0 B7R0.13 C#CC(C)(C)C(=O)O MCULE-4971472343 [0,0,0,0,0,0|1,0,2]=3 1 B7R0.13 C=CC(C)(C)C(=O)O MCULE-4029204507 [0,0,0,0,0,0|1,0,2]=3 2 B7R0.13 C=CC(C)(O)C(=O)O MCULE-2362688567 [0,0,0,0,0,0|1,0,2]=3 3 B7R0.13 C=C[C@@](C)(N)C(=O)O MCULE-4703482436 [0,0,0,0,0,0|0,0,2]=2 4 B7R0.13 CC(=O)C(C)(C)C#N MCULE-1850672063 [0,0,0,0,0,0|3,0,1]=4 5 B7R0.13 CC(=O)C(C)(C)CO MCULE-7885820738 [0,0,0,0,0,0|3,0,0]=3 6 B7R0.13 CC(=O)C(F)(F)CBr MCULE-6144124710 [0,0,0,0,0,0|4,0,0]=4 7 B7R0.13 CC(Br)(CBr)C(=O)O MCULE-1859698457 [0,0,0,0,0,0|2,0,0]=2 8 B7R0.13 CC(Br)(CO)N(=O)=O MCULE-7018173037 [0,0,0,0,0,0|3,0,1]=4 9 B7R0.13 CC(C)(C#N)C(=O)N MCULE-9366288195 [0,0,0,0,0,0|3,0,1]=4 10 B7R0.13 CC(C)(C#N)C(=O)O MCULE-8297007076 [0,0,0,0,0,0|2,0,1]=3 11 B7R0.13 CC(C)(CBr)C(=O)Cl MCULE-2173837084 [0,0,0,0,0,0|3,0,0]=3 12 B7R0.13 CC(C)(CBr)C(=O)F MCULE-3596602192 [0,0,0,0,0,0|3,0,0]=3 13 B7R0.13 CC(C)(CBr)C(=O)N MCULE-5685972374 [0,0,0,0,0,0|3,0,0]=3 14 B7R0.13 CC(C)(CBr)C(=O)O MCULE-2715950010 [0,0,0,0,0,0|2,0,0]=2 15 B7R0.13 CC(C)(CCl)C(=O)O MCULE-2346120215 [0,0,0,0,0,0|2,0,0]=2 16 B7R0.13 CC(C)(CF)C(=O)O MCULE-5866229087 [0,0,0,0,0,0|2,0,0]=2 17 B7R0.13 CC(C)(CN)C(=O)N MCULE-6885361465 [0,0,0,0,0,0|3,0,0]=3 18 B7R0.13 CC(C)(CN)C(=O)O MCULE-1750685187 [0,0,0,0,0,0|2,0,0]=2 19 B7R0.13 CC(C)(CN)C(=O)O MCULE-7138204669 [0,0,0,0,0,0|2,0,0]=2 20 B7R0.13 CC(C)(CO)C(=O)O MCULE-8700273400 [0,0,0,0,0,0|2,0,0]=2 21 B7R0.13 CC(C)(CO)N(=O)=O MCULE-6787663159 [0,0,0,0,0,0|3,0,1]=4 22 B7R0.13 CC(C)(ON)C(=O)O MCULE-3628409953 [0,0,0,0,0,0|3,0,0]=3 23 B7R0.13 CC(C)(ON)C(=O)O MCULE-4840137554 [0,0,0,0,0,0|3,0,0]=3 24 B7R0.13 CC(C)C(C)(N)CN MCULE-2884198159 [0,0,0,0,0,0|3,0,1]=4 25 B7R0.13 CC(Cl)(CCl)C(=O)O MCULE-9297172670 [0,0,0,0,0,0|2,0,0]=2 26 B7R0.13 CC(N)(CO)C(=O)O MCULE-5973815630 [0,0,0,0,0,0|1,0,0]=1 27 B7R0.13 CC(N)(CO)C(=O)O MCULE-6877149014 [0,0,0,0,0,0|1,0,0]=1 28 B7R0.13 CC(N)(CS)C(=O)O MCULE-4669241619 [0,0,0,0,0,0|1,0,0]=1 29 B7R0.13 CC(N)(CS)C(=O)O MCULE-8539612367 [0,0,0,0,0,0|1,0,0]=1 30 B7R0.13 CC(O)(CBr)C(=O)O MCULE-4224343890 [0,0,0,0,0,0|2,0,0]=2 31 B7R0.13 CC(O)(CBr)C(=O)O MCULE-5597565903 [0,0,0,0,0,0|2,0,0]=2 32 B7R0.13 CC(O)(CO)C(=O)O MCULE-5566145169 [0,0,0,0,0,0|2,0,0]=2 33 B7R0.13 CC(O)C(C)(C)CN MCULE-2675460571 [0,0,0,0,0,0|3,0,1]=4 34 B7R0.13 CC(O)C(C)(C)CO MCULE-1064066796 [0,0,0,0,0,0|3,0,1]=4 35 B7R0.13 CCC(C)(Br)B(O)O MCULE-2332813193 [0,0,0,0,0,0|2,0,1]=3 36 B7R0.13 CCC(C)(Br)C(=O)Br MCULE-8711399189 [0,0,0,0,0,0|2,0,0]=2 37 B7R0.13 CCC(C)(Br)C(=O)O MCULE-2564629085 [0,0,0,0,0,0|1,0,0]=1 38 B7R0.13 CCC(C)(C)C(=O)C MCULE-3647111938 [0,0,0,0,0,0|2,0,0]=2 39 B7R0.13 CCC(C)(C)C(=O)Cl MCULE-7950206740 [0,0,0,0,0,0|2,0,0]=2 40 B7R0.13 CCC(C)(C)C(=O)O MCULE-2539552186 [0,0,0,0,0,0|1,0,0]=1 41 B7R0.13 CCC(C)(C)C(C)N MCULE-8507623985 [0,0,0,0,0,0|3,0,1]=4 42 B7R0.13 CCC(C)(C)C(C)N MCULE-9937664897 [0,0,0,0,0,0|3,0,1]=4 43 B7R0.13 CCC(C)(C)S(=O)N MCULE-1907765063 [0,0,0,0,0,0|3,0,0]=3 44 B7R0.13 CCC(C)(C)[S@@](=O)N MCULE-2523817278 [0,0,0,0,0,0|3,0,0]=3 45 B7R0.13 CCC(C)(C)[S@@](=O)N MCULE-5923909544 [0,0,0,0,0,0|3,0,0]=3 46 B7R0.13 CCC(C)(C)[S@](=O)N MCULE-9246547080 [0,0,0,0,0,0|3,0,0]=3 47 B7R0.13 CCC(C)(C)[S@](=O)N MCULE-9419544831 [0,0,0,0,0,0|3,0,0]=3 48 B7R0.13 CCC(C)(N)C(=O)N MCULE-6399521661 [0,0,0,0,0,0|1,0,0]=1 49 B7R0.13 CCC(C)(N)C(=O)O MCULE-4944905519 [0,0,0,0,0,0|0,0,0]=0 50 B7R0.13 CCC(C)(N)C(=O)O MCULE-8684474701 [0,0,0,0,0,0|0,0,0]=0 51 B7R0.13 CCC(C)(N)C(=O)O MCULE-9925925283 [0,0,0,0,0,0|0,0,0]=0 52 B7R0.13 CCC(C)(O)C(=O)C MCULE-5532598723 [0,0,0,0,0,0|2,0,0]=2 53 B7R0.13 CCC(C)(O)C(=O)Cl MCULE-2893490565 [0,0,0,0,0,0|2,0,0]=2 54 B7R0.13 CCC(C)(O)C(=O)N MCULE-7082405574 [0,0,0,0,0,0|2,0,0]=2 55 B7R0.13 CCC(C)(O)C(=O)O MCULE-1193062860 [0,0,0,0,0,0|1,0,0]=1 56 B7R0.13 CCC(C)(O)C(C)O MCULE-5475978311 [0,0,0,0,0,0|2,0,1]=3 57 B7R0.13 CCC(F)(Br)C(=O)O MCULE-8280947459 [0,0,0,0,0,0|2,0,0]=2 58 B7R0.13 CCC(F)(F)C(=O)O MCULE-3712601150 [0,0,0,0,0,0|2,0,0]=2 59 B7R0.13 CCC(F)(F)C(=O)[O-] MCULE-3572838764 [0,0,0,0,0,0|2,0,1]=3 60 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-4076270773 [0,0,0,0,0,0|0,0,0]=0 61 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-4696366287 [0,0,0,0,0,0|0,0,0]=0 62 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-7243626223 [0,0,0,0,0,0|0,0,0]=0 63 B7R0.13 CC[C@@](C)(N)C(=O)O MCULE-8928070809 [0,0,0,0,0,0|0,0,0]=0 64 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-1912860688 [0,0,0,0,0,0|0,0,0]=0 65 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-3601494140 [0,0,0,0,0,0|0,0,0]=0 66 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-4886902354 [0,0,0,0,0,0|0,0,0]=0 67 B7R0.13 CC[C@](C)(N)C(=O)O MCULE-8271138085 [0,0,0,0,0,0|0,0,0]=0 68 B7R0.13 CC[C@](C)(O)C(=O)O MCULE-3871181536 [0,0,0,0,0,0|1,0,0]=1 69 B7R0.13 CNC(C)(C)C(=O)N MCULE-6402593977 [0,0,0,0,0,0|3,0,0]=3 70 B7R0.13 CNC(C)(C)C(=O)N MCULE-9381926111 [0,0,0,0,0,0|3,0,0]=3 71 B7R0.13 CNC(C)(C)C(=O)O MCULE-7551663553 [0,0,0,0,0,0|2,0,0]=2 72 B7R0.13 CNC(C)(C)C(=O)O MCULE-9856262226 [0,0,0,0,0,0|2,0,0]=2 73 B7R0.13 COC(C)(C)C(=O)C MCULE-2989232242 [0,0,0,0,0,0|3,0,0]=3 74 B7R0.13 COC(C)(C)C(=O)N MCULE-4305162688 [0,0,0,0,0,0|3,0,0]=3 75 B7R0.13 COC(C)(C)C(=O)O MCULE-6977996423 [0,0,0,0,0,0|2,0,0]=2 76 B7R0.13 COC(C)(C)C(=S)N MCULE-5301285466 [0,0,0,0,0,0|3,1,0]=4 77 B7R0.13 CSC(C)(C)C(=O)O MCULE-1032417728 [0,0,0,0,0,0|2,0,0]=2 78 B7R0.13 C[C@@](N)(CO)C(=O)O MCULE-2146963065 [0,0,0,0,0,0|1,0,0]=1 79 B7R0.13 C[C@@](N)(CO)C(=O)O MCULE-7622447669 [0,0,0,0,0,0|1,0,0]=1 80 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-2627761655 [0,0,0,0,0,0|1,0,0]=1 81 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-2887268414 [0,0,0,0,0,0|1,0,0]=1 82 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-6190318443 [0,0,0,0,0,0|1,0,0]=1 83 B7R0.13 C[C@@](N)(CS)C(=O)O MCULE-8033021501 [0,0,0,0,0,0|1,0,0]=1 84 B7R0.13 C[C@@](O)(CBr)C(=O)O MCULE-2382162129 [0,0,0,0,0,0|2,0,0]=2 85 B7R0.13 C[C@@](O)(CBr)C(=O)O MCULE-7944927738 [0,0,0,0,0,0|2,0,0]=2 86 B7R0.13 C[C@](N)(CO)C(=O)O MCULE-2760852916 [0,0,0,0,0,0|1,0,0]=1 87 B7R0.13 C[C@](N)(CO)C(=O)O MCULE-4734633152 [0,0,0,0,0,0|1,0,0]=1 88 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-1527310768 [0,0,0,0,0,0|1,0,0]=1 89 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-4351926054 [0,0,0,0,0,0|1,0,0]=1 90 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-6261566257 [0,0,0,0,0,0|1,0,0]=1 91 B7R0.13 C[C@](N)(CS)C(=O)O MCULE-9035242130 [0,0,0,0,0,0|1,0,0]=1 92 B7R0.13 C[C@](O)(CBr)C(=O)O MCULE-1143505996 [0,0,0,0,0,0|2,0,0]=2 93 B7R0.13 C[C@](O)(CBr)C(=O)O MCULE-7898456152 [0,0,0,0,0,0|2,0,0]=2 94 B7R0.13 NCC(F)(F)C(=O)N MCULE-1522301920 [0,0,0,0,0,0|4,0,0]=4 95 B7R0.13 NCC(F)(F)C(=O)N MCULE-2239490291 [0,0,0,0,0,0|4,0,0]=4 96 B7R0.13 NCC(F)(F)C(=O)O MCULE-3688560337 [0,0,0,0,0,0|3,0,0]=3 97 B7R0.13 NCC(F)(F)C(=O)O MCULE-9077054646 [0,0,0,0,0,0|3,0,0]=3 98 B7R0.13 O=C(Cl)C(F)(Cl)CCl MCULE-8770305626 [0,0,0,0,0,0|4,0,0]=4 99 B7R0.13 O=C(O)C(Cl)(Cl)CCl MCULE-4394770604 [0,0,0,0,0,0|3,0,0]=3 100 B7R0.13 O=C(O)C(F)(F)CO MCULE-4913704401 [0,0,0,0,0,0|3,0,0]=3 101 B6R0.3 C#CC(O)C(=O)O MCULE-4214673632 [1,0,0,0,0,0|1,0,2]=4 102 B6R0.3 C(C)(OC)C(=O)O MCULE-4852209230 [1,0,0,0,0,0|1,0,0]=2 103 B6R0.3 C(N)(CO)C(=O)N MCULE-5512645571 [1,0,0,0,0,0|2,0,0]=3 104 B6R0.3 C(N)(CO)C(=O)N MCULE-5852943337 [1,0,0,0,0,0|2,0,0]=3 105 B6R0.3 C/C=C(/C)\C(=O)O MCULE-2116066534 [1,0,0,0,0,0|0,0,2]=3 106 B6R0.3 C/C=C(\Br)/C(=O)O MCULE-5940308548 [1,0,0,0,0,0|1,0,2]=4 107 B6R0.3 C/C=C(\C)/C(=O)O MCULE-4890719796 [1,0,0,0,0,0|0,0,2]=3 108 B6R0.3 C/C=C(\O)/C(=O)O MCULE-9596699660 [1,0,0,0,0,0|1,0,2]=4 109 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [1,0,0,0,0,0|2,0,0]=3 110 B6R0.3 C=C(CBr)C(=O)O MCULE-7257367588 [1,0,0,0,0,0|1,0,2]=4 111 B6R0.3 C=C(CC)C(=O)O MCULE-7335567367 [1,0,0,0,0,0|0,0,2]=3 112 B6R0.3 C=C(CO)C(=O)O MCULE-9731648602 [1,0,0,0,0,0|1,0,2]=4 113 B6R0.3 C=C(I)C(C)CI MCULE-8558127481 [1,0,0,0,0,0|3,0,0]=4 114 B6R0.3 C=C(I)[C@H](C)CI MCULE-1089285398 [1,0,0,0,0,0|3,0,0]=4 115 B6R0.3 C=C(I)[C@H](C)CI MCULE-5444456468 [1,0,0,0,0,0|3,0,0]=4 116 B6R0.3 C=C(OC)C(=O)O MCULE-9965334560 [1,0,0,0,0,0|1,0,2]=4 117 B6R0.3 C=CC(C)C(=O)O MCULE-7280145889 [1,0,0,0,0,0|0,0,2]=3 118 B6R0.3 C=CC(N)C(=O)O MCULE-2000511750 [1,0,0,0,0,0|0,0,2]=3 119 B6R0.3 C=CC(N)C(=O)O MCULE-7504415267 [1,0,0,0,0,0|0,0,2]=3 120 B6R0.3 C=CC(N)C(=O)O MCULE-9012490000 [1,0,0,0,0,0|0,0,2]=3 121 B6R0.3 C=CC(N)C(=O)O MCULE-9978294266 [1,0,0,0,0,0|0,0,2]=3 122 B6R0.3 C=CC(O)C(=O)O MCULE-3847595710 [1,0,0,0,0,0|1,0,2]=4 123 B6R0.3 C=C[C@@H](C)C(=O)O MCULE-9719548038 [1,0,0,0,0,0|0,0,2]=3 124 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-3678761806 [1,0,0,0,0,0|0,0,2]=3 125 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6682447306 [1,0,0,0,0,0|0,0,2]=3 126 B6R0.3 C=C[C@@H](N)C(=O)O MCULE-6779191781 [1,0,0,0,0,0|0,0,2]=3 127 B6R0.3 C=C[C@H](C)C(=O)O MCULE-1694697840 [1,0,0,0,0,0|0,0,2]=3 128 B6R0.3 C=C[C@H](C)C(=O)O MCULE-2601438258 [1,0,0,0,0,0|0,0,2]=3 129 B6R0.3 C=C[C@H](C)C(=O)O MCULE-6098133430 [1,0,0,0,0,0|0,0,2]=3 130 B6R0.3 C=C[C@H](N)C(=O)O MCULE-2657488498 [1,0,0,0,0,0|0,0,2]=3 131 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5103456570 [1,0,0,0,0,0|0,0,2]=3 132 B6R0.3 C=C[C@H](N)C(=O)O MCULE-5936124947 [1,0,0,0,0,0|0,0,2]=3 133 B6R0.3 C=C[C@H](N)C(=O)O MCULE-9631686254 [1,0,0,0,0,0|0,0,2]=3 134 B6R0.3 CC(=CBr)C(=O)O MCULE-3682516046 [1,0,0,0,0,0|1,0,2]=4 135 B6R0.3 CC(=NO)C(=O)O MCULE-8264934008 [1,0,0,0,0,0|2,0,1]=4 136 B6R0.3 CC(=O)C(C)C#N MCULE-3849364002 [1,0,0,0,0,0|2,0,1]=4 137 B6R0.3 CC(=O)C(C)C=O MCULE-7133682970 [1,0,0,0,0,0|2,0,1]=4 138 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [1,0,0,0,0,0|2,0,0]=3 139 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [1,0,0,0,0,0|2,0,0]=3 140 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [1,0,0,0,0,0|2,0,0]=3 141 B6R0.3 CC(C#N)C(=O)N MCULE-2138676966 [1,0,0,0,0,0|2,0,1]=4 142 B6R0.3 CC(C#N)C(=O)O MCULE-3302580561 [1,0,0,0,0,0|1,0,1]=3 143 B6R0.3 CC(CBr)C(=O)O MCULE-1430003780 [1,0,0,0,0,0|1,0,0]=2 144 B6R0.3 CC(CF)C(=O)O MCULE-7390028409 [1,0,0,0,0,0|1,0,0]=2 145 B6R0.3 CC(CN)C(=O)O MCULE-5485986433 [1,0,0,0,0,0|1,0,0]=2 146 B6R0.3 CC(CN)C(=O)O MCULE-5638884438 [1,0,0,0,0,0|1,0,0]=2 147 B6R0.3 CC(CN)S(=O)C MCULE-9048112625 [1,0,0,0,0,0|3,0,0]=4 148 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [1,0,0,0,0,0|1,0,0]=2 149 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [1,0,0,0,0,0|1,0,1]=3 150 B6R0.3 CC(CO)N(=O)=O MCULE-5856696728 [1,0,0,0,0,0|2,0,1]=4 151 B6R0.3 CC(CS)C(=O)O MCULE-9982386135 [1,0,0,0,0,0|1,0,0]=2 152 B6R0.3 CC(O)C(C)CN MCULE-5251700993 [1,0,0,0,0,0|2,0,1]=4 153 B6R0.3 CC(O)C(C)CO MCULE-4061946423 [1,0,0,0,0,0|2,0,1]=4 154 B6R0.3 CC(O)C(N)CN MCULE-2787573482 [1,0,0,0,0,0|2,0,1]=4 155 B6R0.3 CC(O)C(N)CN MCULE-5330950433 [1,0,0,0,0,0|2,0,1]=4 156 B6R0.3 CC(O)C(N)CO MCULE-7733336449 [1,0,0,0,0,0|2,0,1]=4 157 B6R0.3 CC(ON)C(=O)O MCULE-1969235976 [1,0,0,0,0,0|2,0,0]=3 158 B6R0.3 CC(ON)C(=O)O MCULE-4318537884 [1,0,0,0,0,0|2,0,0]=3 159 B6R0.3 CC(ON)C(=O)O MCULE-4455753863 [1,0,0,0,0,0|2,0,0]=3 160 B6R0.3 CC(ON)C(=O)O MCULE-8893009712 [1,0,0,0,0,0|2,0,0]=3 161 B6R0.3 CC=C(Br)C(=O)O MCULE-5368794596 [1,0,0,0,0,0|1,0,2]=4 162 B6R0.3 CC=C(C)C(=O)C MCULE-8950290711 [1,0,0,0,0,0|1,0,2]=4 163 B6R0.3 CC=C(C)C(=O)Cl MCULE-2974704783 [1,0,0,0,0,0|1,0,2]=4 164 B6R0.3 CC=C(C)C(=O)O MCULE-2390677360 [1,0,0,0,0,0|0,0,2]=3 165 B6R0.3 CC=C(Cl)C(=O)O MCULE-5827690088 [1,0,0,0,0,0|1,0,2]=4 166 B6R0.3 CC=C(F)C(=O)O MCULE-5053310707 [1,0,0,0,0,0|1,0,2]=4 167 B6R0.3 CC=C(O)C(=O)O MCULE-7886990963 [1,0,0,0,0,0|1,0,2]=4 168 B6R0.3 CCC(=C(C)C)C MCULE-7258057243 [1,0,0,0,0,0|2,0,1]=4 169 B6R0.3 CCC(=O)C(=O)C MCULE-3065014067 [1,0,0,0,0,0|2,0,1]=4 170 B6R0.3 CCC(=O)C(=O)O MCULE-8360398438 [1,0,0,0,0,0|1,0,1]=3 171 B6R0.3 CCC(=O)C(=O)[O-] MCULE-7571698792 [1,0,0,0,0,0|1,0,2]=4 172 B6R0.3 CCC(Br)C(=O)Br MCULE-2627972929 [1,0,0,0,0,0|2,0,0]=3 173 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [1,0,0,0,0,0|2,0,0]=3 174 B6R0.3 CCC(Br)C(=O)Cl MCULE-1448867234 [1,0,0,0,0,0|2,0,0]=3 175 B6R0.3 CCC(Br)C(=O)N MCULE-5823441392 [1,0,0,0,0,0|2,0,0]=3 176 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [1,0,0,0,0,0|1,0,0]=2 177 B6R0.3 CCC(C)B(O)O MCULE-7544159454 [1,0,0,0,0,0|1,0,1]=3 178 B6R0.3 CCC(C)C(=N)N MCULE-4070060089 [1,0,0,0,0,0|2,0,0]=3 179 B6R0.3 CCC(C)C(=N)N MCULE-7020524406 [1,0,0,0,0,0|2,0,0]=3 180 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [1,0,0,0,0,0|1,0,0]=2 181 B6R0.3 CCC(C)C(=O)Cl MCULE-3594098886 [1,0,0,0,0,0|1,0,0]=2 182 B6R0.3 CCC(C)C(=O)N MCULE-9298244547 [1,0,0,0,0,0|1,0,0]=2 183 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [1,0,0,0,0,0|0,0,0]=1 184 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [1,0,0,0,0,0|0,0,0]=1 185 B6R0.3 CCC(C)C(=S)N MCULE-9682279721 [1,0,0,0,0,0|1,1,0]=3 186 B6R0.3 CCC(C)C(C)Br MCULE-5368409335 [1,0,0,0,0,0|2,0,1]=4 187 B6R0.3 CCC(C)C(C)C MCULE-9189749509 [1,0,0,0,0,0|2,0,1]=4 188 B6R0.3 CCC(C)C(C)Cl MCULE-2663176330 [1,0,0,0,0,0|2,0,1]=4 189 B6R0.3 CCC(C)C(C)N MCULE-1056466337 [1,0,0,0,0,0|2,0,1]=4 190 B6R0.3 CCC(C)C(C)N MCULE-1503543126 [1,0,0,0,0,0|2,0,1]=4 191 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [1,0,0,0,0,0|1,0,1]=3 192 B6R0.3 CCC(Cl)C(=O)Cl MCULE-6260726168 [1,0,0,0,0,0|2,0,0]=3 193 B6R0.3 CCC(Cl)C(=O)N MCULE-7941338456 [1,0,0,0,0,0|2,0,0]=3 194 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [1,0,0,0,0,0|1,0,0]=2 195 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [1,0,0,0,0,0|1,0,0]=2 196 B6R0.3 CCC(N)C(=O)N MCULE-2662930657 [1,0,0,0,0,0|1,0,0]=2 197 B6R0.3 CCC(N)C(=O)N MCULE-5136248706 [1,0,0,0,0,0|1,0,0]=2 198 B6R0.3 CCC(N)C(=O)N MCULE-8876361903 [1,0,0,0,0,0|1,0,0]=2 199 B6R0.3 CCC(N)C(=O)N MCULE-9704177556 [1,0,0,0,0,0|1,0,0]=2 200 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [1,0,0,0,0,0|0,0,0]=1 201 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [1,0,0,0,0,0|0,0,0]=1 202 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [1,0,0,0,0,0|0,0,0]=1 203 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [1,0,0,0,0,0|0,0,0]=1 204 B6R0.3 CCC(N)C(C)C MCULE-3624338196 [1,0,0,0,0,0|2,0,1]=4 205 B6R0.3 CCC(N)C(C)C MCULE-4491326477 [1,0,0,0,0,0|2,0,1]=4 206 B6R0.3 CCC(N)C(C)O MCULE-2752432664 [1,0,0,0,0,0|1,0,1]=3 207 B6R0.3 CCC(N)C(C)O MCULE-6087590428 [1,0,0,0,0,0|1,0,1]=3 208 B6R0.3 CCC(N)C(F)F MCULE-3079670807 [1,0,0,0,0,0|2,0,1]=4 209 B6R0.3 CCC(N)C(F)F MCULE-4157824434 [1,0,0,0,0,0|2,0,1]=4 210 B6R0.3 CCC(O)C(=O)N MCULE-4290959224 [1,0,0,0,0,0|2,0,0]=3 211 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [1,0,0,0,0,0|1,0,0]=2 212 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [1,0,0,0,0,0|1,0,0]=2 213 B6R0.3 CCC(O)C(=O)[O-] MCULE-5297669254 [1,0,0,0,0,0|1,0,1]=3 214 B6R0.3 CCC(O)C(=O)[O-] MCULE-5740032698 [1,0,0,0,0,0|1,0,1]=3 215 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [1,0,0,0,0,0|2,0,1]=4 216 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [1,0,0,0,0,0|2,0,0]=3 217 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [1,0,0,0,0,0|1,0,0]=2 218 B6R0.3 CCN(C)C(=N)N MCULE-1941465818 [1,0,0,0,0,0|3,0,0]=4 219 B6R0.3 CCN(C)C(=O)C MCULE-6881823095 [1,0,0,0,0,0|2,0,0]=3 220 B6R0.3 CCN(C)C(=O)Cl MCULE-3697487267 [1,0,0,0,0,0|2,0,0]=3 221 B6R0.3 CCN(N)C(=O)N MCULE-8674876262 [1,0,0,0,0,0|2,0,0]=3 222 B6R0.3 CCN(O)C(=O)C MCULE-8547381969 [1,0,0,0,0,0|3,0,0]=4 223 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [1,0,0,0,0,0|1,0,0]=2 224 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [1,0,0,0,0,0|1,0,0]=2 225 B6R0.3 CC[C@@H](C)C(=O)N MCULE-3083676357 [1,0,0,0,0,0|1,0,0]=2 226 B6R0.3 CC[C@@H](C)C(=O)N MCULE-4584753474 [1,0,0,0,0,0|1,0,0]=2 227 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [1,0,0,0,0,0|0,0,0]=1 228 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [1,0,0,0,0,0|0,0,0]=1 229 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [1,0,0,0,0,0|1,0,0]=2 230 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [1,0,0,0,0,0|1,0,0]=2 231 B6R0.3 CC[C@@H](N)C(=O)N MCULE-2790345262 [1,0,0,0,0,0|1,0,0]=2 232 B6R0.3 CC[C@@H](N)C(=O)N MCULE-3501293124 [1,0,0,0,0,0|1,0,0]=2 233 B6R0.3 CC[C@@H](N)C(=O)N MCULE-4913204798 [1,0,0,0,0,0|1,0,0]=2 234 B6R0.3 CC[C@@H](N)C(=O)N MCULE-5005994513 [1,0,0,0,0,0|1,0,0]=2 235 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [1,0,0,0,0,0|0,0,0]=1 236 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [1,0,0,0,0,0|0,0,0]=1 237 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [1,0,0,0,0,0|0,0,0]=1 238 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [1,0,0,0,0,0|0,0,0]=1 239 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-8294520512 [1,0,0,0,0,0|1,0,1]=3 240 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-9521001934 [1,0,0,0,0,0|1,0,1]=3 241 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [1,0,0,0,0,0|1,0,0]=2 242 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [1,0,0,0,0,0|1,0,0]=2 243 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [1,0,0,0,0,0|1,0,0]=2 244 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [1,0,0,0,0,0|1,0,0]=2 245 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [1,0,0,0,0,0|0,0,0]=1 246 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [1,0,0,0,0,0|0,0,0]=1 247 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [1,0,0,0,0,0|1,0,0]=2 248 B6R0.3 CC[C@H](N)C(=O)N MCULE-1934671300 [1,0,0,0,0,0|1,0,0]=2 249 B6R0.3 CC[C@H](N)C(=O)N MCULE-3034729287 [1,0,0,0,0,0|1,0,0]=2 250 B6R0.3 CC[C@H](N)C(=O)N MCULE-6902117665 [1,0,0,0,0,0|1,0,0]=2 251 B6R0.3 CC[C@H](N)C(=O)N MCULE-9419812665 [1,0,0,0,0,0|1,0,0]=2 252 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [1,0,0,0,0,0|0,0,0]=1 253 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [1,0,0,0,0,0|0,0,0]=1 254 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [1,0,0,0,0,0|0,0,0]=1 255 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [1,0,0,0,0,0|0,0,0]=1 256 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [1,0,0,0,0,0|0,1,0]=2 257 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [1,0,0,0,0,0|0,1,0]=2 258 B6R0.3 CC[C@H](N)C(C)C MCULE-3200638239 [1,0,0,0,0,0|2,0,1]=4 259 B6R0.3 CC[C@H](N)C(C)C MCULE-4973720203 [1,0,0,0,0,0|2,0,1]=4 260 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-1930738992 [1,0,0,0,0,0|1,0,1]=3 261 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-4226147180 [1,0,0,0,0,0|1,0,1]=3 262 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-7445496718 [1,0,0,0,0,0|1,0,1]=3 263 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-9770959398 [1,0,0,0,0,0|1,0,1]=3 264 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-3878355824 [1,0,0,0,0,0|1,0,1]=3 265 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-4791160457 [1,0,0,0,0,0|1,0,1]=3 266 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [1,0,0,0,0,0|1,0,0]=2 267 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [1,0,0,0,0,0|1,0,0]=2 268 B6R0.3 CC[C@H](O)C(=O)[O-] MCULE-6073275709 [1,0,0,0,0,0|1,0,1]=3 269 B6R0.3 CNC(=O)C(=O)O MCULE-5436132271 [1,0,0,0,0,0|2,0,1]=4 270 B6R0.3 CNC(C)C(=O)N MCULE-1426280147 [1,0,0,0,0,0|2,0,0]=3 271 B6R0.3 CNC(C)C(=O)N MCULE-2344663168 [1,0,0,0,0,0|2,0,0]=3 272 B6R0.3 CNC(C)C(=O)O MCULE-4088114502 [1,0,0,0,0,0|1,0,0]=2 273 B6R0.3 CNC(C)C(=O)O MCULE-7300169560 [1,0,0,0,0,0|1,0,0]=2 274 B6R0.3 CNC(C)C(=O)O MCULE-8623956615 [1,0,0,0,0,0|1,0,0]=2 275 B6R0.3 CN[C@@H](C)C(=O)N MCULE-3316985921 [1,0,0,0,0,0|2,0,0]=3 276 B6R0.3 CN[C@@H](C)C(=O)O MCULE-2079366664 [1,0,0,0,0,0|1,0,0]=2 277 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4072364377 [1,0,0,0,0,0|1,0,0]=2 278 B6R0.3 CN[C@@H](C)C(=O)O MCULE-4518259073 [1,0,0,0,0,0|1,0,0]=2 279 B6R0.3 CN[C@@H](C)C(=O)O MCULE-8200069325 [1,0,0,0,0,0|1,0,0]=2 280 B6R0.3 CN[C@H](C)C(=O)O MCULE-2777429698 [1,0,0,0,0,0|1,0,0]=2 281 B6R0.3 CN[C@H](C)C(=O)O MCULE-7282734154 [1,0,0,0,0,0|1,0,0]=2 282 B6R0.3 CN[C@H](C)C(=O)O MCULE-9709122579 [1,0,0,0,0,0|1,0,0]=2 283 B6R0.3 COC(=O)C(=O)O MCULE-8527842270 [1,0,0,0,0,0|2,0,1]=4 284 B6R0.3 COC(Br)C(=O)C MCULE-1220922171 [1,0,0,0,0,0|3,0,0]=4 285 B6R0.3 COC(Br)C(=O)O MCULE-9018983840 [1,0,0,0,0,0|2,0,0]=3 286 B6R0.3 COC(C)C(=O)C MCULE-8058502137 [1,0,0,0,0,0|2,0,0]=3 287 B6R0.3 COC(C)C(=O)N MCULE-5955494048 [1,0,0,0,0,0|2,0,0]=3 288 B6R0.3 COC(C)C(=O)O MCULE-8913745653 [1,0,0,0,0,0|1,0,0]=2 289 B6R0.3 COC(C)C(=S)N MCULE-6827196665 [1,0,0,0,0,0|2,1,0]=4 290 B6R0.3 COC(C)C(C)O MCULE-9844405908 [1,0,0,0,0,0|2,0,1]=4 291 B6R0.3 CON(C)C(=O)C MCULE-8559238750 [1,0,0,0,0,0|3,0,0]=4 292 B6R0.3 CON(C)C(=O)Cl MCULE-7217619495 [1,0,0,0,0,0|3,0,0]=4 293 B6R0.3 CO[C@@H](C)C(=O)Cl MCULE-9335923061 [1,0,0,0,0,0|2,0,0]=3 294 B6R0.3 CO[C@@H](C)C(=O)O MCULE-7456458246 [1,0,0,0,0,0|1,0,0]=2 295 B6R0.3 CO[C@@H](C)C(=O)O MCULE-8108977564 [1,0,0,0,0,0|1,0,0]=2 296 B6R0.3 CO[C@H](C)C(=O)O MCULE-3078851913 [1,0,0,0,0,0|1,0,0]=2 297 B6R0.3 CO[C@H](C)C(=O)O MCULE-5370950850 [1,0,0,0,0,0|1,0,0]=2 298 B6R0.3 CSC(C)C(=O)C MCULE-8567808254 [1,0,0,0,0,0|2,0,0]=3 299 B6R0.3 CSC(C)C(=O)O MCULE-8062487948 [1,0,0,0,0,0|1,0,0]=2 300 B6R0.3 CSC(C)C(C)O MCULE-9554880840 [1,0,0,0,0,0|2,0,1]=4 301 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4438181090 [1,0,0,0,0,0|1,0,0]=2 302 B6R0.3 C[C@@H](CN)C(=O)O MCULE-4599481344 [1,0,0,0,0,0|1,0,0]=2 303 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5826933618 [1,0,0,0,0,0|1,0,0]=2 304 B6R0.3 C[C@@H](CN)C(=O)O MCULE-5914856504 [1,0,0,0,0,0|1,0,0]=2 305 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [1,0,0,0,0,0|1,0,0]=2 306 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [1,0,0,0,0,0|1,0,0]=2 307 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-1499224916 [1,0,0,0,0,0|2,0,1]=4 308 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-3539522955 [1,0,0,0,0,0|2,0,1]=4 309 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-1381786707 [1,0,0,0,0,0|2,0,1]=4 310 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-3627537672 [1,0,0,0,0,0|2,0,1]=4 311 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-5429038645 [1,0,0,0,0,0|2,0,1]=4 312 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-6146168744 [1,0,0,0,0,0|2,0,1]=4 313 B6R0.3 C[C@@H](ON)C(=O)O MCULE-1538722507 [1,0,0,0,0,0|2,0,0]=3 314 B6R0.3 C[C@@H](ON)C(=O)O MCULE-3835402446 [1,0,0,0,0,0|2,0,0]=3 315 B6R0.3 C[C@H](CN)C(=O)O MCULE-3703540023 [1,0,0,0,0,0|1,0,0]=2 316 B6R0.3 C[C@H](CN)C(=O)O MCULE-5714771083 [1,0,0,0,0,0|1,0,0]=2 317 B6R0.3 C[C@H](CN)C(=O)O MCULE-9009901306 [1,0,0,0,0,0|1,0,0]=2 318 B6R0.3 C[C@H](CN)C(=O)O MCULE-9217365463 [1,0,0,0,0,0|1,0,0]=2 319 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [1,0,0,0,0,0|1,0,0]=2 320 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [1,0,0,0,0,0|1,0,0]=2 321 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [1,0,0,0,0,0|1,0,1]=3 322 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-5329315346 [1,0,0,0,0,0|2,0,1]=4 323 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7239426628 [1,0,0,0,0,0|2,0,1]=4 324 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7437797788 [1,0,0,0,0,0|2,0,1]=4 325 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-2378004602 [1,0,0,0,0,0|2,0,1]=4 326 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-9436764758 [1,0,0,0,0,0|2,0,1]=4 327 B6R0.3 C[C@H](ON)C(=O)O MCULE-3327889540 [1,0,0,0,0,0|2,0,0]=3 328 B6R0.3 C[C@H](ON)C(=O)O MCULE-4523264650 [1,0,0,0,0,0|2,0,0]=3 329 B6R0.3 N#CC(N)C(=O)N MCULE-3175667831 [1,0,0,0,0,0|2,0,1]=4 330 B6R0.3 NC(=O)C(Br)CBr MCULE-3438242131 [1,0,0,0,0,0|3,0,0]=4 331 B6R0.3 NC(=O)C(Cl)CCl MCULE-9549750186 [1,0,0,0,0,0|3,0,0]=4 332 B6R0.3 NC(=O)C(N)CO MCULE-4842751232 [1,0,0,0,0,0|2,0,0]=3 333 B6R0.3 NC(=O)C(N)CO MCULE-6854366147 [1,0,0,0,0,0|2,0,0]=3 334 B6R0.3 NC(=O)C(N)CS MCULE-3144051628 [1,0,0,0,0,0|2,0,0]=3 335 B6R0.3 NC(=O)C(N)CS MCULE-7739536595 [1,0,0,0,0,0|2,0,0]=3 336 B6R0.3 NC(=O)[C@@H](N)CO MCULE-2185844038 [1,0,0,0,0,0|2,0,0]=3 337 B6R0.3 NC(=O)[C@@H](N)CO MCULE-3623516041 [1,0,0,0,0,0|2,0,0]=3 338 B6R0.3 NC(=O)[C@@H](N)CO MCULE-6218638108 [1,0,0,0,0,0|2,0,0]=3 339 B6R0.3 NC(=O)[C@@H](N)CS MCULE-9790378691 [1,0,0,0,0,0|2,0,0]=3 340 B6R0.3 NC(=O)[C@H](N)CO MCULE-2061645482 [1,0,0,0,0,0|2,0,0]=3 341 B6R0.3 NC(=O)[C@H](N)CO MCULE-5920366137 [1,0,0,0,0,0|2,0,0]=3 342 B6R0.3 NC(=O)[C@H](N)CO MCULE-7612340519 [1,0,0,0,0,0|2,0,0]=3 343 B6R0.3 NC(=O)[C@H](N)CO MCULE-7734326153 [1,0,0,0,0,0|2,0,0]=3 344 B6R0.3 NC(CCl)C(=O)O MCULE-1601405489 [1,0,0,0,0,0|1,0,0]=2 345 B6R0.3 NC(CCl)C(=O)O MCULE-3020306643 [1,0,0,0,0,0|1,0,0]=2 346 B6R0.3 NC(CCl)C(=O)O MCULE-5440349631 [1,0,0,0,0,0|1,0,0]=2 347 B6R0.3 NC(CF)C(=O)O MCULE-3274339636 [1,0,0,0,0,0|1,0,0]=2 348 B6R0.3 NC(CO)C(=O)O MCULE-2425237422 [1,0,0,0,0,0|1,0,0]=2 349 B6R0.3 NC(CO)C(=O)O MCULE-6460387318 [1,0,0,0,0,0|1,0,0]=2 350 B6R0.3 NC(CS)C(=O)O MCULE-1666411258 [1,0,0,0,0,0|1,0,0]=2 351 B6R0.3 NC(CS)C(=O)O MCULE-2938329352 [1,0,0,0,0,0|1,0,0]=2 352 B6R0.3 NC(CS)C(=O)O MCULE-7203902929 [1,0,0,0,0,0|1,0,0]=2 353 B6R0.3 NC(CS)C(=O)O MCULE-7790846545 [1,0,0,0,0,0|1,0,0]=2 354 B6R0.3 NCC(Br)C(=O)O MCULE-2289205408 [1,0,0,0,0,0|2,0,0]=3 355 B6R0.3 NCC(Br)C(=O)O MCULE-9361399143 [1,0,0,0,0,0|2,0,0]=3 356 B6R0.3 NCC(F)C(=O)O MCULE-5666887061 [1,0,0,0,0,0|2,0,0]=3 357 B6R0.3 NCC(F)C(=O)O MCULE-6134707533 [1,0,0,0,0,0|2,0,0]=3 358 B6R0.3 NCC(N)C(=O)O MCULE-1867799207 [1,0,0,0,0,0|1,0,0]=2 359 B6R0.3 NCC(N)C(=O)O MCULE-4853376364 [1,0,0,0,0,0|1,0,0]=2 360 B6R0.3 NCC(N)C(=O)O MCULE-7636331821 [1,0,0,0,0,0|1,0,0]=2 361 B6R0.3 NCC(N)C(=O)O MCULE-7735444546 [1,0,0,0,0,0|1,0,0]=2 362 B6R0.3 NCC(N)C(=O)O MCULE-9197553017 [1,0,0,0,0,0|1,0,0]=2 363 B6R0.3 NCC(O)C(=O)N MCULE-1543465850 [1,0,0,0,0,0|3,0,0]=4 364 B6R0.3 NCC(O)C(=O)N MCULE-9574499203 [1,0,0,0,0,0|3,0,0]=4 365 B6R0.3 NCC(O)C(=O)O MCULE-2137675488 [1,0,0,0,0,0|2,0,0]=3 366 B6R0.3 NCC(O)C(=O)O MCULE-3348306437 [1,0,0,0,0,0|2,0,0]=3 367 B6R0.3 NC[C@@H](F)C(=O)O MCULE-3544959183 [1,0,0,0,0,0|2,0,0]=3 368 B6R0.3 NC[C@@H](F)C(=O)O MCULE-4122418685 [1,0,0,0,0,0|2,0,0]=3 369 B6R0.3 NC[C@@H](F)C(=O)O MCULE-8592364466 [1,0,0,0,0,0|2,0,0]=3 370 B6R0.3 NC[C@@H](F)C(=O)O MCULE-9106826144 [1,0,0,0,0,0|2,0,0]=3 371 B6R0.3 NC[C@@H](N)C(=O)O MCULE-5363126654 [1,0,0,0,0,0|1,0,0]=2 372 B6R0.3 NC[C@@H](N)C(=O)O MCULE-8998345978 [1,0,0,0,0,0|1,0,0]=2 373 B6R0.3 NC[C@@H](N)C(=O)O MCULE-9125384126 [1,0,0,0,0,0|1,0,0]=2 374 B6R0.3 NC[C@@H](O)C(=O)O MCULE-5922773276 [1,0,0,0,0,0|2,0,0]=3 375 B6R0.3 NC[C@@H](O)C(=O)O MCULE-8921832932 [1,0,0,0,0,0|2,0,0]=3 376 B6R0.3 NC[C@H](F)C(=O)O MCULE-2695037152 [1,0,0,0,0,0|2,0,0]=3 377 B6R0.3 NC[C@H](F)C(=O)O MCULE-4323150722 [1,0,0,0,0,0|2,0,0]=3 378 B6R0.3 NC[C@H](F)C(=O)O MCULE-6701791437 [1,0,0,0,0,0|2,0,0]=3 379 B6R0.3 NC[C@H](F)C(=O)O MCULE-7674783008 [1,0,0,0,0,0|2,0,0]=3 380 B6R0.3 NC[C@H](N)C(=O)O MCULE-1389567062 [1,0,0,0,0,0|1,0,0]=2 381 B6R0.3 NC[C@H](N)C(=O)O MCULE-1833064192 [1,0,0,0,0,0|1,0,0]=2 382 B6R0.3 NC[C@H](N)C(=O)O MCULE-2347369254 [1,0,0,0,0,0|1,0,0]=2 383 B6R0.3 NC[C@H](N)C(=O)O MCULE-2781423323 [1,0,0,0,0,0|1,0,0]=2 384 B6R0.3 NC[C@H](N)C(=O)O MCULE-6498458695 [1,0,0,0,0,0|1,0,0]=2 385 B6R0.3 NC[C@H](N)C(=O)O MCULE-8313668715 [1,0,0,0,0,0|1,0,0]=2 386 B6R0.3 NC[C@H](O)C(=O)O MCULE-5854124012 [1,0,0,0,0,0|2,0,0]=3 387 B6R0.3 NC[C@H](O)C(=O)O MCULE-7536593166 [1,0,0,0,0,0|2,0,0]=3 388 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-2896868744 [1,0,0,0,0,0|1,0,0]=2 389 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-5799339909 [1,0,0,0,0,0|1,0,0]=2 390 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-7445121230 [1,0,0,0,0,0|1,0,0]=2 391 B6R0.3 N[C@@H](CCl)C(=O)O MCULE-9137000163 [1,0,0,0,0,0|1,0,0]=2 392 B6R0.3 N[C@@H](CO)C(=O)O MCULE-4580794842 [1,0,0,0,0,0|1,0,0]=2 393 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5604658333 [1,0,0,0,0,0|1,0,0]=2 394 B6R0.3 N[C@@H](CO)C(=O)O MCULE-5884286841 [1,0,0,0,0,0|1,0,0]=2 395 B6R0.3 N[C@@H](CO)C(=O)O MCULE-6118038121 [1,0,0,0,0,0|1,0,0]=2 396 B6R0.3 N[C@@H](CS)C(=O)O MCULE-1896679526 [1,0,0,0,0,0|1,0,0]=2 397 B6R0.3 N[C@@H](CS)C(=O)O MCULE-2206038012 [1,0,0,0,0,0|1,0,0]=2 398 B6R0.3 N[C@@H](CS)C(=O)O MCULE-6337217524 [1,0,0,0,0,0|1,0,0]=2 399 B6R0.3 N[C@@H](CS)C(=O)O MCULE-9685479191 [1,0,0,0,0,0|1,0,0]=2 400 B6R0.3 N[C@H](CCl)C(=O)O MCULE-2647266636 [1,0,0,0,0,0|1,0,0]=2 401 B6R0.3 N[C@H](CCl)C(=O)O MCULE-7797369596 [1,0,0,0,0,0|1,0,0]=2 402 B6R0.3 N[C@H](CCl)C(=O)O MCULE-8133148482 [1,0,0,0,0,0|1,0,0]=2 403 B6R0.3 N[C@H](CCl)C(=O)O MCULE-9324545858 [1,0,0,0,0,0|1,0,0]=2 404 B6R0.3 N[C@H](CF)C(=O)O MCULE-4766495272 [1,0,0,0,0,0|1,0,0]=2 405 B6R0.3 N[C@H](CF)C(=O)O MCULE-7679315401 [1,0,0,0,0,0|1,0,0]=2 406 B6R0.3 N[C@H](CO)C(=O)O MCULE-3271603208 [1,0,0,0,0,0|1,0,0]=2 407 B6R0.3 N[C@H](CO)C(=O)O MCULE-8560981570 [1,0,0,0,0,0|1,0,0]=2 408 B6R0.3 N[C@H](CS)C(=O)O MCULE-2137827959 [1,0,0,0,0,0|1,0,0]=2 409 B6R0.3 N[C@H](CS)C(=O)O MCULE-4521387126 [1,0,0,0,0,0|1,0,0]=2 410 B6R0.3 N[C@H](CS)C(=O)O MCULE-7201506202 [1,0,0,0,0,0|1,0,0]=2 411 B6R0.3 N[C@H](CS)C(=O)O MCULE-9147562606 [1,0,0,0,0,0|1,0,0]=2 412 B6R0.3 O=C(Cl)C(Br)CBr MCULE-8490174834 [1,0,0,0,0,0|3,0,0]=4 413 B6R0.3 O=C(Cl)C(Cl)CCl MCULE-5571003994 [1,0,0,0,0,0|3,0,0]=4 414 B6R0.3 O=C(O)C(=O)CBr MCULE-4768170572 [1,0,0,0,0,0|2,0,1]=4 415 B6R0.3 O=C(O)C(=O)CCl MCULE-7853426045 [1,0,0,0,0,0|2,0,1]=4 416 B6R0.3 O=C(O)C(=O)CF MCULE-5884987827 [1,0,0,0,0,0|2,0,1]=4 417 B6R0.3 O=C(O)C(=O)CO MCULE-2263002631 [1,0,0,0,0,0|2,0,1]=4 418 B6R0.3 O=C(O)C(=O)CS MCULE-7466669113 [1,0,0,0,0,0|2,0,1]=4 419 B6R0.3 O=C(O)C(Br)CBr MCULE-9991448725 [1,0,0,0,0,0|2,0,0]=3 420 B6R0.3 O=C(O)C(Br)CF MCULE-6577995297 [1,0,0,0,0,0|2,0,0]=3 421 B6R0.3 O=C(O)C(Br)CO MCULE-9060407295 [1,0,0,0,0,0|2,0,0]=3 422 B6R0.3 O=C(O)C(Cl)CCl MCULE-4757238565 [1,0,0,0,0,0|2,0,0]=3 423 B6R0.3 O=C(O)C(Cl)CO MCULE-3671026398 [1,0,0,0,0,0|2,0,0]=3 424 B6R0.3 O=C(O)C(F)CF MCULE-4323199927 [1,0,0,0,0,0|2,0,0]=3 425 B6R0.3 O=C(O)C(O)CBr MCULE-2600199692 [1,0,0,0,0,0|2,0,0]=3 426 B6R0.3 O=C(O)C(O)CCl MCULE-6346810624 [1,0,0,0,0,0|2,0,0]=3 427 B6R0.3 O=C(O)C(O)CO MCULE-3634533503 [1,0,0,0,0,0|2,0,0]=3 428 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-4486884639 [1,0,0,0,0,0|2,0,0]=3 429 B6R0.3 O=C(O)[C@@H](Br)CO MCULE-8586594526 [1,0,0,0,0,0|2,0,0]=3 430 B6R0.3 O=C(O)[C@@H](O)CCl MCULE-4927034524 [1,0,0,0,0,0|2,0,0]=3 431 B6R0.3 O=C(O)[C@@H](O)CO MCULE-4917119993 [1,0,0,0,0,0|2,0,0]=3 432 B6R0.3 O=C(O)[C@@H](O)CO MCULE-7996851129 [1,0,0,0,0,0|2,0,0]=3 433 B6R0.3 O=C(O)[C@H](Br)CO MCULE-3770944978 [1,0,0,0,0,0|2,0,0]=3 434 B6R0.3 O=C(O)[C@H](Br)CO MCULE-6926119866 [1,0,0,0,0,0|2,0,0]=3 435 B6R0.3 O=C(O)[C@H](O)CF MCULE-4453713074 [1,0,0,0,0,0|2,0,0]=3 436 B6R0.3 O=C([O-])[C@@H](O)CO MCULE-4498291090 [1,0,0,0,0,0|2,0,1]=4 437 B6R0.3 [C@@H](N)(C=C)C(=O)O MCULE-9406839633 [1,0,0,0,0,0|0,0,2]=3 438 B6R0.3 [C@@H](N)(CN)C(=O)O MCULE-2844054083 [1,0,0,0,0,0|1,0,0]=2 439 B6R0.3 [C@H](C)(NC)C(=O)O MCULE-3677465746 [1,0,0,0,0,0|1,0,0]=2 440 B6R0.3 [C@H](N)(CO)C(=O)N MCULE-2792784400 [1,0,0,0,0,0|2,0,0]=3 441 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [1,0,0,0,0,0|1,0,0]=2 442 B6R0.3 [SeH]C[C@H](N)C(=O)O MCULE-8205075370 [1,0,0,0,0,0|1,0,0]=2 443 B6R0.7 C=C(Br)C(C)(C)C MCULE-2463544596 [1,0,0,0,0,0|3,0,0]=4 444 B6R0.7 C=C(C)C(C)(C)C MCULE-9196090881 [1,0,0,0,0,0|3,0,0]=4 445 B6R0.7 CC(=O)C(C)(C)Br MCULE-2211649171 [1,0,0,0,0,0|2,0,0]=3 446 B6R0.7 CC(=O)C(C)(C)C MCULE-9731323161 [1,0,0,0,0,0|2,0,0]=3 447 B6R0.7 CC(=O)C(C)(C)Cl MCULE-3074145802 [1,0,0,0,0,0|2,0,0]=3 448 B6R0.7 CC(=O)C(C)(C)N MCULE-8236547032 [1,0,0,0,0,0|1,0,0]=2 449 B6R0.7 CC(=O)C(C)(C)N MCULE-9736681939 [1,0,0,0,0,0|1,0,0]=2 450 B6R0.7 CC(=O)C(C)(C)O MCULE-1535627387 [1,0,0,0,0,0|2,0,0]=3 451 B6R0.7 CC(=O)C(C)(F)F MCULE-7856452896 [1,0,0,0,0,0|3,0,0]=4 452 B6R0.7 CC(=O)[Si](C)(C)C MCULE-2207276552 [1,0,0,0,0,0|2,1,0]=4 453 B6R0.7 CC(Br)(Br)C(=O)O MCULE-1654765678 [1,0,0,0,0,0|2,0,0]=3 454 B6R0.7 CC(C)(Br)C(=O)Br MCULE-3927664220 [1,0,0,0,0,0|2,0,0]=3 455 B6R0.7 CC(C)(Br)C(=O)Cl MCULE-4186209269 [1,0,0,0,0,0|2,0,0]=3 456 B6R0.7 CC(C)(Br)C(=O)N MCULE-9238574572 [1,0,0,0,0,0|2,0,0]=3 457 B6R0.7 CC(C)(Br)C(=O)O MCULE-9443967216 [1,0,0,0,0,0|1,0,0]=2 458 B6R0.7 CC(C)(Br)N(=O)=O MCULE-3797855170 [1,0,0,0,0,0|2,0,1]=4 459 B6R0.7 CC(C)(C)B(O)O MCULE-9781009287 [1,0,0,0,0,0|2,0,1]=4 460 B6R0.7 CC(C)(C)C(=N)N MCULE-7680688413 [1,0,0,0,0,0|3,0,0]=4 461 B6R0.7 CC(C)(C)C(=N)N MCULE-8879048174 [1,0,0,0,0,0|3,0,0]=4 462 B6R0.7 CC(C)(C)C(=O)Cl MCULE-2528821101 [1,0,0,0,0,0|2,0,0]=3 463 B6R0.7 CC(C)(C)C(=O)N MCULE-1267347906 [1,0,0,0,0,0|2,0,0]=3 464 B6R0.7 CC(C)(C)C(=O)O MCULE-7166067227 [1,0,0,0,0,0|1,0,0]=2 465 B6R0.7 CC(C)(C)C(=O)[O-] MCULE-3836080044 [1,0,0,0,0,0|1,0,1]=3 466 B6R0.7 CC(C)(C)C(=O)[O-] MCULE-4231941340 [1,0,0,0,0,0|1,0,1]=3 467 B6R0.7 CC(C)(C)C(=S)N MCULE-3063566984 [1,0,0,0,0,0|2,1,0]=4 468 B6R0.7 CC(C)(C)N(=O)=O MCULE-5389027053 [1,0,0,0,0,0|2,0,1]=4 469 B6R0.7 CC(C)(C)S(=O)Cl MCULE-2395244349 [1,0,0,0,0,0|3,0,0]=4 470 B6R0.7 CC(C)(C)S(=O)N MCULE-4119217508 [1,0,0,0,0,0|3,0,0]=4 471 B6R0.7 CC(C)(C)S(=O)N MCULE-8120769030 [1,0,0,0,0,0|3,0,0]=4 472 B6R0.7 CC(C)(C)S(=O)O MCULE-4329334255 [1,0,0,0,0,0|2,0,0]=3 473 B6R0.7 CC(C)(C)S(=O)[O-] MCULE-9734265000 [1,0,0,0,0,0|2,0,1]=4 474 B6R0.7 CC(C)(C)[S@@](=O)N MCULE-7239306561 [1,0,0,0,0,0|3,0,0]=4 475 B6R0.7 CC(C)(C)[S@@](=O)N MCULE-8191878313 [1,0,0,0,0,0|3,0,0]=4 476 B6R0.7 CC(C)(C)[S@](=O)N MCULE-1205816977 [1,0,0,0,0,0|3,0,0]=4 477 B6R0.7 CC(C)(C)[S@](=O)N MCULE-6974247624 [1,0,0,0,0,0|3,0,0]=4 478 B6R0.7 CC(C)(Cl)C(=O)Cl MCULE-1923898716 [1,0,0,0,0,0|2,0,0]=3 479 B6R0.7 CC(C)(Cl)C(=O)O MCULE-4744644193 [1,0,0,0,0,0|1,0,0]=2 480 B6R0.7 CC(C)(Cl)N(=O)=O MCULE-9123451241 [1,0,0,0,0,0|2,0,1]=4 481 B6R0.7 CC(C)(F)C(=O)Cl MCULE-5874577670 [1,0,0,0,0,0|2,0,0]=3 482 B6R0.7 CC(C)(F)C(=O)N MCULE-7528431736 [1,0,0,0,0,0|2,0,0]=3 483 B6R0.7 CC(C)(F)C(=O)O MCULE-9323110637 [1,0,0,0,0,0|1,0,0]=2 484 B6R0.7 CC(C)(N)C(=N)N MCULE-2891169783 [1,0,0,0,0,0|2,0,0]=3 485 B6R0.7 CC(C)(N)C(=O)Cl MCULE-1303488979 [1,0,0,0,0,0|1,0,0]=2 486 B6R0.7 CC(C)(N)C(=O)N MCULE-4893991321 [1,0,0,0,0,0|1,0,0]=2 487 B6R0.7 CC(C)(N)C(=O)N MCULE-7819904882 [1,0,0,0,0,0|1,0,0]=2 488 B6R0.7 CC(C)(N)C(=O)O MCULE-4254251799 [1,0,0,0,0,0|0,0,0]=1 489 B6R0.7 CC(C)(N)C(=O)O MCULE-6175880842 [1,0,0,0,0,0|0,0,0]=1 490 B6R0.7 CC(C)(N)C(F)F MCULE-3533657881 [1,0,0,0,0,0|2,0,1]=4 491 B6R0.7 CC(C)(N)C(F)F MCULE-6482627990 [1,0,0,0,0,0|2,0,1]=4 492 B6R0.7 CC(C)(O)C(=N)N MCULE-4499579707 [1,0,0,0,0,0|3,0,0]=4 493 B6R0.7 CC(C)(O)C(=N)N MCULE-5382519131 [1,0,0,0,0,0|3,0,0]=4 494 B6R0.7 CC(C)(O)C(=O)N MCULE-9151369011 [1,0,0,0,0,0|2,0,0]=3 495 B6R0.7 CC(C)(O)C(=O)O MCULE-4093617756 [1,0,0,0,0,0|1,0,0]=2 496 B6R0.7 CC(C)(S)C(=O)O MCULE-1863706684 [1,0,0,0,0,0|1,0,0]=2 497 B6R0.7 CC(C)C(C)(C)N MCULE-1087702564 [1,0,0,0,0,0|2,0,1]=4 498 B6R0.7 CC(C)C(C)(C)N MCULE-7970243446 [1,0,0,0,0,0|2,0,1]=4 499 B6R0.7 CC(C)C(C)(C)N MCULE-9070308251 [1,0,0,0,0,0|2,0,1]=4 500 B6R0.7 CC(C)C(C)(C)N MCULE-9504763687 [1,0,0,0,0,0|2,0,1]=4 501 B6R0.7 CC(Cl)(Cl)C(=O)Cl MCULE-8935732005 [1,0,0,0,0,0|3,0,0]=4 502 B6R0.7 CC(Cl)(Cl)C(=O)O MCULE-8201912740 [1,0,0,0,0,0|2,0,0]=3 503 B6R0.7 CC(Cl)(Cl)C(=O)[O-] MCULE-7677513008 [1,0,0,0,0,0|2,0,1]=4 504 B6R0.7 CC(F)(Br)C(=O)O MCULE-5584369540 [1,0,0,0,0,0|2,0,0]=3 505 B6R0.7 CC(F)(F)C(=O)N MCULE-2299323235 [1,0,0,0,0,0|3,0,0]=4 506 B6R0.7 CC(F)(F)C(=O)O MCULE-3936632737 [1,0,0,0,0,0|2,0,0]=3 507 B6R0.7 CC(F)(F)C(=O)[O-] MCULE-1039544757 [1,0,0,0,0,0|2,0,1]=4 508 B6R0.7 CC(F)(F)C(=S)O MCULE-6682853344 [1,0,0,0,0,0|2,1,0]=4 509 B6R0.7 CC(O)C(C)(C)C MCULE-7642386536 [1,0,0,0,0,0|2,0,1]=4 510 B6R0.7 CC(O)C(C)(C)N MCULE-3194936121 [1,0,0,0,0,0|1,0,1]=3 511 B6R0.7 CC(O)C(C)(C)N MCULE-6694352146 [1,0,0,0,0,0|1,0,1]=3 512 B6R0.7 CC(O)C(C)(C)O MCULE-6808101269 [1,0,0,0,0,0|2,0,1]=4 513 B6R0.7 CS(=O)C(C)(C)C MCULE-5479134400 [1,0,0,0,0,0|3,0,0]=4 514 B6R0.7 C[C@@H](O)C(C)(C)C MCULE-7929838583 [1,0,0,0,0,0|2,0,1]=4 515 B6R0.7 C[C@H](O)C(C)(C)C MCULE-8207064949 [1,0,0,0,0,0|2,0,1]=4 516 B6R0.7 C[C@H](O)C(C)(C)O MCULE-5048641902 [1,0,0,0,0,0|2,0,1]=4 517 B6R0.7 O=C(O)C(Br)(Br)Br MCULE-4004191582 [1,0,0,0,0,0|3,0,0]=4 518 B6R0.7 O=C(O)C(Cl)(Br)Br MCULE-9131760998 [1,0,0,0,0,0|3,0,0]=4 519 B6R0.7 O=C(O)C(Cl)(Cl)Cl MCULE-1368734775 [1,0,0,0,0,0|3,0,0]=4 520 B6R0.7 O=C(O)C(F)(Br)Br MCULE-7267386731 [1,0,0,0,0,0|3,0,0]=4 521 B6R0.7 O=C(O)C(F)(Cl)Cl MCULE-2262288122 [1,0,0,0,0,0|3,0,0]=4 522 B6R0.7 O=C(O)C(F)(F)Br MCULE-2634780711 [1,0,0,0,0,0|3,0,0]=4 523 B6R0.7 O=C(O)C(F)(F)Cl MCULE-4915780097 [1,0,0,0,0,0|3,0,0]=4 524 B6R0.7 O=C(O)C(F)(F)F MCULE-1123900266 [1,0,0,0,0,0|3,0,0]=4 525 B6R0.7 O=C(O)C(F)(F)F MCULE-1306154157 [1,0,0,0,0,0|3,0,0]=4 526 B6R0.7 O=C(O)C(F)(F)F MCULE-1561231965 [1,0,0,0,0,0|3,0,0]=4 527 B6R0.7 O=C(O)C(F)(F)F MCULE-1816747517 [1,0,0,0,0,0|3,0,0]=4 528 B6R0.7 O=C(O)C(F)(F)F MCULE-2319878190 [1,0,0,0,0,0|3,0,0]=4 529 B6R0.7 O=C(O)C(F)(F)F MCULE-2350887018 [1,0,0,0,0,0|3,0,0]=4 530 B6R0.7 O=C(O)C(F)(F)F MCULE-3649131132 [1,0,0,0,0,0|3,0,0]=4 531 B6R0.7 O=C(O)C(F)(F)F MCULE-4102655453 [1,0,0,0,0,0|3,0,0]=4 532 B6R0.7 O=C(O)C(F)(F)F MCULE-4310110442 [1,0,0,0,0,0|3,0,0]=4 533 B6R0.7 O=C(O)C(F)(F)F MCULE-4552778330 [1,0,0,0,0,0|3,0,0]=4 534 B6R0.7 O=C(O)C(F)(F)F MCULE-7120837354 [1,0,0,0,0,0|3,0,0]=4 535 B6R0.7 O=C(O)C(F)(F)F MCULE-7149887430 [1,0,0,0,0,0|3,0,0]=4 536 B6R0.7 O=C(O)C(F)(F)F MCULE-7852591452 [1,0,0,0,0,0|3,0,0]=4 537 B6R0.7 O=C(O)C(F)(F)F MCULE-8109453485 [1,0,0,0,0,0|3,0,0]=4 538 B6R0.7 O=C(O)C(F)(F)F MCULE-8676558809 [1,0,0,0,0,0|3,0,0]=4 539 B6R0.7 O=C(O)C(F)(F)F MCULE-9277867041 [1,0,0,0,0,0|3,0,0]=4 540 B6R0.7 O=C(O)C(F)(F)F MCULE-9449194409 [1,0,0,0,0,0|3,0,0]=4 541 B6R0.7 O=C(O)C(F)(F)F MCULE-9734884974 [1,0,0,0,0,0|3,0,0]=4 542 B6R0.7 O=C(O)C(F)(F)F MCULE-9976402631 [1,0,0,0,0,0|3,0,0]=4 543 B6R0.7 O=C(O)C(F)(F)I MCULE-5082044093 [1,0,0,0,0,0|3,0,0]=4 544 B6R0.8 C#CC(C)(C)CC MCULE-7048640910 [1,0,0,0,0,0|2,0,1]=4 545 B6R0.8 C#CC(C)(N)CC MCULE-1327940404 [1,0,0,0,0,0|1,0,1]=3 546 B6R0.8 C#CC(C)(N)CC MCULE-2834355427 [1,0,0,0,0,0|1,0,1]=3 547 B6R0.8 C#CC(C)(N)CC MCULE-4013726030 [1,0,0,0,0,0|1,0,1]=3 548 B6R0.8 C#CC(C)(N)CC MCULE-4630359970 [1,0,0,0,0,0|1,0,1]=3 549 B6R0.8 C#CC(C)(O)CC MCULE-6936841705 [1,0,0,0,0,0|2,0,1]=4 550 B6R0.8 C=CC(C)(C)CN MCULE-8097307618 [1,0,0,0,0,0|3,0,0]=4 551 B6R0.8 C=CC(C)(C)CO MCULE-8447675743 [1,0,0,0,0,0|3,0,0]=4 552 B6R0.8 C=CC(C)(O)CBr MCULE-8151064620 [1,0,0,0,0,0|3,0,0]=4 553 B6R0.8 C=CC(C)(O)CC MCULE-7004958709 [1,0,0,0,0,0|2,0,0]=3 554 B6R0.8 C=CC(C)(O)CN MCULE-2921164232 [1,0,0,0,0,0|3,0,0]=4 555 B6R0.8 CC(C)(C=O)CCl MCULE-4459822361 [1,0,0,0,0,0|2,0,0]=3 556 B6R0.8 CC(C)(C=O)CF MCULE-7136604991 [1,0,0,0,0,0|2,0,0]=3 557 B6R0.8 CC(C)(C=O)CI MCULE-4319040609 [1,0,0,0,0,0|2,0,0]=3 558 B6R0.8 CC(C)(C=O)CO MCULE-9744921245 [1,0,0,0,0,0|2,0,0]=3 559 B6R0.8 CC(C)(CN)CO MCULE-5342400231 [1,0,0,0,0,0|2,0,1]=4 560 B6R0.8 CC(C)(CO)CBr MCULE-5392401561 [1,0,0,0,0,0|2,0,1]=4 561 B6R0.8 CC(C)(CO)CCl MCULE-4674403441 [1,0,0,0,0,0|2,0,1]=4 562 B6R0.8 CC(C)(CO)CF MCULE-4462488929 [1,0,0,0,0,0|2,0,1]=4 563 B6R0.8 CC(C)(CO)CO MCULE-3663555151 [1,0,0,0,0,0|2,0,1]=4 564 B6R0.8 CC(C)(CO)CS MCULE-2478254611 [1,0,0,0,0,0|2,0,1]=4 565 B6R0.8 CC(F)(CO)CO MCULE-6086305692 [1,0,0,0,0,0|2,0,1]=4 566 B6R0.8 CC(N)(C#N)CO MCULE-2492555292 [1,0,0,0,0,0|1,0,2]=4 567 B6R0.8 CC(N)(CO)CO MCULE-6546409175 [1,0,0,0,0,0|1,0,1]=3 568 B6R0.8 CC(O)(CN)CO MCULE-2184919268 [1,0,0,0,0,0|2,0,1]=4 569 B6R0.8 CC(O)(CO)CO MCULE-5281000424 [1,0,0,0,0,0|2,0,1]=4 570 B6R0.8 CCC(Br)(Br)C=O MCULE-5893364801 [1,0,0,0,0,0|2,0,0]=3 571 B6R0.8 CCC(C)(Br)CC MCULE-6306783726 [1,0,0,0,0,0|2,0,1]=4 572 B6R0.8 CCC(C)(C)C#N MCULE-9978530963 [1,0,0,0,0,0|2,0,1]=4 573 B6R0.8 CCC(C)(C)C=O MCULE-4902007320 [1,0,0,0,0,0|1,0,0]=2 574 B6R0.8 CCC(C)(C)CC MCULE-7259470376 [1,0,0,0,0,0|2,0,1]=4 575 B6R0.8 CCC(C)(C)CN MCULE-2321746087 [1,0,0,0,0,0|2,0,1]=4 576 B6R0.8 CCC(C)(C)CN MCULE-9058132626 [1,0,0,0,0,0|2,0,1]=4 577 B6R0.8 CCC(C)(C)CO MCULE-9731698451 [1,0,0,0,0,0|1,0,1]=3 578 B6R0.8 CCC(C)(C)NC MCULE-2427210996 [1,0,0,0,0,0|3,0,0]=4 579 B6R0.8 CCC(C)(C)NC MCULE-6316686584 [1,0,0,0,0,0|3,0,0]=4 580 B6R0.8 CCC(C)(C)NN MCULE-5144292111 [1,0,0,0,0,0|3,0,0]=4 581 B6R0.8 CCC(C)(C)NN MCULE-6427430833 [1,0,0,0,0,0|3,0,0]=4 582 B6R0.8 CCC(C)(C)OC MCULE-3328037871 [1,0,0,0,0,0|3,0,0]=4 583 B6R0.8 CCC(C)(Cl)CC MCULE-2958469449 [1,0,0,0,0,0|2,0,1]=4 584 B6R0.8 CCC(C)(N)C#N MCULE-3668256074 [1,0,0,0,0,0|1,0,1]=3 585 B6R0.8 CCC(C)(N)C#N MCULE-8050998496 [1,0,0,0,0,0|1,0,1]=3 586 B6R0.8 CCC(C)(N)CC MCULE-6775882748 [1,0,0,0,0,0|1,0,1]=3 587 B6R0.8 CCC(C)(N)CC MCULE-8120212652 [1,0,0,0,0,0|1,0,1]=3 588 B6R0.8 CCC(C)(N)CN MCULE-3477587448 [1,0,0,0,0,0|1,0,1]=3 589 B6R0.8 CCC(C)(N)CO MCULE-3364837123 [1,0,0,0,0,0|0,0,1]=2 590 B6R0.8 CCC(C)(N)CO MCULE-6671299764 [1,0,0,0,0,0|0,0,1]=2 591 B6R0.8 CCC(C)(O)C#N MCULE-9698927439 [1,0,0,0,0,0|2,0,1]=4 592 B6R0.8 CCC(C)(O)CC MCULE-2300322554 [1,0,0,0,0,0|2,0,1]=4 593 B6R0.8 CCC(C)(O)CN MCULE-2912898926 [1,0,0,0,0,0|2,0,1]=4 594 B6R0.8 CCC(C)(O)CO MCULE-7272709587 [1,0,0,0,0,0|1,0,1]=3 595 B6R0.8 CCC(F)(F)CO MCULE-9442155245 [1,0,0,0,0,0|2,0,1]=4 596 B6R0.8 CNC(C)(C)CO MCULE-6733742999 [1,0,0,0,0,0|2,0,1]=4 597 B6R0.8 CNC(C)(C)CO MCULE-8497514322 [1,0,0,0,0,0|2,0,1]=4 598 B6R0.8 COC(C)(C)CO MCULE-2208581417 [1,0,0,0,0,0|2,0,1]=4 599 B6R0.8 CSC(C)(C)C=O MCULE-7777472638 [1,0,0,0,0,0|2,0,0]=3 600 B6R0.8 CSC(C)(C)CO MCULE-7955741611 [1,0,0,0,0,0|2,0,1]=4 601 B6R0.8 C[C@](O)(CO)CBr MCULE-3211170790 [1,0,0,0,0,0|2,0,1]=4 602 B6R0.8 O=CC(Br)(Br)CBr MCULE-3050482544 [1,0,0,0,0,0|3,0,0]=4 603 B6R0.8 [NH3+]C(C)(C#C)CC MCULE-7386979197 [1,0,0,0,0,0|1,0,2]=4 604 B8R0.12 C#CCC(C)(C)C(=O)O MCULE-9823304703 [0,1,0,0,0,0|1,0,1]=3 605 B8R0.12 C#CCC(C)(N)C(=O)O MCULE-8114982544 [0,1,0,0,0,0|0,0,1]=2 606 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-2326062849 [0,1,0,0,0,0|0,0,1]=2 607 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-2897598223 [0,1,0,0,0,0|0,0,1]=2 608 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-6332359697 [0,1,0,0,0,0|0,0,1]=2 609 B8R0.12 C#CC[C@@](C)(N)C(=O)O MCULE-9265618717 [0,1,0,0,0,0|0,0,1]=2 610 B8R0.12 C#CC[C@](C)(N)C(=O)O MCULE-2976528694 [0,1,0,0,0,0|0,0,1]=2 611 B8R0.12 C#CC[C@](C)(N)C(=O)O MCULE-7418052843 [0,1,0,0,0,0|0,0,1]=2 612 B8R0.12 C=CCC(C)(C)C(=O)Cl MCULE-2398829468 [0,1,0,0,0,0|2,0,1]=4 613 B8R0.12 C=CCC(C)(C)C(=O)O MCULE-7428318853 [0,1,0,0,0,0|1,0,1]=3 614 B8R0.12 C=CCC(C)(N)C(=O)O MCULE-7144199889 [0,1,0,0,0,0|0,0,1]=2 615 B8R0.12 C=CCC(F)(F)C(=O)O MCULE-5503944687 [0,1,0,0,0,0|2,0,1]=4 616 B8R0.12 C=CC[C@@](C)(N)C(=O)O MCULE-4753726738 [0,1,0,0,0,0|0,0,1]=2 617 B8R0.12 C=CC[C@@](C)(N)C(=O)O MCULE-8270551752 [0,1,0,0,0,0|0,0,1]=2 618 B8R0.12 C=CC[C@](C)(N)C(=O)O MCULE-2471413685 [0,1,0,0,0,0|0,0,1]=2 619 B8R0.12 C=CC[C@](C)(N)C(=O)O MCULE-5595289174 [0,1,0,0,0,0|0,0,1]=2 620 B8R0.12 CC(C)(CC#N)C(=O)O MCULE-5490055179 [0,1,0,0,0,0|1,0,1]=3 621 B8R0.12 CC(C)(CCCl)C(=O)Cl MCULE-2654588224 [0,1,0,0,0,0|2,0,0]=3 622 B8R0.12 CC(C)(CCN)C(=O)O MCULE-2948071531 [0,1,0,0,0,0|1,0,0]=2 623 B8R0.12 CC(C)(CCN)C(=O)O MCULE-9113980340 [0,1,0,0,0,0|1,0,0]=2 624 B8R0.12 CC(C)(CCO)C(=O)O MCULE-1566648548 [0,1,0,0,0,0|1,0,0]=2 625 B8R0.12 CC(C)(CCO)C(=O)[O-] MCULE-5034791567 [0,1,0,0,0,0|1,0,1]=3 626 B8R0.12 CC(N)(CCF)C(=O)O MCULE-5797177130 [0,1,0,0,0,0|0,0,0]=1 627 B8R0.12 CC(N)(CCF)C(=O)O MCULE-9911119608 [0,1,0,0,0,0|0,0,0]=1 628 B8R0.12 CCCC(C)(C)C(=O)C MCULE-3472590451 [0,1,0,0,0,0|2,0,0]=3 629 B8R0.12 CCCC(C)(C)C(=O)Cl MCULE-1035499713 [0,1,0,0,0,0|2,0,0]=3 630 B8R0.12 CCCC(C)(C)C(=O)O MCULE-7950118630 [0,1,0,0,0,0|1,0,0]=2 631 B8R0.12 CCCC(C)(N)C(=O)O MCULE-3079931045 [0,1,0,0,0,0|0,0,0]=1 632 B8R0.12 CCCC(C)(O)C(=O)N MCULE-5398805490 [0,1,0,0,0,0|2,0,0]=3 633 B8R0.12 CCCC(C)(O)C(=O)O MCULE-5292180056 [0,1,0,0,0,0|1,0,0]=2 634 B8R0.12 CCCC(F)(F)C(=O)O MCULE-9926038462 [0,1,0,0,0,0|2,0,0]=3 635 B8R0.12 CCC[C@](C)(N)C(=O)O MCULE-8569302783 [0,1,0,0,0,0|0,0,0]=1 636 B8R0.12 CCNC(C)(C)C(=O)N MCULE-9687659825 [0,1,0,0,0,0|2,0,0]=3 637 B8R0.12 CCNC(C)(C)C(=O)O MCULE-5196592202 [0,1,0,0,0,0|1,0,0]=2 638 B8R0.12 CCNC(C)(C)C(=O)O MCULE-7185239447 [0,1,0,0,0,0|1,0,0]=2 639 B8R0.12 CCOC(C)(C)C(=O)N MCULE-6728122742 [0,1,0,0,0,0|2,0,0]=3 640 B8R0.12 CCOC(C)(C)C(=O)O MCULE-7344066576 [0,1,0,0,0,0|1,0,0]=2 641 B8R0.12 CCOP(=O)(O)C(=O)O MCULE-8851144535 [0,1,0,0,0,0|3,0,0]=4 642 B8R0.12 CNCC(C)(C)C(=O)O MCULE-1701621773 [0,1,0,0,0,0|1,0,0]=2 643 B8R0.12 CNCC(C)(C)C(=O)O MCULE-7669976515 [0,1,0,0,0,0|1,0,0]=2 644 B8R0.12 CNCC(F)(F)C(=O)O MCULE-3707622806 [0,1,0,0,0,0|2,0,0]=3 645 B8R0.12 CNCC(F)(F)C(=O)O MCULE-4421374171 [0,1,0,0,0,0|2,0,0]=3 646 B8R0.12 COCC(C)(C)C(=O)O MCULE-9074673500 [0,1,0,0,0,0|1,0,0]=2 647 B8R0.12 COCC(C)(N)C(=O)N MCULE-3533018780 [0,1,0,0,0,0|1,0,0]=2 648 B8R0.12 COCC(C)(N)C(=O)N MCULE-9747751712 [0,1,0,0,0,0|1,0,0]=2 649 B8R0.12 COCC(C)(O)C(=O)O MCULE-7674892239 [0,1,0,0,0,0|1,0,0]=2 650 B8R0.12 COCC(F)(F)C(=O)O MCULE-6981513055 [0,1,0,0,0,0|2,0,0]=3 651 B8R0.12 CSCC(C)(C)C(=O)O MCULE-8010872211 [0,1,0,0,0,0|1,0,0]=2 652 B8R0.12 NCCC(F)(F)C(=O)O MCULE-3814517866 [0,1,0,0,0,0|2,0,0]=3 653 B8R0.13 C#CC(C)(C)C(=O)OC MCULE-1769873961 [0,1,0,0,0,0|1,0,2]=4 654 B8R0.13 C#CC(C)(O)C(=O)OC MCULE-6791914528 [0,1,0,0,0,0|1,0,2]=4 655 B8R0.13 CC(C)(CCl)C(=O)NO MCULE-7417714844 [0,1,0,0,0,0|2,0,0]=3 656 B8R0.13 CCC(=O)C(C)(C)CC MCULE-3794055790 [0,1,0,0,0,0|2,0,0]=3 657 B8R0.13 CCC(C)(C)C(=O)CBr MCULE-4740682169 [0,1,0,0,0,0|2,0,0]=3 658 B8R0.13 CCC(C)(C)C(=O)CCl MCULE-6098410477 [0,1,0,0,0,0|2,0,0]=3 659 B8R0.13 CCC(C)(C)C(=O)OC MCULE-4686994014 [0,1,0,0,0,0|1,0,0]=2 660 B8R0.13 CCC(C)(N)C(=O)OC MCULE-3094414845 [0,1,0,0,0,0|0,0,0]=1 661 B8R0.13 CCC(C)(N)C(=O)OC MCULE-3671452978 [0,1,0,0,0,0|0,0,0]=1 662 B8R0.13 CCC(C)(N)C(=O)OC MCULE-7294646980 [0,1,0,0,0,0|0,0,0]=1 663 B8R0.13 CCC(C)(N)C(=O)OC MCULE-7579678256 [0,1,0,0,0,0|0,0,0]=1 664 B8R0.13 CCC(C)(N)C(=O)OC MCULE-8600950514 [0,1,0,0,0,0|0,0,0]=1 665 B8R0.13 CCC(C)(O)C(=O)OC MCULE-8142046975 [0,1,0,0,0,0|1,0,0]=2 666 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-2166068124 [0,1,0,0,0,0|0,0,0]=1 667 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-5528793909 [0,1,0,0,0,0|0,0,0]=1 668 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-5577268972 [0,1,0,0,0,0|0,0,0]=1 669 B8R0.13 CC[C@@](C)(N)C(=O)OC MCULE-9937729069 [0,1,0,0,0,0|0,0,0]=1 670 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-1110630847 [0,1,0,0,0,0|0,0,0]=1 671 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-1873229791 [0,1,0,0,0,0|0,0,0]=1 672 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-2400409033 [0,1,0,0,0,0|0,0,0]=1 673 B8R0.13 CC[C@](C)(N)C(=O)OC MCULE-7488892262 [0,1,0,0,0,0|0,0,0]=1 674 B8R0.13 CNC(=O)C(C)(C)CCl MCULE-6059735836 [0,1,0,0,0,0|3,0,0]=4 675 B8R0.13 CNC(=O)C(C)(C)CN MCULE-2878763373 [0,1,0,0,0,0|3,0,0]=4 676 B8R0.13 CNC(=O)C(C)(C)CN MCULE-3206960064 [0,1,0,0,0,0|3,0,0]=4 677 B8R0.13 CNC(=O)C(C)(C)NC MCULE-4678065112 [0,1,0,0,0,0|3,0,0]=4 678 B8R0.13 CNC(=O)C(C)(C)NC MCULE-5005697101 [0,1,0,0,0,0|3,0,0]=4 679 B8R0.13 CNC(C)(C)/C(=N/O)/C MCULE-7845835577 [0,1,0,0,0,0|3,0,0]=4 680 B8R0.13 CNC(C)(C)C(=NO)C MCULE-5737077582 [0,1,0,0,0,0|3,0,0]=4 681 B8R0.13 CNC(C)(C)C(=O)OC MCULE-3633926086 [0,1,0,0,0,0|2,0,0]=3 682 B8R0.13 CNC(C)(C)C(=O)OC MCULE-5043607769 [0,1,0,0,0,0|2,0,0]=3 683 B8R0.13 COC(=O)C(C)(Br)CBr MCULE-7338587134 [0,1,0,0,0,0|2,0,0]=3 684 B8R0.13 COC(=O)C(C)(C)C#N MCULE-6514633076 [0,1,0,0,0,0|2,0,1]=4 685 B8R0.13 COC(=O)C(C)(C)C=O MCULE-7831259608 [0,1,0,0,0,0|2,0,1]=4 686 B8R0.13 COC(=O)C(C)(C)CBr MCULE-8493306369 [0,1,0,0,0,0|2,0,0]=3 687 B8R0.13 COC(=O)C(C)(C)CN MCULE-3876518389 [0,1,0,0,0,0|2,0,0]=3 688 B8R0.13 COC(=O)C(C)(C)CN MCULE-6058798123 [0,1,0,0,0,0|2,0,0]=3 689 B8R0.13 COC(=O)C(C)(C)CO MCULE-5007341074 [0,1,0,0,0,0|2,0,0]=3 690 B8R0.13 COC(=O)C(C)(C)CS MCULE-1609978379 [0,1,0,0,0,0|2,0,0]=3 691 B8R0.13 COC(=O)C(C)(C)ON MCULE-4323661548 [0,1,0,0,0,0|3,0,0]=4 692 B8R0.13 COC(=O)C(C)(C)ON MCULE-9675322237 [0,1,0,0,0,0|3,0,0]=4 693 B8R0.13 COC(=O)C(C)(N)CO MCULE-3846577646 [0,1,0,0,0,0|1,0,0]=2 694 B8R0.13 COC(=O)C(C)(N)CO MCULE-4981173106 [0,1,0,0,0,0|1,0,0]=2 695 B8R0.13 COC(=O)C(C)(O)CCl MCULE-5923752147 [0,1,0,0,0,0|2,0,0]=3 696 B8R0.13 COC(=O)C(C)(O)CN MCULE-4142904446 [0,1,0,0,0,0|2,0,0]=3 697 B8R0.13 COC(=O)C(C)(O)CN MCULE-7145315033 [0,1,0,0,0,0|2,0,0]=3 698 B8R0.13 COC(=O)C(Cl)(Cl)OC MCULE-5718474171 [0,1,0,0,0,0|3,0,0]=4 699 B8R0.13 COC(=O)C(F)(F)CBr MCULE-4822172189 [0,1,0,0,0,0|3,0,0]=4 700 B8R0.13 COC(=O)C(F)(F)CN MCULE-6242672860 [0,1,0,0,0,0|3,0,0]=4 701 B8R0.13 COC(=O)C(F)(F)CN MCULE-6342895274 [0,1,0,0,0,0|3,0,0]=4 702 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-2857382898 [0,1,0,0,0,0|1,0,0]=2 703 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-3226982515 [0,1,0,0,0,0|1,0,0]=2 704 B8R0.13 COC(C)(C)/C(=N/O)/N MCULE-7630452160 [0,1,0,0,0,0|3,0,0]=4 705 B8R0.13 COC(C)(C)C(=O)CBr MCULE-9948499225 [0,1,0,0,0,0|3,0,0]=4 706 B8R0.13 COC(C)(C)C(=O)CCl MCULE-8073533789 [0,1,0,0,0,0|3,0,0]=4 707 B8R0.13 COC(C)(C)C(=O)NN MCULE-5434259633 [0,1,0,0,0,0|3,0,0]=4 708 B8R0.13 COC(C)(C)C(=O)NN MCULE-5860142862 [0,1,0,0,0,0|3,0,0]=4 709 B8R0.17 CC(O)(CN)P(=O)(O)O MCULE-7669605686 [0,1,0,0,0,0|3,0,0]=4 710 B8R0.17 CCC(C)(N)C(F)(F)F MCULE-5029716900 [0,1,0,0,0,0|2,0,1]=4 711 B8R0.17 CCC(C)(N)C(F)(F)F MCULE-7683402093 [0,1,0,0,0,0|2,0,1]=4 712 B8R0.36 C=CC(C)(CC)C(=O)O MCULE-9807737236 [0,1,0,0,0,0|1,0,0]=2 713 B8R0.36 C=CC(N)(CO)C(=O)O MCULE-8811599430 [0,1,0,0,0,0|0,0,2]=3 714 B8R0.36 CC(CCl)(CCl)C(=O)Cl MCULE-5493124016 [0,1,0,0,0,0|3,0,0]=4 715 B8R0.36 CC(CCl)(CCl)C(=O)O MCULE-2585521435 [0,1,0,0,0,0|2,0,0]=3 716 B8R0.36 CC(CF)(CF)C(=O)O MCULE-6853615208 [0,1,0,0,0,0|2,0,0]=3 717 B8R0.36 CC(CO)(CO)C(=O)O MCULE-5702110239 [0,1,0,0,0,0|2,0,0]=3 718 B8R0.36 CCC(Br)(CC)C(=O)O MCULE-6441337805 [0,1,0,0,0,0|1,0,0]=2 719 B8R0.36 CCC(C)(C#N)C(=O)O MCULE-5558018145 [0,1,0,0,0,0|0,0,1]=2 720 B8R0.36 CCC(C)(CC)C(=O)C MCULE-2334513479 [0,1,0,0,0,0|2,0,0]=3 721 B8R0.36 CCC(C)(CC)C(=O)Cl MCULE-4125691098 [0,1,0,0,0,0|2,0,0]=3 722 B8R0.36 CCC(C)(CC)C(=O)O MCULE-1997463075 [0,1,0,0,0,0|1,0,0]=2 723 B8R0.36 CCC(C)(CN)C(C)O MCULE-6950019734 [0,1,0,0,0,0|1,0,1]=3 724 B8R0.36 CCC(C)(CO)C(=O)O MCULE-7481967307 [0,1,0,0,0,0|1,0,0]=2 725 B8R0.36 CCC(C)(OC)C(=O)O MCULE-9916724590 [0,1,0,0,0,0|1,0,0]=2 726 B8R0.36 CCC(F)(CC)C(=O)O MCULE-9436369621 [0,1,0,0,0,0|1,0,0]=2 727 B8R0.36 CCC(N)(CC)C(=O)N MCULE-4886059492 [0,1,0,0,0,0|1,0,0]=2 728 B8R0.36 CCC(N)(CC)C(=O)N MCULE-8377450478 [0,1,0,0,0,0|1,0,0]=2 729 B8R0.36 CCC(N)(CC)C(=O)O MCULE-9609626868 [0,1,0,0,0,0|0,0,0]=1 730 B8R0.36 CCC(N)(CC)C(=O)O MCULE-9646246236 [0,1,0,0,0,0|0,0,0]=1 731 B8R0.36 CCC(O)(CC)C(=O)C MCULE-8377775342 [0,1,0,0,0,0|2,0,0]=3 732 B8R0.36 CCC(O)(CC)C(=O)O MCULE-9621851149 [0,1,0,0,0,0|1,0,0]=2 