0 B9R0.32 C=CC(C)(C)C(N)C(=O)O MCULE-2556027740 [0,0,0,0,0,0|2,0,2]=4 1 B9R0.32 CC(C)(CN)C(O)C(=O)O MCULE-1251426662 [0,0,0,0,0,0|1,0,2]=3 2 B9R0.32 CC(C)(CO)C(=O)C(=O)O MCULE-6046561180 [0,0,0,0,0,0|0,0,0]=0 3 B9R0.32 CC(C)(CO)C(=O)C(=O)[O-] MCULE-7598598589 [0,0,0,0,0,0|0,0,1]=1 4 B9R0.32 CC(C)(CO)C(O)C(=O)N MCULE-2942836455 [0,0,0,0,0,0|1,0,2]=3 5 B9R0.32 CC(C)(CO)C(O)C(=O)O MCULE-3752332762 [0,0,0,0,0,0|0,0,2]=2 6 B9R0.32 CC(C)(CO)C(O)C(=O)[O-] MCULE-8284553290 [0,0,0,0,0,0|0,0,3]=3 7 B9R0.32 CC(C)(CO)[C@@H](O)C(=O)O MCULE-7418140514 [0,0,0,0,0,0|0,0,2]=2 8 B9R0.32 CC(C)(CO)[C@@H](O)C(=O)[O-] MCULE-3131803550 [0,0,0,0,0,0|0,0,3]=3 9 B9R0.32 CC(C)C(=O)C(C)(C)CO MCULE-3368124870 [0,0,0,0,0,0|2,0,1]=3 10 B9R0.32 CCC(C)(C)C(=O)C(=O)O MCULE-2609139055 [0,0,0,0,0,0|1,0,0]=1 11 B9R0.32 CCC(C)(C)C(N)C(=O)O MCULE-2030759346 [0,0,0,0,0,0|2,0,1]=3 12 B9R0.32 CCC(C)(C)C(N)C(=O)O MCULE-8756866734 [0,0,0,0,0,0|2,0,1]=3 13 B9R0.32 CCC(C)(C)C(O)C(=O)O MCULE-6783140520 [0,0,0,0,0,0|1,0,2]=3 14 B9R0.32 CCC(C)(C)N(C)C(=O)Cl MCULE-2696642386 [0,0,0,0,0,0|4,0,0]=4 15 B9R0.32 CCC(C)(O)C(O)C(=O)O MCULE-6322081363 [0,0,0,0,0,0|2,0,2]=4 16 B9R0.32 COC(C)(C)C(Br)C(=O)O MCULE-4686359113 [0,0,0,0,0,0|3,0,1]=4 17 B9R0.32 COC(C)(C)C(N)C(=O)O MCULE-7291117506 [0,0,0,0,0,0|3,0,1]=4 18 B9R0.32 COC(C)(C)[C@H](N)C(=O)O MCULE-1351027484 [0,0,0,0,0,0|3,0,1]=4 19 B8R0.2 CCC(C)C(=O)C(=O)O MCULE-2376245949 [1,0,0,0,0,0|1,0,0]=2 20 B8R0.2 CCC(C)C(=O)C(=O)[O-] MCULE-9099284149 [1,0,0,0,0,0|1,0,1]=3 21 B8R0.2 CCC(C)C(Br)C(=O)O MCULE-1124609284 [1,0,0,0,0,0|2,0,1]=4 22 B8R0.2 CCC(C)C(C)C(=O)O MCULE-9360443230 [1,0,0,0,0,0|2,0,1]=4 23 B8R0.2 CCC(C)C(N)C(=O)O MCULE-9861955295 [1,0,0,0,0,0|2,0,1]=4 24 B8R0.2 CCC(C)C(O)C(=O)O MCULE-4300622531 [1,0,0,0,0,0|1,0,2]=4 25 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-1413119398 [1,0,0,0,0,0|2,0,1]=4 26 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-5186925599 [1,0,0,0,0,0|2,0,1]=4 27 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O MCULE-5041492133 [1,0,0,0,0,0|2,0,1]=4 28 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-2706440971 [1,0,0,0,0,0|2,0,1]=4 29 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-8101207882 [1,0,0,0,0,0|2,0,1]=4 30 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1200159118 [1,0,0,0,0,0|2,0,1]=4 31 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1359318144 [1,0,0,0,0,0|2,0,1]=4 32 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-9629903099 [1,0,0,0,0,0|2,0,1]=4 33 B8R0.2 CC[C@H](C)[C@@H](O)C(=O)O MCULE-6017510763 [1,0,0,0,0,0|1,0,2]=4 34 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-1760352503 [1,0,0,0,0,0|2,0,1]=4 35 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-2341573677 [1,0,0,0,0,0|2,0,1]=4 36 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-2215911951 [1,0,0,0,0,0|2,0,1]=4 37 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-3217669453 [1,0,0,0,0,0|2,0,1]=4 38 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-2804875804 [1,0,0,0,0,0|1,0,2]=4 39 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-4272353967 [1,0,0,0,0,0|1,0,2]=4 40 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-6087026464 [1,0,0,0,0,0|1,0,2]=4 41 B8R0.2 O=C(O)C(O)C(O)CO MCULE-1397527919 [1,0,0,0,0,0|1,0,2]=4 42 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-1531474304 [1,0,0,0,0,0|1,0,2]=4 43 B8R0.2 O=C(O)[C@H](O)[C@H](O)CO MCULE-3829421433 [1,0,0,0,0,0|1,0,2]=4 44 B8R0.13 CC(C)(CCl)C(=O)NO MCULE-7417714844 [1,0,0,0,0,0|2,0,0]=3 45 B8R0.13 CC(C)(CO)[C@@H](O)CO MCULE-9011219997 [1,0,0,0,0,0|0,0,3]=4 46 B8R0.13 CCC(=O)C(C)(C)CC MCULE-3794055790 [1,0,0,0,0,0|2,0,1]=4 47 B8R0.13 CCC(C)(C)C(=O)CBr MCULE-4740682169 [1,0,0,0,0,0|2,0,1]=4 48 B8R0.13 CCC(C)(C)C(=O)CCl MCULE-6098410477 [1,0,0,0,0,0|2,0,1]=4 49 B8R0.13 CCC(C)(C)C(=O)OC MCULE-4686994014 [1,0,0,0,0,0|3,0,0]=4 50 B8R0.13 CNC(=O)C(C)(C)CCl MCULE-6059735836 [1,0,0,0,0,0|3,0,0]=4 51 B8R0.13 CNC(=O)C(C)(C)CN MCULE-2878763373 [1,0,0,0,0,0|3,0,0]=4 52 B8R0.13 CNC(=O)C(C)(C)CN MCULE-3206960064 [1,0,0,0,0,0|3,0,0]=4 53 B8R0.13 COC(=O)C(C)(C)CBr MCULE-8493306369 [1,0,0,0,0,0|3,0,0]=4 54 B8R0.13 COC(=O)C(C)(C)CN MCULE-3876518389 [1,0,0,0,0,0|3,0,0]=4 55 B8R0.13 COC(=O)C(C)(C)CN MCULE-6058798123 [1,0,0,0,0,0|3,0,0]=4 56 B8R0.13 COC(=O)C(C)(C)CO MCULE-5007341074 [1,0,0,0,0,0|2,0,0]=3 57 B8R0.13 COC(=O)C(C)(C)CS MCULE-1609978379 [1,0,0,0,0,0|2,1,0]=4 58 B8R0.13 COC(=O)C(C)(N)CO MCULE-3846577646 [1,0,0,0,0,0|3,0,0]=4 59 B8R0.13 COC(=O)C(C)(N)CO MCULE-4981173106 [1,0,0,0,0,0|3,0,0]=4 60 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-2857382898 [1,0,0,0,0,0|3,0,0]=4 61 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-3226982515 [1,0,0,0,0,0|3,0,0]=4 62 B8R0.27 C(N)(C(=O)O)C(C)(C)S MCULE-1893345960 [1,0,0,0,0,0|1,1,1]=4 63 B8R0.27 C=C(C(=O)O)C(C)(C)C MCULE-7253303469 [1,0,0,0,0,0|1,0,0]=2 64 B8R0.27 CC(=O)[C@@H](N)C(C)(C)C MCULE-9412848571 [1,0,0,0,0,0|2,0,1]=4 65 B8R0.27 CC(Br)C(=O)C(C)(C)C MCULE-2668790545 [1,0,0,0,0,0|2,0,1]=4 66 B8R0.27 CC(C(=O)O)C(C)(C)C MCULE-5931607530 [1,0,0,0,0,0|1,0,1]=3 67 B8R0.27 CC(C)(Br)C(Br)C(=O)O MCULE-2600237498 [1,0,0,0,0,0|2,0,1]=4 68 B8R0.27 CC(C)(C)C(=O)C(=O)O MCULE-2891266778 [1,0,0,0,0,0|0,0,0]=1 69 B8R0.27 CC(C)(C)C(=O)C(Br)Br MCULE-3869470693 [1,0,0,0,0,0|2,0,1]=4 70 B8R0.27 CC(C)(C)C(=O)C(Cl)Cl MCULE-6631767311 [1,0,0,0,0,0|2,0,1]=4 71 B8R0.27 