0 B8R0.2 C=CC(C)C(C)C(=O)O MCULE-6762624939 [0,0,0,0,0,0|1,0,2]=3 1 B8R0.2 CC(=O)C(O)C(O)CO MCULE-1853649042 [0,0,0,0,0,0|4,0,0]=4 2 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO MCULE-9565941206 [0,0,0,0,0,0|4,0,0]=4 3 B8R0.2 CCC(=O)C(C)C(=O)O MCULE-9192813670 [0,0,0,0,0,0|2,0,1]=3 4 B8R0.2 CCC(C)C(=O)C(=O)O MCULE-2376245949 [0,0,0,0,0,0|1,0,1]=2 5 B8R0.2 CCC(C)C(=O)C(=O)[O-] MCULE-9099284149 [0,0,0,0,0,0|1,0,2]=3 6 B8R0.2 CCC(C)C(Br)C(=O)O MCULE-1124609284 [0,0,0,0,0,0|1,0,0]=1 7 B8R0.2 CCC(C)C(C)C(=O)C MCULE-4030096724 [0,0,0,0,0,0|2,0,0]=2 8 B8R0.2 CCC(C)C(C)C(=O)O MCULE-9360443230 [0,0,0,0,0,0|1,0,0]=1 9 B8R0.2 CCC(C)C(C)C(C)O MCULE-2099710154 [0,0,0,0,0,0|2,0,1]=3 10 B8R0.2 CCC(C)C(N)C(=O)N MCULE-7314175276 [0,0,0,0,0,0|1,0,0]=1 11 B8R0.2 CCC(C)C(N)C(=O)N MCULE-8895055670 [0,0,0,0,0,0|1,0,0]=1 12 B8R0.2 CCC(C)C(N)C(=O)O MCULE-9861955295 [0,0,0,0,0,0|0,0,0]=0 13 B8R0.2 CCC(C)C(O)C(=O)N MCULE-2649023234 [0,0,0,0,0,0|2,0,0]=2 14 B8R0.2 CCC(C)C(O)C(=O)O MCULE-4300622531 [0,0,0,0,0,0|1,0,0]=1 15 B8R0.2 CCC(C)C(O)C(C)C MCULE-1108508487 [0,0,0,0,0,0|3,0,1]=4 16 B8R0.2 CCC(O)C(C)C(=O)O MCULE-7278088016 [0,0,0,0,0,0|2,0,0]=2 17 B8R0.2 CCC(O)C(N)C(=O)O MCULE-5277569808 [0,0,0,0,0,0|1,0,0]=1 18 B8R0.2 CCC(O)[C@H](N)C(=O)O MCULE-7480930876 [0,0,0,0,0,0|1,0,0]=1 19 B8R0.2 CCN(C)C(C)C(=O)O MCULE-6064336068 [0,0,0,0,0,0|2,0,0]=2 20 B8R0.2 CCN(C)[C@@H](C)C(=O)O MCULE-9158211664 [0,0,0,0,0,0|2,0,0]=2 21 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-1413119398 [0,0,0,0,0,0|0,0,0]=0 22 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-5186925599 [0,0,0,0,0,0|0,0,0]=0 23 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O MCULE-5041492133 [0,0,0,0,0,0|1,0,0]=1 24 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-2706440971 [0,0,0,0,0,0|0,0,0]=0 25 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-8101207882 [0,0,0,0,0,0|0,0,0]=0 26 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-1048734191 [0,0,0,0,0,0|1,0,0]=1 27 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-1935827385 [0,0,0,0,0,0|1,0,0]=1 28 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-8753855708 [0,0,0,0,0,0|1,0,0]=1 29 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-9854510560 [0,0,0,0,0,0|1,0,0]=1 30 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1200159118 [0,0,0,0,0,0|0,0,0]=0 31 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1359318144 [0,0,0,0,0,0|0,0,0]=0 32 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-9629903099 [0,0,0,0,0,0|0,0,0]=0 33 B8R0.2 CC[C@H](C)[C@@H](O)C(=O)O MCULE-6017510763 [0,0,0,0,0,0|1,0,0]=1 34 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-1760352503 [0,0,0,0,0,0|1,0,0]=1 35 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-2341573677 [0,0,0,0,0,0|1,0,0]=1 36 B8R0.2 CC[C@H](C)[C@H](N)C(=O)N MCULE-3415036603 [0,0,0,0,0,0|1,0,0]=1 37 B8R0.2 CC[C@H](C)[C@H](N)C(=O)N MCULE-9677139342 [0,0,0,0,0,0|1,0,0]=1 38 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-2215911951 [0,0,0,0,0,0|0,0,0]=0 39 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-3217669453 [0,0,0,0,0,0|0,0,0]=0 40 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-2804875804 [0,0,0,0,0,0|1,0,0]=1 41 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-4272353967 [0,0,0,0,0,0|1,0,0]=1 42 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-6087026464 [0,0,0,0,0,0|1,0,0]=1 43 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-2118005753 [0,0,0,0,0,0|1,0,0]=1 44 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-2420221886 [0,0,0,0,0,0|1,0,0]=1 45 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-7168739287 [0,0,0,0,0,0|1,0,0]=1 46 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-7351381830 [0,0,0,0,0,0|1,0,0]=1 47 B8R0.2 COC(=O)C(C)C(=O)O MCULE-6548116408 [0,0,0,0,0,0|3,0,1]=4 48 B8R0.2 COC(=O)C(N)C(=O)C MCULE-6003738013 [0,0,0,0,0,0|3,0,1]=4 49 B8R0.2 COC(=O)C(N)C(=O)C MCULE-6286319401 [0,0,0,0,0,0|3,0,1]=4 50 B8R0.2 COC(=O)C(N)C(=O)O MCULE-2696171130 [0,0,0,0,0,0|2,0,1]=3 51 B8R0.2 COC(=O)C(N)C(=O)O MCULE-7192453479 [0,0,0,0,0,0|2,0,1]=3 52 B8R0.2 COC(=O)[C@@H](N)C(=O)O MCULE-3813999303 [0,0,0,0,0,0|2,0,1]=3 53 B8R0.2 COC(=O)[C@@H](N)C(=O)O MCULE-7475117362 [0,0,0,0,0,0|2,0,1]=3 54 B8R0.2 COC(C)C(Br)C(=O)O MCULE-2500266383 [0,0,0,0,0,0|2,0,0]=2 55 B8R0.2 COC(C)C(O)C(=O)O MCULE-2673265957 [0,0,0,0,0,0|2,0,0]=2 56 B8R0.2 COC(C)C([NH3+])C(=O)[O-] MCULE-9174020309 [0,0,0,0,0,0|1,0,2]=3 57 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O MCULE-2479965444 [0,0,0,0,0,0|1,0,0]=1 58 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O MCULE-3288712191 [0,0,0,0,0,0|1,0,0]=1 59 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O MCULE-6827226453 [0,0,0,0,0,0|1,0,0]=1 60 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O MCULE-6762158780 [0,0,0,0,0,0|1,0,0]=1 61 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O MCULE-9087542117 [0,0,0,0,0,0|1,0,0]=1 62 B8R0.2 CO[C@H](C)[C@@H](N)C(=O)O MCULE-6235935164 [0,0,0,0,0,0|1,0,0]=1 63 B8R0.2 CO[C@H](C)[C@@H](N)C(=O)O MCULE-6758536252 [0,0,0,0,0,0|1,0,0]=1 64 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O MCULE-7334607468 [0,0,0,0,0,0|1,0,0]=1 65 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O MCULE-8564530384 [0,0,0,0,0,0|1,0,0]=1 66 B8R0.2 CSC(C)C(N)C(=O)O MCULE-6226096646 [0,0,0,0,0,0|1,0,0]=1 67 B8R0.2 O=C(O)C(O)C(O)CO MCULE-1397527919 [0,0,0,0,0,0|3,0,0]=3 68 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-1531474304 [0,0,0,0,0,0|3,0,0]=3 69 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-3829421433 [0,0,0,0,0,0|3,0,0]=3 70 B8R0.2 O=C([O-])C(O)C(O)CO MCULE-4453733473 [0,0,0,0,0,0|3,0,1]=4 71 B8R0.2 O=C([O-])[C@H](O)[C@H](O)CO MCULE-1044422592 [0,0,0,0,0,0|3,0,1]=4 72 B8R0.2 O=C([O-])[C@H](O)[C@H](O)CO MCULE-1805281668 [0,0,0,0,0,0|3,0,1]=4 73 B8R0.2 [C@H](C)(CC)[C@H](N)C(=O)N MCULE-1416545198 [0,0,0,0,0,0|1,0,0]=1 74 B8R0.2 [C@H](C)(CC)[C@H](N)C(=O)N MCULE-1950370478 [0,0,0,0,0,0|1,0,0]=1 75 B7R0.2 C#CC(C)CC(=O)O MCULE-8780802803 [1,0,0,0,0,0|0,0,2]=3 76 B7R0.2 C(O)(CN)CC(=O)O MCULE-8378388788 [1,0,0,0,0,0|2,0,0]=3 77 B7R0.2 C=C(C)CC(C)CC MCULE-1001667584 [1,0,0,0,0,0|2,0,0]=3 78 B7R0.2 C=CC(C)CC(=O)O MCULE-4817084034 [1,0,0,0,0,0|0,0,2]=3 79 B7R0.2 C=CC(N)CC(=O)O MCULE-1733618438 [1,0,0,0,0,0|1,0,2]=4 80 B7R0.2 C=CC(N)CC(=O)O MCULE-9636299966 [1,0,0,0,0,0|1,0,2]=4 81 B7R0.2 C=CC(O)CC(=O)O MCULE-2383393271 [1,0,0,0,0,0|1,0,2]=4 82 B7R0.2 CC(=O)NC(C)CN MCULE-4226474809 [1,0,0,0,0,0|3,0,0]=4 83 B7R0.2 CC(=O)NC(C)CN MCULE-7570690280 [1,0,0,0,0,0|3,0,0]=4 84 B7R0.2 CC(=O)NC(C)CO MCULE-9455210462 [1,0,0,0,0,0|3,0,0]=4 85 B7R0.2 CC(=O)N[C@H](C)CO MCULE-2174899443 [1,0,0,0,0,0|3,0,0]=4 86 B7R0.2 CC(=O)N[C@H](C)CO MCULE-5097293473 [1,0,0,0,0,0|3,0,0]=4 87 B7R0.2 CC(CC(=O)O)NN MCULE-2614719429 [1,0,0,0,0,0|2,0,0]=3 88 B7R0.2 CC(CC(=O)O)NN MCULE-2739806820 [1,0,0,0,0,0|2,0,0]=3 89 B7R0.2 CC(CCl)CC(=O)Cl MCULE-3163826919 [1,0,0,0,0,0|2,0,0]=3 90 B7R0.2 CC(CCl)OC(=O)N MCULE-7734729292 [1,0,0,0,0,0|3,0,0]=4 91 B7R0.2 CC(CN)CC(=O)O MCULE-1594242184 [1,0,0,0,0,0|1,0,0]=2 92 B7R0.2 CC(CN)CC(=O)O MCULE-8074816359 [1,0,0,0,0,0|1,0,0]=2 93 B7R0.2 CC(O)CC(C)CN MCULE-3086796159 [1,0,0,0,0,0|2,0,1]=4 94 B7R0.2 CCC(=CC(=O)O)C MCULE-3864767099 [1,0,0,0,0,0|0,0,2]=3 95 B7R0.2 CCC(=O)CC(=O)C MCULE-1892470405 [1,0,0,0,0,0|2,0,1]=4 96 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [1,0,0,0,0,0|1,0,1]=3 97 B7R0.2 CCC(C)CB(O)O MCULE-4978906892 [1,0,0,0,0,0|1,0,1]=3 98 B7R0.2 CCC(C)CC(=N)N MCULE-6434778899 [1,0,0,0,0,0|2,0,0]=3 99 B7R0.2 CCC(C)CC(=N)N MCULE-7964734356 [1,0,0,0,0,0|2,0,0]=3 100 B7R0.2 CCC(C)CC(=O)C MCULE-5801548800 [1,0,0,0,0,0|1,0,0]=2 101 B7R0.2 CCC(C)CC(=O)Cl MCULE-3063561496 [1,0,0,0,0,0|1,0,0]=2 102 B7R0.2 CCC(C)CC(=O)O MCULE-3409782202 [1,0,0,0,0,0|0,0,0]=1 103 B7R0.2 CCC(C)CC(=O)O MCULE-6537278030 [1,0,0,0,0,0|0,0,0]=1 104 B7R0.2 CCC(C)CC(C)C MCULE-9492683095 [1,0,0,0,0,0|2,0,1]=4 105 B7R0.2 CCC(C)CC(C)N MCULE-2633957870 [1,0,0,0,0,0|2,0,1]=4 106 B7R0.2 CCC(C)CC(C)N MCULE-5740038174 [1,0,0,0,0,0|2,0,1]=4 107 B7R0.2 CCC(C)NC(=O)N MCULE-6186330882 [1,0,0,0,0,0|2,0,0]=3 108 B7R0.2 CCC(C)NC(=S)N MCULE-8856391382 [1,0,0,0,0,0|2,1,0]=4 109 B7R0.2 CCC(C)OC(=O)C MCULE-8410375215 [1,0,0,0,0,0|2,0,0]=3 110 B7R0.2 CCC(C)OC(=O)Cl MCULE-1512790698 [1,0,0,0,0,0|2,0,0]=3 111 B7R0.2 CCC(C)SC(=O)Cl MCULE-4681925921 [1,0,0,0,0,0|2,0,0]=3 112 B7R0.2 CCC(N)CC(=O)O MCULE-1744910444 [1,0,0,0,0,0|1,0,0]=2 113 B7R0.2 CCC(N)CC(=O)O MCULE-5610499925 [1,0,0,0,0,0|1,0,0]=2 114 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [1,0,0,0,0,0|2,0,1]=4 115 B7R0.2 CCC(O)CC(=O)C MCULE-1222748729 [1,0,0,0,0,0|2,0,0]=3 116 B7R0.2 CCC(O)CC(=O)O MCULE-4663578527 [1,0,0,0,0,0|1,0,0]=2 117 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [1,0,0,0,0,0|2,0,1]=4 118 B7R0.2 CCC(O)CN(=O)=O MCULE-6965491054 [1,0,0,0,0,0|2,0,1]=4 119 B7R0.2 CCN(C)CC(=O)C MCULE-5302720081 [1,0,0,0,0,0|2,0,0]=3 120 B7R0.2 CCN(C)CC(=O)C MCULE-7283054437 [1,0,0,0,0,0|2,0,0]=3 121 B7R0.2 CCN(C)CC(=O)O MCULE-3102395413 [1,0,0,0,0,0|1,0,0]=2 122 B7R0.2 CCS(=O)CC(=O)O MCULE-5648298475 [1,0,0,0,0,0|2,0,0]=3 123 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-5550070887 [1,0,0,0,0,0|0,0,0]=1 124 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-9572363620 [1,0,0,0,0,0|0,0,0]=1 125 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-1158271004 [1,0,0,0,0,0|1,0,0]=2 126 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-2354820947 [1,0,0,0,0,0|1,0,0]=2 127 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-4284161835 [1,0,0,0,0,0|1,0,0]=2 128 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-9523089766 [1,0,0,0,0,0|1,0,0]=2 129 B7R0.2 CC[C@H](C)CC(=O)O MCULE-4177365854 [1,0,0,0,0,0|0,0,0]=1 130 B7R0.2 CC[C@H](C)CC(=O)O MCULE-5173108207 [1,0,0,0,0,0|0,0,0]=1 131 B7R0.2 CC[C@H](N)CC(=O)O MCULE-1463536674 [1,0,0,0,0,0|1,0,0]=2 132 B7R0.2 CC[C@H](N)CC(=O)O MCULE-2865599647 [1,0,0,0,0,0|1,0,0]=2 133 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4506847599 [1,0,0,0,0,0|1,0,0]=2 134 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4819674539 [1,0,0,0,0,0|1,0,0]=2 135 B7R0.2 CN(C=O)CC(=O)O MCULE-2679649056 [1,0,0,0,0,0|2,0,1]=4 136 B7R0.2 CN(CC(=O)O)N=O MCULE-5473244336 [1,0,0,0,0,0|3,0,0]=4 137 B7R0.2 CNC(=O)CC(=O)O MCULE-3506871336 [1,0,0,0,0,0|2,0,1]=4 138 B7R0.2 CNC(C)CC(=O)N MCULE-1474658720 [1,0,0,0,0,0|2,0,0]=3 139 B7R0.2 CNC(C)CC(=O)N MCULE-4481385519 [1,0,0,0,0,0|2,0,0]=3 140 B7R0.2 CNC(C)CC(=O)O MCULE-6592893730 [1,0,0,0,0,0|1,0,0]=2 141 B7R0.2 CNC(C)CC(=O)O MCULE-7655437452 [1,0,0,0,0,0|1,0,0]=2 142 B7R0.2 CNC(C)CS(=O)C MCULE-5598071425 [1,0,0,0,0,0|3,0,0]=4 143 B7R0.2 CO/C(=C/C(=O)O)/C MCULE-5031076713 [1,0,0,0,0,0|1,0,2]=4 144 B7R0.2 COC(=CC(=O)O)C MCULE-2215306459 [1,0,0,0,0,0|1,0,2]=4 145 B7R0.2 COC(=O)CC(=O)O MCULE-7983457925 [1,0,0,0,0,0|2,0,1]=4 146 B7R0.2 COC(C)CC(=O)O MCULE-7063015720 [1,0,0,0,0,0|1,0,0]=2 147 B7R0.2 COC(C)CC(C)O MCULE-3635789827 [1,0,0,0,0,0|2,0,1]=4 148 B7R0.2 CSC(C)CC(=O)O MCULE-7827833531 [1,0,0,0,0,0|1,0,0]=2 149 B7R0.2 C[C@H](CN)CC(=O)O MCULE-4808630217 [1,0,0,0,0,0|1,0,0]=2 150 B7R0.2 C[C@H](CN)CC(=O)O MCULE-5474405940 [1,0,0,0,0,0|1,0,0]=2 151 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [1,0,0,0,0,0|2,0,0]=3 152 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [1,0,0,0,0,0|2,0,0]=3 153 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [1,0,0,0,0,0|2,0,0]=3 154 B7R0.2 NCC(N)CC(=O)O MCULE-5523883615 [1,0,0,0,0,0|2,0,0]=3 155 B7R0.2 NCC(N)CC(=O)O MCULE-7594259237 [1,0,0,0,0,0|2,0,0]=3 156 B7R0.2 NCC(O)CC(=O)O MCULE-9221352157 [1,0,0,0,0,0|2,0,0]=3 157 B7R0.2 NC[C@@H](F)CP(=O)O MCULE-6916648546 [1,0,0,0,0,0|3,0,0]=4 158 B7R0.2 NC[C@@H](F)CP(=O)O MCULE-8505911927 [1,0,0,0,0,0|3,0,0]=4 159 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-6348974465 [1,0,0,0,0,0|2,0,0]=3 160 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-9397628218 [1,0,0,0,0,0|2,0,0]=3 161 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-2174350055 [1,0,0,0,0,0|2,0,0]=3 162 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-8177708130 [1,0,0,0,0,0|2,0,0]=3 163 B7R0.2 NC[C@H](N)CC(=O)O MCULE-6133569516 [1,0,0,0,0,0|2,0,0]=3 164 B7R0.2 NC[C@H](N)CC(=O)O MCULE-7098533469 [1,0,0,0,0,0|2,0,0]=3 165 B7R0.2 NC[C@H](O)CC(=O)O MCULE-6634973995 [1,0,0,0,0,0|2,0,0]=3 166 B7R0.2 NC[C@H](O)CC(=O)O MCULE-8055679819 [1,0,0,0,0,0|2,0,0]=3 167 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [1,0,0,0,0,0|2,0,0]=3 168 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [1,0,0,0,0,0|2,0,0]=3 169 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [1,0,0,0,0,0|2,0,0]=3 170 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [1,0,0,0,0,0|2,0,0]=3 171 B7R0.2 O=C(O)CC(=O)CCl MCULE-9671015150 [1,0,0,0,0,0|2,0,1]=4 172 B7R0.2 O=C(O)CC(=O)CO MCULE-2224143705 [1,0,0,0,0,0|2,0,1]=4 173 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [1,0,0,0,0,0|2,0,0]=3 174 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [1,0,0,0,0,0|2,0,0]=3 175 B7R0.2 O=C([O-])CC(O)CO MCULE-5202762172 [1,0,0,0,0,0|2,0,1]=4 176 B7R0.2 O=C([O-])CC(O)CO MCULE-6219855770 [1,0,0,0,0,0|2,0,1]=4 177 B7R0.2 [C@@H](F)(CN)CP(=O)O MCULE-9369150023 [1,0,0,0,0,0|3,0,0]=4 178 B7R0.2 [NH3+][C@H](CO)CC(=O)[O-] MCULE-5131942851 [1,0,0,0,0,0|2,0,1]=4 179 B7R0.5 C#CCC(C)C(=O)O MCULE-4819055703 [1,0,0,0,0,0|1,0,2]=4 180 B7R0.5 C#CCC(F)C(=O)O MCULE-1070671235 [1,0,0,0,0,0|1,0,2]=4 181 B7R0.5 C#CCC(N)C(=O)O MCULE-2022398365 [1,0,0,0,0,0|0,0,2]=3 182 B7R0.5 C#CCC(N)C(=O)O MCULE-2451098139 [1,0,0,0,0,0|0,0,2]=3 183 B7R0.5 C#CCC(N)C(=O)O MCULE-4330300997 [1,0,0,0,0,0|0,0,2]=3 184 B7R0.5 C#CCC(N)C(=O)O MCULE-5100293043 [1,0,0,0,0,0|0,0,2]=3 185 B7R0.5 C#CCC(O)C(=O)O MCULE-4988425198 [1,0,0,0,0,0|1,0,2]=4 186 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-1266511504 [1,0,0,0,0,0|0,0,2]=3 187 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-2589808316 [1,0,0,0,0,0|0,0,2]=3 188 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-4703021434 [1,0,0,0,0,0|0,0,2]=3 189 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-5616417783 [1,0,0,0,0,0|0,0,2]=3 190 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-1593368546 [1,0,0,0,0,0|0,0,2]=3 191 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-5683421535 [1,0,0,0,0,0|0,0,2]=3 192 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-7302855511 [1,0,0,0,0,0|0,0,2]=3 193 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-9256626051 [1,0,0,0,0,0|0,0,2]=3 194 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [1,0,0,0,0,0|1,0,1]=3 195 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [1,0,0,0,0,0|2,0,1]=4 196 B7R0.5 C=C(COC)C(=O)O MCULE-8964616960 [1,0,0,0,0,0|2,0,1]=4 197 B7R0.5 C=CCC(C)C(=O)O MCULE-2912410432 [1,0,0,0,0,0|1,0,2]=4 198 B7R0.5 C=CCC(N)C(=O)O MCULE-1550468430 [1,0,0,0,0,0|0,0,2]=3 199 B7R0.5 C=CCC(N)C(=O)O MCULE-1783682768 [1,0,0,0,0,0|0,0,2]=3 200 B7R0.5 C=CCC(N)C(=O)O MCULE-8721864064 [1,0,0,0,0,0|0,0,2]=3 201 B7R0.5 C=CCC(N)C(=O)O MCULE-9091562338 [1,0,0,0,0,0|0,0,2]=3 202 B7R0.5 C=CCC(O)C(=O)O MCULE-6418899544 [1,0,0,0,0,0|1,0,2]=4 203 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-3817126030 [1,0,0,0,0,0|0,0,2]=3 204 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-5479618260 [1,0,0,0,0,0|0,0,2]=3 205 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-6719393730 [1,0,0,0,0,0|0,0,2]=3 206 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-7577627870 [1,0,0,0,0,0|0,0,2]=3 207 B7R0.5 C=CC[C@@H](O)C(=O)O MCULE-4103471826 [1,0,0,0,0,0|1,0,2]=4 208 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-2073484196 [1,0,0,0,0,0|0,0,2]=3 209 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-3267648941 [1,0,0,0,0,0|0,0,2]=3 210 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-4183531139 [1,0,0,0,0,0|0,0,2]=3 211 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-8225762047 [1,0,0,0,0,0|0,0,2]=3 212 B7R0.5 C=CC[C@H](O)C(=O)O MCULE-8230827617 [1,0,0,0,0,0|1,0,2]=4 213 B7R0.5 CC(=O)C(C)CCBr MCULE-4705039689 [1,0,0,0,0,0|3,0,0]=4 214 B7R0.5 CC(=O)C(C)CCCl MCULE-2960091698 [1,0,0,0,0,0|3,0,0]=4 215 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [1,0,0,0,0,0|3,0,0]=4 216 B7R0.5 CC(=O)C(Cl)CCCl MCULE-4634341484 [1,0,0,0,0,0|3,0,0]=4 217 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [1,0,0,0,0,0|3,0,0]=4 218 B7R0.5 CC(CCCl)C(=O)Cl MCULE-4844969943 [1,0,0,0,0,0|3,0,0]=4 219 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [1,0,0,0,0,0|2,0,0]=3 220 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [1,0,0,0,0,0|2,0,0]=3 221 B7R0.5 CC(CCO)C(=O)N MCULE-3037868887 [1,0,0,0,0,0|3,0,0]=4 222 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [1,0,0,0,0,0|2,0,0]=3 223 B7R0.5 CC(CCO)C(=O)[O-] MCULE-2278638513 [1,0,0,0,0,0|2,0,1]=4 224 B7R0.5 CC/C=C(\C)/C(=O)O MCULE-1290613859 [1,0,0,0,0,0|1,0,2]=4 225 B7R0.5 CC=CC(C)C(=O)O MCULE-5584906296 [1,0,0,0,0,0|1,0,2]=4 226 B7R0.5 CC=CC(O)C(=O)O MCULE-5249095255 [1,0,0,0,0,0|1,0,2]=4 227 B7R0.5 CCC=C(C)C(=O)O MCULE-5045441145 [1,0,0,0,0,0|1,0,2]=4 228 B7R0.5 CCC=C(F)C(=O)O MCULE-6630499680 [1,0,0,0,0,0|1,0,2]=4 229 B7R0.5 CCCC(=O)C(=O)C MCULE-8267463586 [1,0,0,0,0,0|2,0,1]=4 230 B7R0.5 CCCC(=O)C(=O)N MCULE-6625605588 [1,0,0,0,0,0|2,0,1]=4 231 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [1,0,0,0,0,0|1,0,1]=3 232 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [1,0,0,0,0,0|2,0,0]=3 233 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [1,0,0,0,0,0|1,0,0]=2 234 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [1,0,0,0,0,0|2,0,0]=3 235 B7R0.5 CCCC(C)C(=O)Cl MCULE-4855016209 [1,0,0,0,0,0|2,0,0]=3 236 B7R0.5 CCCC(C)C(=O)N MCULE-1948746391 [1,0,0,0,0,0|2,0,0]=3 237 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [1,0,0,0,0,0|1,0,0]=2 238 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [1,0,0,0,0,0|2,0,1]=4 239 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [1,0,0,0,0,0|1,0,0]=2 240 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [1,0,0,0,0,0|1,0,0]=2 241 B7R0.5 CCCC(N)C(=O)N MCULE-5159221123 [1,0,0,0,0,0|1,0,0]=2 242 B7R0.5 CCCC(N)C(=O)N MCULE-5742773956 [1,0,0,0,0,0|1,0,0]=2 243 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [1,0,0,0,0,0|0,0,0]=1 244 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [1,0,0,0,0,0|0,0,0]=1 245 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [1,0,0,0,0,0|0,0,0]=1 246 B7R0.5 CCCC(O)C(=O)N MCULE-3143432132 [1,0,0,0,0,0|2,0,0]=3 247 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [1,0,0,0,0,0|1,0,0]=2 248 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [1,0,0,0,0,0|1,0,0]=2 249 B7R0.5 CCCN(C)C(=O)Cl MCULE-2930764127 [1,0,0,0,0,0|3,0,0]=4 250 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [1,0,0,0,0,0|0,0,0]=1 251 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [1,0,0,0,0,0|0,0,0]=1 252 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [1,0,0,0,0,0|1,0,0]=2 253 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [1,0,0,0,0,0|1,0,0]=2 254 B7R0.5 CCC[C@H](N)C(=O)N MCULE-2163059771 [1,0,0,0,0,0|1,0,0]=2 255 B7R0.5 CCC[C@H](N)C(=O)N MCULE-4687172013 [1,0,0,0,0,0|1,0,0]=2 256 B7R0.5 CCC[C@H](N)C(=O)N MCULE-7482592029 [1,0,0,0,0,0|1,0,0]=2 257 B7R0.5 CCC[C@H](N)C(=O)N MCULE-9639796243 [1,0,0,0,0,0|1,0,0]=2 258 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [1,0,0,0,0,0|0,0,0]=1 259 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [1,0,0,0,0,0|0,0,0]=1 260 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [1,0,0,0,0,0|0,0,0]=1 261 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [1,0,0,0,0,0|1,0,0]=2 262 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [1,0,0,0,0,0|1,0,0]=2 263 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [1,0,0,0,0,0|2,0,1]=4 264 B7R0.5 CCNC(C)C(=O)N MCULE-2861818493 [1,0,0,0,0,0|3,0,0]=4 265 B7R0.5 CCNC(C)C(=O)N MCULE-6110291237 [1,0,0,0,0,0|3,0,0]=4 266 B7R0.5 CCNC(C)C(=O)O MCULE-5445574810 [1,0,0,0,0,0|2,0,0]=3 267 B7R0.5 CCNC(C)C(=O)O MCULE-5666785247 [1,0,0,0,0,0|2,0,0]=3 268 B7R0.5 CCN[C@H](C)C(=O)O MCULE-9676358201 [1,0,0,0,0,0|2,0,0]=3 269 B7R0.5 CCOC(=O)C(=O)O MCULE-2368024441 [1,0,0,0,0,0|2,0,1]=4 270 B7R0.5 CCOC(C)C(=O)O MCULE-2185795311 [1,0,0,0,0,0|2,0,0]=3 271 B7R0.5 CCSC(C)C(=O)O MCULE-9817243573 [1,0,0,0,0,0|2,0,0]=3 272 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [1,0,0,0,0,0|2,0,0]=3 273 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [1,0,0,0,0,0|2,0,0]=3 274 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [1,0,0,0,0,0|1,0,0]=2 275 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [1,0,0,0,0,0|1,0,0]=2 276 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [1,0,0,0,0,0|1,0,0]=2 277 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [1,0,0,0,0,0|1,0,0]=2 278 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [1,0,0,0,0,0|1,0,0]=2 279 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [1,0,0,0,0,0|1,0,0]=2 280 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [1,0,0,0,0,0|2,0,0]=3 281 B7R0.5 COCC(C)C(=O)C MCULE-5328927786 [1,0,0,0,0,0|3,0,0]=4 282 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [1,0,0,0,0,0|2,0,0]=3 283 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [1,0,0,0,0,0|2,0,0]=3 284 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [1,0,0,0,0,0|2,0,0]=3 285 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [1,0,0,0,0,0|2,0,0]=3 286 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [1,0,0,0,0,0|1,0,0]=2 287 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [1,0,0,0,0,0|1,0,0]=2 288 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [1,0,0,0,0,0|1,0,0]=2 289 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [1,0,0,0,0,0|1,0,0]=2 290 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [1,0,0,0,0,0|2,0,0]=3 291 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [1,0,0,0,0,0|1,0,0]=2 292 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [1,0,0,0,0,0|1,0,0]=2 293 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [1,0,0,0,0,0|1,0,0]=2 294 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [1,0,0,0,0,0|1,0,0]=2 295 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [1,0,0,0,0,0|1,0,0]=2 296 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [1,0,0,0,0,0|1,0,0]=2 297 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [1,0,0,0,0,0|1,0,0]=2 298 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [1,0,0,0,0,0|1,0,0]=2 299 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [1,0,0,0,0,0|2,0,0]=3 300 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [1,0,0,0,0,0|1,0,0]=2 301 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [1,0,0,0,0,0|1,0,0]=2 302 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [1,0,0,0,0,0|1,0,0]=2 303 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [1,0,0,0,0,0|2,0,0]=3 304 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [1,0,0,0,0,0|1,0,0]=2 305 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [1,0,0,0,0,0|1,0,0]=2 306 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [1,0,0,0,0,0|1,0,0]=2 307 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [1,0,0,0,0,0|1,0,0]=2 308 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [1,0,0,0,0,0|1,0,0]=2 309 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [1,0,0,0,0,0|1,0,0]=2 310 B7R0.5 N#CCC(N)C(=O)O MCULE-4929926467 [1,0,0,0,0,0|1,0,1]=3 311 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6294926701 [1,0,0,0,0,0|1,0,1]=3 312 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6432920316 [1,0,0,0,0,0|1,0,1]=3 313 B7R0.5 NC(=O)C(Br)CCBr MCULE-5008510444 [1,0,0,0,0,0|3,0,0]=4 314 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [1,0,0,0,0,0|1,0,0]=2 315 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [1,0,0,0,0,0|1,0,0]=2 316 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [1,0,0,0,0,0|1,0,0]=2 317 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [1,0,0,0,0,0|1,0,0]=2 318 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [1,0,0,0,0,0|1,0,0]=2 319 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [1,0,0,0,0,0|1,0,0]=2 320 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [1,0,0,0,0,0|1,0,0]=2 321 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [1,0,0,0,0,0|1,0,0]=2 322 B7R0.5 NC(CNO)C(=O)O MCULE-2332662988 [1,0,0,0,0,0|2,0,0]=3 323 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [1,0,0,0,0,0|2,0,0]=3 324 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [1,0,0,0,0,0|2,0,0]=3 325 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [1,0,0,0,0,0|1,0,0]=2 326 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [1,0,0,0,0,0|1,0,0]=2 327 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [1,0,0,0,0,0|1,0,0]=2 328 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [1,0,0,0,0,0|1,0,0]=2 329 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [1,0,0,0,0,0|1,0,0]=2 330 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [1,0,0,0,0,0|1,0,0]=2 331 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [1,0,0,0,0,0|1,0,0]=2 332 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [1,0,0,0,0,0|2,0,0]=3 333 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [1,0,0,0,0,0|2,0,0]=3 334 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [1,0,0,0,0,0|1,0,0]=2 335 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [1,0,0,0,0,0|1,0,0]=2 336 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [1,0,0,0,0,0|1,0,0]=2 337 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [1,0,0,0,0,0|1,0,0]=2 338 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [1,0,0,0,0,0|2,0,0]=3 339 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [1,0,0,0,0,0|1,0,0]=2 340 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [1,0,0,0,0,0|1,0,0]=2 341 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [1,0,0,0,0,0|1,0,0]=2 342 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [1,0,0,0,0,0|1,0,0]=2 343 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [1,0,0,0,0,0|1,0,0]=2 344 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [1,0,0,0,0,0|1,0,0]=2 345 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [1,0,0,0,0,0|1,0,0]=2 346 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [1,0,0,0,0,0|1,0,0]=2 347 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [1,0,0,0,0,0|1,0,0]=2 348 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [1,0,0,0,0,0|2,0,0]=3 349 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [1,0,0,0,0,0|2,0,0]=3 350 B7R0.5 NOC[C@H](N)C(=O)O MCULE-1050292176 [1,0,0,0,0,0|2,0,0]=3 351 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [1,0,0,0,0,0|1,0,0]=2 352 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [1,0,0,0,0,0|1,0,0]=2 353 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [1,0,0,0,0,0|1,0,0]=2 354 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [1,0,0,0,0,0|1,0,0]=2 355 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [1,0,0,0,0,0|1,0,0]=2 356 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [1,0,0,0,0,0|1,0,0]=2 357 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [1,0,0,0,0,0|1,0,0]=2 358 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [1,0,0,0,0,0|1,0,0]=2 359 B7R0.5 N[C@@H](CSS)C(=O)O MCULE-3029500977 [1,0,0,0,0,0|2,0,0]=3 360 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [1,0,0,0,0,0|1,0,0]=2 361 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [1,0,0,0,0,0|1,0,0]=2 362 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [1,0,0,0,0,0|1,0,0]=2 363 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [1,0,0,0,0,0|1,0,0]=2 364 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [1,0,0,0,0,0|1,0,0]=2 365 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [1,0,0,0,0,0|1,0,0]=2 366 B7R0.5 O=C(Br)C(Br)CCBr MCULE-1496301616 [1,0,0,0,0,0|3,0,0]=4 367 B7R0.5 O=C(Cl)C(Br)CCBr MCULE-9787639147 [1,0,0,0,0,0|3,0,0]=4 368 B7R0.5 O=C(Cl)C(Br)CCCl MCULE-6400872582 [1,0,0,0,0,0|3,0,0]=4 369 B7R0.5 O=C(O)C(Br)CCBr MCULE-3091819269 [1,0,0,0,0,0|2,0,0]=3 370 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [1,0,0,0,0,0|2,0,0]=3 371 B7R0.5 [C@H](N)(CC#C)C(=O)O MCULE-7308061694 [1,0,0,0,0,0|0,0,2]=3 372 B7R0.10 C#CC(N)C(C)CC MCULE-4599913336 [1,0,0,0,0,0|1,0,1]=3 373 B7R0.10 C#CC(N)C(C)CC MCULE-6841022785 [1,0,0,0,0,0|1,0,1]=3 374 B7R0.10 C=CC(C)C(C)CC MCULE-2366850706 [1,0,0,0,0,0|2,0,0]=3 375 B7R0.10 CC(CN)C(N)CO MCULE-1520376315 [1,0,0,0,0,0|1,0,1]=3 376 B7R0.10 CC(CN)[C@H](N)CO MCULE-9250442888 [1,0,0,0,0,0|1,0,1]=3 377 B7R0.10 CCC(C)/C(=N/O)/N MCULE-3220820796 [1,0,0,0,0,0|1,0,1]=3 378 B7R0.10 CCC(C)/C(=N/O)/N MCULE-6860766298 [1,0,0,0,0,0|1,0,1]=3 379 B7R0.10 CCC(C)C(C)CC MCULE-8164178184 [1,0,0,0,0,0|2,0,1]=4 380 B7R0.10 CCC(C)C(N)C#N MCULE-4516295423 [1,0,0,0,0,0|1,0,1]=3 381 B7R0.10 CCC(C)C(N)C#N MCULE-9668149479 [1,0,0,0,0,0|1,0,1]=3 382 B7R0.10 CCC(C)C(N)CO MCULE-3990781918 [1,0,0,0,0,0|0,0,1]=2 383 B7R0.10 CCC(C)C(N)CO MCULE-9261445768 [1,0,0,0,0,0|0,0,1]=2 384 B7R0.10 CCC(C)C(O)CC MCULE-3936368693 [1,0,0,0,0,0|2,0,1]=4 385 B7R0.10 CCC(C)C(O)CN MCULE-1941564207 [1,0,0,0,0,0|2,0,1]=4 386 B7R0.10 CCC(C)C(O)CO MCULE-9999862073 [1,0,0,0,0,0|1,0,1]=3 387 B7R0.10 CCC(C)[C@H](N)C#N MCULE-7403677699 [1,0,0,0,0,0|1,0,1]=3 388 B7R0.10 CCC(C)[C@H](N)C#N MCULE-7724941860 [1,0,0,0,0,0|1,0,1]=3 389 B7R0.10 CCC(C)[C@H](N)C#N MCULE-8975526389 [1,0,0,0,0,0|1,0,1]=3 390 B7R0.10 CCC(C)[C@H](N)C#N MCULE-9352431409 [1,0,0,0,0,0|1,0,1]=3 391 B7R0.10 CCC(N)C(O)CC MCULE-3578258801 [1,0,0,0,0,0|2,0,1]=4 392 B7R0.10 CCC(O)C(C)CO MCULE-3930931405 [1,0,0,0,0,0|2,0,1]=4 393 B7R0.10 CCC(O)C(C)CO MCULE-4472852672 [1,0,0,0,0,0|2,0,1]=4 394 B7R0.10 CCC(S)C(C)CO MCULE-1500370684 [1,0,0,0,0,0|2,0,1]=4 395 B7R0.10 CCN(C)C(C)CO MCULE-3647031998 [1,0,0,0,0,0|2,0,1]=4 396 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-2122638055 [1,0,0,0,0,0|0,0,1]=2 397 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-7964651759 [1,0,0,0,0,0|0,0,1]=2 398 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-8482653298 [1,0,0,0,0,0|0,0,1]=2 399 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-3409941550 [1,0,0,0,0,0|1,0,1]=3 400 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-9750756690 [1,0,0,0,0,0|1,0,1]=3 401 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-3647332227 [1,0,0,0,0,0|0,0,1]=2 402 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-5774547825 [1,0,0,0,0,0|0,0,1]=2 403 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8401203397 [1,0,0,0,0,0|0,0,1]=2 404 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8452836661 [1,0,0,0,0,0|0,0,1]=2 405 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-9307589673 [1,0,0,0,0,0|0,0,1]=2 406 B7R0.10 COC(C)/C(=N/O)/N MCULE-3009628521 [1,0,0,0,0,0|2,0,1]=4 407 B7R0.10 N[C@@H](CO)[C@@H](N)CO MCULE-2394488011 [1,0,0,0,0,0|2,0,1]=4 408 B7R0.10 O=CC(O)C(O)CO MCULE-9564469242 [1,0,0,0,0,0|3,0,0]=4 409 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-3532911413 [1,0,0,0,0,0|3,0,0]=4 410 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-5707669784 [1,0,0,0,0,0|3,0,0]=4 411 B7R0.10 O=C[C@@H](O)[C@H](O)CO MCULE-4902023669 [1,0,0,0,0,0|3,0,0]=4 412 B7R0.10 O=C[C@H](O)[C@@H](O)CO MCULE-5975565699 [1,0,0,0,0,0|3,0,0]=4 413 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-3036594515 [1,0,0,0,0,0|3,0,0]=4 414 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-5412566780 [1,0,0,0,0,0|3,0,0]=4 415 B7R0.10 [C@@H](C)(CC)[C@@H](N)CO MCULE-4423825378 [1,0,0,0,0,0|0,0,1]=2 416 B7R0.16 C=C(C(=O)O)C(C)C MCULE-6667026437 [1,0,0,0,0,0|1,0,1]=3 417 B7R0.16 C=C(C)C(N)C(=O)O MCULE-1815568719 [1,0,0,0,0,0|0,0,2]=3 418 B7R0.16 C=C(C)C(N)C(=O)O MCULE-2839869274 [1,0,0,0,0,0|0,0,2]=3 419 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5015326828 [1,0,0,0,0,0|0,0,2]=3 420 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5043630144 [1,0,0,0,0,0|0,0,2]=3 421 B7R0.16 C=C(C)[C@@H](N)C(=C)O MCULE-5278584348 [1,0,0,0,0,0|1,0,2]=4 422 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-2007035571 [1,0,0,0,0,0|0,0,2]=3 423 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-6240689602 [1,0,0,0,0,0|0,0,2]=3 424 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-8025014656 [1,0,0,0,0,0|0,0,2]=3 425 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-9704891439 [1,0,0,0,0,0|0,0,2]=3 426 B7R0.16 CC(=C(Br)C(=O)O)C MCULE-8944482091 [1,0,0,0,0,0|1,0,2]=4 427 B7R0.16 CC(=C(C)C(=O)O)C MCULE-1062537992 [1,0,0,0,0,0|1,0,2]=4 428 B7R0.16 CC(=C(Cl)C(=O)O)C MCULE-9408683615 [1,0,0,0,0,0|1,0,2]=4 429 B7R0.16 CC(=C(F)C(=O)O)C MCULE-9025515032 [1,0,0,0,0,0|1,0,2]=4 430 B7R0.16 CC(=O)C(Br)C(C)C MCULE-2864707278 [1,0,0,0,0,0|2,0,0]=3 431 B7R0.16 CC(=O)C(Cl)C(C)C MCULE-2825069638 [1,0,0,0,0,0|2,0,0]=3 432 B7R0.16 CC(=O)C(N)C(=O)C MCULE-6440496769 [1,0,0,0,0,0|2,0,1]=4 433 B7R0.16 CC(=O)C(N)C(=O)C MCULE-8525737264 [1,0,0,0,0,0|2,0,1]=4 434 B7R0.16 CC(Br)C(Br)C(=O)O MCULE-8605068480 [1,0,0,0,0,0|2,0,0]=3 435 B7R0.16 CC(Br)C(O)C(=O)O MCULE-8231714451 [1,0,0,0,0,0|2,0,0]=3 436 B7R0.16 CC(C(=O)O)N(C)C MCULE-2658921782 [1,0,0,0,0,0|2,0,0]=3 437 B7R0.16 CC(C(=O)O)N(C)C MCULE-4457336101 [1,0,0,0,0,0|2,0,0]=3 438 B7R0.16 CC(C(=O)O)N(C)N MCULE-1182323460 [1,0,0,0,0,0|3,0,0]=4 439 B7R0.16 CC(C)C(=O)C(=O)Cl MCULE-6254092186 [1,0,0,0,0,0|2,0,1]=4 440 B7R0.16 CC(C)C(=O)C(=O)O MCULE-9877767821 [1,0,0,0,0,0|1,0,1]=3 441 B7R0.16 CC(C)C(=O)C(=O)[O-] MCULE-3960241746 [1,0,0,0,0,0|1,0,2]=4 442 B7R0.16 CC(C)C(Br)C(=O)Br MCULE-7135511419 [1,0,0,0,0,0|2,0,0]=3 443 B7R0.16 CC(C)C(Br)C(=O)Cl MCULE-7468132927 [1,0,0,0,0,0|2,0,0]=3 444 B7R0.16 CC(C)C(Br)C(=O)N MCULE-8059032804 [1,0,0,0,0,0|2,0,0]=3 445 B7R0.16 CC(C)C(Br)C(=O)O MCULE-7284929535 [1,0,0,0,0,0|1,0,0]=2 446 B7R0.16 CC(C)C(Br)C(=O)O MCULE-8100016953 [1,0,0,0,0,0|1,0,0]=2 447 B7R0.16 CC(C)C(C)C(=O)Cl MCULE-4466867108 [1,0,0,0,0,0|2,0,0]=3 448 B7R0.16 CC(C)C(C)C(=O)O MCULE-4998524686 [1,0,0,0,0,0|1,0,0]=2 449 B7R0.16 CC(C)C(Cl)C(=O)Cl