0 B7R0.10 BrCC(Br)C(Br)CBr MCULE-4342639702 [0,0,0,0,0,0|4,0,0]=4 1 B7R0.10 BrC[C@H](Br)[C@H](Br)CBr MCULE-9743935577 [0,0,0,0,0,0|4,0,0]=4 2 B7R0.10 C#CC(N)C(C)CC MCULE-4599913336 [0,0,0,0,0,0|2,0,2]=4 3 B7R0.10 C#CC(N)C(C)CC MCULE-6841022785 [0,0,0,0,0,0|2,0,2]=4 4 B7R0.10 C=CC(C)C(C)CC MCULE-2366850706 [0,0,0,0,0,0|2,0,1]=3 5 B7R0.10 CC(CCl)C(C)CCl MCULE-1834137730 [0,0,0,0,0,0|3,0,0]=3 6 B7R0.10 CC(CN)C(N)CO MCULE-1520376315 [0,0,0,0,0,0|3,0,0]=3 7 B7R0.10 CC(CN)[C@H](N)CO MCULE-9250442888 [0,0,0,0,0,0|3,0,0]=3 8 B7R0.10 CCC(=O)C(=NO)C MCULE-5669219787 [0,0,0,0,0,0|1,1,2]=4 9 B7R0.10 CCC(=O)C(C)C#N MCULE-5937845036 [0,0,0,0,0,0|1,1,2]=4 10 B7R0.10 CCC(=O)C(O)CC MCULE-7549931190 [0,0,0,0,0,0|2,1,1]=4 11 B7R0.10 CCC(=O)N(C)CC MCULE-1764457516 [0,0,0,0,0,0|2,1,1]=4 12 B7R0.10 CCC(C)/C(=N/O)/N MCULE-3220820796 [0,0,0,0,0,0|3,0,1]=4 13 B7R0.10 CCC(C)/C(=N/O)/N MCULE-6860766298 [0,0,0,0,0,0|3,0,1]=4 14 B7R0.10 CCC(C)C(=O)CBr MCULE-7022126762 [0,0,0,0,0,0|2,1,1]=4 15 B7R0.10 CCC(C)C(=O)CCl MCULE-6800466655 [0,0,0,0,0,0|2,1,1]=4 16 B7R0.10 CCC(C)C(=O)NC MCULE-5599095900 [0,0,0,0,0,0|2,1,1]=4 17 B7R0.10 CCC(C)C(=O)OC MCULE-9845747952 [0,0,0,0,0,0|2,1,1]=4 18 B7R0.10 CCC(C)C(C)CC MCULE-8164178184 [0,0,0,0,0,0|2,0,0]=2 19 B7R0.10 CCC(C)C(N)C#N MCULE-4516295423 [0,0,0,0,0,0|3,0,1]=4 20 B7R0.10 CCC(C)C(N)C#N MCULE-9668149479 [0,0,0,0,0,0|3,0,1]=4 21 B7R0.10 CCC(C)C(N)CO MCULE-3990781918 [0,0,0,0,0,0|2,0,0]=2 22 B7R0.10 CCC(C)C(N)CO MCULE-9261445768 [0,0,0,0,0,0|2,0,0]=2 23 B7R0.10 CCC(C)C(O)CC MCULE-3936368693 [0,0,0,0,0,0|1,1,0]=2 24 B7R0.10 CCC(C)C(O)CN MCULE-1941564207 [0,0,0,0,0,0|2,1,0]=3 25 B7R0.10 CCC(C)C(O)CO MCULE-9999862073 [0,0,0,0,0,0|2,0,0]=2 26 B7R0.10 CCC(C)[C@H](N)C#N MCULE-7403677699 [0,0,0,0,0,0|3,0,1]=4 27 B7R0.10 CCC(C)[C@H](N)C#N MCULE-7724941860 [0,0,0,0,0,0|3,0,1]=4 28 B7R0.10 CCC(C)[C@H](N)C#N MCULE-8975526389 [0,0,0,0,0,0|3,0,1]=4 29 B7R0.10 CCC(C)[C@H](N)C#N MCULE-9352431409 [0,0,0,0,0,0|3,0,1]=4 30 B7R0.10 CCC(N)C(=O)NO MCULE-9162328479 [0,0,0,0,0,0|3,0,1]=4 31 B7R0.10 CCC(N)C(O)CC MCULE-3578258801 [0,0,0,0,0,0|2,1,0]=3 32 B7R0.10 CCC(O)C(C)CO MCULE-3930931405 [0,0,0,0,0,0|0,1,0]=1 33 B7R0.10 CCC(O)C(C)CO MCULE-4472852672 [0,0,0,0,0,0|0,1,0]=1 34 B7R0.10 CCC(S)C(C)CO MCULE-1500370684 [0,0,0,0,0,0|0,0,0]=0 35 B7R0.10 CCN(C)C(C)CO MCULE-3647031998 [0,0,0,0,0,0|2,0,0]=2 36 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-2122638055 [0,0,0,0,0,0|2,0,0]=2 37 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-7964651759 [0,0,0,0,0,0|2,0,0]=2 38 B7R0.10 CC[C@@H](C)[C@@H](N)CO MCULE-8482653298 [0,0,0,0,0,0|2,0,0]=2 39 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-3409941550 [0,0,0,0,0,0|3,0,0]=3 40 B7R0.10 CC[C@H](C)[C@H](N)CF MCULE-9750756690 [0,0,0,0,0,0|3,0,0]=3 41 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-3647332227 [0,0,0,0,0,0|2,0,0]=2 42 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-5774547825 [0,0,0,0,0,0|2,0,0]=2 43 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8401203397 [0,0,0,0,0,0|2,0,0]=2 44 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-8452836661 [0,0,0,0,0,0|2,0,0]=2 45 B7R0.10 CC[C@H](C)[C@H](N)CO MCULE-9307589673 [0,0,0,0,0,0|2,0,0]=2 46 B7R0.10 CNC(=O)C(C)CN MCULE-6853199259 [0,0,0,0,0,0|2,1,1]=4 47 B7R0.10 CNC(=O)C(C)CN MCULE-9315732080 [0,0,0,0,0,0|2,1,1]=4 48 B7R0.10 CNC(=O)C(N)CO MCULE-1507161216 [0,0,0,0,0,0|2,1,1]=4 49 B7R0.10 COC(=O)C(Br)CO MCULE-1678765423 [0,0,0,0,0,0|2,1,1]=4 50 B7R0.10 COC(=O)C(Br)CO MCULE-8437488397 [0,0,0,0,0,0|2,1,1]=4 51 B7R0.10 COC(=O)C(C)CBr MCULE-5887558960 [0,0,0,0,0,0|2,1,1]=4 52 B7R0.10 COC(=O)C(C)CBr MCULE-9291707503 [0,0,0,0,0,0|2,1,1]=4 53 B7R0.10 COC(=O)C(C)CN MCULE-8139628698 [0,0,0,0,0,0|2,1,1]=4 54 B7R0.10 COC(=O)C(C)CN MCULE-8839292519 [0,0,0,0,0,0|2,1,1]=4 55 B7R0.10 COC(=O)C(C)CO MCULE-1168600238 [0,0,0,0,0,0|1,1,1]=3 56 B7R0.10 COC(=O)C(C)CO MCULE-9207150786 [0,0,0,0,0,0|1,1,1]=3 57 B7R0.10 COC(=O)C(C)CS MCULE-2870797526 [0,0,0,0,0,0|1,2,1]=4 58 B7R0.10 COC(=O)C(Cl)CO MCULE-9496750776 [0,0,0,0,0,0|2,1,1]=4 59 B7R0.10 COC(=O)C(F)CO MCULE-2188518229 [0,0,0,0,0,0|2,1,1]=4 60 B7R0.10 COC(=O)C(N)CO MCULE-1874204534 [0,0,0,0,0,0|2,1,1]=4 61 B7R0.10 COC(=O)C(N)CO MCULE-1907797317 [0,0,0,0,0,0|2,1,1]=4 62 B7R0.10 COC(=O)C(N)CO MCULE-3851022091 [0,0,0,0,0,0|2,1,1]=4 63 B7R0.10 COC(=O)C(N)CO MCULE-9875856930 [0,0,0,0,0,0|2,1,1]=4 64 B7R0.10 COC(=O)C(O)CO MCULE-1234820163 [0,0,0,0,0,0|2,1,1]=4 65 B7R0.10 COC(=O)C(O)CO MCULE-2142801284 [0,0,0,0,0,0|2,1,1]=4 66 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8075978888 [0,0,0,0,0,0|2,1,1]=4 67 B7R0.10 COC(=O)[C@@H](Br)CO MCULE-8903256620 [0,0,0,0,0,0|2,1,1]=4 68 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-5530851181 [0,0,0,0,0,0|2,1,1]=4 69 B7R0.10 COC(=O)[C@@H](C)CBr MCULE-8885621324 [0,0,0,0,0,0|2,1,1]=4 70 B7R0.10 COC(=O)[C@@H](C)CN MCULE-7205157481 [0,0,0,0,0,0|2,1,1]=4 71 B7R0.10 COC(=O)[C@@H](C)CN MCULE-9885299909 [0,0,0,0,0,0|2,1,1]=4 72 B7R0.10 COC(=O)[C@@H](C)CO MCULE-6738074317 [0,0,0,0,0,0|1,1,1]=3 73 B7R0.10 COC(=O)[C@@H](C)CO MCULE-9697255968 [0,0,0,0,0,0|1,1,1]=3 74 B7R0.10 COC(=O)[C@@H](N)CO MCULE-2171593224 [0,0,0,0,0,0|2,1,1]=4 75 B7R0.10 COC(=O)[C@@H](N)CO MCULE-3393088985 [0,0,0,0,0,0|2,1,1]=4 76 B7R0.10 COC(=O)[C@@H](N)CO MCULE-5476910845 [0,0,0,0,0,0|2,1,1]=4 77 B7R0.10 COC(=O)[C@@H](N)CO MCULE-9984439264 [0,0,0,0,0,0|2,1,1]=4 78 B7R0.10 COC(=O)[C@@H](O)CO MCULE-3655137528 [0,0,0,0,0,0|2,1,1]=4 79 B7R0.10 COC(=O)[C@@H](O)CO MCULE-5801355812 [0,0,0,0,0,0|2,1,1]=4 80 B7R0.10 COC(=O)[C@H](Br)CO MCULE-8230787734 [0,0,0,0,0,0|2,1,1]=4 81 B7R0.10 COC(=O)[C@H](C)CBr MCULE-3829202918 [0,0,0,0,0,0|2,1,1]=4 82 B7R0.10 COC(=O)[C@H](C)CBr MCULE-4931737781 [0,0,0,0,0,0|2,1,1]=4 83 B7R0.10 COC(=O)[C@H](C)CN MCULE-4694019206 [0,0,0,0,0,0|2,1,1]=4 84 B7R0.10 COC(=O)[C@H](C)CN MCULE-9113866081 [0,0,0,0,0,0|2,1,1]=4 85 B7R0.10 COC(=O)[C@H](C)CO MCULE-5719676432 [0,0,0,0,0,0|1,1,1]=3 86 B7R0.10 COC(=O)[C@H](C)CO MCULE-8479546806 [0,0,0,0,0,0|1,1,1]=3 87 B7R0.10 COC(=O)[C@H](N)CO MCULE-4463451892 [0,0,0,0,0,0|2,1,1]=4 88 B7R0.10 COC(=O)[C@H](N)CO MCULE-5622938569 [0,0,0,0,0,0|2,1,1]=4 89 B7R0.10 COC(=O)[C@H](N)CO MCULE-6021580541 [0,0,0,0,0,0|2,1,1]=4 90 B7R0.10 COC(=O)[C@H](N)CO MCULE-8237708167 [0,0,0,0,0,0|2,1,1]=4 91 B7R0.10 COC(=O)[C@H](O)CO MCULE-4219956218 [0,0,0,0,0,0|2,1,1]=4 92 B7R0.10 COC(=O)[C@H](O)CO MCULE-8891571940 [0,0,0,0,0,0|2,1,1]=4 93 B7R0.10 ClCC(Cl)C(Cl)CCl MCULE-9682638312 [0,0,0,0,0,0|4,0,0]=4 94 B7R0.10 ClC[C@H](Cl)[C@H](Cl)CCl MCULE-1943421741 [0,0,0,0,0,0|4,0,0]=4 95 B7R0.10 NC[C@@H](F)[C@H](F)CF MCULE-8718491620 [0,0,0,0,0,0|4,0,0]=4 96 B7R0.10 NC[C@H](F)[C@H](F)CF MCULE-9246801464 [0,0,0,0,0,0|4,0,0]=4 97 B7R0.10 NC[C@H](O)[C@H](O)CN MCULE-1073397630 [0,0,0,0,0,0|3,1,0]=4 98 B7R0.10 NC[C@H](O)[C@H](O)CN MCULE-8068595970 [0,0,0,0,0,0|3,1,0]=4 99 B7R0.10 N[C@@H](CO)[C@@H](N)CO MCULE-2394488011 [0,0,0,0,0,0|3,0,0]=3 100 B7R0.10 O=C(CO)C(O)CO MCULE-9818197491 [0,0,0,0,0,0|2,1,1]=4 101 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8306776225 [0,0,0,0,0,0|2,1,1]=4 102 B7R0.10 O=C(CO)[C@@H](O)CO MCULE-8666498937 [0,0,0,0,0,0|2,1,1]=4 103 B7R0.10 O=C(CO)[C@H](O)CO MCULE-7828531161 [0,0,0,0,0,0|2,1,1]=4 104 B7R0.10 O=CC(O)C(O)CO MCULE-9564469242 [0,0,0,0,0,0|2,1,1]=4 105 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-3532911413 [0,0,0,0,0,0|2,1,1]=4 106 B7R0.10 O=C[C@@H](O)[C@@H](O)CO MCULE-5707669784 [0,0,0,0,0,0|2,1,1]=4 107 B7R0.10 O=C[C@@H](O)[C@H](O)CO MCULE-4902023669 [0,0,0,0,0,0|2,1,1]=4 108 B7R0.10 O=C[C@H](O)[C@@H](O)CO MCULE-5975565699 [0,0,0,0,0,0|2,1,1]=4 109 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-3036594515 [0,0,0,0,0,0|2,1,1]=4 110 B7R0.10 O=C[C@H](O)[C@H](O)CO MCULE-5412566780 [0,0,0,0,0,0|2,1,1]=4 111 B7R0.10 OC(CBr)C(O)CBr MCULE-4608370293 [0,0,0,0,0,0|3,1,0]=4 112 B7R0.10 OC(CCl)C(O)CCl MCULE-9282587936 [0,0,0,0,0,0|3,1,0]=4 113 B7R0.10 OC(CS)C(O)CS MCULE-7432075835 [0,0,0,0,0,0|2,2,0]=4 114 B7R0.10 OCC(Br)C(Br)CO MCULE-4593943249 [0,0,0,0,0,0|3,0,0]=3 115 B7R0.10 OCC(O)C(O)CO MCULE-9009953851 [0,0,0,0,0,0|2,1,0]=3 116 B7R0.10 OC[C@@H](Br)[C@H](Br)CO MCULE-7293448690 [0,0,0,0,0,0|3,0,0]=3 117 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-1593828237 [0,0,0,0,0,0|2,1,0]=3 118 B7R0.10 OC[C@@H](O)[C@H](O)CO MCULE-7577661973 [0,0,0,0,0,0|2,1,0]=3 119 B7R0.10 