CC(C)(C)C(Br)C(=O)O MCULE-3140400663 [1,0,0,0,0,0|1,0,1]=3 72 B8R0.27 CC(C)(C)C(N)C(=O)N MCULE-3894112806 [1,0,0,0,0,0|2,0,1]=4 73 B8R0.27 CC(C)(C)C(N)C(=O)N MCULE-7020753722 [1,0,0,0,0,0|2,0,1]=4 74 B8R0.27 CC(C)(C)C(N)C(=O)N MCULE-7146166501 [1,0,0,0,0,0|2,0,1]=4 75 B8R0.27 CC(C)(C)C(N)C(=O)N MCULE-7871694729 [1,0,0,0,0,0|2,0,1]=4 76 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-4378220677 [1,0,0,0,0,0|1,0,1]=3 77 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-7142182400 [1,0,0,0,0,0|1,0,1]=3 78 B8R0.27 CC(C)(C)C(N)C(=O)O MCULE-9877941557 [1,0,0,0,0,0|1,0,1]=3 79 B8R0.27 CC(C)(C)C(O)C(=O)O MCULE-2831225594 [1,0,0,0,0,0|0,0,2]=3 80 B8R0.27 CC(C)(C)C(O)C(=O)O MCULE-6241480954 [1,0,0,0,0,0|0,0,2]=3 81 B8R0.27 CC(C)(C)[C@@H](N)C(=O)N MCULE-9445074583 [1,0,0,0,0,0|2,0,1]=4 82 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-1280092872 [1,0,0,0,0,0|1,0,1]=3 83 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-8741274445 [1,0,0,0,0,0|1,0,1]=3 84 B8R0.27 CC(C)(C)[C@@H](N)C(=O)O MCULE-9585981018 [1,0,0,0,0,0|1,0,1]=3 85 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O MCULE-4712331175 [1,0,0,0,0,0|0,0,2]=3 86 B8R0.27 CC(C)(C)[C@@H](O)C(=O)O MCULE-9440383034 [1,0,0,0,0,0|0,0,2]=3 87 B8R0.27 CC(C)(C)[C@H](Br)C(=O)O MCULE-3604683063 [1,0,0,0,0,0|1,0,1]=3 88 B8R0.27 CC(C)(C)[C@H](N)C(=O)N MCULE-2483407443 [1,0,0,0,0,0|2,0,1]=4 89 B8R0.27 CC(C)(C)[C@H](N)C(=O)N MCULE-4654034585 [1,0,0,0,0,0|2,0,1]=4 90 B8R0.27 CC(C)(C)[C@H](N)C(=O)N MCULE-9173080997 [1,0,0,0,0,0|2,0,1]=4 91 B8R0.27 CC(C)(C)[C@H](N)C(=O)N MCULE-9398616649 [1,0,0,0,0,0|2,0,1]=4 92 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-2361901374 [1,0,0,0,0,0|1,0,1]=3 93 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-7700637346 [1,0,0,0,0,0|1,0,1]=3 94 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-8028056550 [1,0,0,0,0,0|1,0,1]=3 95 B8R0.27 CC(C)(C)[C@H](N)C(=O)O MCULE-8791211435 [1,0,0,0,0,0|1,0,1]=3 96 B8R0.27 CC(C)(C)[C@H](O)C(=O)O MCULE-4165755614 [1,0,0,0,0,0|0,0,2]=3 97 B8R0.27 CC(C)(C)[C@H](O)C(=O)O MCULE-6845662197 [1,0,0,0,0,0|0,0,2]=3 98 B8R0.27 CC(C)(F)C(Br)C(=O)O MCULE-8601470705 [1,0,0,0,0,0|2,0,1]=4 99 B8R0.27 CC(C)(F)C(N)C(=O)O MCULE-3479476353 [1,0,0,0,0,0|2,0,1]=4 100 B8R0.27 CC(C)(F)[C@H](N)C(=O)O MCULE-4975554837 [1,0,0,0,0,0|2,0,1]=4 101 B8R0.27 CC(C)(F)[C@H](N)C(=O)O MCULE-6202392495 [1,0,0,0,0,0|2,0,1]=4 102 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-4257891769 [1,0,0,0,0,0|1,0,1]=3 103 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-4291820573 [1,0,0,0,0,0|1,0,1]=3 104 B8R0.27 CC(C)(O)C(N)C(=O)O MCULE-8731964950 [1,0,0,0,0,0|1,0,1]=3 105 B8R0.27 CC(C)(O)C(O)C(=O)O MCULE-2030710507 [1,0,0,0,0,0|0,0,2]=3 106 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O MCULE-2953137860 [1,0,0,0,0,0|1,0,1]=3 107 B8R0.27 CC(C)(O)[C@@H](N)C(=O)O MCULE-3424625974 [1,0,0,0,0,0|1,0,1]=3 108 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-3721152032 [1,0,0,0,0,0|1,0,1]=3 109 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-7599346102 [1,0,0,0,0,0|1,0,1]=3 110 B8R0.27 CC(C)(O)[C@H](N)C(=O)O MCULE-9499245205 [1,0,0,0,0,0|1,0,1]=3 111 B8R0.27 CC(C)(S)C(N)C(=O)O MCULE-4184299411 [1,0,0,0,0,0|1,1,1]=4 112 B8R0.27 CC(C)(S)C(N)C(=O)O MCULE-8542176080 [1,0,0,0,0,0|1,1,1]=4 113 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O MCULE-5986342172 [1,0,0,0,0,0|1,1,1]=4 114 B8R0.27 CC(C)(S)[C@@H](N)C(=O)O MCULE-9856748563 [1,0,0,0,0,0|1,1,1]=4 115 B8R0.27 CC(C)(S)[C@H](N)C(=O)O MCULE-3098543641 [1,0,0,0,0,0|1,1,1]=4 116 B8R0.27 CC(C)(S)[C@H](N)C(=O)O MCULE-9539588985 [1,0,0,0,0,0|1,1,1]=4 117 B8R0.27 CC(C)C(=O)C(C)(C)C MCULE-1865080144 [1,0,0,0,0,0|2,0,1]=4 118 B8R0.27 CN(C(=O)Cl)C(C)(C)C MCULE-3673086279 [1,0,0,0,0,0|3,0,0]=4 119 B8R0.27 CN(C)C(=O)C(C)(C)C MCULE-8166953200 [1,0,0,0,0,0|3,0,0]=4 120 B8R0.27 O=C(O)C(=O)C(F)(F)F MCULE-3149176369 [1,0,0,0,0,0|3,0,0]=4 121 B8R0.27 [C@@H](N)(C(=O)O)C(C)(C)O MCULE-5116872005 [1,0,0,0,0,0|1,0,1]=3 122 B8R0.27 [C@H](N)(C(=O)O)C(C)(C)S MCULE-5559697921 [1,0,0,0,0,0|1,1,1]=4 123 B8R0.34 C=CC(C)(C)CC(=O)O MCULE-5164134544 [1,0,0,0,0,0|1,0,2]=4 124 B8R0.34 CC(=O)NC(C)(C)CO MCULE-7854801131 [1,0,0,0,0,0|2,0,0]=3 125 B8R0.34 CC(=O)OC(C)(C)CO MCULE-6739454773 [1,0,0,0,0,0|2,0,0]=3 126 B8R0.34 CC(C)(C#N)CC(=O)O MCULE-3389391069 [1,0,0,0,0,0|1,0,2]=4 127 B8R0.34 CC(C)(CBr)CC(=O)O MCULE-4311085343 [1,0,0,0,0,0|1,0,1]=3 128 B8R0.34 CC(C)(CN)CC(=O)O MCULE-6230830854 [1,0,0,0,0,0|1,0,1]=3 129 B8R0.34 CC(C)(CN)CC(=O)O MCULE-7518023349 [1,0,0,0,0,0|1,0,1]=3 130 B8R0.34 CC(C)(CO)CC(=O)O MCULE-8595593482 [1,0,0,0,0,0|0,0,1]=2 131 B8R0.34 CC(C)(CO)CC(=O)[O-] MCULE-9214676521 [1,0,0,0,0,0|0,0,2]=3 132 B8R0.34 CC(O)(CN)CC(=O)O MCULE-3304637192 [1,0,0,0,0,0|2,0,1]=4 133 B8R0.34 CC(O)(CN)CC(=O)O MCULE-4143526784 [1,0,0,0,0,0|2,0,1]=4 134 B8R0.34 CCC(C)(C)CC(=O)C MCULE-9050476347 [1,0,0,0,0,0|2,0,1]=4 135 B8R0.34 CCC(C)(C)CC(=O)O MCULE-7231252497 [1,0,0,0,0,0|1,0,1]=3 136 B8R0.34 CCC(C)(C)NC(=O)C MCULE-4494448055 [1,0,0,0,0,0|3,0,0]=4 137 B8R0.34 CCC(C)(C)OC(=O)C MCULE-9920396593 [1,0,0,0,0,0|3,0,0]=4 138 B8R0.34 CCC(C)(O)CC(=O)O MCULE-2487477968 [1,0,0,0,0,0|2,0,1]=4 139 B8R0.34 COC(C)(C)CC(=O)O MCULE-3953307849 [1,0,0,0,0,0|2,0,1]=4 140 B10R0.39 CC(C)(CO)C(O)C(=O)NN MCULE-8277236420 [0,1,0,0,0,0|1,0,2]=4 141 B10R0.39 CCC(C)(C)C(=O)N(C)OC MCULE-4745810651 [0,1,0,0,0,0|3,0,0]=4 142 B10R0.39 