MCULE-8764699774 [1,0,0,0,0,0|2,0,0]=3 450 B7R0.16 CC(C)C(Cl)C(=O)O MCULE-8634615546 [1,0,0,0,0,0|1,0,0]=2 451 B7R0.16 CC(C)C(F)C(=O)O MCULE-5644342535 [1,0,0,0,0,0|1,0,0]=2 452 B7R0.16 CC(C)C(N)C(=O)N MCULE-5793065876 [1,0,0,0,0,0|1,0,0]=2 453 B7R0.16 CC(C)C(N)C(=O)N MCULE-6836215171 [1,0,0,0,0,0|1,0,0]=2 454 B7R0.16 CC(C)C(N)C(=O)O MCULE-8140660263 [1,0,0,0,0,0|0,0,0]=1 455 B7R0.16 CC(C)C(N)C(=O)O MCULE-9199801639 [1,0,0,0,0,0|0,0,0]=1 456 B7R0.16 CC(C)C(N)C(C)C MCULE-2164638983 [1,0,0,0,0,0|2,0,1]=4 457 B7R0.16 CC(C)C(N)C(C)C MCULE-8563510082 [1,0,0,0,0,0|2,0,1]=4 458 B7R0.16 CC(C)C(O)C(=O)O MCULE-6517225229 [1,0,0,0,0,0|1,0,0]=2 459 B7R0.16 CC(C)C(O)C(=O)O MCULE-7748605101 [1,0,0,0,0,0|1,0,0]=2 460 B7R0.16 CC(C)N(C)C(=O)Cl MCULE-1063482503 [1,0,0,0,0,0|3,0,0]=4 461 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-2705531785 [1,0,0,0,0,0|1,0,0]=2 462 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-7570119486 [1,0,0,0,0,0|1,0,0]=2 463 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2330575489 [1,0,0,0,0,0|1,0,0]=2 464 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2653474443 [1,0,0,0,0,0|1,0,0]=2 465 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-3449326352 [1,0,0,0,0,0|1,0,0]=2 466 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-7409435805 [1,0,0,0,0,0|1,0,0]=2 467 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-1338052740 [1,0,0,0,0,0|0,0,0]=1 468 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-2459930572 [1,0,0,0,0,0|0,0,0]=1 469 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-7719048521 [1,0,0,0,0,0|1,0,0]=2 470 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-9864796653 [1,0,0,0,0,0|1,0,0]=2 471 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-4863317096 [1,0,0,0,0,0|1,0,0]=2 472 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-8695526864 [1,0,0,0,0,0|1,0,0]=2 473 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-4413397700 [1,0,0,0,0,0|1,0,0]=2 474 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-6269612306 [1,0,0,0,0,0|1,0,0]=2 475 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8084934210 [1,0,0,0,0,0|1,0,0]=2 476 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8307595659 [1,0,0,0,0,0|1,0,0]=2 477 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-1415573194 [1,0,0,0,0,0|1,0,0]=2 478 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-2742126302 [1,0,0,0,0,0|1,0,0]=2 479 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-3124084676 [1,0,0,0,0,0|1,0,0]=2 480 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-4854272542 [1,0,0,0,0,0|1,0,0]=2 481 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-7430998836 [1,0,0,0,0,0|1,0,0]=2 482 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-9899853579 [1,0,0,0,0,0|1,0,0]=2 483 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-2507309072 [1,0,0,0,0,0|0,0,0]=1 484 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-9143825935 [1,0,0,0,0,0|0,0,0]=1 485 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-1975771806 [1,0,0,0,0,0|1,0,0]=2 486 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-4070611738 [1,0,0,0,0,0|1,0,0]=2 487 B7R0.16 CC(F)C(N)C(=O)O MCULE-8810968604 [1,0,0,0,0,0|1,0,0]=2 488 B7R0.16 CC(N)C(C)C(=O)O MCULE-2921617741 [1,0,0,0,0,0|2,0,0]=3 489 B7R0.16 CC(N)C(C)C(=O)O MCULE-8511267926 [1,0,0,0,0,0|2,0,0]=3 490 B7R0.16 CC(N)C(O)C(=O)O MCULE-1086139043 [1,0,0,0,0,0|2,0,0]=3 491 B7R0.16 CC(N)C(O)C(=O)O MCULE-6405300346 [1,0,0,0,0,0|2,0,0]=3 492 B7R0.16 CC(O)C(C)C(=O)O MCULE-2499360516 [1,0,0,0,0,0|2,0,0]=3 493 B7R0.16 CC(O)C(N)C(=O)N MCULE-1234785834 [1,0,0,0,0,0|2,0,0]=3 494 B7R0.16 CC(O)C(N)C(=O)N MCULE-5867306342 [1,0,0,0,0,0|2,0,0]=3 495 B7R0.16 CC(O)C(N)C(=O)O MCULE-1563595722 [1,0,0,0,0,0|1,0,0]=2 496 B7R0.16 CC(O)C(N)C(=O)O MCULE-5581920538 [1,0,0,0,0,0|1,0,0]=2 497 B7R0.16 CN(C)C(=O)C(=O)O MCULE-4063274840 [1,0,0,0,0,0|2,0,1]=4 498 B7R0.16 C[C@@H](C(=O)O)N(C)C MCULE-1371350024 [1,0,0,0,0,0|2,0,0]=3 499 B7R0.16 C[C@@H](C(=O)O)N(C)C MCULE-2001661938 [1,0,0,0,0,0|2,0,0]=3 500 B7R0.16 C[C@@H](C(=O)O)N(C)C MCULE-6789128261 [1,0,0,0,0,0|2,0,0]=3 501 B7R0.16 C[C@@H](N)[C@@H](N)C(=O)O MCULE-5302456851 [1,0,0,0,0,0|1,0,0]=2 502 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-1663687439 [1,0,0,0,0,0|1,0,0]=2 503 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-3863591433 [1,0,0,0,0,0|1,0,0]=2 504 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-8080019797 [1,0,0,0,0,0|1,0,0]=2 505 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-9284411012 [1,0,0,0,0,0|1,0,0]=2 506 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-1969228933 [1,0,0,0,0,0|2,0,0]=3 507 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-3285041526 [1,0,0,0,0,0|2,0,0]=3 508 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-5018319528 [1,0,0,0,0,0|2,0,0]=3 509 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-6080625355 [1,0,0,0,0,0|2,0,0]=3 510 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9393787536 [1,0,0,0,0,0|2,0,0]=3 511 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9925689829 [1,0,0,0,0,0|2,0,0]=3 512 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2430667007 [1,0,0,0,0,0|1,0,0]=2 513 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2676185993 [1,0,0,0,0,0|1,0,0]=2 514 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5254477364 [1,0,0,0,0,0|1,0,0]=2 515 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5505393195 [1,0,0,0,0,0|1,0,0]=2 516 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-7379719940 [1,0,0,0,0,0|1,0,0]=2 517 B7R0.16 C[C@@H](O)[C@H](O)C(=O)O MCULE-9383777855 [1,0,0,0,0,0|2,0,0]=3 518 B7R0.16 C[C@H](C(=O)N)N(C)C MCULE-1489374162 [1,0,0,0,0,0|3,0,0]=4 519 B7R0.16 C[C@H](C(=O)N)N(C)C MCULE-7938995734 [1,0,0,0,0,0|3,0,0]=4 520 B7R0.16 C[C@H](C(=O)O)N(C)C MCULE-2210848569 [1,0,0,0,0,0|2,0,0]=3 521 B7R0.16 C[C@H](C(=O)O)N(C)C MCULE-5148086527 [1,0,0,0,0,0|2,0,0]=3 522 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2245171795 [1,0,0,0,0,0|2,0,0]=3 523 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2727261050 [1,0,0,0,0,0|2,0,0]=3 524 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O MCULE-8875933839 [1,0,0,0,0,0|2,0,0]=3 525 B7R0.16 C[C@H](N)[C@@H](N)C(=O)O MCULE-9507122128 [1,0,0,0,0,0|1,0,0]=2 526 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-2574349608 [1,0,0,0,0,0|2,0,0]=3 527 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-6297204649 [1,0,0,0,0,0|2,0,0]=3 528 B7R0.16 C[C@H](N)[C@H](N)C(=O)O MCULE-3178389621 [1,0,0,0,0,0|1,0,0]=2 529 B7R0.16 C[C@H](O)C(N)C(=O)O MCULE-6661175670 [1,0,0,0,0,0|1,0,0]=2 530 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-6288272506 [1,0,0,0,0,0|1,0,0]=2 531 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-7203096302 [1,0,0,0,0,0|1,0,0]=2 532 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-9531951265 [1,0,0,0,0,0|1,0,0]=2 533 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-2246314901 [1,0,0,0,0,0|1,0,0]=2 534 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-9478987169 [1,0,0,0,0,0|1,0,0]=2 535 B7R0.16 NC(C(=O)O)C(=O)O MCULE-6118746267 [1,0,0,0,0,0|2,0,1]=4 536 B7R0.16 O=C(O)C(O)C(F)F MCULE-6750020534 [1,0,0,0,0,0|3,0,0]=4 537 B9R0.6 CCCC(C)C(N)C(=O)O MCULE-3481285649 [0,1,0,0,0,0|0,0,0]=1 538 B9R0.6 CCCC(N)C(O)C(=O)N MCULE-3877102152 [0,1,0,0,0,0|3,0,0]=4 539 B9R0.6 CCCC(N)C(O)C(=O)N MCULE-5998533545 [0,1,0,0,0,0|3,0,0]=4 540 B9R0.6 CCCC(O)C(N)C(=O)O MCULE-5391337444 [0,1,0,0,0,0|1,0,0]=2 541 B9R0.6 CCC[C@@H](N)C(O)C(=O)N MCULE-1873801018 [0,1,0,0,0,0|3,0,0]=4 542 B9R0.6 CCC[C@@H](N)C(O)C(=O)N MCULE-5086135715 [0,1,0,0,0,0|3,0,0]=4 543 B9R0.6 CCC[C@@H](N)[C@@H](O)C(=O)O MCULE-2918610954 [0,1,0,0,0,0|2,0,0]=3 544 B9R0.6 CCC[C@@H](N)[C@H](O)C(=O)O MCULE-1958502407 [0,1,0,0,0,0|2,0,0]=3 545 B9R0.6 CCC[C@H](N)C(O)C(=O)O MCULE-8649182139 [0,1,0,0,0,0|2,0,0]=3 546 B9R0.6 CCOC(=O)C(C)C(=O)O MCULE-8985852240 [0,1,0,0,0,0|2,0,1]=4 547 B9R0.6 CCOC(=O)C(N)C(=O)C MCULE-2343188401 [0,1,0,0,0,0|2,0,1]=4 548 B9R0.6 CCOC(=O)C(N)C(=O)C MCULE-3236869229 [0,1,0,0,0,0|2,0,1]=4 549 B9R0.6 COCC(C)C(C)C(=O)O MCULE-8168198082 [0,1,0,0,0,0|1,0,0]=2 550 B9R0.25 CCC(C)C(N)C(F)(F)F MCULE-4858568700 [0,1,0,0,0,0|2,0,1]=4 551 B9R0.25 CCC(C)C(N)C(F)(F)F MCULE-6852728815 [0,1,0,0,0,0|2,0,1]=4 552 B9R0.25 CCC(C)[C@@H](N)C(F)(F)F MCULE-2602741878 [0,1,0,0,0,0|2,0,1]=4 553 B9R0.25 CCC(C)[C@@H](N)C(F)(F)F MCULE-4867046241 [0,1,0,0,0,0|2,0,1]=4 554 B9R0.25 CCC(C)[C@H](N)C(F)(F)F MCULE-4680740956 [0,1,0,0,0,0|2,0,1]=4 555 B9R0.25 CCC(C)[C@H](N)C(F)(F)F MCULE-5728510788 [0,1,0,0,0,0|2,0,1]=4 556 B9R0.25 CC[C@H](C)[C@H](N)C(F)(F)F MCULE-2198522956 [0,1,0,0,0,0|2,0,1]=4 557 B9R0.25 CC[C@H](C)[C@H](N)C(F)(F)F MCULE-5276585561 [0,1,0,0,0,0|2,0,1]=4 558 B9R0.27 C=C(OC)C(N)C(=O)OC MCULE-2643396359 [0,1,0,0,0,0|1,0,2]=4 559 B9R0.27 C=C(OC)C(N)C(=O)OC MCULE-5233065686 [0,1,0,0,0,0|1,0,2]=4 560 B9R0.27 CCC(=O)C(C)C(=O)OC MCULE-2153331264 [0,1,0,0,0,0|2,0,1]=4 561 B9R0.27 CCC(=O)C(Cl)C(=O)OC MCULE-6097382115 [0,1,0,0,0,0|2,0,1]=4 562 B9R0.27 CCC(=O)C(F)C(=O)OC MCULE-7376153502 [0,1,0,0,0,0|2,0,1]=4 563 B9R0.27 CCC(C)C(Cl)C(=O)OC MCULE-4549387192 [0,1,0,0,0,0|1,0,0]=2 564 B9R0.27 CCC(C)C(N)C(=O)CCl MCULE-4483538140 [0,1,0,0,0,0|1,0,0]=2 565 B9R0.27 CCC(C)C(N)C(=O)CCl MCULE-8837034349 [0,1,0,0,0,0|1,0,0]=2 566 B9R0.27 CCC(C)C(N)C(=O)OC MCULE-1846968686 [0,1,0,0,0,0|0,0,0]=1 567 B9R0.27 CCC(C)C(N)C(=O)OC MCULE-3209850544 [0,1,0,0,0,0|0,0,0]=1 568 B9R0.27 CCC(C)C(O)C(=O)OC MCULE-8434457313 [0,1,0,0,0,0|1,0,0]=2 569 B9R0.27 CCC(N)C(O)C(=O)OC MCULE-5958902036 [0,1,0,0,0,0|2,0,0]=3 570 B9R0.27 CCC(N)C(O)C(=O)OC MCULE-7272235506 [0,1,0,0,0,0|2,0,0]=3 571 B9R0.27 CCC(O)C(C)C(=O)OC MCULE-2007143538 [0,1,0,0,0,0|2,0,0]=3 572 B9R0.27 CC[C@@H](C)[C@H](N)C(=O)OC MCULE-5533680436 [0,1,0,0,0,0|0,0,0]=1 573 B9R0.27 CC[C@@H](C)[C@H](N)C(=O)OC MCULE-7868747169 [0,1,0,0,0,0|0,0,0]=1 574 B9R0.27 CC[C@@H](C)[C@H](N)C(=O)OC MCULE-9579020209 [0,1,0,0,0,0|0,0,0]=1 575 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC MCULE-1729886523 [0,1,0,0,0,0|0,0,0]=1 576 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC MCULE-2521314466 [0,1,0,0,0,0|0,0,0]=1 577 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC MCULE-5130592222 [0,1,0,0,0,0|0,0,0]=1 578 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC MCULE-6653217048 [0,1,0,0,0,0|0,0,0]=1 579 B9R0.27 CC[C@H](C)[C@H](N)C(=O)CCl MCULE-2281100748 [0,1,0,0,0,0|1,0,0]=2 580 B9R0.27 CC[C@H](C)[C@H](N)C(=O)CCl MCULE-5249500214 [0,1,0,0,0,0|1,0,0]=2 581 B9R0.27 CC[C@H](C)[C@H](N)C(=O)CCl MCULE-6738846261 [0,1,0,0,0,0|1,0,0]=2 582 B9R0.27 CC[C@H](C)[C@H](N)C(=O)CCl MCULE-9006274135 [0,1,0,0,0,0|1,0,0]=2 583 B9R0.27 CC[C@H](C)[C@H](N)C(=O)NC MCULE-4817137974 [0,1,0,0,0,0|1,0,0]=2 584 B9R0.27 CC[C@H](C)[C@H](N)C(=O)NC MCULE-6810748923 [0,1,0,0,0,0|1,0,0]=2 585 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC MCULE-5150983559 [0,1,0,0,0,0|0,0,0]=1 586 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC MCULE-6620651568 [0,1,0,0,0,0|0,0,0]=1 587 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC MCULE-7115424543 [0,1,0,0,0,0|0,0,0]=1 588 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC MCULE-9658781072 [0,1,0,0,0,0|0,0,0]=1 589 B9R0.27 COC(=O)C(Br)C(C)OC MCULE-6549332688 [0,1,0,0,0,0|2,0,0]=3 590 B9R0.27 COC(=O)C(Cl)C(C)OC MCULE-5732373323 [0,1,0,0,0,0|2,0,0]=3 591 B9R0.27 COC(=O)C(N)C(=O)OC MCULE-2149912111 [0,1,0,0,0,0|2,0,1]=4 592 B9R0.27 COC(=O)C(N)C(=O)OC MCULE-3544655591 [0,1,0,0,0,0|2,0,1]=4 593 B9R0.27 COC(=O)C(O)C(C)OC MCULE-5538819656 [0,1,0,0,0,0|2,0,0]=3 594 B9R0.27 COC(=O)[C@@H](Br)[C@H](O)CBr MCULE-2908359031 [0,1,0,0,0,0|3,0,0]=4 595 B9R0.27 COC(=O)[C@@H](Cl)[C@@H](C)OC MCULE-1203632970 [0,1,0,0,0,0|2,0,0]=3 596 B9R0.27 O=C(CO)C(O)C(O)CO MCULE-8935556784 [0,1,0,0,0,0|3,0,0]=4 597 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CO MCULE-2725905076 [0,1,0,0,0,0|3,0,0]=4 598 B9R0.27 O=C(CO)[C@@H](O)[C@@H](O)CO MCULE-9876605173 [0,1,0,0,0,0|3,0,0]=4 599 B9R0.27 O=C(CO)[C@@H](O)[C@H](O)CO MCULE-7865729102 [0,1,0,0,0,0|3,0,0]=4 600 B9R0.27 O=C(CO)[C@@H](O)[C@H](O)CO MCULE-9552269577 [0,1,0,0,0,0|3,0,0]=4 601 B9R0.27 O=C(CO)[C@H](O)[C@@H](O)CO MCULE-2032052659 [0,1,0,0,0,0|3,0,0]=4 602 B9R0.27 O=C(CO)[C@H](O)[C@H](O)CO MCULE-5136624528 [0,1,0,0,0,0|3,0,0]=4 603 B9R0.28 CCC(C)C(F)(F)C(=O)O MCULE-8813807658 [0,1,0,0,0,0|1,0,0]=2 604 B9R0.28 CCC(O)C(F)(F)C(=O)O MCULE-8473962124 [0,1,0,0,0,0|2,0,0]=3 605 B9R0.28 CCN(C)C(C)(C)C(=O)O MCULE-1120650068 [0,1,0,0,0,0|2,0,0]=3 606 B9R0.29 CCC(C(=O)O)N(C)CC MCULE-1956799237 [0,1,0,0,0,0|2,0,0]=3 607 B9R0.29 CCC(C)C(CC)C(=O)N MCULE-4344033333 [0,1,0,0,0,0|2,0,0]=3 608 B9R0.29 CCC(C)C(NC)C(=O)O MCULE-1957885665 [0,1,0,0,0,0|0,0,0]=1 609 B9R0.29 CCC(C)C(OC)C(=O)O MCULE-7966384544 [0,1,0,0,0,0|1,0,0]=2 610 B9R0.29 CC[C@@H](C)[C@H](NC)C(=O)O MCULE-8364477291 [0,1,0,0,0,0|0,0,0]=1 611 B9R0.29 CC[C@H](C)[C@@H](CC)C(=O)N MCULE-3247505890 [0,1,0,0,0,0|2,0,0]=3 612 B9R0.29 CC[C@H](C)[C@@H](NC)C(=O)O MCULE-6136891317 [0,1,0,0,0,0|0,0,0]=1 613 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-1871065287 [0,1,0,0,0,0|0,0,0]=1 614 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-3891615565 [0,1,0,0,0,0|0,0,0]=1 615 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-9489341112 [0,1,0,0,0,0|0,0,0]=1 616 B9R0.29 COC(C)C(OC)C(=O)O MCULE-8500320405 [0,1,0,0,0,0|2,0,0]=3 617 B9R0.29 [C@H](C)(CC)[C@H](NC)C(=O)O MCULE-1663789159 [0,1,0,0,0,0|0,0,0]=1 618 B9R0.32 C=CC(C)(C)C(N)C(=O)O MCULE-2556027740 [0,1,0,0,0,0|0,0,2]=3 619 B9R0.32 CC(C)(CN)C(O)C(=O)O MCULE-1251426662 [0,1,0,0,0,0|2,0,0]=3 620 B9R0.32 CC(C)(CO)C(=O)C(=O)O MCULE-6046561180 [0,1,0,0,0,0|2,0,1]=4 621 B9R0.32 CC(C)(CO)C(O)C(=O)N MCULE-2942836455 [0,1,0,0,0,0|3,0,0]=4 622 B9R0.32 CC(C)(CO)C(O)C(=O)O MCULE-3752332762 [0,1,0,0,0,0|2,0,0]=3 623 B9R0.32 CC(C)(CO)C(O)C(=O)[O-] MCULE-8284553290 [0,1,0,0,0,0|2,0,1]=4 624 B9R0.32 CC(C)(CO)[C@@H](O)C(=O)O MCULE-7418140514 [0,1,0,0,0,0|2,0,0]=3 625 B9R0.32 CC(C)(CO)[C@@H](O)C(=O)[O-] MCULE-3131803550 [0,1,0,0,0,0|2,0,1]=4 626 B9R0.32 CCC(C)(C)C(=O)C(=O)O MCULE-2609139055 [0,1,0,0,0,0|1,0,1]=3 627 B9R0.32 CCC(C)(C)C(N)C(=O)O MCULE-2030759346 [0,1,0,0,0,0|0,0,0]=1 628 B9R0.32 CCC(C)(C)C(N)C(=O)O MCULE-8756866734 [0,1,0,0,0,0|0,0,0]=1 629 B9R0.32 CCC(C)(C)C(O)C(=O)O MCULE-6783140520 [0,1,0,0,0,0|1,0,0]=2 630 B9R0.32 CCC(C)(C)N(C)C(=O)Cl MCULE-2696642386 [0,1,0,0,0,0|3,0,0]=4 631 B9R0.32 CCC(C)(O)C(O)C(=O)O MCULE-6322081363 [0,1,0,0,0,0|1,0,0]=2 632 B9R0.32 CCS(=O)(=O)C(C)C(=O)O MCULE-8630070520 [0,1,0,0,0,0|3,0,0]=4 633 B9R0.32 COC(C)(C)C(Br)C(=O)O MCULE-4686359113 [0,1,0,0,0,0|2,0,0]=3 634 B9R0.32 COC(C)(C)C(N)C(=O)O MCULE-7291117506 [0,1,0,0,0,0|1,0,0]=2 635 B9R0.32 COC(C)(C)[C@H](N)C(=O)O MCULE-1351027484 [0,1,0,0,0,0|1,0,0]=2 636 B9R0.41 CCC(CC)C(C)C(=O)O MCULE-8487981910 [0,1,0,0,0,0|1,0,0]=2 637 B9R0.41 CCC(CC)C(N)C(=O)N MCULE-1437498037 [0,1,0,0,0,0|1,0,0]=2 638 B9R0.41 CCC(CC)C(N)C(=O)O MCULE-5833155408 [0,1,0,0,0,0|0,0,0]=1 639 B9R0.41 CCC(CC)C(N)C(=O)O MCULE-6712053086 [0,1,0,0,0,0|0,0,0]=1 640 B9R0.41 CCC(CC)C(O)C(=O)N MCULE-7184457381 [0,1,0,0,0,0|2,0,0]=3 641 B9R0.41 CCC(CC)[C@@H](N)C(=O)O MCULE-2731098319 [0,1,0,0,0,0|0,0,0]=1 642 B9R0.41 CCC(CC)[C@H](N)C(=O)O MCULE-2848963263 [0,1,0,0,0,0|0,0,0]=1 643 B9R0.41 CCC(CC)[C@H](N)C(=O)O MCULE-7573557331 [0,1,0,0,0,0|0,0,0]=1 644 B9R0.41 CCN(CC)C(=O)C(=O)O MCULE-9769368325 [0,1,0,0,0,0|2,0,1]=4 645 B9R0.41 CCN(CC)C(C)C(=O)O MCULE-1799679345 [0,1,0,0,0,0|2,0,0]=3 646 B9R0.41 COC(OC)C(C)C(=O)C MCULE-7475392468 [0,1,0,0,0,0|3,0,0]=4 647 B9R0.79 CC(=O)C(C)C(C)C(=O)C MCULE-1642593127 [0,1,0,0,0,0|2,0,1]=4 648 B9R0.79 CC(=O)N(C)C(C)C(=O)O MCULE-8770175961 [0,1,0,0,0,0|2,0,1]=4 649 B9R0.79 CC(C(=O)O)C(C)C(=O)O MCULE-6112773421 [0,1,0,0,0,0|2,0,1]=4 650 B9R0.79 CC(C(=O)O)C(N)C(=O)O MCULE-7699599383 [0,1,0,0,0,0|1,0,1]=3 651 B9R0.79 CC(C(=O)O)C(O)C(=O)O MCULE-1644748819 [0,1,0,0,0,0|2,0,1]=4 652 B9R0.79 CC(C(=O)O)[C@H](N)C(=O)O MCULE-1516476673 [0,1,0,0,0,0|1,0,1]=3 653 B9R0.79 CC(C)C(O)C(N)C(=O)O MCULE-8766263714 [0,1,0,0,0,0|1,0,0]=2 654 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O MCULE-5332720895 [0,1,0,0,0,0|1,0,0]=2 655 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O MCULE-5667397461 [0,1,0,0,0,0|2,0,0]=3 656 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(=O)O MCULE-2425417830 [0,1,0,0,0,0|1,0,0]=2 657 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-5438285037 [0,1,0,0,0,0|1,0,0]=2 658 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-6278820254 [0,1,0,0,0,0|1,0,0]=2 659 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-7542741263 [0,1,0,0,0,0|1,0,0]=2 660 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-8101644962 [0,1,0,0,0,0|1,0,0]=2 661 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-6429723072 [0,1,0,0,0,0|1,0,0]=2 662 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-8455636907 [0,1,0,0,0,0|1,0,0]=2 663 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9657202987 [0,1,0,0,0,0|1,0,0]=2 664 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9762128000 [0,1,0,0,0,0|1,0,0]=2 665 B9R0.79 CC(O)C(C)C(N)C(=O)O MCULE-2897656809 [0,1,0,0,0,0|0,0,0]=1 666 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-6535308910 [0,1,0,0,0,0|0,0,0]=1 667 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-8450789997 [0,1,0,0,0,0|0,0,0]=1 668 B9R0.79 C[C@H](C(=O)O)[C@@H](C)C(=O)O MCULE-1961663558 [0,1,0,0,0,0|2,0,1]=4 669 B9R0.79 C[C@H](C(=O)O)[C@@H](N)C(=O)O MCULE-1232463081 [0,1,0,0,0,0|1,0,1]=3 670 B9R0.79 C[C@H](C(=O)O)[C@H](N)C(=O)O MCULE-3277052139 [0,1,0,0,0,0|1,0,1]=3 671 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-1376333194 [0,1,0,0,0,0|0,0,0]=1 672 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-4005119004 [0,1,0,0,0,0|0,0,0]=1 673 B9R0.79 NC(C(=O)O)C(N)C(=O)O MCULE-8316230798 [0,1,0,0,0,0|2,0,1]=4 674 B9R0.79 NC(C(=O)O)C(O)C(=O)O MCULE-9532787420 [0,1,0,0,0,0|2,0,1]=4 675 B9R0.79 N[C@@H](C(=O)O)[C@@H](F)C(=O)O MCULE-2171226271 [0,1,0,0,0,0|2,0,1]=4 676 B9R0.79 N[C@H](C(=O)O)[C@@H](N)C(=O)O MCULE-6540811499 [0,1,0,0,0,0|2,0,1]=4 677 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O MCULE-1913101511 [0,1,0,0,0,0|2,0,1]=4 678 B9R0.79 N[C@H](C(=O)O)[C@H](O)C(=O)O MCULE-9488918896 [0,1,0,0,0,0|2,0,1]=4 679 B9R0.79 [C@@H](N)(C(=O)O)[C@@H](C)C(C)O MCULE-7488780154 [0,1,0,0,0,0|0,0,0]=1 680 B9R1.3 CC1C(=O)NCCN1C MCULE-4438877653 [0,0,0,1,0,0|3,0,0]=4 681 B9R1.3 CC1C(=O)NCCN1C MCULE-5252043587 [0,0,0,1,0,0|3,0,0]=4 682 B9R1.3 CC1CCCC(=O)C1=O MCULE-3677088238 [0,0,0,1,0,0|2,0,1]=4 683 B9R1.3 CC1CCCC(=O)C1C MCULE-1705022712 [0,0,0,1,0,0|2,0,0]=3 684 B9R1.3 CC1CCCC(C1C)O MCULE-1285216829 [0,0,0,1,0,0|2,0,1]=4 685 B9R1.3 CC1CCCC(C1N)C MCULE-4904455493 [0,0,0,1,0,0|2,0,1]=4 686 B9R1.3 CC1CCCC(C1N)C MCULE-9589109711 [0,0,0,1,0,0|2,0,1]=4 687 B9R1.3 CC1CCNC(=O)C1N MCULE-8466322754 [0,0,0,1,0,0|1,0,0]=2 688 B9R1.3 NC1C(CCCC1O)O MCULE-1978359416 [0,0,0,1,0,0|2,0,1]=4 689 B9R1.3 O=C1NCCC(C1Cl)O MCULE-3547246755 [0,0,0,1,0,0|3,0,0]=4 690 B9R1.3 O=C1NCC[C@H]([C@@H]1Cl)O MCULE-4122559640 [0,0,0,1,0,0|3,0,0]=4 691 B9R1.3 [C@@H]1(CCC[C@H]([C@@H]1N)O)O MCULE-9327450801 [0,0,0,1,0,0|2,0,1]=4 692 B9R1.37 CC1=C(C(=O)OC1C)O MCULE-8685541679 [0,0,0,1,0,0|1,0,2]=4 693 B9R1.37 CC1=C(C(OC1=O)C)C MCULE-1587463592 [0,0,0,1,0,0|1,0,2]=4 694 B9R1.37 CC1C(=O)OC(=O)C1C MCULE-1136120780 [0,0,0,1,0,0|2,0,1]=4 695 B9R1.37 CC1CC(=O)C(=O)C1C MCULE-1553900326 [0,0,0,1,0,0|2,0,1]=4 696 B9R1.37 CC1OC(=O)C(C1O)O MCULE-1862325809 [0,0,0,1,0,0|2,0,0]=3 697 B9R1.37 CC1OC(C(C1C)N)C MCULE-6300493082 [0,0,0,1,0,0|1,0,1]=3 698 B9R1.37 CC1OC(C(C1C)N)C MCULE-8122167979 [0,0,0,1,0,0|1,0,1]=3 699 B9R1.37 C[C@@H]1OC(=O)[C@@H]([C@H]1I)O MCULE-8523724511 [0,0,0,1,0,0|2,0,0]=3 700 B9R1.37 C[C@@H]1OC(=O)[C@@H]([C@H]1O)O MCULE-3554272195 [0,0,0,1,0,0|2,0,0]=3 701 B9R1.41 C1(CCCN1C)C(=O)O MCULE-7988130618 [0,0,0,1,0,0|2,0,0]=3 702 B9R1.41 CC1=C(CCC1)C(=O)O MCULE-4166872703 [0,0,0,1,0,0|1,0,2]=4 703 B9R1.41 CC1CCCC1C(=O)O MCULE-5150428001 [0,0,0,1,0,0|1,0,0]=2 704 B9R1.41 CC1CCNC1C(=O)O MCULE-3835684911 [0,0,0,1,0,0|0,0,0]=1 705 B9R1.41 CC1CCNC1C(=O)O MCULE-8361777649 [0,0,0,1,0,0|0,0,0]=1 706 B9R1.41 CC1CNCC1C(=O)O MCULE-1581522558 [0,0,0,1,0,0|2,0,0]=3 707 B9R1.41 CC1CNCC1C(=O)O MCULE-6848551085 [0,0,0,1,0,0|2,0,0]=3 708 B9R1.41 CC1NCCC1C(=O)O MCULE-5042669811 [0,0,0,1,0,0|2,0,0]=3 709 B9R1.41 CC1NCCC1C(=O)O MCULE-8546677468 [0,0,0,1,0,0|2,0,0]=3 710 B9R1.41 CC1OCCC1C(=O)O MCULE-4181521736 [0,0,0,1,0,0|2,0,0]=3 711 B9R1.41 CN1CC=CC1C(=O)O MCULE-5525753116 [0,0,0,1,0,0|2,0,1]=4 712 B9R1.41 CN1CC=CC1C(=O)O MCULE-8585806688 [0,0,0,1,0,0|2,0,1]=4 713 B9R1.41 CN1CCCC1C(=O)N MCULE-1474656837 [0,0,0,1,0,0|3,0,0]=4 714 B9R1.41 CN1CCCC1C(=O)O MCULE-4884381644 [0,0,0,1,0,0|2,0,0]=3 715 B9R1.41 CN1CCCC1C(=O)O MCULE-6241162207 [0,0,0,1,0,0|2,0,0]=3 716 B9R1.41 CN1CCCC1C(=O)O MCULE-7232060205 [0,0,0,1,0,0|2,0,0]=3 717 B9R1.41 CN1CCC[C@@H]1C(=O)N MCULE-1129223179 [0,0,0,1,0,0|3,0,0]=4 718 B9R1.41 CN1CCC[C@@H]1C(=O)N MCULE-1418743058 [0,0,0,1,0,0|3,0,0]=4 719 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-3947573313 [0,0,0,1,0,0|2,0,0]=3 720 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-4168419254 [0,0,0,1,0,0|2,0,0]=3 721 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-6504349835 [0,0,0,1,0,0|2,0,0]=3 722 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-9943329201 [0,0,0,1,0,0|2,0,0]=3 723 B9R1.41 CN1CCC[C@H]1C(=O)N MCULE-1155656545 [0,0,0,1,0,0|3,0,0]=4 724 B9R1.41 CN1CCC[C@H]1C(=O)N MCULE-5987152150 [0,0,0,1,0,0|3,0,0]=4 725 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-1661156416 [0,0,0,1,0,0|2,0,0]=3 726 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-2535799805 [0,0,0,1,0,0|2,0,0]=3 727 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-3283459585 [0,0,0,1,0,0|2,0,0]=3 728 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-5506159927 [0,0,0,1,0,0|2,0,0]=3 729 B9R1.41 CN1CSCC1C(=O)O MCULE-6053778396 [0,0,0,1,0,0|3,0,0]=4 730 B9R1.41 CN1CSCC1C(=O)O MCULE-8768199445 [0,0,0,1,0,0|3,0,0]=4 731 B9R1.41 CN1CSC[C@@H]1C(=O)O MCULE-9390031358 [0,0,0,1,0,0|3,0,0]=4 732 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-2295281512 [0,0,0,1,0,0|3,0,0]=4 733 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-3344236668 [0,0,0,1,0,0|3,0,0]=4 734 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-6116857567 [0,0,0,1,0,0|3,0,0]=4 735 B9R1.41 CN1CSC[C@H]1C(=O)O MCULE-7315008971 [0,0,0,1,0,0|3,0,0]=4 736 B9R1.41 C[C@@H]1CCN[C@@H]1C(=O)O MCULE-6239309390 [0,0,0,1,0,0|0,0,0]=1 737 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-1608471752 [0,0,0,1,0,0|0,0,0]=1 738 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-2896759092 [0,0,0,1,0,0|0,0,0]=1 739 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O MCULE-5338216485 [0,0,0,1,0,0|1,0,0]=2 740 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-3425733853 [0,0,0,1,0,0|2,0,0]=3 741 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-5424989009 [0,0,0,1,0,0|2,0,0]=3 742 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O MCULE-1674735474 [0,0,0,1,0,0|2,0,0]=3 743 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-8959062032 [0,0,0,1,0,0|2,0,0]=3 744 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-9340754868 [0,0,0,1,0,0|2,0,0]=3 745 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4624227681 [0,0,0,1,0,0|2,0,0]=3 746 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4653588182 [0,0,0,1,0,0|2,0,0]=3 747 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-1694933393 [0,0,0,1,0,0|0,0,0]=1 748 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-9088637113 [0,0,0,1,0,0|0,0,0]=1 749 B9R1.41 C[C@H]1CCN[C@H]1C(=O)O MCULE-1449988566 [0,0,0,1,0,0|0,0,0]=1 750 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-3190006541 [0,0,0,1,0,0|2,0,0]=3 751 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-7835079063 [0,0,0,1,0,0|2,0,0]=3 752 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-1189864899 [0,0,0,1,0,0|2,0,0]=3 753 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-8012665255 [0,0,0,1,0,0|2,0,0]=3 754 B9R1.41 NC(=O)C1CCCC1N MCULE-5593863466 [0,0,0,1,0,0|3,0,0]=4 755 B9R1.41 NC(=O)C1CCCC1N MCULE-7208597206 [0,0,0,1,0,0|3,0,0]=4 756 B9R1.41 NC(=O)C1NCCC1O MCULE-1947851170 [0,0,0,1,0,0|2,0,0]=3 757 B9R1.41 NC(=O)C1NCCC1O MCULE-8983481897 [0,0,0,1,0,0|2,0,0]=3 758 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-1275176642 [0,0,0,1,0,0|3,0,0]=4 759 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2107283008 [0,0,0,1,0,0|3,0,0]=4 760 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-2865532845 [0,0,0,1,0,0|3,0,0]=4 761 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1N MCULE-3874121291 [0,0,0,1,0,0|3,0,0]=4 762 B9R1.41 NC(=O)[C@@H]1CCC[C@@H]1O MCULE-7290076922 [0,0,0,1,0,0|3,0,0]=4 763 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-1119399523 [0,0,0,1,0,0|2,0,0]=3 764 B9R1.41 NC(=O)[C@H]1NCC[C@@H]1O MCULE-4733398267 [0,0,0,1,0,0|2,0,0]=3 765 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8085547151 [0,0,0,1,0,0|2,0,0]=3 766 B9R1.41 NC(=O)[C@H]1NCC[C@H]1O MCULE-8491779714 [0,0,0,1,0,0|2,0,0]=3 767 B9R1.41 NC1CCCC1C(=O)O MCULE-4916984038 [0,0,0,1,0,0|2,0,0]=3 768 B9R1.41 NC1CCCC1C(=O)O MCULE-7220342321 [0,0,0,1,0,0|2,0,0]=3 769 B9R1.41 NC1CCNC1C(=O)O MCULE-3789976956 [0,0,0,1,0,0|1,0,0]=2 770 B9R1.41 NC1CCNC1C(=O)O MCULE-5356536056 [0,0,0,1,0,0|1,0,0]=2 771 B9R1.41 NC1CNCC1C(=O)O MCULE-1244086282 [0,0,0,1,0,0|3,0,0]=4 772 B9R1.41 NC1COCC1C(=O)O MCULE-7325840275 [0,0,0,1,0,0|3,0,0]=4 773 B9R1.41 NC1COCC1C(=O)O MCULE-9068897815 [0,0,0,1,0,0|3,0,0]=4 774 B9R1.41 NN1CCCC1C(=O)O MCULE-1374834183 [0,0,0,1,0,0|3,0,0]=4 775 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-3446631182 [0,0,0,1,0,0|2,0,0]=3 776 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-4537266002 [0,0,0,1,0,0|2,0,0]=3 777 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9091292908 [0,0,0,1,0,0|2,0,0]=3 778 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9780104108 [0,0,0,1,0,0|2,0,0]=3 779 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-1397305924 [0,0,0,1,0,0|2,0,0]=3 780 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-5447983159 [0,0,0,1,0,0|2,0,0]=3 781 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-6345808896 [0,0,0,1,0,0|2,0,0]=3 782 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-7658809060 [0,0,0,1,0,0|2,0,0]=3 783 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-1080605796 [0,0,0,1,0,0|1,0,0]=2 784 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5666272526 [0,0,0,1,0,0|1,0,0]=2 785 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5723263979 [0,0,0,1,0,0|1,0,0]=2 786 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-6574312344 [0,0,0,1,0,0|1,0,0]=2 787 B9R1.41 N[C@@H]1COC[C@@H]1C(=O)O MCULE-9833243208 [0,0,0,1,0,0|3,0,0]=4 788 B9R1.41 N[C@@H]1COC[C@H]1C(=O)O MCULE-7323429960 [0,0,0,1,0,0|3,0,0]=4 789 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-5128495564 [0,0,0,1,0,0|2,0,0]=3 790 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-7721875754 [0,0,0,1,0,0|2,0,0]=3 791 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-8287396944 [0,0,0,1,0,0|2,0,0]=3 792 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9470915806 [0,0,0,1,0,0|2,0,0]=3 793 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9776724097 [0,0,0,1,0,0|2,0,0]=3 794 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9997148303 [0,0,0,1,0,0|2,0,0]=3 795 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-1768949677 [0,0,0,1,0,0|2,0,0]=3 796 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-2999200875 [0,0,0,1,0,0|2,0,0]=3 797 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-4735278058 [0,0,0,1,0,0|2,0,0]=3 798 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-7501259126 [0,0,0,1,0,0|2,0,0]=3 799 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O MCULE-4396526735 [0,0,0,1,0,0|3,0,0]=4 800 B9R1.41 N[C@H]1COC[C@@H]1C(=O)O MCULE-9025415433 [0,0,0,1,0,0|3,0,0]=4 801 B9R1.41 N[C@H]1COC[C@H]1C(=O)O MCULE-2956846972 [0,0,0,1,0,0|3,0,0]=4 802 B9R1.41 N[C@H]1COC[C@H]1C(=O)O MCULE-3321988270 [0,0,0,1,0,0|3,0,0]=4 803 B9R1.41 O=C(O)C1CCCC1=O MCULE-9500236289 [0,0,0,1,0,0|2,0,1]=4 804 B9R1.41 O=C(O)C1CCCC1O MCULE-5519958446 [0,0,0,1,0,0|2,0,0]=3 805 B9R1.41 O=C(O)C1CNCC1O MCULE-4948062518 [0,0,0,1,0,0|3,0,0]=4 806 B9R1.41 O=C(O)C1CNCC1O MCULE-8113161890 [0,0,0,1,0,0|3,0,0]=4 807 B9R1.41 O=C(O)C1COCC1F MCULE-8830875984 [0,0,0,1,0,0|3,0,0]=4 808 B9R1.41 O=C(O)C1NCCC1F MCULE-2108063646 [0,0,0,1,0,0|1,0,0]=2 809 B9R1.41 O=C(O)C1NCCC1F MCULE-6901343291 [0,0,0,1,0,0|1,0,0]=2 810 B9R1.41 O=C(O)C1NCCC1O MCULE-3415911467 [0,0,0,1,0,0|1,0,0]=2 811 B9R1.41 O=C(O)C1NCCC1O MCULE-3678949962 [0,0,0,1,0,0|1,0,0]=2 812 B9R1.41 O=C(O)C1NCCC1O MCULE-6594922763 [0,0,0,1,0,0|1,0,0]=2 813 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-3174474393 [0,0,0,1,0,0|1,0,0]=2 814 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-5151888407 [0,0,0,1,0,0|1,0,0]=2 815 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1216340314 [0,0,0,1,0,0|1,0,0]=2 816 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1564327038 [0,0,0,1,0,0|1,0,0]=2 817 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-8208546333 [0,0,0,1,0,0|1,0,0]=2 818 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9489383113 [0,0,0,1,0,0|1,0,0]=2 819 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9999937302 [0,0,0,1,0,0|1,0,0]=2 820 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7001095632 [0,0,0,1,0,0|1,0,0]=2 821 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7931619369 [0,0,0,1,0,0|1,0,0]=2 822 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-1637514285 [0,0,0,1,0,0|1,0,0]=2 823 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-7041138309 [0,0,0,1,0,0|1,0,0]=2 824 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9174140225 [0,0,0,1,0,0|1,0,0]=2 825 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9867563873 [0,0,0,1,0,0|1,0,0]=2 826 B9R1.41 O=C(O)[C@@H]1[NH2+]CC[C@@H]1O MCULE-4350473030 [0,0,0,1,0,0|1,0,1]=3 827 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O MCULE-7220456005 [0,0,0,1,0,0|2,0,0]=3 828 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-1175817797 [0,0,0,1,0,0|1,0,0]=2 829 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-5823079222 [0,0,0,1,0,0|1,0,0]=2 830 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-6437141041 [0,0,0,1,0,0|1,0,0]=2 831 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-8496599400 [0,0,0,1,0,0|1,0,0]=2 832 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-1891620706 [0,0,0,1,0,0|1,0,0]=2 833 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2757873569 [0,0,0,1,0,0|1,0,0]=2 834 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2760733859 [0,0,0,1,0,0|1,0,0]=2 835 B9R1.41 O=C(O)[C@H]1NCC[C@H]1F MCULE-8117073613 [0,0,0,1,0,0|1,0,0]=2 836 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-2253713572 [0,0,0,1,0,0|1,0,0]=2 837 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-4523708371 [0,0,0,1,0,0|1,0,0]=2 838 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6240521801 [0,0,0,1,0,0|1,0,0]=2 839 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6709232399 [0,0,0,1,0,0|1,0,0]=2 840 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6746975985 [0,0,0,1,0,0|1,0,0]=2 841 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-8268334758 [0,0,0,1,0,0|1,0,0]=2 842 B9R1.41 [C@@H]1(CCN[C@H]1C(=O)O)O MCULE-2060265421 [0,0,0,1,0,0|1,0,0]=2 843 B9R1.41 [C@@H]1(NCC[C@H]1O)C(=O)O MCULE-1208236317 [0,0,0,1,0,0|1,0,0]=2 844 B9R1.41 [C@H]1(CCN[C@H]1C(=O)O)O MCULE-3906438921 [0,0,0,1,0,0|1,0,0]=2 845 B9R1.45 C=C1CC1C(N)C(=O)O MCULE-7249491598 [0,0,0,1,0,0|0,0,2]=3 846 B9R1.93 C=C[C@@H]1C[C@]1(N)C(=O)O MCULE-4179168539 [0,0,0,1,0,0|0,0,2]=3 847 B9R1.93 CCC1CC1(N)C(=O)O MCULE-5139419329 [0,0,0,1,0,0|0,0,0]=1 848 B9R1.96 C1(NCC1CC)C(=O)O MCULE-9517338987 [0,0,0,1,0,0|0,0,0]=1 849 B9R1.96 CCC1CNC1C(=O)O MCULE-5561702986 [0,0,0,1,0,0|0,0,0]=1 850 B9R1.96 CCC1CN[C@@H]1C(=O)O MCULE-1585063492 [0,0,0,1,0,0|0,0,0]=1 851 B9R1.96 CCC1CN[C@@H]1C(=O)O MCULE-7143773936 [0,0,0,1,0,0|0,0,0]=1 852 B9R1.96 CCN1CCC1C(=O)O MCULE-9616158921 [0,0,0,1,0,0|2,0,0]=3 853 B9R1.96 CCN1CC[C@H]1C(=O)O MCULE-1971461514 [0,0,0,1,0,0|2,0,0]=3 854 B9R1.96 CCN1CC[C@H]1C(=O)O MCULE-4762142431 [0,0,0,1,0,0|2,0,0]=3 855 B9R1.96 N#CC1CCC1C(=O)O MCULE-1939970378 [0,0,0,1,0,0|2,0,1]=4 856 B9R1.96 O=C(O)C1CCC1CO MCULE-9648982851 [0,0,0,1,0,0|2,0,0]=3 857 B9R1.96 O=C([O-])C1CCC1CO MCULE-8666321081 [0,0,0,1,0,0|2,0,1]=4 858 B9R1.110 C(N)(C(=O)O)C1CCC1 MCULE-9659994288 [0,0,0,1,0,0|0,0,0]=1 859 B9R1.110 C(N)(C(=O)O)C1COC1 MCULE-5400337176 [0,0,0,1,0,0|1,0,0]=2 860 B9R1.110 C=C(C(=O)O)C1CCC1 MCULE-2578265979 [0,0,0,1,0,0|1,0,1]=3 861 B9R1.110 CC(=C1CCC1)C(=O)O MCULE-8904503252 [0,0,0,1,0,0|1,0,2]=4 862 B9R1.110 CC(=O)N(C)C1CCC1 MCULE-6997854698 [0,0,0,1,0,0|3,0,0]=4 863 B9R1.110 CC(C(=O)N)C1CNC1 MCULE-8664603287 [0,0,0,1,0,0|3,0,0]=4 864 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-1352377374 [0,0,0,1,0,0|1,0,0]=2 865 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-3278183132 [0,0,0,1,0,0|1,0,0]=2 866 B9R1.110 CC(C(=O)O)C1CCO1 MCULE-4481804660 [0,0,0,1,0,0|2,0,0]=3 867 B9R1.110 CC(C(=O)O)C1CNC1 MCULE-3425038216 [0,0,0,1,0,0|2,0,0]=3 868 B9R1.110 CC(C(=O)O)C1CNC1 MCULE-8368638713 [0,0,0,1,0,0|2,0,0]=3 869 B9R1.110 CC(C(=O)O)C1COC1 MCULE-1438881074 [0,0,0,1,0,0|2,0,0]=3 870 B9R1.110 CC(C(=O)O)N1CCC1 MCULE-9923940575 [0,0,0,1,0,0|2,0,0]=3 871 B9R1.110 CC(C)C(N)C1CCC1 MCULE-3337597801 [0,0,0,1,0,0|2,0,1]=4 872 B9R1.110 CN(C(=O)Cl)C1CCC1 MCULE-6620618396 [0,0,0,1,0,0|3,0,0]=4 873 B9R1.110 NC(=O)C(N)C1CCC1 MCULE-3518352563 [0,0,0,1,0,0|1,0,0]=2 874 B9R1.110 NC(C(=O)O)C1CCC1 MCULE-3775442501 [0,0,0,1,0,0|0,0,0]=1 875 B9R1.110 NC(C(=O)O)C1CCC1 