OC[C@@H](O)[C@H](S)CS MCULE-1423721945 [0,0,0,0,0,0|2,0,0]=2 120 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-7306394407 [0,0,0,0,0,0|2,1,0]=3 121 B7R0.10 OC[C@H](O)[C@@H](O)CO MCULE-8013265935 [0,0,0,0,0,0|2,1,0]=3 122 B7R0.10 OC[C@H](O)[C@H](O)CO MCULE-6886999157 [0,0,0,0,0,0|2,1,0]=3 123 B7R0.10 O[C@@H](CS)[C@@H](O)CS MCULE-6947486648 [0,0,0,0,0,0|2,2,0]=4 124 B7R0.10 O[C@@H](CS)[C@@H](O)CS MCULE-8883019394 [0,0,0,0,0,0|2,2,0]=4 125 B7R0.10 O[C@H](CBr)[C@H](O)CBr MCULE-5914686116 [0,0,0,0,0,0|3,1,0]=4 126 B7R0.10 O[C@H](CCl)[C@@H](O)CCl MCULE-8266433235 [0,0,0,0,0,0|3,1,0]=4 127 B7R0.10 O[C@H](CS)[C@@H](O)CS MCULE-3618084743 [0,0,0,0,0,0|2,2,0]=4 128 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-3329450277 [0,0,0,0,0,0|2,2,0]=4 129 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-9065556670 [0,0,0,0,0,0|2,2,0]=4 130 B7R0.10 O[C@H](CS)[C@H](O)CS MCULE-9666091728 [0,0,0,0,0,0|2,2,0]=4 131 B7R0.10 [C@@H](C)(CC)[C@@H](N)CO MCULE-4423825378 [0,0,0,0,0,0|2,0,0]=2 132 B6R0.1 C#CC(N)CCC MCULE-1649795667 [1,0,0,0,0,0|2,0,1]=4 133 B6R0.1 C#CC(N)CCC MCULE-4074347601 [1,0,0,0,0,0|2,0,1]=4 134 B6R0.1 C#CC(O)CCC MCULE-6152066005 [1,0,0,0,0,0|2,0,1]=4 135 B6R0.1 C#CCC(C)CO MCULE-6139260605 [1,0,0,0,0,0|0,0,2]=3 136 B6R0.1 C#CCC(N)CC MCULE-4259544439 [1,0,0,0,0,0|2,0,1]=4 137 B6R0.1 C#CCC(N)CO MCULE-5669035635 [1,0,0,0,0,0|1,0,2]=4 138 B6R0.1 C#CCC(O)CC MCULE-8783941008 [1,0,0,0,0,0|1,1,1]=4 139 B6R0.1 C#CC[C@@H](N)CO MCULE-2638776426 [1,0,0,0,0,0|1,0,2]=4 140 B6R0.1 C#CC[C@@H](N)CO MCULE-7710952185 [1,0,0,0,0,0|1,0,2]=4 141 B6R0.1 C#CC[C@H](N)CO MCULE-8069295628 [1,0,0,0,0,0|1,0,2]=4 142 B6R0.1 C#CC[C@H](N)CO MCULE-9440234580 [1,0,0,0,0,0|1,0,2]=4 143 B6R0.1 C=C(CC)CCO MCULE-5317656776 [1,0,0,0,0,0|1,0,1]=3 144 B6R0.1 C=C=CC(C)CO MCULE-4111632331 [1,0,0,0,0,0|0,0,3]=4 145 B6R0.1 C=CC(C)CCC MCULE-2692803387 [1,0,0,0,0,0|1,0,1]=3 146 B6R0.1 C=CC(C)CCO MCULE-2890369298 [1,0,0,0,0,0|1,0,2]=4 147 B6R0.1 C=CC(N)CCO MCULE-7781906138 [1,0,0,0,0,0|1,0,2]=4 148 B6R0.1 C=CC(O)CCC MCULE-3664453040 [1,0,0,0,0,0|2,0,1]=4 149 B6R0.1 C=CCC(C)CC MCULE-8680856865 [1,0,0,0,0,0|1,0,2]=4 150 B6R0.1 C=CCC(C)CO MCULE-9174943108 [1,0,0,0,0,0|0,0,2]=3 151 B6R0.1 C=CCC(N)CC MCULE-2309097248 [1,0,0,0,0,0|2,0,1]=4 152 B6R0.1 C=CCC(N)CC MCULE-8356954197 [1,0,0,0,0,0|2,0,1]=4 153 B6R0.1 C=CCC(N)CO MCULE-3854217705 [1,0,0,0,0,0|1,0,2]=4 154 B6R0.1 C=CCC(N)CO MCULE-6104194102 [1,0,0,0,0,0|1,0,2]=4 155 B6R0.1 C=CCC(N)CO MCULE-6473126335 [1,0,0,0,0,0|1,0,2]=4 156 B6R0.1 C=CCC(N)CO MCULE-8430673873 [1,0,0,0,0,0|1,0,2]=4 157 B6R0.1 C=CCC(O)CC MCULE-1497539816 [1,0,0,0,0,0|1,1,1]=4 158 B6R0.1 C=CC[C@@H](N)CO MCULE-1869015815 [1,0,0,0,0,0|1,0,2]=4 159 B6R0.1 C=CC[C@@H](N)CO MCULE-2792980070 [1,0,0,0,0,0|1,0,2]=4 160 B6R0.1 C=CC[C@@H](N)CO MCULE-3168704187 [1,0,0,0,0,0|1,0,2]=4 161 B6R0.1 C=CC[C@@H](N)CO MCULE-4796522209 [1,0,0,0,0,0|1,0,2]=4 162 B6R0.1 C=CC[C@@H](O)CC MCULE-3259102701 [1,0,0,0,0,0|1,1,1]=4 163 B6R0.1 C=CC[C@H](N)CO MCULE-2427943513 [1,0,0,0,0,0|1,0,2]=4 164 B6R0.1 C=CC[C@H](N)CO MCULE-4244461120 [1,0,0,0,0,0|1,0,2]=4 165 B6R0.1 C=CC[C@H](N)CO MCULE-6760610212 [1,0,0,0,0,0|1,0,2]=4 166 B6R0.1 C=CC[C@H](N)CO MCULE-7914934929 [1,0,0,0,0,0|1,0,2]=4 167 B6R0.1 C=CC[C@H](O)CC MCULE-6527977219 [1,0,0,0,0,0|1,1,1]=4 168 B6R0.1 CC(CN)CCN MCULE-2719332037 [1,0,0,0,0,0|2,0,0]=3 169 B6R0.1 CC(CN)CCN MCULE-4200375624 [1,0,0,0,0,0|2,0,0]=3 170 B6R0.1 CC(CN)CCO MCULE-5515163518 [1,0,0,0,0,0|2,0,0]=3 171 B6R0.1 CC(CO)CCN MCULE-9900244005 [1,0,0,0,0,0|1,0,0]=2 172 B6R0.1 CC(CO)CCO MCULE-5240961149 [1,0,0,0,0,0|1,0,0]=2 173 B6R0.1 CC(CO)CCO MCULE-8678967805 [1,0,0,0,0,0|1,0,0]=2 174 B6R0.1 CC=C[C@@H](N)CO MCULE-4690559736 [1,0,0,0,0,0|1,0,2]=4 175 B6R0.1 CC=C[C@@H](N)CO MCULE-5852475953 [1,0,0,0,0,0|1,0,2]=4 176 B6R0.1 CC=C[C@H](N)CO MCULE-6168992245 [1,0,0,0,0,0|1,0,2]=4 177 B6R0.1 CC=C[C@H](N)CO MCULE-6971252398 [1,0,0,0,0,0|1,0,2]=4 178 B6R0.1 CCC(=CCO)C MCULE-5264054153 [1,0,0,0,0,0|1,0,2]=4 179 B6R0.1 CCC(Br)COC MCULE-7942540965 [1,0,0,0,0,0|3,0,0]=4 180 B6R0.1 CCC(C)C=NO MCULE-2829500970 [1,0,0,0,0,0|2,0,1]=4 181 B6R0.1 CCC(C)CC#N MCULE-8784266918 [1,0,0,0,0,0|2,0,1]=4 182 B6R0.1 CCC(C)CC=O MCULE-9143756592 [1,0,0,0,0,0|1,0,2]=4 183 B6R0.1 CCC(C)CCBr MCULE-6033010731 [1,0,0,0,0,0|2,0,0]=3 184 B6R0.1 CCC(C)CCCl MCULE-2069721626 [1,0,0,0,0,0|2,0,0]=3 185 B6R0.1 CCC(C)CCN MCULE-4140800594 [1,0,0,0,0,0|2,0,0]=3 186 B6R0.1 CCC(C)CCN MCULE-5509248218 [1,0,0,0,0,0|2,0,0]=3 187 B6R0.1 CCC(C)CCO MCULE-6482427735 [1,0,0,0,0,0|1,0,0]=2 188 B6R0.1 CCC(C)CNC MCULE-1998406301 [1,0,0,0,0,0|2,0,0]=3 189 B6R0.1 CCC(C)CNC MCULE-5957910094 [1,0,0,0,0,0|2,0,0]=3 190 B6R0.1 CCC(C)CON MCULE-7033012303 [1,0,0,0,0,0|3,0,0]=4 191 B6R0.1 CCC(N)CC#N MCULE-9550652690 [1,0,0,0,0,0|2,0,1]=4 192 B6R0.1 CCC(N)CCN MCULE-8956610037 [1,0,0,0,0,0|2,0,0]=3 193 B6R0.1 CCC(N)CCO MCULE-1511155206 [1,0,0,0,0,0|1,0,0]=2 194 B6R0.1 CCC(N)CCO MCULE-5525302643 [1,0,0,0,0,0|1,0,0]=2 195 B6R0.1 CCC(N)COC MCULE-2103613859 [1,0,0,0,0,0|3,0,0]=4 196 B6R0.1 CCC(N)COC MCULE-5835446359 [1,0,0,0,0,0|3,0,0]=4 197 B6R0.1 CCC(N)CSC MCULE-9145513729 [1,0,0,0,0,0|3,0,0]=4 198 B6R0.1 CCC(O)CC#N MCULE-2542710031 [1,0,0,0,0,0|1,1,1]=4 199 B6R0.1 CCC(O)CCN MCULE-5387303971 [1,0,0,0,0,0|1,1,0]=3 200 B6R0.1 CCC(O)CCO MCULE-5156075792 [1,0,0,0,0,0|0,1,0]=2 201 B6R0.1 CCC(O)CNC MCULE-2490431367 [1,0,0,0,0,0|2,1,0]=4 202 B6R0.1 CCC(O)CNN MCULE-1038166714 [1,0,0,0,0,0|2,1,0]=4 203 B6R0.1 CCC(O)CNN MCULE-6391104058 [1,0,0,0,0,0|2,1,0]=4 204 B6R0.1 CCC(O)COC MCULE-6751000060 [1,0,0,0,0,0|2,1,0]=4 205 B6R0.1 CCC(O)CSC MCULE-3582683720 [1,0,0,0,0,0|2,1,0]=4 206 B6R0.1 CCC(S)CCO MCULE-4193788852 [1,0,0,0,0,0|0,0,0]=1 207 B6R0.1 CCC/C(=N/O)/N MCULE-1101103373 [1,0,0,0,0,0|2,0,1]=4 208 B6R0.1 CCC/C(=N/O)/N MCULE-2970638438 [1,0,0,0,0,0|2,0,1]=4 209 B6R0.1 CCCC(=NO)C MCULE-6437787263 [1,0,0,0,0,0|1,0,1]=3 210 B6R0.1 CCCC(=O)CBr MCULE-6276592955 [1,0,0,0,0,0|2,0,1]=4 211 B6R0.1 CCCC(=O)CC MCULE-7121523805 [1,0,0,0,0,0|1,1,1]=4 212 B6R0.1 CCCC(=O)CCl MCULE-3021809695 [1,0,0,0,0,0|2,0,1]=4 213 B6R0.1 CCCC(=O)CN MCULE-4663263123 [1,0,0,0,0,0|2,0,1]=4 214 B6R0.1 CCCC(=O)CN MCULE-6326368932 [1,0,0,0,0,0|2,0,1]=4 215 B6R0.1 CCCC(=O)CO MCULE-6518249412 [1,0,0,0,0,0|1,0,1]=3 216 B6R0.1 CCCC(=O)NO MCULE-8710375368 [1,0,0,0,0,0|2,0,1]=4 217 B6R0.1 CCCC(Br)CC MCULE-9116433502 [1,0,0,0,0,0|2,0,0]=3 218 B6R0.1 CCCC(C)C#N MCULE-2492294131 [1,0,0,0,0,0|1,0,1]=3 219 B6R0.1 CCCC(C)C=O MCULE-9756444218 [1,0,0,0,0,0|0,0,2]=3 220 B6R0.1 CCCC(C)CBr MCULE-3437352091 [1,0,0,0,0,0|1,0,0]=2 221 B6R0.1 CCCC(C)CC MCULE-7082933967 [1,0,0,0,0,0|1,0,0]=2 222 B6R0.1 CCCC(C)CCl MCULE-2381010454 [1,0,0,0,0,0|1,0,0]=2 223 B6R0.1 CCCC(C)CN MCULE-9552289739 [1,0,0,0,0,0|1,0,0]=2 224 B6R0.1 CCCC(C)CO MCULE-9777250826 [1,0,0,0,0,0|0,0,0]=1 225 B6R0.1 CCCC(C)NC MCULE-1560121168 [1,0,0,0,0,0|2,0,0]=3 226 B6R0.1 CCCC(C)NC MCULE-2169396338 [1,0,0,0,0,0|2,0,0]=3 227 B6R0.1 CCCC(Cl)CC MCULE-1581617529 [1,0,0,0,0,0|2,0,0]=3 228 B6R0.1 CCCC(Cl)CCl MCULE-9464139069 [1,0,0,0,0,0|2,0,0]=3 229 B6R0.1 CCCC(N)C#N MCULE-6830545935 [1,0,0,0,0,0|2,0,1]=4 230 B6R0.1 CCCC(N)C#N MCULE-9818121096 [1,0,0,0,0,0|2,0,1]=4 231 B6R0.1 CCCC(N)CC MCULE-5349906741 [1,0,0,0,0,0|2,0,0]=3 232 B6R0.1 CCCC(N)CC MCULE-7172418373 [1,0,0,0,0,0|2,0,0]=3 233 B6R0.1 CCCC(N)CN MCULE-8606218569 [1,0,0,0,0,0|2,0,0]=3 234 B6R0.1 CCCC(N)CO MCULE-3404967504 [1,0,0,0,0,0|1,0,0]=2 235 B6R0.1 CCCC(N)CO MCULE-3802448518 [1,0,0,0,0,0|1,0,0]=2 236 B6R0.1 CCCC(N)CO MCULE-4259078445 [1,0,0,0,0,0|1,0,0]=2 237 B6R0.1 CCCC(N)CO MCULE-6425025734 [1,0,0,0,0,0|1,0,0]=2 238 B6R0.1 CCCC(O)C#N MCULE-7017059503 [1,0,0,0,0,0|2,0,1]=4 239 B6R0.1 CCCC(O)CBr MCULE-5186252424 [1,0,0,0,0,0|2,0,0]=3 240 B6R0.1 CCCC(O)CC MCULE-9504041935 [1,0,0,0,0,0|1,1,0]=3 241 B6R0.1 CCCC(O)CCl MCULE-4737360217 [1,0,0,0,0,0|2,0,0]=3 242 B6R0.1 CCCC(O)CN MCULE-9402934997 [1,0,0,0,0,0|2,0,0]=3 243 B6R0.1 CCCC(O)CO MCULE-5124107719 [1,0,0,0,0,0|1,0,0]=2 244 B6R0.1 CCCC(S)CC MCULE-1322481338 [1,0,0,0,0,0|1,0,0]=2 245 B6R0.1 CCC[C@@H](N)CF MCULE-4702552251 [1,0,0,0,0,0|2,0,0]=3 246 B6R0.1 CCC[C@@H](N)CF MCULE-8118043624 [1,0,0,0,0,0|2,0,0]=3 247 B6R0.1 CCC[C@@H](N)CO MCULE-3684308356 [1,0,0,0,0,0|1,0,0]=2 248 B6R0.1 CCC[C@@H](N)CO MCULE-4573401915 [1,0,0,0,0,0|1,0,0]=2 249 B6R0.1 CCC[C@@H](N)CO MCULE-5502830670 [1,0,0,0,0,0|1,0,0]=2 