MCULE-3613869171 [0,2,0,0,0,0|1,0,1]=4 4084 B8R0.3 COC=C(I)C(=O)OC MCULE-9702408627 [0,2,0,0,0,0|0,0,2]=4 4085 B8R0.3 COCC(=O)N(C)OC MCULE-6649507131 [0,2,0,0,0,0|1,0,0]=3 4086 B8R0.3 COCC(Br)C(=O)OC MCULE-5792855565 [0,2,0,0,0,0|0,0,0]=2 4087 B8R0.3 COCC(C)C(=O)OC MCULE-4110856609 [0,2,0,0,0,0|0,0,0]=2 4088 B8R0.3 COCC(N)C(=O)OC MCULE-1717271658 [0,2,0,0,0,0|0,0,0]=2 4089 B8R0.3 COCC(N)C(=O)OC MCULE-4567479747 [0,2,0,0,0,0|0,0,0]=2 4090 B8R0.3 COCC(N)C(=O)OC MCULE-4859095599 [0,2,0,0,0,0|0,0,0]=2 4091 B8R0.3 COCC(N)C(=O)OC MCULE-8125210840 [0,2,0,0,0,0|0,0,0]=2 4092 B8R0.3 COCC(O)C(=O)OC MCULE-6071304250 [0,2,0,0,0,0|0,0,0]=2 4093 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-2867072950 [0,2,0,0,0,0|0,0,0]=2 4094 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-5445193744 [0,2,0,0,0,0|0,0,0]=2 4095 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8505505456 [0,2,0,0,0,0|0,0,0]=2 4096 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8525451378 [0,2,0,0,0,0|0,0,0]=2 4097 B8R0.3 CON(C)C(=O)CC#N MCULE-1400127101 [0,2,0,0,0,0|1,0,1]=4 4098 B8R0.3 CON(C)C(=O)CCBr MCULE-7636468204 [0,2,0,0,0,0|1,0,0]=3 4099 B8R0.3 CON(C)C(=O)CCCl MCULE-5460738044 [0,2,0,0,0,0|1,0,0]=3 4100 B8R0.3 CON=C(Cl)C(=O)OC MCULE-8277036765 [0,2,0,0,0,0|1,0,1]=4 4101 B8R0.3 CON=C(I)C(=O)OC MCULE-5875796121 [0,2,0,0,0,0|1,0,1]=4 4102 B8R0.3 CONC(=O)C(=O)OC MCULE-9234071987 [0,2,0,0,0,0|1,0,1]=4 4103 B8R0.3 [C@H](N)(CO)C(=O)OCC MCULE-8379845791 [0,2,0,0,0,0|1,0,0]=3 4104 B8R0.6 C#CC(=O)NCCOC MCULE-6198532487 [0,2,0,0,0,0|1,0,1]=4 4105 B8R0.6 C#CCCCC(=O)NN MCULE-3070314826 [0,2,0,0,0,0|2,0,0]=4 4106 B8R0.6 C#CCCCC(=O)N[NH3+] MCULE-8856249693 [0,2,0,0,0,0|2,0,0]=4 4107 B8R0.6 C#CCCCC(=O)OC MCULE-1834140672 [0,2,0,0,0,0|0,0,0]=2 4108 B8R0.6 C#CCCNC(=O)OC MCULE-4643907894 [0,2,0,0,0,0|0,0,1]=3 4109 B8R0.6 C#CCOCC(=O)OC MCULE-8743984162 [0,2,0,0,0,0|0,0,1]=3 4110 B8R0.6 C/C=C/C=C/C(=O)OC MCULE-2985403088 [0,2,0,0,0,0|0,0,2]=4 4111 B8R0.6 C=CC(=O)CCCCC MCULE-9094274880 [0,2,0,0,0,0|1,0,1]=4 4112 B8R0.6 C=CC(=O)NCCCC MCULE-9365109925 [0,2,0,0,0,0|1,0,1]=4 4113 B8R0.6 C=CC(=O)NCCOC MCULE-1939884493 [0,2,0,0,0,0|1,0,1]=4 4114 B8R0.6 C=CC(=O)OCCCC MCULE-6944090543 [0,2,0,0,0,0|1,0,1]=4 4115 B8R0.6 C=CC(=O)OCCCO MCULE-7957370216 [0,2,0,0,0,0|1,0,1]=4 4116 B8R0.6 C=CC(=O)OCCOC MCULE-6865078247 [0,2,0,0,0,0|1,0,1]=4 4117 B8R0.6 C=CCCCC(=O)OC MCULE-4913183131 [0,2,0,0,0,0|0,0,0]=2 4118 B8R0.6 C=CCOCC(=O)OC MCULE-7670885186 [0,2,0,0,0,0|0,0,1]=3 4119 B8R0.6 C=CCSCC(=O)OC MCULE-3363963029 [0,2,0,0,0,0|0,0,1]=3 4120 B8R0.6 CC=CC=CC(=O)OC MCULE-4040454111 [0,2,0,0,0,0|0,0,2]=4 4121 B8R0.6 CCC/C=C/C(=O)OC MCULE-6273561448 [0,2,0,0,0,0|0,0,0]=2 4122 B8R0.6 CCC=CCC(=O)OC MCULE-6432541061 [0,2,0,0,0,0|0,0,0]=2 4123 B8R0.6 CCCC#CC(=O)OC MCULE-1573744334 [0,2,0,0,0,0|0,0,0]=2 4124 B8R0.6 CCCC=CC(=O)OC MCULE-1227063444 [0,2,0,0,0,0|0,0,0]=2 4125 B8R0.6 CCCCCC(=O)CBr MCULE-6642335283 [0,2,0,0,0,0|2,0,0]=4 4126 B8R0.6 CCCCCC(=O)CC MCULE-2012071553 [0,2,0,0,0,0|1,0,0]=3 4127 B8R0.6 CCCCCC(=O)NN MCULE-3138841743 [0,2,0,0,0,0|2,0,0]=4 4128 B8R0.6 CCCCCC(=O)NO MCULE-8432990947 [0,2,0,0,0,0|2,0,0]=4 4129 B8R0.6 CCCCCC(=O)OC MCULE-2317616388 [0,2,0,0,0,0|0,0,0]=2 4130 B8R0.6 CCCCNC(=O)CBr MCULE-4128795630 [0,2,0,0,0,0|2,0,0]=4 4131 B8R0.6 CCCCNC(=O)CC MCULE-3176114265 [0,2,0,0,0,0|1,0,0]=3 4132 B8R0.6 CCCCNC(=O)CCl MCULE-6162581938 [0,2,0,0,0,0|2,0,0]=4 4133 B8R0.6 CCCCNC(=O)CN MCULE-2730890796 [0,2,0,0,0,0|2,0,0]=4 4134 B8R0.6 CCCCNC(=O)CN MCULE-8794795131 [0,2,0,0,0,0|2,0,0]=4 4135 B8R0.6 CCCCNC(=O)NC MCULE-7920588549 [0,2,0,0,0,0|1,0,0]=3 4136 B8R0.6 CCCCNC(=O)NN MCULE-2049505984 [0,2,0,0,0,0|2,0,0]=4 4137 B8R0.6 CCCCOC(=O)C=O MCULE-1707513945 [0,2,0,0,0,0|2,0,0]=4 4138 B8R0.6 CCCCOC(=O)CBr MCULE-8883996630 [0,2,0,0,0,0|2,0,0]=4 4139 B8R0.6 CCCCOC(=O)CC MCULE-4622389592 [0,2,0,0,0,0|1,0,0]=3 4140 B8R0.6 CCCCOC(=O)CCl MCULE-1608118057 [0,2,0,0,0,0|2,0,0]=4 4141 B8R0.6 CCCCOC(=O)CF MCULE-1355274212 [0,2,0,0,0,0|2,0,0]=4 4142 B8R0.6 CCCCOC(=O)CN MCULE-9168260466 [0,2,0,0,0,0|2,0,0]=4 4143 B8R0.6 CCCCOC(=O)CN MCULE-9585888268 [0,2,0,0,0,0|2,0,0]=4 4144 B8R0.6 CCCCOC(=O)CO MCULE-4016266350 [0,2,0,0,0,0|2,0,0]=4 4145 B8R0.6 CCCCOC(=O)CS MCULE-4331308025 [0,2,0,0,0,0|2,0,0]=4 4146 B8R0.6 CCCNCC(=O)NC MCULE-4750972571 [0,2,0,0,0,0|1,0,0]=3 4147 B8R0.6 CCCNCC(=O)OC MCULE-3321545319 [0,2,0,0,0,0|0,0,0]=2 4148 B8R0.6 CCCNCC(=O)OC MCULE-5989619684 [0,2,0,0,0,0|0,0,0]=2 4149 B8R0.6 CCCSCC(=O)OC MCULE-3865642484 [0,2,0,0,0,0|0,0,0]=2 4150 B8R0.6 CCNCCC(=O)NC MCULE-8230774906 [0,2,0,0,0,0|1,0,0]=3 4151 B8R0.6 CCNCCC(=O)NC MCULE-9131674592 [0,2,0,0,0,0|1,0,0]=3 4152 B8R0.6 CCNCCC(=O)NN MCULE-8224878393 [0,2,0,0,0,0|2,0,0]=4 4153 B8R0.6 CCNCCC(=O)OC MCULE-4846173976 [0,2,0,0,0,0|0,0,0]=2 4154 B8R0.6 CCOCCC(=N)OC MCULE-1143058685 [0,2,0,0,0,0|1,0,0]=3 4155 B8R0.6 CCOCCC(=N)OC MCULE-1528455249 [0,2,0,0,0,0|1,0,0]=3 4156 B8R0.6 CCOCCC(=O)NN MCULE-2571001026 [0,2,0,0,0,0|2,0,0]=4 4157 B8R0.6 CCSCCC(=O)OC MCULE-5773388371 [0,2,0,0,0,0|0,0,0]=2 4158 B8R0.6 CNC(=O)CCCON MCULE-8352787831 [0,2,0,0,0,0|1,0,0]=3 4159 B8R0.6 CNC(=O)CCN=C=S MCULE-8083154624 [0,2,0,0,0,0|1,0,1]=4 4160 B8R0.6 CNC(=O)CCN=N#N MCULE-4646748413 [0,2,0,0,0,0|2,0,0]=4 4161 B8R0.6 CNC(=O)NCCCO MCULE-3093590717 [0,2,0,0,0,0|1,0,0]=3 4162 B8R0.6 CNCCCC(=O)NN MCULE-9999287103 [0,2,0,0,0,0|2,0,0]=4 4163 B8R0.6 CNCCCC(=O)OC MCULE-2437073705 [0,2,0,0,0,0|0,0,0]=2 4164 B8R0.6 CNCCCC(=O)OC MCULE-6776715081 [0,2,0,0,0,0|0,0,0]=2 4165 B8R0.6 CNCCNC(=O)NC MCULE-2973659795 [0,2,0,0,0,0|1,0,0]=3 4166 B8R0.6 COC(=O)CCCC#N MCULE-9088492518 [0,2,0,0,0,0|0,0,0]=2 4167 B8R0.6 COC(=O)CCCC=O MCULE-2183669341 [0,2,0,0,0,0|0,0,0]=2 4168 B8R0.6 COC(=O)CCCCBr MCULE-8354790214 [0,2,0,0,0,0|0,0,0]=2 4169 B8R0.6 COC(=O)CCCCCl MCULE-7057883989 [0,2,0,0,0,0|0,0,0]=2 4170 B8R0.6 COC(=O)CCCCI MCULE-1527923255 [0,2,0,0,0,0|0,0,0]=2 4171 B8R0.6 COC(=O)CCCCN MCULE-3452725442 [0,2,0,0,0,0|0,0,0]=2 4172 B8R0.6 COC(=O)CCCCN MCULE-8816545129 [0,2,0,0,0,0|0,0,0]=2 4173 B8R0.6 COC(=O)CCCCO MCULE-2443996181 [0,2,0,0,0,0|0,0,0]=2 4174 B8R0.6 COC(=O)CCCCS MCULE-5194099368 [0,2,0,0,0,0|0,0,0]=2 4175 B8R0.6 COC(=O)CCCON MCULE-1522874324 [0,2,0,0,0,0|0,0,0]=2 4176 B8R0.6 COC(=O)CCCON MCULE-4748610058 [0,2,0,0,0,0|0,0,0]=2 4177 B8R0.6 COC(=O)CCCSC MCULE-7320944174 [0,2,0,0,0,0|0,0,0]=2 4178 B8R0.6 COC(=O)CCN=C=O MCULE-8282687885 [0,2,0,0,0,0|0,0,1]=3 4179 B8R0.6 COC(=O)CCN=C=S MCULE-4255379915 [0,2,0,0,0,0|0,0,1]=3 4180 B8R0.6 COC(=O)CCN=N#N MCULE-9952679830 [0,2,0,0,0,0|1,0,0]=3 4181 B8R0.6 COC(=O)CCNC=O MCULE-2214149264 [0,2,0,0,0,0|0,0,1]=3 4182 B8R0.6 COC(=O)CNCC#N MCULE-4088324466 [0,2,0,0,0,0|0,0,1]=3 4183 B8R0.6 COC(=O)COCCCl MCULE-4344602258 [0,2,0,0,0,0|0,0,0]=2 4184 B8R0.6 COC(=O)COCCN MCULE-5090944064 [0,2,0,0,0,0|0,0,0]=2 4185 B8R0.6 COC(=O)COCCN MCULE-6748820855 [0,2,0,0,0,0|0,0,0]=2 4186 B8R0.6 COC(=O)COCCO MCULE-7869619911 [0,2,0,0,0,0|0,0,0]=2 4187 B8R0.6 COC(=O)CSCC#N MCULE-9919146652 [0,2,0,0,0,0|0,0,1]=3 4188 B8R0.6 COC(=O)CSCCN MCULE-5578128958 [0,2,0,0,0,0|0,0,0]=2 4189 B8R0.6 COC(=O)CSCCN MCULE-6891143571 [0,2,0,0,0,0|0,0,0]=2 4190 B8R0.6 COC(=O)NCCC#N MCULE-9903533731 [0,2,0,0,0,0|0,0,1]=3 4191 B8R0.6 COC(=O)SSCCN MCULE-2854223096 [0,2,0,0,0,0|1,0,0]=3 4192 B8R0.6 COC/C=C/C(=O)OC MCULE-5611593935 [0,2,0,0,0,0|0,0,1]=3 4193 B8R0.6 COCC=CC(=O)OC MCULE-1098723055 [0,2,0,0,0,0|0,0,1]=3 4194 B8R0.6 COCCCC(=O)OC MCULE-4109110804 [0,2,0,0,0,0|0,0,0]=2 4195 B8R0.6 COCCNC(=O)CBr MCULE-3132647741 [0,2,0,0,0,0|2,0,0]=4 4196 B8R0.6 COCCNC(=O)CCl MCULE-3082598915 [0,2,0,0,0,0|2,0,0]=4 4197 B8R0.6 COCCNC(=O)CN MCULE-6007531067 [0,2,0,0,0,0|2,0,0]=4 4198 B8R0.6 COCCNC(=O)CN MCULE-6629249444 [0,2,0,0,0,0|2,0,0]=4 4199 B8R0.6 COCCNC(=O)NN MCULE-8505538693 [0,2,0,0,0,0|2,0,0]=4 4200 B8R0.6 COCCOC(=O)CBr MCULE-3194439093 [0,2,0,0,0,0|2,0,0]=4 4201 B8R0.6 COCCOC(=O)CCl MCULE-1894420315 [0,2,0,0,0,0|2,0,0]=4 4202 B8R0.6 COCCOC(=O)CS MCULE-9869840399 [0,2,0,0,0,0|2,0,0]=4 4203 B8R0.6 CONCCC(=O)OC MCULE-8622619087 [0,2,0,0,0,0|0,0,0]=2 4204 B8R0.6 NCC(=O)NCCCO MCULE-3346996357 [0,2,0,0,0,0|2,0,0]=4 4205 B8R0.6 NCC(=O)NCCCO MCULE-5088922472 [0,2,0,0,0,0|2,0,0]=4 4206 B8R0.6 NNC(=O)COCCO MCULE-8424164288 [0,2,0,0,0,0|2,0,0]=4 4207 B8R0.6 O=C(CCl)NCCCO MCULE-7154051707 [0,2,0,0,0,0|2,0,0]=4 4208 B8R0.8 C=C(C)C(=O)NCCN MCULE-4919659895 [0,2,0,0,0,0|2,0,0]=4 4209 B8R0.8 C=C(C)C(=O)NCCN MCULE-8762138825 [0,2,0,0,0,0|2,0,0]=4 4210 B8R0.8 C=C(C)C(=O)NCCO MCULE-3517470957 [0,2,0,0,0,0|2,0,0]=4 4211 B8R0.8 C=C(C)C(=O)NCOC MCULE-1355341818 [0,2,0,0,0,0|2,0,0]=4 4212 B8R0.8 C=C(C)C(=O)OCCBr MCULE-2338171938 [0,2,0,0,0,0|2,0,0]=4 4213 B8R0.8 C=C(C)C(=O)OCCC MCULE-3202968176 [0,2,0,0,0,0|1,0,0]=3 4214 B8R0.8 C=C(C)C(=O)OCCCl MCULE-1588137861 [0,2,0,0,0,0|2,0,0]=4 4215 B8R0.8 C=C(C)C(=O)OCCF MCULE-6402794071 [0,2,0,0,0,0|2,0,0]=4 4216 B8R0.8 C=C(C)C(=O)OCCN MCULE-1298883252 [0,2,0,0,0,0|2,0,0]=4 4217 B8R0.8 C=C(C)C(=O)OCCN MCULE-8628486692 [0,2,0,0,0,0|2,0,0]=4 4218 B8R0.8 C=C(C)C(=O)OCCO MCULE-7874353357 [0,2,0,0,0,0|2,0,0]=4 4219 B8R0.8 CC(C)C(=O)CCCCl MCULE-7442882082 [0,2,0,0,0,0|1,0,0]=3 4220 B8R0.8 CC(C)C(=O)NCCN MCULE-8671421121 [0,2,0,0,0,0|2,0,0]=4 4221 B8R0.8 CC(C)C(=O)NCCN MCULE-9934200854 [0,2,0,0,0,0|2,0,0]=4 4222 B8R0.8 CC(C)C(=O)NCCO MCULE-8748737436 [0,2,0,0,0,0|2,0,0]=4 4223 B8R0.8 CC(C)C(=O)OCCO MCULE-1495755417 [0,2,0,0,0,0|2,0,0]=4 4224 B8R0.8 CC(Cl)C(=O)NCCO MCULE-5321948590 [0,2,0,0,0,0|2,0,0]=4 4225 B8R0.8 CC(N)C(=O)NCCF MCULE-2386057618 [0,2,0,0,0,0|2,0,0]=4 4226 B8R0.8 CC(N)C(=O)NCCF MCULE-6631244596 [0,2,0,0,0,0|2,0,0]=4 4227 B8R0.8 CC(N)C(=O)NCCO MCULE-8762343384 [0,2,0,0,0,0|2,0,0]=4 4228 B8R0.8 CC(N)C(=O)NCCO MCULE-9848656207 [0,2,0,0,0,0|2,0,0]=4 4229 B8R0.8 CC(O)C(=O)NCCO MCULE-2938685957 [0,2,0,0,0,0|2,0,0]=4 4230 B8R0.8 CC(O)C(=O)OCCO MCULE-9321822945 [0,2,0,0,0,0|2,0,0]=4 4231 B8R0.8 CCCCC(=O)C(=O)C MCULE-5957201570 [0,2,0,0,0,0|1,0,0]=3 4232 B8R0.8 CCCCC(=O)C(=O)O MCULE-7796922508 [0,2,0,0,0,0|2,0,0]=4 4233 B8R0.8 CCCCC(=O)C(=O)[O-] MCULE-4575533706 [0,2,0,0,0,0|2,0,0]=4 4234 B8R0.8 CCCCC(=O)C(C)C MCULE-1905176805 [0,2,0,0,0,0|1,0,0]=3 4235 B8R0.8 CCCCC(=O)C(C)N MCULE-1316684028 [0,2,0,0,0,0|1,0,0]=3 4236 B8R0.8 CCCCC(=O)C(C)N MCULE-1846818051 [0,2,0,0,0,0|1,0,0]=3 4237 B8R0.8 CCCCC(=O)C(C)N MCULE-6223994385 [0,2,0,0,0,0|1,0,0]=3 4238 B8R0.8 CCCCC(=O)C(C)N MCULE-8594054065 [0,2,0,0,0,0|1,0,0]=3 4239 B8R0.8 CCCCC(=O)N(C)C MCULE-1521248911 [0,2,0,0,0,0|1,0,0]=3 4240 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-4202397833 [0,2,0,0,0,0|1,0,0]=3 4241 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-8156418445 [0,2,0,0,0,0|1,0,0]=3 4242 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-8186118680 [0,2,0,0,0,0|1,0,0]=3 4243 B8R0.8 CCCCC(=O)[C@H](C)N MCULE-9214507863 [0,2,0,0,0,0|1,0,0]=3 4244 B8R0.8 CCCNC(=O)C(=O)O MCULE-6074987864 [0,2,0,0,0,0|2,0,0]=4 4245 B8R0.8 CCCNC(=O)C(C)Br MCULE-7756965972 [0,2,0,0,0,0|1,0,0]=3 4246 B8R0.8 CCCNC(=O)C(C)Cl MCULE-7279909731 [0,2,0,0,0,0|1,0,0]=3 4247 B8R0.8 CCCNC(=O)C(C)N MCULE-2829232879 [0,2,0,0,0,0|1,0,0]=3 4248 B8R0.8 CCCNC(=O)C(C)N MCULE-5579383254 [0,2,0,0,0,0|1,0,0]=3 4249 B8R0.8 CCCNC(=O)C(Cl)Cl MCULE-8764104239 [0,2,0,0,0,0|2,0,0]=4 4250 B8R0.8 CCCNC(=O)[C@@H](C)N MCULE-4345277738 [0,2,0,0,0,0|1,0,0]=3 4251 B8R0.8 CCCNC(=O)[C@@H](C)N MCULE-8221598088 [0,2,0,0,0,0|1,0,0]=3 4252 B8R0.8 CCCOC(=O)C(C)C MCULE-8112640762 [0,2,0,0,0,0|1,0,0]=3 4253 B8R0.8 CCCOC(=O)C(C)Cl MCULE-6753282934 [0,2,0,0,0,0|1,0,0]=3 4254 B8R0.8 CCCOC(=O)C(C)N MCULE-6692040810 [0,2,0,0,0,0|1,0,0]=3 4255 B8R0.8 CCCOC(=O)C(C)N MCULE-9142364939 [0,2,0,0,0,0|1,0,0]=3 4256 B8R0.8 CCCOC(=O)C(C)O MCULE-8240669472 [0,2,0,0,0,0|1,0,0]=3 4257 B8R0.8 CCCOC(=O)[C@H](C)N MCULE-2973724539 [0,2,0,0,0,0|1,0,0]=3 4258 B8R0.8 CCCOC(=O)[C@H](C)N MCULE-7427167899 [0,2,0,0,0,0|1,0,0]=3 4259 B8R0.8 CCCOC(=O)[C@H](C)O MCULE-4150275631 [0,2,0,0,0,0|1,0,0]=3 4260 B8R0.8 CCNCC(=O)N(C)C MCULE-7864141414 [0,2,0,0,0,0|1,0,0]=3 4261 B8R0.8 CN(C)C(=O)CCCCl MCULE-1395271076 [0,2,0,0,0,0|1,0,0]=3 4262 B8R0.8 CN(C)C(=O)CCCN MCULE-3574617538 [0,2,0,0,0,0|1,0,0]=3 4263 B8R0.8 CN(C)C(=O)CCCN MCULE-6145958264 [0,2,0,0,0,0|1,0,0]=3 4264 B8R0.8 CN(C)C(=O)CCCO MCULE-2835364374 [0,2,0,0,0,0|1,0,0]=3 4265 B8R0.8 CN(C)C(=O)CCNN MCULE-3319427322 [0,2,0,0,0,0|2,0,0]=4 4266 B8R0.8 CN(C)C(=O)CCNN MCULE-7081179425 [0,2,0,0,0,0|2,0,0]=4 4267 B8R0.8 CN(C)C(=O)NCCN MCULE-8853309533 [0,2,0,0,0,0|2,0,0]=4 4268 B8R0.8 CN(C)C(=O)NCCO MCULE-1871590361 [0,2,0,0,0,0|2,0,0]=4 4269 B8R0.8 CN(C)C(=O)OCCBr MCULE-6277675119 [0,2,0,0,0,0|2,0,0]=4 4270 B8R0.8 CN(C)C(=O)OCCN MCULE-5799128416 [0,2,0,0,0,0|2,0,0]=4 4271 B8R0.8 CN(C)C(=O)OCCN MCULE-7701325921 [0,2,0,0,0,0|2,0,0]=4 4272 B8R0.8 CN(C)C(=O)SCCO MCULE-5599478558 [0,2,0,0,0,0|2,0,0]=4 4273 B8R0.8 CNCCC(=O)N(C)C MCULE-6256018690 [0,2,0,0,0,0|1,0,0]=3 4274 B8R0.8 CNCCC(=O)N(C)C MCULE-9074335618 [0,2,0,0,0,0|1,0,0]=3 4275 B8R0.8 COCCC(=O)C(C)C MCULE-8480801762 [0,2,0,0,0,0|1,0,0]=3 4276 B8R0.8 COCCC(=O)N(C)C MCULE-3658554853 [0,2,0,0,0,0|1,0,0]=3 4277 B8R0.8 COCNC(=O)N(C)C MCULE-2879447245 [0,2,0,0,0,0|2,0,0]=4 4278 B8R0.8 CSCCC(=O)C(=O)O MCULE-6752350933 [0,2,0,0,0,0|2,0,0]=4 4279 B8R0.8 CSCCC(=O)C(=O)[O-] MCULE-4931776455 [0,2,0,0,0,0|2,0,0]=4 4280 B8R0.9 C=C(C)CNC(=S)OC MCULE-1057647049 [0,2,0,0,0,0|0,1,1]=4 4281 B8R0.9 C=CC(=O)NCC(C)O MCULE-7092700588 [0,2,0,0,0,0|1,0,1]=4 4282 B8R0.9 C=CC(=O)OCC(C)C MCULE-9738172155 [0,2,0,0,0,0|1,0,1]=4 4283 B8R0.9 C=CC(=O)OCC(C)O MCULE-5600840983 [0,2,0,0,0,0|1,0,1]=4 4284 B8R0.9 CC(C)CCC(=O)CCl MCULE-7122163926 [0,2,0,0,0,0|2,0,0]=4 4285 B8R0.9 CC(C)CCC(=O)CN MCULE-2601333978 [0,2,0,0,0,0|2,0,0]=4 4286 B8R0.9 CC(C)CCC(=O)CN MCULE-9600279855 [0,2,0,0,0,0|2,0,0]=4 4287 B8R0.9 CC(C)CNC(=O)CBr MCULE-8912739616 [0,2,0,0,0,0|2,0,0]=4 4288 B8R0.9 CC(C)CNC(=O)CCl MCULE-6480983342 [0,2,0,0,0,0|2,0,0]=4 4289 B8R0.9 CC(C)CNC(=O)CN MCULE-3593523223 [0,2,0,0,0,0|2,0,0]=4 4290 B8R0.9 CC(C)CNC(=O)CN MCULE-9338504001 [0,2,0,0,0,0|2,0,0]=4 4291 B8R0.9 CC(C)COC(=O)CBr MCULE-3596274514 [0,2,0,0,0,0|2,0,0]=4 4292 B8R0.9 CC(C)COC(=O)CCl MCULE-8531893041 [0,2,0,0,0,0|2,0,0]=4 4293 B8R0.9 CC(C)COC(=O)CS MCULE-6380142851 [0,2,0,0,0,0|2,0,0]=4 4294 B8R0.9 CC(C)OCC(=O)NN MCULE-1756553014 [0,2,0,0,0,0|2,0,0]=4 4295 B8R0.9 CC(C)OCC(=O)NN MCULE-4596563241 [0,2,0,0,0,0|2,0,0]=4 4296 B8R0.9 CC(Cl)CNC(=O)CCl MCULE-1131103741 [0,2,0,0,0,0|2,0,0]=4 4297 B8R0.9 CC(O)CCC(=O)NN MCULE-3743680204 [0,2,0,0,0,0|2,0,0]=4 4298 B8R0.9 CCC(=O)CCC(=O)C MCULE-7923444653 [0,2,0,0,0,0|1,0,0]=3 4299 B8R0.9 CCC(=O)CCC(=O)O MCULE-4505750030 [0,2,0,0,0,0|1,0,1]=4 4300 B8R0.9 CCC(=O)CCC(C)C MCULE-3065298823 [0,2,0,0,0,0|1,0,0]=3 4301 B8R0.9 CCC(=O)COC(=O)C MCULE-4876335377 [0,2,0,0,0,0|1,0,1]=4 4302 B8R0.9 CCC(=O)NCC(C)C MCULE-3079187120 [0,2,0,0,0,0|1,0,0]=3 4303 B8R0.9 CCC(=O)OCC(C)Br MCULE-7344958033 [0,2,0,0,0,0|1,0,0]=3 4304 B8R0.9 CCC(=O)OCC(C)C MCULE-4196106578 [0,2,0,0,0,0|1,0,0]=3 4305 B8R0.9 CN(C)CCC(=O)NN MCULE-5716266931 [0,2,0,0,0,0|2,0,0]=4 4306 B8R0.9 CNC(=O)CCC(=O)O MCULE-8340443315 [0,2,0,0,0,0|1,0,1]=4 4307 B8R0.9 CNC(=O)CNC(=O)C MCULE-3508245247 [0,2,0,0,0,0|1,0,1]=4 4308 B8R0.9 COC(=O)/C=C/C(=O)C MCULE-7597345789 [0,2,0,0,0,0|0,0,2]=4 4309 B8R0.9 COC(=O)/C=C/C(C)C MCULE-3160224452 [0,2,0,0,0,0|0,0,1]=3 4310 B8R0.9 COC(=O)/C=C/N(C)C MCULE-2402483726 [0,2,0,0,0,0|0,0,2]=4 4311 B8R0.9 COC(=O)/N=C/N(C)C MCULE-3421193223 [0,2,0,0,0,0|1,0,1]=4 4312 B8R0.9 COC(=O)C=CC(=O)C MCULE-5746687781 [0,2,0,0,0,0|0,0,2]=4 4313 B8R0.9 COC(=O)C=CC(C)C MCULE-8333658639 [0,2,0,0,0,0|0,0,1]=3 4314 B8R0.9 COC(=O)CCC(=O)C MCULE-6324755148 [0,2,0,0,0,0|0,0,0]=2 4315 B8R0.9 COC(=O)CCC(=O)Cl MCULE-2684320402 [0,2,0,0,0,0|0,0,1]=3 4316 B8R0.9 COC(=O)CCC(=O)N MCULE-1154081515 [0,2,0,0,0,0|0,0,1]=3 4317 B8R0.9 COC(=O)CCC(=O)O MCULE-4083173324 [0,2,0,0,0,0|0,0,1]=3 4318 B8R0.9 COC(=O)CCC(=S)N MCULE-4037707510 [0,2,0,0,0,0|0,0,1]=3 4319 B8R0.9 COC(=O)CCC(F)F MCULE-4602374642 [0,2,0,0,0,0|0,0,0]=2 4320 B8R0.9 COC(=O)CCN(=O)=O MCULE-3836108700 [0,2,0,0,0,0|1,0,0]=3 4321 B8R0.9 COC(=O)CCN(C)C MCULE-5967397518 [0,2,0,0,0,0|0,0,0]=2 4322 B8R0.9 COC(=O)CCS(=O)O MCULE-4935012562 [0,2,0,0,0,0|1,0,0]=3 4323 B8R0.9 COC(=O)CCS(=O)[O-] MCULE-5802411922 [0,2,0,0,0,0|1,0,0]=3 4324 B8R0.9 COC(=O)CNC(=O)C MCULE-3795072377 [0,2,0,0,0,0|0,0,1]=3 4325 B8R0.9 COC(=O)CNC(C)C MCULE-7232154394 [0,2,0,0,0,0|0,0,0]=2 4326 B8R0.9 COC(=O)COC(C)C MCULE-8327092817 [0,2,0,0,0,0|0,0,0]=2 4327 B8R0.9 COC(=O)COC(Cl)Cl MCULE-8466265912 [0,2,0,0,0,0|1,0,0]=3 4328 B8R0.9 COC(=O)CSC(=N)N MCULE-5721573915 [0,2,0,0,0,0|1,0,1]=4 4329 B8R0.9 COC(=O)CSC(=N)N MCULE-8534299006 [0,2,0,0,0,0|1,0,1]=4 4330 B8R0.9 COC(=O)CSC(C)C MCULE-9054714022 [0,2,0,0,0,0|0,0,0]=2 4331 B8R0.9 COC(=O)N=CN(C)C MCULE-5824976694 [0,2,0,0,0,0|1,0,1]=4 4332 B8R0.9 COC(=O)NCC(=O)C MCULE-1043877696 [0,2,0,0,0,0|0,0,1]=3 4333 B8R0.9 COC(=O)NCC(=O)O MCULE-3693365728 [0,2,0,0,0,0|1,0,1]=4 4334 B8R0.9 COC(=O)NCC(C)O MCULE-3862167665 [0,2,0,0,0,0|0,0,0]=2 4335 B8R0.9 COC(=O)OCC(F)F MCULE-9403543035 [0,2,0,0,0,0|1,0,0]=3 4336 B8R0.9 COC(C)CNC(C)C MCULE-3693477371 [0,2,0,0,0,0|1,0,1]=4 4337 B8R0.9 COC(C)OCC(C)C MCULE-2144427762 [0,2,0,0,0,0|1,0,1]=4 4338 B8R0.11 CCC/C=C(/C=O)\CC MCULE-6598454196 [0,2,0,0,0,0|1,0,0]=3 4339 B8R0.11 CCCC=C(C=O)CC MCULE-9099763598 [0,2,0,0,0,0|1,0,0]=3 4340 B8R0.11 CCCC=C(CC)CO MCULE-5047095723 [0,2,0,0,0,0|1,0,1]=4 4341 B8R0.11 CCCCC(C=O)CC MCULE-1141216024 [0,2,0,0,0,0|1,0,1]=4 4342 B8R0.11 CCNCC(OC)OC MCULE-2121819997 [0,2,0,0,0,0|0,0,2]=4 4343 B8R0.11 CCO/C=C(\C=O)/CC MCULE-4972624375 [0,2,0,0,0,0|1,0,1]=4 4344 B8R0.11 CCOC=C(C=O)CC MCULE-2067466903 [0,2,0,0,0,0|1,0,1]=4 4345 B8R0.11 COC(C#N)CCSC MCULE-9976329021 [0,2,0,0,0,0|1,0,1]=4 4346 B8R0.11 COC(CCCBr)OC MCULE-3693606561 [0,2,0,0,0,0|0,0,2]=4 4347 B8R0.11 COC(CCCCl)OC MCULE-4360901428 [0,2,0,0,0,0|0,0,2]=4 4348 B8R0.11 COC(CCCN)OC MCULE-5648092637 [0,2,0,0,0,0|0,0,2]=4 4349 B8R0.11 COC(CCSC)OC MCULE-3069805433 [0,2,0,0,0,0|0,0,2]=4 4350 B8R0.11 COC(CN)CCSC MCULE-1834354805 [0,2,0,0,0,0|1,0,1]=4 4351 B8R0.11 COCCC(OC)OC MCULE-2411343546 [0,2,0,0,0,0|0,0,2]=4 4352 B8R0.25 CCCC[Si](C)(C)OC MCULE-1444604003 [0,2,0,0,0,0|1,1,0]=4 4353 B8R0.25 CCP(=O)(O)CCCN MCULE-1115053809 [0,2,0,0,0,0|2,0,0]=4 4354 B8R0.25 CCP(=O)(O)CCCN MCULE-4786639632 [0,2,0,0,0,0|2,0,0]=4 4355 B8R0.25 CCS(=O)(=O)CCCBr MCULE-1816646174 [0,2,0,0,0,0|2,0,0]=4 4356 B8R0.25 CCS(=O)(=O)CCCI MCULE-6885642073 [0,2,0,0,0,0|2,0,0]=4 4357 B8R0.25 CCS(=O)(=O)CCCN MCULE-2244580003 [0,2,0,0,0,0|2,0,0]=4 4358 B8R0.25 CCS(=O)(=O)CCCN MCULE-5620943859 [0,2,0,0,0,0|2,0,0]=4 4359 B8R0.25 CCS(=O)(=O)CCCO MCULE-6933237968 [0,2,0,0,0,0|2,0,0]=4 4360 B8R0.25 CCS(=O)(=O)CCNC MCULE-1361160144 [0,2,0,0,0,0|2,0,0]=4 4361 B8R0.25 CCS(=O)(=O)CCNC MCULE-5959057283 [0,2,0,0,0,0|2,0,0]=4 4362 B8R0.25 CNCCS(=O)(=O)NC MCULE-4308896599 [0,2,0,0,0,0|2,0,0]=4 4363 B8R0.25 CNCCS(=O)(=O)NC MCULE-5591141597 [0,2,0,0,0,0|2,0,0]=4 4364 B8R0.25 CNS(=O)(=O)CCCCl MCULE-3406123745 [0,2,0,0,0,0|2,0,0]=4 4365 B8R0.25 CNS(=O)(=O)CCCN MCULE-3708844725 [0,2,0,0,0,0|2,0,0]=4 4366 B8R0.25 CNS(=O)(=O)CCCN MCULE-8741221134 [0,2,0,0,0,0|2,0,0]=4 4367 B8R0.25 CNS(=O)(=O)CCOC MCULE-5793950842 [0,2,0,0,0,0|2,0,0]=4 4368 B8R0.25 CO[Si](C)(C)CCCCl MCULE-1614746848 [0,2,0,0,0,0|1,1,0]=4 4369 B8R0.25 CO[Si](C)(C)CCCN MCULE-4067882225 [0,2,0,0,0,0|1,1,0]=4 4370 B8R0.14 CCCC(=O)C(C)(C)C MCULE-9363300648 [0,2,0,0,0,0|1,0,0]=3 4371 B8R0.14 CCCC(=O)C(F)(F)F MCULE-9508540421 [0,2,0,0,0,0|2,0,0]=4 4372 B8R0.14 CCNC(=O)C(C)(C)C MCULE-4793852889 [0,2,0,0,0,0|2,0,0]=4 4373 B8R0.14 CCNC(=O)C(C)(C)N MCULE-1282054868 [0,2,0,0,0,0|2,0,0]=4 4374 B8R0.14 CCNC(=O)C(C)(C)N MCULE-3092301108 [0,2,0,0,0,0|2,0,0]=4 4375 B8R0.14 CCNC(=O)C(C)(C)O MCULE-6606508192 [0,2,0,0,0,0|2,0,0]=4 4376 B8R0.14 CCOC(=O)C(C)(C)Br MCULE-3948539521 [0,2,0,0,0,0|2,0,0]=4 4377 B8R0.14 CCOC(=O)C(C)(C)C MCULE-5977998626 [0,2,0,0,0,0|2,0,0]=4 4378 B8R0.14 CCOC(=O)C(C)(C)F MCULE-3847407505 [0,2,0,0,0,0|2,0,0]=4 4379 B8R0.14 CCOC(=O)C(C)(C)I MCULE-6786973853 [0,2,0,0,0,0|2,0,0]=4 4380 B8R0.14 CCOC(=O)C(C)(C)N MCULE-1684967791 [0,2,0,0,0,0|2,0,0]=4 4381 B8R0.14 CCOC(=O)C(C)(C)N MCULE-5714208606 [0,2,0,0,0,0|2,0,0]=4 4382 B8R0.14 CCOC(=O)C(C)(C)O MCULE-8595289214 [0,2,0,0,0,0|2,0,0]=4 4383 B8R0.14 CCOC(=O)C(C)(F)F MCULE-2091498609 [0,2,0,0,0,0|2,0,0]=4 4384 B8R0.14 CNCC(=O)C(C)(C)C MCULE-5273719763 [0,2,0,0,0,0|2,0,0]=4 4385 B8R0.14 CNCC(=O)C(C)(C)C MCULE-9474779464 [0,2,0,0,0,0|2,0,0]=4 4386 B8R0.15 CCCC(=NO)C(=O)N MCULE-4974052536 [0,2,0,0,0,0|2,0,0]=4 4387 B8R0.15 CCCC(CC)C(=O)C MCULE-3483794250 [0,2,0,0,0,0|1,0,1]=4 4388 B8R0.15 CCCC(CC)C(=O)O MCULE-2070546888 [0,2,0,0,0,0|1,0,1]=4 4389 B8R0.15 CCCC(NC)C(=O)O MCULE-5292420123 [0,2,0,0,0,0|1,0,1]=4 4390 B8R0.15 CCCC(NC)C(=O)O MCULE-5734283547 [0,2,0,0,0,0|1,0,1]=4 4391 B8R0.15 CCCC(NC)C(=O)O MCULE-9559460593 [0,2,0,0,0,0|1,0,1]=4 4392 B8R0.15 CCCC(OC)C(=O)O MCULE-6875744280 [0,2,0,0,0,0|0,0,1]=3 4393 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-3394704356 [0,2,0,0,0,0|1,0,1]=4 4394 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-8140893147 [0,2,0,0,0,0|1,0,1]=4 4395 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-1028689544 [0,2,0,0,0,0|1,0,1]=4 4396 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-4848752673 [0,2,0,0,0,0|1,0,1]=4 4397 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-5585839502 [0,2,0,0,0,0|1,0,1]=4 4398 B8R0.15 COC(CCN)C(=O)N MCULE-4310174639 [0,2,0,0,0,0|1,0,1]=4 4399 B8R0.15 COC(CCN)C(=O)O MCULE-1510512790 [0,2,0,0,0,0|1,0,1]=4 4400 B8R0.15 COCC(OC)C(=O)O MCULE-5776685365 [0,2,0,0,0,0|1,0,1]=4 4401 B8R0.22 CCCC(C=O)CCC MCULE-6309806380 [0,2,0,0,0,0|1,0,1]=4 4402 B8R0.22 CCCC(CN)OCC MCULE-2445802050 [0,2,0,0,0,0|1,0,1]=4 4403 B8R0.22 CCCN(C=O)CCC MCULE-8028235265 [0,2,0,0,0,0|2,0,0]=4 4404 B8R0.22 CCCN(CCC)N=O MCULE-8973096480 [0,2,0,0,0,0|2,0,0]=4 4405 B8R0.30 CCCP(=O)(O)CCC MCULE-8312121464 [0,2,0,0,0,0|2,0,0]=4 4406 B8R0.30 CCCS(=O)(=O)CCC MCULE-7276251936 [0,2,0,0,0,0|2,0,0]=4 4407 B8R0.30 CCCS(=O)(=O)CCCl MCULE-5717074276 [0,2,0,0,0,0|2,0,0]=4 4408 B8R0.30 CCCS(=O)(=O)CCO MCULE-7684067482 [0,2,0,0,0,0|2,0,0]=4 4409 B8R0.30 CCOP(=O)(C)CCCl MCULE-7315021258 [0,2,0,0,0,0|2,0,0]=4 4410 B8R0.30 CCOP(=O)(C)OCC MCULE-8935982898 [0,2,0,0,0,0|2,0,0]=4 4411 B8R0.30 CCOP(=O)(Cl)OCC MCULE-3227922476 [0,2,0,0,0,0|2,0,0]=4 4412 B8R0.30 CCOP(=O)(N)OCC MCULE-2701752082 [0,2,0,0,0,0|2,0,0]=4 4413 B8R0.30 CCOP(=O)(O)OCC MCULE-1463065293 [0,2,0,0,0,0|2,0,0]=4 4414 B8R0.30 CCOP(=O)([O-])OCC MCULE-3156784021 [0,2,0,0,0,0|2,0,0]=4 4415 B8R0.30 CCOP(=O)([O-])OCC MCULE-3406523495 [0,2,0,0,0,0|2,0,0]=4 4416 B8R0.30 CCOS(=O)(=O)CCO MCULE-8910965824 [0,2,0,0,0,0|2,0,0]=4 4417 B8R0.30 CCOS(=O)(=O)OCC MCULE-1621267036 [0,2,0,0,0,0|2,0,0]=4 4418 B8R0.13 C#CC(C)(C)C(=O)OC MCULE-1769873961 [0,2,0,0,0,0|0,0,2]=4 4419 B8R0.13 C#CC(C)(O)C(=O)OC MCULE-6791914528 [0,2,0,0,0,0|0,0,2]=4 4420 B8R0.13 CCC(=O)C(C)(C)CC MCULE-3794055790 [0,2,0,0,0,0|1,0,0]=3 4421 B8R0.13 CCC(C)(C)C(=O)CBr MCULE-4740682169 [0,2,0,0,0,0|2,0,0]=4 4422 B8R0.13 CCC(C)(C)C(=O)CCl MCULE-6098410477 [0,2,0,0,0,0|2,0,0]=4 4423 B8R0.13 CCC(C)(C)C(=O)OC MCULE-4686994014 [0,2,0,0,0,0|0,0,0]=2 4424 B8R0.13 CCC(C)(N)C(=O)OC MCULE-3094414845 [0,2,0,0,0,0|0,0,0]=2 4425 B8R0.13 CCC(C)(N)C(=O)OC MCULE-3671452978 [0,2,0,0,0,0|0,0,0]=2 4426 B8R0.13 CCC(C)(N)C(=O)OC MCULE-7294646980 [0,2,0,0,0,0|0,0,0]=2 4427 B8R0.13 CCC(C)(N)C(=O)OC MCULE-7579678256 [0,2,0,0,0,0|0,0,0]=2 4428 B8R0.13 CCC(C)(N)C(=O)OC MCULE-8600950514 [0,2,0,0,0,0|0,0,0]=2 4429 B8R0.13 CCC(C)(O)C(=O)OC MCULE-8142046975 [0,2,0,0,0,0|0,0,0]=2 4430 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-2166068124 [0,2,0,0,0,0|0,0,0]=2 4431 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-5528793909 [0,2,0,0,0,0|0,0,0]=2 4432 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-5577268972 [0,2,0,0,0,0|0,0,0]=2 4433 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-9937729069 [0,2,0,0,0,0|0,0,0]=2 4434 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-1110630847 [0,2,0,0,0,0|0,0,0]=2 4435 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-1873229791 [0,2,0,0,0,0|0,0,0]=2 4436 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-2400409033 [0,2,0,0,0,0|0,0,0]=2 4437 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-7488892262 [0,2,0,0,0,0|0,0,0]=2 4438 B8R0.13 CNC(=O)C(C)(C)CCl MCULE-6059735836 [0,2,0,0,0,0|2,0,0]=4 4439 B8R0.13 CNC(=O)C(C)(C)CN MCULE-2878763373 [0,2,0,0,0,0|2,0,0]=4 4440 B8R0.13 CNC(=O)C(C)(C)CN MCULE-3206960064 [0,2,0,0,0,0|2,0,0]=4 4441 B8R0.13 CNC(=O)C(C)(C)NC MCULE-4678065112 [0,2,0,0,0,0|2,0,0]=4 4442 B8R0.13 CNC(=O)C(C)(C)NC MCULE-5005697101 [0,2,0,0,0,0|2,0,0]=4 4443 B8R0.13 CNC(C)(C)C(=O)OC MCULE-3633926086 [0,2,0,0,0,0|1,0,0]=3 4444 B8R0.13 CNC(C)(C)C(=O)OC MCULE-5043607769 [0,2,0,0,0,0|1,0,0]=3 4445 B8R0.13 COC(=O)C(C)(Br)CBr MCULE-7338587134 [0,2,0,0,0,0|1,0,0]=3 4446 B8R0.13 COC(=O)C(C)(C)C#N MCULE-6514633076 [0,2,0,0,0,0|1,0,1]=4 4447 B8R0.13 COC(=O)C(C)(C)C=O MCULE-7831259608 [0,2,0,0,0,0|1,0,1]=4 4448 B8R0.13 COC(=O)C(C)(C)CBr MCULE-8493306369 [0,2,0,0,0,0|1,0,0]=3 4449 B8R0.13 COC(=O)C(C)(C)CN MCULE-3876518389 [0,2,0,0,0,0|1,0,0]=3 4450 B8R0.13 COC(=O)C(C)(C)CN MCULE-6058798123 [0,2,0,0,0,0|1,0,0]=3 4451 B8R0.13 COC(=O)C(C)(C)CO MCULE-5007341074 [0,2,0,0,0,0|1,0,0]=3 4452 B8R0.13 COC(=O)C(C)(C)CS MCULE-1609978379 [0,2,0,0,0,0|1,0,0]=3 4453 B8R0.13 COC(=O)C(C)(C)ON MCULE-4323661548 [0,2,0,0,0,0|2,0,0]=4 4454 B8R0.13 COC(=O)C(C)(C)ON MCULE-9675322237 [0,2,0,0,0,0|2,0,0]=4 4455 B8R0.13 COC(=O)C(C)(N)CO MCULE-3846577646 [0,2,0,0,0,0|1,0,0]=3 4456 B8R0.13 COC(=O)C(C)(N)CO MCULE-4981173106 [0,2,0,0,0,0|1,0,0]=3 4457 B8R0.13 COC(=O)C(C)(O)CCl MCULE-5923752147 [0,2,0,0,0,0|1,0,0]=3 4458 B8R0.13 COC(=O)C(C)(O)CN MCULE-4142904446 [0,2,0,0,0,0|1,0,0]=3 4459 B8R0.13 COC(=O)C(C)(O)CN MCULE-7145315033 [0,2,0,0,0,0|1,0,0]=3 4460 B8R0.13 COC(=O)C(Cl)(Cl)C#N MCULE-4682972969 [0,2,0,0,0,0|1,0,1]=4 4461 B8R0.13 COC(=O)C(Cl)(Cl)OC MCULE-5718474171 [0,2,0,0,0,0|1,0,0]=3 4462 B8R0.13 COC(=O)C(F)(F)CBr MCULE-4822172189 [0,2,0,0,0,0|1,0,0]=3 4463 B8R0.13 COC(=O)C(F)(F)CN MCULE-6242672860 [0,2,0,0,0,0|1,0,0]=3 4464 B8R0.13 COC(=O)C(F)(F)CN MCULE-6342895274 [0,2,0,0,0,0|1,0,0]=3 4465 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-2857382898 [0,2,0,0,0,0|1,0,0]=3 4466 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-3226982515 [0,2,0,0,0,0|1,0,0]=3 4467 B8R0.20 CCC(=O)N(CC)CC MCULE-4492225722 [0,2,0,0,0,0|2,0,0]=4 4468 B8R0.20 CCC(Br)C(OC)OC MCULE-9053790367 [0,2,0,0,0,0|0,0,2]=4 4469 B8R0.20 CCC(C)C(C=O)OC MCULE-5091212843 [0,2,0,0,0,0|0,0,1]=3 4470 B8R0.20 CCC(C)C(CN)OC MCULE-5181614773 [0,2,0,0,0,0|1,0,1]=4 4471 B8R0.20 CCC(C)C(CO)OC MCULE-9009724151 [0,2,0,0,0,0|0,0,2]=4 4472 B8R0.20 CCC(CC)C(=O)NC MCULE-1491407837 [0,2,0,0,0,0|1,0,0]=3 4473 B8R0.20 CCC(CC)C(=O)NN MCULE-2188897892 [0,2,0,0,0,0|2,0,0]=4 4474 B8R0.20 CCC(CC)C(=O)OC MCULE-4475439540 [0,2,0,0,0,0|0,0,0]=2 4475 B8R0.20 CCC(CN)C(=O)OC MCULE-1321974588 [0,2,0,0,0,0|0,0,0]=2 4476 B8R0.20 CCC(CN)C(=O)OC MCULE-3486156834 [0,2,0,0,0,0|0,0,0]=2 4477 B8R0.20 CCC(CO)C(=O)OC MCULE-3580039708 [0,2,0,0,0,0|0,0,0]=2 4478 B8R0.20 CCC(N)C(OC)OC MCULE-4426944560 [0,2,0,0,0,0|0,0,2]=4 4479 B8R0.20 CCC(N)C(OC)OC MCULE-7743570977 [0,2,0,0,0,0|0,0,2]=4 4480 B8R0.20 CCC(NC)C(=O)OC MCULE-2432468432 [0,2,0,0,0,0|0,0,0]=2 4481 B8R0.20 CCC(NC)C(=O)OC MCULE-3478855741 [0,2,0,0,0,0|0,0,0]=2 4482 B8R0.20 CCC(OC)C(=O)NN MCULE-3579318749 [0,2,0,0,0,0|2,0,0]=4 4483 B8R0.20 CCC(OC)C(=O)NN MCULE-8374336485 [0,2,0,0,0,0|2,0,0]=4 4484 B8R0.20 CCN(CC)C(=O)SC MCULE-6776760270 [0,2,0,0,0,0|1,1,0]=4 4485 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-3786730078 [0,2,0,0,0,0|0,0,0]=2 4486 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-5452442009 [0,2,0,0,0,0|0,0,0]=2 4487 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-6957965861 [0,2,0,0,0,0|0,0,0]=2 4488 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-7876560081 [0,2,0,0,0,0|0,0,0]=2 4489 B8R0.20 CNC(CN)C(=O)OC MCULE-3787828683 [0,2,0,0,0,0|1,0,0]=3 4490 B8R0.20 CNC(CO)C(=O)OC MCULE-1017957273 [0,2,0,0,0,0|1,0,0]=3 4491 B8R0.20 CNC(CO)C(=O)OC MCULE-2751377307 [0,2,0,0,0,0|1,0,0]=3 4492 B8R0.20 COC(=O)C(C=O)C=O MCULE-1727120989 [0,2,0,0,0,0|1,0,1]=4 4493 B8R0.20 COC(=O)C(CBr)CBr MCULE-2058360654 [0,2,0,0,0,0|1,0,0]=3 4494 B8R0.20 COC(=O)C(CBr)OC MCULE-1221978209 [0,2,0,0,0,0|1,0,0]=3 4495 B8R0.20 COC(=O)C(CN)CN MCULE-2482587382 [0,2,0,0,0,0|1,0,0]=3 4496 B8R0.20 COC(=O)C(CN)CN MCULE-7758396429 [0,2,0,0,0,0|1,0,0]=3 4497 B8R0.20 COC(=O)C(CN)OC MCULE-2907367615 [0,2,0,0,0,0|1,0,0]=3 4498 B8R0.20 COC(=O)C(OC)OC MCULE-7706382604 [0,2,0,0,0,0|1,0,0]=3 4499 B8R0.20 COC(=O)[C@H](CN)OC MCULE-7711946747 [0,2,0,0,0,0|1,0,0]=3 4500 B8R0.20 COC(=O)[C@H](CN)OC MCULE-8104475257 [0,2,0,0,0,0|1,0,0]=3 4501 B8R0.31 CCC[Si](C)(OC)OC MCULE-7774578168 [0,2,0,0,0,0|0,1,1]=4 4502 B8R0.31 COP(=O)(CCN)OC MCULE-2090301241 [0,2,0,0,0,0|2,0,0]=4 4503 B8R0.31 COP(=O)(CCO)OC MCULE-2482162119 [0,2,0,0,0,0|2,0,0]=4 4504 B6R1.2 BrC1=CCCC1 MCULE-1008379150 [1,0,0,1,0,0|1,0,1]=4 4505 B6R1.2 BrC1CCCC1 MCULE-9383923023 [1,0,0,1,0,0|1,0,1]=4 4506 B6R1.2 C=C1CCCC1 MCULE-4115373196 [1,0,0,1,0,0|1,0,0]=3 4507 B6R1.2 C=C1CCNC1 