MCULE-4685141546 [0,0,0,1,0,0|0,0,0]=1 876 B9R1.110 NC(C(=O)O)C1COC1 MCULE-1331194239 [0,0,0,1,0,0|1,0,0]=2 877 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-2214697836 [0,0,0,1,0,0|0,0,0]=1 878 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-7786634114 [0,0,0,1,0,0|0,0,0]=1 879 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-8265180180 [0,0,0,1,0,0|0,0,0]=1 880 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-9469768507 [0,0,0,1,0,0|0,0,0]=1 881 B9R1.110 N[C@@H](C(=O)O)C1COC1 MCULE-4389145324 [0,0,0,1,0,0|1,0,0]=2 882 B9R1.110 N[C@@H](C(=O)O)C1COC1 MCULE-4852474986 [0,0,0,1,0,0|1,0,0]=2 883 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-4701147798 [0,0,0,1,0,0|0,0,0]=1 884 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-5196473423 [0,0,0,1,0,0|0,0,0]=1 885 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-8882106256 [0,0,0,1,0,0|0,0,0]=1 886 B9R1.110 N[C@H](C(=O)O)C1COC1 MCULE-3016057788 [0,0,0,1,0,0|1,0,0]=2 887 B9R1.110 N[C@H](C(=O)O)C1COC1 MCULE-8770476335 [0,0,0,1,0,0|1,0,0]=2 888 B9R1.110 O=C(O)C(=C1CCC1)F MCULE-3335084975 [0,0,0,1,0,0|1,0,2]=4 889 B9R1.110 O=C(O)C(=O)C1CCC1 MCULE-3680158952 [0,0,0,1,0,0|1,0,1]=3 890 B9R1.110 O=C(O)C(=O)N1CCC1 MCULE-2155911842 [0,0,0,1,0,0|2,0,1]=4 891 B9R1.110 O=C(O)C(Br)C1CCC1 MCULE-4353551170 [0,0,0,1,0,0|1,0,0]=2 892 B9R1.110 O=C(O)C(F)C1CCC1 MCULE-8989287343 [0,0,0,1,0,0|1,0,0]=2 893 B9R1.110 O=C(O)C(O)C1CCC1 MCULE-8720651836 [0,0,0,1,0,0|1,0,0]=2 894 B9R1.110 O=C(O)[C@@H](O)C1CCC1 MCULE-7295025986 [0,0,0,1,0,0|1,0,0]=2 895 B9R1.110 O=C(O)[C@H](O)C1CCC1 MCULE-7776940136 [0,0,0,1,0,0|1,0,0]=2 896 B9R1.111 CC(C(=O)O)C1(CC1)N MCULE-1517881247 [0,0,0,1,0,0|2,0,0]=3 897 B9R1.111 CC1(CC1)C(N)C(=O)O MCULE-6145936175 [0,0,0,1,0,0|0,0,0]=1 898 B9R1.111 CC1(CC1)C(N)C(=O)O MCULE-7535494625 [0,0,0,1,0,0|0,0,0]=1 899 B9R1.111 CC1(CC1)C(O)C(=O)O MCULE-9368385665 [0,0,0,1,0,0|1,0,0]=2 900 B9R1.111 CC1(CC1)[C@H](N)C(=O)O MCULE-1811208675 [0,0,0,1,0,0|0,0,0]=1 901 B9R1.111 CC1(CC1)[C@H](N)C(=O)O MCULE-7721561513 [0,0,0,1,0,0|0,0,0]=1 902 B9R1.111 NC(C(=O)O)C1(CC1)O MCULE-6983168418 [0,0,0,1,0,0|1,0,0]=2 903 B9R1.111 NC(C(=O)O)C1(CC1)O MCULE-8148582012 [0,0,0,1,0,0|1,0,0]=2 904 B9R1.111 N[C@@H](C(=O)O)C1(CC1)O MCULE-3141771978 [0,0,0,1,0,0|1,0,0]=2 905 B9R1.111 N[C@H](C(=O)O)C1(CC1)O MCULE-9602505956 [0,0,0,1,0,0|1,0,0]=2 906 B9R1.111 O=C(O)C(=O)C1(CC1)F MCULE-2939361516 [0,0,0,1,0,0|2,0,1]=4 907 B9R1.111 [C@@H](N)(C(=O)O)C1(CC1)C MCULE-5173033031 [0,0,0,1,0,0|0,0,0]=1 908 B9R1.111 [C@@H](N)(C(=O)O)C1(CC1)C MCULE-8799551410 [0,0,0,1,0,0|0,0,0]=1 909 B9R1.127 CCC1(CC1C(=O)O)C MCULE-5907126944 [0,0,0,1,0,0|1,0,0]=2 910 B9R1.132 CN1C(=O)OCC1CN MCULE-6042520549 [0,0,0,1,0,0|3,0,0]=4 911 B9R1.132 CN1C(=O)OCC1CO MCULE-8007610205 [0,0,0,1,0,0|3,0,0]=4 912 B9R0.23 C(N)(CC(=O)O)C(=O)OC MCULE-3786901582 [0,0,0,0,0,1|2,0,1]=4 913 B9R0.23 CCC(C)C(=N)CC(=O)C MCULE-9690278340 [0,0,0,0,0,1|1,0,2]=4 914 B9R0.23 CCC(C)C(=O)CC(=O)C MCULE-8072360859 [0,0,0,0,0,1|2,0,1]=4 915 B9R0.23 CCC(C)C(N)CC(=O)O MCULE-4327977098 [0,0,0,0,0,1|0,0,0]=1 916 B9R0.23 CCC(C)C(N)CC(=O)O MCULE-9731178196 [0,0,0,0,0,1|0,0,0]=1 917 B9R0.23 CCN(C)C(C)CC(=O)O MCULE-8864839000 [0,0,0,0,0,1|2,0,0]=3 918 B9R0.23 CCN(C)C(C)CC(=O)O MCULE-9691138087 [0,0,0,0,0,1|2,0,0]=3 919 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-3497593262 [0,0,0,0,0,1|0,0,0]=1 920 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-4155901879 [0,0,0,0,0,1|0,0,0]=1 921 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-8221314475 [0,0,0,0,0,1|0,0,0]=1 922 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-9196761404 [0,0,0,0,0,1|0,0,0]=1 923 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O MCULE-2430009158 [0,0,0,0,0,1|0,0,0]=1 924 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O MCULE-9647386489 [0,0,0,0,0,1|0,0,0]=1 925 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-2618743733 [0,0,0,0,0,1|0,0,0]=1 926 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-5773439736 [0,0,0,0,0,1|0,0,0]=1 927 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-6590436922 [0,0,0,0,0,1|0,0,0]=1 928 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-9722049324 [0,0,0,0,0,1|0,0,0]=1 929 B9R0.23 COC(=O)C(N)CC(=O)O MCULE-7519781259 [0,0,0,0,0,1|2,0,1]=4 930 B9R0.23 COC(=O)[C@@H](N)CC(=O)O MCULE-2094999701 [0,0,0,0,0,1|2,0,1]=4 931 B9R0.23 COC(=O)[C@@H](N)CC(=O)O MCULE-9407721038 [0,0,0,0,0,1|2,0,1]=4 932 B9R0.23 COC(=O)[C@H](N)CC(=O)O MCULE-1453787543 [0,0,0,0,0,1|2,0,1]=4 933 B9R0.23 COC(=O)[C@H](N)CC(=O)O MCULE-8348108837 [0,0,0,0,0,1|2,0,1]=4 934 B9R0.23 COC(=O)[C@H](N)CC(=O)O MCULE-8725707708 [0,0,0,0,0,1|2,0,1]=4 935 B9R0.23 O=C(O)C[C@@H](O)[C@@H](O)CO MCULE-5394522095 [0,0,0,0,0,1|3,0,0]=4 936 B9R0.23 O=C(O)C[C@H](O)[C@H](O)CO MCULE-2704229472 [0,0,0,0,0,1|3,0,0]=4 937 B9R0.23 [C@H](N)(CC(=O)O)C(=O)OC MCULE-3013306674 [0,0,0,0,0,1|2,0,1]=4 938 B9R0.42 C(N)(CC(=O)OC)C(=O)O MCULE-8015036052 [0,0,0,0,0,1|2,0,1]=4 939 B9R0.42 CC(CO)CC(N)C(=O)O MCULE-1659842949 [0,0,0,0,0,1|1,0,0]=2 940 B9R0.42 CCC(=O)CC(N)C(=O)O MCULE-7167843152 [0,0,0,0,0,1|1,0,1]=3 941 B9R0.42 CCC(=O)CC(N)C(=O)O MCULE-9225518491 [0,0,0,0,0,1|1,0,1]=3 942 B9R0.42 CCC(=O)NC(C)C(=O)O MCULE-5488194337 [0,0,0,0,0,1|2,0,1]=4 943 B9R0.42 CCC(=O)N[C@@H](C)C(=O)O MCULE-5552061501 [0,0,0,0,0,1|2,0,1]=4 944 B9R0.42 CCC(C)CC(C)C(=O)O MCULE-6856405301 [0,0,0,0,0,1|1,0,0]=2 945 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-1321158720 [0,0,0,0,0,1|0,0,0]=1 946 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-9833457318 [0,0,0,0,0,1|0,0,0]=1 947 B9R0.42 CCC(C)NC(=O)C(=O)O MCULE-6488437367 [0,0,0,0,0,1|1,0,1]=3 948 B9R0.42 CCN(C)CC(C)C(=O)O MCULE-6094320295 [0,0,0,0,0,1|2,0,0]=3 949 B9R0.42 CCN(C)CC(C)C(=O)O MCULE-8043640135 [0,0,0,0,0,1|2,0,0]=3 950 B9R0.42 CNC(=O)CC(N)C(=O)O MCULE-1910017583 [0,0,0,0,0,1|2,0,1]=4 951 B9R0.42 CNC(=O)CC(N)C(=O)O MCULE-2273353640 [0,0,0,0,0,1|2,0,1]=4 952 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O MCULE-6316771422 [0,0,0,0,0,1|2,0,1]=4 953 B9R0.42 CNC(=O)C[C@@H](N)C(=O)O MCULE-8833942582 [0,0,0,0,0,1|2,0,1]=4 954 B9R0.42 CNC(=O)C[C@H](N)C(=O)O MCULE-7953918935 [0,0,0,0,0,1|2,0,1]=4 955 B9R0.42 CNC(=O)C[C@H](N)C(=O)O MCULE-9595811834 [0,0,0,0,0,1|2,0,1]=4 956 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-1915038693 [0,0,0,0,0,1|2,0,1]=4 957 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-4452484594 [0,0,0,0,0,1|2,0,1]=4 958 B9R0.42 COC(=O)CC(N)C(=O)O MCULE-8573910427 [0,0,0,0,0,1|2,0,1]=4 959 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-2364792775 [0,0,0,0,0,1|2,0,1]=4 960 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-3240459376 [0,0,0,0,0,1|2,0,1]=4 961 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-5997294610 [0,0,0,0,0,1|2,0,1]=4 962 B9R0.42 COC(=O)C[C@@H](N)C(=O)O MCULE-6955235147 [0,0,0,0,0,1|2,0,1]=4 963 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-3838383924 [0,0,0,0,0,1|2,0,1]=4 964 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-4621655906 [0,0,0,0,0,1|2,0,1]=4 965 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-5113413935 [0,0,0,0,0,1|2,0,1]=4 966 B9R0.42 COC(=O)C[C@H](N)C(=O)O MCULE-9857677224 [0,0,0,0,0,1|2,0,1]=4 967 B9R0.42 NCC(=O)CC(N)C(=O)O MCULE-5617919538 [0,0,0,0,0,1|2,0,1]=4 968 B9R0.42 NCC(=O)CC(N)C(=O)O MCULE-5853178152 [0,0,0,0,0,1|2,0,1]=4 969 B6R0.1 C#CC(N)CCC MCULE-1649795667 [2,0,0,0,0,0|1,0,1]=4 970 B6R0.1 C#CC(N)CCC MCULE-4074347601 [2,0,0,0,0,0|1,0,1]=4 971 B6R0.1 C=CC(C)CCC MCULE-2692803387 [2,0,0,0,0,0|2,0,0]=4 972 B6R0.1 C=CC(N)CCO MCULE-7781906138 [2,0,0,0,0,0|2,0,0]=4 973 B6R0.1 C=CC(N)COC MCULE-3217346081 [2,0,0,0,0,0|2,0,0]=4 974 B6R0.1 C=CC(O)CCC MCULE-3664453040 [2,0,0,0,0,0|2,0,0]=4 975 B6R0.1 C=CCC(C)CC MCULE-8680856865 [2,0,0,0,0,0|1,0,0]=3 976 B6R0.1 C=CCC(C)CO MCULE-9174943108 [2,0,0,0,0,0|2,0,0]=4 977 B6R0.1 C=CCC(N)CC MCULE-2309097248 [2,0,0,0,0,0|2,0,0]=4 978 B6R0.1 C=CCC(N)CC MCULE-8356954197 [2,0,0,0,0,0|2,0,0]=4 979 B6R0.1 C=CCC(O)CC MCULE-1497539816 [2,0,0,0,0,0|2,0,0]=4 980 B6R0.1 C=CC[C@@H](O)CC MCULE-3259102701 [2,0,0,0,0,0|2,0,0]=4 981 B6R0.1 C=CC[C@H](O)CC MCULE-6527977219 [2,0,0,0,0,0|2,0,0]=4 982 B6R0.1 CC(CN)CCO MCULE-5515163518 [2,0,0,0,0,0|1,0,1]=4 983 B6R0.1 CC(CO)CCO MCULE-5240961149 [2,0,0,0,0,0|1,0,1]=4 984 B6R0.1 CC(CO)CCO MCULE-8678967805 [2,0,0,0,0,0|1,0,1]=4 985 B6R0.1 CCC(C)C=NO MCULE-2829500970 [2,0,0,0,0,0|1,0,1]=4 986 B6R0.1 CCC(C)CC#N MCULE-8784266918 [2,0,0,0,0,0|1,0,1]=4 987 B6R0.1 CCC(C)CC=O MCULE-9143756592 [2,0,0,0,0,0|0,0,0]=2 988 B6R0.1 CCC(C)CCBr MCULE-6033010731 [2,0,0,0,0,0|1,0,1]=4 989 B6R0.1 CCC(C)CCCl MCULE-2069721626 [2,0,0,0,0,0|1,0,1]=4 990 B6R0.1 CCC(C)CCN MCULE-4140800594 [2,0,0,0,0,0|1,0,1]=4 991 B6R0.1 CCC(C)CCN MCULE-5509248218 [2,0,0,0,0,0|1,0,1]=4 992 B6R0.1 CCC(C)CCO MCULE-6482427735 [2,0,0,0,0,0|0,0,1]=3 993 B6R0.1 CCC(C)CNC MCULE-1998406301 [2,0,0,0,0,0|2,0,0]=4 994 B6R0.1 CCC(C)CNC MCULE-5957910094 [2,0,0,0,0,0|2,0,0]=4 995 B6R0.1 CCC(C)CON MCULE-7033012303 [2,0,0,0,0,0|2,0,0]=4 996 B6R0.1 CCC(C)N=C=O MCULE-4771945289 [2,0,0,0,0,0|1,0,1]=4 997 B6R0.1 CCC(C)NC=O MCULE-2197007756 [2,0,0,0,0,0|1,0,0]=3 998 B6R0.1 CCC(C)OC=O MCULE-9361787208 [2,0,0,0,0,0|1,0,0]=3 999 B6R0.1 CCC(N)CCO MCULE-1511155206 [2,0,0,0,0,0|1,0,1]=4 1000 B6R0.1 CCC(N)CCO MCULE-5525302643 [2,0,0,0,0,0|1,0,1]=4 1001 B6R0.1 CCC(O)CCO MCULE-5156075792 [2,0,0,0,0,0|1,0,1]=4 1002 B6R0.1 CCC(S)CCO MCULE-4193788852 [2,0,0,0,0,0|1,0,1]=4 1003 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [2,0,0,0,0,0|1,0,1]=4 1004 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [2,0,0,0,0,0|1,0,1]=4 1005 B6R0.1 CCCC(C)C=O MCULE-9756444218 [2,0,0,0,0,0|1,0,0]=3 1006 B6R0.1 CCCC(C)CC MCULE-7082933967 [2,0,0,0,0,0|1,0,1]=4 1007 B6R0.1 CCCC(C)CO MCULE-9777250826 [2,0,0,0,0,0|1,0,1]=4 1008 B6R0.1 CCCC(N)C#N MCULE-6830545935 [2,0,0,0,0,0|1,0,1]=4 1009 B6R0.1 CCCC(N)C#N MCULE-9818121096 [2,0,0,0,0,0|1,0,1]=4 1010 B6R0.1 CCCC(N)CC MCULE-5349906741 [2,0,0,0,0,0|1,0,1]=4 1011 B6R0.1 CCCC(N)CC MCULE-7172418373 [2,0,0,0,0,0|1,0,1]=4 1012 B6R0.1 CCCC(N)CN MCULE-8606218569 [2,0,0,0,0,0|1,0,1]=4 1013 B6R0.1 CCCC(N)CO MCULE-3404967504 [2,0,0,0,0,0|0,0,1]=3 1014 B6R0.1 CCCC(N)CO MCULE-3802448518 [2,0,0,0,0,0|0,0,1]=3 1015 B6R0.1 CCCC(N)CO MCULE-4259078445 [2,0,0,0,0,0|0,0,1]=3 1016 B6R0.1 CCCC(N)CO MCULE-6425025734 [2,0,0,0,0,0|0,0,1]=3 1017 B6R0.1 CCCC(O)CO MCULE-5124107719 [2,0,0,0,0,0|1,0,1]=4 1018 B6R0.1 CCC[C@@H](N)CF MCULE-4702552251 [2,0,0,0,0,0|1,0,1]=4 1019 B6R0.1 CCC[C@@H](N)CF MCULE-8118043624 [2,0,0,0,0,0|1,0,1]=4 1020 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [2,0,0,0,0,0|0,0,1]=3 1021 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [2,0,0,0,0,0|0,0,1]=3 1022 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [2,0,0,0,0,0|0,0,1]=3 1023 B6R0.1 CCC[C@H](N)CF MCULE-7192744944 [2,0,0,0,0,0|1,0,1]=4 1024 B6R0.1 CCC[C@H](N)CF MCULE-7441387613 [2,0,0,0,0,0|1,0,1]=4 1025 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [2,0,0,0,0,0|0,0,1]=3 1026 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [2,0,0,0,0,0|0,0,1]=3 1027 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [2,0,0,0,0,0|0,0,1]=3 1028 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [2,0,0,0,0,0|0,0,1]=3 1029 B6R0.1 CCN(C)CCO MCULE-5519271145 [2,0,0,0,0,0|1,0,1]=4 1030 B6R0.1 CC[C@H](C)CCO MCULE-1190203828 [2,0,0,0,0,0|0,0,1]=3 1031 B6R0.1 CC[C@H](C)CCO MCULE-8460710173 [2,0,0,0,0,0|0,0,1]=3 1032 B6R0.1 CNC(C)CCO MCULE-4722422254 [2,0,0,0,0,0|1,0,1]=4 1033 B6R0.1 COC(C)CC=O MCULE-7243333697 [2,0,0,0,0,0|1,0,0]=3 1034 B6R0.1 COC(C)CCO MCULE-7396381165 [2,0,0,0,0,0|1,0,1]=4 1035 B6R0.1 COCC(C)C=O MCULE-7679332713 [2,0,0,0,0,0|2,0,0]=4 1036 B6R0.1 COCC(N)CO MCULE-2141613120 [2,0,0,0,0,0|1,0,1]=4 1037 B6R0.1 COCC(N)CO MCULE-3194232042 [2,0,0,0,0,0|1,0,1]=4 1038 B6R0.1 COCC(N)CO MCULE-6545937769 [2,0,0,0,0,0|1,0,1]=4 1039 B6R0.1 COCC(N)CO MCULE-7989665777 [2,0,0,0,0,0|1,0,1]=4 1040 B6R0.1 COC[C@@H](N)CO MCULE-2792470078 [2,0,0,0,0,0|1,0,1]=4 1041 B6R0.1 COC[C@@H](N)CO MCULE-3805343572 [2,0,0,0,0,0|1,0,1]=4 1042 B6R0.1 COC[C@@H](N)CO MCULE-7953239910 [2,0,0,0,0,0|1,0,1]=4 1043 B6R0.1 COC[C@@H](N)CO MCULE-9178553914 [2,0,0,0,0,0|1,0,1]=4 1044 B6R0.1 COC[C@H](N)CO MCULE-1678153673 [2,0,0,0,0,0|1,0,1]=4 1045 B6R0.1 COC[C@H](N)CO MCULE-2304967280 [2,0,0,0,0,0|1,0,1]=4 1046 B6R0.1 COC[C@H](N)CO MCULE-6509090198 [2,0,0,0,0,0|1,0,1]=4 1047 B6R0.1 COC[C@H](N)CO MCULE-9806530206 [2,0,0,0,0,0|1,0,1]=4 1048 B6R0.1 CSC(C)CC=O MCULE-9433914892 [2,0,0,0,0,0|1,0,0]=3 1049 B6R0.1 CSC(C)CCO MCULE-4317600086 [2,0,0,0,0,0|1,0,1]=4 1050 B6R0.1 C[C@@H](CO)CCO MCULE-6545491289 [2,0,0,0,0,0|1,0,1]=4 1051 B6R0.1 C[C@H](CO)CCO MCULE-2543010074 [2,0,0,0,0,0|1,0,1]=4 1052 B6R0.1 C[C@H](CO)CCO MCULE-6036462418 [2,0,0,0,0,0|1,0,1]=4 1053 B6R0.1 NC(CO)CCF MCULE-3691993352 [2,0,0,0,0,0|1,0,1]=4 1054 B6R0.1 NC(CO)CCO MCULE-3703088648 [2,0,0,0,0,0|1,0,1]=4 1055 B6R0.1 NC(CO)CCO MCULE-7609576462 [2,0,0,0,0,0|1,0,1]=4 1056 B6R0.1 N[C@@H](CO)CCO MCULE-4583236919 [2,0,0,0,0,0|1,0,1]=4 1057 B6R0.1 N[C@@H](CO)CCO MCULE-5489716742 [2,0,0,0,0,0|1,0,1]=4 1058 B6R0.1 N[C@H](CO)CCO MCULE-5338659573 [2,0,0,0,0,0|1,0,1]=4 1059 B6R0.1 N[C@H](CO)CCO MCULE-8998003003 [2,0,0,0,0,0|1,0,1]=4 1060 B6R0.1 O=CC[C@H](O)CCl MCULE-6385696769 [2,0,0,0,0,0|2,0,0]=4 1061 B6R0.2 C=C(C)CC(=O)O MCULE-5404023928 [2,0,0,0,0,0|0,0,2]=4 1062 B6R0.2 C=C(C)CC(C)C MCULE-5553118538 [2,0,0,0,0,0|2,0,0]=4 1063 B6R0.2 CC(=CC(=O)O)C MCULE-4772426340 [2,0,0,0,0,0|0,0,2]=4 1064 B6R0.2 CC(=O)CC(=O)O MCULE-2601276539 [2,0,0,0,0,0|1,0,1]=4 1065 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [2,0,0,0,0,0|1,0,0]=3 1066 B6R0.2 CC(=O)CC(C)N MCULE-1028280795 [2,0,0,0,0,0|2,0,0]=4 1067 B6R0.2 CC(=O)CC(C)N MCULE-7911343070 [2,0,0,0,0,0|2,0,0]=4 1068 B6R0.2 CC(=O)CC(C)O MCULE-5175367575 [2,0,0,0,0,0|2,0,0]=4 1069 B6R0.2 CC(=O)CN(C)C MCULE-8561521241 [2,0,0,0,0,0|2,0,0]=4 1070 B6R0.2 CC(=O)C[C@@H](C)N MCULE-1260669737 [2,0,0,0,0,0|2,0,0]=4 1071 B6R0.2 CC(=O)C[C@@H](C)N MCULE-6556661125 [2,0,0,0,0,0|2,0,0]=4 1072 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [2,0,0,0,0,0|2,0,0]=4 1073 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [2,0,0,0,0,0|2,0,0]=4 1074 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [2,0,0,0,0,0|1,0,0]=3 1075 B6R0.2 CC(C)CB(O)O MCULE-9748327681 [2,0,0,0,0,0|1,0,1]=4 1076 B6R0.2 CC(C)CC(=N)N MCULE-1578322850 [2,0,0,0,0,0|2,0,0]=4 1077 B6R0.2 CC(C)CC(=N)N MCULE-1643115412 [2,0,0,0,0,0|2,0,0]=4 1078 B6R0.2 CC(C)CC(=N)N MCULE-9650824038 [2,0,0,0,0,0|2,0,0]=4 1079 B6R0.2 CC(C)CC(=O)Cl MCULE-8821231794 [2,0,0,0,0,0|1,0,0]=3 1080 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [2,0,0,0,0,0|1,0,0]=3 1081 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [2,0,0,0,0,0|0,0,0]=2 1082 B6R0.2 CC(C)CC(=S)N MCULE-7704222819 [2,0,0,0,0,0|1,1,0]=4 1083 B6R0.2 CC(C)CC(C)O MCULE-9223768698 [2,0,0,0,0,0|1,0,1]=4 1084 B6R0.2 CC(C)CN(=O)=O MCULE-1357840093 [2,0,0,0,0,0|1,0,1]=4 1085 B6R0.2 CC(C)CS(=O)[O-] MCULE-3716652382 [2,0,0,0,0,0|1,0,1]=4 1086 B6R0.2 CC(C)CS(=O)[O-] MCULE-7111094918 [2,0,0,0,0,0|1,0,1]=4 1087 B6R0.2 CC(C)C[C@@H](C)O MCULE-3150675602 [2,0,0,0,0,0|1,0,1]=4 1088 B6R0.2 CC(C)C[C@@H](C)O MCULE-4011042896 [2,0,0,0,0,0|1,0,1]=4 1089 B6R0.2 CC(C)NC(=O)N MCULE-2725741897 [2,0,0,0,0,0|2,0,0]=4 1090 B6R0.2 CC(C)OC(=O)Cl MCULE-3303340398 [2,0,0,0,0,0|2,0,0]=4 1091 B6R0.2 CC(C)OC(=O)N MCULE-9996500963 [2,0,0,0,0,0|2,0,0]=4 1092 B6R0.2 CC(C)SC(=O)Cl MCULE-9803882280 [2,0,0,0,0,0|2,0,0]=4 1093 B6R0.2 CC(Cl)CC(=O)Cl MCULE-3323045052 [2,0,0,0,0,0|2,0,0]=4 1094 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [2,0,0,0,0,0|1,0,0]=3 1095 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [2,0,0,0,0,0|1,0,0]=3 1096 B6R0.2 CC(N)CC(=O)N MCULE-8604112274 [2,0,0,0,0,0|2,0,0]=4 1097 B6R0.2 CC(N)CC(=O)N MCULE-8651032460 [2,0,0,0,0,0|2,0,0]=4 1098 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [2,0,0,0,0,0|1,0,0]=3 1099 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [2,0,0,0,0,0|1,0,0]=3 1100 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [2,0,0,0,0,0|1,0,0]=3 1101 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [2,0,0,0,0,0|1,0,0]=3 1102 B6R0.2 CC(O)CC(=O)N MCULE-7442557911 [2,0,0,0,0,0|2,0,0]=4 1103 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [2,0,0,0,0,0|1,0,0]=3 1104 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [2,0,0,0,0,0|1,0,0]=3 1105 B6R0.2 CC(O)CC(=O)[O-] MCULE-1109368801 [2,0,0,0,0,0|1,0,1]=4 1106 B6R0.2 CC(O)CC(=O)[O-] MCULE-5681138302 [2,0,0,0,0,0|1,0,1]=4 1107 B6R0.2 CN(C)CC(=O)Cl MCULE-2168217529 [2,0,0,0,0,0|2,0,0]=4 1108 B6R0.2 CN(C)CC(=O)Cl MCULE-6810056185 [2,0,0,0,0,0|2,0,0]=4 1109 B6R0.2 CN(C)CC(=O)N MCULE-3894706713 [2,0,0,0,0,0|2,0,0]=4 1110 B6R0.2 CN(C)CC(=O)O MCULE-2303978039 [2,0,0,0,0,0|1,0,0]=3 1111 B6R0.2 CN(C)CC(=O)O MCULE-3368936600 [2,0,0,0,0,0|1,0,0]=3 1112 B6R0.2 CN(C)CC(=O)[O-] MCULE-3077067854 [2,0,0,0,0,0|1,0,1]=4 1113 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [2,0,0,0,0,0|1,0,0]=3 1114 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [2,0,0,0,0,0|1,0,0]=3 1115 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [2,0,0,0,0,0|1,0,0]=3 1116 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [2,0,0,0,0,0|1,0,0]=3 1117 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [2,0,0,0,0,0|1,0,0]=3 1118 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [2,0,0,0,0,0|1,0,0]=3 1119 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7081161048 [2,0,0,0,0,0|1,0,1]=4 1120 B6R0.2 C[C@@H](O)CC(=O)[O-] MCULE-7886150665 [2,0,0,0,0,0|1,0,1]=4 1121 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [2,0,0,0,0,0|1,0,0]=3 1122 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [2,0,0,0,0,0|1,0,0]=3 1123 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [2,0,0,0,0,0|1,0,0]=3 1124 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [2,0,0,0,0,0|1,0,0]=3 1125 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [2,0,0,0,0,0|1,0,0]=3 1126 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [2,0,0,0,0,0|1,0,0]=3 1127 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [2,0,0,0,0,0|1,0,0]=3 1128 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [2,0,0,0,0,0|1,0,0]=3 1129 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-3624690550 [2,0,0,0,0,0|1,0,1]=4 1130 B6R0.2 C[C@H](O)CC(=O)[O-] MCULE-5550257128 [2,0,0,0,0,0|1,0,1]=4 1131 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-1975585935 [2,0,0,0,0,0|1,0,1]=4 1132 B6R0.2 C[S+](C)CC(=O)[O-] MCULE-7679949306 [2,0,0,0,0,0|1,0,1]=4 1133 B6R0.2 NC(F)CC(=O)O MCULE-1563194776 [2,0,0,0,0,0|2,0,0]=4 1134 B6R0.2 NC(F)CC(=O)O MCULE-1655564430 [2,0,0,0,0,0|2,0,0]=4 1135 B6R0.2 O=C(O)CC(F)F MCULE-9388620099 [2,0,0,0,0,0|2,0,0]=4 1136 B6R0.4 C#CCCC(=O)O MCULE-6669146060 [2,0,0,0,0,0|0,0,2]=4 1137 B6R0.4 C/C=C/CC(=O)O MCULE-4626577048 [2,0,0,0,0,0|0,0,2]=4 1138 B6R0.4 C=C(C)CCCC MCULE-1010177756 [2,0,0,0,0,0|2,0,0]=4 1139 B6R0.4 C=CCCC(=O)O MCULE-6221951425 [2,0,0,0,0,0|0,0,2]=4 1140 B6R0.4 CC#CCC(=O)O MCULE-8576178825 [2,0,0,0,0,0|0,0,2]=4 1141 B6R0.4 CC(=O)CCCBr MCULE-7143092097 [2,0,0,0,0,0|2,0,0]=4 1142 B6R0.4 CC(=O)CCCCl MCULE-7158553745 [2,0,0,0,0,0|2,0,0]=4 1143 B6R0.4 CC(=O)CCCO MCULE-1335342150 [2,0,0,0,0,0|2,0,0]=4 1144 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [2,0,0,0,0,0|0,0,2]=4 1145 B6R0.4 CC=CCC(=O)O MCULE-9174714653 [2,0,0,0,0,0|0,0,2]=4 1146 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [2,0,0,0,0,0|0,0,2]=4 1147 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [2,0,0,0,0,0|0,0,2]=4 1148 B6R0.4 CCCCB(O)O MCULE-9002672645 [2,0,0,0,0,0|1,0,1]=4 1149 B6R0.4 CCCCC(=N)N MCULE-3271993509 [2,0,0,0,0,0|2,0,0]=4 1150 B6R0.4 CCCCC(=N)N MCULE-3935017760 [2,0,0,0,0,0|2,0,0]=4 1151 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [2,0,0,0,0,0|1,0,0]=3 1152 B6R0.4 CCCCC(=O)C MCULE-3554390184 [2,0,0,0,0,0|1,0,0]=3 1153 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [2,0,0,0,0,0|1,0,0]=3 1154 B6R0.4 CCCCC(=O)N MCULE-6419483436 [2,0,0,0,0,0|1,0,0]=3 1155 B6R0.4 CCCCC(=O)O MCULE-2333640078 [2,0,0,0,0,0|0,0,0]=2 1156 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [2,0,0,0,0,0|0,0,1]=3 1157 B6R0.4 CCCCC(=S)N MCULE-8236760762 [2,0,0,0,0,0|1,1,0]=4 1158 B6R0.4 CCCCC(C)O MCULE-6558228722 [2,0,0,0,0,0|1,0,1]=4 1159 B6R0.4 CCCCN(=O)=O MCULE-7679767771 [2,0,0,0,0,0|1,0,1]=4 1160 B6R0.4 CCCCS(=O)[O-] MCULE-4347348762 [2,0,0,0,0,0|1,0,1]=4 1161 B6R0.4 CCCCS(=O)[O-] MCULE-8153578421 [2,0,0,0,0,0|1,0,1]=4 1162 B6R0.4 CCCC[C@@H](C)O MCULE-3149375333 [2,0,0,0,0,0|1,0,1]=4 1163 B6R0.4 CCCC[C@@H](C)O MCULE-5463481348 [2,0,0,0,0,0|1,0,1]=4 1164 B6R0.4 CCCC[C@H](C)O MCULE-1658952902 [2,0,0,0,0,0|1,0,1]=4 1165 B6R0.4 CCCC[C@H](C)O MCULE-7987243522 [2,0,0,0,0,0|1,0,1]=4 1166 B6R0.4 CCCNC(=O)C MCULE-5899703886 [2,0,0,0,0,0|2,0,0]=4 1167 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [2,0,0,0,0,0|2,0,0]=4 1168 B6R0.4 CCCNC(=O)N MCULE-8528844765 [2,0,0,0,0,0|2,0,0]=4 1169 B6R0.4 CCCOC(=O)C MCULE-7327042566 [2,0,0,0,0,0|2,0,0]=4 1170 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [2,0,0,0,0,0|2,0,0]=4 1171 B6R0.4 CCCOC(=O)N MCULE-2760622567 [2,0,0,0,0,0|2,0,0]=4 1172 B6R0.4 CCCSC(=O)C MCULE-4329646671 [2,0,0,0,0,0|2,0,0]=4 1173 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [2,0,0,0,0,0|2,0,0]=4 1174 B6R0.4 CCNCC(=O)C MCULE-5799315547 [2,0,0,0,0,0|2,0,0]=4 1175 B6R0.4 CCNCC(=O)C MCULE-9258294157 [2,0,0,0,0,0|2,0,0]=4 1176 B6R0.4 CCNCC(=O)N MCULE-1787248899 [2,0,0,0,0,0|2,0,0]=4 1177 B6R0.4 CCNCC(=O)N MCULE-3821700273 [2,0,0,0,0,0|2,0,0]=4 1178 B6R0.4 CCNCC(=O)O MCULE-5989480216 [2,0,0,0,0,0|1,0,0]=3 1179 B6R0.4 CCNCC(=O)O MCULE-8087863397 [2,0,0,0,0,0|1,0,0]=3 1180 B6R0.4 CCOCC(=O)C MCULE-2825677443 [2,0,0,0,0,0|2,0,0]=4 1181 B6R0.4 CCOCC(=O)Cl MCULE-2172268229 [2,0,0,0,0,0|2,0,0]=4 1182 B6R0.4 CCOCC(=O)O MCULE-1726530898 [2,0,0,0,0,0|1,0,0]=3 1183 B6R0.4 CCSCC(=O)C MCULE-9872082780 [2,0,0,0,0,0|2,0,0]=4 1184 B6R0.4 CCSCC(=O)O MCULE-7471335718 [2,0,0,0,0,0|1,0,0]=3 1185 B6R0.4 CNCCC(=O)N MCULE-1118876220 [2,0,0,0,0,0|2,0,0]=4 1186 B6R0.4 CNCCC(=O)N MCULE-6679713144 [2,0,0,0,0,0|2,0,0]=4 1187 B6R0.4 CNCCC(=O)O MCULE-3627988097 [2,0,0,0,0,0|1,0,0]=3 1188 B6R0.4 CNCCC(=O)O MCULE-9858204248 [2,0,0,0,0,0|1,0,0]=3 1189 B6R0.4 COCCC(=O)C MCULE-5939812376 [2,0,0,0,0,0|2,0,0]=4 1190 B6R0.4 COCCC(=O)Cl MCULE-9454266286 [2,0,0,0,0,0|2,0,0]=4 1191 B6R0.4 COCCC(=O)N MCULE-7556483675 [2,0,0,0,0,0|2,0,0]=4 1192 B6R0.4 COCCC(=O)O MCULE-3436347115 [2,0,0,0,0,0|1,0,0]=3 1193 B6R0.4 CSCCC(=O)C MCULE-6178663156 [2,0,0,0,0,0|2,0,0]=4 1194 B6R0.4 CSCCC(=O)Cl MCULE-9732512141 [2,0,0,0,0,0|2,0,0]=4 1195 B6R0.4 CSCCC(=O)N MCULE-7105035733 [2,0,0,0,0,0|2,0,0]=4 1196 B6R0.4 CSCCC(=O)O MCULE-9550032941 [2,0,0,0,0,0|1,0,0]=3 1197 B6R0.4 CSSCC(=O)O MCULE-5829510166 [2,0,0,0,0,0|2,0,0]=4 1198 B6R0.4 N#CCCC(=O)O MCULE-3165189228 [2,0,0,0,0,0|1,0,1]=4 1199 B6R0.4 NC(=O)CCCCl MCULE-2774705212 [2,0,0,0,0,0|2,0,0]=4 1200 B6R0.4 NC(=O)CCCO MCULE-3779341561 [2,0,0,0,0,0|2,0,0]=4 1201 B6R0.4 NCCCC(=O)Cl MCULE-1312882775 [2,0,0,0,0,0|2,0,0]=4 1202 B6R0.4 NCCCC(=O)Cl MCULE-6405362906 [2,0,0,0,0,0|2,0,0]=4 1203 B6R0.4 NCCCC(=O)N MCULE-8039142092 [2,0,0,0,0,0|2,0,0]=4 1204 B6R0.4 NCCCC(=O)N MCULE-8262250872 [2,0,0,0,0,0|2,0,0]=4 1205 B6R0.4 NCCCC(=O)O MCULE-3615304273 [2,0,0,0,0,0|1,0,0]=3 1206 B6R0.4 NCCCC(=O)O MCULE-7613134021 [2,0,0,0,0,0|1,0,0]=3 1207 B6R0.4 NOCCC(=O)O MCULE-1529492904 [2,0,0,0,0,0|2,0,0]=4 1208 B6R0.4 NOCCC(=O)O MCULE-6297331357 [2,0,0,0,0,0|2,0,0]=4 1209 B6R0.4 O=C(Cl)CCCBr MCULE-1389049838 [2,0,0,0,0,0|2,0,0]=4 1210 B6R0.4 O=C(Cl)CCCCl MCULE-5885932072 [2,0,0,0,0,0|2,0,0]=4 1211 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [2,0,0,0,0,0|1,0,0]=3 1212 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [2,0,0,0,0,0|1,0,0]=3 1213 B6R0.4 O=C(O)CCCF MCULE-2415675768 [2,0,0,0,0,0|1,0,0]=3 1214 B6R0.4 O=C(O)CCCI MCULE-7794841553 [2,0,0,0,0,0|1,0,0]=3 1215 B6R0.4 O=C(O)CCCS MCULE-3352840152 [2,0,0,0,0,0|1,0,0]=3 1216 B6R0.4 O=C(O)CNCO MCULE-4092998319 [2,0,0,0,0,0|2,0,0]=4 1217 B6R0.4 O=C([O-])CCCCl MCULE-4131322715 [2,0,0,0,0,0|1,0,1]=4 1218 B6R0.4 O=CCCC(=O)O MCULE-7183864722 [2,0,0,0,0,0|1,0,1]=4 1219 B6R0.3 C#CC(N)C(C)C MCULE-3430729891 [2,0,0,0,0,0|1,0,1]=4 1220 B6R0.3 C#CC(N)C(C)C MCULE-7604887558 [2,0,0,0,0,0|1,0,1]=4 1221 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [2,0,0,0,0,0|2,0,0]=4 1222 B6R0.3 C(N)(CO)C(=O)N MCULE-5512645571 [2,0,0,0,0,0|2,0,0]=4 1223 B6R0.3 C(N)(CO)C(=O)N MCULE-5852943337 [2,0,0,0,0,0|2,0,0]=4 1224 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [2,0,0,0,0,0|1,0,1]=4 1225 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [2,0,0,0,0,0|1,0,1]=4 1226 B6R0.3 C=CC(C)C(C)C MCULE-4461669612 [2,0,0,0,0,0|2,0,0]=4 1227 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [2,0,0,0,0,0|0,0,2]=4 1228 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [2,0,0,0,0,0|0,0,2]=4 1229 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [2,0,0,0,0,0|0,0,2]=4 1230 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [2,0,0,0,0,0|0,0,2]=4 1231 B6R0.3 C=CC(O)C(C)C MCULE-2504249276 [2,0,0,0,0,0|2,0,0]=4 1232 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [2,0,0,0,0,0|0,0,2]=4 1233 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [2,0,0,0,0,0|0,0,2]=4 1234 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [2,0,0,0,0,0|0,0,2]=4 1235 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [2,0,0,0,0,0|0,0,2]=4 1236 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [2,0,0,0,0,0|0,0,2]=4 1237 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [2,0,0,0,0,0|0,0,2]=4 1238 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [2,0,0,0,0,0|0,0,2]=4 1239 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [2,0,0,0,0,0|2,0,0]=4 1240 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [2,0,0,0,0,0|2,0,0]=4 1241 B6R0.3 CC(C)/C(=N/O)/N MCULE-4474697690 [2,0,0,0,0,0|1,0,1]=4 1242 B6R0.3 CC(C)C(Br)C=O MCULE-2054791376 [2,0,0,0,0,0|1,0,0]=3 1243 B6R0.3 CC(C)C(C)CO MCULE-7008552664 [2,0,0,0,0,0|1,0,1]=4 1244 B6R0.3 CC(C)C(N)C#N MCULE-5486541909 [2,0,0,0,0,0|1,0,1]=4 1245 B6R0.3 CC(C)C(N)C#N MCULE-6250354053 [2,0,0,0,0,0|1,0,1]=4 1246 B6R0.3 CC(C)C(N)CF MCULE-4101575579 [2,0,0,0,0,0|1,0,1]=4 1247 B6R0.3 CC(C)C(N)CF MCULE-4888178244 [2,0,0,0,0,0|1,0,1]=4 1248 B6R0.3 CC(C)C(N)CN MCULE-3414430422 [2,0,0,0,0,0|1,0,1]=4 1249 B6R0.3 CC(C)C(N)CN MCULE-5279153780 [2,0,0,0,0,0|1,0,1]=4 1250 B6R0.3 CC(C)C(N)CO MCULE-2361921763 [2,0,0,0,0,0|0,0,1]=3 1251 B6R0.3 CC(C)C(N)CO MCULE-2989454077 [2,0,0,0,0,0|0,0,1]=3 1252 B6R0.3 CC(C)C(N)CO MCULE-9793548365 [2,0,0,0,0,0|0,0,1]=3 1253 B6R0.3 CC(C)C(O)CO MCULE-6069815474 [2,0,0,0,0,0|1,0,1]=4 1254 B6R0.3 CC(C)C(S)CO MCULE-1903780493 [2,0,0,0,0,0|1,0,1]=4 1255 B6R0.3 CC(C)[C@@H](C)CO MCULE-4943691177 [2,0,0,0,0,0|1,0,1]=4 1256 B6R0.3 CC(C)[C@@H](C)CO MCULE-6583781047 [2,0,0,0,0,0|1,0,1]=4 1257 B6R0.3 CC(C)[C@@H](N)C#N MCULE-3710740145 [2,0,0,0,0,0|1,0,1]=4 1258 B6R0.3 CC(C)[C@@H](N)C#N MCULE-6831295533 [2,0,0,0,0,0|1,0,1]=4 1259 B6R0.3 CC(C)[C@@H](N)CF MCULE-7429178470 [2,0,0,0,0,0|1,0,1]=4 1260 B6R0.3 CC(C)[C@@H](N)CF MCULE-7951488806 [2,0,0,0,0,0|1,0,1]=4 1261 B6R0.3 CC(C)[C@@H](N)CO MCULE-1135743088 [2,0,0,0,0,0|0,0,1]=3 1262 B6R0.3 CC(C)[C@@H](N)CO MCULE-3994511291 [2,0,0,0,0,0|0,0,1]=3 1263 B6R0.3 CC(C)[C@H](C)CO MCULE-9527582465 [2,0,0,0,0,0|1,0,1]=4 1264 B6R0.3 CC(C)[C@H](N)C#N MCULE-6519039369 [2,0,0,0,0,0|1,0,1]=4 1265 B6R0.3 CC(C)[C@H](N)C#N MCULE-8475611484 [2,0,0,0,0,0|1,0,1]=4 1266 B6R0.3 CC(C)[C@H](N)C=O MCULE-6686967175 [2,0,0,0,0,0|0,0,0]=2 1267 B6R0.3 CC(C)[C@H](N)CF MCULE-2978082368 [2,0,0,0,0,0|1,0,1]=4 1268 B6R0.3 CC(C)[C@H](N)CF MCULE-4609473233 [2,0,0,0,0,0|1,0,1]=4 1269 B6R0.3 CC(C)[C@H](N)CN MCULE-2884084983 [2,0,0,0,0,0|1,0,1]=4 1270 B6R0.3 CC(C)[C@H](N)CO MCULE-2625936994 [2,0,0,0,0,0|0,0,1]=3 1271 B6R0.3 CC(C)[C@H](N)CO MCULE-3229973889 [2,0,0,0,0,0|0,0,1]=3 1272 B6R0.3 CC(C)[C@H](N)CO MCULE-6090001117 [2,0,0,0,0,0|0,0,1]=3 1273 B6R0.3 CC(C)[C@H](N)CO MCULE-8284816696 [2,0,0,0,0,0|0,0,1]=3 1274 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [2,0,0,0,0,0|2,0,0]=4 1275 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [2,0,0,0,0,0|2,0,0]=4 1276 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [2,0,0,0,0,0|2,0,0]=4 1277 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [2,0,0,0,0,0|2,0,0]=4 1278 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [2,0,0,0,0,0|2,0,0]=4 1279 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [2,0,0,0,0,0|2,0,0]=4 1280 B6R0.3 CC(N)C(C)CO MCULE-8179225289 [2,0,0,0,0,0|1,0,1]=4 1281 B6R0.3 CC(O)C(C)CN MCULE-5251700993 [2,0,0,0,0,0|2,0,0]=4 1282 B6R0.3 CC(O)C(C)CO MCULE-4061946423 [2,0,0,0,0,0|2,0,0]=4 1283 B6R0.3 CC(O)C(N)CO MCULE-7733336449 [2,0,0,0,0,0|1,0,1]=4 1284 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [2,0,0,0,0,0|1,0,1]=4 1285 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [2,0,0,0,0,0|2,0,0]=4 1286 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [2,0,0,0,0,0|2,0,0]=4 1287 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [2,0,0,0,0,0|2,0,0]=4 1288 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [2,0,0,0,0,0|1,0,1]=4 1289 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [2,0,0,0,0,0|1,0,0]=3 1290 B6R0.3 CCC(C)B(O)O MCULE-7544159454 [2,0,0,0,0,0|2,0,0]=4 1291 B6R0.3 CCC(C)C(=N)N MCULE-4070060089 [2,0,0,0,0,0|1,0,1]=4 1292 B6R0.3 CCC(C)C(=N)N MCULE-7020524406 [2,0,0,0,0,0|1,0,1]=4 1293 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [2,0,0,0,0,0|1,0,1]=4 1294 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [2,0,0,0,0,0|1,0,1]=4 1295 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [2,0,0,0,0,0|0,0,1]=3 1296 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [2,0,0,0,0,0|1,0,0]=3 1297 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [2,0,0,0,0,0|1,0,0]=3 1298 B6R0.3 CCC(C)C(=S)N MCULE-9682279721 [2,0,0,0,0,0|0,1,1]=4 1299 B6R0.3 CCC(C)C(C)Br MCULE-5368409335 [2,0,0,0,0,0|1,0,1]=4 1300 B6R0.3 CCC(C)C(C)C MCULE-9189749509 [2,0,0,0,0,0|1,0,1]=4 1301 B6R0.3 CCC(C)C(C)Cl MCULE-2663176330 [2,0,0,0,0,0|1,0,1]=4 1302 B6R0.3 CCC(C)C(C)N MCULE-1056466337 [2,0,0,0,0,0|0,0,1]=3 1303 B6R0.3 CCC(C)C(C)N MCULE-1503543126 [2,0,0,0,0,0|0,0,1]=3 1304 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [2,0,0,0,0,0|1,0,0]=3 1305 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [2,0,0,0,0,0|2,0,0]=4 1306 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [2,0,0,0,0,0|1,0,1]=4 1307 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [2,0,0,0,0,0|1,0,0]=3 1308 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [2,0,0,0,0,0|1,0,0]=3 1309 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [2,0,0,0,0,0|1,0,0]=3 1310 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [2,0,0,0,0,0|1,0,0]=3 1311 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [2,0,0,0,0,0|1,0,0]=3 1312 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [2,0,0,0,0,0|1,0,0]=3 1313 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [2,0,0,0,0,0|0,0,0]=2 1314 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [2,0,0,0,0,0|0,0,0]=2 1315 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [2,0,0,0,0,0|0,0,0]=2 1316 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [2,0,0,0,0,0|0,0,0]=2 1317 B6R0.3 CCC(N)C(C)C MCULE-3624338196 [2,0,0,0,0,0|1,0,1]=4 1318 B6R0.3 CCC(N)C(C)C MCULE-4491326477 [2,0,0,0,0,0|1,0,1]=4 1319 B6R0.3 CCC(N)C(C)O MCULE-2752432664 [2,0,0,0,0,0|1,0,1]=4 1320 B6R0.3 CCC(N)C(C)O MCULE-6087590428 [2,0,0,0,0,0|1,0,1]=4 1321 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [2,0,0,0,0,0|1,0,1]=4 1322 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [2,0,0,0,0,0|1,0,0]=3 1323 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [2,0,0,0,0,0|1,0,0]=3 1324 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [2,0,0,0,0,0|1,0,1]=4 1325 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [2,0,0,0,0,0|1,0,1]=4 1326 B6R0.3 CCC(O)C(C)N MCULE-4027170059 [2,0,0,0,0,0|1,0,1]=4 1327 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [2,0,0,0,0,0|2,0,0]=4 1328 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [2,0,0,0,0,0|2,0,0]=4 1329 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [2,0,0,0,0,0|1,0,0]=3 1330 B6R0.3 CCN(N)C(=O)N MCULE-8674876262 [2,0,0,0,0,0|2,0,0]=4 1331 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [2,0,0,0,0,0|1,0,0]=3 1332 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [2,0,0,0,0,0|1,0,0]=3 1333 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [2,0,0,0,0,0|0,0,1]=3 1334 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [2,0,0,0,0,0|0,0,1]=3 1335 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [2,0,0,0,0,0|1,0,0]=3 1336 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [2,0,0,0,0,0|1,0,0]=3 1337 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [2,0,0,0,0,0|1,0,0]=3 1338 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [2,0,0,0,0,0|1,0,0]=3 1339 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [2,0,0,0,0,0|1,0,0]=3 1340 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [2,0,0,0,0,0|1,0,0]=3 1341 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [2,0,0,0,0,0|1,0,0]=3 1342 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [2,0,0,0,0,0|1,0,0]=3 1343 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [2,0,0,0,0,0|0,0,0]=2 1344 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [2,0,0,0,0,0|0,0,0]=2 1345 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [2,0,0,0,0,0|0,0,0]=2 1346 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [2,0,0,0,0,0|0,0,0]=2 1347 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-8294520512 [2,0,0,0,0,0|1,0,1]=4 1348 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-9521001934 [2,0,0,0,0,0|1,0,1]=4 1349 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [2,0,0,0,0,0|1,0,0]=3 