CCC(F)(F)C(=O)C(=O)OF MCULE-4360333144 [0,1,0,0,0,0|3,0,0]=4 143 B10R0.39 CON(C)C(=O)C(C)(C)CO MCULE-4756100932 [0,1,0,0,0,0|2,0,0]=3 144 B10R1.83 CC1(C(CC1C(=O)O)N)C MCULE-1760692606 [0,0,0,1,0,0|2,0,1]=4 145 B10R1.83 CC1(C(CC1C(=O)O)N)C MCULE-6477382898 [0,0,0,1,0,0|2,0,1]=4 146 B10R1.83 CC1([C@H](C[C@@H]1C(=O)O)N)C MCULE-1367965106 [0,0,0,1,0,0|2,0,1]=4 147 B10R1.83 CC1([C@H](C[C@@H]1C(=O)O)N)C MCULE-5181157821 [0,0,0,1,0,0|2,0,1]=4 148 B10R1.83 CC1([C@H](C[C@@H]1C(=O)O)N)C MCULE-9629419450 [0,0,0,1,0,0|2,0,1]=4 149 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-1255189062 [0,0,0,1,0,0|2,0,1]=4 150 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-1573159970 [0,0,0,1,0,0|2,0,1]=4 151 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-3597897261 [0,0,0,1,0,0|2,0,1]=4 152 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-5950701932 [0,0,0,1,0,0|2,0,1]=4 153 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-6764578128 [0,0,0,1,0,0|2,0,1]=4 154 B10R1.83 CC1([C@H](C[C@H]1C(=O)O)N)C MCULE-8635317976 [0,0,0,1,0,0|2,0,1]=4 155 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-2623468295 [0,0,0,1,0,0|2,0,1]=4 156 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-4157898594 [0,0,0,1,0,0|2,0,1]=4 157 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-8831652749 [0,0,0,1,0,0|2,0,1]=4 158 B10R1.83 CC1([C@H](C[C@H]1N)C(=O)O)C MCULE-8994723547 [0,0,0,1,0,0|2,0,1]=4 159 B10R1.128 CC1(CCC=C1C(=O)O)C MCULE-6540475820 [0,0,0,1,0,0|2,0,0]=3 160 B10R1.128 CC1(CCCC1C(=O)O)C MCULE-4580682391 [0,0,0,1,0,0|2,0,1]=4 161 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-4368125699 [0,0,0,1,0,0|2,0,1]=4 162 B10R1.128 CC1(CCNC1C(=O)O)C MCULE-9548940162 [0,0,0,1,0,0|2,0,1]=4 163 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9288829524 [0,0,0,1,0,0|2,0,1]=4 164 B10R1.128 CC1(CCN[C@@H]1C(=O)O)C MCULE-9565122593 [0,0,0,1,0,0|2,0,1]=4 165 B10R1.128 CC1(CNCC1C(=O)O)C MCULE-3386370307 [0,0,0,1,0,0|2,0,1]=4 166 B10R1.128 CC1(CNCC1C(=O)O)C MCULE-6121405177 [0,0,0,1,0,0|2,0,1]=4 167 B10R1.128 CC1(CNC[C@@H]1C(=O)O)C MCULE-2007377437 [0,0,0,1,0,0|2,0,1]=4 168 B10R1.128 CC1(CNC[C@@H]1C(=O)O)C MCULE-2184930829 [0,0,0,1,0,0|2,0,1]=4 169 B10R1.128 CC1(CNC[C@H]1C(=O)O)C MCULE-1263349937 [0,0,0,1,0,0|2,0,1]=4 170 B10R1.128 CC1(CNC[C@H]1C(=O)O)C MCULE-7547643584 [0,0,0,1,0,0|2,0,1]=4 171 B10R1.236 CN1CCC(C1=O)(C)CO MCULE-5237925950 [0,0,0,1,0,0|3,0,0]=4 172 B10R1.315 CC1(C(=O)C(C1O)(C)C)C MCULE-4656054302 [0,0,0,1,0,0|2,0,1]=4 173 B10R1.495 CC1(COC1)C(N)C(=O)O MCULE-3054998452 [0,0,0,1,0,0|1,0,1]=3 174 B10R1.495 CC1(COC1)[C@H](N)C(=O)O MCULE-3689733091 [0,0,0,1,0,0|1,0,1]=3 175 B10R0.67 CC(N)C(=O)NC(C)(C)CO MCULE-6126021300 [0,0,0,0,0,1|2,0,1]=4 176 B10R0.67 CC(N)C(=O)NC(C)(C)CO MCULE-6505309191 [0,0,0,0,0,1|2,0,1]=4 177 B10R0.67 CCC(C)(C)NC(=O)C(=O)O MCULE-5676334997 [0,0,0,0,0,1|1,0,0]=2 178 B7R0.2 CC(=O)NC(C)CO MCULE-9455210462 [2,0,0,0,0,0|2,0,0]=4 179 B7R0.2 CC(=O)N[C@H](C)CO MCULE-2174899443 [2,0,0,0,0,0|2,0,0]=4 180 B7R0.2 CC(=O)N[C@H](C)CO MCULE-5097293473 [2,0,0,0,0,0|2,0,0]=4 181 B7R0.2 CC(CN)CC(=O)O MCULE-1594242184 [2,0,0,0,0,0|1,0,1]=4 182 B7R0.2 CC(CN)CC(=O)O MCULE-8074816359 [2,0,0,0,0,0|1,0,1]=4 183 B7R0.2 CCC(=CC(=O)O)C MCULE-3864767099 [2,0,0,0,0,0|1,0,1]=4 184 B7R0.2 CCC(C)CC(=O)O MCULE-3409782202 [2,0,0,0,0,0|1,0,1]=4 185 B7R0.2 CCC(C)CC(=O)O MCULE-6537278030 [2,0,0,0,0,0|1,0,1]=4 186 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-5550070887 [2,0,0,0,0,0|1,0,1]=4 187 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-9572363620 [2,0,0,0,0,0|1,0,1]=4 188 B7R0.2 CC[C@H](C)CC(=O)O MCULE-4177365854 [2,0,0,0,0,0|1,0,1]=4 189 B7R0.2 CC[C@H](C)CC(=O)O MCULE-5173108207 [2,0,0,0,0,0|1,0,1]=4 190 B7R0.2 C[C@H](CN)CC(=O)O MCULE-4808630217 [2,0,0,0,0,0|1,0,1]=4 191 B7R0.2 C[C@H](CN)CC(=O)O MCULE-5474405940 [2,0,0,0,0,0|1,0,1]=4 192 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [2,0,0,0,0,0|1,0,1]=4 193 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [2,0,0,0,0,0|1,0,1]=4 194 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [2,0,0,0,0,0|1,0,1]=4 195 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [2,0,0,0,0,0|1,0,1]=4 196 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [2,0,0,0,0,0|1,0,1]=4 197 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [2,0,0,0,0,0|1,0,1]=4 198 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [2,0,0,0,0,0|1,0,1]=4 199 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [2,0,0,0,0,0|1,0,1]=4 200 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [2,0,0,0,0,0|1,0,1]=4 201 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [2,0,0,0,0,0|2,0,0]=4 202 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [2,0,0,0,0,0|1,0,0]=3 203 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [2,0,0,0,0,0|1,0,1]=4 204 B7R0.5 CCCC(=O)C(=O)C MCULE-8267463586 [2,0,0,0,0,0|2,0,0]=4 205 B7R0.5 CCCC(=O)C(=O)N MCULE-6625605588 [2,0,0,0,0,0|2,0,0]=4 206 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [2,0,0,0,0,0|1,0,0]=3 207 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [2,0,0,0,0,0|2,0,0]=4 208 B7R0.5 CCOC(=O)C(=O)O MCULE-2368024441 [2,0,0,0,0,0|2,0,0]=4 209 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [2,0,0,0,0,0|1,0,1]=4 210 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [2,0,0,0,0,0|1,0,1]=4 211 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [2,0,0,0,0,0|1,0,1]=4 