0 B8R0.2 C=CC(C)C(C)C(=O)O MCULE-6762624939 [0,0,0,0,0,0|1,0,3]=4 1 B8R0.2 CCC(=O)C(C)C(=O)O MCULE-9192813670 [0,0,0,0,0,0|2,0,2]=4 2 B8R0.2 CCC(Br)C(=O)N(C)C MCULE-4967079536 [0,0,0,0,0,0|4,0,0]=4 3 B8R0.2 CCC(C)C(=O)C(=O)O MCULE-2376245949 [0,0,0,0,0,0|0,0,0]=0 4 B8R0.2 CCC(C)C(=O)C(=O)[O-] MCULE-9099284149 [0,0,0,0,0,0|0,0,1]=1 5 B8R0.2 CCC(C)C(=O)C(C)C MCULE-5036699104 [0,0,0,0,0,0|2,0,1]=3 6 B8R0.2 CCC(C)C(Br)C(=O)O MCULE-1124609284 [0,0,0,0,0,0|1,0,1]=2 7 B8R0.2 CCC(C)C(C)C(=O)C MCULE-4030096724 [0,0,0,0,0,0|2,0,1]=3 8 B8R0.2 CCC(C)C(C)C(=O)O MCULE-9360443230 [0,0,0,0,0,0|1,0,1]=2 9 B8R0.2 CCC(C)C(C)C(C)O MCULE-2099710154 [0,0,0,0,0,0|2,0,2]=4 10 B8R0.2 CCC(C)C(N)C(=O)N MCULE-7314175276 [0,0,0,0,0,0|2,0,1]=3 11 B8R0.2 CCC(C)C(N)C(=O)N MCULE-8895055670 [0,0,0,0,0,0|2,0,1]=3 12 B8R0.2 CCC(C)C(N)C(=O)O MCULE-9861955295 [0,0,0,0,0,0|1,0,1]=2 13 B8R0.2 CCC(C)C(O)C(=O)N MCULE-2649023234 [0,0,0,0,0,0|1,0,2]=3 14 B8R0.2 CCC(C)C(O)C(=O)O MCULE-4300622531 [0,0,0,0,0,0|0,0,2]=2 15 B8R0.2 CCC(N)C(=O)N(C)C MCULE-7436417019 [0,0,0,0,0,0|4,0,0]=4 16 B8R0.2 CCC(O)C(C)C(=O)O MCULE-7278088016 [0,0,0,0,0,0|2,0,1]=3 17 B8R0.2 CCC(O)C(N)C(=O)O MCULE-5277569808 [0,0,0,0,0,0|2,0,1]=3 18 B8R0.2 CCC(O)[C@H](N)C(=O)O MCULE-7480930876 [0,0,0,0,0,0|2,0,1]=3 19 B8R0.2 CCN(C)C(=O)C(C)Br MCULE-3591775660 [0,0,0,0,0,0|3,0,1]=4 20 B8R0.2 CCN(C)C(=O)C(C)N MCULE-1338723028 [0,0,0,0,0,0|3,0,1]=4 21 B8R0.2 CCN(C)C(=O)C(C)N MCULE-7082141732 [0,0,0,0,0,0|3,0,1]=4 22 B8R0.2 CCN(C)C(C)C(=O)O MCULE-6064336068 [0,0,0,0,0,0|2,0,1]=3 23 B8R0.2 CCN(C)[C@@H](C)C(=O)O MCULE-9158211664 [0,0,0,0,0,0|2,0,1]=3 24 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-1413119398 [0,0,0,0,0,0|1,0,1]=2 25 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-5186925599 [0,0,0,0,0,0|1,0,1]=2 26 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O MCULE-5041492133 [0,0,0,0,0,0|1,0,1]=2 27 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-2706440971 [0,0,0,0,0,0|1,0,1]=2 28 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-8101207882 [0,0,0,0,0,0|1,0,1]=2 29 B8R0.2 CC[C@@H](N)C(=O)N(C)C MCULE-7595904175 [0,0,0,0,0,0|4,0,0]=4 30 B8R0.2 CC[C@@H](N)C(=O)N(C)C MCULE-8778722434 [0,0,0,0,0,0|4,0,0]=4 31 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-1048734191 [0,0,0,0,0,0|2,0,1]=3 32 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-1935827385 [0,0,0,0,0,0|2,0,1]=3 33 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-8753855708 [0,0,0,0,0,0|2,0,1]=3 34 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-9854510560 [0,0,0,0,0,0|2,0,1]=3 35 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1200159118 [0,0,0,0,0,0|1,0,1]=2 36 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1359318144 [0,0,0,0,0,0|1,0,1]=2 37 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-9629903099 [0,0,0,0,0,0|1,0,1]=2 38 B8R0.2 CC[C@H](C)[C@@H](O)C(=O)O MCULE-6017510763 [0,0,0,0,0,0|0,0,2]=2 39 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-1760352503 [0,0,0,0,0,0|1,0,1]=2 40 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-2341573677 [0,0,0,0,0,0|1,0,1]=2 41 B8R0.2 CC[C@H](C)[C@H](N)C(=O)N MCULE-3415036603 [0,0,0,0,0,0|2,0,1]=3 42 B8R0.2 CC[C@H](C)[C@H](N)C(=O)N MCULE-9677139342 [0,0,0,0,0,0|2,0,1]=3 43 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-2215911951 [0,0,0,0,0,0|1,0,1]=2 44 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-3217669453 [0,0,0,0,0,0|1,0,1]=2 45 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-2804875804 [0,0,0,0,0,0|0,0,2]=2 46 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-4272353967 [0,0,0,0,0,0|0,0,2]=2 47 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-6087026464 [0,0,0,0,0,0|0,0,2]=2 48 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-2118005753 [0,0,0,0,0,0|2,0,1]=3 49 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-2420221886 [0,0,0,0,0,0|2,0,1]=3 50 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-7168739287 [0,0,0,0,0,0|2,0,1]=3 51 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-7351381830 [0,0,0,0,0,0|2,0,1]=3 52 B8R0.2 CNC(C)C(=O)N(C)C MCULE-8857921885 [0,0,0,0,0,0|4,0,0]=4 53 B8R0.2 CN[C@@H](C)C(=O)N(C)C MCULE-5765231303 [0,0,0,0,0,0|4,0,0]=4 54 B8R0.2 CN[C@@H](C)C(=O)N(C)C MCULE-9148770350 [0,0,0,0,0,0|4,0,0]=4 55 B8R0.2 COC(C)C(Br)C(=O)O MCULE-2500266383 [0,0,0,0,0,0|2,0,1]=3 56 B8R0.2 COC(C)C(O)C(=O)O MCULE-2673265957 [0,0,0,0,0,0|1,0,2]=3 57 B8R0.2 COC(C)C([NH3+])C(=O)[O-] MCULE-9174020309 [0,0,0,0,0,0|2,0,2]=4 58 B8R0.2 CON(C)C(=O)C(=O)C MCULE-5569194996 [0,0,0,0,0,0|3,0,0]=3 59 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O MCULE-2479965444 [0,0,0,0,0,0|2,0,1]=3 60 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O MCULE-3288712191 [0,0,0,0,0,0|2,0,1]=3 61 B8R0.2 CO[C@@H](C)[C@@H](N)C(=O)O MCULE-6827226453 [0,0,0,0,0,0|2,0,1]=3 62 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O MCULE-6762158780 [0,0,0,0,0,0|2,0,1]=3 63 B8R0.2 CO[C@@H](C)[C@H](N)C(=O)O MCULE-9087542117 [0,0,0,0,0,0|2,0,1]=3 64 B8R0.2 CO[C@H](C)[C@@H](N)C(=O)O MCULE-6235935164 [0,0,0,0,0,0|2,0,1]=3 65 B8R0.2 CO[C@H](C)[C@@H](N)C(=O)O MCULE-6758536252 [0,0,0,0,0,0|2,0,1]=3 66 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O MCULE-7334607468 [0,0,0,0,0,0|2,0,1]=3 67 B8R0.2 CO[C@H](C)[C@H](N)C(=O)O MCULE-8564530384 [0,0,0,0,0,0|2,0,1]=3 68 B8R0.2 CSC(C)C(N)C(=O)O MCULE-6226096646 [0,0,0,0,0,0|2,0,1]=3 69 B8R0.2 O=C(O)C(O)C(O)CO MCULE-1397527919 [0,0,0,0,0,0|2,0,2]=4 70 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-1531474304 [0,0,0,0,0,0|2,0,2]=4 71 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-3829421433 [0,0,0,0,0,0|2,0,2]=4 72 B8R0.2 [C@H](C)(CC)[C@H](N)C(=O)N MCULE-1416545198 [0,0,0,0,0,0|2,0,1]=3 73 B8R0.2 [C@H](C)(CC)[C@H](N)C(=O)N MCULE-1950370478 [0,0,0,0,0,0|2,0,1]=3 74 B7R0.2 C#CC(C)CC(=O)O MCULE-8780802803 [1,0,0,0,0,0|0,0,3]=4 75 B7R0.2 C(O)(CN)CC(=O)O MCULE-8378388788 [1,0,0,0,0,0|2,0,1]=4 76 B7R0.2 C=C(C)CC(C)CC MCULE-1001667584 [1,0,0,0,0,0|2,0,1]=4 77 B7R0.2 C=CC(C)CC(=O)O MCULE-4817084034 [1,0,0,0,0,0|0,0,3]=4 78 B7R0.2 CC(=CC(=O)O)C=O MCULE-7652207149 [1,0,0,0,0,0|1,0,2]=4 79 B7R0.2 CC(=O)NC(C)CN MCULE-4226474809 [1,0,0,0,0,0|3,0,0]=4 80 B7R0.2 CC(=O)NC(C)CN MCULE-7570690280 [1,0,0,0,0,0|3,0,0]=4 81 B7R0.2 CC(=O)NC(C)CO MCULE-9455210462 [1,0,0,0,0,0|3,0,0]=4 82 B7R0.2 CC(=O)N[C@H](C)CO MCULE-2174899443 [1,0,0,0,0,0|3,0,0]=4 83 B7R0.2 CC(=O)N[C@H](C)CO MCULE-5097293473 [1,0,0,0,0,0|3,0,0]=4 84 B7R0.2 CC(CC(=O)O)NN MCULE-2614719429 [1,0,0,0,0,0|2,0,1]=4 85 B7R0.2 CC(CC(=O)O)NN MCULE-2739806820 [1,0,0,0,0,0|2,0,1]=4 86 B7R0.2 CC(CCl)CC(=O)Cl MCULE-3163826919 [1,0,0,0,0,0|2,0,1]=4 87 B7R0.2 CC(CCl)OC(=O)N MCULE-7734729292 [1,0,0,0,0,0|3,0,0]=4 88 B7R0.2 CC(CN)CC(=O)O MCULE-1594242184 [1,0,0,0,0,0|1,0,1]=3 89 B7R0.2 CC(CN)CC(=O)O MCULE-8074816359 [1,0,0,0,0,0|1,0,1]=3 90 B7R0.2 CCC(=CC(=O)O)C MCULE-3864767099 [1,0,0,0,0,0|0,0,1]=2 91 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [1,0,0,0,0,0|1,0,2]=4 92 B7R0.2 CCC(C)CB(O)O MCULE-4978906892 [1,0,0,0,0,0|1,0,2]=4 93 B7R0.2 CCC(C)CC(=N)N MCULE-6434778899 [1,0,0,0,0,0|2,0,1]=4 94 B7R0.2 CCC(C)CC(=N)N MCULE-7964734356 [1,0,0,0,0,0|2,0,1]=4 95 B7R0.2 CCC(C)CC(=O)C MCULE-5801548800 [1,0,0,0,0,0|1,0,1]=3 96 B7R0.2 CCC(C)CC(=O)Cl MCULE-3063561496 [1,0,0,0,0,0|1,0,1]=3 97 B7R0.2 CCC(C)CC(=O)O MCULE-3409782202 [1,0,0,0,0,0|0,0,1]=2 98 B7R0.2 CCC(C)CC(=O)O MCULE-6537278030 [1,0,0,0,0,0|0,0,1]=2 99 B7R0.2 CCC(C)NC(=O)N MCULE-6186330882 [1,0,0,0,0,0|2,0,0]=3 100 B7R0.2 CCC(C)NC(=S)N MCULE-8856391382 [1,0,0,0,0,0|2,1,0]=4 101 B7R0.2 CCC(C)OC(=O)C MCULE-8410375215 [1,0,0,0,0,0|2,0,0]=3 102 B7R0.2 CCC(C)OC(=O)Cl MCULE-1512790698 [1,0,0,0,0,0|2,0,0]=3 103 B7R0.2 CCC(C)SC(=O)Cl MCULE-4681925921 [1,0,0,0,0,0|2,0,0]=3 104 B7R0.2 CCC(N)CC(=O)O MCULE-1744910444 [1,0,0,0,0,0|1,0,1]=3 105 B7R0.2 CCC(N)CC(=O)O MCULE-5610499925 [1,0,0,0,0,0|1,0,1]=3 106 B7R0.2 CCC(O)CC(=O)C MCULE-1222748729 [1,0,0,0,0,0|2,0,1]=4 107 B7R0.2 CCC(O)CC(=O)O MCULE-4663578527 [1,0,0,0,0,0|1,0,1]=3 108 B7R0.2 CCN(C)CC(=O)C MCULE-5302720081 [1,0,0,0,0,0|2,0,1]=4 109 B7R0.2 CCN(C)CC(=O)C MCULE-7283054437 [1,0,0,0,0,0|2,0,1]=4 110 B7R0.2 CCN(C)CC(=O)O MCULE-3102395413 [1,0,0,0,0,0|1,0,1]=3 111 B7R0.2 CCS(=O)CC(=O)O MCULE-5648298475 [1,0,0,0,0,0|2,0,1]=4 112 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-5550070887 [1,0,0,0,0,0|0,0,1]=2 113 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-9572363620 [1,0,0,0,0,0|0,0,1]=2 114 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-1158271004 [1,0,0,0,0,0|1,0,1]=3 115 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-2354820947 [1,0,0,0,0,0|1,0,1]=3 116 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-4284161835 [1,0,0,0,0,0|1,0,1]=3 117 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-9523089766 [1,0,0,0,0,0|1,0,1]=3 118 B7R0.2 CC[C@H](C)CC(=O)O MCULE-4177365854 [1,0,0,0,0,0|0,0,1]=2 119 B7R0.2 CC[C@H](C)CC(=O)O MCULE-5173108207 [1,0,0,0,0,0|0,0,1]=2 120 B7R0.2 CC[C@H](N)CC(=O)O MCULE-1463536674 [1,0,0,0,0,0|1,0,1]=3 121 B7R0.2 CC[C@H](N)CC(=O)O MCULE-2865599647 [1,0,0,0,0,0|1,0,1]=3 122 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4506847599 [1,0,0,0,0,0|1,0,1]=3 123 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4819674539 [1,0,0,0,0,0|1,0,1]=3 124 B7R0.2 CNC(=CC(=O)C)C MCULE-1943688292 [1,0,0,0,0,0|2,0,1]=4 125 B7R0.2 CNC(C)CC(=O)N MCULE-1474658720 [1,0,0,0,0,0|2,0,1]=4 126 B7R0.2 CNC(C)CC(=O)N MCULE-4481385519 [1,0,0,0,0,0|2,0,1]=4 127 B7R0.2 CNC(C)CC(=O)O MCULE-6592893730 [1,0,0,0,0,0|1,0,1]=3 128 B7R0.2 CNC(C)CC(=O)O MCULE-7655437452 [1,0,0,0,0,0|1,0,1]=3 129 B7R0.2 CO/C(=C/C(=O)O)/C MCULE-5031076713 [1,0,0,0,0,0|1,0,1]=3 130 B7R0.2 COC(=CC(=O)C)C MCULE-1939113485 [1,0,0,0,0,0|2,0,1]=4 131 B7R0.2 COC(=CC(=O)O)C MCULE-2215306459 [1,0,0,0,0,0|1,0,1]=3 132 B7R0.2 COC(C)CC(=O)O MCULE-7063015720 [1,0,0,0,0,0|1,0,1]=3 133 B7R0.2 CSC(C)CC(=O)O MCULE-7827833531 [1,0,0,0,0,0|1,0,1]=3 134 B7R0.2 C[C@H](CN)CC(=O)O MCULE-4808630217 [1,0,0,0,0,0|1,0,1]=3 135 B7R0.2 C[C@H](CN)CC(=O)O MCULE-5474405940 [1,0,0,0,0,0|1,0,1]=3 136 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [1,0,0,0,0,0|2,0,1]=4 137 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [1,0,0,0,0,0|2,0,1]=4 138 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [1,0,0,0,0,0|2,0,1]=4 139 B7R0.2 NCC(N)CC(=O)O MCULE-5523883615 [1,0,0,0,0,0|2,0,1]=4 140 B7R0.2 NCC(N)CC(=O)O MCULE-7594259237 [1,0,0,0,0,0|2,0,1]=4 141 B7R0.2 NCC(O)CC(=O)O MCULE-9221352157 [1,0,0,0,0,0|2,0,1]=4 142 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-6348974465 [1,0,0,0,0,0|2,0,1]=4 143 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-9397628218 [1,0,0,0,0,0|2,0,1]=4 144 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-2174350055 [1,0,0,0,0,0|2,0,1]=4 145 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-8177708130 [1,0,0,0,0,0|2,0,1]=4 146 B7R0.2 NC[C@H](N)CC(=O)O MCULE-6133569516 [1,0,0,0,0,0|2,0,1]=4 147 B7R0.2 NC[C@H](N)CC(=O)O MCULE-7098533469 [1,0,0,0,0,0|2,0,1]=4 148 B7R0.2 NC[C@H](O)CC(=O)O MCULE-6634973995 [1,0,0,0,0,0|2,0,1]=4 149 B7R0.2 NC[C@H](O)CC(=O)O MCULE-8055679819 [1,0,0,0,0,0|2,0,1]=4 150 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [1,0,0,0,0,0|2,0,1]=4 151 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [1,0,0,0,0,0|2,0,1]=4 152 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [1,0,0,0,0,0|2,0,1]=4 153 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [1,0,0,0,0,0|2,0,1]=4 154 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [1,0,0,0,0,0|2,0,1]=4 155 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [1,0,0,0,0,0|2,0,1]=4 156 B7R0.5 C=C(Br)C(=O)OCC MCULE-3441307956 [1,0,0,0,0,0|3,0,0]=4 157 B7R0.5 C=C(C)C(=O)OCC MCULE-9496497565 [1,0,0,0,0,0|3,0,0]=4 158 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [1,0,0,0,0,0|1,0,0]=2 159 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [1,0,0,0,0,0|2,0,0]=3 160 B7R0.5 C=C(COC)C(=O)O MCULE-8964616960 [1,0,0,0,0,0|2,0,0]=3 161 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [1,0,0,0,0,0|2,0,1]=4 162 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [1,0,0,0,0,0|2,0,1]=4 163 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [1,0,0,0,0,0|2,0,1]=4 164 B7R0.5 CC/C=C(\C)/C(=O)O MCULE-1290613859 [1,0,0,0,0,0|1,0,1]=3 165 B7R0.5 CCC=C(C)C(=O)O MCULE-5045441145 [1,0,0,0,0,0|1,0,1]=3 166 B7R0.5 CCC=C(F)C(=O)O MCULE-6630499680 [1,0,0,0,0,0|1,0,1]=3 167 B7R0.5 CCCC(=C(F)F)F MCULE-1831306144 [1,0,0,0,0,0|3,0,0]=4 168 B7R0.5 CCCC(=O)C(=O)C MCULE-8267463586 [1,0,0,0,0,0|1,0,0]=2 169 B7R0.5 CCCC(=O)C(=O)N MCULE-6625605588 [1,0,0,0,0,0|1,0,0]=2 170 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [1,0,0,0,0,0|0,0,0]=1 171 B7R0.5 CCCC(=O)C(C)Br MCULE-8743472868 [1,0,0,0,0,0|2,0,1]=4 172 B7R0.5 CCCC(=O)C(C)C MCULE-7690543374 [1,0,0,0,0,0|2,0,1]=4 173 B7R0.5 CCCC(=O)N(C)C MCULE-8154537620 [1,0,0,0,0,0|3,0,0]=4 174 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [1,0,0,0,0,0|2,0,1]=4 175 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [1,0,0,0,0,0|1,0,1]=3 176 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [1,0,0,0,0,0|2,0,1]=4 177 B7R0.5 CCCC(C)C(=O)Cl MCULE-4855016209 [1,0,0,0,0,0|2,0,1]=4 178 B7R0.5 CCCC(C)C(=O)N MCULE-1948746391 [1,0,0,0,0,0|2,0,1]=4 179 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [1,0,0,0,0,0|1,0,1]=3 180 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [1,0,0,0,0,0|1,0,1]=3 181 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [1,0,0,0,0,0|1,0,1]=3 182 B7R0.5 CCCC(N)C(=O)N MCULE-5159221123 [1,0,0,0,0,0|2,0,1]=4 183 B7R0.5 CCCC(N)C(=O)N MCULE-5742773956 [1,0,0,0,0,0|2,0,1]=4 184 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [1,0,0,0,0,0|1,0,1]=3 185 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [1,0,0,0,0,0|1,0,1]=3 186 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [1,0,0,0,0,0|1,0,1]=3 187 B7R0.5 CCCC(O)C(=O)N MCULE-3143432132 [1,0,0,0,0,0|1,0,2]=4 188 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [1,0,0,0,0,0|0,0,2]=3 189 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [1,0,0,0,0,0|0,0,2]=3 190 B7R0.5 CCCN(C)C(=O)Cl MCULE-2930764127 [1,0,0,0,0,0|3,0,0]=4 191 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [1,0,0,0,0,0|1,0,1]=3 192 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [1,0,0,0,0,0|1,0,1]=3 193 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [1,0,0,0,0,0|0,0,2]=3 194 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [1,0,0,0,0,0|1,0,1]=3 195 B7R0.5 CCC[C@H](N)C(=O)N MCULE-2163059771 [1,0,0,0,0,0|2,0,1]=4 196 B7R0.5 CCC[C@H](N)C(=O)N MCULE-4687172013 [1,0,0,0,0,0|2,0,1]=4 197 B7R0.5 CCC[C@H](N)C(=O)N MCULE-7482592029 [1,0,0,0,0,0|2,0,1]=4 198 B7R0.5 CCC[C@H](N)C(=O)N MCULE-9639796243 [1,0,0,0,0,0|2,0,1]=4 199 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [1,0,0,0,0,0|1,0,1]=3 200 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [1,0,0,0,0,0|1,0,1]=3 201 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [1,0,0,0,0,0|1,0,1]=3 202 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [1,0,0,0,0,0|0,0,2]=3 203 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [1,0,0,0,0,0|0,0,2]=3 204 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [1,0,0,0,0,0|1,0,0]=2 205 B7R0.5 CCNC(=O)[C@H](C)O MCULE-9098995292 [1,0,0,0,0,0|2,0,1]=4 206 B7R0.5 CCNC(C)C(=O)O MCULE-5445574810 [1,0,0,0,0,0|2,0,1]=4 207 B7R0.5 CCNC(C)C(=O)O MCULE-5666785247 [1,0,0,0,0,0|2,0,1]=4 208 B7R0.5 CCN[C@H](C)C(=O)O MCULE-9676358201 [1,0,0,0,0,0|2,0,1]=4 209 B7R0.5 CCOC(=O)C(=N)N MCULE-4853735680 [1,0,0,0,0,0|3,0,0]=4 210 B7R0.5 CCOC(=O)C(=N)N MCULE-9212797796 [1,0,0,0,0,0|3,0,0]=4 211 B7R0.5 CCOC(=O)C(=O)C MCULE-5817261721 [1,0,0,0,0,0|2,0,0]=3 212 B7R0.5 CCOC(=O)C(=O)Cl MCULE-6454421959 [1,0,0,0,0,0|2,0,0]=3 213 B7R0.5 CCOC(=O)C(=O)N MCULE-2968497645 [1,0,0,0,0,0|2,0,0]=3 214 B7R0.5 CCOC(=O)C(=O)O MCULE-2368024441 [1,0,0,0,0,0|1,0,0]=2 215 B7R0.5 CCOC(=O)C(=O)[O-] MCULE-1807862684 [1,0,0,0,0,0|1,0,1]=3 216 B7R0.5 CCOC(=O)C(=S)N MCULE-3285821799 [1,0,0,0,0,0|2,1,0]=4 217 B7R0.5 CCOC(=O)C(C)O MCULE-8057202883 [1,0,0,0,0,0|2,0,1]=4 218 B7R0.5 CCOC(=O)C(C)O MCULE-9679398205 [1,0,0,0,0,0|2,0,1]=4 219 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-3372948910 [1,0,0,0,0,0|2,0,1]=4 220 B7R0.5 CCOC(=O)[C@@H](C)O MCULE-5795033916 [1,0,0,0,0,0|2,0,1]=4 221 B7R0.5 CCOC(=O)[C@H](C)O MCULE-4333545760 [1,0,0,0,0,0|2,0,1]=4 222 B7R0.5 CCOC(=O)[C@H](C)O MCULE-8787861948 [1,0,0,0,0,0|2,0,1]=4 223 B7R0.5 CCOC(=S)C(=O)N MCULE-4600711043 [1,0,0,0,0,0|2,1,0]=4 224 B7R0.5 CCOC(C)C(=O)O MCULE-2185795311 [1,0,0,0,0,0|2,0,1]=4 225 B7R0.5 CCSC(C)C(=O)O MCULE-9817243573 [1,0,0,0,0,0|2,0,1]=4 226 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [1,0,0,0,0,0|2,0,1]=4 227 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [1,0,0,0,0,0|2,0,1]=4 228 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [1,0,0,0,0,0|2,0,1]=4 229 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [1,0,0,0,0,0|2,0,1]=4 230 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [1,0,0,0,0,0|2,0,1]=4 231 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [1,0,0,0,0,0|2,0,1]=4 232 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [1,0,0,0,0,0|2,0,1]=4 233 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [1,0,0,0,0,0|2,0,1]=4 234 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [1,0,0,0,0,0|2,0,1]=4 235 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [1,0,0,0,0,0|2,0,1]=4 236 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [1,0,0,0,0,0|2,0,1]=4 237 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [1,0,0,0,0,0|2,0,1]=4 238 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [1,0,0,0,0,0|2,0,1]=4 239 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [1,0,0,0,0,0|2,0,1]=4 240 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [1,0,0,0,0,0|2,0,1]=4 241 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [1,0,0,0,0,0|1,0,2]=4 242 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [1,0,0,0,0,0|2,0,1]=4 243 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [1,0,0,0,0,0|2,0,1]=4 244 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [1,0,0,0,0,0|2,0,1]=4 245 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [1,0,0,0,0,0|2,0,1]=4 246 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [1,0,0,0,0,0|2,0,1]=4 247 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [1,0,0,0,0,0|2,0,1]=4 248 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [1,0,0,0,0,0|2,0,1]=4 249 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [1,0,0,0,0,0|2,0,1]=4 250 B7R0.5 CON=C(C)C(=O)O MCULE-8599774085 [1,0,0,0,0,0|3,0,0]=4 251 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [1,0,0,0,0,0|2,0,1]=4 252 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [1,0,0,0,0,0|2,0,1]=4 253 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [1,0,0,0,0,0|2,0,1]=4 254 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [1,0,0,0,0,0|2,0,1]=4 255 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [1,0,0,0,0,0|2,0,1]=4 256 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [1,0,0,0,0,0|2,0,1]=4 257 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [1,0,0,0,0,0|2,0,1]=4 258 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [1,0,0,0,0,0|2,0,1]=4 259 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [1,0,0,0,0,0|2,0,1]=4 260 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [1,0,0,0,0,0|2,0,1]=4 261 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [1,0,0,0,0,0|2,0,1]=4 262 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [1,0,0,0,0,0|2,0,1]=4 263 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [1,0,0,0,0,0|2,0,1]=4 264 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [1,0,0,0,0,0|2,0,1]=4 265 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [1,0,0,0,0,0|2,0,1]=4 266 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [1,0,0,0,0,0|2,0,1]=4 267 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [1,0,0,0,0,0|2,0,1]=4 268 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [1,0,0,0,0,0|2,0,1]=4 269 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [1,0,0,0,0,0|2,0,1]=4 270 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [1,0,0,0,0,0|2,0,1]=4 271 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [1,0,0,0,0,0|2,0,1]=4 272 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [1,0,0,0,0,0|2,0,1]=4 273 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [1,0,0,0,0,0|2,0,1]=4 274 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [1,0,0,0,0,0|2,0,1]=4 275 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [1,0,0,0,0,0|2,0,1]=4 276 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [1,0,0,0,0,0|2,0,1]=4 277 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [1,0,0,0,0,0|2,0,1]=4 278 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [1,0,0,0,0,0|2,0,1]=4 279 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [1,0,0,0,0,0|1,0,2]=4 