250 B6R0.1 CCC[C@@H](O)CC MCULE-7377135785 [1,0,0,0,0,0|1,1,0]=3 251 B6R0.1 CCC[C@H](N)CF MCULE-7192744944 [1,0,0,0,0,0|2,0,0]=3 252 B6R0.1 CCC[C@H](N)CF MCULE-7441387613 [1,0,0,0,0,0|2,0,0]=3 253 B6R0.1 CCC[C@H](N)CO MCULE-4293730307 [1,0,0,0,0,0|1,0,0]=2 254 B6R0.1 CCC[C@H](N)CO MCULE-5185063577 [1,0,0,0,0,0|1,0,0]=2 255 B6R0.1 CCC[C@H](N)CO MCULE-5836622975 [1,0,0,0,0,0|1,0,0]=2 256 B6R0.1 CCC[C@H](N)CO MCULE-7340014196 [1,0,0,0,0,0|1,0,0]=2 257 B6R0.1 CCC[C@H](O)CC MCULE-2229025348 [1,0,0,0,0,0|1,1,0]=3 258 B6R0.1 CCN(C)CCCl MCULE-4264927085 [1,0,0,0,0,0|3,0,0]=4 259 B6R0.1 CCN(C)CCCl MCULE-8125659652 [1,0,0,0,0,0|3,0,0]=4 260 B6R0.1 CCN(C)CCN MCULE-9503910262 [1,0,0,0,0,0|3,0,0]=4 261 B6R0.1 CCN(C)CCO MCULE-5519271145 [1,0,0,0,0,0|2,0,0]=3 262 B6R0.1 CCN(C)CCS MCULE-9974758531 [1,0,0,0,0,0|2,1,0]=4 263 B6R0.1 CCN(N)CCO MCULE-7988723724 [1,0,0,0,0,0|2,0,0]=3 264 B6R0.1 CCNC(=O)CO MCULE-1386307800 [1,0,0,0,0,0|2,0,1]=4 265 B6R0.1 CCNC(C)C#N MCULE-2197533334 [1,0,0,0,0,0|2,0,1]=4 266 B6R0.1 CCNC(C)C#N MCULE-2463800188 [1,0,0,0,0,0|2,0,1]=4 267 B6R0.1 CCNC(C)CC MCULE-1017617081 [1,0,0,0,0,0|2,0,0]=3 268 B6R0.1 CCNC(C)CC MCULE-2691229640 [1,0,0,0,0,0|2,0,0]=3 269 B6R0.1 CCNC(C)CO MCULE-4344397973 [1,0,0,0,0,0|1,0,0]=2 270 B6R0.1 CCN[C@@H](C)CO MCULE-5648721449 [1,0,0,0,0,0|1,0,0]=2 271 B6R0.1 CCN[C@H](C)CO MCULE-8047465405 [1,0,0,0,0,0|1,0,0]=2 272 B6R0.1 CCO/C(=N/O)/C MCULE-2336241507 [1,0,0,0,0,0|2,0,1]=4 273 B6R0.1 CCO/C(=N\O)/C MCULE-7101376522 [1,0,0,0,0,0|2,0,1]=4 274 B6R0.1 CCOC(=NO)C MCULE-6964305821 [1,0,0,0,0,0|2,0,1]=4 275 B6R0.1 CCOC(=O)CO MCULE-8121340151 [1,0,0,0,0,0|2,0,1]=4 276 B6R0.1 CCOC(C)CC MCULE-5049998907 [1,0,0,0,0,0|2,0,0]=3 277 B6R0.1 CCOC(C)CN MCULE-2322112215 [1,0,0,0,0,0|2,0,0]=3 278 B6R0.1 CCOC(C)CN MCULE-7307949125 [1,0,0,0,0,0|2,0,0]=3 279 B6R0.1 CCOC(C)CO MCULE-1592146913 [1,0,0,0,0,0|1,0,0]=2 280 B6R0.1 CCOC(Cl)CCl MCULE-2309448343 [1,0,0,0,0,0|3,0,0]=4 281 B6R0.1 CCS(=O)CCCl MCULE-1910591721 [1,0,0,0,0,0|2,1,0]=4 282 B6R0.1 CCS(=O)CCN MCULE-7201812983 [1,0,0,0,0,0|2,1,0]=4 283 B6R0.1 CCS(=O)CCN MCULE-7831905163 [1,0,0,0,0,0|2,1,0]=4 284 B6R0.1 CCS(=O)CCO MCULE-8290368918 [1,0,0,0,0,0|1,1,0]=3 285 B6R0.1 CCSC(C)C#N MCULE-1159924867 [1,0,0,0,0,0|2,0,1]=4 286 B6R0.1 CC[C@@H](N)CC#N MCULE-3694594576 [1,0,0,0,0,0|2,0,1]=4 287 B6R0.1 CC[C@@H](N)CC#N MCULE-9083117229 [1,0,0,0,0,0|2,0,1]=4 288 B6R0.1 CC[C@@H](N)COC MCULE-2231338404 [1,0,0,0,0,0|3,0,0]=4 289 B6R0.1 CC[C@@H](N)COC MCULE-2931188781 [1,0,0,0,0,0|3,0,0]=4 290 B6R0.1 CC[C@@H](N)COC MCULE-5773677141 [1,0,0,0,0,0|3,0,0]=4 291 B6R0.1 CC[C@@H](N)COC MCULE-5939905142 [1,0,0,0,0,0|3,0,0]=4 292 B6R0.1 CC[C@@H](O)CC#N MCULE-5921416613 [1,0,0,0,0,0|1,1,1]=4 293 B6R0.1 CC[C@@H](O)CC#N MCULE-8527710778 [1,0,0,0,0,0|1,1,1]=4 294 B6R0.1 CC[C@H](C)CCO MCULE-1190203828 [1,0,0,0,0,0|1,0,0]=2 295 B6R0.1 CC[C@H](C)CCO MCULE-8460710173 [1,0,0,0,0,0|1,0,0]=2 296 B6R0.1 CC[C@H](N)CC#N MCULE-9692545503 [1,0,0,0,0,0|2,0,1]=4 297 B6R0.1 CC[C@H](N)COC MCULE-1115072226 [1,0,0,0,0,0|3,0,0]=4 298 B6R0.1 CC[C@H](N)COC MCULE-3917835289 [1,0,0,0,0,0|3,0,0]=4 299 B6R0.1 CC[C@H](N)COC MCULE-8706423122 [1,0,0,0,0,0|3,0,0]=4 300 B6R0.1 CC[C@H](N)COC MCULE-9406311547 [1,0,0,0,0,0|3,0,0]=4 301 B6R0.1 CNC(=O)CCO MCULE-3222339741 [1,0,0,0,0,0|1,1,1]=4 302 B6R0.1 CNC(C)CCO MCULE-4722422254 [1,0,0,0,0,0|2,0,0]=3 303 B6R0.1 CNC(C)COC MCULE-6864731576 [1,0,0,0,0,0|3,0,0]=4 304 B6R0.1 CNC(C)COC MCULE-9135013355 [1,0,0,0,0,0|3,0,0]=4 305 B6R0.1 CNC(C)CSC MCULE-8293407208 [1,0,0,0,0,0|3,0,0]=4 306 B6R0.1 CNCC(C)C#N MCULE-1673067512 [1,0,0,0,0,0|2,0,1]=4 307 B6R0.1 CNCC(C)CN MCULE-1889673811 [1,0,0,0,0,0|2,0,0]=3 308 B6R0.1 CNCC(C)CO MCULE-6329429747 [1,0,0,0,0,0|1,0,0]=2 309 B6R0.1 CNCC(C)OC MCULE-6977139114 [1,0,0,0,0,0|3,0,0]=4 310 B6R0.1 CNCC(C)OC MCULE-8216810034 [1,0,0,0,0,0|3,0,0]=4 311 B6R0.1 CNCC(O)CF MCULE-3368370486 [1,0,0,0,0,0|3,0,0]=4 312 B6R0.1 CNCC(O)CN MCULE-1077260629 [1,0,0,0,0,0|3,0,0]=4 313 B6R0.1 CNCC(O)CO MCULE-4566952448 [1,0,0,0,0,0|2,0,0]=3 314 B6R0.1 CNC[C@H](O)CO MCULE-3410453252 [1,0,0,0,0,0|2,0,0]=3 315 B6R0.1 COC(=N)CCO MCULE-1904978557 [1,0,0,0,0,0|2,0,1]=4 316 B6R0.1 COC(=N)CCO MCULE-8146089973 [1,0,0,0,0,0|2,0,1]=4 317 B6R0.1 COC(=O)CCO MCULE-8538834260 [1,0,0,0,0,0|1,1,1]=4 318 B6R0.1 COC(C)CCN MCULE-8081876282 [1,0,0,0,0,0|3,0,0]=4 319 B6R0.1 COC(C)CCN MCULE-8892057529 [1,0,0,0,0,0|3,0,0]=4 320 B6R0.1 COC(C)CCO MCULE-7396381165 [1,0,0,0,0,0|2,0,0]=3 321 B6R0.1 COCC(C)C#N MCULE-2978497753 [1,0,0,0,0,0|2,0,1]=4 322 B6R0.1 COCC(C)C=O MCULE-7679332713 [1,0,0,0,0,0|1,0,2]=4 323 B6R0.1 COCC(C)CN MCULE-3223901774 [1,0,0,0,0,0|2,0,0]=3 324 B6R0.1 COCC(C)CO MCULE-7663064542 [1,0,0,0,0,0|1,0,0]=2 325 B6R0.1 COCC(C)OC MCULE-1583498700 [1,0,0,0,0,0|3,0,0]=4 326 B6R0.1 COCC(F)CN MCULE-2821685967 [1,0,0,0,0,0|3,0,0]=4 327 B6R0.1 COCC(F)CN MCULE-9691951401 [1,0,0,0,0,0|3,0,0]=4 328 B6R0.1 COCC(N)CN MCULE-1244199319 [1,0,0,0,0,0|3,0,0]=4 329 B6R0.1 COCC(N)CO MCULE-2141613120 [1,0,0,0,0,0|2,0,0]=3 330 B6R0.1 COCC(N)CO MCULE-3194232042 [1,0,0,0,0,0|2,0,0]=3 331 B6R0.1 COCC(N)CO MCULE-6545937769 [1,0,0,0,0,0|2,0,0]=3 332 B6R0.1 COCC(N)CO MCULE-7989665777 [1,0,0,0,0,0|2,0,0]=3 333 B6R0.1 COCC(O)CBr MCULE-6900294714 [1,0,0,0,0,0|3,0,0]=4 334 B6R0.1 COCC(O)CCl MCULE-9314630227 [1,0,0,0,0,0|3,0,0]=4 335 B6R0.1 COCC(O)CF MCULE-1938415887 [1,0,0,0,0,0|3,0,0]=4 336 B6R0.1 COCC(O)CN MCULE-2044547388 [1,0,0,0,0,0|3,0,0]=4 337 B6R0.1 COCC(O)CN MCULE-2145726384 [1,0,0,0,0,0|3,0,0]=4 338 B6R0.1 COCC(O)CN MCULE-3637597204 [1,0,0,0,0,0|3,0,0]=4 339 B6R0.1 COCC(O)CO MCULE-1154104224 [1,0,0,0,0,0|2,0,0]=3 340 B6R0.1 COC[C@@H](N)CO MCULE-2792470078 [1,0,0,0,0,0|2,0,0]=3 341 B6R0.1 COC[C@@H](N)CO MCULE-3805343572 [1,0,0,0,0,0|2,0,0]=3 342 B6R0.1 COC[C@@H](N)CO MCULE-7953239910 [1,0,0,0,0,0|2,0,0]=3 343 B6R0.1 COC[C@@H](N)CO MCULE-9178553914 [1,0,0,0,0,0|2,0,0]=3 344 B6R0.1 COC[C@@H](O)CN MCULE-2116679841 [1,0,0,0,0,0|3,0,0]=4 345 B6R0.1 COC[C@@H](O)CN MCULE-4198842123 [1,0,0,0,0,0|3,0,0]=4 346 B6R0.1 COC[C@@H](O)CN MCULE-6330998296 [1,0,0,0,0,0|3,0,0]=4 347 B6R0.1 COC[C@H](C)CO MCULE-3120475252 [1,0,0,0,0,0|1,0,0]=2 348 B6R0.1 COC[C@H](F)CN MCULE-2663238018 [1,0,0,0,0,0|3,0,0]=4 349 B6R0.1 COC[C@H](N)CO MCULE-1678153673 [1,0,0,0,0,0|2,0,0]=3 350 B6R0.1 COC[C@H](N)CO MCULE-2304967280 [1,0,0,0,0,0|2,0,0]=3 351 B6R0.1 COC[C@H](N)CO MCULE-6509090198 [1,0,0,0,0,0|2,0,0]=3 352 B6R0.1 COC[C@H](N)CO MCULE-9806530206 [1,0,0,0,0,0|2,0,0]=3 353 B6R0.1 COC[C@H](O)CN MCULE-1962346446 [1,0,0,0,0,0|3,0,0]=4 354 B6R0.1 COC[C@H](O)CN MCULE-6290984425 [1,0,0,0,0,0|3,0,0]=4 355 B6R0.1 CSC(C)CCN MCULE-5474458753 [1,0,0,0,0,0|3,0,0]=4 356 B6R0.1 CSC(C)CCO MCULE-4317600086 [1,0,0,0,0,0|2,0,0]=3 357 B6R0.1 CSCC(C)CN MCULE-4493405290 [1,0,0,0,0,0|2,0,0]=3 358 B6R0.1 CSCC(C)CO MCULE-3842820579 [1,0,0,0,0,0|1,0,0]=2 359 B6R0.1 CSCC(O)CO MCULE-6573013078 [1,0,0,0,0,0|2,0,0]=3 360 B6R0.1 C[C@@H](CO)CCN MCULE-4422620011 [1,0,0,0,0,0|1,0,0]=2 361 B6R0.1 C[C@@H](CO)CCN MCULE-7560169391 [1,0,0,0,0,0|1,0,0]=2 362 B6R0.1 C[C@@H](CO)CCO MCULE-6545491289 [1,0,0,0,0,0|1,0,0]=2 363 B6R0.1 C[C@H](CO)CCO MCULE-2543010074 [1,0,0,0,0,0|1,0,0]=2 364 B6R0.1 C[C@H](CO)CCO MCULE-6036462418 [1,0,0,0,0,0|1,0,0]=2 365 B6R0.1 ClCC(Cl)CCBr MCULE-2469656567 [1,0,0,0,0,0|3,0,0]=4 366 B6R0.1 FC(CBr)CCBr MCULE-2311323533 [1,0,0,0,0,0|3,0,0]=4 367 B6R0.1 NC(CO)CCF MCULE-3691993352 [1,0,0,0,0,0|2,0,0]=3 368 B6R0.1 NC(CO)CCO MCULE-3703088648 [1,0,0,0,0,0|2,0,0]=3 369 B6R0.1 NC(CO)CCO MCULE-7609576462 [1,0,0,0,0,0|2,0,0]=3 370 B6R0.1 NCC(N)CCO MCULE-2965554481 [1,0,0,0,0,0|2,0,0]=3 371 B6R0.1 NCCC(F)CN MCULE-9478589176 [1,0,0,0,0,0|3,0,0]=4 372 B6R0.1 NCCC(O)CN MCULE-9177974477 [1,0,0,0,0,0|2,1,0]=4 373 B6R0.1 NCCC(O)CO MCULE-2556586168 [1,0,0,0,0,0|2,0,0]=3 374 B6R0.1 N[C@@H](CO)CCO MCULE-4583236919 [1,0,0,0,0,0|2,0,0]=3 375 B6R0.1 N[C@@H](CO)CCO MCULE-5489716742 [1,0,0,0,0,0|2,0,0]=3 376 B6R0.1 N[C@H](CO)CCO MCULE-5338659573 [1,0,0,0,0,0|2,0,0]=3 377 B6R0.1 N[C@H](CO)CCO MCULE-8998003003 [1,0,0,0,0,0|2,0,0]=3 378 B6R0.1 N[C@H](CS)CCS MCULE-5846021725 [1,0,0,0,0,0|2,1,0]=4 379 B6R0.1 N[C@H](CS)CCS MCULE-6871313350 [1,0,0,0,0,0|2,1,0]=4 380 B6R0.1 N[C@H](CS)CCS MCULE-8095554848 [1,0,0,0,0,0|2,1,0]=4 381 B6R0.1 N[C@H](CS)CCS MCULE-8177349504 [1,0,0,0,0,0|2,1,0]=4 382 B6R0.1 OC(CBr)CCBr MCULE-5156583342 [1,0,0,0,0,0|2,1,0]=4 383 