212 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [2,0,0,0,0,0|1,0,1]=4 213 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [2,0,0,0,0,0|1,0,1]=4 214 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [2,0,0,0,0,0|1,0,1]=4 215 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [2,0,0,0,0,0|0,0,2]=4 216 B7R0.10 COC(=O)C(C)CO MCULE-1168600238 [2,0,0,0,0,0|2,0,0]=4 217 B7R0.10 COC(=O)C(C)CO MCULE-9207150786 [2,0,0,0,0,0|2,0,0]=4 218 B7R0.10 COC(=O)[C@@H](C)CO MCULE-6738074317 [2,0,0,0,0,0|2,0,0]=4 219 B7R0.10 COC(=O)[C@@H](C)CO MCULE-9697255968 [2,0,0,0,0,0|2,0,0]=4 220 B7R0.10 COC(=O)[C@H](C)CO MCULE-5719676432 [2,0,0,0,0,0|2,0,0]=4 221 B7R0.10 COC(=O)[C@H](C)CO MCULE-8479546806 [2,0,0,0,0,0|2,0,0]=4 222 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [2,0,0,0,0,0|1,0,1]=4 223 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [2,0,0,0,0,0|1,0,1]=4 224 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [2,0,0,0,0,0|1,0,1]=4 225 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [2,0,0,0,0,0|1,0,1]=4 226 B7R0.16 C=C(C(=O)O)C(C)C MCULE-6667026437 [2,0,0,0,0,0|1,0,0]=3 227 B7R0.16 C=C(C)C(=O)C(C)C MCULE-6219149152 [2,0,0,0,0,0|2,0,0]=4 228 B7R0.16 CC(=C(Br)C(=O)O)C MCULE-8944482091 [2,0,0,0,0,0|1,0,1]=4 229 B7R0.16 CC(=C(C)C(=O)O)C MCULE-1062537992 [2,0,0,0,0,0|1,0,1]=4 230 B7R0.16 CC(=C(Cl)C(=O)O)C MCULE-9408683615 [2,0,0,0,0,0|1,0,1]=4 231 B7R0.16 CC(=C(F)C(=O)O)C MCULE-9025515032 [2,0,0,0,0,0|1,0,1]=4 232 B7R0.16 CC(=O)C(=O)C(C)Br MCULE-8153095418 [2,0,0,0,0,0|2,0,0]=4 233 B7R0.16 CC(=O)C(=O)N(C)C MCULE-9467983911 [2,0,0,0,0,0|2,0,0]=4 234 B7R0.16 CC(C)C(=O)C(=O)Cl MCULE-6254092186 [2,0,0,0,0,0|1,0,0]=3 235 B7R0.16 CC(C)C(=O)C(=O)O MCULE-9877767821 [2,0,0,0,0,0|0,0,0]=2 236 B7R0.16 CC(C)C(=O)C(=O)[O-] MCULE-3960241746 [2,0,0,0,0,0|0,0,1]=3 237 B7R0.16 CC(C)C(Br)C(=O)O MCULE-7284929535 [2,0,0,0,0,0|1,0,1]=4 238 B7R0.16 CC(C)C(Br)C(=O)O MCULE-8100016953 [2,0,0,0,0,0|1,0,1]=4 239 B7R0.16 CC(C)C(C)C(=O)O MCULE-4998524686 [2,0,0,0,0,0|1,0,1]=4 240 B7R0.16 CC(C)C(Cl)C(=O)O MCULE-8634615546 [2,0,0,0,0,0|1,0,1]=4 241 B7R0.16 CC(C)C(F)C(=O)O MCULE-5644342535 [2,0,0,0,0,0|1,0,1]=4 242 B7R0.16 CC(C)C(N)C(=O)O MCULE-8140660263 [2,0,0,0,0,0|1,0,1]=4 243 B7R0.16 CC(C)C(N)C(=O)O MCULE-9199801639 [2,0,0,0,0,0|1,0,1]=4 244 B7R0.16 CC(C)C(O)C(=O)O MCULE-6517225229 [2,0,0,0,0,0|0,0,2]=4 245 B7R0.16 CC(C)C(O)C(=O)O MCULE-7748605101 [2,0,0,0,0,0|0,0,2]=4 246 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-2705531785 [2,0,0,0,0,0|1,0,1]=4 247 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-7570119486 [2,0,0,0,0,0|1,0,1]=4 248 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-1338052740 [2,0,0,0,0,0|1,0,1]=4 249 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-2459930572 [2,0,0,0,0,0|1,0,1]=4 250 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-7719048521 [2,0,0,0,0,0|0,0,2]=4 251 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-9864796653 [2,0,0,0,0,0|0,0,2]=4 252 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-4863317096 [2,0,0,0,0,0|1,0,1]=4 253 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-8695526864 [2,0,0,0,0,0|1,0,1]=4 254 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-4413397700 [2,0,0,0,0,0|1,0,1]=4 255 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-6269612306 [2,0,0,0,0,0|1,0,1]=4 256 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8084934210 [2,0,0,0,0,0|1,0,1]=4 257 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8307595659 [2,0,0,0,0,0|1,0,1]=4 258 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-2507309072 [2,0,0,0,0,0|1,0,1]=4 259 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-9143825935 [2,0,0,0,0,0|1,0,1]=4 260 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-1975771806 [2,0,0,0,0,0|0,0,2]=4 261 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-4070611738 [2,0,0,0,0,0|0,0,2]=4 262 B7R0.16 CC(O)C(C)C(=O)O MCULE-2499360516 [2,0,0,0,0,0|1,0,1]=4 263 B7R0.16 CC(O)C(N)C(=O)O MCULE-1563595722 [2,0,0,0,0,0|1,0,1]=4 264 B7R0.16 CC(O)C(N)C(=O)O MCULE-5581920538 [2,0,0,0,0,0|1,0,1]=4 265 B7R0.16 CN(C)C(=O)C(=O)O MCULE-4063274840 [2,0,0,0,0,0|1,0,0]=3 266 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-1663687439 [2,0,0,0,0,0|1,0,1]=4 267 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-3863591433 [2,0,0,0,0,0|1,0,1]=4 268 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-8080019797 [2,0,0,0,0,0|1,0,1]=4 269 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-9284411012 [2,0,0,0,0,0|1,0,1]=4 270 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2430667007 [2,0,0,0,0,0|1,0,1]=4 271 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2676185993 [2,0,0,0,0,0|1,0,1]=4 272 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5254477364 [2,0,0,0,0,0|1,0,1]=4 273 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5505393195 [2,0,0,0,0,0|1,0,1]=4 274 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-7379719940 [2,0,0,0,0,0|1,0,1]=4 275 B7R0.16 C[C@@H](O)[C@H](O)C(=O)O MCULE-9383777855 [2,0,0,0,0,0|0,0,2]=4 276 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O MCULE-8875933839 [2,0,0,0,0,0|1,0,1]=4 277 B7R0.16 C[C@H](O)C(N)C(=O)O MCULE-6661175670 [2,0,0,0,0,0|1,0,1]=4 278 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-6288272506 [2,0,0,0,0,0|1,0,1]=4 279 