280 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [1,0,0,0,0,0|1,0,2]=4 281 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [1,0,0,0,0,0|2,0,1]=4 282 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [1,0,0,0,0,0|2,0,1]=4 283 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [1,0,0,0,0,0|2,0,1]=4 284 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [1,0,0,0,0,0|2,0,1]=4 285 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [1,0,0,0,0,0|1,0,2]=4 286 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [1,0,0,0,0,0|2,0,1]=4 287 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [1,0,0,0,0,0|2,0,1]=4 288 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [1,0,0,0,0,0|2,0,1]=4 289 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [1,0,0,0,0,0|2,0,1]=4 290 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [1,0,0,0,0,0|2,0,1]=4 291 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [1,0,0,0,0,0|2,0,1]=4 292 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [1,0,0,0,0,0|2,0,1]=4 293 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [1,0,0,0,0,0|2,0,1]=4 294 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [1,0,0,0,0,0|2,0,1]=4 295 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [1,0,0,0,0,0|1,0,2]=4 296 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [1,0,0,0,0,0|1,0,2]=4 297 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [1,0,0,0,0,0|2,0,1]=4 298 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [1,0,0,0,0,0|2,0,1]=4 299 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [1,0,0,0,0,0|2,0,1]=4 300 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [1,0,0,0,0,0|2,0,1]=4 301 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [1,0,0,0,0,0|2,0,1]=4 302 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [1,0,0,0,0,0|2,0,1]=4 303 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [1,0,0,0,0,0|2,0,1]=4 304 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [1,0,0,0,0,0|2,0,1]=4 305 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [1,0,0,0,0,0|2,0,1]=4 306 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [1,0,0,0,0,0|2,0,1]=4 307 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [1,0,0,0,0,0|2,0,1]=4 308 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [1,0,0,0,0,0|2,0,1]=4 309 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [1,0,0,0,0,0|2,0,1]=4 310 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [1,0,0,0,0,0|2,0,1]=4 311 B7R0.5 O=C(O)C(Br)CCBr MCULE-3091819269 [1,0,0,0,0,0|2,0,1]=4 312 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [1,0,0,0,0,0|1,0,2]=4 313 B7R0.10 C=CC(=O)N(C)CC MCULE-8629361048 [1,0,0,0,0,0|2,0,0]=3 314 B7R0.10 C=CC(=O)N(C)OC MCULE-8945434721 [1,0,0,0,0,0|3,0,0]=4 315 B7R0.10 C=CC(C)C(C)CC MCULE-2366850706 [1,0,0,0,0,0|2,0,1]=4 316 B7R0.10 CC(CCl)C(=N)NO MCULE-4023987029 [1,0,0,0,0,0|3,0,0]=4 317 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [1,0,0,0,0,0|2,0,1]=4 318 B7R0.10 CCC(=O)N(C)CC MCULE-1764457516 [1,0,0,0,0,0|2,0,1]=4 319 B7R0.10 CCC(Br)C(=O)NC MCULE-5335067622 [1,0,0,0,0,0|3,0,0]=4 320 B7R0.10 CCC(Br)C(=O)OC MCULE-2335527491 [1,0,0,0,0,0|3,0,0]=4 321 B7R0.10 CCC(C)/C(=N/O)/N MCULE-3220820796 [1,0,0,0,0,0|2,0,0]=3 322 B7R0.10 CCC(C)/C(=N/O)/N MCULE-6860766298 [1,0,0,0,0,0|2,0,0]=3 323 B7R0.10 CCC(C)C(=O)CBr MCULE-7022126762 [1,0,0,0,0,0|1,0,1]=3 324 B7R0.10 CCC(C)C(=O)CCl MCULE-6800466655 [1,0,0,0,0,0|1,0,1]=3 325 B7R0.10 CCC(C)C(=O)NC MCULE-5599095900 [1,0,0,0,0,0|2,0,0]=3 326 B7R0.10 CCC(C)C(=O)NN MCULE-4144584435 [1,0,0,0,0,0|2,0,0]=3 327 B7R0.10 CCC(C)C(=O)OC MCULE-9845747952 [1,0,0,0,0,0|2,0,0]=3 328 B7R0.10 CCC(C)C(N)CO MCULE-3990781918 [1,0,0,0,0,0|1,0,2]=4 329 B7R0.10 CCC(C)C(N)CO MCULE-9261445768 [1,0,0,0,0,0|1,0,2]=4 330 B7R0.10 CCC(C)C(O)CO MCULE-9999862073 [1,0,0,0,0,0|0,0,3]=4 331 B7R0.10 CCC(Cl)C(=O)OC MCULE-4773486285 [1,0,0,0,0,0|3,0,0]=4 332 B7R0.10 CCC(N)C(=O)NC MCULE-7274856339 [1,0,0,0,0,0|3,0,0]=4 333 B7R0.10 CCC(N)C(=O)NC MCULE-9912780545 [1,0,0,0,0,0|3,0,0]=4 334 B7R0.10 CCC(N)C(=O)NO MCULE-9162328479 [1,0,0,0,0,0|2,0,0]=3 335 B7R0.10 CCC(N)C(=O)OC MCULE-1569242271 [1,0,0,0,0,0|3,0,0]=4 336 B7R0.10 CCC(N)C(=O)OC MCULE-3183954116 [1,0,0,0,0,0|3,0,0]=4 337 B7R0.10 CCC(N)C(=O)OC MCULE-4045754117 [1,0,0,0,0,0|3,0,0]=4 338 B7R0.10 CCC(N)C(=O)OC MCULE-5328984047 [1,0,0,0,0,0|3,0,0]=4 339 B7R0.10 CCC(O)C(=O)OC MCULE-8768500574 [1,0,0,0,0,0|3,0,0]=4 340 B7R0.10 CCN(C)C(=O)CBr MCULE-4444194334 [1,0,0,0,0,0|2,0,1]=4 341 B7R0.10 CCN(C)C(=O)CCl MCULE-7762522604 [1,0,0,0,0,0|2,0,1]=4 342 B7R0.10 CC[C@@H](Br)C(=O)OC MCULE-2676798410 [1,0,0,0,0,0|3,0,0]=4 343 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-2122638055 [1,0,0,0,0,0|1,0,2]=4 344 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-7964651759 [1,0,0,0,0,0|1,0,2]=4 345 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-8482653298 [1,0,0,0,0,0|1,0,2]=4 346 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6794991435 [1,0,0,0,0,0|3,0,0]=4 347 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6825672331 [1,0,0,0,0,0|3,0,0]=4 348 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-7307663817 [1,0,0,0,0,0|3,0,0]=4 349 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-8717527808 [1,0,0,0,0,0|3,0,0]=4 350 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-6916010003 [1,0,0,0,0,0|3,0,0]=4 351 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-9376722018 [1,0,0,0,0,0|3,0,0]=4 352 B7R0.10 CC[C@H](Br)C(=O)OC MCULE-5490793206 [1,0,0,0,0,0|3,0,0]=4 353 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-3647332227 [1,0,0,0,0,0|1,0,2]=4 354 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-5774547825 [1,0,0,0,0,0|1,0,2]=4 355 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8401203397 [1,0,0,0,0,0|1,0,2]=4 356 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8452836661 [1,0,0,0,0,0|1,0,2]=4 357 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-9307589673 [1,0,0,0,0,0|1,0,2]=4 358 B7R0.10 CC[C@H](N)C(=O)OC MCULE-2336816190 [1,0,0,0,0,0|3,0,0]=4 359 B7R0.10 CC[C@H](N)C(=O)OC MCULE-3480066740 [1,0,0,0,0,0|3,0,0]=4 360 B7R0.10 CC[C@H](N)C(=O)OC MCULE-4883083558 [1,0,0,0,0,0|3,0,0]=4 361 B7R0.10 CC[C@H](N)C(=O)OC MCULE-6241184216 [1,0,0,0,0,0|3,0,0]=4 362 B7R0.10 CC[C@H](O)C(=O)OC MCULE-5873092635 [1,0,0,0,0,0|3,0,0]=4 363 B7R0.10 CC[C@H](O)C(=O)OC MCULE-8209874812 [1,0,0,0,0,0|3,0,0]=4 364 B7R0.10 CNC(=O)C(C)CN MCULE-6853199259 [1,0,0,0,0,0|3,0,0]=4 365 B7R0.10 CNC(=O)C(C)CN MCULE-9315732080 [1,0,0,0,0,0|3,0,0]=4 366 B7R0.10 CNC(=O)C(C)NC MCULE-5788965533 [1,0,0,0,0,0|3,0,0]=4 367 B7R0.10 CNC(=O)[C@H](C)NC MCULE-4236618966 [1,0,0,0,0,0|3,0,0]=4 368 B7R0.10 CNC(=O)[C@H](C)NC MCULE-9974564724 [1,0,0,0,0,0|3,0,0]=4 369 B7R0.10 CNC(C)C(=O)OC MCULE-1524259113 [1,0,0,0,0,0|3,0,0]=4 370 B7R0.10 CNC(C)C(=O)OC MCULE-2414146201 [1,0,0,0,0,0|3,0,0]=4 371 B7R0.10 CNC(C)C(=O)OC MCULE-3192973771 [1,0,0,0,0,0|3,0,0]=4 372 B7R0.10 CNC(C)C(=O)OC MCULE-9929257431 [1,0,0,0,0,0|3,0,0]=4 373 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-1271745038 [1,0,0,0,0,0|3,0,0]=4 374 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-3018199319 [1,0,0,0,0,0|3,0,0]=4 375 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3420184809 [1,0,0,0,0,0|3,0,0]=4 376 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3818454089 [1,0,0,0,0,0|3,0,0]=4 377 B7R0.10 CN[C@H](C)C(=O)OC MCULE-8297775033 [1,0,0,0,0,0|3,0,0]=4 378 B7R0.10 CN[C@H](C)C(=O)OC MCULE-9637759835 [1,0,0,0,0,0|3,0,0]=4 379 B7R0.10 COC(=O)C(C)CBr MCULE-5887558960 [1,0,0,0,0,0|3,0,0]=4 380 B7R0.10 COC(=O)C(C)CBr MCULE-9291707503 [1,0,0,0,0,0|3,0,0]=4 381 B7R0.10 COC(=O)C(C)CN MCULE-8139628698 [1,0,0,0,0,0|3,0,0]=4 382 B7R0.10 COC(=O)C(C)CN MCULE-8839292519 [1,0,0,0,0,0|3,0,0]=4 383 B7R0.10 COC(=O)C(C)CO MCULE-1168600238 [1,0,0,0,0,0|3,0,0]=4 384 B7R0.10 COC(=O)C(C)CO MCULE-9207150786 [1,0,0,0,0,0|3,0,0]=4 385 B7R0.10 COC(=O)C(C)CS MCULE-2870797526 [1,0,0,0,0,0|3,0,0]=4 386 B7R0.10 COC(=O)C(C)OC MCULE-3274761391 [1,0,0,0,0,0|3,0,0]=4 387 B7R0.10 COC(=O)C(C)SC MCULE-6914204626 [1,0,0,0,0,0|3,0,0]=4 388 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-5530851181 [1,0,0,0,0,0|3,0,0]=4 389 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-8885621324 [1,0,0,0,0,0|3,0,0]=4 390 B7R0.10 COC(=O)[C@@H](C)CN MCULE-7205157481 [1,0,0,0,0,0|3,0,0]=4 391 B7R0.10 COC(=O)[C@@H](C)CN MCULE-9885299909 [1,0,0,0,0,0|3,0,0]=4 392 B7R0.10 COC(=O)[C@@H](C)CO MCULE-6738074317 [1,0,0,0,0,0|3,0,0]=4 393 B7R0.10 COC(=O)[C@@H](C)CO MCULE-9697255968 [1,0,0,0,0,0|3,0,0]=4 394 B7R0.10 COC(=O)[C@H](C)CBr MCULE-3829202918 [1,0,0,0,0,0|3,0,0]=4 395 B7R0.10 COC(=O)[C@H](C)CBr MCULE-4931737781 [1,0,0,0,0,0|3,0,0]=4 396 B7R0.10 COC(=O)[C@H](C)CN MCULE-4694019206 [1,0,0,0,0,0|3,0,0]=4 397 B7R0.10 COC(=O)[C@H](C)CN MCULE-9113866081 [1,0,0,0,0,0|3,0,0]=4 398 B7R0.10 COC(=O)[C@H](C)CO MCULE-5719676432 [1,0,0,0,0,0|3,0,0]=4 399 B7R0.10 COC(=O)[C@H](C)CO MCULE-8479546806 [1,0,0,0,0,0|3,0,0]=4 400 B7R0.10 COC(=O)[C@H](C)OC MCULE-3095326114 [1,0,0,0,0,0|3,0,0]=4 401 B7R0.10 COC(C)/C(=N/O)/N MCULE-3009628521 [1,0,0,0,0,0|3,0,0]=4 402 B7R0.10 COC(C)C(=O)NN MCULE-7263059210 [1,0,0,0,0,0|3,0,0]=4 403 B7R0.10 NC(CCl)C(=O)NO MCULE-8256545065 [1,0,0,0,0,0|3,0,0]=4 404 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [1,0,0,0,0,0|2,0,1]=4 405 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [1,0,0,0,0,0|2,0,1]=4 406 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [1,0,0,0,0,0|2,0,1]=4 407 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [1,0,0,0,0,0|2,0,1]=4 408 B7R0.10 [C@@H](C)(CC)[C@@H](N)CO MCULE-4423825378 [1,0,0,0,0,0|1,0,2]=4 409 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-1799930850 [1,0,0,0,0,0|3,0,0]=4 410 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-5931188957 [1,0,0,0,0,0|3,0,0]=4 411 B7R0.16 C=C(C(=O)O)C(C)C MCULE-6667026437 [1,0,0,0,0,0|1,0,0]=2 412 B7R0.16 C=C(C)C(=O)C(C)C MCULE-6219149152 [1,0,0,0,0,0|2,0,0]=3 413 B7R0.16 C=C(C)C(=O)N(C)C MCULE-5921699549 [1,0,0,0,0,0|3,0,0]=4 414 B7R0.16 CC(=C(Br)C(=O)O)C MCULE-8944482091 [1,0,0,0,0,0|1,0,1]=3 415 B7R0.16 CC(=C(C)C(=O)O)Br MCULE-9431818570 [1,0,0,0,0,0|2,0,1]=4 416 B7R0.16 CC(=C(C)C(=O)O)C MCULE-1062537992 [1,0,0,0,0,0|1,0,1]=3 417 B7R0.16 CC(=C(C)C(C)C)C MCULE-1277261872 [1,0,0,0,0,0|3,0,0]=4 418 B7R0.16 CC(=C(Cl)C(=O)O)C MCULE-9408683615 [1,0,0,0,0,0|1,0,1]=3 419 B7R0.16 CC(=C(F)C(=O)O)C MCULE-9025515032 [1,0,0,0,0,0|1,0,1]=3 420 B7R0.16 CC(=O)C(=O)C(C)Br MCULE-8153095418 [1,0,0,0,0,0|2,0,0]=3 421 B7R0.16 CC(=O)C(=O)N(C)C MCULE-9467983911 [1,0,0,0,0,0|2,0,0]=3 422 B7R0.16 CC(=O)C(Br)C(C)C MCULE-2864707278 [1,0,0,0,0,0|2,0,1]=4 423 B7R0.16 CC(=O)C(Cl)C(C)C MCULE-2825069638 [1,0,0,0,0,0|2,0,1]=4 424 B7R0.16 CC(Br)C(Br)C(=O)O MCULE-8605068480 [1,0,0,0,0,0|2,0,1]=4 425 B7R0.16 CC(Br)C(O)C(=O)O MCULE-8231714451 [1,0,0,0,0,0|1,0,2]=4 426 B7R0.16 CC(C(=O)O)N(C)C MCULE-2658921782 [1,0,0,0,0,0|2,0,1]=4 427 B7R0.16 CC(C(=O)O)N(C)C MCULE-4457336101 [1,0,0,0,0,0|2,0,1]=4 428 B7R0.16 CC(C)C(=O)C(=O)Cl MCULE-6254092186 [1,0,0,0,0,0|1,0,0]=2 429 B7R0.16 CC(C)C(=O)C(=O)O MCULE-9877767821 [1,0,0,0,0,0|0,0,0]=1 430 B7R0.16 CC(C)C(=O)C(=O)[O-] MCULE-3960241746 [1,0,0,0,0,0|0,0,1]=2 431 B7R0.16 CC(C)C(=O)C(C)Br MCULE-3431811578 [1,0,0,0,0,0|2,0,1]=4 432 B7R0.16 CC(C)C(=O)C(C)C MCULE-2525492530 [1,0,0,0,0,0|2,0,1]=4 433 B7R0.16 CC(C)C(=O)N(C)C MCULE-7036977402 [1,0,0,0,0,0|3,0,0]=4 434 B7R0.16 CC(C)C(Br)C(=O)Br MCULE-7135511419 [1,0,0,0,0,0|2,0,1]=4 435 B7R0.16 CC(C)C(Br)C(=O)Cl MCULE-7468132927 [1,0,0,0,0,0|2,0,1]=4 436 B7R0.16 CC(C)C(Br)C(=O)N MCULE-8059032804 [1,0,0,0,0,0|2,0,1]=4 437 B7R0.16 CC(C)C(Br)C(=O)O MCULE-7284929535 [1,0,0,0,0,0|1,0,1]=3 438 B7R0.16 CC(C)C(Br)C(=O)O MCULE-8100016953 [1,0,0,0,0,0|1,0,1]=3 439 B7R0.16 CC(C)C(C)C(=O)Cl MCULE-4466867108 [1,0,0,0,0,0|2,0,1]=4 440 B7R0.16 CC(C)C(C)C(=O)O MCULE-4998524686 [1,0,0,0,0,0|1,0,1]=3 441 B7R0.16 CC(C)C(Cl)C(=O)Cl MCULE-8764699774 [1,0,0,0,0,0|2,0,1]=4 442 B7R0.16 CC(C)C(Cl)C(=O)O MCULE-8634615546 [1,0,0,0,0,0|1,0,1]=3 443 B7R0.16 CC(C)C(F)C(=O)O MCULE-5644342535 [1,0,0,0,0,0|1,0,1]=3 444 B7R0.16 CC(C)C(N)C(=O)N MCULE-5793065876 [1,0,0,0,0,0|2,0,1]=4 445 B7R0.16 CC(C)C(N)C(=O)N MCULE-6836215171 [1,0,0,0,0,0|2,0,1]=4 446 B7R0.16 CC(C)C(N)C(=O)O MCULE-8140660263 [1,0,0,0,0,0|1,0,1]=3 447 B7R0.16 CC(C)C(N)C(=O)O MCULE-9199801639 [1,0,0,0,0,0|1,0,1]=3 448 B7R0.16 CC(C)C(O)C(=O)O MCULE-6517225229 [1,0,0,0,0,0|0,0,2]=3 449 B7R0.16 CC(C)C(O)C(=O)O MCULE-7748605101 [1,0,0,0,0,0|0,0,2]=3 450 B7R0.16 CC(C)N(C)C(=O)Cl MCULE-1063482503 [1,0,0,0,0,0|3,0,0]=4 451 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-2705531785 [1,0,0,0,0,0|1,0,1]=3 452 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-7570119486 [1,0,0,0,0,0|1,0,1]=3 453 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2330575489 [1,0,0,0,0,0|2,0,1]=4 454 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2653474443 [1,0,0,0,0,0|2,0,1]=4 455 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-3449326352 [1,0,0,0,0,0|2,0,1]=4 456 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-7409435805 [1,0,0,0,0,0|2,0,1]=4 457 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-1338052740 [1,0,0,0,0,0|1,0,1]=3 458 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-2459930572 [1,0,0,0,0,0|1,0,1]=3 459 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-7719048521 [1,0,0,0,0,0|0,0,2]=3 460 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-9864796653 [1,0,0,0,0,0|0,0,2]=3 461 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-4863317096 [1,0,0,0,0,0|1,0,1]=3 462 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-8695526864 [1,0,0,0,0,0|1,0,1]=3 463 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-4413397700 [1,0,0,0,0,0|1,0,1]=3 464 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-6269612306 [1,0,0,0,0,0|1,0,1]=3 465 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8084934210 [1,0,0,0,0,0|1,0,1]=3 466 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8307595659 [1,0,0,0,0,0|1,0,1]=3 467 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-1415573194 [1,0,0,0,0,0|2,0,1]=4 468 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-2742126302 [1,0,0,0,0,0|2,0,1]=4 469 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-3124084676 [1,0,0,0,0,0|2,0,1]=4 470 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-4854272542 [1,0,0,0,0,0|2,0,1]=4 471 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-7430998836 [1,0,0,0,0,0|2,0,1]=4 472 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-9899853579 [1,0,0,0,0,0|2,0,1]=4 473 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-2507309072 [1,0,0,0,0,0|1,0,1]=3 474 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-9143825935 [1,0,0,0,0,0|1,0,1]=3 475 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-1975771806 [1,0,0,0,0,0|0,0,2]=3 476 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-4070611738 [1,0,0,0,0,0|0,0,2]=3 477 B7R0.16 CC(F)C(N)C(=O)O MCULE-8810968604 [1,0,0,0,0,0|2,0,1]=4 478 B7R0.16 CC(N)C(C)C(=O)O MCULE-2921617741 [1,0,0,0,0,0|2,0,1]=4 479 B7R0.16 CC(N)C(C)C(=O)O MCULE-8511267926 [1,0,0,0,0,0|2,0,1]=4 480 B7R0.16 CC(N)C(O)C(=O)O MCULE-1086139043 [1,0,0,0,0,0|1,0,2]=4 481 B7R0.16 CC(N)C(O)C(=O)O MCULE-6405300346 [1,0,0,0,0,0|1,0,2]=4 482 B7R0.16 CC(O)C(=O)N(C)C MCULE-9214363632 [1,0,0,0,0,0|2,0,1]=4 483 B7R0.16 CC(O)C(C)C(=O)O MCULE-2499360516 [1,0,0,0,0,0|2,0,1]=4 484 B7R0.16 CC(O)C(N)C(=O)O MCULE-1563595722 [1,0,0,0,0,0|2,0,1]=4 485 B7R0.16 CC(O)C(N)C(=O)O MCULE-5581920538 [1,0,0,0,0,0|2,0,1]=4 486 B7R0.16 CN(C)C(=O)C(=O)O MCULE-4063274840 [1,0,0,0,0,0|1,0,0]=2 487 B7R0.16 C[C@@H](C(=O)O)N(C)C MCULE-1371350024 [1,0,0,0,0,0|2,0,1]=4 488 B7R0.16 C[C@@H](C(=O)O)N(C)C MCULE-2001661938 [1,0,0,0,0,0|2,0,1]=4 489 B7R0.16 C[C@@H](C(=O)O)N(C)C MCULE-6789128261 [1,0,0,0,0,0|2,0,1]=4 490 B7R0.16 C[C@@H](N)[C@@H](N)C(=O)O MCULE-5302456851 [1,0,0,0,0,0|2,0,1]=4 491 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-1663687439 [1,0,0,0,0,0|2,0,1]=4 492 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-3863591433 [1,0,0,0,0,0|2,0,1]=4 493 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-8080019797 [1,0,0,0,0,0|2,0,1]=4 494 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-9284411012 [1,0,0,0,0,0|2,0,1]=4 495 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2430667007 [1,0,0,0,0,0|2,0,1]=4 496 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2676185993 [1,0,0,0,0,0|2,0,1]=4 497 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5254477364 [1,0,0,0,0,0|2,0,1]=4 498 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5505393195 [1,0,0,0,0,0|2,0,1]=4 499 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-7379719940 [1,0,0,0,0,0|2,0,1]=4 500 B7R0.16 C[C@@H](O)[C@H](O)C(=O)O MCULE-9383777855 [1,0,0,0,0,0|1,0,2]=4 501 B7R0.16 C[C@H](C(=O)O)N(C)C MCULE-2210848569 [1,0,0,0,0,0|2,0,1]=4 502 B7R0.16 C[C@H](C(=O)O)N(C)C MCULE-5148086527 [1,0,0,0,0,0|2,0,1]=4 503 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2245171795 [1,0,0,0,0,0|2,0,1]=4 504 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2727261050 [1,0,0,0,0,0|2,0,1]=4 505 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O MCULE-8875933839 [1,0,0,0,0,0|2,0,1]=4 506 B7R0.16 C[C@H](N)[C@@H](N)C(=O)O MCULE-9507122128 [1,0,0,0,0,0|2,0,1]=4 507 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-2574349608 [1,0,0,0,0,0|1,0,2]=4 508 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-6297204649 [1,0,0,0,0,0|1,0,2]=4 509 B7R0.16 C[C@H](N)[C@H](N)C(=O)O MCULE-3178389621 [1,0,0,0,0,0|2,0,1]=4 510 B7R0.16 C[C@H](O)C(N)C(=O)O MCULE-6661175670 [1,0,0,0,0,0|2,0,1]=4 511 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-6288272506 [1,0,0,0,0,0|2,0,1]=4 512 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-7203096302 [1,0,0,0,0,0|2,0,1]=4 513 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-9531951265 [1,0,0,0,0,0|2,0,1]=4 514 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-2246314901 [1,0,0,0,0,0|2,0,1]=4 515 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-9478987169 [1,0,0,0,0,0|2,0,1]=4 516 B7R0.16 O=C(O)C(=O)C(=O)O MCULE-9031084199 [1,0,0,0,0,0|2,0,1]=4 517 B7R0.16 O=C(O)C(=O)C(Br)Br MCULE-6847251467 [1,0,0,0,0,0|2,0,0]=3 518 B9R0.6 CCCC(C)C(=O)C(C)C MCULE-1550454602 [0,1,0,0,0,0|2,0,1]=4 519 B9R0.6 CCCC(C)C(N)C(=O)O MCULE-3481285649 [0,1,0,0,0,0|1,0,1]=3 520 B9R0.6 CCCC(O)C(N)C(=O)O MCULE-5391337444 [0,1,0,0,0,0|2,0,1]=4 521 B9R0.6 CCC[C@@H](N)[C@@H](O)C(=O)O MCULE-2918610954 [0,1,0,0,0,0|1,0,2]=4 522 B9R0.6 CCC[C@@H](N)[C@H](O)C(=O)O MCULE-1958502407 [0,1,0,0,0,0|1,0,2]=4 523 B9R0.6 CCC[C@H](N)C(O)C(=O)O MCULE-8649182139 [0,1,0,0,0,0|1,0,2]=4 524 B9R0.6 CCOC(=O)C(=O)C(=O)C MCULE-9413993780 [0,1,0,0,0,0|2,0,1]=4 525 B9R0.6 CCOC(C)C(=O)C(O)O MCULE-3687671794 [0,1,0,0,0,0|0,0,2]=3 526 B9R0.6 COCC(C)C(C)C(=O)O MCULE-8168198082 [0,1,0,0,0,0|1,0,1]=3 527 B9R0.27 CCC(C)C(=O)C(C)CC MCULE-5205263443 [0,1,0,0,0,0|2,0,1]=4 528 B9R0.27 CCC(C)C(=O)N(C)OC MCULE-7932955475 [0,1,0,0,0,0|2,0,0]=3 529 B9R0.27 CCC(C)C(Cl)C(=O)OC MCULE-4549387192 [0,1,0,0,0,0|1,0,1]=3 530 B9R0.27 CCC(C)C(N)C(=O)CCl MCULE-4483538140 [0,1,0,0,0,0|2,0,1]=4 531 B9R0.27 CCC(C)C(N)C(=O)CCl MCULE-8837034349 [0,1,0,0,0,0|2,0,1]=4 532 B9R0.27 CCC(C)C(N)C(=O)OC MCULE-1846968686 [0,1,0,0,0,0|1,0,1]=3 533 B9R0.27 CCC(C)C(N)C(=O)OC MCULE-3209850544 [0,1,0,0,0,0|1,0,1]=3 534 B9R0.27 CCC(C)C(O)C(=O)OC MCULE-8434457313 [0,1,0,0,0,0|0,0,2]=3 535 B9R0.27 CCC(N)C(O)C(=O)OC MCULE-5958902036 [0,1,0,0,0,0|1,0,2]=4 536 B9R0.27 CCC(N)C(O)C(=O)OC MCULE-7272235506 [0,1,0,0,0,0|1,0,2]=4 537 B9R0.27 CCC(O)C(C)C(=O)OC MCULE-2007143538 [0,1,0,0,0,0|2,0,1]=4 538 B9R0.27 CC[C@@H](C)[C@H](N)C(=O)OC MCULE-5533680436 [0,1,0,0,0,0|1,0,1]=3 539 B9R0.27 CC[C@@H](C)[C@H](N)C(=O)OC MCULE-7868747169 [0,1,0,0,0,0|1,0,1]=3 540 B9R0.27 CC[C@@H](C)[C@H](N)C(=O)OC MCULE-9579020209 [0,1,0,0,0,0|1,0,1]=3 541 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC MCULE-1729886523 [0,1,0,0,0,0|1,0,1]=3 542 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC MCULE-2521314466 [0,1,0,0,0,0|1,0,1]=3 543 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC MCULE-5130592222 [0,1,0,0,0,0|1,0,1]=3 544 B9R0.27 CC[C@H](C)[C@@H](N)C(=O)OC MCULE-6653217048 [0,1,0,0,0,0|1,0,1]=3 545 B9R0.27 CC[C@H](C)[C@H](N)C(=O)CCl MCULE-2281100748 [0,1,0,0,0,0|2,0,1]=4 546 B9R0.27 CC[C@H](C)[C@H](N)C(=O)CCl MCULE-5249500214 [0,1,0,0,0,0|2,0,1]=4 547 B9R0.27 CC[C@H](C)[C@H](N)C(=O)CCl MCULE-6738846261 [0,1,0,0,0,0|2,0,1]=4 548 B9R0.27 CC[C@H](C)[C@H](N)C(=O)CCl MCULE-9006274135 [0,1,0,0,0,0|2,0,1]=4 549 B9R0.27 CC[C@H](C)[C@H](N)C(=O)NC MCULE-4817137974 [0,1,0,0,0,0|2,0,1]=4 550 B9R0.27 CC[C@H](C)[C@H](N)C(=O)NC MCULE-6810748923 [0,1,0,0,0,0|2,0,1]=4 551 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC MCULE-5150983559 [0,1,0,0,0,0|1,0,1]=3 552 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC MCULE-6620651568 [0,1,0,0,0,0|1,0,1]=3 553 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC MCULE-7115424543 [0,1,0,0,0,0|1,0,1]=3 554 B9R0.27 CC[C@H](C)[C@H](N)C(=O)OC MCULE-9658781072 [0,1,0,0,0,0|1,0,1]=3 555 B9R0.27 COC(=O)C(=O)N(C)OC MCULE-5786819783 [0,1,0,0,0,0|2,0,0]=3 556 B9R0.27 COC(=O)C(Br)C(C)OC MCULE-6549332688 [0,1,0,0,0,0|2,0,1]=4 557 B9R0.27 COC(=O)C(Cl)C(C)OC MCULE-5732373323 [0,1,0,0,0,0|2,0,1]=4 558 B9R0.27 COC(=O)C(O)C(C)OC MCULE-5538819656 [0,1,0,0,0,0|1,0,2]=4 559 B9R0.27 COC(=O)[C@@H](Cl)[C@@H](C)OC MCULE-1203632970 [0,1,0,0,0,0|2,0,1]=4 560 B9R0.28 CCC(C)C(F)(F)C(=O)O MCULE-8813807658 [0,1,0,0,0,0|1,0,1]=3 561 B9R0.28 CCC(O)C(F)(F)C(=O)O MCULE-8473962124 [0,1,0,0,0,0|2,0,1]=4 562 B9R0.28 CCN(C)C(C)(C)C(=O)O MCULE-1120650068 [0,1,0,0,0,0|2,0,1]=4 563 B9R0.29 CCC(C(=O)O)N(C)CC MCULE-1956799237 [0,1,0,0,0,0|2,0,1]=4 564 B9R0.29 CCC(C)C(CC)C(=O)N MCULE-4344033333 [0,1,0,0,0,0|2,0,1]=4 565 B9R0.29 CCC(C)C(NC)C(=O)O MCULE-1957885665 [0,1,0,0,0,0|1,0,1]=3 566 B9R0.29 CCC(C)C(OC)C(=O)O MCULE-7966384544 [0,1,0,0,0,0|0,0,2]=3 567 B9R0.29 CC[C@@H](C)[C@H](NC)C(=O)O MCULE-8364477291 [0,1,0,0,0,0|1,0,1]=3 568 B9R0.29 CC[C@H](C)[C@@H](CC)C(=O)N MCULE-3247505890 [0,1,0,0,0,0|2,0,1]=4 569 B9R0.29 CC[C@H](C)[C@@H](NC)C(=O)O MCULE-6136891317 [0,1,0,0,0,0|1,0,1]=3 570 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-1871065287 [0,1,0,0,0,0|1,0,1]=3 571 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-3891615565 [0,1,0,0,0,0|1,0,1]=3 572 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-9489341112 [0,1,0,0,0,0|1,0,1]=3 573 B9R0.29 COC(C)C(OC)C(=O)O MCULE-8500320405 [0,1,0,0,0,0|1,0,2]=4 574 B9R0.29 [C@H](C)(CC)[C@H](NC)C(=O)O MCULE-1663789159 [0,1,0,0,0,0|1,0,1]=3 575 B9R0.32 CC(C)(CN)C(O)C(=O)O MCULE-1251426662 [0,1,0,0,0,0|1,0,2]=4 576 B9R0.32 CC(C)(CO)C(=O)C(=O)O MCULE-6046561180 [0,1,0,0,0,0|1,0,0]=2 577 B9R0.32 CC(C)(CO)C(=O)C(=O)[O-] MCULE-7598598589 [0,1,0,0,0,0|1,0,1]=3 578 B9R0.32 CC(C)(CO)C(O)C(=O)O MCULE-3752332762 [0,1,0,0,0,0|1,0,2]=4 579 B9R0.32 CC(C)(CO)[C@@H](O)C(=O)O MCULE-7418140514 [0,1,0,0,0,0|1,0,2]=4 580 B9R0.32 CCC(C)(C)C(=O)C(=O)O MCULE-2609139055 [0,1,0,0,0,0|0,0,0]=1 581 B9R0.32 CCC(C)(C)C(N)C(=O)O MCULE-2030759346 [0,1,0,0,0,0|1,0,1]=3 582 B9R0.32 CCC(C)(C)C(N)C(=O)O MCULE-8756866734 [0,1,0,0,0,0|1,0,1]=3 583 B9R0.32 CCC(C)(C)C(O)C(=O)O MCULE-6783140520 [0,1,0,0,0,0|0,0,2]=3 584 B9R0.32 CCC(C)(C)N(C)C(=O)Cl MCULE-2696642386 [0,1,0,0,0,0|3,0,0]=4 585 B9R0.32 CCC(C)(O)C(O)C(=O)O MCULE-6322081363 [0,1,0,0,0,0|0,0,2]=3 586 B9R0.32 COC(C)(C)C(Br)C(=O)O MCULE-4686359113 [0,1,0,0,0,0|2,0,1]=4 587 B9R0.32 COC(C)(C)C(N)C(=O)O MCULE-7291117506 [0,1,0,0,0,0|2,0,1]=4 588 B9R0.32 COC(C)(C)[C@H](N)C(=O)O MCULE-1351027484 [0,1,0,0,0,0|2,0,1]=4 589 B9R0.41 C=C(C)C(=O)N(CC)CC MCULE-6157133971 [0,1,0,0,0,0|3,0,0]=4 590 B9R0.41 CCC(CC)C(C)C(=O)O MCULE-8487981910 [0,1,0,0,0,0|1,0,1]=3 591 B9R0.41 CCC(CC)C(N)C(=O)N MCULE-1437498037 [0,1,0,0,0,0|2,0,1]=4 592 B9R0.41 CCC(CC)C(N)C(=O)O MCULE-5833155408 [0,1,0,0,0,0|1,0,1]=3 593 B9R0.41 CCC(CC)C(N)C(=O)O MCULE-6712053086 [0,1,0,0,0,0|1,0,1]=3 594 B9R0.41 CCC(CC)C(O)C(=O)N MCULE-7184457381 [0,1,0,0,0,0|1,0,2]=4 595 B9R0.41 CCC(CC)[C@@H](N)C(=O)O MCULE-2731098319 [0,1,0,0,0,0|1,0,1]=3 596 B9R0.41 CCC(CC)[C@H](N)C(=O)O MCULE-2848963263 [0,1,0,0,0,0|1,0,1]=3 597 B9R0.41 CCC(CC)[C@H](N)C(=O)O MCULE-7573557331 [0,1,0,0,0,0|1,0,1]=3 598 B9R0.41 CCN(CC)C(=O)C(=O)O MCULE-9769368325 [0,1,0,0,0,0|1,0,0]=2 599 B9R0.41 CCN(CC)C(C)C(=O)O MCULE-1799679345 [0,1,0,0,0,0|2,0,1]=4 600 B9R0.41 CN=C(C#N)C(=O)C(=O)O MCULE-3967951911 [0,1,0,0,0,0|1,0,2]=4 601 B9R0.79 CC(C)C(O)C(N)C(=O)O MCULE-8766263714 [0,1,0,0,0,0|2,0,1]=4 602 B9R0.79 CC(C)C(O)[C@H](N)C(=O)O MCULE-5332720895 [0,1,0,0,0,0|2,0,1]=4 603 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O MCULE-5667397461 [0,1,0,0,0,0|2,0,1]=4 604 B9R0.79 CC(C)[C@@H](O)[C@@H](N)C(=O)O MCULE-2425417830 [0,1,0,0,0,0|2,0,1]=4 605 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-5438285037 [0,1,0,0,0,0|2,0,1]=4 606 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-6278820254 [0,1,0,0,0,0|2,0,1]=4 607 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-7542741263 [0,1,0,0,0,0|2,0,1]=4 608 B9R0.79 CC(C)[C@@H](O)[C@H](N)C(=O)O MCULE-8101644962 [0,1,0,0,0,0|2,0,1]=4 609 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-6429723072 [0,1,0,0,0,0|2,0,1]=4 610 B9R0.79 CC(C)[C@H](O)[C@@H](N)C(=O)O MCULE-8455636907 [0,1,0,0,0,0|2,0,1]=4 611 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9657202987 [0,1,0,0,0,0|2,0,1]=4 612 B9R0.79 CC(C)[C@H](O)[C@H](N)C(=O)O MCULE-9762128000 [0,1,0,0,0,0|2,0,1]=4 613 B9R0.79 CC(O)C(C)C(N)C(=O)O MCULE-2897656809 [0,1,0,0,0,0|1,0,1]=3 614 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-6535308910 [0,1,0,0,0,0|1,0,1]=3 615 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-8450789997 [0,1,0,0,0,0|1,0,1]=3 616 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-1376333194 [0,1,0,0,0,0|1,0,1]=3 617 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-4005119004 [0,1,0,0,0,0|1,0,1]=3 618 B9R0.79 [C@@H](N)(C(=O)O)[C@@H](C)C(C)O MCULE-7488780154 [0,1,0,0,0,0|1,0,1]=3 619 B9R1.3 CC1=C(C(=O)CCC1)C MCULE-2092030294 [0,0,0,1,0,0|2,0,1]=4 620 B9R1.3 CC1=C(C(=O)CCC1)I MCULE-1524025435 [0,0,0,1,0,0|2,0,1]=4 621 B9R1.3 CC1CCCC(=O)C1=O MCULE-3677088238 [0,0,0,1,0,0|1,0,0]=2 622 B9R1.3 CC1CCCC(=O)C1C MCULE-1705022712 [0,0,0,1,0,0|2,0,1]=4 623 B9R1.3 CC1CCCC(C1=O)C MCULE-4896844140 [0,0,0,1,0,0|2,0,1]=4 624 B9R1.3 CC1CCNC(=O)C1N MCULE-8466322754 [0,0,0,1,0,0|2,0,1]=4 625 B9R1.3 CC1OC=CC(=O)C1=O MCULE-7675608776 [0,0,0,1,0,0|2,0,1]=4 626 B9R1.3 CN1CCCC(C1=O)O MCULE-9396895370 [0,0,0,1,0,0|2,0,1]=4 627 B9R1.3 CN1CCNC(=O)C1=O MCULE-8196761481 [0,0,0,1,0,0|2,0,0]=3 628 B9R1.3 NC1CCCN(C1=O)O MCULE-1786572763 [0,0,0,1,0,0|3,0,0]=4 629 B9R1.3 O=C1CCCC(C1=O)Br MCULE-4868069859 [0,0,0,1,0,0|2,0,0]=3 630 B9R1.37 CC1=C(C(=O)CC1C)O MCULE-3677110376 [0,0,0,1,0,0|1,0,2]=4 631 B9R1.37 CC1=C(C(=O)OC1C)O MCULE-8685541679 [0,0,0,1,0,0|0,0,2]=3 632 B9R1.37 CC1=C(C(OC1=O)C)C MCULE-1587463592 [0,0,0,1,0,0|1,0,1]=3 633 B9R1.37 CC1=C(C(OC1=O)C)O MCULE-9804613276 [0,0,0,1,0,0|2,0,1]=4 634 B9R1.37 CC1=C(C(OC1=O)O)C MCULE-1024110805 [0,0,0,1,0,0|2,0,1]=4 635 B9R1.37 CC1CC(=O)C(=O)C1C MCULE-1553900326 [0,0,0,1,0,0|1,0,0]=2 636 B9R1.37 CC1CN(C(=O)C1N)O MCULE-1541937372 [0,0,0,1,0,0|3,0,0]=4 637 B9R1.37 CC1CN(C(=O)C1N)O MCULE-3876251131 [0,0,0,1,0,0|3,0,0]=4 638 B9R1.37 CC1OC(=O)C(=C1O)O MCULE-5304828877 [0,0,0,1,0,0|1,0,2]=4 639 B9R1.37 CC1OC(=O)C(C1O)O MCULE-1862325809 [0,0,0,1,0,0|1,0,2]=4 640 B9R1.37 C[C@@H]1CN(C(=O)[C@@H]1N)O MCULE-1789519376 [0,0,0,1,0,0|3,0,0]=4 641 B9R1.37 C[C@@H]1CN(C(=O)[C@@H]1N)O MCULE-4750685085 [0,0,0,1,0,0|3,0,0]=4 642 B9R1.37 C[C@@H]1CN(C(=O)[C@@H]1N)O MCULE-7635519729 [0,0,0,1,0,0|3,0,0]=4 643 B9R1.37 C[C@@H]1CN(C(=O)[C@@H]1N)O MCULE-7984264167 [0,0,0,1,0,0|3,0,0]=4 644 B9R1.37 C[C@@H]1CN(C(=O)[C@@H]1N)O MCULE-8015807838 [0,0,0,1,0,0|3,0,0]=4 645 B9R1.37 C[C@@H]1CN(C(=O)[C@@H]1N)O MCULE-8810381823 [0,0,0,1,0,0|3,0,0]=4 646 B9R1.37 C[C@@H]1OC(=O)[C@@H]([C@H]1I)O MCULE-8523724511 [0,0,0,1,0,0|1,0,2]=4 647 B9R1.37 C[C@@H]1OC(=O)[C@@H]([C@H]1O)O MCULE-3554272195 [0,0,0,1,0,0|1,0,2]=4 648 B9R1.37 C[C@H]1CN(C(=O)[C@H]1N)O MCULE-6099115683 [0,0,0,1,0,0|3,0,0]=4 649 B9R1.37 C[C@H]1CN(C(=O)[C@H]1N)O MCULE-6659955179 [0,0,0,1,0,0|3,0,0]=4 650 B9R1.41 C1(CCCN1C)C(=O)O MCULE-7988130618 [0,0,0,1,0,0|2,0,1]=4 651 B9R1.41 CC(=O)C1=C(CCC1)C MCULE-9433038766 [0,0,0,1,0,0|2,0,1]=4 652 B9R1.41 CC1=C(CCC1)C(=O)O MCULE-4166872703 [0,0,0,1,0,0|1,0,1]=3 653 B9R1.41 CC1=C(CCO1)C(=O)O MCULE-2847123201 [0,0,0,1,0,0|2,0,1]=4 654 B9R1.41 CC1CCCC1C(=O)O MCULE-5150428001 [0,0,0,1,0,0|1,0,1]=3 655 B9R1.41 CC1CCNC1C(=O)O MCULE-3835684911 [0,0,0,1,0,0|1,0,1]=3 656 B9R1.41 CC1CCNC1C(=O)O MCULE-8361777649 [0,0,0,1,0,0|1,0,1]=3 657 B9R1.41 CC1CNCC1C(=O)O MCULE-1581522558 [0,0,0,1,0,0|2,0,1]=4 658 B9R1.41 CC1CNCC1C(=O)O MCULE-6848551085 [0,0,0,1,0,0|2,0,1]=4 659 B9R1.41 CC1NCCC1C(=O)O MCULE-5042669811 [0,0,0,1,0,0|2,0,1]=4 660 B9R1.41 CC1NCCC1C(=O)O MCULE-8546677468 [0,0,0,1,0,0|2,0,1]=4 661 B9R1.41 CC1OCCC1C(=O)O MCULE-4181521736 [0,0,0,1,0,0|2,0,1]=4 662 B9R1.41 CN1CCCC1C(=O)O MCULE-4884381644 [0,0,0,1,0,0|2,0,1]=4 663 B9R1.41 CN1CCCC1C(=O)O MCULE-6241162207 [0,0,0,1,0,0|2,0,1]=4 664 B9R1.41 CN1CCCC1C(=O)O MCULE-7232060205 [0,0,0,1,0,0|2,0,1]=4 665 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-3947573313 [0,0,0,1,0,0|2,0,1]=4 666 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-4168419254 [0,0,0,1,0,0|2,0,1]=4 667 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-6504349835 [0,0,0,1,0,0|2,0,1]=4 668 B9R1.41 CN1CCC[C@@H]1C(=O)O MCULE-9943329201 [0,0,0,1,0,0|2,0,1]=4 669 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-1661156416 [0,0,0,1,0,0|2,0,1]=4 670 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-2535799805 [0,0,0,1,0,0|2,0,1]=4 671 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-3283459585 [0,0,0,1,0,0|2,0,1]=4 672 B9R1.41 CN1CCC[C@H]1C(=O)O MCULE-5506159927 [0,0,0,1,0,0|2,0,1]=4 673 B9R1.41 C[C@@H]1CCN[C@@H]1C(=O)O MCULE-6239309390 [0,0,0,1,0,0|1,0,1]=3 674 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-1608471752 [0,0,0,1,0,0|1,0,1]=3 675 B9R1.41 C[C@@H]1CCN[C@H]1C(=O)O MCULE-2896759092 [0,0,0,1,0,0|1,0,1]=3 676 B9R1.41 C[C@@H]1CCO[C@H]1C(=O)O MCULE-5338216485 [0,0,0,1,0,0|0,0,2]=3 677 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-3425733853 [0,0,0,1,0,0|2,0,1]=4 678 B9R1.41 C[C@@H]1CNC[C@H]1C(=O)O MCULE-5424989009 [0,0,0,1,0,0|2,0,1]=4 679 B9R1.41 C[C@@H]1NCC[C@@H]1C(=O)O MCULE-1674735474 [0,0,0,1,0,0|2,0,1]=4 680 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-8959062032 [0,0,0,1,0,0|2,0,1]=4 681 B9R1.41 C[C@@H]1NCC[C@H]1C(=O)O MCULE-9340754868 [0,0,0,1,0,0|2,0,1]=4 682 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4624227681 [0,0,0,1,0,0|2,0,1]=4 683 B9R1.41 C[C@@H]1OCC[C@@H]1C(=O)O MCULE-4653588182 [0,0,0,1,0,0|2,0,1]=4 684 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-1694933393 [0,0,0,1,0,0|1,0,1]=3 685 B9R1.41 C[C@H]1CCN[C@@H]1C(=O)O MCULE-9088637113 [0,0,0,1,0,0|1,0,1]=3 686 B9R1.41 C[C@H]1CCN[C@H]1C(=O)O MCULE-1449988566 [0,0,0,1,0,0|1,0,1]=3 687 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-3190006541 [0,0,0,1,0,0|2,0,1]=4 688 B9R1.41 C[C@H]1NCC[C@@H]1C(=O)O MCULE-7835079063 [0,0,0,1,0,0|2,0,1]=4 689 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-1189864899 [0,0,0,1,0,0|2,0,1]=4 690 B9R1.41 C[C@H]1NCC[C@H]1C(=O)O MCULE-8012665255 [0,0,0,1,0,0|2,0,1]=4 691 B9R1.41 NC1=C(CCC1)C(=O)O MCULE-9287668193 [0,0,0,1,0,0|2,0,1]=4 692 B9R1.41 NC1CCCC1C(=O)O MCULE-4916984038 [0,0,0,1,0,0|2,0,1]=4 693 B9R1.41 NC1CCCC1C(=O)O MCULE-7220342321 [0,0,0,1,0,0|2,0,1]=4 694 B9R1.41 NC1CCNC1C(=O)O MCULE-3789976956 [0,0,0,1,0,0|2,0,1]=4 695 B9R1.41 NC1CCNC1C(=O)O MCULE-5356536056 [0,0,0,1,0,0|2,0,1]=4 696 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-3446631182 [0,0,0,1,0,0|2,0,1]=4 697 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-4537266002 [0,0,0,1,0,0|2,0,1]=4 698 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9091292908 [0,0,0,1,0,0|2,0,1]=4 699 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9780104108 [0,0,0,1,0,0|2,0,1]=4 700 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-1397305924 [0,0,0,1,0,0|2,0,1]=4 701 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-5447983159 [0,0,0,1,0,0|2,0,1]=4 702 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-6345808896 [0,0,0,1,0,0|2,0,1]=4 703 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-7658809060 [0,0,0,1,0,0|2,0,1]=4 704 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-1080605796 [0,0,0,1,0,0|2,0,1]=4 705 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5666272526 [0,0,0,1,0,0|2,0,1]=4 706 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-5723263979 [0,0,0,1,0,0|2,0,1]=4 707 B9R1.41 N[C@@H]1CCN[C@@H]1C(=O)O MCULE-6574312344 [0,0,0,1,0,0|2,0,1]=4 708 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-5128495564 [0,0,0,1,0,0|2,0,1]=4 709 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-7721875754 [0,0,0,1,0,0|2,0,1]=4 710 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-8287396944 [0,0,0,1,0,0|2,0,1]=4 711 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9470915806 [0,0,0,1,0,0|2,0,1]=4 712 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9776724097 [0,0,0,1,0,0|2,0,1]=4 713 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9997148303 [0,0,0,1,0,0|2,0,1]=4 714 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-1768949677 [0,0,0,1,0,0|2,0,1]=4 715 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-2999200875 [0,0,0,1,0,0|2,0,1]=4 716 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-4735278058 [0,0,0,1,0,0|2,0,1]=4 717 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-7501259126 [0,0,0,1,0,0|2,0,1]=4 718 B9R1.41 O=C(O)C1=C(CCC1)Cl MCULE-4349801654 [0,0,0,1,0,0|2,0,1]=4 719 B9R1.41 O=C(O)C1CCCC1O MCULE-5519958446 [0,0,0,1,0,0|2,0,1]=4 720 B9R1.41 O=C(O)C1NCCC1F MCULE-2108063646 [0,0,0,1,0,0|2,0,1]=4 721 B9R1.41 O=C(O)C1NCCC1F MCULE-6901343291 [0,0,0,1,0,0|2,0,1]=4 722 B9R1.41 O=C(O)C1NCCC1O MCULE-3415911467 [0,0,0,1,0,0|2,0,1]=4 723 B9R1.41 O=C(O)C1NCCC1O MCULE-3678949962 [0,0,0,1,0,0|2,0,1]=4 724 B9R1.41 O=C(O)C1NCCC1O MCULE-6594922763 [0,0,0,1,0,0|2,0,1]=4 725 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-3174474393 [0,0,0,1,0,0|2,0,1]=4 726 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1F MCULE-5151888407 [0,0,0,1,0,0|2,0,1]=4 727 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1216340314 [0,0,0,1,0,0|2,0,1]=4 728 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-1564327038 [0,0,0,1,0,0|2,0,1]=4 729 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-8208546333 [0,0,0,1,0,0|2,0,1]=4 730 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9489383113 [0,0,0,1,0,0|2,0,1]=4 731 B9R1.41 O=C(O)[C@@H]1NCC[C@@H]1O MCULE-9999937302 [0,0,0,1,0,0|2,0,1]=4 732 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7001095632 [0,0,0,1,0,0|2,0,1]=4 733 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1F MCULE-7931619369 [0,0,0,1,0,0|2,0,1]=4 734 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-1637514285 [0,0,0,1,0,0|2,0,1]=4 735 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-7041138309 [0,0,0,1,0,0|2,0,1]=4 736 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9174140225 [0,0,0,1,0,0|2,0,1]=4 737 B9R1.41 O=C(O)[C@@H]1NCC[C@H]1O MCULE-9867563873 [0,0,0,1,0,0|2,0,1]=4 738 B9R1.41 O=C(O)[C@@H]1[NH2+]CC[C@@H]1O MCULE-4350473030 [0,0,0,1,0,0|2,0,1]=4 739 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O MCULE-7220456005 [0,0,0,1,0,0|2,0,1]=4 740 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-1175817797 [0,0,0,1,0,0|2,0,1]=4 741 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-5823079222 [0,0,0,1,0,0|2,0,1]=4 742 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-6437141041 [0,0,0,1,0,0|2,0,1]=4 743 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1F MCULE-8496599400 [0,0,0,1,0,0|2,0,1]=4 744 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-1891620706 [0,0,0,1,0,0|2,0,1]=4 745 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2757873569 [0,0,0,1,0,0|2,0,1]=4 746 B9R1.41 O=C(O)[C@H]1NCC[C@@H]1O MCULE-2760733859 [0,0,0,1,0,0|2,0,1]=4 747 B9R1.41 O=C(O)[C@H]1NCC[C@H]1F MCULE-8117073613 [0,0,0,1,0,0|2,0,1]=4 748 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-2253713572 [0,0,0,1,0,0|2,0,1]=4 749 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-4523708371 [0,0,0,1,0,0|2,0,1]=4 750 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6240521801 [0,0,0,1,0,0|2,0,1]=4 751 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6709232399 [0,0,0,1,0,0|2,0,1]=4 752 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-6746975985 [0,0,0,1,0,0|2,0,1]=4 753 B9R1.41 O=C(O)[C@H]1NCC[C@H]1O MCULE-8268334758 [0,0,0,1,0,0|2,0,1]=4 754 B9R1.41 [C@@H]1(CCN[C@H]1C(=O)O)O MCULE-2060265421 [0,0,0,1,0,0|2,0,1]=4 755 B9R1.41 [C@@H]1(NCC[C@H]1O)C(=O)O MCULE-1208236317 [0,0,0,1,0,0|2,0,1]=4 756 B9R1.41 [C@H]1(CCN[C@H]1C(=O)O)O MCULE-3906438921 [0,0,0,1,0,0|2,0,1]=4 757 B9R1.93 CCC1CC1(N)C(=O)O MCULE-5139419329 [0,0,0,1,0,0|1,0,1]=3 758 B9R1.96 C1(NCC1CC)C(=O)O MCULE-9517338987 [0,0,0,1,0,0|1,0,1]=3 759 B9R1.96 CCC1CNC1C(=O)O MCULE-5561702986 [0,0,0,1,0,0|1,0,1]=3 760 B9R1.96 CCC1CN[C@@H]1C(=O)O MCULE-1585063492 [0,0,0,1,0,0|1,0,1]=3 761 B9R1.96 CCC1CN[C@@H]1C(=O)O MCULE-7143773936 [0,0,0,1,0,0|1,0,1]=3 762 B9R1.96 CCN1CCC1C(=O)O MCULE-9616158921 [0,0,0,1,0,0|2,0,1]=4 763 B9R1.96 CCN1CC[C@H]1C(=O)O MCULE-1971461514 [0,0,0,1,0,0|2,0,1]=4 764 B9R1.96 CCN1CC[C@H]1C(=O)O MCULE-4762142431 [0,0,0,1,0,0|2,0,1]=4 765 B9R1.96 O=C(O)C1CCC1CO MCULE-9648982851 [0,0,0,1,0,0|2,0,1]=4 766 B9R1.110 C(N)(C(=O)O)C1CCC1 MCULE-9659994288 [0,0,0,1,0,0|1,0,1]=3 767 B9R1.110 C(N)(C(=O)O)C1COC1 MCULE-5400337176 [0,0,0,1,0,0|2,0,1]=4 768 B9R1.110 C=C(C(=O)O)C1CCC1 MCULE-2578265979 [0,0,0,1,0,0|1,0,0]=2 769 B9R1.110 CC(=C1CCC1)C(=O)O MCULE-8904503252 [0,0,0,1,0,0|1,0,1]=3 770 B9R1.110 CC(=O)N(C)C1CCC1 MCULE-6997854698 [0,0,0,1,0,0|3,0,0]=4 771 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-1352377374 [0,0,0,1,0,0|1,0,1]=3 772 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-3278183132 [0,0,0,1,0,0|1,0,1]=3 773 B9R1.110 CC(C(=O)O)C1CCO1 MCULE-4481804660 [0,0,0,1,0,0|2,0,1]=4 774 B9R1.110 CC(C(=O)O)C1CNC1 MCULE-3425038216 [0,0,0,1,0,0|2,0,1]=4 775 B9R1.110 CC(C(=O)O)C1CNC1 MCULE-8368638713 [0,0,0,1,0,0|2,0,1]=4 776 B9R1.110 CC(C(=O)O)C1COC1 MCULE-1438881074 [0,0,0,1,0,0|2,0,1]=4 777 B9R1.110 CC(C(=O)O)N1CCC1 MCULE-9923940575 [0,0,0,1,0,0|2,0,1]=4 778 B9R1.110 CN(C(=O)Cl)C1CCC1 MCULE-6620618396 [0,0,0,1,0,0|3,0,0]=4 779 B9R1.110 NC(=O)C(N)C1CCC1 MCULE-3518352563 [0,0,0,1,0,0|2,0,1]=4 780 B9R1.110 NC(C(=O)O)C1CCC1 MCULE-3775442501 [0,0,0,1,0,0|1,0,1]=3 781 B9R1.110 NC(C(=O)O)C1CCC1 MCULE-4685141546 [0,0,0,1,0,0|1,0,1]=3 782 B9R1.110 NC(C(=O)O)C1COC1 MCULE-1331194239 [0,0,0,1,0,0|2,0,1]=4 783 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-2214697836 [0,0,0,1,0,0|1,0,1]=3 784 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-7786634114 [0,0,0,1,0,0|1,0,1]=3 785 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-8265180180 [0,0,0,1,0,0|1,0,1]=3 786 B9R1.110 N[C@@H](C(=O)O)C1CCC1 MCULE-9469768507 [0,0,0,1,0,0|1,0,1]=3 787 B9R1.110 N[C@@H](C(=O)O)C1COC1 MCULE-4389145324 [0,0,0,1,0,0|2,0,1]=4 788 B9R1.110 N[C@@H](C(=O)O)C1COC1 MCULE-4852474986 [0,0,0,1,0,0|2,0,1]=4 789 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-4701147798 [0,0,0,1,0,0|1,0,1]=3 790 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-5196473423 [0,0,0,1,0,0|1,0,1]=3 791 B9R1.110 N[C@H](C(=O)O)C1CCC1 MCULE-8882106256 [0,0,0,1,0,0|1,0,1]=3 792 B9R1.110 N[C@H](C(=O)O)C1COC1 MCULE-3016057788 [0,0,0,1,0,0|2,0,1]=4 793 B9R1.110 N[C@H](C(=O)O)C1COC1 MCULE-8770476335 [0,0,0,1,0,0|2,0,1]=4 794 B9R1.110 O=C(O)C(=C1CCC1)F MCULE-3335084975 [0,0,0,1,0,0|1,0,1]=3 795 B9R1.110 O=C(O)C(=O)C1CCC1 MCULE-3680158952 [0,0,0,1,0,0|0,0,0]=1 796 B9R1.110 O=C(O)C(=O)N1CCC1 MCULE-2155911842 [0,0,0,1,0,0|1,0,0]=2 797 B9R1.110 O=C(O)C(Br)C1CCC1 MCULE-4353551170 [0,0,0,1,0,0|1,0,1]=3 798 B9R1.110 O=C(O)C(F)C1CCC1 MCULE-8989287343 [0,0,0,1,0,0|1,0,1]=3 799 B9R1.110 O=C(O)C(O)C1CCC1 MCULE-8720651836 [0,0,0,1,0,0|0,0,2]=3 800 B9R1.110 O=C(O)[C@@H](O)C1CCC1 MCULE-7295025986 [0,0,0,1,0,0|0,0,2]=3 801 B9R1.110 O=C(O)[C@H](O)C1CCC1 MCULE-7776940136 [0,0,0,1,0,0|0,0,2]=3 802 B9R1.111 CC(C(=O)O)C1(CC1)N MCULE-1517881247 [0,0,0,1,0,0|2,0,1]=4 803 B9R1.111 CC1(CC1)C(N)C(=O)O MCULE-6145936175 [0,0,0,1,0,0|1,0,1]=3 804 B9R1.111 CC1(CC1)C(N)C(=O)O MCULE-7535494625 [0,0,0,1,0,0|1,0,1]=3 805 B9R1.111 CC1(CC1)C(O)C(=O)O MCULE-9368385665 [0,0,0,1,0,0|0,0,2]=3 806 B9R1.111 CC1(CC1)[C@H](N)C(=O)O MCULE-1811208675 [0,0,0,1,0,0|1,0,1]=3 807 B9R1.111 CC1(CC1)[C@H](N)C(=O)O MCULE-7721561513 [0,0,0,1,0,0|1,0,1]=3 808 B9R1.111 NC(C(=O)O)C1(CC1)O MCULE-6983168418 [0,0,0,1,0,0|2,0,1]=4 809 B9R1.111 NC(C(=O)O)C1(CC1)O MCULE-8148582012 [0,0,0,1,0,0|2,0,1]=4 810 B9R1.111 N[C@@H](C(=O)O)C1(CC1)O MCULE-3141771978 [0,0,0,1,0,0|2,0,1]=4 811 B9R1.111 N[C@H](C(=O)O)C1(CC1)O MCULE-9602505956 [0,0,0,1,0,0|2,0,1]=4 812 B9R1.111 O=C(O)C(=O)C1(CC1)F MCULE-2939361516 [0,0,0,1,0,0|1,0,0]=2 813 B9R1.111 [C@@H](N)(C(=O)O)C1(CC1)C MCULE-5173033031 [0,0,0,1,0,0|1,0,1]=3 814 B9R1.111 [C@@H](N)(C(=O)O)C1(CC1)C MCULE-8799551410 [0,0,0,1,0,0|1,0,1]=3 815 B9R1.127 CCC1(CC1C(=O)O)C MCULE-5907126944 [0,0,0,1,0,0|1,0,1]=3 816 B9R1.132 CCC1=C(C(=O)CC1)O MCULE-3983794608 [0,0,0,1,0,0|1,0,2]=4 817 B9R1.132 CCC1=C(C(=O)NC1)C MCULE-7695528957 [0,0,0,1,0,0|2,0,1]=4 818 B9R1.132 CCN1CCC(=O)C1=O MCULE-7001636786 [0,0,0,1,0,0|2,0,0]=3 819 B9R1.132 CN1C(=O)OCC1CN MCULE-6042520549 [0,0,0,1,0,0|3,0,0]=4 820 B9R1.132 CN1C(=O)OCC1CO MCULE-8007610205 [0,0,0,1,0,0|3,0,0]=4 821 B9R0.23 CCC(C)C(=N)CC(=O)C MCULE-9690278340 [0,0,0,0,0,1|2,0,0]=3 822 B9R0.23 CCC(C)C(=O)CC(=O)C MCULE-8072360859 [0,0,0,0,0,1|1,0,0]=2 823 B9R0.23 CCC(C)C(=O)OC(C)C MCULE-1304634433 [0,0,0,0,0,1|2,0,1]=4 824 B9R0.23 CCC(C)C(N)CC(=O)O MCULE-4327977098 [0,0,0,0,0,1|1,0,1]=3 825 B9R0.23 CCC(C)C(N)CC(=O)O MCULE-9731178196 [0,0,0,0,0,1|1,0,1]=3 826 B9R0.23 CCN(C)C(C)CC(=O)O MCULE-8864839000 [0,0,0,0,0,1|2,0,1]=4 827 B9R0.23 CCN(C)C(C)CC(=O)O MCULE-9691138087 [0,0,0,0,0,1|2,0,1]=4 828 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-3497593262 [0,0,0,0,0,1|1,0,1]=3 829 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-4155901879 [0,0,0,0,0,1|1,0,1]=3 830 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-8221314475 [0,0,0,0,0,1|1,0,1]=3 831 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-9196761404 [0,0,0,0,0,1|1,0,1]=3 832 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O MCULE-2430009158 [0,0,0,0,0,1|1,0,1]=3 833 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O MCULE-9647386489 [0,0,0,0,0,1|1,0,1]=3 834 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-2618743733 [0,0,0,0,0,1|1,0,1]=3 835 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-5773439736 [0,0,0,0,0,1|1,0,1]=3 836 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-6590436922 [0,0,0,0,0,1|1,0,1]=3 837 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-9722049324 [0,0,0,0,0,1|1,0,1]=3 838 B9R0.42 C=C(C)C(=O)OC(C)CO MCULE-3069032725 [0,0,0,0,0,1|3,0,0]=4 839 B9R0.42 CC(CO)CC(N)C(=O)O MCULE-1659842949 [0,0,0,0,0,1|2,0,1]=4 840 B9R0.42 CCC(C)CC(C)C(=O)O MCULE-6856405301 [0,0,0,0,0,1|1,0,1]=3 841 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-1321158720 [0,0,0,0,0,1|1,0,1]=3 842 B9R0.42 CCC(C)CC(N)C(=O)O MCULE-9833457318 [0,0,0,0,0,1|1,0,1]=3 843 B9R0.42 CCC(C)NC(=O)C(=O)O MCULE-6488437367 [0,0,0,0,0,1|0,0,0]=1 844 B9R0.42 CCC(C)NC(=O)C(C)Cl MCULE-2841510321 [0,0,0,0,0,1|2,0,1]=4 845 B9R0.42 CCC(C)NC(=O)C(C)N MCULE-6470935908 [0,0,0,0,0,1|2,0,1]=4 846 B9R0.42 CCC(C)NC(=O)C(C)N MCULE-9652796484 [0,0,0,0,0,1|2,0,1]=4 847 B9R0.42 CCN(C)CC(C)C(=O)O MCULE-6094320295 [0,0,0,0,0,1|2,0,1]=4 848 B9R0.42 CCN(C)CC(C)C(=O)O MCULE-8043640135 [0,0,0,0,0,1|2,0,1]=4 849 B9R0.42 COC(=O)CC(=O)C(=O)O MCULE-5008305161 [0,0,0,0,0,1|2,0,1]=4 850 B6R0.1 C#CC(=O)CCC MCULE-8990254228 [2,0,0,0,0,0|1,0,1]=4 851 B6R0.1 C=CC(=O)CCC MCULE-9373104880 [2,0,0,0,0,0|1,0,0]=3 852 B6R0.1 C=CC(=O)COC MCULE-1933195578 [2,0,0,0,0,0|2,0,0]=4 853 B6R0.1 C=CC(=O)NCC MCULE-3515057147 [2,0,0,0,0,0|2,0,0]=4 854 B6R0.1 C=CC(=O)OCC MCULE-9281713240 [2,0,0,0,0,0|2,0,0]=4 855 B6R0.1 C=CCC(C)CC MCULE-8680856865 [2,0,0,0,0,0|1,0,1]=4 856 B6R0.1 CC/C=C(\C)/C=O MCULE-6692882718 [2,0,0,0,0,0|1,0,1]=4 857 B6R0.1 CCC(=CCO)C MCULE-5264054153 [2,0,0,0,0,0|0,0,2]=4 858 B6R0.1 CCC(C)C=NO MCULE-2829500970 [2,0,0,0,0,0|1,0,0]=3 859 B6R0.1 CCC(C)CC=O MCULE-9143756592 [2,0,0,0,0,0|0,0,1]=3 860 B6R0.1 CCC(C)CCO MCULE-6482427735 [2,0,0,0,0,0|0,0,2]=4 861 B6R0.1 CCC(C)N=C=O MCULE-4771945289 [2,0,0,0,0,0|1,0,1]=4 862 B6R0.1 CCC(C)NC=O MCULE-2197007756 [2,0,0,0,0,0|1,0,0]=3 863 B6R0.1 CCC(C)OC=O MCULE-9361787208 [2,0,0,0,0,0|1,0,0]=3 864 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [2,0,0,0,0,0|2,0,0]=4 865 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [2,0,0,0,0,0|2,0,0]=4 866 B6R0.1 CCC=C(C)C=O MCULE-1636090264 [2,0,0,0,0,0|1,0,1]=4 867 B6R0.1 CCCC(=NO)C MCULE-6437787263 [2,0,0,0,0,0|2,0,0]=4 868 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [2,0,0,0,0,0|1,0,1]=4 869 B6R0.1 CCCC(=O)CC MCULE-7121523805 [2,0,0,0,0,0|1,0,1]=4 870 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [2,0,0,0,0,0|1,0,1]=4 871 B6R0.1 CCCC(=O)CN MCULE-4663263123 [2,0,0,0,0,0|1,0,1]=4 872 B6R0.1 CCCC(=O)CN MCULE-6326368932 [2,0,0,0,0,0|1,0,1]=4 873 B6R0.1 CCCC(=O)CO MCULE-6518249412 [2,0,0,0,0,0|0,0,1]=3 874 B6R0.1 CCCC(=O)NC MCULE-5770149071 [2,0,0,0,0,0|2,0,0]=4 875 B6R0.1 CCCC(=O)NN MCULE-3660167295 [2,0,0,0,0,0|2,0,0]=4 876 B6R0.1 CCCC(=O)NO MCULE-8710375368 [2,0,0,0,0,0|1,0,0]=3 877 B6R0.1 CCCC(=O)OC MCULE-1092030267 [2,0,0,0,0,0|2,0,0]=4 878 B6R0.1 CCCC(=O)SC MCULE-1490654381 [2,0,0,0,0,0|2,0,0]=4 879 B6R0.1 CCCC(C)C=O MCULE-9756444218 [2,0,0,0,0,0|1,0,1]=4 880 B6R0.1 CCNC(=O)CO MCULE-1386307800 [2,0,0,0,0,0|1,0,1]=4 881 B6R0.1 CCNC(=O)NO MCULE-3264850022 [2,0,0,0,0,0|2,0,0]=4 882 B6R0.1 CCOC(=O)C=O MCULE-3433596669 [2,0,0,0,0,0|1,0,0]=3 883 B6R0.1 CCOC(=O)CO MCULE-8121340151 [2,0,0,0,0,0|1,0,1]=4 884 B6R0.1 CCOC(=O)NO MCULE-4701193610 [2,0,0,0,0,0|2,0,0]=4 885 B6R0.1 CC[C@H](C)CCO MCULE-1190203828 [2,0,0,0,0,0|0,0,2]=4 886 B6R0.1 CC[C@H](C)CCO MCULE-8460710173 [2,0,0,0,0,0|0,0,2]=4 887 B6R0.1 COC(C)CC=O MCULE-7243333697 [2,0,0,0,0,0|1,0,1]=4 888 B6R0.1 CSC(C)CC=O MCULE-9433914892 [2,0,0,0,0,0|1,0,1]=4 889 B6R0.1 O=C(CCCl)NO MCULE-5569658108 [2,0,0,0,0,0|2,0,0]=4 890 B6R0.2 CC(=CC(=O)Cl)C MCULE-7644585609 [2,0,0,0,0,0|1,0,1]=4 891 B6R0.2 CC(=CC(=O)N)C MCULE-6264319579 [2,0,0,0,0,0|1,0,1]=4 892 B6R0.2 CC(=CC(=O)O)C MCULE-4772426340 [2,0,0,0,0,0|0,0,1]=3 893 B6R0.2 CC(=CC(=O)O)Cl MCULE-7503760292 [2,0,0,0,0,0|1,0,1]=4 894 B6R0.2 CC(=CC(=O)O)I MCULE-2652373771 [2,0,0,0,0,0|1,0,1]=4 895 B6R0.2 CC(=CC(=O)O)N MCULE-5894724848 [2,0,0,0,0,0|1,0,1]=4 896 B6R0.2 CC(=CC(C)C)C MCULE-5460531772 [2,0,0,0,0,0|2,0,0]=4 897 B6R0.2 CC(=O)C=C(C)C MCULE-4922478422 [2,0,0,0,0,0|1,0,1]=4 898 B6R0.2 CC(=O)CC(C)C MCULE-2172909634 [2,0,0,0,0,0|1,0,1]=4 899 B6R0.2 CC(=O)NC(C)C MCULE-2095134698 [2,0,0,0,0,0|2,0,0]=4 900 B6R0.2 CC(=O)OC(C)C MCULE-6152257819 [2,0,0,0,0,0|2,0,0]=4 901 B6R0.2 CC(Br)CC(=O)O MCULE-3353526571 [2,0,0,0,0,0|1,0,1]=4 902 B6R0.2 CC(C)CC(=O)Cl MCULE-8821231794 [2,0,0,0,0,0|1,0,1]=4 903 B6R0.2 CC(C)CC(=O)N MCULE-7790849976 [2,0,0,0,0,0|1,0,1]=4 904 B6R0.2 CC(C)CC(=O)O MCULE-5805071360 [2,0,0,0,0,0|0,0,1]=3 905 B6R0.2 CC(C)NC(=O)N MCULE-2725741897 [2,0,0,0,0,0|2,0,0]=4 906 B6R0.2 CC(C)OC(=O)Cl MCULE-3303340398 [2,0,0,0,0,0|2,0,0]=4 907 B6R0.2 CC(C)OC(=O)N MCULE-9996500963 [2,0,0,0,0,0|2,0,0]=4 908 B6R0.2 CC(C)SC(=O)Cl MCULE-9803882280 [2,0,0,0,0,0|2,0,0]=4 909 B6R0.2 CC(Cl)CC(=O)O MCULE-1436146199 [2,0,0,0,0,0|1,0,1]=4 910 B6R0.2 CC(F)CC(=O)O MCULE-9214258715 [2,0,0,0,0,0|1,0,1]=4 911 B6R0.2 CC(N)CC(=O)O MCULE-2960589915 [2,0,0,0,0,0|1,0,1]=4 912 B6R0.2 CC(N)CC(=O)O MCULE-5772407106 [2,0,0,0,0,0|1,0,1]=4 913 B6R0.2 CC(N)CC(=O)O MCULE-7818257350 [2,0,0,0,0,0|1,0,1]=4 914 B6R0.2 CC(N)CC(=O)O MCULE-7847644131 [2,0,0,0,0,0|1,0,1]=4 915 B6R0.2 CC(O)CC(=O)O MCULE-3566732882 [2,0,0,0,0,0|1,0,1]=4 916 B6R0.2 CC(O)CC(=O)O MCULE-6537877725 [2,0,0,0,0,0|1,0,1]=4 917 B6R0.2 CN(C)CC(=O)O MCULE-2303978039 [2,0,0,0,0,0|1,0,1]=4 918 B6R0.2 CN(C)CC(=O)O MCULE-3368936600 [2,0,0,0,0,0|1,0,1]=4 919 B6R0.2 C[C@@H](N)CC(=O)O MCULE-2652696372 [2,0,0,0,0,0|1,0,1]=4 920 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7054489636 [2,0,0,0,0,0|1,0,1]=4 921 B6R0.2 C[C@@H](N)CC(=O)O MCULE-7621851215 [2,0,0,0,0,0|1,0,1]=4 922 B6R0.2 C[C@@H](N)CC(=O)O MCULE-8671397640 [2,0,0,0,0,0|1,0,1]=4 923 B6R0.2 C[C@@H](O)CC(=O)O MCULE-2545577683 [2,0,0,0,0,0|1,0,1]=4 924 B6R0.2 C[C@@H](O)CC(=O)O MCULE-4159227891 [2,0,0,0,0,0|1,0,1]=4 925 B6R0.2 C[C@H](Br)CC(=O)O MCULE-1601745040 [2,0,0,0,0,0|1,0,1]=4 926 B6R0.2 C[C@H](Br)CC(=O)O MCULE-2894930407 [2,0,0,0,0,0|1,0,1]=4 927 B6R0.2 C[C@H](N)CC(=O)O MCULE-2656839691 [2,0,0,0,0,0|1,0,1]=4 928 B6R0.2 C[C@H](N)CC(=O)O MCULE-4695512293 [2,0,0,0,0,0|1,0,1]=4 929 B6R0.2 C[C@H](N)CC(=O)O MCULE-5288044169 [2,0,0,0,0,0|1,0,1]=4 930 B6R0.2 C[C@H](N)CC(=O)O MCULE-6641912058 [2,0,0,0,0,0|1,0,1]=4 931 B6R0.2 C[C@H](O)CC(=O)O MCULE-2857686566 [2,0,0,0,0,0|1,0,1]=4 932 B6R0.2 C[C@H](O)CC(=O)O MCULE-3362266278 [2,0,0,0,0,0|1,0,1]=4 933 B6R0.4 CC/C=C/C(=O)Cl MCULE-8929214872 [2,0,0,0,0,0|1,0,1]=4 934 B6R0.4 CC/C=C/C(=O)O MCULE-4888215476 [2,0,0,0,0,0|0,0,1]=3 935 B6R0.4 CCC#CC(=O)O MCULE-1053283381 [2,0,0,0,0,0|0,0,2]=4 936 B6R0.4 CCC=CC(=O)C MCULE-2986269826 [2,0,0,0,0,0|1,0,1]=4 937 B6R0.4 CCC=CC(=O)Cl MCULE-5159865849 [2,0,0,0,0,0|1,0,1]=4 938 B6R0.4 CCC=CC(=O)O MCULE-3920494238 [2,0,0,0,0,0|0,0,1]=3 939 B6R0.4 CCCC=C(C)C MCULE-2110588796 [2,0,0,0,0,0|2,0,0]=4 940 B6R0.4 CCCCC(=O)Br MCULE-2980405081 [2,0,0,0,0,0|1,0,1]=4 941 B6R0.4 CCCCC(=O)C MCULE-3554390184 [2,0,0,0,0,0|1,0,1]=4 942 B6R0.4 CCCCC(=O)Cl MCULE-3875407102 [2,0,0,0,0,0|1,0,1]=4 943 B6R0.4 CCCCC(=O)N MCULE-6419483436 [2,0,0,0,0,0|1,0,1]=4 944 B6R0.4 CCCCC(=O)O MCULE-2333640078 [2,0,0,0,0,0|0,0,1]=3 945 B6R0.4 CCCCC(=O)[O-] MCULE-4817107962 [2,0,0,0,0,0|0,0,2]=4 946 B6R0.4 CCCNC(=O)C MCULE-5899703886 [2,0,0,0,0,0|2,0,0]=4 947 B6R0.4 CCCNC(=O)Cl MCULE-2937184966 [2,0,0,0,0,0|2,0,0]=4 948 B6R0.4 CCCNC(=O)N MCULE-8528844765 [2,0,0,0,0,0|2,0,0]=4 949 B6R0.4 CCCOC(=O)C MCULE-7327042566 [2,0,0,0,0,0|2,0,0]=4 950 B6R0.4 CCCOC(=O)Cl MCULE-1312686139 [2,0,0,0,0,0|2,0,0]=4 951 B6R0.4 CCCOC(=O)N MCULE-2760622567 [2,0,0,0,0,0|2,0,0]=4 952 B6R0.4 CCCSC(=O)C MCULE-4329646671 [2,0,0,0,0,0|2,0,0]=4 953 B6R0.4 CCCSC(=O)Cl MCULE-5971141999 [2,0,0,0,0,0|2,0,0]=4 954 B6R0.4 CCNCC(=O)O MCULE-5989480216 [2,0,0,0,0,0|1,0,1]=4 955 B6R0.4 CCNCC(=O)O MCULE-8087863397 [2,0,0,0,0,0|1,0,1]=4 956 B6R0.4 CCOCC(=O)O MCULE-1726530898 [2,0,0,0,0,0|1,0,1]=4 957 B6R0.4 CCSCC(=O)O MCULE-7471335718 [2,0,0,0,0,0|1,0,1]=4 958 B6R0.4 CNCCC(=O)O MCULE-3627988097 [2,0,0,0,0,0|1,0,1]=4 959 B6R0.4 CNCCC(=O)O MCULE-9858204248 [2,0,0,0,0,0|1,0,1]=4 960 B6R0.4 CO/C=C/C(=O)O MCULE-3681049176 [2,0,0,0,0,0|1,0,1]=4 961 B6R0.4 COC=CC(=O)O MCULE-4252899122 [2,0,0,0,0,0|1,0,1]=4 962 B6R0.4 COCCC(=O)O MCULE-3436347115 [2,0,0,0,0,0|1,0,1]=4 963 B6R0.4 CON=CC(=O)O MCULE-6800819509 [2,0,0,0,0,0|2,0,0]=4 964 B6R0.4 CSCCC(=O)O MCULE-9550032941 [2,0,0,0,0,0|1,0,1]=4 965 B6R0.4 NC/C=C/C(=O)O MCULE-1249244912 [2,0,0,0,0,0|1,0,1]=4 966 B6R0.4 NCC=CC(=O)O MCULE-3049811576 [2,0,0,0,0,0|1,0,1]=4 967 B6R0.4 NCC=CC(=O)O MCULE-5171717036 [2,0,0,0,0,0|1,0,1]=4 968 B6R0.4 NCCCC(=O)O MCULE-3615304273 [2,0,0,0,0,0|1,0,1]=4 969 B6R0.4 NCCCC(=O)O MCULE-7613134021 [2,0,0,0,0,0|1,0,1]=4 970 B6R0.4 O=C(O)/C=C/CBr MCULE-2012997584 [2,0,0,0,0,0|1,0,1]=4 971 B6R0.4 O=C(O)/C=C/CCl MCULE-5651159998 [2,0,0,0,0,0|1,0,1]=4 972 B6R0.4 O=C(O)/C=C/CO MCULE-1612823053 [2,0,0,0,0,0|1,0,1]=4 973 B6R0.4 O=C(O)C=CCBr MCULE-3029375430 [2,0,0,0,0,0|1,0,1]=4 974 B6R0.4 O=C(O)C=CCCl MCULE-1050913038 [2,0,0,0,0,0|1,0,1]=4 975 B6R0.4 O=C(O)C=CCO MCULE-3375515425 [2,0,0,0,0,0|1,0,1]=4 976 B6R0.4 O=C(O)CCCBr MCULE-5669825022 [2,0,0,0,0,0|1,0,1]=4 977 B6R0.4 O=C(O)CCCCl MCULE-7721427391 [2,0,0,0,0,0|1,0,1]=4 978 B6R0.4 O=C(O)CCCF MCULE-2415675768 [2,0,0,0,0,0|1,0,1]=4 979 B6R0.4 O=C(O)CCCI MCULE-7794841553 [2,0,0,0,0,0|1,0,1]=4 980 B6R0.4 O=C(O)CCCS MCULE-3352840152 [2,0,0,0,0,0|1,0,1]=4 981 B6R0.3 C#CC(=O)C(C)C MCULE-9471281560 [2,0,0,0,0,0|1,0,1]=4 982 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [2,0,0,0,0,0|1,0,0]=3 983 B6R0.3 C/C=C(/C)\C(=O)O MCULE-2116066534 [2,0,0,0,0,0|0,0,2]=4 984 B6R0.3 C/C=C(\Br)/C(=O)O MCULE-5940308548 [2,0,0,0,0,0|1,0,1]=4 985 B6R0.3 C/C=C(\C)/C(=O)O MCULE-4890719796 [2,0,0,0,0,0|0,0,2]=4 986 B6R0.3 C/C=C(\O)/C(=O)O MCULE-9596699660 [2,0,0,0,0,0|0,0,2]=4 987 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [2,0,0,0,0,0|1,0,0]=3 988 B6R0.3 C=C(CBr)C(=O)O MCULE-7257367588 [2,0,0,0,0,0|2,0,0]=4 989 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [2,0,0,0,0,0|1,0,0]=3 990 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [2,0,0,0,0,0|2,0,0]=4 991 B6R0.3 C=C(I)C(C)CI MCULE-8558127481 [2,0,0,0,0,0|2,0,0]=4 992 B6R0.3 C=C(I)[C@H](C)CI MCULE-1089285398 [2,0,0,0,0,0|2,0,0]=4 993 B6R0.3 C=C(I)[C@H](C)CI MCULE-5444456468 [2,0,0,0,0,0|2,0,0]=4 994 B6R0.3 C=C(OC)C(=O)O MCULE-9965334560 [2,0,0,0,0,0|2,0,0]=4 995 B6R0.3 C=CC(=O)C(=O)O MCULE-9816982424 [2,0,0,0,0,0|0,0,2]=4 996 B6R0.3 C=CC(=O)C(C)C MCULE-8577593172 [2,0,0,0,0,0|1,0,0]=3 997 B6R0.3 C=CC(=O)N(C)C MCULE-3105693382 [2,0,0,0,0,0|2,0,0]=4 998 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [2,0,0,0,0,0|0,0,2]=4 999 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [2,0,0,0,0,0|0,0,2]=4 1000 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [2,0,0,0,0,0|0,0,2]=4 1001 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [2,0,0,0,0,0|0,0,2]=4 1002 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [2,0,0,0,0,0|0,0,2]=4 1003 B6R0.3 CC(=O)C(=O)CBr MCULE-8560925164 [2,0,0,0,0,0|2,0,0]=4 1004 B6R0.3 CC(=O)C(=O)CCl MCULE-2778551811 [2,0,0,0,0,0|2,0,0]=4 1005 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [2,0,0,0,0,0|1,0,1]=4 1006 B6R0.3 CC(C#N)C(=O)O MCULE-3302580561 [2,0,0,0,0,0|1,0,1]=4 1007 B6R0.3 CC(C)/C(=N/O)/Cl MCULE-8655360746 [2,0,0,0,0,0|2,0,0]=4 1008 B6R0.3 CC(C)/C(=N/O)/N MCULE-4474697690 [2,0,0,0,0,0|2,0,0]=4 1009 B6R0.3 CC(C)C(=N)NO MCULE-9934498877 [2,0,0,0,0,0|2,0,0]=4 1010 B6R0.3 CC(C)C(=O)CBr MCULE-5913227185 [2,0,0,0,0,0|1,0,1]=4 1011 B6R0.3 CC(C)C(=O)CCl MCULE-4093256141 [2,0,0,0,0,0|1,0,1]=4 1012 B6R0.3 CC(C)C(=O)CN MCULE-6091425997 [2,0,0,0,0,0|1,0,1]=4 1013 B6R0.3 CC(C)C(=O)CN MCULE-7368122425 [2,0,0,0,0,0|1,0,1]=4 1014 B6R0.3 CC(C)C(=O)CO MCULE-8746789873 [2,0,0,0,0,0|0,0,1]=3 1015 B6R0.3 CC(C)C(=O)NN MCULE-1262854337 [2,0,0,0,0,0|2,0,0]=4 1016 B6R0.3 CC(C)C(Br)C=O MCULE-2054791376 [2,0,0,0,0,0|1,0,1]=4 1017 B6R0.3 CC(C)[C@H](N)C=O MCULE-6686967175 [2,0,0,0,0,0|1,0,1]=4 1018 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [2,0,0,0,0,0|1,0,0]=3 1019 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [2,0,0,0,0,0|1,0,0]=3 1020 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [2,0,0,0,0,0|1,0,0]=3 1021 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [2,0,0,0,0,0|1,0,0]=3 1022 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [2,0,0,0,0,0|1,0,0]=3 1023 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [2,0,0,0,0,0|1,0,1]=4 1024 B6R0.3 CC(CO)N(=O)=O MCULE-5856696728 [2,0,0,0,0,0|2,0,0]=4 1025 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [2,0,0,0,0,0|1,0,0]=3 1026 B6R0.3 CC(ON)C(=O)O MCULE-1969235976 [2,0,0,0,0,0|2,0,0]=4 1027 B6R0.3 CC(ON)C(=O)O MCULE-4318537884 [2,0,0,0,0,0|2,0,0]=4 1028 B6R0.3 CC(ON)C(=O)O MCULE-4455753863 [2,0,0,0,0,0|2,0,0]=4 1029 B6R0.3 CC(ON)C(=O)O MCULE-8893009712 [2,0,0,0,0,0|2,0,0]=4 1030 B6R0.3 CC=C(Br)C(=O)O MCULE-5368794596 [2,0,0,0,0,0|1,0,1]=4 1031 B6R0.3 CC=C(C)C(=O)O MCULE-2390677360 [2,0,0,0,0,0|0,0,2]=4 1032 B6R0.3 CC=C(C)C(C)C MCULE-4070109813 [2,0,0,0,0,0|2,0,0]=4 1033 B6R0.3 CC=C(Cl)C(=O)O MCULE-5827690088 [2,0,0,0,0,0|1,0,1]=4 1034 B6R0.3 CC=C(F)C(=O)O MCULE-5053310707 [2,0,0,0,0,0|1,0,1]=4 1035 B6R0.3 CC=C(O)C(=O)O MCULE-7886990963 [2,0,0,0,0,0|0,0,2]=4 1036 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [2,0,0,0,0,0|1,0,0]=3 1037 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [2,0,0,0,0,0|0,0,0]=2 1038 B6R0.3 CCC(=O)C(=O)[O-] MCULE-7571698792 [2,0,0,0,0,0|0,0,1]=3 1039 B6R0.3 CCC(=O)C(C)C MCULE-9576230007 [2,0,0,0,0,0|1,0,1]=4 1040 B6R0.3 CCC(=O)C(C)O MCULE-4144791660 [2,0,0,0,0,0|1,0,1]=4 1041 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [2,0,0,0,0,0|2,0,0]=4 1042 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [2,0,0,0,0,0|1,0,1]=4 1043 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [2,0,0,0,0,0|2,0,0]=4 1044 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [2,0,0,0,0,0|2,0,0]=4 1045 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [2,0,0,0,0,0|1,0,0]=3 1046 B6R0.3 CCC(C)B(O)O MCULE-7544159454 [2,0,0,0,0,0|1,0,1]=4 1047 B6R0.3 CCC(C)C(=N)N MCULE-4070060089 [2,0,0,0,0,0|2,0,0]=4 1048 B6R0.3 CCC(C)C(=N)N MCULE-7020524406 [2,0,0,0,0,0|2,0,0]=4 1049 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [2,0,0,0,0,0|0,0,1]=3 1050 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [2,0,0,0,0,0|1,0,0]=3 1051 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [2,0,0,0,0,0|1,0,0]=3 1052 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [2,0,0,0,0,0|0,0,0]=2 1053 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [2,0,0,0,0,0|0,0,0]=2 1054 B6R0.3 CCC(C)C(=S)N MCULE-9682279721 [2,0,0,0,0,0|1,1,0]=4 1055 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [2,0,0,0,0,0|1,0,1]=4 1056 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [2,0,0,0,0,0|2,0,0]=4 1057 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [2,0,0,0,0,0|2,0,0]=4 1058 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [2,0,0,0,0,0|1,0,0]=3 1059 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [2,0,0,0,0,0|1,0,0]=3 1060 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [2,0,0,0,0,0|2,0,0]=4 1061 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [2,0,0,0,0,0|2,0,0]=4 1062 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [2,0,0,0,0,0|2,0,0]=4 1063 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [2,0,0,0,0,0|2,0,0]=4 1064 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [2,0,0,0,0,0|1,0,0]=3 1065 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [2,0,0,0,0,0|1,0,0]=3 1066 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [2,0,0,0,0,0|1,0,0]=3 1067 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [2,0,0,0,0,0|1,0,0]=3 1068 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [2,0,0,0,0,0|2,0,0]=4 1069 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [2,0,0,0,0,0|1,0,0]=3 1070 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [2,0,0,0,0,0|1,0,0]=3 1071 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [2,0,0,0,0,0|1,0,1]=4 1072 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [2,0,0,0,0,0|1,0,1]=4 1073 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [2,0,0,0,0,0|1,0,1]=4 1074 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [2,0,0,0,0,0|1,0,0]=3 1075 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [2,0,0,0,0,0|1,0,1]=4 1076 B6R0.3 CCN(C)C(=O)Cl MCULE-3697487267 [2,0,0,0,0,0|2,0,0]=4 1077 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [2,0,0,0,0,0|1,0,0]=3 1078 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [2,0,0,0,0,0|1,0,0]=3 1079 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [2,0,0,0,0,0|1,0,0]=3 1080 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [2,0,0,0,0,0|1,0,0]=3 1081 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [2,0,0,0,0,0|0,0,0]=2 1082 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [2,0,0,0,0,0|0,0,0]=2 1083 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [2,0,0,0,0,0|1,0,0]=3 1084 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [2,0,0,0,0,0|1,0,0]=3 1085 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [2,0,0,0,0,0|2,0,0]=4 1086 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [2,0,0,0,0,0|2,0,0]=4 1087 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [2,0,0,0,0,0|2,0,0]=4 1088 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [2,0,0,0,0,0|2,0,0]=4 1089 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [2,0,0,0,0,0|1,0,0]=3 1090 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [2,0,0,0,0,0|1,0,0]=3 1091 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [2,0,0,0,0,0|1,0,0]=3 1092 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [2,0,0,0,0,0|1,0,0]=3 1093 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [2,0,0,0,0,0|1,0,0]=3 1094 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [2,0,0,0,0,0|1,0,0]=3 1095 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [2,0,0,0,0,0|1,0,0]=3 1096 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [2,0,0,0,0,0|1,0,0]=3 1097 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [2,0,0,0,0,0|0,0,0]=2 1098 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [2,0,0,0,0,0|0,0,0]=2 1099 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [2,0,0,0,0,0|1,0,0]=3 1100 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [2,0,0,0,0,0|2,0,0]=4 1101 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [2,0,0,0,0,0|2,0,0]=4 1102 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [2,0,0,0,0,0|2,0,0]=4 1103 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [2,0,0,0,0,0|2,0,0]=4 1104 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [2,0,0,0,0,0|1,0,0]=3 1105 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [2,0,0,0,0,0|1,0,0]=3 1106 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [2,0,0,0,0,0|1,0,0]=3 1107 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [2,0,0,0,0,0|1,0,0]=3 1108 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [2,0,0,0,0,0|1,1,0]=4 1109 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [2,0,0,0,0,0|1,1,0]=4 1110 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [2,0,0,0,0,0|1,0,0]=3 1111 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [2,0,0,0,0,0|1,0,0]=3 1112 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [2,0,0,0,0,0|1,0,1]=4 1113 B6R0.3 CN(C)C(=O)CO MCULE-8470749078 [2,0,0,0,0,0|1,0,1]=4 1114 B6R0.3 CN(C)C(=O)NO MCULE-7406409363 [2,0,0,0,0,0|2,0,0]=4 1115 B6R0.3 CNC(=O)C(=O)O MCULE-5436132271 [2,0,0,0,0,0|1,0,0]=3 1116 B6R0.3 CNC(=O)C(C)C MCULE-9646758802 [2,0,0,0,0,0|2,0,0]=4 1117 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [2,0,0,0,0,0|2,0,0]=4 