B6R0.1 OC(CCl)CCCl MCULE-5495327725 [1,0,0,0,0,0|2,1,0]=4 384 B6R0.1 OCCC(O)CCl MCULE-4752952606 [1,0,0,0,0,0|1,1,0]=3 385 B6R0.1 OCCC(O)CO MCULE-6470178852 [1,0,0,0,0,0|1,1,0]=3 386 B6R0.1 OCC[C@@H](Br)CO MCULE-4859199629 [1,0,0,0,0,0|2,0,0]=3 387 B6R0.1 OCC[C@@H](O)CO MCULE-2312093276 [1,0,0,0,0,0|1,1,0]=3 388 B6R0.1 OCC[C@@H](O)CO MCULE-4636748782 [1,0,0,0,0,0|1,1,0]=3 389 B6R0.1 OCC[C@H](O)CBr MCULE-1990035925 [1,0,0,0,0,0|1,1,0]=3 390 B6R0.1 OCC[C@H](O)CCl MCULE-4561806159 [1,0,0,0,0,0|1,1,0]=3 391 B6R0.1 OCC[C@H](O)CCl MCULE-8582759529 [1,0,0,0,0,0|1,1,0]=3 392 B6R0.1 OCC[C@H](O)CO MCULE-2265914374 [1,0,0,0,0,0|1,1,0]=3 393 B6R0.1 OCC[C@H](O)CO MCULE-5459838421 [1,0,0,0,0,0|1,1,0]=3 394 B6R0.1 O[C@@H](CBr)CCBr MCULE-2137750043 [1,0,0,0,0,0|2,1,0]=4 395 B6R0.1 O[C@H](CBr)CCBr MCULE-2647046297 [1,0,0,0,0,0|2,1,0]=4 396 B6R0.1 O[C@H](CBr)CCBr MCULE-5662911918 [1,0,0,0,0,0|2,1,0]=4 397 B6R0.1 [C@@H](N)(CC)CC#N MCULE-3832898190 [1,0,0,0,0,0|2,0,1]=4 398 B6R0.1 [C@H](N)(CC)CC#N MCULE-3962570164 [1,0,0,0,0,0|2,0,1]=4 399 B6R0.1 [NH3+]CCC(F)C[NH3+] MCULE-8320233584 [1,0,0,0,0,0|3,0,0]=4 400 B6R0.3 C#CC(N)C(C)C MCULE-3430729891 [1,0,0,0,0,0|1,0,2]=4 401 B6R0.3 C#CC(N)C(C)C MCULE-7604887558 [1,0,0,0,0,0|1,0,2]=4 402 B6R0.3 C#CC(O)C(C)C MCULE-6729964061 [1,0,0,0,0,0|0,1,2]=4 403 B6R0.3 C#C[C@@H](O)C(C)C MCULE-2957798079 [1,0,0,0,0,0|0,1,2]=4 404 B6R0.3 C#C[C@H](O)C(C)C MCULE-7477457472 [1,0,0,0,0,0|0,1,2]=4 405 B6R0.3 C=C(C)C(C)CC MCULE-3736079313 [1,0,0,0,0,0|1,0,2]=4 406 B6R0.3 C=CC(C)C(C)C MCULE-4461669612 [1,0,0,0,0,0|1,0,2]=4 407 B6R0.3 C=CC(C)C(C)O MCULE-5639096655 [1,0,0,0,0,0|1,0,2]=4 408 B6R0.3 C=CC(O)C(C)C MCULE-2504249276 [1,0,0,0,0,0|0,1,2]=4 409 B6R0.3 C=C[C@@H](C)[C@@H](C)O MCULE-1946110265 [1,0,0,0,0,0|1,0,2]=4 410 B6R0.3 C=C[C@@H](C)[C@@H](C)O MCULE-2042493608 [1,0,0,0,0,0|1,0,2]=4 411 B6R0.3 C=C[C@@H](C)[C@H](C)O MCULE-1482556738 [1,0,0,0,0,0|1,0,2]=4 412 B6R0.3 C=C[C@H](C)[C@@H](C)O MCULE-4591189626 [1,0,0,0,0,0|1,0,2]=4 413 B6R0.3 C=C[C@H](C)[C@H](C)O MCULE-2180884086 [1,0,0,0,0,0|1,0,2]=4 414 B6R0.3 C=C[C@H](C)[C@H](C)O MCULE-2347920403 [1,0,0,0,0,0|1,0,2]=4 415 B6R0.3 CC(=C(C)CO)C MCULE-2852322197 [1,0,0,0,0,0|1,0,2]=4 416 B6R0.3 CC(=O)C(C)CO MCULE-9026658672 [1,0,0,0,0,0|0,1,1]=3 417 B6R0.3 CC(=O)C(N)CO MCULE-4063057020 [1,0,0,0,0,0|1,1,1]=4 418 B6R0.3 CC(=O)[C@@H](N)CO MCULE-9046372356 [1,0,0,0,0,0|1,1,1]=4 419 B6R0.3 CC(C)C(=O)CBr MCULE-5913227185 [1,0,0,0,0,0|1,1,1]=4 420 B6R0.3 CC(C)C(=O)CCl MCULE-4093256141 [1,0,0,0,0,0|1,1,1]=4 421 B6R0.3 CC(C)C(=O)CN MCULE-6091425997 [1,0,0,0,0,0|1,1,1]=4 422 B6R0.3 CC(C)C(=O)CN MCULE-7368122425 [1,0,0,0,0,0|1,1,1]=4 423 B6R0.3 CC(C)C(=O)CO MCULE-8746789873 [1,0,0,0,0,0|1,1,1]=4 424 B6R0.3 CC(C)C(Br)C#N MCULE-3045325666 [1,0,0,0,0,0|2,0,1]=4 425 B6R0.3 CC(C)C(Br)C=O MCULE-2054791376 [1,0,0,0,0,0|2,0,1]=4 426 B6R0.3 CC(C)C(C)CBr MCULE-4323135623 [1,0,0,0,0,0|2,0,0]=3 427 B6R0.3 CC(C)C(C)CN MCULE-1011041652 [1,0,0,0,0,0|2,0,0]=3 428 B6R0.3 CC(C)C(C)CN MCULE-5682817467 [1,0,0,0,0,0|2,0,0]=3 429 B6R0.3 CC(C)C(C)CO MCULE-7008552664 [1,0,0,0,0,0|1,0,0]=2 430 B6R0.3 CC(C)C(C)NN MCULE-3145633578 [1,0,0,0,0,0|3,0,0]=4 431 B6R0.3 CC(C)C(C)NN MCULE-5160672778 [1,0,0,0,0,0|3,0,0]=4 432 B6R0.3 CC(C)C(C)NN MCULE-7702836838 [1,0,0,0,0,0|3,0,0]=4 433 B6R0.3 CC(C)C(Cl)C#N MCULE-5102063658 [1,0,0,0,0,0|2,0,1]=4 434 B6R0.3 CC(C)C(N)C#N MCULE-5486541909 [1,0,0,0,0,0|2,0,1]=4 435 B6R0.3 CC(C)C(N)C#N MCULE-6250354053 [1,0,0,0,0,0|2,0,1]=4 436 B6R0.3 CC(C)C(N)CF MCULE-4101575579 [1,0,0,0,0,0|2,0,0]=3 437 B6R0.3 CC(C)C(N)CF MCULE-4888178244 [1,0,0,0,0,0|2,0,0]=3 438 B6R0.3 CC(C)C(N)CN MCULE-3414430422 [1,0,0,0,0,0|2,0,0]=3 439 B6R0.3 CC(C)C(N)CN MCULE-5279153780 [1,0,0,0,0,0|2,0,0]=3 440 B6R0.3 CC(C)C(N)CO MCULE-2361921763 [1,0,0,0,0,0|2,0,0]=3 441 B6R0.3 CC(C)C(N)CO MCULE-2989454077 [1,0,0,0,0,0|2,0,0]=3 442 B6R0.3 CC(C)C(N)CO MCULE-9793548365 [1,0,0,0,0,0|2,0,0]=3 443 B6R0.3 CC(C)C(O)C#N MCULE-1764798154 [1,0,0,0,0,0|1,1,1]=4 444 B6R0.3 CC(C)C(O)CBr MCULE-1921145212 [1,0,0,0,0,0|1,1,0]=3 445 B6R0.3 CC(C)C(O)CCl MCULE-7270676495 [1,0,0,0,0,0|1,1,0]=3 446 B6R0.3 CC(C)C(O)CN MCULE-3560246402 [1,0,0,0,0,0|1,1,0]=3 447 B6R0.3 CC(C)C(O)CN MCULE-9420842607 [1,0,0,0,0,0|1,1,0]=3 448 B6R0.3 CC(C)C(O)CO MCULE-6069815474 [1,0,0,0,0,0|1,1,0]=3 449 B6R0.3 CC(C)C(S)CO MCULE-1903780493 [1,0,0,0,0,0|1,0,0]=2 450 B6R0.3 CC(C)[C@@H](C)CO MCULE-4943691177 [1,0,0,0,0,0|1,0,0]=2 451 B6R0.3 CC(C)[C@@H](C)CO MCULE-6583781047 [1,0,0,0,0,0|1,0,0]=2 452 B6R0.3 CC(C)[C@@H](N)C#N MCULE-3710740145 [1,0,0,0,0,0|2,0,1]=4 453 B6R0.3 CC(C)[C@@H](N)C#N MCULE-6831295533 [1,0,0,0,0,0|2,0,1]=4 454 B6R0.3 CC(C)[C@@H](N)CF MCULE-7429178470 [1,0,0,0,0,0|2,0,0]=3 455 B6R0.3 CC(C)[C@@H](N)CF MCULE-7951488806 [1,0,0,0,0,0|2,0,0]=3 456 B6R0.3 CC(C)[C@@H](N)CO MCULE-1135743088 [1,0,0,0,0,0|2,0,0]=3 457 B6R0.3 CC(C)[C@@H](N)CO MCULE-3994511291 [1,0,0,0,0,0|2,0,0]=3 458 B6R0.3 CC(C)[C@H](C)CO MCULE-9527582465 [1,0,0,0,0,0|1,0,0]=2 459 B6R0.3 CC(C)[C@H](N)C#N MCULE-6519039369 [1,0,0,0,0,0|2,0,1]=4 460 B6R0.3 CC(C)[C@H](N)C#N MCULE-8475611484 [1,0,0,0,0,0|2,0,1]=4 461 B6R0.3 CC(C)[C@H](N)C=O MCULE-6686967175 [1,0,0,0,0,0|2,0,1]=4 462 B6R0.3 CC(C)[C@H](N)CF MCULE-2978082368 [1,0,0,0,0,0|2,0,0]=3 463 B6R0.3 CC(C)[C@H](N)CF MCULE-4609473233 [1,0,0,0,0,0|2,0,0]=3 464 B6R0.3 CC(C)[C@H](N)CN MCULE-2884084983 [1,0,0,0,0,0|2,0,0]=3 465 B6R0.3 CC(C)[C@H](N)CO MCULE-2625936994 [1,0,0,0,0,0|2,0,0]=3 466 B6R0.3 CC(C)[C@H](N)CO MCULE-3229973889 [1,0,0,0,0,0|2,0,0]=3 467 B6R0.3 CC(C)[C@H](N)CO MCULE-6090001117 [1,0,0,0,0,0|2,0,0]=3 468 B6R0.3 CC(C)[C@H](N)CO MCULE-8284816696 [1,0,0,0,0,0|2,0,0]=3 469 B6R0.3 CC(CCl)N(C)C MCULE-1058476958 [1,0,0,0,0,0|3,0,0]=4 470 B6R0.3 CC(CCl)N(C)C MCULE-3515287037 [1,0,0,0,0,0|3,0,0]=4 471 B6R0.3 CC(CN)C(F)F MCULE-3764511329 [1,0,0,0,0,0|3,0,0]=4 472 B6R0.3 CC(CN)C(F)F MCULE-3885392808 [1,0,0,0,0,0|3,0,0]=4 473 B6R0.3 CC(CN)N(C)C MCULE-1383449400 [1,0,0,0,0,0|3,0,0]=4 474 B6R0.3 CC(CN)N(C)C MCULE-9891789912 [1,0,0,0,0,0|3,0,0]=4 475 B6R0.3 CC(CN)S(=O)C MCULE-9048112625 [1,0,0,0,0,0|2,1,0]=4 476 B6R0.3 CC(CO)C(=O)O MCULE-2772009804 [1,0,0,0,0,0|1,1,1]=4 477 B6R0.3 CC(CO)C(=O)[O-] MCULE-6956620176 [1,0,0,0,0,0|1,1,1]=4 478 B6R0.3 CC(CO)N(=O)=O MCULE-5856696728 [1,0,0,0,0,0|2,1,0]=4 479 B6R0.3 CC(CO)N(C)C MCULE-7300076854 [1,0,0,0,0,0|2,0,0]=3 480 B6R0.3 CC(CO)N(C)N MCULE-8306784573 [1,0,0,0,0,0|2,0,0]=3 481 B6R0.3 CC(Cl)C(O)CCl MCULE-5399761987 [1,0,0,0,0,0|2,1,0]=4 482 B6R0.3 CC(N)C(C)CO MCULE-8179225289 [1,0,0,0,0,0|1,0,0]=2 483 B6R0.3 CC(N)C(O)CO MCULE-8191126136 [1,0,0,0,0,0|2,0,0]=3 484 B6R0.3 CC(O)C(C)C#N MCULE-2580244921 [1,0,0,0,0,0|1,1,1]=4 485 B6R0.3 CC(O)C(C)CN MCULE-5251700993 [1,0,0,0,0,0|1,1,0]=3 486 B6R0.3 CC(O)C(C)CO MCULE-4061946423 [1,0,0,0,0,0|0,1,0]=2 487 B6R0.3 CC(O)C(N)CN MCULE-2787573482 [1,0,0,0,0,0|2,0,0]=3 488 B6R0.3 CC(O)C(N)CN MCULE-5330950433 [1,0,0,0,0,0|2,0,0]=3 489 B6R0.3 CC(O)C(N)CO MCULE-7733336449 [1,0,0,0,0,0|1,1,0]=3 490 B6R0.3 CC(O)C(O)CN MCULE-6591390331 [1,0,0,0,0,0|1,1,0]=3 491 B6R0.3 CC(O)C(O)CO MCULE-1795053551 [1,0,0,0,0,0|1,1,0]=3 492 B6R0.3 CC(S)C(C)CO MCULE-5435813701 [1,0,0,0,0,0|0,0,0]=1 493 B6R0.3 CC=C(C)C(C)C MCULE-4070109813 [1,0,0,0,0,0|1,0,2]=4 494 B6R0.3 CCC(=C(C)C)C MCULE-7258057243 [1,0,0,0,0,0|1,0,2]=4 495 B6R0.3 CCC(=O)C(C)Br MCULE-2803556971 [1,0,0,0,0,0|1,1,1]=4 496 B6R0.3 CCC(=O)C(C)C MCULE-9576230007 [1,0,0,0,0,0|0,1,1]=3 497 B6R0.3 CCC(=O)C(C)Cl MCULE-8346980404 [1,0,0,0,0,0|1,1,1]=4 498 B6R0.3 CCC(=O)C(C)N MCULE-5434634349 [1,0,0,0,0,0|1,1,1]=4 499 B6R0.3 CCC(=O)C(C)N MCULE-8408562669 [1,0,0,0,0,0|1,1,1]=4 500 B6R0.3 CCC(=O)C(C)O MCULE-4144791660 [1,0,0,0,0,0|0,1,1]=3 501 B6R0.3 CCC(=O)C(C)S MCULE-3934356624 [1,0,0,0,0,0|0,2,1]=4 502 B6R0.3 CCC(=O)N(C)C MCULE-1734001200 [1,0,0,0,0,0|1,1,1]=4 503 B6R0.3 CCC(=S)N(C)C MCULE-7026282622 [1,0,0,0,0,0|1,0,2]=4 504 B6R0.3 CCC(Br)C(=O)C MCULE-7759811805 [1,0,0,0,0,0|1,0,2]=4 505 B6R0.3 CCC(Br)C(=O)O MCULE-4214463814 [1,0,0,0,0,0|2,0,1]=4 506 B6R0.3 CCC(C)B(O)O MCULE-7544159454 [1,0,0,0,0,0|3,0,0]=4 507 B6R0.3 CCC(C)C(=O)C MCULE-5294244024 [1,0,0,0,0,0|1,0,2]=4 508 B6R0.3 CCC(C)C(=O)O MCULE-5615925204 [1,0,0,0,0,0|2,0,1]=4 509 B6R0.3 CCC(C)C(=O)O MCULE-7434436828 [1,0,0,0,0,0|2,0,1]=4 510 B6R0.3 CCC(C)C(C)Br MCULE-5368409335 [1,0,0,0,0,0|2,0,0]=3 511 B6R0.3 CCC(C)C(C)C MCULE-9189749509 [1,0,0,0,0,0|1,0,0]=2 512 B6R0.3 CCC(C)C(C)Cl MCULE-2663176330 [1,0,0,0,0,0|2,0,0]=3 513 B6R0.3 CCC(C)C(C)N MCULE-1056466337 [1,0,0,0,0,0|2,0,0]=3 514 B6R0.3 CCC(C)C(C)N MCULE-1503543126 [1,0,0,0,0,0|2,0,0]=3 515 B6R0.3 CCC(C)C(C)O MCULE-8290655999 [1,0,0,0,0,0|1,0,0]=2 516 B6R0.3 CCC(Cl)C(=O)O MCULE-6325944516 [1,0,0,0,0,0|2,0,1]=4 517 B6R0.3 CCC(F)C(=O)O MCULE-3947852767 [1,0,0,0,0,0|2,0,1]=4 518 B6R0.3 CCC(N)C(=O)O MCULE-2132009026 [1,0,0,0,0,0|2,0,1]=4 519 B6R0.3 CCC(N)C(=O)O MCULE-7397078475 [1,0,0,0,0,0|2,0,1]=4 520 B6R0.3 CCC(N)C(=O)O MCULE-8052711911 [1,0,0,0,0,0|2,0,1]=4 521 B6R0.3 CCC(N)C(=O)O MCULE-9815187967 [1,0,0,0,0,0|2,0,1]=4 522 B6R0.3 CCC(N)C(C)C MCULE-3624338196 [1,0,0,0,0,0|1,0,0]=2 523 B6R0.3 CCC(N)C(C)C MCULE-4491326477 [1,0,0,0,0,0|1,0,0]=2 524 B6R0.3 CCC(N)C(C)O MCULE-2752432664 [1,0,0,0,0,0|1,0,0]=2 525 B6R0.3 CCC(N)C(C)O MCULE-6087590428 [1,0,0,0,0,0|1,0,0]=2 526 B6R0.3 CCC(N)C(F)F MCULE-3079670807 [1,0,0,0,0,0|3,0,0]=4 527 B6R0.3 CCC(N)C(F)F MCULE-4157824434 [1,0,0,0,0,0|3,0,0]=4 528 B6R0.3 CCC(O)C(=O)O MCULE-1958918710 [1,0,0,0,0,0|1,1,1]=4 529 B6R0.3 CCC(O)C(=O)O MCULE-2006594131 [1,0,0,0,0,0|1,1,1]=4 530 B6R0.3 CCC(O)C(C)C MCULE-1130775455 [1,0,0,0,0,0|0,1,0]=2 531 B6R0.3 CCC(O)C(C)N MCULE-4027170059 [1,0,0,0,0,0|1,1,0]=3 532 B6R0.3 CCC(O)C(C)O MCULE-1468922095 [1,0,0,0,0,0|0,1,0]=2 533 B6R0.3 CCC(S)C(=O)C MCULE-4243782106 [1,0,0,0,0,0|0,0,2]=3 534 B6R0.3 CCC(S)C(=O)O MCULE-9887370695 [1,0,0,0,0,0|1,0,1]=3 535 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-3890418201 [1,0,0,0,0,0|2,0,1]=4 536 B6R0.3 CC[C@@H](Br)C(=O)O MCULE-5910145154 [1,0,0,0,0,0|2,0,1]=4 537 B6R0.3 CC[C@@H](C)C(=O)O MCULE-4225604875 [1,0,0,0,0,0|2,0,1]=4 538 B6R0.3 CC[C@@H](C)C(=O)O MCULE-6581991788 [1,0,0,0,0,0|2,0,1]=4 539 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-2496023102 [1,0,0,0,0,0|2,0,1]=4 540 B6R0.3 CC[C@@H](Cl)C(=O)O MCULE-9719915588 [1,0,0,0,0,0|2,0,1]=4 541 B6R0.3 CC[C@@H](N)C(=O)O MCULE-3824768448 [1,0,0,0,0,0|2,0,1]=4 542 B6R0.3 CC[C@@H](N)C(=O)O MCULE-7078248621 [1,0,0,0,0,0|2,0,1]=4 543 B6R0.3 CC[C@@H](N)C(=O)O MCULE-8856363896 [1,0,0,0,0,0|2,0,1]=4 544 B6R0.3 CC[C@@H](N)C(=O)O MCULE-9662763952 [1,0,0,0,0,0|2,0,1]=4 545 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-8294520512 [1,0,0,0,0,0|1,0,0]=2 546 B6R0.3 CC[C@@H](N)[C@H](C)O MCULE-9521001934 [1,0,0,0,0,0|1,0,0]=2 547 B6R0.3 CC[C@@H](O)C(=O)O MCULE-8118182602 [1,0,0,0,0,0|1,1,1]=4 548 B6R0.3 CC[C@@H](O)C(=O)O MCULE-9744322272 [1,0,0,0,0,0|1,1,1]=4 549 B6R0.3 CC[C@@H](O)C(C)C MCULE-3684327261 [1,0,0,0,0,0|0,1,0]=2 550 B6R0.3 CC[C@H](Br)C(=O)O MCULE-2859668715 [1,0,0,0,0,0|2,0,1]=4 551 B6R0.3 CC[C@H](Br)C(=O)O MCULE-9989821197 [1,0,0,0,0,0|2,0,1]=4 552 B6R0.3 CC[C@H](C)C(=O)O MCULE-5170193492 [1,0,0,0,0,0|2,0,1]=4 553 B6R0.3 CC[C@H](C)C(=O)O MCULE-6595467867 [1,0,0,0,0,0|2,0,1]=4 554 B6R0.3 CC[C@H](Cl)C(=O)O MCULE-8870390851 [1,0,0,0,0,0|2,0,1]=4 555 B6R0.3 CC[C@H](N)C(=O)O MCULE-3597025691 [1,0,0,0,0,0|2,0,1]=4 556 B6R0.3 CC[C@H](N)C(=O)O MCULE-5445914617 [1,0,0,0,0,0|2,0,1]=4 557 B6R0.3 CC[C@H](N)C(=O)O MCULE-7781302707 [1,0,0,0,0,0|2,0,1]=4 558 B6R0.3 CC[C@H](N)C(=O)O MCULE-8446392822 [1,0,0,0,0,0|2,0,1]=4 559 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-2161876558 [1,0,0,0,0,0|2,0,1]=4 560 B6R0.3 CC[C@H](N)C(=[Se])O MCULE-6045953433 [1,0,0,0,0,0|2,0,1]=4 561 B6R0.3 CC[C@H](N)C(C)C MCULE-3200638239 [1,0,0,0,0,0|1,0,0]=2 562 B6R0.3 CC[C@H](N)C(C)C MCULE-4973720203 [1,0,0,0,0,0|1,0,0]=2 563 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-1930738992 [1,0,0,0,0,0|1,0,0]=2 564 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-4226147180 [1,0,0,0,0,0|1,0,0]=2 565 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-7445496718 [1,0,0,0,0,0|1,0,0]=2 566 B6R0.3 CC[C@H](N)[C@@H](C)O MCULE-9770959398 [1,0,0,0,0,0|1,0,0]=2 567 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-3878355824 [1,0,0,0,0,0|1,0,0]=2 568 B6R0.3 CC[C@H](N)[C@H](C)O MCULE-4791160457 [1,0,0,0,0,0|1,0,0]=2 569 B6R0.3 CC[C@H](O)C(=O)O MCULE-4284991317 [1,0,0,0,0,0|1,1,1]=4 570 B6R0.3 CC[C@H](O)C(=O)O MCULE-6782147427 [1,0,0,0,0,0|1,1,1]=4 571 B6R0.3 CC[C@H](O)C(C)C MCULE-9659963395 [1,0,0,0,0,0|0,1,0]=2 572 B6R0.3 CNC(=O)C(C)C MCULE-9646758802 [1,0,0,0,0,0|1,1,1]=4 573 B6R0.3 CNC(=O)C(C)O MCULE-4714977257 [1,0,0,0,0,0|1,1,1]=4 574 B6R0.3 CNC(=O)[C@@H](C)O MCULE-8955033466 [1,0,0,0,0,0|1,1,1]=4 575 B6R0.3 CNC(=O)[C@H](C)O MCULE-8015727044 [1,0,0,0,0,0|1,1,1]=4 576 B6R0.3 CNC(C)C(C)C MCULE-3041212030 [1,0,0,0,0,0|2,0,0]=3 577 B6R0.3 CNC(C)C(C)C MCULE-7052543779 [1,0,0,0,0,0|2,0,0]=3 578 B6R0.3 COC(=N)C(C)C MCULE-2061399513 [1,0,0,0,0,0|2,0,1]=4 579 B6R0.3 COC(=N)C(C)C MCULE-9270611186 [1,0,0,0,0,0|2,0,1]=4 580 B6R0.3 COC(=O)C(C)C MCULE-8740211817 [1,0,0,0,0,0|1,1,1]=4 581 B6R0.3 COC(=O)C(C)O MCULE-7040827393 [1,0,0,0,0,0|1,1,1]=4 582 B6R0.3 COC(=O)C(C)O MCULE-7872489483 [1,0,0,0,0,0|1,1,1]=4 583 B6R0.3 COC(=O)[C@@H](C)O MCULE-5441095431 [1,0,0,0,0,0|1,1,1]=4 584 B6R0.3 COC(=O)[C@@H](C)O MCULE-6924152779 [1,0,0,0,0,0|1,1,1]=4 585 B6R0.3 COC(=O)[C@H](C)O MCULE-2590929895 [1,0,0,0,0,0|1,1,1]=4 586 B6R0.3 COC(=O)[C@H](C)O MCULE-3292709954 [1,0,0,0,0,0|1,1,1]=4 587 B6R0.3 COC(C)C(C)O MCULE-9844405908 [1,0,0,0,0,0|2,0,0]=3 588 B6R0.3 COC(C)[C@@H](C)N MCULE-2029978265 [1,0,0,0,0,0|3,0,0]=4 589 B6R0.3 COC(C)[C@@H](C)N MCULE-4755003017 [1,0,0,0,0,0|3,0,0]=4 590 B6R0.3 COC(C)[C@@H](C)N MCULE-9820337483 [1,0,0,0,0,0|3,0,0]=4 591 B6R0.3 COC(C)[C@@H](C)N MCULE-9820818995 [1,0,0,0,0,0|3,0,0]=4 592 B6R0.3 CSC(=O)C(C)C MCULE-3533547228 [1,0,0,0,0,0|1,1,1]=4 593 B6R0.3 CSC(C)C(C)O MCULE-9554880840 [1,0,0,0,0,0|2,0,0]=3 594 B6R0.3 C[C@@H](CO)C(=O)O MCULE-1381224499 [1,0,0,0,0,0|1,1,1]=4 595 B6R0.3 C[C@@H](CO)C(=O)O MCULE-4599417419 [1,0,0,0,0,0|1,1,1]=4 596 B6R0.3 C[C@@H](CO)N(C)C MCULE-4388248602 [1,0,0,0,0,0|2,0,0]=3 597 B6R0.3 C[C@@H](CS)N(C)C MCULE-7111398165 [1,0,0,0,0,0|2,1,0]=4 598 B6R0.3 C[C@@H](F)[C@@H](F)CN MCULE-9285557840 [1,0,0,0,0,0|3,0,0]=4 599 B6R0.3 C[C@@H](F)[C@H](F)CN MCULE-9353092073 [1,0,0,0,0,0|3,0,0]=4 600 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-1499224916 [1,0,0,0,0,0|1,1,0]=3 601 B6R0.3 C[C@@H](O)[C@@H](N)CO MCULE-3539522955 [1,0,0,0,0,0|1,1,0]=3 602 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-1381786707 [1,0,0,0,0,0|1,1,0]=3 603 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-3627537672 [1,0,0,0,0,0|1,1,0]=3 604 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-5429038645 [1,0,0,0,0,0|1,1,0]=3 605 B6R0.3 C[C@@H](O)[C@H](N)CO MCULE-6146168744 [1,0,0,0,0,0|1,1,0]=3 606 B6R0.3 C[C@H](CO)C(=O)O MCULE-7012562122 [1,0,0,0,0,0|1,1,1]=4 607 B6R0.3 C[C@H](CO)C(=O)O MCULE-9702865885 [1,0,0,0,0,0|1,1,1]=4 608 B6R0.3 C[C@H](CO)C(=O)[O-] MCULE-5733737039 [1,0,0,0,0,0|1,1,1]=4 609 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-5329315346 [1,0,0,0,0,0|1,1,0]=3 610 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7239426628 [1,0,0,0,0,0|1,1,0]=3 611 B6R0.3 C[C@H](O)[C@@H](N)CO MCULE-7437797788 [1,0,0,0,0,0|1,1,0]=3 612 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-2378004602 [1,0,0,0,0,0|1,1,0]=3 613 B6R0.3 C[C@H](O)[C@H](N)CO MCULE-9436764758 [1,0,0,0,0,0|1,1,0]=3 614 B6R0.3 OC[C@@H](O)C(F)F MCULE-5042610356 [1,0,0,0,0,0|3,0,0]=4 615 B6R0.3 OC[C@@H](O)C(F)F MCULE-8643910063 [1,0,0,0,0,0|3,0,0]=4 616 B6R0.3 [C@H](S)(CC)C(=O)O MCULE-4267293279 [1,0,0,0,0,0|1,0,1]=3 617 B8R0.2 CC(=O)C(O)C(O)CO MCULE-1853649042 [0,1,0,0,0,0|1,1,1]=4 618 B8R0.2 CC(=O)[C@@H](O)[C@H](O)CO MCULE-9565941206 [0,1,0,0,0,0|1,1,1]=4 619 B8R0.2 CC(CO)C(C)N(C)C MCULE-9738578179 [0,1,0,0,0,0|2,0,0]=3 620 B8R0.2 CCC(=O)C(C)C(=O)O MCULE-9192813670 [0,1,0,0,0,0|0,1,2]=4 621 B8R0.2 CCC(C)C(=O)C(C)C MCULE-5036699104 [0,1,0,0,0,0|1,1,1]=4 622 B8R0.2 CCC(C)C(Br)C(=O)O MCULE-1124609284 [0,1,0,0,0,0|2,0,1]=4 623 B8R0.2 CCC(C)C(C)C(=O)C MCULE-4030096724 [0,1,0,0,0,0|1,0,2]=4 624 B8R0.2 CCC(C)C(C)C(=O)O MCULE-9360443230 [0,1,0,0,0,0|1,0,1]=3 625 B8R0.2 CCC(C)C(C)C(C)O MCULE-2099710154 [0,1,0,0,0,0|1,0,0]=2 626 B8R0.2 CCC(C)C(N)C(=O)O MCULE-9861955295 [0,1,0,0,0,0|2,0,1]=4 627 B8R0.2 CCC(C)C(O)C(=O)O MCULE-4300622531 [0,1,0,0,0,0|2,0,1]=4 628 B8R0.2 CCC(C)C(O)C(C)C MCULE-1108508487 [0,1,0,0,0,0|1,1,0]=3 629 B8R0.2 CCC(N)C(O)C(C)C MCULE-1144815530 [0,1,0,0,0,0|2,1,0]=4 630 B8R0.2 CCC(N)C(O)C(C)C MCULE-7062182958 [0,1,0,0,0,0|2,1,0]=4 631 B8R0.2 