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-7203096302 [2,0,0,0,0,0|1,0,1]=4 280 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-9531951265 [2,0,0,0,0,0|1,0,1]=4 281 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-2246314901 [2,0,0,0,0,0|1,0,1]=4 282 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-9478987169 [2,0,0,0,0,0|1,0,1]=4 283 B7R0.16 O=C(O)C(=O)C(=O)O MCULE-9031084199 [2,0,0,0,0,0|1,0,1]=4 284 B7R0.16 O=C(O)C(=O)C(Br)Br MCULE-6847251467 [2,0,0,0,0,0|2,0,0]=4 285 B7R0.11 C=CCC(C)(C)CO MCULE-7471335170 [2,0,0,0,0,0|1,0,1]=4 286 B7R0.11 CC(C)(CO)CCO MCULE-1756560398 [2,0,0,0,0,0|0,0,2]=4 287 B7R0.11 CC(C)(CO)NC=O MCULE-3904144073 [2,0,0,0,0,0|1,0,0]=3 288 B7R0.11 CCC(C)(C)C=NO MCULE-6597900233 [2,0,0,0,0,0|2,0,0]=4 289 B7R0.11 CCC(C)(C)CC=O MCULE-5511626130 [2,0,0,0,0,0|1,0,1]=4 290 B7R0.13 C#CC(C)(C)C(=O)O MCULE-4971472343 [2,0,0,0,0,0|1,0,1]=4 291 B7R0.13 C=CC(C)(C)C(=O)O MCULE-4029204507 [2,0,0,0,0,0|1,0,1]=4 292 B7R0.13 CC(=O)C(C)(C)CO MCULE-7885820738 [2,0,0,0,0,0|0,0,1]=3 293 B7R0.13 CC(Br)(CBr)C(=O)O MCULE-1859698457 [2,0,0,0,0,0|2,0,0]=4 294 B7R0.13 CC(Br)(CO)N(=O)=O MCULE-7018173037 [2,0,0,0,0,0|2,0,0]=4 295 B7R0.13 CC(C)(C#N)C(=O)O MCULE-8297007076 [2,0,0,0,0,0|1,0,1]=4 296 B7R0.13 CC(C)(CBr)C(=O)Cl MCULE-2173837084 [2,0,0,0,0,0|2,0,0]=4 297 B7R0.13 CC(C)(CBr)C(=O)F MCULE-3596602192 [2,0,0,0,0,0|2,0,0]=4 298 B7R0.13 CC(C)(CBr)C(=O)N MCULE-5685972374 [2,0,0,0,0,0|2,0,0]=4 299 B7R0.13 CC(C)(CBr)C(=O)O MCULE-2715950010 [2,0,0,0,0,0|1,0,0]=3 300 B7R0.13 CC(C)(CCl)C(=O)O MCULE-2346120215 [2,0,0,0,0,0|1,0,0]=3 301 B7R0.13 CC(C)(CF)C(=O)O MCULE-5866229087 [2,0,0,0,0,0|1,0,0]=3 302 B7R0.13 CC(C)(CN)C(=O)N MCULE-6885361465 [2,0,0,0,0,0|2,0,0]=4 303 B7R0.13 CC(C)(CN)C(=O)O MCULE-1750685187 [2,0,0,0,0,0|1,0,0]=3 304 B7R0.13 CC(C)(CN)C(=O)O MCULE-7138204669 [2,0,0,0,0,0|1,0,0]=3 305 B7R0.13 CC(C)(CO)C(=O)O MCULE-8700273400 [2,0,0,0,0,0|0,0,0]=2 306 B7R0.13 CC(C)(CO)N(=O)=O MCULE-6787663159 [2,0,0,0,0,0|1,0,0]=3 307 B7R0.13 CC(C)(ON)C(=O)O MCULE-3628409953 [2,0,0,0,0,0|2,0,0]=4 308 B7R0.13 CC(C)(ON)C(=O)O MCULE-4840137554 [2,0,0,0,0,0|2,0,0]=4 309 B7R0.13 CC(Cl)(CCl)C(=O)O MCULE-9297172670 [2,0,0,0,0,0|2,0,0]=4 310 B7R0.13 CC(N)(CO)C(=O)O MCULE-5973815630 [2,0,0,0,0,0|1,0,0]=3 311 B7R0.13 CC(N)(CO)C(=O)O MCULE-6877149014 [2,0,0,0,0,0|1,0,0]=3 312 B7R0.13 CC(N)(CS)C(=O)O MCULE-4669241619 [2,0,0,0,0,0|1,1,0]=4 313 B7R0.13 CC(N)(CS)C(=O)O MCULE-8539612367 [2,0,0,0,0,0|1,1,0]=4 314 B7R0.13 CC(O)(CBr)C(=O)O MCULE-4224343890 [2,0,0,0,0,0|2,0,0]=4 315 B7R0.13 CC(O)(CBr)C(=O)O MCULE-5597565903 [2,0,0,0,0,0|2,0,0]=4 316 B7R0.13 CC(O)(CO)C(=O)O MCULE-5566145169 [2,0,0,0,0,0|1,0,0]=3 317 B7R0.13 CC(O)C(C)(C)CO MCULE-1064066796 [2,0,0,0,0,0|1,0,1]=4 318 B7R0.13 CCC(C)(Br)C(=O)O MCULE-2564629085 [2,0,0,0,0,0|2,0,0]=4 319 B7R0.13 CCC(C)(C)C(=O)C MCULE-3647111938 [2,0,0,0,0,0|1,0,1]=4 320 B7R0.13 CCC(C)(C)C(=O)Cl MCULE-7950206740 [2,0,0,0,0,0|2,0,0]=4 321 B7R0.13 CCC(C)(C)C(=O)O MCULE-2539552186 [2,0,0,0,0,0|1,0,0]=3 322 B7R0.13 CCC(C)(N)C(=O)O MCULE-4944905519 [2,0,0,0,0,0|2,0,0]=4 323 B7R0.13 CCC(C)(N)C(=O)O MCULE-8684474701 [2,0,0,0,0,0|2,0,0]=4 324 B7R0.13 CCC(C)(N)C(=O)O MCULE-9925925283 [2,0,0,0,0,0|2,0,0]=4 325 B7R0.13 CCC(C)(O)C(=O)O MCULE-1193062860 [2,0,0,0,0,0|2,0,0]=4 326 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-4076270773 [2,0,0,0,0,0|2,0,0]=4 327 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-4696366287 [2,0,0,0,0,0|2,0,0]=4 328 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-7243626223 [2,0,0,0,0,0|2,0,0]=4 329 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-8928070809 [2,0,0,0,0,0|2,0,0]=4 330 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-1912860688 [2,0,0,0,0,0|2,0,0]=4 331 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-3601494140 [2,0,0,0,0,0|2,0,0]=4 332 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-4886902354 [2,0,0,0,0,0|2,0,0]=4 333 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-8271138085 [2,0,0,0,0,0|2,0,0]=4 334 B7R0.13 CC[C@](C)(O)C(=O)O MCULE-3871181536 [2,0,0,0,0,0|2,0,0]=4 335 B7R0.13 CNC(C)(C)C(=O)O MCULE-7551663553 [2,0,0,0,0,0|2,0,0]=4 336 B7R0.13 CNC(C)(C)C(=O)O MCULE-9856262226 [2,0,0,0,0,0|2,0,0]=4 337 B7R0.13 COC(C)(C)C(=O)O MCULE-6977996423 [2,0,0,0,0,0|2,0,0]=4 338 B7R0.13 CSC(C)(C)C(=O)O MCULE-1032417728 [2,0,0,0,0,0|2,0,0]=4 339 B7R0.13 C[C@@](N)(CO)C(=O)O MCULE-2146963065 [2,0,0,0,0,0|1,0,0]=3 340 B7R0.13 C[C@@](N)(CO)C(=O)O MCULE-7622447669 [2,0,0,0,0,0|1,0,0]=3 341 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-2627761655 [2,0,0,0,0,0|1,1,0]=4 342 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-2887268414 [2,0,0,0,0,0|1,1,0]=4 343 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-6190318443 [2,0,0,0,0,0|1,1,0]=4 344 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-8033021501 [2,0,0,0,0,0|1,1,0]=4 345 B7R0.13 C[C@@](O)(CBr)C(=O)O MCULE-2382162129 [2,0,0,0,0,0|2,0,0]=4 346 B7R0.13 C[C@@](O)(CBr)C(=O)O MCULE-7944927738 [2,0,0,0,0,0|2,0,0]=4 347 B7R0.13 C[C@](N)(CO)C(=O)O MCULE-2760852916 [2,0,0,0,0,0|1,0,0]=3 348 B7R0.13 C[C@](N)(CO)C(=O)O MCULE-4734633152 [2,0,0,0,0,0|1,0,0]=3 349 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-1527310768 [2,0,0,0,0,0|1,1,0]=4 350 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-4351926054 [2,0,0,0,0,0|1,1,0]=4 351 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-6261566257 [2,0,0,0,0,0|1,1,0]=4 352 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-9035242130 [2,0,0,0,0,0|1,1,0]=4 353 B7R0.13 C[C@](O)(CBr)C(=O)O MCULE-1143505996 [2,0,0,0,0,0|2,0,0]=4 354 B7R0.13 C[C@](O)(CBr)C(=O)O MCULE-7898456152 [2,0,0,0,0,0|2,0,0]=4 355 B7R0.13 O=C(O)C(F)(F)CO MCULE-4913704401 [2,0,0,0,0,0|2,0,0]=4 356 B7R0.14 C#CC(=O)C(C)(C)C MCULE-4014843108 [2,0,0,0,0,0|1,0,1]=4 357 B7R0.14 C/C(=N\O)/C(C)(C)C MCULE-9144150659 [2,0,0,0,0,0|2,0,0]=4 358 B7R0.14 C/C(=N\O)/C(C)(C)O MCULE-4351772949 [2,0,0,0,0,0|2,0,0]=4 359 B7R0.14 C=C(C=O)C(C)(C)C MCULE-1459556575 [2,0,0,0,0,0|1,0,0]=3 360 B7R0.14 C=CC(=O)C(C)(C)C MCULE-2078206387 [2,0,0,0,0,0|1,0,0]=3 361 B7R0.14 C=CS(=O)C(C)(C)C MCULE-7810374996 [2,0,0,0,0,0|2,0,0]=4 362 B7R0.14 CC(=NO)C(C)(C)C MCULE-3197862590 [2,0,0,0,0,0|2,0,0]=4 363 B7R0.14 CC(=NO)C(C)(C)O MCULE-8500175274 [2,0,0,0,0,0|2,0,0]=4 364 B7R0.14 CC(C)(C)/C(=C\Br)/Br MCULE-3114526295 [2,0,0,0,0,0|2,0,0]=4 365 B7R0.14 CC(C)(C)/C(=N/O)/N MCULE-2323239146 [2,0,0,0,0,0|2,0,0]=4 366 B7R0.14 CC(C)(C)C(=CBr)Br MCULE-5330763999 [2,0,0,0,0,0|2,0,0]=4 367 B7R0.14 CC(C)(C)C(=O)C#N MCULE-1278115423 [2,0,0,0,0,0|1,0,1]=4 368 B7R0.14 CC(C)(C)C(=O)C=O MCULE-6968249228 [2,0,0,0,0,0|0,0,0]=2 369 B7R0.14 CC(C)(C)C(=O)CBr MCULE-9372273167 [2,0,0,0,0,0|1,0,1]=4 370 B7R0.14 CC(C)(C)C(=O)CCl MCULE-1894659371 [2,0,0,0,0,0|1,0,1]=4 371 B7R0.14 CC(C)(C)C(=O)CN MCULE-7674237053 [2,0,0,0,0,0|1,0,1]=4 372 B7R0.14 CC(C)(C)C(=O)CN MCULE-8608463504 [2,0,0,0,0,0|1,0,1]=4 373 B7R0.14 CC(C)(C)C(=O)CN MCULE-9702095018 [2,0,0,0,0,0|1,0,1]=4 374 B7R0.14 CC(C)(C)C(=O)CO MCULE-4134803818 [2,0,0,0,0,0|0,0,1]=3 375 B7R0.14 CC(C)(C)C(=O)CS MCULE-7051407339 [2,0,0,0,0,0|0,1,1]=4 376 B7R0.14 CC(C)(C)C(=O)NN MCULE-1793011833 [2,0,0,0,0,0|2,0,0]=4 377 B7R0.14 CC(C)(C)C(=O)NO MCULE-8308717662 [2,0,0,0,0,0|1,0,0]=3 378 B7R0.14 CC(C)(C)C(=O)ON MCULE-7067922027 [2,0,0,0,0,0|2,0,0]=4 379 B7R0.14 CC(C)(C)C(=O)ON MCULE-8657954784 [2,0,0,0,0,0|2,0,0]=4 380 B7R0.14 CC(C)(O)C(=N)NO MCULE-3400813193 [2,0,0,0,0,0|2,0,0]=4 381 B7R0.14 CC(C)(O)C(=O)NN MCULE-2403937132 [2,0,0,0,0,0|2,0,0]=4 382 B7R0.14 CC(C=O)C(C)(C)C MCULE-9604117107 [2,0,0,0,0,0|1,0,1]=4 383 B7R0.14 CC=C(C)C(C)(C)C MCULE-9617441610 [2,0,0,0,0,0|2,0,0]=4 384 B7R0.14 CCC(=O)C(C)(C)C MCULE-1267009248 [2,0,0,0,0,0|1,0,1]=4 385 B7R0.14 CNC(=O)C(C)(C)C MCULE-8496171703 [2,0,0,0,0,0|2,0,0]=4 386 B7R0.14 COC(=O)C(C)(C)C MCULE-7232137855 [2,0,0,0,0,0|2,0,0]=4 387 B7R0.14 COC(=O)C(C)(C)O MCULE-2680975247 [2,0,0,0,0,0|2,0,0]=4 388 B7R0.9 CC(=CC(C)(C)C)C MCULE-4264115616 [2,0,0,0,0,0|2,0,0]=4 389 B7R0.9 CC(=O)CC(C)(C)C MCULE-5477546626 [2,0,0,0,0,0|1,0,1]=4 390 B7R0.9 CC(=O)CC(C)(C)O MCULE-2623560163 [2,0,0,0,0,0|1,0,1]=4 391 B7R0.9 CC(=O)NC(C)(C)C MCULE-7590749185 [2,0,0,0,0,0|2,0,0]=4 392 B7R0.9 CC(=O)OC(C)(C)C MCULE-4713236745 [2,0,0,0,0,0|2,0,0]=4 393 B7R0.9 CC(=O)SC(C)(C)C MCULE-7111846167 [2,0,0,0,0,0|2,0,0]=4 394 B7R0.9 CC(C)(Br)CC(=O)O MCULE-2452885576 [2,0,0,0,0,0|1,0,1]=4 395 B7R0.9 CC(C)(C)CC(=O)Cl MCULE-6018997465 [2,0,0,0,0,0|1,0,1]=4 396 B7R0.9 CC(C)(C)CC(=O)N MCULE-5884141657 [2,0,0,0,0,0|1,0,1]=4 397 B7R0.9 CC(C)(C)CC(=O)O MCULE-8746589287 [2,0,0,0,0,0|0,0,1]=3 398 B7R0.9 CC(C)(C)NC(=O)N MCULE-7867571542 [2,0,0,0,0,0|2,0,0]=4 399 B7R0.9 CC(C)(C)OC(=O)N MCULE-8089044173 [2,0,0,0,0,0|2,0,0]=4 400 B7R0.9 CC(C)(C)SC(=O)Cl MCULE-5079482641 [2,0,0,0,0,0|2,0,0]=4 401 B7R0.9 CC(C)(N)CC(=O)O MCULE-1798345695 [2,0,0,0,0,0|1,0,1]=4 402 B7R0.9 CC(C)(N)CC(=O)O MCULE-4385513857 [2,0,0,0,0,0|1,0,1]=4 403 B7R0.9 CC(C)(N)CC(=O)O MCULE-7160776320 [2,0,0,0,0,0|1,0,1]=4 404 B7R0.9 CC(C)(O)CC(=O)O MCULE-3649642958 [2,0,0,0,0,0|0,0,1]=3 405 B7R0.9 CC(C)(S)CC(=O)O MCULE-6501202267 [2,0,0,0,0,0|0,1,1]=4 406 B7R0.9 C[As+](C)(C)CC(=O)O MCULE-7167642312 [2,0,0,0,0,0|1,0,1]=4 407 B7R0.9 C[N+](C)(C)CC(=O)O MCULE-5937838609 [2,0,0,0,0,0|1,0,1]=4 408 B7R0.9 C[Si](C)(C)CC(=O)O MCULE-3888042601 [2,0,0,0,0,0|0,1,1]=4 409 B9R0.6 COCC(C)C(C)C(=O)O MCULE-8168198082 [1,1,0,0,0,0|1,0,1]=4 410 B9R0.41 CCN(CC)C(=O)C(=O)O MCULE-9769368325 [1,1,0,0,0,0|2,0,0]=4 411 B9R0.79 CC(O)C(C)C(N)C(=O)O MCULE-2897656809 [1,1,0,0,0,0|1,0,1]=4 412 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-6535308910 [1,1,0,0,0,0|1,0,1]=4 413 B9R0.79 CC(O)[C@H](C)[C@H](N)C(=O)O MCULE-8450789997 [1,1,0,0,0,0|1,0,1]=4 414 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-1376333194 [1,1,0,0,0,0|1,0,1]=4 415 B9R0.79 C[C@H](O)[C@H](C)[C@H](N)C(=O)O MCULE-4005119004 [1,1,0,0,0,0|1,0,1]=4 416 B9R0.79 [C@@H](N)(C(=O)O)[C@@H](C)C(C)O MCULE-7488780154 [1,1,0,0,0,0|1,0,1]=4 417 B9R0.19 CC(C)(CO)C(=O)CC#N MCULE-8443347297 [1,1,0,0,0,0|1,0,1]=4 418 B9R0.19 CCOC(=O)C(C)(C)CO MCULE-4450228796 [1,1,0,0,0,0|1,0,1]=4 419 B9R0.60 COC(=O)C(C)(C)CCO MCULE-8244412814 [1,1,0,0,0,0|2,0,0]=4 420 B9R0.60 COCC(C)(C)C(=O)OC MCULE-3637426085 [1,1,0,0,0,0|2,0,0]=4 421 B9R0.69 COC(=O)C(C)(CO)CO MCULE-3441914987 [1,1,0,0,0,0|2,0,0]=4 422 B9R0.72 CC(C)(C)C(CN)C(=O)O MCULE-1814717719 [1,1,0,0,0,0|1,0,1]=4 423 B9R0.72 CC(C)(C)C(CN)C(=O)O MCULE-3258847627 [1,1,0,0,0,0|1,0,1]=4 424 B9R0.72 CC(C)(C)[C@@H](CN)C(=O)O MCULE-3007742472 [1,1,0,0,0,0|1,0,1]=4 425 B9R0.72 CC(C)(C)[C@@H](CN)C(=O)O MCULE-6149552678 [1,1,0,0,0,0|1,0,1]=4 426 B9R0.72 CC(C)(C)[C@H](CN)C(=O)O MCULE-1430277271 [1,1,0,0,0,0|1,0,1]=4 427 B9R0.72 CC(C)(C)[C@H](CN)C(=O)O MCULE-7160833387 [1,1,0,0,0,0|1,0,1]=4 