733 B8R0.36 COC(C)(OC)C(=O)C MCULE-1748868627 [0,1,0,0,0,0|3,0,0]=4 734 B8R0.36 COC(C)(OC)C(=O)N MCULE-7255859330 [0,1,0,0,0,0|3,0,0]=4 735 B8R0.37 C=C(C)C(C)(C)C(=O)O MCULE-2186408605 [0,1,0,0,0,0|1,0,1]=3 736 B8R0.37 C=C(C)C(C)(O)C(C)C MCULE-7276818888 [0,1,0,0,0,0|3,0,0]=4 737 B8R0.37 C=C(Cl)C(C)(C)C(=O)O MCULE-1485350518 [0,1,0,0,0,0|1,0,2]=4 738 B8R0.37 CC(=O)C(C)(C)C(=O)C MCULE-5128209361 [0,1,0,0,0,0|2,0,1]=4 739 B8R0.37 CC(=O)C(C)(C)C(=O)O MCULE-5093326895 [0,1,0,0,0,0|1,0,1]=3 740 B8R0.37 CC(=O)C(C)(C)C(=O)[O-] MCULE-6832030747 [0,1,0,0,0,0|1,0,2]=4 741 B8R0.37 CC(=O)C(C)(C)C(F)F MCULE-4059441524 [0,1,0,0,0,0|3,0,0]=4 742 B8R0.37 CC(Br)C(C)(Br)C(=O)O MCULE-4288495047 [0,1,0,0,0,0|1,0,0]=2 743 B8R0.37 CC(C)(C(=O)Cl)C(F)F MCULE-8188664685 [0,1,0,0,0,0|3,0,0]=4 744 B8R0.37 CC(C)(C(=O)N)C(=O)O MCULE-2390691265 [0,1,0,0,0,0|2,0,1]=4 745 B8R0.37 CC(C)(C(=O)N)C(F)F MCULE-6048049569 [0,1,0,0,0,0|3,0,0]=4 746 B8R0.37 CC(C)(C(=O)O)C(=O)O MCULE-7318511088 [0,1,0,0,0,0|2,0,1]=4 747 B8R0.37 CC(C)(C(=O)O)C(F)F MCULE-4082438822 [0,1,0,0,0,0|2,0,0]=3 748 B8R0.37 CC(C)C(C)(C)C(=O)O MCULE-8335448418 [0,1,0,0,0,0|1,0,0]=2 749 B8R0.37 CC(C)C(C)(N)C(=O)N MCULE-6386036357 [0,1,0,0,0,0|1,0,0]=2 750 B8R0.37 CC(C)C(C)(N)C(=O)O MCULE-2018617657 [0,1,0,0,0,0|0,0,0]=1 751 B8R0.37 CC(C)C(C)(N)C(=O)O MCULE-8116018936 [0,1,0,0,0,0|0,0,0]=1 752 B8R0.37 CC(C)C(C)(O)C(=O)O MCULE-3909217790 [0,1,0,0,0,0|1,0,0]=2 753 B8R0.37 CC(C)C(F)(F)C(=O)O MCULE-2732318443 [0,1,0,0,0,0|2,0,0]=3 754 B8R0.37 CC(C)[C@@](C)(N)C(=O)O MCULE-1672449529 [0,1,0,0,0,0|0,0,0]=1 755 B8R0.37 CC(C)[C@@](C)(N)C(=O)O MCULE-5333264309 [0,1,0,0,0,0|0,0,0]=1 756 B8R0.37 CC(C)[C@](C)(N)C(=O)O MCULE-3942243398 [0,1,0,0,0,0|0,0,0]=1 757 B8R0.37 CC(C)[C@](C)(N)C(=O)O MCULE-5291448404 [0,1,0,0,0,0|0,0,0]=1 758 B8R0.37 CC(N)C(C)(C)C(=O)O MCULE-4369218088 [0,1,0,0,0,0|1,0,0]=2 759 B8R0.37 CC(N)C(C)(C)C(=O)O MCULE-9651473536 [0,1,0,0,0,0|1,0,0]=2 760 B8R0.37 CC(O)(C(=O)O)C(F)F MCULE-8638068323 [0,1,0,0,0,0|2,0,0]=3 761 B8R0.37 CC(O)C(C)(C)N(=O)=O MCULE-4237134352 [0,1,0,0,0,0|2,0,1]=4 762 B8R0.37 CC(O)C(C)(N)C(=O)O MCULE-9781647782 [0,1,0,0,0,0|0,0,0]=1 763 B8R0.37 CC(O)C(C)(O)C(=O)O MCULE-5546110054 [0,1,0,0,0,0|1,0,0]=2 764 B8R0.37 CC(O)C(F)(F)C(=O)O MCULE-8714570962 [0,1,0,0,0,0|2,0,0]=3 765 B8R0.37 CN(C)C(C)(C)C(=O)N MCULE-6674001349 [0,1,0,0,0,0|3,0,0]=4 766 B8R0.37 CN(C)C(C)(C)C(=O)O MCULE-8408889105 [0,1,0,0,0,0|2,0,0]=3 767 B8R0.37 CN(C)C(C)(C)C(=O)O MCULE-9860731659 [0,1,0,0,0,0|2,0,0]=3 768 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O MCULE-4212497890 [0,1,0,0,0,0|0,0,0]=1 769 B8R0.37 C[C@@H](O)[C@](C)(N)C(=O)O MCULE-7382680634 [0,1,0,0,0,0|0,0,0]=1 770 B8R0.37 C[C@H](O)[C@@](C)(N)C(=O)O MCULE-5661079280 [0,1,0,0,0,0|0,0,0]=1 771 B8R0.37 O=C(O)C(F)(F)C(F)Br MCULE-1128175847 [0,1,0,0,0,0|3,0,0]=4 772 B8R0.37 O=C(O)C(F)(F)C(F)F MCULE-7798040617 [0,1,0,0,0,0|3,0,0]=4 773 B8R1.19 CC1(CC=CC1=O)C MCULE-5478168383 [0,0,0,1,0,0|2,0,1]=4 774 B8R1.19 CC1(CCC=N1=O)C MCULE-3270262370 [0,0,0,1,0,0|3,0,0]=4 775 B8R1.19 CC1(CCCC1=O)C MCULE-2010694408 [0,0,0,1,0,0|2,0,0]=3 776 B8R1.19 CC1(CCCC1=O)F MCULE-5382994089 [0,0,0,1,0,0|2,0,0]=3 777 B8R1.19 CC1(CCCC1O)C MCULE-4878410443 [0,0,0,1,0,0|2,0,1]=4 778 B8R1.19 CC1(CCCC1O)O MCULE-7509860049 [0,0,0,1,0,0|2,0,1]=4 779 B8R1.19 CC1(CCC[C@@H]1O)C MCULE-9402548740 [0,0,0,1,0,0|2,0,1]=4 780 B8R1.19 CC1(CCC[C@H]1O)C MCULE-3856604720 [0,0,0,1,0,0|2,0,1]=4 781 B8R1.19 CC1(CCN=C1S)C MCULE-9605141691 [0,0,0,1,0,0|2,1,0]=4 782 B8R1.19 CC1(CCNC1=O)C MCULE-6714447777 [0,0,0,1,0,0|2,0,0]=3 783 B8R1.19 CC1(CCNC1=O)C MCULE-7206545498 [0,0,0,1,0,0|2,0,0]=3 784 B8R1.19 CC1(CCNC1=O)N MCULE-2999548291 [0,0,0,1,0,0|1,0,0]=2 785 B8R1.19 CC1(CCNC1=O)O MCULE-2802989638 [0,0,0,1,0,0|2,0,0]=3 786 B8R1.19 CC1(CCOC1=O)Br MCULE-3061445898 [0,0,0,1,0,0|1,0,0]=2 787 B8R1.19 CC1(CCOC1=O)C MCULE-4294599964 [0,0,0,1,0,0|1,0,0]=2 788 B8R1.19 CC1(CCOC1=O)N MCULE-5332143573 [0,0,0,1,0,0|0,0,0]=1 789 B8R1.19 CC1(CCOC1=O)N MCULE-6557455932 [0,0,0,1,0,0|0,0,0]=1 790 B8R1.19 CC1(COCC1=O)C MCULE-8148059071 [0,0,0,1,0,0|3,0,0]=4 791 B8R1.19 CC1(CONC1=O)C MCULE-5889106208 [0,0,0,1,0,0|3,0,0]=4 792 B8R1.19 CC1(NCCC1=O)C MCULE-1973849102 [0,0,0,1,0,0|3,0,0]=4 793 B8R1.19 CC1(NCCC1=O)C MCULE-6763568764 [0,0,0,1,0,0|3,0,0]=4 794 B8R1.19 CC1(OCCC1=O)C MCULE-3204846453 [0,0,0,1,0,0|3,0,0]=4 795 B8R1.19 CC1OCCC1(C)N MCULE-3604874294 [0,0,0,1,0,0|1,0,1]=3 796 B8R1.19 O=C1CCCC1(F)F MCULE-7191261042 [0,0,0,1,0,0|3,0,0]=4 797 B8R1.19 O=C1NCCC1(F)F MCULE-6135502988 [0,0,0,1,0,0|3,0,0]=4 798 B8R1.28 CCC(C)(N)C1CC1 MCULE-3249204454 [0,0,0,1,0,0|2,0,1]=4 799 B8R1.28 CCC(C)(N)C1CC1 MCULE-9890630828 [0,0,0,1,0,0|2,0,1]=4 800 B8R1.30 CC1(CC1Br)C(=O)O MCULE-8673991477 [0,0,0,1,0,0|2,0,0]=3 801 B8R1.30 CC1(CC1F)C(=O)O MCULE-8465675013 [0,0,0,1,0,0|2,0,0]=3 802 B8R1.30 CC1CC1(C)C(=O)O MCULE-8330983425 [0,0,0,1,0,0|1,0,0]=2 803 B8R1.30 C[C@@]1(C[C@@H]1Br)C(=O)O MCULE-1474744945 [0,0,0,1,0,0|2,0,0]=3 804 B8R1.30 C[C@]1(C[C@@H]1F)C(=O)O MCULE-3210206701 [0,0,0,1,0,0|2,0,0]=3 805 B8R1.30 C[C@]1(C[C@H]1F)C(=O)O MCULE-6362421682 [0,0,0,1,0,0|2,0,0]=3 806 B8R1.30 C[C@]1(C[C@H]1F)C(=O)O MCULE-9963754001 [0,0,0,1,0,0|2,0,0]=3 807 B8R1.58 CCC1(CCC1=O)C MCULE-1365656204 [0,0,0,1,0,0|2,0,0]=3 808 B8R1.63 C#CC1(CC1)C(=O)O MCULE-6621925501 [0,0,0,1,0,0|1,0,2]=4 809 B8R1.63 C=CC1(CC1)C(=O)O MCULE-8050617761 [0,0,0,1,0,0|1,0,2]=4 810 B8R1.63 CC(=O)C1(CC1)CO MCULE-4289679044 [0,0,0,1,0,0|3,0,0]=4 811 B8R1.63 CCC1(CC1)C(=O)O MCULE-7607784304 [0,0,0,1,0,0|1,0,0]=2 812 B8R1.63 CNC1(CC1)C(=O)O MCULE-3174431935 [0,0,0,1,0,0|2,0,0]=3 813 B8R1.63 CNC1(CC1)C(=O)O MCULE-5558985564 [0,0,0,1,0,0|2,0,0]=3 814 B8R1.63 COC1(CC1)C(=O)O MCULE-2609996745 [0,0,0,1,0,0|2,0,0]=3 815 B8R1.63 CSC1(CC1)C(=O)O MCULE-9737877956 [0,0,0,1,0,0|2,0,0]=3 816 B8R1.63 N#CC1(CC1)C(=O)O MCULE-9709025654 [0,0,0,1,0,0|2,0,1]=4 817 B8R1.63 NC(=O)C1(CC1)CO MCULE-1137522312 [0,0,0,1,0,0|3,0,0]=4 818 B8R1.63 NCC1(CC1)C(=O)N MCULE-4765639788 [0,0,0,1,0,0|3,0,0]=4 819 B8R1.63 NCC1(CC1)C(=O)N MCULE-5417302237 [0,0,0,1,0,0|3,0,0]=4 820 B8R1.63 NCC1(CC1)C(=O)O MCULE-1804159571 [0,0,0,1,0,0|2,0,0]=3 821 B8R1.63 NCC1(CC1)C(=O)O MCULE-4552998222 [0,0,0,1,0,0|2,0,0]=3 822 B8R1.63 O=C(O)C1(CC1)CBr MCULE-6158877293 [0,0,0,1,0,0|2,0,0]=3 823 B8R1.63 O=C(O)C1(CC1)CF MCULE-8400153389 [0,0,0,1,0,0|2,0,0]=3 824 B8R1.63 O=C(O)C1(CC1)CO MCULE-4753217590 [0,0,0,1,0,0|2,0,0]=3 825 B8R1.63 O=C([O-])C1(CC1)CO MCULE-5718678066 [0,0,0,1,0,0|2,0,1]=4 826 B8R1.63 O=CC1(CC1)C(=O)O MCULE-8329913880 [0,0,0,1,0,0|2,0,1]=4 827 B8R1.78 CC(=O)C1(CCC1)C MCULE-7668067765 [0,0,0,1,0,0|2,0,0]=3 828 B8R1.78 CC(=O)C1(CCC1)O MCULE-9112690180 [0,0,0,1,0,0|2,0,0]=3 829 B8R1.78 CC(=O)C1(CNC1)F MCULE-3665722852 [0,0,0,1,0,0|3,0,0]=4 830 B8R1.78 CC(=O)C1(CNC1)F MCULE-6096163194 [0,0,0,1,0,0|3,0,0]=4 831 B8R1.78 CC(=O)C1(COC1)C MCULE-3650835000 [0,0,0,1,0,0|3,0,0]=4 832 B8R1.78 CC(C)C1(CCC1)N MCULE-6914017446 [0,0,0,1,0,0|2,0,1]=4 833 B8R1.78 CC1(CCC1)C(=O)Cl MCULE-4438397604 [0,0,0,1,0,0|2,0,0]=3 834 B8R1.78 CC1(CCC1)C(=O)O MCULE-8539228760 [0,0,0,1,0,0|1,0,0]=2 835 B8R1.78 CC1(CCO1)C(=O)O MCULE-3206195959 [0,0,0,1,0,0|1,0,0]=2 836 B8R1.78 CC1(CNC1)C(=O)N MCULE-5961415095 [0,0,0,1,0,0|3,0,0]=4 837 B8R1.78 CC1(CNC1)C(=O)N MCULE-6950504484 [0,0,0,1,0,0|3,0,0]=4 838 B8R1.78 CC1(CNC1)C(=O)O MCULE-3626067455 [0,0,0,1,0,0|2,0,0]=3 839 B8R1.78 CC1(CNC1)C(=O)O MCULE-7316902394 [0,0,0,1,0,0|2,0,0]=3 840 B8R1.78 CC1(COC1)C(=O)O MCULE-6360656030 [0,0,0,1,0,0|2,0,0]=3 841 B8R1.78 C[C@@]1(CCO1)C(=O)O MCULE-1153504060 [0,0,0,1,0,0|1,0,0]=2 842 B8R1.78 NC(=O)C1(CCC1)Br MCULE-3386940591 [0,0,0,1,0,0|2,0,0]=3 843 B8R1.78 NC(=O)C1(CCC1)N MCULE-1043802844 [0,0,0,1,0,0|1,0,0]=2 844 B8R1.78 NC(=O)C1(CCC1)N MCULE-8757108427 [0,0,0,1,0,0|1,0,0]=2 845 B8R1.78 NC(=O)C1(CCC1)O MCULE-9017924933 [0,0,0,1,0,0|2,0,0]=3 846 B8R1.78 NC(=O)C1(CNC1)O MCULE-4705401931 [0,0,0,1,0,0|3,0,0]=4 847 B8R1.78 NC(=O)C1(CNC1)O MCULE-6961987506 [0,0,0,1,0,0|3,0,0]=4 848 B8R1.78 NC(=O)C1(COC1)N MCULE-1019126091 [0,0,0,1,0,0|2,0,0]=3 849 B8R1.78 NC1(CCC1)C(=O)Cl MCULE-4330568570 [0,0,0,1,0,0|1,0,0]=2 850 B8R1.78 NC1(CCC1)C(=O)Cl MCULE-9506658674 [0,0,0,1,0,0|1,0,0]=2 851 B8R1.78 NC1(CCC1)C(=O)O MCULE-7741753062 [0,0,0,1,0,0|0,0,0]=1 852 B8R1.78 NC1(CCC1)C(=O)O MCULE-8986168461 [0,0,0,1,0,0|0,0,0]=1 853 B8R1.78 NC1(CCC1)C(F)F MCULE-1817302854 [0,0,0,1,0,0|2,0,1]=4 854 B8R1.78 NC1(CCC1)C(F)F MCULE-7583183872 [0,0,0,1,0,0|2,0,1]=4 855 B8R1.78 NC1(CNC1)C(=O)O MCULE-1078717796 [0,0,0,1,0,0|1,0,0]=2 856 B8R1.78 NC1(CNC1)C(=O)O MCULE-1597584418 [0,0,0,1,0,0|1,0,0]=2 857 B8R1.78 NC1(COC1)C(=O)O MCULE-2048452241 [0,0,0,1,0,0|1,0,0]=2 858 B8R1.78 NC1(CSC1)C(=O)O MCULE-3865165435 [0,0,0,1,0,0|1,0,0]=2 859 B8R1.78 NC1(CSC1)C(=O)O MCULE-7335919130 [0,0,0,1,0,0|1,0,0]=2 860 B8R1.78 O=C(O)C1(CCC1)Br MCULE-2468093858 [0,0,0,1,0,0|1,0,0]=2 861 B8R1.78 O=C(O)C1(CCC1)F MCULE-5784376163 [0,0,0,1,0,0|1,0,0]=2 862 B8R1.78 O=C(O)C1(CCC1)O MCULE-3418659917 [0,0,0,1,0,0|1,0,0]=2 863 B8R1.78 O=C(O)C1(CNC1)F MCULE-7253312158 [0,0,0,1,0,0|2,0,0]=3 864 B8R1.78 O=C(O)C1(CNC1)O MCULE-3436636334 [0,0,0,1,0,0|2,0,0]=3 865 B8R1.78 O=C(O)C1(CNC1)O MCULE-4261639250 [0,0,0,1,0,0|2,0,0]=3 866 B8R1.78 O=C(O)C1(COC1)O MCULE-7009915692 [0,0,0,1,0,0|2,0,0]=3 867 B8R1.78 O=N(=O)C1(CCC1)Br MCULE-5339530869 [0,0,0,1,0,0|2,0,1]=4 868 B8R0.34 C=C(C)CC(C)(C)CC MCULE-9469757352 [0,0,0,0,0,1|3,0,0]=4 869 B8R0.34 C=CC(C)(C)CC(=O)O MCULE-5164134544 [0,0,0,0,0,1|1,0,2]=4 870 B8R0.34 C=CC(C)(N)CC(=O)O MCULE-6219975516 [0,0,0,0,0,1|0,0,2]=3 871 B8R0.34 C=CC(C)(N)CC(=O)O MCULE-7181187393 [0,0,0,0,0,1|0,0,2]=3 872 B8R0.34 C=CC(C)(O)CC(=O)O MCULE-2178203310 [0,0,0,0,0,1|1,0,2]=4 873 B8R0.34 CC(=O)NC(C)(C)CO MCULE-7854801131 [0,0,0,0,0,1|3,0,0]=4 874 B8R0.34 CC(=O)OC(C)(C)CO MCULE-6739454773 [0,0,0,0,0,1|3,0,0]=4 875 B8R0.34 CC(C)(C#N)CC(=O)O MCULE-3389391069 [0,0,0,0,0,1|2,0,1]=4 876 B8R0.34 CC(C)(CBr)CC(=O)O MCULE-4311085343 [0,0,0,0,0,1|2,0,0]=3 877 B8R0.34 CC(C)(CN)CC(=O)O MCULE-6230830854 [0,0,0,0,0,1|2,0,0]=3 878 B8R0.34 CC(C)(CN)CC(=O)O MCULE-7518023349 [0,0,0,0,0,1|2,0,0]=3 879 B8R0.34 CC(C)(CO)CC(=O)O MCULE-8595593482 [0,0,0,0,0,1|2,0,0]=3 880 B8R0.34 CC(C)(CO)CC(=O)[O-] MCULE-9214676521 [0,0,0,0,0,1|2,0,1]=4 881 B8R0.34 CC(O)(CN)CC(=O)O MCULE-3304637192 [0,0,0,0,0,1|2,0,0]=3 882 B8R0.34 CC(O)(CN)CC(=O)O MCULE-4143526784 [0,0,0,0,0,1|2,0,0]=3 883 B8R0.34 CCC(C)(C)CC(=O)C MCULE-9050476347 [0,0,0,0,0,1|2,0,0]=3 884 B8R0.34 CCC(C)(C)CC(=O)O MCULE-7231252497 [0,0,0,0,0,1|1,0,0]=2 885 B8R0.34 CCC(C)(C)NC(=O)C MCULE-4494448055 [0,0,0,0,0,1|2,0,0]=3 886 B8R0.34 CCC(C)(C)OC(=O)C MCULE-9920396593 [0,0,0,0,0,1|2,0,0]=3 887 B8R0.34 CCC(C)(O)CC(=O)O MCULE-2487477968 [0,0,0,0,0,1|1,0,0]=2 888 B8R0.34 CCC(F)(F)CC(=O)O MCULE-6139996682 [0,0,0,0,0,1|2,0,0]=3 889 B8R0.34 CCS(=O)(=O)CC(=O)O MCULE-2833586083 [0,0,0,0,0,1|3,0,0]=4 890 B8R0.34 COC(C)(C)CC(=O)C MCULE-7283878436 [0,0,0,0,0,1|3,0,0]=4 891 B8R0.34 COC(C)(C)CC(=O)O MCULE-3953307849 [0,0,0,0,0,1|2,0,0]=3 892 B8R0.34 CSC(C)(C)CC(=O)C MCULE-8630996828 [0,0,0,0,0,1|3,0,0]=4 893 B8R0.34 NCC(F)(F)CC(=O)O MCULE-1672648881 [0,0,0,0,0,1|3,0,0]=4 894 B5R0.1 C#CCC(=O)O MCULE-4680699666 [2,0,0,0,0,0|0,0,2]=4 895 B5R0.1 C/C=C/C(=O)O MCULE-6937494852 [2,0,0,0,0,0|0,0,2]=4 896 B5R0.1 C=C(C)CCC MCULE-8225129744 [2,0,0,0,0,0|2,0,0]=4 897 B5R0.1 C=CCC(=O)O MCULE-6288979337 [2,0,0,0,0,0|0,0,2]=4 898 B5R0.1 CC#CC(=O)O MCULE-9994142213 [2,0,0,0,0,0|0,0,2]=4 899 B5R0.1 CC(=O)CCBr MCULE-2615300206 [2,0,0,0,0,0|2,0,0]=4 900 B5R0.1 CC(=O)CCCl MCULE-8019748964 [2,0,0,0,0,0|2,0,0]=4 901 B5R0.1 CC(=O)CCN MCULE-7550348751 [2,0,0,0,0,0|2,0,0]=4 902 B5R0.1 CC(=O)CCN MCULE-9519063810 [2,0,0,0,0,0|2,0,0]=4 903 B5R0.1 CC(=O)CCO MCULE-6328537335 [2,0,0,0,0,0|2,0,0]=4 904 B5R0.1 CC=CC(=O)O MCULE-7970410217 [2,0,0,0,0,0|0,0,2]=4 905 B5R0.1 CCCB(O)O MCULE-4994980798 [2,0,0,0,0,0|1,0,1]=4 906 B5R0.1 CCCC(=N)N MCULE-5974105638 [2,0,0,0,0,0|2,0,0]=4 907 B5R0.1 CCCC(=N)N MCULE-9230704591 [2,0,0,0,0,0|2,0,0]=4 908 B5R0.1 CCCC(=O)C MCULE-7174095676 [2,0,0,0,0,0|1,0,0]=3 909 B5R0.1 CCCC(=O)Cl MCULE-3288175193 [2,0,0,0,0,0|1,0,0]=3 910 B5R0.1 CCCC(=O)N MCULE-2712067671 [2,0,0,0,0,0|1,0,0]=3 911 B5R0.1 CCCC(=O)O MCULE-4116382006 [2,0,0,0,0,0|0,0,0]=2 912 B5R0.1 CCCC(=O)[O-] MCULE-8706538802 [2,0,0,0,0,0|0,0,1]=3 913 B5R0.1 CCCC(=O)[O-] MCULE-9764702574 [2,0,0,0,0,0|0,0,1]=3 914 B5R0.1 CCCC(=S)N MCULE-3529335988 [2,0,0,0,0,0|1,1,0]=4 915 B5R0.1 CCCC(=S)O MCULE-3382199964 [2,0,0,0,0,0|0,1,0]=3 916 B5R0.1 CCCC(C)O MCULE-8205906299 [2,0,0,0,0,0|1,0,1]=4 917 B5R0.1 CCCC(O)Cl MCULE-3188577082 [2,0,0,0,0,0|1,0,1]=4 918 B5R0.1 CCCN(=O)=O MCULE-5615753372 [2,0,0,0,0,0|1,0,1]=4 919 B5R0.1 CCCS(=O)[O-] MCULE-4306915022 [2,0,0,0,0,0|1,0,1]=4 920 B5R0.1 CCCS(=O)[O-] MCULE-9775151913 [2,0,0,0,0,0|1,0,1]=4 921 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [2,0,0,0,0,0|1,0,1]=4 922 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [2,0,0,0,0,0|1,0,1]=4 923 B5R0.1 CCNC(=O)C MCULE-7543656350 [2,0,0,0,0,0|2,0,0]=4 924 B5R0.1 CCNC(=O)Cl MCULE-5831262934 [2,0,0,0,0,0|2,0,0]=4 925 B5R0.1 CCNC(=O)N MCULE-1913599861 [2,0,0,0,0,0|2,0,0]=4 926 B5R0.1 CCOC(=O)C MCULE-6628539781 [2,0,0,0,0,0|2,0,0]=4 927 B5R0.1 CCOC(=O)Cl MCULE-4167904934 [2,0,0,0,0,0|2,0,0]=4 928 B5R0.1 CCOC(=O)N MCULE-1776877276 [2,0,0,0,0,0|2,0,0]=4 929 B5R0.1 CCSC(=O)C MCULE-8015440229 [2,0,0,0,0,0|2,0,0]=4 930 B5R0.1 CNCC(=O)C MCULE-3695443024 [2,0,0,0,0,0|2,0,0]=4 931 B5R0.1 CNCC(=O)C MCULE-7402723072 [2,0,0,0,0,0|2,0,0]=4 932 B5R0.1 CNCC(=O)N MCULE-2328887394 [2,0,0,0,0,0|2,0,0]=4 933 B5R0.1 CNCC(=O)N MCULE-3031605853 [2,0,0,0,0,0|2,0,0]=4 934 B5R0.1 CNCC(=O)N MCULE-7300977677 [2,0,0,0,0,0|2,0,0]=4 935 B5R0.1 CNCC(=O)O MCULE-3448356048 [2,0,0,0,0,0|1,0,0]=3 936 B5R0.1 CNCC(=O)O MCULE-4484444573 [2,0,0,0,0,0|1,0,0]=3 937 B5R0.1 CNCC(=O)[O-] MCULE-7993701866 [2,0,0,0,0,0|1,0,1]=4 938 B5R0.1 COCC(=O)C MCULE-7262197587 [2,0,0,0,0,0|2,0,0]=4 939 B5R0.1 COCC(=O)Cl MCULE-5449267495 [2,0,0,0,0,0|2,0,0]=4 940 B5R0.1 COCC(=O)N MCULE-6674958132 [2,0,0,0,0,0|2,0,0]=4 941 B5R0.1 COCC(=O)O MCULE-3945589151 [2,0,0,0,0,0|1,0,0]=3 942 B5R0.1 CSCC(=O)C MCULE-4131794172 [2,0,0,0,0,0|2,0,0]=4 943 B5R0.1 CSCC(=O)Cl MCULE-9750052685 [2,0,0,0,0,0|2,0,0]=4 944 B5R0.1 CSCC(=O)N MCULE-4865579476 [2,0,0,0,0,0|2,0,0]=4 945 B5R0.1 CSCC(=O)O MCULE-7003418159 [2,0,0,0,0,0|1,0,0]=3 946 B5R0.1 N#CCC(=O)O MCULE-3440765061 [2,0,0,0,0,0|1,0,1]=4 947 B5R0.1 NC(=O)CCBr MCULE-3930714776 [2,0,0,0,0,0|2,0,0]=4 948 B5R0.1 NC(=O)CCCl MCULE-8300320959 [2,0,0,0,0,0|2,0,0]=4 949 B5R0.1 NC(=O)CCO MCULE-4026170350 [2,0,0,0,0,0|2,0,0]=4 950 B5R0.1 NC(=O)CCS MCULE-7451827717 [2,0,0,0,0,0|2,0,0]=4 951 B5R0.1 NCCC(=O)Cl MCULE-1298355499 [2,0,0,0,0,0|2,0,0]=4 952 B5R0.1 NCCC(=O)N MCULE-2899414135 [2,0,0,0,0,0|2,0,0]=4 953 B5R0.1 NCCC(=O)N MCULE-6993286668 [2,0,0,0,0,0|2,0,0]=4 954 B5R0.1 NCCC(=O)O MCULE-1344289084 [2,0,0,0,0,0|1,0,0]=3 955 B5R0.1 NCCC(=O)O MCULE-2298605337 [2,0,0,0,0,0|1,0,0]=3 956 B5R0.1 NCCC(=O)O MCULE-9375577631 [2,0,0,0,0,0|1,0,0]=3 957 B5R0.1 NCCC(=O)[O-] MCULE-2492250086 [2,0,0,0,0,0|1,0,1]=4 958 B5R0.1 NCCP(=O)O MCULE-7093964616 [2,0,0,0,0,0|2,0,0]=4 959 B5R0.1 NCCS(=O)O MCULE-4372248641 [2,0,0,0,0,0|2,0,0]=4 960 B5R0.1 NNCC(=O)O MCULE-4908184724 [2,0,0,0,0,0|2,0,0]=4 961 B5R0.1 NNCC(=O)O MCULE-6315598774 [2,0,0,0,0,0|2,0,0]=4 962 B5R0.1 NOCC(=O)O MCULE-4566186819 [2,0,0,0,0,0|2,0,0]=4 963 B5R0.1 NOCC(=O)O MCULE-4824237418 [2,0,0,0,0,0|2,0,0]=4 964 B5R0.1 NOCC(=O)O MCULE-8132180423 [2,0,0,0,0,0|2,0,0]=4 965 B5R0.1 O=C(Cl)CCBr MCULE-4659506608 [2,0,0,0,0,0|2,0,0]=4 966 B5R0.1 O=C(Cl)CCCl MCULE-3313924878 [2,0,0,0,0,0|2,0,0]=4 967 B5R0.1 O=C(Cl)CCF MCULE-3316397790 [2,0,0,0,0,0|2,0,0]=4 968 B5R0.1 O=C(O)CCBr MCULE-2816055853 [2,0,0,0,0,0|1,0,0]=3 969 B5R0.1 O=C(O)CCCl MCULE-8511144183 [2,0,0,0,0,0|1,0,0]=3 970 B5R0.1 O=C(O)CCF MCULE-4382025684 [2,0,0,0,0,0|1,0,0]=3 971 B5R0.1 O=C(O)CCI MCULE-3371354708 [2,0,0,0,0,0|1,0,0]=3 972 B5R0.1 O=C(O)CCO MCULE-3428604829 [2,0,0,0,0,0|1,0,0]=3 973 B5R0.1 O=C(O)CCS MCULE-3211932163 [2,0,0,0,0,0|1,0,0]=3 974 B5R0.1 O=C(O)CNO MCULE-4437067339 [2,0,0,0,0,0|2,0,0]=4 975 B5R0.1 O=C([O-])CCO MCULE-4429611588 [2,0,0,0,0,0|1,0,1]=4 976 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [2,0,0,0,0,0|1,0,1]=4 977 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [2,0,0,0,0,0|1,0,1]=4 978 B5R0.3 C#CC(N)CC MCULE-2327605941 [2,0,0,0,0,0|1,0,1]=4 979 B5R0.3 C#CC(N)CC MCULE-3572771620 [2,0,0,0,0,0|1,0,1]=4 980 B5R0.3 C/C=C(/C)\CC MCULE-9789907985 [2,0,0,0,0,0|1,0,1]=4 981 B5R0.3 C/C=C(\C)/C=O MCULE-2818872726 [2,0,0,0,0,0|0,0,2]=4 982 B5R0.3 C/C=C(\C)/CC MCULE-7119786881 [2,0,0,0,0,0|1,0,1]=4 983 B5R0.3 C=C(C=O)CC MCULE-2875154067 [2,0,0,0,0,0|0,0,2]=4 984 B5R0.3 C=CC(C)CC MCULE-8112547661 [2,0,0,0,0,0|1,0,0]=3 985 B5R0.3 C=CC(C)NC MCULE-1929679074 [2,0,0,0,0,0|2,0,0]=4 986 B5R0.3 C=CC(C)NC MCULE-6382339452 [2,0,0,0,0,0|2,0,0]=4 987 B5R0.3 C=CC(N)CC MCULE-6270835453 [2,0,0,0,0,0|1,0,0]=3 988 B5R0.3 C=CC(N)CC MCULE-7920121163 [2,0,0,0,0,0|1,0,0]=3 989 B5R0.3 C=CC(N)CO MCULE-2457433196 [2,0,0,0,0,0|2,0,0]=4 990 B5R0.3 C=CC(N)CO MCULE-6697949182 [2,0,0,0,0,0|2,0,0]=4 991 B5R0.3 C=CC(N)CO MCULE-7137123222 [2,0,0,0,0,0|2,0,0]=4 992 B5R0.3 C=CC(N)CO MCULE-8388687355 [2,0,0,0,0,0|2,0,0]=4 993 B5R0.3 C=CC(O)CC MCULE-2794806228 [2,0,0,0,0,0|2,0,0]=4 994 B5R0.3 C=C[C@@H](N)CO MCULE-1000343618 [2,0,0,0,0,0|2,0,0]=4 995 B5R0.3 C=C[C@@H](N)CO MCULE-1074988940 [2,0,0,0,0,0|2,0,0]=4 996 B5R0.3 C=C[C@@H](N)CO MCULE-3685491078 [2,0,0,0,0,0|2,0,0]=4 997 B5R0.3 C=C[C@@H](N)CO MCULE-4969611575 [2,0,0,0,0,0|2,0,0]=4 998 B5R0.3 C=C[C@H](N)CO MCULE-2834725512 [2,0,0,0,0,0|2,0,0]=4 999 B5R0.3 C=C[C@H](N)CO MCULE-3281738311 [2,0,0,0,0,0|2,0,0]=4 1000 B5R0.3 C=C[C@H](N)CO MCULE-3551585090 [2,0,0,0,0,0|2,0,0]=4 1001 B5R0.3 C=C[C@H](N)CO MCULE-9055556349 [2,0,0,0,0,0|2,0,0]=4 1002 B5R0.3 CC(CN)CO MCULE-5880795484 [2,0,0,0,0,0|1,0,1]=4 1003 B5R0.3 CC(CN)CO MCULE-8083007887 [2,0,0,0,0,0|1,0,1]=4 1004 B5R0.3 CC(CO)CBr MCULE-3815333295 [2,0,0,0,0,0|1,0,1]=4 1005 B5R0.3 CC(CO)CBr MCULE-5695891877 [2,0,0,0,0,0|1,0,1]=4 1006 B5R0.3 CC(CO)CO MCULE-2340730326 [2,0,0,0,0,0|1,0,1]=4 1007 B5R0.3 CC(CO)CS MCULE-1990992504 [2,0,0,0,0,0|1,0,1]=4 1008 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [2,0,0,0,0,0|1,0,1]=4 1009 B5R0.3 CC/C(=N/O)/N MCULE-2794748611 [2,0,0,0,0,0|1,0,1]=4 1010 B5R0.3 CC/C(=N/O)/N MCULE-7162577220 [2,0,0,0,0,0|1,0,1]=4 1011 B5R0.3 CC=C(C)C=O MCULE-9453566957 [2,0,0,0,0,0|0,0,2]=4 1012 B5R0.3 CC=C(C)CC MCULE-5790494157 [2,0,0,0,0,0|1,0,1]=4 1013 B5R0.3 CCC(=NO)C MCULE-1859652505 [2,0,0,0,0,0|1,0,1]=4 1014 B5R0.3 CCC(Br)C=O MCULE-3064952987 [2,0,0,0,0,0|1,0,0]=3 1015 B5R0.3 CCC(Br)CO MCULE-7211805716 [2,0,0,0,0,0|1,0,1]=4 1016 B5R0.3 CCC(C)C#N MCULE-6204122967 [2,0,0,0,0,0|1,0,1]=4 1017 B5R0.3 CCC(C)C=O MCULE-2523669899 [2,0,0,0,0,0|0,0,0]=2 1018 B5R0.3 CCC(C)CBr MCULE-5451416952 [2,0,0,0,0,0|1,0,1]=4 1019 B5R0.3 CCC(C)CC MCULE-2542807917 [2,0,0,0,0,0|1,0,1]=4 1020 B5R0.3 CCC(C)CCl MCULE-7450386476 [2,0,0,0,0,0|1,0,1]=4 1021 B5R0.3 CCC(C)CI MCULE-5444509280 [2,0,0,0,0,0|1,0,1]=4 1022 B5R0.3 CCC(C)CN MCULE-2777327284 [2,0,0,0,0,0|1,0,1]=4 1023 B5R0.3 CCC(C)CN MCULE-7014901600 [2,0,0,0,0,0|1,0,1]=4 1024 B5R0.3 CCC(C)CO MCULE-6521026296 [2,0,0,0,0,0|0,0,1]=3 1025 B5R0.3 CCC(C)CS MCULE-7795095685 [2,0,0,0,0,0|0,1,1]=4 1026 B5R0.3 CCC(C)NC MCULE-2676584804 [2,0,0,0,0,0|2,0,0]=4 1027 B5R0.3 CCC(C)NC MCULE-6158046887 [2,0,0,0,0,0|2,0,0]=4 1028 B5R0.3 CCC(C)NN MCULE-6074476998 [2,0,0,0,0,0|2,0,0]=4 1029 B5R0.3 CCC(C)NN MCULE-8130021960 [2,0,0,0,0,0|2,0,0]=4 1030 B5R0.3 CCC(C)NN MCULE-8519369369 [2,0,0,0,0,0|2,0,0]=4 1031 B5R0.3 CCC(C)NO MCULE-1247092627 [2,0,0,0,0,0|1,0,0]=3 1032 B5R0.3 CCC(C)NO MCULE-6169819668 [2,0,0,0,0,0|1,0,0]=3 1033 B5R0.3 CCC(C)OC MCULE-7354431606 [2,0,0,0,0,0|2,0,0]=4 1034 B5R0.3 CCC(C)ON MCULE-2907890438 [2,0,0,0,0,0|2,0,0]=4 1035 B5R0.3 CCC(C)ON MCULE-4364205813 [2,0,0,0,0,0|2,0,0]=4 1036 B5R0.3 CCC(Cl)C=O MCULE-5238776091 [2,0,0,0,0,0|1,0,0]=3 1037 B5R0.3 CCC(Cl)CO MCULE-1756262629 [2,0,0,0,0,0|1,0,1]=4 1038 B5R0.3 CCC(N)C#N MCULE-1350483203 [2,0,0,0,0,0|1,0,1]=4 1039 B5R0.3 CCC(N)C#N MCULE-3867024162 [2,0,0,0,0,0|1,0,1]=4 1040 B5R0.3 CCC(N)CBr MCULE-3567691924 [2,0,0,0,0,0|1,0,1]=4 1041 B5R0.3 CCC(N)CC MCULE-4261937519 [2,0,0,0,0,0|1,0,1]=4 1042 B5R0.3 CCC(N)CC MCULE-5899128891 [2,0,0,0,0,0|1,0,1]=4 1043 B5R0.3 CCC(N)CN MCULE-6911484065 [2,0,0,0,0,0|1,0,1]=4 1044 B5R0.3 CCC(N)CN MCULE-8376506697 [2,0,0,0,0,0|1,0,1]=4 1045 B5R0.3 CCC(N)CO MCULE-1135809021 [2,0,0,0,0,0|0,0,1]=3 1046 B5R0.3 CCC(N)CO MCULE-7588854111 [2,0,0,0,0,0|0,0,1]=3 1047 B5R0.3 CCC(O)CO MCULE-2488753438 [2,0,0,0,0,0|1,0,1]=4 1048 B5R0.3 CCC(O)CO MCULE-7297282094 [2,0,0,0,0,0|1,0,1]=4 1049 B5R0.3 CCN(C)C=O MCULE-2308681384 [2,0,0,0,0,0|1,0,0]=3 1050 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [2,0,0,0,0,0|1,0,1]=4 1051 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [2,0,0,0,0,0|1,0,1]=4 1052 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [2,0,0,0,0,0|0,0,1]=3 1053 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [2,0,0,0,0,0|0,0,1]=3 1054 B5R0.3 CC[C@@H](N)C#N MCULE-3696119254 [2,0,0,0,0,0|1,0,1]=4 1055 B5R0.3 CC[C@@H](N)C#N MCULE-5586041766 [2,0,0,0,0,0|1,0,1]=4 1056 B5R0.3 CC[C@@H](N)CO MCULE-3821348404 [2,0,0,0,0,0|0,0,1]=3 1057 B5R0.3 CC[C@@H](N)CO MCULE-7190248306 [2,0,0,0,0,0|0,0,1]=3 1058 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [2,0,0,0,0,0|1,0,1]=4 1059 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [2,0,0,0,0,0|1,0,1]=4 1060 B5R0.3 CC[C@H](C)C#N MCULE-9118306872 [2,0,0,0,0,0|1,0,1]=4 1061 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [2,0,0,0,0,0|1,0,1]=4 1062 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [2,0,0,0,0,0|1,0,1]=4 1063 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [2,0,0,0,0,0|1,0,1]=4 1064 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [2,0,0,0,0,0|1,0,1]=4 1065 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [2,0,0,0,0,0|1,0,1]=4 1066 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [2,0,0,0,0,0|1,0,1]=4 1067 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [2,0,0,0,0,0|1,0,1]=4 1068 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [2,0,0,0,0,0|1,0,1]=4 1069 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [2,0,0,0,0,0|1,0,1]=4 1070 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [2,0,0,0,0,0|0,0,1]=3 1071 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [2,0,0,0,0,0|0,0,1]=3 1072 B5R0.3 CC[C@H](N)C#N MCULE-4431283179 [2,0,0,0,0,0|1,0,1]=4 1073 B5R0.3 CC[C@H](N)C#N MCULE-8842235277 [2,0,0,0,0,0|1,0,1]=4 1074 B5R0.3 CC[C@H](N)CF MCULE-3646304583 [2,0,0,0,0,0|1,0,1]=4 1075 B5R0.3 CC[C@H](N)CF MCULE-4493834638 [2,0,0,0,0,0|1,0,1]=4 1076 B5R0.3 CC[C@H](N)CO MCULE-5500083870 [2,0,0,0,0,0|0,0,1]=3 1077 B5R0.3 CC[C@H](N)CO MCULE-6312512384 [2,0,0,0,0,0|0,0,1]=3 1078 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [2,0,0,0,0,0|1,0,1]=4 1079 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [2,0,0,0,0,0|1,0,1]=4 1080 B5R0.3 CNC(C)CO MCULE-3841057780 [2,0,0,0,0,0|1,0,1]=4 1081 B5R0.3 CNC(C)CO MCULE-6474892275 [2,0,0,0,0,0|1,0,1]=4 1082 B5R0.3 CN[C@@H](C)CO MCULE-1633741835 [2,0,0,0,0,0|1,0,1]=4 1083 B5R0.3 CN[C@@H](C)CO MCULE-6736108875 [2,0,0,0,0,0|1,0,1]=4 1084 B5R0.3 CN[C@@H](C)CO MCULE-7554801630 [2,0,0,0,0,0|1,0,1]=4 1085 B5R0.3 CN[C@@H](C)CO MCULE-9312521497 [2,0,0,0,0,0|1,0,1]=4 1086 B5R0.3 CN[C@H](C)CO MCULE-2402322400 [2,0,0,0,0,0|1,0,1]=4 1087 B5R0.3 CN[C@H](C)CO MCULE-4362091386 [2,0,0,0,0,0|1,0,1]=4 1088 B5R0.3 CN[C@H](C)CO MCULE-5426855707 [2,0,0,0,0,0|1,0,1]=4 1089 B5R0.3 CN[C@H](C)CO MCULE-9777995604 [2,0,0,0,0,0|1,0,1]=4 1090 B5R0.3 COC(C)CO MCULE-5269990702 [2,0,0,0,0,0|1,0,1]=4 1091 B5R0.3 COC(C)CO MCULE-7173093332 [2,0,0,0,0,0|1,0,1]=4 1092 B5R0.3 CON(C)C=O MCULE-6743121315 [2,0,0,0,0,0|2,0,0]=4 1093 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [2,0,0,0,0,0|1,0,1]=4 1094 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [2,0,0,0,0,0|1,0,1]=4 1095 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [2,0,0,0,0,0|1,0,1]=4 1096 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [2,0,0,0,0,0|1,0,1]=4 1097 B5R0.3 CSC(C)CO MCULE-4646435737 [2,0,0,0,0,0|1,0,1]=4 1098 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [2,0,0,0,0,0|1,0,1]=4 1099 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [2,0,0,0,0,0|1,0,1]=4 1100 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [2,0,0,0,0,0|1,0,1]=4 1101 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [2,0,0,0,0,0|1,0,1]=4 1102 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [2,0,0,0,0,0|1,0,1]=4 1103 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [2,0,0,0,0,0|1,0,1]=4 1104 B5R0.3 NC(CO)CF MCULE-3756808200 [2,0,0,0,0,0|1,0,1]=4 1105 B5R0.3 NC(CO)CF MCULE-9468719402 [2,0,0,0,0,0|1,0,1]=4 1106 B5R0.3 NC(CO)CO MCULE-1559988016 [2,0,0,0,0,0|1,0,1]=4 1107 B5R0.3 NC(CO)CO MCULE-4954119952 [2,0,0,0,0,0|1,0,1]=4 1108 B5R0.3 NC[C@@H](N)CO MCULE-7333007012 [2,0,0,0,0,0|1,0,1]=4 1109 B5R0.3 NC[C@@H](N)CO MCULE-9200386635 [2,0,0,0,0,0|1,0,1]=4 1110 B5R0.3 NC[C@H](N)CO MCULE-1060049548 [2,0,0,0,0,0|1,0,1]=4 1111 B5R0.3 NC[C@H](N)CO MCULE-9942356112 [2,0,0,0,0,0|1,0,1]=4 1112 B5R0.3 N[C@@H](CO)CF MCULE-1103631898 [2,0,0,0,0,0|1,0,1]=4 1113 B5R0.3 N[C@@H](CO)CF MCULE-1137418239 [2,0,0,0,0,0|1,0,1]=4 1114 B5R0.3 N[C@@H](CO)CF MCULE-7452275160 [2,0,0,0,0,0|1,0,1]=4 