1118 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [2,0,0,0,0,0|2,0,0]=4 1119 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [2,0,0,0,0,0|1,0,0]=3 1120 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [2,0,0,0,0,0|1,0,0]=3 1121 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [2,0,0,0,0,0|1,0,0]=3 1122 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [2,0,0,0,0,0|2,0,0]=4 1123 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [2,0,0,0,0,0|1,0,0]=3 1124 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [2,0,0,0,0,0|1,0,0]=3 1125 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [2,0,0,0,0,0|1,0,0]=3 1126 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [2,0,0,0,0,0|1,0,0]=3 1127 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [2,0,0,0,0,0|1,0,0]=3 1128 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [2,0,0,0,0,0|1,0,0]=3 1129 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [2,0,0,0,0,0|1,0,0]=3 1130 B6R0.3 COC(=O)C(=O)C MCULE-5423483210 [2,0,0,0,0,0|2,0,0]=4 1131 B6R0.3 COC(=O)C(=O)Cl MCULE-1380456689 [2,0,0,0,0,0|2,0,0]=4 1132 B6R0.3 COC(=O)C(=O)O MCULE-8527842270 [2,0,0,0,0,0|1,0,0]=3 1133 B6R0.3 COC(=O)C(=O)[O-] MCULE-5187907456 [2,0,0,0,0,0|1,0,1]=4 1134 B6R0.3 COC(=O)C(C)C MCULE-8740211817 [2,0,0,0,0,0|2,0,0]=4 1135 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [2,0,0,0,0,0|2,0,0]=4 1136 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [2,0,0,0,0,0|1,0,1]=4 1137 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [2,0,0,0,0,0|2,0,0]=4 1138 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [2,0,0,0,0,0|1,0,0]=3 1139 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [2,0,0,0,0,0|2,0,0]=4 1140 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [2,0,0,0,0,0|1,0,0]=3 1141 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [2,0,0,0,0,0|1,0,0]=3 1142 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [2,0,0,0,0,0|1,0,0]=3 1143 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [2,0,0,0,0,0|1,0,0]=3 1144 B6R0.3 CSC(=O)C(C)C MCULE-3533547228 [2,0,0,0,0,0|2,0,0]=4 1145 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [2,0,0,0,0,0|1,0,1]=4 1146 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [2,0,0,0,0,0|1,0,0]=3 1147 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [2,0,0,0,0,0|1,0,0]=3 1148 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [2,0,0,0,0,0|1,0,0]=3 1149 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [2,0,0,0,0,0|1,0,0]=3 1150 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [2,0,0,0,0,0|1,0,0]=3 1151 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [2,0,0,0,0,0|1,0,0]=3 1152 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [2,0,0,0,0,0|1,0,0]=3 1153 B6R0.3 C[C@@H](ON)C(=O)O MCULE-1538722507 [2,0,0,0,0,0|2,0,0]=4 1154 B6R0.3 C[C@@H](ON)C(=O)O MCULE-3835402446 [2,0,0,0,0,0|2,0,0]=4 1155 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [2,0,0,0,0,0|1,0,0]=3 1156 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [2,0,0,0,0,0|1,0,0]=3 1157 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [2,0,0,0,0,0|1,0,0]=3 1158 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [2,0,0,0,0,0|1,0,0]=3 1159 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [2,0,0,0,0,0|1,0,0]=3 1160 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [2,0,0,0,0,0|1,0,0]=3 1161 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [2,0,0,0,0,0|1,0,1]=4 1162 B6R0.3 C[C@H](ON)C(=O)O MCULE-3327889540 [2,0,0,0,0,0|2,0,0]=4 1163 B6R0.3 C[C@H](ON)C(=O)O MCULE-4523264650 [2,0,0,0,0,0|2,0,0]=4 1164 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [2,0,0,0,0,0|2,0,0]=4 1165 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [2,0,0,0,0,0|2,0,0]=4 1166 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [2,0,0,0,0,0|2,0,0]=4 1167 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [2,0,0,0,0,0|2,0,0]=4 1168 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [2,0,0,0,0,0|2,0,0]=4 1169 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [2,0,0,0,0,0|2,0,0]=4 1170 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [2,0,0,0,0,0|2,0,0]=4 1171 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [2,0,0,0,0,0|2,0,0]=4 1172 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [2,0,0,0,0,0|2,0,0]=4 1173 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [2,0,0,0,0,0|2,0,0]=4 1174 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [2,0,0,0,0,0|2,0,0]=4 1175 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [2,0,0,0,0,0|2,0,0]=4 1176 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [2,0,0,0,0,0|2,0,0]=4 1177 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [2,0,0,0,0,0|2,0,0]=4 1178 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [2,0,0,0,0,0|2,0,0]=4 1179 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [2,0,0,0,0,0|2,0,0]=4 1180 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [2,0,0,0,0,0|2,0,0]=4 1181 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [2,0,0,0,0,0|2,0,0]=4 1182 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [2,0,0,0,0,0|2,0,0]=4 1183 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [2,0,0,0,0,0|2,0,0]=4 1184 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [2,0,0,0,0,0|2,0,0]=4 1185 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [2,0,0,0,0,0|2,0,0]=4 1186 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [2,0,0,0,0,0|2,0,0]=4 1187 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [2,0,0,0,0,0|2,0,0]=4 1188 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [2,0,0,0,0,0|2,0,0]=4 1189 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [2,0,0,0,0,0|2,0,0]=4 1190 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [2,0,0,0,0,0|2,0,0]=4 1191 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [2,0,0,0,0,0|2,0,0]=4 1192 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [2,0,0,0,0,0|2,0,0]=4 1193 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [2,0,0,0,0,0|2,0,0]=4 1194 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [2,0,0,0,0,0|2,0,0]=4 1195 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [2,0,0,0,0,0|2,0,0]=4 1196 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [2,0,0,0,0,0|2,0,0]=4 1197 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [2,0,0,0,0,0|2,0,0]=4 1198 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [2,0,0,0,0,0|2,0,0]=4 1199 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [2,0,0,0,0,0|2,0,0]=4 1200 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [2,0,0,0,0,0|2,0,0]=4 1201 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [2,0,0,0,0,0|2,0,0]=4 1202 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [2,0,0,0,0,0|2,0,0]=4 1203 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [2,0,0,0,0,0|2,0,0]=4 1204 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [2,0,0,0,0,0|2,0,0]=4 1205 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [2,0,0,0,0,0|2,0,0]=4 1206 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [2,0,0,0,0,0|2,0,0]=4 1207 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [2,0,0,0,0,0|2,0,0]=4 1208 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [2,0,0,0,0,0|2,0,0]=4 1209 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [2,0,0,0,0,0|2,0,0]=4 1210 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [2,0,0,0,0,0|2,0,0]=4 1211 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [2,0,0,0,0,0|2,0,0]=4 1212 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [2,0,0,0,0,0|2,0,0]=4 1213 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [2,0,0,0,0,0|2,0,0]=4 1214 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [2,0,0,0,0,0|2,0,0]=4 1215 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [2,0,0,0,0,0|2,0,0]=4 1216 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [2,0,0,0,0,0|2,0,0]=4 1217 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [2,0,0,0,0,0|2,0,0]=4 1218 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [2,0,0,0,0,0|2,0,0]=4 1219 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [2,0,0,0,0,0|2,0,0]=4 1220 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [2,0,0,0,0,0|2,0,0]=4 1221 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [2,0,0,0,0,0|2,0,0]=4 1222 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [2,0,0,0,0,0|2,0,0]=4 1223 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [2,0,0,0,0,0|2,0,0]=4 1224 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [2,0,0,0,0,0|2,0,0]=4 1225 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [2,0,0,0,0,0|2,0,0]=4 1226 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [2,0,0,0,0,0|2,0,0]=4 1227 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [2,0,0,0,0,0|2,0,0]=4 1228 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [2,0,0,0,0,0|2,0,0]=4 1229 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [2,0,0,0,0,0|2,0,0]=4 1230 B6R0.3 O=C(Cl)C(=O)CBr MCULE-1637788630 [2,0,0,0,0,0|2,0,0]=4 1231 B6R0.3 O=C(O)C(=O)CBr MCULE-4768170572 [2,0,0,0,0,0|1,0,0]=3 1232 B6R0.3 O=C(O)C(=O)CCl MCULE-7853426045 [2,0,0,0,0,0|1,0,0]=3 1233 B6R0.3 O=C(O)C(=O)CF MCULE-5884987827 [2,0,0,0,0,0|1,0,0]=3 1234 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [2,0,0,0,0,0|1,0,0]=3 1235 B6R0.3 O=C(O)C(=O)CS MCULE-7466669113 [2,0,0,0,0,0|1,0,0]=3 1236 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [2,0,0,0,0,0|2,0,0]=4 1237 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [2,0,0,0,0,0|2,0,0]=4 1238 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [2,0,0,0,0,0|2,0,0]=4 1239 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [2,0,0,0,0,0|2,0,0]=4 1240 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [2,0,0,0,0,0|2,0,0]=4 1241 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [2,0,0,0,0,0|2,0,0]=4 1242 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [2,0,0,0,0,0|2,0,0]=4 1243 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [2,0,0,0,0,0|2,0,0]=4 1244 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [2,0,0,0,0,0|2,0,0]=4 1245 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [2,0,0,0,0,0|2,0,0]=4 1246 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [2,0,0,0,0,0|2,0,0]=4 1247 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [2,0,0,0,0,0|2,0,0]=4 1248 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [2,0,0,0,0,0|2,0,0]=4 1249 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [2,0,0,0,0,0|2,0,0]=4 1250 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [2,0,0,0,0,0|2,0,0]=4 1251 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [2,0,0,0,0,0|2,0,0]=4 1252 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [2,0,0,0,0,0|2,0,0]=4 1253 B6R0.3 O=C([O-])C(=O)CF MCULE-9109967389 [2,0,0,0,0,0|1,0,1]=4 1254 B6R0.3 O=C([O-])C(=O)CS MCULE-4375165973 [2,0,0,0,0,0|1,0,1]=4 1255 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [2,0,0,0,0,0|2,0,0]=4 1256 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [2,0,0,0,0,0|1,0,0]=3 1257 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [2,0,0,0,0,0|1,0,0]=3 1258 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [2,0,0,0,0,0|2,0,0]=4 1259 B8R0.5 CCC/C(=C/C(=O)O)/C MCULE-2055195599 [1,1,0,0,0,0|0,0,1]=3 1260 B8R0.5 CCCC(=CC(=O)O)C MCULE-9033187683 [1,1,0,0,0,0|0,0,1]=3 1261 B8R0.5 CCCC(C)CC(=O)C MCULE-7925360299 [1,1,0,0,0,0|1,0,1]=4 1262 B8R0.5 CCCC(C)CC(=O)O MCULE-6002154473 [1,1,0,0,0,0|0,0,1]=3 1263 B8R0.5 CCCC(C)OC(=O)C MCULE-2841775696 [1,1,0,0,0,0|2,0,0]=4 1264 B8R0.5 CCCC(C)OC(=O)Cl MCULE-8719460411 [1,1,0,0,0,0|2,0,0]=4 1265 B8R0.5 CCCC(C)OC(=O)N MCULE-5471819133 [1,1,0,0,0,0|2,0,0]=4 1266 B8R0.5 CCCC(N)CC(=O)O MCULE-1356349547 [1,1,0,0,0,0|1,0,1]=4 1267 B8R0.5 CCCC(N)CC(=O)O MCULE-4946770886 [1,1,0,0,0,0|1,0,1]=4 1268 B8R0.5 CCCC(N)CC(=O)O MCULE-5502250330 [1,1,0,0,0,0|1,0,1]=4 1269 B8R0.5 CCCC(N)CC(=O)O MCULE-9959180111 [1,1,0,0,0,0|1,0,1]=4 1270 B8R0.5 CCCC(O)CC(=O)O MCULE-3158579605 [1,1,0,0,0,0|1,0,1]=4 1271 B8R0.5 CCCN(C)CC(=O)O MCULE-2690950295 [1,1,0,0,0,0|1,0,1]=4 1272 B8R0.5 CCCN(C)CC(=O)O MCULE-9588106269 [1,1,0,0,0,0|1,0,1]=4 1273 B8R0.5 CCC[C@@H](N)CC(=O)O MCULE-9961668094 [1,1,0,0,0,0|1,0,1]=4 1274 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-1726586898 [1,1,0,0,0,0|1,0,1]=4 1275 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5359238908 [1,1,0,0,0,0|1,0,1]=4 1276 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-5593873511 [1,1,0,0,0,0|1,0,1]=4 1277 B8R0.5 CCC[C@H](N)CC(=O)O MCULE-7588873691 [1,1,0,0,0,0|1,0,1]=4 1278 B8R0.5 CCNC(=CC(=O)C)C MCULE-8804688598 [1,1,0,0,0,0|1,0,1]=4 1279 B8R0.5 CCNC(C)CC(=O)O MCULE-2938286546 [1,1,0,0,0,0|0,0,1]=3 1280 B8R0.5 CCNC(C)CC(=O)O MCULE-4848873654 [1,1,0,0,0,0|0,0,1]=3 1281 B8R0.5 CCO/C(=C/C(=O)O)/N MCULE-7778274433 [1,1,0,0,0,0|1,0,1]=4 1282 B8R0.5 CCO/C(=C/C(=O)O)/N MCULE-8836710093 [1,1,0,0,0,0|1,0,1]=4 1283 B8R0.5 CCOC(C)SC(=O)C MCULE-7308480995 [1,1,0,0,0,0|2,0,0]=4 1284 B8R0.5 CCSC(C)CC(=O)O MCULE-9735540046 [1,1,0,0,0,0|0,0,1]=3 1285 B8R0.5 CN(CCO)CC(=O)O MCULE-9266824629 [1,1,0,0,0,0|1,0,1]=4 1286 B8R0.5 CNCC(O)CC(=O)O MCULE-4502865855 [1,1,0,0,0,0|1,0,1]=4 1287 B8R0.5 CNCC(O)CC(=O)O MCULE-5628718703 [1,1,0,0,0,0|1,0,1]=4 1288 B8R0.5 COCC(=CC(=O)O)C MCULE-7202220126 [1,1,0,0,0,0|0,0,1]=3 1289 B8R0.5 COCC(C)CC(=O)O MCULE-7551495663 [1,1,0,0,0,0|0,0,1]=3 1290 B8R0.5 COCC(C)NC(=O)N MCULE-1001849810 [1,1,0,0,0,0|2,0,0]=4 1291 B8R0.5 COCC(C)OC(=O)C MCULE-8540773364 [1,1,0,0,0,0|2,0,0]=4 1292 B8R0.5 COCC(C)OC(=O)Cl MCULE-3426225357 [1,1,0,0,0,0|2,0,0]=4 1293 B8R0.5 NCCC(O)CC(=O)O MCULE-3095949832 [1,1,0,0,0,0|1,0,1]=4 1294 B8R0.5 NCCC(O)CC(=O)O MCULE-8864780829 [1,1,0,0,0,0|1,0,1]=4 1295 B8R0.16 C=CC(CC)CC(=O)O MCULE-3976460208 [1,1,0,0,0,0|0,0,2]=4 1296 B8R0.16 CCC(=CC(=O)O)CC MCULE-1347248467 [1,1,0,0,0,0|0,0,1]=3 1297 B8R0.16 CCC(CC(=O)N)OC MCULE-9685044533 [1,1,0,0,0,0|1,0,1]=4 1298 B8R0.16 CCC(CC(=O)O)OC MCULE-7066116722 [1,1,0,0,0,0|0,0,1]=3 1299 B8R0.16 CCC(CC(=O)O)SC MCULE-6546556452 [1,1,0,0,0,0|0,0,1]=3 1300 B8R0.16 CCC(CC)CC(=O)C MCULE-6127320575 [1,1,0,0,0,0|1,0,1]=4 1301 B8R0.16 CCC(CC)CC(=O)N MCULE-7974720854 [1,1,0,0,0,0|1,0,1]=4 1302 B8R0.16 CCC(CC)CC(=O)O MCULE-1604696319 [1,1,0,0,0,0|0,0,1]=3 1303 B8R0.16 CCC(CO)NC(=O)C MCULE-9868176705 [1,1,0,0,0,0|2,0,0]=4 1304 B8R0.16 CCN(CC)CC(=O)O MCULE-3120416437 [1,1,0,0,0,0|1,0,1]=4 1305 B8R0.16 CCN(CC)CC(=O)O MCULE-4968287986 [1,1,0,0,0,0|1,0,1]=4 1306 B8R0.16 CC[C@@H](CO)NC(=O)C MCULE-2664687963 [1,1,0,0,0,0|2,0,0]=4 1307 B8R0.16 CC[C@@H](CO)NC(=O)C MCULE-6485833206 [1,1,0,0,0,0|2,0,0]=4 1308 B8R0.16 COC(CC(=O)O)OC MCULE-5378328171 [1,1,0,0,0,0|1,0,1]=4 1309 B8R0.16 COC(CN)CC(=O)O MCULE-5640667137 [1,1,0,0,0,0|1,0,1]=4 1310 B8R0.16 COC(CN)CC(=O)O MCULE-6451369002 [1,1,0,0,0,0|1,0,1]=4 1311 B8R0.16 NCC(CO)CC(=O)O MCULE-2939268634 [1,1,0,0,0,0|1,0,1]=4 1312 B8R0.19 C(O)(CC)CC(=O)OC MCULE-6615199457 [1,1,0,0,0,0|1,0,1]=4 1313 B8R0.19 CCC(=O)CC(C)CC MCULE-8568086135 [1,1,0,0,0,0|1,0,1]=4 1314 B8R0.19 CCC(=O)OC(C)CC MCULE-9589388650 [1,1,0,0,0,0|2,0,0]=4 1315 B8R0.19 CCC(C)CC(=O)OC MCULE-6040162942 [1,1,0,0,0,0|0,0,1]=3 1316 B8R0.19 CCC(C)NC(=O)CBr MCULE-1471524055 [1,1,0,0,0,0|2,0,0]=4 1317 B8R0.19 CCC(C)NC(=O)CCl MCULE-1032516079 [1,1,0,0,0,0|2,0,0]=4 1318 B8R0.19 CCC(C)NC(=O)CN MCULE-2235248545 [1,1,0,0,0,0|2,0,0]=4 1319 B8R0.19 CCC(C)NC(=O)CN MCULE-5232759952 [1,1,0,0,0,0|2,0,0]=4 1320 B8R0.19 CCC(C)OC(=O)NN MCULE-8409912635 [1,1,0,0,0,0|2,0,0]=4 1321 B8R0.19 CCC(N)CC(=O)OC MCULE-4861062224 [1,1,0,0,0,0|1,0,1]=4 1322 B8R0.19 CCC(N)CC(=O)OC MCULE-5474414259 [1,1,0,0,0,0|1,0,1]=4 1323 B8R0.19 CCC(N)CC(=O)OC MCULE-6614411962 [1,1,0,0,0,0|1,0,1]=4 1324 B8R0.19 CCC(N)CC(=O)OC MCULE-8833088600 [1,1,0,0,0,0|1,0,1]=4 1325 B8R0.19 CC[C@@H](N)CC(=O)OC MCULE-2253918492 [1,1,0,0,0,0|1,0,1]=4 1326 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-7264527834 [1,1,0,0,0,0|1,0,1]=4 1327 B8R0.19 CC[C@@H](O)CC(=O)OC MCULE-8077794874 [1,1,0,0,0,0|1,0,1]=4 1328 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-1636989319 [1,1,0,0,0,0|1,0,1]=4 1329 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-6253948831 [1,1,0,0,0,0|1,0,1]=4 1330 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-7924708820 [1,1,0,0,0,0|1,0,1]=4 1331 B8R0.19 CC[C@H](N)CC(=O)OC MCULE-8911472049 [1,1,0,0,0,0|1,0,1]=4 1332 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-3861554927 [1,1,0,0,0,0|1,0,1]=4 1333 B8R0.19 CC[C@H](O)CC(=O)OC MCULE-6307000918 [1,1,0,0,0,0|1,0,1]=4 1334 B8R0.19 CN/C(=C/C(=O)OC)/C MCULE-6748104823 [1,1,0,0,0,0|1,0,1]=4 1335 B8R0.19 CN/C(=C\C(=O)OC)/C MCULE-6583518879 [1,1,0,0,0,0|1,0,1]=4 1336 B8R0.19 CNC(=CC(=O)OC)C MCULE-1607524183 [1,1,0,0,0,0|1,0,1]=4 1337 B8R0.19 CNC(C)CC(=O)OC MCULE-1039195486 [1,1,0,0,0,0|1,0,1]=4 1338 B8R0.19 COC(=O)/C=C(\C)/OC MCULE-8813923973 [1,1,0,0,0,0|1,0,1]=4 1339 B8R0.19 COC(=O)C=C(C)OC MCULE-1610055087 [1,1,0,0,0,0|1,0,1]=4 1340 B8R0.19 COC(=O)CC(C)CBr MCULE-9170421446 [1,1,0,0,0,0|1,0,1]=4 1341 B8R0.19 COC(=O)CC(C)SC MCULE-9425584839 [1,1,0,0,0,0|1,0,1]=4 1342 B8R0.19 COC(=O)NC(C)CN MCULE-4563927308 [1,1,0,0,0,0|2,0,0]=4 1343 B8R0.19 COC(=O)NC(C)CN MCULE-8813177733 [1,1,0,0,0,0|2,0,0]=4 1344 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-1533957902 [1,1,0,0,0,0|2,0,0]=4 1345 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-7036214898 [1,1,0,0,0,0|2,0,0]=4 1346 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-8908212489 [1,1,0,0,0,0|2,0,0]=4 1347 B8R0.19 COC(=O)N[C@@H](C)CN MCULE-9526857370 [1,1,0,0,0,0|2,0,0]=4 1348 B8R0.19 [C@@H](N)(CC)CC(=O)OC MCULE-3287738066 [1,1,0,0,0,0|1,0,1]=4 1349 B8R0.23 CC(=CC(=O)O)C(C)C MCULE-3448393194 [1,1,0,0,0,0|0,0,1]=3 1350 B8R0.23 CC(=O)C(C)CC(=O)O MCULE-9095166615 [1,1,0,0,0,0|0,0,2]=4 1351 B8R0.23 CC(C)C(C)CC(=O)O MCULE-8256978568 [1,1,0,0,0,0|0,0,1]=3 1352 B8R0.23 CC(C)C(N)CC(=O)O MCULE-1591106639 [1,1,0,0,0,0|1,0,1]=4 1353 B8R0.23 CC(C)C(N)CC(=O)O MCULE-2785677086 [1,1,0,0,0,0|1,0,1]=4 1354 B8R0.23 CC(C)C(N)CC(=O)O MCULE-7741390676 [1,1,0,0,0,0|1,0,1]=4 1355 B8R0.23 CC(C)C(N)CC(=O)O MCULE-7820976140 [1,1,0,0,0,0|1,0,1]=4 1356 B8R0.23 CC(C)C(O)CC(=O)O MCULE-2577623422 [1,1,0,0,0,0|1,0,1]=4 1357 B8R0.23 CC(C)N(C)CC(=O)O MCULE-7118433089 [1,1,0,0,0,0|1,0,1]=4 1358 B8R0.23 CC(C)N(C)CC(=O)O MCULE-8801372857 [1,1,0,0,0,0|1,0,1]=4 1359 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-4128027229 [1,1,0,0,0,0|1,0,1]=4 1360 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-5111030586 [1,1,0,0,0,0|1,0,1]=4 1361 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-7447469347 [1,1,0,0,0,0|1,0,1]=4 1362 B8R0.23 CC(C)[C@@H](N)CC(=O)O MCULE-8228659608 [1,1,0,0,0,0|1,0,1]=4 1363 B8R0.23 CC(C)[C@@H](O)CC(=O)O MCULE-6946774834 [1,1,0,0,0,0|1,0,1]=4 1364 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-2362404476 [1,1,0,0,0,0|1,0,1]=4 1365 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-4006103633 [1,1,0,0,0,0|1,0,1]=4 1366 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-8085621397 [1,1,0,0,0,0|1,0,1]=4 1367 B8R0.23 CC(C)[C@H](N)CC(=O)O MCULE-8783742568 [1,1,0,0,0,0|1,0,1]=4 1368 B8R0.23 CC(CC(=O)O)C(F)F MCULE-1349015136 [1,1,0,0,0,0|1,0,1]=4 1369 B8R0.23 CC(CC(=O)O)N(C)C MCULE-5382425068 [1,1,0,0,0,0|1,0,1]=4 1370 B8R0.23 CC(CC(=O)O)N(C)C MCULE-9798996642 [1,1,0,0,0,0|1,0,1]=4 1371 B8R0.23 CC(O)C(N)CC(=O)O MCULE-5161755443 [1,1,0,0,0,0|1,0,1]=4 1372 B8R0.23 CC(O)C(N)CC(=O)O MCULE-6370326858 [1,1,0,0,0,0|1,0,1]=4 1373 B8R0.23 C[C@@H](CC(=O)O)N(C)C MCULE-7203350382 [1,1,0,0,0,0|1,0,1]=4 1374 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-1416044737 [1,1,0,0,0,0|1,0,1]=4 1375 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-2990511228 [1,1,0,0,0,0|1,0,1]=4 1376 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-3178455647 [1,1,0,0,0,0|1,0,1]=4 1377 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-4413833682 [1,1,0,0,0,0|1,0,1]=4 1378 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7332826518 [1,1,0,0,0,0|1,0,1]=4 1379 B8R0.23 C[C@@H](O)[C@H](N)CC(=O)O MCULE-7552978009 [1,1,0,0,0,0|1,0,1]=4 1380 B8R0.23 C[C@H](CC(=O)O)N(C)C MCULE-8459726256 [1,1,0,0,0,0|1,0,1]=4 1381 B8R0.23 C[C@H](O)[C@@H](N)CC(=O)O MCULE-8673070329 [1,1,0,0,0,0|1,0,1]=4 1382 B8R0.34 CC(C)(CBr)CC(=O)O MCULE-4311085343 [1,1,0,0,0,0|1,0,1]=4 1383 B8R0.34 CC(C)(CN)CC(=O)O MCULE-6230830854 [1,1,0,0,0,0|1,0,1]=4 1384 B8R0.34 CC(C)(CN)CC(=O)O MCULE-7518023349 [1,1,0,0,0,0|1,0,1]=4 1385 B8R0.34 CC(C)(CO)CC(=O)O MCULE-8595593482 [1,1,0,0,0,0|1,0,1]=4 1386 B8R0.34 CC(O)(CN)CC(=O)O MCULE-3304637192 [1,1,0,0,0,0|1,0,1]=4 1387 B8R0.34 CC(O)(CN)CC(=O)O MCULE-4143526784 [1,1,0,0,0,0|1,0,1]=4 1388 B8R0.34 CCC(C)(C)CC(=O)C MCULE-9050476347 [1,1,0,0,0,0|1,0,1]=4 1389 B8R0.34 CCC(C)(C)CC(=O)O MCULE-7231252497 [1,1,0,0,0,0|0,0,1]=3 1390 B8R0.34 CCC(C)(C)NC(=O)C MCULE-4494448055 [1,1,0,0,0,0|2,0,0]=4 1391 B8R0.34 CCC(C)(C)OC(=O)C MCULE-9920396593 [1,1,0,0,0,0|2,0,0]=4 1392 B8R0.34 CCC(C)(O)CC(=O)O MCULE-2487477968 [1,1,0,0,0,0|0,0,1]=3 1393 B8R0.34 CCC(F)(F)CC(=O)O MCULE-6139996682 [1,1,0,0,0,0|1,0,1]=4 1394 B8R0.34 COC(C)(C)CC(=O)O MCULE-3953307849 [1,1,0,0,0,0|1,0,1]=4 1395 B8R0.3 C=C(CO)C(=O)OCC MCULE-6343981167 [1,1,0,0,0,0|2,0,0]=4 1396 B8R0.3 C=C(COC)C(=O)OC MCULE-7593559443 [1,1,0,0,0,0|2,0,0]=4 1397 B8R0.3 C=CC(=O)C(=O)OCC MCULE-1301231078 [1,1,0,0,0,0|2,0,0]=4 1398 B8R0.3 CCC=C(C)C(=O)OC MCULE-1695208139 [1,1,0,0,0,0|1,0,1]=4 1399 B8R0.3 CCCC(=O)C(=O)OC MCULE-5789275467 [1,1,0,0,0,0|0,0,0]=2 1400 B8R0.3 CCCC(=O)C(N)CO MCULE-4196745965 [1,1,0,0,0,0|1,0,1]=4 1401 B8R0.3 CCCC(=O)C(N)CO MCULE-9001126199 [1,1,0,0,0,0|1,0,1]=4 1402 B8R0.3 CCCC(=O)N(C)OC MCULE-7871714953 [1,1,0,0,0,0|2,0,0]=4 1403 B8R0.3 CCCC(Br)C(=O)OC MCULE-2779995445 [1,1,0,0,0,0|1,0,1]=4 1404 B8R0.3 CCCC(C)C(=O)OC MCULE-6953134216 [1,1,0,0,0,0|1,0,1]=4 1405 B8R0.3 CCCC(N)C(=O)NO MCULE-2069838283 [1,1,0,0,0,0|1,0,1]=4 1406 B8R0.3 CCCC(N)C(=O)OC MCULE-1453218994 [1,1,0,0,0,0|1,0,1]=4 1407 B8R0.3 CCCC(N)C(=O)OC MCULE-4171872835 [1,1,0,0,0,0|1,0,1]=4 1408 B8R0.3 CCCC(N)C(=O)OC MCULE-4324009425 [1,1,0,0,0,0|1,0,1]=4 1409 B8R0.3 CCCC(N)C(=O)OC MCULE-9533158990 [1,1,0,0,0,0|1,0,1]=4 1410 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-1310673609 [1,1,0,0,0,0|1,0,1]=4 1411 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5850698619 [1,1,0,0,0,0|1,0,1]=4 1412 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-5854286766 [1,1,0,0,0,0|1,0,1]=4 1413 B8R0.3 CCC[C@@H](N)C(=O)OC MCULE-9793822862 [1,1,0,0,0,0|1,0,1]=4 1414 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-2009036281 [1,1,0,0,0,0|1,0,1]=4 1415 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5609199650 [1,1,0,0,0,0|1,0,1]=4 1416 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-5628439347 [1,1,0,0,0,0|1,0,1]=4 1417 B8R0.3 CCC[C@H](N)C(=O)OC MCULE-8724830592 [1,1,0,0,0,0|1,0,1]=4 1418 B8R0.3 CCNC(=O)C(=O)NC MCULE-1033646355 [1,1,0,0,0,0|2,0,0]=4 1419 B8R0.3 CCNC(=O)C(=O)NN MCULE-6591789468 [1,1,0,0,0,0|2,0,0]=4 1420 B8R0.3 CCOC(=O)/C(=C/O)/Cl MCULE-5353637265 [1,1,0,0,0,0|2,0,0]=4 1421 B8R0.3 CCOC(=O)/C(=N/O)/Cl MCULE-3204014001 [1,1,0,0,0,0|2,0,0]=4 1422 B8R0.3 CCOC(=O)/C(=N\O)/Cl MCULE-2082763927 [1,1,0,0,0,0|2,0,0]=4 1423 B8R0.3 CCOC(=O)/C(=N\O)/N MCULE-1558189438 [1,1,0,0,0,0|2,0,0]=4 1424 B8R0.3 CCOC(=O)C(=NO)C MCULE-5698950336 [1,1,0,0,0,0|2,0,0]=4 1425 B8R0.3 CCOC(=O)C(=NO)Cl MCULE-7370047890 [1,1,0,0,0,0|2,0,0]=4 1426 B8R0.3 CCOC(=O)C(=O)CBr MCULE-1292003261 [1,1,0,0,0,0|2,0,0]=4 1427 B8R0.3 CCOC(=O)C(=O)CC MCULE-6268795804 [1,1,0,0,0,0|2,0,0]=4 1428 B8R0.3 CCOC(=O)C(=O)NC MCULE-7000353340 [1,1,0,0,0,0|2,0,0]=4 1429 B8R0.3 CCOC(=O)C(=O)NN MCULE-2508041863 [1,1,0,0,0,0|2,0,0]=4 1430 B8R0.3 CONC(=O)C(=O)OC MCULE-9234071987 [1,1,0,0,0,0|2,0,0]=4 1431 B8R0.8 C=C(C)C(=O)OCCC MCULE-3202968176 [1,1,0,0,0,0|2,0,0]=4 1432 B8R0.8 C=CCCC(=O)C(=O)O MCULE-8012003653 [1,1,0,0,0,0|0,0,1]=3 1433 B8R0.8 CC(CCCCl)C(=O)O MCULE-6504631587 [1,1,0,0,0,0|1,0,1]=4 1434 B8R0.8 CCC/C=C(\C)/C(=O)O MCULE-4080682767 [1,1,0,0,0,0|1,0,0]=3 1435 B8R0.8 CCCC=C(C)C(=O)O MCULE-1072900673 [1,1,0,0,0,0|1,0,0]=3 1436 B8R0.8 CCCCC(=O)C(=O)C MCULE-5957201570 [1,1,0,0,0,0|1,0,0]=3 1437 B8R0.8 CCCCC(=O)C(=O)O MCULE-7796922508 [1,1,0,0,0,0|0,0,0]=2 1438 B8R0.8 CCCCC(=O)C(=O)[O-] MCULE-4575533706 [1,1,0,0,0,0|0,0,1]=3 1439 B8R0.8 CCCCC(Br)C(=O)O MCULE-5428502537 [1,1,0,0,0,0|1,0,1]=4 1440 B8R0.8 CCCCC(C)C(=O)O MCULE-7933263354 [1,1,0,0,0,0|1,0,1]=4 1441 B8R0.8 CCCCC(F)C(=O)O MCULE-2276381656 [1,1,0,0,0,0|1,0,1]=4 1442 B8R0.8 CCCCC(N)C(=O)O MCULE-4930484202 [1,1,0,0,0,0|1,0,1]=4 1443 B8R0.8 CCCCC(O)C(=O)O MCULE-2557585903 [1,1,0,0,0,0|0,0,2]=4 1444 B8R0.8 CCCC[C@@H](C)C(=O)O MCULE-3454696473 [1,1,0,0,0,0|1,0,1]=4 1445 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-3687527484 [1,1,0,0,0,0|1,0,1]=4 1446 B8R0.8 CCCC[C@@H](N)C(=O)O MCULE-9410581572 [1,1,0,0,0,0|1,0,1]=4 1447 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9016844851 [1,1,0,0,0,0|1,0,1]=4 1448 B8R0.8 CCCC[C@H](C)C(=O)O MCULE-9437190196 [1,1,0,0,0,0|1,0,1]=4 1449 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-3656145338 [1,1,0,0,0,0|1,0,1]=4 1450 B8R0.8 CCCC[C@H](N)C(=O)O MCULE-7427914532 [1,1,0,0,0,0|1,0,1]=4 1451 B8R0.8 CCCNC(=O)C(=O)O MCULE-6074987864 [1,1,0,0,0,0|0,0,0]=2 1452 B8R0.8 CCCOC(=O)C(C)O MCULE-8240669472 [1,1,0,0,0,0|1,0,1]=4 1453 B8R0.8 CCCOC(=O)[C@H](C)O MCULE-4150275631 [1,1,0,0,0,0|1,0,1]=4 1454 B8R0.8 CCCOC(C)C(=O)O MCULE-4477829415 [1,1,0,0,0,0|1,0,1]=4 1455 B8R0.8 CCNCC(C)C(=O)O MCULE-3863191122 [1,1,0,0,0,0|1,0,1]=4 1456 B8R0.8 CCNCC(C)C(=O)O MCULE-4164323563 [1,1,0,0,0,0|1,0,1]=4 1457 B8R0.8 CCOCC(C)C(=O)O MCULE-5346959026 [1,1,0,0,0,0|1,0,1]=4 1458 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9199053225 [1,1,0,0,0,0|1,0,1]=4 1459 B8R0.8 CCOC[C@@H](N)C(=O)O MCULE-9684903914 [1,1,0,0,0,0|1,0,1]=4 1460 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-6351196285 [1,1,0,0,0,0|1,0,1]=4 1461 B8R0.8 CCOC[C@H](N)C(=O)O MCULE-7653589662 [1,1,0,0,0,0|1,0,1]=4 1462 B8R0.8 CCSCC(N)C(=O)O MCULE-9449250733 [1,1,0,0,0,0|1,0,1]=4 1463 B8R0.8 COCCC(C)C(=O)O MCULE-5066180613 [1,1,0,0,0,0|1,0,1]=4 1464 B8R0.8 COCCC(N)C(=O)O MCULE-3018605108 [1,1,0,0,0,0|1,0,1]=4 1465 B8R0.8 COCC[C@H](N)C(=O)O MCULE-6748608543 [1,1,0,0,0,0|1,0,1]=4 1466 B8R0.8 COCC[C@H](N)C(=O)O MCULE-8586358852 [1,1,0,0,0,0|1,0,1]=4 1467 B8R0.8 CSCCC(=O)C(=O)O MCULE-6752350933 [1,1,0,0,0,0|0,0,0]=2 1468 B8R0.8 CSCCC(=O)C(=O)[O-] MCULE-4931776455 [1,1,0,0,0,0|0,0,1]=3 1469 B8R0.8 CSCCC(N)C(=O)O MCULE-5626142345 [1,1,0,0,0,0|1,0,1]=4 1470 B8R0.8 CSCCC(O)C(=O)O MCULE-3684026487 [1,1,0,0,0,0|0,0,2]=4 1471 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-2209985195 [1,1,0,0,0,0|1,0,1]=4 1472 B8R0.8 CSCC[C@@H](N)C(=O)O MCULE-9944164883 [1,1,0,0,0,0|1,0,1]=4 1473 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-3383932641 [1,1,0,0,0,0|1,0,1]=4 1474 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-4603455639 [1,1,0,0,0,0|1,0,1]=4 1475 B8R0.8 CSCC[C@H](N)C(=O)O MCULE-7228063662 [1,1,0,0,0,0|1,0,1]=4 1476 B8R0.8 C[Se]CCC(N)C(=O)O MCULE-9212969564 [1,1,0,0,0,0|1,0,1]=4 1477 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5333020269 [1,1,0,0,0,0|1,0,1]=4 1478 B8R0.8 C[Se]CC[C@H](N)C(=O)O MCULE-5980340572 [1,1,0,0,0,0|1,0,1]=4 1479 B8R0.8 NC(CCCO)C(=O)O MCULE-5421732564 [1,1,0,0,0,0|1,0,1]=4 1480 B8R0.8 NCCCC(N)C(=O)O MCULE-1970642620 [1,1,0,0,0,0|1,0,1]=4 1481 B8R0.8 NCCCC(N)C(=O)O MCULE-4486209373 [1,1,0,0,0,0|1,0,1]=4 1482 B8R0.8 NCCCC(N)C(=O)O MCULE-8193724048 [1,1,0,0,0,0|1,0,1]=4 1483 B8R0.8 NCCCC(N)C(=O)O MCULE-9223414094 [1,1,0,0,0,0|1,0,1]=4 1484 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-1634156072 [1,1,0,0,0,0|1,0,1]=4 1485 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2602820298 [1,1,0,0,0,0|1,0,1]=4 1486 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-2719848774 [1,1,0,0,0,0|1,0,1]=4 1487 B8R0.8 NCCC[C@@H](N)C(=O)O MCULE-8413545449 [1,1,0,0,0,0|1,0,1]=4 1488 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2588005079 [1,1,0,0,0,0|1,0,1]=4 1489 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-2852667696 [1,1,0,0,0,0|1,0,1]=4 1490 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-3029872280 [1,1,0,0,0,0|1,0,1]=4 1491 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-4242810787 [1,1,0,0,0,0|1,0,1]=4 1492 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-6924538097 [1,1,0,0,0,0|1,0,1]=4 1493 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-8642266626 [1,1,0,0,0,0|1,0,1]=4 1494 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9352931710 [1,1,0,0,0,0|1,0,1]=4 1495 B8R0.8 NCCC[C@H](N)C(=O)O MCULE-9532999202 [1,1,0,0,0,0|1,0,1]=4 1496 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-3220645027 [1,1,0,0,0,0|1,0,1]=4 1497 B8R0.8 N[C@@H](CCCO)C(=O)O MCULE-4608316868 [1,1,0,0,0,0|1,0,1]=4 1498 B8R0.8 O=C(O)C(O)CCCO MCULE-9386031706 [1,1,0,0,0,0|0,0,2]=4 1499 B8R0.12 CCCC(C)(C)C(=O)O MCULE-7950118630 [1,1,0,0,0,0|1,0,1]=4 1500 B8R0.12 CCCC(C)(N)C(=O)O MCULE-3079931045 [1,1,0,0,0,0|1,0,1]=4 1501 B8R0.12 CCCC(C)(O)C(=O)O MCULE-5292180056 [1,1,0,0,0,0|0,0,2]=4 1502 B8R0.12 CCCC(F)(F)C(=O)O MCULE-9926038462 [1,1,0,0,0,0|1,0,1]=4 1503 B8R0.12 CCC[C@](C)(N)C(=O)O MCULE-8569302783 [1,1,0,0,0,0|1,0,1]=4 1504 B8R0.12 CCOP(=O)(O)C(=O)O MCULE-8851144535 [1,1,0,0,0,0|2,0,0]=4 1505 B8R0.14 CCOC(=O)P(=O)(O)O MCULE-4584710421 [1,1,0,0,0,0|2,0,0]=4 1506 B8R0.15 CCCC(=NO)C(=O)N MCULE-4974052536 [1,1,0,0,0,0|1,0,1]=4 1507 B8R0.15 CCCC(C#N)C(=O)O MCULE-8231205596 [1,1,0,0,0,0|1,0,1]=4 1508 B8R0.15 CCCC(CC)C(=O)O MCULE-2070546888 [1,1,0,0,0,0|1,0,1]=4 1509 B8R0.15 CCCC(CO)C(=O)O MCULE-2653026260 [1,1,0,0,0,0|0,0,2]=4 1510 B8R0.15 CCCC(NC)C(=O)O MCULE-5292420123 [1,1,0,0,0,0|1,0,1]=4 1511 B8R0.15 CCCC(NC)C(=O)O MCULE-5734283547 [1,1,0,0,0,0|1,0,1]=4 1512 B8R0.15 CCCC(NC)C(=O)O MCULE-9559460593 [1,1,0,0,0,0|1,0,1]=4 1513 B8R0.15 CCCC(NO)C(=O)O MCULE-7484331195 [1,1,0,0,0,0|0,0,2]=4 1514 B8R0.15 CCCC(OC)C(=O)O MCULE-6875744280 [1,1,0,0,0,0|0,0,2]=4 1515 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-3394704356 [1,1,0,0,0,0|1,0,1]=4 1516 B8R0.15 CCC[C@@H](NC)C(=O)O MCULE-8140893147 [1,1,0,0,0,0|1,0,1]=4 1517 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-1805025355 [1,1,0,0,0,0|0,0,2]=4 1518 B8R0.15 CCC[C@H](CO)C(=O)O MCULE-3449491143 [1,1,0,0,0,0|0,0,2]=4 1519 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-1028689544 [1,1,0,0,0,0|1,0,1]=4 1520 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-4848752673 [1,1,0,0,0,0|1,0,1]=4 1521 B8R0.15 CCC[C@H](NC)C(=O)O MCULE-5585839502 [1,1,0,0,0,0|1,0,1]=4 1522 B8R0.15 CCC[C@H](NO)C(=O)O MCULE-7455558431 [1,1,0,0,0,0|0,0,2]=4 1523 B8R0.13 CC(C)(CCl)C(=O)NO MCULE-7417714844 [1,1,0,0,0,0|2,0,0]=4 1524 B8R0.13 CCC(=O)C(C)(C)CC MCULE-3794055790 [1,1,0,0,0,0|1,0,1]=4 1525 B8R0.13 CCC(C)(C)C(=O)CBr MCULE-4740682169 [1,1,0,0,0,0|1,0,1]=4 1526 B8R0.13 CCC(C)(C)C(=O)CCl MCULE-6098410477 [1,1,0,0,0,0|1,0,1]=4 1527 B8R0.13 CCC(C)(C)C(=O)OC MCULE-4686994014 [1,1,0,0,0,0|2,0,0]=4 1528 B8R0.13 CCC(C)(N)C(=O)OC MCULE-3094414845 [1,1,0,0,0,0|2,0,0]=4 1529 B8R0.13 CCC(C)(N)C(=O)OC MCULE-3671452978 [1,1,0,0,0,0|2,0,0]=4 1530 B8R0.13 CCC(C)(N)C(=O)OC MCULE-7294646980 [1,1,0,0,0,0|2,0,0]=4 1531 B8R0.13 CCC(C)(N)C(=O)OC MCULE-7579678256 [1,1,0,0,0,0|2,0,0]=4 1532 B8R0.13 CCC(C)(N)C(=O)OC MCULE-8600950514 [1,1,0,0,0,0|2,0,0]=4 1533 B8R0.13 CCC(C)(O)C(=O)OC MCULE-8142046975 [1,1,0,0,0,0|2,0,0]=4 1534 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-2166068124 [1,1,0,0,0,0|2,0,0]=4 1535 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-5528793909 [1,1,0,0,0,0|2,0,0]=4 1536 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-5577268972 [1,1,0,0,0,0|2,0,0]=4 1537 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-9937729069 [1,1,0,0,0,0|2,0,0]=4 1538 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-1110630847 [1,1,0,0,0,0|2,0,0]=4 1539 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-1873229791 [1,1,0,0,0,0|2,0,0]=4 1540 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-2400409033 [1,1,0,0,0,0|2,0,0]=4 1541 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-7488892262 [1,1,0,0,0,0|2,0,0]=4 1542 B8R0.20 C=CC(=O)N(CC)CC MCULE-7297711661 [1,1,0,0,0,0|2,0,0]=4 1543 B8R0.20 CCC(C)C(C=O)OC MCULE-5091212843 [1,1,0,0,0,0|0,0,2]=4 1544 B8R0.20 CCC(CC)C(=O)NC MCULE-1491407837 [1,1,0,0,0,0|2,0,0]=4 1545 B8R0.20 CCC(CC)C(=O)NN MCULE-2188897892 [1,1,0,0,0,0|2,0,0]=4 1546 B8R0.20 CCC(CC)C(=O)OC MCULE-4475439540 [1,1,0,0,0,0|2,0,0]=4 1547 B8R0.20 CCC(CN)C(=O)OC MCULE-1321974588 [1,1,0,0,0,0|2,0,0]=4 1548 B8R0.20 CCC(CN)C(=O)OC MCULE-3486156834 [1,1,0,0,0,0|2,0,0]=4 1549 B8R0.20 CCC(CO)C(=O)OC MCULE-3580039708 [1,1,0,0,0,0|2,0,0]=4 1550 B8R0.20 CCC(NC)C(=O)OC MCULE-2432468432 [1,1,0,0,0,0|2,0,0]=4 1551 B8R0.20 CCC(NC)C(=O)OC MCULE-3478855741 [1,1,0,0,0,0|2,0,0]=4 1552 B8R0.20 CCC(OC)C(=O)NN MCULE-3579318749 [1,1,0,0,0,0|2,0,0]=4 1553 B8R0.20 CCC(OC)C(=O)NN MCULE-8374336485 [1,1,0,0,0,0|2,0,0]=4 1554 B8R0.20 CCN(CC)C(=O)CO MCULE-1108898893 [1,1,0,0,0,0|1,0,1]=4 1555 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-3786730078 [1,1,0,0,0,0|2,0,0]=4 1556 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-5452442009 [1,1,0,0,0,0|2,0,0]=4 1557 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-6957965861 [1,1,0,0,0,0|2,0,0]=4 1558 B8R0.20 CC[C@H](NC)C(=O)OC MCULE-7876560081 [1,1,0,0,0,0|2,0,0]=4 1559 B8R0.18 CC(=C(C#N)C(=O)O)C MCULE-7102466999 [1,1,0,0,0,0|1,0,1]=4 1560 B8R0.18 CC(=O)C(=NO)C(C)C MCULE-2066689265 [1,1,0,0,0,0|1,0,1]=4 1561 B8R0.18 CC(C)C(CN)C(=O)O MCULE-4117902081 [1,1,0,0,0,0|1,0,1]=4 1562 B8R0.18 CC(C)C(CN)C(=O)O MCULE-7615812755 [1,1,0,0,0,0|1,0,1]=4 1563 B8R0.18 CC(C)C(CN)C(=O)O MCULE-7742033605 [1,1,0,0,0,0|1,0,1]=4 1564 B8R0.18 CC(C)C(CO)C(=O)O MCULE-3554430088 [1,1,0,0,0,0|0,0,2]=4 1565 B8R0.18 CC(C)C(NN)C(=O)O MCULE-5064228794 [1,1,0,0,0,0|1,0,1]=4 1566 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-1192054373 [1,1,0,0,0,0|1,0,1]=4 1567 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-3040043200 [1,1,0,0,0,0|1,0,1]=4 1568 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-4353846755 [1,1,0,0,0,0|1,0,1]=4 1569 B8R0.18 CC(C)[C@@H](CN)C(=O)O MCULE-6762829521 [1,1,0,0,0,0|1,0,1]=4 1570 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4384560751 [1,1,0,0,0,0|1,0,1]=4 1571 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4859224613 [1,1,0,0,0,0|1,0,1]=4 1572 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-4974717674 [1,1,0,0,0,0|1,0,1]=4 1573 B8R0.18 CC(C)[C@H](CN)C(=O)O MCULE-7170111497 [1,1,0,0,0,0|1,0,1]=4 1574 B8R0.18 CC(C)[C@H](NO)C(=O)O MCULE-4203177410 [1,1,0,0,0,0|0,0,2]=4 1575 B8R0.18 CCC(C(=O)O)C(C)C MCULE-5914693527 [1,1,0,0,0,0|1,0,1]=4 1576 B8R0.18 CNC(C(=O)O)C(C)C MCULE-2983512448 [1,1,0,0,0,0|1,0,1]=4 1577 B8R0.18 CNC(C(=O)O)C(C)C MCULE-5377326864 [1,1,0,0,0,0|1,0,1]=4 1578 B8R0.18 CNC(C(=O)O)C(C)C MCULE-7319327975 [1,1,0,0,0,0|1,0,1]=4 1579 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-4099145544 [1,1,0,0,0,0|1,0,1]=4 1580 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-4380404369 [1,1,0,0,0,0|1,0,1]=4 1581 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-9367123188 [1,1,0,0,0,0|1,0,1]=4 1582 B8R0.18 CN[C@@H](C(=O)O)C(C)C MCULE-9706333586 [1,1,0,0,0,0|1,0,1]=4 1583 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5443567819 [1,1,0,0,0,0|1,0,1]=4 1584 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5552228182 [1,1,0,0,0,0|1,0,1]=4 1585 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-5767489702 [1,1,0,0,0,0|1,0,1]=4 1586 B8R0.18 CN[C@H](C(=O)O)C(C)C MCULE-8822349419 [1,1,0,0,0,0|1,0,1]=4 1587 B8R0.18 COC(C(=O)O)C(C)C MCULE-4922461673 [1,1,0,0,0,0|0,0,2]=4 1588 B8R0.18 COC(C(=O)O)C(C)C MCULE-6661618070 [1,1,0,0,0,0|0,0,2]=4 1589 B8R0.18 CO[C@@H](C(=O)O)C(C)C MCULE-1619707717 [1,1,0,0,0,0|0,0,2]=4 1590 B8R0.18 CO[C@H](C(=O)O)C(C)C MCULE-2291773409 [1,1,0,0,0,0|0,0,2]=4 1591 B8R0.18 CSC(C(=O)O)C(C)C MCULE-9613087260 [1,1,0,0,0,0|0,1,1]=4 1592 B8R0.27 C(N)(C(=O)O)C(C)(C)S MCULE-1893345960 [1,1,0,0,0,0|1,0,1]=4 1593 B8R0.27 C=C(C(=O)O)C(C)(C)C MCULE-7253303469 [1,1,0,0,0,0|1,0,0]=3 1594 B8R0.27 CC(C(=O)O)C(C)(C)C MCULE-5931607530 [1,1,0,0,0,0|1,0,1]=4 1595 B8R0.27 CC(C)(Br)C(Br)C(=O)O MCULE-2600237498 [1,1,0,0,0,0|1,0,1]=4 1596 B8R0.27 CC(C)(C)C(=O)C(=O)O MCULE-2891266778 [1,1,0,0,0,0|0,0,0]=2 1597 B8R0.27 CC(C)(C)C(Br)C(=O)O MCULE-3140400663 [1,1,0,0,0,0|1,0,1]=4 1598 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-4378220677 [1,1,0,0,0,0|1,0,1]=4 1599 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-7142182400 [1,1,0,0,0,0|1,0,1]=4 1600 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-9877941557 [1,1,0,0,0,0|1,0,1]=4 1601 B8R0.27 CC(C)(C)C(O)C(=O)O MCULE-2831225594 [1,1,0,0,0,0|0,0,2]=4 1602 B8R0.27 CC(C)(C)C(O)C(=O)O MCULE-6241480954 [1,1,0,0,0,0|0,0,2]=4 1603 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-1280092872 [1,1,0,0,0,0|1,0,1]=4 1604 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-8741274445 [1,1,0,0,0,0|1,0,1]=4 1605 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-9585981018 [1,1,0,0,0,0|1,0,1]=4 1606 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O MCULE-4712331175 [1,1,0,0,0,0|0,0,2]=4 1607 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O MCULE-9440383034 [1,1,0,0,0,0|0,0,2]=4 1608 B8R0.27 CC(C)(C)[C@H](Br)C(=O)O MCULE-3604683063 [1,1,0,0,0,0|1,0,1]=4 1609 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-2361901374 [1,1,0,0,0,0|1,0,1]=4 1610 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-7700637346 [1,1,0,0,0,0|1,0,1]=4 1611 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-8028056550 [1,1,0,0,0,0|1,0,1]=4 1612 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-8791211435 [1,1,0,0,0,0|1,0,1]=4 1613 B8R0.27 CC(C)(C)[C@H](O)C(=O)O MCULE-4165755614 [1,1,0,0,0,0|0,0,2]=4 1614 B8R0.27 CC(C)(C)[C@H](O)C(=O)O MCULE-6845662197 [1,1,0,0,0,0|0,0,2]=4 1615 B8R0.27 CC(C)(F)C(Br)C(=O)O MCULE-8601470705 [1,1,0,0,0,0|1,0,1]=4 1616 B8R0.27 CC(C)(F)C(N)C(=O)O MCULE-3479476353 [1,1,0,0,0,0|1,0,1]=4 1617 B8R0.27 CC(C)(F)[C@H](N)C(=O)O MCULE-4975554837 [1,1,0,0,0,0|1,0,1]=4 1618 B8R0.27 CC(C)(F)[C@H](N)C(=O)O MCULE-6202392495 [1,1,0,0,0,0|1,0,1]=4 1619 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-4257891769 [1,1,0,0,0,0|1,0,1]=4 1620 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-4291820573 [1,1,0,0,0,0|1,0,1]=4 1621 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-8731964950 [1,1,0,0,0,0|1,0,1]=4 1622 B8R0.27 CC(C)(O)C(O)C(=O)O MCULE-2030710507 [1,1,0,0,0,0|0,0,2]=4 1623 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O MCULE-2953137860 [1,1,0,0,0,0|1,0,1]=4 1624 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O MCULE-3424625974 [1,1,0,0,0,0|1,0,1]=4 1625 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-3721152032 [1,1,0,0,0,0|1,0,1]=4 1626 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-7599346102 [1,1,0,0,0,0|1,0,1]=4 1627 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-9499245205 [1,1,0,0,0,0|1,0,1]=4 1628 B8R0.27 CC(C)(S)C(N)C(=O)O MCULE-4184299411 [1,1,0,0,0,0|1,0,1]=4 1629 B8R0.27 CC(C)(S)C(N)C(=O)O MCULE-8542176080 [1,1,0,0,0,0|1,0,1]=4 1630 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O MCULE-5986342172 [1,1,0,0,0,0|1,0,1]=4 1631 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O MCULE-9856748563 [1,1,0,0,0,0|1,0,1]=4 1632 B8R0.27 CC(C)(S)[C@H](N)C(=O)O MCULE-3098543641 [1,1,0,0,0,0|1,0,1]=4 1633 B8R0.27 CC(C)(S)[C@H](N)C(=O)O MCULE-9539588985 [1,1,0,0,0,0|1,0,1]=4 1634 B8R0.27 O=C(O)C(=O)C(F)(F)F MCULE-3149176369 [1,1,0,0,0,0|2,0,0]=4 1635 B8R0.27 [C@@H](N)(C(=O)O)C(C)(C)O MCULE-5116872005 [1,1,0,0,0,0|1,0,1]=4 1636 B8R0.27 [C@H](N)(C(=O)O)C(C)(C)S MCULE-5559697921 [1,1,0,0,0,0|1,0,1]=4 1637 B8R0.37 CC(C)C(C)(C)C(=O)O MCULE-8335448418 [1,1,0,0,0,0|1,0,1]=4 1638 B8R0.37 CC(C)C(C)(N)C(=O)O MCULE-2018617657 [1,1,0,0,0,0|1,0,1]=4 1639 B8R0.37 CC(C)C(C)(N)C(=O)O MCULE-8116018936 [1,1,0,0,0,0|1,0,1]=4 1640 B8R0.37 CC(C)C(C)(O)C(=O)O MCULE-3909217790 [1,1,0,0,0,0|0,0,2]=4 1641 B8R0.37 CC(C)C(F)(F)C(=O)O MCULE-2732318443 [1,1,0,0,0,0|1,0,1]=4 1642 B8R0.37 CC(C)[C@@](C)(N)C(=O)O MCULE-1672449529 [1,1,0,0,0,0|1,0,1]=4 1643 B8R0.37 CC(C)[C@@](C)(N)C(=O)O MCULE-5333264309 [1,1,0,0,0,0|1,0,1]=4 1644 B8R0.37 CC(C)[C@](C)(N)C(=O)O MCULE-3942243398 [1,1,0,0,0,0|1,0,1]=4 1645 B8R0.37 CC(C)[C@](C)(N)C(=O)O MCULE-5291448404 [1,1,0,0,0,0|1,0,1]=4 1646 B10R0.13 CC(C)C(Br)C(=O)NC(=O)N MCULE-4773250122 [0,1,0,0,0,1|2,0,0]=4 1647 B10R0.32 CCCC(C)C(N)CC(=O)O MCULE-9134317193 [0,1,0,0,0,1|1,0,1]=4 1648 B10R0.144 C(=C(CC)C(=O)NC(=O)N)C MCULE-4660531154 [0,1,0,0,0,1|1,0,1]=4 1649 B10R0.144 CCC(CC)C(N)CC(=O)O MCULE-2563066834 [0,1,0,0,0,1|1,0,1]=4 1650 B10R0.144 CCN(CC)C(=O)CC(=O)C MCULE-9697121939 [0,1,0,0,0,1|2,0,0]=4 1651 B10R0.26 CCCC(C)CC(N)C(=O)O MCULE-8848436054 [0,1,0,0,0,1|1,0,1]=4 1652 B10R0.26 CCNC(=O)NC(=O)C(=O)O MCULE-3212586863 [0,1,0,0,0,1|1,0,1]=4 1653 B10R0.67 CCC(C)(C)NC(=O)C(=O)O MCULE-5676334997 [0,1,0,0,0,1|0,0,0]=2 1654 B10R0.72 C=C(CN(CC)CC)C(=O)O MCULE-5441926538 [0,1,0,0,0,1|2,0,0]=4 1655 B10R0.72 CCC(CC)CC(C)C(=O)O MCULE-7999332262 [0,1,0,0,0,1|1,0,1]=4 1656 B10R0.72 CCC(CC)NC(=O)C(=O)O MCULE-8448792347 [0,1,0,0,0,1|0,0,0]=2 1657 B10R0.35 CCOC(=O)C(=O)C(Br)CC MCULE-5207848184 [0,2,0,0,0,0|1,0,0]=3 1658 B10R0.35 CCOC(=O)C(=O)C(C)C#N MCULE-3953724003 [0,2,0,0,0,0|1,0,1]=4 1659 B10R0.35 CCOC(=O)C(=O)N(C)OC MCULE-1827102213 [0,2,0,0,0,0|2,0,0]=4 1660 B10R0.35 CCOC(=O)C(N)C(C)CC MCULE-5178020021 [0,2,0,0,0,0|1,0,1]=4 1661 B10R0.35 CCOC(=O)C(N)C(C)CC MCULE-7362580174 [0,2,0,0,0,0|1,0,1]=4 1662 B10R0.35 CCOC(=O)[C@@H](N)[C@@H](C)CC MCULE-1994822721 [0,2,0,0,0,0|1,0,1]=4 1663 B10R0.35 CCOC(=O)[C@@H](N)[C@@H](C)CC MCULE-7243123410 [0,2,0,0,0,0|1,0,1]=4 1664 B10R0.35 CCOC(=O)[C@@H](N)[C@@H](C)CC MCULE-7344945722 [0,2,0,0,0,0|1,0,1]=4 1665 B10R0.35 CCOC(=O)[C@@H](N)[C@@H](C)CC