428 B9R0.72 CNC(C(=O)O)C(C)(C)O MCULE-9955166228 [1,1,0,0,0,0|1,0,1]=4 429 B9R0.72 COC(C(=O)O)C(C)(C)C MCULE-2556771977 [1,1,0,0,0,0|0,0,2]=4 430 B9R0.72 CSC(C(=O)O)C(C)(C)C MCULE-6524033146 [1,1,0,0,0,0|0,1,1]=4 431 B9R0.80 CC(C)(C)C(C)(C)C(=O)O MCULE-3500693535 [1,1,0,0,0,0|1,0,1]=4 432 B9R0.80 CC(C)(C)C(C)(N)C(=O)O MCULE-3988446243 [1,1,0,0,0,0|1,0,1]=4 433 B9R0.80 CC(C)(C)C(C)(N)C(=O)O MCULE-7919587109 [1,1,0,0,0,0|1,0,1]=4 434 B9R0.80 CC(C)(C)[C@@](C)(N)C(=O)O MCULE-3756983669 [1,1,0,0,0,0|1,0,1]=4 435 B9R0.80 CC(C)(O)C(F)(F)C(=O)O MCULE-9755377954 [1,1,0,0,0,0|1,0,1]=4 436 B9R0.11 CC(C)(CC(=O)O)C(=O)O MCULE-7005043054 [1,1,0,0,0,0|0,0,2]=4 437 B9R0.11 CC(C)(CC(=O)O)C(F)F MCULE-3977275616 [1,1,0,0,0,0|1,0,1]=4 438 B9R0.22 CC(C)(CO)NC(=O)CCl MCULE-9318061619 [1,1,0,0,0,0|2,0,0]=4 439 B9R0.22 CC(C)(CO)NC(=O)CN MCULE-2929837789 [1,1,0,0,0,0|2,0,0]=4 440 B9R0.22 CC(C)(CO)NC(=O)CN MCULE-8779999945 [1,1,0,0,0,0|2,0,0]=4 441 B9R0.22 CCC(C)(C)CC(=O)OC MCULE-9086898294 [1,1,0,0,0,0|1,0,1]=4 442 B9R0.22 COC(=O)CC(C)(C)CN MCULE-1994410298 [1,1,0,0,0,0|1,0,1]=4 443 B9R0.22 COC(=O)CC(C)(C)CN MCULE-9711171520 [1,1,0,0,0,0|1,0,1]=4 444 B9R0.58 C=CCC(C)(C)CC(=O)O MCULE-3859494910 [1,1,0,0,0,0|1,0,1]=4 445 B9R0.58 CC(O)(CCO)CC(=O)O MCULE-1728546222 [1,1,0,0,0,0|1,0,1]=4 446 B9R0.58 CCCC(C)(C)CC(=O)O MCULE-3472003458 [1,1,0,0,0,0|1,0,1]=4 447 B9R0.58 CNCC(C)(C)CC(=O)O MCULE-9673126610 [1,1,0,0,0,0|1,0,1]=4 448 B9R0.58 COCC(C)(C)CC(=O)O MCULE-3020905492 [1,1,0,0,0,0|0,0,1]=3 449 B9R0.58 C[C@](O)(CCO)CC(=O)O MCULE-1986337120 [1,1,0,0,0,0|1,0,1]=4 450 B9R0.58 C[C@](O)(CCO)CC(=O)O MCULE-8476600793 [1,1,0,0,0,0|1,0,1]=4 451 B9R0.63 CC(C#N)(CO)CC(=O)O MCULE-7644811798 [1,1,0,0,0,0|0,0,2]=4 452 B9R0.63 CC(CN)(CO)CC(=O)O MCULE-3238773867 [1,1,0,0,0,0|0,0,1]=3 453 B9R0.63 CC(CN)(CO)CC(=O)O MCULE-9021134491 [1,1,0,0,0,0|0,0,1]=3 454 B9R1.3 CC1CCCC(=O)C1=O MCULE-3677088238 [1,0,0,1,0,0|2,0,0]=4 455 B9R1.37 CC1=C(C(OC1=O)O)C MCULE-1024110805 [1,0,0,1,0,0|1,0,1]=4 456 B9R1.37 CC1CC(=O)C(=O)C1C MCULE-1553900326 [1,0,0,1,0,0|2,0,0]=4 457 B9R1.96 O=C(O)C1CCC1CO MCULE-9648982851 [1,0,0,1,0,0|1,0,1]=4 458 B9R1.110 C(N)(C(=O)O)C1COC1 MCULE-5400337176 [1,0,0,1,0,0|1,0,1]=4 459 B9R1.110 C=C(C(=O)O)C1CCC1 MCULE-2578265979 [1,0,0,1,0,0|2,0,0]=4 460 B9R1.110 CC(C(=O)O)C1COC1 MCULE-1438881074 [1,0,0,1,0,0|1,0,1]=4 461 B9R1.110 NC(C(=O)O)C1COC1 MCULE-1331194239 [1,0,0,1,0,0|1,0,1]=4 462 B9R1.110 N[C@@H](C(=O)O)C1COC1 MCULE-4389145324 [1,0,0,1,0,0|1,0,1]=4 463 B9R1.110 N[C@@H](C(=O)O)C1COC1 MCULE-4852474986 [1,0,0,1,0,0|1,0,1]=4 464 B9R1.110 N[C@H](C(=O)O)C1COC1 MCULE-3016057788 [1,0,0,1,0,0|1,0,1]=4 465 B9R1.110 N[C@H](C(=O)O)C1COC1 MCULE-8770476335 [1,0,0,1,0,0|1,0,1]=4 466 B9R1.110 O=C(O)C(=O)C1CCC1 MCULE-3680158952 [1,0,0,1,0,0|1,0,0]=3 467 B9R1.110 O=C(O)C(=O)N1CCC1 MCULE-2155911842 [1,0,0,1,0,0|2,0,0]=4 468 B9R1.111 O=C(O)C(=O)C1(CC1)F MCULE-2939361516 [1,0,0,1,0,0|2,0,0]=4 469 B9R1.132 CN1C(=O)OCC1CO MCULE-8007610205 [1,0,0,1,0,0|2,0,0]=4 470 B9R1.40 CC1(CCC=CC1=O)C MCULE-1811364024 [1,0,0,1,0,0|2,0,0]=4 471 B9R1.40 CC1(COC=CC1=O)C MCULE-6422133092 [1,0,0,1,0,0|1,0,0]=3 472 B9R1.40 CC1(COCCC1=O)C MCULE-2901452802 [1,0,0,1,0,0|1,0,1]=4 473 B9R1.106 CC1(C(=O)CCC1O)C MCULE-3636393805 [1,0,0,1,0,0|1,0,1]=4 474 B9R1.186 CC1(COC1)C(=O)NN MCULE-8411000980 [1,0,0,1,0,0|2,0,0]=4 475 B9R1.186 COC(=O)C1(COC1)C MCULE-3679844068 [1,0,0,1,0,0|2,0,0]=4 476 B9R1.190 CNC(=O)C1(CC1)CO MCULE-1475265525 [1,0,0,1,0,0|2,0,0]=4 477 B9R1.190 COC(=O)C1(CC1)CO MCULE-4380084932 [1,0,0,1,0,0|2,0,0]=4 478 B9R1.202 CC1(CCNC1=O)CO MCULE-3034841692 [1,0,0,1,0,0|2,0,0]=4 479 B9R1.166 C1(NCC1(C)C)C(=O)O MCULE-8091738282 [1,0,0,1,0,0|1,0,1]=4 480 B9R1.166 CC1(CCC1C(=O)O)C MCULE-4099946993 [1,0,0,1,0,0|1,0,1]=4 481 B9R1.166 CC1(CNC1C(=O)O)C MCULE-8386082188 [1,0,0,1,0,0|1,0,1]=4 482 B9R1.166 CC1(CNC1C(=O)O)C MCULE-9067770862 [1,0,0,1,0,0|1,0,1]=4 483 B9R1.166 CC1(CN[C@@H]1C(=O)O)C MCULE-3707363843 [1,0,0,1,0,0|1,0,1]=4 484 B9R1.166 CC1(CN[C@@H]1C(=O)O)C MCULE-5671349948 [1,0,0,1,0,0|1,0,1]=4 485 B9R1.166 CC1(CN[C@H]1C(=O)O)C MCULE-3480839319 [1,0,0,1,0,0|1,0,1]=4 486 B9R1.38 CC1(NC(=O)CC1O)C MCULE-8306254701 [1,0,0,1,0,0|2,0,0]=4 487 B9R1.38 CC1OC(=O)CC1(C)C MCULE-2629079906 [1,0,0,1,0,0|1,0,1]=4 488 B9R1.44 CC1(CC1F)CC(=O)O MCULE-2399259815 [1,0,0,1,0,0|1,0,1]=4 489 B9R1.66 CC1(CCOC(=O)C1)C MCULE-4727187858 [1,0,0,1,0,0|1,0,1]=4 490 B9R1.66 CC1(COCC(=O)C1)C MCULE-9899246450 [1,0,0,1,0,0|1,0,1]=4 491 B9R1.66 CC1(COCC(=O)N1)C MCULE-4764218630 [1,0,0,1,0,0|2,0,0]=4 492 B9R1.125 CC1(CCC(=O)N1)CO MCULE-9700105207 [1,0,0,1,0,0|2,0,0]=4 493 B9R1.125 CC1(CNC(=O)C1)CO MCULE-1633429143 [1,0,0,1,0,0|1,0,1]=4 494 B9R1.125 CC1(COC(=O)C1)CO MCULE-2278000717 [1,0,0,1,0,0|0,0,1]=3 495 B9R1.125 CC1(COC(=O)N1)CI MCULE-2242952890 [1,0,0,1,0,0|2,0,0]=4 496 B9R1.125 CC1(COC(=O)N1)CN MCULE-6928291098 [1,0,0,1,0,0|2,0,0]=4 497 B9R1.125 CC1(COC(=O)N1)CO MCULE-7873521103 [1,0,0,1,0,0|1,0,0]=3 498 B9R1.125 CC1=NC(CO1)(C)CO MCULE-3331389349 [1,0,0,1,0,0|2,0,0]=4 499 B9R1.128 NCC1(CC1)CC(=O)O MCULE-5672358915 [1,0,0,1,0,0|1,0,1]=4 500 B9R1.128 NCC1(CC1)CC(=O)O MCULE-9536586933 [1,0,0,1,0,0|1,0,1]=4 501 B9R1.128 O=C(O)CC1(CC1)CO MCULE-8706737331 [1,0,0,1,0,0|0,0,1]=3 502 B9R1.128 O=C(O)CC1(CC1)CS MCULE-2805511819 [1,0,0,1,0,0|0,1,1]=4 503 B9R1.171 CC1(CCC1)CC(=O)O MCULE-7933536922 [1,0,0,1,0,0|1,0,1]=4 504 B9R1.171 