1350 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [2,0,0,0,0,0|1,0,0]=3 1351 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [2,0,0,0,0,0|1,0,0]=3 1352 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [2,0,0,0,0,0|1,0,0]=3 1353 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [2,0,0,0,0,0|1,0,0]=3 1354 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [2,0,0,0,0,0|1,0,0]=3 1355 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [2,0,0,0,0,0|1,0,0]=3 1356 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [2,0,0,0,0,0|1,0,0]=3 1357 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [2,0,0,0,0,0|1,0,0]=3 1358 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [2,0,0,0,0,0|1,0,0]=3 1359 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [2,0,0,0,0,0|1,0,0]=3 1360 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [2,0,0,0,0,0|0,0,0]=2 1361 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [2,0,0,0,0,0|0,0,0]=2 1362 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [2,0,0,0,0,0|0,0,0]=2 1363 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [2,0,0,0,0,0|0,0,0]=2 1364 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [2,0,0,0,0,0|0,1,0]=3 1365 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [2,0,0,0,0,0|0,1,0]=3 1366 B6R0.3 CC[C@H](N)C(C)C MCULE-3200638239 [2,0,0,0,0,0|1,0,1]=4 1367 B6R0.3 CC[C@H](N)C(C)C MCULE-4973720203 [2,0,0,0,0,0|1,0,1]=4 1368 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-1930738992 [2,0,0,0,0,0|1,0,1]=4 1369 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-4226147180 [2,0,0,0,0,0|1,0,1]=4 1370 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-7445496718 [2,0,0,0,0,0|1,0,1]=4 1371 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-9770959398 [2,0,0,0,0,0|1,0,1]=4 1372 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-3878355824 [2,0,0,0,0,0|1,0,1]=4 1373 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-4791160457 [2,0,0,0,0,0|1,0,1]=4 1374 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [2,0,0,0,0,0|1,0,0]=3 1375 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [2,0,0,0,0,0|1,0,0]=3 1376 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [2,0,0,0,0,0|1,0,1]=4 1377 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [2,0,0,0,0,0|1,0,1]=4 1378 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [2,0,0,0,0,0|1,0,1]=4 1379 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [2,0,0,0,0,0|2,0,0]=4 1380 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [2,0,0,0,0,0|2,0,0]=4 1381 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [2,0,0,0,0,0|2,0,0]=4 1382 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [2,0,0,0,0,0|1,0,1]=4 1383 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [2,0,0,0,0,0|2,0,0]=4 1384 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [2,0,0,0,0,0|2,0,0]=4 1385 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [2,0,0,0,0,0|2,0,0]=4 1386 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [2,0,0,0,0,0|2,0,0]=4 1387 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [2,0,0,0,0,0|2,0,0]=4 1388 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [2,0,0,0,0,0|2,0,0]=4 1389 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [2,0,0,0,0,0|2,0,0]=4 1390 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [2,0,0,0,0,0|2,0,0]=4 1391 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [2,0,0,0,0,0|1,0,1]=4 1392 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [2,0,0,0,0,0|2,0,0]=4 1393 B6R0.3 COC(C)C(C)O MCULE-9844405908 [2,0,0,0,0,0|2,0,0]=4 1394 B6R0.3 COC(C)[C@@H](C)N MCULE-2029978265 [2,0,0,0,0,0|1,0,1]=4 1395 B6R0.3 COC(C)[C@@H](C)N MCULE-4755003017 [2,0,0,0,0,0|1,0,1]=4 1396 B6R0.3 COC(C)[C@@H](C)N MCULE-9820337483 [2,0,0,0,0,0|1,0,1]=4 1397 B6R0.3 COC(C)[C@@H](C)N MCULE-9820818995 [2,0,0,0,0,0|1,0,1]=4 1398 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [2,0,0,0,0,0|2,0,0]=4 1399 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [2,0,0,0,0,0|2,0,0]=4 1400 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [2,0,0,0,0,0|2,0,0]=4 1401 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [2,0,0,0,0,0|2,0,0]=4 1402 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [2,0,0,0,0,0|2,0,0]=4 1403 B6R0.3 CSC(C)C(C)O MCULE-9554880840 [2,0,0,0,0,0|2,0,0]=4 1404 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [2,0,0,0,0,0|2,0,0]=4 1405 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [2,0,0,0,0,0|2,0,0]=4 1406 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [2,0,0,0,0,0|2,0,0]=4 1407 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [2,0,0,0,0,0|2,0,0]=4 1408 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [2,0,0,0,0,0|2,0,0]=4 1409 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [2,0,0,0,0,0|2,0,0]=4 1410 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-1499224916 [2,0,0,0,0,0|1,0,1]=4 1411 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-3539522955 [2,0,0,0,0,0|1,0,1]=4 1412 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-1381786707 [2,0,0,0,0,0|1,0,1]=4 1413 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-3627537672 [2,0,0,0,0,0|1,0,1]=4 1414 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-5429038645 [2,0,0,0,0,0|1,0,1]=4 1415 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-6146168744 [2,0,0,0,0,0|1,0,1]=4 1416 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [2,0,0,0,0,0|2,0,0]=4 1417 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [2,0,0,0,0,0|2,0,0]=4 1418 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [2,0,0,0,0,0|2,0,0]=4 1419 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [2,0,0,0,0,0|2,0,0]=4 1420 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [2,0,0,0,0,0|2,0,0]=4 1421 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [2,0,0,0,0,0|2,0,0]=4 1422 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-5329315346 [2,0,0,0,0,0|1,0,1]=4 1423 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7239426628 [2,0,0,0,0,0|1,0,1]=4 1424 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7437797788 [2,0,0,0,0,0|1,0,1]=4 1425 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-2378004602 [2,0,0,0,0,0|1,0,1]=4 1426 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-9436764758 [2,0,0,0,0,0|1,0,1]=4 1427 B6R0.3 NC(=O)C(N)CO MCULE-4842751232 [2,0,0,0,0,0|2,0,0]=4 1428 B6R0.3 NC(=O)C(N)CO MCULE-6854366147 [2,0,0,0,0,0|2,0,0]=4 1429 B6R0.3 NC(=O)C(N)CS MCULE-3144051628 [2,0,0,0,0,0|2,0,0]=4 1430 B6R0.3 NC(=O)C(N)CS MCULE-7739536595 [2,0,0,0,0,0|2,0,0]=4 1431 B6R0.3 NC(=O)[C@@H](N)CO MCULE-2185844038 [2,0,0,0,0,0|2,0,0]=4 1432 B6R0.3 NC(=O)[C@@H](N)CO MCULE-3623516041 [2,0,0,0,0,0|2,0,0]=4 1433 B6R0.3 NC(=O)[C@@H](N)CO MCULE-6218638108 [2,0,0,0,0,0|2,0,0]=4 1434 B6R0.3 NC(=O)[C@@H](N)CS MCULE-9790378691 [2,0,0,0,0,0|2,0,0]=4 1435 B6R0.3 NC(=O)[C@H](N)CO MCULE-2061645482 [2,0,0,0,0,0|2,0,0]=4 1436 B6R0.3 NC(=O)[C@H](N)CO MCULE-5920366137 [2,0,0,0,0,0|2,0,0]=4 1437 B6R0.3 NC(=O)[C@H](N)CO MCULE-7612340519 [2,0,0,0,0,0|2,0,0]=4 1438 B6R0.3 NC(=O)[C@H](N)CO MCULE-7734326153 [2,0,0,0,0,0|2,0,0]=4 1439 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [2,0,0,0,0,0|1,0,0]=3 1440 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [2,0,0,0,0,0|1,0,0]=3 1441 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [2,0,0,0,0,0|1,0,0]=3 1442 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [2,0,0,0,0,0|1,0,0]=3 1443 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [2,0,0,0,0,0|1,0,0]=3 1444 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [2,0,0,0,0,0|1,0,0]=3 1445 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [2,0,0,0,0,0|1,0,0]=3 1446 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [2,0,0,0,0,0|1,0,0]=3 1447 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [2,0,0,0,0,0|1,0,0]=3 1448 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [2,0,0,0,0,0|1,0,0]=3 1449 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [2,0,0,0,0,0|2,0,0]=4 1450 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [2,0,0,0,0,0|2,0,0]=4 1451 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [2,0,0,0,0,0|2,0,0]=4 1452 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [2,0,0,0,0,0|2,0,0]=4 1453 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [2,0,0,0,0,0|1,0,0]=3 1454 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [2,0,0,0,0,0|1,0,0]=3 1455 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [2,0,0,0,0,0|1,0,0]=3 1456 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [2,0,0,0,0,0|1,0,0]=3 1457 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [2,0,0,0,0,0|1,0,0]=3 1458 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [2,0,0,0,0,0|2,0,0]=4 1459 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [2,0,0,0,0,0|2,0,0]=4 1460 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [2,0,0,0,0,0|2,0,0]=4 1461 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [2,0,0,0,0,0|2,0,0]=4 1462 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [2,0,0,0,0,0|2,0,0]=4 1463 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [2,0,0,0,0,0|2,0,0]=4 1464 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [2,0,0,0,0,0|1,0,0]=3 1465 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [2,0,0,0,0,0|1,0,0]=3 1466 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [2,0,0,0,0,0|1,0,0]=3 1467 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [2,0,0,0,0,0|2,0,0]=4 1468 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [2,0,0,0,0,0|2,0,0]=4 1469 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [2,0,0,0,0,0|2,0,0]=4 1470 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [2,0,0,0,0,0|2,0,0]=4 1471 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [2,0,0,0,0,0|2,0,0]=4 1472 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [2,0,0,0,0,0|2,0,0]=4 1473 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [2,0,0,0,0,0|1,0,0]=3 1474 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [2,0,0,0,0,0|1,0,0]=3 1475 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [2,0,0,0,0,0|1,0,0]=3 1476 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [2,0,0,0,0,0|1,0,0]=3 1477 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [2,0,0,0,0,0|1,0,0]=3 1478 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [2,0,0,0,0,0|1,0,0]=3 1479 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [2,0,0,0,0,0|2,0,0]=4 1480 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [2,0,0,0,0,0|2,0,0]=4 1481 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [2,0,0,0,0,0|1,0,0]=3 1482 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [2,0,0,0,0,0|1,0,0]=3 1483 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [2,0,0,0,0,0|1,0,0]=3 1484 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [2,0,0,0,0,0|1,0,0]=3 1485 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [2,0,0,0,0,0|1,0,0]=3 1486 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [2,0,0,0,0,0|1,0,0]=3 1487 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [2,0,0,0,0,0|1,0,0]=3 1488 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [2,0,0,0,0,0|1,0,0]=3 1489 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [2,0,0,0,0,0|1,0,0]=3 1490 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [2,0,0,0,0,0|1,0,0]=3 1491 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [2,0,0,0,0,0|1,0,0]=3 1492 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [2,0,0,0,0,0|1,0,0]=3 1493 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [2,0,0,0,0,0|1,0,0]=3 1494 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [2,0,0,0,0,0|1,0,0]=3 1495 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [2,0,0,0,0,0|1,0,0]=3 1496 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [2,0,0,0,0,0|1,0,0]=3 1497 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [2,0,0,0,0,0|1,0,0]=3 1498 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [2,0,0,0,0,0|1,0,0]=3 1499 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [2,0,0,0,0,0|1,0,0]=3 1500 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [2,0,0,0,0,0|1,0,0]=3 1501 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [2,0,0,0,0,0|1,0,0]=3 1502 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [2,0,0,0,0,0|1,0,0]=3 1503 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [2,0,0,0,0,0|1,0,0]=3 1504 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [2,0,0,0,0,0|1,0,0]=3 1505 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [2,0,0,0,0,0|2,0,0]=4 1506 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [2,0,0,0,0,0|2,0,0]=4 1507 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [2,0,0,0,0,0|2,0,0]=4 1508 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [2,0,0,0,0,0|2,0,0]=4 1509 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [2,0,0,0,0,0|2,0,0]=4 1510 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [2,0,0,0,0,0|2,0,0]=4 1511 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [2,0,0,0,0,0|2,0,0]=4 1512 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [2,0,0,0,0,0|2,0,0]=4 1513 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [2,0,0,0,0,0|2,0,0]=4 1514 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [2,0,0,0,0,0|2,0,0]=4 1515 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [2,0,0,0,0,0|2,0,0]=4 1516 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [2,0,0,0,0,0|2,0,0]=4 1517 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [2,0,0,0,0,0|2,0,0]=4 1518 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [2,0,0,0,0,0|2,0,0]=4 1519 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [2,0,0,0,0,0|2,0,0]=4 1520 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [2,0,0,0,0,0|2,0,0]=4 1521 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [2,0,0,0,0,0|2,0,0]=4 1522 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [2,0,0,0,0,0|0,0,2]=4 1523 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [2,0,0,0,0,0|1,0,0]=3 1524 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [2,0,0,0,0,0|2,0,0]=4 1525 B6R0.3 [C@H](N)(CO)C(=O)N MCULE-2792784400 [2,0,0,0,0,0|2,0,0]=4 1526 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [2,0,0,0,0,0|1,0,0]=3 1527 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [2,0,0,0,0,0|1,0,0]=3 1528 B8R0.5 C#CCC(N)CC(=O)O MCULE-2010410671 [1,1,0,0,0,0|1,0,1]=4 1529 B8R0.5 C#CCC(N)CC(=O)O MCULE-9655976746 [1,1,0,0,0,0|1,0,1]=4 1530 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-1849013560 [1,1,0,0,0,0|1,0,1]=4 1531 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-5050240935 [1,1,0,0,0,0|1,0,1]=4 1532 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-7394019004 [1,1,0,0,0,0|1,0,1]=4 1533 B8R0.5 C#CC[C@@H](N)CC(=O)O MCULE-8376747540 [1,1,0,0,0,0|1,0,1]=4 1534 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-1446527937 [1,1,0,0,0,0|1,0,1]=4 1535 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-4559086818 [1,1,0,0,0,0|1,0,1]=4 1536 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-5154381271 [1,1,0,0,0,0|1,0,1]=4 1537 B8R0.5 C#CC[C@H](N)CC(=O)O MCULE-9666448400 [1,1,0,0,0,0|1,0,1]=4 1538 B8R0.5 C/C=C/C(O)CC(=O)O MCULE-3416519692 [1,1,0,0,0,0|1,0,1]=4 1539 B8R0.5 C=C(C)CC(C)CCC MCULE-7442491404 [1,1,0,0,0,0|2,0,0]=4 1540 B8R0.5 C=C(CCC)CC(=O)O MCULE-5240115049 [1,1,0,0,0,0|0,0,2]=4 1541 B8R0.5 C=CCC(N)CC(=O)O MCULE-1468461223 [1,1,0,0,0,0|1,0,1]=4 1542 B8R0.5 C=CCC(N)CC(=O)O MCULE-3288937491 [1,1,0,0,0,0|1,0,1]=4 1543 B8R0.5 C=CCC(N)CC(=O)O MCULE-4022730599 [1,1,0,0,0,0|1,0,1]=4 1544 B8R0.5 C=CCC(N)CC(=O)O MCULE-5843795649 [1,1,0,0,0,0|1,0,1]=4 1545 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-4754294062 [1,1,0,0,0,0|1,0,1]=4 1546 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-7831408077 [1,1,0,0,0,0|1,0,1]=4 1547 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-8503288377 [1,1,0,0,0,0|1,0,1]=4 1548 B8R0.5 C=CC[C@@H](N)CC(=O)O MCULE-9398972010 [1,1,0,0,0,0|1,0,1]=4 1549 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-1784444892 [1,1,0,0,0,0|1,0,1]=4 1550 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-3247296447 [1,1,0,0,0,0|1,0,1]=4 1551 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-5484030094 [1,1,0,0,0,0|1,0,1]=4 1552 B8R0.5 C=CC[C@H](N)CC(=O)O MCULE-8982980423 [1,1,0,0,0,0|1,0,1]=4 1553 B8R0.5 CC(=O)CN(C)CCO MCULE-4972701308 [1,1,0,0,0,0|2,0,0]=4 1554 B8R0.5 CC=CC(O)CC(=O)O MCULE-9449456878 [1,1,0,0,0,0|1,0,1]=4 1555 B8R0.5 CCC/C(=C/C(=O)O)/C MCULE-2055195599 [1,1,0,0,0,0|0,0,2]=4 1556 B8R0.5 CCCC(=CC(=O)O)C MCULE-9033187683 [1,1,0,0,0,0|0,0,2]=4 1557 B8R0.5 CCCC(=O)CC(=O)O MCULE-8977313826 [1,1,0,0,0,0|1,0,1]=4 1558 B8R0.5 CCCC(C)CC(=O)C MCULE-7925360299 [1,1,0,0,0,0|1,0,0]=3 1559 B8R0.5 CCCC(C)CC(=O)O MCULE-6002154473 [1,1,0,0,0,0|0,0,0]=2 1560 B8R0.5 CCCC(C)CC(C)O MCULE-3968478752 [1,1,0,0,0,0|1,0,1]=4 1561 B8R0.5 CCCC(C)OC(=O)C MCULE-2841775696 [1,1,0,0,0,0|2,0,0]=4 1562 B8R0.5 CCCC(C)OC(=O)Cl MCULE-8719460411 [1,1,0,0,0,0|2,0,0]=4 1563 B8R0.5 CCCC(C)OC(=O)N MCULE-5471819133 [1,1,0,0,0,0|2,0,0]=4 1564 B8R0.5 CCCC(N)CC(=O)O MCULE-1356349547 [1,1,0,0,0,0|1,0,0]=3 1565 B8R0.5 CCCC(N)CC(=O)O MCULE-4946770886 [1,1,0,0,0,0|1,0,0]=3 1566 B8R0.5 CCCC(N)CC(=O)O MCULE-5502250330 [1,1,0,0,0,0|1,0,0]=3 1567 B8R0.5 CCCC(N)CC(=O)O MCULE-9959180111 [1,1,0,0,0,0|1,0,0]=3 1568 B8R0.5 CCCC(O)CC(=O)O MCULE-3158579605 [1,1,0,0,0,0|1,0,0]=3 1569 B8R0.5 CCCN(C)CC(=O)O MCULE-2690950295 [1,1,0,0,0,0|1,0,0]=3 1570 B8R0.5 CCCN(C)CC(=O)O MCULE-9588106269 [1,1,0,0,0,0|1,0,0]=3 1571 B8R0.5 CCCS(=O)CC(=O)O MCULE-4278595326 [1,1,0,0,0,0|2,0,0]=4 1572 B8R0.5 CCC[C@@H](N)CC(=O)O MCULE-9961668094 [1,1,0,0,0,0|1,0,0]=3 1573 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-1726586898 [1,1,0,0,0,0|1,0,0]=3 1574 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5359238908 [1,1,0,0,0,0|1,0,0]=3 1575 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5593873511 [1,1,0,0,0,0|1,0,0]=3 1576 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-7588873691 [1,1,0,0,0,0|1,0,0]=3 1577 B8R0.5 CCNC(=O)CC(=O)O MCULE-6073095545 [1,1,0,0,0,0|1,0,1]=4 1578 B8R0.5 CCNC(C)CC(=O)O MCULE-2938286546 [1,1,0,0,0,0|0,0,0]=2 1579 B8R0.5 CCNC(C)CC(=O)O MCULE-4848873654 [1,1,0,0,0,0|0,0,0]=2 1580 B8R0.5 CCOC(=O)CC(=O)O MCULE-9495505919 [1,1,0,0,0,0|1,0,1]=4 1581 B8R0.5 CCOC(C)SC(=O)C MCULE-7308480995 [1,1,0,0,0,0|2,0,0]=4 1582 B8R0.5 CCSC(C)CC(=O)O MCULE-9735540046 [1,1,0,0,0,0|0,0,0]=2 1583 B8R0.5 CN(CCO)CC(=O)O MCULE-9266824629 [1,1,0,0,0,0|1,0,0]=3 1584 B8R0.5 CNCC(O)CC(=O)O MCULE-4502865855 [1,1,0,0,0,0|1,0,0]=3 1585 B8R0.5 CNCC(O)CC(=O)O MCULE-5628718703 [1,1,0,0,0,0|1,0,0]=3 1586 B8R0.5 COCC(=CC(=O)O)C MCULE-7202220126 [1,1,0,0,0,0|0,0,2]=4 1587 B8R0.5 COCC(C)CC(=O)O MCULE-7551495663 [1,1,0,0,0,0|0,0,0]=2 1588 B8R0.5 COCC(C)NC(=O)N MCULE-1001849810 [1,1,0,0,0,0|2,0,0]=4 1589 B8R0.5 COCC(C)OC(=O)C MCULE-8540773364 [1,1,0,0,0,0|2,0,0]=4 1590 B8R0.5 COCC(C)OC(=O)Cl MCULE-3426225357 [1,1,0,0,0,0|2,0,0]=4 1591 B8R0.5 NCCC(O)CC(=O)O MCULE-3095949832 [1,1,0,0,0,0|1,0,0]=3 1592 B8R0.5 NCCC(O)CC(=O)O MCULE-8864780829 [1,1,0,0,0,0|1,0,0]=3 1593 B8R0.16 C=CC(CC)CC(=O)O MCULE-3976460208 [1,1,0,0,0,0|0,0,1]=3 1594 B8R0.16 CCC(=CC(=O)O)CC MCULE-1347248467 [1,1,0,0,0,0|0,0,2]=4 1595 B8R0.16 CCC(CC(=O)N)OC MCULE-9685044533 [1,1,0,0,0,0|1,0,0]=3 1596 B8R0.16 CCC(CC(=O)O)OC MCULE-7066116722 [1,1,0,0,0,0|0,0,0]=2 1597 B8R0.16 CCC(CC(=O)O)SC MCULE-6546556452 [1,1,0,0,0,0|0,0,0]=2 1598 B8R0.16 CCC(CC)CC(=O)C MCULE-6127320575 [1,1,0,0,0,0|1,0,0]=3 1599 B8R0.16 CCC(CC)CC(=O)N MCULE-7974720854 [1,1,0,0,0,0|1,0,0]=3 1600 B8R0.16 CCC(CC)CC(=O)O MCULE-1604696319 [1,1,0,0,0,0|0,0,0]=2 1601 B8R0.16 CCC(CO)NC(=O)C MCULE-9868176705 [1,1,0,0,0,0|2,0,0]=4 1602 B8R0.16 CCN(CC)CC(=O)C MCULE-9148873435 [1,1,0,0,0,0|2,0,0]=4 1603 B8R0.16 CCN(CC)CC(=O)N MCULE-6912193750 [1,1,0,0,0,0|2,0,0]=4 1604 B8R0.16 CCN(CC)CC(=O)O MCULE-3120416437 [1,1,0,0,0,0|1,0,0]=3 1605 B8R0.16 CCN(CC)CC(=O)O MCULE-4968287986 [1,1,0,0,0,0|1,0,0]=3 1606 B8R0.16 CCN(CC)CC(=O)[O-] MCULE-5593114931 [1,1,0,0,0,0|1,0,1]=4 1607 B8R0.16 CC[C@@H](CO)NC(=O)C MCULE-2664687963 [1,1,0,0,0,0|2,0,0]=4 1608 B8R0.16 CC[C@@H](CO)NC(=O)C MCULE-6485833206 [1,1,0,0,0,0|2,0,0]=4 1609 B8R0.16 COC(CC(=O)C)OC MCULE-4638877505 [1,1,0,0,0,0|2,0,0]=4 1610 B8R0.16 COC(CC(=O)N)OC MCULE-8599636273 [1,1,0,0,0,0|2,0,0]=4 1611 B8R0.16 COC(CC(=O)O)OC MCULE-5378328171 [1,1,0,0,0,0|1,0,0]=3 1612 B8R0.16 COC(CN)CC(=O)O MCULE-5640667137 [1,1,0,0,0,0|1,0,0]=3 1613 B8R0.16 COC(CN)CC(=O)O MCULE-6451369002 [1,1,0,0,0,0|1,0,0]=3 1614 B8R0.16 NCC(CO)CC(=O)O MCULE-2939268634 [1,1,0,0,0,0|1,0,0]=3 1615 B8R0.19 C(O)(CC)CC(=O)OC MCULE-6615199457 [1,1,0,0,0,0|1,0,0]=3 1616 B8R0.19 CCC(=O)CC(=O)OC MCULE-1605349915 [1,1,0,0,0,0|1,0,1]=4 1617 B8R0.19 CCC(=O)CC(C)CC MCULE-8568086135 [1,1,0,0,0,0|1,0,0]=3 1618 B8R0.19 CCC(=O)OC(C)CC MCULE-9589388650 [1,1,0,0,0,0|2,0,0]=4 1619 B8R0.19 CCC(C)CC(=O)OC MCULE-6040162942 [1,1,0,0,0,0|0,0,0]=2 1620 B8R0.19 CCC(C)CC(C)CO MCULE-5737704972 [1,1,0,0,0,0|1,0,1]=4 1621 B8R0.19 CCC(C)CC(N)CO MCULE-5344165944 [1,1,0,0,0,0|1,0,1]=4 1622 B8R0.19 CCC(C)CC(N)CO MCULE-6408946943 [1,1,0,0,0,0|1,0,1]=4 1623 B8R0.19 CCC(C)CC(O)CC MCULE-9706306627 [1,1,0,0,0,0|1,0,1]=4 1624 B8R0.19 CCC(C)NC(=O)CBr MCULE-1471524055 [1,1,0,0,0,0|2,0,0]=4 1625 B8R0.19 CCC(C)NC(=O)CCl MCULE-1032516079 [1,1,0,0,0,0|2,0,0]=4 1626 B8R0.19 CCC(C)NC(=O)CN MCULE-2235248545 [1,1,0,0,0,0|2,0,0]=4 1627 B8R0.19 CCC(C)NC(=O)CN MCULE-5232759952 [1,1,0,0,0,0|2,0,0]=4 1628 B8R0.19 CCC(C)OC(=O)NN MCULE-8409912635 [1,1,0,0,0,0|2,0,0]=4 1629 B8R0.19 CCC(N)CC(=O)OC MCULE-4861062224 [1,1,0,0,0,0|1,0,0]=3 1630 B8R0.19 CCC(N)CC(=O)OC MCULE-5474414259 [1,1,0,0,0,0|1,0,0]=3 1631 B8R0.19 CCC(N)CC(=O)OC MCULE-6614411962 [1,1,0,0,0,0|1,0,0]=3 1632 B8R0.19 CCC(N)CC(=O)OC MCULE-8833088600 [1,1,0,0,0,0|1,0,0]=3 1633 B8R0.19 CCN(C)CC(=O)NN MCULE-1832911721 [1,1,0,0,0,0|2,0,0]=4 1634 B8R0.19 CCN(C)CC(=O)NN MCULE-2865164993 [1,1,0,0,0,0|2,0,0]=4 1635 B8R0.19 CCN(C)CC(=O)NN MCULE-7681557684 [1,1,0,0,0,0|2,0,0]=4 1636 B8R0.19 CC[C@@H](N)CC(=O)OC MCULE-2253918492 [1,1,0,0,0,0|1,0,0]=3 1637 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-7264527834 [1,1,0,0,0,0|1,0,0]=3 1638 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-8077794874 [1,1,0,0,0,0|1,0,0]=3 1639 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-1636989319 [1,1,0,0,0,0|1,0,0]=3 1640 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-6253948831 [1,1,0,0,0,0|1,0,0]=3 1641 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-7924708820 [1,1,0,0,0,0|1,0,0]=3 1642 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-8911472049 [1,1,0,0,0,0|1,0,0]=3 1643 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-3861554927 [1,1,0,0,0,0|1,0,0]=3 1644 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-6307000918 [1,1,0,0,0,0|1,0,0]=3 1645 B8R0.19 CNC(=O)CC(C)NC MCULE-8409395532 [1,1,0,0,0,0|2,0,0]=4 1646 B8R0.19 CNC(=O)CC(C)NC MCULE-9311295772 [1,1,0,0,0,0|2,0,0]=4 1647 B8R0.19 CNC(C)CC(=O)OC MCULE-1039195486 [1,1,0,0,0,0|1,0,0]=3 1648 B8R0.19 COC(=O)CC(C)C=O MCULE-1183479071 [1,1,0,0,0,0|1,0,1]=4 1649 B8R0.19 COC(=O)CC(C)CBr MCULE-9170421446 [1,1,0,0,0,0|1,0,0]=3 1650 B8R0.19 COC(=O)CC(C)SC MCULE-9425584839 [1,1,0,0,0,0|1,0,0]=3 1651 B8R0.19 COC(=O)CC(N)CN MCULE-3079708048 [1,1,0,0,0,0|2,0,0]=4 1652 B8R0.19 COC(=O)CC(N)CN MCULE-5046271852 [1,1,0,0,0,0|2,0,0]=4 1653 B8R0.19 COC(=O)CC(N)CO MCULE-4803123890 [1,1,0,0,0,0|2,0,0]=4 1654 B8R0.19 COC(=O)CC(N)CO MCULE-5372024399 [1,1,0,0,0,0|2,0,0]=4 1655 B8R0.19 COC(=O)CC(O)CCl MCULE-3924993874 [1,1,0,0,0,0|2,0,0]=4 1656 B8R0.19 COC(=O)CC(O)CN MCULE-6633164904 [1,1,0,0,0,0|2,0,0]=4 1657 B8R0.19 COC(=O)CC(O)CN MCULE-6973205945 [1,1,0,0,0,0|2,0,0]=4 1658 B8R0.19 COC(=O)CC(O)CO MCULE-1721395490 [1,1,0,0,0,0|2,0,0]=4 1659 B8R0.19 COC(=O)CC(O)CO MCULE-7578547932 [1,1,0,0,0,0|2,0,0]=4 1660 B8R0.19 COC(=O)C[C@@H](O)CCl MCULE-2437500598 [1,1,0,0,0,0|2,0,0]=4 1661 B8R0.19 COC(=O)C[C@@H](O)CCl MCULE-2535323310 [1,1,0,0,0,0|2,0,0]=4 1662 B8R0.19 COC(=O)C[C@H](O)CCl MCULE-2232290900 [1,1,0,0,0,0|2,0,0]=4 1663 B8R0.19 COC(=O)C[C@H](O)CCl MCULE-2298624118 [1,1,0,0,0,0|2,0,0]=4 1664 B8R0.19 COC(=O)C[C@H](O)CO MCULE-3243102477 [1,1,0,0,0,0|2,0,0]=4 1665 B8R0.19 COC(=O)C[C@H](O)CO MCULE-7538479392 [1,1,0,0,0,0|2,0,0]=4 1666 B8R0.19 COC(=O)NC(C)CN MCULE-4563927308 [1,1,0,0,0,0|2,0,0]=4 1667 B8R0.19 COC(=O)NC(C)CN MCULE-8813177733 [1,1,0,0,0,0|2,0,0]=4 1668 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-1533957902 [1,1,0,0,0,0|2,0,0]=4 1669 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-7036214898 [1,1,0,0,0,0|2,0,0]=4 1670 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-8908212489 [1,1,0,0,0,0|2,0,0]=4 1671 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-9526857370 [1,1,0,0,0,0|2,0,0]=4 1672 B8R0.19 O=C(CO)CC(O)CO MCULE-2853556664 [1,1,0,0,0,0|2,0,0]=4 1673 B8R0.19 [C@@H](N)(CC)CC(=O)OC MCULE-3287738066 [1,1,0,0,0,0|1,0,0]=3 1674 B8R0.23 C=C(C)C(N)CC(=O)O MCULE-5527747045 [1,1,0,0,0,0|1,0,1]=4 1675 B8R0.23 C=C(C)[C@@H](O)CC(=O)O MCULE-9399932923 [1,1,0,0,0,0|1,0,1]=4 1676 B8R0.23 CC(=CC(=O)O)C(C)C MCULE-3448393194 [1,1,0,0,0,0|0,0,2]=4 1677 B8R0.23 CC(=O)C(C)CC(=O)O MCULE-9095166615 [1,1,0,0,0,0|0,0,1]=3 1678 B8R0.23 CC(=O)C(N)CC(=O)O MCULE-7043175556 [1,1,0,0,0,0|1,0,1]=4 1679 B8R0.23 CC(=O)CC(O)[C@H](C)N MCULE-3417979643 [1,1,0,0,0,0|2,0,0]=4 1680 B8R0.23 CC(=O)CN(C)C(C)C MCULE-2905536744 [1,1,0,0,0,0|2,0,0]=4 1681 B8R0.23 CC(=O)CN(C)C(C)C MCULE-7902012708 [1,1,0,0,0,0|2,0,0]=4 1682 B8R0.23 CC(=O)N(C)CC(=O)O MCULE-1037482941 [1,1,0,0,0,0|1,0,1]=4 1683 B8R0.23 CC(C)C(=O)CC(=O)O MCULE-9781100715 [1,1,0,0,0,0|1,0,1]=4 1684 B8R0.23 CC(C)C(C)CC(=O)O MCULE-8256978568 [1,1,0,0,0,0|0,0,0]=2 1685 B8R0.23 CC(C)C(N)CC(=O)O MCULE-1591106639 [1,1,0,0,0,0|1,0,0]=3 1686 B8R0.23 CC(C)C(N)CC(=O)O MCULE-2785677086 [1,1,0,0,0,0|1,0,0]=3 1687 B8R0.23 CC(C)C(N)CC(=O)O MCULE-7741390676 [1,1,0,0,0,0|1,0,0]=3 1688 B8R0.23 CC(C)C(N)CC(=O)O MCULE-7820976140 [1,1,0,0,0,0|1,0,0]=3 1689 B8R0.23 CC(C)C(O)CC(=O)O MCULE-2577623422 [1,1,0,0,0,0|1,0,0]=3 1690 B8R0.23 CC(C)N(C)CC(=O)O MCULE-7118433089 [1,1,0,0,0,0|1,0,0]=3 1691 B8R0.23 CC(C)N(C)CC(=O)O MCULE-8801372857 [1,1,0,0,0,0|1,0,0]=3 1692 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-4128027229 [1,1,0,0,0,0|1,0,0]=3 1693 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-5111030586 [1,1,0,0,0,0|1,0,0]=3 1694 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-7447469347 [1,1,0,0,0,0|1,0,0]=3 1695 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-8228659608 [1,1,0,0,0,0|1,0,0]=3 1696 B8R0.23 CC(C)[C@@H](O)CC(=O)O MCULE-6946774834 [1,1,0,0,0,0|1,0,0]=3 1697 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-2362404476 [1,1,0,0,0,0|1,0,0]=3 1698 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-4006103633 [1,1,0,0,0,0|1,0,0]=3 1699 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-8085621397 [1,1,0,0,0,0|1,0,0]=3 1700 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-8783742568 [1,1,0,0,0,0|1,0,0]=3 1701 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-4824634360 [1,1,0,0,0,0|1,0,1]=4 1702 B8R0.23 CC(CC(=O)O)C(=O)O MCULE-8116748590 [1,1,0,0,0,0|1,0,1]=4 1703 B8R0.23 CC(CC(=O)O)C(F)F MCULE-1349015136 [1,1,0,0,0,0|1,0,0]=3 1704 B8R0.23 CC(CC(=O)O)N(C)C MCULE-5382425068 [1,1,0,0,0,0|1,0,0]=3 1705 B8R0.23 CC(CC(=O)O)N(C)C MCULE-9798996642 [1,1,0,0,0,0|1,0,0]=3 1706 B8R0.23 CC(O)C(N)CC(=O)O MCULE-5161755443 [1,1,0,0,0,0|1,0,0]=3 1707 B8R0.23 CC(O)C(N)CC(=O)O MCULE-6370326858 [1,1,0,0,0,0|1,0,0]=3 1708 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-1711994689 [1,1,0,0,0,0|1,0,1]=4 1709 B8R0.23 C[C@@H](CC(=O)O)C(=O)O MCULE-6107805812 [1,1,0,0,0,0|1,0,1]=4 1710 B8R0.23 C[C@@H](CC(=O)O)N(C)C MCULE-7203350382 [1,1,0,0,0,0|1,0,0]=3 1711 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-1416044737 [1,1,0,0,0,0|1,0,0]=3 1712 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-2990511228 [1,1,0,0,0,0|1,0,0]=3 1713 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-3178455647 [1,1,0,0,0,0|1,0,0]=3 1714 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-4413833682 [1,1,0,0,0,0|1,0,0]=3 1715 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7332826518 [1,1,0,0,0,0|1,0,0]=3 1716 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7552978009 [1,1,0,0,0,0|1,0,0]=3 1717 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-2738295504 [1,1,0,0,0,0|1,0,1]=4 1718 B8R0.23 C[C@H](CC(=O)O)C(=O)O MCULE-4544789339 [1,1,0,0,0,0|1,0,1]=4 1719 B8R0.23 C[C@H](CC(=O)O)N(C)C MCULE-8459726256 [1,1,0,0,0,0|1,0,0]=3 1720 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O MCULE-8673070329 [1,1,0,0,0,0|1,0,0]=3 1721 B8R0.24 CCC(C)CS(=O)(=O)Cl MCULE-3522467576 [1,1,0,0,0,0|1,0,1]=4 1722 B8R0.24 CCC(C)CS(=O)(=O)F MCULE-3296257856 [1,1,0,0,0,0|1,0,1]=4 1723 B8R0.24 CCC(C)CS(=O)(=O)N MCULE-5238656824 [1,1,0,0,0,0|1,0,1]=4 1724 B8R0.34 C=C(C)CC(C)(C)CC MCULE-9469757352 [1,1,0,0,0,0|2,0,0]=4 1725 B8R0.34 C=CC(C)(C)CC(=O)O MCULE-5164134544 [1,1,0,0,0,0|0,0,2]=4 1726 B8R0.34 C=CC(C)(N)CC(=O)O MCULE-6219975516 [1,1,0,0,0,0|0,0,2]=4 1727 B8R0.34 C=CC(C)(N)CC(=O)O MCULE-7181187393 [1,1,0,0,0,0|0,0,2]=4 1728 B8R0.34 C=CC(C)(O)CC(=O)O MCULE-2178203310 [1,1,0,0,0,0|0,0,2]=4 1729 B8R0.34 CC(C)(C#N)CC(=O)O MCULE-3389391069 [1,1,0,0,0,0|1,0,1]=4 1730 B8R0.34 CC(C)(CBr)CC(=O)O MCULE-4311085343 [1,1,0,0,0,0|1,0,0]=3 1731 B8R0.34 CC(C)(CN)CC(=O)O MCULE-6230830854 [1,1,0,0,0,0|1,0,0]=3 1732 B8R0.34 CC(C)(CN)CC(=O)O MCULE-7518023349 [1,1,0,0,0,0|1,0,0]=3 1733 B8R0.34 CC(C)(CO)CC(=O)O MCULE-8595593482 [1,1,0,0,0,0|1,0,0]=3 1734 B8R0.34 CC(C)(CO)CC(=O)[O-] MCULE-9214676521 [1,1,0,0,0,0|1,0,1]=4 1735 B8R0.34 CC(O)(CN)CC(=O)O MCULE-3304637192 [1,1,0,0,0,0|1,0,0]=3 1736 B8R0.34 CC(O)(CN)CC(=O)O MCULE-4143526784 [1,1,0,0,0,0|1,0,0]=3 1737 B8R0.34 CCC(C)(C)CC(=O)C MCULE-9050476347 [1,1,0,0,0,0|1,0,0]=3 1738 B8R0.34 CCC(C)(C)CC(=O)O MCULE-7231252497 [1,1,0,0,0,0|0,0,0]=2 1739 B8R0.34 CCC(C)(C)NC(=O)C MCULE-4494448055 [1,1,0,0,0,0|2,0,0]=4 1740 B8R0.34 CCC(C)(C)OC(=O)C MCULE-9920396593 [1,1,0,0,0,0|2,0,0]=4 1741 B8R0.34 CCC(C)(O)CC(=O)O MCULE-2487477968 [1,1,0,0,0,0|0,0,0]=2 1742 B8R0.34 CCC(F)(F)CC(=O)O MCULE-6139996682 [1,1,0,0,0,0|1,0,0]=3 1743 B8R0.34 CCS(=O)(=O)CC(=O)O MCULE-2833586083 [1,1,0,0,0,0|2,0,0]=4 1744 B8R0.34 COC(C)(C)CC(=O)C MCULE-7283878436 [1,1,0,0,0,0|2,0,0]=4 1745 B8R0.34 COC(C)(C)CC(=O)O MCULE-3953307849 [1,1,0,0,0,0|1,0,0]=3 1746 B8R0.34 CSC(C)(C)CC(=O)C MCULE-8630996828 [1,1,0,0,0,0|2,0,0]=4 1747 B8R0.34 NCC(F)(F)CC(=O)O MCULE-1672648881 [1,1,0,0,0,0|2,0,0]=4 1748 B8R0.3 C#CCC(N)C(=O)OC MCULE-2178950640 [1,1,0,0,0,0|0,0,2]=4 1749 B8R0.3 C#CCC(N)C(=O)OC MCULE-6758978147 [1,1,0,0,0,0|0,0,2]=4 1750 B8R0.3 C#CC[C@@H](N)C(=O)OC MCULE-1974908886 [1,1,0,0,0,0|0,0,2]=4 1751 B8R0.3 C#CC[C@@H](N)C(=O)OC MCULE-4511622416 [1,1,0,0,0,0|0,0,2]=4 1752 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-1519824425 [1,1,0,0,0,0|0,0,2]=4 1753 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-2744971317 [1,1,0,0,0,0|0,0,2]=4 1754 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-4813964115 [1,1,0,0,0,0|0,0,2]=4 1755 B8R0.3 C#CC[C@H](N)C(=O)OC MCULE-6433911913 [1,1,0,0,0,0|0,0,2]=4 1756 B8R0.3 C=CCC(N)C(=O)OC MCULE-1390503391 [1,1,0,0,0,0|0,0,2]=4 1757 B8R0.3 C=CCC(N)C(=O)OC MCULE-6527008669 [1,1,0,0,0,0|0,0,2]=4 1758 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1188632168 [1,1,0,0,0,0|0,0,2]=4 1759 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1561172370 [1,1,0,0,0,0|0,0,2]=4 1760 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-1592773442 [1,1,0,0,0,0|0,0,2]=4 1761 B8R0.3 C=CC[C@@H](N)C(=O)OC MCULE-2928833845 [1,1,0,0,0,0|0,0,2]=4 1762 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-1184647267 [1,1,0,0,0,0|0,0,2]=4 1763 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-6782970786 [1,1,0,0,0,0|0,0,2]=4 1764 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-7213365607 [1,1,0,0,0,0|0,0,2]=4 1765 B8R0.3 C=CC[C@H](N)C(=O)OC MCULE-9811834405 [1,1,0,0,0,0|0,0,2]=4 1766 B8R0.3 CCCC(=O)C(=O)OC MCULE-5789275467 [1,1,0,0,0,0|1,0,1]=4 1767 B8R0.3 CCCC(Br)C(=O)OC MCULE-2779995445 [1,1,0,0,0,0|1,0,0]=3 1768 B8R0.3 CCCC(C)C(=O)CC MCULE-9990200653 [1,1,0,0,0,0|2,0,0]=4 1769 B8R0.3 CCCC(C)C(=O)OC MCULE-6953134216 [1,1,0,0,0,0|1,0,0]=3 1770 B8R0.3 CCCC(N)C(=O)NC MCULE-3980097421 [1,1,0,0,0,0|1,0,0]=3 1771 B8R0.3 CCCC(N)C(=O)NO MCULE-2069838283 [1,1,0,0,0,0|0,0,0]=2 1772 B8R0.3 CCCC(N)C(=O)OC MCULE-1453218994 [1,1,0,0,0,0|0,0,0]=2 1773 B8R0.3 CCCC(N)C(=O)OC MCULE-4171872835 [1,1,0,0,0,0|0,0,0]=2 1774 B8R0.3 CCCC(N)C(=O)OC MCULE-4324009425 [1,1,0,0,0,0|0,0,0]=2 1775 B8R0.3 CCCC(N)C(=O)OC MCULE-9533158990 [1,1,0,0,0,0|0,0,0]=2 1776 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-1310673609 [1,1,0,0,0,0|0,0,0]=2 1777 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5850698619 [1,1,0,0,0,0|0,0,0]=2 1778 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5854286766 [1,1,0,0,0,0|0,0,0]=2 1779 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-9793822862 [1,1,0,0,0,0|0,0,0]=2 1780 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-2009036281 [1,1,0,0,0,0|0,0,0]=2 1781 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5609199650 [1,1,0,0,0,0|0,0,0]=2 1782 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5628439347 [1,1,0,0,0,0|0,0,0]=2 1783 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-8724830592 [1,1,0,0,0,0|0,0,0]=2 1784 B8R0.3 CCNC(C)C(=O)OC MCULE-3289750233 [1,1,0,0,0,0|2,0,0]=4 1785 B8R0.3 CCNC(C)C(=O)OC MCULE-6862987622 [1,1,0,0,0,0|2,0,0]=4 1786 B8R0.3 CCN[C@@H](C)C(=O)OC MCULE-5663920756 [1,1,0,0,0,0|2,0,0]=4 1787 B8R0.3 CNCC(Br)C(=O)OC MCULE-2818400613 [1,1,0,0,0,0|2,0,0]=4 1788 B8R0.3 CNCC(Br)C(=O)OC MCULE-5823314810 [1,1,0,0,0,0|2,0,0]=4 1789 B8R0.3 CNCC(C)C(=O)OC MCULE-5525958870 [1,1,0,0,0,0|2,0,0]=4 1790 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-6377659413 [1,1,0,0,0,0|1,0,0]=3 1791 B8R0.3 CNC[C@H](N)C(=O)OC MCULE-9611469994 [1,1,0,0,0,0|1,0,0]=3 1792 B8R0.3 COC(=O)C(Br)CCBr MCULE-4290973865 [1,1,0,0,0,0|2,0,0]=4 1793 B8R0.3 COC(=O)C(C)CCBr MCULE-7970722391 [1,1,0,0,0,0|2,0,0]=4 1794 B8R0.3 COC(=O)C(C)CCCl MCULE-3423199485 [1,1,0,0,0,0|2,0,0]=4 1795 B8R0.3 COC(=O)C(C)CCN MCULE-4788413403 [1,1,0,0,0,0|2,0,0]=4 1796 B8R0.3 COC(=O)C(C)CCN MCULE-6075427964 [1,1,0,0,0,0|2,0,0]=4 1797 B8R0.3 COC(=O)C(N)CCBr MCULE-5668145888 [1,1,0,0,0,0|1,0,0]=3 1798 B8R0.3 COC(=O)C(N)CCBr MCULE-5831054247 [1,1,0,0,0,0|1,0,0]=3 1799 B8R0.3 COC(=O)C(N)CCF MCULE-3356013030 [1,1,0,0,0,0|1,0,0]=3 1800 B8R0.3 COC(=O)C(N)CCF MCULE-6443244944 [1,1,0,0,0,0|1,0,0]=3 1801 B8R0.3 COC(=O)C(N)CCS MCULE-8178229832 [1,1,0,0,0,0|1,0,0]=3 1802 B8R0.3 COC(=O)C(N)CSC MCULE-6702025743 [1,1,0,0,0,0|1,0,0]=3 1803 B8R0.3 COC(=O)C(N)CSC MCULE-7180641175 [1,1,0,0,0,0|1,0,0]=3 1804 B8R0.3 COC(=O)C(O)CCN MCULE-7139144229 [1,1,0,0,0,0|2,0,0]=4 1805 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-1252477377 [1,1,0,0,0,0|1,0,0]=3 1806 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-6780159971 [1,1,0,0,0,0|1,0,0]=3 1807 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-8129635461 [1,1,0,0,0,0|1,0,0]=3 1808 B8R0.3 COC(=O)[C@@H](N)CCBr MCULE-9824385803 [1,1,0,0,0,0|1,0,0]=3 1809 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-5345736899 [1,1,0,0,0,0|1,0,0]=3 1810 B8R0.3 COC(=O)[C@@H](N)CCN MCULE-8434362314 [1,1,0,0,0,0|1,0,0]=3 1811 B8R0.3 COC(=O)[C@@H](N)CCS MCULE-1895611205 [1,1,0,0,0,0|1,0,0]=3 1812 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-2532401863 [1,1,0,0,0,0|1,0,0]=3 1813 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-3321267517 [1,1,0,0,0,0|1,0,0]=3 1814 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-5693942065 [1,1,0,0,0,0|1,0,0]=3 1815 B8R0.3 COC(=O)[C@@H](N)CSC MCULE-7597642447 [1,1,0,0,0,0|1,0,0]=3 1816 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-1204029497 [1,1,0,0,0,0|2,0,0]=4 1817 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-2464186416 [1,1,0,0,0,0|2,0,0]=4 1818 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-4887582087 [1,1,0,0,0,0|2,0,0]=4 1819 B8R0.3 COC(=O)[C@@H](O)CCN MCULE-8785450046 [1,1,0,0,0,0|2,0,0]=4 1820 B8R0.3 COC(=O)[C@H](N)CCN MCULE-1821826306 [1,1,0,0,0,0|1,0,0]=3 1821 B8R0.3 COC(=O)[C@H](N)CCN MCULE-8161776969 [1,1,0,0,0,0|1,0,0]=3 1822 B8R0.3 COC(=O)[C@H](N)CCO MCULE-1194830786 [1,1,0,0,0,0|1,0,0]=3 1823 B8R0.3 COC(=O)[C@H](N)CCO MCULE-2532522705 [1,1,0,0,0,0|1,0,0]=3 1824 B8R0.3 COC(=O)[C@H](N)CCS MCULE-8558179208 [1,1,0,0,0,0|1,0,0]=3 1825 B8R0.3 COCC(Br)C(=O)OC MCULE-5792855565 [1,1,0,0,0,0|2,0,0]=4 1826 B8R0.3 COCC(C)C(=O)OC MCULE-4110856609 [1,1,0,0,0,0|2,0,0]=4 1827 B8R0.3 COCC(N)C(=O)OC MCULE-1717271658 [1,1,0,0,0,0|1,0,0]=3 1828 B8R0.3 COCC(N)C(=O)OC MCULE-4567479747 [1,1,0,0,0,0|1,0,0]=3 1829 B8R0.3 COCC(N)C(=O)OC MCULE-4859095599 [1,1,0,0,0,0|1,0,0]=3 1830 B8R0.3 COCC(N)C(=O)OC MCULE-8125210840 [1,1,0,0,0,0|1,0,0]=3 1831 B8R0.3 COCC(O)C(=O)OC MCULE-6071304250 [1,1,0,0,0,0|2,0,0]=4 1832 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-2867072950 [1,1,0,0,0,0|1,0,0]=3 1833 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-5445193744 [1,1,0,0,0,0|1,0,0]=3 1834 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8505505456 [1,1,0,0,0,0|1,0,0]=3 1835 B8R0.3 COC[C@@H](N)C(=O)OC MCULE-8525451378 [1,1,0,0,0,0|1,0,0]=3 1836 B8R0.8 C#CCCC(N)C(=O)O MCULE-2306841483 [1,1,0,0,0,0|0,0,1]=3 1837 B8R0.8 C#CCCC(O)C(=O)O MCULE-1983462487 [1,1,0,0,0,0|1,0,1]=4 1838 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-3328230047 [1,1,0,0,0,0|0,0,1]=3 1839 B8R0.8 C#CCC[C@@H](N)C(=O)O MCULE-8588363102 [1,1,0,0,0,0|0,0,1]=3 1840 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-3269292516 [1,1,0,0,0,0|0,0,1]=3 1841 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6769399323 [1,1,0,0,0,0|0,0,1]=3 1842 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-6930343823 [1,1,0,0,0,0|0,0,1]=3 1843 B8R0.8 C#CCC[C@H](N)C(=O)O MCULE-9522590396 [1,1,0,0,0,0|0,0,1]=3 1844 B8R0.8 C(N)(CCCC)C(=O)N MCULE-1406613793 [1,1,0,0,0,0|1,0,0]=3 1845 B8R0.8 C(N)(CCCC)C(=O)N MCULE-4692008742 [1,1,0,0,0,0|1,0,0]=3 1846 B8R0.8 C=CCCC(C)C(=O)O MCULE-3089071984 [1,1,0,0,0,0|1,0,1]=4 1847 B8R0.8 C=CCCC(N)C(=O)N MCULE-3025865201 [1,1,0,0,0,0|1,0,1]=4 1848 B8R0.8 C=CCCC(N)C(=O)N MCULE-6477490851 [1,1,0,0,0,0|1,0,1]=4 1849 B8R0.8 C=CCCC(N)C(=O)O MCULE-1524160350 [1,1,0,0,0,0|0,0,1]=3 1850 B8R0.8 C=CCCC(N)C(=O)O MCULE-5522822192 [1,1,0,0,0,0|0,0,1]=3 1851 B8R0.8 C=CCCC(N)C(=O)O MCULE-7998584890 [1,1,0,0,0,0|0,0,1]=3 1852 B8R0.8 C=CCC[C@@H](N)C(=O)O MCULE-4571532321 [1,1,0,0,0,0|0,0,1]=3 1853 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-2235047291 [1,1,0,0,0,0|0,0,1]=3 1854 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-4644458098 [1,1,0,0,0,0|0,0,1]=3 1855 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-7821274952 [1,1,0,0,0,0|0,0,1]=3 1856 B8R0.8 C=CCC[C@H](N)C(=O)O MCULE-9807212949 [1,1,0,0,0,0|0,0,1]=3 1857 B8R0.8 CC#CCC(N)C(=O)O MCULE-2943446929 [1,1,0,0,0,0|0,0,1]=3 1858 B8R0.8 CC#CCC(N)C(=O)O MCULE-8126081664 [1,1,0,0,0,0|0,0,1]=3 1859 B8R0.8 CC#CC[C@@H](N)C(=O)O MCULE-5156383275 [1,1,0,0,0,0|0,0,1]=3 1860 B8R0.8 CC#CC[C@H](N)C(=O)O MCULE-4618959735 [1,1,0,0,0,0|0,0,1]=3 1861 B8R0.8 CC#CC[C@H](N)C(=O)O MCULE-7818390064 [1,1,0,0,0,0|0,0,1]=3 1862 B8R0.8 CC(CCCCl)C(=O)O MCULE-6504631587 [1,1,0,0,0,0|1,0,0]=3 1863 B8R0.8 CC(OCCN)C(=O)O MCULE-4117277894 [1,1,0,0,0,0|2,0,0]=4 1864 B8R0.8 CC(OCCN)C(=O)O MCULE-6407651037 [1,1,0,0,0,0|2,0,0]=4 1865 B8R0.8 CC(OCCO)C(=O)O MCULE-4305620136 [1,1,0,0,0,0|2,0,0]=4 1866 B8R0.8 CCC/C=C(\C)/C(=O)O MCULE-4080682767 [1,1,0,0,0,0|1,0,1]=4 1867 B8R0.8 CCCC=C(C)C(=O)O MCULE-1072900673 [1,1,0,0,0,0|1,0,1]=4 1868 B8R0.8 CCCCC(=O)C(=O)O MCULE-7796922508 [1,1,0,0,0,0|1,0,1]=4 1869 B8R0.8 CCCCC(Br)C(=O)N MCULE-9831415558 [1,1,0,0,0,0|2,0,0]=4 1870 B8R0.8 CCCCC(Br)C(=O)O MCULE-5428502537 [1,1,0,0,0,0|1,0,0]=3 1871 B8R0.8 CCCCC(C)C(=O)C MCULE-2303839464 [1,1,0,0,0,0|2,0,0]=4 1872 B8R0.8 CCCCC(C)C(=O)Cl MCULE-1718383314 [1,1,0,0,0,0|2,0,0]=4 1873 B8R0.8 CCCCC(C)C(=O)N MCULE-6062124512 [1,1,0,0,0,0|2,0,0]=4 1874 B8R0.8 CCCCC(C)C(=O)O MCULE-7933263354 [1,1,0,0,0,0|1,0,0]=3 1875 B8R0.8 CCCCC(F)C(=O)O MCULE-2276381656 [1,1,0,0,0,0|1,0,0]=3 1876 B8R0.8 CCCCC(N)C(=O)C MCULE-2471947344 [1,1,0,0,0,0|1,0,0]=3 1877 B8R0.8 CCCCC(N)C(=O)C MCULE-4947552776 [1,1,0,0,0,0|1,0,0]=3 1878 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [1,1,0,0,0,0|0,0,0]=2 1879 B8R0.8 CCCCC(N)C(C)O MCULE-3645367149 [1,1,0,0,0,0|1,0,1]=4 1880 B8R0.8 CCCCC(N)C(C)O MCULE-4512291097 [1,1,0,0,0,0|1,0,1]=4 1881 B8R0.8 CCCCC(O)C(=O)N MCULE-1063256537 [1,1,0,0,0,0|2,0,0]=4 1882 B8R0.8 CCCCC(O)C(=O)O MCULE-2557585903 [1,1,0,0,0,0|1,0,0]=3 1883 B8R0.8 CCCC[C@@H](C)C(=O)O MCULE-3454696473 [1,1,0,0,0,0|1,0,0]=3 1884 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [1,1,0,0,0,0|0,0,0]=2 1885 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [1,1,0,0,0,0|0,0,0]=2 1886 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9016844851 [1,1,0,0,0,0|1,0,0]=3 1887 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9437190196 [1,1,0,0,0,0|1,0,0]=3 1888 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-1555661156 [1,1,0,0,0,0|1,0,0]=3 1889 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9202467107 [1,1,0,0,0,0|1,0,0]=3 1890 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9573872199 [1,1,0,0,0,0|1,0,0]=3 1891 B8R0.8 CCCC[C@H](N)C(=O)N MCULE-9773159994 [1,1,0,0,0,0|1,0,0]=3 1892 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [1,1,0,0,0,0|0,0,0]=2 1893 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [1,1,0,0,0,0|0,0,0]=2 1894 B8R0.8 CCCNC(=O)C(=O)O MCULE-6074987864 [1,1,0,0,0,0|1,0,1]=4 1895 B8R0.8 CCCOC(C)C(=O)O MCULE-4477829415 [1,1,0,0,0,0|1,0,0]=3 1896 B8R0.8 CCNCC(C)C(=O)O MCULE-3863191122 [1,1,0,0,0,0|1,0,0]=3 1897 B8R0.8 CCNCC(C)C(=O)O MCULE-4164323563 [1,1,0,0,0,0|1,0,0]=3 1898 B8R0.8 CCOCC(C)C(=O)O MCULE-5346959026 [1,1,0,0,0,0|1,0,0]=3 1899 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9199053225 [1,1,0,0,0,0|0,0,0]=2 1900 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9684903914 [1,1,0,0,0,0|0,0,0]=2 1901 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-6351196285 [1,1,0,0,0,0|0,0,0]=2 1902 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-7653589662 [1,1,0,0,0,0|0,0,0]=2 1903 B8R0.8 CCSCC(N)C(=O)O MCULE-9449250733 [1,1,0,0,0,0|0,0,0]=2 1904 B8R0.8 COCCC(C)C(=O)O MCULE-5066180613 [1,1,0,0,0,0|1,0,0]=3 1905 B8R0.8 COCCC(N)C(=O)N MCULE-4212561129 [1,1,0,0,0,0|1,0,0]=3 1906 B8R0.8 COCCC(N)C(=O)N MCULE-5370323024 [1,1,0,0,0,0|1,0,0]=3 1907 B8R0.8 COCCC(N)C(=O)O MCULE-3018605108 [1,1,0,0,0,0|0,0,0]=2 1908 B8R0.8 COCC[C@H](N)C(=O)O MCULE-6748608543 [1,1,0,0,0,0|0,0,0]=2 1909 B8R0.8 COCC[C@H](N)C(=O)O MCULE-8586358852 [1,1,0,0,0,0|0,0,0]=2 1910 B8R0.8 CSCCC(=O)C(=O)O MCULE-6752350933 [1,1,0,0,0,0|1,0,1]=4 1911 B8R0.8 CSCCC(N)C(=O)N MCULE-8379409756 [1,1,0,0,0,0|1,0,0]=3 1912 B8R0.8 CSCCC(N)C(=O)N MCULE-9130755274 [1,1,0,0,0,0|1,0,0]=3 1913 B8R0.8 CSCCC(N)C(=O)N MCULE-9536539093 [1,1,0,0,0,0|1,0,0]=3 1914 B8R0.8 CSCCC(N)C(=O)N MCULE-9630072876 [1,1,0,0,0,0|1,0,0]=3 1915 B8R0.8 CSCCC(N)C(=O)O MCULE-5626142345 [1,1,0,0,0,0|0,0,0]=2 1916 B8R0.8 CSCCC(O)C(=O)N MCULE-9019971815 [1,1,0,0,0,0|2,0,0]=4 1917 B8R0.8 CSCCC(O)C(=O)O MCULE-3684026487 [1,1,0,0,0,0|1,0,0]=3 1918 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-2209985195 [1,1,0,0,0,0|0,0,0]=2 1919 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-9944164883 [1,1,0,0,0,0|0,0,0]=2 1920 B8R0.8 CSCC[C@@H](N)C(=O)[O-] MCULE-2405585602 [1,1,0,0,0,0|0,0,1]=3 1921 B8R0.8 CSCC[C@@H](N)C(=O)[O-] MCULE-6869616866 [1,1,0,0,0,0|0,0,1]=3 1922 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-1318828477 [1,1,0,0,0,0|1,0,0]=3 1923 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-2645914311 [1,1,0,0,0,0|1,0,0]=3 1924 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-4676970409 [1,1,0,0,0,0|1,0,0]=3 1925 B8R0.8 CSCC[C@H](N)C(=O)N MCULE-6619857551 [1,1,0,0,0,0|1,0,0]=3 1926 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-3383932641 [1,1,0,0,0,0|0,0,0]=2 1927 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-4603455639 [1,1,0,0,0,0|0,0,0]=2 1928 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-7228063662 [1,1,0,0,0,0|0,0,0]=2 1929 B8R0.8 C[Se]CCC(N)C(=O)O MCULE-9212969564 [1,1,0,0,0,0|0,0,0]=2 1930 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5333020269 [1,1,0,0,0,0|0,0,0]=2 1931 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5980340572 [1,1,0,0,0,0|0,0,0]=2 1932 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [1,1,0,0,0,0|0,0,0]=2 1933 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [1,1,0,0,0,0|0,0,0]=2 1934 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [1,1,0,0,0,0|0,0,0]=2 1935 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [1,1,0,0,0,0|0,0,0]=2 1936 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [1,1,0,0,0,0|0,0,0]=2 1937 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [1,1,0,0,0,0|0,0,0]=2 1938 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [1,1,0,0,0,0|0,0,0]=2 1939 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [1,1,0,0,0,0|0,0,0]=2 1940 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [1,1,0,0,0,0|0,0,0]=2 1941 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [1,1,0,0,0,0|0,0,0]=2 1942 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [1,1,0,0,0,0|0,0,0]=2 1943 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [1,1,0,0,0,0|0,0,0]=2 1944 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [1,1,0,0,0,0|0,0,0]=2 1945 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [1,1,0,0,0,0|0,0,0]=2 1946 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [1,1,0,0,0,0|0,0,0]=2 1947 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [1,1,0,0,0,0|0,0,0]=2 1948 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [1,1,0,0,0,0|0,0,0]=2 1949 B8R0.8 NOCCC(N)C(=O)O MCULE-1540658941 [1,1,0,0,0,0|1,0,0]=3 1950 B8R0.8 NOCCC(N)C(=O)O MCULE-3729513992 [1,1,0,0,0,0|1,0,0]=3 1951 B8R0.8 NOCC[C@@H](N)C(=O)O MCULE-3273727827 [1,1,0,0,0,0|1,0,0]=3 1952 B8R0.8 NOCC[C@H](N)C(=O)O MCULE-2315172974 [1,1,0,0,0,0|1,0,0]=3 1953 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [1,1,0,0,0,0|0,0,0]=2 1954 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [1,1,0,0,0,0|0,0,0]=2 1955 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [1,1,0,0,0,0|1,0,0]=3 1956 B8R0.8 O=C([O-])C(O)CCCO MCULE-5137868319 [1,1,0,0,0,0|1,0,1]=4 1957 B8R0.8 [C@@H](N)(CCC=C)C(=O)O MCULE-9648209291 [1,1,0,0,0,0|0,0,1]=3 1958 B8R0.8 [C@H](N)(CCON)C(=O)O MCULE-1309966773 [1,1,0,0,0,0|1,0,0]=3 1959 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O MCULE-4562460888 [1,1,0,0,0,0|2,0,0]=4 1960 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O MCULE-4736712462 [1,1,0,0,0,0|2,0,0]=4 1961 B8R0.8 [N-]=[N+]=NC[C@@H](N)C(=O)O MCULE-6764345986 [1,1,0,0,0,0|2,0,0]=4 1962 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-1901194070 [1,1,0,0,0,0|2,0,0]=4 1963 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-2129950967 [1,1,0,0,0,0|2,0,0]=4 1964 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-4531641107 [1,1,0,0,0,0|2,0,0]=4 1965 B8R0.8 [N-]=[N+]=NC[C@H](N)C(=O)O MCULE-9554569949 [1,1,0,0,0,0|2,0,0]=4 1966 B8R0.12 C#CCC(C)(N)C(=O)O MCULE-8114982544 [1,1,0,0,0,0|0,0,2]=4 1967 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-2326062849 [1,1,0,0,0,0|0,0,2]=4 1968 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-2897598223 [1,1,0,0,0,0|0,0,2]=4 1969 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-6332359697 [1,1,0,0,0,0|0,0,2]=4 1970 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-9265618717 [1,1,0,0,0,0|0,0,2]=4 1971 B8R0.12 C#CC[C@](C)(N)C(=O)O MCULE-2976528694 [1,1,0,0,0,0|0,0,2]=4 1972 B8R0.12 C#CC[C@](C)(N)C(=O)O MCULE-7418052843 [1,1,0,0,0,0|0,0,2]=4 1973 B8R0.12 C=CCC(C)(N)C(=O)O MCULE-7144199889 [1,1,0,0,0,0|0,0,2]=4 1974 B8R0.12 C=CC[C@@](C)(N)C(=O)O MCULE-4753726738 [1,1,0,0,0,0|0,0,2]=4 1975 B8R0.12 C=CC[C@@](C)(N)C(=O)O MCULE-8270551752 [1,1,0,0,0,0|0,0,2]=4 1976 B8R0.12 C=CC[C@](C)(N)C(=O)O MCULE-2471413685 [1,1,0,0,0,0|0,0,2]=4 1977 B8R0.12 C=CC[C@](C)(N)C(=O)O MCULE-5595289174 [1,1,0,0,0,0|0,0,2]=4 1978 B8R0.12 CC(C)(CCN)C(=O)O MCULE-2948071531 [1,1,0,0,0,0|2,0,0]=4 1979 B8R0.12 CC(C)(CCN)C(=O)O MCULE-9113980340 [1,1,0,0,0,0|2,0,0]=4 1980 B8R0.12 CC(C)(CCO)C(=O)O MCULE-1566648548 [1,1,0,0,0,0|2,0,0]=4 1981 B8R0.12 CC(N)(CCF)C(=O)O MCULE-5797177130 [1,1,0,0,0,0|1,0,0]=3 1982 B8R0.12 CC(N)(CCF)C(=O)O MCULE-9911119608 [1,1,0,0,0,0|1,0,0]=3 1983 B8R0.12 CCCC(C)(C)C(=O)C MCULE-3472590451 [1,1,0,0,0,0|2,0,0]=4 1984 B8R0.12 CCCC(C)(C)C(=O)Cl MCULE-1035499713 [1,1,0,0,0,0|2,0,0]=4 1985 B8R0.12 CCCC(C)(C)C(=O)O MCULE-7950118630 [1,1,0,0,0,0|1,0,0]=3 1986 B8R0.12 CCCC(C)(N)C(=O)O MCULE-3079931045 [1,1,0,0,0,0|0,0,0]=2 1987 B8R0.12 CCCC(C)(O)C(=O)N MCULE-5398805490 [1,1,0,0,0,0|2,0,0]=4 1988 B8R0.12 CCCC(C)(O)C(=O)O MCULE-5292180056 [1,1,0,0,0,0|1,0,0]=3 1989 B8R0.12 CCCC(F)(F)C(=O)O MCULE-9926038462 [1,1,0,0,0,0|1,0,0]=3 1990 B8R0.12 CCC[C@](C)(N)C(=O)O MCULE-8569302783 [1,1,0,0,0,0|0,0,0]=2 1991 B8R0.12 CCNC(C)(C)C(=O)O MCULE-5196592202 [1,1,0,0,0,0|2,0,0]=4 1992 B8R0.12 CCNC(C)(C)C(=O)O MCULE-7185239447 [1,1,0,0,0,0|2,0,0]=4 1993 B8R0.12 CCOC(C)(C)C(=O)O MCULE-7344066576 [1,1,0,0,0,0|2,0,0]=4 1994 B8R0.12 CNCC(C)(C)C(=O)O MCULE-1701621773 [1,1,0,0,0,0|2,0,0]=4 1995 B8R0.12 CNCC(C)(C)C(=O)O MCULE-7669976515 [1,1,0,0,0,0|2,0,0]=4 1996 B8R0.12 CNCC(F)(F)C(=O)O MCULE-3707622806 [1,1,0,0,0,0|2,0,0]=4 1997 B8R0.12 CNCC(F)(F)C(=O)O MCULE-4421374171 [1,1,0,0,0,0|2,0,0]=4 1998 B8R0.12 COCC(C)(C)C(=O)O MCULE-9074673500 [1,1,0,0,0,0|2,0,0]=4 1999 B8R0.12 COCC(C)(N)C(=O)N MCULE-3533018780 [1,1,0,0,0,0|2,0,0]=4 2000 B8R0.12 COCC(C)(N)C(=O)N MCULE-9747751712 [1,1,0,0,0,0|2,0,0]=4 2001 B8R0.12 COCC(C)(O)C(=O)O MCULE-7674892239 [1,1,0,0,0,0|2,0,0]=4 2002 B8R0.12 COCC(F)(F)C(=O)O MCULE-6981513055 [1,1,0,0,0,0|2,0,0]=4 2003 B8R0.12 CSCC(C)(C)C(=O)O MCULE-8010872211 [1,1,0,0,0,0|2,0,0]=4 2004 B8R0.12 NCCC(F)(F)C(=O)O MCULE-3814517866 [1,1,0,0,0,0|2,0,0]=4 2005 B8R0.15 C#CC(OCC)C(=O)O MCULE-4920328481 [1,1,0,0,0,0|2,0,0]=4 2006 B8R0.15 CCC(CCN)C(=O)O MCULE-3540595708 [1,1,0,0,0,0|2,0,0]=4 2007 B8R0.15 CCC(CCN)C(=O)O MCULE-6369668711 [1,1,0,0,0,0|2,0,0]=4 2008 B8R0.15 CCCC(C#N)C(=O)O MCULE-8231205596 [1,1,0,0,0,0|0,0,1]=3 2009 B8R0.15 CCCC(CC)C(=O)C MCULE-3483794250 [1,1,0,0,0,0|2,0,0]=4 2010 B8R0.15 CCCC(CC)C(=O)O MCULE-2070546888 [1,1,0,0,0,0|1,0,0]=3 2011 B8R0.15 CCCC(CO)C(=O)O MCULE-2653026260 [1,1,0,0,0,0|1,0,0]=3 2012 B8R0.15 CCCC(NC)C(=O)O MCULE-5292420123 [1,1,0,0,0,0|0,0,0]=2 2013 B8R0.15 CCCC(NC)C(=O)O MCULE-5734283547 [1,1,0,0,0,0|0,0,0]=2 2014 B8R0.15 CCCC(NC)C(=O)O MCULE-9559460593 [1,1,0,0,0,0|0,0,0]=2 2015 B8R0.15 CCCC(NO)C(=O)O MCULE-7484331195 [1,1,0,0,0,0|0,0,0]=2 2016 B8R0.15 CCCC(OC)C(=O)O MCULE-6875744280 [1,1,0,0,0,0|1,0,0]=3 2017 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-3394704356 [1,1,0,0,0,0|0,0,0]=2 2018 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-8140893147 [1,1,0,0,0,0|0,0,0]=2 2019 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-1805025355 [1,1,0,0,0,0|1,0,0]=3 2020 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-3449491143 [1,1,0,0,0,0|1,0,0]=3 2021 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-1028689544 [1,1,0,0,0,0|0,0,0]=2 2022 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-4848752673 [1,1,0,0,0,0|0,0,0]=2 2023 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-5585839502 [1,1,0,0,0,0|0,0,0]=2 2024 B8R0.15 CCC[C@H](NO)C(=O)O MCULE-7455558431 [1,1,0,0,0,0|0,0,0]=2 2025 B8R0.15 CCOC(CBr)C(=O)O MCULE-5345866284 [1,1,0,0,0,0|2,0,0]=4 2026 B8R0.15 CCOC(CC)C(=O)O MCULE-1674742787 [1,1,0,0,0,0|2,0,0]=4 2027 B8R0.15 CNC(CCN)C(=O)N MCULE-4176706453 [1,1,0,0,0,0|2,0,0]=4 2028 B8R0.15 CNC(CCN)C(=O)O MCULE-6687313255 [1,1,0,0,0,0|1,0,0]=3 2029 B8R0.15 CNC(COC)C(=O)N MCULE-9124173069 [1,1,0,0,0,0|2,0,0]=4 2030 B8R0.15 CNC(COC)C(=O)O MCULE-4091913769 [1,1,0,0,0,0|1,0,0]=3 2031 B8R0.15 CNC(COC)C(=O)O MCULE-6745647660 [1,1,0,0,0,0|1,0,0]=3 2032 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-4209872941 [1,1,0,0,0,0|1,0,0]=3 2033 B8R0.15 CN[C@@H](CCO)C(=O)O MCULE-7202916887 [1,1,0,0,0,0|1,0,0]=3 2034 B8R0.15 CN[C@@H](COC)C(=O)N MCULE-2651499559 [1,1,0,0,0,0|2,0,0]=4 2035 B8R0.15 CN[C@@H](COC)C(=O)N MCULE-2761071254 [1,1,0,0,0,0|2,0,0]=4 2036 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-1874728709 [1,1,0,0,0,0|1,0,0]=3 2037 B8R0.15 CN[C@H](CCO)C(=O)O MCULE-3716592032 [1,1,0,0,0,0|1,0,0]=3 2038 B8R0.15 COC(CCN)C(=O)O MCULE-1510512790 [1,1,0,0,0,0|2,0,0]=4 2039 B8R0.15 COCC(OC)C(=O)O MCULE-5776685365 [1,1,0,0,0,0|2,0,0]=4 2040 B8R0.15 COCC(ON)C(=O)O MCULE-4466158339 [1,1,0,0,0,0|1,0,0]=3 2041 B8R0.15 COCC(ON)C(=O)O MCULE-6084078663 [1,1,0,0,0,0|1,0,0]=3 2042 B8R0.20 CCC(C)C(C=O)OC MCULE-5091212843 [1,1,0,0,0,0|1,0,0]=3 2043 B8R0.20 CCC(C)C(CN)OC MCULE-5181614773 [1,1,0,0,0,0|2,0,0]=4 2044 B8R0.20 CCC(C)C(CO)OC MCULE-9009724151 [1,1,0,0,0,0|1,0,1]=4 2045 B8R0.20 CCC(CC)C(O)CO MCULE-2947428739 [1,1,0,0,0,0|1,0,1]=4 2046 B8R0.18 CC(=O)C(C#N)C(C)C MCULE-2400075763 [1,1,0,0,0,0|1,0,1]=4 2047 B8R0.18 CC(C)C(CN)C(=O)O MCULE-4117902081 [1,1,0,0,0,0|0,0,0]=2 2048 B8R0.18 CC(C)C(CN)C(=O)O MCULE-7615812755 [1,1,0,0,0,0|0,0,0]=2 2049 B8R0.18 CC(C)C(CN)C(=O)O MCULE-7742033605 [1,1,0,0,0,0|0,0,0]=2 2050 B8R0.18 CC(C)C(CO)C(=O)O MCULE-3554430088 [1,1,0,0,0,0|1,0,0]=3 2051 B8R0.18 CC(C)C(CO)C(=O)[O-] MCULE-8769338268 [1,1,0,0,0,0|1,0,1]=4 2052 B8R0.18 CC(C)C(NN)C(=O)O MCULE-5064228794 [1,1,0,0,0,0|0,0,0]=2 2053 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-1192054373 [1,1,0,0,0,0|0,0,0]=2 2054 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-3040043200 [1,1,0,0,0,0|0,0,0]=2 2055 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-4353846755 [1,1,0,0,0,0|0,0,0]=2 2056 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-6762829521 [1,1,0,0,0,0|0,0,0]=2 2057 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4384560751 [1,1,0,0,0,0|0,0,0]=2 2058 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4859224613 [1,1,0,0,0,0|0,0,0]=2 2059 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4974717674 [1,1,0,0,0,0|0,0,0]=2 2060 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-7170111497 [1,1,0,0,0,0|0,0,0]=2 2061 B8R0.18 CC(C)[C@H](NO)C(=O)O MCULE-4203177410 [1,1,0,0,0,0|0,0,0]=2 2062 B8R0.18 CCC(C(=O)C)C(C)C MCULE-3028115393 [1,1,0,0,0,0|2,0,0]=4 2063 B8R0.18 CCC(C(=O)O)C(C)C MCULE-5914693527 [1,1,0,0,0,0|1,0,0]=3 2064 B8R0.18 CCC(C(=O)O)C(C)N MCULE-2976322800 [1,1,0,0,0,0|2,0,0]=4 2065 B8R0.18 CCC(C(=O)O)C(C)O MCULE-1064081188 [1,1,0,0,0,0|2,0,0]=4 2066 B8R0.18 CCC(C(=O)O)N(C)C MCULE-4235177725 [1,1,0,0,0,0|2,0,0]=4 2067 B8R0.18 CC[C@@H](C(=O)O)N(C)C MCULE-3756764540 [1,1,0,0,0,0|2,0,0]=4 2068 B8R0.18 CC[C@H](C(=O)O)N(C)C MCULE-4719850768 [1,1,0,0,0,0|2,0,0]=4 2069 B8R0.18 CN(C)C(CN)C(=O)O MCULE-6449978430 [1,1,0,0,0,0|1,0,0]=3 2070 B8R0.18 CNC(C(=O)C)C(C)C MCULE-7800115305 [1,1,0,0,0,0|1,0,0]=3 2071 B8R0.18 CNC(C(=O)C)C(C)C MCULE-7817785327 [1,1,0,0,0,0|1,0,0]=3 2072 B8R0.18 CNC(C(=O)O)C(C)C MCULE-2983512448 [1,1,0,0,0,0|0,0,0]=2 2073 B8R0.18 CNC(C(=O)O)C(C)C MCULE-5377326864 [1,1,0,0,0,0|0,0,0]=2 2074 B8R0.18 CNC(C(=O)O)C(C)C MCULE-7319327975 [1,1,0,0,0,0|0,0,0]=2 2075 B8R0.18 CNC(C(=O)O)C(C)O MCULE-8017224741 [1,1,0,0,0,0|1,0,0]=3 2076 B8R0.18 CN[C@@H](C(=O)N)C(C)C MCULE-3721439514 [1,1,0,0,0,0|1,0,0]=3 2077 B8R0.18 CN[C@@H](C(=O)N)C(C)C MCULE-9356028516 [1,1,0,0,0,0|1,0,0]=3 2078 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-4099145544 [1,1,0,0,0,0|0,0,0]=2 2079 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-4380404369 [1,1,0,0,0,0|0,0,0]=2 2080 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-9367123188 [1,1,0,0,0,0|0,0,0]=2 2081 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-9706333586 [1,1,0,0,0,0|0,0,0]=2 2082 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5443567819 [1,1,0,0,0,0|0,0,0]=2 2083 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5552228182 [1,1,0,0,0,0|0,0,0]=2 2084 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5767489702 [1,1,0,0,0,0|0,0,0]=2 2085 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-8822349419 [1,1,0,0,0,0|0,0,0]=2 2086 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-5405618703 [1,1,0,0,0,0|1,0,0]=3 2087 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-6470355986 [1,1,0,0,0,0|1,0,0]=3 2088 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-7261692258 [1,1,0,0,0,0|1,0,0]=3 2089 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-7763091319 [1,1,0,0,0,0|1,0,0]=3 2090 B8R0.18 CN[C@H](C(=O)O)[C@@H](C)O MCULE-8429501411 [1,1,0,0,0,0|1,0,0]=3 2091 B8R0.18 COC(C(=O)O)C(C)Br MCULE-9261088290 [1,1,0,0,0,0|2,0,0]=4 2092 B8R0.18 COC(C(=O)O)C(C)C MCULE-4922461673 [1,1,0,0,0,0|1,0,0]=3 2093 B8R0.18 COC(C(=O)O)C(C)C MCULE-6661618070 [1,1,0,0,0,0|1,0,0]=3 2094 B8R0.18 COC(C(=O)O)C(C)N MCULE-5882264486 [1,1,0,0,0,0|2,0,0]=4 2095 B8R0.18 CO[C@@H](C(=O)O)C(C)C MCULE-1619707717 [1,1,0,0,0,0|1,0,0]=3 2096 B8R0.18 CO[C@H](C(=O)O)C(C)C MCULE-2291773409 [1,1,0,0,0,0|1,0,0]=3 2097 B8R0.18 CSC(C(=O)O)C(C)C MCULE-9613087260 [1,1,0,0,0,0|1,0,0]=3 2098 B8R0.27 C(N)(C(=O)O)C(C)(C)S MCULE-1893345960 [1,1,0,0,0,0|0,0,0]=2 2099 B8R0.27 C=C(C(=O)O)C(C)(C)C MCULE-7253303469 [1,1,0,0,0,0|1,0,1]=4 2100 B8R0.27 CC(=O)[C@@H](N)C(C)(C)C MCULE-9412848571 [1,1,0,0,0,0|1,0,0]=3 2101 B8R0.27 CC(C(=O)O)C(C)(C)C MCULE-5931607530 [1,1,0,0,0,0|1,0,0]=3 2102 B8R0.27 CC(C(=O)O)C(C)(F)F MCULE-3134887311 [1,1,0,0,0,0|2,0,0]=4 2103 B8R0.27 CC(C)(Br)C(Br)C(=O)O MCULE-2600237498 [1,1,0,0,0,0|1,0,0]=3 2104 B8R0.27 CC(C)(C)C(=O)C(=O)O MCULE-2891266778 [1,1,0,0,0,0|1,0,1]=4 2105 B8R0.27 CC(C)(C)C(Br)C(=O)O MCULE-3140400663 [1,1,0,0,0,0|1,0,0]=3 2106 B8R0.27 CC(C)(C)C(N)C(=O)N MCULE-3894112806 [1,1,0,0,0,0|1,0,0]=3 2107 B8R0.27 CC(C)(C)C(N)C(=O)N MCULE-7020753722 [1,1,0,0,0,0|1,0,0]=3 2108 B8R0.27 CC(C)(C)C(N)C(=O)N MCULE-7146166501 [1,1,0,0,0,0|1,0,0]=3 2109 B8R0.27 CC(C)(C)C(N)C(=O)N MCULE-7871694729 [1,1,0,0,0,0|1,0,0]=3 2110 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-4378220677 [1,1,0,0,0,0|0,0,0]=2 2111 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-7142182400 [1,1,0,0,0,0|0,0,0]=2 2112 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-9877941557 [1,1,0,0,0,0|0,0,0]=2 2113 B8R0.27 CC(C)(C)C(O)C(=O)O MCULE-2831225594 [1,1,0,0,0,0|1,0,0]=3 2114 B8R0.27 CC(C)(C)C(O)C(=O)O MCULE-6241480954 [1,1,0,0,0,0|1,0,0]=3 2115 B8R0.27 CC(C)(C)[C@@H](N)C(=O)N MCULE-9445074583 [1,1,0,0,0,0|1,0,0]=3 2116 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-1280092872 [1,1,0,0,0,0|0,0,0]=2 2117 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-8741274445 [1,1,0,0,0,0|0,0,0]=2 2118 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-9585981018 [1,1,0,0,0,0|0,0,0]=2 2119 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O MCULE-4712331175 [1,1,0,0,0,0|1,0,0]=3 2120 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O MCULE-9440383034 [1,1,0,0,0,0|1,0,0]=3 2121 B8R0.27 CC(C)(C)[C@H](Br)C(=O)O MCULE-3604683063 [1,1,0,0,0,0|1,0,0]=3 2122 B8R0.27 CC(C)(C)[C@H](N)C(=O)N MCULE-2483407443 [1,1,0,0,0,0|1,0,0]=3 2123 B8R0.27 CC(C)(C)[C@H](N)C(=O)N MCULE-4654034585 [1,1,0,0,0,0|1,0,0]=3 2124 B8R0.27 CC(C)(C)[C@H](N)C(=O)N MCULE-9173080997 [1,1,0,0,0,0|1,0,0]=3 2125 B8R0.27 CC(C)(C)[C@H](N)C(=O)N MCULE-9398616649 [1,1,0,0,0,0|1,0,0]=3 2126 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-2361901374 [1,1,0,0,0,0|0,0,0]=2 2127 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-7700637346 [1,1,0,0,0,0|0,0,0]=2 2128 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-8028056550 [1,1,0,0,0,0|0,0,0]=2 2129 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-8791211435 [1,1,0,0,0,0|0,0,0]=2 2130 B8R0.27 CC(C)(C)[C@H](O)C(=O)O MCULE-4165755614 [1,1,0,0,0,0|1,0,0]=3 2131 B8R0.27 CC(C)(C)[C@H](O)C(=O)O MCULE-6845662197 [1,1,0,0,0,0|1,0,0]=3 2132 B8R0.27 CC(C)(F)C(Br)C(=O)O MCULE-8601470705 [1,1,0,0,0,0|1,0,0]=3 2133 B8R0.27 CC(C)(F)C(N)C(=O)O MCULE-3479476353 [1,1,0,0,0,0|0,0,0]=2 2134 B8R0.27 CC(C)(F)[C@H](N)C(=O)O MCULE-4975554837 [1,1,0,0,0,0|0,0,0]=2 2135 B8R0.27 CC(C)(F)[C@H](N)C(=O)O MCULE-6202392495 [1,1,0,0,0,0|0,0,0]=2 2136 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-4257891769 [1,1,0,0,0,0|0,0,0]=2 2137 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-4291820573 [1,1,0,0,0,0|0,0,0]=2 2138 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-8731964950 [1,1,0,0,0,0|0,0,0]=2 2139 B8R0.27 CC(C)(O)C(O)C(=O)O MCULE-2030710507 [1,1,0,0,0,0|1,0,0]=3 2140 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O MCULE-2953137860 [1,1,0,0,0,0|0,0,0]=2 2141 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O MCULE-3424625974 [1,1,0,0,0,0|0,0,0]=2 2142 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-3721152032 [1,1,0,0,0,0|0,0,0]=2 2143 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-7599346102 [1,1,0,0,0,0|0,0,0]=2 2144 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-9499245205 [1,1,0,0,0,0|0,0,0]=2 2145 B8R0.27 CC(C)(S)C(N)C(=O)O MCULE-4184299411 [1,1,0,0,0,0|0,0,0]=2 2146 B8R0.27 CC(C)(S)C(N)C(=O)O MCULE-8542176080 [1,1,0,0,0,0|0,0,0]=2 2147 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O MCULE-5986342172 [1,1,0,0,0,0|0,0,0]=2 2148 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O MCULE-9856748563 [1,1,0,0,0,0|0,0,0]=2 2149 B8R0.27 CC(C)(S)[C@H](N)C(=O)O MCULE-3098543641 [1,1,0,0,0,0|0,0,0]=2 2150 B8R0.27 CC(C)(S)[C@H](N)C(=O)O MCULE-9539588985 [1,1,0,0,0,0|0,0,0]=2 2151 B8R0.27 CC(C)C(N)S(=O)(=O)O MCULE-1741232006 [1,1,0,0,0,0|1,0,0]=3 2152 B8R0.27 CC(C)C(O)S(=O)(=O)O MCULE-5782226558 [1,1,0,0,0,0|2,0,0]=4 2153 B8R0.27 CC(C)[C@H](N)C(C)(C)O MCULE-2380720216 [1,1,0,0,0,0|1,0,1]=4 2154 B8R0.27 CC(F)(F)C(N)C(=O)O MCULE-1789483909 [1,1,0,0,0,0|1,0,0]=3 2155 B8R0.27 CC(F)(F)C(N)C(=O)O MCULE-3186979989 [1,1,0,0,0,0|1,0,0]=3 2156 B8R0.27 CP(=O)(C)C(O)C(=O)O MCULE-6921301874 [1,1,0,0,0,0|2,0,0]=4 2157 B8R0.27 C[C@@H](O)[C@@H](N)C(C)(C)C MCULE-3406515694 [1,1,0,0,0,0|1,0,1]=4 2158 B8R0.27 NC(C(=O)O)C(F)(F)F MCULE-3733724676 [1,1,0,0,0,0|2,0,0]=4 2159 B8R0.27 NC(C(=O)O)C(F)(F)F MCULE-4711987697 [1,1,0,0,0,0|2,0,0]=4 2160 B8R0.27 N[C@@H](C(=O)O)C(F)(F)F MCULE-8591691301 [1,1,0,0,0,0|2,0,0]=4 2161 B8R0.27 N[C@H](C(=O)O)C(F)(F)F MCULE-3358276371 [1,1,0,0,0,0|2,0,0]=4 2162 B8R0.27 N[C@H](C(=O)O)C(F)(F)F MCULE-4061030354 [1,1,0,0,0,0|2,0,0]=4 2163 B8R0.27 N[C@H](C(=O)O)C(F)(F)F MCULE-4421291156 [1,1,0,0,0,0|2,0,0]=4 2164 B8R0.27 N[C@H](C(=O)O)C(F)(F)F MCULE-8051017113 [1,1,0,0,0,0|2,0,0]=4 2165 B8R0.27 [C@@H](N)(C(=O)O)C(C)(C)O MCULE-5116872005 [1,1,0,0,0,0|0,0,0]=2 2166 B8R0.27 [C@H](N)(C(=O)O)C(C)(C)S MCULE-5559697921 [1,1,0,0,0,0|0,0,0]=2 2167 B8R0.37 CC(Br)C(C)(Br)C(=O)O MCULE-4288495047 [1,1,0,0,0,0|2,0,0]=4 2168 B8R0.37 CC(C)C(C)(C)C(=O)O MCULE-8335448418 [1,1,0,0,0,0|1,0,0]=3 2169 B8R0.37 CC(C)C(C)(N)C(=O)N MCULE-6386036357 [1,1,0,0,0,0|1,0,0]=3 2170 B8R0.37 CC(C)C(C)(N)C(=O)O MCULE-2018617657 [1,1,0,0,0,0|0,0,0]=2 2171 B8R0.37 CC(C)C(C)(N)C(=O)O MCULE-8116018936 [1,1,0,0,0,0|0,0,0]=2 2172 B8R0.37 CC(C)C(C)(O)C(=O)O MCULE-3909217790 [1,1,0,0,0,0|1,0,0]=3 2173 B8R0.37 CC(C)C(F)(F)C(=O)O MCULE-2732318443 [1,1,0,0,0,0|1,0,0]=3 2174 B8R0.37 CC(C)[C@@](C)(N)C(=O)O MCULE-1672449529 [1,1,0,0,0,0|0,0,0]=2 2175 B8R0.37 CC(C)[C@@](C)(N)C(=O)O MCULE-5333264309 [1,1,0,0,0,0|0,0,0]=2 2176 B8R0.37 CC(C)[C@](C)(N)C(=O)O MCULE-3942243398 [1,1,0,0,0,0|0,0,0]=2 2177 B8R0.37 CC(C)[C@](C)(N)C(=O)O MCULE-5291448404 [1,1,0,0,0,0|0,0,0]=2 2178 B8R0.37 CC(N)C(C)(C)C(=O)O MCULE-4369218088 [1,1,0,0,0,0|2,0,0]=4 2179 B8R0.37 CC(N)C(C)(C)C(=O)O MCULE-9651473536 [1,1,0,0,0,0|2,0,0]=4 2180 B8R0.37 CC(O)C(C)(N)C(=O)O MCULE-9781647782 [1,1,0,0,0,0|1,0,0]=3 2181 B8R0.37 CC(O)C(C)(O)C(=O)O MCULE-5546110054 [1,1,0,0,0,0|2,0,0]=4 2182 B8R0.37 CC(O)C(F)(F)C(=O)O MCULE-8714570962 [1,1,0,0,0,0|2,0,0]=4 2183 B8R0.37 CN(C)C(C)(C)C(=O)O MCULE-8408889105 [1,1,0,0,0,0|2,0,0]=4 2184 B8R0.37 CN(C)C(C)(C)C(=O)O MCULE-9860731659 [1,1,0,0,0,0|2,0,0]=4 2185 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O MCULE-4212497890 [1,1,0,0,0,0|1,0,0]=3 2186 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O MCULE-7382680634 [1,1,0,0,0,0|1,0,0]=3 2187 B8R0.37 C[C@H](O)[C@@](C)(N)C(=O)O MCULE-5661079280 [1,1,0,0,0,0|1,0,0]=3 2188 B10R0.13 CC(=O)C(C)C(C)CC(=O)O MCULE-2467523561 [0,1,0,0,0,1|1,0,1]=4 2189 B10R0.32 CCCC(C)C(N)CC(=O)O MCULE-9134317193 [0,1,0,0,0,1|0,0,0]=2 2190 B10R0.32 CCOC(=O)[C@@H](N)CC(=O)O MCULE-8240292825 [0,1,0,0,0,1|1,0,1]=4 2191 B10R0.144 CCC(CC)C(N)CC(=O)O MCULE-2563066834 [0,1,0,0,0,1|0,0,0]=2 2192 B10R0.144 CCN(CC)C(C)CC(=O)O MCULE-8525999396 [0,1,0,0,0,1|2,0,0]=4 2193 B10R0.144 COC(OC)C(N)CC(=O)O MCULE-3271762028 [0,1,0,0,0,1|1,0,0]=3 2194 B10R0.26 CCCC(C)CC(N)C(=O)O MCULE-8848436054 [0,1,0,0,0,1|0,0,0]=2 2195 B10R0.26 CCCS(=O)CC(N)C(=O)O MCULE-8745806923 [0,1,0,0,0,1|2,0,0]=4 2196 B10R0.26 CCCS(=O)C[C@H](N)C(=O)O MCULE-6968745632 [0,1,0,0,0,1|2,0,0]=4 2197 B10R0.26 CCOC(=O)CC(N)C(=O)O MCULE-1325477968 [0,1,0,0,0,1|1,0,1]=4 2198 B10R0.47 CCN(C)CC(C)(C)C(=O)O MCULE-4261379786 [0,1,0,0,0,1|2,0,0]=4 2199 B10R0.47 CCN(C)CC(C)(C)C(=O)O MCULE-7230628954 [0,1,0,0,0,1|2,0,0]=4 2200 B10R0.67 CCC(C)(C)NC(=O)C(=O)O MCULE-5676334997 [0,1,0,0,0,1|1,0,1]=4 2201 B10R0.67 COC(C)(C)CC(N)C(=O)O MCULE-1291000987 [0,1,0,0,0,1|1,0,0]=3 2202 B10R0.67 COC(C)(C)CC(O)C(=O)O MCULE-5362367135 [0,1,0,0,0,1|2,0,0]=4 2203 B10R0.72 CCC(CC)CC(C)C(=O)O MCULE-7999332262 [0,1,0,0,0,1|1,0,0]=3 2204 B10R0.72 CCC(CC)NC(=O)C(=O)O MCULE-8448792347 [0,1,0,0,0,1|1,0,1]=4 2205 B10R0.72 CCN(CC)CC(C)C(=O)O MCULE-4165010028 [0,1,0,0,0,1|2,0,0]=4 2206 B10R0.72 CCN(CC)CC(N)C(=O)N MCULE-5054958387 [0,1,0,0,0,1|2,0,0]=4 2207 B10R0.93 CC(CC(N)C(=O)O)C(=O)O MCULE-4117547649 [0,1,0,0,0,1|1,0,1]=4 2208 B10R0.93 CC(CN(C)C(C)C)C(=O)O MCULE-5853455073 [0,1,0,0,0,1|2,0,0]=4 2209 B10R0.93 CC(CN(C)C(C)C)C(=O)O MCULE-6179331704 [0,1,0,0,0,1|2,0,0]=4 2210 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O MCULE-2754578678 [0,1,0,0,0,1|1,0,1]=4 2211 B10R0.93 C[C@H](C[C@H](N)C(=O)O)C(=O)O MCULE-7169309772 [0,1,0,0,0,1|1,0,1]=4 2212 B10R0.35 CCNC(=O)C(N)C(C)CC MCULE-5586743866 [0,2,0,0,0,0|1,0,0]=3 2213 B10R0.35 CCOC(=O)C(N)C(C)CC MCULE-5178020021 [0,2,0,0,0,0|0,0,0]=2 2214 B10R0.35 CCOC(=O)C(N)C(C)CC MCULE-7362580174 [0,2,0,0,0,0|0,0,0]=2 2215 B10R0.35 CCOC(=O)[C@@H](N)[C@@H](C)CC MCULE-1994822721 [0,2,0,0,0,0|0,0,0]=2 2216 B10R0.35 CCOC(=O)[C@@H](N)[C@@H](C)CC MCULE-7243123410 [0,2,0,0,0,0|0,0,0]=2 2217 B10R0.35 CCOC(=O)[C@@H](N)[C@@H](C)CC MCULE-7344945722 [0,2,0,0,0,0|0,0,0]=2 2218 B10R0.35 CCOC(=O)[C@@H](N)[C@@H](C)CC MCULE-9527149766 [0,2,0,0,0,0|0,0,0]=2 2219 B10R0.35 CCOC(=O)[C@H](N)[C@@H](C)CC MCULE-2879934278 [0,2,0,0,0,0|0,0,0]=2 2220 B10R0.35 CCOC(=O)[C@H](N)[C@@H](C)CC MCULE-4370248546 [0,2,0,0,0,0|0,0,0]=2 2221 B10R0.35 CCOC(=O)[C@H](N)[C@@H](C)CC MCULE-5462791379 [0,2,0,0,0,0|0,0,0]=2 2222 B10R0.35 CCOC(=O)[C@H](N)[C@@H](C)CC MCULE-7887489997 [0,2,0,0,0,0|0,0,0]=2 2223 B10R0.81 C=CCOC(C)C(N)C(=O)O MCULE-3631812514 [0,2,0,0,0,0|0,0,1]=3 2224 B10R0.81 C=CCOC(C)C(N)C(=O)O MCULE-3885008525 [0,2,0,0,0,0|0,0,1]=3 2225 B10R0.81 C=CCO[C@H](C)[C@H](N)C(=O)O MCULE-2462180654 [0,2,0,0,0,0|0,0,1]=3 2226 B10R0.81 C=CCO[C@H](C)[C@H](N)C(=O)O MCULE-5064570394 [0,2,0,0,0,0|0,0,1]=3 2227 B10R0.81 C=CCO[C@H](C)[C@H](N)C(=O)O MCULE-6538716292 [0,2,0,0,0,0|0,0,1]=3 2228 B10R0.81 C=CCO[C@H](C)[C@H](N)C(=O)O MCULE-9236706170 [0,2,0,0,0,0|0,0,1]=3 2229 B10R0.81 CCCCC(N)C(O)C(=O)O MCULE-9772584692 [0,2,0,0,0,0|2,0,0]=4 2230 B10R0.81 CCCC[C@@H](N)[C@H](O)C(=O)O MCULE-8826953669 [0,2,0,0,0,0|2,0,0]=4 2231 B10R0.81 CCCC[C@H](N)[C@H](O)C(=O)O MCULE-6737057860 [0,2,0,0,0,0|2,0,0]=4 2232 B10R0.81 COCCC(C)C(N)C(=O)O MCULE-6609752945 [0,2,0,0,0,0|0,0,0]=2 2233 B10R0.39 C=CC(C)(C)C(N)C(=O)OC MCULE-1614518057 [0,2,0,0,0,0|0,0,2]=4 2234 B10R0.39 COC(=O)C(Br)C(C)(C)OC MCULE-9700418906 [0,2,0,0,0,0|2,0,0]=4 2235 B10R0.154 CC(C(=O)O)C(C)C(C)(C)C MCULE-2102421943 [0,2,0,0,0,0|1,0,0]=3 2236 B10R0.154 CC(C(=O)O)C(C)S(=O)(=O)C MCULE-2563221262 [0,2,0,0,0,0|2,0,0]=4 2237 B10R0.154 CC(C(F)C(=O)O)C(F)(F)F MCULE-2610697298 [0,2,0,0,0,0|2,0,0]=4 2238 B10R0.154 CC(C(N)C(=O)O)C(F)(F)F MCULE-2722370440 [0,2,0,0,0,0|1,0,0]=3 2239 B10R0.154 CC(C)(C)C(O)C(N)C(=O)O MCULE-9655540951 [0,2,0,0,0,0|1,0,0]=3 2240 B10R0.154 CC(C)(C)[C@@H](O)[C@H](N)C(=O)O MCULE-3285070258 [0,2,0,0,0,0|1,0,0]=3 2241 B10R0.154 CC(C)(C)[C@H](O)[C@@H](N)C(=O)O MCULE-1720433604 [0,2,0,0,0,0|1,0,0]=3 2242 B10R0.154 CC(C)(C)[C@H](O)[C@@H](N)C(=O)O MCULE-5518166439 [0,2,0,0,0,0|1,0,0]=3 2243 B10R0.38 CCC(CC)C(N)C(=O)OC MCULE-8884744531 [0,2,0,0,0,0|0,0,0]=2 2244 B10R0.38 COC(=O)C(Br)C(OC)OC MCULE-2981559763 [0,2,0,0,0,0|2,0,0]=4 2245 B10R0.38 COC(=O)C(C)C(OC)OC MCULE-4451149507 [0,2,0,0,0,0|2,0,0]=4 2246 B10R0.51 CCC(C)C(NC)C(=O)OC MCULE-1335818075 [0,2,0,0,0,0|0,0,0]=2 2247 B10R0.51 CCC(C)C(NC)C(=O)OC MCULE-8651667707 [0,2,0,0,0,0|0,0,0]=2 2248 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-1696715513 [0,2,0,0,0,0|0,0,0]=2 2249 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-3420861648 [0,2,0,0,0,0|0,0,0]=2 2250 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-3994275289 [0,2,0,0,0,0|0,0,0]=2 2251 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-4977295519 [0,2,0,0,0,0|0,0,0]=2 2252 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-6644502635 [0,2,0,0,0,0|0,0,0]=2 2253 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-9316815477 [0,2,0,0,0,0|0,0,0]=2 2254 B10R0.66 CCC(F)(F)C(C)(C)C(=O)O MCULE-1342421125 [0,2,0,0,0,0|2,0,0]=4 2255 B10R0.117 CC(C)(C(N)C(=O)O)N(=O)=O MCULE-9002564501 [0,2,0,0,0,0|2,0,0]=4 2256 B10R0.117 CC(C)([C@H](N)C(=O)O)[N+](=O)[O-] MCULE-3869741264 [0,2,0,0,0,0|2,0,0]=4 2257 B10R0.117 CC(C)C(N)C(C)(C)C(=O)O MCULE-5032697130 [0,2,0,0,0,0|2,0,0]=4 2258 B10R0.117 CC(C)C(N)C(C)(C)C(=O)O MCULE-7477381212 [0,2,0,0,0,0|2,0,0]=4 2259 B10R0.117 CC(C)C(O)C(C)(C)C(=O)O MCULE-5981343574 [0,2,0,0,0,0|2,0,0]=4 2260 B10R0.146 CCC(CC)C(F)(F)C(=O)O MCULE-9230607654 [0,2,0,0,0,0|1,0,0]=3 2261 B10R0.30 CC[C@H](C)[C@H](N=[N+]=[N-])C(=O)O MCULE-8569248155 [0,2,0,0,0,0|0,0,1]=3 2262 B10R0.30 CC[C@H](C)[C@H](N=[N+]=[N-])C(=O)O MCULE-9621159559 [0,2,0,0,0,0|0,0,1]=3 2263 B10R0.94 CCC(C(=O)O)N(CC)CC MCULE-1409960648 [0,2,0,0,0,0|2,0,0]=4 2264 B10R0.94 CCC(C(=O)O)N(CC)CC MCULE-2268188943 [0,2,0,0,0,0|2,0,0]=4 2265 B10R0.118 CCC(C)C(C(=O)N)N(C)C MCULE-5054633727 [0,2,0,0,0,0|1,0,0]=3 2266 B10R0.118 CCC(C)C(C(=O)O)N(C)C MCULE-9389725198 [0,2,0,0,0,0|0,0,0]=2 2267 B8R1.1 C1(CNC(=O)C1)CN MCULE-6663370335 [1,0,0,1,0,0|2,0,0]=4 2268 B8R1.1 C1(CNC(=O)C1)CN MCULE-8237162259 [1,0,0,1,0,0|2,0,0]=4 2269 B8R1.1 C=CC1COC(=O)C1 MCULE-5888906344 [1,0,0,1,0,0|0,0,2]=4 2270 B8R1.1 C=CC1COC(=O)C1 MCULE-8602073759 [1,0,0,1,0,0|0,0,2]=4 2271 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-1274088394 [1,0,0,1,0,0|0,0,2]=4 2272 B8R1.1 C=C[C@@H]1COC(=O)C1 MCULE-3162707973 [1,0,0,1,0,0|0,0,2]=4 2273 B8R1.1 CCC1CC(=O)CO1 MCULE-7105024194 [1,0,0,1,0,0|2,0,0]=4 2274 B8R1.1 CCC1CCC(=O)C1 MCULE-8455504217 [1,0,0,1,0,0|1,0,0]=3 2275 B8R1.1 CCC1CCC(=O)N1 MCULE-6150249637 [1,0,0,1,0,0|2,0,0]=4 2276 B8R1.1 CCC1CCC(=O)O1 MCULE-5161861312 [1,0,0,1,0,0|2,0,0]=4 2277 B8R1.1 CCC1CNC(=O)C1 MCULE-1800672545 [1,0,0,1,0,0|1,0,0]=3 2278 B8R1.1 CCC1CNC(=O)O1 MCULE-9388725409 [1,0,0,1,0,0|2,0,0]=4 2279 B8R1.1 CCC1COC(=N1)C MCULE-1406641220 [1,0,0,1,0,0|2,0,0]=4 2280 B8R1.1 CCC1COC(=O)C1 MCULE-1996435734 [1,0,0,1,0,0|0,0,0]=2 2281 B8R1.1 CCC1COC(=O)N1 MCULE-4345668230 [1,0,0,1,0,0|1,0,0]=3 2282 B8R1.1 CCC1COC(=O)O1 MCULE-5743084846 [1,0,0,1,0,0|1,0,0]=3 2283 B8R1.1 CCN1CCC(=O)C1 MCULE-5806094458 [1,0,0,1,0,0|2,0,0]=4 2284 B8R1.1 CC[C@@H]1CCC(=O)C1 MCULE-7687801028 [1,0,0,1,0,0|1,0,0]=3 2285 B8R1.1 CC[C@@H]1CCC(=O)O1 MCULE-9831904901 [1,0,0,1,0,0|2,0,0]=4 2286 B8R1.1 CC[C@H]1CCC(=O)C1 MCULE-6479003670 [1,0,0,1,0,0|1,0,0]=3 2287 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-2443615902 [1,0,0,1,0,0|1,0,0]=3 2288 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-9191549724 [1,0,0,1,0,0|1,0,0]=3 2289 B8R1.1 CNC1CNC(=O)C1 MCULE-1673491824 [1,0,0,1,0,0|2,0,0]=4 2290 B8R1.1 CN[C@H]1CNC(=O)C1 MCULE-7859463391 [1,0,0,1,0,0|2,0,0]=4 2291 B8R1.1 COC1CCC(=O)C1 MCULE-3259977239 [1,0,0,1,0,0|2,0,0]=4 2292 B8R1.1 COC1CNC(=O)C1 MCULE-2023546447 [1,0,0,1,0,0|2,0,0]=4 2293 B8R1.1 NCC1CNC(=O)C1 MCULE-2522987651 [1,0,0,1,0,0|2,0,0]=4 2294 B8R1.1 NCC1CNC(=O)C1 MCULE-7249550892 [1,0,0,1,0,0|2,0,0]=4 2295 B8R1.1 NCC1CNC(=O)C1 MCULE-7253893960 [1,0,0,1,0,0|2,0,0]=4 2296 B8R1.1 NCC1COC(=O)N1 MCULE-8454292565 [1,0,0,1,0,0|2,0,0]=4 2297 B8R1.1 NCC1COC(=O)N1 MCULE-9068275563 [1,0,0,1,0,0|2,0,0]=4 2298 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-1184474214 [1,0,0,1,0,0|2,0,0]=4 2299 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-2421452869 [1,0,0,1,0,0|2,0,0]=4 2300 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-3903743084 [1,0,0,1,0,0|2,0,0]=4 2301 B8R1.1 NC[C@@H]1CNC(=O)C1 MCULE-9080425518 [1,0,0,1,0,0|2,0,0]=4 2302 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-7212975165 [1,0,0,1,0,0|2,0,0]=4 2303 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8203034485 [1,0,0,1,0,0|2,0,0]=4 2304 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-8803246698 [1,0,0,1,0,0|2,0,0]=4 2305 B8R1.1 NC[C@H]1CNC(=O)C1 MCULE-9580224880 [1,0,0,1,0,0|2,0,0]=4 2306 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-1988909942 [1,0,0,1,0,0|2,0,0]=4 2307 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-9340310155 [1,0,0,1,0,0|2,0,0]=4 2308 B8R1.1 O=C1CC(CN1)CBr MCULE-1780879209 [1,0,0,1,0,0|2,0,0]=4 2309 B8R1.1 O=C1CC(CN1)CO MCULE-8619053563 [1,0,0,1,0,0|2,0,0]=4 2310 B8R1.1 O=C1CC(CO1)CO MCULE-7403068263 [1,0,0,1,0,0|1,0,0]=3 2311 B8R1.1 O=C1CCC(C1)CF MCULE-9077358027 [1,0,0,1,0,0|2,0,0]=4 2312 B8R1.1 O=C1CCC(C1)CO MCULE-7524267942 [1,0,0,1,0,0|2,0,0]=4 2313 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-2590805877 [1,0,0,1,0,0|2,0,0]=4 2314 B8R1.1 O=C1CC[C@@H](C1)CO MCULE-7134607780 [1,0,0,1,0,0|2,0,0]=4 2315 B8R1.1 O=C1C[C@@H](CN1)CO MCULE-5572559100 [1,0,0,1,0,0|2,0,0]=4 2316 B8R1.1 O=C1C[C@H](CN1)CO MCULE-4450345453 [1,0,0,1,0,0|2,0,0]=4 2317 B8R1.1 O=C1NC(CO1)CI MCULE-3725463438 [1,0,0,1,0,0|2,0,0]=4 2318 B8R1.1 O=C1NC(CO1)CI MCULE-8271591026 [1,0,0,1,0,0|2,0,0]=4 2319 B8R1.1 O=C1NC(CO1)CO MCULE-8296379772 [1,0,0,1,0,0|2,0,0]=4 2320 B8R1.1 O=C1NC(CO1)CO MCULE-9797812862 [1,0,0,1,0,0|2,0,0]=4 2321 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-2270288938 [1,0,0,1,0,0|2,0,0]=4 2322 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-5533745846 [1,0,0,1,0,0|2,0,0]=4 2323 B8R1.1 O=C1N[C@H](CO1)CI MCULE-5817468950 [1,0,0,1,0,0|2,0,0]=4 2324 B8R1.1 O=C1N[C@H](CO1)CI MCULE-6940377154 [1,0,0,1,0,0|2,0,0]=4 2325 B8R1.1 O=C1N[C@H](CO1)CO MCULE-3186572246 [1,0,0,1,0,0|2,0,0]=4 2326 B8R1.1 O=C1N[C@H](CO1)CO MCULE-4534112642 [1,0,0,1,0,0|2,0,0]=4 2327 B8R1.1 O=C1OCC(O1)CCl MCULE-7212643481 [1,0,0,1,0,0|2,0,0]=4 2328 B8R1.1 O=C1OCC(O1)CF MCULE-2066386250 [1,0,0,1,0,0|2,0,0]=4 2329 B8R1.1 O=C1OCC(O1)CO MCULE-1831262013 [1,0,0,1,0,0|2,0,0]=4 2330 B8R1.1 O=CC1COC(=O)C1 MCULE-7312168752 [1,0,0,1,0,0|1,0,1]=4 2331 B8R1.1 [C@@H]1(COC(=O)C1)C=C MCULE-1356778810 [1,0,0,1,0,0|0,0,2]=4 2332 B8R1.4 C1(CC(=O)CCN1)C MCULE-1061296374 [1,0,0,1,0,0|2,0,0]=4 2333 B8R1.4 C1(CC(=O)CCN1)C MCULE-4465075512 [1,0,0,1,0,0|2,0,0]=4 2334 B8R1.4 C1(CC(=O)CCN1)C MCULE-9958407361 [1,0,0,1,0,0|2,0,0]=4 2335 B8R1.4 CC1=CC(=O)OCC1 MCULE-1467184061 [1,0,0,1,0,0|0,0,2]=4 2336 B8R1.4 CC1CC(=O)CCN1 MCULE-3306158037 [1,0,0,1,0,0|2,0,0]=4 2337 B8R1.4 CC1CC(=O)CCN1 MCULE-4556824309 [1,0,0,1,0,0|2,0,0]=4 2338 B8R1.4 CC1CC(=O)CCN1 MCULE-6103506996 [1,0,0,1,0,0|2,0,0]=4 2339 B8R1.4 CC1CC(=O)CCN1 MCULE-9670943852 [1,0,0,1,0,0|2,0,0]=4 2340 B8R1.4 CC1CC(=O)CCO1 MCULE-3051168755 [1,0,0,1,0,0|2,0,0]=4 2341 B8R1.4 CC1CCCC(=O)C1 MCULE-6473963111 [1,0,0,1,0,0|1,0,0]=3 2342 B8R1.4 CC1CCCC(=O)C1 MCULE-9918051823 [1,0,0,1,0,0|1,0,0]=3 2343 B8R1.4 CC1CCCC(=O)N1 MCULE-3851963076 [1,0,0,1,0,0|2,0,0]=4 2344 B8R1.4 CC1CCCC(=O)O1 MCULE-4000069856 [1,0,0,1,0,0|2,0,0]=4 2345 B8R1.4 CC1CCCC(C1)O MCULE-5839979596 [1,0,0,1,0,0|1,0,1]=4 2346 B8R1.4 CC1CCC[C@H](C1)O MCULE-8817611474 [1,0,0,1,0,0|1,0,1]=4 2347 B8R1.4 CC1CCNC(=N)C1 MCULE-2615774284 [1,0,0,1,0,0|2,0,0]=4 2348 B8R1.4 CC1CCNC(=N)C1 MCULE-9034088725 [1,0,0,1,0,0|2,0,0]=4 2349 B8R1.4 CC1CCNC(=O)C1 MCULE-8903018599 [1,0,0,1,0,0|1,0,0]=3 2350 B8R1.4 CC1CCNC(=O)N1 MCULE-6491047836 [1,0,0,1,0,0|2,0,0]=4 2351 B8R1.4 CC1CCOC(=O)C1 MCULE-2682865017 [1,0,0,1,0,0|0,0,0]=2 2352 B8R1.4 CC1CCOC(=O)O1 MCULE-5929311811 [1,0,0,1,0,0|1,0,0]=3 2353 B8R1.4 CC1CCOS(=O)O1 MCULE-8688981983 [1,0,0,1,0,0|2,0,0]=4 2354 B8R1.4 CN1CCCC(=O)C1 MCULE-1067967474 [1,0,0,1,0,0|2,0,0]=4 2355 B8R1.4 CN1CCCC(=O)C1 MCULE-4816876030 [1,0,0,1,0,0|2,0,0]=4 2356 B8R1.4 CN1CCNC(=O)C1 MCULE-5564854834 [1,0,0,1,0,0|2,0,0]=4 2357 B8R1.4 CN1CCOC(=O)C1 MCULE-2224720964 [1,0,0,1,0,0|1,0,0]=3 2358 B8R1.4 CN1CCOC(=O)C1 MCULE-9163078129 [1,0,0,1,0,0|1,0,0]=3 2359 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7688577280 [1,0,0,1,0,0|2,0,0]=4 2360 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-7762440526 [1,0,0,1,0,0|2,0,0]=4 2361 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-8158589956 [1,0,0,1,0,0|2,0,0]=4 2362 B8R1.4 C[C@@H]1CC(=O)CCN1 MCULE-9544551566 [1,0,0,1,0,0|2,0,0]=4 2363 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-4878813100 [1,0,0,1,0,0|2,0,0]=4 2364 B8R1.4 C[C@@H]1CC(=O)CCO1 MCULE-7917159022 [1,0,0,1,0,0|2,0,0]=4 2365 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-1868776628 [1,0,0,1,0,0|1,0,0]=3 2366 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-6973928430 [1,0,0,1,0,0|1,0,0]=3 2367 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-2050655386 [1,0,0,1,0,0|2,0,0]=4 2368 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-7049359933 [1,0,0,1,0,0|2,0,0]=4 2369 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-6306078053 [1,0,0,1,0,0|2,0,0]=4 2370 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-7616070208 [1,0,0,1,0,0|2,0,0]=4 2371 B8R1.4 C[C@@H]1CCC[C@@H](C1)O MCULE-9818117668 [1,0,0,1,0,0|1,0,1]=4 2372 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-1599463757 [1,0,0,1,0,0|2,0,0]=4 2373 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-4580048332 [1,0,0,1,0,0|2,0,0]=4 2374 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5356496154 [1,0,0,1,0,0|2,0,0]=4 2375 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-5733481696 [1,0,0,1,0,0|2,0,0]=4 2376 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-6641640616 [1,0,0,1,0,0|2,0,0]=4 2377 B8R1.4 C[C@H]1CC(=O)CCN1 MCULE-8001129555 [1,0,0,1,0,0|2,0,0]=4 2378 B8R1.4 C[C@H]1CC(=O)CCO1 MCULE-7799394182 [1,0,0,1,0,0|2,0,0]=4 2379 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-4643975445 [1,0,0,1,0,0|1,0,0]=3 2380 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-6122391840 [1,0,0,1,0,0|1,0,0]=3 2381 B8R1.4 C[C@H]1CCC[C@H](C1)O MCULE-9355825371 [1,0,0,1,0,0|1,0,1]=4 2382 B8R1.4 C[C@H]1CCNC(=O)C1 MCULE-7120988665 [1,0,0,1,0,0|1,0,0]=3 2383 B8R1.4 NC1CCCC(=O)C1 MCULE-3659606498 [1,0,0,1,0,0|2,0,0]=4 2384 B8R1.4 NC1CCCC(=O)C1 MCULE-8815445353 [1,0,0,1,0,0|2,0,0]=4 2385 B8R1.4 NC1CCNC(=O)C1 MCULE-2185303732 [1,0,0,1,0,0|2,0,0]=4 2386 B8R1.4 NC1CCNC(=O)C1 MCULE-4290135082 [1,0,0,1,0,0|2,0,0]=4 2387 B8R1.4 NC1CCNC(=O)C1 MCULE-6525283699 [1,0,0,1,0,0|2,0,0]=4 2388 B8R1.4 NC1CCNC(=O)C1 MCULE-8080194775 [1,0,0,1,0,0|2,0,0]=4 2389 B8R1.4 N[C@@H]1CCCC(=O)C1 MCULE-4006583256 [1,0,0,1,0,0|2,0,0]=4 2390 B8R1.4 N[C@@H]1CCNC(=O)C1 MCULE-8276559925 [1,0,0,1,0,0|2,0,0]=4 2391 B8R1.4 N[C@H]1CCCC(=O)C1 MCULE-9786035316 [1,0,0,1,0,0|2,0,0]=4 2392 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-1641151984 [1,0,0,1,0,0|2,0,0]=4 2393 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-2042394403 [1,0,0,1,0,0|2,0,0]=4 2394 B8R1.4 N[C@H]1CCNC(=O)C1 MCULE-6400271298 [1,0,0,1,0,0|2,0,0]=4 2395 B8R1.4 O=C1CC(CCN1)F MCULE-3828280868 [1,0,0,1,0,0|2,0,0]=4 2396 B8R1.4 O=C1CC(CCN1)F MCULE-8150833328 [1,0,0,1,0,0|2,0,0]=4 2397 B8R1.4 O=C1CC(CCN1)O MCULE-5400068518 [1,0,0,1,0,0|2,0,0]=4 2398 B8R1.4 O=C1CC(CCN1)O MCULE-8702086069 [1,0,0,1,0,0|2,0,0]=4 2399 B8R1.4 O=C1CCCC(C1)O MCULE-3100717907 [1,0,0,1,0,0|2,0,0]=4 2400 B8R1.4 O=C1CCC[C@@H](C1)O MCULE-3841179351 [1,0,0,1,0,0|2,0,0]=4 2401 B8R1.4 O=C1CCOC(=O)C1 MCULE-3134133687 [1,0,0,1,0,0|1,0,1]=4 2402 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-8279613188 [1,0,0,1,0,0|2,0,0]=4 2403 B8R1.4 O=C1C[C@@H](CCN1)O MCULE-9911849866 [1,0,0,1,0,0|2,0,0]=4 2404 B8R1.4 O=C1C[C@H](CCN1)O MCULE-3843806479 [1,0,0,1,0,0|2,0,0]=4 2405 B8R1.4 O=C1C[C@H](CCN1)O MCULE-9127195212 [1,0,0,1,0,0|2,0,0]=4 2406 B8R1.4 [C@@H]1(CCCC(=O)N1)C MCULE-8906937588 [1,0,0,1,0,0|2,0,0]=4 2407 B8R1.18 CC1=CC(=O)CC1C MCULE-9587444246 [1,0,0,1,0,0|1,0,1]=4 2408 B8R1.18 CC1CC(=O)CN1C MCULE-3142275674 [1,0,0,1,0,0|2,0,0]=4 2409 B8R1.18 CC1CC(=O)OC1=O MCULE-6043315810 [1,0,0,1,0,0|1,0,1]=4 2410 B8R1.18 CC1CC(=O)OC1C MCULE-3906254123 [1,0,0,1,0,0|0,0,0]=2 2411 B8R1.18 CC1CC(=O)OC1O MCULE-7140241012 [1,0,0,1,0,0|1,0,0]=3 2412 B8R1.18 CC1NC(=O)CC1O MCULE-6370955032 [1,0,0,1,0,0|2,0,0]=4 2413 B8R1.18 CC1NC(=O)OC1C MCULE-5204749893 [1,0,0,1,0,0|1,0,0]=3 2414 B8R1.18 CC1OC(=O)OC1C MCULE-1302025126 [1,0,0,1,0,0|1,0,0]=3 2415 B8R1.18 CC1OS(=O)OC1C MCULE-8578188591 [1,0,0,1,0,0|2,0,0]=4 2416 B8R1.18 C[C@@H]1NC(=O)C[C@@H]1O MCULE-5647492108 [1,0,0,1,0,0|2,0,0]=4 2417 B8R1.18 C[C@H]1CC(=O)OC1=O MCULE-7764909201 [1,0,0,1,0,0|1,0,1]=4 2418 B8R1.18 C[C@H]1CC(=O)O[C@H]1C MCULE-7756599719 [1,0,0,1,0,0|0,0,0]=2 2419 B8R1.20 CC1CC1CC(=O)O MCULE-3151390667 [1,0,0,1,0,0|0,0,0]=2 2420 B8R1.31 C1(CCN1C)C(=O)O MCULE-3478640390 [1,0,0,1,0,0|1,0,0]=3 2421 B8R1.31 C=C1CCC1C(=O)O MCULE-7307560863 [1,0,0,1,0,0|0,0,2]=4 2422 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C MCULE-1543129128 [1,0,0,1,0,0|1,0,0]=3 2423 B8R1.31 CC1CCC1C(=O)O MCULE-2755332087 [1,0,0,1,0,0|0,0,0]=2 2424 B8R1.31 CC1CNC1C(=O)O MCULE-4084486339 [1,0,0,1,0,0|1,0,0]=3 2425 B8R1.31 CC1NCC1C(=O)O MCULE-3701314568 [1,0,0,1,0,0|1,0,0]=3 2426 B8R1.31 CN1CCC1C(=O)O MCULE-5037838055 [1,0,0,1,0,0|1,0,0]=3 2427 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-3293015609 [1,0,0,1,0,0|1,0,0]=3 2428 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-6726499104 [1,0,0,1,0,0|1,0,0]=3 2429 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-1519401164 [1,0,0,1,0,0|1,0,0]=3 2430 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-2682368839 [1,0,0,1,0,0|1,0,0]=3 2431 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-6870930523 [1,0,0,1,0,0|1,0,0]=3 2432 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-9495962068 [1,0,0,1,0,0|1,0,0]=3 2433 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-4996743185 [1,0,0,1,0,0|1,0,0]=3 2434 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-5548697786 [1,0,0,1,0,0|1,0,0]=3 2435 B8R1.31 NC1CCC1C(=O)O MCULE-1271890671 [1,0,0,1,0,0|1,0,0]=3 2436 B8R1.31 NC1CCC1C(=O)O MCULE-6203451123 [1,0,0,1,0,0|1,0,0]=3 2437 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O MCULE-7309195085 [1,0,0,1,0,0|1,0,0]=3 2438 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-1231832702 [1,0,0,1,0,0|1,0,0]=3 2439 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-4120413857 [1,0,0,1,0,0|1,0,0]=3 2440 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-7581321099 [1,0,0,1,0,0|1,0,0]=3 2441 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-8814127531 [1,0,0,1,0,0|1,0,0]=3 2442 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O MCULE-1877122488 [1,0,0,1,0,0|1,0,0]=3 2443 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-2323153571 [1,0,0,1,0,0|1,0,0]=3 2444 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3627026930 [1,0,0,1,0,0|1,0,0]=3 2445 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3814908416 [1,0,0,1,0,0|1,0,0]=3 2446 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-8552378194 [1,0,0,1,0,0|1,0,0]=3 2447 B8R1.31 O=C(O)C1CCC1F MCULE-6928594613 [1,0,0,1,0,0|1,0,0]=3 2448 B8R1.31 O=C(O)C1CCC1O MCULE-5612797663 [1,0,0,1,0,0|1,0,0]=3 2449 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O MCULE-4502275905 [1,0,0,1,0,0|1,0,0]=3 2450 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O MCULE-1446557503 [1,0,0,1,0,0|1,0,0]=3 2451 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-3693378535 [1,0,0,1,0,0|1,0,0]=3 2452 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-4998471402 [1,0,0,1,0,0|1,0,0]=3 2453 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-1179436878 [1,0,0,1,0,0|1,0,0]=3 2454 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-6666180327 [1,0,0,1,0,0|1,0,0]=3 2455 B8R1.31 [C@@H]1(NC[C@H]1C)C(=O)O MCULE-4107819391 [1,0,0,1,0,0|1,0,0]=3 2456 B8R1.34 CC(=O)CC1CCC1 MCULE-8119711389 [1,0,0,1,0,0|1,0,0]=3 2457 B8R1.34 CC(=O)CC1COC1 MCULE-8127220146 [1,0,0,1,0,0|2,0,0]=4 2458 B8R1.34 N=C(N)CC1CCC1 MCULE-7694021103 [1,0,0,1,0,0|2,0,0]=4 2459 B8R1.34 NC(=O)CC1CNC1 MCULE-3085452095 [1,0,0,1,0,0|2,0,0]=4 2460 B8R1.34 NC(=O)CC1CNC1 MCULE-7868797282 [1,0,0,1,0,0|2,0,0]=4 2461 B8R1.34 NC(=O)NC1CCC1 MCULE-4153424610 [1,0,0,1,0,0|2,0,0]=4 2462 B8R1.34 NC(=S)CC1CCC1 MCULE-7458307170 [1,0,0,1,0,0|1,1,0]=4 2463 B8R1.34 O=C(Cl)CC1CCC1 MCULE-4282346796 [1,0,0,1,0,0|1,0,0]=3 2464 B8R1.34 O=C(O)C=C1CCC1 MCULE-7015909117 [1,0,0,1,0,0|0,0,2]=4 2465 B8R1.34 O=C(O)CC1CCC1 MCULE-3720911045 [1,0,0,1,0,0|0,0,0]=2 2466 B8R1.34 O=C(O)CC1CCN1 MCULE-4161960358 [1,0,0,1,0,0|1,0,0]=3 2467 B8R1.34 O=C(O)CC1CCO1 MCULE-7021545652 [1,0,0,1,0,0|1,0,0]=3 2468 B8R1.34 O=C(O)CC1CNC1 MCULE-4671495498 [1,0,0,1,0,0|1,0,0]=3 2469 B8R1.34 O=C(O)CC1CNC1 MCULE-5456583939 [1,0,0,1,0,0|1,0,0]=3 2470 B8R1.34 O=C(O)CC1CNC1 MCULE-9655427403 [1,0,0,1,0,0|1,0,0]=3 2471 B8R1.34 O=C(O)CC1COC1 MCULE-1090518485 [1,0,0,1,0,0|1,0,0]=3 2472 B8R1.34 O=C(O)CC1CSC1 MCULE-1573505481 [1,0,0,1,0,0|1,0,0]=3 2473 B8R1.34 O=C(O)CN1CCC1 MCULE-2649525817 [1,0,0,1,0,0|1,0,0]=3 2474 B8R1.34 O=C(O)CN1CCC1 MCULE-6889274435 [1,0,0,1,0,0|1,0,0]=3 2475 B8R1.34 O=C([O-])CC1COC1 MCULE-8848528767 [1,0,0,1,0,0|1,0,1]=4 2476 B8R1.42 CC(=O)CC1(CC1)C MCULE-3117561505 [1,0,0,1,0,0|1,0,0]=3 2477 B8R1.42 CC(=O)OC1(CC1)C MCULE-8484243192 [1,0,0,1,0,0|2,0,0]=4 2478 B8R1.42 CC1(CC1)CC(=O)O MCULE-1590977154 [1,0,0,1,0,0|0,0,0]=2 2479 B8R1.42 CC1(CC1)NC(=O)N MCULE-2689884910 [1,0,0,1,0,0|2,0,0]=4 2480 B8R1.42 CC1(N=N1)CC(=O)O MCULE-1987955811 [1,0,0,1,0,0|2,0,0]=4 2481 B8R1.42 NC1(CC1)CC(=O)O MCULE-3593224967 [1,0,0,1,0,0|1,0,0]=3 2482 B8R1.42 NC1(CC1)CC(=O)O MCULE-8049209917 [1,0,0,1,0,0|1,0,0]=3 2483 B8R1.42 O=C(O)CC1(CC1)O MCULE-1745399123 [1,0,0,1,0,0|1,0,0]=3 2484 B8R1.43 C#CC1CC1C(=O)O MCULE-3287712150 [1,0,0,1,0,0|0,0,2]=4 2485 B8R1.43 C#C[C@@H]1C[C@H]1C(=O)O MCULE-3682886945 [1,0,0,1,0,0|0,0,2]=4 2486 B8R1.43 C#C[C@H]1C[C@@H]1C(=O)O MCULE-7332146893 [1,0,0,1,0,0|0,0,2]=4 2487 B8R1.43 C#C[C@H]1C[C@@H]1C(=O)O MCULE-8247580113 [1,0,0,1,0,0|0,0,2]=4 2488 B8R1.43 C#C[C@H]1C[C@H]1C(=O)O MCULE-7681925135 [1,0,0,1,0,0|0,0,2]=4 2489 B8R1.43 C=C[C@@H]1C[C@H]1C(=O)O MCULE-6323262453 [1,0,0,1,0,0|0,0,2]=4 2490 B8R1.43 C=C[C@H]1C[C@H]1C(=O)O MCULE-6983531899 [1,0,0,1,0,0|0,0,2]=4 2491 B8R1.43 CCC1CC1C(=O)O MCULE-2993174891 [1,0,0,1,0,0|0,0,0]=2 2492 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O MCULE-8944777861 [1,0,0,1,0,0|0,0,0]=2 2493 B8R1.43 COC1CC1C(=O)O MCULE-8490015991 [1,0,0,1,0,0|1,0,0]=3 2494 B8R1.43 N#CC1CC1C(=O)O MCULE-9124706645 [1,0,0,1,0,0|1,0,1]=4 2495 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O MCULE-5445653149 [1,0,0,1,0,0|1,0,1]=4 2496 B8R1.43 N#C[C@@H]1C[C@H]1C(=O)O MCULE-6130530861 [1,0,0,1,0,0|1,0,1]=4 2497 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O MCULE-3330628556 [1,0,0,1,0,0|1,0,1]=4 2498 B8R1.43 N#C[C@H]1C[C@H]1C(=O)O MCULE-6684718700 [1,0,0,1,0,0|1,0,1]=4 2499 B8R1.43 NC(=O)C1CC1CO MCULE-3191620985 [1,0,0,1,0,0|2,0,0]=4 2500 B8R1.43 NCC1CC1C(=O)O MCULE-8216751454 [1,0,0,1,0,0|1,0,0]=3 2501 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-3415372050 [1,0,0,1,0,0|1,0,0]=3 2502 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-6765918556 [1,0,0,1,0,0|1,0,0]=3 2503 B8R1.43 O=C(O)C1CC1CCl MCULE-8596410287 [1,0,0,1,0,0|1,0,0]=3 2504 B8R1.43 O=C(O)C1CC1CF MCULE-8263605468 [1,0,0,1,0,0|1,0,0]=3 2505 B8R1.43 O=C(O)C1CC1CO MCULE-5433690867 [1,0,0,1,0,0|1,0,0]=3 2506 B8R1.43 O=C(O)[C@@H]1C[C@H]1CCl MCULE-7560724994 [1,0,0,1,0,0|1,0,0]=3 2507 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO MCULE-9657133495 [1,0,0,1,0,0|1,0,0]=3 2508 B8R1.43 O=C(O)[C@H]1C[C@@H]1CO MCULE-1395497386 [1,0,0,1,0,0|1,0,0]=3 2509 B8R1.43 [C@@H]1(C[C@H]1C(=O)O)C#N MCULE-9124193326 [1,0,0,1,0,0|1,0,1]=4 2510 B8R1.43 [C@H]1(C[C@H]1C(=O)O)C#N MCULE-3751215343 [1,0,0,1,0,0|1,0,1]=4 2511 B8R1.51 CC1CCC(C1)(C)O MCULE-5369529521 [1,0,0,1,0,0|1,0,1]=4 2512 B8R1.51 CC1CCS(=O)(=O)C1 MCULE-8205416735 [1,0,0,1,0,0|1,0,1]=4 2513 B8R1.62 CC1(CC(=O)C1)CO MCULE-4643412830 [1,0,0,1,0,0|2,0,0]=4 2514 B8R1.62 CC1(CC(=O)N1)CCl MCULE-7182920776 [1,0,0,1,0,0|2,0,0]=4 2515 B8R1.67 C[C@H]1[C@H]([C@@H]1C(=O)O)C MCULE-2637094670 [1,0,0,1,0,0|0,0,0]=2 2516 B8R1.5 CC1CCCCC1=O MCULE-6363555535 [1,0,0,1,0,0|2,0,0]=4 2517 B8R1.5 CC1CCCNC1=O MCULE-5295531632 [1,0,0,1,0,0|2,0,0]=4 2518 B8R1.5 CC1CCCOC1=O MCULE-5926029136 [1,0,0,1,0,0|1,0,0]=3 2519 B8R1.5 NC1CCCCC1=O MCULE-2382898926 [1,0,0,1,0,0|1,0,0]=3 2520 B8R1.5 NC1CCCCC1=O MCULE-9230455128 [1,0,0,1,0,0|1,0,0]=3 2521 B8R1.5 NC1CCCCC1O MCULE-1427424523 [1,0,0,1,0,0|1,0,1]=4 2522 B8R1.5 NC1CCCCC1O MCULE-2793336591 [1,0,0,1,0,0|1,0,1]=4 2523 B8R1.5 NC1CCCNC1=O MCULE-2560564171 [1,0,0,1,0,0|1,0,0]=3 2524 B8R1.5 NC1CCCNC1=O MCULE-4494449620 [1,0,0,1,0,0|1,0,0]=3 2525 B8R1.5 NC1CCCNC1=O MCULE-7473475906 [1,0,0,1,0,0|1,0,0]=3 2526 B8R1.5 NC1CCCNC1=O MCULE-8288645102 [1,0,0,1,0,0|1,0,0]=3 2527 B8R1.5 NC1COCCC1=O MCULE-2621905094 [1,0,0,1,0,0|2,0,0]=4 2528 B8R1.5 NC1COCCC1=O MCULE-5417580672 [1,0,0,1,0,0|2,0,0]=4 2529 B8R1.5 NN1CCCCC1=O MCULE-3663308028 [1,0,0,1,0,0|2,0,0]=4 2530 B8R1.5 NN1CCCCC1=O MCULE-9929233745 [1,0,0,1,0,0|2,0,0]=4 2531 B8R1.5 NN1CCCNC1=O MCULE-1690172508 [1,0,0,1,0,0|2,0,0]=4 2532 B8R1.5 NN1CCCOC1=O MCULE-6942418314 [1,0,0,1,0,0|1,0,0]=3 2533 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2753918610 [1,0,0,1,0,0|1,0,1]=4 2534 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2761271370 [1,0,0,1,0,0|1,0,1]=4 2535 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-4978213189 [1,0,0,1,0,0|1,0,1]=4 2536 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-9182719952 [1,0,0,1,0,0|1,0,1]=4 2537 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-1509174959 [1,0,0,1,0,0|1,0,1]=4 2538 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-2336529349 [1,0,0,1,0,0|1,0,1]=4 2539 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-4732604931 [1,0,0,1,0,0|1,0,1]=4 2540 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-6124510830 [1,0,0,1,0,0|1,0,1]=4 2541 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-7301593250 [1,0,0,1,0,0|1,0,1]=4 2542 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-8501577810 [1,0,0,1,0,0|1,0,1]=4 2543 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2058435105 [1,0,0,1,0,0|1,0,0]=3 2544 B8R1.5 N[C@@H]1CCCNC1=O MCULE-2444659445 [1,0,0,1,0,0|1,0,0]=3 2545 B8R1.5 N[C@@H]1CCCNC1=O MCULE-3005560472 [1,0,0,1,0,0|1,0,0]=3 2546 B8R1.5 N[C@@H]1CCCNC1=O MCULE-6935410876 [1,0,0,1,0,0|1,0,0]=3 2547 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1277967673 [1,0,0,1,0,0|1,0,1]=4 2548 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1301750612 [1,0,0,1,0,0|1,0,1]=4 2549 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-3861922722 [1,0,0,1,0,0|1,0,1]=4 2550 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-8489439004 [1,0,0,1,0,0|1,0,1]=4 2551 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-1599409645 [1,0,0,1,0,0|1,0,1]=4 2552 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-3318800690 [1,0,0,1,0,0|1,0,1]=4 2553 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-4235445104 [1,0,0,1,0,0|1,0,1]=4 2554 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6518289705 [1,0,0,1,0,0|1,0,1]=4 2555 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6606691116 [1,0,0,1,0,0|1,0,1]=4 2556 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-9979333085 [1,0,0,1,0,0|1,0,1]=4 2557 B8R1.5 N[C@H]1CCCNC1=O MCULE-1247931890 [1,0,0,1,0,0|1,0,0]=3 2558 B8R1.5 N[C@H]1CCCNC1=O MCULE-2425510086 [1,0,0,1,0,0|1,0,0]=3 2559 B8R1.5 N[C@H]1CCCNC1=O MCULE-6121950966 [1,0,0,1,0,0|1,0,0]=3 2560 B8R1.5 N[C@H]1CCCNC1=O MCULE-7701042199 [1,0,0,1,0,0|1,0,0]=3 2561 B8R1.5 O=C1CCCCC1Br MCULE-9356057483 [1,0,0,1,0,0|2,0,0]=4 2562 B8R1.5 O=C1CCCCC1Cl MCULE-1580566298 [1,0,0,1,0,0|2,0,0]=4 2563 B8R1.5 O=C1CCCCC1F MCULE-6406930837 [1,0,0,1,0,0|2,0,0]=4 2564 B8R1.5 O=C1CCCCC1O MCULE-7509366699 [1,0,0,1,0,0|2,0,0]=4 2565 B8R1.5 O=C1NCCCC1Br MCULE-1860833784 [1,0,0,1,0,0|2,0,0]=4 2566 B8R1.5 O=C1NCCCC1O MCULE-4922755542 [1,0,0,1,0,0|2,0,0]=4 2567 B8R1.5 O=C1NCCC[C@@H]1O MCULE-2813817931 [1,0,0,1,0,0|2,0,0]=4 2568 B8R1.5 O=C1NCCC[C@@H]1O MCULE-3354550946 [1,0,0,1,0,0|2,0,0]=4 2569 B8R1.5 O=C1NCCC[C@H]1O MCULE-2892218765 [1,0,0,1,0,0|2,0,0]=4 2570 B8R1.5 O=C1NCCC[C@H]1O MCULE-8394704933 [1,0,0,1,0,0|2,0,0]=4 2571 B8R1.5 O=C1OCCCC1Br MCULE-4407787541 [1,0,0,1,0,0|1,0,0]=3 2572 B8R1.5 O=C1OCCCC1O MCULE-3021418071 [1,0,0,1,0,0|1,0,0]=3 2573 B8R1.7 C1(CCCN1)C(=O)N MCULE-2539007211 [1,0,0,1,0,0|1,0,0]=3 2574 B8R1.7 C1(CCCN1)C(=O)N MCULE-7289713183 [1,0,0,1,0,0|1,0,0]=3 2575 B8R1.7 C1(CCNC1)C(=O)O MCULE-3210241958 [1,0,0,1,0,0|2,0,0]=4 2576 B8R1.7 C1(CCNC1)C(=O)O MCULE-6517290754 [1,0,0,1,0,0|2,0,0]=4 2577 B8R1.7 C1(CCOC1)C(=O)O MCULE-4859263225 [1,0,0,1,0,0|2,0,0]=4 2578 B8R1.7 CC(=O)C1CCCC1 MCULE-7952211819 [1,0,0,1,0,0|2,0,0]=4 2579 B8R1.7 CC(=O)C1CCCN1 MCULE-2528977871 [1,0,0,1,0,0|1,0,0]=3 2580 B8R1.7 CC(=O)C1CCCN1 MCULE-9222880225 [1,0,0,1,0,0|1,0,0]=3 2581 B8R1.7 CC(=O)C1CCCO1 MCULE-7518147693 [1,0,0,1,0,0|2,0,0]=4 2582 B8R1.7 CC(=O)C1NCCS1 MCULE-4092674646 [1,0,0,1,0,0|2,0,0]=4 2583 B8R1.7 CC(=O)C1NCCS1 MCULE-8660367055 [1,0,0,1,0,0|2,0,0]=4 2584 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-1290635339 [1,0,0,1,0,0|1,0,0]=3 2585 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2855198659 [1,0,0,1,0,0|1,0,0]=3 2586 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-2944662012 [1,0,0,1,0,0|1,0,0]=3 2587 B8R1.7 CC(=O)[C@@H]1CCCN1 MCULE-4806473466 [1,0,0,1,0,0|1,0,0]=3 2588 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-2015960170 [1,0,0,1,0,0|2,0,0]=4 2589 B8R1.7 CC(=O)[C@@H]1CCCO1 MCULE-3381319090 [1,0,0,1,0,0|2,0,0]=4 2590 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-2095368644 [1,0,0,1,0,0|1,0,0]=3 2591 B8R1.7 CC(=O)[C@H]1CCCN1 MCULE-5460066005 [1,0,0,1,0,0|1,0,0]=3 2592 B8R1.7 CC(=O)[C@H]1CCCO1 MCULE-5637204370 [1,0,0,1,0,0|2,0,0]=4 2593 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5014228849 [1,0,0,1,0,0|1,0,1]=4 2594 B8R1.7 C[C@H](O)[C@@H]1CCCN1 MCULE-5063876687 [1,0,0,1,0,0|1,0,1]=4 2595 B8R1.7 N=C(N)C1CCCN1 MCULE-3357684433 [1,0,0,1,0,0|2,0,0]=4 2596 B8R1.7 N=C(N)C1CCCN1 MCULE-7506606085 [1,0,0,1,0,0|2,0,0]=4 2597 B8R1.7 NC(=O)C1CCCC1 MCULE-3900666396 [1,0,0,1,0,0|2,0,0]=4 2598 B8R1.7 NC(=O)C1CCCN1 MCULE-4159463416 [1,0,0,1,0,0|1,0,0]=3 2599 B8R1.7 NC(=O)C1CCCN1 MCULE-4804910089 [1,0,0,1,0,0|1,0,0]=3 2600 B8R1.7 NC(=O)C1CCCO1 MCULE-9101921416 [1,0,0,1,0,0|2,0,0]=4 2601 B8R1.7 NC(=O)C1CSCN1 MCULE-7557874523 [1,0,0,1,0,0|2,0,0]=4 2602 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2635874022 [1,0,0,1,0,0|1,0,0]=3 2603 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-2652734118 [1,0,0,1,0,0|1,0,0]=3 2604 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-4692992308 [1,0,0,1,0,0|1,0,0]=3 2605 B8R1.7 NC(=O)[C@@H]1CCCN1 MCULE-6463625531 [1,0,0,1,0,0|1,0,0]=3 2606 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-3181755658 [1,0,0,1,0,0|2,0,0]=4 2607 B8R1.7 NC(=O)[C@@H]1CCCO1 MCULE-9348376356 [1,0,0,1,0,0|2,0,0]=4 2608 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-1391877694 [1,0,0,1,0,0|1,0,0]=3 2609 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-2636422628 [1,0,0,1,0,0|1,0,0]=3 2610 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-3135852117 [1,0,0,1,0,0|1,0,0]=3 2611 B8R1.7 NC(=O)[C@H]1CCCN1 MCULE-9661392945 [1,0,0,1,0,0|1,0,0]=3 2612 B8R1.7 O=C(Cl)C1CCCC1 MCULE-1337538941 [1,0,0,1,0,0|2,0,0]=4 2613 B8R1.7 O=C(Cl)C1CCCO1 MCULE-9691919934 [1,0,0,1,0,0|2,0,0]=4 2614 B8R1.7 O=C(O)C1=CCCC1 MCULE-2928571993 [1,0,0,1,0,0|1,0,1]=4 2615 B8R1.7 O=C(O)C1=NCCC1 MCULE-2664768755 [1,0,0,1,0,0|0,0,2]=4 2616 B8R1.7 O=C(O)C1C=CCC1 MCULE-8870546284 [1,0,0,1,0,0|1,0,1]=4 2617 B8R1.7 O=C(O)C1C=CCN1 MCULE-2141949922 [1,0,0,1,0,0|0,0,2]=4 2618 B8R1.7 O=C(O)C1C=CCN1 MCULE-3068035697 [1,0,0,1,0,0|0,0,2]=4 2619 B8R1.7 O=C(O)C1C=CCN1 MCULE-4825351403 [1,0,0,1,0,0|0,0,2]=4 2620 B8R1.7 O=C(O)C1C=CCN1 MCULE-9928071710 [1,0,0,1,0,0|0,0,2]=4 2621 B8R1.7 O=C(O)C1CCC=N1 MCULE-1792151957 [1,0,0,1,0,0|0,0,2]=4 2622 B8R1.7 O=C(O)C1CCCC1 MCULE-6415159340 [1,0,0,1,0,0|1,0,0]=3 2623 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [1,0,0,1,0,0|0,0,0]=2 2624 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [1,0,0,1,0,0|0,0,0]=2 2625 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [1,0,0,1,0,0|0,0,0]=2 2626 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [1,0,0,1,0,0|0,0,0]=2 2627 B8R1.7 O=C(O)C1CCCO1 MCULE-1952289090 [1,0,0,1,0,0|1,0,0]=3 2628 B8R1.7 O=C(O)C1CCCO1 MCULE-5387481824 [1,0,0,1,0,0|1,0,0]=3 2629 B8R1.7 O=C(O)C1CCCS1 MCULE-7760686042 [1,0,0,1,0,0|1,0,0]=3 2630 B8R1.7 O=C(O)C1CCNC1 MCULE-4976520029 [1,0,0,1,0,0|2,0,0]=4 2631 B8R1.7 O=C(O)C1CCNC1 MCULE-5937045785 [1,0,0,1,0,0|2,0,0]=4 2632 B8R1.7 O=C(O)C1CCNC1 MCULE-6983695276 [1,0,0,1,0,0|2,0,0]=4 2633 B8R1.7 O=C(O)C1CCOC1 MCULE-3567941338 [1,0,0,1,0,0|2,0,0]=4 2634 B8R1.7 O=C(O)C1CCSC1 MCULE-7898686734 [1,0,0,1,0,0|2,0,0]=4 2635 B8R1.7 O=C(O)C1COCN1 MCULE-4997392610 [1,0,0,1,0,0|1,0,0]=3 2636 B8R1.7 O=C(O)C1COCN1 MCULE-7001651226 [1,0,0,1,0,0|1,0,0]=3 2637 B8R1.7 O=C(O)C1CSCN1 MCULE-2391637686 [1,0,0,1,0,0|1,0,0]=3 2638 B8R1.7 O=C(O)C1CSCN1 MCULE-9622331370 [1,0,0,1,0,0|1,0,0]=3 2639 B8R1.7 O=C(O)C1NCCS1 MCULE-2504435743 [1,0,0,1,0,0|1,0,0]=3 2640 B8R1.7 O=C(O)C1SCCS1 MCULE-4466563646 [1,0,0,1,0,0|2,0,0]=4 2641 B8R1.7 O=C(O)N1CCCC1 MCULE-7984061130 [1,0,0,1,0,0|2,0,0]=4 2642 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-2515045579 [1,0,0,1,0,0|0,0,2]=4 2643 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-3589058117 [1,0,0,1,0,0|0,0,2]=4 2644 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-7995918745 [1,0,0,1,0,0|0,0,2]=4 2645 B8R1.7 O=C(O)[C@@H]1C=CCN1 MCULE-8155212892 [1,0,0,1,0,0|0,0,2]=4 2646 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [1,0,0,1,0,0|0,0,0]=2 2647 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [1,0,0,1,0,0|0,0,0]=2 2648 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [1,0,0,1,0,0|0,0,0]=2 2649 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [1,0,0,1,0,0|0,0,0]=2 2650 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-5193388500 [1,0,0,1,0,0|1,0,0]=3 2651 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-8181760406 [1,0,0,1,0,0|1,0,0]=3 2652 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-3068007507 [1,0,0,1,0,0|2,0,0]=4 2653 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4477578687 [1,0,0,1,0,0|2,0,0]=4 2654 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4524201006 [1,0,0,1,0,0|2,0,0]=4 2655 B8R1.7 O=C(O)[C@@H]1CCNC1 MCULE-4868292658 [1,0,0,1,0,0|2,0,0]=4 2656 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-4807765276 [1,0,0,1,0,0|2,0,0]=4 2657 B8R1.7 O=C(O)[C@@H]1CCOC1 MCULE-7912413581 [1,0,0,1,0,0|2,0,0]=4 2658 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1547472283 [1,0,0,1,0,0|1,0,0]=3 2659 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1876089066 [1,0,0,1,0,0|1,0,0]=3 2660 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-1926856350 [1,0,0,1,0,0|1,0,0]=3 2661 B8R1.7 O=C(O)[C@@H]1COCN1 MCULE-9876695932 [1,0,0,1,0,0|1,0,0]=3 2662 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-4243406881 [1,0,0,1,0,0|1,0,0]=3 2663 B8R1.7 O=C(O)[C@@H]1CSCN1 MCULE-6343154165 [1,0,0,1,0,0|1,0,0]=3 2664 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-2145380755 [1,0,0,1,0,0|0,0,2]=4 2665 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-5768283844 [1,0,0,1,0,0|0,0,2]=4 2666 B8R1.7 O=C(O)[C@H]1C=CCN1 MCULE-8522372891 [1,0,0,1,0,0|0,0,2]=4 2667 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [1,0,0,1,0,0|0,0,0]=2 2668 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [1,0,0,1,0,0|0,0,0]=2 2669 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-2258024439 [1,0,0,1,0,0|1,0,0]=3 2670 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-5143953192 [1,0,0,1,0,0|1,0,0]=3 2671 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2003400674 [1,0,0,1,0,0|2,0,0]=4 2672 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-2851087395 [1,0,0,1,0,0|2,0,0]=4 2673 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7223432888 [1,0,0,1,0,0|2,0,0]=4 2674 B8R1.7 O=C(O)[C@H]1CCNC1 MCULE-7610384670 [1,0,0,1,0,0|2,0,0]=4 2675 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-3213766488 [1,0,0,1,0,0|2,0,0]=4 2676 B8R1.7 O=C(O)[C@H]1CCOC1 