1115 B5R0.3 N[C@@H](CO)CF MCULE-9154795583 [2,0,0,0,0,0|1,0,1]=4 1116 B5R0.3 N[C@H](CO)CF MCULE-1070351343 [2,0,0,0,0,0|1,0,1]=4 1117 B5R0.3 N[C@H](CO)CF MCULE-4715788718 [2,0,0,0,0,0|1,0,1]=4 1118 B5R0.3 N[C@H](CO)CF MCULE-8220585202 [2,0,0,0,0,0|1,0,1]=4 1119 B5R0.3 N[C@H](CO)CF MCULE-8991857376 [2,0,0,0,0,0|1,0,1]=4 1120 B5R0.3 O=CC(O)CO MCULE-9581740191 [2,0,0,0,0,0|2,0,0]=4 1121 B5R0.3 O=C[C@@H](O)CO MCULE-3883857491 [2,0,0,0,0,0|2,0,0]=4 1122 B5R0.3 O=C[C@@H](O)CO MCULE-7852783182 [2,0,0,0,0,0|2,0,0]=4 1123 B5R0.3 O=C[C@H](O)CO MCULE-4574984840 [2,0,0,0,0,0|2,0,0]=4 1124 B5R0.5 C=C(C)C(=O)O MCULE-9899621926 [2,0,0,0,0,0|0,0,2]=4 1125 B5R0.5 C=C(C)C(C)C MCULE-2535284443 [2,0,0,0,0,0|2,0,0]=4 1126 B5R0.5 CC(=O)C(=O)O MCULE-8587144313 [2,0,0,0,0,0|1,0,1]=4 1127 B5R0.5 CC(=O)C(C)Br MCULE-3764525199 [2,0,0,0,0,0|2,0,0]=4 1128 B5R0.5 CC(=O)C(C)C MCULE-5982732938 [2,0,0,0,0,0|1,0,0]=3 1129 B5R0.5 CC(=O)C(C)Cl MCULE-5065840606 [2,0,0,0,0,0|2,0,0]=4 1130 B5R0.5 CC(=O)C(C)F MCULE-2129925918 [2,0,0,0,0,0|2,0,0]=4 1131 B5R0.5 CC(=O)C(C)N MCULE-5716124999 [2,0,0,0,0,0|1,0,0]=3 1132 B5R0.5 CC(=O)C(C)N MCULE-9248002534 [2,0,0,0,0,0|1,0,0]=3 1133 B5R0.5 CC(=O)C(C)O MCULE-5374414264 [2,0,0,0,0,0|2,0,0]=4 1134 B5R0.5 CC(=O)C(C)S MCULE-2716722148 [2,0,0,0,0,0|2,0,0]=4 1135 B5R0.5 CC(=O)N(C)C MCULE-4256511309 [2,0,0,0,0,0|2,0,0]=4 1136 B5R0.5 CC(=O)N(C)N MCULE-2447375293 [2,0,0,0,0,0|2,0,0]=4 1137 B5R0.5 CC(=O)[C@H](C)N MCULE-2609095078 [2,0,0,0,0,0|1,0,0]=3 1138 B5R0.5 CC(=O)[C@H](C)N MCULE-6039921944 [2,0,0,0,0,0|1,0,0]=3 1139 B5R0.5 CC(=O)[C@H](C)N MCULE-6387613992 [2,0,0,0,0,0|1,0,0]=3 1140 B5R0.5 CC(=O)[C@H](C)N MCULE-7052375323 [2,0,0,0,0,0|1,0,0]=3 1141 B5R0.5 CC(Br)C(=O)Br MCULE-2400047844 [2,0,0,0,0,0|2,0,0]=4 1142 B5R0.5 CC(Br)C(=O)Cl MCULE-7431871683 [2,0,0,0,0,0|2,0,0]=4 1143 B5R0.5 CC(Br)C(=O)N MCULE-9226586148 [2,0,0,0,0,0|2,0,0]=4 1144 B5R0.5 CC(Br)C(=O)O MCULE-3935837943 [2,0,0,0,0,0|1,0,0]=3 1145 B5R0.5 CC(Br)C(=O)O MCULE-6068441065 [2,0,0,0,0,0|1,0,0]=3 1146 B5R0.5 CC(C)B(O)O MCULE-1255589444 [2,0,0,0,0,0|1,0,1]=4 1147 B5R0.5 CC(C)C(=N)N MCULE-2464075086 [2,0,0,0,0,0|2,0,0]=4 1148 B5R0.5 CC(C)C(=N)N MCULE-6743996580 [2,0,0,0,0,0|2,0,0]=4 1149 B5R0.5 CC(C)C(=O)Br MCULE-3679003896 [2,0,0,0,0,0|1,0,0]=3 1150 B5R0.5 CC(C)C(=O)Cl MCULE-6582236331 [2,0,0,0,0,0|1,0,0]=3 1151 B5R0.5 CC(C)C(=O)N MCULE-9773835068 [2,0,0,0,0,0|1,0,0]=3 1152 B5R0.5 CC(C)C(=O)O MCULE-7783770647 [2,0,0,0,0,0|0,0,0]=2 1153 B5R0.5 CC(C)C(=O)S MCULE-9552406593 [2,0,0,0,0,0|0,1,0]=3 1154 B5R0.5 CC(C)C(=S)N MCULE-3546856315 [2,0,0,0,0,0|1,1,0]=4 1155 B5R0.5 CC(C)C(C)O MCULE-4829392845 [2,0,0,0,0,0|1,0,1]=4 1156 B5R0.5 CC(C)N(=O)=O MCULE-8418443353 [2,0,0,0,0,0|1,0,1]=4 1157 B5R0.5 CC(C)S(=O)N MCULE-8425110407 [2,0,0,0,0,0|2,0,0]=4 1158 B5R0.5 CC(C)S(=O)O MCULE-5200056082 [2,0,0,0,0,0|1,0,0]=3 1159 B5R0.5 CC(C)S(=O)[O-] MCULE-2354817364 [2,0,0,0,0,0|1,0,1]=4 1160 B5R0.5 CC(C)[C@@H](C)O MCULE-3565458505 [2,0,0,0,0,0|1,0,1]=4 1161 B5R0.5 CC(C)[C@H](C)O MCULE-1553214756 [2,0,0,0,0,0|1,0,1]=4 1162 B5R0.5 CC(C)[C@H](C)O MCULE-8141633445 [2,0,0,0,0,0|1,0,1]=4 1163 B5R0.5 CC(Cl)C(=O)Cl MCULE-6547241717 [2,0,0,0,0,0|2,0,0]=4 1164 B5R0.5 CC(Cl)C(=O)N MCULE-5322078211 [2,0,0,0,0,0|2,0,0]=4 1165 B5R0.5 CC(Cl)C(=O)O MCULE-3597230803 [2,0,0,0,0,0|1,0,0]=3 1166 B5R0.5 CC(Cl)C(=O)O MCULE-5449120618 [2,0,0,0,0,0|1,0,0]=3 1167 B5R0.5 CC(F)C(=O)O MCULE-7334922730 [2,0,0,0,0,0|1,0,0]=3 1168 B5R0.5 CC(I)C(=O)N MCULE-8608495554 [2,0,0,0,0,0|2,0,0]=4 1169 B5R0.5 CC(N)C(=O)N MCULE-1264398810 [2,0,0,0,0,0|1,0,0]=3 1170 B5R0.5 CC(N)C(=O)N MCULE-2251123672 [2,0,0,0,0,0|1,0,0]=3 1171 B5R0.5 CC(N)C(=O)N MCULE-2273926073 [2,0,0,0,0,0|1,0,0]=3 1172 B5R0.5 CC(N)C(=O)N MCULE-5340923071 [2,0,0,0,0,0|1,0,0]=3 1173 B5R0.5 CC(N)C(=O)N MCULE-6061233032 [2,0,0,0,0,0|1,0,0]=3 1174 B5R0.5 CC(N)C(=O)N MCULE-9273221837 [2,0,0,0,0,0|1,0,0]=3 1175 B5R0.5 CC(N)C(=O)O MCULE-3498369789 [2,0,0,0,0,0|0,0,0]=2 1176 B5R0.5 CC(N)C(=O)O MCULE-3809839392 [2,0,0,0,0,0|0,0,0]=2 1177 B5R0.5 CC(N)C(=O)O MCULE-4751903561 [2,0,0,0,0,0|0,0,0]=2 1178 B5R0.5 CC(N)C(=O)O MCULE-6963397848 [2,0,0,0,0,0|0,0,0]=2 1179 B5R0.5 CC(N)C(C)O MCULE-3512899672 [2,0,0,0,0,0|1,0,1]=4 1180 B5R0.5 CC(N)C(C)O MCULE-6286987696 [2,0,0,0,0,0|1,0,1]=4 1181 B5R0.5 CC(O)C(=O)N MCULE-6247123668 [2,0,0,0,0,0|2,0,0]=4 1182 B5R0.5 CC(O)C(=O)N MCULE-7823792358 [2,0,0,0,0,0|2,0,0]=4 1183 B5R0.5 CC(O)C(=O)O MCULE-3922256529 [2,0,0,0,0,0|1,0,0]=3 1184 B5R0.5 CC(O)C(=O)O MCULE-5387110670 [2,0,0,0,0,0|1,0,0]=3 1185 B5R0.5 CC(O)C(=O)[O-] MCULE-1056716990 [2,0,0,0,0,0|1,0,1]=4 1186 B5R0.5 CC(O)C(=O)[O-] MCULE-8184872865 [2,0,0,0,0,0|1,0,1]=4 1187 B5R0.5 CC(O)C(=O)[O-] MCULE-8730993694 [2,0,0,0,0,0|1,0,1]=4 1188 B5R0.5 CC(S)C(=O)N MCULE-1465182001 [2,0,0,0,0,0|2,0,0]=4 1189 B5R0.5 CC(S)C(=O)O MCULE-6944738352 [2,0,0,0,0,0|1,0,0]=3 1190 B5R0.5 CN(C)C(=O)Cl MCULE-1738506605 [2,0,0,0,0,0|2,0,0]=4 1191 B5R0.5 CN(C)C(=O)N MCULE-3142720631 [2,0,0,0,0,0|2,0,0]=4 1192 B5R0.5 CN(C)C(=O)O MCULE-1039144559 [2,0,0,0,0,0|1,0,0]=3 1193 B5R0.5 CN(C)C(=O)[O-] MCULE-5405204721 [2,0,0,0,0,0|1,0,1]=4 1194 B5R0.5 CN(N)C(=O)N MCULE-9114734246 [2,0,0,0,0,0|2,0,0]=4 1195 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8303539222 [2,0,0,0,0,0|1,0,0]=3 1196 B5R0.5 C[C@@H](Br)C(=O)O MCULE-8530283309 [2,0,0,0,0,0|1,0,0]=3 1197 B5R0.5 C[C@@H](Cl)C(=O)Cl MCULE-3579498695 [2,0,0,0,0,0|2,0,0]=4 1198 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-6578788045 [2,0,0,0,0,0|1,0,0]=3 1199 B5R0.5 C[C@@H](Cl)C(=O)O MCULE-8314108697 [2,0,0,0,0,0|1,0,0]=3 1200 B5R0.5 C[C@@H](F)C(=O)N MCULE-1505685009 [2,0,0,0,0,0|2,0,0]=4 1201 B5R0.5 C[C@@H](N)C(=O)N MCULE-4677983549 [2,0,0,0,0,0|1,0,0]=3 1202 B5R0.5 C[C@@H](N)C(=O)N MCULE-6112443507 [2,0,0,0,0,0|1,0,0]=3 1203 B5R0.5 C[C@@H](N)C(=O)N MCULE-7940270709 [2,0,0,0,0,0|1,0,0]=3 1204 B5R0.5 C[C@@H](N)C(=O)N MCULE-8482332558 [2,0,0,0,0,0|1,0,0]=3 1205 B5R0.5 C[C@@H](N)C(=O)O MCULE-3571488623 [2,0,0,0,0,0|0,0,0]=2 1206 B5R0.5 C[C@@H](N)C(=O)O MCULE-9756365751 [2,0,0,0,0,0|0,0,0]=2 1207 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-4537991630 [2,0,0,0,0,0|1,0,1]=4 1208 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5710552020 [2,0,0,0,0,0|1,0,1]=4 1209 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5951487868 [2,0,0,0,0,0|1,0,1]=4 1210 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8093543292 [2,0,0,0,0,0|1,0,1]=4 1211 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8196664475 [2,0,0,0,0,0|1,0,1]=4 1212 B5R0.5 C[C@@H](O)C(=O)N MCULE-2026557726 [2,0,0,0,0,0|2,0,0]=4 1213 B5R0.5 C[C@@H](O)C(=O)N MCULE-8056291801 [2,0,0,0,0,0|2,0,0]=4 1214 B5R0.5 C[C@@H](O)C(=O)O MCULE-4625208788 [2,0,0,0,0,0|1,0,0]=3 1215 B5R0.5 C[C@@H](O)C(=O)O MCULE-9141235095 [2,0,0,0,0,0|1,0,0]=3 1216 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-5673591667 [2,0,0,0,0,0|1,0,1]=4 1217 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-8146434340 [2,0,0,0,0,0|1,0,1]=4 1218 B5R0.5 C[C@@H](O)C(=O)[O-] MCULE-9026662277 [2,0,0,0,0,0|1,0,1]=4 1219 B5R0.5 C[C@H](Br)C(=O)Cl MCULE-2960953088 [2,0,0,0,0,0|2,0,0]=4 1220 B5R0.5 C[C@H](Br)C(=O)O MCULE-4788730445 [2,0,0,0,0,0|1,0,0]=3 1221 B5R0.5 C[C@H](Br)C(=O)O MCULE-9354978281 [2,0,0,0,0,0|1,0,0]=3 1222 B5R0.5 C[C@H](Cl)C(=O)O MCULE-4816831649 [2,0,0,0,0,0|1,0,0]=3 1223 B5R0.5 C[C@H](Cl)C(=O)O MCULE-8389122613 [2,0,0,0,0,0|1,0,0]=3 1224 B5R0.5 C[C@H](F)C(=O)N MCULE-7457242428 [2,0,0,0,0,0|2,0,0]=4 1225 B5R0.5 C[C@H](N)C(=O)N MCULE-4716963408 [2,0,0,0,0,0|1,0,0]=3 1226 B5R0.5 C[C@H](N)C(=O)N MCULE-6879702251 [2,0,0,0,0,0|1,0,0]=3 1227 B5R0.5 C[C@H](N)C(=O)N MCULE-7090555441 [2,0,0,0,0,0|1,0,0]=3 1228 B5R0.5 C[C@H](N)C(=O)N MCULE-7293369315 [2,0,0,0,0,0|1,0,0]=3 1229 B5R0.5 C[C@H](N)C(=O)N MCULE-7341432132 [2,0,0,0,0,0|1,0,0]=3 1230 B5R0.5 C[C@H](N)C(=O)N MCULE-7556063213 [2,0,0,0,0,0|1,0,0]=3 1231 B5R0.5 C[C@H](N)C(=O)N MCULE-8320991932 [2,0,0,0,0,0|1,0,0]=3 1232 B5R0.5 C[C@H](N)C(=O)N MCULE-8491573930 [2,0,0,0,0,0|1,0,0]=3 1233 B5R0.5 C[C@H](N)C(=O)O MCULE-4916719758 [2,0,0,0,0,0|0,0,0]=2 1234 B5R0.5 C[C@H](N)C(=O)O MCULE-5261590548 [2,0,0,0,0,0|0,0,0]=2 1235 B5R0.5 C[C@H](N)C(=O)O MCULE-7791919887 [2,0,0,0,0,0|0,0,0]=2 1236 B5R0.5 C[C@H](N)C(=O)O MCULE-8724854497 [2,0,0,0,0,0|0,0,0]=2 1237 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-6389040758 [2,0,0,0,0,0|1,0,1]=4 1238 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-7956913866 [2,0,0,0,0,0|1,0,1]=4 1239 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1340338147 [2,0,0,0,0,0|1,0,1]=4 1240 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1738016964 [2,0,0,0,0,0|1,0,1]=4 1241 B5R0.5 C[C@H](N)[C@H](C)O MCULE-2254798251 [2,0,0,0,0,0|1,0,1]=4 1242 B5R0.5 C[C@H](N)[C@H](C)O MCULE-7688101680 [2,0,0,0,0,0|1,0,1]=4 1243 B5R0.5 C[C@H](O)C(=O)N MCULE-8400190365 [2,0,0,0,0,0|2,0,0]=4 1244 B5R0.5 C[C@H](O)C(=O)O MCULE-5695391344 [2,0,0,0,0,0|1,0,0]=3 1245 B5R0.5 C[C@H](O)C(=O)O MCULE-8864689875 [2,0,0,0,0,0|1,0,0]=3 1246 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-1034285072 [2,0,0,0,0,0|1,0,1]=4 1247 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-3598405830 [2,0,0,0,0,0|1,0,1]=4 1248 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-7525689298 [2,0,0,0,0,0|1,0,1]=4 1249 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8057429776 [2,0,0,0,0,0|1,0,1]=4 1250 B5R0.5 C[C@H](O)C(=O)[O-] MCULE-8729310894 [2,0,0,0,0,0|1,0,1]=4 1251 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-3776841970 [2,0,0,0,0,0|1,0,1]=4 1252 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-4906999918 [2,0,0,0,0,0|1,0,1]=4 1253 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5860404631 [2,0,0,0,0,0|1,0,1]=4 1254 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5888789996 [2,0,0,0,0,0|1,0,1]=4 1255 B5R0.5 NC(=O)C(=O)O MCULE-4442165428 [2,0,0,0,0,0|1,0,1]=4 1256 B5R0.5 NC(O)C(=O)O MCULE-6546070388 [2,0,0,0,0,0|1,0,0]=3 1257 B5R0.5 O=C(O)C(Br)Br MCULE-4908900588 [2,0,0,0,0,0|2,0,0]=4 1258 B5R0.5 O=C(O)C(Cl)Br MCULE-4569127340 [2,0,0,0,0,0|2,0,0]=4 1259 B5R0.5 O=C(O)C(Cl)Cl MCULE-1246638159 [2,0,0,0,0,0|2,0,0]=4 1260 B5R0.5 O=C(O)C(F)Br MCULE-5639771935 [2,0,0,0,0,0|2,0,0]=4 1261 B5R0.5 O=C(O)C(F)Cl MCULE-8791727704 [2,0,0,0,0,0|2,0,0]=4 1262 B5R0.5 O=C(O)C(F)F MCULE-9791449975 [2,0,0,0,0,0|2,0,0]=4 1263 B5R0.5 O=C(O)C(F)I MCULE-2596137309 [2,0,0,0,0,0|2,0,0]=4 1264 B5R0.5 O=C(O)C(O)O MCULE-8045135900 [2,0,0,0,0,0|2,0,0]=4 1265 B5R0.5 O=C(O)[C@@H](F)Cl MCULE-9934674808 [2,0,0,0,0,0|2,0,0]=4 1266 B5R0.5 O=C(O)[C@H](F)Cl MCULE-8184552815 [2,0,0,0,0,0|2,0,0]=4 1267 B5R0.5 [C@@H](C)(O)C(=O)N MCULE-6953360641 [2,0,0,0,0,0|2,0,0]=4 1268 B5R0.4 C#CC(C)(C)N MCULE-3908309106 [2,0,0,0,0,0|1,0,1]=4 1269 B5R0.4 C#CC(C)(C)N MCULE-4795277170 [2,0,0,0,0,0|1,0,1]=4 1270 B5R0.4 C=CC(C)(C)C MCULE-9118431864 [2,0,0,0,0,0|2,0,0]=4 1271 B5R0.4 C=CC(C)(C)Cl MCULE-4502558407 [2,0,0,0,0,0|2,0,0]=4 1272 B5R0.4 C=CC(C)(C)N MCULE-2016559865 [2,0,0,0,0,0|1,0,0]=3 1273 B5R0.4 C=CC(C)(C)N MCULE-2690537002 [2,0,0,0,0,0|1,0,0]=3 1274 B5R0.4 C=CC(C)(C)O MCULE-5809739830 [2,0,0,0,0,0|2,0,0]=4 1275 B5R0.4 CC(C)(Br)C=O MCULE-8695321251 [2,0,0,0,0,0|1,0,0]=3 1276 B5R0.4 CC(C)(Br)CO MCULE-5949221311 [2,0,0,0,0,0|1,0,1]=4 1277 B5R0.4 CC(C)(C)C=O MCULE-6866358966 [2,0,0,0,0,0|1,0,0]=3 1278 B5R0.4 CC(C)(C)CO MCULE-4399535684 [2,0,0,0,0,0|1,0,1]=4 1279 B5R0.4 CC(C)(C)N=O MCULE-9098145731 [2,0,0,0,0,0|2,0,0]=4 1280 B5R0.4 CC(C)(C)NO MCULE-4676405280 [2,0,0,0,0,0|2,0,0]=4 1281 B5R0.4 CC(C)(C)NO MCULE-6482556352 [2,0,0,0,0,0|2,0,0]=4 1282 B5R0.4 CC(C)(C)NO MCULE-7368313644 [2,0,0,0,0,0|2,0,0]=4 1283 B5R0.4 CC(C)(C)OO MCULE-2835127745 [2,0,0,0,0,0|2,0,0]=4 1284 B5R0.4 CC(C)(F)C=O MCULE-4323838362 [2,0,0,0,0,0|1,0,0]=3 1285 B5R0.4 CC(C)(F)CO MCULE-1700621997 [2,0,0,0,0,0|1,0,1]=4 1286 B5R0.4 CC(C)(N)C#N MCULE-4837687196 [2,0,0,0,0,0|1,0,1]=4 1287 B5R0.4 CC(C)(N)C#N MCULE-7947575054 [2,0,0,0,0,0|1,0,1]=4 1288 B5R0.4 CC(C)(N)CCl MCULE-2098848089 [2,0,0,0,0,0|1,0,1]=4 1289 B5R0.4 CC(C)(N)CCl MCULE-2847180011 [2,0,0,0,0,0|1,0,1]=4 1290 B5R0.4 CC(C)(N)CF MCULE-3102233948 [2,0,0,0,0,0|1,0,1]=4 1291 B5R0.4 CC(C)(N)CF MCULE-9737357598 [2,0,0,0,0,0|1,0,1]=4 1292 B5R0.4 CC(C)(N)CN MCULE-4218187677 [2,0,0,0,0,0|1,0,1]=4 1293 B5R0.4 CC(C)(N)CN MCULE-6476068080 [2,0,0,0,0,0|1,0,1]=4 1294 B5R0.4 CC(C)(N)CO MCULE-4072416202 [2,0,0,0,0,0|0,0,1]=3 1295 B5R0.4 CC(C)(N)CO MCULE-4209651459 [2,0,0,0,0,0|0,0,1]=3 1296 B5R0.4 CC(C)(N)CO MCULE-6047079177 [2,0,0,0,0,0|0,0,1]=3 1297 B5R0.4 CC(C)(O)C=O MCULE-2581637282 [2,0,0,0,0,0|1,0,0]=3 1298 B5R0.4 CC(C)(O)CBr MCULE-6366129174 [2,0,0,0,0,0|2,0,0]=4 1299 B5R0.4 CC(C)(O)CCl MCULE-3118028441 [2,0,0,0,0,0|2,0,0]=4 1300 B5R0.4 CC(C)(O)CF MCULE-6616447132 [2,0,0,0,0,0|2,0,0]=4 1301 B5R0.4 CC(C)(O)CI MCULE-5132198363 [2,0,0,0,0,0|2,0,0]=4 1302 B5R0.4 CC(C)(O)CN MCULE-5270413077 [2,0,0,0,0,0|2,0,0]=4 1303 B5R0.4 CC(C)(O)CN MCULE-7438555366 [2,0,0,0,0,0|2,0,0]=4 1304 B5R0.4 CC(C)(O)CO MCULE-6797456030 [2,0,0,0,0,0|1,0,1]=4 1305 B5R0.4 CC(C)(O)CS MCULE-2370088388 [2,0,0,0,0,0|2,0,0]=4 1306 B5R0.4 CC(C)(S)CO MCULE-6119329508 [2,0,0,0,0,0|1,0,1]=4 1307 B5R0.4 CCC(C)(C)Br MCULE-8895489875 [2,0,0,0,0,0|1,0,1]=4 1308 B5R0.4 CCC(C)(C)C MCULE-3388707671 [2,0,0,0,0,0|1,0,1]=4 1309 B5R0.4 CCC(C)(C)Cl MCULE-9597829372 [2,0,0,0,0,0|1,0,1]=4 1310 B5R0.4 CCC(C)(C)I MCULE-3678105747 [2,0,0,0,0,0|1,0,1]=4 1311 B5R0.4 CCC(C)(C)N MCULE-5538333672 [2,0,0,0,0,0|0,0,1]=3 1312 B5R0.4 CCC(C)(C)O MCULE-7894262803 [2,0,0,0,0,0|1,0,0]=3 1313 B5R0.4 CCC(C)(Cl)Cl MCULE-7771494508 [2,0,0,0,0,0|2,0,0]=4 1314 B5R0.4 CCC(C)(F)F MCULE-9944788511 [2,0,0,0,0,0|2,0,0]=4 1315 B5R0.4 CCS(=N)(=O)C MCULE-6682726319 [2,0,0,0,0,0|1,0,1]=4 1316 B5R0.4 CCS(=O)(=O)C MCULE-8932195925 [2,0,0,0,0,0|2,0,0]=4 1317 B5R0.4 CCS(=O)(=O)N MCULE-4542844597 [2,0,0,0,0,0|2,0,0]=4 1318 B7R0.5 C#CCC(C)C(=O)O MCULE-4819055703 [1,1,0,0,0,0|0,0,1]=3 1319 B7R0.5 C#CCC(F)C(=O)O MCULE-1070671235 [1,1,0,0,0,0|1,0,1]=4 1320 B7R0.5 C#CCC(N)C(=O)O MCULE-2022398365 [1,1,0,0,0,0|0,0,1]=3 1321 B7R0.5 C#CCC(N)C(=O)O MCULE-2451098139 [1,1,0,0,0,0|0,0,1]=3 1322 B7R0.5 C#CCC(N)C(=O)O MCULE-4330300997 [1,1,0,0,0,0|0,0,1]=3 1323 B7R0.5 C#CCC(N)C(=O)O MCULE-5100293043 [1,1,0,0,0,0|0,0,1]=3 1324 B7R0.5 C#CCC(O)C(=O)O MCULE-4988425198 [1,1,0,0,0,0|1,0,1]=4 1325 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-1266511504 [1,1,0,0,0,0|0,0,1]=3 1326 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-2589808316 [1,1,0,0,0,0|0,0,1]=3 1327 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-4703021434 [1,1,0,0,0,0|0,0,1]=3 1328 B7R0.5 C#CC[C@@H](N)C(=O)O MCULE-5616417783 [1,1,0,0,0,0|0,0,1]=3 1329 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-1593368546 [1,1,0,0,0,0|0,0,1]=3 1330 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-5683421535 [1,1,0,0,0,0|0,0,1]=3 1331 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-7302855511 [1,1,0,0,0,0|0,0,1]=3 1332 B7R0.5 C#CC[C@H](N)C(=O)O MCULE-9256626051 [1,1,0,0,0,0|0,0,1]=3 1333 B7R0.5 C=C(CCC)C(=O)O MCULE-5702167426 [1,1,0,0,0,0|0,0,2]=4 1334 B7R0.5 C=C(CCO)C(=O)O MCULE-3336434079 [1,1,0,0,0,0|0,0,2]=4 1335 B7R0.5 C=C(COC)C(=O)O MCULE-8964616960 [1,1,0,0,0,0|0,0,2]=4 1336 B7R0.5 C=C=CC(C)C(=O)O MCULE-3438905862 [1,1,0,0,0,0|0,0,2]=4 1337 B7R0.5 C=CCC(C)C(=O)C MCULE-4395269639 [1,1,0,0,0,0|1,0,1]=4 1338 B7R0.5 C=CCC(C)C(=O)O MCULE-2912410432 [1,1,0,0,0,0|0,0,1]=3 1339 B7R0.5 C=CCC(N)C(=O)O MCULE-1550468430 [1,1,0,0,0,0|0,0,1]=3 1340 B7R0.5 C=CCC(N)C(=O)O MCULE-1783682768 [1,1,0,0,0,0|0,0,1]=3 1341 B7R0.5 C=CCC(N)C(=O)O MCULE-8721864064 [1,1,0,0,0,0|0,0,1]=3 1342 B7R0.5 C=CCC(N)C(=O)O MCULE-9091562338 [1,1,0,0,0,0|0,0,1]=3 1343 B7R0.5 C=CCC(O)C(=O)O MCULE-6418899544 [1,1,0,0,0,0|1,0,1]=4 1344 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-3817126030 [1,1,0,0,0,0|0,0,1]=3 1345 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-5479618260 [1,1,0,0,0,0|0,0,1]=3 1346 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-6719393730 [1,1,0,0,0,0|0,0,1]=3 1347 B7R0.5 C=CC[C@@H](N)C(=O)O MCULE-7577627870 [1,1,0,0,0,0|0,0,1]=3 1348 B7R0.5 C=CC[C@@H](O)C(=O)O MCULE-4103471826 [1,1,0,0,0,0|1,0,1]=4 1349 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-2073484196 [1,1,0,0,0,0|0,0,1]=3 1350 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-3267648941 [1,1,0,0,0,0|0,0,1]=3 1351 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-4183531139 [1,1,0,0,0,0|0,0,1]=3 1352 B7R0.5 C=CC[C@H](N)C(=O)O MCULE-8225762047 [1,1,0,0,0,0|0,0,1]=3 1353 B7R0.5 C=CC[C@H](O)C(=O)O MCULE-8230827617 [1,1,0,0,0,0|1,0,1]=4 1354 B7R0.5 CC(=O)C(C)CCBr MCULE-4705039689 [1,1,0,0,0,0|1,0,0]=3 1355 B7R0.5 CC(=O)C(C)CCCl MCULE-2960091698 [1,1,0,0,0,0|1,0,0]=3 1356 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [1,1,0,0,0,0|1,0,0]=3 1357 B7R0.5 CC(=O)C(Cl)CCCl MCULE-4634341484 [1,1,0,0,0,0|2,0,0]=4 1358 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [1,1,0,0,0,0|2,0,0]=4 1359 B7R0.5 CC(=O)N(C)CCN MCULE-3153405152 [1,1,0,0,0,0|2,0,0]=4 1360 B7R0.5 CC(=O)N(C)CCN MCULE-4043248689 [1,1,0,0,0,0|2,0,0]=4 1361 B7R0.5 CC(=O)N(C)CCO MCULE-4135818139 [1,1,0,0,0,0|2,0,0]=4 1362 B7R0.5 CC(CCCl)C(=O)Cl MCULE-4844969943 [1,1,0,0,0,0|1,0,0]=3 1363 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [1,1,0,0,0,0|0,0,0]=2 1364 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [1,1,0,0,0,0|0,0,0]=2 1365 B7R0.5 CC(CCN)S(=O)C MCULE-4983155747 [1,1,0,0,0,0|2,0,0]=4 1366 B7R0.5 CC(CCO)C(=O)N MCULE-3037868887 [1,1,0,0,0,0|1,0,0]=3 1367 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [1,1,0,0,0,0|0,0,0]=2 1368 B7R0.5 CC(CCO)C(=O)[O-] MCULE-2278638513 [1,1,0,0,0,0|0,0,1]=3 1369 B7R0.5 CC(N=N#N)C(=O)O MCULE-1449528032 [1,1,0,0,0,0|2,0,0]=4 1370 B7R0.5 CC(N=N#N)C(=O)O MCULE-6367123914 [1,1,0,0,0,0|2,0,0]=4 1371 B7R0.5 CC(NC=O)C(=O)O MCULE-7277951464 [1,1,0,0,0,0|1,0,1]=4 1372 B7R0.5 CC/C=C(\C)/C(=O)O MCULE-1290613859 [1,1,0,0,0,0|0,0,1]=3 1373 B7R0.5 CC=CC(C)C(=O)O MCULE-5584906296 [1,1,0,0,0,0|0,0,1]=3 1374 B7R0.5 CC=CC(O)C(=O)O MCULE-5249095255 [1,1,0,0,0,0|1,0,1]=4 1375 B7R0.5 CCC=C(C)C(=O)O MCULE-5045441145 [1,1,0,0,0,0|0,0,1]=3 1376 B7R0.5 CCC=C(F)C(=O)O MCULE-6630499680 [1,1,0,0,0,0|1,0,1]=4 1377 B7R0.5 CCCC(=O)C(=O)O MCULE-5281491858 [1,1,0,0,0,0|1,0,1]=4 1378 B7R0.5 CCCC(Br)C(=O)C MCULE-2062903416 [1,1,0,0,0,0|2,0,0]=4 1379 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [1,1,0,0,0,0|1,0,0]=3 1380 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [1,1,0,0,0,0|1,0,0]=3 1381 B7R0.5 CCCC(C)C(=O)Cl MCULE-4855016209 [1,1,0,0,0,0|1,0,0]=3 1382 B7R0.5 CCCC(C)C(=O)N MCULE-1948746391 [1,1,0,0,0,0|1,0,0]=3 1383 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [1,1,0,0,0,0|0,0,0]=2 1384 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [1,1,0,0,0,0|1,0,1]=4 1385 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [1,1,0,0,0,0|1,0,0]=3 1386 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [1,1,0,0,0,0|1,0,0]=3 1387 B7R0.5 CCCC(N)C(=O)N MCULE-5159221123 [1,1,0,0,0,0|1,0,0]=3 1388 B7R0.5 CCCC(N)C(=O)N MCULE-5742773956 [1,1,0,0,0,0|1,0,0]=3 1389 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [1,1,0,0,0,0|0,0,0]=2 1390 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [1,1,0,0,0,0|0,0,0]=2 1391 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [1,1,0,0,0,0|0,0,0]=2 1392 B7R0.5 CCCC(O)C(=O)N MCULE-3143432132 [1,1,0,0,0,0|2,0,0]=4 1393 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [1,1,0,0,0,0|1,0,0]=3 1394 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [1,1,0,0,0,0|1,0,0]=3 1395 B7R0.5 CCCN(C)C(=O)Cl MCULE-2930764127 [1,1,0,0,0,0|2,0,0]=4 1396 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [1,1,0,0,0,0|0,0,0]=2 1397 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [1,1,0,0,0,0|0,0,0]=2 1398 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [1,1,0,0,0,0|1,0,0]=3 1399 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [1,1,0,0,0,0|1,0,0]=3 1400 B7R0.5 CCC[C@H](N)C(=O)N MCULE-2163059771 [1,1,0,0,0,0|1,0,0]=3 1401 B7R0.5 CCC[C@H](N)C(=O)N MCULE-4687172013 [1,1,0,0,0,0|1,0,0]=3 1402 B7R0.5 CCC[C@H](N)C(=O)N MCULE-7482592029 [1,1,0,0,0,0|1,0,0]=3 1403 B7R0.5 CCC[C@H](N)C(=O)N MCULE-9639796243 [1,1,0,0,0,0|1,0,0]=3 1404 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [1,1,0,0,0,0|0,0,0]=2 1405 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [1,1,0,0,0,0|0,0,0]=2 1406 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [1,1,0,0,0,0|0,0,0]=2 1407 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [1,1,0,0,0,0|1,0,0]=3 1408 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [1,1,0,0,0,0|1,0,0]=3 1409 B7R0.5 CCNC(=O)C(=O)O MCULE-1213485294 [1,1,0,0,0,0|1,0,1]=4 1410 B7R0.5 CCNC(C)C(=O)N MCULE-2861818493 [1,1,0,0,0,0|1,0,0]=3 1411 B7R0.5 CCNC(C)C(=O)N MCULE-6110291237 [1,1,0,0,0,0|1,0,0]=3 1412 B7R0.5 CCNC(C)C(=O)O MCULE-5445574810 [1,1,0,0,0,0|0,0,0]=2 1413 B7R0.5 CCNC(C)C(=O)O MCULE-5666785247 [1,1,0,0,0,0|0,0,0]=2 1414 B7R0.5 CCN[C@H](C)C(=O)O MCULE-9676358201 [1,1,0,0,0,0|0,0,0]=2 1415 B7R0.5 CCOC(=O)C(=O)O MCULE-2368024441 [1,1,0,0,0,0|1,0,1]=4 1416 B7R0.5 CCOC(C)C(=O)O MCULE-2185795311 [1,1,0,0,0,0|0,0,0]=2 1417 B7R0.5 CCOC(C)C(=S)N MCULE-2027801148 [1,1,0,0,0,0|1,1,0]=4 1418 B7R0.5 CCSC(C)C(=O)O MCULE-9817243573 [1,1,0,0,0,0|0,0,0]=2 1419 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [1,1,0,0,0,0|0,0,0]=2 1420 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [1,1,0,0,0,0|0,0,0]=2 1421 B7R0.5 CNCC(N)C(=O)O MCULE-4360775406 [1,1,0,0,0,0|0,0,0]=2 1422 B7R0.5 CNCC(N)C(=O)O MCULE-4913403405 [1,1,0,0,0,0|0,0,0]=2 1423 B7R0.5 CNC[C@H](N)C(=O)O MCULE-3465445123 [1,1,0,0,0,0|0,0,0]=2 1424 B7R0.5 CNC[C@H](N)C(=O)O MCULE-7309489523 [1,1,0,0,0,0|0,0,0]=2 1425 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8418254346 [1,1,0,0,0,0|0,0,0]=2 1426 B7R0.5 CNC[C@H](N)C(=O)O MCULE-8752314299 [1,1,0,0,0,0|0,0,0]=2 1427 B7R0.5 COCC(Br)C(=O)O MCULE-2977381282 [1,1,0,0,0,0|1,0,0]=3 1428 B7R0.5 COCC(C)C(=O)C MCULE-5328927786 [1,1,0,0,0,0|1,0,0]=3 1429 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [1,1,0,0,0,0|0,0,0]=2 1430 B7R0.5 COCC(C)C(=S)N MCULE-6392999047 [1,1,0,0,0,0|1,1,0]=4 1431 B7R0.5 COCC(Cl)C(=O)O MCULE-1439107016 [1,1,0,0,0,0|1,0,0]=3 1432 B7R0.5 COCC(N)C(=O)N MCULE-2465830538 [1,1,0,0,0,0|1,0,0]=3 1433 B7R0.5 COCC(N)C(=O)N MCULE-6194410780 [1,1,0,0,0,0|1,0,0]=3 1434 B7R0.5 COCC(N)C(=O)O MCULE-4336440568 [1,1,0,0,0,0|0,0,0]=2 1435 B7R0.5 COCC(N)C(=O)O MCULE-4899043582 [1,1,0,0,0,0|0,0,0]=2 1436 B7R0.5 COCC(N)C(=O)O MCULE-6964823693 [1,1,0,0,0,0|0,0,0]=2 1437 B7R0.5 COCC(N)C(=O)O MCULE-7037870255 [1,1,0,0,0,0|0,0,0]=2 1438 B7R0.5 COCC(O)C(=O)O MCULE-3185498869 [1,1,0,0,0,0|1,0,0]=3 1439 B7R0.5 COC[C@@H](N)C(=O)O MCULE-1827086666 [1,1,0,0,0,0|0,0,0]=2 1440 B7R0.5 COC[C@@H](N)C(=O)O MCULE-4868456769 [1,1,0,0,0,0|0,0,0]=2 1441 B7R0.5 COC[C@@H](N)C(=O)O MCULE-5275247485 [1,1,0,0,0,0|0,0,0]=2 1442 B7R0.5 COC[C@@H](N)C(=O)O MCULE-7339751251 [1,1,0,0,0,0|0,0,0]=2 1443 B7R0.5 COC[C@H](N)C(=O)O MCULE-3719679803 [1,1,0,0,0,0|0,0,0]=2 1444 B7R0.5 COC[C@H](N)C(=O)O MCULE-4874807874 [1,1,0,0,0,0|0,0,0]=2 1445 B7R0.5 COC[C@H](N)C(=O)O MCULE-5303156917 [1,1,0,0,0,0|0,0,0]=2 1446 B7R0.5 COC[C@H](N)C(=O)O MCULE-8138564560 [1,1,0,0,0,0|0,0,0]=2 1447 B7R0.5 CON=C(C)C(=O)O MCULE-8599774085 [1,1,0,0,0,0|1,0,1]=4 1448 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [1,1,0,0,0,0|0,0,0]=2 1449 B7R0.5 CSCC(N)C(=O)O MCULE-7668628251 [1,1,0,0,0,0|0,0,0]=2 1450 B7R0.5 CSC[C@H](N)C(=O)O MCULE-1178337776 [1,1,0,0,0,0|0,0,0]=2 1451 B7R0.5 CSC[C@H](N)C(=O)O MCULE-2769761337 [1,1,0,0,0,0|0,0,0]=2 1452 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [1,1,0,0,0,0|0,0,0]=2 1453 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O MCULE-2214426945 [1,1,0,0,0,0|2,0,0]=4 1454 B7R0.5 C[C@@H](N=[N+]=[N-])C(=O)O MCULE-6124505236 [1,1,0,0,0,0|2,0,0]=4 1455 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O MCULE-3591368470 [1,1,0,0,0,0|2,0,0]=4 1456 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O MCULE-5109353470 [1,1,0,0,0,0|2,0,0]=4 1457 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O MCULE-6277841083 [1,1,0,0,0,0|2,0,0]=4 1458 B7R0.5 C[C@H](N=[N+]=[N-])C(=O)O MCULE-7843278634 [1,1,0,0,0,0|2,0,0]=4 1459 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-3824082361 [1,1,0,0,0,0|1,0,1]=4 1460 B7R0.5 C[C@H](NC=O)C(=O)O MCULE-5248110352 [1,1,0,0,0,0|1,0,1]=4 1461 B7R0.5 C[Se]CC(N)C(=O)O MCULE-3357465269 [1,1,0,0,0,0|0,0,0]=2 1462 B7R0.5 C[Se]CC(N)C(=O)O MCULE-7671606756 [1,1,0,0,0,0|0,0,0]=2 1463 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-5208306365 [1,1,0,0,0,0|0,0,0]=2 1464 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6734478742 [1,1,0,0,0,0|0,0,0]=2 1465 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-6760615750 [1,1,0,0,0,0|0,0,0]=2 1466 B7R0.5 C[Se]C[C@H](N)C(=O)O MCULE-7512025617 [1,1,0,0,0,0|0,0,0]=2 1467 B7R0.5 N#CCC(N)C(=O)O MCULE-4929926467 [1,1,0,0,0,0|0,0,1]=3 1468 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6294926701 [1,1,0,0,0,0|0,0,1]=3 1469 B7R0.5 N#CC[C@H](N)C(=O)O MCULE-6432920316 [1,1,0,0,0,0|0,0,1]=3 1470 B7R0.5 NC(=O)C(Br)CCBr MCULE-5008510444 [1,1,0,0,0,0|2,0,0]=4 1471 B7R0.5 NC(CCBr)C(=O)O MCULE-1900559475 [1,1,0,0,0,0|0,0,0]=2 1472 B7R0.5 NC(CCBr)C(=O)O MCULE-7293320576 [1,1,0,0,0,0|0,0,0]=2 1473 B7R0.5 NC(CCF)C(=O)O MCULE-5519595590 [1,1,0,0,0,0|0,0,0]=2 1474 B7R0.5 NC(CCF)C(=O)O MCULE-7293194855 [1,1,0,0,0,0|0,0,0]=2 1475 B7R0.5 NC(CCO)C(=O)O MCULE-1744838687 [1,1,0,0,0,0|0,0,0]=2 