CC1(COC1)CC(=O)O MCULE-6717906096 [1,0,0,1,0,0|0,0,1]=3 505 B9R1.171 CC1(COC1)CC(=O)[O-] MCULE-9614788106 [1,0,0,1,0,0|0,0,2]=4 506 B9R1.171 NC1(COC1)CC(=O)O MCULE-7347209492 [1,0,0,1,0,0|1,0,1]=4 507 B9R1.171 O=C(O)CC1(COC1)F MCULE-8446148413 [1,0,0,1,0,0|1,0,1]=4 508 B11R1.677 CC1(C(CC1CC(=O)O)O)C MCULE-4359794974 [0,0,0,1,0,1|1,0,1]=4 509 B11R1.730 CC1(CCC=C(C1)C(=O)O)C MCULE-7732020212 [0,0,0,1,0,1|2,0,0]=4 510 B11R1.730 CC1(COCC(N1)C(=O)O)C MCULE-9878578908 [0,0,0,1,0,1|1,0,1]=4 511 B11R1.730 CC1(COCC(O1)C(=O)O)C MCULE-8209803482 [0,0,0,1,0,1|1,0,1]=4 512 B11R1.854 COC(=O)C1CC(C1(C)C)O MCULE-1366498997 [0,1,0,1,0,0|1,0,1]=4 513 B11R1.854 COC(=O)[C@@H]1C[C@@H](C1(C)C)O MCULE-2688469486 [0,1,0,1,0,0|1,0,1]=4 514 B11R1.854 COC(=O)[C@@H]1C[C@@H](C1(C)C)O MCULE-6565339766 [0,1,0,1,0,0|1,0,1]=4 515 B11R1.854 COC(=O)[C@@H]1C[C@H](C1(C)C)O MCULE-4218623180 [0,1,0,1,0,0|1,0,1]=4 516 B11R1.854 COC(=O)[C@H]1C[C@H](C1(C)C)O MCULE-3853552624 [0,1,0,1,0,0|1,0,1]=4 517 B11R1.854 COC(=O)[C@H]1C[C@H](C1(C)C)O MCULE-7140466216 [0,1,0,1,0,0|1,0,1]=4 518 B11R1.854 [C@@H]1(C[C@H](C1(C)C)O)C(=O)OC MCULE-1817420342 [0,1,0,1,0,0|1,0,1]=4 519 B11R1.177 CC1(COCCC1C(=O)O)C MCULE-5824022501 [0,1,0,1,0,0|1,0,1]=4 520 B11R1.1110 CC1(CC1(Cl)Cl)C(=O)C(=O)N MCULE-1372727206 [0,1,0,1,0,0|2,0,0]=4 521 B9R0.23 CCC(C)C(=O)CC(=O)C MCULE-8072360859 [1,0,0,0,0,1|2,0,0]=4 522 B9R0.42 C=C(C)C(=O)OC(C)CO MCULE-3069032725 [1,0,0,0,0,1|2,0,0]=4 523 B9R0.42 CC(CO)CC(N)C(=O)O MCULE-1659842949 [1,0,0,0,0,1|1,0,1]=4 524 B9R0.42 CCC(C)NC(=O)C(=O)O MCULE-6488437367 [1,0,0,0,0,1|1,0,0]=3 525 B9R0.10 C/C(=C\C(=O)N)/C(C)(C)C MCULE-7362991011 [1,0,0,0,0,1|2,0,0]=4 526 B9R0.10 C/C(=C\C(=O)O)/C(C)(C)C MCULE-2172546258 [1,0,0,0,0,1|1,0,0]=3 527 B9R0.10 CC(=CC(=O)N)C(C)(C)C MCULE-3746818709 [1,0,0,0,0,1|2,0,0]=4 528 B9R0.10 CC(=CC(=O)O)C(C)(C)C MCULE-6247723647 [1,0,0,0,0,1|1,0,0]=3 529 B9R0.10 CC(=O)CC(=O)C(C)(C)C MCULE-4002232840 [1,0,0,0,0,1|1,0,0]=3 530 B9R0.10 CC(C)(C)C(N)CC(=O)O MCULE-6654125396 [1,0,0,0,0,1|1,0,1]=4 531 B9R0.10 CC(C)(C)C(N)CC(=O)O MCULE-6842051841 [1,0,0,0,0,1|1,0,1]=4 532 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O MCULE-5408253054 [1,0,0,0,0,1|1,0,1]=4 533 B9R0.10 CC(C)(C)[C@@H](N)CC(=O)O MCULE-6704022659 [1,0,0,0,0,1|1,0,1]=4 534 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O MCULE-4579899518 [1,0,0,0,0,1|1,0,1]=4 535 B9R0.10 CC(C)(C)[C@H](N)CC(=O)O MCULE-4645205176 [1,0,0,0,0,1|1,0,1]=4 536 B9R0.10 CC(CC(=O)O)C(C)(C)C MCULE-4114895909 [1,0,0,0,0,1|1,0,1]=4 537 B9R0.10 CC(CC(=O)O)C(C)(C)O MCULE-5216715591 [1,0,0,0,0,1|1,0,1]=4 538 B9R0.10 CS(=O)CC(=O)C(C)(C)C MCULE-6922331739 [1,0,0,0,0,1|2,0,0]=4 539 B9R0.10 [C@@H](N)(CC(=O)O)C(C)(C)C MCULE-5327849230 [1,0,0,0,0,1|1,0,1]=4 540 B9R0.57 C=C(C)C(=O)NC(C)(C)C MCULE-5867038626 [1,0,0,0,0,1|2,0,0]=4 541 B9R0.57 C=C(C)C(=O)OC(C)(C)C MCULE-6622794833 [1,0,0,0,0,1|2,0,0]=4 542 B9R0.57 C=C(F)C(=O)OC(C)(C)C MCULE-7121491302 [1,0,0,0,0,1|2,0,0]=4 543 B9R0.57 CC(=O)C(=O)OC(C)(C)C MCULE-1173308844 [1,0,0,0,0,1|1,0,0]=3 544 B9R0.57 CC(C)(C)CC(=O)C(=O)O MCULE-5877446185 [1,0,0,0,0,1|0,0,0]=2 545 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-1846409149 [1,0,0,0,0,1|1,0,1]=4 546 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-6496394437 [1,0,0,0,0,1|1,0,1]=4 547 B9R0.57 CC(C)(C)CC(N)C(=O)O MCULE-6507277407 [1,0,0,0,0,1|1,0,1]=4 548 B9R0.57 CC(C)(C)CC(O)C(=O)O MCULE-2158861127 [1,0,0,0,0,1|0,0,2]=4 549 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O MCULE-6215032420 [1,0,0,0,0,1|1,0,1]=4 550 B9R0.57 CC(C)(C)C[C@@H](N)C(=O)O MCULE-8005575699 [1,0,0,0,0,1|1,0,1]=4 551 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O MCULE-1515081556 [1,0,0,0,0,1|1,0,1]=4 552 B9R0.57 CC(C)(C)C[C@H](N)C(=O)O MCULE-3358775275 [1,0,0,0,0,1|1,0,1]=4 553 B9R0.57 CC(C)(C)NC(=O)C(=O)N MCULE-9051715230 [1,0,0,0,0,1|1,0,0]=3 554 B9R0.57 CC(C)(C)NC(=O)C(=O)O MCULE-6289295285 [1,0,0,0,0,1|0,0,0]=2 555 B9R0.57 CC(C)(C)OC(=O)C(=O)Cl MCULE-2313626021 [1,0,0,0,0,1|1,0,0]=3 556 B9R0.57 CC(C)(C)OC(=O)C(=O)N MCULE-7593631374 [1,0,0,0,0,1|1,0,0]=3 557 B9R0.57 CC(C)(C)OC(=O)C(=O)O MCULE-9176016955 [1,0,0,0,0,1|0,0,0]=2 558 B9R0.57 CC(C)(C)OC(=O)C(=O)[O-] MCULE-3028924355 [1,0,0,0,0,1|0,0,1]=3 559 B9R0.57 CC(C)(C)OC(=O)C(=S)N MCULE-8566827320 [1,0,0,0,0,1|1,1,0]=4 560 B9R0.57 CC(C)(C)OC(=O)C(O)O MCULE-9640448193 [1,0,0,0,0,1|0,0,2]=4 561 B9R0.57 CC(CC(C)(C)C)C(=O)O MCULE-1654401215 [1,0,0,0,0,1|1,0,1]=4 562 B9R0.57 CC(NC(C)(C)C)C(=O)O MCULE-8104914924 [1,0,0,0,0,1|1,0,1]=4 563 B9R0.57 CC(NC(C)(C)C)C(=O)O MCULE-8686537841 [1,0,0,0,0,1|1,0,1]=4 564 B9R0.57 CC(O)C(=O)OC(C)(C)C MCULE-8118139390 [1,0,0,0,0,1|1,0,1]=4 565 B9R0.57 CC(O)C(=O)OC(C)(C)C MCULE-9526190907 [1,0,0,0,0,1|1,0,1]=4 566 B9R0.57 CC(OC(C)(C)C)C(=O)O MCULE-8310959538 [1,0,0,0,0,1|1,0,1]=4 567 B9R0.57 CN(O)C(=O)OC(C)(C)C MCULE-3953683753 [1,0,0,0,0,1|2,0,0]=4 568 B9R0.57 CS(=O)(=NC(=O)C(=O)O)C MCULE-5865028854 [1,0,0,0,0,1|1,0,1]=4 569 B9R0.57 C[C@@H](O)C(=O)OC(C)(C)C MCULE-5595398573 [1,0,0,0,0,1|1,0,1]=4 570 B9R0.57 C[C@@H](O)C(=O)OC(C)(C)C MCULE-8607887563 [1,0,0,0,0,1|1,0,1]=4 571 B9R0.57 C[C@H](O)C(=O)OC(C)(C)C MCULE-5044893123 [1,0,0,0,0,1|1,0,1]=4 572 B9R0.57 C[C@H](O)C(=O)OC(C)(C)C MCULE-8230448493 [1,0,0,0,0,1|1,0,1]=4 573 B9R0.64 CC(C)(CO)COC(=O)N MCULE-1642548295 [1,0,0,0,0,1|1,0,1]=4 574 B9R0.64 CCC(C)(C)OCC(=O)O MCULE-6870018986 [1,0,0,0,0,1|1,0,1]=4