MCULE-9627397250 [1,0,0,1,0,0|2,0,0]=4 2677 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-6095527710 [1,0,0,1,0,0|1,0,0]=3 2678 B8R1.7 O=C(O)[C@H]1CSCN1 MCULE-9117444908 [1,0,0,1,0,0|1,0,0]=3 2679 B8R1.7 O=C([O-])C1CCCN1 MCULE-9155494525 [1,0,0,1,0,0|0,0,1]=3 2680 B8R1.7 O=C([O-])C1CSCN1 MCULE-9836043803 [1,0,0,1,0,0|1,0,1]=4 2681 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-2694821396 [1,0,0,1,0,0|0,0,1]=3 2682 B8R1.7 O=C([O-])[C@@H]1CCCN1 MCULE-8353601451 [1,0,0,1,0,0|0,0,1]=3 2683 B8R1.7 OB(O)C1CCCN1 MCULE-5123578937 [1,0,0,1,0,0|1,0,1]=4 2684 B8R1.7 OB(O)C1CCCN1 MCULE-6072524963 [1,0,0,1,0,0|1,0,1]=4 2685 B8R1.7 [C@@H]1(CSCN1)C(=O)[O-] MCULE-3895380806 [1,0,0,1,0,0|1,0,1]=4 2686 B8R1.13 CCCC1CCC1=O MCULE-7626165824 [1,0,0,1,0,0|2,0,0]=4 2687 B8R1.19 CC1(CCCC1N)O MCULE-3396541731 [1,0,0,1,0,0|1,0,1]=4 2688 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-4508286005 [1,0,0,1,0,0|1,0,1]=4 2689 B8R1.19 C[C@@]1(CCC[C@@H]1N)O MCULE-9668737274 [1,0,0,1,0,0|1,0,1]=4 2690 B8R1.19 C[C@@]1(CCC[C@H]1N)O MCULE-2369187970 [1,0,0,1,0,0|1,0,1]=4 2691 B8R1.19 C[C@]1(CCC[C@@H]1N)O MCULE-2644040109 [1,0,0,1,0,0|1,0,1]=4 2692 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-2446086306 [1,0,0,1,0,0|1,0,1]=4 2693 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-8959851594 [1,0,0,1,0,0|1,0,1]=4 2694 B8R1.19 C[C@]1(CCC[C@H]1N)O MCULE-9937788175 [1,0,0,1,0,0|1,0,1]=4 2695 B8R1.23 C1(CC(=O)N1)C(=O)O MCULE-3416083471 [1,0,0,1,0,0|1,0,1]=4 2696 B8R1.23 CC1CC(C1)C(=O)O MCULE-2185016477 [1,0,0,1,0,0|1,0,0]=3 2697 B8R1.23 CC1CC(N1)C(=O)O MCULE-2803934033 [1,0,0,1,0,0|0,0,0]=2 2698 B8R1.23 CN1CC(C1)C(=O)O MCULE-8825389553 [1,0,0,1,0,0|2,0,0]=4 2699 B8R1.23 C[C@@H]1C[C@H](N1)C(=O)O MCULE-6318758002 [1,0,0,1,0,0|0,0,0]=2 2700 B8R1.23 C[C@H]1C[C@@H](C1)C(=O)O MCULE-1777784731 [1,0,0,1,0,0|1,0,0]=3 2701 B8R1.23 C[C@H]1C[C@H](C1)C(=O)O MCULE-8951813405 [1,0,0,1,0,0|1,0,0]=3 2702 B8R1.23 C[C@H]1C[C@H](N1)C(=O)O MCULE-2969381793 [1,0,0,1,0,0|0,0,0]=2 2703 B8R1.23 NC1CC(C1)C(=O)O MCULE-8750839632 [1,0,0,1,0,0|2,0,0]=4 2704 B8R1.23 NC1CC(C1)C(=O)O MCULE-9051964103 [1,0,0,1,0,0|2,0,0]=4 2705 B8R1.23 N[C@H]1C[C@@H](C1)C(=O)O MCULE-1844060803 [1,0,0,1,0,0|2,0,0]=4 2706 B8R1.23 N[C@H]1C[C@@H](C1)C(=O)O MCULE-2707924504 [1,0,0,1,0,0|2,0,0]=4 2707 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O MCULE-3847725342 [1,0,0,1,0,0|2,0,0]=4 2708 B8R1.23 N[C@H]1C[C@H](C1)C(=O)O MCULE-4578532365 [1,0,0,1,0,0|2,0,0]=4 2709 B8R1.23 O=C(O)C1CC(C1)Br MCULE-8162503332 [1,0,0,1,0,0|2,0,0]=4 2710 B8R1.23 O=C(O)C1CC(C1)Cl MCULE-7489933597 [1,0,0,1,0,0|2,0,0]=4 2711 B8R1.23 O=C(O)C1CC(C1)F MCULE-7905028761 [1,0,0,1,0,0|2,0,0]=4 2712 B8R1.23 O=C(O)C1CC(C1)O MCULE-4341192467 [1,0,0,1,0,0|2,0,0]=4 2713 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)Br MCULE-1173253398 [1,0,0,1,0,0|2,0,0]=4 2714 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)F MCULE-4909435716 [1,0,0,1,0,0|2,0,0]=4 2715 B8R1.23 O=C(O)[C@H]1C[C@@H](C1)O MCULE-9908072079 [1,0,0,1,0,0|2,0,0]=4 2716 B8R1.23 O=C(O)[C@H]1C[C@H](C1)Br MCULE-9142067708 [1,0,0,1,0,0|2,0,0]=4 2717 B8R1.23 O=C(O)[C@H]1C[C@H](C1)F MCULE-7816380416 [1,0,0,1,0,0|2,0,0]=4 2718 B8R1.23 O=C(O)[C@H]1C[C@H](C1)O MCULE-5181925767 [1,0,0,1,0,0|2,0,0]=4 2719 B8R1.23 O=C1CC(N1)C(=O)O MCULE-3167823583 [1,0,0,1,0,0|1,0,1]=4 2720 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-2118093307 [1,0,0,1,0,0|1,0,1]=4 2721 B8R1.23 O=C1C[C@@H](N1)C(=O)O MCULE-7784171286 [1,0,0,1,0,0|1,0,1]=4 2722 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-1255798587 [1,0,0,1,0,0|1,0,1]=4 2723 B8R1.23 O=C1C[C@H](N1)C(=O)O MCULE-6947698869 [1,0,0,1,0,0|1,0,1]=4 2724 B8R1.23 [C@@H]1(C[C@@H](C1)C(=O)O)Cl MCULE-4605935494 [1,0,0,1,0,0|2,0,0]=4 2725 B8R1.30 CC1(CC1Br)C(=O)O MCULE-8673991477 [1,0,0,1,0,0|2,0,0]=4 2726 B8R1.30 CC1(CC1F)C(=O)O MCULE-8465675013 [1,0,0,1,0,0|2,0,0]=4 2727 B8R1.30 CC1CC1(C)C(=O)O MCULE-8330983425 [1,0,0,1,0,0|1,0,0]=3 2728 B8R1.30 C[C@@]1(C[C@@H]1Br)C(=O)O MCULE-1474744945 [1,0,0,1,0,0|2,0,0]=4 2729 B8R1.30 C[C@]1(C[C@@H]1F)C(=O)O MCULE-3210206701 [1,0,0,1,0,0|2,0,0]=4 2730 B8R1.30 C[C@]1(C[C@H]1F)C(=O)O MCULE-6362421682 [1,0,0,1,0,0|2,0,0]=4 2731 B8R1.30 C[C@]1(C[C@H]1F)C(=O)O MCULE-9963754001 [1,0,0,1,0,0|2,0,0]=4 2732 B8R1.54 C(N)(C(=O)O)C1CC1 MCULE-4833544032 [1,0,0,1,0,0|0,0,0]=2 2733 B8R1.54 C=C(C(=O)O)C1CC1 MCULE-9531805422 [1,0,0,1,0,0|1,0,1]=4 2734 B8R1.54 CC(=O)C(C)C1CC1 MCULE-9797389889 [1,0,0,1,0,0|2,0,0]=4 2735 B8R1.54 CC(C(=O)O)C1CC1 MCULE-9343385076 [1,0,0,1,0,0|1,0,0]=3 2736 B8R1.54 NC(=O)C(N)C1CC1 MCULE-5863587661 [1,0,0,1,0,0|1,0,0]=3 2737 B8R1.54 NC(=O)C(N)C1CC1 MCULE-5987826744 [1,0,0,1,0,0|1,0,0]=3 2738 B8R1.54 NC(=O)C(O)C1CC1 MCULE-4055290448 [1,0,0,1,0,0|2,0,0]=4 2739 B8R1.54 NC(C(=O)O)C1CC1 MCULE-1974514713 [1,0,0,1,0,0|0,0,0]=2 2740 B8R1.54 NC(C(=O)O)C1CC1 MCULE-3126466096 [1,0,0,1,0,0|0,0,0]=2 2741 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-5662004537 [1,0,0,1,0,0|0,0,0]=2 2742 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-9004548949 [1,0,0,1,0,0|0,0,0]=2 2743 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-4323013494 [1,0,0,1,0,0|0,0,0]=2 2744 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-9475774396 [1,0,0,1,0,0|0,0,0]=2 2745 B8R1.54 O=C(O)C(=O)C1CC1 MCULE-2935818452 [1,0,0,1,0,0|1,0,1]=4 2746 B8R1.54 O=C(O)C(F)C1CC1 MCULE-4799246955 [1,0,0,1,0,0|1,0,0]=3 2747 B8R1.54 O=C(O)C(O)C1CC1 MCULE-9945035089 [1,0,0,1,0,0|1,0,0]=3 2748 B8R1.54 O=C(O)[C@@H](O)C1CC1 MCULE-2409990996 [1,0,0,1,0,0|1,0,0]=3 2749 B8R1.54 O=C(O)[C@H](O)C1CC1 MCULE-2255829314 [1,0,0,1,0,0|1,0,0]=3 2750 B8R1.78 CC(=O)C1(CCC1)C MCULE-7668067765 [1,0,0,1,0,0|2,0,0]=4 2751 B8R1.78 CC(=O)C1(CCC1)O MCULE-9112690180 [1,0,0,1,0,0|2,0,0]=4 2752 B8R1.78 CC1(CCC1)C(=O)Cl MCULE-4438397604 [1,0,0,1,0,0|2,0,0]=4 2753 B8R1.78 CC1(CCC1)C(=O)O MCULE-8539228760 [1,0,0,1,0,0|1,0,0]=3 2754 B8R1.78 CC1(CCO1)C(=O)O MCULE-3206195959 [1,0,0,1,0,0|2,0,0]=4 2755 B8R1.78 CC1(CNC1)C(=O)O MCULE-3626067455 [1,0,0,1,0,0|2,0,0]=4 2756 B8R1.78 CC1(CNC1)C(=O)O MCULE-7316902394 [1,0,0,1,0,0|2,0,0]=4 2757 B8R1.78 CC1(COC1)C(=O)O MCULE-6360656030 [1,0,0,1,0,0|2,0,0]=4 2758 B8R1.78 C[C@@]1(CCO1)C(=O)O MCULE-1153504060 [1,0,0,1,0,0|2,0,0]=4 2759 B8R1.78 NC(=O)C1(CCC1)Br MCULE-3386940591 [1,0,0,1,0,0|2,0,0]=4 2760 B8R1.78 NC(=O)C1(CCC1)N MCULE-1043802844 [1,0,0,1,0,0|1,0,0]=3 2761 B8R1.78 NC(=O)C1(CCC1)N MCULE-8757108427 [1,0,0,1,0,0|1,0,0]=3 2762 B8R1.78 NC(=O)C1(CCC1)O MCULE-9017924933 [1,0,0,1,0,0|2,0,0]=4 2763 B8R1.78 NC(=O)C1(COC1)N MCULE-1019126091 [1,0,0,1,0,0|2,0,0]=4 2764 B8R1.78 NC1(CCC1)C(=O)Cl MCULE-4330568570 [1,0,0,1,0,0|1,0,0]=3 2765 B8R1.78 NC1(CCC1)C(=O)Cl MCULE-9506658674 [1,0,0,1,0,0|1,0,0]=3 2766 B8R1.78 NC1(CCC1)C(=O)O MCULE-7741753062 [1,0,0,1,0,0|0,0,0]=2 2767 B8R1.78 NC1(CCC1)C(=O)O MCULE-8986168461 [1,0,0,1,0,0|0,0,0]=2 2768 B8R1.78 NC1(CNC1)C(=O)O MCULE-1078717796 [1,0,0,1,0,0|1,0,0]=3 2769 B8R1.78 NC1(CNC1)C(=O)O MCULE-1597584418 [1,0,0,1,0,0|1,0,0]=3 2770 B8R1.78 NC1(COC1)C(=O)O MCULE-2048452241 [1,0,0,1,0,0|1,0,0]=3 2771 B8R1.78 NC1(CSC1)C(=O)O MCULE-3865165435 [1,0,0,1,0,0|1,0,0]=3 2772 B8R1.78 NC1(CSC1)C(=O)O MCULE-7335919130 [1,0,0,1,0,0|1,0,0]=3 2773 B8R1.78 O=C(O)C1(CCC1)Br MCULE-2468093858 [1,0,0,1,0,0|1,0,0]=3 2774 B8R1.78 O=C(O)C1(CCC1)F MCULE-5784376163 [1,0,0,1,0,0|1,0,0]=3 2775 B8R1.78 O=C(O)C1(CCC1)O MCULE-3418659917 [1,0,0,1,0,0|1,0,0]=3 2776 B8R1.78 O=C(O)C1(CNC1)F MCULE-7253312158 [1,0,0,1,0,0|2,0,0]=4 2777 B8R1.78 O=C(O)C1(CNC1)O MCULE-3436636334 [1,0,0,1,0,0|2,0,0]=4 2778 B8R1.78 O=C(O)C1(CNC1)O MCULE-4261639250 [1,0,0,1,0,0|2,0,0]=4 2779 B8R1.78 O=C(O)C1(COC1)O MCULE-7009915692 [1,0,0,1,0,0|2,0,0]=4 2780 B8R1.11 CC1CCCC1CO MCULE-9356546543 [1,0,0,1,0,0|1,0,1]=4 2781 B8R1.11 CC1CCNC1CO MCULE-3727613396 [1,0,0,1,0,0|0,0,1]=3 2782 B8R1.11 CC1OCCC1C=O MCULE-5505705817 [1,0,0,1,0,0|2,0,0]=4 2783 B8R1.11 CCC1CCCC1N MCULE-3368757457 [1,0,0,1,0,0|1,0,1]=4 2784 B8R1.11 CCC1COCC1N MCULE-2113082654 [1,0,0,1,0,0|0,0,1]=3 2785 B8R1.11 CCC1NCCC1C MCULE-2665209322 [1,0,0,1,0,0|1,0,1]=4 2786 B8R1.11 CCC1NCCC1C MCULE-2699257293 [1,0,0,1,0,0|1,0,1]=4 2787 B8R1.11 CC[C@@H]1CCC[C@H]1N MCULE-6461151240 [1,0,0,1,0,0|1,0,1]=4 2788 B8R1.11 CN1CCC[C@H]1C=O MCULE-5852490757 [1,0,0,1,0,0|2,0,0]=4 2789 B8R1.11 COC1COCC1N MCULE-6188451020 [1,0,0,1,0,0|1,0,1]=4 2790 B8R1.11 COC1COCC1N MCULE-7557608634 [1,0,0,1,0,0|1,0,1]=4 2791 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-3467113726 [1,0,0,1,0,0|1,0,1]=4 2792 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-3863734761 [1,0,0,1,0,0|1,0,1]=4 2793 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-8760768893 [1,0,0,1,0,0|1,0,1]=4 2794 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-9860387973 [1,0,0,1,0,0|1,0,1]=4 2795 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-1558766585 [1,0,0,1,0,0|1,0,1]=4 2796 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-2616949947 [1,0,0,1,0,0|1,0,1]=4 2797 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-3846862415 [1,0,0,1,0,0|1,0,1]=4 2798 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-7298485885 [1,0,0,1,0,0|1,0,1]=4 2799 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-4582501901 [1,0,0,1,0,0|1,0,1]=4 2800 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-8842335446 [1,0,0,1,0,0|1,0,1]=4 2801 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-9594556693 [1,0,0,1,0,0|1,0,1]=4 2802 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-9701067125 [1,0,0,1,0,0|1,0,1]=4 2803 B8R1.11 CO[C@H]1COC[C@H]1N MCULE-9067624195 [1,0,0,1,0,0|1,0,1]=4 2804 B8R1.11 C[C@@H]1CCN[C@@H]1CO MCULE-7458696223 [1,0,0,1,0,0|0,0,1]=3 2805 B8R1.11 C[C@@H]1CCN[C@H]1CO MCULE-7407237429 [1,0,0,1,0,0|0,0,1]=3 2806 B8R1.11 C[C@H]1CCN[C@@H]1CO MCULE-9913318158 [1,0,0,1,0,0|0,0,1]=3 2807 B8R1.11 C[C@H]1CCN[C@H]1CO MCULE-4322110368 [1,0,0,1,0,0|0,0,1]=3 2808 B8R1.11 NC1COCC1CO MCULE-6651647999 [1,0,0,1,0,0|1,0,1]=4 2809 B8R1.11 N[C@@H]1COC[C@@H]1CO MCULE-8267820303 [1,0,0,1,0,0|1,0,1]=4 2810 B8R1.11 N[C@@H]1COC[C@H]1CO MCULE-3070797384 [1,0,0,1,0,0|1,0,1]=4 2811 B8R1.11 N[C@@H]1COC[C@H]1CO MCULE-4572096805 [1,0,0,1,0,0|1,0,1]=4 2812 B8R1.11 N[C@H]1COC[C@@H]1CO MCULE-2948740480 [1,0,0,1,0,0|1,0,1]=4 2813 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-3409455124 [1,0,0,1,0,0|1,0,1]=4 2814 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-6058647833 [1,0,0,1,0,0|1,0,1]=4 2815 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-6847790594 [1,0,0,1,0,0|1,0,1]=4 2816 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-8456266436 [1,0,0,1,0,0|1,0,1]=4 2817 B8R1.11 OCC1NCCC1O MCULE-6288507636 [1,0,0,1,0,0|1,0,1]=4 2818 B8R1.11 OCC1NCCC1O MCULE-6806405470 [1,0,0,1,0,0|1,0,1]=4 2819 B8R1.11 OC[C@@H]1NCC[C@@H]1O MCULE-8384230507 [1,0,0,1,0,0|1,0,1]=4 2820 B8R1.11 OC[C@@H]1NCC[C@H]1O MCULE-3549294738 [1,0,0,1,0,0|1,0,1]=4 2821 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-3020492285 [1,0,0,1,0,0|1,0,1]=4 2822 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-4180813715 [1,0,0,1,0,0|1,0,1]=4 2823 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-8831128340 [1,0,0,1,0,0|1,0,1]=4 2824 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-9415023769 [1,0,0,1,0,0|1,0,1]=4 2825 B8R1.11 OC[C@H]1NCC[C@H]1O MCULE-9396804561 [1,0,0,1,0,0|1,0,1]=4 2826 B8R1.38 C=CC(N)C1CCC1 MCULE-3645428001 [1,0,0,1,0,0|1,0,0]=3 2827 B8R1.38 CC(C=O)C1CCC1 MCULE-5860376202 [1,0,0,1,0,0|1,0,0]=3 2828 B8R1.38 CC(CO)C1CCC1 MCULE-1784327025 [1,0,0,1,0,0|1,0,1]=4 2829 B8R1.38 CCC(N)C1CCC1 MCULE-4148346502 [1,0,0,1,0,0|1,0,1]=4 2830 B8R1.38 CCC(N)C1CCC1 MCULE-8370575436 [1,0,0,1,0,0|1,0,1]=4 2831 B8R1.38 N#CC(N)C1CCC1 MCULE-8208759516 [1,0,0,1,0,0|1,0,1]=4 2832 B8R1.38 NC(CO)C1CCC1 MCULE-1060557753 [1,0,0,1,0,0|0,0,1]=3 2833 B8R1.38 NC(CO)C1CCC1 MCULE-4732995704 [1,0,0,1,0,0|0,0,1]=3 2834 B8R1.38 NCC(N)C1CCC1 MCULE-5439532200 [1,0,0,1,0,0|1,0,1]=4 2835 B8R1.38 NCC(N)C1CCC1 MCULE-8490064832 [1,0,0,1,0,0|1,0,1]=4 2836 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-1191204694 [1,0,0,1,0,0|0,0,1]=3 2837 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-4280800914 [1,0,0,1,0,0|0,0,1]=3 2838 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-4912879577 [1,0,0,1,0,0|0,0,1]=3 2839 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-8248389845 [1,0,0,1,0,0|0,0,1]=3 2840 B8R1.38 N[C@H](CO)C1CCC1 MCULE-2165772919 [1,0,0,1,0,0|0,0,1]=3 2841 B8R1.38 N[C@H](CO)C1CCC1 MCULE-5153627963 [1,0,0,1,0,0|0,0,1]=3 2842 B8R1.38 N[C@H](CO)C1CCC1 MCULE-5389043091 [1,0,0,1,0,0|0,0,1]=3 2843 B8R1.38 N[C@H](CO)C1CCC1 MCULE-7675577168 [1,0,0,1,0,0|0,0,1]=3 2844 B8R1.38 N[C@H](CO)C1COC1 MCULE-3365163158 [1,0,0,1,0,0|1,0,1]=4 2845 B8R1.38 N[C@H](CO)C1COC1 MCULE-4558714642 [1,0,0,1,0,0|1,0,1]=4 2846 B8R1.38 OCC(O)C1CCC1 MCULE-5695655912 [1,0,0,1,0,0|1,0,1]=4 2847 B8R1.39 CC1(CC1)C(O)CO MCULE-9588411733 [1,0,0,1,0,0|1,0,1]=4 2848 B8R1.50 CC1C(=O)CCN1C MCULE-8191851293 [1,0,0,1,0,0|2,0,0]=4 2849 B8R1.50 CC1CCC(=O)C1=O MCULE-7649396652 [1,0,0,1,0,0|1,0,1]=4 2850 B8R1.50 CC1CCC(=O)N1C MCULE-7405072604 [1,0,0,1,0,0|2,0,0]=4 2851 B8R1.50 CC1CCC(C1N)C MCULE-5534270110 [1,0,0,1,0,0|1,0,1]=4 2852 B8R1.50 CC1CCC(C1N)C MCULE-9569539393 [1,0,0,1,0,0|1,0,1]=4 2853 B8R1.50 CC1CCC(C1O)O MCULE-3292232581 [1,0,0,1,0,0|1,0,1]=4 2854 B8R1.50 CC1CNC(=O)C1C MCULE-7439537346 [1,0,0,1,0,0|2,0,0]=4 2855 B8R1.50 CC1OCC(=O)C1C MCULE-5834923125 [1,0,0,1,0,0|2,0,0]=4 2856 B8R1.50 N[C@@H]1C(=O)NC[C@H]1O MCULE-6840872048 [1,0,0,1,0,0|2,0,0]=4 2857 B8R1.77 C1(CC1(C)C)C(=O)N MCULE-5718477060 [1,0,0,1,0,0|2,0,0]=4 2858 B8R1.77 CC(=O)C1CC1(C)C MCULE-5036637605 [1,0,0,1,0,0|2,0,0]=4 2859 B8R1.77 CC1(CC1C(=O)Cl)C MCULE-4090499692 [1,0,0,1,0,0|2,0,0]=4 2860 B8R1.77 CC1(CC1C(=O)N)C MCULE-5357702152 [1,0,0,1,0,0|2,0,0]=4 2861 B8R1.77 CC1(CC1C(=O)O)Br MCULE-8354202393 [1,0,0,1,0,0|2,0,0]=4 2862 B8R1.77 CC1(CC1C(=O)O)C MCULE-1018303180 [1,0,0,1,0,0|1,0,0]=3 2863 B8R1.77 CC1(C[C@@H]1C(=O)N)C MCULE-5378835991 [1,0,0,1,0,0|2,0,0]=4 2864 B8R1.77 CC1(C[C@@H]1C(=O)N)C MCULE-9161411761 [1,0,0,1,0,0|2,0,0]=4 2865 B8R1.77 CC1(C[C@@H]1C(=O)O)C MCULE-8058233700 [1,0,0,1,0,0|1,0,0]=3 2866 B8R1.77 CC1(C[C@@H]1C(=O)O)C MCULE-8306311088 [1,0,0,1,0,0|1,0,0]=3 2867 B8R1.77 CC1(C[C@H]1C(=O)O)C MCULE-1908265175 [1,0,0,1,0,0|1,0,0]=3 2868 B8R1.77 CC1(OC1C(=O)O)C MCULE-6178976856 [1,0,0,1,0,0|1,0,0]=3 2869 B8R1.77 [C@H]1(CC1(C)C)C(=O)N MCULE-6467459637 [1,0,0,1,0,0|2,0,0]=4 2870 B10R1.14 CCC(C)C1CCC(=O)C1 MCULE-5167904978 [0,0,0,1,0,1|2,0,0]=4 2871 B10R1.64 CC1CCCC1CC(=O)O MCULE-1034129697 [0,0,0,1,0,1|1,0,0]=3 2872 B10R1.64 CC1CCCN1CC(=O)O MCULE-5477147476 [0,0,0,1,0,1|2,0,0]=4 2873 B10R1.64 CC1CCCN1CC(=O)O MCULE-7787437864 [0,0,0,1,0,1|2,0,0]=4 2874 B10R1.64 CC1OCCC1CC(=O)O MCULE-3630286814 [0,0,0,1,0,1|2,0,0]=4 2875 B10R1.64 CN1CCCC1CC(=O)O MCULE-1900515698 [0,0,0,1,0,1|2,0,0]=4 2876 B10R1.64 CN1CCCC1CC(=O)O MCULE-4392051296 [0,0,0,1,0,1|2,0,0]=4 2877 B10R1.64 CN1CCC[C@H]1CC(=O)O MCULE-2926738632 [0,0,0,1,0,1|2,0,0]=4 2878 B10R1.64 NC1CCCC1CC(=O)O MCULE-7275948763 [0,0,0,1,0,1|2,0,0]=4 2879 B10R1.64 NC1CCCC1CC(=O)O MCULE-7852876693 [0,0,0,1,0,1|2,0,0]=4 2880 B10R1.194 CC1C(CCN1C)C(=O)O MCULE-3080880087 [0,0,0,1,0,1|2,0,0]=4 2881 B10R1.194 CC1C(CCN1C)C(=O)O MCULE-8463571511 [0,0,0,1,0,1|2,0,0]=4 2882 B10R1.194 CC1CCC(N1C)C(=O)O MCULE-1631473352 [0,0,0,1,0,1|2,0,0]=4 2883 B10R1.194 C[C@@H]1CC[C@H](N1C)C(=O)O MCULE-5064787674 [0,0,0,1,0,1|2,0,0]=4 2884 B10R1.194 C[C@@H]1CC[C@H](N1C)C(=O)O MCULE-5375480697 [0,0,0,1,0,1|2,0,0]=4 2885 B10R1.194 C[C@@H]1[C@@H](CCN1C)C(=O)O MCULE-1037781010 [0,0,0,1,0,1|2,0,0]=4 2886 B10R1.194 C[C@@H]1[C@@H](CCN1C)C(=O)O MCULE-5608694177 [0,0,0,1,0,1|2,0,0]=4 2887 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-2143702379 [0,0,0,1,0,1|2,0,0]=4 2888 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-3730566868 [0,0,0,1,0,1|2,0,0]=4 2889 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-7974927719 [0,0,0,1,0,1|2,0,0]=4 2890 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-9806319171 [0,0,0,1,0,1|2,0,0]=4 2891 B10R1.266 CC(CC(=O)O)C1CCC1 MCULE-6722364184 [0,0,0,1,0,1|1,0,0]=3 2892 B10R1.266 CN(CC(=O)O)C1CCC1 MCULE-1496285495 [0,0,0,1,0,1|2,0,0]=4 2893 B10R1.266 NC(CC(=O)O)C1CCC1 MCULE-2395479190 [0,0,0,1,0,1|0,0,0]=2 2894 B10R1.266 NC(CC(=O)O)C1CCC1 MCULE-6970002304 [0,0,0,1,0,1|0,0,0]=2 2895 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-5065468951 [0,0,0,1,0,1|0,0,0]=2 2896 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-5782293460 [0,0,0,1,0,1|0,0,0]=2 2897 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-7296271886 [0,0,0,1,0,1|0,0,0]=2 2898 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-8027827308 [0,0,0,1,0,1|0,0,0]=2 2899 B10R1.475 C=C1OC(=O)OC1(C)CC MCULE-7115635798 [0,0,0,1,0,1|1,0,1]=4 2900 B10R1.475 CCC1(OC(=O)NC1=O)C MCULE-1221658185 [0,0,0,1,0,1|1,0,1]=4 2901 B10R1.31 C1(NC(CS1)C(=O)O)CC MCULE-6124427567 [0,0,0,1,0,1|2,0,0]=4 2902 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9089135115 [0,0,0,1,0,1|1,0,0]=3 2903 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9951781675 [0,0,0,1,0,1|1,0,0]=3 2904 B10R1.31 CCC1NC(CS1)C(=O)O MCULE-2037916598 [0,0,0,1,0,1|2,0,0]=4 2905 B10R1.31 CCN1CCC(C1)C(=O)O MCULE-6987605321 [0,0,0,1,0,1|2,0,0]=4 2906 B10R1.31 COC1CCC(C1)C(=O)O MCULE-5189432372 [0,0,0,1,0,1|2,0,0]=4 2907 B10R1.31 CO[C@@H]1CN[C@@H](C1)C(=O)O MCULE-2339543928 [0,0,0,1,0,1|1,0,0]=3 2908 B10R1.31 CO[C@H]1CC[C@@H](C1)C(=O)O MCULE-8255434197 [0,0,0,1,0,1|2,0,0]=4 2909 B10R1.31 CO[C@H]1CC[C@H](C1)C(=O)O MCULE-3942607370 [0,0,0,1,0,1|2,0,0]=4 2910 B10R1.31 CO[C@H]1CN[C@@H](C1)C(=O)O MCULE-2951589630 [0,0,0,1,0,1|1,0,0]=3 2911 B10R1.31 NC[C@@H]1CN[C@@H](C1)C(=O)O MCULE-2543185174 [0,0,0,1,0,1|1,0,0]=3 2912 B10R1.31 NC[C@@H]1CN[C@@H](C1)C(=O)O MCULE-5699643655 [0,0,0,1,0,1|1,0,0]=3 2913 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-7720743223 [0,0,0,1,0,1|2,0,0]=4 2914 B10R1.113 CC1CC(CCN1)C(=O)O MCULE-8584436669 [0,0,0,1,0,1|2,0,0]=4 2915 B10R1.113 CC1CC(CCO1)C(=O)O MCULE-8051149188 [0,0,0,1,0,1|2,0,0]=4 2916 B10R1.113 CC1CCCC(C1)C(=O)O MCULE-1709216331 [0,0,0,1,0,1|1,0,0]=3 2917 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-2752928027 [0,0,0,1,0,1|1,0,0]=3 2918 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7361502591 [0,0,0,1,0,1|1,0,0]=3 2919 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7906995060 [0,0,0,1,0,1|1,0,0]=3 2920 B10R1.113 CC1CCCC(O1)C(=O)O MCULE-2545962496 [0,0,0,1,0,1|1,0,0]=3 2921 B10R1.113 CC1CCNC(C1)C(=O)N MCULE-8372541866 [0,0,0,1,0,1|1,0,0]=3 2922 B10R1.113 CC1CCNC(C1)C(=O)O MCULE-7170086856 [0,0,0,1,0,1|0,0,0]=2 2923 B10R1.113 CC1CCNC(C1)C(C)O MCULE-6816426503 [0,0,0,1,0,1|1,0,1]=4 2924 B10R1.113 CC1CNCC(C1)C(=O)O MCULE-6208683659 [0,0,0,1,0,1|2,0,0]=4 2925 B10R1.113 CC1CNCC(O1)C(=O)O MCULE-4851002529 [0,0,0,1,0,1|2,0,0]=4 2926 B10R1.113 CC1COCC(N1)C(=O)O MCULE-6739051094 [0,0,0,1,0,1|2,0,0]=4 2927 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-2577677138 [0,0,0,1,0,1|2,0,0]=4 2928 B10R1.113 CN1CCCC(C1)C(=O)O MCULE-9093982856 [0,0,0,1,0,1|2,0,0]=4 2929 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3472059995 [0,0,0,1,0,1|2,0,0]=4 2930 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-3661518240 [0,0,0,1,0,1|2,0,0]=4 2931 B10R1.113 CN1CCC[C@@H](C1)C(=O)O MCULE-4244061094 [0,0,0,1,0,1|2,0,0]=4 2932 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-1368409828 [0,0,0,1,0,1|2,0,0]=4 2933 B10R1.113 CN1CCC[C@H](C1)C(=O)O MCULE-2079226353 [0,0,0,1,0,1|2,0,0]=4 2934 B10R1.113 CN1CCNC(C1)C(=O)N MCULE-3257789162 [0,0,0,1,0,1|2,0,0]=4 2935 B10R1.113 CN1CCNC(C1)C(=O)N MCULE-6597619500 [0,0,0,1,0,1|2,0,0]=4 2936 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-2247528725 [0,0,0,1,0,1|1,0,0]=3 2937 B10R1.113 CN1CCNC(C1)C(=O)O MCULE-9094338983 [0,0,0,1,0,1|1,0,0]=3 2938 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-5238925665 [0,0,0,1,0,1|1,0,0]=3 2939 B10R1.113 CN1CCN[C@@H](C1)C(=O)O MCULE-6341643779 [0,0,0,1,0,1|1,0,0]=3 2940 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-1518073789 [0,0,0,1,0,1|1,0,0]=3 2941 B10R1.113 CN1CCN[C@H](C1)C(=O)O MCULE-8312508233 [0,0,0,1,0,1|1,0,0]=3 2942 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-5046751827 [0,0,0,1,0,1|2,0,0]=4 2943 B10R1.113 CN1CCOC(C1)C(=O)O MCULE-8819512874 [0,0,0,1,0,1|2,0,0]=4 2944 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-4534640450 [0,0,0,1,0,1|1,0,0]=3 2945 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6827473516 [0,0,0,1,0,1|1,0,0]=3 2946 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6916060172 [0,0,0,1,0,1|1,0,0]=3 2947 B10R1.113 C[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2658835025 [0,0,0,1,0,1|1,0,0]=3 2948 B10R1.113 C[C@@H]1CCN[C@@H](C1)C(=O)O MCULE-6382189211 [0,0,0,1,0,1|0,0,0]=2 2949 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-3220705725 [0,0,0,1,0,1|0,0,0]=2 2950 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-4368703620 [0,0,0,1,0,1|0,0,0]=2 2951 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-5852226290 [0,0,0,1,0,1|0,0,0]=2 2952 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-8448888283 [0,0,0,1,0,1|0,0,0]=2 2953 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-6787897599 [0,0,0,1,0,1|2,0,0]=4 2954 B10R1.113 C[C@@H]1CNC[C@@H](C1)C(=O)O MCULE-7011808441 [0,0,0,1,0,1|2,0,0]=4 2955 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-1640808929 [0,0,0,1,0,1|2,0,0]=4 2956 B10R1.113 C[C@@H]1CNC[C@@H](O1)C(=O)O MCULE-5152957457 [0,0,0,1,0,1|2,0,0]=4 2957 B10R1.113 C[C@@H]1CNC[C@H](C1)C(=O)O MCULE-8762702780 [0,0,0,1,0,1|2,0,0]=4 2958 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-6500795104 [0,0,0,1,0,1|2,0,0]=4 2959 B10R1.113 C[C@@H]1C[C@@H](CCN1)C(=O)O MCULE-9135304432 [0,0,0,1,0,1|2,0,0]=4 2960 B10R1.113 C[C@H]1CCC[C@@H](C1)C(=O)O MCULE-2151963828 [0,0,0,1,0,1|1,0,0]=3 2961 B10R1.113 C[C@H]1CCC[C@H](C1)C(=O)O MCULE-9191189376 [0,0,0,1,0,1|1,0,0]=3 2962 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3797871093 [0,0,0,1,0,1|0,0,0]=2 2963 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3813657182 [0,0,0,1,0,1|0,0,0]=2 2964 B10R1.113 C[C@H]1CCN[C@H](C1)C(=O)O MCULE-8048617173 [0,0,0,1,0,1|0,0,0]=2 2965 B10R1.113 C[C@H]1CNC[C@@H](C1)C(=O)O MCULE-9182357479 [0,0,0,1,0,1|2,0,0]=4 2966 B10R1.113 C[C@H]1CNC[C@H](C1)C(=O)O MCULE-7208949681 [0,0,0,1,0,1|2,0,0]=4 2967 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-3777490064 [0,0,0,1,0,1|2,0,0]=4 2968 B10R1.113 C[C@H]1C[C@H](CCN1)C(=O)O MCULE-7587755997 [0,0,0,1,0,1|2,0,0]=4 2969 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-1721377644 [0,0,0,1,0,1|2,0,0]=4 2970 B10R1.113 NC1CCCC(C1)C(=O)O MCULE-3598251126 [0,0,0,1,0,1|2,0,0]=4 2971 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7071803947 [0,0,0,1,0,1|2,0,0]=4 2972 B10R1.113 NC1CCOC(C1)C(=O)O MCULE-7129710557 [0,0,0,1,0,1|2,0,0]=4 2973 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5563204448 [0,0,0,1,0,1|2,0,0]=4 2974 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-5798146682 [0,0,0,1,0,1|2,0,0]=4 2975 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-8105249419 [0,0,0,1,0,1|2,0,0]=4 2976 B10R1.113 N[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-9161171059 [0,0,0,1,0,1|2,0,0]=4 2977 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2713838733 [0,0,0,1,0,1|2,0,0]=4 2978 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2810146308 [0,0,0,1,0,1|2,0,0]=4 2979 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-3141762073 [0,0,0,1,0,1|2,0,0]=4 2980 B10R1.113 N[C@@H]1CCC[C@H](C1)C(=O)O MCULE-6970045085 [0,0,0,1,0,1|2,0,0]=4 2981 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-5264166397 [0,0,0,1,0,1|2,0,0]=4 2982 B10R1.113 N[C@@H]1CCO[C@H](C1)C(=O)O MCULE-6153195788 [0,0,0,1,0,1|2,0,0]=4 2983 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-3283868687 [0,0,0,1,0,1|2,0,0]=4 2984 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-5009823003 [0,0,0,1,0,1|2,0,0]=4 2985 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-6716939610 [0,0,0,1,0,1|2,0,0]=4 2986 B10R1.113 N[C@H]1CCC[C@@H](C1)C(=O)O MCULE-8264766500 [0,0,0,1,0,1|2,0,0]=4 2987 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-1016300044 [0,0,0,1,0,1|2,0,0]=4 2988 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-2730367375 [0,0,0,1,0,1|2,0,0]=4 2989 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3326410223 [0,0,0,1,0,1|2,0,0]=4 2990 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3370817462 [0,0,0,1,0,1|2,0,0]=4 2991 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-3467671648 [0,0,0,1,0,1|2,0,0]=4 2992 B10R1.113 N[C@H]1CCC[C@H](C1)C(=O)O MCULE-7929171022 [0,0,0,1,0,1|2,0,0]=4 2993 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-2758341308 [0,0,0,1,0,1|1,0,0]=3 2994 B10R1.113 O=C(O)C1CC(CCN1)O MCULE-7585455422 [0,0,0,1,0,1|1,0,0]=3 2995 B10R1.113 O=C(O)C1CCCC(C1)F MCULE-2589850350 [0,0,0,1,0,1|2,0,0]=4 2996 B10R1.113 O=C(O)C1CCCC(C1)O MCULE-9068909742 [0,0,0,1,0,1|2,0,0]=4 2997 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-2725116552 [0,0,0,1,0,1|2,0,0]=4 2998 B10R1.113 O=C(O)C1CS(=O)CCN1 MCULE-7493333189 [0,0,0,1,0,1|2,0,0]=4 2999 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-1509835362 [0,0,0,1,0,1|2,0,0]=4 3000 B10R1.113 O=C(O)[C@@H]1CCC[C@@H](C1)O MCULE-2282540668 [0,0,0,1,0,1|2,0,0]=4 3001 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-2678948022 [0,0,0,1,0,1|2,0,0]=4 3002 B10R1.113 O=C(O)[C@@H]1CCC[C@H](C1)O MCULE-6048774329 [0,0,0,1,0,1|2,0,0]=4 3003 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-1390000123 [0,0,0,1,0,1|1,0,0]=3 3004 B10R1.113 O=C(O)[C@@H]1C[C@@H](CCN1)O MCULE-5873942206 [0,0,0,1,0,1|1,0,0]=3 3005 B10R1.113 O=C(O)[C@@H]1C[C@H](CCN1)O MCULE-5317131791 [0,0,0,1,0,1|1,0,0]=3 3006 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-1308626340 [0,0,0,1,0,1|2,0,0]=4 3007 B10R1.113 O=C(O)[C@H]1CCC[C@@H](C1)O MCULE-5789638591 [0,0,0,1,0,1|2,0,0]=4 3008 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3370494896 [0,0,0,1,0,1|2,0,0]=4 3009 B10R1.113 O=C(O)[C@H]1CCC[C@H](C1)O MCULE-3728932412 [0,0,0,1,0,1|2,0,0]=4 3010 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1474484031 [0,0,0,1,0,1|1,0,0]=3 3011 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-1820373402 [0,0,0,1,0,1|1,0,0]=3 3012 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4771226737 [0,0,0,1,0,1|1,0,0]=3 3013 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-4907773186 [0,0,0,1,0,1|1,0,0]=3 3014 B10R1.113 O=C(O)[C@H]1C[C@@H](CCN1)O MCULE-8175624129 [0,0,0,1,0,1|1,0,0]=3 3015 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-4751772547 [0,0,0,1,0,1|1,0,0]=3 3016 B10R1.113 O=C(O)[C@H]1C[C@H](CCN1)O MCULE-6686826243 [0,0,0,1,0,1|1,0,0]=3 3017 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-6916176336 [0,0,0,1,0,1|1,0,1]=4 3018 B10R1.113 O=C1CCNC(C1)C(=O)O MCULE-9262761817 [0,0,0,1,0,1|1,0,1]=4 3019 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-1115212106 [0,0,0,1,0,1|1,0,1]=4 3020 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5896394571 [0,0,0,1,0,1|1,0,1]=4 3021 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-5937606037 [0,0,0,1,0,1|1,0,1]=4 3022 B10R1.113 O=C1CCN[C@@H](C1)C(=O)O MCULE-7073629862 [0,0,0,1,0,1|1,0,1]=4 3023 B10R1.113 [C@@H]1(CCCC(N1)C)C(=O)O MCULE-7930307305 [0,0,0,1,0,1|1,0,0]=3 3024 B10R1.113 [C@H]1(CCCN(C1)C)C(=O)O MCULE-4364645223 [0,0,0,1,0,1|2,0,0]=4 3025 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-2539251802 [0,0,0,1,0,1|2,0,0]=4 3026 B10R1.113 [C@H]1(CCC[C@H](C1)C(=O)O)N MCULE-4407634771 [0,0,0,1,0,1|2,0,0]=4 3027 B10R1.118 CC1NC(C(NC1=O)C)C MCULE-9730027586 [0,0,0,1,0,1|2,0,0]=4 3028 B10R1.203 CC1(N=N1)C[C@H](N)C(=O)O MCULE-2034050150 [0,0,0,1,0,1|2,0,0]=4 3029 B10R1.203 CC1(N=N1)C[C@H](N)C(=O)O MCULE-8922336030 [0,0,0,1,0,1|2,0,0]=4 3030 B10R1.204 CC(CC1CCC1)C(=O)O MCULE-9404107634 [0,0,0,1,0,1|1,0,0]=3 3031 B10R1.204 C[C@H](NC1CCC1)C(=O)O MCULE-7409631566 [0,0,0,1,0,1|1,0,0]=3 3032 B10R1.204 NC(=O)C(F)CC1CCC1 MCULE-6493382532 [0,0,0,1,0,1|2,0,0]=4 3033 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-3218968630 [0,0,0,1,0,1|0,0,0]=2 3034 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-4504908507 [0,0,0,1,0,1|0,0,0]=2 3035 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-9377321223 [0,0,0,1,0,1|0,0,0]=2 3036 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-1216111783 [0,0,0,1,0,1|0,0,0]=2 3037 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-5390134859 [0,0,0,1,0,1|0,0,0]=2 3038 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-5493935992 [0,0,0,1,0,1|0,0,0]=2 3039 B10R1.204 N[C@H](CC1CCC1)C(=O)O MCULE-3225528393 [0,0,0,1,0,1|0,0,0]=2 3040 B10R1.204 N[C@H](CC1CCC1)C(=O)O MCULE-7473428983 [0,0,0,1,0,1|0,0,0]=2 3041 B10R1.204 O=C(O)C(F)CC1CCC1 MCULE-4701098034 [0,0,0,1,0,1|1,0,0]=3 3042 B10R1.204 O=C(O)[C@H](O)CC1CCC1 MCULE-8975040339 [0,0,0,1,0,1|1,0,0]=3 3043 B10R1.235 CCC1(CC(C1)C(=O)O)F MCULE-9977538313 [0,0,0,1,0,1|2,0,0]=4 3044 B10R1.470 CC1(CCC(C1)N)C(=O)O MCULE-5009717504 [0,0,0,1,0,1|2,0,0]=4 3045 B10R1.470 CC1(CCC(C1)N)C(=O)O MCULE-6646895058 [0,0,0,1,0,1|2,0,0]=4 3046 B10R1.470 CC1CCC(C1)(C)C(=O)O MCULE-3638409630 [0,0,0,1,0,1|1,0,0]=3 3047 B10R1.470 CN1CCC(C1)(C)C(=O)O MCULE-3111826192 [0,0,0,1,0,1|2,0,0]=4 3048 B10R1.470 CN1CCC(C1)(F)C(=O)O MCULE-3877912842 [0,0,0,1,0,1|2,0,0]=4 3049 B10R1.470 NC1CCC(C1)(F)C(=O)O MCULE-1564321784 [0,0,0,1,0,1|2,0,0]=4 3050 B10R1.470 NC1CCC(C1)(F)C(=O)O MCULE-3542104690 [0,0,0,1,0,1|2,0,0]=4 3051 B10R1.490 CO[C@H]1C[C@](C1)(N)C(=O)O MCULE-7267565968 [0,0,0,1,0,1|1,0,0]=3 3052 B10R1.490 NC1(CC(C1)CO)C(=O)O MCULE-1855927879 [0,0,0,1,0,1|1,0,0]=3 3053 B10R1.490 N[C@@]1(C[C@H](C1)CO)C(=O)O MCULE-2462435991 [0,0,0,1,0,1|1,0,0]=3 3054 B10R1.23 CC(C(=O)O)C1CCCC1 MCULE-5802736245 [0,1,0,1,0,0|1,0,0]=3 3055 B10R1.23 CC(C(=O)O)C1CCCO1 MCULE-7845267101 [0,1,0,1,0,0|1,0,0]=3 3056 B10R1.23 CC(C(=O)O)C1CCOC1 MCULE-7866218529 [0,1,0,1,0,0|1,0,0]=3 3057 B10R1.23 CC(C(=O)O)N1CCCC1 MCULE-1089880160 [0,1,0,1,0,0|2,0,0]=4 3058 B10R1.23 CC(C(=O)O)N1CCCC1 MCULE-6643699902 [0,1,0,1,0,0|2,0,0]=4 3059 B10R1.23 CC(C(=O)O)N1CCCC1 MCULE-9316791928 [0,1,0,1,0,0|2,0,0]=4 3060 B10R1.23 C[C@@H](C(=O)O)N1CCCC1 MCULE-3614375066 [0,1,0,1,0,0|2,0,0]=4 3061 B10R1.23 C[C@@H](C(=O)O)N1CCCC1 MCULE-3855579270 [0,1,0,1,0,0|2,0,0]=4 3062 B10R1.23 C[C@H](C(=O)O)N1CCCC1 MCULE-8338161515 [0,1,0,1,0,0|2,0,0]=4 3063 B10R1.23 C[C@H](C(=O)O)N1CCCC1 MCULE-8839356147 [0,1,0,1,0,0|2,0,0]=4 3064 B10R1.23 NC(=O)C(F)C1CCCC1 MCULE-2132325699 [0,1,0,1,0,0|2,0,0]=4 3065 B10R1.23 NC(=O)C(N)C1CCCC1 MCULE-5304987336 [0,1,0,1,0,0|1,0,0]=3 3066 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-7146175523 [0,1,0,1,0,0|0,0,0]=2 3067 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-7746486136 [0,1,0,1,0,0|0,0,0]=2 3068 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-9888348666 [0,1,0,1,0,0|0,0,0]=2 3069 B10R1.23 NC(C(=O)O)C1CCCO1 MCULE-3670924700 [0,1,0,1,0,0|0,0,0]=2 3070 B10R1.23 NC(C(=O)O)C1CCNC1 MCULE-1642984994 [0,1,0,1,0,0|0,0,0]=2 3071 B10R1.23 NC(C(=O)O)C1CCNC1 MCULE-8012924580 [0,1,0,1,0,0|0,0,0]=2 3072 B10R1.23 NC(C(=O)O)C1CCOC1 MCULE-9063647673 [0,1,0,1,0,0|0,0,0]=2 3073 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 MCULE-2078695461 [0,1,0,1,0,0|0,0,0]=2 3074 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 MCULE-7548517913 [0,1,0,1,0,0|0,0,0]=2 3075 B10R1.23 N[C@H](C(=O)O)C1CCCC1 MCULE-1391706498 [0,1,0,1,0,0|0,0,0]=2 3076 B10R1.23 N[C@H](C(=O)O)C1CCCC1 MCULE-5447481000 [0,1,0,1,0,0|0,0,0]=2 3077 B10R1.23 O=C(O)C(=O)C1CCCC1 MCULE-3971745471 [0,1,0,1,0,0|1,0,1]=4 3078 B10R1.23 O=C(O)C(=O)C1CCOC1 MCULE-9419104810 [0,1,0,1,0,0|1,0,1]=4 3079 B10R1.23 O=C(O)C(Br)C1CCCC1 MCULE-1051918450 [0,1,0,1,0,0|1,0,0]=3 3080 B10R1.23 O=C(O)C(F)C1CCCC1 MCULE-8637303916 [0,1,0,1,0,0|1,0,0]=3 3081 B10R1.23 O=C(O)C(F)C1CCOC1 MCULE-4380204267 [0,1,0,1,0,0|1,0,0]=3 3082 B10R1.23 O=C(O)C(O)C1CCCC1 MCULE-1471598195 [0,1,0,1,0,0|1,0,0]=3 3083 B10R1.23 O=C(O)C(O)C1CCNC1 MCULE-8304713060 [0,1,0,1,0,0|1,0,0]=3 3084 B10R1.23 O=C(O)[C@@H](Br)C1CCCC1 MCULE-6560406332 [0,1,0,1,0,0|1,0,0]=3 3085 B10R1.23 O=C(O)[C@H](O)C1CCCC1 MCULE-1883242923 [0,1,0,1,0,0|1,0,0]=3 3086 B10R1.34 O=C1OC(C(C1O)O)CO MCULE-4992937478 [0,1,0,1,0,0|2,0,0]=4 3087 B10R1.34 O=C1O[C@@H]([C@@H]([C@@H]1O)O)CO MCULE-4238222743 [0,1,0,1,0,0|2,0,0]=4 3088 B10R1.34 O=C1O[C@@H]([C@@H]([C@@H]1O)O)CO MCULE-8746085882 [0,1,0,1,0,0|2,0,0]=4 3089 B10R1.34 O=C1O[C@@H]([C@@H]([C@H]1O)O)CO MCULE-1302555586 [0,1,0,1,0,0|2,0,0]=4 3090 B10R1.34 O=C1O[C@@H]([C@@H]([C@H]1O)O)CO MCULE-6947519194 [0,1,0,1,0,0|2,0,0]=4 3091 B10R1.34 O=C1O[C@@H]([C@H]([C@@H]1O)O)CO MCULE-3419728176 [0,1,0,1,0,0|2,0,0]=4 3092 B10R1.34 O=C1O[C@@H]([C@H]([C@H]1F)O)CO MCULE-9538867890 [0,1,0,1,0,0|2,0,0]=4 3093 B10R1.34 O=C1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-1946078293 [0,1,0,1,0,0|2,0,0]=4 3094 B10R1.34 O=C1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-4119913524 [0,1,0,1,0,0|2,0,0]=4 3095 B10R1.34 O=C1O[C@@H]([C@H]([C@H]1O)O)CO MCULE-7655191062 [0,1,0,1,0,0|2,0,0]=4 3096 B10R1.34 O=C1O[C@H]([C@@H]([C@@H]1O)O)CO MCULE-9668504351 [0,1,0,1,0,0|2,0,0]=4 3097 B10R1.34 O=C1O[C@H]([C@@H]([C@H]1O)O)CO MCULE-2196473829 [0,1,0,1,0,0|2,0,0]=4 3098 B10R1.34 O=C1O[C@H]([C@@H]([C@H]1O)O)CO MCULE-2293188422 [0,1,0,1,0,0|2,0,0]=4 3099 B10R1.34 O=C1O[C@H]([C@H]([C@H]1O)O)CO MCULE-7094668506 [0,1,0,1,0,0|2,0,0]=4 3100 B10R1.34 O=C1O[C@H]([C@H]([C@H]1O)O)CO MCULE-8957458384 [0,1,0,1,0,0|2,0,0]=4 3101 B10R1.59 CC1CC(=O)NC1C(=O)O MCULE-1142843058 [0,1,0,1,0,0|0,0,1]=3 3102 B10R1.59 CC1CC(C(O1)C(=O)O)C MCULE-6609295709 [0,1,0,1,0,0|1,0,0]=3 3103 B10R1.59 CC1CC(C(O1)C)C(=O)O MCULE-4495071251 [0,1,0,1,0,0|1,0,0]=3 3104 B10R1.59 CC1CC(N(C1)C)C(=O)O MCULE-1544526499 [0,1,0,1,0,0|2,0,0]=4 3105 B10R1.59 CC1CC(N(C1)C)C(=O)O MCULE-4035906246 [0,1,0,1,0,0|2,0,0]=4 