MCULE-7982953073 [1,0,0,1,0,0|2,0,0]=4 4508 B6R1.2 C=C1CCNC1 MCULE-8428731599 [1,0,0,1,0,0|2,0,0]=4 4509 B6R1.2 C=C1CCSC1 MCULE-7042571473 [1,0,0,1,0,0|2,0,0]=4 4510 B6R1.2 CC1=CCCC1 MCULE-8508688474 [1,0,0,1,0,0|1,0,0]=3 4511 B6R1.2 CC1=CCCO1 MCULE-7276659214 [1,0,0,1,0,0|0,0,2]=4 4512 B6R1.2 CC1=CCNC1 MCULE-5892113847 [1,0,0,1,0,0|2,0,0]=4 4513 B6R1.2 CC1=CCNC1 MCULE-9225220351 [1,0,0,1,0,0|2,0,0]=4 4514 B6R1.2 CC1=NCCC1 MCULE-5009170423 [1,0,0,1,0,0|1,0,0]=3 4515 B6R1.2 CC1=NCCN1 MCULE-4787238872 [1,0,0,1,0,0|2,0,0]=4 4516 B6R1.2 CC1=NCCO1 MCULE-8564633040 [1,0,0,1,0,0|1,0,1]=4 4517 B6R1.2 CC1=NCCS1 MCULE-1701303405 [1,0,0,1,0,0|1,1,0]=4 4518 B6R1.2 CC1=NNCC1 MCULE-1758510182 [1,0,0,1,0,0|2,0,0]=4 4519 B6R1.2 CC1CCCC1 MCULE-4702116068 [1,0,0,1,0,0|1,0,1]=4 4520 B6R1.2 CC1CCCN1 MCULE-4853624560 [1,0,0,1,0,0|1,0,1]=4 4521 B6R1.2 CC1CCCN1 MCULE-5939948024 [1,0,0,1,0,0|1,0,1]=4 4522 B6R1.2 CC1CCCN1 MCULE-6020011445 [1,0,0,1,0,0|1,0,1]=4 4523 B6R1.2 CC1CCCN1 MCULE-7855346849 [1,0,0,1,0,0|1,0,1]=4 4524 B6R1.2 CC1CCCO1 MCULE-2526138687 [1,0,0,1,0,0|0,0,2]=4 4525 B6R1.2 CC1CCCS1 MCULE-8372499972 [1,0,0,1,0,0|0,1,1]=4 4526 B6R1.2 CN1CCCC1 MCULE-5387702231 [1,0,0,1,0,0|2,0,0]=4 4527 B6R1.2 C[C@@H]1CCCN1 MCULE-1038329474 [1,0,0,1,0,0|1,0,1]=4 4528 B6R1.2 C[C@@H]1CCCN1 MCULE-1829999308 [1,0,0,1,0,0|1,0,1]=4 4529 B6R1.2 C[C@@H]1CCCN1 MCULE-8644278041 [1,0,0,1,0,0|1,0,1]=4 4530 B6R1.2 C[C@@H]1CCCN1 MCULE-9243990647 [1,0,0,1,0,0|1,0,1]=4 4531 B6R1.2 C[C@H]1CCCN1 MCULE-2078024663 [1,0,0,1,0,0|1,0,1]=4 4532 B6R1.2 C[C@H]1CCCN1 MCULE-3113877345 [1,0,0,1,0,0|1,0,1]=4 4533 B6R1.2 C[C@H]1CCCN1 MCULE-3426869473 [1,0,0,1,0,0|1,0,1]=4 4534 B6R1.2 C[C@H]1CCCN1 MCULE-5093266679 [1,0,0,1,0,0|1,0,1]=4 4535 B6R1.2 C[S+]1CCCC1 MCULE-6294888335 [1,0,0,1,0,0|2,0,0]=4 4536 B6R1.2 C[S+]1CCCC1 MCULE-8432227262 [1,0,0,1,0,0|2,0,0]=4 4537 B6R1.2 ClC1=CCCC1 MCULE-7680993065 [1,0,0,1,0,0|1,0,1]=4 4538 B6R1.2 ClC1CCCC1 MCULE-3285928655 [1,0,0,1,0,0|1,0,1]=4 4539 B6R1.2 FC1CCCC1 MCULE-1416016970 [1,0,0,1,0,0|1,0,1]=4 4540 B6R1.2 IC1=CCCC1 MCULE-5953451970 [1,0,0,1,0,0|1,0,1]=4 4541 B6R1.2 IC1CCCC1 MCULE-2705379744 [1,0,0,1,0,0|1,0,1]=4 4542 B6R1.2 N=C1CCCS1 MCULE-4228855265 [1,0,0,1,0,0|1,1,0]=4 4543 B6R1.2 N=C1CCCS1 MCULE-7496124035 [1,0,0,1,0,0|1,1,0]=4 4544 B6R1.2 NC1=NCCC1 MCULE-6089369366 [1,0,0,1,0,0|2,0,0]=4 4545 B6R1.2 NC1=NCCC1 MCULE-8979618464 [1,0,0,1,0,0|2,0,0]=4 4546 B6R1.2 NC1=NCCO1 MCULE-1257431295 [1,0,0,1,0,0|2,0,0]=4 4547 B6R1.2 NC1=NCCO1 MCULE-9912511107 [1,0,0,1,0,0|2,0,0]=4 4548 B6R1.2 NC1CCCC1 MCULE-2292038009 [1,0,0,1,0,0|1,0,1]=4 4549 B6R1.2 NN1CCCC1 MCULE-1562593919 [1,0,0,1,0,0|2,0,0]=4 4550 B6R1.2 NN1CCCC1 MCULE-2311855036 [1,0,0,1,0,0|2,0,0]=4 4551 B6R1.2 NN1CCCC1 MCULE-5484008222 [1,0,0,1,0,0|2,0,0]=4 4552 B6R1.2 O=C1C=CCC1 MCULE-1844779047 [1,0,0,1,0,0|0,0,2]=4 4553 B6R1.2 O=C1C=CCO1 MCULE-4296503663 [1,0,0,1,0,0|0,0,2]=4 4554 B6R1.2 O=C1CC=CC1 MCULE-7606670114 [1,0,0,1,0,0|0,0,2]=4 4555 B6R1.2 O=C1CCCC1 MCULE-9455227735 [1,0,0,1,0,0|0,0,0]=2 4556 B6R1.2 O=C1CCCN1 MCULE-3061780794 [1,0,0,1,0,0|1,0,0]=3 4557 B6R1.2 O=C1CCCO1 MCULE-6795890265 [1,0,0,1,0,0|0,0,0]=2 4558 B6R1.2 O=C1CCCS1 MCULE-5361654550 [1,0,0,1,0,0|0,1,0]=3 4559 B6R1.2 O=C1CCNC1 MCULE-2947789259 [1,0,0,1,0,0|1,0,0]=3 4560 B6R1.2 O=C1CCNC1 MCULE-7192595052 [1,0,0,1,0,0|1,0,0]=3 4561 B6R1.2 O=C1CCNN1 MCULE-7030953666 [1,0,0,1,0,0|2,0,0]=4 4562 B6R1.2 O=C1CCOC1 MCULE-2031733910 [1,0,0,1,0,0|1,0,0]=3 4563 B6R1.2 O=C1CCON1 MCULE-6799359324 [1,0,0,1,0,0|2,0,0]=4 4564 B6R1.2 O=C1CCSC1 MCULE-2059655624 [1,0,0,1,0,0|1,0,0]=3 4565 B6R1.2 O=C1CC[NH2+]N1 MCULE-5327505055 [1,0,0,1,0,0|2,0,0]=4 4566 B6R1.2 O=C1CNCN1 MCULE-2645891847 [1,0,0,1,0,0|2,0,0]=4 4567 B6R1.2 O=C1CNCN1 MCULE-9269137129 [1,0,0,1,0,0|2,0,0]=4 4568 B6R1.2 O=C1CSCN1 MCULE-3946660854 [1,0,0,1,0,0|2,0,0]=4 4569 B6R1.2 O=C1NCCN1 MCULE-9806791551 [1,0,0,1,0,0|2,0,0]=4 4570 B6R1.2 O=C1NCCO1 MCULE-3934923008 [1,0,0,1,0,0|1,0,0]=3 4571 B6R1.2 O=C1NCCS1 MCULE-6732478086 [1,0,0,1,0,0|1,1,0]=4 4572 B6R1.2 O=C1OCCO1 MCULE-9493253045 [1,0,0,1,0,0|1,0,0]=3 4573 B6R1.2 O=S1CCCC1 MCULE-2442126780 [1,0,0,1,0,0|1,0,0]=3 4574 B6R1.2 O=S1OCCO1 MCULE-5773173321 [1,0,0,1,0,0|2,0,0]=4 4575 B6R1.2 OC1CCCC1 MCULE-1758440264 [1,0,0,1,0,0|0,0,2]=4 4576 B6R1.2 OC1CCCN1 MCULE-4787168972 [1,0,0,1,0,0|1,0,1]=4 4577 B6R1.2 OC1CCCO1 MCULE-9632627344 [1,0,0,1,0,0|0,0,2]=4 4578 B6R1.2 P1(=O)OCCO1 MCULE-3753821837 [1,0,0,1,0,0|2,0,0]=4 4579 B6R1.2 S=C1CCCN1 MCULE-1089290822 [1,0,0,1,0,0|1,1,0]=4 4580 B6R1.2 SC1=NCCO1 MCULE-6684545723 [1,0,0,1,0,0|1,1,0]=4 4581 B6R1.2 SC1CCCC1 MCULE-5932400506 [1,0,0,1,0,0|0,1,1]=4 4582 B6R1.3 CCCC1CO1 MCULE-5080039224 [1,0,0,1,0,0|0,0,2]=4 4583 B6R1.3 CCC[C@@H]1CO1 MCULE-1815222100 [1,0,0,1,0,0|0,0,2]=4 4584 B6R1.3 CCC[C@H]1CO1 MCULE-9952368131 [1,0,0,1,0,0|0,0,2]=4 4585 B6R1.5 C=C1CC(=O)O1 MCULE-7149487095 [1,0,0,1,0,0|0,0,2]=4 4586 B6R1.5 C=C1CC(C1)N MCULE-4635717695 [1,0,0,1,0,0|2,0,0]=4 4587 B6R1.5 C=C1CC(C1)N MCULE-6992894696 [1,0,0,1,0,0|2,0,0]=4 4588 B6R1.5 CC1CC(=O)C1 MCULE-2159393653 [1,0,0,1,0,0|0,0,0]=2 4589 B6R1.5 CC1CC(=O)N1 MCULE-6139592633 [1,0,0,1,0,0|1,0,0]=3 4590 B6R1.5 CC1CC(=O)O1 MCULE-9285847382 [1,0,0,1,0,0|0,0,0]=2 4591 B6R1.5 CC1CC(C1)N MCULE-5323299846 [1,0,0,1,0,0|1,0,1]=4 4592 B6R1.5 CC1CC(C1)N MCULE-9940885824 [1,0,0,1,0,0|1,0,1]=4 4593 B6R1.5 CC1CC(C1)O MCULE-8612661286 [1,0,0,1,0,0|0,0,2]=4 4594 B6R1.5 CC1CC(N1)C MCULE-2112479012 [1,0,0,1,0,0|1,0,1]=4 4595 B6R1.5 CC1CC(N1)C MCULE-4224653730 [1,0,0,1,0,0|1,0,1]=4 4596 B6R1.5 CN1CC(=O)C1 MCULE-1685267969 [1,0,0,1,0,0|1,0,0]=3 4597 B6R1.5 CN1CC(=O)C1 MCULE-2242594777 [1,0,0,1,0,0|1,0,0]=3 4598 B6R1.5 C[C@@H]1CC(=O)O1 MCULE-3257475519 [1,0,0,1,0,0|0,0,0]=2 4599 B6R1.5 C[C@@H]1C[C@H](N1)C MCULE-1994890312 [1,0,0,1,0,0|1,0,1]=4 4600 B6R1.5 C[C@@H]1C[C@H](N1)C MCULE-7235151096 [1,0,0,1,0,0|1,0,1]=4 4601 B6R1.5 C[C@H]1C[C@@H](C1)N MCULE-1535311916 [1,0,0,1,0,0|1,0,1]=4 4602 B6R1.5 C[C@H]1C[C@@H](C1)N MCULE-2831484375 [1,0,0,1,0,0|1,0,1]=4 4603 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-4062075526 [1,0,0,1,0,0|1,0,1]=4 4604 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-8779826872 [1,0,0,1,0,0|1,0,1]=4 4605 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-9842353775 [1,0,0,1,0,0|1,0,1]=4 4606 B6R1.5 C[C@H]1C[C@@H](N1)C MCULE-9945333960 [1,0,0,1,0,0|1,0,1]=4 4607 B6R1.5 C[C@H]1C[C@H](C1)N MCULE-7323273959 [1,0,0,1,0,0|1,0,1]=4 4608 B6R1.5 C[C@H]1C[C@H](C1)N MCULE-9517005721 [1,0,0,1,0,0|1,0,1]=4 4609 B6R1.5 C[C@H]1C[C@H](C1)O MCULE-9757332081 [1,0,0,1,0,0|0,0,2]=4 4610 B6R1.5 C[C@H]1C[C@H](N1)C MCULE-1014047015 [1,0,0,1,0,0|1,0,1]=4 4611 B6R1.5 C[C@H]1C[C@H](N1)C MCULE-9280852387 [1,0,0,1,0,0|1,0,1]=4 4612 B6R1.5 NC1CC(=O)C1 MCULE-3450860282 [1,0,0,1,0,0|1,0,0]=3 4613 B6R1.5 NC1CC(=O)C1 MCULE-5974961836 [1,0,0,1,0,0|1,0,0]=3 4614 B6R1.5 O=C1CC(C1)Br MCULE-1715982282 [1,0,0,1,0,0|1,0,0]=3 4615 B6R1.5 O=C1CC(C1)F MCULE-2541516698 [1,0,0,1,0,0|1,0,0]=3 4616 B6R1.5 O=C1CC(C1)O MCULE-7099112258 [1,0,0,1,0,0|1,0,0]=3 4617 B6R1.8 C=C1CC1CO MCULE-4338601055 [1,0,0,1,0,0|2,0,0]=4 4618 B6R1.8 CCC1CC1N MCULE-6304873051 [1,0,0,1,0,0|1,0,1]=4 4619 B6R1.8 CC[C@@H]1C[C@@H]1N MCULE-9218626187 [1,0,0,1,0,0|1,0,1]=4 4620 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-5365117215 [1,0,0,1,0,0|1,0,1]=4 4621 B6R1.8 CC[C@@H]1C[C@H]1N MCULE-9993971387 [1,0,0,1,0,0|1,0,1]=4 4622 B6R1.8 CC[C@H]1C[C@@H]1N MCULE-5971477946 [1,0,0,1,0,0|1,0,1]=4 4623 B6R1.8 CC[C@H]1C[C@H]1N MCULE-4387456908 [1,0,0,1,0,0|1,0,1]=4 4624 B6R1.9 CC1CC1(C)N MCULE-2748884505 [1,0,0,1,0,0|1,0,1]=4 4625 B6R1.9 CC1CC1(C)N MCULE-6309103404 [1,0,0,1,0,0|1,0,1]=4 4626 B6R1.10 CC1(CCC1)N MCULE-1932351179 [1,0,0,1,0,0|1,0,1]=4 4627 B6R1.10 CC1(CCC1)N MCULE-9177696302 [1,0,0,1,0,0|1,0,1]=4 4628 B6R1.10 CC1(CCC1)O MCULE-4021675717 [1,0,0,1,0,0|0,0,2]=4 4629 B6R1.10 C[Si]1(CCC1)C MCULE-9944003023 [1,0,0,1,0,0|1,1,0]=4 4630 B6R1.10 C[Si]1(CCC1)Cl MCULE-2261277636 [1,0,0,1,0,0|1,1,0]=4 4631 B6R1.10 N=S1(=O)CCC1 MCULE-7690864417 [1,0,0,1,0,0|2,0,0]=4 4632 B6R1.10 O=S1(=O)CCC1 MCULE-7796411172 [1,0,0,1,0,0|1,0,1]=4 4633 B6R1.11 C=C(C)C1CO1 MCULE-3656533343 [1,0,0,1,0,0|2,0,0]=4 4634 B6R1.11 CC(=O)C1CC1 MCULE-3846146416 [1,0,0,1,0,0|0,0,0]=2 4635 B6R1.11 CC(=O)C1CO1 MCULE-4329154079 [1,0,0,1,0,0|1,0,0]=3 4636 B6R1.11 CC(Cl)C1CC1 MCULE-7361335709 [1,0,0,1,0,0|1,0,1]=4 4637 B6R1.11 CC(N)C1CC1 MCULE-2052303800 [1,0,0,1,0,0|1,0,1]=4 4638 B6R1.11 CC(N)C1CC1 MCULE-3007763115 [1,0,0,1,0,0|1,0,1]=4 4639 B6R1.11 CC(N)C1CC1 MCULE-3459276996 [1,0,0,1,0,0|1,0,1]=4 4640 B6R1.11 CC(N)C1CC1 MCULE-6761961556 [1,0,0,1,0,0|1,0,1]=4 4641 B6R1.11 CC(O)C1CC1 MCULE-8628810684 [1,0,0,1,0,0|0,0,2]=4 4642 B6R1.11 CN(C)C1CC1 MCULE-5891640069 [1,0,0,1,0,0|2,0,0]=4 4643 B6R1.11 CN(C)C1CC1 MCULE-6751529979 [1,0,0,1,0,0|2,0,0]=4 4644 B6R1.11 CN(N)C1CC1 MCULE-4590166937 [1,0,0,1,0,0|2,0,0]=4 4645 B6R1.11 CN(N)C1CC1 MCULE-7317282450 [1,0,0,1,0,0|2,0,0]=4 4646 B6R1.11 C[C@@H](N)C1CC1 MCULE-2097889079 [1,0,0,1,0,0|1,0,1]=4 4647 B6R1.11 C[C@@H](N)C1CC1 MCULE-3667125695 [1,0,0,1,0,0|1,0,1]=4 4648 B6R1.11 C[C@@H](N)C1CC1 MCULE-4529741221 [1,0,0,1,0,0|1,0,1]=4 4649 B6R1.11 C[C@@H](N)C1CC1 MCULE-4996656085 [1,0,0,1,0,0|1,0,1]=4 4650 B6R1.11 C[C@@H](O)C1CC1 MCULE-8359847821 [1,0,0,1,0,0|0,0,2]=4 4651 B6R1.11 C[C@H](N)C1CC1 MCULE-5080052640 [1,0,0,1,0,0|1,0,1]=4 4652 B6R1.11 C[C@H](N)C1CC1 MCULE-8331040870 [1,0,0,1,0,0|1,0,1]=4 4653 B6R1.11 C[C@H](N)C1CC1 MCULE-8367240790 [1,0,0,1,0,0|1,0,1]=4 4654 B6R1.11 C[C@H](N)C1CC1 MCULE-8726268701 [1,0,0,1,0,0|1,0,1]=4 4655 B6R1.11 C[C@H](O)C1CC1 MCULE-2458075152 [1,0,0,1,0,0|0,0,2]=4 4656 B6R1.11 N=C(N)C1CC1 MCULE-1244673727 [1,0,0,1,0,0|2,0,0]=4 4657 B6R1.11 N=C(N)C1CC1 MCULE-2494860413 [1,0,0,1,0,0|2,0,0]=4 4658 B6R1.11 NC(=O)C1CC1 MCULE-9911054913 [1,0,0,1,0,0|1,0,0]=3 4659 B6R1.11 NC(=O)C1CO1 MCULE-6911744868 [1,0,0,1,0,0|2,0,0]=4 4660 B6R1.11 NC(=S)C1CC1 MCULE-7304936539 [1,0,0,1,0,0|1,1,0]=4 4661 B6R1.11 O=C(Cl)C1CC1 MCULE-8675746452 [1,0,0,1,0,0|1,0,0]=3 4662 B6R1.11 O=C(O)C1CC1 MCULE-4677373694 [1,0,0,1,0,0|0,0,0]=2 4663 B6R1.11 O=C(O)C1CN1 MCULE-3236125597 [1,0,0,1,0,0|1,0,0]=3 4664 B6R1.11 O=C(O)C1CO1 MCULE-2152916793 [1,0,0,1,0,0|1,0,0]=3 4665 B6R1.11 O=C(O)[C@@H]1CN1 MCULE-4363753412 [1,0,0,1,0,0|1,0,0]=3 4666 B6R1.11 O=C(O)[C@H]1CN1 MCULE-4830347195 [1,0,0,1,0,0|1,0,0]=3 4667 B6R1.11 O=C(O)[C@H]1CO1 MCULE-5204459723 [1,0,0,1,0,0|1,0,0]=3 4668 B6R1.11 O=C(O)[C@H]1CO1 MCULE-6983707093 [1,0,0,1,0,0|1,0,0]=3 4669 B6R1.11 O=C([O-])C1CN1 MCULE-6490437892 [1,0,0,1,0,0|1,0,1]=4 4670 B6R1.11 O=C([O-])C1CO1 MCULE-4586459966 [1,0,0,1,0,0|1,0,1]=4 4671 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1647975669 [1,0,0,1,0,0|1,0,1]=4 4672 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-1906997950 [1,0,0,1,0,0|1,0,1]=4 4673 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-4899800766 [1,0,0,1,0,0|1,0,1]=4 4674 B6R1.11 O=C([O-])[C@@H]1CO1 MCULE-9148170094 [1,0,0,1,0,0|1,0,1]=4 4675 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-6663734494 [1,0,0,1,0,0|1,0,1]=4 4676 B6R1.11 O=C([O-])[C@H]1CO1 MCULE-8580451361 [1,0,0,1,0,0|1,0,1]=4 4677 B6R1.11 O=S(O)C1CC1 MCULE-1616243918 [1,0,0,1,0,0|1,0,0]=3 4678 B6R1.11 O=S([O-])C1CC1 MCULE-9446364072 [1,0,0,1,0,0|1,0,1]=4 4679 B6R1.11 OB(O)C1CC1 MCULE-5364427631 [1,0,0,1,0,0|1,0,1]=4 4680 B6R1.1 C1=CCCCC1 MCULE-3564016252 [1,0,0,1,0,0|1,0,0]=3 4681 B6R1.1 C1=CCNCC1 MCULE-4850984502 [1,0,0,1,0,0|2,0,0]=4 4682 B6R1.1 C1=CCNCC1 MCULE-9744767398 [1,0,0,1,0,0|2,0,0]=4 4683 B6R1.1 C1=CCOCC1 MCULE-7723901693 [1,0,0,1,0,0|2,0,0]=4 4684 B6R1.1 C1=COCCC1 MCULE-1260841717 [1,0,0,1,0,0|0,0,1]=3 4685 B6R1.1 C1=COCCO1 MCULE-2562788031 [1,0,0,1,0,0|1,0,1]=4 4686 B6R1.1 C1=COCOC1 MCULE-9916358884 [1,0,0,1,0,0|1,0,1]=4 4687 B6R1.1 C1=NCCCC1 MCULE-7101012273 [1,0,0,1,0,0|1,0,0]=3 4688 B6R1.1 C1=NCCCN1 MCULE-8199642953 [1,0,0,1,0,0|2,0,0]=4 4689 B6R1.1 C1CCCCC1 MCULE-3136361765 [1,0,0,1,0,0|1,0,1]=4 4690 B6R1.1 C1CCNCC1 MCULE-4094049864 [1,0,0,1,0,0|1,0,1]=4 4691 B6R1.1 C1CCNNC1 MCULE-6440414301 [1,0,0,1,0,0|2,0,0]=4 4692 B6R1.1 C1CCNNC1 MCULE-6764314654 [1,0,0,1,0,0|2,0,0]=4 4693 B6R1.1 C1CCOCC1 MCULE-6904583049 [1,0,0,1,0,0|0,0,1]=3 4694 B6R1.1 C1CCONC1 MCULE-4106728300 [1,0,0,1,0,0|1,0,0]=3 4695 B6R1.1 C1CCONC1 MCULE-7653057344 [1,0,0,1,0,0|1,0,0]=3 4696 B6R1.1 C1CCSCC1 MCULE-5775966946 [1,0,0,1,0,0|0,1,1]=4 4697 B6R1.1 C1CNCOC1 MCULE-7862832103 [1,0,0,1,0,0|1,0,1]=4 4698 B6R1.1 C1COCCN1 MCULE-2533030492 [1,0,0,1,0,0|1,0,1]=4 4699 B6R1.1 C1COCCN1 MCULE-4684386765 [1,0,0,1,0,0|1,0,1]=4 4700 B6R1.1 C1COCCN1 MCULE-8040983584 [1,0,0,1,0,0|1,0,1]=4 4701 B6R1.1 C1COCCO1 MCULE-5088019198 [1,0,0,1,0,0|1,0,1]=4 4702 B6R1.1 C1COCC[NH2+]1 MCULE-5238323153 [1,0,0,1,0,0|1,0,1]=4 4703 B6R1.1 C1COCOC1 MCULE-3698539550 [1,0,0,1,0,0|1,0,1]=4 4704 B6R1.1 C1CSCCO1 MCULE-5803800470 [1,0,0,1,0,0|1,0,1]=4 4705 B6R1.4 CC1CNC1C MCULE-6217110869 [1,0,0,1,0,0|2,0,0]=4 4706 B6R1.4 CC1CNC1C MCULE-8966220604 [1,0,0,1,0,0|2,0,0]=4 4707 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-5099590573 [1,0,0,1,0,0|2,0,0]=4 4708 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-6754257002 [1,0,0,1,0,0|2,0,0]=4 4709 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-7084262632 [1,0,0,1,0,0|2,0,0]=4 4710 B6R1.4 C[C@@H]1CN[C@@H]1C MCULE-9147724667 [1,0,0,1,0,0|2,0,0]=4 4711 B6R1.6 BrCC1COC1 MCULE-3267235863 [1,0,0,1,0,0|1,0,1]=4 4712 B6R1.6 CCC1CCN1 MCULE-2791335818 [1,0,0,1,0,0|2,0,0]=4 4713 B6R1.6 CCC1CCN1 MCULE-3929810240 [1,0,0,1,0,0|2,0,0]=4 4714 B6R1.6 CCC1CNC1 MCULE-5314495230 [1,0,0,1,0,0|1,0,1]=4 4715 B6R1.6 CCC1CNC1 MCULE-6675770601 [1,0,0,1,0,0|1,0,1]=4 4716 B6R1.6 CNC1CCC1 MCULE-1364608179 [1,0,0,1,0,0|1,0,1]=4 4717 B6R1.6 CNC1CCC1 MCULE-2951993315 [1,0,0,1,0,0|1,0,1]=4 4718 B6R1.6 CNC1COC1 MCULE-2040978636 [1,0,0,1,0,0|1,0,1]=4 4719 B6R1.6 CNC1COC1 MCULE-3130259264 [1,0,0,1,0,0|1,0,1]=4 4720 B6R1.6 CNC1COC1 MCULE-4618612030 [1,0,0,1,0,0|1,0,1]=4 4721 B6R1.6 COC1CNC1 MCULE-1522685592 [1,0,0,1,0,0|1,0,1]=4 4722 B6R1.6 COC1CNC1 MCULE-4835486151 [1,0,0,1,0,0|1,0,1]=4 4723 B6R1.6 ClCC1COC1 MCULE-1144637548 [1,0,0,1,0,0|1,0,1]=4 4724 B6R1.6 ICC1COC1 MCULE-6325029437 [1,0,0,1,0,0|1,0,1]=4 4725 B6R1.6 NCC1COC1 MCULE-4685637013 [1,0,0,1,0,0|1,0,1]=4 4726 B6R1.6 NCC1COC1 MCULE-6896653344 [1,0,0,1,0,0|1,0,1]=4 4727 B6R1.6 NOC1CCC1 MCULE-2140396646 [1,0,0,1,0,0|1,0,1]=4 4728 B6R1.6 NOC1CCC1 MCULE-9347173321 [1,0,0,1,0,0|1,0,1]=4 4729 B6R1.6 OCC1COC1 MCULE-5031415478 [1,0,0,1,0,0|1,0,1]=4 4730 B6R1.6 ON=C1CCC1 MCULE-4777625640 [1,0,0,1,0,0|2,0,0]=4 4731 B6R1.6 SCC1COC1 MCULE-7193197469 [1,0,0,1,0,0|1,0,1]=4 4732 B6R1.7 CCC1(CO1)C