MCULE-9527149766 [0,2,0,0,0,0|1,0,1]=4 1666 B10R0.35 CCOC(=O)[C@H](N)[C@@H](C)CC MCULE-2879934278 [0,2,0,0,0,0|1,0,1]=4 1667 B10R0.35 CCOC(=O)[C@H](N)[C@@H](C)CC MCULE-4370248546 [0,2,0,0,0,0|1,0,1]=4 1668 B10R0.35 CCOC(=O)[C@H](N)[C@@H](C)CC MCULE-5462791379 [0,2,0,0,0,0|1,0,1]=4 1669 B10R0.35 CCOC(=O)[C@H](N)[C@@H](C)CC MCULE-7887489997 [0,2,0,0,0,0|1,0,1]=4 1670 B10R0.81 COCCC(C)C(N)C(=O)O MCULE-6609752945 [0,2,0,0,0,0|1,0,1]=4 1671 B10R0.39 CCC(C)(C)C(=O)N(C)OC MCULE-4745810651 [0,2,0,0,0,0|2,0,0]=4 1672 B10R0.39 CCC(F)(F)C(=O)C(=O)OF MCULE-4360333144 [0,2,0,0,0,0|1,0,0]=3 1673 B10R0.154 CC(C(=O)O)C(C)C(C)(C)C MCULE-2102421943 [0,2,0,0,0,0|1,0,1]=4 1674 B10R0.38 CCC(CC)C(=O)N(C)OC MCULE-8963746278 [0,2,0,0,0,0|2,0,0]=4 1675 B10R0.38 CCC(CC)C(N)C(=O)OC MCULE-8884744531 [0,2,0,0,0,0|1,0,1]=4 1676 B10R0.51 CCC(C)C(NC)C(=O)OC MCULE-1335818075 [0,2,0,0,0,0|1,0,1]=4 1677 B10R0.51 CCC(C)C(NC)C(=O)OC MCULE-8651667707 [0,2,0,0,0,0|1,0,1]=4 1678 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-1696715513 [0,2,0,0,0,0|1,0,1]=4 1679 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-3420861648 [0,2,0,0,0,0|1,0,1]=4 1680 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-3994275289 [0,2,0,0,0,0|1,0,1]=4 1681 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-4977295519 [0,2,0,0,0,0|1,0,1]=4 1682 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-6644502635 [0,2,0,0,0,0|1,0,1]=4 1683 B10R0.51 CC[C@H](C)[C@H](NC)C(=O)OC MCULE-9316815477 [0,2,0,0,0,0|1,0,1]=4 1684 B10R0.146 CCC(CC)C(F)(F)C(=O)O MCULE-9230607654 [0,2,0,0,0,0|1,0,1]=4 1685 B10R0.30 CC[C@H](C)[C@H](N=[N+]=[N-])C(=O)O MCULE-8569248155 [0,2,0,0,0,0|1,0,1]=4 1686 B10R0.30 CC[C@H](C)[C@H](N=[N+]=[N-])C(=O)O MCULE-9621159559 [0,2,0,0,0,0|1,0,1]=4 1687 B10R0.118 CCC(C)C(C(=O)O)N(C)C MCULE-9389725198 [0,2,0,0,0,0|1,0,1]=4 1688 B8R1.1 CCC1=CC(=O)CC1 MCULE-6681801286 [1,0,0,1,0,0|1,0,1]=4 1689 B8R1.1 CCC1CCC(=O)C1 MCULE-8455504217 [1,0,0,1,0,0|1,0,1]=4 1690 B8R1.1 CCC1CCC(=O)N1 MCULE-6150249637 [1,0,0,1,0,0|2,0,0]=4 1691 B8R1.1 CCC1CCC(=O)O1 MCULE-5161861312 [1,0,0,1,0,0|2,0,0]=4 1692 B8R1.1 CCC1CNC(=O)C1 MCULE-1800672545 [1,0,0,1,0,0|1,0,1]=4 1693 B8R1.1 CCC1CNC(=O)O1 MCULE-9388725409 [1,0,0,1,0,0|2,0,0]=4 1694 B8R1.1 CCC1COC(=N1)C MCULE-1406641220 [1,0,0,1,0,0|2,0,0]=4 1695 B8R1.1 CCC1COC(=O)C1 MCULE-1996435734 [1,0,0,1,0,0|0,0,1]=3 1696 B8R1.1 CCC1COC(=O)N1 MCULE-4345668230 [1,0,0,1,0,0|1,0,0]=3 1697 B8R1.1 CCC1COC(=O)O1 MCULE-5743084846 [1,0,0,1,0,0|1,0,0]=3 1698 B8R1.1 CC[C@@H]1CCC(=O)C1 MCULE-7687801028 [1,0,0,1,0,0|1,0,1]=4 1699 B8R1.1 CC[C@@H]1CCC(=O)O1 MCULE-9831904901 [1,0,0,1,0,0|2,0,0]=4 1700 B8R1.1 CC[C@H]1CCC(=O)C1 MCULE-6479003670 [1,0,0,1,0,0|1,0,1]=4 1701 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-2443615902 [1,0,0,1,0,0|1,0,0]=3 1702 B8R1.1 CC[C@H]1COC(=O)N1 MCULE-9191549724 [1,0,0,1,0,0|1,0,0]=3 1703 B8R1.1 COC1=CC(=O)OC1 MCULE-9199919492 [1,0,0,1,0,0|1,0,1]=4 1704 B8R1.1 NCC1COC(=O)N1 MCULE-8454292565 [1,0,0,1,0,0|2,0,0]=4 1705 B8R1.1 NCC1COC(=O)N1 MCULE-9068275563 [1,0,0,1,0,0|2,0,0]=4 1706 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-1988909942 [1,0,0,1,0,0|2,0,0]=4 1707 B8R1.1 NC[C@H]1COC(=O)N1 MCULE-9340310155 [1,0,0,1,0,0|2,0,0]=4 1708 B8R1.1 O=C1C=C(CO1)CBr MCULE-1493137482 [1,0,0,1,0,0|1,0,1]=4 1709 B8R1.1 O=C1C=C(CO1)CI MCULE-7834471824 [1,0,0,1,0,0|1,0,1]=4 1710 B8R1.1 O=C1C=C(CO1)CO MCULE-9263407854 [1,0,0,1,0,0|1,0,1]=4 1711 B8R1.1 O=C1CC(CO1)CO MCULE-7403068263 [1,0,0,1,0,0|1,0,1]=4 1712 B8R1.1 O=C1NC(CO1)CI MCULE-3725463438 [1,0,0,1,0,0|2,0,0]=4 1713 B8R1.1 O=C1NC(CO1)CI MCULE-8271591026 [1,0,0,1,0,0|2,0,0]=4 1714 B8R1.1 O=C1NC(CO1)CO MCULE-8296379772 [1,0,0,1,0,0|2,0,0]=4 1715 B8R1.1 O=C1NC(CO1)CO MCULE-9797812862 [1,0,0,1,0,0|2,0,0]=4 1716 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-2270288938 [1,0,0,1,0,0|2,0,0]=4 1717 B8R1.1 O=C1N[C@@H](CO1)CO MCULE-5533745846 [1,0,0,1,0,0|2,0,0]=4 1718 B8R1.1 O=C1N[C@H](CO1)CI MCULE-5817468950 [1,0,0,1,0,0|2,0,0]=4 1719 B8R1.1 O=C1N[C@H](CO1)CI MCULE-6940377154 [1,0,0,1,0,0|2,0,0]=4 1720 B8R1.1 O=C1N[C@H](CO1)CO MCULE-3186572246 [1,0,0,1,0,0|2,0,0]=4 1721 B8R1.1 O=C1N[C@H](CO1)CO MCULE-4534112642 [1,0,0,1,0,0|2,0,0]=4 1722 B8R1.1 O=C1OCC(O1)CCl MCULE-7212643481 [1,0,0,1,0,0|2,0,0]=4 1723 B8R1.1 O=C1OCC(O1)CF MCULE-2066386250 [1,0,0,1,0,0|2,0,0]=4 1724 B8R1.1 O=C1OCC(O1)CO MCULE-1831262013 [1,0,0,1,0,0|2,0,0]=4 1725 B8R1.4 CC1=CC(=O)CCC1 MCULE-6849313207 [1,0,0,1,0,0|1,0,1]=4 1726 B8R1.4 CC1=CC(=O)OCC1 MCULE-1467184061 [1,0,0,1,0,0|0,0,1]=3 1727 B8R1.4 CC1CCCC(=O)C1 MCULE-6473963111 [1,0,0,1,0,0|1,0,1]=4 1728 B8R1.4 CC1CCCC(=O)C1 MCULE-9918051823 [1,0,0,1,0,0|1,0,1]=4 1729 B8R1.4 CC1CCCC(=O)N1 MCULE-3851963076 [1,0,0,1,0,0|2,0,0]=4 1730 B8R1.4 CC1CCCC(=O)O1 MCULE-4000069856 [1,0,0,1,0,0|2,0,0]=4 1731 B8R1.4 CC1CCNC(=O)C1 MCULE-8903018599 [1,0,0,1,0,0|1,0,1]=4 1732 B8R1.4 CC1CCNC(=O)N1 MCULE-6491047836 [1,0,0,1,0,0|2,0,0]=4 1733 B8R1.4 CC1CCOC(=O)C1 MCULE-2682865017 [1,0,0,1,0,0|0,0,1]=3 1734 B8R1.4 CC1CCOC(=O)O1 MCULE-5929311811 [1,0,0,1,0,0|1,0,0]=3 1735 B8R1.4 CC1CCOS(=O)O1 MCULE-8688981983 [1,0,0,1,0,0|2,0,0]=4 1736 B8R1.4 CN1CCOC(=O)C1 MCULE-2224720964 [1,0,0,1,0,0|1,0,1]=4 1737 B8R1.4 CN1CCOC(=O)C1 MCULE-9163078129 [1,0,0,1,0,0|1,0,1]=4 1738 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-1868776628 [1,0,0,1,0,0|1,0,1]=4 1739 B8R1.4 C[C@@H]1CCCC(=O)C1 MCULE-6973928430 [1,0,0,1,0,0|1,0,1]=4 1740 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-2050655386 [1,0,0,1,0,0|2,0,0]=4 1741 B8R1.4 C[C@@H]1CCCC(=O)N1 MCULE-7049359933 [1,0,0,1,0,0|2,0,0]=4 1742 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-6306078053 [1,0,0,1,0,0|2,0,0]=4 1743 B8R1.4 C[C@@H]1CCCC(=O)O1 MCULE-7616070208 [1,0,0,1,0,0|2,0,0]=4 1744 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-4643975445 [1,0,0,1,0,0|1,0,1]=4 1745 B8R1.4 C[C@H]1CCCC(=O)C1 MCULE-6122391840 [1,0,0,1,0,0|1,0,1]=4 1746 B8R1.4 C[C@H]1CCNC(=O)C1 MCULE-7120988665 [1,0,0,1,0,0|1,0,1]=4 1747 B8R1.4 [C@@H]1(CCCC(=O)N1)C MCULE-8906937588 [1,0,0,1,0,0|2,0,0]=4 1748 B8R1.18 CC1=CC(=O)CC1C MCULE-9587444246 [1,0,0,1,0,0|1,0,1]=4 1749 B8R1.18 CC1=CC(=O)OC1O MCULE-2111708862 [1,0,0,1,0,0|1,0,1]=4 1750 B8R1.18 CC1=CC(=O)O[C@@H]1O MCULE-3894053073 [1,0,0,1,0,0|1,0,1]=4 1751 B8R1.18 CC1CC(=O)OC1C MCULE-3906254123 [1,0,0,1,0,0|0,0,1]=3 1752 B8R1.18 CC1CC(=O)OC1O MCULE-7140241012 [1,0,0,1,0,0|1,0,1]=4 1753 B8R1.18 CC1NC(=O)OC1C MCULE-5204749893 [1,0,0,1,0,0|1,0,0]=3 1754 B8R1.18 CC1OC(=O)C=C1O MCULE-1494473960 [1,0,0,1,0,0|1,0,1]=4 1755 B8R1.18 CC1OC(=O)OC1C MCULE-1302025126 [1,0,0,1,0,0|1,0,0]=3 1756 B8R1.18 CC1OS(=O)OC1C MCULE-8578188591 [1,0,0,1,0,0|2,0,0]=4 1757 B8R1.18 C[C@H]1CC(=O)O[C@H]1C MCULE-7756599719 [1,0,0,1,0,0|0,0,1]=3 1758 B8R1.20 CC1CC1CC(=O)O MCULE-3151390667 [1,0,0,1,0,0|0,0,1]=3 1759 B8R1.31 C1(CCN1C)C(=O)O MCULE-3478640390 [1,0,0,1,0,0|1,0,1]=4 1760 B8R1.31 CC(=O)[C@@H]1CC[C@H]1C MCULE-1543129128 [1,0,0,1,0,0|1,0,1]=4 1761 B8R1.31 CC1CCC1C(=O)O MCULE-2755332087 [1,0,0,1,0,0|0,0,1]=3 1762 B8R1.31 CC1CNC1C(=O)O MCULE-4084486339 [1,0,0,1,0,0|1,0,1]=4 1763 B8R1.31 CC1NCC1C(=O)O MCULE-3701314568 [1,0,0,1,0,0|1,0,1]=4 1764 B8R1.31 CN1CCC1C(=O)O MCULE-5037838055 [1,0,0,1,0,0|1,0,1]=4 1765 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-3293015609 [1,0,0,1,0,0|1,0,1]=4 1766 B8R1.31 CN1CC[C@@H]1C(=O)O MCULE-6726499104 [1,0,0,1,0,0|1,0,1]=4 1767 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-1519401164 [1,0,0,1,0,0|1,0,1]=4 1768 B8R1.31 CN1CC[C@H]1C(=O)O MCULE-2682368839 [1,0,0,1,0,0|1,0,1]=4 1769 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-6870930523 [1,0,0,1,0,0|1,0,1]=4 1770 B8R1.31 C[C@@H]1CN[C@@H]1C(=O)O MCULE-9495962068 [1,0,0,1,0,0|1,0,1]=4 1771 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-4996743185 [1,0,0,1,0,0|1,0,1]=4 1772 B8R1.31 C[C@@H]1NC[C@H]1C(=O)O MCULE-5548697786 [1,0,0,1,0,0|1,0,1]=4 1773 B8R1.31 NC1CCC1C(=O)O MCULE-1271890671 [1,0,0,1,0,0|1,0,1]=4 1774 B8R1.31 NC1CCC1C(=O)O MCULE-6203451123 [1,0,0,1,0,0|1,0,1]=4 1775 B8R1.31 N[C@@H]1CC[C@@H]1C(=O)O MCULE-7309195085 [1,0,0,1,0,0|1,0,1]=4 1776 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-1231832702 [1,0,0,1,0,0|1,0,1]=4 1777 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-4120413857 [1,0,0,1,0,0|1,0,1]=4 1778 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-7581321099 [1,0,0,1,0,0|1,0,1]=4 1779 B8R1.31 N[C@@H]1CC[C@H]1C(=O)O MCULE-8814127531 [1,0,0,1,0,0|1,0,1]=4 1780 B8R1.31 N[C@H]1CC[C@@H]1C(=O)O MCULE-1877122488 [1,0,0,1,0,0|1,0,1]=4 1781 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-2323153571 [1,0,0,1,0,0|1,0,1]=4 1782 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3627026930 [1,0,0,1,0,0|1,0,1]=4 1783 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-3814908416 [1,0,0,1,0,0|1,0,1]=4 1784 B8R1.31 N[C@H]1CC[C@H]1C(=O)O MCULE-8552378194 [1,0,0,1,0,0|1,0,1]=4 1785 B8R1.31 O=C(O)C1CCC1F MCULE-6928594613 [1,0,0,1,0,0|1,0,1]=4 1786 B8R1.31 O=C(O)C1CCC1O MCULE-5612797663 [1,0,0,1,0,0|1,0,1]=4 1787 B8R1.31 O=C(O)[C@@H]1CC[C@H]1O MCULE-4502275905 [1,0,0,1,0,0|1,0,1]=4 1788 B8R1.31 O=C(O)[C@H]1CC[C@@H]1O MCULE-1446557503 [1,0,0,1,0,0|1,0,1]=4 1789 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-3693378535 [1,0,0,1,0,0|1,0,1]=4 1790 B8R1.31 [C@@H]1(CC[C@@H]1C(=O)O)N MCULE-4998471402 [1,0,0,1,0,0|1,0,1]=4 1791 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-1179436878 [1,0,0,1,0,0|1,0,1]=4 1792 B8R1.31 [C@@H]1(CC[C@H]1C(=O)O)N MCULE-6666180327 [1,0,0,1,0,0|1,0,1]=4 1793 B8R1.31 [C@@H]1(NC[C@H]1C)C(=O)O MCULE-4107819391 [1,0,0,1,0,0|1,0,1]=4 1794 B8R1.34 CC(=O)C=C1CCC1 MCULE-5198652682 [1,0,0,1,0,0|1,0,1]=4 1795 B8R1.34 CC(=O)CC1CCC1 MCULE-8119711389 [1,0,0,1,0,0|1,0,1]=4 1796 B8R1.34 NC(=O)NC1CCC1 MCULE-4153424610 [1,0,0,1,0,0|2,0,0]=4 1797 B8R1.34 O=C(Cl)CC1CCC1 MCULE-4282346796 [1,0,0,1,0,0|1,0,1]=4 1798 B8R1.34 O=C(O)C=C1CCC1 MCULE-7015909117 [1,0,0,1,0,0|0,0,1]=3 1799 B8R1.34 O=C(O)CC1CCC1 MCULE-3720911045 [1,0,0,1,0,0|0,0,1]=3 1800 B8R1.34 O=C(O)CC1CCN1 MCULE-4161960358 [1,0,0,1,0,0|1,0,1]=4 1801 B8R1.34 O=C(O)CC1CCO1 MCULE-7021545652 [1,0,0,1,0,0|1,0,1]=4 1802 B8R1.34 O=C(O)CC1CNC1 MCULE-4671495498 [1,0,0,1,0,0|1,0,1]=4 1803 B8R1.34 O=C(O)CC1CNC1 MCULE-5456583939 [1,0,0,1,0,0|1,0,1]=4 1804 B8R1.34 O=C(O)CC1CNC1 MCULE-9655427403 [1,0,0,1,0,0|1,0,1]=4 1805 B8R1.34 O=C(O)CC1COC1 MCULE-1090518485 [1,0,0,1,0,0|1,0,1]=4 1806 B8R1.34 O=C(O)CC1CSC1 MCULE-1573505481 [1,0,0,1,0,0|1,0,1]=4 1807 B8R1.34 O=C(O)CN1CCC1 MCULE-2649525817 [1,0,0,1,0,0|1,0,1]=4 1808 B8R1.34 O=C(O)CN1CCC1 MCULE-6889274435 [1,0,0,1,0,0|1,0,1]=4 1809 B8R1.42 CC(=O)CC1(CC1)C MCULE-3117561505 [1,0,0,1,0,0|1,0,1]=4 1810 B8R1.42 CC(=O)OC1(CC1)C MCULE-8484243192 [1,0,0,1,0,0|2,0,0]=4 1811 B8R1.42 CC1(CC1)CC(=O)O MCULE-1590977154 [1,0,0,1,0,0|0,0,1]=3 1812 B8R1.42 CC1(CC1)NC(=O)N MCULE-2689884910 [1,0,0,1,0,0|2,0,0]=4 1813 B8R1.42 NC1(CC1)CC(=O)O MCULE-3593224967 [1,0,0,1,0,0|1,0,1]=4 1814 B8R1.42 NC1(CC1)CC(=O)O MCULE-8049209917 [1,0,0,1,0,0|1,0,1]=4 1815 B8R1.42 O=C(O)CC1(CC1)O MCULE-1745399123 [1,0,0,1,0,0|1,0,1]=4 1816 B8R1.43 CCC1CC1C(=O)O MCULE-2993174891 [1,0,0,1,0,0|0,0,1]=3 1817 B8R1.43 CC[C@@H]1C[C@H]1C(=O)O MCULE-8944777861 [1,0,0,1,0,0|0,0,1]=3 1818 B8R1.43 COC1CC1C(=O)O MCULE-8490015991 [1,0,0,1,0,0|1,0,1]=4 1819 B8R1.43 NCC1CC1C(=O)O MCULE-8216751454 [1,0,0,1,0,0|1,0,1]=4 1820 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-3415372050 [1,0,0,1,0,0|1,0,1]=4 1821 B8R1.43 NC[C@@H]1C[C@H]1C(=O)O MCULE-6765918556 [1,0,0,1,0,0|1,0,1]=4 1822 B8R1.43 O=C(O)C1CC1CCl MCULE-8596410287 [1,0,0,1,0,0|1,0,1]=4 1823 B8R1.43 O=C(O)C1CC1CF MCULE-8263605468 [1,0,0,1,0,0|1,0,1]=4 1824 B8R1.43 O=C(O)C1CC1CO MCULE-5433690867 [1,0,0,1,0,0|1,0,1]=4 1825 B8R1.43 O=C(O)[C@@H]1C[C@H]1CCl MCULE-7560724994 [1,0,0,1,0,0|1,0,1]=4 1826 B8R1.43 O=C(O)[C@@H]1C[C@H]1CO MCULE-9657133495 [1,0,0,1,0,0|1,0,1]=4 1827 B8R1.43 O=C(O)[C@H]1C[C@@H]1CO MCULE-1395497386 [1,0,0,1,0,0|1,0,1]=4 1828 B8R1.67 C[C@H]1[C@H]([C@@H]1C(=O)O)C MCULE-2637094670 [1,0,0,1,0,0|0,0,1]=3 1829 B8R1.5 C=C1CCCNC1=O MCULE-1867993758 [1,0,0,1,0,0|2,0,0]=4 1830 B8R1.5 CC1=CCCCC1=O MCULE-6245248136 [1,0,0,1,0,0|2,0,0]=4 1831 B8R1.5 CC1CCCOC1=O MCULE-5926029136 [1,0,0,1,0,0|1,0,1]=4 1832 B8R1.5 NN1CCCOC1=O MCULE-6942418314 [1,0,0,1,0,0|2,0,0]=4 1833 B8R1.5 O=C1CCCC=C1Br MCULE-3661382076 [1,0,0,1,0,0|2,0,0]=4 1834 B8R1.5 O=C1CCCC=C1I MCULE-5006563152 [1,0,0,1,0,0|2,0,0]=4 1835 B8R1.5 O=C1CCCCC1=O MCULE-5770827130 [1,0,0,1,0,0|1,0,0]=3 1836 B8R1.5 O=C1CCCCC1O MCULE-7509366699 [1,0,0,1,0,0|1,0,1]=4 1837 B8R1.5 O=C1CCCNC1=O MCULE-3369124759 [1,0,0,1,0,0|1,0,0]=3 1838 B8R1.5 O=C1NCCNC1=O MCULE-5492631108 [1,0,0,1,0,0|2,0,0]=4 1839 B8R1.5 O=C1NCCOC1=O MCULE-5092732656 [1,0,0,1,0,0|1,0,0]=3 1840 B8R1.5 O=C1OCCC=C1Br MCULE-6619697801 [1,0,0,1,0,0|1,0,1]=4 1841 B8R1.5 O=C1OCCCC1Br MCULE-4407787541 [1,0,0,1,0,0|1,0,1]=4 1842 B8R1.5 O=C1OCCCC1O MCULE-3021418071 [1,0,0,1,0,0|0,0,2]=4 1843 B8R1.7 CC(=O)C1=CCCC1 MCULE-9623046872 [1,0,0,1,0,0|2,0,0]=4 1844 B8R1.7 O=C(O)C1=CCCC1 MCULE-2928571993 [1,0,0,1,0,0|1,0,0]=3 1845 B8R1.7 O=C(O)C1=CCCO1 MCULE-8380391200 [1,0,0,1,0,0|0,0,2]=4 1846 B8R1.7 O=C(O)C1=CCCS1 MCULE-9231409703 [1,0,0,1,0,0|0,1,1]=4 1847 B8R1.7 O=C(O)C1=CCNC1 MCULE-2391284266 [1,0,0,1,0,0|2,0,0]=4 1848 B8R1.7 O=C(O)C1=CCNC1 MCULE-5725335930 [1,0,0,1,0,0|2,0,0]=4 1849 B8R1.7 O=C(O)C1=CCOC1 MCULE-3209603870 [1,0,0,1,0,0|2,0,0]=4 1850 B8R1.7 O=C(O)C1=CCSC1 MCULE-3187835692 [1,0,0,1,0,0|2,0,0]=4 1851 B8R1.7 O=C(O)C1=COCC1 MCULE-7263072561 [1,0,0,1,0,0|2,0,0]=4 1852 B8R1.7 O=C(O)C1=NCCC1 MCULE-2664768755 [1,0,0,1,0,0|1,0,0]=3 1853 B8R1.7 O=C(O)C1=NOCC1 MCULE-3126584315 [1,0,0,1,0,0|2,0,0]=4 1854 B8R1.7 O=C(O)C1CCCC1 MCULE-6415159340 [1,0,0,1,0,0|1,0,1]=4 1855 B8R1.7 O=C(O)C1CCCN1 MCULE-2229401513 [1,0,0,1,0,0|1,0,1]=4 1856 B8R1.7 O=C(O)C1CCCN1 MCULE-6305507014 [1,0,0,1,0,0|1,0,1]=4 1857 B8R1.7 O=C(O)C1CCCN1 MCULE-8387491590 [1,0,0,1,0,0|1,0,1]=4 1858 B8R1.7 O=C(O)C1CCCN1 MCULE-8611160929 [1,0,0,1,0,0|1,0,1]=4 1859 B8R1.7 O=C(O)C1CCCO1 MCULE-1952289090 [1,0,0,1,0,0|0,0,2]=4 1860 B8R1.7 O=C(O)C1CCCO1 MCULE-5387481824 [1,0,0,1,0,0|0,0,2]=4 1861 B8R1.7 O=C(O)C1CCCS1 MCULE-7760686042 [1,0,0,1,0,0|0,1,1]=4 1862 B8R1.7 O=C(O)N1CCCC1 MCULE-7984061130 [1,0,0,1,0,0|2,0,0]=4 1863 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-1020921088 [1,0,0,1,0,0|1,0,1]=4 1864 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6398060480 [1,0,0,1,0,0|1,0,1]=4 1865 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-6772131264 [1,0,0,1,0,0|1,0,1]=4 1866 B8R1.7 O=C(O)[C@@H]1CCCN1 MCULE-8415049837 [1,0,0,1,0,0|1,0,1]=4 1867 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-5193388500 [1,0,0,1,0,0|0,0,2]=4 1868 B8R1.7 O=C(O)[C@@H]1CCCO1 MCULE-8181760406 [1,0,0,1,0,0|0,0,2]=4 1869 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-5856142508 [1,0,0,1,0,0|1,0,1]=4 1870 B8R1.7 O=C(O)[C@H]1CCCN1 MCULE-7748032436 [1,0,0,1,0,0|1,0,1]=4 1871 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-2258024439 [1,0,0,1,0,0|0,0,2]=4 1872 B8R1.7 O=C(O)[C@H]1CCCO1 MCULE-5143953192 [1,0,0,1,0,0|0,0,2]=4 1873 B8R1.23 CC1CC(C1)C(=O)O MCULE-2185016477 [1,0,0,1,0,0|1,0,1]=4 1874 B8R1.23 CC1CC(N1)C(=O)O MCULE-2803934033 [1,0,0,1,0,0|1,0,1]=4 1875 B8R1.23 C[C@@H]1C[C@H](N1)C(=O)O MCULE-6318758002 [1,0,0,1,0,0|1,0,1]=4 1876 B8R1.23 C[C@H]1C[C@@H](C1)C(=O)O MCULE-1777784731 [1,0,0,1,0,0|1,0,1]=4 1877 B8R1.23 C[C@H]1C[C@H](C1)C(=O)O MCULE-8951813405 [1,0,0,1,0,0|1,0,1]=4 1878 B8R1.23 C[C@H]1C[C@H](N1)C(=O)O MCULE-2969381793 [1,0,0,1,0,0|1,0,1]=4 1879 B8R1.30 CC1CC1(C)C(=O)O MCULE-8330983425 [1,0,0,1,0,0|1,0,1]=4 1880 B8R1.54 C(N)(C(=O)O)C1CC1 MCULE-4833544032 [1,0,0,1,0,0|1,0,1]=4 1881 B8R1.54 C=C(C(=O)O)C1CC1 MCULE-9531805422 [1,0,0,1,0,0|1,0,0]=3 1882 B8R1.54 CC(=C1CC1)C(=O)O MCULE-5864255450 [1,0,0,1,0,0|1,0,1]=4 1883 B8R1.54 CC(=O)C(=O)C1CC1 MCULE-6206613019 [1,0,0,1,0,0|1,0,0]=3 1884 B8R1.54 CC(C(=O)O)C1CC1 MCULE-9343385076 [1,0,0,1,0,0|1,0,1]=4 1885 B8R1.54 NC(C(=O)O)C1CC1 MCULE-1974514713 [1,0,0,1,0,0|1,0,1]=4 1886 B8R1.54 NC(C(=O)O)C1CC1 MCULE-3126466096 [1,0,0,1,0,0|1,0,1]=4 1887 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-5662004537 [1,0,0,1,0,0|1,0,1]=4 1888 B8R1.54 N[C@@H](C(=O)O)C1CC1 MCULE-9004548949 [1,0,0,1,0,0|1,0,1]=4 1889 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-4323013494 [1,0,0,1,0,0|1,0,1]=4 1890 B8R1.54 N[C@H](C(=O)O)C1CC1 MCULE-9475774396 [1,0,0,1,0,0|1,0,1]=4 1891 B8R1.54 O=C(O)C(=O)C1CC1 MCULE-2935818452 [1,0,0,1,0,0|0,0,0]=2 1892 B8R1.54 O=C(O)C(F)C1CC1 MCULE-4799246955 [1,0,0,1,0,0|1,0,1]=4 1893 B8R1.54 O=C(O)C(O)C1CC1 MCULE-9945035089 [1,0,0,1,0,0|0,0,2]=4 1894 B8R1.54 O=C(O)[C@@H](O)C1CC1 MCULE-2409990996 [1,0,0,1,0,0|0,0,2]=4 1895 B8R1.54 O=C(O)[C@H](O)C1CC1 MCULE-2255829314 [1,0,0,1,0,0|0,0,2]=4 1896 B8R1.54 O=C([O-])C(=O)C1CC1 MCULE-3173453359 [1,0,0,1,0,0|0,0,1]=3 1897 B8R1.78 CC1(CCC1)C(=O)O MCULE-8539228760 [1,0,0,1,0,0|1,0,1]=4 1898 B8R1.78 NC1(CCC1)C(=O)O MCULE-7741753062 [1,0,0,1,0,0|1,0,1]=4 1899 B8R1.78 NC1(CCC1)C(=O)O MCULE-8986168461 [1,0,0,1,0,0|1,0,1]=4 1900 B8R1.78 O=C(O)C1(CCC1)Br MCULE-2468093858 [1,0,0,1,0,0|1,0,1]=4 1901 B8R1.78 O=C(O)C1(CCC1)F MCULE-5784376163 [1,0,0,1,0,0|1,0,1]=4 1902 B8R1.78 O=C(O)C1(CCC1)O MCULE-3418659917 [1,0,0,1,0,0|0,0,2]=4 1903 B8R1.11 CCC1CCCC1=O MCULE-1884299455 [1,0,0,1,0,0|1,0,1]=4 1904 B8R1.11 CCC1CCNC1=O MCULE-8307536027 [1,0,0,1,0,0|2,0,0]=4 1905 B8R1.11 CCC1CCOC1=O MCULE-2375464273 [1,0,0,1,0,0|2,0,0]=4 1906 B8R1.11 CCC1COCC1=O MCULE-5486171882 [1,0,0,1,0,0|0,0,1]=3 1907 B8R1.11 COC1COCC1=O MCULE-2097991610 [1,0,0,1,0,0|1,0,1]=4 1908 B8R1.38 C#CC(=O)C1CCC1 MCULE-7044839324 [1,0,0,1,0,0|1,0,1]=4 1909 B8R1.38 C=CC(=O)N1CCC1 MCULE-5467836720 [1,0,0,1,0,0|2,0,0]=4 1910 B8R1.38 CC(C=O)C1CCC1 MCULE-5860376202 [1,0,0,1,0,0|1,0,1]=4 1911 B8R1.38 CCC(=O)C1CCC1 MCULE-2054282062 [1,0,0,1,0,0|1,0,1]=4 1912 B8R1.38 CNC(=O)C1CCC1 MCULE-7934051142 [1,0,0,1,0,0|2,0,0]=4 1913 B8R1.38 COC(=O)C1CCC1 MCULE-2900002276 [1,0,0,1,0,0|2,0,0]=4 1914 B8R1.38 N=C(NO)C1CCC1 MCULE-4445464088 [1,0,0,1,0,0|2,0,0]=4 1915 B8R1.38 NCC(=O)C1CCC1 MCULE-2102604629 [1,0,0,1,0,0|1,0,1]=4 1916 B8R1.38 NCC(=O)C1CCC1 MCULE-5571071703 [1,0,0,1,0,0|1,0,1]=4 1917 B8R1.38 NNC(=O)C1CCC1 MCULE-3104625459 [1,0,0,1,0,0|2,0,0]=4 1918 B8R1.38 O=C(CBr)C1CCC1 MCULE-7056136632 [1,0,0,1,0,0|1,0,1]=4 1919 B8R1.38 O=C(CCl)C1CCC1 MCULE-9286559827 [1,0,0,1,0,0|1,0,1]=4 1920 B8R1.38 O=C(NO)C1CCC1 MCULE-5722727330 [1,0,0,1,0,0|1,0,0]=3 1921 B8R1.39 CC1(CC1)C(=O)CBr MCULE-9435700009 [1,0,0,1,0,0|1,0,1]=4 1922 B8R1.39 CC1(CC1)C(=O)CCl MCULE-5713988608 [1,0,0,1,0,0|1,0,1]=4 1923 B8R1.39 CC1(CC1)C(=O)CN MCULE-2015892200 [1,0,0,1,0,0|1,0,1]=4 1924 B8R1.39 CC1(CC1)C(=O)NN MCULE-2792690923 [1,0,0,1,0,0|2,0,0]=4 1925 B8R1.39 COC(=O)C1(CC1)C MCULE-1688202939 [1,0,0,1,0,0|2,0,0]=4 1926 B8R1.50 CC1=C(C(=O)CC1)Br MCULE-4093496442 [1,0,0,1,0,0|1,0,1]=4 1927 B8R1.50 CC1=C(C(=O)CC1)C MCULE-6370073595 [1,0,0,1,0,0|1,0,1]=4 1928 B8R1.50 CC1=C(C(=O)CC1)O MCULE-2968247012 [1,0,0,1,0,0|0,0,2]=4 1929 B8R1.50 CC1=C(C(=O)CC1)O MCULE-9147894168 [1,0,0,1,0,0|0,0,2]=4 1930 B8R1.50 CC1CCC(=O)C1=O MCULE-7649396652 [1,0,0,1,0,0|0,0,0]=2 1931 B8R1.50 CC1CCC(=O)N1C MCULE-7405072604 [1,0,0,1,0,0|2,0,0]=4 1932 B8R1.50 CC1CCC(C1=O)C MCULE-1473375660 [1,0,0,1,0,0|1,0,1]=4 1933 B8R1.50 CC1CCN(C1=O)C MCULE-1499213360 [1,0,0,1,0,0|2,0,0]=4 1934 B8R1.50 CC1CNC(=O)C1C MCULE-7439537346 [1,0,0,1,0,0|2,0,0]=4 1935 B8R1.50 CC1OCC(=O)C1C MCULE-5834923125 [1,0,0,1,0,0|0,0,1]=3 1936 B8R1.50 CN1CCC(=O)C1=O MCULE-7541521172 [1,0,0,1,0,0|1,0,0]=3 1937 B8R1.50 CN1CCC(C1=O)O MCULE-6867263123 [1,0,0,1,0,0|1,0,1]=4 1938 B8R1.50 NC1CCN(C1=O)O MCULE-3774736319 [1,0,0,1,0,0|2,0,0]=4 1939 B8R1.50 N[C@@H]1CCN(C1=O)O MCULE-1260256164 [1,0,0,1,0,0|2,0,0]=4 1940 B8R1.50 N[C@@H]1CCN(C1=O)O MCULE-9067133595 [1,0,0,1,0,0|2,0,0]=4 1941 B8R1.50 N[C@H]1CCN(C1=O)O MCULE-1056806464 [1,0,0,1,0,0|2,0,0]=4 1942 B8R1.58 CCC1(CCC1=O)C MCULE-1365656204 [1,0,0,1,0,0|1,0,1]=4 1943 B8R1.77 CC1(CC1C(=O)O)C MCULE-1018303180 [1,0,0,1,0,0|1,0,1]=4 1944 B8R1.77 CC1(C[C@@H]1C(=O)O)C MCULE-8058233700 [1,0,0,1,0,0|1,0,1]=4 1945 B8R1.77 CC1(C[C@@H]1C(=O)O)C MCULE-8306311088 [1,0,0,1,0,0|1,0,1]=4 1946 B8R1.77 CC1(C[C@H]1C(=O)O)C MCULE-1908265175 [1,0,0,1,0,0|1,0,1]=4 1947 B8R1.77 CC1(OC1C(=O)O)C MCULE-6178976856 [1,0,0,1,0,0|0,0,2]=4 1948 B10R1.14 CCC(C)C1=NOC(=C1)N MCULE-5214187757 [0,0,0,1,0,1|2,0,0]=4 1949 B10R1.14 CCC(N)C1=NOC(=O)N1 MCULE-3413073501 [0,0,0,1,0,1|2,0,0]=4 1950 B10R1.25 CCC1CNC(=O)CC1=O MCULE-1470997152 [0,0,0,1,0,1|1,0,0]=3 1951 B10R1.25 CCN1CCC(=O)CC1=O MCULE-6760700486 [0,0,0,1,0,1|2,0,0]=4 1952 B10R1.25 CCN1CCC(=O)NC1=O MCULE-4286048959 [0,0,0,1,0,1|2,0,0]=4 1953 B10R1.25 CNC1CCC(=O)NC1=O MCULE-2479123541 [0,0,0,1,0,1|2,0,0]=4 1954 B10R1.25 CNC1CCC(=O)NC1=O MCULE-9198191101 [0,0,0,1,0,1|2,0,0]=4 1955 B10R1.64 CC1CCCC1CC(=O)O MCULE-1034129697 [0,0,0,1,0,1|1,0,1]=4 1956 B10R1.64 CC1CCCN1CC(=O)O MCULE-5477147476 [0,0,0,1,0,1|2,0,0]=4 1957 B10R1.64 CC1CCCN1CC(=O)O MCULE-7787437864 [0,0,0,1,0,1|2,0,0]=4 1958 B10R1.194 CC(=O)C1CCN(C1=O)C MCULE-9271914398 [0,0,0,1,0,1|2,0,0]=4 1959 B10R1.194 CC1CCC(N1C)C(=O)O MCULE-1631473352 [0,0,0,1,0,1|2,0,0]=4 1960 B10R1.194 CN1CCC(C1=O)C(=O)O MCULE-9291039298 [0,0,0,1,0,1|1,0,0]=3 1961 B10R1.194 CN1CCN(C1=O)C(=O)Cl MCULE-9515872586 [0,0,0,1,0,1|2,0,0]=4 1962 B10R1.194 C[C@@H]1CC[C@H](N1C)C(=O)O MCULE-5064787674 [0,0,0,1,0,1|2,0,0]=4 1963 B10R1.194 C[C@@H]1CC[C@H](N1C)C(=O)O MCULE-5375480697 [0,0,0,1,0,1|2,0,0]=4 1964 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-2143702379 [0,0,0,1,0,1|2,0,0]=4 1965 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-3730566868 [0,0,0,1,0,1|2,0,0]=4 1966 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-7974927719 [0,0,0,1,0,1|2,0,0]=4 1967 B10R1.194 C[C@H]1CC[C@H](N1C)C(=O)O MCULE-9806319171 [0,0,0,1,0,1|2,0,0]=4 1968 B10R1.266 CC(=O)CC(=O)C1CCC1 MCULE-1261794615 [0,0,0,1,0,1|1,0,0]=3 1969 B10R1.266 CC(CC(=O)O)C1CCC1 MCULE-6722364184 [0,0,0,1,0,1|1,0,1]=4 1970 B10R1.266 CN(CC(=O)O)C1CCC1 MCULE-1496285495 [0,0,0,1,0,1|2,0,0]=4 1971 B10R1.266 NC(CC(=O)O)C1CCC1 MCULE-2395479190 [0,0,0,1,0,1|1,0,1]=4 1972 B10R1.266 NC(CC(=O)O)C1CCC1 MCULE-6970002304 [0,0,0,1,0,1|1,0,1]=4 1973 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-5065468951 [0,0,0,1,0,1|1,0,1]=4 1974 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-5782293460 [0,0,0,1,0,1|1,0,1]=4 1975 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-7296271886 [0,0,0,1,0,1|1,0,1]=4 1976 B10R1.266 N[C@@H](CC(=O)O)C1CCC1 MCULE-8027827308 [0,0,0,1,0,1|1,0,1]=4 1977 B10R1.475 C=C1OC(=O)OC1(C)CC MCULE-7115635798 [0,0,0,1,0,1|1,0,0]=3 1978 B10R1.475 CC1(NC(=O)NC1=O)CCl MCULE-4574202093 [0,0,0,1,0,1|2,0,0]=4 1979 B10R1.475 CC1(NC(=O)NC1=O)CN MCULE-6192115785 [0,0,0,1,0,1|2,0,0]=4 1980 B10R1.475 CC1(NC(=O)NC1=O)CN MCULE-6939222331 [0,0,0,1,0,1|2,0,0]=4 1981 B10R1.475 CCC1(CC(=O)NC1=O)C MCULE-4034034545 [0,0,0,1,0,1|1,0,0]=3 1982 B10R1.475 CCC1(CC(=O)OC1=O)C MCULE-4178533393 [0,0,0,1,0,1|1,0,0]=3 1983 B10R1.475 CCC1(NC(=O)NC1=O)C MCULE-2733724550 [0,0,0,1,0,1|1,0,0]=3 1984 B10R1.475 CCC1(NC(=S)NC1=O)C MCULE-1780869646 [0,0,0,1,0,1|1,1,0]=4 1985 B10R1.475 CCC1(OC(=O)NC1=O)C MCULE-1221658185 [0,0,0,1,0,1|0,0,0]=2 1986 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9089135115 [0,0,0,1,0,1|1,0,1]=4 1987 B10R1.31 CCC1CCC(N1)C(=O)O MCULE-9951781675 [0,0,0,1,0,1|1,0,1]=4 1988 B10R1.31 O=C(O)C1=NCC(S1)CI MCULE-3959061514 [0,0,0,1,0,1|2,0,0]=4 1989 B10R1.113 CC1CCCC(C1)C(=O)O MCULE-1709216331 [0,0,0,1,0,1|1,0,1]=4 1990 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-2752928027 [0,0,0,1,0,1|1,0,1]=4 1991 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7361502591 [0,0,0,1,0,1|1,0,1]=4 1992 B10R1.113 CC1CCCC(N1)C(=O)O MCULE-7906995060 [0,0,0,1,0,1|1,0,1]=4 1993 B10R1.113 CC1CCCC(O1)C(=O)O MCULE-2545962496 [0,0,0,1,0,1|1,0,1]=4 1994 B10R1.113 CC1CCNC(C1)C(=O)O MCULE-7170086856 [0,0,0,1,0,1|1,0,1]=4 1995 B10R1.113 CN1CCC=C(C1)C(=O)O MCULE-5778457701 [0,0,0,1,0,1|2,0,0]=4 1996 B10R1.113 C[C@@H]1CCC[C@@H](C1)C(=O)O MCULE-4534640450 [0,0,0,1,0,1|1,0,1]=4 1997 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6827473516 [0,0,0,1,0,1|1,0,1]=4 1998 B10R1.113 C[C@@H]1CCC[C@@H](N1)C(=O)O MCULE-6916060172 [0,0,0,1,0,1|1,0,1]=4 1999 B10R1.113 C[C@@H]1CCC[C@H](C1)C(=O)O MCULE-2658835025 [0,0,0,1,0,1|1,0,1]=4 2000 B10R1.113 C[C@@H]1CCN[C@@H](C1)C(=O)O MCULE-6382189211 [0,0,0,1,0,1|1,0,1]=4 2001 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-3220705725 [0,0,0,1,0,1|1,0,1]=4 2002 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-4368703620 [0,0,0,1,0,1|1,0,1]=4 2003 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-5852226290 [0,0,0,1,0,1|1,0,1]=4 2004 B10R1.113 C[C@@H]1CCN[C@H](C1)C(=O)O MCULE-8448888283 [0,0,0,1,0,1|1,0,1]=4 2005 B10R1.113 C[C@H]1CCC[C@@H](C1)C(=O)O MCULE-2151963828 [0,0,0,1,0,1|1,0,1]=4 2006 B10R1.113 C[C@H]1CCC[C@H](C1)C(=O)O MCULE-9191189376 [0,0,0,1,0,1|1,0,1]=4 2007 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3797871093 [0,0,0,1,0,1|1,0,1]=4 2008 B10R1.113 C[C@H]1CCN[C@@H](C1)C(=O)O MCULE-3813657182 [0,0,0,1,0,1|1,0,1]=4 2009 B10R1.113 C[C@H]1CCN[C@H](C1)C(=O)O MCULE-8048617173 [0,0,0,1,0,1|1,0,1]=4 2010 B10R1.113 C[NH+]1CCC=C(C1)C(=O)O MCULE-8096594321 [0,0,0,1,0,1|2,0,0]=4 2011 B10R1.113 O=C(O)C1=CC(CCC1)O MCULE-3053514968 [0,0,0,1,0,1|2,0,0]=4 2012 B10R1.113 [C@@H]1(CCCC(N1)C)C(=O)O MCULE-7930307305 [0,0,0,1,0,1|1,0,1]=4 2013 B10R1.176 NCC1CNC(=O)C(=O)N1 MCULE-8867930601 [0,0,0,1,0,1|2,0,0]=4 2014 B10R1.190 C=C1CC1CC(=O)C(=O)O MCULE-1169611562 [0,0,0,1,0,1|0,0,2]=4 2015 B10R1.204 CC(CC1CCC1)C(=O)O MCULE-9404107634 [0,0,0,1,0,1|1,0,1]=4 2016 B10R1.204 C[C@H](NC1CCC1)C(=O)O MCULE-7409631566 [0,0,0,1,0,1|1,0,1]=4 2017 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-3218968630 [0,0,0,1,0,1|1,0,1]=4 2018 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-4504908507 [0,0,0,1,0,1|1,0,1]=4 2019 B10R1.204 NC(CC1CCC1)C(=O)O MCULE-9377321223 [0,0,0,1,0,1|1,0,1]=4 2020 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-1216111783 [0,0,0,1,0,1|1,0,1]=4 2021 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-5390134859 [0,0,0,1,0,1|1,0,1]=4 2022 B10R1.204 N[C@@H](CC1CCC1)C(=O)O MCULE-5493935992 [0,0,0,1,0,1|1,0,1]=4 2023 B10R1.204 N[C@H](CC1CCC1)C(=O)O MCULE-3225528393 [0,0,0,1,0,1|1,0,1]=4 2024 B10R1.204 N[C@H](CC1CCC1)C(=O)O MCULE-7473428983 [0,0,0,1,0,1|1,0,1]=4 2025 B10R1.204 O=C(O)C(F)CC1CCC1 MCULE-4701098034 [0,0,0,1,0,1|1,0,1]=4 2026 B10R1.204 O=C(O)[C@H](O)CC1CCC1 MCULE-8975040339 [0,0,0,1,0,1|0,0,2]=4 2027 B10R1.470 CC1CCC(C1)(C)C(=O)O MCULE-3638409630 [0,0,0,1,0,1|1,0,1]=4 2028 B10R1.23 CC(=C1CCCC1)C(=O)O MCULE-3562031446 [0,1,0,1,0,0|1,0,1]=4 2029 B10R1.23 CC(C(=O)O)C1CCCC1 MCULE-5802736245 [0,1,0,1,0,0|1,0,1]=4 2030 B10R1.23 CC(C(=O)O)C1CCCO1 MCULE-7845267101 [0,1,0,1,0,0|1,0,1]=4 2031 B10R1.23 CC(C(=O)O)C1CCOC1 MCULE-7866218529 [0,1,0,1,0,0|1,0,1]=4 2032 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-7146175523 [0,1,0,1,0,0|1,0,1]=4 2033 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-7746486136 [0,1,0,1,0,0|1,0,1]=4 2034 B10R1.23 NC(C(=O)O)C1CCCC1 MCULE-9888348666 [0,1,0,1,0,0|1,0,1]=4 2035 B10R1.23 NC(C(=O)O)C1CCCO1 MCULE-3670924700 [0,1,0,1,0,0|1,0,1]=4 2036 B10R1.23 NC(C(=O)O)C1CCNC1 MCULE-1642984994 [0,1,0,1,0,0|1,0,1]=4 2037 B10R1.23 NC(C(=O)O)C1CCNC1 MCULE-8012924580 [0,1,0,1,0,0|1,0,1]=4 2038 B10R1.23 NC(C(=O)O)C1CCOC1 MCULE-9063647673 [0,1,0,1,0,0|1,0,1]=4 2039 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 MCULE-2078695461 [0,1,0,1,0,0|1,0,1]=4 2040 B10R1.23 N[C@@H](C(=O)O)C1CCCC1 MCULE-7548517913 [0,1,0,1,0,0|1,0,1]=4 2041 B10R1.23 N[C@H](C(=O)O)C1CCCC1 MCULE-1391706498 [0,1,0,1,0,0|1,0,1]=4 2042 B10R1.23 N[C@H](C(=O)O)C1CCCC1 MCULE-5447481000 [0,1,0,1,0,0|1,0,1]=4 2043 B10R1.23 O=C(O)C(=C1CCCC1)F MCULE-7724617873 [0,1,0,1,0,0|1,0,1]=4 2044 B10R1.23 O=C(O)C(=C1CCCC1)S MCULE-2991118664 [0,1,0,1,0,0|0,1,1]=4 2045 B10R1.23 O=C(O)C(=O)C1CCCC1 MCULE-3971745471 [0,1,0,1,0,0|0,0,0]=2 2046 B10R1.23 O=C(O)C(=O)C1CCOC1 MCULE-9419104810 [0,1,0,1,0,0|0,0,0]=2 2047 B10R1.23 O=C(O)C(=O)N1CCCC1 MCULE-9901176707 [0,1,0,1,0,0|1,0,0]=3 2048 B10R1.23 O=C(O)C(Br)C1CCCC1 MCULE-1051918450 [0,1,0,1,0,0|1,0,1]=4 2049 B10R1.23 O=C(O)C(F)C1CCCC1 MCULE-8637303916 [0,1,0,1,0,0|1,0,1]=4 2050 B10R1.23 O=C(O)C(F)C1CCOC1 MCULE-4380204267 [0,1,0,1,0,0|1,0,1]=4 2051 B10R1.23 O=C(O)C(O)C1CCCC1 MCULE-1471598195 [0,1,0,1,0,0|0,0,2]=4 2052 B10R1.23 O=C(O)C(O)C1CCNC1 MCULE-8304713060 [0,1,0,1,0,0|0,0,2]=4 2053 B10R1.23 O=C(O)[C@@H](Br)C1CCCC1 MCULE-6560406332 [0,1,0,1,0,0|1,0,1]=4 2054 B10R1.23 O=C(O)[C@H](O)C1CCCC1 MCULE-1883242923 [0,1,0,1,0,0|0,0,2]=4 2055 B10R1.23 O=C([O-])C(=O)C1CCCC1 MCULE-7060762433 [0,1,0,1,0,0|0,0,1]=3 2056 B10R1.34 CCC1OC(=C(C1=O)O)C MCULE-2986128683 [0,1,0,1,0,0|2,0,0]=4 2057 B10R1.34 CCC1OC(=O)C(=C1C)O MCULE-6771374122 [0,1,0,1,0,0|0,0,2]=4 2058 B10R1.59 CC1CC(C(O1)C(=O)O)C MCULE-6609295709 [0,1,0,1,0,0|0,0,2]=4 2059 B10R1.59 CC1CC(C(O1)C)C(=O)O MCULE-4495071251 [0,1,0,1,0,0|1,0,1]=4 2060 B10R1.61 CC1=C(CCCC1)C(=O)O MCULE-2899177590 [0,1,0,1,0,0|1,0,1]=4 2061 B10R1.61 CC1=C(CCCO1)C(=O)O MCULE-1778977864 [0,1,0,1,0,0|1,0,1]=4 2062 B10R1.61 CC1=C(OCCO1)C(=O)O MCULE-1214060885 [0,1,0,1,0,0|0,0,2]=4 2063 B10R1.61 CC1=C(SCCO1)C(=O)O MCULE-2576357484 [0,1,0,1,0,0|0,1,1]=4 2064 B10R1.61 CC1CCCC=C1C(=O)O MCULE-2002913109 [0,1,0,1,0,0|1,0,0]=3 2065 B10R1.61 CC1CCCCC1C(=O)O MCULE-3305682191 [0,1,0,1,0,0|1,0,1]=4 2066 B10R1.61 CC1CCNCC1C(=O)O MCULE-8748624987 [0,1,0,1,0,0|1,0,1]=4 2067 B10R1.61 CC1CCNCC1C(=O)O MCULE-9934986088 [0,1,0,1,0,0|1,0,1]=4 2068 B10R1.61 CC1CNCCC1C(=O)O MCULE-4662714630 [0,1,0,1,0,0|1,0,1]=4 2069 B10R1.61 CC1CNCCC1C(=O)O MCULE-7019458300 [0,1,0,1,0,0|1,0,1]=4 2070 B10R1.61 CC1COCCC1C(=O)O MCULE-3541844170 [0,1,0,1,0,0|1,0,1]=4 2071 B10R1.61 CC1NCCCC1C(=O)O MCULE-1657397096 [0,1,0,1,0,0|1,0,1]=4 2072 B10R1.61 CC1NCCCC1C(=O)O MCULE-3297923255 [0,1,0,1,0,0|1,0,1]=4 2073 B10R1.61 CC1OCCCC1C(=O)O MCULE-1412449239 [0,1,0,1,0,0|1,0,1]=4 2074 B10R1.61 CC1OCCNC1C(=O)O MCULE-7650728786 [0,1,0,1,0,0|1,0,1]=4 2075 B10R1.61 CC1OCCNC1C(=O)O MCULE-7980002158 [0,1,0,1,0,0|1,0,1]=4 2076 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-5453839569 [0,1,0,1,0,0|1,0,1]=4 2077 B10R1.61 C[C@@H]1NCCC[C@@H]1C(=O)O MCULE-8712948607 [0,1,0,1,0,0|1,0,1]=4 2078 B10R1.61 C[C@@H]1NCCC[C@H]1C(=O)O MCULE-4097586923 [0,1,0,1,0,0|1,0,1]=4 2079 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-5754974970 [0,1,0,1,0,0|1,0,1]=4 2080 B10R1.61 C[C@@H]1OCCN[C@@H]1C(=O)O MCULE-9389286375 [0,1,0,1,0,0|1,0,1]=4 2081 B10R1.61 C[C@H]1NCCC[C@@H]1C(=O)O MCULE-1705027594 [0,1,0,1,0,0|1,0,1]=4 2082 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8221283836 [0,1,0,1,0,0|1,0,1]=4 2083 B10R1.61 C[C@H]1NCCC[C@H]1C(=O)O MCULE-8542699735 [0,1,0,1,0,0|1,0,1]=4 2084 B10R1.61 C[C@H]1OCCC[C@H]1C(=O)O MCULE-9860065784 [0,1,0,1,0,0|1,0,1]=4 2085 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-1879170734 [0,1,0,1,0,0|1,0,1]=4 2086 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4061314927 [0,1,0,1,0,0|1,0,1]=4 2087 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4489336660 [0,1,0,1,0,0|1,0,1]=4 2088 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-4667134552 [0,1,0,1,0,0|1,0,1]=4 2089 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-5449945964 [0,1,0,1,0,0|1,0,1]=4 2090 B10R1.61 C[C@H]1OCCN[C@@H]1C(=O)O MCULE-7387257453 [0,1,0,1,0,0|1,0,1]=4 2091 B10R1.278 CC(=C(F)C(=O)O)C1CC1 MCULE-9075272286 [0,1,0,1,0,0|1,0,1]=4 2092 B10R1.278 CC(C1CC1)C(N)C(=O)O MCULE-4997364057 [0,1,0,1,0,0|1,0,1]=4 2093 B10R1.278 CC(C1CC1)C(N)C(=O)O MCULE-9996915560 [0,1,0,1,0,0|1,0,1]=4 2094 B10R1.291 CC1CCCC1(C)C(=O)O MCULE-3149463709 [0,1,0,1,0,0|1,0,1]=4 2095 B10R1.291 CC1OCCC1(C)C(=O)O MCULE-4774939870 [0,1,0,1,0,0|1,0,1]=4 2096 B10R1.495 CC(C(=O)O)C1(CCC1)O MCULE-2874864037 [0,1,0,1,0,0|1,0,1]=4 2097 B10R1.495 CC1(COC1)C(N)C(=O)O MCULE-3054998452 [0,1,0,1,0,0|1,0,1]=4 2098 B10R1.495 CC1(COC1)[C@H](N)C(=O)O MCULE-3689733091 [0,1,0,1,0,0|1,0,1]=4 2099 B10R1.495 O=C(O)C(O)C1(CCC1)O MCULE-5858632598 [0,1,0,1,0,0|0,0,2]=4 2100 B10R1.183 COC(=O)C(=O)C1(CC1)F MCULE-5487493421 [0,1,0,1,0,0|1,0,0]=3 2101 B10R1.183 CON(C)C(=O)C1(CC1)C MCULE-6877353544 [0,1,0,1,0,0|2,0,0]=4 2102 B10R1.2 CC1CCCC(=C1Cl)C=O MCULE-8965516932 [0,1,0,1,0,0|2,0,0]=4 2103 B10R1.2 CCN1CCNC(=O)C1=O MCULE-1343518980 [0,1,0,1,0,0|2,0,0]=4 2104 B10R1.119 CN1CCN(C(=O)C1=O)C MCULE-9741955103 [0,1,0,1,0,0|2,0,0]=4 2105 B10R1.149 COC(=O)C1NCCC1C MCULE-2145747628 [0,1,0,1,0,0|1,0,1]=4 2106 B10R1.149 COC(=O)[C@@H]1NCC[C@@H]1C MCULE-6327833377 [0,1,0,1,0,0|1,0,1]=4 2107 B10R1.149 COC(=O)[C@@H]1NCC[C@H]1C MCULE-8404202430 [0,1,0,1,0,0|1,0,1]=4 2108 B10R1.149 COC(=O)[C@H]1NCC[C@@H]1C MCULE-6874278829 [0,1,0,1,0,0|1,0,1]=4 2109 B10R1.149 COC(=O)[C@H]1NCC[C@H]1C MCULE-1156779891 [0,1,0,1,0,0|1,0,1]=4 2110 B10R1.159 CCC1CC1(N)C(=O)OC MCULE-7541504397 [0,1,0,1,0,0|1,0,1]=4 2111 B10R1.182 COC(=O)C(N)C1CCC1 MCULE-3063876554 [0,1,0,1,0,0|1,0,1]=4 2112 B10R1.182 COC(=O)C(N)C1CCC1 MCULE-3740715014 [0,1,0,1,0,0|1,0,1]=4 2113 B10R1.182 COC(=O)C(O)C1CCC1 MCULE-3016777020 [0,1,0,1,0,0|0,0,2]=4 2114 B10R1.182 COC(=O)[C@@H](N)C1CCC1 MCULE-2319437388 [0,1,0,1,0,0|1,0,1]=4 2115 B10R1.182 COC(=O)[C@@H](N)C1CCC1 MCULE-4764567509 [0,1,0,1,0,0|1,0,1]=4 2116 B10R1.182 COC(=O)[C@@H](N)C1CCC1 MCULE-8996478840 [0,1,0,1,0,0|1,0,1]=4 2117 B10R1.182 COC(=O)[C@@H](N)C1CCC1 MCULE-9749004524 [0,1,0,1,0,0|1,0,1]=4 2118 B10R1.182 COC(=O)[C@H](N)C1CCC1 MCULE-3771166263 [0,1,0,1,0,0|1,0,1]=4 2119 B10R1.182 COC(=O)[C@H](N)C1CCC1 MCULE-4986645692 [0,1,0,1,0,0|1,0,1]=4 2120 B10R1.182 COC(=O)[C@H](N)C1CCC1 MCULE-6414521728 [0,1,0,1,0,0|1,0,1]=4 2121 B10R1.182 COC(=O)[C@H](N)C1CCC1 MCULE-8525319101 [0,1,0,1,0,0|1,0,1]=4 2122 B10R1.182 CON(C)C(=O)C1CCC1 MCULE-5827006674 [0,1,0,1,0,0|2,0,0]=4 2123 B10R1.191 CC1=C(C(C(C1=O)C)C)C MCULE-9392152255 [0,1,0,1,0,0|2,0,0]=4 2124 B10R1.354 CC(C)(C(=O)O)C1CCC1 MCULE-2258535093 [0,1,0,1,0,0|1,0,1]=4 2125 B10R1.354 CC(N)(C(=O)O)C1CCC1 MCULE-4918102968 [0,1,0,1,0,0|1,0,1]=4 2126 B10R1.354 CC(N)(C(=O)O)C1CCC1 MCULE-6559227354 [0,1,0,1,0,0|1,0,1]=4 2127 B10R1.354 CC(O)(C(=O)O)C1CCC1 MCULE-4063351378 [0,1,0,1,0,0|0,0,2]=4 2128 B10R1.354 O=C(O)C(F)(F)C1CCC1 MCULE-6803588002 [0,1,0,1,0,0|1,0,1]=4 2129 B10R1.39 CCC1CCCC1C(=O)O MCULE-2134315765 [0,1,0,1,0,0|1,0,1]=4 2130 B10R1.39 CCC1CCNC1C(=O)O MCULE-1392850907 [0,1,0,1,0,0|1,0,1]=4 2131 B10R1.39 CCC1CCNC1C(=O)O MCULE-2618729884 [0,1,0,1,0,0|1,0,1]=4 2132 B10R1.39 CCC1NCCC1C(=O)O MCULE-6308897662 [0,1,0,1,0,0|1,0,1]=4 2133 B10R1.39 CCC1NCCC1C(=O)O MCULE-6989316364 [0,1,0,1,0,0|1,0,1]=4 2134 B10R1.39 CCC1OCCC1C(=O)O MCULE-3029813377 [0,1,0,1,0,0|1,0,1]=4 2135 B10R1.39 CC[C@@H]1CNC[C@@H]1C(=O)O MCULE-8464460557 [0,1,0,1,0,0|1,0,1]=4 2136 B10R1.39 CC[C@H]1CNC[C@H]1C(=O)O MCULE-2742804200 [0,1,0,1,0,0|1,0,1]=4 2137 B10R1.39 COC1CCCC1C(=O)O MCULE-6165424004 [0,1,0,1,0,0|1,0,1]=4 2138 B10R1.39 CSC1CCCC1C(=O)O MCULE-7830513386 [0,1,0,1,0,0|1,0,1]=4 2139 B10R1.39 NCC1CCCC1C(=O)O MCULE-5775773821 [0,1,0,1,0,0|1,0,1]=4 2140 B10R1.39 NCC1CCCC1C(=O)O MCULE-6872336527 [0,1,0,1,0,0|1,0,1]=4 2141 B10R1.165 CCC1CN(C1C(=O)O)C MCULE-5939427175 [0,1,0,1,0,0|1,0,1]=4 2142 B10R1.165 CCC1CN([C@@H]1C(=O)O)C MCULE-3015108374 [0,1,0,1,0,0|1,0,1]=4 2143 B10R1.165 CCC1CN([C@@H]1C(=O)O)C MCULE-3864383046 [0,1,0,1,0,0|1,0,1]=4 2144 B10R1.192 CC1COC(=O)C1C(=O)O MCULE-6047208777 [0,1,0,1,0,0|1,0,1]=4 2145 B10R1.219 CNC(C(=O)O)C1CCC1 MCULE-1036621151 [0,1,0,1,0,0|1,0,1]=4 2146 B10R1.219 CNC(C(=O)O)C1CCC1 MCULE-2626477980 [0,1,0,1,0,0|1,0,1]=4 2147 B10R1.219 COC(C(=O)O)C1CCC1 MCULE-4130966763 [0,1,0,1,0,0|0,0,2]=4 2148 B10R1.219 NCC(C(=O)O)C1CCC1 MCULE-2140507835 [0,1,0,1,0,0|1,0,1]=4 2149 B10R1.219 NCC(C(=O)O)C1CCC1 MCULE-4447331997 [0,1,0,1,0,0|1,0,1]=4 2150 B10R1.257 CCC1=C(C(=O)OC1)CO MCULE-3164100904 [0,1,0,1,0,0|0,0,2]=4 2151 B10R1.128 CC1(CCC=C1C(=O)O)C MCULE-6540475820 [0,1,0,1,0,0|1,0,0]=3 2152 B10R1.128 CC1(CCCC1C(=O)O)C MCULE-4580682391 [0,1,0,1,0,0|1,0,1]=4 2153 B10R1.128 CC1(CCCC1C(=O)O)N MCULE-6959799055 [0,1,0,1,0,0|1,0,1]=4 2154 B10R1.128 CC1(CCCC1C(=O)O)N MCULE-7529713765 [0,1,0,1,0,0|1,0,1]=4 2155 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-4368125699 [0,1,0,1,0,0|1,0,1]=4 2156 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-9548940162 [0,1,0,1,0,0|1,0,1]=4 2157 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9288829524 [0,1,0,1,0,0|1,0,1]=4 2158 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9565122593 [0,1,0,1,0,0|1,0,1]=4 2159 B10R1.128 C[C@]1(CCC[C@@H]1C(=O)O)N MCULE-2638855066 [0,1,0,1,0,0|1,0,1]=4 2160 B10R1.128 C[C@]1(CCC[C@@H]1C(=O)O)N MCULE-7472901526 [0,1,0,1,0,0|1,0,1]=4 2161 B10R1.483 CCC1(CC1C(=O)O)CC MCULE-2319800478 [0,1,0,1,0,0|1,0,1]=4 2162 B10R1.360 CC(C)C1(CC1C(=O)O)C MCULE-7783755862 [0,1,0,1,0,0|1,0,1]=4 2163 B10R2.25 C=C1C(=O)C2CCC1C2 MCULE-6446104918 [0,0,0,2,0,0|2,0,0]=4 2164 B10R2.25 [C@H]12CC[C@H](C1)C(=C)C2=O MCULE-3111478302 [0,0,0,2,0,0|2,0,0]=4 2165 B10R2.25 [C@H]12CC[C@H](C1)C(=C)C2=O MCULE-7597877958 [0,0,0,2,0,0|2,0,0]=4 2166 B10R2.32 O=C1OCC2C1CCC2 MCULE-1680539728 [0,0,0,2,0,0|1,0,1]=4 2167 B10R2.32 [C@H]12CCC[C@H]1C(=O)OC2 MCULE-7791113994 [0,0,0,2,0,0|1,0,1]=4 2168 B10R2.344 O=C(O)C12CC1CCN2 MCULE-8958769379 [0,0,0,2,0,0|1,0,1]=4 2169 B10R2.344 O=C(O)C12CC1CCN2 MCULE-9918894627 [0,0,0,2,0,0|1,0,1]=4 2170 B10R2.344 O=C(O)C12CCCC1C2 MCULE-1433395114 [0,0,0,2,0,0|1,0,1]=4 2171 B10R2.344 O=C(O)[C@@]12CC1CCN2 MCULE-8361805191 [0,0,0,2,0,0|1,0,1]=4 2172 B10R2.344 O=C(O)[C@@]12CC1CCN2 MCULE-9298532680 [0,0,0,2,0,0|1,0,1]=4 2173 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-8087821545 [0,0,0,2,0,0|1,0,1]=4 2174 B10R2.355 O=C(O)C1NCC2C1C2 MCULE-9943749675 [0,0,0,2,0,0|1,0,1]=4 2175 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-3741942930 [0,0,0,2,0,0|1,0,1]=4 2176 B10R2.355 O=C(O)C1NC[C@@H]2[C@H]1C2 MCULE-8099098772 [0,0,0,2,0,0|1,0,1]=4 2177 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-6549710478 [0,0,0,2,0,0|1,0,1]=4 2178 B10R2.355 O=C(O)[C@@H]1NC[C@@H]2[C@H]1C2 MCULE-7349536483 [0,0,0,2,0,0|1,0,1]=4 2179 B10R2.355 O=C(O)[C@H]1NC[C@@H]2[C@H]1C2 MCULE-1865131686 [0,0,0,2,0,0|1,0,1]=4 2180 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-3923610209 [0,0,0,2,0,0|1,0,1]=4 2181 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-6551780838 [0,0,0,2,0,0|1,0,1]=4 2182 B10R2.355 O=C(O)[C@H]1NC[C@H]2[C@@H]1C2 MCULE-9694754423 [0,0,0,2,0,0|1,0,1]=4 2183 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-4493728887 [0,0,0,2,0,0|1,0,1]=4 2184 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8766409370 [0,0,0,2,0,0|1,0,1]=4 2185 B10R2.355 [C@@H]12CN[C@@H]([C@@H]1C2)C(=O)O MCULE-8840539566 [0,0,0,2,0,0|1,0,1]=4 2186 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-1970630066 [0,0,0,2,0,0|1,0,1]=4 2187 B10R2.355 [C@@H]12CN[C@H]([C@@H]1C2)C(=O)O MCULE-7946950016 [0,0,0,2,0,0|1,0,1]=4 2188 B10R2.355 [C@H]12C[C@H]1CN[C@@H]2C(=O)O MCULE-9408302039 [0,0,0,2,0,0|1,0,1]=4 2189 B10R2.355 [C@H]12C[C@H]1CN[C@H]2C(=O)O MCULE-4802776373 [0,0,0,2,0,0|1,0,1]=4 2190 B10R2.358 O=C(O)C1CCC12CC2 MCULE-5575310904 [0,0,0,2,0,0|1,0,1]=4 2191 B10R2.638 O=C(O)C1CC12CCC2 MCULE-5122422025 [0,0,0,2,0,0|1,0,1]=4 2192 B10R2.638 O=C(O)[C@H]1CC12CCC2 MCULE-6436884704 [0,0,0,2,0,0|1,0,1]=4 2193 B8R0.9 CC=C(C)C=CC(=O)O MCULE-4818681786 [1,0,0,0,0,1|0,0,2]=4 2194 B8R0.9 CCC(=CCC(=O)O)C MCULE-3358969895 [1,0,0,0,0,1|0,0,1]=3 2195 B8R0.9 CCC(=O)C=CC(=O)O MCULE-2770953486 [1,0,0,0,0,1|1,0,1]=4 2196 B8R0.9 CCC(C)CCC(=O)C MCULE-6498666006 [1,0,0,0,0,1|1,0,1]=4 2197 B8R0.9 CCC(C)CCC(=O)O MCULE-9270270979 [1,0,0,0,0,1|0,0,1]=3 2198 B8R0.9 CCC(C)COC(=O)C MCULE-1846190306 [1,0,0,0,0,1|1,0,1]=4 2199 B8R0.9 CCC(C)COC(=O)Cl MCULE-7986633908 [1,0,0,0,0,1|1,0,1]=4 2200 B8R0.9 CCC(C)NCC(=O)O MCULE-1578825700 [1,0,0,0,0,1|0,0,1]=3 2201 B8R0.9 CCC(C)NCC(=O)O MCULE-8981987872 [1,0,0,0,0,1|0,0,1]=3 2202 B8R0.9 CCC(C)OCC(=O)O MCULE-8235265405 [1,0,0,0,0,1|0,0,1]=3 2203 B8R0.9 CCC(N)CCC(=O)O MCULE-3116763773 [1,0,0,0,0,1|1,0,1]=4 2204 B8R0.9 CCC(N)CCC(=O)O MCULE-9126260921 [1,0,0,0,0,1|1,0,1]=4 2205 B8R0.9 CCC(O)CCC(=O)O MCULE-1512608136 [1,0,0,0,0,1|1,0,1]=4 2206 B8R0.9 CCN(C)CCC(=O)O MCULE-2510720087 [1,0,0,0,0,1|1,0,1]=4 2207 B8R0.9 CCN(C)CCC(=O)O MCULE-4192684079 [1,0,0,0,0,1|1,0,1]=4 2208 B8R0.9 CC[C@H](N)C=CC(=O)O MCULE-8933495159 [1,0,0,0,0,1|1,0,0]=3 2209 B8R0.9 COC(C)CCC(=O)O MCULE-5873043454 [1,0,0,0,0,1|1,0,1]=4 2210 B8R0.9 CSC(C)CCC(=O)O MCULE-3505570511 [1,0,0,0,0,1|1,0,1]=4 2211 B10R0.44 CCC(C)CC(=CC(=O)O)C MCULE-1620434072 [0,0,0,0,0,2|1,0,0]=3 2212 B10R0.44 CCC(C)OC(=O)CC(=O)C MCULE-2735347318 [0,0,0,0,0,2|1,0,0]=3 2213 B10R0.57 CC(CS)C(=O)NCC(=O)O MCULE-4747840264 [0,0,0,0,0,2|1,0,0]=3 2214 B10R0.57 CC=C(C)C(=O)NCC(=O)O MCULE-8496586597 [0,0,0,0,0,2|0,0,2]=4 2215 B10R0.57 CCC(C)C(=O)NCC(=O)O MCULE-9921017610 [0,0,0,0,0,2|0,0,0]=2 2216 B10R0.57 CC[C@@H](C)[C@H](N)CCC(=O)O MCULE-6163799872 [0,0,0,0,0,2|1,0,1]=4 2217 B10R0.57 CC[C@@H](C)[C@H](N)CCC(=O)O MCULE-8974084013 [0,0,0,0,0,2|1,0,1]=4 2218 B10R0.57 CC[C@H](N)C(=O)NCC(=O)O MCULE-4271533887 [0,0,0,0,0,2|1,0,0]=3 2219 B10R0.57 CC[C@H](N)C(=O)NCC(=O)O MCULE-5443625025 [0,0,0,0,0,2|1,0,0]=3 2220 B10R0.57 NC(CO)C(=O)NCC(=O)O MCULE-5910324391 [0,0,0,0,0,2|2,0,0]=4 2221 B10R0.57 NC(CS)C(=O)NCC(=O)O MCULE-5948849786 [0,0,0,0,0,2|2,0,0]=4 2222 B10R0.57 N[C@@H](CO)C(=O)NCC(=O)O MCULE-7361409108 [0,0,0,0,0,2|2,0,0]=4 2223 B10R0.57 N[C@@H](CO)C(=O)NCC(=O)O MCULE-8884104065 [0,0,0,0,0,2|2,0,0]=4 2224 B10R0.57 N[C@@H](CS)C(=O)NCC(=O)O MCULE-1642629130 [0,0,0,0,0,2|2,0,0]=4 2225 B10R0.57 N[C@@H](CS)C(=O)NCC(=O)O MCULE-2192958037 [0,0,0,0,0,2|2,0,0]=4 2226 B10R0.57 N[C@@H](CS)C(=O)NCC(=O)O MCULE-6747357474 [0,0,0,0,0,2|2,0,0]=4 2227 B10R0.57 N[C@@H](CS)C(=O)NCC(=O)O MCULE-6862327950 [0,0,0,0,0,2|2,0,0]=4