1476 B7R0.5 NC(CCO)C(=O)O MCULE-9642233758 [1,1,0,0,0,0|0,0,0]=2 1477 B7R0.5 NC(CCS)C(=O)O MCULE-8057550187 [1,1,0,0,0,0|0,0,0]=2 1478 B7R0.5 NC(CCS)C(=O)O MCULE-8117596001 [1,1,0,0,0,0|0,0,0]=2 1479 B7R0.5 NC(CNO)C(=O)O MCULE-2332662988 [1,1,0,0,0,0|1,0,0]=3 1480 B7R0.5 NCCC(F)C(=O)O MCULE-5068755002 [1,1,0,0,0,0|1,0,0]=3 1481 B7R0.5 NCCC(F)C(=O)O MCULE-9196695600 [1,1,0,0,0,0|1,0,0]=3 1482 B7R0.5 NCCC(N)C(=O)O MCULE-1239764966 [1,1,0,0,0,0|0,0,0]=2 1483 B7R0.5 NCCC(N)C(=O)O MCULE-2441123923 [1,1,0,0,0,0|0,0,0]=2 1484 B7R0.5 NCCC(N)C(=O)O MCULE-3966593369 [1,1,0,0,0,0|0,0,0]=2 1485 B7R0.5 NCCC(N)C(=O)O MCULE-4212078130 [1,1,0,0,0,0|0,0,0]=2 1486 B7R0.5 NCCC(N)C(=O)O MCULE-7713366571 [1,1,0,0,0,0|0,0,0]=2 1487 B7R0.5 NCCC(N)C(=O)O MCULE-8402131049 [1,1,0,0,0,0|0,0,0]=2 1488 B7R0.5 NCCC(N)C(=O)O MCULE-9198187552 [1,1,0,0,0,0|0,0,0]=2 1489 B7R0.5 NCCC(O)C(=O)O MCULE-3670080484 [1,1,0,0,0,0|1,0,0]=3 1490 B7R0.5 NCCC(O)C(=O)O MCULE-6540935279 [1,1,0,0,0,0|1,0,0]=3 1491 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-4000770618 [1,1,0,0,0,0|0,0,0]=2 1492 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-5775312784 [1,1,0,0,0,0|0,0,0]=2 1493 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-6259961704 [1,1,0,0,0,0|0,0,0]=2 1494 B7R0.5 NCC[C@@H](N)C(=O)O MCULE-9871958374 [1,1,0,0,0,0|0,0,0]=2 1495 B7R0.5 NCC[C@@H](O)C(=O)O MCULE-9726912888 [1,1,0,0,0,0|1,0,0]=3 1496 B7R0.5 NCC[C@H](N)C(=O)O MCULE-1745978456 [1,1,0,0,0,0|0,0,0]=2 1497 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3856066353 [1,1,0,0,0,0|0,0,0]=2 1498 B7R0.5 NCC[C@H](N)C(=O)O MCULE-3919721317 [1,1,0,0,0,0|0,0,0]=2 1499 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5434373726 [1,1,0,0,0,0|0,0,0]=2 1500 B7R0.5 NCC[C@H](N)C(=O)O MCULE-5992578597 [1,1,0,0,0,0|0,0,0]=2 1501 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6536533546 [1,1,0,0,0,0|0,0,0]=2 1502 B7R0.5 NCC[C@H](N)C(=O)O MCULE-6978035806 [1,1,0,0,0,0|0,0,0]=2 1503 B7R0.5 NCC[C@H](N)C(=O)O MCULE-8762011291 [1,1,0,0,0,0|0,0,0]=2 1504 B7R0.5 NCC[C@H](N)C(=O)O MCULE-9645608127 [1,1,0,0,0,0|0,0,0]=2 1505 B7R0.5 NCC[C@H](O)C(=O)O MCULE-3296998083 [1,1,0,0,0,0|1,0,0]=3 1506 B7R0.5 NCC[C@H](O)C(=O)O MCULE-7901866019 [1,1,0,0,0,0|1,0,0]=3 1507 B7R0.5 NOC[C@H](N)C(=O)O MCULE-1050292176 [1,1,0,0,0,0|1,0,0]=3 1508 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2388269464 [1,1,0,0,0,0|0,0,0]=2 1509 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-2456796412 [1,1,0,0,0,0|0,0,0]=2 1510 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-6229782603 [1,1,0,0,0,0|0,0,0]=2 1511 B7R0.5 N[C@@H](CCBr)C(=O)O MCULE-8123446168 [1,1,0,0,0,0|0,0,0]=2 1512 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-2370353784 [1,1,0,0,0,0|0,0,0]=2 1513 B7R0.5 N[C@@H](CCO)C(=O)O MCULE-4861747928 [1,1,0,0,0,0|0,0,0]=2 1514 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-4021115723 [1,1,0,0,0,0|0,0,0]=2 1515 B7R0.5 N[C@@H](CCS)C(=O)O MCULE-7661321953 [1,1,0,0,0,0|0,0,0]=2 1516 B7R0.5 N[C@@H](CSS)C(=O)O MCULE-3029500977 [1,1,0,0,0,0|1,0,0]=3 1517 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-1975650690 [1,1,0,0,0,0|0,0,0]=2 1518 B7R0.5 N[C@H](CCBr)C(=O)O MCULE-7245104465 [1,1,0,0,0,0|0,0,0]=2 1519 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8005652100 [1,1,0,0,0,0|0,0,0]=2 1520 B7R0.5 N[C@H](CCO)C(=O)O MCULE-8613625039 [1,1,0,0,0,0|0,0,0]=2 1521 B7R0.5 N[C@H](CCS)C(=O)O MCULE-1110046008 [1,1,0,0,0,0|0,0,0]=2 1522 B7R0.5 N[C@H](CCS)C(=O)O MCULE-7556963357 [1,1,0,0,0,0|0,0,0]=2 1523 B7R0.5 O=C(Br)C(Br)CCBr MCULE-1496301616 [1,1,0,0,0,0|2,0,0]=4 1524 B7R0.5 O=C(Cl)C(Br)CCBr MCULE-9787639147 [1,1,0,0,0,0|2,0,0]=4 1525 B7R0.5 O=C(Cl)C(Br)CCCl MCULE-6400872582 [1,1,0,0,0,0|2,0,0]=4 1526 B7R0.5 O=C(O)C(Br)CCBr MCULE-3091819269 [1,1,0,0,0,0|1,0,0]=3 1527 B7R0.5 O=C(O)C(O)CCO MCULE-9096271794 [1,1,0,0,0,0|1,0,0]=3 1528 B7R0.5 [C@H](N)(CC#C)C(=O)O MCULE-7308061694 [1,1,0,0,0,0|0,0,1]=3 1529 B7R0.10 C/C=C(/C)\C(=O)OC MCULE-6490619453 [1,1,0,0,0,0|0,0,2]=4 1530 B7R0.10 C/C=C(\C)/C(=O)OC MCULE-2521624465 [1,1,0,0,0,0|0,0,2]=4 1531 B7R0.10 C=C(CC)C(=O)OC MCULE-2064145693 [1,1,0,0,0,0|0,0,2]=4 1532 B7R0.10 C=CC(=O)N(C)CC MCULE-8629361048 [1,1,0,0,0,0|2,0,0]=4 1533 B7R0.10 C=CC(N)C(=O)OC MCULE-6449924585 [1,1,0,0,0,0|0,0,2]=4 1534 B7R0.10 C=CC(N)C(=O)OC MCULE-8138684326 [1,1,0,0,0,0|0,0,2]=4 1535 B7R0.10 CC(CCl)C(=N)NO MCULE-4023987029 [1,1,0,0,0,0|2,0,0]=4 1536 B7R0.10 CC=C(C)C(=O)OC MCULE-7431996149 [1,1,0,0,0,0|0,0,2]=4 1537 B7R0.10 CCC(=O)C(=O)OC MCULE-6526576267 [1,1,0,0,0,0|1,0,1]=4 1538 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [1,1,0,0,0,0|2,0,0]=4 1539 B7R0.10 CCC(=O)N(C)CC MCULE-1764457516 [1,1,0,0,0,0|2,0,0]=4 1540 B7R0.10 CCC(Br)C(=O)NC MCULE-5335067622 [1,1,0,0,0,0|2,0,0]=4 1541 B7R0.10 CCC(Br)C(=O)OC MCULE-2335527491 [1,1,0,0,0,0|1,0,0]=3 1542 B7R0.10 CCC(C)/C(=N/O)/N MCULE-3220820796 [1,1,0,0,0,0|1,0,0]=3 1543 B7R0.10 CCC(C)/C(=N/O)/N MCULE-6860766298 [1,1,0,0,0,0|1,0,0]=3 1544 B7R0.10 CCC(C)C(=O)CBr MCULE-7022126762 [1,1,0,0,0,0|1,0,0]=3 1545 B7R0.10 CCC(C)C(=O)CCl MCULE-6800466655 [1,1,0,0,0,0|1,0,0]=3 1546 B7R0.10 CCC(C)C(=O)NC MCULE-5599095900 [1,1,0,0,0,0|1,0,0]=3 1547 B7R0.10 CCC(C)C(=O)NN MCULE-4144584435 [1,1,0,0,0,0|1,0,0]=3 1548 B7R0.10 CCC(C)C(=O)OC MCULE-9845747952 [1,1,0,0,0,0|0,0,0]=2 1549 B7R0.10 CCC(C)C(N)CO MCULE-3990781918 [1,1,0,0,0,0|1,0,1]=4 1550 B7R0.10 CCC(C)C(N)CO MCULE-9261445768 [1,1,0,0,0,0|1,0,1]=4 1551 B7R0.10 CCC(C)C(O)CC MCULE-3936368693 [1,1,0,0,0,0|1,0,1]=4 1552 B7R0.10 CCC(C)C(O)CN MCULE-1941564207 [1,1,0,0,0,0|1,0,1]=4 1553 B7R0.10 CCC(C)C(O)CO MCULE-9999862073 [1,1,0,0,0,0|0,0,2]=4 1554 B7R0.10 CCC(Cl)C(=O)OC MCULE-4773486285 [1,1,0,0,0,0|1,0,0]=3 1555 B7R0.10 CCC(N)C(=O)NC MCULE-7274856339 [1,1,0,0,0,0|1,0,0]=3 1556 B7R0.10 CCC(N)C(=O)NC MCULE-9912780545 [1,1,0,0,0,0|1,0,0]=3 1557 B7R0.10 CCC(N)C(=O)NO MCULE-9162328479 [1,1,0,0,0,0|0,0,0]=2 1558 B7R0.10 CCC(N)C(=O)OC MCULE-1569242271 [1,1,0,0,0,0|0,0,0]=2 1559 B7R0.10 CCC(N)C(=O)OC MCULE-3183954116 [1,1,0,0,0,0|0,0,0]=2 1560 B7R0.10 CCC(N)C(=O)OC MCULE-4045754117 [1,1,0,0,0,0|0,0,0]=2 1561 B7R0.10 CCC(N)C(=O)OC MCULE-5328984047 [1,1,0,0,0,0|0,0,0]=2 1562 B7R0.10 CCC(N)C(O)CC MCULE-3578258801 [1,1,0,0,0,0|1,0,1]=4 1563 B7R0.10 CCC(O)C(=O)OC MCULE-8768500574 [1,1,0,0,0,0|1,0,0]=3 1564 B7R0.10 CCN(C)C(=O)CBr MCULE-4444194334 [1,1,0,0,0,0|2,0,0]=4 1565 B7R0.10 CCN(C)C(=O)CCl MCULE-7762522604 [1,1,0,0,0,0|2,0,0]=4 1566 B7R0.10 CC[C@@H](Br)C(=O)OC MCULE-2676798410 [1,1,0,0,0,0|1,0,0]=3 1567 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-2122638055 [1,1,0,0,0,0|1,0,1]=4 1568 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-7964651759 [1,1,0,0,0,0|1,0,1]=4 1569 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-8482653298 [1,1,0,0,0,0|1,0,1]=4 1570 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6794991435 [1,1,0,0,0,0|0,0,0]=2 1571 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-6825672331 [1,1,0,0,0,0|0,0,0]=2 1572 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-7307663817 [1,1,0,0,0,0|0,0,0]=2 1573 B7R0.10 CC[C@@H](N)C(=O)OC MCULE-8717527808 [1,1,0,0,0,0|0,0,0]=2 1574 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-6916010003 [1,1,0,0,0,0|1,0,0]=3 1575 B7R0.10 CC[C@@H](O)C(=O)OC MCULE-9376722018 [1,1,0,0,0,0|1,0,0]=3 1576 B7R0.10 CC[C@H](Br)C(=O)OC MCULE-5490793206 [1,1,0,0,0,0|1,0,0]=3 1577 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-3647332227 [1,1,0,0,0,0|1,0,1]=4 1578 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-5774547825 [1,1,0,0,0,0|1,0,1]=4 1579 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8401203397 [1,1,0,0,0,0|1,0,1]=4 1580 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8452836661 [1,1,0,0,0,0|1,0,1]=4 1581 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-9307589673 [1,1,0,0,0,0|1,0,1]=4 1582 B7R0.10 CC[C@H](N)C(=O)OC MCULE-2336816190 [1,1,0,0,0,0|0,0,0]=2 1583 B7R0.10 CC[C@H](N)C(=O)OC MCULE-3480066740 [1,1,0,0,0,0|0,0,0]=2 1584 B7R0.10 CC[C@H](N)C(=O)OC MCULE-4883083558 [1,1,0,0,0,0|0,0,0]=2 1585 B7R0.10 CC[C@H](N)C(=O)OC MCULE-6241184216 [1,1,0,0,0,0|0,0,0]=2 1586 B7R0.10 CC[C@H](O)C(=O)OC MCULE-5873092635 [1,1,0,0,0,0|1,0,0]=3 1587 B7R0.10 CC[C@H](O)C(=O)OC MCULE-8209874812 [1,1,0,0,0,0|1,0,0]=3 1588 B7R0.10 CNC(=O)C(C)CN MCULE-6853199259 [1,1,0,0,0,0|2,0,0]=4 1589 B7R0.10 CNC(=O)C(C)CN MCULE-9315732080 [1,1,0,0,0,0|2,0,0]=4 1590 B7R0.10 CNC(=O)C(C)NC MCULE-5788965533 [1,1,0,0,0,0|2,0,0]=4 1591 B7R0.10 CNC(=O)C(N)CO MCULE-1507161216 [1,1,0,0,0,0|2,0,0]=4 1592 B7R0.10 CNC(=O)[C@H](C)NC MCULE-4236618966 [1,1,0,0,0,0|2,0,0]=4 1593 B7R0.10 CNC(=O)[C@H](C)NC MCULE-9974564724 [1,1,0,0,0,0|2,0,0]=4 1594 B7R0.10 CNC(C)C(=O)OC MCULE-1524259113 [1,1,0,0,0,0|1,0,0]=3 1595 B7R0.10 CNC(C)C(=O)OC MCULE-2414146201 [1,1,0,0,0,0|1,0,0]=3 1596 B7R0.10 CNC(C)C(=O)OC MCULE-3192973771 [1,1,0,0,0,0|1,0,0]=3 1597 B7R0.10 CNC(C)C(=O)OC MCULE-9929257431 [1,1,0,0,0,0|1,0,0]=3 1598 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-1271745038 [1,1,0,0,0,0|1,0,0]=3 1599 B7R0.10 CN[C@@H](C)C(=O)OC MCULE-3018199319 [1,1,0,0,0,0|1,0,0]=3 1600 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3420184809 [1,1,0,0,0,0|1,0,0]=3 1601 B7R0.10 CN[C@H](C)C(=O)OC MCULE-3818454089 [1,1,0,0,0,0|1,0,0]=3 1602 B7R0.10 CN[C@H](C)C(=O)OC MCULE-8297775033 [1,1,0,0,0,0|1,0,0]=3 1603 B7R0.10 CN[C@H](C)C(=O)OC MCULE-9637759835 [1,1,0,0,0,0|1,0,0]=3 1604 B7R0.10 COC(=O)C(Br)CBr MCULE-7056048789 [1,1,0,0,0,0|2,0,0]=4 1605 B7R0.10 COC(=O)C(Br)CF MCULE-4013908914 [1,1,0,0,0,0|2,0,0]=4 1606 B7R0.10 COC(=O)C(Br)CO MCULE-1678765423 [1,1,0,0,0,0|2,0,0]=4 1607 B7R0.10 COC(=O)C(Br)CO MCULE-8437488397 [1,1,0,0,0,0|2,0,0]=4 1608 B7R0.10 COC(=O)C(Br)OC MCULE-5672396067 [1,1,0,0,0,0|2,0,0]=4 1609 B7R0.10 COC(=O)C(C)C#N MCULE-3764857061 [1,1,0,0,0,0|1,0,1]=4 1610 B7R0.10 COC(=O)C(C)C=O MCULE-8461987901 [1,1,0,0,0,0|1,0,1]=4 1611 B7R0.10 COC(=O)C(C)CBr MCULE-5887558960 [1,1,0,0,0,0|1,0,0]=3 1612 B7R0.10 COC(=O)C(C)CBr MCULE-9291707503 [1,1,0,0,0,0|1,0,0]=3 1613 B7R0.10 COC(=O)C(C)CN MCULE-8139628698 [1,1,0,0,0,0|1,0,0]=3 1614 B7R0.10 COC(=O)C(C)CN MCULE-8839292519 [1,1,0,0,0,0|1,0,0]=3 1615 B7R0.10 COC(=O)C(C)CO MCULE-1168600238 [1,1,0,0,0,0|1,0,0]=3 1616 B7R0.10 COC(=O)C(C)CO MCULE-9207150786 [1,1,0,0,0,0|1,0,0]=3 1617 B7R0.10 COC(=O)C(C)CS MCULE-2870797526 [1,1,0,0,0,0|1,0,0]=3 1618 B7R0.10 COC(=O)C(C)OC MCULE-3274761391 [1,1,0,0,0,0|1,0,0]=3 1619 B7R0.10 COC(=O)C(C)ON MCULE-1829014190 [1,1,0,0,0,0|2,0,0]=4 1620 B7R0.10 COC(=O)C(C)ON MCULE-4104938309 [1,1,0,0,0,0|2,0,0]=4 1621 B7R0.10 COC(=O)C(C)SC MCULE-6914204626 [1,1,0,0,0,0|1,0,0]=3 1622 B7R0.10 COC(=O)C(Cl)CCl MCULE-3086208783 [1,1,0,0,0,0|2,0,0]=4 1623 B7R0.10 COC(=O)C(Cl)CO MCULE-9496750776 [1,1,0,0,0,0|2,0,0]=4 1624 B7R0.10 COC(=O)C(Cl)OC MCULE-8296320773 [1,1,0,0,0,0|2,0,0]=4 1625 B7R0.10 COC(=O)C(F)CN MCULE-3089053107 [1,1,0,0,0,0|2,0,0]=4 1626 B7R0.10 COC(=O)C(F)CN MCULE-5618581260 [1,1,0,0,0,0|2,0,0]=4 1627 B7R0.10 COC(=O)C(F)CO MCULE-2188518229 [1,1,0,0,0,0|2,0,0]=4 1628 B7R0.10 COC(=O)C(N)C#N MCULE-9016686741 [1,1,0,0,0,0|1,0,1]=4 1629 B7R0.10 COC(=O)C(N)CCl MCULE-2253564316 [1,1,0,0,0,0|1,0,0]=3 1630 B7R0.10 COC(=O)C(N)CCl MCULE-3851909822 [1,1,0,0,0,0|1,0,0]=3 1631 B7R0.10 COC(=O)C(N)CCl MCULE-4649966066 [1,1,0,0,0,0|1,0,0]=3 1632 B7R0.10 COC(=O)C(N)CCl MCULE-9193407415 [1,1,0,0,0,0|1,0,0]=3 1633 B7R0.10 COC(=O)C(N)CF MCULE-2617218019 [1,1,0,0,0,0|1,0,0]=3 1634 B7R0.10 COC(=O)C(N)CF MCULE-3926207531 [1,1,0,0,0,0|1,0,0]=3 1635 B7R0.10 COC(=O)C(N)CN MCULE-7949926265 [1,1,0,0,0,0|1,0,0]=3 1636 B7R0.10 COC(=O)C(N)CN MCULE-9215212479 [1,1,0,0,0,0|1,0,0]=3 1637 B7R0.10 COC(=O)C(N)CO MCULE-1874204534 [1,1,0,0,0,0|1,0,0]=3 1638 B7R0.10 COC(=O)C(N)CO MCULE-1907797317 [1,1,0,0,0,0|1,0,0]=3 1639 B7R0.10 COC(=O)C(N)CO MCULE-3851022091 [1,1,0,0,0,0|1,0,0]=3 1640 B7R0.10 COC(=O)C(N)CO MCULE-9875856930 [1,1,0,0,0,0|1,0,0]=3 1641 B7R0.10 COC(=O)C(N)CS MCULE-5131519605 [1,1,0,0,0,0|1,0,0]=3 1642 B7R0.10 COC(=O)C(N)CS MCULE-5561205392 [1,1,0,0,0,0|1,0,0]=3 1643 B7R0.10 COC(=O)C(N)CS MCULE-9291008448 [1,1,0,0,0,0|1,0,0]=3 1644 B7R0.10 COC(=O)C(N)CS MCULE-9963292576 [1,1,0,0,0,0|1,0,0]=3 1645 B7R0.10 COC(=O)C(O)CCl MCULE-1480405341 [1,1,0,0,0,0|2,0,0]=4 1646 B7R0.10 COC(=O)C(O)CN MCULE-1003241246 [1,1,0,0,0,0|2,0,0]=4 1647 B7R0.10 COC(=O)C(O)CN MCULE-9006804473 [1,1,0,0,0,0|2,0,0]=4 1648 B7R0.10 COC(=O)C(O)CO MCULE-1234820163 [1,1,0,0,0,0|2,0,0]=4 1649 B7R0.10 COC(=O)C(O)CO MCULE-2142801284 [1,1,0,0,0,0|2,0,0]=4 1650 B7R0.10 COC(=O)C(O)OC MCULE-5465190164 [1,1,0,0,0,0|2,0,0]=4 1651 B7R0.10 COC(=O)N(C)CCl MCULE-8717315487 [1,1,0,0,0,0|2,0,0]=4 1652 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8075978888 [1,1,0,0,0,0|2,0,0]=4 1653 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8903256620 [1,1,0,0,0,0|2,0,0]=4 1654 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-5530851181 [1,1,0,0,0,0|1,0,0]=3 1655 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-8885621324 [1,1,0,0,0,0|1,0,0]=3 1656 B7R0.10 COC(=O)[C@@H](C)CN MCULE-7205157481 [1,1,0,0,0,0|1,0,0]=3 1657 B7R0.10 COC(=O)[C@@H](C)CN MCULE-9885299909 [1,1,0,0,0,0|1,0,0]=3 1658 B7R0.10 COC(=O)[C@@H](C)CO MCULE-6738074317 [1,1,0,0,0,0|1,0,0]=3 1659 B7R0.10 COC(=O)[C@@H](C)CO MCULE-9697255968 [1,1,0,0,0,0|1,0,0]=3 1660 B7R0.10 COC(=O)[C@@H](F)CN MCULE-2209395189 [1,1,0,0,0,0|2,0,0]=4 1661 B7R0.10 COC(=O)[C@@H](F)CN MCULE-2951378763 [1,1,0,0,0,0|2,0,0]=4 1662 B7R0.10 COC(=O)[C@@H](F)CN MCULE-4599856185 [1,1,0,0,0,0|2,0,0]=4 1663 B7R0.10 COC(=O)[C@@H](F)CN MCULE-5571914049 [1,1,0,0,0,0|2,0,0]=4 1664 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-1649684135 [1,1,0,0,0,0|1,0,0]=3 1665 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-4803192908 [1,1,0,0,0,0|1,0,0]=3 1666 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-6514033613 [1,1,0,0,0,0|1,0,0]=3 1667 B7R0.10 COC(=O)[C@@H](N)CCl MCULE-7997387565 [1,1,0,0,0,0|1,0,0]=3 1668 B7R0.10 COC(=O)[C@@H](N)CN MCULE-4407014418 [1,1,0,0,0,0|1,0,0]=3 1669 B7R0.10 COC(=O)[C@@H](N)CN MCULE-4854066134 [1,1,0,0,0,0|1,0,0]=3 1670 B7R0.10 COC(=O)[C@@H](N)CN MCULE-5060962890 [1,1,0,0,0,0|1,0,0]=3 1671 B7R0.10 COC(=O)[C@@H](N)CN MCULE-8572432694 [1,1,0,0,0,0|1,0,0]=3 1672 B7R0.10 COC(=O)[C@@H](N)CO MCULE-2171593224 [1,1,0,0,0,0|1,0,0]=3 1673 B7R0.10 COC(=O)[C@@H](N)CO MCULE-3393088985 [1,1,0,0,0,0|1,0,0]=3 1674 B7R0.10 COC(=O)[C@@H](N)CO MCULE-5476910845 [1,1,0,0,0,0|1,0,0]=3 1675 B7R0.10 COC(=O)[C@@H](N)CO MCULE-9984439264 [1,1,0,0,0,0|1,0,0]=3 1676 B7R0.10 COC(=O)[C@@H](N)CS MCULE-2560943261 [1,1,0,0,0,0|1,0,0]=3 1677 B7R0.10 COC(=O)[C@@H](N)CS MCULE-3682774490 [1,1,0,0,0,0|1,0,0]=3 1678 B7R0.10 COC(=O)[C@@H](N)CS MCULE-6613123984 [1,1,0,0,0,0|1,0,0]=3 1679 B7R0.10 COC(=O)[C@@H](N)CS MCULE-7354291938 [1,1,0,0,0,0|1,0,0]=3 1680 B7R0.10 COC(=O)[C@@H](O)CN MCULE-1265508864 [1,1,0,0,0,0|2,0,0]=4 1681 B7R0.10 COC(=O)[C@@H](O)CN MCULE-2334791448 [1,1,0,0,0,0|2,0,0]=4 1682 B7R0.10 COC(=O)[C@@H](O)CN MCULE-6207278824 [1,1,0,0,0,0|2,0,0]=4 1683 B7R0.10 COC(=O)[C@@H](O)CN MCULE-6634004594 [1,1,0,0,0,0|2,0,0]=4 1684 B7R0.10 COC(=O)[C@@H](O)CO MCULE-3655137528 [1,1,0,0,0,0|2,0,0]=4 1685 B7R0.10 COC(=O)[C@@H](O)CO MCULE-5801355812 [1,1,0,0,0,0|2,0,0]=4 1686 B7R0.10 COC(=O)[C@H](Br)CO MCULE-8230787734 [1,1,0,0,0,0|2,0,0]=4 1687 B7R0.10 COC(=O)[C@H](C)C=O MCULE-9841785503 [1,1,0,0,0,0|1,0,1]=4 1688 B7R0.10 COC(=O)[C@H](C)CBr MCULE-3829202918 [1,1,0,0,0,0|1,0,0]=3 1689 B7R0.10 COC(=O)[C@H](C)CBr MCULE-4931737781 [1,1,0,0,0,0|1,0,0]=3 1690 B7R0.10 COC(=O)[C@H](C)CN MCULE-4694019206 [1,1,0,0,0,0|1,0,0]=3 1691 B7R0.10 COC(=O)[C@H](C)CN MCULE-9113866081 [1,1,0,0,0,0|1,0,0]=3 1692 B7R0.10 COC(=O)[C@H](C)CO MCULE-5719676432 [1,1,0,0,0,0|1,0,0]=3 1693 B7R0.10 COC(=O)[C@H](C)CO MCULE-8479546806 [1,1,0,0,0,0|1,0,0]=3 1694 B7R0.10 COC(=O)[C@H](C)OC MCULE-3095326114 [1,1,0,0,0,0|1,0,0]=3 1695 B7R0.10 COC(=O)[C@H](N)CCl MCULE-1199425954 [1,1,0,0,0,0|1,0,0]=3 1696 B7R0.10 COC(=O)[C@H](N)CCl MCULE-2611523756 [1,1,0,0,0,0|1,0,0]=3 1697 B7R0.10 COC(=O)[C@H](N)CCl MCULE-6503487325 [1,1,0,0,0,0|1,0,0]=3 1698 B7R0.10 COC(=O)[C@H](N)CCl MCULE-8714444412 [1,1,0,0,0,0|1,0,0]=3 1699 B7R0.10 COC(=O)[C@H](N)CO MCULE-4463451892 [1,1,0,0,0,0|1,0,0]=3 1700 B7R0.10 COC(=O)[C@H](N)CO MCULE-5622938569 [1,1,0,0,0,0|1,0,0]=3 1701 B7R0.10 COC(=O)[C@H](N)CO MCULE-6021580541 [1,1,0,0,0,0|1,0,0]=3 1702 B7R0.10 COC(=O)[C@H](N)CO MCULE-8237708167 [1,1,0,0,0,0|1,0,0]=3 1703 B7R0.10 COC(=O)[C@H](N)CS MCULE-1845308816 [1,1,0,0,0,0|1,0,0]=3 1704 B7R0.10 COC(=O)[C@H](N)CS MCULE-3480554390 [1,1,0,0,0,0|1,0,0]=3 1705 B7R0.10 COC(=O)[C@H](N)CS MCULE-4432617084 [1,1,0,0,0,0|1,0,0]=3 1706 B7R0.10 COC(=O)[C@H](N)CS MCULE-5747217193 [1,1,0,0,0,0|1,0,0]=3 1707 B7R0.10 COC(=O)[C@H](O)CN MCULE-5902729244 [1,1,0,0,0,0|2,0,0]=4 1708 B7R0.10 COC(=O)[C@H](O)CN MCULE-9252373981 [1,1,0,0,0,0|2,0,0]=4 1709 B7R0.10 COC(=O)[C@H](O)CO MCULE-4219956218 [1,1,0,0,0,0|2,0,0]=4 1710 B7R0.10 COC(=O)[C@H](O)CO MCULE-8891571940 [1,1,0,0,0,0|2,0,0]=4 1711 B7R0.10 COC(C)/C(=N/O)/N MCULE-3009628521 [1,1,0,0,0,0|2,0,0]=4 1712 B7R0.10 COC(C)C(=O)NN MCULE-7263059210 [1,1,0,0,0,0|2,0,0]=4 1713 B7R0.10 NC(CCl)C(=O)NO MCULE-8256545065 [1,1,0,0,0,0|1,0,0]=3 1714 B7R0.10 NNC(=O)C(N)CO MCULE-3324075598 [1,1,0,0,0,0|2,0,0]=4 1715 B7R0.10 NNC(=O)C(N)CO MCULE-6651241883 [1,1,0,0,0,0|2,0,0]=4 1716 B7R0.10 NNC(=O)[C@@H](N)CS MCULE-9375468264 [1,1,0,0,0,0|2,0,0]=4 1717 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [1,1,0,0,0,0|2,0,0]=4 1718 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [1,1,0,0,0,0|2,0,0]=4 1719 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [1,1,0,0,0,0|2,0,0]=4 1720 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [1,1,0,0,0,0|2,0,0]=4 1721 B7R0.10 [C@@H](C)(CC)[C@@H](N)CO MCULE-4423825378 [1,1,0,0,0,0|1,0,1]=4 1722 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-1799930850 [1,1,0,0,0,0|1,0,0]=3 1723 B7R0.10 [C@@H](C)(NC)C(=O)OC MCULE-5931188957 [1,1,0,0,0,0|1,0,0]=3 1724 B7R0.14 CCC(C)S(=N)(=O)C MCULE-7078981450 [1,1,0,0,0,0|2,0,0]=4 1725 B7R0.14 CCC(C)S(=O)(=O)Cl MCULE-2920227730 [1,1,0,0,0,0|1,0,1]=4 1726 B7R0.14 CCC(C)S(=O)(=O)N MCULE-1411854215 [1,1,0,0,0,0|1,0,1]=4 1727 B7R0.14 CCC(C)S(=O)(=O)O MCULE-3403875457 [1,1,0,0,0,0|1,0,0]=3 1728 B7R0.14 CCC(N)C(C)(C)O MCULE-2452246439 [1,1,0,0,0,0|1,0,1]=4 1729 B7R0.14 CCC(N)C(C)(C)O MCULE-3686970762 [1,1,0,0,0,0|1,0,1]=4 1730 B7R0.14 CCC(N)P(=O)(O)O MCULE-5746903883 [1,1,0,0,0,0|1,0,0]=3 1731 B7R0.14 CCC(O)S(=O)(=O)O MCULE-8714704624 [1,1,0,0,0,0|2,0,0]=4 1732 B7R0.14 CC[C@@H](N)C(C)(C)O MCULE-2250873384 [1,1,0,0,0,0|1,0,1]=4 1733 B7R0.14 CC[C@@H](N)C(C)(C)O MCULE-7069208023 [1,1,0,0,0,0|1,0,1]=4 1734 B7R0.14 CC[C@H](N)C(C)(C)O MCULE-6344226071 [1,1,0,0,0,0|1,0,1]=4 1735 B7R0.14 CC[C@H](N)C(C)(C)O MCULE-7677944024 [1,1,0,0,0,0|1,0,1]=4 1736 B7R0.15 C#CC(OC)C(=O)O MCULE-9292798546 [1,1,0,0,0,0|0,0,2]=4 1737 B7R0.15 C=C(C)C(CC)CC MCULE-2424136176 [1,1,0,0,0,0|2,0,0]=4 1738 B7R0.15 CC(=O)C(CO)CO MCULE-6408384667 [1,1,0,0,0,0|2,0,0]=4 1739 B7R0.15 CC=C(CC)C(=O)O MCULE-9303879981 [1,1,0,0,0,0|0,0,1]=3 1740 B7R0.15 CCC(C#N)C(=O)O MCULE-4808497444 [1,1,0,0,0,0|0,0,1]=3 1741 B7R0.15 CCC(CC)C(=O)C MCULE-5291760485 [1,1,0,0,0,0|1,0,0]=3 1742 B7R0.15 CCC(CC)C(=O)Cl MCULE-1027070009 [1,1,0,0,0,0|1,0,0]=3 1743 B7R0.15 CCC(CC)C(=O)N MCULE-7337294425 [1,1,0,0,0,0|1,0,0]=3 1744 B7R0.15 CCC(CC)C(=O)O MCULE-5236890306 [1,1,0,0,0,0|0,0,0]=2 1745 B7R0.15 CCC(CC)C(=S)N MCULE-8027076934 [1,1,0,0,0,0|1,1,0]=4 1746 B7R0.15 CCC(CC)C(C)O MCULE-9742014522 [1,1,0,0,0,0|1,0,1]=4 1747 B7R0.15 CCC(CN)C(=O)O MCULE-3795207054 [1,1,0,0,0,0|0,0,0]=2 1748 B7R0.15 CCC(CN)C(=O)O MCULE-3929048283 [1,1,0,0,0,0|0,0,0]=2 1749 B7R0.15 CCC(CO)C(=O)O MCULE-9435802738 [1,1,0,0,0,0|0,0,0]=2 1750 B7R0.15 CCC(CO)C(=O)[O-] MCULE-4277685135 [1,1,0,0,0,0|0,0,1]=3 1751 B7R0.15 CCC(NC)C(=O)N MCULE-1925914686 [1,1,0,0,0,0|1,0,0]=3 1752 B7R0.15 CCC(NC)C(=O)N MCULE-3283265693 [1,1,0,0,0,0|1,0,0]=3 1753 B7R0.15 CCC(NC)C(=O)O MCULE-4101988968 [1,1,0,0,0,0|0,0,0]=2 1754 B7R0.15 CCC(NC)C(=O)O MCULE-4491873969 [1,1,0,0,0,0|0,0,0]=2 1755 B7R0.15 CCC(NN)C(=O)O MCULE-8823684595 [1,1,0,0,0,0|0,0,0]=2 1756 B7R0.15 CCC(NO)C(=O)O MCULE-1962461048 [1,1,0,0,0,0|0,0,0]=2 1757 B7R0.15 CCC(OC)C(=O)N MCULE-4022181907 [1,1,0,0,0,0|1,0,0]=3 1758 B7R0.15 CCC(OC)C(=O)O MCULE-2475290794 [1,1,0,0,0,0|0,0,0]=2 1759 B7R0.15 CCC(SC)C(=O)O MCULE-3373016779 [1,1,0,0,0,0|0,0,0]=2 1760 B7R0.15 CCN(CC)C(=O)C MCULE-6584128098 [1,1,0,0,0,0|2,0,0]=4 1761 B7R0.15 CCN(CC)C(=O)Cl MCULE-2162985195 [1,1,0,0,0,0|2,0,0]=4 1762 B7R0.15 CCN(CC)C(=O)N MCULE-7011051295 [1,1,0,0,0,0|2,0,0]=4 1763 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-3190659348 [1,1,0,0,0,0|0,0,0]=2 1764 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-5613487575 [1,1,0,0,0,0|0,0,0]=2 1765 B7R0.15 CC[C@@H](CN)C(=O)O MCULE-6726398435 [1,1,0,0,0,0|0,0,0]=2 1766 B7R0.15 CC[C@H](CN)C(=O)O MCULE-2222410753 [1,1,0,0,0,0|0,0,0]=2 1767 B7R0.15 CC[C@H](CN)C(=O)O MCULE-3153536523 [1,1,0,0,0,0|0,0,0]=2 1768 B7R0.15 CC[C@H](CO)C(=O)O MCULE-3017159819 [1,1,0,0,0,0|0,0,0]=2 1769 B7R0.15 CC[C@H](NC)C(=O)N MCULE-6927041915 [1,1,0,0,0,0|1,0,0]=3 1770 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8566282898 [1,1,0,0,0,0|1,0,0]=3 1771 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8659413445 [1,1,0,0,0,0|1,0,0]=3 1772 B7R0.15 CC[C@H](NC)C(=O)N MCULE-8863599251 [1,1,0,0,0,0|1,0,0]=3 1773 B7R0.15 CNC(CN)C(=O)N MCULE-4431940195 [1,1,0,0,0,0|2,0,0]=4 1774 B7R0.15 CNC(CO)C(=O)O MCULE-1439435474 [1,1,0,0,0,0|1,0,0]=3 1775 B7R0.15 CNC(CO)C(=O)O MCULE-7611211207 [1,1,0,0,0,0|1,0,0]=3 1776 B7R0.15 CNC(CS)C(=O)O MCULE-4817727684 [1,1,0,0,0,0|1,0,0]=3 1777 B7R0.15 CNC(CS)C(=O)O MCULE-5741984055 [1,1,0,0,0,0|1,0,0]=3 1778 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3196852022 [1,1,0,0,0,0|1,0,0]=3 1779 B7R0.15 CN[C@@H](CN)C(=O)O MCULE-3690177999 [1,1,0,0,0,0|1,0,0]=3 1780 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-3320307572 [1,1,0,0,0,0|1,0,0]=3 1781 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-5844994620 [1,1,0,0,0,0|1,0,0]=3 1782 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6293854138 [1,1,0,0,0,0|1,0,0]=3 1783 B7R0.15 CN[C@@H](CO)C(=O)O MCULE-6463850730 [1,1,0,0,0,0|1,0,0]=3 1784 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-3043115433 [1,1,0,0,0,0|1,0,0]=3 1785 B7R0.15 CN[C@@H](CS)C(=O)O MCULE-8814760080 [1,1,0,0,0,0|1,0,0]=3 1786 B7R0.15 CN[C@H](CO)C(=O)O MCULE-1791141182 [1,1,0,0,0,0|1,0,0]=3 1787 B7R0.15 CN[C@H](CO)C(=O)O MCULE-9346314213 [1,1,0,0,0,0|1,0,0]=3 1788 B7R0.15 COC(CBr)C(=O)O MCULE-5528365617 [1,1,0,0,0,0|1,0,0]=3 1789 B7R0.15 COC(CN)C(=O)N MCULE-3215392526 [1,1,0,0,0,0|2,0,0]=4 1790 B7R0.15 COC(CN)C(=O)O MCULE-1561937449 [1,1,0,0,0,0|1,0,0]=3 1791 B7R0.15 COC(CN)C(=O)O MCULE-7501291426 [1,1,0,0,0,0|1,0,0]=3 1792 B7R0.15 COC(OC)C(=O)C MCULE-9746788369 [1,1,0,0,0,0|2,0,0]=4 1793 B7R0.15 COC(OC)C(=O)N MCULE-2624682764 [1,1,0,0,0,0|2,0,0]=4 1794 B7R0.15 COC(OC)C(=O)O MCULE-3341727181 [1,1,0,0,0,0|1,0,0]=3 1795 B7R0.15 COC(OC)C(=O)[O-] MCULE-5345464135 [1,1,0,0,0,0|1,0,1]=4 1796 B7R0.15 CO[C@@H](CN)C(=O)O MCULE-5536624827 [1,1,0,0,0,0|1,0,0]=3 1797 B7R0.15 CO[C@@H](CN)C(=O)O MCULE-6198841067 [1,1,0,0,0,0|1,0,0]=3 1798 B7R0.15 N#CC(CN)C(=O)O MCULE-3513807694 [1,1,0,0,0,0|1,0,1]=4 1799 B7R0.15 NCC(CO)C(=O)O MCULE-5510878508 [1,1,0,0,0,0|1,0,0]=3 1800 B7R0.15 NCC(CO)C(=O)O MCULE-9991285445 [1,1,0,0,0,0|1,0,0]=3 1801 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-4607648703 [1,1,0,0,0,0|1,0,0]=3 1802 B7R0.15 NC[C@@H](CO)C(=O)O MCULE-8943978569 [1,1,0,0,0,0|1,0,0]=3 1803 B7R0.15 NC[C@H](CO)C(=O)O MCULE-8459713640 [1,1,0,0,0,0|1,0,0]=3 1804 B7R0.15 O=C(O)C(CBr)CBr MCULE-5180730979 [1,1,0,0,0,0|1,0,0]=3 1805 B7R0.15 O=C(O)C(CS)CS MCULE-3175815620 [1,1,0,0,0,0|1,0,0]=3 1806 B7R0.15 O=C(O)[C@H](CO)NP MCULE-8418001133 [1,1,0,0,0,0|1,0,0]=3 1807 B7R0.16 C=C(C(=O)O)C(C)C MCULE-6667026437 [1,1,0,0,0,0|0,0,2]=4 1808 B7R0.16 C=C(C)C(C)C(=O)C MCULE-2480790812 [1,1,0,0,0,0|1,0,1]=4 1809 B7R0.16 C=C(C)C(N)C(=O)O MCULE-1815568719 [1,1,0,0,0,0|0,0,1]=3 1810 B7R0.16 C=C(C)C(N)C(=O)O MCULE-2839869274 [1,1,0,0,0,0|0,0,1]=3 1811 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5015326828 [1,1,0,0,0,0|0,0,1]=3 1812 B7R0.16 C=C(C)C(N)C(=O)O MCULE-5043630144 [1,1,0,0,0,0|0,0,1]=3 1813 B7R0.16 C=C(C)[C@@H](N)C(=C)O MCULE-5278584348 [1,1,0,0,0,0|1,0,1]=4 1814 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-2007035571 [1,1,0,0,0,0|0,0,1]=3 1815 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-6240689602 [1,1,0,0,0,0|0,0,1]=3 1816 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-8025014656 [1,1,0,0,0,0|0,0,1]=3 1817 B7R0.16 C=C(C)[C@@H](N)C(=O)O MCULE-9704891439 [1,1,0,0,0,0|0,0,1]=3 1818 B7R0.16 CC(=C(C)C(=O)O)Br MCULE-9431818570 [1,1,0,0,0,0|0,0,2]=4 1819 B7R0.16 CC(=C(C)C(=O)O)C MCULE-1062537992 [1,1,0,0,0,0|0,0,2]=4 1820 B7R0.16 CC(=O)C(Br)C(C)C MCULE-2864707278 [1,1,0,0,0,0|2,0,0]=4 1821 B7R0.16 CC(=O)C(C)C(=O)C MCULE-9607259412 [1,1,0,0,0,0|1,0,1]=4 1822 B7R0.16 CC(=O)C(Cl)C(C)C MCULE-2825069638 [1,1,0,0,0,0|2,0,0]=4 1823 B7R0.16 CC(=O)C(N)C(=O)C MCULE-6440496769 [1,1,0,0,0,0|1,0,1]=4 1824 B7R0.16 CC(=O)C(N)C(=O)C MCULE-8525737264 [1,1,0,0,0,0|1,0,1]=4 1825 B7R0.16 CC(Br)C(Br)C(=O)O MCULE-8605068480 [1,1,0,0,0,0|1,0,0]=3 1826 B7R0.16 CC(Br)C(O)C(=O)O MCULE-8231714451 [1,1,0,0,0,0|1,0,0]=3 1827 B7R0.16 CC(C(=O)O)C(=O)O MCULE-7232226851 [1,1,0,0,0,0|1,0,1]=4 