MCULE-5308881519 [1,0,0,1,0,0|1,0,1]=4 4733 B8R1.1 C#CC1COC(=O)N1 MCULE-7019791209 [0,1,0,1,0,0|0,0,2]=4 4734 B8R1.1 C#C[C@@H]1COC(=O)N1 MCULE-3103635703 [0,1,0,1,0,0|0,0,2]=4 4735 B8R1.1 C#C[C@@H]1COC(=O)N1 MCULE-7796064143 [0,1,0,1,0,0|0,0,2]=4 4736 B8R1.1 C#C[C@H]1COC(=O)N1 MCULE-4375742729 [0,1,0,1,0,0|0,0,2]=4 4737 B8R1.1 C#C[C@H]1COC(=O)N1 MCULE-5542662617 [0,1,0,1,0,0|0,0,2]=4 4738 B8R1.1 C1(CCC(=O)N1)CBr MCULE-4451864575 [0,1,0,1,0,0|2,0,0]=4 4739 B8R1.1 C1(CCC(=O)N1)CN MCULE-3169700074 [0,1,0,1,0,0|2,0,0]=4 4740 B8R1.1 C1(CCC(=O)N1)CO MCULE-8513534447 [0,1,0,1,0,0|2,0,0]=4 4741 B8R1.1 C1(CNC(=O)C1)CN MCULE-6663370335 [0,1,0,1,0,0|1,0,0]=3 4742 B8R1.1 C1(CNC(=O)C1)CN MCULE-8237162259 [0,1,0,1,0,0|1,0,0]=3 4743 B8R1.1 C1(CNC(=O)O1)CO MCULE-2451079587 [0,1,0,1,0,0|2,0,0]=4 4744 B8R1.1 C=CC1COC(=O)C1 MCULE-5888906344 [0,1,0,1,0,0|0,0,1]=3 4745 B8R1.1 C=CC1COC(=O)C1 MCULE-8602073759 [0,1,0,1,0,0|0,0,1]=3 4746 B8R1.1 C=CC1COC(=O)O1 MCULE-3470962220 [0,1,0,1,0,0|0,0,2]=4 4747 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-1274088394 [0,1,0,1,0,0|0,0,1]=3 4748 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-3162707973 [0,1,0,1,0,0|0,0,1]=3 4749 B8R1.1 C=C[C@@H]1COC(=O)N1 MCULE-1532767336 [0,1,0,1,0,0|0,0,2]=4 4750 B8R1.1 C=C[C@@H]1COC(=O)N1 MCULE-3932839401 [0,1,0,1,0,0|0,0,2]=4 4751 B8R1.1 C=C[C@H]1COC(=O)N1 MCULE-3492854139 [0,1,0,1,0,0|0,0,2]=4 4752 B8R1.1 C=C[C@H]1COC(=O)N1 MCULE-9796474747 [0,1,0,1,0,0|0,0,2]=4 4753 B8R1.1 CC1=NC(CO1)CBr MCULE-4046707435 [0,1,0,1,0,0|2,0,0]=4 4754 B8R1.1 CC1CCC(C1)C=O MCULE-9381232427 [0,1,0,1,0,0|1,0,1]=4 4755 B8R1.1 CC1COC(C1)CO MCULE-4511313299 [0,1,0,1,0,0|0,0,2]=4 4756 B8R1.1 CCC1=CC(=O)CC1 MCULE-6681801286 [0,1,0,1,0,0|1,0,1]=4 4757 B8R1.1 CCC1=NC(CN1)C MCULE-6333019212 [0,1,0,1,0,0|2,0,0]=4 4758 B8R1.1 CCC1=NNC(=O)C1 MCULE-8387854697 [0,1,0,1,0,0|2,0,0]=4 4759 B8R1.1 CCC1C=CC(=O)O1 MCULE-8058927851 [0,1,0,1,0,0|1,0,1]=4 4760 B8R1.1 CCC1CC(=O)CO1 MCULE-7105024194 [0,1,0,1,0,0|2,0,0]=4 4761 B8R1.1 CCC1CCC(=O)C1 MCULE-8455504217 [0,1,0,1,0,0|1,0,0]=3 4762 B8R1.1 CCC1CCC(=O)N1 MCULE-6150249637 [0,1,0,1,0,0|1,0,0]=3 4763 B8R1.1 CCC1CCC(=O)O1 MCULE-5161861312 [0,1,0,1,0,0|1,0,0]=3 4764 B8R1.1 CCC1CNC(=O)C1 MCULE-1800672545 [0,1,0,1,0,0|1,0,0]=3 4765 B8R1.1 CCC1CNC(=O)O1 MCULE-9388725409 [0,1,0,1,0,0|1,0,0]=3 4766 B8R1.1 CCC1COC(=N1)C MCULE-1406641220 [0,1,0,1,0,0|1,0,0]=3 4767 B8R1.1 CCC1COC(=O)C1 MCULE-1996435734 [0,1,0,1,0,0|0,0,0]=2 4768 B8R1.1 CCC1COC(=O)N1 MCULE-4345668230 [0,1,0,1,0,0|0,0,0]=2 4769 B8R1.1 CCC1COC(=O)O1 MCULE-5743084846 [0,1,0,1,0,0|0,0,0]=2 4770 B8R1.1 CCC1CSC(=N1)C MCULE-4393928745 [0,1,0,1,0,0|1,1,0]=4 4771 B8R1.1 CCN1CCC(=O)C1 MCULE-5806094458 [0,1,0,1,0,0|1,0,0]=3 4772 B8R1.1 CC[C@@H]1CCC(=O)C1 MCULE-7687801028 [0,1,0,1,0,0|1,0,0]=3 4773 B8R1.1 CC[C@@H]1CCC(=O)O1 MCULE-9831904901 [0,1,0,1,0,0|1,0,0]=3 4774 B8R1.1 CC[C@H]1CCC(=O)C1 MCULE-6479003670 [0,1,0,1,0,0|1,0,0]=3 4775 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-2443615902 [0,1,0,1,0,0|0,0,0]=2 4776 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-9191549724 [0,1,0,1,0,0|0,0,0]=2 4777 B8R1.1 CNC1=NCC(S1)C MCULE-2475573763 [0,1,0,1,0,0|1,1,0]=4 4778 B8R1.1 CNC1CNC(=O)C1 MCULE-1673491824 [0,1,0,1,0,0|1,0,0]=3 4779 B8R1.1 CN[C@H]1CNC(=O)C1 MCULE-7859463391 [0,1,0,1,0,0|1,0,0]=3 4780 B8R1.1 COC1=CC(=O)CC1 MCULE-7963656232 [0,1,0,1,0,0|1,0,1]=4 4781 B8R1.1 COC1=CC(=O)OC1 MCULE-9199919492 [0,1,0,1,0,0|0,0,2]=4 4782 B8R1.1 COC1C=CC(=O)C1 MCULE-3904672515 [0,1,0,1,0,0|1,0,1]=4 4783 B8R1.1 COC1CCC(=O)C1 MCULE-3259977239 [0,1,0,1,0,0|1,0,0]=3 4784 B8R1.1 COC1CCC(=O)N1 MCULE-9661875090 [0,1,0,1,0,0|2,0,0]=4 4785 B8R1.1 COC1CCC(C1)Br MCULE-2042021360 [0,1,0,1,0,0|1,0,1]=4 4786 B8R1.1 COC1CCC(C1)N MCULE-4717179971 [0,1,0,1,0,0|1,0,1]=4 4787 B8R1.1 COC1CCC(C1)N MCULE-6288105544 [0,1,0,1,0,0|1,0,1]=4 4788 B8R1.1 COC1CCC(C1)O MCULE-3531007988 [0,1,0,1,0,0|1,0,1]=4 4789 B8R1.1 COC1CNC(=O)C1 MCULE-2023546447 [0,1,0,1,0,0|1,0,0]=3 4790 B8R1.1 CO[C@@H]1CC[C@@H](C1)N MCULE-2875608408 [0,1,0,1,0,0|1,0,1]=4 4791 B8R1.1 CO[C@@H]1CC[C@@H](C1)N MCULE-8416754512 [0,1,0,1,0,0|1,0,1]=4 4792 B8R1.1 CO[C@@H]1CC[C@@H](C1)O MCULE-5232016028 [0,1,0,1,0,0|1,0,1]=4 4793 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-1888407079 [0,1,0,1,0,0|1,0,1]=4 4794 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-2445501949 [0,1,0,1,0,0|1,0,1]=4 4795 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-6019984409 [0,1,0,1,0,0|1,0,1]=4 4796 B8R1.1 CO[C@@H]1CC[C@H](C1)N MCULE-6778321044 [0,1,0,1,0,0|1,0,1]=4 4797 B8R1.1 CO[C@H]1CCN(C1)C MCULE-3202078388 [0,1,0,1,0,0|1,0,1]=4 4798 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-1126971030 [0,1,0,1,0,0|1,0,1]=4 4799 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-2897044722 [0,1,0,1,0,0|1,0,1]=4 4800 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-5627949204 [0,1,0,1,0,0|1,0,1]=4 4801 B8R1.1 CO[C@H]1CC[C@@H](C1)N MCULE-8060845967 [0,1,0,1,0,0|1,0,1]=4 4802 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-1601734575 [0,1,0,1,0,0|1,0,1]=4 4803 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-1920912186 [0,1,0,1,0,0|1,0,1]=4 4804 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-3006479304 [0,1,0,1,0,0|1,0,1]=4 4805 B8R1.1 CO[C@H]1CC[C@H](C1)N MCULE-4560375617 [0,1,0,1,0,0|1,0,1]=4 4806 B8R1.1 CSC1=NC(CN1)C MCULE-5363773569 [0,1,0,1,0,0|1,1,0]=4 4807 B8R1.1 CSC1=NC(CN1)C MCULE-7884427745 [0,1,0,1,0,0|1,1,0]=4 4808 B8R1.1 CSC1=NC(CS1)C MCULE-7229347458 [0,1,0,1,0,0|1,1,0]=4 4809 B8R1.1 N#CC1CCC(=O)C1 MCULE-3783981366 [0,1,0,1,0,0|1,0,1]=4 4810 B8R1.1 N#CC1CNC(=O)C1 MCULE-7040868747 [0,1,0,1,0,0|1,0,1]=4 4811 B8R1.1 N#CC1COC(=O)O1 MCULE-7635108167 [0,1,0,1,0,0|1,0,1]=4 4812 B8R1.1 N#C[C@@H]1CCC(=O)C1 MCULE-1506687355 [0,1,0,1,0,0|1,0,1]=4 4813 B8R1.1 N#C[C@H]1CCC(=O)C1 MCULE-3791390646 [0,1,0,1,0,0|1,0,1]=4 4814 B8R1.1 NCC1CCC(=O)N1 MCULE-2195138544 [0,1,0,1,0,0|2,0,0]=4 4815 B8R1.1 NCC1CCC(=O)N1 MCULE-5064964559 [0,1,0,1,0,0|2,0,0]=4 4816 B8R1.1 NCC1CCC(=O)N1 MCULE-9686422256 [0,1,0,1,0,0|2,0,0]=4 4817 B8R1.1 NCC1CCC(=O)N1 MCULE-9973113927 [0,1,0,1,0,0|2,0,0]=4 4818 B8R1.1 NCC1CCC(=O)O1 MCULE-5413792723 [0,1,0,1,0,0|2,0,0]=4 4819 B8R1.1 NCC1CCC(=O)O1 MCULE-8312895206 [0,1,0,1,0,0|2,0,0]=4 4820 B8R1.1 NCC1CNC(=O)C1 MCULE-2522987651 [0,1,0,1,0,0|1,0,0]=3 4821 B8R1.1 NCC1CNC(=O)C1 MCULE-7249550892 [0,1,0,1,0,0|1,0,0]=3 4822 B8R1.1 NCC1CNC(=O)C1 MCULE-7253893960 [0,1,0,1,0,0|1,0,0]=3 4823 B8R1.1 NCC1CNC(=O)O1 MCULE-3940030823 [0,1,0,1,0,0|2,0,0]=4 4824 B8R1.1 NCC1CNC(=O)O1 MCULE-7671055394 [0,1,0,1,0,0|2,0,0]=4 4825 B8R1.1 NCC1COC(=O)N1 MCULE-8454292565 [0,1,0,1,0,0|1,0,0]=3 4826 B8R1.1 NCC1COC(=O)N1 MCULE-9068275563 [0,1,0,1,0,0|1,0,0]=3 4827 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-5772277021 [0,1,0,1,0,0|2,0,0]=4 4828 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-6147061481 [0,1,0,1,0,0|2,0,0]=4 4829 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-7644508115 [0,1,0,1,0,0|2,0,0]=4 4830 B8R1.1 NC[C@@H]1CCC(=O)N1 MCULE-7782108755 [0,1,0,1,0,0|2,0,0]=4 4831 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-1184474214 [0,1,0,1,0,0|1,0,0]=3 4832 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-2421452869 [0,1,0,1,0,0|1,0,0]=3 4833 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-3903743084 [0,1,0,1,0,0|1,0,0]=3 4834 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-9080425518 [0,1,0,1,0,0|1,0,0]=3 4835 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-1463241001 [0,1,0,1,0,0|2,0,0]=4 4836 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-3217887113 [0,1,0,1,0,0|2,0,0]=4 4837 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-5423398321 [0,1,0,1,0,0|2,0,0]=4 4838 B8R1.1 NC[C@@H]1CNC(=O)O1 MCULE-9322185538 [0,1,0,1,0,0|2,0,0]=4 4839 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-1485902199 [0,1,0,1,0,0|2,0,0]=4 4840 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-1751255260 [0,1,0,1,0,0|2,0,0]=4 4841 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-3641870628 [0,1,0,1,0,0|2,0,0]=4 4842 B8R1.1 NC[C@H]1CCC(=O)N1 MCULE-9839264859 [0,1,0,1,0,0|2,0,0]=4 4843 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-7212975165 [0,1,0,1,0,0|1,0,0]=3 4844 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8203034485 [0,1,0,1,0,0|1,0,0]=3 4845 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8803246698 [0,1,0,1,0,0|1,0,0]=3 4846 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-9580224880 [0,1,0,1,0,0|1,0,0]=3 4847 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-1224919034 [0,1,0,1,0,0|2,0,0]=4 4848 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-6003746665 [0,1,0,1,0,0|2,0,0]=4 4849 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-6937146715 [0,1,0,1,0,0|2,0,0]=4 4850 B8R1.1 NC[C@H]1CNC(=O)O1 MCULE-9419881517 [0,1,0,1,0,0|2,0,0]=4 4851 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-1988909942 [0,1,0,1,0,0|1,0,0]=3 4852 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-9340310155 [0,1,0,1,0,0|1,0,0]=3 4853 B8R1.1 O=C1C=C(CO1)CBr MCULE-1493137482 [0,1,0,1,0,0|0,0,2]=4 4854 B8R1.1 O=C1C=C(CO1)CI MCULE-7834471824 [0,1,0,1,0,0|0,0,2]=4 4855 B8R1.1 O=C1C=C(CO1)CO MCULE-9263407854 [0,1,0,1,0,0|0,0,2]=4 4856 B8R1.1 O=C1CC(CN1)CBr MCULE-1780879209 [0,1,0,1,0,0|1,0,0]=3 4857 B8R1.1 O=C1CC(CN1)CO MCULE-8619053563 [0,1,0,1,0,0|1,0,0]=3 4858 B8R1.1 O=C1CC(CO1)CO MCULE-7403068263 [0,1,0,1,0,0|0,0,0]=2 4859 B8R1.1 O=C1CCC(C1)CF MCULE-9077358027 [0,1,0,1,0,0|1,0,0]=3 4860 B8R1.1 O=C1CCC(C1)CO MCULE-7524267942 [0,1,0,1,0,0|1,0,0]=3 4861 B8R1.1 O=C1CCC(N1)CBr MCULE-7024022934 [0,1,0,1,0,0|2,0,0]=4 4862 B8R1.1 O=C1CCC(N1)CI MCULE-6956070937 [0,1,0,1,0,0|2,0,0]=4 4863 B8R1.1 O=C1CCC(N1)CO MCULE-1498000761 [0,1,0,1,0,0|2,0,0]=4 4864 B8R1.1 O=C1CCC(O1)CBr MCULE-9370722806 [0,1,0,1,0,0|2,0,0]=4 4865 B8R1.1 O=C1CCC(O1)CCl MCULE-3199749385 [0,1,0,1,0,0|2,0,0]=4 4866 B8R1.1 O=C1CCC(O1)CI MCULE-4432096360 [0,1,0,1,0,0|2,0,0]=4 4867 B8R1.1 O=C1CCC(O1)CO MCULE-3178999726 [0,1,0,1,0,0|2,0,0]=4 4868 B8R1.1 O=C1CCC(O1)CO MCULE-4390773734 [0,1,0,1,0,0|2,0,0]=4 4869 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-2590805877 [0,1,0,1,0,0|1,0,0]=3 4870 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-7134607780 [0,1,0,1,0,0|1,0,0]=3 4871 B8R1.1 O=C1CC[C@@H](N1)CBr MCULE-4537645558 [0,1,0,1,0,0|2,0,0]=4 4872 B8R1.1 O=C1CC[C@@H](N1)CBr MCULE-6830001458 [0,1,0,1,0,0|2,0,0]=4 4873 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3021506643 [0,1,0,1,0,0|2,0,0]=4 4874 B8R1.1 O=C1CC[C@@H](N1)CO MCULE-3659077476 [0,1,0,1,0,0|2,0,0]=4 4875 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-1532290348 [0,1,0,1,0,0|2,0,0]=4 4876 B8R1.1 O=C1CC[C@@H](O1)CO MCULE-3600746831 [0,1,0,1,0,0|2,0,0]=4 4877 B8R1.1 O=C1CC[C@H](N1)CBr MCULE-1684731751 [0,1,0,1,0,0|2,0,0]=4 4878 B8R1.1 O=C1CC[C@H](N1)CBr MCULE-4479348379 [0,1,0,1,0,0|2,0,0]=4 4879 B8R1.1 O=C1CC[C@H](N1)CO MCULE-4532009930 [0,1,0,1,0,0|2,0,0]=4 4880 B8R1.1 O=C1CC[C@H](N1)CO MCULE-6466848372 [0,1,0,1,0,0|2,0,0]=4 4881 B8R1.1 O=C1CC[C@H](O1)CO MCULE-1675076625 [0,1,0,1,0,0|2,0,0]=4 4882 B8R1.1 O=C1CC[C@H](O1)CO MCULE-6265569115 [0,1,0,1,0,0|2,0,0]=4 4883 B8R1.1 O=C1C[C@@H](CN1)CO MCULE-5572559100 [0,1,0,1,0,0|1,0,0]=3 4884 B8R1.1 O=C1C[C@H](CN1)CO MCULE-4450345453 [0,1,0,1,0,0|1,0,0]=3 4885 B8R1.1 O=C1NC(CO1)CI MCULE-3725463438 [0,1,0,1,0,0|1,0,0]=3 4886 B8R1.1 O=C1NC(CO1)CI MCULE-8271591026 [0,1,0,1,0,0|1,0,0]=3 4887 B8R1.1 O=C1NC(CO1)CO MCULE-8296379772 [0,1,0,1,0,0|1,0,0]=3 4888 B8R1.1 O=C1NC(CO1)CO MCULE-9797812862 [0,1,0,1,0,0|1,0,0]=3 4889 B8R1.1 O=C1NCC(O1)CBr MCULE-3294572412 [0,1,0,1,0,0|2,0,0]=4 4890 B8R1.1 O=C1NCC(O1)CCl MCULE-6711754093 [0,1,0,1,0,0|2,0,0]=4 4891 B8R1.1 O=C1NCC(O1)CCl MCULE-6847066968 [0,1,0,1,0,0|2,0,0]=4 4892 B8R1.1 O=C1NCC(O1)CO MCULE-8225938772 [0,1,0,1,0,0|2,0,0]=4 4893 B8R1.1 O=C1NCC(S1)CBr MCULE-9963419555 [0,1,0,1,0,0|2,0,0]=4 4894 B8R1.1 O=C1NC[C@@H](O1)CCl MCULE-4606501061 [0,1,0,1,0,0|2,0,0]=4 4895 B8R1.1 O=C1NC[C@@H](O1)CO MCULE-4749906822 [0,1,0,1,0,0|2,0,0]=4 4896 B8R1.1 O=C1NC[C@@H](O1)CO MCULE-7879354917 [0,1,0,1,0,0|2,0,0]=4 4897 B8R1.1 O=C1NC[C@H](O1)CCl MCULE-1912687608 [0,1,0,1,0,0|2,0,0]=4 4898 B8R1.1 O=C1NC[C@H](O1)CO MCULE-2698871687 [0,1,0,1,0,0|2,0,0]=4 4899 B8R1.1 O=C1NC[C@H](O1)CO MCULE-5771560221 [0,1,0,1,0,0|2,0,0]=4 4900 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-2270288938 [0,1,0,1,0,0|1,0,0]=3 4901 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-5533745846 [0,1,0,1,0,0|1,0,0]=3 4902 B8R1.1 O=C1N[C@H](CO1)CI MCULE-5817468950 [0,1,0,1,0,0|1,0,0]=3 4903 B8R1.1 O=C1N[C@H](CO1)CI MCULE-6940377154 [0,1,0,1,0,0|1,0,0]=3 4904 B8R1.1 O=C1N[C@H](CO1)CO MCULE-3186572246 [0,1,0,1,0,0|1,0,0]=3 4905 B8R1.1 O=C1N[C@H](CO1)CO MCULE-4534112642 [0,1,0,1,0,0|1,0,0]=3 4906 B8R1.1 O=C1OCC(O1)CCl MCULE-7212643481 [0,1,0,1,0,0|1,0,0]=3 4907 B8R1.1 O=C1OCC(O1)CF MCULE-2066386250 [0,1,0,1,0,0|1,0,0]=3 4908 B8R1.1 O=C1OCC(O1)CO MCULE-1831262013 [0,1,0,1,0,0|1,0,0]=3 4909 B8R1.1 O=CC1COC(=O)C1 MCULE-7312168752 [0,1,0,1,0,0|0,0,1]=3 4910 B8R1.1 [C@@H]1(COC(=O)C1)C=C MCULE-1356778810 [0,1,0,1,0,0|0,0,1]=3 4911 B8R1.1 [C@H]1(CNC(=O)O1)CCl MCULE-6032247892 [0,1,0,1,0,0|2,0,0]=4 4912 B8R1.4 C1(CC(=O)CCN1)C MCULE-1061296374 [0,1,0,1,0,0|1,0,0]=3 4913 B8R1.4 C1(CC(=O)CCN1)C MCULE-4465075512 [0,1,0,1,0,0|1,0,0]=3 4914 B8R1.4 C1(CC(=O)CCN1)C MCULE-9958407361 [0,1,0,1,0,0|1,0,0]=3 4915 B8R1.4 C1(CNCC(=O)N1)C MCULE-3246707428 [0,1,0,1,0,0|2,0,0]=4 4916 B8R1.4 C=C1CCCC(=O)O1 MCULE-1342678884 [0,1,0,1,0,0|0,0,1]=3 4917 B8R1.4 CC1=CC(=O)CCC1 MCULE-6849313207 [0,1,0,1,0,0|1,0,0]=3 4918 B8R1.4 CC1=CC(=O)OCC1 MCULE-1467184061 [0,1,0,1,0,0|0,0,2]=4 4919 B8R1.4 CC1=CC(CCC1)O MCULE-3389687006 [0,1,0,1,0,0|2,0,0]=4 4920 B8R1.4 CC1=CCCC(=O)C1 MCULE-8078773996 [0,1,0,1,0,0|1,0,1]=4 4921 B8R1.4 CC1=CCCC(=O)O1 MCULE-1590433845 [0,1,0,1,0,0|0,0,1]=3 4922 B8R1.4 CC1CC(=O)CCN1 MCULE-3306158037 [0,1,0,1,0,0|1,0,0]=3 4923 B8R1.4 CC1CC(=O)CCN1 MCULE-4556824309 [0,1,0,1,0,0|1,0,0]=3 4924 B8R1.4 CC1CC(=O)CCN1 MCULE-6103506996 [0,1,0,1,0,0|1,0,0]=3 4925 B8R1.4 CC1CC(=O)CCN1 MCULE-9670943852 [0,1,0,1,0,0|1,0,0]=3 4926 B8R1.4 CC1CC(=O)CCO1 MCULE-3051168755 [0,1,0,1,0,0|1,0,0]=3 4927 B8R1.4 CC1CC(CCO1)N MCULE-6804148880 [0,1,0,1,0,0|1,0,1]=4 4928 B8R1.4 CC1CC(CCO1)N MCULE-8648516718 [0,1,0,1,0,0|1,0,1]=4 4929 B8R1.4 CC1CC(CCO1)O MCULE-4865141445 [0,1,0,1,0,0|1,0,1]=4 4930 B8R1.4 CC1CC=CC(=O)O1 MCULE-3191839185 [0,1,0,1,0,0|0,0,2]=4 4931 B8R1.4 CC1CCCC(=O)C1 MCULE-6473963111 [0,1,0,1,0,0|1,0,0]=3 4932 B8R1.4 CC1CCCC(=O)C1 MCULE-9918051823 [0,1,0,1,0,0|1,0,0]=3 4933 B8R1.4 