3106 B10R1.59 CC1OC(=O)NC1C(=O)O MCULE-7595794618 [0,1,0,1,0,0|1,0,1]=4 3107 B10R1.59 CN1CC(CC1C(=O)O)N MCULE-7362090633 [0,1,0,1,0,0|2,0,0]=4 3108 B10R1.59 CN1CC(CC1C(=O)O)O MCULE-6963505872 [0,1,0,1,0,0|2,0,0]=4 3109 B10R1.59 CN1C[C@@H](C[C@@H]1C(=O)O)O MCULE-7645006550 [0,1,0,1,0,0|2,0,0]=4 3110 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)F MCULE-1701571164 [0,1,0,1,0,0|2,0,0]=4 3111 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)F MCULE-3801669792 [0,1,0,1,0,0|2,0,0]=4 3112 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)O MCULE-4289101461 [0,1,0,1,0,0|2,0,0]=4 3113 B10R1.59 CN1C[C@@H](C[C@H]1C(=O)O)O MCULE-5652344615 [0,1,0,1,0,0|2,0,0]=4 3114 B10R1.59 CN1C[C@H](C[C@@H]1C(=O)O)O MCULE-4231676044 [0,1,0,1,0,0|2,0,0]=4 3115 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)N MCULE-7565756526 [0,1,0,1,0,0|2,0,0]=4 3116 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)N MCULE-8931908939 [0,1,0,1,0,0|2,0,0]=4 3117 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)O MCULE-2551559641 [0,1,0,1,0,0|2,0,0]=4 3118 B10R1.59 CN1C[C@H](C[C@H]1C(=O)O)O MCULE-4981449681 [0,1,0,1,0,0|2,0,0]=4 3119 B10R1.59 C[C@@H]1CC(=O)N[C@@H]1C(=O)O MCULE-5687745727 [0,1,0,1,0,0|0,0,1]=3 3120 B10R1.59 C[C@@H]1CC(=O)N[C@H]1C(=O)O MCULE-3978079245 [0,1,0,1,0,0|0,0,1]=3 3121 B10R1.59 C[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-3249388528 [0,1,0,1,0,0|2,0,0]=4 3122 B10R1.59 C[C@@H]1C[C@H](N(C1)C)C(=O)O MCULE-5892295670 [0,1,0,1,0,0|2,0,0]=4 3123 B10R1.59 C[C@H]1CC(=O)N[C@@H]1C(=O)O MCULE-1352855018 [0,1,0,1,0,0|0,0,1]=3 3124 B10R1.59 C[C@H]1CC(=O)N[C@H]1C(=O)O MCULE-6205979547 [0,1,0,1,0,0|0,0,1]=3 3125 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1379494499 [0,1,0,1,0,0|2,0,0]=4 3126 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1502363575 [0,1,0,1,0,0|2,0,0]=4 3127 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-1565262465 [0,1,0,1,0,0|2,0,0]=4 3128 B10R1.59 C[C@H]1C[C@H](N(C1)C)C(=O)O MCULE-4515635703 [0,1,0,1,0,0|2,0,0]=4 3129 B10R1.59 [C@H]1(C[C@H](CN1C)C)C(=O)O MCULE-6457651208 [0,1,0,1,0,0|2,0,0]=4 3130 B10R1.61 CC(=O)C1CCCCC1C MCULE-9283684652 [0,1,0,1,0,0|2,0,0]=4 3131 B10R1.61 CC(=O)C1NCCCC1C MCULE-2230049407 [0,1,0,1,0,0|1,0,0]=3 3132 B10R1.61 CC(=O)C1NCCCC1C MCULE-8677498528 [0,1,0,1,0,0|1,0,0]=3 3133 B10R1.61 CC1CC=CCC1C(=O)O MCULE-9141456284 [0,1,0,1,0,0|1,0,1]=4 3134 B10R1.61 CC1CCCC=C1C(=O)O MCULE-2002913109 [0,1,0,1,0,0|1,0,1]=4 3135 B10R1.61 CC1CCCCC1C(=O)Cl MCULE-7597713129 [0,1,0,1,0,0|2,0,0]=4 3136 B10R1.61 CC1CCCCC1C(=O)O MCULE-3305682191 [0,1,0,1,0,0|1,0,0]=3 3137 B10R1.61 CC1CCCNC1C(=O)N MCULE-8821146640 [0,1,0,1,0,0|1,0,0]=3 3138 B10R1.61 CC1CCNCC1C(=O)O MCULE-8748624987 [0,1,0,1,0,0|0,0,0]=2 3139 B10R1.61 CC1CCNCC1C(=O)O MCULE-9934986088 [0,1,0,1,0,0|0,0,0]=2 3140 B10R1.61 CC1CNCCC1C(=O)O MCULE-4662714630 [0,1,0,1,0,0|1,0,0]=3 3141 B10R1.61 CC1CNCCC1C(=O)O MCULE-7019458300 [0,1,0,1,0,0|1,0,0]=3 3142 B10R1.61 CC1COCCC1C(=O)O MCULE-3541844170 [0,1,0,1,0,0|1,0,0]=3 3143 B10R1.61 CC1NCCCC1C(=O)O MCULE-1657397096 [0,1,0,1,0,0|1,0,0]=3 3144 B10R1.61 CC1NCCCC1C(=O)O MCULE-3297923255 [0,1,0,1,0,0|1,0,0]=3 3145 B10R1.61 CC1OCCCC1C(=O)O MCULE-1412449239 [0,1,0,1,0,0|1,0,0]=3 3146 B10R1.61 CC1OCCNC1C(=O)O MCULE-7650728786 [0,1,0,1,0,0|0,0,0]=2 3147 B10R1.61 CC1OCCNC1C(=O)O MCULE-7980002158 [0,1,0,1,0,0|0,0,0]=2 3148 B10R1.61 CN1CCCCC1C(=O)O MCULE-3456275150 [0,1,0,1,0,0|2,0,0]=4 3149 B10R1.61 CN1CCCCC1C(=O)O MCULE-6372652181 [0,1,0,1,0,0|2,0,0]=4 3150 B10R1.61 CN1CCCCC1C(=O)O MCULE-7834522939 [0,1,0,1,0,0|2,0,0]=4 3151 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2245294368 [0,1,0,1,0,0|2,0,0]=4 3152 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-2258119449 [0,1,0,1,0,0|2,0,0]=4 3153 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-4757725445 [0,1,0,1,0,0|2,0,0]=4 3154 B10R1.61 CN1CCCC[C@@H]1C(=O)O MCULE-9648696079 [0,1,0,1,0,0|2,0,0]=4 3155 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5396822712 [0,1,0,1,0,0|2,0,0]=4 3156 B10R1.61 CN1CCCC[C@H]1C(=O)O MCULE-5529863786 [0,1,0,1,0,0|2,0,0]=4 3157 B10R1.61 CN1CCNCC1C(=O)N MCULE-5869045526 [0,1,0,1,0,0|2,0,0]=4 3158 B10R1.61 CN1CCNCC1C(=O)N MCULE-6913155408 [0,1,0,1,0,0|2,0,0]=4 3159 B10R1.61 CN1CCNCC1C(=O)O MCULE-1461373192 [0,1,0,1,0,0|1,0,0]=3 3160 B10R1.61 CN1CCNCC1C(=O)O MCULE-2314108697 [0,1,0,1,0,0|1,0,0]=3 3161 B10R1.61 CN1CCNCC1C(=O)O MCULE-6876364616 [0,1,0,1,0,0|1,0,0]=3 3162 B10R1.61 CN1CCNC[C@@H]1C(=O)O MCULE-6844980804 [0,1,0,1,0,0|1,0,0]=3 3163 B10R1.61 CN1CCNC[C@@H]1C(=O)O MCULE-9108769184 [0,1,0,1,0,0|1,0,0]=3 3164 B10R1.61 CN1CCNC[C@H]1C(=O)O MCULE-5706230528 [0,1,0,1,0,0|1,0,0]=3 3165 B10R1.61 CN1CCNC[C@H]1C(=O)O MCULE-6493932779 [0,1,0,1,0,0|1,0,0]=3 3166 B10R1.61 CN1CCOCC1C(=O)O MCULE-3133710690 [0,1,0,1,0,0|2,0,0]=4 3167 B10R1.61 CN1CCOCC1C(=O)O MCULE-3290676693 [0,1,0,1,0,0|2,0,0]=4 3168 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-1062473078 [0,1,0,1,0,0|2,0,0]=4 3169 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-1353468073 [0,1,0,1,0,0|2,0,0]=4 3170 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-2754171059 [0,1,0,1,0,0|2,0,0]=4 3171 B10R1.61 CN1CCOC[C@@H]1C(=O)O MCULE-8165717473 [0,1,0,1,0,0|2,0,0]=4 3172 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-4042448961 [0,1,0,1,0,0|2,0,0]=4 3173 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-4563667791 [0,1,0,1,0,0|2,0,0]=4 3174 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-6824999437 [0,1,0,1,0,0|2,0,0]=4 3175 B10R1.61 CN1CCOC[C@H]1C(=O)O MCULE-9114074540 [0,1,0,1,0,0|2,0,0]=4 3176 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-1327276849 [0,1,0,1,0,0|1,0,0]=3 3177 B10R1.61 C[C@@H]1CCCN[C@@H]1C(=O)N MCULE-3578282795 [0,1,0,1,0,0|1,0,0]=3 3178 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-5453839569 [0,1,0,1,0,0|1,0,0]=3 3179 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-8712948607 [0,1,0,1,0,0|1,0,0]=3 3180 B10R1.61 C[C@@H]1NCCC[C@H]1C(=O)O MCULE-4097586923 [0,1,0,1,0,0|1,0,0]=3 3181 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-5754974970 [0,1,0,1,0,0|0,0,0]=2 3182 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-9389286375 [0,1,0,1,0,0|0,0,0]=2 3183 B10R1.61 C[C@H]1NCCC[C@@H]1C(=O)O MCULE-1705027594 [0,1,0,1,0,0|1,0,0]=3 3184 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8221283836 [0,1,0,1,0,0|1,0,0]=3 3185 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8542699735 [0,1,0,1,0,0|1,0,0]=3 3186 B10R1.61 C[C@H]1OCCC[C@H]1C(=O)O MCULE-9860065784 [0,1,0,1,0,0|1,0,0]=3 3187 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-1879170734 [0,1,0,1,0,0|0,0,0]=2 3188 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4061314927 [0,1,0,1,0,0|0,0,0]=2 3189 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4489336660 [0,1,0,1,0,0|0,0,0]=2 3190 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4667134552 [0,1,0,1,0,0|0,0,0]=2 3191 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-5449945964 [0,1,0,1,0,0|0,0,0]=2 3192 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-7387257453 [0,1,0,1,0,0|0,0,0]=2 3193 B10R1.61 NC1CCCCC1C(=O)O MCULE-4736252154 [0,1,0,1,0,0|2,0,0]=4 3194 B10R1.61 NC1CCCCC1C(=O)O MCULE-6203238767 [0,1,0,1,0,0|2,0,0]=4 3195 B10R1.61 NC1COCCC1C(=O)O MCULE-3475622537 [0,1,0,1,0,0|2,0,0]=4 3196 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-1790728170 [0,1,0,1,0,0|2,0,0]=4 3197 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-3150171920 [0,1,0,1,0,0|2,0,0]=4 3198 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-4600025587 [0,1,0,1,0,0|2,0,0]=4 3199 B10R1.61 N[C@@H]1CCCC[C@@H]1C(=O)O MCULE-9708582870 [0,1,0,1,0,0|2,0,0]=4 3200 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-3088249896 [0,1,0,1,0,0|2,0,0]=4 3201 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-4663931442 [0,1,0,1,0,0|2,0,0]=4 3202 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-6017464144 [0,1,0,1,0,0|2,0,0]=4 3203 B10R1.61 N[C@@H]1CCCC[C@H]1C(=O)O MCULE-9507759371 [0,1,0,1,0,0|2,0,0]=4 3204 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-2040720562 [0,1,0,1,0,0|2,0,0]=4 3205 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-5411687824 [0,1,0,1,0,0|2,0,0]=4 3206 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-6353451287 [0,1,0,1,0,0|2,0,0]=4 3207 B10R1.61 N[C@H]1CCCC[C@@H]1C(=O)O MCULE-9744443114 [0,1,0,1,0,0|2,0,0]=4 3208 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-1070315128 [0,1,0,1,0,0|2,0,0]=4 3209 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-2665445473 [0,1,0,1,0,0|2,0,0]=4 3210 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-5776301031 [0,1,0,1,0,0|2,0,0]=4 3211 B10R1.61 N[C@H]1CCCC[C@H]1C(=O)O MCULE-7183400727 [0,1,0,1,0,0|2,0,0]=4 3212 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-4608934385 [0,1,0,1,0,0|2,0,0]=4 3213 B10R1.61 N[C@H]1COCC[C@H]1C(=O)O MCULE-7590284479 [0,1,0,1,0,0|2,0,0]=4 3214 B10R1.61 O=C(O)C1CCCCC1F MCULE-9495362772 [0,1,0,1,0,0|2,0,0]=4 3215 B10R1.61 O=C(O)C1CCCCC1O MCULE-4502285714 [0,1,0,1,0,0|2,0,0]=4 3216 B10R1.61 O=C(O)C1CCNCC1F MCULE-5749357486 [0,1,0,1,0,0|2,0,0]=4 3217 B10R1.61 O=C(O)C1CCNCC1F MCULE-7431262807 [0,1,0,1,0,0|2,0,0]=4 3218 B10R1.61 O=C(O)C1CNCCC1=O MCULE-3624462455 [0,1,0,1,0,0|1,0,1]=4 3219 B10R1.61 O=C(O)C1NCCCC1O MCULE-2981139992 [0,1,0,1,0,0|1,0,0]=3 3220 B10R1.61 O=C(O)C1NCCNC1=O MCULE-5861499693 [0,1,0,1,0,0|1,0,1]=4 3221 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-2224593354 [0,1,0,1,0,0|1,0,0]=3 3222 B10R1.61 O=C(O)[C@@H]1NCCC[C@H]1O MCULE-3743184576 [0,1,0,1,0,0|1,0,0]=3 3223 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-2137327596 [0,1,0,1,0,0|1,0,0]=3 3224 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3028221093 [0,1,0,1,0,0|1,0,0]=3 3225 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-3468221525 [0,1,0,1,0,0|1,0,0]=3 3226 B10R1.61 O=C(O)[C@H]1NCCC[C@@H]1O MCULE-5449397815 [0,1,0,1,0,0|1,0,0]=3 3227 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-2786788134 [0,1,0,1,0,0|1,0,0]=3 3228 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-3262303247 [0,1,0,1,0,0|1,0,0]=3 3229 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4026886814 [0,1,0,1,0,0|1,0,0]=3 3230 B10R1.61 O=C(O)[C@H]1NCCC[C@H]1O MCULE-4165843552 [0,1,0,1,0,0|1,0,0]=3 3231 B10R1.86 C1(CCN1CCC)C(=O)O MCULE-6068820697 [0,1,0,1,0,0|2,0,0]=4 3232 B10R1.86 C1(CCN1CCF)C(=O)O MCULE-2135962737 [0,1,0,1,0,0|2,0,0]=4 3233 B10R1.86 CCCN1CCC1C(=O)O MCULE-3134623791 [0,1,0,1,0,0|2,0,0]=4 3234 B10R1.86 CCCN1CC[C@H]1C(=O)O MCULE-3091851598 [0,1,0,1,0,0|2,0,0]=4 3235 B10R1.86 CCCN1CC[C@H]1C(=O)O MCULE-5611349990 [0,1,0,1,0,0|2,0,0]=4 3236 B10R1.86 O=C(O)[C@@H]1CCN1CCF MCULE-3445864469 [0,1,0,1,0,0|2,0,0]=4 3237 B10R1.86 [C@H]1(CCN1CCF)C(=O)O MCULE-3345473633 [0,1,0,1,0,0|2,0,0]=4 3238 B10R1.278 CC(C1CC1)C(N)C(=O)O MCULE-4997364057 [0,1,0,1,0,0|0,0,0]=2 3239 B10R1.278 CC(C1CC1)C(N)C(=O)O MCULE-9996915560 [0,1,0,1,0,0|0,0,0]=2 3240 B10R1.291 CC1CCCC1(C)C(=O)O MCULE-3149463709 [0,1,0,1,0,0|1,0,0]=3 3241 B10R1.291 CC1OCCC1(C)C(=O)O MCULE-4774939870 [0,1,0,1,0,0|1,0,0]=3 3242 B10R1.291 CN1CCCC1(C)C(=O)O MCULE-3073966944 [0,1,0,1,0,0|2,0,0]=4 3243 B10R1.291 CN1CCC[C@@]1(C)C(=O)O MCULE-3527940712 [0,1,0,1,0,0|2,0,0]=4 3244 B10R1.291 CN1CCC[C@]1(C)C(=O)O MCULE-2144267845 [0,1,0,1,0,0|2,0,0]=4 3245 B10R1.291 C[C@]1(CCC[C@@H]1N)C(=O)O MCULE-2571628010 [0,1,0,1,0,0|2,0,0]=4 3246 B10R1.291 C[C@]1(CCC[C@@H]1N)C(=O)O MCULE-3056122824 [0,1,0,1,0,0|2,0,0]=4 3247 B10R1.495 CC(C(=O)O)C1(CCC1)O MCULE-2874864037 [0,1,0,1,0,0|1,0,0]=3 3248 B10R1.495 CC1(COC1)C(N)C(=O)O MCULE-3054998452 [0,1,0,1,0,0|0,0,0]=2 3249 B10R1.495 CC1(COC1)[C@H](N)C(=O)O MCULE-3689733091 [0,1,0,1,0,0|0,0,0]=2 3250 B10R1.495 O=C(O)C(O)C1(CCC1)O MCULE-5858632598 [0,1,0,1,0,0|1,0,0]=3 3251 B10R1.119 CC1CCC(C(C1=O)C)C MCULE-4588148046 [0,1,0,1,0,0|2,0,0]=4 3252 B10R1.149 COC(=O)C1CCCC1N MCULE-1292074679 [0,1,0,1,0,0|2,0,0]=4 3253 B10R1.149 COC(=O)C1CCCC1N MCULE-1475645605 [0,1,0,1,0,0|2,0,0]=4 3254 B10R1.149 COC(=O)C1CCCC1O MCULE-3674845958 [0,1,0,1,0,0|2,0,0]=4 3255 B10R1.149 COC(=O)C1CCCN1C MCULE-4362840235 [0,1,0,1,0,0|2,0,0]=4 3256 B10R1.149 COC(=O)C1CCCN1C MCULE-5596975421 [0,1,0,1,0,0|2,0,0]=4 3257 B10R1.149 COC(=O)C1CCNC1C MCULE-8241817730 [0,1,0,1,0,0|2,0,0]=4 3258 B10R1.149 COC(=O)C1CCNC1C MCULE-8840385748 [0,1,0,1,0,0|2,0,0]=4 3259 B10R1.149 COC(=O)C1CCOC1C MCULE-1899362431 [0,1,0,1,0,0|2,0,0]=4 3260 B10R1.149 COC(=O)C1CNCC1C MCULE-7210179317 [0,1,0,1,0,0|2,0,0]=4 3261 B10R1.149 COC(=O)C1CNCC1C MCULE-8278654714 [0,1,0,1,0,0|2,0,0]=4 3262 B10R1.149 COC(=O)C1NCCC1C MCULE-2145747628 [0,1,0,1,0,0|0,0,0]=2 3263 B10R1.149 COC(=O)C1NCCC1O MCULE-7668238984 [0,1,0,1,0,0|1,0,0]=3 3264 B10R1.149 COC(=O)C1NCCC1O MCULE-8444325552 [0,1,0,1,0,0|1,0,0]=3 3265 B10R1.149 COC(=O)[C@@H]1CCCN1C MCULE-1885742091 [0,1,0,1,0,0|2,0,0]=4 3266 B10R1.149 COC(=O)[C@@H]1CCCN1C MCULE-9974114171 [0,1,0,1,0,0|2,0,0]=4 3267 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-2645143657 [0,1,0,1,0,0|2,0,0]=4 3268 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-7497757726 [0,1,0,1,0,0|2,0,0]=4 3269 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-8238495714 [0,1,0,1,0,0|2,0,0]=4 3270 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-9068401272 [0,1,0,1,0,0|2,0,0]=4 3271 B10R1.149 COC(=O)[C@@H]1CCC[C@@H]1N MCULE-9532295626 [0,1,0,1,0,0|2,0,0]=4 3272 B10R1.149 COC(=O)[C@@H]1CCC[C@H]1N MCULE-8649678944 [0,1,0,1,0,0|2,0,0]=4 3273 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C MCULE-2548615141 [0,1,0,1,0,0|2,0,0]=4 3274 B10R1.149 COC(=O)[C@@H]1CNC[C@H]1C MCULE-6985668415 [0,1,0,1,0,0|2,0,0]=4 3275 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1C MCULE-6327833377 [0,1,0,1,0,0|0,0,0]=2 3276 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-3563774658 [0,1,0,1,0,0|1,0,0]=3 3277 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-4025671364 [0,1,0,1,0,0|1,0,0]=3 3278 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-4085872822 [0,1,0,1,0,0|1,0,0]=3 3279 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1O MCULE-5987049143 [0,1,0,1,0,0|1,0,0]=3 3280 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1C MCULE-8404202430 [0,1,0,1,0,0|0,0,0]=2 3281 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-7580132055 [0,1,0,1,0,0|1,0,0]=3 3282 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-8046366255 [0,1,0,1,0,0|1,0,0]=3 3283 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-8054998969 [0,1,0,1,0,0|1,0,0]=3 3284 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1O MCULE-9150462314 [0,1,0,1,0,0|1,0,0]=3 3285 B10R1.149 COC(=O)[C@H]1CCCN1C MCULE-4739167857 [0,1,0,1,0,0|2,0,0]=4 3286 B10R1.149 COC(=O)[C@H]1CCCN1C MCULE-5685325244 [0,1,0,1,0,0|2,0,0]=4 3287 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N MCULE-1925401143 [0,1,0,1,0,0|2,0,0]=4 3288 B10R1.149 COC(=O)[C@H]1CCC[C@@H]1N MCULE-3666883935 [0,1,0,1,0,0|2,0,0]=4 3289 B10R1.149 COC(=O)[C@H]1CCC[C@H]1N MCULE-2108800799 [0,1,0,1,0,0|2,0,0]=4 3290 B10R1.149 COC(=O)[C@H]1CCC[C@H]1N MCULE-9702061223 [0,1,0,1,0,0|2,0,0]=4 3291 B10R1.149 COC(=O)[C@H]1CCC[C@H]1O MCULE-9551218859 [0,1,0,1,0,0|2,0,0]=4 3292 B10R1.149 COC(=O)[C@H]1CCN[C@@H]1C MCULE-2992960189 [0,1,0,1,0,0|2,0,0]=4 3293 B10R1.149 COC(=O)[C@H]1CCN[C@@H]1C MCULE-9449255589 [0,1,0,1,0,0|2,0,0]=4 3294 B10R1.149 COC(=O)[C@H]1CCN[C@H]1C MCULE-1719318949 [0,1,0,1,0,0|2,0,0]=4 3295 B10R1.149 COC(=O)[C@H]1CCN[C@H]1C MCULE-7330244444 [0,1,0,1,0,0|2,0,0]=4 3296 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-1764804596 [0,1,0,1,0,0|2,0,0]=4 3297 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-2864244140 [0,1,0,1,0,0|2,0,0]=4 3298 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-5987586809 [0,1,0,1,0,0|2,0,0]=4 3299 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-8761929916 [0,1,0,1,0,0|2,0,0]=4 3300 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-8926066537 [0,1,0,1,0,0|2,0,0]=4 3301 B10R1.149 COC(=O)[C@H]1CNC[C@@H]1C MCULE-9572268200 [0,1,0,1,0,0|2,0,0]=4 3302 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1C MCULE-6874278829 [0,1,0,1,0,0|0,0,0]=2 3303 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-1707749919 [0,1,0,1,0,0|1,0,0]=3 3304 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-2162736804 [0,1,0,1,0,0|1,0,0]=3 3305 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-2328775326 [0,1,0,1,0,0|1,0,0]=3 3306 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1O MCULE-6152782400 [0,1,0,1,0,0|1,0,0]=3 3307 B10R1.149 COC(=O)[C@H]1NCC[C@H]1C MCULE-1156779891 [0,1,0,1,0,0|0,0,0]=2 3308 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-3447587166 [0,1,0,1,0,0|1,0,0]=3 3309 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-5783585395 [0,1,0,1,0,0|1,0,0]=3 3310 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-7552928230 [0,1,0,1,0,0|1,0,0]=3 3311 B10R1.149 COC(=O)[C@H]1NCC[C@H]1O MCULE-8961364493 [0,1,0,1,0,0|1,0,0]=3 3312 B10R1.149 C[C@H]1CNC[C@@H]1C(=O)CO MCULE-2509682466 [0,1,0,1,0,0|2,0,0]=4 3313 B10R1.149 [C@@H]1(CCN[C@@H]1C(=O)OC)O MCULE-3575931306 [0,1,0,1,0,0|1,0,0]=3 3314 B10R1.149 [C@@H]1(CCN[C@@H]1C(=O)OC)O MCULE-5233829978 [0,1,0,1,0,0|1,0,0]=3 3315 B10R1.149 [C@@H]1(NCC[C@H]1O)C(=O)OC MCULE-4044407927 [0,1,0,1,0,0|1,0,0]=3 3316 B10R1.149 [C@@H]1(NCC[C@H]1O)C(=O)OC MCULE-7536456993 [0,1,0,1,0,0|1,0,0]=3 3317 B10R1.159 C=CC1CC1(N)C(=O)OC MCULE-1931253124 [0,1,0,1,0,0|0,0,2]=4 3318 B10R1.159 C=CC1CC1(N)C(=O)OC MCULE-2304764422 [0,1,0,1,0,0|0,0,2]=4 3319 B10R1.159 C=C[C@@H]1C[C@@]1(N)C(=O)OC MCULE-2530802578 [0,1,0,1,0,0|0,0,2]=4 3320 B10R1.159 C=C[C@@H]1C[C@]1(N)C(=O)OC MCULE-3335452130 [0,1,0,1,0,0|0,0,2]=4 3321 B10R1.159 C=C[C@@H]1C[C@]1(N)C(=O)OC MCULE-9644253631 [0,1,0,1,0,0|0,0,2]=4 3322 B10R1.159 C=C[C@@H]1C[C@]1(N)C(=O)OC MCULE-9815536324 [0,1,0,1,0,0|0,0,2]=4 3323 B10R1.159 CCC1CC1(N)C(=O)OC MCULE-7541504397 [0,1,0,1,0,0|0,0,0]=2 3324 B10R1.175 COC(=O)C1CCC1CO MCULE-4671679944 [0,1,0,1,0,0|2,0,0]=4 3325 B10R1.182 COC(=O)C(N)C1CCC1 MCULE-3063876554 [0,1,0,1,0,0|0,0,0]=2 3326 B10R1.182 COC(=O)C(N)C1CCC1 MCULE-3740715014 [0,1,0,1,0,0|0,0,0]=2 3327 B10R1.182 COC(=O)C(N)C1COC1 MCULE-4838271134 [0,1,0,1,0,0|1,0,0]=3 3328 B10R1.182 COC(=O)C(N)C1COC1 MCULE-6581486330 [0,1,0,1,0,0|1,0,0]=3 3329 B10R1.182 COC(=O)C(O)C1CCC1 MCULE-3016777020 [0,1,0,1,0,0|1,0,0]=3 3330 B10R1.182 COC(=O)[C@@H](N)C1CCC1 MCULE-2319437388 [0,1,0,1,0,0|0,0,0]=2 3331 B10R1.182 COC(=O)[C@@H](N)C1CCC1 MCULE-4764567509 [0,1,0,1,0,0|0,0,0]=2 3332 B10R1.182 COC(=O)[C@@H](N)C1CCC1 MCULE-8996478840 [0,1,0,1,0,0|0,0,0]=2 3333 B10R1.182 COC(=O)[C@@H](N)C1CCC1 MCULE-9749004524 [0,1,0,1,0,0|0,0,0]=2 3334 B10R1.182 COC(=O)[C@@H](N)C1COC1 MCULE-2357062048 [0,1,0,1,0,0|1,0,0]=3 3335 B10R1.182 COC(=O)[C@@H](N)C1COC1 MCULE-9469302989 [0,1,0,1,0,0|1,0,0]=3 3336 B10R1.182 COC(=O)[C@H](N)C1CCC1 MCULE-3771166263 [0,1,0,1,0,0|0,0,0]=2 3337 B10R1.182 COC(=O)[C@H](N)C1CCC1 MCULE-4986645692 [0,1,0,1,0,0|0,0,0]=2 3338 B10R1.182 COC(=O)[C@H](N)C1CCC1 MCULE-6414521728 [0,1,0,1,0,0|0,0,0]=2 3339 B10R1.182 COC(=O)[C@H](N)C1CCC1 MCULE-8525319101 [0,1,0,1,0,0|0,0,0]=2 3340 B10R1.182 COC(=O)[C@H](N)C1COC1 MCULE-5371642768 [0,1,0,1,0,0|1,0,0]=3 3341 B10R1.354 CC(C)(C(=O)O)C1CCC1 MCULE-2258535093 [0,1,0,1,0,0|1,0,0]=3 3342 B10R1.354 CC(C)(C(=O)O)C1CNC1 MCULE-1343052229 [0,1,0,1,0,0|2,0,0]=4 3343 B10R1.354 CC(C)(C(=O)O)C1CNC1 MCULE-7369462099 [0,1,0,1,0,0|2,0,0]=4 3344 B10R1.354 CC(N)(C(=O)O)C1CCC1 MCULE-4918102968 [0,1,0,1,0,0|0,0,0]=2 3345 B10R1.354 CC(N)(C(=O)O)C1CCC1 MCULE-6559227354 [0,1,0,1,0,0|0,0,0]=2 3346 B10R1.354 CC(N)(C(=O)O)C1COC1 MCULE-6006399645 [0,1,0,1,0,0|1,0,0]=3 3347 B10R1.354 CC(N)(C(=O)O)C1COC1 MCULE-7118895389 [0,1,0,1,0,0|1,0,0]=3 3348 B10R1.354 CC(O)(C(=O)O)C1CCC1 MCULE-4063351378 [0,1,0,1,0,0|1,0,0]=3 3349 B10R1.354 O=C(O)C(F)(F)C1CCC1 MCULE-6803588002 [0,1,0,1,0,0|1,0,0]=3 3350 B10R1.39 CCC1CCCC1C(=O)O MCULE-2134315765 [0,1,0,1,0,0|1,0,0]=3 3351 B10R1.39 CCC1CCNC1C(=O)O MCULE-1392850907 [0,1,0,1,0,0|0,0,0]=2 3352 B10R1.39 CCC1CCNC1C(=O)O MCULE-2618729884 [0,1,0,1,0,0|0,0,0]=2 3353 B10R1.39 CCC1NCCC1C(=O)O MCULE-6308897662 [0,1,0,1,0,0|1,0,0]=3 3354 B10R1.39 CCC1NCCC1C(=O)O MCULE-6989316364 [0,1,0,1,0,0|1,0,0]=3 3355 B10R1.39 CCC1OCCC1C(=O)O MCULE-3029813377 [0,1,0,1,0,0|1,0,0]=3 3356 B10R1.39 CCN1CCCC1C(=O)O MCULE-9170639085 [0,1,0,1,0,0|2,0,0]=4 3357 B10R1.39 CCN1CCC[C@@H]1C(=O)O MCULE-6272401541 [0,1,0,1,0,0|2,0,0]=4 3358 B10R1.39 CCN1CCC[C@H]1C(=O)O MCULE-4672768595 [0,1,0,1,0,0|2,0,0]=4 3359 B10R1.39 CCN1CCC[C@H]1C(=O)O MCULE-5066096497 [0,1,0,1,0,0|2,0,0]=4 3360 B10R1.39 CC[C@@H]1CNC[C@@H]1C(=O)O MCULE-8464460557 [0,1,0,1,0,0|0,0,0]=2 3361 B10R1.39 CC[C@H]1CNC[C@H]1C(=O)O MCULE-2742804200 [0,1,0,1,0,0|0,0,0]=2 3362 B10R1.39 COC1CCCC1C(=O)O MCULE-6165424004 [0,1,0,1,0,0|1,0,0]=3 3363 B10R1.39 CSC1CCCC1C(=O)O MCULE-7830513386 [0,1,0,1,0,0|1,0,0]=3 3364 B10R1.39 NCC1CCCC1C(=O)O MCULE-5775773821 [0,1,0,1,0,0|1,0,0]=3 3365 B10R1.39 NCC1CCCC1C(=O)O MCULE-6872336527 [0,1,0,1,0,0|1,0,0]=3 3366 B10R1.39 NCC1OCCC1C(=O)O MCULE-2668866861 [0,1,0,1,0,0|2,0,0]=4 3367 B10R1.39 NCC1OCCC1C(=O)O MCULE-9067491644 [0,1,0,1,0,0|2,0,0]=4 3368 B10R1.39 O=C(O)C1CNCC1CO MCULE-4689035983 [0,1,0,1,0,0|1,0,0]=3 3369 B10R1.165 CCC1CN(C1C(=O)O)C MCULE-5939427175 [0,1,0,1,0,0|0,0,0]=2 3370 B10R1.165 CCC1CN([C@@H]1C(=O)O)C MCULE-3015108374 [0,1,0,1,0,0|0,0,0]=2 3371 B10R1.165 CCC1CN([C@@H]1C(=O)O)C MCULE-3864383046 [0,1,0,1,0,0|0,0,0]=2 3372 B10R1.192 CC1COC(=O)C1C(=O)O MCULE-6047208777 [0,1,0,1,0,0|2,0,0]=4 3373 B10R1.219 CC(=O)C(C#N)C1CCC1 MCULE-8298180006 [0,1,0,1,0,0|1,0,1]=4 3374 B10R1.219 CNC(C(=O)O)C1CCC1 MCULE-1036621151 [0,1,0,1,0,0|0,0,0]=2 3375 B10R1.219 CNC(C(=O)O)C1CCC1 MCULE-2626477980 [0,1,0,1,0,0|0,0,0]=2 3376 B10R1.219 COC(C(=O)O)C1CCC1 MCULE-4130966763 [0,1,0,1,0,0|1,0,0]=3 3377 B10R1.219 NCC(C(=O)O)C1CCC1 MCULE-2140507835 [0,1,0,1,0,0|0,0,0]=2 3378 B10R1.219 NCC(C(=O)O)C1CCC1 MCULE-4447331997 [0,1,0,1,0,0|0,0,0]=2 3379 B10R1.83 CC1(C(CC1C(=O)O)N)C MCULE-1760692606 [0,1,0,1,0,0|2,0,0]=4 3380 B10R1.83 CC1(C(CC1C(=O)O)N)C MCULE-6477382898 [0,1,0,1,0,0|2,0,0]=4 3381 B10R1.83 CC1([C@H](C[C@@H]1C(=O)O)N)C MCULE-1367965106 [0,1,0,1,0,0|2,0,0]=4 3382 B10R1.83 CC1([C@H](C[C@@H]1C(=O)O)N)C MCULE-5181157821 [0,1,0,1,0,0|2,0,0]=4 3383 B10R1.83 CC1([C@H](C[C@@H]1C(=O)O)N)C MCULE-9629419450 [0,1,0,1,0,0|2,0,0]=4 3384 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-1255189062 [0,1,0,1,0,0|2,0,0]=4 3385 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-1573159970 [0,1,0,1,0,0|2,0,0]=4 3386 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-3597897261 [0,1,0,1,0,0|2,0,0]=4 3387 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-5950701932 [0,1,0,1,0,0|2,0,0]=4 3388 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-6764578128 [0,1,0,1,0,0|2,0,0]=4 3389 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-8635317976 [0,1,0,1,0,0|2,0,0]=4 3390 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-2623468295 [0,1,0,1,0,0|2,0,0]=4 3391 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-4157898594 [0,1,0,1,0,0|2,0,0]=4 3392 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-8831652749 [0,1,0,1,0,0|2,0,0]=4 3393 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-8994723547 [0,1,0,1,0,0|2,0,0]=4 3394 B10R1.128 CC1(CCC=C1C(=O)O)C MCULE-6540475820 [0,1,0,1,0,0|1,0,1]=4 3395 B10R1.128 CC1(CCCC1C(=O)O)C MCULE-4580682391 [0,1,0,1,0,0|1,0,0]=3 3396 B10R1.128 CC1(CCCC1C(=O)O)N MCULE-6959799055 [0,1,0,1,0,0|1,0,0]=3 3397 B10R1.128 CC1(CCCC1C(=O)O)N MCULE-7529713765 [0,1,0,1,0,0|1,0,0]=3 3398 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-4368125699 [0,1,0,1,0,0|0,0,0]=2 3399 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-9548940162 [0,1,0,1,0,0|0,0,0]=2 3400 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9288829524 [0,1,0,1,0,0|0,0,0]=2 3401 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9565122593 [0,1,0,1,0,0|0,0,0]=2 3402 B10R1.128 CC1(CNCC1C(=O)O)C MCULE-3386370307 [0,1,0,1,0,0|2,0,0]=4 3403 B10R1.128 CC1(CNCC1C(=O)O)C MCULE-6121405177 [0,1,0,1,0,0|2,0,0]=4 3404 B10R1.128 CC1(CNC[C@@H]1C(=O)O)C MCULE-2007377437 [0,1,0,1,0,0|2,0,0]=4 3405 B10R1.128 CC1(CNC[C@@H]1C(=O)O)C MCULE-2184930829 [0,1,0,1,0,0|2,0,0]=4 3406 B10R1.128 CC1(CNC[C@H]1C(=O)O)C MCULE-1263349937 [0,1,0,1,0,0|2,0,0]=4 3407 B10R1.128 CC1(CNC[C@H]1C(=O)O)C MCULE-7547643584 [0,1,0,1,0,0|2,0,0]=4 3408 B10R1.128 CC1(OCCC1C(=O)O)C MCULE-4433776174 [0,1,0,1,0,0|2,0,0]=4 3409 B10R1.128 CC1(SCNC1C(=O)O)C MCULE-4649954723 [0,1,0,1,0,0|1,0,0]=3 3410 B10R1.128 CC1(SCN[C@@H]1C(=O)O)C MCULE-3039934368 [0,1,0,1,0,0|1,0,0]=3 3411 B10R1.128 CC1(SCN[C@@H]1C(=O)O)C MCULE-7607354946 [0,1,0,1,0,0|1,0,0]=3 3412 B10R1.128 CC1(SCN[C@H]1C(=O)O)C MCULE-3400987510 [0,1,0,1,0,0|1,0,0]=3 3413 B10R1.128 CC1(SCN[C@H]1C(=O)O)C MCULE-7230856340 [0,1,0,1,0,0|1,0,0]=3 3414 B10R1.128 C[C@]1(CCC[C@@H]1C(=O)O)N MCULE-2638855066 [0,1,0,1,0,0|1,0,0]=3 3415 B10R1.128 C[C@]1(CCC[C@@H]1C(=O)O)N MCULE-7472901526 [0,1,0,1,0,0|1,0,0]=3 3416 B10R1.128 C[N+]1(CCCC1C(=O)O)C MCULE-4111590223 [0,1,0,1,0,0|2,0,0]=4 3417 B10R1.128 C[N+]1(CCC[C@H]1C(=O)O)C MCULE-8126384491 [0,1,0,1,0,0|2,0,0]=4 3418 B10R1.128 O=C(O)C1CCCC1(F)F MCULE-3687597013 [0,1,0,1,0,0|2,0,0]=4 3419 B10R1.128 O=C(O)C1NCCC1(F)F MCULE-2455048138 [0,1,0,1,0,0|1,0,0]=3 3420 B10R1.128 O=C(O)C1NCCC1(F)F MCULE-9521153177 [0,1,0,1,0,0|1,0,0]=3 3421 B10R1.128 O=C(O)C1OCCC1(F)F MCULE-1033630667 [0,1,0,1,0,0|2,0,0]=4 3422 B10R1.128 O=C(O)[C@@H]1OCCC1(F)F MCULE-3394730004 [0,1,0,1,0,0|2,0,0]=4 3423 B10R1.128 O=C(O)[C@H]1OCCC1(F)F MCULE-2296740232 [0,1,0,1,0,0|2,0,0]=4 3424 B10R1.128 [C@H]1(NCSC1(C)C)C(=O)[O-] MCULE-4393899911 [0,1,0,1,0,0|1,0,1]=4 3425 B10R1.128 [C@H]1(NCSC1(C)C)C(=O)[O-] MCULE-5413994595 [0,1,0,1,0,0|1,0,1]=4 3426 B10R1.483 CCC1(CC1C(=O)O)CC MCULE-2319800478 [0,1,0,1,0,0|1,0,0]=3 3427 B10R1.360 C=C(C)C1(CC1C(=O)O)C MCULE-5145834120 [0,1,0,1,0,0|1,0,1]=4 3428 B10R1.360 CC(C)C1(CC1C(=O)O)C MCULE-7783755862 [0,1,0,1,0,0|1,0,0]=3 3429 B10R1.361 C1(CCN1C(C)C)C(=O)O MCULE-2301490448 [0,1,0,1,0,0|2,0,0]=4 3430 B10R1.361 CC(C)N1CCC1C(=O)O MCULE-3327703206 [0,1,0,1,0,0|2,0,0]=4 3431 B10R1.361 CC(C)N1CC[C@H]1C(=O)O MCULE-1726046033 [0,1,0,1,0,0|2,0,0]=4 3432 B10R1.361 CC(C)N1CC[C@H]1C(=O)O MCULE-3879944736 [0,1,0,1,0,0|2,0,0]=4 3433 B10R2.25 O=C1C2CCC(C2)C1Cl MCULE-5605308647 [0,0,0,2,0,0|2,0,0]=4 3434 B10R2.25 [C@H]12CC[C@H](C1)C(C2=O)Cl MCULE-3759432797 [0,0,0,2,0,0|2,0,0]=4 3435 B10R2.65 CC12CC1CCCC2=O MCULE-7187224935 [0,0,0,2,0,0|2,0,0]=4 3436 B10R2.179 CC12CCCC(=O)C1C2 MCULE-5216940743 [0,0,0,2,0,0|2,0,0]=4 3437 B10R2.179 CC12CCCC(=O)C1O2 MCULE-5513375456 [0,0,0,2,0,0|2,0,0]=4 3438 B10R2.32 C12CCNC1C(=O)NC2 MCULE-9691167616 [0,0,0,2,0,0|1,0,0]=3 3439 B10R2.32 O=C1CCC2C1CCC2 MCULE-7663799084 [0,0,0,2,0,0|2,0,0]=4 3440 B10R2.32 O=C1OCC2C1CCC2 MCULE-1680539728 [0,0,0,2,0,0|1,0,0]=3 3441 B10R2.32 O[C@@H]1CC[C@@H]2[C@H]1NCC2 MCULE-5080250769 [0,0,0,2,0,0|1,0,1]=4 3442 B10R2.32 O[C@@H]1CC[C@@H]2[C@H]1NCC2 MCULE-7790238150 [0,0,0,2,0,0|1,0,1]=4 3443 B10R2.32 [C@@H]12CCN[C@@H]1C(=O)NC2 MCULE-6925376025 [0,0,0,2,0,0|1,0,0]=3 3444 B10R2.32 [C@H]12CCC[C@H]1C(=O)OC2 MCULE-7791113994 [0,0,0,2,0,0|1,0,0]=3 3445 B10R2.32 [C@H]12CCN[C@H]1C(=O)NC2 MCULE-5094345573 [0,0,0,2,0,0|1,0,0]=3 3446 B10R2.32 [C@H]12CCN[C@H]1C(=O)NC2 MCULE-5128140663 [0,0,0,2,0,0|1,0,0]=3 3447 B10R2.117 CC12CCCC1C(=O)N2 MCULE-9281165627 [0,0,0,2,0,0|2,0,0]=4 3448 B10R2.344 O=C(O)C12CC1CCN2 MCULE-8958769379 [0,0,0,2,0,0|0,0,0]=2 3449 B10R2.344 O=C(O)C12CC1CCN2 MCULE-9918894627 [0,0,0,2,0,0|0,0,0]=2 3450 B10R2.344 O=C(O)C12CCCC1C2 MCULE-1433395114 [0,0,0,2,0,0|1,0,0]=3 3451 B10R2.344 O=C(O)C12CCNC1C2 MCULE-4622558327 [0,0,0,2,0,0|2,0,0]=4 3452 B10R2.344 O=C(O)C12CCNC1C2 MCULE-5876870827 [0,0,0,2,0,0|2,0,0]=4 3453 B10R2.344 O=C(O)C12CNCC1C2 MCULE-1023234959 [0,0,0,2,0,0|2,0,0]=4 3454 B10R2.344 O=C(O)C12CNCC1C2 MCULE-2698470641 [0,0,0,2,0,0|2,0,0]=4 3455 B10R2.344 O=C(O)C12COCC1C2 MCULE-4962599130 [0,0,0,2,0,0|2,0,0]=4 3456 B10R2.344 O=C(O)[C@@]12CC1CCN2 MCULE-8361805191 [0,0,0,2,0,0|0,0,0]=2 3457 B10R2.344 O=C(O)[C@@]12CC1CCN2 MCULE-9298532680 [0,0,0,2,0,0|0,0,0]=2 3458 B10R2.344 O=C(O)[C@@]12COC[C@@H]1C2 MCULE-5335382694 [0,0,0,2,0,0|2,0,0]=4 3459 B10R2.344 O=C(O)[C@@]12COC[C@@H]1C2 MCULE-6955865926 [0,0,0,2,0,0|2,0,0]=4 3460 B10R2.344 O=C(O)[C@]12COCC1C2 MCULE-6646373866 [0,0,0,2,0,0|2,0,0]=4 3461 B10R2.344 [C@@H]12COC[C@@]1(C2)C(=O)O MCULE-1926490936 [0,0,0,2,0,0|2,0,0]=4 3462 B10R2.344 [C@@H]12COC[C@@]1(C2)C(=O)O MCULE-4045090245 [0,0,0,2,0,0|2,0,0]=4 3463 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-8087821545 [0,0,0,2,0,0|0,0,0]=2 3464 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-9943749675 [0,0,0,2,0,0|0,0,0]=2 3465 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-3741942930 [0,0,0,2,0,0|0,0,0]=2 3466 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-8099098772 [0,0,0,2,0,0|0,0,0]=2 3467 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-6549710478 [0,0,0,2,0,0|0,0,0]=2 3468 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-7349536483 [0,0,0,2,0,0|0,0,0]=2 3469 B10R2.355 O=C(O)[C@H]1NC[C@@H]2[C@H]1C2 MCULE-1865131686 [0,0,0,2,0,0|0,0,0]=2 3470 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-3923610209 [0,0,0,2,0,0|0,0,0]=2 3471 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-6551780838 [0,0,0,2,0,0|0,0,0]=2 3472 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-9694754423 [0,0,0,2,0,0|0,0,0]=2 3473 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-4493728887 [0,0,0,2,0,0|0,0,0]=2 3474 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8766409370 [0,0,0,2,0,0|0,0,0]=2 3475 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8840539566 [0,0,0,2,0,0|0,0,0]=2 3476 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-1970630066 [0,0,0,2,0,0|0,0,0]=2 3477 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-7946950016 [0,0,0,2,0,0|0,0,0]=2 3478 B10R2.355 [C@H]12C[C@H]1CN[C@@H]2C(=O)O MCULE-9408302039 [0,0,0,2,0,0|0,0,0]=2 3479 B10R2.355 [C@H]12C[C@H]1CN[C@H]2C(=O)O MCULE-4802776373 [0,0,0,2,0,0|0,0,0]=2 3480 B10R2.324 O=C1CCC1C2CCC2 MCULE-1229359882 [0,0,0,2,0,0|2,0,0]=4 3481 B10R2.358 O=C(O)C1CCC12CC2 MCULE-5575310904 [0,0,0,2,0,0|1,0,0]=3 3482 B10R2.638 O=C(O)C1CC12CCC2 MCULE-5122422025 [0,0,0,2,0,0|1,0,0]=3 3483 B10R2.638 O=C(O)C1CC12COC2 MCULE-3616837602 [0,0,0,2,0,0|2,0,0]=4 3484 B10R2.638 O=C(O)[C@H]1CC12CCC2 MCULE-6436884704 [0,0,0,2,0,0|1,0,0]=3 3485 B8R0.9 CC(=O)NCC(C)CN MCULE-6305271563 [1,0,0,0,0,1|2,0,0]=4 3486 B8R0.9 CC(=O)OCC(C)CBr MCULE-5776578434 [1,0,0,0,0,1|2,0,0]=4 3487 B8R0.9 CC(=O)OC[C@H](C)CO MCULE-2650760220 [1,0,0,0,0,1|2,0,0]=4 3488 B8R0.9 CC(=O)OC[C@H](C)CO MCULE-7616916740 [1,0,0,0,0,1|2,0,0]=4 3489 B8R0.9 CC(=O)SCC(C)CCl MCULE-2266172098 [1,0,0,0,0,1|2,0,0]=4 3490 B8R0.9 CC(C#N)CCC(=O)O MCULE-6867167636 [1,0,0,0,0,1|1,0,1]=4 3491 B8R0.9 CC(CCl)CCC(=O)Cl MCULE-3716923938 [1,0,0,0,0,1|2,0,0]=4 3492 B8R0.9 CCC(=CCC(=O)O)C MCULE-3358969895 [1,0,0,0,0,1|0,0,1]=3 3493 B8R0.9 CCC(=O)CCC(=O)O MCULE-4505750030 [1,0,0,0,0,1|1,0,1]=4 3494 B8R0.9 CCC(=O)NCC(=O)O MCULE-9173889437 [1,0,0,0,0,1|1,0,1]=4 3495 B8R0.9 CCC(C)CCC(=O)C MCULE-6498666006 [1,0,0,0,0,1|1,0,0]=3 3496 B8R0.9 CCC(C)CCC(=O)O MCULE-9270270979 [1,0,0,0,0,1|0,0,0]=2 3497 B8R0.9 CCC(C)CCC(C)O MCULE-4781356880 [1,0,0,0,0,1|1,0,1]=4 3498 B8R0.9 CCC(C)COC(=O)C MCULE-1846190306 [1,0,0,0,0,1|1,0,0]=3 3499 B8R0.9 CCC(C)COC(=O)Cl MCULE-7986633908 [1,0,0,0,0,1|1,0,0]=3 3500 B8R0.9 CCC(C)NCC(=O)O MCULE-1578825700 [1,0,0,0,0,1|0,0,0]=2 3501 B8R0.9 CCC(C)NCC(=O)O MCULE-8981987872 [1,0,0,0,0,1|0,0,0]=2 3502 B8R0.9 CCC(C)OCC(=O)O MCULE-8235265405 [1,0,0,0,0,1|0,0,0]=2 3503 B8R0.9 CCC(Cl)CCC(=O)Cl MCULE-3849391288 [1,0,0,0,0,1|2,0,0]=4 3504 B8R0.9 CCC(N)CCC(=O)O MCULE-3116763773 [1,0,0,0,0,1|1,0,0]=3 3505 B8R0.9 CCC(N)CCC(=O)O MCULE-9126260921 [1,0,0,0,0,1|1,0,0]=3 3506 B8R0.9 CCC(O)CCC(=O)O MCULE-1512608136 [1,0,0,0,0,1|1,0,0]=3 3507 B8R0.9 CCC(O)CCC(=O)[O-] MCULE-6831827135 [1,0,0,0,0,1|1,0,1]=4 3508 B8R0.9 CCN(C)CCC(=O)O MCULE-2510720087 [1,0,0,0,0,1|1,0,0]=3 3509 B8R0.9 CCN(C)CCC(=O)O MCULE-4192684079 [1,0,0,0,0,1|1,0,0]=3 3510 B8R0.9 CCS(=O)CCC(=O)O MCULE-4027618720 [1,0,0,0,0,1|2,0,0]=4 3511 B8R0.9 CC[C@H](N)C=CC(=O)O MCULE-8933495159 [1,0,0,0,0,1|1,0,1]=4 3512 B8R0.9 COC(C)CCC(=O)O MCULE-5873043454 [1,0,0,0,0,1|1,0,0]=3 3513 B8R0.9 COC(C)COC(=O)C MCULE-7948047479 [1,0,0,0,0,1|2,0,0]=4 3514 B8R0.9 CSC(C)CCC(=O)O MCULE-3505570511 [1,0,0,0,0,1|1,0,0]=3 3515 B8R0.9 NCC(N)CCC(=O)O MCULE-1054409990 [1,0,0,0,0,1|2,0,0]=4 3516 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-2916881042 [1,0,0,0,0,1|2,0,0]=4 3517 B8R0.9 NC[C@@H](N)CCC(=O)O MCULE-7249154843 [1,0,0,0,0,1|2,0,0]=4 3518 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-1233079264 [1,0,0,0,0,1|2,0,0]=4 3519 B8R0.9 N[C@H](CO)CCC(=O)O MCULE-8091475267 [1,0,0,0,0,1|2,0,0]=4 3520 B10R0.44 CCC(C)CC(=CC(=O)O)C MCULE-1620434072 [0,0,0,0,0,2|1,0,1]=4 3521 B10R0.57 CCC(C)C(=O)NCC(=O)O MCULE-9921017610 [0,0,0,0,0,2|1,0,1]=4 3522 B10R0.57 CC[C@@H](C)[C@H](N)CCC(=O)O MCULE-6163799872 [0,0,0,0,0,2|0,0,0]=2 3523 B10R0.57 CC[C@@H](C)[C@H](N)CCC(=O)O MCULE-8974084013 [0,0,0,0,0,2|0,0,0]=2 3524 B10R0.82 COC(C)COC(C)C(=O)O MCULE-1581882016 [0,0,0,0,0,2|2,0,0]=4 3525 B10R0.82 NCC(F)CCC(N)C(=O)O MCULE-5359725270 [0,0,0,0,0,2|2,0,0]=4 3526 B10R0.82 NCC(F)CCC(N)C(=O)O MCULE-7837362209 [0,0,0,0,0,2|2,0,0]=4 3527 B10R0.82 NCC(O)CCC(N)C(=O)O MCULE-6064290143 [0,0,0,0,0,2|2,0,0]=4 3528 B10R0.82 NCC(O)CCC(N)C(=O)O MCULE-6546706417 [0,0,0,0,0,2|2,0,0]=4 3529 B10R0.82 NCC(O)CC[C@H](N)C(=O)O MCULE-4925093695 [0,0,0,0,0,2|2,0,0]=4 3530 B10R0.82 NCC(O)CC[C@H](N)C(=O)O MCULE-7103430731 [0,0,0,0,0,2|2,0,0]=4 3531 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O MCULE-1390178110 [0,0,0,0,0,2|2,0,0]=4 3532 B10R0.82 NC[C@H](O)CC[C@H](N)C(=O)O MCULE-7788161688 [0,0,0,0,0,2|2,0,0]=4