1828 B7R0.16 CC(C(=O)O)N(C)C MCULE-2658921782 [1,1,0,0,0,0|1,0,0]=3 1829 B7R0.16 CC(C(=O)O)N(C)C MCULE-4457336101 [1,1,0,0,0,0|1,0,0]=3 1830 B7R0.16 CC(C(=O)O)N(C)N MCULE-1182323460 [1,1,0,0,0,0|1,0,0]=3 1831 B7R0.16 CC(C)C(=O)C(=O)O MCULE-9877767821 [1,1,0,0,0,0|1,0,1]=4 1832 B7R0.16 CC(C)C(Br)C(=O)Br MCULE-7135511419 [1,1,0,0,0,0|2,0,0]=4 1833 B7R0.16 CC(C)C(Br)C(=O)Cl MCULE-7468132927 [1,1,0,0,0,0|2,0,0]=4 1834 B7R0.16 CC(C)C(Br)C(=O)N MCULE-8059032804 [1,1,0,0,0,0|2,0,0]=4 1835 B7R0.16 CC(C)C(Br)C(=O)O MCULE-7284929535 [1,1,0,0,0,0|1,0,0]=3 1836 B7R0.16 CC(C)C(Br)C(=O)O MCULE-8100016953 [1,1,0,0,0,0|1,0,0]=3 1837 B7R0.16 CC(C)C(C)C(=O)Cl MCULE-4466867108 [1,1,0,0,0,0|1,0,0]=3 1838 B7R0.16 CC(C)C(C)C(=O)O MCULE-4998524686 [1,1,0,0,0,0|0,0,0]=2 1839 B7R0.16 CC(C)C(Cl)C(=O)Cl MCULE-8764699774 [1,1,0,0,0,0|2,0,0]=4 1840 B7R0.16 CC(C)C(Cl)C(=O)O MCULE-8634615546 [1,1,0,0,0,0|1,0,0]=3 1841 B7R0.16 CC(C)C(F)C(=O)O MCULE-5644342535 [1,1,0,0,0,0|1,0,0]=3 1842 B7R0.16 CC(C)C(N)C(=O)N MCULE-5793065876 [1,1,0,0,0,0|1,0,0]=3 1843 B7R0.16 CC(C)C(N)C(=O)N MCULE-6836215171 [1,1,0,0,0,0|1,0,0]=3 1844 B7R0.16 CC(C)C(N)C(=O)O MCULE-8140660263 [1,1,0,0,0,0|0,0,0]=2 1845 B7R0.16 CC(C)C(N)C(=O)O MCULE-9199801639 [1,1,0,0,0,0|0,0,0]=2 1846 B7R0.16 CC(C)C(O)C(=O)O MCULE-6517225229 [1,1,0,0,0,0|1,0,0]=3 1847 B7R0.16 CC(C)C(O)C(=O)O MCULE-7748605101 [1,1,0,0,0,0|1,0,0]=3 1848 B7R0.16 CC(C)N(C)C(=O)Cl MCULE-1063482503 [1,1,0,0,0,0|2,0,0]=4 1849 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-2705531785 [1,1,0,0,0,0|1,0,0]=3 1850 B7R0.16 CC(C)[C@@H](Br)C(=O)O MCULE-7570119486 [1,1,0,0,0,0|1,0,0]=3 1851 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2330575489 [1,1,0,0,0,0|1,0,0]=3 1852 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-2653474443 [1,1,0,0,0,0|1,0,0]=3 1853 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-3449326352 [1,1,0,0,0,0|1,0,0]=3 1854 B7R0.16 CC(C)[C@@H](N)C(=O)N MCULE-7409435805 [1,1,0,0,0,0|1,0,0]=3 1855 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-1338052740 [1,1,0,0,0,0|0,0,0]=2 1856 B7R0.16 CC(C)[C@@H](N)C(=O)O MCULE-2459930572 [1,1,0,0,0,0|0,0,0]=2 1857 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-7719048521 [1,1,0,0,0,0|1,0,0]=3 1858 B7R0.16 CC(C)[C@@H](O)C(=O)O MCULE-9864796653 [1,1,0,0,0,0|1,0,0]=3 1859 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-4863317096 [1,1,0,0,0,0|1,0,0]=3 1860 B7R0.16 CC(C)[C@H](Br)C(=O)O MCULE-8695526864 [1,1,0,0,0,0|1,0,0]=3 1861 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-4413397700 [1,1,0,0,0,0|0,0,0]=2 1862 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-6269612306 [1,1,0,0,0,0|0,0,0]=2 1863 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8084934210 [1,1,0,0,0,0|1,0,0]=3 1864 B7R0.16 CC(C)[C@H](Cl)C(=O)O MCULE-8307595659 [1,1,0,0,0,0|1,0,0]=3 1865 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-1415573194 [1,1,0,0,0,0|1,0,0]=3 1866 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-2742126302 [1,1,0,0,0,0|1,0,0]=3 1867 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-3124084676 [1,1,0,0,0,0|1,0,0]=3 1868 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-4854272542 [1,1,0,0,0,0|1,0,0]=3 1869 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-7430998836 [1,1,0,0,0,0|1,0,0]=3 1870 B7R0.16 CC(C)[C@H](N)C(=O)N MCULE-9899853579 [1,1,0,0,0,0|1,0,0]=3 1871 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-2507309072 [1,1,0,0,0,0|0,0,0]=2 1872 B7R0.16 CC(C)[C@H](N)C(=O)O MCULE-9143825935 [1,1,0,0,0,0|0,0,0]=2 1873 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-1975771806 [1,1,0,0,0,0|1,0,0]=3 1874 B7R0.16 CC(C)[C@H](O)C(=O)O MCULE-4070611738 [1,1,0,0,0,0|1,0,0]=3 1875 B7R0.16 CC(F)C(N)C(=O)O MCULE-8810968604 [1,1,0,0,0,0|0,0,0]=2 1876 B7R0.16 CC(N)C(C)C(=O)O MCULE-2921617741 [1,1,0,0,0,0|0,0,0]=2 1877 B7R0.16 CC(N)C(C)C(=O)O MCULE-8511267926 [1,1,0,0,0,0|0,0,0]=2 1878 B7R0.16 CC(N)C(O)C(=O)O MCULE-1086139043 [1,1,0,0,0,0|1,0,0]=3 1879 B7R0.16 CC(N)C(O)C(=O)O MCULE-6405300346 [1,1,0,0,0,0|1,0,0]=3 1880 B7R0.16 CC(O)C(C)C(=O)O MCULE-2499360516 [1,1,0,0,0,0|0,0,0]=2 1881 B7R0.16 CC(O)C(C)N(=O)=O MCULE-8190257217 [1,1,0,0,0,0|1,0,1]=4 1882 B7R0.16 CC(O)C(N)C(=O)N MCULE-1234785834 [1,1,0,0,0,0|1,0,0]=3 1883 B7R0.16 CC(O)C(N)C(=O)N MCULE-5867306342 [1,1,0,0,0,0|1,0,0]=3 1884 B7R0.16 CC(O)C(N)C(=O)O MCULE-1563595722 [1,1,0,0,0,0|0,0,0]=2 1885 B7R0.16 CC(O)C(N)C(=O)O MCULE-5581920538 [1,1,0,0,0,0|0,0,0]=2 1886 B7R0.16 C[C@@H](C(=O)O)N(C)C MCULE-1371350024 [1,1,0,0,0,0|1,0,0]=3 1887 B7R0.16 C[C@@H](C(=O)O)N(C)C MCULE-2001661938 [1,1,0,0,0,0|1,0,0]=3 1888 B7R0.16 C[C@@H](C(=O)O)N(C)C MCULE-6789128261 [1,1,0,0,0,0|1,0,0]=3 1889 B7R0.16 C[C@@H](N)[C@@H](N)C(=O)O MCULE-5302456851 [1,1,0,0,0,0|0,0,0]=2 1890 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-1663687439 [1,1,0,0,0,0|0,0,0]=2 1891 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-3863591433 [1,1,0,0,0,0|0,0,0]=2 1892 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-8080019797 [1,1,0,0,0,0|0,0,0]=2 1893 B7R0.16 C[C@@H](O)[C@@H](N)C(=O)O MCULE-9284411012 [1,1,0,0,0,0|0,0,0]=2 1894 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-1969228933 [1,1,0,0,0,0|1,0,0]=3 1895 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-3285041526 [1,1,0,0,0,0|1,0,0]=3 1896 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-5018319528 [1,1,0,0,0,0|1,0,0]=3 1897 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-6080625355 [1,1,0,0,0,0|1,0,0]=3 1898 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9393787536 [1,1,0,0,0,0|1,0,0]=3 1899 B7R0.16 C[C@@H](O)[C@H](N)C(=O)N MCULE-9925689829 [1,1,0,0,0,0|1,0,0]=3 1900 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2430667007 [1,1,0,0,0,0|0,0,0]=2 1901 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-2676185993 [1,1,0,0,0,0|0,0,0]=2 1902 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5254477364 [1,1,0,0,0,0|0,0,0]=2 1903 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-5505393195 [1,1,0,0,0,0|0,0,0]=2 1904 B7R0.16 C[C@@H](O)[C@H](N)C(=O)O MCULE-7379719940 [1,1,0,0,0,0|0,0,0]=2 1905 B7R0.16 C[C@@H](O)[C@H](O)C(=O)O MCULE-9383777855 [1,1,0,0,0,0|1,0,0]=3 1906 B7R0.16 C[C@H](C(=O)N)N(C)C MCULE-1489374162 [1,1,0,0,0,0|2,0,0]=4 1907 B7R0.16 C[C@H](C(=O)N)N(C)C MCULE-7938995734 [1,1,0,0,0,0|2,0,0]=4 1908 B7R0.16 C[C@H](C(=O)O)N(C)C MCULE-2210848569 [1,1,0,0,0,0|1,0,0]=3 1909 B7R0.16 C[C@H](C(=O)O)N(C)C MCULE-5148086527 [1,1,0,0,0,0|1,0,0]=3 1910 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2245171795 [1,1,0,0,0,0|0,0,0]=2 1911 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2727261050 [1,1,0,0,0,0|0,0,0]=2 1912 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O MCULE-8875933839 [1,1,0,0,0,0|0,0,0]=2 1913 B7R0.16 C[C@H](N)[C@@H](N)C(=O)O MCULE-9507122128 [1,1,0,0,0,0|0,0,0]=2 1914 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-2574349608 [1,1,0,0,0,0|1,0,0]=3 1915 B7R0.16 C[C@H](N)[C@@H](O)C(=O)O MCULE-6297204649 [1,1,0,0,0,0|1,0,0]=3 1916 B7R0.16 C[C@H](N)[C@H](N)C(=O)O MCULE-3178389621 [1,1,0,0,0,0|0,0,0]=2 1917 B7R0.16 C[C@H](O)C(N)C(=O)O MCULE-6661175670 [1,1,0,0,0,0|0,0,0]=2 1918 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-6288272506 [1,1,0,0,0,0|0,0,0]=2 1919 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-7203096302 [1,1,0,0,0,0|0,0,0]=2 1920 B7R0.16 C[C@H](O)[C@@H](N)C(=O)O MCULE-9531951265 [1,1,0,0,0,0|0,0,0]=2 1921 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-2246314901 [1,1,0,0,0,0|0,0,0]=2 1922 B7R0.16 C[C@H](O)[C@H](N)C(=O)O MCULE-9478987169 [1,1,0,0,0,0|0,0,0]=2 1923 B7R0.16 NC(C(=O)O)C(=O)O MCULE-6118746267 [1,1,0,0,0,0|1,0,1]=4 1924 B7R0.16 O=C(O)C(O)C(F)F MCULE-6750020534 [1,1,0,0,0,0|2,0,0]=4 1925 B7R0.17 CC(C)(C)P(=O)(O)O MCULE-6822028220 [1,1,0,0,0,0|2,0,0]=4 1926 B7R0.17 CC(C)(N)C(C)(C)O MCULE-3235981746 [1,1,0,0,0,0|1,0,1]=4 1927 B7R0.11 C=CC(C)(C)CCC MCULE-7100135827 [1,1,0,0,0,0|2,0,0]=4 1928 B7R0.11 C=CC(C)(C)CCN MCULE-5742499645 [1,1,0,0,0,0|2,0,0]=4 1929 B7R0.11 C=CC(C)(C)CCO MCULE-8304657692 [1,1,0,0,0,0|2,0,0]=4 1930 B7R0.11 C=CCC(C)(C)C=O MCULE-7775740469 [1,1,0,0,0,0|1,0,1]=4 1931 B7R0.11 C=CCC(C)(O)CC MCULE-9630662931 [1,1,0,0,0,0|2,0,0]=4 1932 B7R0.11 CC(C)(CO)CCN MCULE-5221703852 [1,1,0,0,0,0|1,0,1]=4 1933 B7R0.11 CC(C)(CO)CCN MCULE-7380535368 [1,1,0,0,0,0|1,0,1]=4 1934 B7R0.11 CC(C)(CO)CCO MCULE-1756560398 [1,1,0,0,0,0|1,0,1]=4 1935 B7R0.11 CC(C)(CO)NC=O MCULE-3904144073 [1,1,0,0,0,0|2,0,0]=4 1936 B7R0.11 CC(N)(CO)CCF MCULE-5569472665 [1,1,0,0,0,0|0,0,1]=3 1937 B7R0.11 CC(O)(CO)CCO MCULE-4148316300 [1,1,0,0,0,0|1,0,1]=4 1938 B7R0.11 CCC(C)(C)C=NO MCULE-6597900233 [1,1,0,0,0,0|1,0,0]=3 1939 B7R0.11 CCC(C)(C)CC=O MCULE-5511626130 [1,1,0,0,0,0|1,0,0]=3 1940 B7R0.11 CCC(C)(C)CCO MCULE-5248034600 [1,1,0,0,0,0|1,0,1]=4 1941 B7R0.11 CCC(C)(N)CCO MCULE-7673513204 [1,1,0,0,0,0|0,0,1]=3 1942 B7R0.11 CCC(C)(O)CCO MCULE-6173398477 [1,1,0,0,0,0|1,0,1]=4 1943 B7R0.11 CCCC(C)(C)C=O MCULE-1675435662 [1,1,0,0,0,0|1,0,0]=3 1944 B7R0.11 CCCC(C)(N)C#N MCULE-6266398743 [1,1,0,0,0,0|1,0,1]=4 1945 B7R0.11 CCCC(C)(N)CN MCULE-3215432035 [1,1,0,0,0,0|1,0,1]=4 1946 B7R0.11 CCCC(C)(N)CO MCULE-9180767555 [1,1,0,0,0,0|0,0,1]=3 1947 B7R0.11 CCCC(C)(O)CO MCULE-3737630396 [1,1,0,0,0,0|1,0,1]=4 1948 B7R0.11 CCNC(C)(C)CO MCULE-9120392867 [1,1,0,0,0,0|1,0,1]=4 1949 B7R0.11 CCNC(C)(C)CO MCULE-9465450982 [1,1,0,0,0,0|1,0,1]=4 1950 B7R0.11 CCOC(C)(C)C=O MCULE-7101941149 [1,1,0,0,0,0|1,0,0]=3 1951 B7R0.11 CCOC(C)(C)CO MCULE-6294474255 [1,1,0,0,0,0|1,0,1]=4 1952 B7R0.11 CCO[C@](C)(O)CO MCULE-2547633573 [1,1,0,0,0,0|1,0,1]=4 1953 B7R0.11 CNCC(C)(C)CO MCULE-1912751262 [1,1,0,0,0,0|1,0,1]=4 1954 B7R0.11 COC(C)(C)CC=O MCULE-7442199663 [1,1,0,0,0,0|2,0,0]=4 1955 B7R0.11 COCC(C)(C)C=O MCULE-9091298674 [1,1,0,0,0,0|1,0,0]=3 1956 B7R0.11 COCC(C)(C)CO MCULE-2985367717 [1,1,0,0,0,0|1,0,1]=4 1957 B7R0.11 COCC(C)(N)C#N MCULE-4779930875 [1,1,0,0,0,0|1,0,1]=4 1958 B7R0.11 COCC(C)(N)CN MCULE-1467574919 [1,1,0,0,0,0|1,0,1]=4 1959 B7R0.11 COCC(C)(N)CO MCULE-2603485329 [1,1,0,0,0,0|0,0,1]=3 1960 B7R0.11 COCC(C)(N)CO MCULE-3416999559 [1,1,0,0,0,0|0,0,1]=3 1961 B7R0.11 CSC(C)(C)CC=O MCULE-1759296791 [1,1,0,0,0,0|2,0,0]=4 1962 B7R0.11 CSCC(C)(C)CO MCULE-4089291196 [1,1,0,0,0,0|1,0,1]=4 1963 B7R0.11 CSCC(C)(N)C#N MCULE-4406087207 [1,1,0,0,0,0|1,0,1]=4 1964 B7R0.11 CSCC(C)(N)C#N MCULE-4987558587 [1,1,0,0,0,0|1,0,1]=4 1965 B7R0.18 C#CC(N)(CC)CC MCULE-3723234977 [1,1,0,0,0,0|1,0,1]=4 1966 B7R0.18 C#CC(N)(CC)CC MCULE-5947266532 [1,1,0,0,0,0|1,0,1]=4 1967 B7R0.18 C=CC(C)(CC)CO MCULE-3218490864 [1,1,0,0,0,0|1,0,1]=4 1968 B7R0.18 CC(C=O)(CO)CO MCULE-2216366062 [1,1,0,0,0,0|2,0,0]=4 1969 B7R0.18 CC(CN)(CO)CO MCULE-8513833512 [1,1,0,0,0,0|1,0,1]=4 1970 B7R0.18 CCC(C)(C#N)NC MCULE-3991970200 [1,1,0,0,0,0|1,0,1]=4 1971 B7R0.18 CCC(C)(C=O)CC MCULE-8427357130 [1,1,0,0,0,0|1,0,0]=3 1972 B7R0.18 CCC(C)(C=O)OC MCULE-8307303148 [1,1,0,0,0,0|1,0,0]=3 1973 B7R0.18 CCC(C)(CC)CN MCULE-8216748689 [1,1,0,0,0,0|1,0,1]=4 1974 B7R0.18 CCC(C)(CC)CN MCULE-8692148167 [1,1,0,0,0,0|1,0,1]=4 1975 B7R0.18 CCC(C)(CN)CO MCULE-2703250369 [1,1,0,0,0,0|0,0,1]=3 1976 B7R0.18 CCC(C)(CN)OC MCULE-4472544393 [1,1,0,0,0,0|2,0,0]=4 1977 B7R0.18 CCC(C)(CO)CO MCULE-6918244309 [1,1,0,0,0,0|1,0,1]=4 1978 B7R0.18 CCC(C)(CO)OC MCULE-2048434225 [1,1,0,0,0,0|1,0,1]=4 1979 B7R0.18 CCC(N)(C#N)CC MCULE-4136160537 [1,1,0,0,0,0|1,0,1]=4 1980 B7R0.18 CCC(N)(CC)CC MCULE-4252517795 [1,1,0,0,0,0|1,0,1]=4 1981 B7R0.18 CCC(N)(CC)CC MCULE-5828916987 [1,1,0,0,0,0|1,0,1]=4 1982 B7R0.18 CCC(N)(CC)CN MCULE-7290366649 [1,1,0,0,0,0|1,0,1]=4 1983 B7R0.18 CCC(N)(CC)CO MCULE-7822189565 [1,1,0,0,0,0|0,0,1]=3 1984 B7R0.18 CCC(N)(CO)CO MCULE-6627376273 [1,1,0,0,0,0|0,0,1]=3 1985 B7R0.18 CCC(O)(CC)CO MCULE-5622837545 [1,1,0,0,0,0|1,0,1]=4 1986 B7R0.18 COC(C)(CN)CO MCULE-1091911796 [1,1,0,0,0,0|1,0,1]=4 1987 B7R0.18 COC(N)(CO)CO MCULE-3562349590 [1,1,0,0,0,0|1,0,1]=4 1988 B7R0.18 COC(N)(CO)CO MCULE-5361347592 [1,1,0,0,0,0|1,0,1]=4 1989 B7R0.18 NC(CO)(CO)CO MCULE-1491189847 [1,1,0,0,0,0|1,0,1]=4 1990 B7R0.18 NC(CO)(CO)CO MCULE-2267999286 [1,1,0,0,0,0|1,0,1]=4 1991 B7R0.18 NC(CO)(CO)CO MCULE-4100030243 [1,1,0,0,0,0|1,0,1]=4 1992 B7R0.18 NC(CO)(CO)CO MCULE-4852633554 [1,1,0,0,0,0|1,0,1]=4 1993 B7R0.18 NC(CO)(CO)CO MCULE-6369744326 [1,1,0,0,0,0|1,0,1]=4 1994 B7R0.18 NC(CO)(CO)CO MCULE-7300085951 [1,1,0,0,0,0|1,0,1]=4 1995 B7R0.18 NC(CO)(CO)CO MCULE-8252586319 [1,1,0,0,0,0|1,0,1]=4 1996 B7R0.18 NC(CO)(CO)CO MCULE-8592789920 [1,1,0,0,0,0|1,0,1]=4 1997 B7R0.18 NC(CO)(CO)CO MCULE-9200014500 [1,1,0,0,0,0|1,0,1]=4 1998 B9R0.11 C=C(C)C(C)(N)CC(=O)O MCULE-2432744381 [0,1,0,0,0,1|0,0,1]=3 1999 B9R0.11 C=C(C)C(C)(N)CC(=O)O MCULE-7800105371 [0,1,0,0,0,1|0,0,1]=3 2000 B9R0.11 CC(=O)C(C)(C)CC(=O)O MCULE-3797968347 [0,1,0,0,0,1|1,0,1]=4 2001 B9R0.11 CC(=O)NC(C)(C)C(C)C MCULE-5595520176 [0,1,0,0,0,1|2,0,0]=4 2002 B9R0.11 CC(C)(CC(=O)O)C(F)F MCULE-3977275616 [0,1,0,0,0,1|2,0,0]=4 2003 B9R0.11 CC(N)(CC(=O)O)C(=O)O MCULE-3390093551 [0,1,0,0,0,1|1,0,1]=4 2004 B9R0.11 CC(N)(CC(=O)O)C(=O)O MCULE-4137717341 [0,1,0,0,0,1|1,0,1]=4 2005 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O MCULE-5803003392 [0,1,0,0,0,1|1,0,1]=4 2006 B9R0.11 C[C@@](N)(CC(=O)O)C(=O)O MCULE-7987571569 [0,1,0,0,0,1|1,0,1]=4 2007 B9R0.11 C[C@](N)(CC(=O)O)C(=O)O MCULE-4314292616 [0,1,0,0,0,1|1,0,1]=4 2008 B9R0.22 CCC(=O)CC(C)(O)CC MCULE-6647150636 [0,1,0,0,0,1|2,0,0]=4 2009 B9R0.22 CCC(C)(C)CC(=O)OC MCULE-9086898294 [0,1,0,0,0,1|1,0,0]=3 2010 B9R0.22 CCC(C)(C)NC(=O)CCl MCULE-2010718751 [0,1,0,0,0,1|2,0,0]=4 2011 B9R0.22 CCC(F)(F)CC(=O)OC MCULE-3813818214 [0,1,0,0,0,1|2,0,0]=4 2012 B9R0.22 CNC(C)(C)CC(=O)OC MCULE-7640864823 [0,1,0,0,0,1|2,0,0]=4 2013 B9R0.22 COC(=O)CC(C)(C)CN MCULE-1994410298 [0,1,0,0,0,1|2,0,0]=4 2014 B9R0.22 COC(=O)CC(C)(C)CN MCULE-9711171520 [0,1,0,0,0,1|2,0,0]=4 2015 B9R0.32 CC(C)(CN)C(O)C(=O)O MCULE-1251426662 [0,1,0,0,0,1|2,0,0]=4 2016 B9R0.32 CC(C)(CO)C(=O)C(=O)O MCULE-6046561180 [0,1,0,0,0,1|2,0,0]=4 2017 B9R0.32 CC(C)(CO)C(O)C(=O)O MCULE-3752332762 [0,1,0,0,0,1|2,0,0]=4 2018 B9R0.32 CC(C)(CO)[C@@H](O)C(=O)O MCULE-7418140514 [0,1,0,0,0,1|2,0,0]=4 2019 B9R0.32 CCC(C)(C)C(=O)C(=O)O MCULE-2609139055 [0,1,0,0,0,1|1,0,0]=3 2020 B9R0.32 CCC(C)(C)C(N)C(=O)O MCULE-2030759346 [0,1,0,0,0,1|1,0,0]=3 2021 B9R0.32 CCC(C)(C)C(N)C(=O)O MCULE-8756866734 [0,1,0,0,0,1|1,0,0]=3 2022 B9R0.32 CCC(C)(C)C(O)C(=O)O MCULE-6783140520 [0,1,0,0,0,1|1,0,0]=3 2023 B9R0.32 CCC(C)(C)N(C)C(=O)Cl MCULE-2696642386 [0,1,0,0,0,1|2,0,0]=4 2024 B9R0.32 CCC(C)(O)C(O)C(=O)O MCULE-6322081363 [0,1,0,0,0,1|1,0,0]=3 2025 B9R0.32 COC(C)(C)C(Br)C(=O)O MCULE-4686359113 [0,1,0,0,0,1|2,0,0]=4 2026 B9R0.32 COC(C)(C)C(N)C(=O)O MCULE-7291117506 [0,1,0,0,0,1|2,0,0]=4 2027 B9R0.32 COC(C)(C)[C@H](N)C(=O)O MCULE-1351027484 [0,1,0,0,0,1|2,0,0]=4 2028 B9R0.58 C=CCC(C)(C)CC(=O)O MCULE-3859494910 [0,1,0,0,0,1|1,0,1]=4 2029 B9R0.58 CC(O)(CCO)CC(=O)O MCULE-1728546222 [0,1,0,0,0,1|1,0,0]=3 2030 B9R0.58 CC(O)(CCO)CC(=O)[O-] MCULE-2842724264 [0,1,0,0,0,1|1,0,1]=4 2031 B9R0.58 CCCC(C)(C)CC(=O)O MCULE-3472003458 [0,1,0,0,0,1|1,0,0]=3 2032 B9R0.58 CCCC(C)(O)CC(=O)O MCULE-7082436494 [0,1,0,0,0,1|1,0,0]=3 2033 B9R0.58 CNCC(C)(C)CC(=O)O MCULE-9673126610 [0,1,0,0,0,1|1,0,0]=3 2034 B9R0.58 COCC(C)(C)CC(=O)O MCULE-3020905492 [0,1,0,0,0,1|1,0,0]=3 2035 B9R0.58 C[C@](O)(CCO)CC(=O)O MCULE-1986337120 [0,1,0,0,0,1|1,0,0]=3 2036 B9R0.58 C[C@](O)(CCO)CC(=O)O MCULE-8476600793 [0,1,0,0,0,1|1,0,0]=3 2037 B9R0.63 C#CC(C)(CC)OC(=O)N MCULE-1478667664 [0,1,0,0,0,1|2,0,0]=4 2038 B9R0.63 CC(C#N)(CO)CC(=O)O MCULE-7644811798 [0,1,0,0,0,1|1,0,1]=4 2039 B9R0.63 CC(CN)(CO)CC(=O)O MCULE-3238773867 [0,1,0,0,0,1|1,0,0]=3 2040 B9R0.63 CC(CN)(CO)CC(=O)O MCULE-9021134491 [0,1,0,0,0,1|1,0,0]=3 2041 B9R0.63 CCC(C)(CC)OC(=O)N MCULE-7485099295 [0,1,0,0,0,1|2,0,0]=4 2042 B9R0.28 CCC(C)C(F)(F)C(=O)O MCULE-8813807658 [0,2,0,0,0,0|2,0,0]=4 2043 B9R0.28 CCC(O)C(F)(F)C(=O)O MCULE-8473962124 [0,2,0,0,0,0|2,0,0]=4 2044 B9R0.28 CCN(C)C(C)(C)C(=O)O MCULE-1120650068 [0,2,0,0,0,0|1,0,0]=3 2045 B9R0.28 COC(=O)C(C)(C)C(=O)C MCULE-4521147482 [0,2,0,0,0,0|1,0,1]=4 2046 B9R0.28 COC(=O)C(C)(C)C(=O)O MCULE-7134002417 [0,2,0,0,0,0|1,0,1]=4 2047 B9R0.28 COC(=O)C(C)(C)C(F)F MCULE-9694591390 [0,2,0,0,0,0|2,0,0]=4 2048 B9R0.28 COC(=O)C(C)(C)N(C)C MCULE-8020220783 [0,2,0,0,0,0|2,0,0]=4 2049 B9R0.28 COC(=O)C(C)(C)[C@H](C)N MCULE-2083452615 [0,2,0,0,0,0|1,0,0]=3 2050 B9R0.28 COC(=O)C(C)(N)C(C)C MCULE-5819374375 [0,2,0,0,0,0|0,0,0]=2 2051 B9R0.28 COC(=O)C(C)(O)C(=O)C MCULE-8340608181 [0,2,0,0,0,0|1,0,1]=4 2052 B9R0.51 C=CCCC(C)(C)C(=O)O MCULE-1492058519 [0,2,0,0,0,0|1,0,0]=3 2053 B9R0.51 C=CCC[C@@](C)(N)C(=O)O MCULE-8852684173 [0,2,0,0,0,0|0,0,0]=2 2054 B9R0.51 C=CCC[C@](C)(N)C(=O)O MCULE-1635647275 [0,2,0,0,0,0|0,0,0]=2 2055 B9R0.51 C=CCOC(C)(C)C(=O)O MCULE-5351990103 [0,2,0,0,0,0|1,0,1]=4 2056 B9R0.51 CC(C)(CCC#N)C(=O)O MCULE-6179801954 [0,2,0,0,0,0|1,0,0]=3 2057 B9R0.51 CC(C)(CCCO)C(=O)O MCULE-8432032551 [0,2,0,0,0,0|1,0,0]=3 2058 B9R0.51 CC(C)(CCCO)C(=O)[O-] MCULE-7948640149 [0,2,0,0,0,0|1,0,1]=4 2059 B9R0.51 CC(C)(CN=N#N)C(=O)O MCULE-3654564475 [0,2,0,0,0,0|2,0,0]=4 2060 B9R0.51 CC(C)(OCCO)C(=O)O MCULE-7350629526 [0,2,0,0,0,0|1,0,0]=3 2061 B9R0.51 CC(N)(CCCN)C(=O)O MCULE-3848172930 [0,2,0,0,0,0|0,0,0]=2 2062 B9R0.51 CC(N)(CCCN)C(=O)O MCULE-8569683447 [0,2,0,0,0,0|0,0,0]=2 2063 B9R0.51 CCCCC(C)(C)C(=O)C MCULE-3392309275 [0,2,0,0,0,0|2,0,0]=4 2064 B9R0.51 CCCCC(C)(C)C(=O)O MCULE-6533628152 [0,2,0,0,0,0|1,0,0]=3 2065 B9R0.51 CCCCC(C)(F)C(=O)O MCULE-3264455202 [0,2,0,0,0,0|1,0,0]=3 2066 B9R0.51 CCCCC(C)(O)C(=O)O MCULE-4036610380 [0,2,0,0,0,0|1,0,0]=3 2067 B9R0.51 CCCCC(F)(F)C(=O)O MCULE-3383573238 [0,2,0,0,0,0|2,0,0]=4 2068 B9R0.51 CCOCC(C)(C)C(=O)O MCULE-3248915686 [0,2,0,0,0,0|1,0,0]=3 2069 B9R0.51 COCCC(C)(C)C(=O)O MCULE-6792174270 [0,2,0,0,0,0|1,0,0]=3 2070 B9R0.51 COCCC(C)(N)C(=O)O MCULE-5241047385 [0,2,0,0,0,0|0,0,0]=2 2071 B9R0.60 C#CCC(C)(C)C(=O)OC MCULE-2637201661 [0,2,0,0,0,0|1,0,1]=4 2072 B9R0.60 C=CCC(C)(C)C(=O)OC MCULE-2394204776 [0,2,0,0,0,0|1,0,1]=4 2073 B9R0.60 C=CCC(C)(N)C(=O)OC MCULE-9985053421 [0,2,0,0,0,0|0,0,1]=3 2074 B9R0.60 C=CC[C@@](C)(N)C(=O)OC MCULE-5748038167 [0,2,0,0,0,0|0,0,1]=3 2075 B9R0.60 C=CC[C@](C)(N)C(=O)OC MCULE-8337287647 [0,2,0,0,0,0|0,0,1]=3 2076 B9R0.60 CCCC(C)(N)C(=O)OC MCULE-3420672647 [0,2,0,0,0,0|0,0,0]=2 2077 B9R0.60 CCCC(C)(N)C(=O)OC MCULE-5121628800 [0,2,0,0,0,0|0,0,0]=2 2078 B9R0.60 CCCC(C)(O)C(=O)OC MCULE-6961757561 [0,2,0,0,0,0|1,0,0]=3 2079 B9R0.60 CCNC(C)(C)C(=O)OC MCULE-5158822270 [0,2,0,0,0,0|1,0,0]=3 2080 B9R0.60 COC(=O)C(C)(C)CC#N MCULE-1215620344 [0,2,0,0,0,0|1,0,1]=4 2081 B9R0.60 COC(=O)C(C)(C)CC=O MCULE-4092182602 [0,2,0,0,0,0|1,0,1]=4 2082 B9R0.60 COC(=O)C(C)(C)CCBr MCULE-5231711658 [0,2,0,0,0,0|1,0,0]=3 2083 B9R0.60 COC(=O)C(C)(C)CCN MCULE-2023148799 [0,2,0,0,0,0|1,0,0]=3 2084 B9R0.60 COC(=O)C(C)(C)CCN MCULE-2474943279 [0,2,0,0,0,0|1,0,0]=3 2085 B9R0.60 COC(=O)C(C)(C)CCO MCULE-8244412814 [0,2,0,0,0,0|1,0,0]=3 2086 B9R0.60 COC(=O)C(C)(N)CCF MCULE-3286692679 [0,2,0,0,0,0|0,0,0]=2 2087 B9R0.60 COCC(C)(C)C(=O)OC MCULE-3637426085 [0,2,0,0,0,0|1,0,0]=3 2088 B9R0.60 COCC(C)(N)C(=O)OC MCULE-1217021832 [0,2,0,0,0,0|0,0,0]=2 2089 B9R0.60 COCC(C)(O)C(=O)OC MCULE-1952223492 [0,2,0,0,0,0|1,0,0]=3 2090 B9R0.60 COCC(F)(F)C(=O)OC MCULE-3963371314 [0,2,0,0,0,0|2,0,0]=4 2091 B9R0.74 CCC(N)(COC)C(=O)O MCULE-1112258412 [0,2,0,0,0,0|0,0,0]=2 2092 B9R0.74 CCC(N)(COC)C(=O)O MCULE-3146530110 [0,2,0,0,0,0|0,0,0]=2 2093 B9R0.74 CCCC(C)(CC)C(=O)C MCULE-3275508969 [0,2,0,0,0,0|2,0,0]=4 2094 B9R0.74 CCCC(C)(CC)C(=O)O MCULE-2557760328 [0,2,0,0,0,0|1,0,0]=3 2095 B9R0.74 CCCC(N)(CC)C(=O)O MCULE-2758260935 [0,2,0,0,0,0|0,0,0]=2 2096 B9R0.74 CCCC(N)(CC)C(=O)O MCULE-6297600490 [0,2,0,0,0,0|0,0,0]=2 2097 B9R0.74 CNC(C)(COC)C(=O)O MCULE-1951800408 [0,2,0,0,0,0|0,0,0]=2 2098 B9R0.74 CNC(C)(COC)C(=O)O MCULE-6037506715 [0,2,0,0,0,0|0,0,0]=2 2099 B9R0.74 COCC(C)(OC)C(=O)O MCULE-5307101549 [0,2,0,0,0,0|1,0,0]=3 2100 B9R0.19 CCC(C)(C)C(=O)CC#N MCULE-5988482707 [0,2,0,0,0,0|2,0,0]=4 2101 B9R0.19 CCC(C)(C)C(=O)OCCl MCULE-6422146090 [0,2,0,0,0,0|1,0,0]=3 2102 B9R0.19 CCOC(=O)C(C)(Br)CBr MCULE-9216887739 [0,2,0,0,0,0|2,0,0]=4 2103 B9R0.19 CCOC(=O)C(C)(C)CBr MCULE-2866756259 [0,2,0,0,0,0|2,0,0]=4 2104 B9R0.19 CCOC(=O)C(C)(C)CCl MCULE-7664180009 [0,2,0,0,0,0|2,0,0]=4 2105 B9R0.19 CCOC(=O)C(C)(C)CI MCULE-4406506275 [0,2,0,0,0,0|2,0,0]=4 2106 B9R0.19 CCOC(=O)C(C)(C)CN MCULE-1528973073 [0,2,0,0,0,0|2,0,0]=4 2107 B9R0.19 CCOC(=O)C(C)(C)CN MCULE-9149326099 [0,2,0,0,0,0|2,0,0]=4 2108 B9R0.19 CCOC(=O)C(C)(C)CO MCULE-4450228796 [0,2,0,0,0,0|2,0,0]=4 2109 B9R0.19 CCOC(=O)C(C)(C)NC MCULE-8462935665 [0,2,0,0,0,0|2,0,0]=4 2110 B9R0.19 CCOC(=O)C(C)(C)NC MCULE-9197884278 [0,2,0,0,0,0|2,0,0]=4 2111 B9R0.19 CCOC(=O)C(C)(N)CC MCULE-3495043111 [0,2,0,0,0,0|0,0,0]=2 2112 B9R0.19 CCOC(=O)C(C)(O)CC MCULE-1828865836 [0,2,0,0,0,0|1,0,0]=3 2113 B9R0.19 CCOC(=O)C(C)(O)CN MCULE-6327200603 [0,2,0,0,0,0|2,0,0]=4 2114 B9R0.19 CCOC(=O)C(C)(O)CN MCULE-7766533741 [0,2,0,0,0,0|2,0,0]=4 2115 B9R0.19 CCOC(=O)C(C)(O)CO MCULE-2282982715 [0,2,0,0,0,0|2,0,0]=4 2116 B9R0.19 CCOC(=O)C(F)(F)CC MCULE-1412823639 [0,2,0,0,0,0|2,0,0]=4 2117 B9R0.69 CCC(C)(CC)C(=O)OC MCULE-3531872790 [0,2,0,0,0,0|1,0,0]=3 2118 B9R0.69 CCC(C)(NC)C(=O)OC MCULE-8710804680 [0,2,0,0,0,0|0,0,0]=2 2119 B9R0.69 CCC(N)(CC)C(=O)OC MCULE-6550120853 [0,2,0,0,0,0|0,0,0]=2 2120 B9R0.69 CCC(N)(CC)C(=O)OC MCULE-9092222744 [0,2,0,0,0,0|0,0,0]=2 2121 B9R0.69 COC(=O)C(C)(CBr)OC MCULE-3369144968 [0,2,0,0,0,0|2,0,0]=4 2122 B9R0.69 COC(=O)C(C)(CO)CO MCULE-3441914987 [0,2,0,0,0,0|2,0,0]=4 2123 B9R0.69 COC(=O)C(C)(OC)OC MCULE-6687425114 [0,2,0,0,0,0|2,0,0]=4 2124 B9R0.80 CC(C)(C(=O)O)C(F)(F)F MCULE-1523608191 [0,2,0,0,0,0|2,0,0]=4 2125 B9R0.80 CC(C)(C(=O)O)S(=O)(=O)C MCULE-8100618443 [0,2,0,0,0,0|2,0,0]=4 2126 B9R0.80 CC(C)(C)C(C)(C)C(=O)O MCULE-3500693535 [0,2,0,0,0,0|1,0,0]=3 2127 B9R0.80 CC(C)(C)C(C)(N)C(=O)O MCULE-3988446243 [0,2,0,0,0,0|0,0,0]=2 2128 B9R0.80 CC(C)(C)C(C)(N)C(=O)O MCULE-7919587109 [0,2,0,0,0,0|0,0,0]=2 2129 B9R0.80 CC(C)(C)[C@@](C)(N)C(=O)O MCULE-3756983669 [0,2,0,0,0,0|0,0,0]=2 2130 B9R0.80 CC(C)(C)[C@](C)(N)C(=O)N MCULE-2518607642 [0,2,0,0,0,0|1,0,0]=3 2131 B9R0.80 CC(C)(N)C(C)(C)C(=O)O MCULE-7444700765 [0,2,0,0,0,0|1,0,0]=3 2132 B9R0.80 CC(C)(N)C(C)(C)C(=O)O MCULE-8264716334 [0,2,0,0,0,0|1,0,0]=3 2133 B9R0.80 CC(C)(O)C(F)(F)C(=O)O MCULE-9755377954 [0,2,0,0,0,0|2,0,0]=4 2134 B9R0.80 CC(C)(S)C(C)(N)C(=O)O MCULE-2809601301 [0,2,0,0,0,0|0,0,0]=2 2135 B9R0.80 CC(F)(F)C(C)(C)C(=O)O MCULE-3044493520 [0,2,0,0,0,0|1,0,0]=3 2136 B9R0.80 CC(N)(C(=O)O)C(F)(F)F MCULE-6819035786 [0,2,0,0,0,0|1,0,0]=3 2137 B9R0.80 CC(N)(C(=O)O)C(F)(F)F MCULE-9761017768 [0,2,0,0,0,0|1,0,0]=3 2138 B9R0.80 CC(O)(C(=O)O)C(F)(F)F MCULE-3476646324 [0,2,0,0,0,0|2,0,0]=4 2139 B9R0.80 CC(O)(C(=O)O)C(F)(F)F MCULE-4165629591 [0,2,0,0,0,0|2,0,0]=4 2140 B9R0.80 C[C@@](N)(C(=O)O)C(F)(F)F MCULE-4245316724 [0,2,0,0,0,0|1,0,0]=3 2141 B9R0.80 C[C@@](O)(C(=O)O)C(F)(F)F MCULE-1393019431 [0,2,0,0,0,0|2,0,0]=4 2142 B9R0.80 C[C@@](O)(C(=O)O)C(F)(F)F MCULE-7751382900 [0,2,0,0,0,0|2,0,0]=4 2143 B9R0.80 C[C@](N)(C(=O)O)C(F)(F)F MCULE-5162628039 [0,2,0,0,0,0|1,0,0]=3 2144 B9R0.80 C[C@](O)(C(=O)O)C(F)(F)F MCULE-2400315687 [0,2,0,0,0,0|2,0,0]=4 2145 B9R0.80 C[C@](O)(C(=O)O)C(F)(F)F MCULE-5802653510 [0,2,0,0,0,0|2,0,0]=4 2146 B9R0.76 CC(C)C(F)(CN)C(=O)O MCULE-1177869145 [0,2,0,0,0,0|1,0,0]=3 2147 B9R0.76 CCC(C)(C(=O)N)N(C)C MCULE-4087449719 [0,2,0,0,0,0|1,0,0]=3 2148 B9R0.76 CCC(C)(C(=O)O)C(=O)O MCULE-2432593138 [0,2,0,0,0,0|1,0,0]=3 2149 B9R0.76 CCC(N)(C(=O)N)C(C)C MCULE-1761450489 [0,2,0,0,0,0|1,0,0]=3 2150 B9R0.78 CCC(C#N)(CC)C(=O)O MCULE-4469512703 [0,2,0,0,0,0|0,0,1]=3 2151 B9R0.78 CCC(CC)(CC)C(=O)O MCULE-4084421366 [0,2,0,0,0,0|1,0,0]=3 2152 B9R0.78 CCC(CC)(CN)C(=O)O MCULE-4095004267 [0,2,0,0,0,0|0,0,0]=2 2153 B9R0.78 CCC(CC)(CN)C(=O)O MCULE-9385355534 [0,2,0,0,0,0|0,0,0]=2 2154 B9R0.78 CCC(CC)(CO)C(=O)O MCULE-5860910537 [0,2,0,0,0,0|1,0,0]=3 2155 B9R0.78 CCC(CO)(CO)C(=O)O MCULE-9340744825 [0,2,0,0,0,0|1,0,0]=3 2156 B9R0.78 O=C(O)C(CBr)(CBr)CBr MCULE-2581373086 [0,2,0,0,0,0|2,0,0]=4 2157 B9R0.78 O=C(O)C(CCl)(CCl)CCl MCULE-6501113691 [0,2,0,0,0,0|2,0,0]=4 2158 B9R0.78 O=C(O)C(CO)(CO)CO MCULE-5931961935 [0,2,0,0,0,0|2,0,0]=4 2159 B7R1.4 C1(CCNC1=O)N MCULE-4906952813 [1,0,0,1,0,0|1,0,0]=3 2160 B7R1.4 C1(CCNC1=O)N MCULE-9500853209 [1,0,0,1,0,0|1,0,0]=3 2161 B7R1.4 C=C1CCOC1=O MCULE-5907828600 [1,0,0,1,0,0|0,0,2]=4 2162 B7R1.4 CC1=CCOC1=O MCULE-9785490540 [1,0,0,1,0,0|0,0,2]=4 2163 B7R1.4 CC1CCCC1=O MCULE-3710290162 [1,0,0,1,0,0|1,0,0]=3 2164 B7R1.4 CC1CCCC1O MCULE-1288711765 [1,0,0,1,0,0|1,0,1]=4 2165 B7R1.4 CC1CCNC1=O MCULE-7799644249 [1,0,0,1,0,0|1,0,0]=3 2166 B7R1.4 CC1CCOC1=O MCULE-2223078294 [1,0,0,1,0,0|0,0,0]=2 2167 B7R1.4 CC1CNCC1=O MCULE-2728909327 [1,0,0,1,0,0|2,0,0]=4 2168 B7R1.4 CC1CNCC1=O MCULE-9172381840 [1,0,0,1,0,0|2,0,0]=4 2169 B7R1.4 CC1COCC1=O MCULE-8115238635 [1,0,0,1,0,0|2,0,0]=4 2170 B7R1.4 CC1CSCC1=O MCULE-5611423322 [1,0,0,1,0,0|2,0,0]=4 2171 B7R1.4 CC1NCCC1=O MCULE-4206844406 [1,0,0,1,0,0|2,0,0]=4 2172 B7R1.4 CC1NCCC1=O MCULE-7025918222 [1,0,0,1,0,0|2,0,0]=4 2173 B7R1.4 CC1OCCC1=O MCULE-8278816952 [1,0,0,1,0,0|2,0,0]=4 2174 B7R1.4 CC1OCCC1N MCULE-4343663724 [1,0,0,1,0,0|1,0,1]=4 2175 B7R1.4 CC1OCCC1N MCULE-9003879039 [1,0,0,1,0,0|1,0,1]=4 2176 B7R1.4 CC1SCCC1=O MCULE-5264322365 [1,0,0,1,0,0|2,0,0]=4 2177 B7R1.4 CN1CCCC1=O MCULE-1381506705 [1,0,0,1,0,0|2,0,0]=4 2178 B7R1.4 