CC1CCCC(=O)N1 MCULE-3851963076 [0,1,0,1,0,0|1,0,0]=3 4934 B8R1.4 CC1CCCC(=O)O1 MCULE-4000069856 [0,1,0,1,0,0|0,0,0]=2 4935 B8R1.4 CC1CCNC(=N)C1 MCULE-2615774284 [0,1,0,1,0,0|2,0,0]=4 4936 B8R1.4 CC1CCNC(=N)C1 MCULE-9034088725 [0,1,0,1,0,0|2,0,0]=4 4937 B8R1.4 CC1CCNC(=O)C1 MCULE-8903018599 [0,1,0,1,0,0|1,0,0]=3 4938 B8R1.4 CC1CCNC(=O)N1 MCULE-6491047836 [0,1,0,1,0,0|2,0,0]=4 4939 B8R1.4 CC1CCOC(=O)C1 MCULE-2682865017 [0,1,0,1,0,0|0,0,0]=2 4940 B8R1.4 CC1CCOC(=O)O1 MCULE-5929311811 [0,1,0,1,0,0|1,0,0]=3 4941 B8R1.4 CC1CCOS(=O)O1 MCULE-8688981983 [0,1,0,1,0,0|2,0,0]=4 4942 B8R1.4 CC1CNCC(=O)N1 MCULE-5727167900 [0,1,0,1,0,0|2,0,0]=4 4943 B8R1.4 CC1CNCC(=O)N1 MCULE-9599432640 [0,1,0,1,0,0|2,0,0]=4 4944 B8R1.4 CC1COCC(=O)N1 MCULE-4768427051 [0,1,0,1,0,0|1,0,0]=3 4945 B8R1.4 CC1COCC(=O)N1 MCULE-5909800781 [0,1,0,1,0,0|1,0,0]=3 4946 B8R1.4 CC1CS(=O)CCN1 MCULE-1283703183 [0,1,0,1,0,0|2,0,0]=4 4947 B8R1.4 CN1CCCC(=O)C1 MCULE-1067967474 [0,1,0,1,0,0|1,0,0]=3 4948 B8R1.4 CN1CCCC(=O)C1 MCULE-4816876030 [0,1,0,1,0,0|1,0,0]=3 4949 B8R1.4 CN1CCNC(=O)C1 MCULE-5564854834 [0,1,0,1,0,0|2,0,0]=4 4950 B8R1.4 CN1CCOC(=O)C1 MCULE-2224720964 [0,1,0,1,0,0|1,0,0]=3 4951 B8R1.4 CN1CCOC(=O)C1 MCULE-9163078129 [0,1,0,1,0,0|1,0,0]=3 4952 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7688577280 [0,1,0,1,0,0|1,0,0]=3 4953 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7762440526 [0,1,0,1,0,0|1,0,0]=3 4954 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-8158589956 [0,1,0,1,0,0|1,0,0]=3 4955 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-9544551566 [0,1,0,1,0,0|1,0,0]=3 4956 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-4878813100 [0,1,0,1,0,0|1,0,0]=3 4957 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-7917159022 [0,1,0,1,0,0|1,0,0]=3 4958 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-1868776628 [0,1,0,1,0,0|1,0,0]=3 4959 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-6973928430 [0,1,0,1,0,0|1,0,0]=3 4960 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-2050655386 [0,1,0,1,0,0|1,0,0]=3 4961 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-7049359933 [0,1,0,1,0,0|1,0,0]=3 4962 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-6306078053 [0,1,0,1,0,0|0,0,0]=2 4963 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-7616070208 [0,1,0,1,0,0|0,0,0]=2 4964 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-3378865379 [0,1,0,1,0,0|2,0,0]=4 4965 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-5740698320 [0,1,0,1,0,0|2,0,0]=4 4966 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-7692987274 [0,1,0,1,0,0|2,0,0]=4 4967 B8R1.4 C[C@@H]1CNCC(=O)N1 MCULE-8897582822 [0,1,0,1,0,0|2,0,0]=4 4968 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-1758598852 [0,1,0,1,0,0|1,0,0]=3 4969 B8R1.4 C[C@@H]1COCC(=O)N1 MCULE-2011395384 [0,1,0,1,0,0|1,0,0]=3 4970 B8R1.4 C[C@@H]1C[C@@H](CCO1)N MCULE-5401313109 [0,1,0,1,0,0|1,0,1]=4 4971 B8R1.4 C[C@@H]1C[C@@H](CCO1)N MCULE-6369939467 [0,1,0,1,0,0|1,0,1]=4 4972 B8R1.4 C[C@@H]1C[C@@H](CCO1)O MCULE-6251959536 [0,1,0,1,0,0|1,0,1]=4 4973 B8R1.4 C[C@@H]1C[C@H](CCO1)Br MCULE-5055630042 [0,1,0,1,0,0|1,0,1]=4 4974 B8R1.4 C[C@@H]1C[C@H](CCO1)N MCULE-3414529082 [0,1,0,1,0,0|1,0,1]=4 4975 B8R1.4 C[C@@H]1C[C@H](CCO1)N MCULE-9424615508 [0,1,0,1,0,0|1,0,1]=4 4976 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-1599463757 [0,1,0,1,0,0|1,0,0]=3 4977 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-4580048332 [0,1,0,1,0,0|1,0,0]=3 4978 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5356496154 [0,1,0,1,0,0|1,0,0]=3 4979 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5733481696 [0,1,0,1,0,0|1,0,0]=3 4980 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-6641640616 [0,1,0,1,0,0|1,0,0]=3 4981 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-8001129555 [0,1,0,1,0,0|1,0,0]=3 4982 B8R1.4 C[C@H]1CC(=O)CCO1 MCULE-7799394182 [0,1,0,1,0,0|1,0,0]=3 4983 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-4643975445 [0,1,0,1,0,0|1,0,0]=3 4984 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-6122391840 [0,1,0,1,0,0|1,0,0]=3 4985 B8R1.4 C[C@H]1CCNC(=O)C1 MCULE-7120988665 [0,1,0,1,0,0|1,0,0]=3 4986 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3182538973 [0,1,0,1,0,0|2,0,0]=4 4987 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-3207104811 [0,1,0,1,0,0|2,0,0]=4 4988 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-5895954143 [0,1,0,1,0,0|2,0,0]=4 4989 B8R1.4 C[C@H]1CNCC(=O)N1 MCULE-6535652978 [0,1,0,1,0,0|2,0,0]=4 4990 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-5693624195 [0,1,0,1,0,0|1,0,0]=3 4991 B8R1.4 C[C@H]1COCC(=O)N1 MCULE-8476323396 [0,1,0,1,0,0|1,0,0]=3 4992 B8R1.4 C[C@H]1C[C@@H](CCO1)N MCULE-1731421927 [0,1,0,1,0,0|1,0,1]=4 4993 B8R1.4 C[C@H]1C[C@@H](CCO1)O MCULE-3846187212 [0,1,0,1,0,0|1,0,1]=4 4994 B8R1.4 C[C@H]1C[C@H](CCO1)N MCULE-6954386064 [0,1,0,1,0,0|1,0,1]=4 4995 B8R1.4 C[C@H]1C[C@H](CCO1)O MCULE-3007764630 [0,1,0,1,0,0|1,0,1]=4 4996 B8R1.4 NC1=CC(=O)CCC1 MCULE-3362548403 [0,1,0,1,0,0|1,0,1]=4 4997 B8R1.4 NC1C=C(CCC1)F MCULE-7477602128 [0,1,0,1,0,0|2,0,0]=4 4998 B8R1.4 NC1CCCC(=O)C1 MCULE-3659606498 [0,1,0,1,0,0|1,0,0]=3 4999 B8R1.4 NC1CCCC(=O)C1 MCULE-8815445353 [0,1,0,1,0,0|1,0,0]=3 5000 B8R1.4 NC1CCNC(=O)C1 MCULE-2185303732 [0,1,0,1,0,0|1,0,0]=3 5001 B8R1.4 NC1CCNC(=O)C1 MCULE-4290135082 [0,1,0,1,0,0|1,0,0]=3 5002 B8R1.4 NC1CCNC(=O)C1 MCULE-6525283699 [0,1,0,1,0,0|1,0,0]=3 5003 B8R1.4 NC1CCNC(=O)C1 MCULE-8080194775 [0,1,0,1,0,0|1,0,0]=3 5004 B8R1.4 NC1COCC(=O)C1 MCULE-4958107203 [0,1,0,1,0,0|1,0,0]=3 5005 B8R1.4 NC1COCC(=O)C1 MCULE-9645630994 [0,1,0,1,0,0|1,0,0]=3 5006 B8R1.4 N[C@@H]1CCCC(=O)C1 MCULE-4006583256 [0,1,0,1,0,0|1,0,0]=3 5007 B8R1.4 N[C@@H]1CCNC(=O)C1 MCULE-8276559925 [0,1,0,1,0,0|1,0,0]=3 5008 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-3299834957 [0,1,0,1,0,0|1,0,0]=3 5009 B8R1.4 N[C@@H]1COCC(=O)C1 MCULE-6683156371 [0,1,0,1,0,0|1,0,0]=3 5010 B8R1.4 N[C@H]1CCCC(=O)C1 MCULE-9786035316 [0,1,0,1,0,0|1,0,0]=3 5011 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-1641151984 [0,1,0,1,0,0|1,0,0]=3 5012 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-2042394403 [0,1,0,1,0,0|1,0,0]=3 5013 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-6400271298 [0,1,0,1,0,0|1,0,0]=3 5014 B8R1.4 O=C1C=C(CCC1)Br MCULE-3733885681 [0,1,0,1,0,0|1,0,1]=4 5015 B8R1.4 O=C1C=C(CCC1)Cl MCULE-9612484193 [0,1,0,1,0,0|1,0,1]=4 5016 B8R1.4 O=C1C=C(CCC1)I MCULE-4085762002 [0,1,0,1,0,0|1,0,1]=4 5017 B8R1.4 O=C1C=C(CCC1)O MCULE-5615245957 [0,1,0,1,0,0|1,0,1]=4 5018 B8R1.4 O=C1CC(CCN1)F MCULE-3828280868 [0,1,0,1,0,0|1,0,0]=3 5019 B8R1.4 O=C1CC(CCN1)F MCULE-8150833328 [0,1,0,1,0,0|1,0,0]=3 5020 B8R1.4 O=C1CC(CCN1)O MCULE-5400068518 [0,1,0,1,0,0|1,0,0]=3 5021 B8R1.4 O=C1CC(CCN1)O MCULE-8702086069 [0,1,0,1,0,0|1,0,0]=3 5022 B8R1.4 O=C1CCCC(=O)C1 MCULE-7494421285 [0,1,0,1,0,0|1,0,1]=4 5023 B8R1.4 O=C1CCCC(=O)N1 MCULE-7505150579 [0,1,0,1,0,0|1,0,1]=4 5024 B8R1.4 O=C1CCCC(=O)O1 MCULE-4866925975 [0,1,0,1,0,0|0,0,1]=3 5025 B8R1.4 O=C1CCCC(C1)O MCULE-3100717907 [0,1,0,1,0,0|1,0,0]=3 5026 B8R1.4 O=C1CCC[C@@H](C1)O MCULE-3841179351 [0,1,0,1,0,0|1,0,0]=3 5027 B8R1.4 O=C1CCNC(=O)C1 MCULE-7662080105 [0,1,0,1,0,0|1,0,1]=4 5028 B8R1.4 O=C1CCNC(=O)O1 MCULE-8298722634 [0,1,0,1,0,0|1,0,1]=4 5029 B8R1.4 O=C1CCOC(=O)C1 MCULE-3134133687 [0,1,0,1,0,0|0,0,1]=3 5030 B8R1.4 O=C1COCC(=O)C1 MCULE-1763175933 [0,1,0,1,0,0|1,0,1]=4 5031 B8R1.4 O=C1COCC(=O)O1 MCULE-7640970930 [0,1,0,1,0,0|1,0,1]=4 5032 B8R1.4 O=C1COCC(C1)O MCULE-6056926421 [0,1,0,1,0,0|1,0,0]=3 5033 B8R1.4 O=C1CSCC(=O)O1 MCULE-6767203470 [0,1,0,1,0,0|1,0,1]=4 5034 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-8279613188 [0,1,0,1,0,0|1,0,0]=3 5035 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-9911849866 [0,1,0,1,0,0|1,0,0]=3 5036 B8R1.4 O=C1C[C@H](CCN1)O MCULE-3843806479 [0,1,0,1,0,0|1,0,0]=3 5037 B8R1.4 O=C1C[C@H](CCN1)O MCULE-9127195212 [0,1,0,1,0,0|1,0,0]=3 5038 B8R1.4 [C@@H]1(CCCC(=O)N1)C MCULE-8906937588 [0,1,0,1,0,0|1,0,0]=3 5039 B8R1.18 C=C1CC(OC1=O)C MCULE-4610228867 [0,1,0,1,0,0|2,0,0]=4 5040 B8R1.18 CC1=C(OC(=O)N1)C MCULE-9563427028 [0,1,0,1,0,0|1,0,1]=4 5041 B8R1.18 CC1=C(OC(=O)O1)C MCULE-2205012091 [0,1,0,1,0,0|1,0,1]=4 5042 B8R1.18 CC1=CC(=O)CC1C MCULE-9587444246 [0,1,0,1,0,0|1,0,0]=3 5043 B8R1.18 CC1=CC(=O)OC1O MCULE-2111708862 [0,1,0,1,0,0|0,0,2]=4 5044 B8R1.18 CC1=CC(=O)O[C@@H]1O MCULE-3894053073 [0,1,0,1,0,0|0,0,2]=4 5045 B8R1.18 CC1=CC(CC1=O)O MCULE-6348285774 [0,1,0,1,0,0|1,0,1]=4 5046 B8R1.18 CC1=NN(C(=O)C1)C MCULE-3316902396 [0,1,0,1,0,0|1,0,1]=4 5047 B8R1.18 CC1CC(=O)C(O1)C MCULE-9648127298 [0,1,0,1,0,0|1,0,0]=3 5048 B8R1.18 CC1CC(=O)CN1C MCULE-3142275674 [0,1,0,1,0,0|1,0,0]=3 5049 B8R1.18 CC1CC(=O)N(C1)C MCULE-2164356802 [0,1,0,1,0,0|1,0,0]=3 5050 B8R1.18 CC1CC(=O)N(N1)C MCULE-3951114099 [0,1,0,1,0,0|1,0,0]=3 5051 B8R1.18 CC1CC(=O)NC1=O MCULE-2962850802 [0,1,0,1,0,0|1,0,1]=4 5052 B8R1.18 CC1CC(=O)OC1=O MCULE-6043315810 [0,1,0,1,0,0|0,0,1]=3 5053 B8R1.18 CC1CC(=O)OC1C MCULE-3906254123 [0,1,0,1,0,0|0,0,0]=2 5054 B8R1.18 CC1CC(=O)OC1O MCULE-7140241012 [0,1,0,1,0,0|0,0,0]=2 5055 B8R1.18 CC1CC(C(=O)O1)Br MCULE-3628819780 [0,1,0,1,0,0|2,0,0]=4 5056 B8R1.18 CC1CC(C(=O)O1)N MCULE-4414809681 [0,1,0,1,0,0|2,0,0]=4 5057 B8R1.18 CC1CC(C(=O)O1)N MCULE-7247771680 [0,1,0,1,0,0|2,0,0]=4 5058 B8R1.18 CC1CN(CC1=O)C MCULE-3780339739 [0,1,0,1,0,0|2,0,0]=4 5059 B8R1.18 CC1NC(=O)CC1O MCULE-6370955032 [0,1,0,1,0,0|2,0,0]=4 5060 B8R1.18 CC1NC(=O)OC1=O MCULE-5437194910 [0,1,0,1,0,0|1,0,1]=4 5061 B8R1.18 CC1NC(=O)OC1=O MCULE-6711218397 [0,1,0,1,0,0|1,0,1]=4 5062 B8R1.18 CC1NC(=O)OC1C MCULE-5204749893 [0,1,0,1,0,0|1,0,0]=3 5063 B8R1.18 CC1OC(=O)OC1C MCULE-1302025126 [0,1,0,1,0,0|1,0,0]=3 5064 B8R1.18 CC1OS(=O)OC1C MCULE-8578188591 [0,1,0,1,0,0|2,0,0]=4 5065 B8R1.18 CN1CC(=O)CC1=O MCULE-9941627549 [0,1,0,1,0,0|1,0,1]=4 5066 B8R1.18 CN1CC(=O)OC1=O MCULE-7537862268 [0,1,0,1,0,0|1,0,1]=4 5067 B8R1.18 CN1CC(CC1=O)I MCULE-4945824576 [0,1,0,1,0,0|1,0,0]=3 5068 B8R1.18 CN1CC(CC1=O)N MCULE-2463085778 [0,1,0,1,0,0|1,0,0]=3 5069 B8R1.18 CN1CC(CC1=O)N MCULE-2958084133 [0,1,0,1,0,0|1,0,0]=3 5070 B8R1.18 CN1CC(CC1=O)O MCULE-3900359646 [0,1,0,1,0,0|1,0,0]=3 5071 B8R1.18 CN1C[C@@H](CC1=O)N MCULE-5898871508 [0,1,0,1,0,0|1,0,0]=3 5072 B8R1.18 CN1C[C@@H](CC1=O)O MCULE-6983684031 [0,1,0,1,0,0|1,0,0]=3 5073 B8R1.18 CN1C[C@@H](CC1=O)O MCULE-9036883490 [0,1,0,1,0,0|1,0,0]=3 5074 B8R1.18 CN1C[C@H](CC1=O)N MCULE-6260844558 [0,1,0,1,0,0|1,0,0]=3 5075 B8R1.18 CN1C[C@H](CC1=O)N MCULE-9464195407 [0,1,0,1,0,0|1,0,0]=3 5076 B8R1.18 CN1C[C@H](CC1=O)O MCULE-1129246553 [0,1,0,1,0,0|1,0,0]=3 5077 B8R1.18 CN1C[C@H](CC1=O)O MCULE-3762455862 [0,1,0,1,0,0|1,0,0]=3 5078 B8R1.18 C[C@@H]1CC(=O)NC1=O MCULE-9043552998 [0,1,0,1,0,0|1,0,1]=4 5079 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1O MCULE-5647492108 [0,1,0,1,0,0|2,0,0]=4 5080 B8R1.18 C[C@@H]1NC(=O)OC1=O MCULE-3338806314 [0,1,0,1,0,0|1,0,1]=4 5081 B8R1.18 C[C@@H]1NC(=O)OC1=O MCULE-9892061668 [0,1,0,1,0,0|1,0,1]=4 5082 B8R1.18 C[C@H]1CC(=O)OC1=O MCULE-7764909201 [0,1,0,1,0,0|0,0,1]=3 5083 B8R1.18 C[C@H]1CC(=O)O[C@H]1C MCULE-7756599719 [0,1,0,1,0,0|0,0,0]=2 5084 B8R1.18 C[C@H]1NC(=O)OC1=O MCULE-2658468572 [0,1,0,1,0,0|1,0,1]=4 5085 B8R1.18 C[C@H]1NC(=O)OC1=O MCULE-9205776561 [0,1,0,1,0,0|1,0,1]=4 5086 B8R1.18 NC1CC(=O)OC1=O MCULE-1406790351 [0,1,0,1,0,0|1,0,1]=4 5087 B8R1.18 NC1CC(=O)OC1=O MCULE-2807590870 [0,1,0,1,0,0|1,0,1]=4 5088 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-1937927503 [0,1,0,1,0,0|1,0,1]=4 5089 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-2080587685 [0,1,0,1,0,0|1,0,1]=4 5090 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-8793349665 [0,1,0,1,0,0|1,0,1]=4 5091 B8R1.18 N[C@@H]1CC(=O)OC1=O MCULE-9640337170 [0,1,0,1,0,0|1,0,1]=4 5092 B8R1.18 N[C@H]1CC(=O)OC1=O MCULE-3191926438 [0,1,0,1,0,0|1,0,1]=4 5093 B8R1.18 N[C@H]1CC(=O)OC1=O MCULE-4503342222 [0,1,0,1,0,0|1,0,1]=4 5094 B8R1.18 O=C1OC(C(O1)Cl)Cl MCULE-2346794223 [0,1,0,1,0,0|2,0,0]=4 5095 B8R1.18 O=C1O[C@@H]([C@H](O1)F)F MCULE-7614704509 [0,1,0,1,0,0|2,0,0]=4 5096 B8R1.31 CC(C)C1CCC1=O MCULE-1869737626 [0,1,0,1,0,0|1,0,0]=3 5097 B8R1.40 C=CC(=O)CC1CC1 MCULE-2286262087 [0,1,0,1,0,0|1,0,1]=4 5098 B8R1.40 C=CC(=O)NC1CC1 MCULE-2482571861 [0,1,0,1,0,0|1,0,1]=4 5099 B8R1.40 CCC(=O)CC1CC1 MCULE-7991524982 [0,1,0,1,0,0|1,0,0]=3 5100 B8R1.40 CNC(=O)NC1CC1 MCULE-7333117512 [0,1,0,1,0,0|1,0,0]=3 5101 B8R1.40 CNC(=S)NC1CC1 MCULE-3030208665 [0,1,0,1,0,0|1,1,0]=4 5102 B8R1.40 COC(=O)C=C1CC1 MCULE-9046312556 [0,1,0,1,0,0|0,0,1]=3 5103 B8R1.40 COC(=O)CC1CC1 MCULE-5556326610 [0,1,0,1,0,0|0,0,0]=2 5104 B8R1.40 COC(=O)CC1CO1 MCULE-1978729257 [0,1,0,1,0,0|0,0,0]=2 5105 B8R1.40 COC(=O)C[C@@H]1CO1 MCULE-5425441463 [0,1,0,1,0,0|0,0,0]=2 5106 B8R1.40 NCC(=O)CC1CC1 MCULE-2543196441 [0,1,0,1,0,0|2,0,0]=4 5107 B8R1.40 NCC(=O)CC1CC1 MCULE-5112659326 [0,1,0,1,0,0|2,0,0]=4 5108 B8R1.40 NCC(=O)NC1CC1 MCULE-2762684805 [0,1,0,1,0,0|2,0,0]=4 5109 B8R1.40 NCC(=O)NC1CC1 MCULE-4322562048 [0,1,0,1,0,0|2,0,0]=4 5110 B8R1.40 NCC(=O)OC1CC1 MCULE-9881697631 [0,1,0,1,0,0|2,0,0]=4 5111 B8R1.40 NNC(=O)CC1CC1 MCULE-5050226429 [0,1,0,1,0,0|2,0,0]=4 5112 B8R1.40 NNC(=O)NC1CC1 MCULE-4098919000 [0,1,0,1,0,0|2,0,0]=4 5113 B8R1.40 O=C(CBr)CC1CC1 MCULE-2483365582 [0,1,0,1,0,0|2,0,0]=4 5114 B8R1.40 O=C(CBr)NC1CC1 MCULE-4062220255 [0,1,0,1,0,0|2,0,0]=4 5115 B8R1.40 O=C(CCl)NC1CC1 MCULE-3538029068 [0,1,0,1,0,0|2,0,0]=4 5116 B8R1.40 O=C(CO)NC1CC1 MCULE-8403900056 [0,1,0,1,0,0|2,0,0]=4 5117 B8R1.40 O=C(CS)NC1CC1 MCULE-1359704742 [0,1,0,1,0,0|2,0,0]=4 5118 B8R1.51 CC1(C=CC(=O)C1)C MCULE-2691948275 [0,1,0,1,0,0|1,0,1]=4 5119 B8R1.51 CC1(CC(=O)CN1)C MCULE-3002354818 [0,1,0,1,0,0|2,0,0]=4 5120 B8R1.51 CC1(CC(=O)CO1)C MCULE-3813236339 [0,1,0,1,0,0|2,0,0]=4 5121 B8R1.51 CC1(CC(=O)CS1)C MCULE-8119393989 [0,1,0,1,0,0|2,0,0]=4 5122 B8R1.51 CC1(CC(=O)NN1)C MCULE-3949987986 [0,1,0,1,0,0|2,0,0]=4 5123 B8R1.51 CC1(CC(=O)NO1)C MCULE-2107007864 [0,1,0,1,0,0|2,0,0]=4 5124 B8R1.51 CC1(CCC(=O)C1)C MCULE-9814375082 [0,1,0,1,0,0|1,0,0]=3 5125 B8R1.51 CC1(CCC(=O)N1)C MCULE-2538104334 [0,1,0,1,0,0|2,0,0]=4 5126 B8R1.51 CC1(CCC(=O)O1)C MCULE-3069658569 [0,1,0,1,0,0|2,0,0]=4 5127 B8R1.51 CC1(CN=C(C1)N)C MCULE-2728105590 [0,1,0,1,0,0|2,0,0]=4 5128 B8R1.51 CC1(CN=C(C1)N)C MCULE-9014086278 [0,1,0,1,0,0|2,0,0]=4 5129 B8R1.51 CC1(CNC(=O)C1)C MCULE-1184902754 [0,1,0,1,0,0|1,0,0]=3 5130 B8R1.51 CC1(CNC(=O)C1)O MCULE-3317128471 [0,1,0,1,0,0|1,0,0]=3 5131 B8R1.51 CC1(CNC(=O)N1)C MCULE-2885809296 [0,1,0,1,0,0|2,0,0]=4 5132 B8R1.51 CC1(CNC(=O)O1)C MCULE-9188826896 [0,1,0,1,0,0|2,0,0]=4 5133 