CCC(N)C(O)C(F)F MCULE-8040533324 [0,1,0,0,0,0|3,0,0]=4 632 B8R0.2 CCC(N)C(O)C(F)F MCULE-9737477996 [0,1,0,0,0,0|3,0,0]=4 633 B8R0.2 CCC(O)C(C)C(=O)O MCULE-7278088016 [0,1,0,0,0,0|0,1,1]=3 634 B8R0.2 CCC(O)C(N)C(=O)O MCULE-5277569808 [0,1,0,0,0,0|1,1,1]=4 635 B8R0.2 CCC(O)[C@H](N)C(=O)O MCULE-7480930876 [0,1,0,0,0,0|1,1,1]=4 636 B8R0.2 CCN(C)C(C)C(=O)O MCULE-6064336068 [0,1,0,0,0,0|2,0,1]=4 637 B8R0.2 CCN(C)[C@@H](C)C(=O)O MCULE-9158211664 [0,1,0,0,0,0|2,0,1]=4 638 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-1413119398 [0,1,0,0,0,0|2,0,1]=4 639 B8R0.2 CC[C@@H](C)[C@@H](N)C(=O)O MCULE-5186925599 [0,1,0,0,0,0|2,0,1]=4 640 B8R0.2 CC[C@@H](C)[C@H](Br)C(=O)O MCULE-5041492133 [0,1,0,0,0,0|2,0,1]=4 641 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-2706440971 [0,1,0,0,0,0|2,0,1]=4 642 B8R0.2 CC[C@@H](C)[C@H](N)C(=O)O MCULE-8101207882 [0,1,0,0,0,0|2,0,1]=4 643 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-1048734191 [0,1,0,0,0,0|1,1,1]=4 644 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-1935827385 [0,1,0,0,0,0|1,1,1]=4 645 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-8753855708 [0,1,0,0,0,0|1,1,1]=4 646 B8R0.2 CC[C@@H](O)[C@H](N)C(=O)O MCULE-9854510560 [0,1,0,0,0,0|1,1,1]=4 647 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1200159118 [0,1,0,0,0,0|2,0,1]=4 648 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-1359318144 [0,1,0,0,0,0|2,0,1]=4 649 B8R0.2 CC[C@H](C)[C@@H](N)C(=O)O MCULE-9629903099 [0,1,0,0,0,0|2,0,1]=4 650 B8R0.2 CC[C@H](C)[C@@H](O)C(=O)O MCULE-6017510763 [0,1,0,0,0,0|2,0,1]=4 651 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-1760352503 [0,1,0,0,0,0|2,0,1]=4 652 B8R0.2 CC[C@H](C)[C@H](Cl)C(=O)O MCULE-2341573677 [0,1,0,0,0,0|2,0,1]=4 653 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-2215911951 [0,1,0,0,0,0|2,0,1]=4 654 B8R0.2 CC[C@H](C)[C@H](N)C(=O)O MCULE-3217669453 [0,1,0,0,0,0|2,0,1]=4 655 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-2804875804 [0,1,0,0,0,0|2,0,1]=4 656 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-4272353967 [0,1,0,0,0,0|2,0,1]=4 657 B8R0.2 CC[C@H](C)[C@H](O)C(=O)O MCULE-6087026464 [0,1,0,0,0,0|2,0,1]=4 658 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-2118005753 [0,1,0,0,0,0|1,1,1]=4 659 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-2420221886 [0,1,0,0,0,0|1,1,1]=4 660 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-7168739287 [0,1,0,0,0,0|1,1,1]=4 661 B8R0.2 CC[C@H](O)[C@@H](N)C(=O)O MCULE-7351381830 [0,1,0,0,0,0|1,1,1]=4 662 B8R0.2 COC(=O)C(C)C(C)O MCULE-1377857651 [0,1,0,0,0,0|1,1,1]=4 663 B8R0.3 CCC(C)N(C)CCN MCULE-5072902037 [0,1,0,0,0,0|3,0,0]=4 664 B8R0.3 CCCC(=O)C(C)CC MCULE-7559638932 [0,1,0,0,0,0|1,1,1]=4 665 B8R0.3 CCCC(=O)C(N)CO MCULE-4196745965 [0,1,0,0,0,0|1,1,1]=4 666 B8R0.3 CCCC(=O)C(N)CO MCULE-9001126199 [0,1,0,0,0,0|1,1,1]=4 667 B8R0.3 CCCC(C)C(=O)CC MCULE-9990200653 [0,1,0,0,0,0|1,1,1]=4 668 B8R0.3 CCCC(C)C(C)CC MCULE-1049161950 [0,1,0,0,0,0|2,0,0]=3 669 B8R0.3 CCCC(C)C(N)CO MCULE-7204075039 [0,1,0,0,0,0|2,0,0]=3 670 B8R0.3 CCCC(C)C(N)CO MCULE-9206965368 [0,1,0,0,0,0|2,0,0]=3 671 B8R0.3 CCCC(C)C(O)CC MCULE-5128705007 [0,1,0,0,0,0|1,1,0]=3 672 B8R0.3 CCCC(O)C(C)CC MCULE-5746279508 [0,1,0,0,0,0|1,1,0]=3 673 B8R0.3 CCCC(O)C(N)CO MCULE-6983866986 [0,1,0,0,0,0|1,1,0]=3 674 B8R0.3 CCN(C)C(C)CCN MCULE-2896639711 [0,1,0,0,0,0|3,0,0]=4 675 B8R0.3 CCOC(=O)C(C)CBr MCULE-9513285816 [0,1,0,0,0,0|1,1,1]=4 676 B8R0.3 CCOC(=O)C(C)CC MCULE-3895639860 [0,1,0,0,0,0|1,1,1]=4 677 B8R0.3 CCOC(=O)C(C)CCl MCULE-9783842448 [0,1,0,0,0,0|1,1,1]=4 678 B8R0.3 CCOC(=O)C(C)CN MCULE-6123639141 [0,1,0,0,0,0|1,1,1]=4 679 B8R0.3 CCOC(=O)C(C)CN MCULE-6716626093 [0,1,0,0,0,0|1,1,1]=4 680 B8R0.3 CCOC(=O)C(C)CO MCULE-7936560025 [0,1,0,0,0,0|0,1,1]=3 681 B8R0.3 CCOC(=O)C(N)CO MCULE-1666659750 [0,1,0,0,0,0|1,1,1]=4 682 B8R0.3 CCOC(=O)C(N)CO MCULE-1998512614 [0,1,0,0,0,0|1,1,1]=4 683 B8R0.3 CCOC(=O)C(N)CO MCULE-2382743439 [0,1,0,0,0,0|1,1,1]=4 684 B8R0.3 CCOC(=O)C(N)CO MCULE-8735565522 [0,1,0,0,0,0|1,1,1]=4 685 B8R0.3 CCOC(=O)C(S)CC MCULE-8709451175 [0,1,0,0,0,0|2,0,1]=4 686 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-3922789205 [0,1,0,0,0,0|1,1,1]=4 687 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-4123182744 [0,1,0,0,0,0|1,1,1]=4 688 B8R0.3 CCOC(=O)[C@@H](N)CO MCULE-9348155020 [0,1,0,0,0,0|1,1,1]=4 689 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-5633972344 [0,1,0,0,0,0|1,1,1]=4 690 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-6411527516 [0,1,0,0,0,0|1,1,1]=4 691 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-9780267969 [0,1,0,0,0,0|1,1,1]=4 692 B8R0.3 CCOC(=O)[C@H](N)CO MCULE-9929488925 [0,1,0,0,0,0|1,1,1]=4 693 B8R0.3 COCC(C)C(=O)OC MCULE-4110856609 [0,1,0,0,0,0|1,1,1]=4 694 B8R0.3 O=CCC(O)C(O)CO MCULE-3895407431 [0,1,0,0,0,0|1,1,1]=4 695 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO MCULE-1639637147 [0,1,0,0,0,0|1,1,1]=4 696 B8R0.3 O=CC[C@@H](O)[C@@H](O)CO MCULE-4968821647 [0,1,0,0,0,0|1,1,1]=4 697 B8R0.3 O=CC[C@@H](O)[C@H](O)CO MCULE-5691852027 [0,1,0,0,0,0|1,1,1]=4 698 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-4741377107 [0,1,0,0,0,0|1,1,1]=4 699 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-6728124442 [0,1,0,0,0,0|1,1,1]=4 700 B8R0.3 O=CC[C@H](O)[C@H](O)CO MCULE-7223741689 [0,1,0,0,0,0|1,1,1]=4 701 B8R0.3 [C@H](N)(CO)C(=O)OCC MCULE-8379845791 [0,1,0,0,0,0|1,1,1]=4 702 B8R0.13 CC(C)(CO)C(O)CN MCULE-8834765819 [0,1,0,0,0,0|1,1,0]=3 703 B8R0.13 CC(C)(CO)[C@@H](O)CO MCULE-9011219997 [0,1,0,0,0,0|1,1,0]=3 704 B8R0.13 CCC(=O)C(C)(C)CC MCULE-3794055790 [0,1,0,0,0,0|1,1,1]=4 705 B8R0.13 CCC(C)C(C)(O)CC MCULE-8544550267 [0,1,0,0,0,0|1,1,0]=3 706 B8R0.13 CCC(C)C(C)(O)CN MCULE-5517076234 [0,1,0,0,0,0|2,0,0]=3 707 B8R0.13 CCN(C)C(C)(C)CN MCULE-3788950991 [0,1,0,0,0,0|3,0,0]=4 708 B8R0.13 COC(=O)C(C)(C)CO MCULE-5007341074 [0,1,0,0,0,0|1,1,1]=4 709 B8R0.13 COC(=O)C(C)(N)CO MCULE-3846577646 [0,1,0,0,0,0|1,1,1]=4 710 B8R0.13 COC(=O)C(C)(N)CO MCULE-4981173106 [0,1,0,0,0,0|1,1,1]=4 711 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-2857382898 [0,1,0,0,0,0|1,1,1]=4 712 B8R0.13 COC(=O)[C@@](C)(N)CO MCULE-3226982515 [0,1,0,0,0,0|1,1,1]=4 713 B8R0.13 C[C@](O)(CO)[C@H](O)CO MCULE-5157161314 [0,1,0,0,0,0|1,1,0]=3 714 B8R0.20 CCC(Br)C(OC)OC MCULE-9053790367 [0,1,0,0,0,0|3,0,0]=4 715 B8R0.20 CCC(C)C(C=O)OC MCULE-5091212843 [0,1,0,0,0,0|1,0,2]=4 716 B8R0.20 CCC(C)C(CN)OC MCULE-5181614773 [0,1,0,0,0,0|2,0,0]=3 717 B8R0.20 CCC(C)C(CO)OC MCULE-9009724151 [0,1,0,0,0,0|1,0,0]=2 718 B8R0.20 CCC(CC)C(O)CN MCULE-3311357012 [0,1,0,0,0,0|2,1,0]=4 719 B8R0.20 CCC(CC)C(O)CO MCULE-2947428739 [0,1,0,0,0,0|2,0,0]=3 720 B8R0.20 CCC(CN)N(C)CC MCULE-8850303439 [0,1,0,0,0,0|3,0,0]=4 721 B8R0.20 CCC(CO)C(=O)OC MCULE-3580039708 [0,1,0,0,0,0|1,1,1]=4 722 B8R0.20 CCC(N)C(OC)OC MCULE-4426944560 [0,1,0,0,0,0|3,0,0]=4 723 B8R0.20 CCC(N)C(OC)OC MCULE-7743570977 [0,1,0,0,0,0|3,0,0]=4 724 B8R0.20 CCC(N)N(CC)CC MCULE-6202857859 [0,1,0,0,0,0|3,0,0]=4 725 B8R0.20 CCC(O)C(CC)CC MCULE-1113039438 [0,1,0,0,0,0|1,1,0]=3 726 B8R0.20 CCN(CC)C(C)CN MCULE-2439435000 [0,1,0,0,0,0|3,0,0]=4 727 B8R0.20 CCN(CC)C(C)CO MCULE-6456878379 [0,1,0,0,0,0|2,0,0]=3 728 B8R0.20 CCN(CC)[C@H](C)CN MCULE-3421531997 [0,1,0,0,0,0|3,0,0]=4 729 B8R0.20 CNC(CO)C(=O)OC MCULE-1017957273 [0,1,0,0,0,0|1,1,1]=4 730 B8R0.20 CNC(CO)C(=O)OC MCULE-2751377307 [0,1,0,0,0,0|1,1,1]=4 731 B8R0.20 COC(C)C(CBr)OC MCULE-3245972419 [0,1,0,0,0,0|3,0,0]=4 732 B8R0.20 COC(C)C(CN)OC MCULE-6570822844 [0,1,0,0,0,0|3,0,0]=4 733 B8R0.20 COC(C)C(CO)OC MCULE-5469068997 [0,1,0,0,0,0|2,0,0]=3 734 B8R0.20 COC(CO)C(Br)CO MCULE-7125758160 [0,1,0,0,0,0|2,0,0]=3 735 B8R0.20 COC(OC)C(O)CO MCULE-6139329169 [0,1,0,0,0,0|2,1,0]=4 736 B8R1.5 BrC1CCCCC1Br MCULE-1701720026 [0,0,0,1,0,0|3,0,0]=4 737 B8R1.5 Br[C@@H]1CCCC[C@H]1Br MCULE-3924798087 [0,0,0,1,0,0|3,0,0]=4 738 B8R1.5 Br[C@@H]1CCCC[C@H]1Br MCULE-5649353367 [0,0,0,1,0,0|3,0,0]=4 739 B8R1.5 Br[C@H]1CCCC[C@@H]1Br MCULE-1538086495 [0,0,0,1,0,0|3,0,0]=4 740 B8R1.5 Br[C@H]1CCCC[C@@H]1Br MCULE-2632706043 [0,0,0,1,0,0|3,0,0]=4 741 B8R1.5 C1(CNCCN1C)C MCULE-7298788210 [0,0,0,1,0,0|3,0,0]=4 742 B8R1.5 C1(CNCCN1C)C MCULE-9473957667 [0,0,0,1,0,0|3,0,0]=4 743 B8R1.5 C=C1COCCC1N MCULE-4966385224 [0,0,0,1,0,0|1,0,2]=4 744 B8R1.5 CC1CC=CCC1C MCULE-9305523958 [0,0,0,1,0,0|2,0,1]=4 745 B8R1.5 CC1CCCCC1=O