CN1CCNC1=O MCULE-9774864412 [1,0,0,1,0,0|2,0,0]=4 2179 B7R1.4 CN1CCOC1=O MCULE-7467321799 [1,0,0,1,0,0|1,0,0]=3 2180 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [1,0,0,1,0,0|1,0,1]=4 2181 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [1,0,0,1,0,0|1,0,1]=4 2182 B7R1.4 C[C@@H]1CCNC1=O MCULE-1037883660 [1,0,0,1,0,0|1,0,0]=3 2183 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-5910807847 [1,0,0,1,0,0|1,0,1]=4 2184 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-7586038907 [1,0,0,1,0,0|1,0,1]=4 2185 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [1,0,0,1,0,0|1,0,1]=4 2186 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [1,0,0,1,0,0|1,0,1]=4 2187 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [1,0,0,1,0,0|1,0,1]=4 2188 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [1,0,0,1,0,0|1,0,1]=4 2189 B7R1.4 C[C@H]1CCNC1=O MCULE-9500360544 [1,0,0,1,0,0|1,0,0]=3 2190 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-1432785321 [1,0,0,1,0,0|1,0,1]=4 2191 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-3008045787 [1,0,0,1,0,0|1,0,1]=4 2192 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-7656776924 [1,0,0,1,0,0|1,0,1]=4 2193 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-8087379612 [1,0,0,1,0,0|1,0,1]=4 2194 B7R1.4 NC1=CCOC1=O MCULE-9089854091 [1,0,0,1,0,0|0,0,2]=4 2195 B7R1.4 NC1CCCC1=O MCULE-3654949473 [1,0,0,1,0,0|1,0,0]=3 2196 B7R1.4 NC1CCCC1=O MCULE-6579965788 [1,0,0,1,0,0|1,0,0]=3 2197 B7R1.4 NC1CCCC1O MCULE-1657591641 [1,0,0,1,0,0|1,0,1]=4 2198 B7R1.4 NC1CCCC1O MCULE-6248992494 [1,0,0,1,0,0|1,0,1]=4 2199 B7R1.4 NC1CCNC1=O MCULE-2061829370 [1,0,0,1,0,0|1,0,0]=3 2200 B7R1.4 NC1CCNC1=O MCULE-4272585488 [1,0,0,1,0,0|1,0,0]=3 2201 B7R1.4 NC1CCOC1=O MCULE-1011670330 [1,0,0,1,0,0|0,0,0]=2 2202 B7R1.4 NC1CCOC1=O MCULE-1366805966 [1,0,0,1,0,0|0,0,0]=2 2203 B7R1.4 NC1CCOC1=O MCULE-1874490478 [1,0,0,1,0,0|0,0,0]=2 2204 B7R1.4 NC1CCOC1=O MCULE-4434379753 [1,0,0,1,0,0|0,0,0]=2 2205 B7R1.4 NC1CCOC1=O MCULE-7302633352 [1,0,0,1,0,0|0,0,0]=2 2206 B7R1.4 NC1CCOC1=O MCULE-8009953591 [1,0,0,1,0,0|0,0,0]=2 2207 B7R1.4 NC1CCSC1=O MCULE-5181497015 [1,0,0,1,0,0|0,1,0]=3 2208 B7R1.4 NC1CCSC1=O MCULE-8775141567 [1,0,0,1,0,0|0,1,0]=3 2209 B7R1.4 NC1CONC1=O MCULE-3118867985 [1,0,0,1,0,0|2,0,0]=4 2210 B7R1.4 NC1CONC1=O MCULE-3159218372 [1,0,0,1,0,0|2,0,0]=4 2211 B7R1.4 NN1CCCC1=O MCULE-2994786381 [1,0,0,1,0,0|2,0,0]=4 2212 B7R1.4 NN1CCCC1=O MCULE-5599329775 [1,0,0,1,0,0|2,0,0]=4 2213 B7R1.4 NN1CCNC1=O MCULE-9094725216 [1,0,0,1,0,0|2,0,0]=4 2214 B7R1.4 NN1CCOC1=O MCULE-7407834106 [1,0,0,1,0,0|1,0,0]=3 2215 B7R1.4 NN1CCOC1=O MCULE-8091613930 [1,0,0,1,0,0|1,0,0]=3 2216 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-3619202671 [1,0,0,1,0,0|1,0,1]=4 2217 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-5588562063 [1,0,0,1,0,0|1,0,1]=4 2218 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-8937650915 [1,0,0,1,0,0|1,0,1]=4 2219 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9550479411 [1,0,0,1,0,0|1,0,1]=4 2220 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9908988904 [1,0,0,1,0,0|1,0,1]=4 2221 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-2283352070 [1,0,0,1,0,0|1,0,1]=4 2222 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-3279782742 [1,0,0,1,0,0|1,0,1]=4 2223 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-6823698796 [1,0,0,1,0,0|1,0,1]=4 2224 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-7752087047 [1,0,0,1,0,0|1,0,1]=4 2225 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-8823714511 [1,0,0,1,0,0|1,0,1]=4 2226 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-9789739251 [1,0,0,1,0,0|1,0,1]=4 2227 B7R1.4 N[C@@H]1CCNC1=O MCULE-2357766642 [1,0,0,1,0,0|1,0,0]=3 2228 B7R1.4 N[C@@H]1CCNC1=O MCULE-9089591546 [1,0,0,1,0,0|1,0,0]=3 2229 B7R1.4 N[C@@H]1CCNC1=O MCULE-9558758567 [1,0,0,1,0,0|1,0,0]=3 2230 B7R1.4 N[C@@H]1CCNC1=O MCULE-9668255740 [1,0,0,1,0,0|1,0,0]=3 2231 B7R1.4 N[C@@H]1CCOC1=O MCULE-1027751896 [1,0,0,1,0,0|0,0,0]=2 2232 B7R1.4 N[C@@H]1CCOC1=O MCULE-4034349263 [1,0,0,1,0,0|0,0,0]=2 2233 B7R1.4 N[C@@H]1CCOC1=O MCULE-8790782772 [1,0,0,1,0,0|0,0,0]=2 2234 B7R1.4 N[C@@H]1CCOC1=O MCULE-9300265861 [1,0,0,1,0,0|0,0,0]=2 2235 B7R1.4 N[C@@H]1CCSC1=O MCULE-1269968791 [1,0,0,1,0,0|0,1,0]=3 2236 B7R1.4 N[C@@H]1CCSC1=O MCULE-5374422420 [1,0,0,1,0,0|0,1,0]=3 2237 B7R1.4 N[C@@H]1CCSC1=O MCULE-8203732076 [1,0,0,1,0,0|0,1,0]=3 2238 B7R1.4 N[C@@H]1CCSC1=O MCULE-8418670804 [1,0,0,1,0,0|0,1,0]=3 2239 B7R1.4 N[C@@H]1CONC1=O MCULE-4212827696 [1,0,0,1,0,0|2,0,0]=4 2240 B7R1.4 N[C@@H]1CONC1=O MCULE-6014142329 [1,0,0,1,0,0|2,0,0]=4 2241 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-6629056296 [1,0,0,1,0,0|1,0,1]=4 2242 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-7682114350 [1,0,0,1,0,0|1,0,1]=4 2243 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-8554796061 [1,0,0,1,0,0|1,0,1]=4 2244 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-9329258920 [1,0,0,1,0,0|1,0,1]=4 2245 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-1156997833 [1,0,0,1,0,0|1,0,1]=4 2246 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-2524879699 [1,0,0,1,0,0|1,0,1]=4 2247 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-7034968971 [1,0,0,1,0,0|1,0,1]=4 2248 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9262461574 [1,0,0,1,0,0|1,0,1]=4 2249 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9904485750 [1,0,0,1,0,0|1,0,1]=4 2250 B7R1.4 N[C@H]1CCNC1=O MCULE-2327147408 [1,0,0,1,0,0|1,0,0]=3 2251 B7R1.4 N[C@H]1CCNC1=O MCULE-2923469662 [1,0,0,1,0,0|1,0,0]=3 2252 B7R1.4 N[C@H]1CCNC1=O MCULE-5882745021 [1,0,0,1,0,0|1,0,0]=3 2253 B7R1.4 N[C@H]1CCNC1=O MCULE-7846724738 [1,0,0,1,0,0|1,0,0]=3 2254 B7R1.4 N[C@H]1CCOC1=O MCULE-4393293388 [1,0,0,1,0,0|0,0,0]=2 2255 B7R1.4 N[C@H]1CCOC1=O MCULE-4751602783 [1,0,0,1,0,0|0,0,0]=2 2256 B7R1.4 N[C@H]1CCOC1=O MCULE-7924572479 [1,0,0,1,0,0|0,0,0]=2 2257 B7R1.4 N[C@H]1CCOC1=O MCULE-8545644747 [1,0,0,1,0,0|0,0,0]=2 2258 B7R1.4 N[C@H]1CCOC1=O MCULE-8634641228 [1,0,0,1,0,0|0,0,0]=2 2259 B7R1.4 N[C@H]1CCSC1=O MCULE-4497814170 [1,0,0,1,0,0|0,1,0]=3 2260 B7R1.4 N[C@H]1CCSC1=O MCULE-6209097230 [1,0,0,1,0,0|0,1,0]=3 2261 B7R1.4 N[C@H]1CCSC1=O MCULE-6419348515 [1,0,0,1,0,0|0,1,0]=3 2262 B7R1.4 N[C@H]1CCSC1=O MCULE-9091827364 [1,0,0,1,0,0|0,1,0]=3 2263 B7R1.4 N[C@H]1CONC1=O MCULE-4286940154 [1,0,0,1,0,0|2,0,0]=4 2264 B7R1.4 N[C@H]1CONC1=O MCULE-9925977120 [1,0,0,1,0,0|2,0,0]=4 2265 B7R1.4 O=C1CCCC1Br MCULE-3651373380 [1,0,0,1,0,0|2,0,0]=4 2266 B7R1.4 O=C1CCCC1Cl MCULE-7745647260 [1,0,0,1,0,0|2,0,0]=4 2267 B7R1.4 O=C1CCCC1F MCULE-8001765295 [1,0,0,1,0,0|2,0,0]=4 2268 B7R1.4 O=C1CCCC1O MCULE-6795188798 [1,0,0,1,0,0|2,0,0]=4 2269 B7R1.4 O=C1NCCC1Br MCULE-5321265801 [1,0,0,1,0,0|2,0,0]=4 2270 B7R1.4 O=C1NCCC1Cl MCULE-1663035789 [1,0,0,1,0,0|2,0,0]=4 2271 B7R1.4 O=C1NCCC1F MCULE-2209899044 [1,0,0,1,0,0|2,0,0]=4 2272 B7R1.4 O=C1NCCC1O MCULE-8818841339 [1,0,0,1,0,0|2,0,0]=4 2273 B7R1.4 O=C1NCCC1O MCULE-9662824811 [1,0,0,1,0,0|2,0,0]=4 2274 B7R1.4 O=C1NCC[C@@H]1O MCULE-3212474164 [1,0,0,1,0,0|2,0,0]=4 2275 B7R1.4 O=C1NCC[C@@H]1O MCULE-7816291255 [1,0,0,1,0,0|2,0,0]=4 2276 B7R1.4 O=C1NCC[C@H]1O MCULE-1281835510 [1,0,0,1,0,0|2,0,0]=4 2277 B7R1.4 O=C1NCC[C@H]1O MCULE-6809356348 [1,0,0,1,0,0|2,0,0]=4 2278 B7R1.4 O=C1OCCC1Br MCULE-8316114331 [1,0,0,1,0,0|1,0,0]=3 2279 B7R1.4 O=C1OCCC1O MCULE-2144002601 [1,0,0,1,0,0|1,0,0]=3 2280 B7R1.4 O=C1OCCC1S MCULE-2130434062 [1,0,0,1,0,0|1,0,0]=3 2281 B7R1.4 O=C1OCC[C@@H]1O MCULE-7764011790 [1,0,0,1,0,0|1,0,0]=3 2282 B7R1.4 O=C1OCC[C@@H]1O MCULE-9001729998 [1,0,0,1,0,0|1,0,0]=3 2283 B7R1.4 O=C1OCC[C@H]1O MCULE-6949645282 [1,0,0,1,0,0|1,0,0]=3 2284 B7R1.4 O=C1OCC[C@H]1O MCULE-7110242636 [1,0,0,1,0,0|1,0,0]=3 2285 B7R1.4 [NH3+][C@H]1CCOC1=O MCULE-8903471982 [1,0,0,1,0,0|0,0,1]=3 2286 B7R1.8 CCC1CCC1=O MCULE-5109615435 [1,0,0,1,0,0|1,0,0]=3 2287 B7R1.8 COC1CCC1=O MCULE-6511996246 [1,0,0,1,0,0|2,0,0]=4 2288 B7R1.8 CSC1CCC1=O MCULE-3892720319 [1,0,0,1,0,0|2,0,0]=4 2289 B7R1.8 O=C1CCC1CO MCULE-5501600764 [1,0,0,1,0,0|2,0,0]=4 2290 B7R1.8 O=C1CC[C@@H]1CO MCULE-9840363539 [1,0,0,1,0,0|2,0,0]=4 2291 B7R1.12 C=C1CC1C(=O)O MCULE-4330944573 [1,0,0,1,0,0|0,0,2]=4 2292 B7R1.12 CC(=O)C1CC1C MCULE-5857709747 [1,0,0,1,0,0|1,0,0]=3 2293 B7R1.12 CC(=O)[C@@H]1C[C@H]1C MCULE-4367650211 [1,0,0,1,0,0|1,0,0]=3 2294 B7R1.12 CC1=CC1C(=O)O MCULE-6979504623 [1,0,0,1,0,0|0,0,2]=4 2295 B7R1.12 CC1CC1C(=O)Cl MCULE-7645594952 [1,0,0,1,0,0|1,0,0]=3 2296 B7R1.12 CC1CC1C(=O)N MCULE-4145079494 [1,0,0,1,0,0|1,0,0]=3 2297 B7R1.12 CC1CC1C(=O)O MCULE-1757330006 [1,0,0,1,0,0|0,0,0]=2 2298 B7R1.12 CC1SC1C(=O)N MCULE-7010314546 [1,0,0,1,0,0|2,0,0]=4 2299 B7R1.12 C[C@@H]1C[C@@H]1B(O)O MCULE-4091409950 [1,0,0,1,0,0|1,0,1]=4 2300 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-1245851874 [1,0,0,1,0,0|0,0,0]=2 2301 B7R1.12 C[C@@H]1C[C@@H]1C(=O)O MCULE-9582782871 [1,0,0,1,0,0|0,0,0]=2 2302 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-2621918749 [1,0,0,1,0,0|0,0,0]=2 2303 B7R1.12 C[C@@H]1C[C@H]1C(=O)O MCULE-7347988261 [1,0,0,1,0,0|0,0,0]=2 2304 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-4499487863 [1,0,0,1,0,0|0,0,0]=2 2305 B7R1.12 C[C@H]1C[C@@H]1C(=O)O MCULE-9300153165 [1,0,0,1,0,0|0,0,0]=2 2306 B7R1.12 C[C@H]1C[C@H]1B(O)O MCULE-9584013970 [1,0,0,1,0,0|1,0,1]=4 2307 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-4410115478 [1,0,0,1,0,0|0,0,0]=2 2308 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-6590525761 [1,0,0,1,0,0|0,0,0]=2 2309 B7R1.12 C[C@H]1C[C@H]1C(=O)O MCULE-8070492716 [1,0,0,1,0,0|0,0,0]=2 2310 B7R1.12 NC(=O)C1CC1N MCULE-9433325277 [1,0,0,1,0,0|2,0,0]=4 2311 B7R1.12 NC(=O)[C@@H]1C[C@@H]1F MCULE-2857193174 [1,0,0,1,0,0|2,0,0]=4 2312 B7R1.12 O=C(O)C1CC1Br MCULE-6387317137 [1,0,0,1,0,0|1,0,0]=3 2313 B7R1.12 O=C(O)C1CC1Cl MCULE-8907850405 [1,0,0,1,0,0|1,0,0]=3 2314 B7R1.12 O=C(O)C1CC1F MCULE-8258481986 [1,0,0,1,0,0|1,0,0]=3 2315 B7R1.12 O=C(O)C1CC1I MCULE-9535592263 [1,0,0,1,0,0|1,0,0]=3 2316 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-1882710455 [1,0,0,1,0,0|1,0,0]=3 2317 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-7715660561 [1,0,0,1,0,0|1,0,0]=3 2318 B7R1.12 O=C(O)[C@@H]1C[C@@H]1F MCULE-7741460434 [1,0,0,1,0,0|1,0,0]=3 2319 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-2594739726 [1,0,0,1,0,0|1,0,0]=3 2320 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-3033770510 [1,0,0,1,0,0|1,0,0]=3 2321 B7R1.12 O=C(O)[C@@H]1C[C@@H]1I MCULE-6224902495 [1,0,0,1,0,0|1,0,0]=3 2322 B7R1.12 O=C(O)[C@@H]1C[C@H]1Br MCULE-3031410853 [1,0,0,1,0,0|1,0,0]=3 2323 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-1201733028 [1,0,0,1,0,0|1,0,0]=3 2324 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-5963625184 [1,0,0,1,0,0|1,0,0]=3 2325 B7R1.12 O=C(O)[C@@H]1C[C@H]1F MCULE-9724617114 [1,0,0,1,0,0|1,0,0]=3 2326 B7R1.12 O=C(O)[C@@H]1C[C@H]1I MCULE-3702576454 [1,0,0,1,0,0|1,0,0]=3 2327 B7R1.12 O=C(O)[C@H]1C[C@@H]1F MCULE-3766204952 [1,0,0,1,0,0|1,0,0]=3 2328 B7R1.12 O=C(O)[C@H]1C[C@@H]1F MCULE-4258983574 [1,0,0,1,0,0|1,0,0]=3 2329 B7R1.12 O=C(O)[C@H]1C[C@H]1Br MCULE-3094747797 [1,0,0,1,0,0|1,0,0]=3 2330 B7R1.12 O=C(O)[C@H]1C[C@H]1F MCULE-7993479857 [1,0,0,1,0,0|1,0,0]=3 2331 B7R1.12 O=C(O)[C@H]1C[C@H]1F MCULE-9922834235 [1,0,0,1,0,0|1,0,0]=3 2332 B7R1.12 O=C(O)[C@H]1C[C@H]1I MCULE-5714437007 [1,0,0,1,0,0|1,0,0]=3 2333 B7R1.12 O=C(O)[C@H]1C[C@H]1I MCULE-8000208987 [1,0,0,1,0,0|1,0,0]=3 2334 B7R1.12 [C@H]1(C[C@H]1C(=O)O)C MCULE-9539625763 [1,0,0,1,0,0|0,0,0]=2 2335 B7R1.15 CC1CC(=O)C1C MCULE-1068922218 [1,0,0,1,0,0|1,0,0]=3 2336 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2032555036 [1,0,0,1,0,0|1,0,0]=3 2337 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-2738127555 [1,0,0,1,0,0|1,0,0]=3 2338 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-5044901082 [1,0,0,1,0,0|1,0,0]=3 2339 B7R1.15 C[C@@H]1NC(=O)[C@H]1N MCULE-7632990759 [1,0,0,1,0,0|1,0,0]=3 2340 B7R1.18 C1(CCN1)C(=O)O MCULE-9324355017 [1,0,0,1,0,0|0,0,0]=2 2341 B7R1.18 CC(=O)C1CCC1 MCULE-5770046789 [1,0,0,1,0,0|1,0,0]=3 2342 B7R1.18 CC(=O)C1CNC1 MCULE-2354733934 [1,0,0,1,0,0|2,0,0]=4 2343 B7R1.18 CC(=O)C1CNC1 MCULE-3110609785 [1,0,0,1,0,0|2,0,0]=4 2344 B7R1.18 CC(=O)C1CNC1 MCULE-4112322251 [1,0,0,1,0,0|2,0,0]=4 2345 B7R1.18 CC(=O)C1COC1 MCULE-3416774210 [1,0,0,1,0,0|2,0,0]=4 2346 B7R1.18 CC(=O)N1CCC1 MCULE-6467100562 [1,0,0,1,0,0|2,0,0]=4 2347 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [1,0,0,1,0,0|1,0,1]=4 2348 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [1,0,0,1,0,0|1,0,1]=4 2349 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [1,0,0,1,0,0|1,0,1]=4 2350 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [1,0,0,1,0,0|1,0,1]=4 2351 B7R1.18 N=C(N)C1CCC1 MCULE-3470535674 [1,0,0,1,0,0|2,0,0]=4 2352 B7R1.18 N=C(N)C1CCC1 MCULE-4802517706 [1,0,0,1,0,0|2,0,0]=4 2353 B7R1.18 N=C(N)C1CCC1 MCULE-5858986439 [1,0,0,1,0,0|2,0,0]=4 2354 B7R1.18 NC(=O)C1CCC1 MCULE-5151176129 [1,0,0,1,0,0|1,0,0]=3 2355 B7R1.18 NC(=O)C1CCN1 MCULE-1856696035 [1,0,0,1,0,0|1,0,0]=3 2356 B7R1.18 NC(=O)C1CCN1 MCULE-5757704016 [1,0,0,1,0,0|1,0,0]=3 2357 B7R1.18 NC(=O)C1CNC1 MCULE-2319282799 [1,0,0,1,0,0|2,0,0]=4 2358 B7R1.18 NC(=O)C1CNC1 MCULE-4985073048 [1,0,0,1,0,0|2,0,0]=4 2359 B7R1.18 NC(=O)C1CNC1 MCULE-8796959516 [1,0,0,1,0,0|2,0,0]=4 2360 B7R1.18 NC(=O)C1COC1 MCULE-1077689713 [1,0,0,1,0,0|2,0,0]=4 2361 B7R1.18 NC(=O)N1CCC1 MCULE-1594728830 [1,0,0,1,0,0|2,0,0]=4 2362 B7R1.18 NC(=O)[C@H]1CCN1 MCULE-7187425143 [1,0,0,1,0,0|1,0,0]=3 2363 B7R1.18 NC(=S)C1CCC1 MCULE-9753547991 [1,0,0,1,0,0|1,1,0]=4 2364 B7R1.18 O=C(Cl)C1CCC1 MCULE-2155859428 [1,0,0,1,0,0|1,0,0]=3 2365 B7R1.18 O=C(Cl)N1CCC1 MCULE-8313088104 [1,0,0,1,0,0|2,0,0]=4 2366 B7R1.18 O=C(O)C1=CCC1 MCULE-4244912351 [1,0,0,1,0,0|0,0,2]=4 2367 B7R1.18 O=C(O)C1CCC1 MCULE-2498509888 [1,0,0,1,0,0|0,0,0]=2 2368 B7R1.18 O=C(O)C1CCN1 MCULE-1336085891 [1,0,0,1,0,0|0,0,0]=2 2369 B7R1.18 O=C(O)C1CCN1 MCULE-6501890131 [1,0,0,1,0,0|0,0,0]=2 2370 B7R1.18 O=C(O)C1CCN1 MCULE-7647115314 [1,0,0,1,0,0|0,0,0]=2 2371 B7R1.18 O=C(O)C1CCO1 MCULE-6065911736 [1,0,0,1,0,0|1,0,0]=3 2372 B7R1.18 O=C(O)C1CCO1 MCULE-9296370119 [1,0,0,1,0,0|1,0,0]=3 2373 B7R1.18 O=C(O)C1CNC1 MCULE-2350328355 [1,0,0,1,0,0|1,0,0]=3 2374 B7R1.18 O=C(O)C1CNC1 MCULE-7890374869 [1,0,0,1,0,0|1,0,0]=3 2375 B7R1.18 O=C(O)C1COC1 MCULE-2530431165 [1,0,0,1,0,0|1,0,0]=3 2376 B7R1.18 O=C(O)C1CSC1 MCULE-4019152056 [1,0,0,1,0,0|1,0,0]=3 2377 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2126306157 [1,0,0,1,0,0|0,0,0]=2 2378 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-2597576629 [1,0,0,1,0,0|0,0,0]=2 2379 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-6006656004 [1,0,0,1,0,0|0,0,0]=2 2380 B7R1.18 O=C(O)[C@@H]1CCN1 MCULE-7241612713 [1,0,0,1,0,0|0,0,0]=2 2381 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-5117442811 [1,0,0,1,0,0|1,0,0]=3 2382 B7R1.18 O=C(O)[C@@H]1CCO1 MCULE-8116248615 [1,0,0,1,0,0|1,0,0]=3 2383 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-3254184046 [1,0,0,1,0,0|0,0,0]=2 2384 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5162570273 [1,0,0,1,0,0|0,0,0]=2 2385 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-5488052558 [1,0,0,1,0,0|0,0,0]=2 2386 B7R1.18 O=C(O)[C@H]1CCN1 MCULE-8240936495 [1,0,0,1,0,0|0,0,0]=2 2387 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-5499247834 [1,0,0,1,0,0|1,0,0]=3 2388 B7R1.18 O=C(O)[C@H]1CCO1 MCULE-7468207073 [1,0,0,1,0,0|1,0,0]=3 2389 B7R1.18 O=N(=O)C1CCC1 MCULE-1263563910 [1,0,0,1,0,0|1,0,1]=4 2390 B7R1.18 O=S([O-])C1CCC1 MCULE-2181260614 [1,0,0,1,0,0|1,0,1]=4 2391 B7R1.18 O=S([O-])C1CCC1 MCULE-5691798035 [1,0,0,1,0,0|1,0,1]=4 2392 B7R1.18 OB(O)C1CCC1 MCULE-3574521261 [1,0,0,1,0,0|1,0,1]=4 2393 B7R1.19 CC(=O)C1(CC1)Br MCULE-6185731473 [1,0,0,1,0,0|2,0,0]=4 2394 B7R1.19 CC(=O)C1(CC1)C MCULE-8745387740 [1,0,0,1,0,0|1,0,0]=3 2395 B7R1.19 CC(=O)C1(CC1)Cl MCULE-5975776904 [1,0,0,1,0,0|2,0,0]=4 2396 B7R1.19 CC(=O)C1(CC1)F MCULE-5848997919 [1,0,0,1,0,0|2,0,0]=4 2397 B7R1.19 CC(=O)C1(CC1)N MCULE-2138315633 [1,0,0,1,0,0|1,0,0]=3 2398 B7R1.19 CC(=O)C1(CC1)N MCULE-4094057841 [1,0,0,1,0,0|1,0,0]=3 2399 B7R1.19 CC(=O)C1(CO1)C MCULE-3263824467 [1,0,0,1,0,0|2,0,0]=4 2400 B7R1.19 CC(O)C1(CC1)C MCULE-6644959738 [1,0,0,1,0,0|1,0,1]=4 2401 B7R1.19 CC(O)C1(CC1)N MCULE-7865299177 [1,0,0,1,0,0|1,0,1]=4 2402 B7R1.19 CC1(CC1)B(O)O MCULE-4256202693 [1,0,0,1,0,0|1,0,1]=4 2403 B7R1.19 CC1(CC1)C(=N)N MCULE-1351695314 [1,0,0,1,0,0|2,0,0]=4 2404 B7R1.19 CC1(CC1)C(=N)N MCULE-5893769308 [1,0,0,1,0,0|2,0,0]=4 2405 B7R1.19 CC1(CC1)C(=O)Cl MCULE-6881294103 [1,0,0,1,0,0|1,0,0]=3 2406 B7R1.19 CC1(CC1)C(=O)N MCULE-7674282751 [1,0,0,1,0,0|1,0,0]=3 2407 B7R1.19 CC1(CC1)C(=O)O MCULE-6220717648 [1,0,0,1,0,0|0,0,0]=2 2408 B7R1.19 CC1(CO1)C(=O)O MCULE-9344660544 [1,0,0,1,0,0|1,0,0]=3 2409 B7R1.19 CC1(CS1)C(=O)N MCULE-5046393193 [1,0,0,1,0,0|2,0,0]=4 2410 B7R1.19 NC(=O)C1(CC1)Br MCULE-5824122510 [1,0,0,1,0,0|2,0,0]=4 2411 B7R1.19 NC(=O)C1(CC1)N MCULE-3982594366 [1,0,0,1,0,0|1,0,0]=3 2412 B7R1.19 NC(=O)C1(CC1)N MCULE-7935338610 [1,0,0,1,0,0|1,0,0]=3 2413 B7R1.19 NC(=O)C1(CC1)O MCULE-6542611632 [1,0,0,1,0,0|2,0,0]=4 2414 B7R1.19 NC1(CC1)C(=O)Cl MCULE-1901749245 [1,0,0,1,0,0|1,0,0]=3 2415 B7R1.19 NC1(CC1)C(=O)Cl MCULE-4354269723 [1,0,0,1,0,0|1,0,0]=3 2416 B7R1.19 NC1(CC1)C(=O)O MCULE-8718774934 [1,0,0,1,0,0|0,0,0]=2 2417 B7R1.19 NC1(CC1)C(=O)O MCULE-8788149299 [1,0,0,1,0,0|0,0,0]=2 2418 B7R1.19 O=C(O)C1(CC1)Br MCULE-9862099846 [1,0,0,1,0,0|1,0,0]=3 2419 B7R1.19 O=C(O)C1(CC1)Cl MCULE-9183003328 [1,0,0,1,0,0|1,0,0]=3 2420 B7R1.19 O=C(O)C1(CC1)F MCULE-1230430743 [1,0,0,1,0,0|1,0,0]=3 2421 B7R1.19 O=C(O)C1(CC1)I MCULE-7977320561 [1,0,0,1,0,0|1,0,0]=3 2422 B7R1.19 O=C(O)C1(CC1)O MCULE-7923609070 [1,0,0,1,0,0|1,0,0]=3 2423 B7R1.14 CC1(C=CCC1)C MCULE-9154912302 [1,0,0,1,0,0|2,0,0]=4 2424 B7R1.14 CC1(CCCC1)N MCULE-1696024032 [1,0,0,1,0,0|1,0,1]=4 2425 B7R1.14 CC1(CCCC1)N MCULE-7897960444 [1,0,0,1,0,0|1,0,1]=4 2426 B7R1.14 CC1(CCNC1)N MCULE-9317786482 [1,0,0,1,0,0|1,0,1]=4 2427 B7R1.14 CC1(CCNC1)N MCULE-9638120938 [1,0,0,1,0,0|1,0,1]=4 2428 B7R1.14 CC1(CCOC1)N MCULE-1997756007 [1,0,0,1,0,0|0,0,1]=3 2429 B7R1.14 CC1(CCOC1)N MCULE-5807249895 [1,0,0,1,0,0|0,0,1]=3 2430 B7R1.14 CC1(CCOC1)O MCULE-5065022086 [1,0,0,1,0,0|1,0,1]=4 2431 B7R1.14 C[C@@]1(CCNC1)N MCULE-3652011553 [1,0,0,1,0,0|1,0,1]=4 2432 B7R1.25 C#CC1(CCC1)N MCULE-5371030411 [1,0,0,1,0,0|1,0,1]=4 2433 B7R1.25 C#CC1(CCC1)N MCULE-7138087833 [1,0,0,1,0,0|1,0,1]=4 2434 B7R1.25 C=CC1(COC1)N MCULE-1446171155 [1,0,0,1,0,0|2,0,0]=4 2435 B7R1.25 C=CC1(COC1)N MCULE-2444826926 [1,0,0,1,0,0|2,0,0]=4 2436 B7R1.25 CC1(CCC1)C=O MCULE-9513047998 [1,0,0,1,0,0|1,0,0]=3 2437 B7R1.25 CC1(CCC1)CO MCULE-9646690839 [1,0,0,1,0,0|1,0,1]=4 2438 B7R1.25 CC1(CCN1)CO MCULE-2134260042 [1,0,0,1,0,0|0,0,1]=3 2439 B7R1.25 CC1(CCN1)CO MCULE-3210259937 [1,0,0,1,0,0|0,0,1]=3 2440 B7R1.25 CC1(CCO1)CO MCULE-6424264752 [1,0,0,1,0,0|1,0,1]=4 2441 B7R1.25 CC1(COC1)C=O MCULE-4295634366 [1,0,0,1,0,0|2,0,0]=4 2442 B7R1.25 CC1(CSC1)C=O MCULE-8783002976 [1,0,0,1,0,0|2,0,0]=4 2443 B7R1.25 CCC1(CCC1)N MCULE-5053916607 [1,0,0,1,0,0|1,0,1]=4 2444 B7R1.25 CCC1(CCC1)N MCULE-5413278315 [1,0,0,1,0,0|1,0,1]=4 2445 B7R1.25 CCC1(CNC1)N MCULE-3356995774 [1,0,0,1,0,0|1,0,1]=4 2446 B7R1.25 CCC1(CNC1)N MCULE-3405511665 [1,0,0,1,0,0|1,0,1]=4 2447 B7R1.25 CCC1(CNC1)N MCULE-9106873585 [1,0,0,1,0,0|1,0,1]=4 2448 B7R1.25 CCC1(COC1)N MCULE-1675536237 [1,0,0,1,0,0|0,0,1]=3 2449 B7R1.25 CCC1(COC1)N MCULE-2070317664 [1,0,0,1,0,0|0,0,1]=3 2450 B7R1.25 CCC1(COC1)O MCULE-7543171366 [1,0,0,1,0,0|1,0,1]=4 2451 B7R1.25 C[C@@]1(CCO1)CO MCULE-4685471926 [1,0,0,1,0,0|1,0,1]=4 2452 B7R1.25 C[C@@]1(CCO1)CO MCULE-5799098537 [1,0,0,1,0,0|1,0,1]=4 2453 B7R1.25 C[C@]1(CCO1)CO MCULE-5749345841 [1,0,0,1,0,0|1,0,1]=4 2454 B7R1.25 N#CC1(CCC1)N MCULE-5265286874 [1,0,0,1,0,0|1,0,1]=4 2455 B7R1.25 N#CC1(CCC1)N MCULE-9294868612 [1,0,0,1,0,0|1,0,1]=4 2456 B7R1.25 NC1(CCC1)CF MCULE-1820863854 [1,0,0,1,0,0|1,0,1]=4 2457 B7R1.25 NC1(CCC1)CF MCULE-4073039809 [1,0,0,1,0,0|1,0,1]=4 2458 B7R1.25 NC1(CCC1)CO MCULE-3303213714 [1,0,0,1,0,0|0,0,1]=3 2459 B7R1.25 NC1(CCC1)CO MCULE-7230626576 [1,0,0,1,0,0|0,0,1]=3 2460 B7R1.25 NC1(COC1)CF MCULE-5210114564 [1,0,0,1,0,0|1,0,1]=4 2461 B7R1.25 NC1(COC1)CF MCULE-9301949135 [1,0,0,1,0,0|1,0,1]=4 2462 B7R1.25 NC1(COC1)CO MCULE-5347414182 [1,0,0,1,0,0|1,0,1]=4 2463 B7R1.25 NCC1(CCC1)N MCULE-4976713787 [1,0,0,1,0,0|1,0,1]=4 2464 B7R1.25 NCC1(CCC1)N MCULE-8019875303 [1,0,0,1,0,0|1,0,1]=4 2465 B7R1.25 NCC1(COC1)N MCULE-1079562077 [1,0,0,1,0,0|1,0,1]=4 2466 B7R1.25 NCC1(COC1)N MCULE-6820840703 [1,0,0,1,0,0|1,0,1]=4 2467 B7R1.25 NCC1(COC1)N MCULE-6888014911 [1,0,0,1,0,0|1,0,1]=4 2468 B7R1.25 O=CC1(CCC1)F MCULE-8878080032 [1,0,0,1,0,0|1,0,0]=3 2469 B7R1.25 OCC1(CCC1)F MCULE-5944864184 [1,0,0,1,0,0|1,0,1]=4 2470 B7R1.25 OCC1(CCC1)O MCULE-2830358505 [1,0,0,1,0,0|1,0,1]=4 2471 B7R1.29 CCC1(CC1)C=O MCULE-9240015002 [1,0,0,1,0,0|1,0,0]=3 2472 B7R1.29 CCC1(CC1)CO MCULE-9504231451 [1,0,0,1,0,0|1,0,1]=4 2473 B7R1.29 COC1(CC1)C=O MCULE-7427428769 [1,0,0,1,0,0|2,0,0]=4 2474 B7R1.29 CSC1(CC1)C=O MCULE-8407600042 [1,0,0,1,0,0|2,0,0]=4 2475 B7R1.29 O=CC1(CC1)CF MCULE-6887466124 [1,0,0,1,0,0|2,0,0]=4 2476 B9R1.38 CC1CC(=O)NC1(C)C MCULE-4801665077 [0,0,0,1,0,1|2,0,0]=4 2477 B9R1.38 CC1CC(=O)OC1(C)C MCULE-6169528498 [0,0,0,1,0,1|2,0,0]=4 2478 B9R1.38 CC1OC(=O)CC1(C)C MCULE-2629079906 [0,0,0,1,0,1|1,0,0]=3 2479 B9R1.44 CC1(CC1F)CC(=O)O MCULE-2399259815 [0,0,0,1,0,1|2,0,0]=4 2480 B9R1.66 CC1(CCCC(=O)C1)C MCULE-5947496314 [0,0,0,1,0,1|2,0,0]=4 2481 B9R1.66 CC1(CCCC(=O)N1)C MCULE-9506005736 [0,0,0,1,0,1|2,0,0]=4 2482 B9R1.66 CC1(CCNC(=O)C1)C MCULE-5703517542 [0,0,0,1,0,1|2,0,0]=4 2483 B9R1.66 CC1(CCOC(=O)C1)C MCULE-4727187858 [0,0,0,1,0,1|1,0,0]=3 2484 B9R1.66 CC1(CCOC(=O)C1)O MCULE-5265065779 [0,0,0,1,0,1|1,0,0]=3 2485 B9R1.66 CC1(CCOS(=O)O1)C MCULE-7552644708 [0,0,0,1,0,1|2,0,0]=4 2486 B9R1.66 C[C@]1(CCOC(=O)C1)O MCULE-9416165586 [0,0,0,1,0,1|1,0,0]=3 2487 B9R1.125 CC1(COC(=O)C1)CO MCULE-2278000717 [0,0,0,1,0,1|2,0,0]=4 2488 B9R1.125 CC1(COC(=O)N1)CI MCULE-2242952890 [0,0,0,1,0,1|2,0,0]=4 2489 B9R1.125 CC1(COC(=O)N1)CN MCULE-6928291098 [0,0,0,1,0,1|2,0,0]=4 2490 B9R1.125 CC1(COC(=O)N1)CO MCULE-7873521103 [0,0,0,1,0,1|2,0,0]=4 2491 B9R1.125 CCC1(CCC(=O)O1)C MCULE-1533992852 [0,0,0,1,0,1|2,0,0]=4 2492 B9R1.125 CCC1(CNC(=O)C1)C MCULE-9614797023 [0,0,0,1,0,1|2,0,0]=4 2493 B9R1.127 CCC1(CC1C(=O)O)C MCULE-5907126944 [0,0,0,1,0,1|1,0,0]=3 2494 B9R1.128 COC1(CC1)CC(=O)O MCULE-1379689122 [0,0,0,1,0,1|2,0,0]=4 2495 B9R1.128 NCC1(CC1)CC(=O)O MCULE-5672358915 [0,0,0,1,0,1|2,0,0]=4 2496 B9R1.128 NCC1(CC1)CC(=O)O MCULE-9536586933 [0,0,0,1,0,1|2,0,0]=4 2497 B9R1.128 O=C(O)CC1(CC1)CO MCULE-8706737331 [0,0,0,1,0,1|2,0,0]=4 2498 B9R1.128 O=C(O)CC1(CC1)CS MCULE-2805511819 [0,0,0,1,0,1|2,0,0]=4 2499 B9R1.146 CC1(CCS(=O)(=O)C1)N MCULE-1622028320 [0,0,0,1,0,1|1,0,1]=4 2500 B9R1.146 CC1(CCS(=O)(=O)C1)N MCULE-3413973551 [0,0,0,1,0,1|1,0,1]=4 2501 B9R1.146 C[C@@]1(CCS(=O)(=O)C1)N MCULE-2880224003 [0,0,0,1,0,1|1,0,1]=4 2502 B9R1.146 C[C@@]1(CCS(=O)(=O)C1)N MCULE-9371741380 [0,0,0,1,0,1|1,0,1]=4 2503 B9R1.146 C[C@]1(CCS(=O)(=O)C1)N MCULE-5474639854 [0,0,0,1,0,1|1,0,1]=4 2504 B9R1.146 C[C@]1(CCS(=O)(=O)C1)N MCULE-9653680627 [0,0,0,1,0,1|1,0,1]=4 2505 B9R1.166 C1(NCC1(C)C)C(=O)O MCULE-8091738282 [0,0,0,1,0,1|2,0,0]=4 2506 B9R1.166 CC1(CCC1C(=O)O)C MCULE-4099946993 [0,0,0,1,0,1|1,0,0]=3 2507 B9R1.166 CC1(CNC1C(=O)O)C MCULE-8386082188 [0,0,0,1,0,1|2,0,0]=4 2508 B9R1.166 CC1(CNC1C(=O)O)C MCULE-9067770862 [0,0,0,1,0,1|2,0,0]=4 2509 B9R1.166 CC1(CN[C@@H]1C(=O)O)C MCULE-3707363843 [0,0,0,1,0,1|2,0,0]=4 2510 B9R1.166 CC1(CN[C@@H]1C(=O)O)C MCULE-5671349948 [0,0,0,1,0,1|2,0,0]=4 2511 B9R1.166 CC1(CN[C@H]1C(=O)O)C MCULE-3480839319 [0,0,0,1,0,1|2,0,0]=4 2512 B9R1.166 O=C(O)C1CCC1(F)F MCULE-5646109920 [0,0,0,1,0,1|2,0,0]=4 2513 B9R1.166 O=C(O)[C@@H]1CCC1(F)F MCULE-1777760238 [0,0,0,1,0,1|2,0,0]=4 2514 B9R1.166 O=C(O)[C@H]1CCC1(F)F MCULE-9140397233 [0,0,0,1,0,1|2,0,0]=4 2515 B9R1.171 CC(=O)CC1(CCC1)O MCULE-9059999179 [0,0,0,1,0,1|2,0,0]=4 2516 B9R1.171 CC(=O)NC1(CCC1)C MCULE-3803103967 [0,0,0,1,0,1|2,0,0]=4 2517 B9R1.171 CC1(CCC1)CC(=O)O MCULE-7933536922 [0,0,0,1,0,1|1,0,0]=3 2518 B9R1.171 CC1(COC1)CC(=O)O MCULE-6717906096 [0,0,0,1,0,1|2,0,0]=4 2519 B9R1.171 NC(=O)CC1(CCC1)N MCULE-9066660105 [0,0,0,1,0,1|1,0,0]=3 2520 B9R1.171 NC(=O)CC1(CCC1)N MCULE-9947560643 [0,0,0,1,0,1|1,0,0]=3 2521 B9R1.171 NC(=O)CC1(COC1)N MCULE-9538138103 [0,0,0,1,0,1|2,0,0]=4 2522 B9R1.171 NC1(CCC1)CC(=O)O MCULE-2268387352 [0,0,0,1,0,1|0,0,0]=2 2523 B9R1.171 NC1(CCC1)CC(=O)O MCULE-7887308813 [0,0,0,1,0,1|0,0,0]=2 2524 B9R1.171 NC1(COC1)CC(=O)O MCULE-7347209492 [0,0,0,1,0,1|1,0,0]=3 2525 B9R1.171 O=C(O)CC1(CCC1)O MCULE-4697861595 [0,0,0,1,0,1|1,0,0]=3 2526 B9R1.171 O=C(O)CC1(COC1)F MCULE-8446148413 [0,0,0,1,0,1|2,0,0]=4 2527 B9R1.40 CC1(CCC=CC1=O)C MCULE-1811364024 [0,1,0,1,0,0|2,0,0]=4 2528 B9R1.40 CC1(CCCCC1=O)C MCULE-8496149275 [0,1,0,1,0,0|2,0,0]=4 2529 B9R1.40 CC1(CCCCC1=O)Cl MCULE-4801960774 [0,1,0,1,0,0|2,0,0]=4 2530 B9R1.40 CC1(CCCNC1=O)C MCULE-4245207122 [0,1,0,1,0,0|2,0,0]=4 2531 B9R1.40 CC1(CCCNC1=O)N MCULE-5500513283 [0,1,0,1,0,0|1,0,0]=3 2532 B9R1.40 CC1(CCCNC1=O)N MCULE-5995809623 [0,1,0,1,0,0|1,0,0]=3 2533 B9R1.40 CC1(CCCOC1=O)C MCULE-9200729474 [0,1,0,1,0,0|1,0,0]=3 2534 B9R1.40 CC1(CCNCC1=O)C MCULE-8773076138 [0,1,0,1,0,0|2,0,0]=4 2535 B9R1.40 CC1(CNCCC1=O)C