B8R1.51 CC1(COC(=N1)N)C MCULE-6966870092 [0,1,0,1,0,0|2,0,0]=4 5134 B8R1.51 CC1(COC(=O)C1)C MCULE-2810911497 [0,1,0,1,0,0|0,0,0]=2 5135 B8R1.51 CC1(COC(=O)N1)C MCULE-9709457440 [0,1,0,1,0,0|1,0,0]=3 5136 B8R1.51 CC1(COC(=S)N1)C MCULE-2461637364 [0,1,0,1,0,0|1,1,0]=4 5137 B8R1.51 CC1=NC(CO1)(C)C MCULE-5229270650 [0,1,0,1,0,0|2,0,0]=4 5138 B8R1.51 CC1CCS(=O)(=O)C1 MCULE-8205416735 [0,1,0,1,0,0|2,0,0]=4 5139 B8R1.51 CC1CNS(=O)(=O)C1 MCULE-2299608411 [0,1,0,1,0,0|2,0,0]=4 5140 B8R1.51 CC1COS(=O)(=O)C1 MCULE-3208476537 [0,1,0,1,0,0|1,0,0]=3 5141 B8R1.51 CC1COS(=O)(=O)O1 MCULE-1582385826 [0,1,0,1,0,0|2,0,0]=4 5142 B8R1.51 C[C@@H]1COS(=O)(=O)O1 MCULE-8592617135 [0,1,0,1,0,0|2,0,0]=4 5143 B8R1.51 C[C@@H]1COS(=O)(=O)O1 MCULE-8834088750 [0,1,0,1,0,0|2,0,0]=4 5144 B8R1.51 C[C@H]1COS(=O)(=O)O1 MCULE-3969026002 [0,1,0,1,0,0|2,0,0]=4 5145 B8R1.51 C[C@H]1COS(=O)(=O)O1 MCULE-5192877040 [0,1,0,1,0,0|2,0,0]=4 5146 B8R1.51 O=C1CC(CN1)(F)F MCULE-5899183897 [0,1,0,1,0,0|2,0,0]=4 5147 B8R1.51 O=S1(=O)CC(CO1)Br MCULE-9410616687 [0,1,0,1,0,0|2,0,0]=4 5148 B8R1.83 CC1CC1C(=O)CCl MCULE-1203840849 [0,1,0,1,0,0|2,0,0]=4 5149 B8R1.83 CC1CC1C(=O)NN MCULE-3813713819 [0,1,0,1,0,0|2,0,0]=4 5150 B8R1.83 CCC(=O)C1CC1C MCULE-4552256059 [0,1,0,1,0,0|1,0,0]=3 5151 B8R1.83 COC(=O)C1CC1Br MCULE-8891645401 [0,1,0,1,0,0|0,0,0]=2 5152 B8R1.83 COC(=O)C1CC1C MCULE-9202068586 [0,1,0,1,0,0|0,0,0]=2 5153 B8R1.83 COC(=O)[C@@H]1C[C@@H]1Br MCULE-3965032710 [0,1,0,1,0,0|0,0,0]=2 5154 B8R1.83 COC(=O)[C@H]1C[C@@H]1Br MCULE-9083522272 [0,1,0,1,0,0|0,0,0]=2 5155 B8R1.2 BrC=C1CCCCC1 MCULE-1203677785 [0,1,0,1,0,0|2,0,0]=4 5156 B8R1.2 BrCC1=CCCCC1 MCULE-4196033923 [0,1,0,1,0,0|2,0,0]=4 5157 B8R1.2 BrCC1CCCCO1 MCULE-7555024882 [0,1,0,1,0,0|1,0,1]=4 5158 B8R1.2 C#CC1=CCCCC1 MCULE-2729587527 [0,1,0,1,0,0|2,0,0]=4 5159 B8R1.2 C#CC1CCCCO1 MCULE-3115070208 [0,1,0,1,0,0|1,0,1]=4 5160 B8R1.2 C/N=C\1/[NH2+]CCCS1 MCULE-7599934566 [0,1,0,1,0,0|1,1,0]=4 5161 B8R1.2 C1(CCCCO1)CC MCULE-5189391029 [0,1,0,1,0,0|1,0,1]=4 5162 B8R1.2 C1(CCCNC1)OC MCULE-1114013355 [0,1,0,1,0,0|1,0,1]=4 5163 B8R1.2 C1(CCCNC1)OC MCULE-4203507585 [0,1,0,1,0,0|1,0,1]=4 5164 B8R1.2 CC=C1CCCCC1 MCULE-6327883518 [0,1,0,1,0,0|2,0,0]=4 5165 B8R1.2 CCC1=NCCCC1 MCULE-5828184755 [0,1,0,1,0,0|2,0,0]=4 5166 B8R1.2 COC1=CCC=CC1 MCULE-7415926731 [0,1,0,1,0,0|1,0,1]=4 5167 B8R1.2 COC1=CCCCC1 MCULE-9079372045 [0,1,0,1,0,0|1,0,0]=3 5168 B8R1.2 COC1=CCOCC1 MCULE-8337045524 [0,1,0,1,0,0|1,0,0]=3 5169 B8R1.2 COC1=NCCCC1 MCULE-3080988027 [0,1,0,1,0,0|1,0,0]=3 5170 B8R1.2 COC1=NCCOC1 MCULE-6346383497 [0,1,0,1,0,0|1,0,0]=3 5171 B8R1.2 COC1C=CCCC1 MCULE-4692829014 [0,1,0,1,0,0|1,0,1]=4 5172 B8R1.2 COC1CCCCC1 MCULE-2340244681 [0,1,0,1,0,0|1,0,1]=4 5173 B8R1.2 COC1CCCCO1 MCULE-5586923898 [0,1,0,1,0,0|0,0,2]=4 5174 B8R1.2 COC1CCCNC1 MCULE-2428257033 [0,1,0,1,0,0|1,0,1]=4 5175 B8R1.2 COC1CCCNC1 MCULE-8656248481 [0,1,0,1,0,0|1,0,1]=4 5176 B8R1.2 COC1CCNCC1 MCULE-4479092950 [0,1,0,1,0,0|1,0,1]=4 5177 B8R1.2 COC1CCNCC1 MCULE-9875032721 [0,1,0,1,0,0|1,0,1]=4 5178 B8R1.2 COC1CNCCO1 MCULE-4273991787 [0,1,0,1,0,0|0,0,2]=4 5179 B8R1.2 CON1CCNCC1 MCULE-1535907405 [0,1,0,1,0,0|2,0,0]=4 5180 B8R1.2 COP1OCCCO1 MCULE-2903353416 [0,1,0,1,0,0|1,0,1]=4 5181 B8R1.2 CO[C@@H]1CCCNC1 MCULE-1593626348 [0,1,0,1,0,0|1,0,1]=4 5182 B8R1.2 CO[C@@H]1CCCNC1 MCULE-4085125909 [0,1,0,1,0,0|1,0,1]=4 5183 B8R1.2 CO[C@@H]1CCCNC1 MCULE-6313387662 [0,1,0,1,0,0|1,0,1]=4 5184 B8R1.2 CO[C@@H]1CCCNC1 MCULE-8494307603 [0,1,0,1,0,0|1,0,1]=4 5185 B8R1.2 CO[C@H]1CCCNC1 MCULE-1042411558 [0,1,0,1,0,0|1,0,1]=4 5186 B8R1.2 CO[C@H]1CCCNC1 MCULE-3363706345 [0,1,0,1,0,0|1,0,1]=4 5187 B8R1.2 CO[C@H]1CCCNC1 MCULE-3745051847 [0,1,0,1,0,0|1,0,1]=4 5188 B8R1.2 CO[C@H]1CCCNC1 MCULE-6475889306 [0,1,0,1,0,0|1,0,1]=4 5189 B8R1.2 CSC1=NCCCN1 MCULE-4252949660 [0,1,0,1,0,0|1,1,0]=4 5190 B8R1.2 CSC1=NCCCN1 MCULE-4367422216 [0,1,0,1,0,0|1,1,0]=4 5191 B8R1.2 CSC1=NCCCN1 MCULE-7320602045 [0,1,0,1,0,0|1,1,0]=4 5192 B8R1.2 CSC1=NCCCS1 MCULE-6353934403 [0,1,0,1,0,0|0,2,0]=4 5193 B8R1.2 CSC1=NCCSC1 MCULE-1243311765 [0,1,0,1,0,0|1,1,0]=4 5194 B8R1.2 ClCC1CCCCO1 MCULE-7493119643 [0,1,0,1,0,0|1,0,1]=4 5195 B8R1.2 ClN=C1CCCCC1 MCULE-6786339883 [0,1,0,1,0,0|2,0,0]=4 5196 B8R1.2 IC=C1CCCCC1 MCULE-9165742833 [0,1,0,1,0,0|2,0,0]=4 5197 B8R1.2 ICC1CCCCO1 MCULE-4630701067 [0,1,0,1,0,0|1,0,1]=4 5198 B8R1.2 N#CC1=CCCCC1 MCULE-7215745635 [0,1,0,1,0,0|2,0,0]=4 5199 B8R1.2 N#CC1=CCCCO1 MCULE-5646992777 [0,1,0,1,0,0|1,0,1]=4 5200 B8R1.2 N#CC1CCCCO1 MCULE-3506953632 [0,1,0,1,0,0|1,0,1]=4 5201 B8R1.2 NCC1=CCCCC1 MCULE-3951635533 [0,1,0,1,0,0|2,0,0]=4 5202 B8R1.2 NCC1=CCCCC1 MCULE-4923330324 [0,1,0,1,0,0|2,0,0]=4 5203 B8R1.2 NCC1CCCCO1 MCULE-2644735894 [0,1,0,1,0,0|1,0,1]=4 5204 B8R1.2 NCC1CCCCO1 MCULE-5042678896 [0,1,0,1,0,0|1,0,1]=4 5205 B8R1.2 NC[C@@H]1CCCCO1 MCULE-1435985280 [0,1,0,1,0,0|1,0,1]=4 5206 B8R1.2 NC[C@@H]1CCCCO1 MCULE-4778440271 [0,1,0,1,0,0|1,0,1]=4 5207 B8R1.2 NC[C@@H]1CCCCO1 MCULE-6014338525 [0,1,0,1,0,0|1,0,1]=4 5208 B8R1.2 NC[C@@H]1CCCCO1 MCULE-9488694680 [0,1,0,1,0,0|1,0,1]=4 5209 B8R1.2 NC[C@H]1CCCCO1 MCULE-2835389541 [0,1,0,1,0,0|1,0,1]=4 5210 B8R1.2 NC[C@H]1CCCCO1 MCULE-4500797236 [0,1,0,1,0,0|1,0,1]=4 5211 B8R1.2 NC[C@H]1CCCCO1 MCULE-5990717573 [0,1,0,1,0,0|1,0,1]=4 5212 B8R1.2 NC[C@H]1CCCCO1 MCULE-7362278601 [0,1,0,1,0,0|1,0,1]=4 5213 B8R1.2 NOC1CCCCO1 MCULE-2818785498 [0,1,0,1,0,0|0,0,2]=4 5214 B8R1.2 O=CC1=CCCCC1 MCULE-6209420256 [0,1,0,1,0,0|1,0,0]=3 5215 B8R1.2 O=CC1=CCCOC1 MCULE-5495935874 [0,1,0,1,0,0|2,0,0]=4 5216 B8R1.2 O=CC1=CCCSC1 MCULE-9611960845 [0,1,0,1,0,0|2,0,0]=4 5217 B8R1.2 O=CC1=COCCC1 MCULE-5246467858 [0,1,0,1,0,0|2,0,0]=4 5218 B8R1.2 O=CC1=COCCO1 MCULE-4502742368 [0,1,0,1,0,0|1,0,1]=4 5219 B8R1.2 O=CC1CCCCC1 MCULE-7345097178 [0,1,0,1,0,0|1,0,1]=4 5220 B8R1.2 O=CC1CCCCN1 MCULE-7681438476 [0,1,0,1,0,0|1,0,1]=4 5221 B8R1.2 O=CC1CCCCN1 MCULE-9370686295 [0,1,0,1,0,0|1,0,1]=4 5222 B8R1.2 O=CC1CCCCO1 MCULE-6497412510 [0,1,0,1,0,0|0,0,1]=3 5223 B8R1.2 O=CC1COCCO1 MCULE-3817488986 [0,1,0,1,0,0|1,0,1]=4 5224 B8R1.2 O=CN1CCCCC1 MCULE-3028605826 [0,1,0,1,0,0|2,0,0]=4 5225 B8R1.2 O=NN1CCCCC1 MCULE-6180064865 [0,1,0,1,0,0|2,0,0]=4 5226 B8R1.2 OCC1=CCCCC1 MCULE-2422738199 [0,1,0,1,0,0|1,0,1]=4 5227 B8R1.2 OCC1=CCCCO1 MCULE-1995059172 [0,1,0,1,0,0|0,0,2]=4 5228 B8R1.2 OCC1CCCCO1 MCULE-2390789074 [0,1,0,1,0,0|0,0,2]=4 5229 B8R1.2 OCC1CCCCO1 MCULE-7483291767 [0,1,0,1,0,0|0,0,2]=4 5230 B8R1.2 OC[C@@H]1CCCCO1 MCULE-5978396739 [0,1,0,1,0,0|0,0,2]=4 5231 B8R1.2 OC[C@@H]1CCCCO1 MCULE-8715909099 [0,1,0,1,0,0|0,0,2]=4 5232 B8R1.2 OC[C@H]1CCCCO1 MCULE-4700719427 [0,1,0,1,0,0|0,0,2]=4 5233 B8R1.2 OC[C@H]1CCCCO1 MCULE-7990169259 [0,1,0,1,0,0|0,0,2]=4 5234 B8R1.2 ON=C1CCCCC1 MCULE-4628080057 [0,1,0,1,0,0|1,0,1]=4 5235 B8R1.3 C1(CNC(=O)CN1)C MCULE-9891046463 [0,1,0,1,0,0|1,0,0]=3 5236 B8R1.3 C=C1CCC(=O)CC1 MCULE-8766071389 [0,1,0,1,0,0|1,0,1]=4 5237 B8R1.3 C=C1CCC(CC1)C MCULE-8335929583 [0,1,0,1,0,0|2,0,0]=4 5238 B8R1.3 C=C1CCC(CC1)N MCULE-3488509161 [0,1,0,1,0,0|2,0,0]=4 5239 B8R1.3 C=C1CCC(CC1)N MCULE-4928995581 [0,1,0,1,0,0|2,0,0]=4 5240 B8R1.3 C=C1CCN(CC1)C MCULE-8616538841 [0,1,0,1,0,0|2,0,0]=4 5241 B8R1.3 CC1=CCC(=O)CC1 MCULE-5396065385 [0,1,0,1,0,0|1,0,1]=4 5242 B8R1.3 CC1=CCC(CC1)N MCULE-2698586518 [0,1,0,1,0,0|2,0,0]=4 5243 B8R1.3 CC1=NNC(=O)CC1 MCULE-3548202908 [0,1,0,1,0,0|2,0,0]=4 5244 B8R1.3 CC1C=CC(=O)CC1 MCULE-6972928704 [0,1,0,1,0,0|1,0,1]=4 5245 B8R1.3 CC1CC=C(CC1)Cl MCULE-9255462781 [0,1,0,1,0,0|2,0,0]=4 5246 B8R1.3 CC1CCC(=O)CC1 MCULE-5534475096 [0,1,0,1,0,0|1,0,0]=3 5247 B8R1.3 CC1CCC(=O)CC1 MCULE-9038467737 [0,1,0,1,0,0|1,0,0]=3 5248 B8R1.3 CC1CCC(=O)CN1 MCULE-1285022466 [0,1,0,1,0,0|1,0,0]=3 5249 B8R1.3 CC1CCC(=O)CN1 MCULE-9314433387 [0,1,0,1,0,0|1,0,0]=3 5250 B8R1.3 CC1CCC(=O)CO1 MCULE-8334906567 [0,1,0,1,0,0|1,0,0]=3 5251 B8R1.3 CC1CCC(=O)CS1 MCULE-9188619559 [0,1,0,1,0,0|1,0,0]=3 5252 B8R1.3 CC1CCC(=O)NC1 MCULE-1307751847 [0,1,0,1,0,0|1,0,0]=3 5253 B8R1.3 CC1CCC(CO1)O MCULE-8416383333 [0,1,0,1,0,0|1,0,1]=4 5254 B8R1.3 CC1CNC(=O)CN1 MCULE-2050820306 [0,1,0,1,0,0|1,0,0]=3 5255 B8R1.3 CC1CNC(=O)CN1 MCULE-9509469557 [0,1,0,1,0,0|1,0,0]=3 5256 B8R1.3 CC1CNC(=O)CO1 MCULE-6817757578 [0,1,0,1,0,0|1,0,0]=3 5257 B8R1.3 CC1COC(=O)OC1 MCULE-6795228051 [0,1,0,1,0,0|0,0,0]=2 5258 B8R1.3 CC1COC(CN1)C MCULE-4975068364 [0,1,0,1,0,0|1,0,1]=4 5259 B8R1.3 CC1COC(CN1)C MCULE-6443209935 [0,1,0,1,0,0|1,0,1]=4 5260 B8R1.3 CN1CC=C(CC1)Br MCULE-7803632839 [0,1,0,1,0,0|2,0,0]=4 5261 B8R1.3 CN1CC=C(CC1)Br MCULE-9568791028 [0,1,0,1,0,0|2,0,0]=4 5262 B8R1.3 CN1CCC(=O)CC1 MCULE-3370577555 [0,1,0,1,0,0|1,0,0]=3 5263 B8R1.3 CN1CCC(=O)CC1 MCULE-5364011649 [0,1,0,1,0,0|1,0,0]=3 5264 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-4693797730 [0,1,0,1,0,0|1,0,0]=3 5265 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-5991774380 [0,1,0,1,0,0|1,0,0]=3 5266 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-6484213897 [0,1,0,1,0,0|1,0,0]=3 5267 B8R1.3 C[C@@H]1CCC(=O)CN1 MCULE-7346191190 [0,1,0,1,0,0|1,0,0]=3 5268 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-1088991552 [0,1,0,1,0,0|1,0,0]=3 5269 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-1952714815 [0,1,0,1,0,0|1,0,0]=3 5270 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-3350871833 [0,1,0,1,0,0|1,0,0]=3 5271 B8R1.3 C[C@@H]1CNC(=O)CN1 MCULE-9637742350 [0,1,0,1,0,0|1,0,0]=3 5272 B8R1.3 C[C@@H]1CNC(=O)CO1 MCULE-7192421297 [0,1,0,1,0,0|1,0,0]=3 5273 B8R1.3 C[C@@H]1CNC(=O)CO1 MCULE-7394512903 [0,1,0,1,0,0|1,0,0]=3 5274 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-1103945502 [0,1,0,1,0,0|1,0,1]=4 5275 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-1391537108 [0,1,0,1,0,0|1,0,1]=4 5276 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-1946095385 [0,1,0,1,0,0|1,0,1]=4 5277 B8R1.3 C[C@@H]1CO[C@@H](CN1)C MCULE-4549349129 [0,1,0,1,0,0|1,0,1]=4 5278 B8R1.3 C[C@H]1CCC(=O)CN1 MCULE-6334939841 [0,1,0,1,0,0|1,0,0]=3 5279 B8R1.3 C[C@H]1CCC(=O)CN1 MCULE-8476307649 [0,1,0,1,0,0|1,0,0]=3 5280 B8R1.3 C[C@H]1CCC(=O)NC1 MCULE-5712112445 [0,1,0,1,0,0|1,0,0]=3 5281 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-3373819559 [0,1,0,1,0,0|1,0,0]=3 5282 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-4486681671 [0,1,0,1,0,0|1,0,0]=3 5283 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-7180229103 [0,1,0,1,0,0|1,0,0]=3 5284 B8R1.3 C[C@H]1CNC(=O)CN1 MCULE-9466864223 [0,1,0,1,0,0|1,0,0]=3 5285 B8R1.3 C[C@H]1CNC(=O)CO1 MCULE-6169535590 [0,1,0,1,0,0|1,0,0]=3 5286 B8R1.3 C[C@H]1CNC(=O)CO1 MCULE-8876635175 [0,1,0,1,0,0|1,0,0]=3 5287 B8R1.3 C[C@H]1CN[C@@H](CO1)C MCULE-4621250808 [0,1,0,1,0,0|1,0,1]=4 5288 B8R1.3 C[C@H]1CN[C@@H](CO1)C MCULE-7331563103 [0,1,0,1,0,0|1,0,1]=4 5289 B8R1.3 C[C@H]1CO[C@@H](CN1)C MCULE-5045303209 [0,1,0,1,0,0|1,0,1]=4 5290 B8R1.3 C[C@H]1CO[C@@H](CN1)C MCULE-8352332219 [0,1,0,1,0,0|1,0,1]=4 5291 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-1410633938 [0,1,0,1,0,0|1,0,1]=4 5292 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-1498993915 [0,1,0,1,0,0|1,0,1]=4 5293 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-3545205619 [0,1,0,1,0,0|1,0,1]=4 5294 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-5064602423 [0,1,0,1,0,0|1,0,1]=4 5295 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-5773597642 [0,1,0,1,0,0|1,0,1]=4 5296 B8R1.3 C[C@H]1CO[C@H](CN1)C MCULE-6073716335 [0,1,0,1,0,0|1,0,1]=4 5297 B8R1.3 NC1CC=C(CC1)F MCULE-2544035375 [0,1,0,1,0,0|2,0,0]=4 5298 B8R1.3 NC1CC=C(CC1)F MCULE-8564869491 [0,1,0,1,0,0|2,0,0]=4 5299 B8R1.3 NC1CCC(=O)CC1 MCULE-5825363145 [0,1,0,1,0,0|1,0,0]=3 5300 B8R1.3 NC1CCC(=O)CC1 MCULE-6212878324 [0,1,0,1,0,0|1,0,0]=3 5301 B8R1.3 NC1CCC(=O)NC1 MCULE-2677675224 [0,1,0,1,0,0|1,0,0]=3 5302 B8R1.3 NC1CCC(=O)NC1 MCULE-8711968877 [0,1,0,1,0,0|1,0,0]=3 5303 B8R1.3 NC1CCC(=O)NC1 MCULE-8915391016 [0,1,0,1,0,0|1,0,0]=3 5304 B8R1.3 NC1CCS(=O)CC1 MCULE-3451996362 [0,1,0,1,0,0|2,0,0]=4 5305 B8R1.3 NC1CCS(=O)CC1 MCULE-4019175019 [0,1,0,1,0,0|2,0,0]=4 5306 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-5372893548 [0,1,0,1,0,0|1,0,0]=3 5307 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-6411408704 [0,1,0,1,0,0|1,0,0]=3 5308 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-6771263407 [0,1,0,1,0,0|1,0,0]=3 5309 B8R1.3 N[C@@H]1CCC(=O)NC1 MCULE-9035818807 [0,1,0,1,0,0|1,0,0]=3 5310 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-1921494480 [0,1,0,1,0,0|1,0,0]=3 5311 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-4843708987 [0,1,0,1,0,0|1,0,0]=3 5312 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-6599794889 [0,1,0,1,0,0|1,0,0]=3 5313 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-7112568050 [0,1,0,1,0,0|1,0,0]=3 5314 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-9053885307 [0,1,0,1,0,0|1,0,0]=3 5315 B8R1.3 N[C@H]1CCC(=O)NC1 MCULE-9780118077 [0,1,0,1,0,0|1,0,0]=3 5316 B8R1.3 O=C1CCC(=O)CC1 MCULE-5432049567 [0,1,0,1,0,0|1,0,1]=4 5317 B8R1.3 O=C1CCC(=O)NC1 MCULE-8297515560 [0,1,0,1,0,0|1,0,1]=4 5318 B8R1.3 O=C1CCC(=O)OC1 MCULE-5478039984 [0,1,0,1,0,0|0,0,1]=3 5319 B8R1.3 O=C1CCC(CC1)Br MCULE-1177789896 [0,1,0,1,0,0|1,0,0]=3 5320 B8R1.3 O=C1CCC(CC1)Cl MCULE-3647406761 [0,1,0,1,0,0|1,0,0]=3 5321 B8R1.3 O=C1CCC(CC1)F MCULE-5757540710 [0,1,0,1,0,0|1,0,0]=3 5322 B8R1.3 O=C1CCC(CC1)O MCULE-7247867750 [0,1,0,1,0,0|1,0,0]=3 5323 B8R1.3 O=C1CCC(CN1)F MCULE-1848493447 [0,1,0,1,0,0|1,0,0]=3 5324 B8R1.3 O=C1CCC(CN1)O MCULE-4501886280 [0,1,0,1,0,0|1,0,0]=3 5325 B8R1.3 O=C1CCC(CO1)O MCULE-6372408261 [0,1,0,1,0,0|0,0,0]=2 5326 B8R1.3 O=C1CCS(=O)CC1 MCULE-5385870019 [0,1,0,1,0,0|2,0,0]=4 5327 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-3426407148 [0,1,0,1,0,0|1,0,0]=3 5328 B8R1.3 O=C1CC[C@@H](CN1)O MCULE-9592320749 [0,1,0,1,0,0|1,0,0]=3 5329 B8R1.3 O=C1CC[C@H](CN1)O MCULE-1500705916 [0,1,0,1,0,0|1,0,0]=3 5330 B8R1.3 O=C1CC[C@H](CN1)O MCULE-9578240246 [0,1,0,1,0,0|1,0,0]=3 5331 B8R1.3 O=C1COC(=O)CN1 MCULE-4171313774 [0,1,0,1,0,0|1,0,1]=4 5332 B8R1.3 O=C1COC(=O)CO1 MCULE-8927291216 [0,1,0,1,0,0|1,0,1]=4 5333 B8R1.3 O=C1NCC(CN1)O MCULE-7019603243 [0,1,0,1,0,0|2,0,0]=4 5334 B8R1.3 O=S1CCC(CC1)O MCULE-7693506009 [0,1,0,1,0,0|2,0,0]=4 5335 B8R1.3 [C@@H]1(CN[C@@H](CO1)C)C MCULE-3712952908 [0,1,0,1,0,0|1,0,1]=4 5336 B8R1.5 BrC1=C(CCCC1)Br MCULE-3043011492 [0,1,0,1,0,0|2,0,0]=4 5337 B8R1.5 BrC1=CCCCC1Br MCULE-4680116883 [0,1,0,1,0,0|2,0,0]=4 5338 B8R1.5 BrC1CCCOC1Br MCULE-5122148511 [0,1,0,1,0,0|1,0,1]=4 5339 B8R1.5 C=C1CCCCC1O MCULE-3853228524 [0,1,0,1,0,0|2,0,0]=4 5340 B8R1.5 C=C1CCCCC1O MCULE-5911864977 [0,1,0,1,0,0|2,0,0]=4 5341 B8R1.5 C=C1CCCNC1=O MCULE-1867993758 [0,1,0,1,0,0|1,0,1]=4 5342 B8R1.5 CC1=C(CNCC1)Br