MCULE-5070569514 [0,1,0,1,0,0|2,0,0]=4 2536 B9R1.40 CC1(CNCCC1=O)C MCULE-7248994046 [0,1,0,1,0,0|2,0,0]=4 2537 B9R1.40 CC1(COCCC1=O)C MCULE-2901452802 [0,1,0,1,0,0|2,0,0]=4 2538 B9R1.40 CC1(NCCNC1=O)C MCULE-5729807670 [0,1,0,1,0,0|2,0,0]=4 2539 B9R1.40 CC1(NCCOC1=O)C MCULE-4468431509 [0,1,0,1,0,0|1,0,0]=3 2540 B9R1.40 CC1(OCCCC1=O)C MCULE-1810586504 [0,1,0,1,0,0|2,0,0]=4 2541 B9R1.40 CC1(SCCNC1=O)C MCULE-8853284892 [0,1,0,1,0,0|2,0,0]=4 2542 B9R1.93 C=C[C@@H]1C[C@]1(N)C(=O)O MCULE-4179168539 [0,1,0,1,0,0|0,0,1]=3 2543 B9R1.93 CCC1CC1(N)C(=O)O MCULE-5139419329 [0,1,0,1,0,0|0,0,0]=2 2544 B9R1.107 COC1CC(=O)C1(C)C MCULE-8233585132 [0,1,0,1,0,0|2,0,0]=4 2545 B9R1.152 C=C1CC(C1)(C)C(=O)O MCULE-7205894158 [0,1,0,1,0,0|1,0,1]=4 2546 B9R1.152 C=C1CC(C1)(O)C(=O)O MCULE-9531189314 [0,1,0,1,0,0|1,0,1]=4 2547 B9R1.152 CC1(CC(=O)C1)C(=O)O MCULE-5766836727 [0,1,0,1,0,0|1,0,1]=4 2548 B9R1.152 CC1(CC(C1)N)C(=O)O MCULE-2576475336 [0,1,0,1,0,0|1,0,0]=3 2549 B9R1.152 CC1(CC(C1)N)C(=O)O MCULE-6535558159 [0,1,0,1,0,0|1,0,0]=3 2550 B9R1.152 CC1CC(C1)(C)C(=O)O MCULE-6119301322 [0,1,0,1,0,0|1,0,0]=3 2551 B9R1.152 CN1CC(C1)(C)C(=O)O MCULE-4633405499 [0,1,0,1,0,0|1,0,0]=3 2552 B9R1.152 C[C@@]1(C[C@@H](C1)N)C(=O)O MCULE-4599601598 [0,1,0,1,0,0|1,0,0]=3 2553 B9R1.152 C[C@@]1(C[C@@H](C1)N)C(=O)O MCULE-4763611062 [0,1,0,1,0,0|1,0,0]=3 2554 B9R1.152 C[C@@]1(C[C@H](C1)N)C(=O)O MCULE-2054460365 [0,1,0,1,0,0|1,0,0]=3 2555 B9R1.152 C[C@@]1(C[C@H](C1)N)C(=O)O MCULE-8615255294 [0,1,0,1,0,0|1,0,0]=3 2556 B9R1.152 C[C@H]1C[C@@](C1)(N)C(=O)O MCULE-7807418833 [0,1,0,1,0,0|0,0,0]=2 2557 B9R1.152 C[C@H]1C[C@](C1)(N)C(=O)O MCULE-2634950955 [0,1,0,1,0,0|0,0,0]=2 2558 B9R1.152 NC1(CC(C1)F)C(=O)O MCULE-5206815009 [0,1,0,1,0,0|0,0,0]=2 2559 B9R1.152 NC1(CC(C1)F)C(=O)O MCULE-9944960595 [0,1,0,1,0,0|0,0,0]=2 2560 B9R1.152 NC1(CC(C1)O)C(=O)O MCULE-8304595021 [0,1,0,1,0,0|0,0,0]=2 2561 B9R1.152 NC1(CC(C1)O)C(=O)O MCULE-8353432396 [0,1,0,1,0,0|0,0,0]=2 2562 B9R1.152 NC1CC(C1)(F)C(=O)O MCULE-8174066741 [0,1,0,1,0,0|1,0,0]=3 2563 B9R1.152 N[C@@]1(C[C@@H](C1)F)C(=O)O MCULE-3535102578 [0,1,0,1,0,0|0,0,0]=2 2564 B9R1.152 N[C@@]1(C[C@@H](C1)O)C(=O)O MCULE-3919423791 [0,1,0,1,0,0|0,0,0]=2 2565 B9R1.152 N[C@@]1(C[C@H](C1)F)C(=O)O MCULE-4417403698 [0,1,0,1,0,0|0,0,0]=2 2566 B9R1.152 O=C(O)C1(CC(C1)O)O MCULE-4321795643 [0,1,0,1,0,0|1,0,0]=3 2567 B9R1.152 O=C(O)[C@@]1(C[C@@H](C1)O)F MCULE-1599041261 [0,1,0,1,0,0|1,0,0]=3 2568 B9R1.152 O=C(O)[C@@]1(C[C@@H](C1)O)O MCULE-3005775021 [0,1,0,1,0,0|1,0,0]=3 2569 B9R1.152 O=C(O)[C@@]1(C[C@H](C1)O)F MCULE-8929901678 [0,1,0,1,0,0|1,0,0]=3 2570 B9R1.152 O=C(O)[C@@]1(C[C@H](C1)O)O MCULE-2152193030 [0,1,0,1,0,0|1,0,0]=3 2571 B9R1.153 CC1(NC(=O)C1(C)C)C MCULE-9399815180 [0,1,0,1,0,0|2,0,0]=4 2572 B9R1.163 CC(=O)C1(CCCC1)C MCULE-7946764519 [0,1,0,1,0,0|2,0,0]=4 2573 B9R1.163 CC(=O)C1(CCCC1)N MCULE-1766488888 [0,1,0,1,0,0|1,0,0]=3 2574 B9R1.163 CC(=O)C1(CCCC1)N MCULE-2390313394 [0,1,0,1,0,0|1,0,0]=3 2575 B9R1.163 CC(=O)C1(CCCC1)O MCULE-4607553416 [0,1,0,1,0,0|2,0,0]=4 2576 B9R1.163 CC(=O)C1(CCCO1)C MCULE-3832225855 [0,1,0,1,0,0|2,0,0]=4 2577 B9R1.163 CC1(C=CCC1)C(=O)O MCULE-5900825388 [0,1,0,1,0,0|1,0,0]=3 2578 B9R1.163 CC1(CC=CC1)C(=O)O MCULE-6612456038 [0,1,0,1,0,0|1,0,1]=4 2579 B9R1.163 CC1(CCCC1)C(=O)Cl MCULE-6905026517 [0,1,0,1,0,0|2,0,0]=4 2580 B9R1.163 CC1(CCCC1)C(=O)O MCULE-8150530718 [0,1,0,1,0,0|1,0,0]=3 2581 B9R1.163 CC1(CCCN1)C(=O)N MCULE-1073156492 [0,1,0,1,0,0|1,0,0]=3 2582 B9R1.163 CC1(CCCN1)C(=O)N MCULE-4207908355 [0,1,0,1,0,0|1,0,0]=3 2583 B9R1.163 CC1(CCCN1)C(=O)N MCULE-5102556329 [0,1,0,1,0,0|1,0,0]=3 2584 B9R1.163 CC1(CCCN1)C(=O)O MCULE-2669113714 [0,1,0,1,0,0|0,0,0]=2 2585 B9R1.163 CC1(CCCN1)C(=O)O MCULE-3184723558 [0,1,0,1,0,0|0,0,0]=2 2586 B9R1.163 CC1(CCCN1)C(=O)O MCULE-5494365974 [0,1,0,1,0,0|0,0,0]=2 2587 B9R1.163 CC1(CCCN1)C(=O)O MCULE-9532642299 [0,1,0,1,0,0|0,0,0]=2 2588 B9R1.163 CC1(CCCN1)C(=O)O MCULE-9805069526 [0,1,0,1,0,0|0,0,0]=2 2589 B9R1.163 CC1(CCCO1)C(=O)O MCULE-9576233735 [0,1,0,1,0,0|1,0,0]=3 2590 B9R1.163 CC1(CCCS1)C(=O)O MCULE-3409370715 [0,1,0,1,0,0|1,0,0]=3 2591 B9R1.163 CC1(CCNC1)C(=O)N MCULE-9618767565 [0,1,0,1,0,0|1,0,0]=3 2592 B9R1.163 CC1(CCNC1)C(=O)O MCULE-2715430873 [0,1,0,1,0,0|0,0,0]=2 2593 B9R1.163 CC1(CCNC1)C(=O)O MCULE-4084355022 [0,1,0,1,0,0|0,0,0]=2 2594 B9R1.163 CC1(CCOC1)C(=O)O MCULE-6893882009 [0,1,0,1,0,0|1,0,0]=3 2595 B9R1.163 CC1(CSSC1)C(=O)O MCULE-1267186189 [0,1,0,1,0,0|2,0,0]=4 2596 B9R1.163 CC1(NCCS1)C(=O)O MCULE-3303237869 [0,1,0,1,0,0|0,0,0]=2 2597 B9R1.163 CC1(OCCO1)C(=O)O MCULE-6576803543 [0,1,0,1,0,0|1,0,0]=3 2598 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-2607591453 [0,1,0,1,0,0|0,0,0]=2 2599 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-6141960789 [0,1,0,1,0,0|0,0,0]=2 2600 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-7011144386 [0,1,0,1,0,0|0,0,0]=2 2601 B9R1.163 C[C@@]1(CCCN1)C(=O)O MCULE-8922118927 [0,1,0,1,0,0|0,0,0]=2 2602 B9R1.163 C[C@@]1(CCCO1)C(=O)O MCULE-5169117592 [0,1,0,1,0,0|1,0,0]=3 2603 B9R1.163 C[C@@]1(CCNC1)C(=O)O MCULE-3070355045 [0,1,0,1,0,0|0,0,0]=2 2604 B9R1.163 C[C@@]1(CCNC1)C(=O)O MCULE-3719506215 [0,1,0,1,0,0|0,0,0]=2 2605 B9R1.163 C[C@@]1(CCOC1)C(=O)O MCULE-5585882923 [0,1,0,1,0,0|1,0,0]=3 2606 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-4783754920 [0,1,0,1,0,0|1,0,0]=3 2607 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-7441682522 [0,1,0,1,0,0|1,0,0]=3 2608 B9R1.163 C[C@]1(CCCN1)C(=O)N MCULE-8011663424 [0,1,0,1,0,0|1,0,0]=3 2609 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-6724020872 [0,1,0,1,0,0|0,0,0]=2 2610 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-7675502884 [0,1,0,1,0,0|0,0,0]=2 2611 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-8343149548 [0,1,0,1,0,0|0,0,0]=2 2612 B9R1.163 C[C@]1(CCCN1)C(=O)O MCULE-9260269719 [0,1,0,1,0,0|0,0,0]=2 2613 B9R1.163 C[C@]1(CCCO1)C(=O)O MCULE-3910400790 [0,1,0,1,0,0|1,0,0]=3 2614 B9R1.163 C[C@]1(CCNC1)C(=O)O MCULE-1423230640 [0,1,0,1,0,0|0,0,0]=2 2615 B9R1.163 C[C@]1(CCNC1)C(=O)O MCULE-7327407576 [0,1,0,1,0,0|0,0,0]=2 2616 B9R1.163 NC(=O)C1(CCCC1)N MCULE-1603183997 [0,1,0,1,0,0|1,0,0]=3 2617 B9R1.163 NC(=O)C1(CCCC1)N MCULE-6535833155 [0,1,0,1,0,0|1,0,0]=3 2618 B9R1.163 NC(=O)C1(CCCC1)O MCULE-7750018506 [0,1,0,1,0,0|2,0,0]=4 2619 B9R1.163 NC(=O)C1(CCNC1)F MCULE-2967472132 [0,1,0,1,0,0|2,0,0]=4 2620 B9R1.163 NC(=O)C1(CCNC1)O MCULE-3402125568 [0,1,0,1,0,0|2,0,0]=4 2621 B9R1.163 NC(=O)C1(CCNC1)O MCULE-4107989965 [0,1,0,1,0,0|2,0,0]=4 2622 B9R1.163 NC(=O)C1(CCSC1)N MCULE-1255795217 [0,1,0,1,0,0|1,0,0]=3 2623 B9R1.163 NC(=O)C1(CCSC1)O MCULE-2351837625 [0,1,0,1,0,0|2,0,0]=4 2624 B9R1.163 NC(=S)C1(CCCC1)N MCULE-1374309481 [0,1,0,1,0,0|1,1,0]=4 2625 B9R1.163 NC1(CC=CC1)C(=O)O MCULE-1445980877 [0,1,0,1,0,0|0,0,1]=3 2626 B9R1.163 NC1(CC=CC1)C(=O)O MCULE-5381827504 [0,1,0,1,0,0|0,0,1]=3 2627 B9R1.163 NC1(CCCC1)C(=O)O MCULE-6366286422 [0,1,0,1,0,0|0,0,0]=2 2628 B9R1.163 NC1(CCNC1)C(=O)O MCULE-1061035749 [0,1,0,1,0,0|0,0,0]=2 2629 B9R1.163 NC1(CCOC1)C(=O)O MCULE-1020331216 [0,1,0,1,0,0|0,0,0]=2 2630 B9R1.163 NC1(CCOC1)C(=O)O MCULE-3239849151 [0,1,0,1,0,0|0,0,0]=2 2631 B9R1.163 NC1(CCOC1)C(=O)O MCULE-7635316557 [0,1,0,1,0,0|0,0,0]=2 2632 B9R1.163 NC1(CCSC1)C(=O)O MCULE-2866413498 [0,1,0,1,0,0|0,0,0]=2 2633 B9R1.163 NC1(CCSC1)C(=O)O MCULE-3077570702 [0,1,0,1,0,0|0,0,0]=2 2634 B9R1.163 N[C@@]1(CCOC1)C(=O)O MCULE-4940789798 [0,1,0,1,0,0|0,0,0]=2 2635 B9R1.163 N[C@@]1(CCOC1)C(=O)O MCULE-9120207414 [0,1,0,1,0,0|0,0,0]=2 2636 B9R1.163 N[C@@]1(CCSC1)C(=O)O MCULE-3449072625 [0,1,0,1,0,0|0,0,0]=2 2637 B9R1.163 N[C@@]1(CCSC1)C(=O)O MCULE-6533506498 [0,1,0,1,0,0|0,0,0]=2 2638 B9R1.163 N[C@]1(CCNC1)C(=O)O MCULE-5112163951 [0,1,0,1,0,0|0,0,0]=2 2639 B9R1.163 N[C@]1(CCNC1)C(=O)O MCULE-7065442028 [0,1,0,1,0,0|0,0,0]=2 2640 B9R1.163 N[C@]1(CCOC1)C(=O)O MCULE-6757422211 [0,1,0,1,0,0|0,0,0]=2 2641 B9R1.163 N[C@]1(CCOC1)C(=O)O MCULE-8786481856 [0,1,0,1,0,0|0,0,0]=2 2642 B9R1.163 N[C@]1(CCSC1)C(=O)O MCULE-1832449395 [0,1,0,1,0,0|0,0,0]=2 2643 B9R1.163 N[C@]1(CCSC1)C(=O)O MCULE-1974139646 [0,1,0,1,0,0|0,0,0]=2 2644 B9R1.163 O=C(O)C1(CCCC1)Br MCULE-3131005284 [0,1,0,1,0,0|1,0,0]=3 2645 B9R1.163 O=C(O)C1(CCCC1)F MCULE-4282263280 [0,1,0,1,0,0|1,0,0]=3 2646 B9R1.163 O=C(O)C1(CCCC1)O MCULE-2147028492 [0,1,0,1,0,0|1,0,0]=3 2647 B9R1.163 O=C(O)C1(CCNC1)F MCULE-3943818123 [0,1,0,1,0,0|1,0,0]=3 2648 B9R1.163 O=C(O)C1(CCNC1)F MCULE-9385624346 [0,1,0,1,0,0|1,0,0]=3 2649 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5890399768 [0,1,0,1,0,0|1,0,0]=3 2650 B9R1.163 O=C(O)C1(CCNC1)O MCULE-5910869185 [0,1,0,1,0,0|1,0,0]=3 2651 B9R1.163 O=C(O)C1(CCOC1)F MCULE-5718551369 [0,1,0,1,0,0|1,0,0]=3 2652 B9R1.163 O=C(O)C1(CCOC1)O MCULE-8834969992 [0,1,0,1,0,0|1,0,0]=3 2653 B9R1.163 O=C(O)C1(CCSC1)O MCULE-7477879136 [0,1,0,1,0,0|1,0,0]=3 2654 B9R1.163 O=C(O)[C@@]1(CCNC1)F MCULE-8296048165 [0,1,0,1,0,0|1,0,0]=3 2655 B9R1.165 CC(C)(C(=O)O)C1CC1 MCULE-6388172792 [0,1,0,1,0,0|1,0,0]=3 2656 B9R1.165 CC(N)(C(=O)N)C1CC1 MCULE-9753922744 [0,1,0,1,0,0|1,0,0]=3 2657 B9R1.165 CC(N)(C(=O)O)C1CC1 MCULE-5305811185 [0,1,0,1,0,0|0,0,0]=2 2658 B9R1.165 CC(N)(C(=O)O)C1CC1 MCULE-5428190802 [0,1,0,1,0,0|0,0,0]=2 2659 B9R1.165 CC(O)(C(=O)O)C1CC1 MCULE-4917199167 [0,1,0,1,0,0|1,0,0]=3 2660 B9R1.165 O=C(O)C(F)(F)C1CC1 MCULE-2348785938 [0,1,0,1,0,0|2,0,0]=4 2661 B9R1.179 C=CCC1(CC1)C(=O)O MCULE-9984484632 [0,1,0,1,0,0|1,0,1]=4 2662 B9R1.179 CCCC1(CC1)C(=O)O MCULE-3737695448 [0,1,0,1,0,0|1,0,0]=3 2663 B9R1.179 CCOC1(CC1)C(=O)O MCULE-2011368943 [0,1,0,1,0,0|1,0,0]=3 2664 B9R1.179 CCSC1(CC1)C(=O)O MCULE-1424616643 [0,1,0,1,0,0|1,0,0]=3 2665 B9R1.179 CNCC1(CC1)C(=O)O MCULE-4156653448 [0,1,0,1,0,0|1,0,0]=3 2666 B9R1.179 CNCC1(CC1)C(=O)O MCULE-7565142951 [0,1,0,1,0,0|1,0,0]=3 2667 B9R1.179 COCC1(CC1)C(=O)O MCULE-8440485105 [0,1,0,1,0,0|1,0,0]=3 2668 B9R1.179 N#CCC1(CC1)C(=O)O MCULE-4792635696 [0,1,0,1,0,0|1,0,1]=4 2669 B9R1.179 NCCC1(CC1)C(=O)O MCULE-1732909908 [0,1,0,1,0,0|1,0,0]=3 2670 B9R1.179 NCCC1(CC1)C(=O)O MCULE-7079307522 [0,1,0,1,0,0|1,0,0]=3 2671 B9R1.179 O=C(O)C1(CC1)CCCl MCULE-8895296339 [0,1,0,1,0,0|1,0,0]=3 2672 B9R1.179 O=C(O)C1(CC1)CCF MCULE-7598361699 [0,1,0,1,0,0|1,0,0]=3 2673 B9R1.179 O=C(O)C1(CC1)CCO MCULE-4706234979 [0,1,0,1,0,0|1,0,0]=3 2674 B9R1.24 CC1(CCCC1CO)N MCULE-2343642043 [0,1,0,1,0,0|1,0,1]=4 2675 B9R1.24 CC1(CCCC1CO)N MCULE-9579192803 [0,1,0,1,0,0|1,0,1]=4 2676 B9R1.24 CC1(CCOC1C=O)C MCULE-9559919142 [0,1,0,1,0,0|1,0,1]=4 2677 B9R1.106 CC1(C(=O)CCC1O)C MCULE-3636393805 [0,1,0,1,0,0|2,0,0]=4 2678 B9R1.106 CC1(C(=O)COC1=O)C MCULE-4169378372 [0,1,0,1,0,0|1,0,1]=4 2679 B9R1.106 CC1(C(=O)NCC1N)C MCULE-8754705727 [0,1,0,1,0,0|2,0,0]=4 2680 B9R1.106 CC1(C(=O)NC[C@@H]1N)C MCULE-1926232108 [0,1,0,1,0,0|2,0,0]=4 2681 B9R1.106 CC1(C(=O)NC[C@@H]1N)C MCULE-8824415523 [0,1,0,1,0,0|2,0,0]=4 2682 B9R1.106 CC1(C(=O)NC[C@H]1N)C MCULE-2199732058 [0,1,0,1,0,0|2,0,0]=4 2683 B9R1.106 CC1(C(=O)NC[C@H]1N)C MCULE-7384902839 [0,1,0,1,0,0|2,0,0]=4 2684 B9R1.106 C[C@@]1(C(=O)OC[C@H]1O)O MCULE-6247915400 [0,1,0,1,0,0|1,0,0]=3 2685 B9R1.106 C[C@@]1(C(=O)OC[C@H]1O)O MCULE-6635734630 [0,1,0,1,0,0|1,0,0]=3 2686 B9R1.138 CC1(CCC(=O)C1=O)C MCULE-2832918423 [0,1,0,1,0,0|1,0,1]=4 2687 B9R1.138 CC1(CCC(C1=O)Br)C MCULE-1239203799 [0,1,0,1,0,0|2,0,0]=4 2688 B9R1.138 CC1(CCC(C1=O)Cl)C MCULE-9064906453 [0,1,0,1,0,0|2,0,0]=4 2689 B9R1.186 CNC(=O)C1(COC1)N MCULE-2205559430 [0,1,0,1,0,0|2,0,0]=4 2690 B9R1.186 COC(=O)C1(CCC1)Br MCULE-8163588898 [0,1,0,1,0,0|1,0,0]=3 2691 B9R1.186 COC(=O)C1(CCC1)C MCULE-4295306660 [0,1,0,1,0,0|1,0,0]=3 2692 B9R1.186 COC(=O)C1(CCC1)N MCULE-4561399895 [0,1,0,1,0,0|0,0,0]=2 2693 B9R1.186 COC(=O)C1(CCC1)N MCULE-6643904748 [0,1,0,1,0,0|0,0,0]=2 2694 B9R1.186 COC(=O)C1(CCC1)O MCULE-9685086952 [0,1,0,1,0,0|1,0,0]=3 2695 B9R1.186 COC(=O)C1(CCN1)C MCULE-7183976970 [0,1,0,1,0,0|0,0,0]=2 2696 B9R1.186 COC(=O)C1(CCN1)C MCULE-7540921007 [0,1,0,1,0,0|0,0,0]=2 2697 B9R1.186 COC(=O)C1(CNC1)C MCULE-1276155967 [0,1,0,1,0,0|2,0,0]=4 2698 B9R1.186 COC(=O)C1(CNC1)C MCULE-9741948554 [0,1,0,1,0,0|2,0,0]=4 2699 B9R1.186 COC(=O)C1(CNC1)F MCULE-4349625868 [0,1,0,1,0,0|2,0,0]=4 2700 B9R1.186 COC(=O)C1(CNC1)F MCULE-6589739194 [0,1,0,1,0,0|2,0,0]=4 2701 B9R1.186 COC(=O)C1(CNC1)O MCULE-4998959697 [0,1,0,1,0,0|2,0,0]=4 2702 B9R1.186 COC(=O)C1(CNC1)O MCULE-7985614560 [0,1,0,1,0,0|2,0,0]=4 2703 B9R1.186 COC(=O)C1(COC1)C MCULE-3679844068 [0,1,0,1,0,0|2,0,0]=4 2704 B9R1.186 COC(=O)C1(COC1)N MCULE-4240909479 [0,1,0,1,0,0|1,0,0]=3 2705 B9R1.186 COC(=O)[C@@]1(CCN1)C MCULE-6518097292 [0,1,0,1,0,0|0,0,0]=2 2706 B9R1.186 COC(=O)[C@@]1(CCN1)C MCULE-7597317458 [0,1,0,1,0,0|0,0,0]=2 2707 B9R1.190 CNC1(CC1)C(=O)OC MCULE-3867090191 [0,1,0,1,0,0|2,0,0]=4 2708 B9R1.190 COC(=O)C1(CC1)CBr MCULE-7592167668 [0,1,0,1,0,0|2,0,0]=4 2709 B9R1.190 COC(=O)C1(CC1)CF MCULE-1552017513 [0,1,0,1,0,0|2,0,0]=4 2710 B9R1.190 COC(=O)C1(CC1)CN MCULE-3043222647 [0,1,0,1,0,0|2,0,0]=4 2711 B9R1.190 COC(=O)C1(CC1)CN MCULE-5823579491 [0,1,0,1,0,0|2,0,0]=4 2712 B9R1.190 COC(=O)C1(CC1)CO MCULE-4380084932 [0,1,0,1,0,0|2,0,0]=4 2713 B9R1.190 COC(=O)C1(CC1)OC MCULE-2012883593 [0,1,0,1,0,0|2,0,0]=4 2714 B9R1.202 CC1(CCNC1=O)CO MCULE-3034841692 [0,1,0,1,0,0|2,0,0]=4 2715 B9R1.202 CCC1(CCCC1=O)C MCULE-6845043548 [0,1,0,1,0,0|2,0,0]=4 2716 B9R1.202 CCC1(CCNC1=O)C MCULE-7294526579 [0,1,0,1,0,0|2,0,0]=4 2717 B9R1.119 C#CC1(CCC1)C(=O)O MCULE-2021077070 [0,1,0,1,0,0|1,0,0]=3 2718 B9R1.119 CC(=O)C1(CCC1)C#N MCULE-9307675365 [0,1,0,1,0,0|1,0,1]=4 2719 B9R1.119 CCC1(CCC1)C(=O)O MCULE-8472500117 [0,1,0,1,0,0|1,0,0]=3 2720 B9R1.119 CCC1(CCO1)C(=O)O MCULE-9145728118 [0,1,0,1,0,0|1,0,0]=3 2721 B9R1.119 CCC1(CNC1)C(=O)O MCULE-8053068489 [0,1,0,1,0,0|0,0,0]=2 2722 B9R1.119 CCC1(COC1)C(=O)C MCULE-8523538443 [0,1,0,1,0,0|2,0,0]=4 2723 B9R1.119 CCC1(COC1)C(=O)O MCULE-3962066812 [0,1,0,1,0,0|1,0,0]=3 2724 B9R1.119 CC[C@]1(CCO1)C(=O)O MCULE-5752888055 [0,1,0,1,0,0|1,0,0]=3 2725 B9R1.119 CNC1(CCC1)C(=O)N MCULE-9618501617 [0,1,0,1,0,0|1,0,0]=3 2726 B9R1.119 CNC1(CCC1)C(=O)O MCULE-3757495053 [0,1,0,1,0,0|0,0,0]=2 2727 B9R1.119 CNC1(CCC1)C(=O)O MCULE-4024637716 [0,1,0,1,0,0|0,0,0]=2 2728 B9R1.119 CNC1(CNC1)C(=O)N MCULE-8113222638 [0,1,0,1,0,0|2,0,0]=4 2729 B9R1.119 CNC1(CNC1)C(=O)N MCULE-9287185171 [0,1,0,1,0,0|2,0,0]=4 2730 B9R1.119 CNC1(CNC1)C(=O)O MCULE-2429867360 [0,1,0,1,0,0|1,0,0]=3 2731 B9R1.119 CNC1(CNC1)C(=O)O MCULE-6668272665 [0,1,0,1,0,0|1,0,0]=3 2732 B9R1.119 CNC1(COC1)C(=O)O MCULE-5428851378 [0,1,0,1,0,0|1,0,0]=3 2733 B9R1.119 COC1(CCC1)C(=O)C MCULE-7851460728 [0,1,0,1,0,0|2,0,0]=4 2734 B9R1.119 COC1(CCC1)C(=O)Cl MCULE-2970127433 [0,1,0,1,0,0|2,0,0]=4 2735 B9R1.119 COC1(CCC1)C(=O)O MCULE-5969292821 [0,1,0,1,0,0|1,0,0]=3 2736 B9R1.119 COC1(CNC1)C(=O)O MCULE-2037277700 [0,1,0,1,0,0|1,0,0]=3 2737 B9R1.119 COC1(CNC1)C(=O)O MCULE-8524872732 [0,1,0,1,0,0|1,0,0]=3 2738 B9R1.119 CS(=O)C1(CCC1)CN MCULE-1873403604 [0,1,0,1,0,0|2,0,0]=4 2739 B9R1.119 CSC1(CCC1)C(=O)O MCULE-8804902018 [0,1,0,1,0,0|1,0,0]=3 2740 B9R1.119 N#CC1(CCC1)C(=O)O MCULE-3878444605 [0,1,0,1,0,0|0,0,1]=3 2741 B9R1.119 N#CC1(COC1)C(=O)O MCULE-2152442122 [0,1,0,1,0,0|1,0,1]=4 2742 B9R1.119 NC(=O)C1(CCC1)CO MCULE-9946184317 [0,1,0,1,0,0|2,0,0]=4 2743 B9R1.119 NCC1(CCC1)C(=O)N MCULE-9304292524 [0,1,0,1,0,0|1,0,0]=3 2744 B9R1.119 NCC1(CCC1)C(=O)O MCULE-3914754838 [0,1,0,1,0,0|0,0,0]=2 2745 B9R1.119 NCC1(CCC1)C(=O)O MCULE-4280814319 [0,1,0,1,0,0|0,0,0]=2 2746 B9R1.119 O=C(O)C1(CCC1)CBr MCULE-5543146509 [0,1,0,1,0,0|1,0,0]=3 2747 B9R1.119 O=C(O)C1(CCC1)CF MCULE-5485073729 [0,1,0,1,0,0|1,0,0]=3 2748 B9R1.119 O=C(O)C1(CCC1)CO MCULE-3232370055 [0,1,0,1,0,0|1,0,0]=3 2749 B9R1.119 O=C(O)C1(CNC1)CF MCULE-5137140836 [0,1,0,1,0,0|1,0,0]=3 2750 B9R1.119 O=C(O)C1(CNC1)CF MCULE-7308600698 [0,1,0,1,0,0|1,0,0]=3 2751 B9R1.119 O=C(O)C1(COC1)CBr MCULE-4458668966 [0,1,0,1,0,0|2,0,0]=4 2752 B9R1.119 O=C(O)C1(COC1)CF MCULE-2717237905 [0,1,0,1,0,0|2,0,0]=4 2753 B9R1.119 O=C(O)C1(COC1)CO MCULE-8517233263 [0,1,0,1,0,0|2,0,0]=4 2754 B9R1.130 CC1CC1(C#N)C(=O)O MCULE-4083324671 [0,1,0,1,0,0|0,0,1]=3 2755 B9R1.130 CC[C@]1(C[C@@H]1F)C(=O)O MCULE-7765739144 [0,1,0,1,0,0|1,0,0]=3 2756 B9R1.130 CC[C@]1(C[C@H]1F)C(=O)O MCULE-6558255104 [0,1,0,1,0,0|1,0,0]=3 2757 B9R1.130 CC[C@]1(C[C@H]1F)C(=O)O MCULE-9949603359 [0,1,0,1,0,0|1,0,0]=3 2758 B9R1.168 CC(=O)C1(CC1)C(=O)O MCULE-4529598350 [0,1,0,1,0,0|1,0,1]=4 2759 B9R1.168 CC(C)C1(CC1)C(=O)O MCULE-5558173332 [0,1,0,1,0,0|1,0,0]=3 2760 B9R1.168 CN(C)C1(CC1)C(=O)O MCULE-3736666169 [0,1,0,1,0,0|2,0,0]=4 2761 B9R1.168 CN(C)C1(CC1)C(=O)O MCULE-5389503299 [0,1,0,1,0,0|2,0,0]=4 2762 B9R1.168 O=C(O)C1(CC1)C(F)F MCULE-2905461016 [0,1,0,1,0,0|2,0,0]=4 2763 B9R1.169 CC1(CC1(Br)Br)C(=O)O MCULE-3847405281 [0,1,0,1,0,0|2,0,0]=4 2764 B9R1.169 CC1(CC1(Cl)Cl)C(=O)O MCULE-4921441641 [0,1,0,1,0,0|2,0,0]=4 2765 B9R1.169 CC1(CC1(F)Cl)C(=O)O MCULE-2748610174 [0,1,0,1,0,0|2,0,0]=4 2766 B9R1.169 CC1(CC1(F)F)C(=O)O MCULE-3474318455 [0,1,0,1,0,0|2,0,0]=4 2767 B9R2.5 O=C1CCCC12CC2 MCULE-5278125581 [0,0,0,2,0,0|2,0,0]=4 2768 B9R2.5 O=C1NCCC12CC2 MCULE-4724464660 [0,0,0,2,0,0|2,0,0]=4 2769 B9R2.5 O=C1OCCC12CC2 MCULE-6263987451 [0,0,0,2,0,0|1,0,0]=3 2770 B9R2.5 O=C1OCCC12CO2 MCULE-2333540011 [0,0,0,2,0,0|1,0,0]=3 2771 B9R2.140 O=C1CCC12CCC2 MCULE-3558542285 [0,0,0,2,0,0|2,0,0]=4 2772 B9R2.140 O=C1COC12CCC2 MCULE-7119377731 [0,0,0,2,0,0|2,0,0]=4 2773 B9R2.140 O=C1NCC12CCC2 MCULE-9964635912 [0,0,0,2,0,0|2,0,0]=4 2774 B9R2.145 CC(=O)C12CC(C1)C2 MCULE-4306075078 [0,0,0,2,0,0|2,0,0]=4 2775 B9R2.145 NC(=O)C12CC(C1)C2 MCULE-6296637670 [0,0,0,2,0,0|2,0,0]=4 2776 B9R2.145 O=C(O)C12CC(C1)C2 MCULE-3144378973 [0,0,0,2,0,0|1,0,0]=3 2777 B7R0.2 C#CC(C)CC(=O)O MCULE-8780802803 [1,0,0,0,0,1|0,0,2]=4 2778 B7R0.2 C(O)(CN)CC(=O)O MCULE-8378388788 [1,0,0,0,0,1|2,0,0]=4 2779 B7R0.2 C=C(C)CC(C)CC MCULE-1001667584 [1,0,0,0,0,1|2,0,0]=4 2780 B7R0.2 C=CC(C)CC(=O)O MCULE-4817084034 [1,0,0,0,0,1|0,0,2]=4 2781 B7R0.2 C=CC(N)CC(=O)O MCULE-1733618438 [1,0,0,0,0,1|0,0,2]=4 2782 B7R0.2 C=CC(N)CC(=O)O MCULE-9636299966 [1,0,0,0,0,1|0,0,2]=4 2783 B7R0.2 CC(=O)NC(C)CN MCULE-4226474809 [1,0,0,0,0,1|2,0,0]=4 2784 B7R0.2 CC(=O)NC(C)CN MCULE-7570690280 [1,0,0,0,0,1|2,0,0]=4 2785 B7R0.2 CC(=O)NC(C)CO MCULE-9455210462 [1,0,0,0,0,1|2,0,0]=4 2786 B7R0.2 CC(=O)N[C@H](C)CO MCULE-2174899443 [1,0,0,0,0,1|2,0,0]=4 2787 B7R0.2 CC(=O)N[C@H](C)CO MCULE-5097293473 [1,0,0,0,0,1|2,0,0]=4 2788 B7R0.2 CC(CC(=O)O)NN MCULE-2614719429 [1,0,0,0,0,1|2,0,0]=4 2789 B7R0.2 CC(CC(=O)O)NN MCULE-2739806820 [1,0,0,0,0,1|2,0,0]=4 2790 B7R0.2 CC(CCl)CC(=O)Cl MCULE-3163826919 [1,0,0,0,0,1|2,0,0]=4 2791 B7R0.2 CC(CCl)OC(=O)N MCULE-7734729292 [1,0,0,0,0,1|2,0,0]=4 2792 B7R0.2 CC(CN)CC(=O)O MCULE-1594242184 [1,0,0,0,0,1|1,0,0]=3 2793 B7R0.2 CC(CN)CC(=O)O MCULE-8074816359 [1,0,0,0,0,1|1,0,0]=3 2794 B7R0.2 CCC(=CC(=O)O)C MCULE-3864767099 [1,0,0,0,0,1|0,0,1]=3 2795 B7R0.2 CCC(=O)CC(=O)O MCULE-1083768149 [1,0,0,0,0,1|1,0,1]=4 2796 B7R0.2 CCC(C)CB(O)O MCULE-4978906892 [1,0,0,0,0,1|1,0,1]=4 2797 B7R0.2 CCC(C)CC(=N)N MCULE-6434778899 [1,0,0,0,0,1|2,0,0]=4 2798 B7R0.2 CCC(C)CC(=N)N MCULE-7964734356 [1,0,0,0,0,1|2,0,0]=4 2799 B7R0.2 CCC(C)CC(=O)C MCULE-5801548800 [1,0,0,0,0,1|1,0,0]=3 2800 B7R0.2 CCC(C)CC(=O)Cl MCULE-3063561496 [1,0,0,0,0,1|1,0,0]=3 2801 B7R0.2 CCC(C)CC(=O)O MCULE-3409782202 [1,0,0,0,0,1|0,0,0]=2 2802 B7R0.2 CCC(C)CC(=O)O MCULE-6537278030 [1,0,0,0,0,1|0,0,0]=2 2803 B7R0.2 CCC(C)NC(=O)N MCULE-6186330882 [1,0,0,0,0,1|1,0,0]=3 2804 B7R0.2 CCC(C)NC(=S)N MCULE-8856391382 [1,0,0,0,0,1|1,1,0]=4 2805 B7R0.2 CCC(C)OC(=O)C MCULE-8410375215 [1,0,0,0,0,1|1,0,0]=3 2806 B7R0.2 CCC(C)OC(=O)Cl MCULE-1512790698 [1,0,0,0,0,1|1,0,0]=3 2807 B7R0.2 CCC(C)SC(=O)Cl MCULE-4681925921 [1,0,0,0,0,1|1,0,0]=3 2808 B7R0.2 CCC(N)CC(=O)O MCULE-1744910444 [1,0,0,0,0,1|0,0,0]=2 2809 B7R0.2 CCC(N)CC(=O)O MCULE-5610499925 [1,0,0,0,0,1|0,0,0]=2 2810 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [1,0,0,0,0,1|1,0,1]=4 2811 B7R0.2 CCC(O)CC(=O)C MCULE-1222748729 [1,0,0,0,0,1|2,0,0]=4 2812 B7R0.2 CCC(O)CC(=O)O MCULE-4663578527 [1,0,0,0,0,1|1,0,0]=3 2813 B7R0.2 CCN(C)CC(=O)C MCULE-5302720081 [1,0,0,0,0,1|2,0,0]=4 2814 B7R0.2 CCN(C)CC(=O)C MCULE-7283054437 [1,0,0,0,0,1|2,0,0]=4 2815 B7R0.2 CCN(C)CC(=O)O MCULE-3102395413 [1,0,0,0,0,1|1,0,0]=3 2816 B7R0.2 CCS(=O)CC(=O)O MCULE-5648298475 [1,0,0,0,0,1|2,0,0]=4 2817 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-5550070887 [1,0,0,0,0,1|0,0,0]=2 2818 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-9572363620 [1,0,0,0,0,1|0,0,0]=2 2819 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-1158271004 [1,0,0,0,0,1|0,0,0]=2 2820 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-2354820947 [1,0,0,0,0,1|0,0,0]=2 2821 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-4284161835 [1,0,0,0,0,1|0,0,0]=2 2822 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-9523089766 [1,0,0,0,0,1|0,0,0]=2 2823 B7R0.2 CC[C@H](C)CC(=O)O MCULE-4177365854 [1,0,0,0,0,1|0,0,0]=2 2824 B7R0.2 CC[C@H](C)CC(=O)O MCULE-5173108207 [1,0,0,0,0,1|0,0,0]=2 2825 B7R0.2 CC[C@H](N)CC(=O)O MCULE-1463536674 [1,0,0,0,0,1|0,0,0]=2 2826 B7R0.2 CC[C@H](N)CC(=O)O MCULE-2865599647 [1,0,0,0,0,1|0,0,0]=2 2827 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4506847599 [1,0,0,0,0,1|0,0,0]=2 2828 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4819674539 [1,0,0,0,0,1|0,0,0]=2 2829 B7R0.2 CNC(C)CC(=O)N MCULE-1474658720 [1,0,0,0,0,1|2,0,0]=4 2830 B7R0.2 CNC(C)CC(=O)N MCULE-4481385519 [1,0,0,0,0,1|2,0,0]=4 2831 B7R0.2 CNC(C)CC(=O)O MCULE-6592893730 [1,0,0,0,0,1|1,0,0]=3 2832 B7R0.2 CNC(C)CC(=O)O MCULE-7655437452 [1,0,0,0,0,1|1,0,0]=3 2833 B7R0.2 CO/C(=C/C(=O)O)/C MCULE-5031076713 [1,0,0,0,0,1|1,0,1]=4 2834 B7R0.2 COC(=CC(=O)O)C MCULE-2215306459 [1,0,0,0,0,1|1,0,1]=4 2835 B7R0.2 COC(C)CC(=O)O MCULE-7063015720 [1,0,0,0,0,1|1,0,0]=3 2836 B7R0.2 CSC(C)CC(=O)O MCULE-7827833531 [1,0,0,0,0,1|1,0,0]=3 2837 B7R0.2 C[C@H](CN)CC(=O)O MCULE-4808630217 [1,0,0,0,0,1|1,0,0]=3 2838 B7R0.2 C[C@H](CN)CC(=O)O MCULE-5474405940 [1,0,0,0,0,1|1,0,0]=3 2839 B7R0.2 NC(CO)CC(=O)O MCULE-4749383822 [1,0,0,0,0,1|1,0,0]=3 2840 B7R0.2 NC(CO)CC(=O)O MCULE-7973334774 [1,0,0,0,0,1|1,0,0]=3 2841 B7R0.2 NC(CO)CC(=O)O MCULE-8406665261 [1,0,0,0,0,1|1,0,0]=3 2842 B7R0.2 NCC(N)CC(=O)O MCULE-5523883615 [1,0,0,0,0,1|1,0,0]=3 2843 B7R0.2 NCC(N)CC(=O)O MCULE-7594259237 [1,0,0,0,0,1|1,0,0]=3 2844 B7R0.2 NCC(O)CC(=O)O MCULE-9221352157 [1,0,0,0,0,1|2,0,0]=4 2845 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-6348974465 [1,0,0,0,0,1|1,0,0]=3 2846 B7R0.2 NC[C@@H](N)CC(=O)O MCULE-9397628218 [1,0,0,0,0,1|1,0,0]=3 2847 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-2174350055 [1,0,0,0,0,1|2,0,0]=4 2848 B7R0.2 NC[C@@H](O)CC(=O)O MCULE-8177708130 [1,0,0,0,0,1|2,0,0]=4 2849 B7R0.2 NC[C@H](N)CC(=O)O MCULE-6133569516 [1,0,0,0,0,1|1,0,0]=3 2850 B7R0.2 NC[C@H](N)CC(=O)O MCULE-7098533469 [1,0,0,0,0,1|1,0,0]=3 2851 B7R0.2 NC[C@H](O)CC(=O)O MCULE-6634973995 [1,0,0,0,0,1|2,0,0]=4 2852 B7R0.2 NC[C@H](O)CC(=O)O MCULE-8055679819 [1,0,0,0,0,1|2,0,0]=4 2853 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-1773927420 [1,0,0,0,0,1|1,0,0]=3 2854 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-2797951743 [1,0,0,0,0,1|1,0,0]=3 2855 B7R0.2 N[C@@H](CO)CC(=O)O MCULE-3839766977 [1,0,0,0,0,1|1,0,0]=3 2856 B7R0.2 N[C@H](CO)CC(=O)O MCULE-4130106630 [1,0,0,0,0,1|1,0,0]=3 2857 B7R0.2 O=C(O)CC(O)CO MCULE-2851149196 [1,0,0,0,0,1|2,0,0]=4 2858 B7R0.2 O=C(O)C[C@H](O)CO MCULE-5671818548 [1,0,0,0,0,1|2,0,0]=4 2859 B7R0.9 CC(=O)CC(C)(C)C MCULE-5477546626 [1,0,0,0,0,1|2,0,0]=4 2860 B7R0.9 CC(=O)CC(C)(C)Cl MCULE-5981575591 [1,0,0,0,0,1|2,0,0]=4 2861 B7R0.9 CC(=O)CC(C)(C)N MCULE-1511988439 [1,0,0,0,0,1|1,0,0]=3 2862 B7R0.9 CC(=O)CC(C)(C)N MCULE-7807079460 [1,0,0,0,0,1|1,0,0]=3 2863 B7R0.9 CC(=O)CC(C)(C)N MCULE-8677016157 [1,0,0,0,0,1|1,0,0]=3 2864 B7R0.9 CC(=O)CC(C)(C)O MCULE-2623560163 [1,0,0,0,0,1|2,0,0]=4 2865 B7R0.9 CC(=O)CC(C)(C)S MCULE-8901285593 [1,0,0,0,0,1|2,0,0]=4 2866 B7R0.9 CC(=O)NC(C)(C)C MCULE-7590749185 [1,0,0,0,0,1|2,0,0]=4 2867 B7R0.9 CC(=O)OC(C)(C)C MCULE-4713236745 [1,0,0,0,0,1|2,0,0]=4 2868 B7R0.9 CC(=O)SC(C)(C)C MCULE-7111846167 [1,0,0,0,0,1|2,0,0]=4 2869 B7R0.9 CC(C)(Br)CC(=O)O MCULE-2452885576 [1,0,0,0,0,1|1,0,0]=3 2870 B7R0.9 CC(C)(C)CC(=O)Cl MCULE-6018997465 [1,0,0,0,0,1|2,0,0]=4 2871 B7R0.9 CC(C)(C)CC(=O)N MCULE-5884141657 [1,0,0,0,0,1|2,0,0]=4 2872 B7R0.9 CC(C)(C)CC(=O)O MCULE-8746589287 [1,0,0,0,0,1|1,0,0]=3 2873 B7R0.9 CC(C)(C)NC(=O)N MCULE-7867571542 [1,0,0,0,0,1|2,0,0]=4 2874 B7R0.9 CC(C)(C)OC(=O)N MCULE-8089044173 [1,0,0,0,0,1|2,0,0]=4 2875 B7R0.9 CC(C)(C)SC(=O)Cl MCULE-5079482641 [1,0,0,0,0,1|2,0,0]=4 2876 B7R0.9 CC(C)(N)CC(=O)N MCULE-8203649114 [1,0,0,0,0,1|1,0,0]=3 2877 B7R0.9 CC(C)(N)CC(=O)N MCULE-9031143786 [1,0,0,0,0,1|1,0,0]=3 2878 B7R0.9 CC(C)(N)CC(=O)O MCULE-1798345695 [1,0,0,0,0,1|0,0,0]=2 2879 B7R0.9 CC(C)(N)CC(=O)O MCULE-4385513857 [1,0,0,0,0,1|0,0,0]=2 2880 B7R0.9 CC(C)(N)CC(=O)O MCULE-7160776320 [1,0,0,0,0,1|0,0,0]=2 2881 B7R0.9 CC(C)(O)CC(=O)O MCULE-3649642958 [1,0,0,0,0,1|1,0,0]=3 2882 B7R0.9 CC(C)(S)CC(=O)O MCULE-6501202267 [1,0,0,0,0,1|1,0,0]=3 2883 B7R0.9 CC(F)(F)CC(=O)O MCULE-2075069695 [1,0,0,0,0,1|2,0,0]=4 2884 B7R0.9 CC(O)CC(C)(C)N MCULE-2860111904 [1,0,0,0,0,1|1,0,1]=4 2885 B7R0.9 C[As+](C)(C)CC(=O)O MCULE-7167642312 [1,0,0,0,0,1|2,0,0]=4 2886 B7R0.9 C[N+](C)(C)CC(=O)O MCULE-5937838609 [1,0,0,0,0,1|2,0,0]=4 2887 B7R0.9 C[Si](C)(C)CC(=O)O MCULE-3888042601 [1,0,0,0,0,1|1,1,0]=4 2888 B9R0.64 CCC(C)(C)OCC(=O)O MCULE-6870018986 [0,0,0,0,0,2|1,0,0]=3