MCULE-2210558974 [0,1,0,1,0,0|2,0,0]=4 5343 B8R1.5 CC1=C(CNCC1)Br MCULE-2548770953 [0,1,0,1,0,0|2,0,0]=4 5344 B8R1.5 CC1=C(CNCC1)C MCULE-7715400597 [0,1,0,1,0,0|2,0,0]=4 5345 B8R1.5 CC1=C(CNCC1)C MCULE-9843104075 [0,1,0,1,0,0|2,0,0]=4 5346 B8R1.5 CC1=CCCCC1=O MCULE-6245248136 [0,1,0,1,0,0|1,0,0]=3 5347 B8R1.5 CC1=NCCCN1C MCULE-1598225464 [0,1,0,1,0,0|2,0,0]=4 5348 B8R1.5 CC1CCCCC1=O MCULE-6363555535 [0,1,0,1,0,0|1,0,0]=3 5349 B8R1.5 CC1CCCNC1=O MCULE-5295531632 [0,1,0,1,0,0|1,0,0]=3 5350 B8R1.5 CC1CCCOC1=O MCULE-5926029136 [0,1,0,1,0,0|0,0,0]=2 5351 B8R1.5 CC1CCNCC1=O MCULE-8618050685 [0,1,0,1,0,0|1,0,0]=3 5352 B8R1.5 CC1CCNCC1=O MCULE-9238977073 [0,1,0,1,0,0|1,0,0]=3 5353 B8R1.5 CC1CCOCC1=O MCULE-2481965177 [0,1,0,1,0,0|1,0,0]=3 5354 B8R1.5 CC1CNCCC1=O MCULE-6306655160 [0,1,0,1,0,0|1,0,0]=3 5355 B8R1.5 CC1CNCCC1=O MCULE-9018912988 [0,1,0,1,0,0|1,0,0]=3 5356 B8R1.5 CC1CNCCS1=O MCULE-7861495998 [0,1,0,1,0,0|2,0,0]=4 5357 B8R1.5 CC1COCCC1=O MCULE-2694187526 [0,1,0,1,0,0|1,0,0]=3 5358 B8R1.5 CC1CSCCC1=O MCULE-4565033608 [0,1,0,1,0,0|1,0,0]=3 5359 B8R1.5 CC1NCCCC1=O MCULE-1303642695 [0,1,0,1,0,0|1,0,0]=3 5360 B8R1.5 CC1NCCCC1=O MCULE-6618358169 [0,1,0,1,0,0|1,0,0]=3 5361 B8R1.5 CC1NCCNC1=O MCULE-3078767867 [0,1,0,1,0,0|2,0,0]=4 5362 B8R1.5 CC1NCCNC1=O MCULE-9884862705 [0,1,0,1,0,0|2,0,0]=4 5363 B8R1.5 CC1OCCNC1=O MCULE-8812176499 [0,1,0,1,0,0|2,0,0]=4 5364 B8R1.5 CC1SCCCC1=O MCULE-7641066964 [0,1,0,1,0,0|1,0,0]=3 5365 B8R1.5 CC1SCCNC1=O MCULE-1825894745 [0,1,0,1,0,0|2,0,0]=4 5366 B8R1.5 CN1CCCCC1=O MCULE-9619129797 [0,1,0,1,0,0|1,0,0]=3 5367 B8R1.5 CN1CCCNC1=O MCULE-3141639397 [0,1,0,1,0,0|1,0,0]=3 5368 B8R1.5 CN1CCCNC1=S MCULE-2262321761 [0,1,0,1,0,0|1,1,0]=4 5369 B8R1.5 CN1CCNCC1=O MCULE-4783963074 [0,1,0,1,0,0|1,0,0]=3 5370 B8R1.5 CN1CCNCC1=O MCULE-7251084542 [0,1,0,1,0,0|1,0,0]=3 5371 B8R1.5 CN1CCNCC1=O MCULE-9201460493 [0,1,0,1,0,0|1,0,0]=3 5372 B8R1.5 CN1CCNCC1=O MCULE-9789420240 [0,1,0,1,0,0|1,0,0]=3 5373 B8R1.5 CN1CCOCC1=O MCULE-8864378597 [0,1,0,1,0,0|1,0,0]=3 5374 B8R1.5 C[C@@H]1NCCNC1=O MCULE-1719923601 [0,1,0,1,0,0|2,0,0]=4 5375 B8R1.5 C[C@@H]1NCCNC1=O MCULE-3211216058 [0,1,0,1,0,0|2,0,0]=4 5376 B8R1.5 C[C@@H]1NCCNC1=O MCULE-4268624973 [0,1,0,1,0,0|2,0,0]=4 5377 B8R1.5 C[C@H]1CNCCC1=O MCULE-8062269317 [0,1,0,1,0,0|1,0,0]=3 5378 B8R1.5 C[C@H]1CNCCC1=O MCULE-9510433313 [0,1,0,1,0,0|1,0,0]=3 5379 B8R1.5 C[C@H]1COCCC1=O MCULE-3103478095 [0,1,0,1,0,0|1,0,0]=3 5380 B8R1.5 C[C@H]1NCCNC1=O MCULE-1350777729 [0,1,0,1,0,0|2,0,0]=4 5381 B8R1.5 C[C@H]1NCCNC1=O MCULE-3433713206 [0,1,0,1,0,0|2,0,0]=4 5382 B8R1.5 C[C@H]1NCCNC1=O MCULE-6014092524 [0,1,0,1,0,0|2,0,0]=4 5383 B8R1.5 FC1=C(CCCC1)Br MCULE-1560441134 [0,1,0,1,0,0|2,0,0]=4 5384 B8R1.5 NC1CCCCC1=O MCULE-2382898926 [0,1,0,1,0,0|1,0,0]=3 5385 B8R1.5 NC1CCCCC1=O MCULE-9230455128 [0,1,0,1,0,0|1,0,0]=3 5386 B8R1.5 NC1CCCNC1=O MCULE-2560564171 [0,1,0,1,0,0|1,0,0]=3 5387 B8R1.5 NC1CCCNC1=O MCULE-4494449620 [0,1,0,1,0,0|1,0,0]=3 5388 B8R1.5 NC1CCCNC1=O MCULE-7473475906 [0,1,0,1,0,0|1,0,0]=3 5389 B8R1.5 NC1CCCNC1=O MCULE-8288645102 [0,1,0,1,0,0|1,0,0]=3 5390 B8R1.5 NC1COCCC1=O MCULE-2621905094 [0,1,0,1,0,0|2,0,0]=4 5391 B8R1.5 NC1COCCC1=O MCULE-5417580672 [0,1,0,1,0,0|2,0,0]=4 5392 B8R1.5 NN1CCCCC1=O MCULE-3663308028 [0,1,0,1,0,0|1,0,0]=3 5393 B8R1.5 NN1CCCCC1=O MCULE-9929233745 [0,1,0,1,0,0|1,0,0]=3 5394 B8R1.5 NN1CCCNC1=O MCULE-1690172508 [0,1,0,1,0,0|2,0,0]=4 5395 B8R1.5 NN1CCCOC1=O MCULE-6942418314 [0,1,0,1,0,0|1,0,0]=3 5396 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2058435105 [0,1,0,1,0,0|1,0,0]=3 5397 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2444659445 [0,1,0,1,0,0|1,0,0]=3 5398 B8R1.5 N[C@@H]1CCCNC1=O MCULE-3005560472 [0,1,0,1,0,0|1,0,0]=3 5399 B8R1.5 N[C@@H]1CCCNC1=O MCULE-6935410876 [0,1,0,1,0,0|1,0,0]=3 5400 B8R1.5 N[C@H]1CCCNC1=O MCULE-1247931890 [0,1,0,1,0,0|1,0,0]=3 5401 B8R1.5 N[C@H]1CCCNC1=O MCULE-2425510086 [0,1,0,1,0,0|1,0,0]=3 5402 B8R1.5 N[C@H]1CCCNC1=O MCULE-6121950966 [0,1,0,1,0,0|1,0,0]=3 5403 B8R1.5 N[C@H]1CCCNC1=O MCULE-7701042199 [0,1,0,1,0,0|1,0,0]=3 5404 B8R1.5 O=C1CCCC=C1Br MCULE-3661382076 [0,1,0,1,0,0|1,0,1]=4 5405 B8R1.5 O=C1CCCC=C1I MCULE-5006563152 [0,1,0,1,0,0|1,0,1]=4 5406 B8R1.5 O=C1CCCCC1=O MCULE-5770827130 [0,1,0,1,0,0|1,0,0]=3 5407 B8R1.5 O=C1CCCCC1Br MCULE-9356057483 [0,1,0,1,0,0|1,0,0]=3 5408 B8R1.5 O=C1CCCCC1Cl MCULE-1580566298 [0,1,0,1,0,0|1,0,0]=3 5409 B8R1.5 O=C1CCCCC1F MCULE-6406930837 [0,1,0,1,0,0|1,0,0]=3 5410 B8R1.5 O=C1CCCCC1O MCULE-7509366699 [0,1,0,1,0,0|1,0,0]=3 5411 B8R1.5 O=C1CCCNC1=O MCULE-3369124759 [0,1,0,1,0,0|1,0,1]=4 5412 B8R1.5 O=C1CCNCC1Br MCULE-1607524353 [0,1,0,1,0,0|2,0,0]=4 5413 B8R1.5 O=C1CCNCC1Br MCULE-2623420651 [0,1,0,1,0,0|2,0,0]=4 5414 B8R1.5 O=C1CCNCC1Br MCULE-9921456309 [0,1,0,1,0,0|2,0,0]=4 5415 B8R1.5 O=C1CCNCC1F MCULE-4156323292 [0,1,0,1,0,0|2,0,0]=4 5416 B8R1.5 O=C1CCNCC1F MCULE-5488977269 [0,1,0,1,0,0|2,0,0]=4 5417 B8R1.5 O=C1CCNC[C@@H]1F MCULE-1703177711 [0,1,0,1,0,0|2,0,0]=4 5418 B8R1.5 O=C1CCNC[C@@H]1F MCULE-2722101377 [0,1,0,1,0,0|2,0,0]=4 5419 B8R1.5 O=C1CCNC[C@@H]1F MCULE-3843083136 [0,1,0,1,0,0|2,0,0]=4 5420 B8R1.5 O=C1CCNC[C@@H]1F MCULE-8423259867 [0,1,0,1,0,0|2,0,0]=4 5421 B8R1.5 O=C1CCNC[C@H]1F MCULE-4893691455 [0,1,0,1,0,0|2,0,0]=4 5422 B8R1.5 O=C1CCNC[C@H]1F MCULE-7014608979 [0,1,0,1,0,0|2,0,0]=4 5423 B8R1.5 O=C1CCOCC1Br MCULE-1103002154 [0,1,0,1,0,0|2,0,0]=4 5424 B8R1.5 O=C1CCOCC1Cl MCULE-6926183930 [0,1,0,1,0,0|2,0,0]=4 5425 B8R1.5 O=C1CCOCC1F MCULE-8590362767 [0,1,0,1,0,0|2,0,0]=4 5426 B8R1.5 O=C1CCOCC1O MCULE-7032874317 [0,1,0,1,0,0|2,0,0]=4 5427 B8R1.5 O=C1CCOC[C@@H]1Br MCULE-8729201111 [0,1,0,1,0,0|2,0,0]=4 5428 B8R1.5 O=C1CCOC[C@@H]1F MCULE-3075219245 [0,1,0,1,0,0|2,0,0]=4 5429 B8R1.5 O=C1NCCCC1Br MCULE-1860833784 [0,1,0,1,0,0|1,0,0]=3 5430 B8R1.5 O=C1NCCCC1O MCULE-4922755542 [0,1,0,1,0,0|1,0,0]=3 5431 B8R1.5 O=C1NCCC[C@@H]1O MCULE-2813817931 [0,1,0,1,0,0|1,0,0]=3 5432 B8R1.5 O=C1NCCC[C@@H]1O MCULE-3354550946 [0,1,0,1,0,0|1,0,0]=3 5433 B8R1.5 O=C1NCCC[C@H]1O MCULE-2892218765 [0,1,0,1,0,0|1,0,0]=3 5434 B8R1.5 O=C1NCCC[C@H]1O MCULE-8394704933 [0,1,0,1,0,0|1,0,0]=3 5435 B8R1.5 O=C1NCCOC1=O MCULE-5092732656 [0,1,0,1,0,0|1,0,1]=4 5436 B8R1.5 O=C1OCCC=C1Br MCULE-6619697801 [0,1,0,1,0,0|0,0,2]=4 5437 B8R1.5 O=C1OCCCC1Br MCULE-4407787541 [0,1,0,1,0,0|0,0,0]=2 5438 B8R1.5 O=C1OCCCC1O MCULE-3021418071 [0,1,0,1,0,0|0,0,0]=2 5439 B8R1.5 OC1CCCC=C1Br MCULE-1040444564 [0,1,0,1,0,0|2,0,0]=4 5440 B8R1.5 O[C@@H]1CCCC=C1Br MCULE-9847748740 [0,1,0,1,0,0|2,0,0]=4 5441 B8R1.13 C=CCC1CCC1=O MCULE-1128394688 [0,1,0,1,0,0|1,0,1]=4 5442 B8R1.13 CCCC1CCC1=O MCULE-7626165824 [0,1,0,1,0,0|1,0,0]=3 5443 B8R1.13 O=C1CCC1CCCl MCULE-1577834742 [0,1,0,1,0,0|1,0,0]=3 5444 B8R1.22 BrC1=CCCCCC1 MCULE-1629255872 [0,1,0,1,0,0|2,0,0]=4 5445 B8R1.22 C=C1CCCNCC1 MCULE-2798255197 [0,1,0,1,0,0|2,0,0]=4 5446 B8R1.22 C=C1CCCNCC1 MCULE-4874852480 [0,1,0,1,0,0|2,0,0]=4 5447 B8R1.22 C=C1CNCCOC1 MCULE-6114191545 [0,1,0,1,0,0|2,0,0]=4 5448 B8R1.22 C=C1CNCCOC1 MCULE-6722705565 [0,1,0,1,0,0|2,0,0]=4 5449 B8R1.22 C=C1COCCOC1 MCULE-3194930888 [0,1,0,1,0,0|2,0,0]=4 5450 B8R1.22 C=C1OCCCCO1 MCULE-8283334358 [0,1,0,1,0,0|1,0,0]=3 5451 B8R1.22 CC1CNCCCO1 MCULE-6836650488 [0,1,0,1,0,0|1,0,1]=4 5452 B8R1.22 CC1CNCCCO1 MCULE-8246520743 [0,1,0,1,0,0|1,0,1]=4 5453 B8R1.22 C[C@@H]1CCNCCO1 MCULE-4706490422 [0,1,0,1,0,0|1,0,1]=4 5454 B8R1.22 C[C@@H]1CCNCCO1 MCULE-7769149413 [0,1,0,1,0,0|1,0,1]=4 5455 B8R1.22 NC1=NCCCCC1 MCULE-2757008672 [0,1,0,1,0,0|2,0,0]=4 5456 B8R1.22 NC1=NCCCCC1 MCULE-7781415779 [0,1,0,1,0,0|2,0,0]=4 5457 B8R1.22 O=C1C=CCCCC1 MCULE-5281461360 [0,1,0,1,0,0|1,0,0]=3 5458 B8R1.22 O=C1C=CCCCN1 MCULE-6257739832 [0,1,0,1,0,0|1,0,1]=4 5459 B8R1.22 O=C1CCC=CCC1 MCULE-5704984437 [0,1,0,1,0,0|1,0,1]=4 5460 B8R1.22 O=C1CCCCCC1 MCULE-3507111924 [0,1,0,1,0,0|1,0,0]=3 5461 B8R1.22 O=C1CCCCCN1 MCULE-4544579564 [0,1,0,1,0,0|1,0,0]=3 5462 B8R1.22 O=C1CCCCCO1 MCULE-3051096014 [0,1,0,1,0,0|0,0,0]=2 5463 B8R1.22 O=C1CCCCNC1 MCULE-8257380915 [0,1,0,1,0,0|1,0,0]=3 5464 B8R1.22 O=C1CCCCNC1 MCULE-8344538815 [0,1,0,1,0,0|1,0,0]=3 5465 B8R1.22 O=C1CCCNCC1 MCULE-3201401906 [0,1,0,1,0,0|1,0,0]=3 5466 B8R1.22 O=C1CCCNCC1 MCULE-8264253371 [0,1,0,1,0,0|1,0,0]=3 5467 B8R1.22 O=C1CCCOCC1 MCULE-9595066384 [0,1,0,1,0,0|1,0,0]=3 5468 B8R1.22 O=C1CCCSCC1 MCULE-9359592851 [0,1,0,1,0,0|1,0,0]=3 5469 B8R1.22 O=C1CCNCCN1 MCULE-1678306131 [0,1,0,1,0,0|1,0,0]=3 5470 B8R1.22 O=C1CCNCCN1 MCULE-1867860146 [0,1,0,1,0,0|1,0,0]=3 5471 B8R1.22 O=C1CCOCCN1 MCULE-6881734685 [0,1,0,1,0,0|1,0,0]=3 5472 B8R1.22 O=C1CCOCCO1 MCULE-1433837187 [0,1,0,1,0,0|0,0,0]=2 5473 B8R1.22 O=C1CCSCCN1 MCULE-9445131358 [0,1,0,1,0,0|1,0,0]=3 5474 B8R1.22 O=C1CNCCCN1 MCULE-6106237928 [0,1,0,1,0,0|1,0,0]=3 5475 B8R1.22 O=C1CNCCCN1 MCULE-9943393784 [0,1,0,1,0,0|1,0,0]=3 5476 B8R1.22 O=C1CNCCNC1 MCULE-2450825992 [0,1,0,1,0,0|2,0,0]=4 5477 B8R1.22 O=C1CNCCNC1 MCULE-7379420394 [0,1,0,1,0,0|2,0,0]=4 5478 B8R1.22 O=C1CNCCOC1 MCULE-7546546158 [0,1,0,1,0,0|1,0,0]=3 5479 B8R1.22 O=C1CNCCOC1 MCULE-9183427962 [0,1,0,1,0,0|1,0,0]=3 5480 B8R1.22 O=C1COCCCN1 MCULE-1471963909 [0,1,0,1,0,0|1,0,0]=3 5481 B8R1.22 O=C1COCCOC1 MCULE-4481438739 [0,1,0,1,0,0|1,0,0]=3 5482 B8R1.22 O=C1CSCCSC1 MCULE-5039848738 [0,1,0,1,0,0|1,1,0]=4 5483 B8R1.22 O=C1OCCCCO1 MCULE-1107419276 [0,1,0,1,0,0|0,0,0]=2 5484 B8R1.22 O=S1CCCNCC1 MCULE-1954952183 [0,1,0,1,0,0|2,0,0]=4 5485 B8R1.22 O=S1CCCNCC1 MCULE-2035316359 [0,1,0,1,0,0|2,0,0]=4 5486 B8R1.22 O=S1OCCCCO1 MCULE-6898726705 [0,1,0,1,0,0|1,0,0]=3 5487 B8R1.22 S=C1CCCCCN1 MCULE-6573611309 [0,1,0,1,0,0|1,1,0]=4 5488 B8R1.22 S=C1NCCCCN1 MCULE-5312414479 [0,1,0,1,0,0|1,1,0]=4 5489 B8R1.38 C#CC(=O)C1CCC1 MCULE-7044839324 [0,1,0,1,0,0|1,0,1]=4 5490 B8R1.38 C1(CCN1)C(=O)OC MCULE-4001628620 [0,1,0,1,0,0|0,0,0]=2 5491 B8R1.38 C1(CCN1)C(=O)OC MCULE-6304194058 [0,1,0,1,0,0|0,0,0]=2 5492 B8R1.38 C=CC(=O)N1CCC1 MCULE-5467836720 [0,1,0,1,0,0|1,0,1]=4 5493 B8R1.38 CCC(=O)C1CCC1 MCULE-2054282062 [0,1,0,1,0,0|1,0,0]=3 5494 B8R1.38 CCC(=O)C1COC1 MCULE-2036532813 [0,1,0,1,0,0|1,0,0]=3 5495 B8R1.38 CNC(=O)C1CCC1 MCULE-7934051142 [0,1,0,1,0,0|1,0,0]=3 5496 B8R1.38 CNC(=O)C1CNC1 MCULE-1757312789 [0,1,0,1,0,0|1,0,0]=3 5497 B8R1.38 CNC(=O)C1CNC1 MCULE-5774189315 [0,1,0,1,0,0|1,0,0]=3 5498 B8R1.38 CNC(=O)C1CNC1 MCULE-8342593933 [0,1,0,1,0,0|1,0,0]=3 5499 B8R1.38 COC(=O)C1=CCC1 MCULE-5016158090 [0,1,0,1,0,0|0,0,1]=3 5500 B8R1.38 COC(=O)C1CCC1 MCULE-2900002276 [0,1,0,1,0,0|0,0,0]=2 5501 B8R1.38 COC(=O)C1CCN1 MCULE-2766647683 [0,1,0,1,0,0|0,0,0]=2 5502 B8R1.38 COC(=O)C1CCN1 MCULE-6440918459 [0,1,0,1,0,0|0,0,0]=2 5503 B8R1.38 COC(=O)C1CCN1 MCULE-6964468849 [0,1,0,1,0,0|0,0,0]=2 5504 B8R1.38 COC(=O)C1CCO1 MCULE-7860079290 [0,1,0,1,0,0|0,0,0]=2 5505 B8R1.38 COC(=O)C1CNC1 MCULE-5731952071 [0,1,0,1,0,0|0,0,0]=2 5506 B8R1.38 COC(=O)C1CNC1 MCULE-9436948908 [0,1,0,1,0,0|0,0,0]=2 5507 B8R1.38 COC(=O)C1COC1 MCULE-8897565340 [0,1,0,1,0,0|0,0,0]=2 5508 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-4539844768 [0,1,0,1,0,0|0,0,0]=2 5509 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-5257592845 [0,1,0,1,0,0|0,0,0]=2 5510 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-7483834256 [0,1,0,1,0,0|0,0,0]=2 5511 B8R1.38 COC(=O)[C@@H]1CCN1 MCULE-7502882004 [0,1,0,1,0,0|0,0,0]=2 5512 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-1944761309 [0,1,0,1,0,0|0,0,0]=2 5513 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-2075005250 [0,1,0,1,0,0|0,0,0]=2 5514 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-5626630564 [0,1,0,1,0,0|0,0,0]=2 5515 B8R1.38 COC(=O)[C@H]1CCN1 MCULE-8309542560 [0,1,0,1,0,0|0,0,0]=2 5516 B8R1.38 COC(C)C1CNC1 MCULE-5997179380 [0,1,0,1,0,0|1,0,1]=4 5517 B8R1.38 COC(C)C1CNC1 MCULE-8250860953 [0,1,0,1,0,0|1,0,1]=4 5518 B8R1.38 CON(C)C1CNC1 MCULE-1830302155 [0,1,0,1,0,0|2,0,0]=4 5519 B8R1.38 CON(C)C1CNC1 MCULE-7061671019 [0,1,0,1,0,0|2,0,0]=4 5520 B8R1.38 NCC(=O)C1CCC1 MCULE-2102604629 [0,1,0,1,0,0|2,0,0]=4 5521 B8R1.38 NCC(=O)C1CCC1 MCULE-5571071703 [0,1,0,1,0,0|2,0,0]=4 5522 B8R1.38 NCC(=O)N1CCC1 MCULE-3850014745 [0,1,0,1,0,0|2,0,0]=4 5523 B8R1.38 NNC(=O)C1CCC1 MCULE-3104625459 [0,1,0,1,0,0|2,0,0]=4 5524 B8R1.38 O=C(CBr)C1CCC1 MCULE-7056136632 [0,1,0,1,0,0|2,0,0]=4 5525 B8R1.38 O=C(CBr)N1CCC1 MCULE-2341003437 [0,1,0,1,0,0|2,0,0]=4 5526 B8R1.38 O=C(CCl)C1CCC1 MCULE-9286559827 [0,1,0,1,0,0|2,0,0]=4 5527 B8R1.38 O=C(CCl)N1CCC1 MCULE-1485330958 [0,1,0,1,0,0|2,0,0]=4 5528 B8R1.38 O=C(NO)C1CCC1 MCULE-5722727330 [0,1,0,1,0,0|2,0,0]=4 5529 B8R1.47 CNC1CC(C1)OC MCULE-2708223915 [0,1,0,1,0,0|1,0,1]=4 5530 B8R1.47 CNC1CC(C1)OC MCULE-6795006113 [0,1,0,1,0,0|1,0,1]=4 5531 B8R1.47 CN[C@H]1C[C@H](C1)OC MCULE-9779767218 [0,1,0,1,0,0|1,0,1]=4 5532 B8R1.47 COC1CC(C1)CBr MCULE-7547750524 [0,1,0,1,0,0|1,0,1]=4 5533 B8R1.47 COC1CC(C1)CN MCULE-1876436922 [0,1,0,1,0,0|1,0,1]=4 5534 B8R1.47 COC1CC(C1)CN MCULE-2671284483 [0,1,0,1,0,0|1,0,1]=4 5535 B8R1.47 COC1CC(C1)CO MCULE-9110825744 [0,1,0,1,0,0|1,0,1]=4 5536 B8R1.47 CO[C@H]1C[C@@H](C1)CN MCULE-2551820721 [0,1,0,1,0,0|1,0,1]=4 5537 B8R1.47 CO[C@H]1C[C@@H](C1)CN MCULE-3234945341 [0,1,0,1,0,0|1,0,1]=4 5538 B8R1.47 CO[C@H]1C[C@H](C1)CN MCULE-1935507713 [0,1,0,1,0,0|1,0,1]=4 5539 B8R1.47 CO[C@H]1C[C@H](C1)CN MCULE-8411728691 [0,1,0,1,0,0|1,0,1]=4 5540 B8R1.50 CC1=C(C(=O)CC1)Br MCULE-4093496442 [0,1,0,1,0,0|2,0,0]=4 5541 B8R1.50 CC1=C(C(=O)CC1)C MCULE-6370073595 [0,1,0,1,0,0|1,0,0]=3 5542 B8R1.50 CC1=C(C(=O)CC1)O MCULE-2968247012 [0,1,0,1,0,0|2,0,0]=4 5543 B8R1.50 CC1=C(C(=O)CC1)O MCULE-9147894168 [0,1,0,1,0,0|2,0,0]=4 5544 B8R1.50 CC1=C(C(=O)NC1)C MCULE-4444366984 [0,1,0,1,0,0|1,0,1]=4 5545 B8R1.50 CC1=C(C(=O)OC1)O MCULE-7870847121 [0,1,0,1,0,0|0,0,2]=4 5546 B8R1.50 CC1=C(CCC1=O)O MCULE-6367252690 [0,1,0,1,0,0|1,0,1]=4 5547 B8R1.50 CC1=NOC(=O)C1C MCULE-6668573558 [0,1,0,1,0,0|1,0,1]=4 5548 B8R1.50 CC1C(=O)CCC1=O MCULE-4418458735 [0,1,0,1,0,0|1,0,1]=4 5549 B8R1.50 CC1C(=O)CCN1C MCULE-8191851293 [0,1,0,1,0,0|1,0,0]=3 5550 B8R1.50 CC1C(=O)COC1=O MCULE-4188541096 [0,1,0,1,0,0|1,0,1]=4 5551 B8R1.50 CC1CCC(=O)C1=O MCULE-7649396652 [0,1,0,1,0,0|1,0,1]=4 5552 B8R1.50 CC1CCC(=O)N1C MCULE-7405072604 [0,1,0,1,0,0|1,0,0]=3 5553 B8R1.50 CC1CCC(C1=O)C MCULE-1473375660 [0,1,0,1,0,0|1,0,0]=3 5554 B8R1.50 CC1CCN(C1=O)C MCULE-1499213360 [0,1,0,1,0,0|1,0,0]=3 5555 B8R1.50 CC1CNC(=O)C1C MCULE-7439537346 [0,1,0,1,0,0|1,0,0]=3 5556 B8R1.50 CC1NCN(C1=O)C MCULE-2390134887 [0,1,0,1,0,0|2,0,0]=4 5557 B8R1.50 CC1NCN(C1=O)C MCULE-7463423136 [0,1,0,1,0,0|2,0,0]=4 5558 B8R1.50 CC1OCC(=O)C1C MCULE-5834923125 [0,1,0,1,0,0|1,0,0]=3 5559 B8R1.50 CN1C(=O)CCC1=O MCULE-6726005566 [0,1,0,1,0,0|1,0,1]=4 5560 B8R1.50 CN1C(=O)CCC1O MCULE-1070053575 [0,1,0,1,0,0|1,0,0]=3 5561 B8R1.50 CN1CCC(=O)C1=O MCULE-7541521172 [0,1,0,1,0,0|1,0,1]=4 5562 B8R1.50 CN1CCC(C1=O)Br MCULE-9857530514 [0,1,0,1,0,0|1,0,0]=3 5563 B8R1.50 CN1CCC(C1=O)Cl MCULE-5732339719 [0,1,0,1,0,0|1,0,0]=3 5564 B8R1.50 CN1CCC(C1=O)N MCULE-2896853309 [0,1,0,1,0,0|1,0,0]=3 5565 B8R1.50 CN1CCC(C1=O)N MCULE-5951659989 [0,1,0,1,0,0|1,0,0]=3 5566 B8R1.50 CN1CCC(C1=O)O MCULE-6867263123 [0,1,0,1,0,0|1,0,0]=3 5567 B8R1.50 CN1CCN(C1=O)C MCULE-4012400107 [0,1,0,1,0,0|2,0,0]=4 5568 B8R1.50 CN1CC[C@@H](C1=O)N MCULE-3820062607 [0,1,0,1,0,0|1,0,0]=3 5569 B8R1.50 CN1CC[C@@H](C1=O)N MCULE-7270649984 [0,1,0,1,0,0|1,0,0]=3 5570 B8R1.50 CN1CC[C@@H](C1=O)N MCULE-8015311112 [0,1,0,1,0,0|1,0,0]=3 5571 B8R1.50 CN1CC[C@H](C1=O)N MCULE-1278006515 [0,1,0,1,0,0|1,0,0]=3 5572 B8R1.50 CN1CC[C@H](C1=O)N MCULE-3751335664 [0,1,0,1,0,0|1,0,0]=3 5573 B8R1.50 CN1CC[C@H](C1=O)N MCULE-4883949932 [0,1,0,1,0,0|1,0,0]=3 5574 B8R1.50 CN1CC[C@H](C1=O)N MCULE-7143065464 [0,1,0,1,0,0|1,0,0]=3 5575 B8R1.50 NC1CCN(C1=O)O MCULE-3774736319 [0,1,0,1,0,0|2,0,0]=4 5576 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O MCULE-6840872048 [0,1,0,1,0,0|2,0,0]=4 5577 B8R1.50 N[C@@H]1CCN(C1=O)O MCULE-1260256164 [0,1,0,1,0,0|2,0,0]=4 5578 B8R1.50 N[C@@H]1CCN(C1=O)O MCULE-9067133595 [0,1,0,1,0,0|2,0,0]=4 5579 B8R1.50 N[C@H]1CCN(C1=O)O MCULE-1056806464 [0,1,0,1,0,0|2,0,0]=4 5580 B8R1.50 O=C1COC(=O)C1Br MCULE-7458581655 [0,1,0,1,0,0|1,0,1]=4 5581 B8R1.50 O=C1COC(=O)C1Cl MCULE-1326411169 [0,1,0,1,0,0|1,0,1]=4 5582 B8R1.50 O=C1OCC(C1O)O MCULE-9766741798 [0,1,0,1,0,0|1,0,0]=3 5583 B8R1.50 O=C1OC[C@@H]([C@@H]1Br)O MCULE-5447777048 [0,1,0,1,0,0|1,0,0]=3 5584 B8R1.50 O=C1OC[C@@H]([C@@H]1Br)O MCULE-8691985034 [0,1,0,1,0,0|1,0,0]=3 5585 B8R1.50 O=C1OC[C@@H]([C@@H]1O)O MCULE-8629460196 [0,1,0,1,0,0|1,0,0]=3 5586 B8R1.50 O=C1OC[C@@H]([C@H]1O)O MCULE-7303431003 [0,1,0,1,0,0|1,0,0]=3 5587 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-4704805755 [0,1,0,1,0,0|1,0,0]=3 5588 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7070309718 [0,1,0,1,0,0|1,0,0]=3 5589 B8R1.50 O=C1OC[C@H]([C@H]1O)O MCULE-7824820688 [0,1,0,1,0,0|1,0,0]=3 5590 B8R1.52 COC1(CCNC1)C MCULE-2470466297 [0,1,0,1,0,0|1,0,1]=4 5591 B8R1.52 COC1(CCNC1)C MCULE-7307603260 [0,1,0,1,0,0|1,0,1]=4 5592 B8R1.52 CO[C@@]1(CCNC1)C MCULE-4781551854 [0,1,0,1,0,0|1,0,1]=4 5593 B8R1.52 CO[C@@]1(CCNC1)C MCULE-8558958453 [0,1,0,1,0,0|1,0,1]=4 5594 B8R1.52 CO[C@]1(CCNC1)C MCULE-3251974041 [0,1,0,1,0,0|1,0,1]=4 5595 B8R1.52 CO[C@]1(CCNC1)C MCULE-4840363009 [0,1,0,1,0,0|1,0,1]=4 5596 B8R1.58 CCC1(CCC1=O)C MCULE-1365656204 [0,1,0,1,0,0|1,0,0]=3 5597 B8R1.7 CC(=O)C1=CCCC1 MCULE-9623046872 [0,1,0,1,0,0|2,0,0]=4 5598 B8R1.19 CC1(CCCC1=O)C MCULE-2010694408 [0,1,0,1,0,0|1,0,0]=3 5599 B8R1.19 CC1(CCCC1=O)F MCULE-5382994089 [0,1,0,1,0,0|1,0,0]=3 5600 B8R1.19 CC1(CCNC1=O)C MCULE-6714447777 [0,1,0,1,0,0|2,0,0]=4 5601 B8R1.19 CC1(CCNC1=O)C MCULE-7206545498 [0,1,0,1,0,0|2,0,0]=4 5602 B8R1.19 CC1(CCNC1=O)N MCULE-2999548291 [0,1,0,1,0,0|2,0,0]=4 5603 B8R1.19 CC1(CCNC1=O)O MCULE-2802989638 [0,1,0,1,0,0|2,0,0]=4 5604 B8R1.19 CC1(CCOC1=O)Br MCULE-3061445898 [0,1,0,1,0,0|2,0,0]=4 5605 B8R1.19 CC1(CCOC1=O)C MCULE-4294599964 [0,1,0,1,0,0|2,0,0]=4 5606 B8R1.19 CC1(CCOC1=O)N MCULE-5332143573 [0,1,0,1,0,0|2,0,0]=4 5607 B8R1.19 CC1(CCOC1=O)N MCULE-6557455932 [0,1,0,1,0,0|2,0,0]=4 5608 B8R1.19 CC1(COCC1=O)C MCULE-8148059071 [0,1,0,1,0,0|2,0,0]=4 5609 B8R1.19 CC1(NCCC1=O)C MCULE-1973849102 [0,1,0,1,0,0|2,0,0]=4 5610 B8R1.19 CC1(NCCC1=O)C MCULE-6763568764 [0,1,0,1,0,0|2,0,0]=4 5611 B8R1.19 CC1(OCCC1=O)C MCULE-3204846453 [0,1,0,1,0,0|2,0,0]=4 5612 B8R1.19 CC1CCCS1(=O)=O MCULE-2985632984 [0,1,0,1,0,0|2,0,0]=4 5613 B8R1.19 CN1CCCS1(=O)=O MCULE-2950650087 [0,1,0,1,0,0|2,0,0]=4 5614 B8R1.19 O=C1CCCC1(F)F MCULE-7191261042 [0,1,0,1,0,0|2,0,0]=4 5615 B8R1.37 C=CCC(=O)C1CC1 MCULE-6402799206 [0,1,0,1,0,0|1,0,1]=4 5616 B8R1.37 CC(=CCN)C1CC1 MCULE-2607605109 [0,1,0,1,0,0|2,0,0]=4 5617 B8R1.37 CC(=CCO)C1CC1 MCULE-3993521534 [0,1,0,1,0,0|2,0,0]=4 5618 B8R1.37 CCCC(=O)C1CC1 MCULE-5533671390 [0,1,0,1,0,0|1,0,0]=3 5619 B8R1.37 CCOC(=N)C1CC1 MCULE-2588423044 [0,1,0,1,0,0|1,0,0]=3 5620 B8R1.37 CCOC(=N)C1CC1 MCULE-3591830795 [0,1,0,1,0,0|1,0,0]=3 5621 B8R1.37 CCOC(=O)C1CC1 MCULE-1233809766 [0,1,0,1,0,0|0,0,0]=2 5622 B8R1.37 CCOC(=O)C1CO1 MCULE-6286980506 [0,1,0,1,0,0|1,0,0]=3 5623 B8R1.37 CCOC(=O)[C@@H]1CO1 MCULE-2938641654 [0,1,0,1,0,0|1,0,0]=3 5624 B8R1.37 CCOC(=O)[C@@H]1CO1 MCULE-4221865731 [0,1,0,1,0,0|1,0,0]=3 5625 B8R1.37 CCOC(=O)[C@H]1CO1 MCULE-6602474167 [0,1,0,1,0,0|1,0,0]=3 5626 B8R1.37 COCC(=O)C1CC1 MCULE-9169780113 [0,1,0,1,0,0|0,0,0]=2 5627 B8R1.37 COCC(N)C1CC1 MCULE-2784315900 [0,1,0,1,0,0|1,0,1]=4 5628 B8R1.37 COCC(N)C1CC1 MCULE-8580221311 [0,1,0,1,0,0|1,0,1]=4 5629 B8R1.37 COCC(O)C1CC1 MCULE-7802972677 [0,1,0,1,0,0|0,0,2]=4 5630 B8R1.37 CONC(=O)C1CC1 MCULE-1146603952 [0,1,0,1,0,0|0,0,0]=2 5631 B8R1.37 N#CCC(=O)C1CC1 MCULE-4245227049 [0,1,0,1,0,0|1,0,1]=4 5632 B8R1.37 O=C(N=C=S)C1CC1 MCULE-9955071507 [0,1,0,1,0,0|1,0,1]=4 5633 B8R1.37 O=C(OCCl)C1CC1 MCULE-6572714787 [0,1,0,1,0,0|0,0,0]=2 5634 B8R1.37 O=C=NC(=O)C1CC1 MCULE-6167498600 [0,1,0,1,0,0|1,0,1]=4 5635 B8R1.54 CC(=O)C(=O)C1CC1 MCULE-6206613019 [0,1,0,1,0,0|1,0,0]=3 5636 B8R1.54 CC(Br)C(=O)C1CC1 MCULE-4786532022 [0,1,0,1,0,0|1,0,0]=3 5637 B8R1.54 CC(C)C(=O)C1CC1 MCULE-7614369244 [0,1,0,1,0,0|1,0,0]=3 5638 B8R1.54 CN(C)C(=O)C1CC1 MCULE-2661320301 [0,1,0,1,0,0|1,0,0]=3 5639 B8R1.54 C[C@H](Br)C(=O)C1CC1 MCULE-9338949407 [0,1,0,1,0,0|1,0,0]=3 5640 B8R1.54 O=C(O)C(=O)C1CC1 MCULE-2935818452 [0,1,0,1,0,0|2,0,0]=4 5641 B8R1.54 O=C([O-])C(=O)C1CC1 MCULE-3173453359 [0,1,0,1,0,0|2,0,0]=4 5642 B8R1.8 C1(CCCN1)COC MCULE-7740200307 [0,1,0,1,0,0|1,0,1]=4 5643 B8R1.8 CCCC1=CC=CO1 MCULE-9366942285 [0,1,0,1,0,0|1,0,1]=4 5644 B8R1.8 CCCC1=NCCN1 MCULE-9254537375 [0,1,0,1,0,0|2,0,0]=4 5645 B8R1.8 CCCC1=NCCO1 MCULE-4941877816 [0,1,0,1,0,0|1,0,0]=3 5646 B8R1.8 CCCC1=NCCS1 MCULE-8191971237 [0,1,0,1,0,0|1,1,0]=4 5647 B8R1.8 CCCC1=NN=CO1 MCULE-6422922100 [0,1,0,1,0,0|1,0,1]=4 5648 B8R1.8 CCCC1OCCO1 MCULE-1064235053 [0,1,0,1,0,0|0,0,2]=4 5649 B8R1.8 CCCC1OCCS1 MCULE-4434497484 [0,1,0,1,0,0|0,1,1]=4 5650 B8R1.8 CCOC1=NCCC1 MCULE-7392104128 [0,1,0,1,0,0|1,0,0]=3 5651 B8R1.8 CCOC1CCCO1 MCULE-8408094445 [0,1,0,1,0,0|0,0,2]=4 5652 B8R1.8 CNOC1CCCC1 MCULE-4982755353 [0,1,0,1,0,0|1,0,1]=4 5653 B8R1.8 COCC1=NCCS1 MCULE-6899503116 [0,1,0,1,0,0|1,1,0]=4 5654 B8R1.8 COCC1CCCN1 MCULE-3490399589 [0,1,0,1,0,0|1,0,1]=4 5655 B8R1.8 COCC1CCCN1 MCULE-7671263939 [0,1,0,1,0,0|1,0,1]=4 5656 B8R1.8 COC[C@@H]1CCCN1 MCULE-2033169765 [0,1,0,1,0,0|1,0,1]=4 5657 B8R1.8 COC[C@@H]1CCCN1 MCULE-2588521588 [0,1,0,1,0,0|1,0,1]=4 5658 B8R1.8 COC[C@@H]1CCCN1 MCULE-9107605896 [0,1,0,1,0,0|1,0,1]=4 5659 B8R1.8 COC[C@@H]1CCCN1 MCULE-9163912821 [0,1,0,1,0,0|1,0,1]=4 5660 B8R1.8 COC[C@H]1CCCN1 MCULE-4066409185 [0,1,0,1,0,0|1,0,1]=4 5661 B8R1.8 COC[C@H]1CCCN1 MCULE-4591980137 [0,1,0,1,0,0|1,0,1]=4 5662 B8R1.8 COC[C@H]1CCCN1 MCULE-4935200138 [0,1,0,1,0,0|1,0,1]=4 5663 B8R1.8 COC[C@H]1CCCN1 MCULE-7300265857 [0,1,0,1,0,0|1,0,1]=4 5664 B8R1.8 CONC1CCCC1 MCULE-2334525824 [0,1,0,1,0,0|1,0,1]=4 5665 B8R1.8 CONC1CCCC1 MCULE-8234744945 [0,1,0,1,0,0|1,0,1]=4 5666 B8R1.8 ClCOC1CCCC1 MCULE-5114597793 [0,1,0,1,0,0|1,0,1]=4 5667 B8R1.11 C=CN1CCCC1=O MCULE-3025814103 [0,1,0,1,0,0|1,0,1]=4 5668 B8R1.11 CCC1CCCC1=O MCULE-1884299455 [0,1,0,1,0,0|1,0,0]=3 5669 B8R1.11 CCC1CCNC1=O MCULE-8307536027 [0,1,0,1,0,0|1,0,0]=3 5670 B8R1.11 CCC1CCOC1=O MCULE-2375464273 [0,1,0,1,0,0|0,0,0]=2 5671 B8R1.11 CCC1COCC1=O MCULE-5486171882 [0,1,0,1,0,0|0,0,0]=2 5672 B8R1.11 CCC1COCC1N MCULE-2113082654 [0,1,0,1,0,0|1,0,1]=4 5673 B8R1.11 CCN1CCCC1=O MCULE-7206309773 [0,1,0,1,0,0|1,0,0]=3 5674 B8R1.11 CCN1CCCC1=O MCULE-7415495937 [0,1,0,1,0,0|1,0,0]=3 5675 B8R1.11 CCN1CCNC1=O MCULE-8168665695 [0,1,0,1,0,0|2,0,0]=4 5676 B8R1.11 CCN1CNCC1=O MCULE-2327338525 [0,1,0,1,0,0|2,0,0]=4 5677 B8R1.11 CN1CCC[C@H]1C=O MCULE-5852490757 [0,1,0,1,0,0|1,0,1]=4 5678 B8R1.11 CNC1CCNC1=O MCULE-1302732570 [0,1,0,1,0,0|2,0,0]=4 5679 B8R1.11 CNC1CCNC1=O MCULE-7065523709 [0,1,0,1,0,0|2,0,0]=4 5680 B8R1.11 COC1=CCCC1=O MCULE-2849263860 [0,1,0,1,0,0|0,0,1]=3 5681 B8R1.11 COC1CCCC1=O MCULE-2741778082 [0,1,0,1,0,0|0,0,0]=2 5682 B8R1.11 COC1CCCC1Br MCULE-2771155480 [0,1,0,1,0,0|1,0,1]=4 5683 B8R1.11 COC1CCCC1N MCULE-8362175674 [0,1,0,1,0,0|1,0,1]=4 5684 B8R1.11 COC1CCCC1N MCULE-9069118012 [0,1,0,1,0,0|1,0,1]=4 5685 B8R1.11 COC1CCOC1=O MCULE-6321591157 [0,1,0,1,0,0|1,0,0]=3 5686 B8R1.11 COC1COCC1=O MCULE-2097991610 [0,1,0,1,0,0|1,0,0]=3 5687 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-4692120885 [0,1,0,1,0,0|1,0,1]=4 5688 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-5926423252 [0,1,0,1,0,0|1,0,1]=4 5689 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-7482120389 [0,1,0,1,0,0|1,0,1]=4 5690 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-8564106437 [0,1,0,1,0,0|1,0,1]=4 5691 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-3230499380 [0,1,0,1,0,0|1,0,1]=4 5692 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-3289874569 [0,1,0,1,0,0|1,0,1]=4 5693 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-6247013104 [0,1,0,1,0,0|1,0,1]=4 5694 B8R1.11 CO[C@@H]1CCC[C@H]1O MCULE-8222306700 [0,1,0,1,0,0|0,0,2]=4 5695 B8R1.11 CO[C@H]1CCC[C@@H]1N MCULE-2030514470 [0,1,0,1,0,0|1,0,1]=4 5696 B8R1.11 CO[C@H]1CCC[C@@H]1N MCULE-7221434150 [0,1,0,1,0,0|1,0,1]=4 5697 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-5694225216 [0,1,0,1,0,0|1,0,1]=4 5698 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-6324790556 [0,1,0,1,0,0|1,0,1]=4 5699 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-7994033941 [0,1,0,1,0,0|1,0,1]=4 5700 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-9253743808 [0,1,0,1,0,0|1,0,1]=4 5701 B8R1.11 N#CC1CCCC1=O MCULE-6254621629 [0,1,0,1,0,0|1,0,1]=4 5702 B8R1.11 N#CC1CCOC1=O MCULE-4716981850 [0,1,0,1,0,0|1,0,1]=4 5703 B8R1.11 N#CC1COCC1=O MCULE-8235489299 [0,1,0,1,0,0|1,0,1]=4 5704 B8R1.11 N#C[C@H]1COCC1=O MCULE-3727267765 [0,1,0,1,0,0|1,0,1]=4 5705 B8R1.11 NCC1CCCC1=O MCULE-4144323636 [0,1,0,1,0,0|1,0,0]=3 5706 B8R1.11 NCC1CCCC1=O MCULE-8761719757 [0,1,0,1,0,0|1,0,0]=3 5707 B8R1.11 NCC1CCOC1=O MCULE-5843107965 [0,1,0,1,0,0|1,0,0]=3 5708 B8R1.11 NCC1CCOC1=O MCULE-6077637171 [0,1,0,1,0,0|1,0,0]=3 5709 B8R1.11 NOC1CCOC1=O MCULE-1912651031 [0,1,0,1,0,0|2,0,0]=4 5710 B8R1.11 O=C1CCC=C1CO MCULE-5949194155 [0,1,0,1,0,0|1,0,1]=4 5711 B8R1.11 O=C1CCCC1CO MCULE-9171970685 [0,1,0,1,0,0|1,0,0]=3 5712 B8R1.11 O=C1CCCN1CBr MCULE-1337183945 [0,1,0,1,0,0|1,0,0]=3 5713 B8R1.11 O=C1CCCN1CCl MCULE-6204630639 [0,1,0,1,0,0|1,0,0]=3 5714 B8R1.11 O=C1CCCN1CO MCULE-6508920438 [0,1,0,1,0,0|1,0,0]=3 5715 B8R1.11 O=C1CNCN1CO MCULE-1880077159 [0,1,0,1,0,0|2,0,0]=4 5716 B8R1.11 O=C1CNCN1CO MCULE-4265247225 [0,1,0,1,0,0|2,0,0]=4 5717 B8R1.11 O=C1NCCC1CO MCULE-8442279545 [0,1,0,1,0,0|2,0,0]=4 5718 B8R1.11 O=C1NCC[C@@H]1CO MCULE-5339343040 [0,1,0,1,0,0|2,0,0]=4 5719 B8R1.11 O=CC1=C(CCC1)Cl MCULE-2468041387 [0,1,0,1,0,0|2,0,0]=4 5720 B8R1.11 O=CC1CCOC1=O MCULE-6358043470 [0,1,0,1,0,0|1,0,1]=4 5721 B8R1.11 O=CN1CCCC1=O MCULE-1097328464 [0,1,0,1,0,0|1,0,1]=4 5722 B8R1.66 COCC1(CCC1)N MCULE-2225460146 [0,1,0,1,0,0|1,0,1]=4 5723 B8R1.66 COCC1(CCC1)N MCULE-6251408388 [0,1,0,1,0,0|1,0,1]=4 5724 B8R1.39 CC1(CC1)C(=O)CBr MCULE-9435700009 [0,1,0,1,0,0|2,0,0]=4 5725 B8R1.39 CC1(CC1)C(=O)CCl MCULE-5713988608 [0,1,0,1,0,0|2,0,0]=4 5726 B8R1.39 CC1(CC1)C(=O)CN MCULE-2015892200 [0,1,0,1,0,0|2,0,0]=4 5727 B8R1.39 CC1(CC1)C(=O)NN MCULE-2792690923 [0,1,0,1,0,0|2,0,0]=4 5728 B8R1.39 CNC(=O)C1(CC1)N MCULE-5670276563 [0,1,0,1,0,0|1,0,0]=3 5729 B8R1.39 COC(=O)C1(CC1)Br MCULE-3569653934 [0,1,0,1,0,0|0,0,0]=2 5730 B8R1.39 COC(=O)C1(CC1)C MCULE-1688202939 [0,1,0,1,0,0|0,0,0]=2 5731 B8R1.39 COC(=O)C1(CC1)F MCULE-5595108152 [0,1,0,1,0,0|0,0,0]=2 5732 B8R1.39 COC(=O)C1(CC1)N MCULE-7742849761 [0,1,0,1,0,0|0,0,0]=2 5733 B8R1.39 COC(=O)C1(CC1)N MCULE-8414845491 [0,1,0,1,0,0|0,0,0]=2 5734 B8R1.39 COC(=O)C1(CC1)O MCULE-3205655719 [0,1,0,1,0,0|0,0,0]=2 5735 B8R1.39 COC(=O)C1(CO1)C MCULE-9345493771 [0,1,0,1,0,0|1,0,0]=3 5736 B8R1.39 NNC(=O)C1(CC1)O MCULE-4091057496 [0,1,0,1,0,0|2,0,0]=4 5737 B8R1.39 O=C(CBr)C1(CC1)Cl MCULE-8877577446 [0,1,0,1,0,0|2,0,0]=4 5738 B8R1.39 O=C(CBr)C1(CC1)F MCULE-9417589315 [0,1,0,1,0,0|2,0,0]=4 5739 B8R1.39 O=C(CCl)C1(CC1)Cl MCULE-5430408633 [0,1,0,1,0,0|2,0,0]=4 5740 B8R1.39 O=C(CCl)C1(CC1)F MCULE-4434710140 [0,1,0,1,0,0|2,0,0]=4 5741 B8R1.72 C[Si]1(CCCCO1)C MCULE-8051030048 [0,1,0,1,0,0|1,1,0]=4 5742 B8R1.72 N=S1(=O)CCCCC1 MCULE-8920208485 [0,1,0,1,0,0|2,0,0]=4 5743 B8R1.72 O=S1(=O)CCCCN1 MCULE-6296400181 [0,1,0,1,0,0|2,0,0]=4 5744 B8R1.72 O=S1(=O)CCCCO1 MCULE-8722166220 [0,1,0,1,0,0|1,0,0]=3 5745 B8R1.72 O=S1(=O)OCCCO1 MCULE-8391650877 [0,1,0,1,0,0|2,0,0]=4 5746 B8R1.33 COC(C=O)C1CC1 MCULE-3422346780 [0,1,0,1,0,0|0,0,1]=3 5747 B8R1.33 COC(CBr)C1CC1 MCULE-8355863566 [0,1,0,1,0,0|1,0,1]=4 5748 B8R1.33 COC(CN)C1CC1 MCULE-4297813094 [0,1,0,1,0,0|1,0,1]=4 5749 B8R1.33 COC(CO)C1CC1 MCULE-9815577002 [0,1,0,1,0,0|0,0,2]=4 5750 B8R1.60 COC1(CCC1)C#N MCULE-9136067247 [0,1,0,1,0,0|1,0,1]=4 5751 B8R1.60 COC1(CCC1)CBr MCULE-3758534248 [0,1,0,1,0,0|1,0,1]=4 5752 B8R1.60 COC1(CCC1)CN MCULE-2750136950 [0,1,0,1,0,0|1,0,1]=4 5753 B8R1.60 COC1(CCC1)CO MCULE-4115867543 [0,1,0,1,0,0|0,0,2]=4 5754 B8R1.60 COC1(CCC1)OC MCULE-7220801415 [0,1,0,1,0,0|0,0,2]=4 5755 B8R1.60 CSC1(CCC1)C=O MCULE-8595554657 [0,1,0,1,0,0|0,1,1]=4 5756 B8R2.55 C1CCC2(C1)CO2 MCULE-3685762990 [0,0,0,2,0,0|1,0,1]=4 5757 B8R2.4 O=C1CC2CC1C2 MCULE-5372379094 [0,0,0,2,0,0|1,0,0]=3 5758 B8R2.18 O=C1CC2CC2C1 MCULE-4411193370 [0,0,0,2,0,0|1,0,0]=3 5759 B8R2.18 O=C1CC2CC2N1 MCULE-6301280583 [0,0,0,2,0,0|1,0,0]=3 5760 B8R2.18 O=C1CC2OC2C1 MCULE-2497020989 [0,0,0,2,0,0|2,0,0]=4 5761 B8R2.18 O=C1C[C@@H]2C[C@@H]2C1 MCULE-3069760916 [0,0,0,2,0,0|1,0,0]=3 5762 B8R2.38 O=C1CCC2C1C2 MCULE-4714285285 [0,0,0,2,0,0|1,0,0]=3 5763 B8R2.38 O=C1CCC2C1O2 MCULE-5532735099 [0,0,0,2,0,0|2,0,0]=4 5764 B8R2.38 O=C1CC[C@@H]2[C@H]1C2 MCULE-7728867768 [0,0,0,2,0,0|1,0,0]=3 5765 B8R2.38 O=C1CC[C@H]2[C@@H]1C2 MCULE-1007541778 [0,0,0,2,0,0|1,0,0]=3 5766 B8R2.38 O=C1CC[C@H]2[C@@H]1C2 MCULE-8077752466 [0,0,0,2,0,0|1,0,0]=3 5767 B8R2.38 O=C1NCC2C1C2 MCULE-5593114305 [0,0,0,2,0,0|1,0,0]=3 5768 B8R2.38 O=C1NC[C@H]2[C@@H]1C2 MCULE-6438081695 [0,0,0,2,0,0|1,0,0]=3 5769 B8R2.2 CC12CCCC1O2 MCULE-5518981528 [0,0,0,2,0,0|1,0,1]=4 5770 B8R2.19 O=C1CCC12CC2 MCULE-6343718897 [0,0,0,2,0,0|1,0,0]=3 5771 B8R2.41 CC1(CO1)C2CC2 MCULE-3916895683 [0,0,0,2,0,0|1,0,1]=4