MCULE-6363555535 [0,0,0,1,0,0|1,1,1]=4 746 B8R1.5 CC1CCCCC1C MCULE-9841432259 [0,0,0,1,0,0|2,0,0]=3 747 B8R1.5 CC1CCCCC1N MCULE-3041016580 [0,0,0,1,0,0|2,0,0]=3 748 B8R1.5 CC1CCCCC1N MCULE-4294403075 [0,0,0,1,0,0|2,0,0]=3 749 B8R1.5 CC1CCCCC1O MCULE-2704647488 [0,0,0,1,0,0|1,1,0]=3 750 B8R1.5 CC1CCCCN1C MCULE-8197728941 [0,0,0,1,0,0|3,0,0]=4 751 B8R1.5 CC1CCCCN1N MCULE-8724967874 [0,0,0,1,0,0|3,0,0]=4 752 B8R1.5 CC1CCCNC1C MCULE-4611965577 [0,0,0,1,0,0|3,0,0]=4 753 B8R1.5 CC1CCCNC1C MCULE-5766379292 [0,0,0,1,0,0|3,0,0]=4 754 B8R1.5 CC1CCCNC1C MCULE-6191112458 [0,0,0,1,0,0|3,0,0]=4 755 B8R1.5 CC1CCNCC1C MCULE-5683848513 [0,0,0,1,0,0|2,0,0]=3 756 B8R1.5 CC1CCNCC1F MCULE-2423279658 [0,0,0,1,0,0|3,0,0]=4 757 B8R1.5 CC1CCNCC1F MCULE-3345403654 [0,0,0,1,0,0|3,0,0]=4 758 B8R1.5 CC1CCNCC1O MCULE-5450375148 [0,0,0,1,0,0|2,1,0]=4 759 B8R1.5 CC1CCNCC1O MCULE-5649027214 [0,0,0,1,0,0|2,1,0]=4 760 B8R1.5 CC1CCOCC1=O MCULE-2481965177 [0,0,0,1,0,0|2,0,1]=4 761 B8R1.5 CC1CNCCC1=O MCULE-6306655160 [0,0,0,1,0,0|1,1,1]=4 762 B8R1.5 CC1CNCCC1=O MCULE-9018912988 [0,0,0,1,0,0|1,1,1]=4 763 B8R1.5 CC1CNCCC1N MCULE-4288510851 [0,0,0,1,0,0|2,0,0]=3 764 B8R1.5 CC1CNCCC1N MCULE-7264043917 [0,0,0,1,0,0|2,0,0]=3 765 B8R1.5 CC1CNCCC1O MCULE-1960718296 [0,0,0,1,0,0|1,1,0]=3 766 B8R1.5 CC1CNCCC1O MCULE-8434519185 [0,0,0,1,0,0|1,1,0]=3 767 B8R1.5 CC1CNCCN1C MCULE-6819150286 [0,0,0,1,0,0|3,0,0]=4 768 B8R1.5 CC1CNCCN1C MCULE-7498903385 [0,0,0,1,0,0|3,0,0]=4 769 B8R1.5 CC1CNCCS1=O MCULE-7861495998 [0,0,0,1,0,0|2,1,0]=4 770 B8R1.5 CC1COCCC1=O MCULE-2694187526 [0,0,0,1,0,0|0,1,1]=3 771 B8R1.5 CC1COCCC1N MCULE-6236890728 [0,0,0,1,0,0|1,0,0]=2 772 B8R1.5 CC1COCCC1N MCULE-7497946239 [0,0,0,1,0,0|1,0,0]=2 773 B8R1.5 CC1COCCC1O MCULE-9430778912 [0,0,0,1,0,0|0,1,0]=2 774 B8R1.5 CC1CSCCC1=O MCULE-4565033608 [0,0,0,1,0,0|0,2,1]=4 775 B8R1.5 CC1NCCCC1O MCULE-4670774259 [0,0,0,1,0,0|2,1,0]=4 776 B8R1.5 CC1NCCCC1O MCULE-7229970366 [0,0,0,1,0,0|2,1,0]=4 777 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-2207912311 [0,0,0,1,0,0|2,0,0]=3 778 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-3227199256 [0,0,0,1,0,0|2,0,0]=3 779 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-4948677049 [0,0,0,1,0,0|2,0,0]=3 780 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-6377741621 [0,0,0,1,0,0|2,0,0]=3 781 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-8426223529 [0,0,0,1,0,0|2,0,0]=3 782 B8R1.5 C[C@@H]1CCCC[C@@H]1N MCULE-9542068395 [0,0,0,1,0,0|2,0,0]=3 783 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-3547716632 [0,0,0,1,0,0|1,1,0]=3 784 B8R1.5 C[C@@H]1CCCC[C@@H]1O MCULE-9259793572 [0,0,0,1,0,0|1,1,0]=3 785 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-2021817746 [0,0,0,1,0,0|2,0,0]=3 786 B8R1.5 C[C@@H]1CCCC[C@H]1N MCULE-3944837592 [0,0,0,1,0,0|2,0,0]=3 787 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-1550031816 [0,0,0,1,0,0|3,0,0]=4 788 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-6650080658 [0,0,0,1,0,0|3,0,0]=4 789 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-6715745499 [0,0,0,1,0,0|3,0,0]=4 790 B8R1.5 C[C@@H]1CCCN[C@@H]1C MCULE-7283977917 [0,0,0,1,0,0|3,0,0]=4 791 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-6946702609 [0,0,0,1,0,0|2,1,0]=4 792 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-7899767253 [0,0,0,1,0,0|2,1,0]=4 793 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-9159305922 [0,0,0,1,0,0|2,1,0]=4 794 B8R1.5 C[C@@H]1CCNC[C@@H]1O MCULE-9391376462 [0,0,0,1,0,0|2,1,0]=4 795 B8R1.5 C[C@@H]1CCNC[C@H]1F MCULE-1681100584 [0,0,0,1,0,0|3,0,0]=4 796 B8R1.5 C[C@@H]1CCNC[C@H]1F MCULE-2733502904 [0,0,0,1,0,0|3,0,0]=4 797 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-4706073937 [0,0,0,1,0,0|2,1,0]=4 798 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-5188621987 [0,0,0,1,0,0|2,1,0]=4 799 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-6031430878 [0,0,0,1,0,0|2,1,0]=4 800 B8R1.5 C[C@@H]1CCNC[C@H]1O MCULE-8311134495 [0,0,0,1,0,0|2,1,0]=4 801 B8R1.5 C[C@@H]1CNCCN1C MCULE-4245576564 [0,0,0,1,0,0|3,0,0]=4 802 B8R1.5 C[C@@H]1CNCCN1C MCULE-5117246567 [0,0,0,1,0,0|3,0,0]=4 803 B8R1.5 C[C@@H]1CNCCN1C MCULE-6852418533 [0,0,0,1,0,0|3,0,0]=4 804 B8R1.5 C[C@@H]1CNCCN1C MCULE-8377240136 [0,0,0,1,0,0|3,0,0]=4 805 B8R1.5 C[C@@H]1CNCC[C@@H]1N MCULE-1733727000 [0,0,0,1,0,0|2,0,0]=3 806 B8R1.5 C[C@@H]1CNCC[C@@H]1N MCULE-5971884774 [0,0,0,1,0,0|2,0,0]=3 807 B8R1.5 C[C@@H]1CNCC[C@H]1N MCULE-4381780061 [0,0,0,1,0,0|2,0,0]=3 808 B8R1.5 C[C@@H]1CNCC[C@H]1N MCULE-7332887720 [0,0,0,1,0,0|2,0,0]=3 809 B8R1.5 C[C@@H]1CNCC[C@H]1O MCULE-1211656855 [0,0,0,1,0,0|1,1,0]=3 810 B8R1.5 C[C@@H]1CNCC[C@H]1O MCULE-8887033073 [0,0,0,1,0,0|1,1,0]=3 811 B8R1.5 C[C@@H]1COCC[C@@H]1N MCULE-1854737385 [0,0,0,1,0,0|1,0,0]=2 812 B8R1.5 C[C@@H]1COCC[C@@H]1N MCULE-5272955365 [0,0,0,1,0,0|1,0,0]=2 813 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-1385721208 [0,0,0,1,0,0|1,0,0]=2 814 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-1584947952 [0,0,0,1,0,0|1,0,0]=2 815 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-3448920251 [0,0,0,1,0,0|1,0,0]=2 816 B8R1.5 C[C@@H]1COCC[C@H]1N MCULE-7256484712 [0,0,0,1,0,0|1,0,0]=2 817 B8R1.5 C[C@@H]1NCCC[C@H]1O MCULE-4565116334 [0,0,0,1,0,0|2,1,0]=4 818 B8R1.5 C[C@H]1CCCC[C@@H]1C MCULE-3536263334 [0,0,0,1,0,0|2,0,0]=3 819 B8R1.5 C[C@H]1CCCC[C@@H]1C MCULE-5867798019 [0,0,0,1,0,0|2,0,0]=3 820 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-3841584035 [0,0,0,1,0,0|2,0,0]=3 821 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-4158219749 [0,0,0,1,0,0|2,0,0]=3 822 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-8973971252 [0,0,0,1,0,0|2,0,0]=3 823 B8R1.5 C[C@H]1CCCC[C@@H]1N MCULE-9885453921 [0,0,0,1,0,0|2,0,0]=3 824 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-4879328575 [0,0,0,1,0,0|1,1,0]=3 825 B8R1.5 C[C@H]1CCCC[C@@H]1O MCULE-7331434797 [0,0,0,1,0,0|1,1,0]=3 826 B8R1.5 C[C@H]1CCCC[C@H]1C MCULE-9131794520 [0,0,0,1,0,0|2,0,0]=3 827 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-1533998857 [0,0,0,1,0,0|2,0,0]=3 828 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5254242664 [0,0,0,1,0,0|2,0,0]=3 829 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-5432486645 [0,0,0,1,0,0|2,0,0]=3 830 B8R1.5 C[C@H]1CCCC[C@H]1N MCULE-7149509445 [0,0,0,1,0,0|2,0,0]=3 831 B8R1.5 C[C@H]1CCNC[C@@H]1F MCULE-4761102749 [0,0,0,1,0,0|3,0,0]=4 832 B8R1.5 C[C@H]1CCNC[C@@H]1F MCULE-8933374788 [0,0,0,1,0,0|3,0,0]=4 833 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-2413866964 [0,0,0,1,0,0|2,1,0]=4 834 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-3541397142 [0,0,0,1,0,0|2,1,0]=4 835 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-4524645861 [0,0,0,1,0,0|2,1,0]=4 836 B8R1.5 C[C@H]1CCNC[C@@H]1O MCULE-4989324272 [0,0,0,1,0,0|2,1,0]=4 837 B8R1.5 C[C@H]1CCNC[C@H]1F MCULE-4253107784 [0,0,0,1,0,0|3,0,0]=4 838 B8R1.5 C[C@H]1CCNC[C@H]1F MCULE-5700696523 [0,0,0,1,0,0|3,0,0]=4 839 B8R1.5 C[C@H]1CCNC[C@H]1O MCULE-6149485279 [0,0,0,1,0,0|2,1,0]=4 840 B8R1.5 C[C@H]1CCNC[C@H]1O MCULE-9609136161 [0,0,0,1,0,0|2,1,0]=4 841 B8R1.5 C[C@H]1CNCCC1=O MCULE-8062269317 [0,0,0,1,0,0|1,1,1]=4 842 B8R1.5 C[C@H]1CNCCC1=O MCULE-9510433313 [0,0,0,1,0,0|1,1,1]=4 843 B8R1.5 C[C@H]1CNCCN1C MCULE-2247489661 [0,0,0,1,0,0|3,0,0]=4 844 B8R1.5 C[C@H]1CNCCN1C MCULE-2710257203 [0,0,0,1,0,0|3,0,0]=4 845 B8R1.5 C[C@H]1CNCCN1C MCULE-4486771855 [0,0,0,1,0,0|3,0,0]=4 846 B8R1.5 C[C@H]1CNCCN1C MCULE-8285859555 [0,0,0,1,0,0|3,0,0]=4 847 B8R1.5 C[C@H]1CNCC[C@@H]1N MCULE-1222815331 [0,0,0,1,0,0|2,0,0]=3 848 B8R1.5 C[C@H]1CNCC[C@@H]1N MCULE-1657518091 [0,0,0,1,0,0|2,0,0]=3 849 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-1418189839 [0,0,0,1,0,0|1,1,0]=3 850 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-2162007646 [0,0,0,1,0,0|1,1,0]=3 851 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-4884869364 [0,0,0,1,0,0|1,1,0]=3 852 B8R1.5 C[C@H]1CNCC[C@@H]1O MCULE-9707177849 [0,0,0,1,0,0|1,1,0]=3 853 B8R1.5 C[C@H]1CNCC[C@H]1N MCULE-2604448103 [0,0,0,1,0,0|2,0,0]=3 854 B8R1.5 C[C@H]1CNCC[C@H]1N MCULE-4549710847 [0,0,0,1,0,0|2,0,0]=3 855 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-1909814972 [0,0,0,1,0,0|1,1,0]=3 856 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-8202226496 [0,0,0,1,0,0|1,1,0]=3 857 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-9674887824 [0,0,0,1,0,0|1,1,0]=3 858 B8R1.5 C[C@H]1CNCC[C@H]1O MCULE-9888495251 [0,0,0,1,0,0|1,1,0]=3 859 B8R1.5 C[C@H]1COCCC1=O MCULE-3103478095 [0,0,0,1,0,0|0,1,1]=3 860 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-3420685614 [0,0,0,1,0,0|1,0,0]=2 861 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-4495690357 [0,0,0,1,0,0|1,0,0]=2 862 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-9724547988 [0,0,0,1,0,0|1,0,0]=2 863 B8R1.5 C[C@H]1COCC[C@@H]1N MCULE-9889716251 [0,0,0,1,0,0|1,0,0]=2 864 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-3075216082 [0,0,0,1,0,0|1,0,0]=2 865 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-4276602047 [0,0,0,1,0,0|1,0,0]=2 866 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-6090606114 [0,0,0,1,0,0|1,0,0]=2 867 B8R1.5 C[C@H]1COCC[C@H]1N MCULE-6610603811 [0,0,0,1,0,0|1,0,0]=2 868 B8R1.5 C[C@H]1NCCC[C@@H]1O MCULE-4581708846 [0,0,0,1,0,0|2,1,0]=4 869 B8R1.5 ClC1CCCCC1Cl MCULE-4249390413 [0,0,0,1,0,0|3,0,0]=4 870 B8R1.5 Cl[C@@H]1CCCC[C@H]1Cl MCULE-7886724296 [0,0,0,1,0,0|3,0,0]=4 871 B8R1.5 Cl[C@H]1CCCC[C@@H]1Br MCULE-5215368864 [0,0,0,1,0,0|3,0,0]=4 872 B8R1.5 Cl[C@H]1CCCC[C@@H]1Cl MCULE-4820169474 [0,0,0,1,0,0|3,0,0]=4 873 B8R1.5 Cl[C@H]1CCCC[C@@H]1Cl MCULE-7788819843 [0,0,0,1,0,0|3,0,0]=4 874 B8R1.5 Cl[C@H]1CCCC[C@H]1Cl MCULE-8380485042 [0,0,0,1,0,0|3,0,0]=4 875 B8R1.5 FC1CCCCC1Br MCULE-5989278401 [0,0,0,1,0,0|3,0,0]=4 876 B8R1.5 FC1CCNCC1F MCULE-6536309243 [0,0,0,1,0,0|3,0,0]=4 877 B8R1.5 FC1CCNCC1F MCULE-7145018916 [0,0,0,1,0,0|3,0,0]=4 878 B8R1.5 F[C@@H]1CCNC[C@H]1F MCULE-6799503527 [0,0,0,1,0,0|3,0,0]=4 879 B8R1.5 F[C@@H]1CCNC[C@H]1F MCULE-9656045295 [0,0,0,1,0,0|3,0,0]=4 880 B8R1.5 F[C@H]1CCNC[C@H]1F MCULE-3083739703 [0,0,0,1,0,0|3,0,0]=4 881 B8R1.5 F[C@H]1CCNC[C@H]1F MCULE-5631085665 [0,0,0,1,0,0|3,0,0]=4 882 B8R1.5 F[C@H]1CNCC[C@H]1F MCULE-6688369638 [0,0,0,1,0,0|3,0,0]=4 883 B8R1.5 F[C@H]1CNCC[C@H]1F MCULE-7021410764 [0,0,0,1,0,0|3,0,0]=4 884 B8R1.5 NC1CCCCC1Cl MCULE-3676302646 [0,0,0,1,0,0|3,0,0]=4 885 B8R1.5 NC1CCCCC1Cl MCULE-7920658638 [0,0,0,1,0,0|3,0,0]=4 886 B8R1.5 NC1CCCCC1F MCULE-6643891539 [0,0,0,1,0,0|3,0,0]=4 887 B8R1.5 NC1CCCCC1F MCULE-7855236144 [0,0,0,1,0,0|3,0,0]=4 888 B8R1.5 NC1CCCCC1N MCULE-1677916175 [0,0,0,1,0,0|3,0,0]=4 889 B8R1.5 NC1CCCCC1N MCULE-9568644004 [0,0,0,1,0,0|3,0,0]=4 890 B8R1.5 NC1CCCCC1O MCULE-1427424523 [0,0,0,1,0,0|2,1,0]=4 891 B8R1.5 NC1CCCCC1O MCULE-2793336591 [0,0,0,1,0,0|2,1,0]=4 892 B8R1.5 NC1CCNCC1O MCULE-2705091841 [0,0,0,1,0,0|3,0,0]=4 893 B8R1.5 NC1CCOCC1F MCULE-1016932578 [0,0,0,1,0,0|2,0,0]=3 894 B8R1.5 NC1CCOCC1F MCULE-9622790392 [0,0,0,1,0,0|2,0,0]=3 895 B8R1.5 NC1CCOCC1O MCULE-2815184899 [0,0,0,1,0,0|2,0,0]=3 896 B8R1.5 NC1CCOCC1O MCULE-4548392204 [0,0,0,1,0,0|2,0,0]=3 897 B8R1.5 NC1COCCC1=O MCULE-2621905094 [0,0,0,1,0,0|1,1,1]=4 898 B8R1.5 NC1COCCC1=O MCULE-5417580672 [0,0,0,1,0,0|1,1,1]=4 899 B8R1.5 NC1COCCC1F MCULE-1455837903 [0,0,0,1,0,0|2,0,0]=3 900 B8R1.5 NC1COCCC1F MCULE-7145252320 [0,0,0,1,0,0|2,0,0]=3 901 B8R1.5 NC1COCCC1O MCULE-6374385354 [0,0,0,1,0,0|1,1,0]=3 902 B8R1.5 NC1COCCC1O MCULE-7944406292 [0,0,0,1,0,0|1,1,0]=3 903 B8R1.5 N[C@@H]1CCCC[C@@H]1F MCULE-1657692826 [0,0,0,1,0,0|3,0,0]=4 904 B8R1.5 N[C@@H]1CCCC[C@@H]1F MCULE-3328673946 [0,0,0,1,0,0|3,0,0]=4 905 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2753918610 [0,0,0,1,0,0|2,1,0]=4 906 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-2761271370 [0,0,0,1,0,0|2,1,0]=4 907 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-4978213189 [0,0,0,1,0,0|2,1,0]=4 908 B8R1.5 N[C@@H]1CCCC[C@@H]1O MCULE-9182719952 [0,0,0,1,0,0|2,1,0]=4 909 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-3474870548 [0,0,0,1,0,0|3,0,0]=4 910 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-3984172565 [0,0,0,1,0,0|3,0,0]=4 911 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-4705427644 [0,0,0,1,0,0|3,0,0]=4 912 B8R1.5 N[C@@H]1CCCC[C@H]1F MCULE-7025237099 [0,0,0,1,0,0|3,0,0]=4 913 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-1186999216 [0,0,0,1,0,0|3,0,0]=4 914 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-2134025562 [0,0,0,1,0,0|3,0,0]=4 915 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6149251599 [0,0,0,1,0,0|3,0,0]=4 916 B8R1.5 N[C@@H]1CCCC[C@H]1N MCULE-6588424966 [0,0,0,1,0,0|3,0,0]=4 917 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-1509174959 [0,0,0,1,0,0|2,1,0]=4 918 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-2336529349 [0,0,0,1,0,0|2,1,0]=4 919 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-4732604931 [0,0,0,1,0,0|2,1,0]=4 920 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-6124510830 [0,0,0,1,0,0|2,1,0]=4 921 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-7301593250 [0,0,0,1,0,0|2,1,0]=4 922 B8R1.5 N[C@@H]1CCCC[C@H]1O MCULE-8501577810 [0,0,0,1,0,0|2,1,0]=4 923 B8R1.5 N[C@@H]1CCNC[C@H]1O MCULE-1435526553 [0,0,0,1,0,0|3,0,0]=4 924 B8R1.5 N[C@@H]1CCNC[C@H]1O MCULE-8731873892 [0,0,0,1,0,0|3,0,0]=4 925 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-1239747130 [0,0,0,1,0,0|2,0,0]=3 926 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-2720196545 [0,0,0,1,0,0|2,0,0]=3 927 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-4681308404 [0,0,0,1,0,0|2,0,0]=3 928 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-5510784592 [0,0,0,1,0,0|2,0,0]=3 929 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-6118396691 [0,0,0,1,0,0|2,0,0]=3 930 B8R1.5 N[C@@H]1CCOC[C@@H]1F MCULE-9001277868 [0,0,0,1,0,0|2,0,0]=3 931 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-1888816293 [0,0,0,1,0,0|2,0,0]=3 932 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-3667258867 [0,0,0,1,0,0|2,0,0]=3 933 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-3915823883 [0,0,0,1,0,0|2,0,0]=3 934 B8R1.5 N[C@@H]1CCOC[C@@H]1O MCULE-9959521476 [0,0,0,1,0,0|2,0,0]=3 935 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-3556707940 [0,0,0,1,0,0|2,0,0]=3 936 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-4525092522 [0,0,0,1,0,0|2,0,0]=3 937 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-7086756183 [0,0,0,1,0,0|2,0,0]=3 938 B8R1.5 N[C@@H]1CCOC[C@H]1F MCULE-8506007792 [0,0,0,1,0,0|2,0,0]=3 939 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-1071839837 [0,0,0,1,0,0|2,0,0]=3 940 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-6051401821 [0,0,0,1,0,0|2,0,0]=3 941 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-7013720281 [0,0,0,1,0,0|2,0,0]=3 942 B8R1.5 N[C@@H]1CCOC[C@H]1O MCULE-8477518337 [0,0,0,1,0,0|2,0,0]=3 943 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-1031623201 [0,0,0,1,0,0|1,1,0]=3 944 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-2846030882 [0,0,0,1,0,0|1,1,0]=3 945 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-8863364874 [0,0,0,1,0,0|1,1,0]=3 946 B8R1.5 N[C@@H]1COCC[C@@H]1O MCULE-9836639365 [0,0,0,1,0,0|1,1,0]=3 947 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-2318671918 [0,0,0,1,0,0|2,0,0]=3 948 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-3695420668 [0,0,0,1,0,0|2,0,0]=3 949 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-6955873978 [0,0,0,1,0,0|2,0,0]=3 950 B8R1.5 N[C@@H]1COCC[C@H]1F MCULE-8343413560 [0,0,0,1,0,0|2,0,0]=3 951 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-4436769496 [0,0,0,1,0,0|1,1,0]=3 952 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-6163244980 [0,0,0,1,0,0|1,1,0]=3 953 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-8697534407 [0,0,0,1,0,0|1,1,0]=3 954 B8R1.5 N[C@@H]1COCC[C@H]1O MCULE-9625047427 [0,0,0,1,0,0|1,1,0]=3 955 B8R1.5 N[C@H]1CCCC[C@@H]1F MCULE-2983212378 [0,0,0,1,0,0|3,0,0]=4 956 B8R1.5 N[C@H]1CCCC[C@@H]1F MCULE-6196710696 [0,0,0,1,0,0|3,0,0]=4 957 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-3653211978 [0,0,0,1,0,0|3,0,0]=4 958 B8R1.5 N[C@H]1CCCC[C@@H]1N MCULE-5059719804 [0,0,0,1,0,0|3,0,0]=4 959 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1277967673 [0,0,0,1,0,0|2,1,0]=4 960 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-1301750612 [0,0,0,1,0,0|2,1,0]=4 961 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-3861922722 [0,0,0,1,0,0|2,1,0]=4 962 B8R1.5 N[C@H]1CCCC[C@@H]1O MCULE-8489439004 [0,0,0,1,0,0|2,1,0]=4 963 B8R1.5 N[C@H]1CCCC[C@H]1F MCULE-7579368841 [0,0,0,1,0,0|3,0,0]=4 964 B8R1.5 N[C@H]1CCCC[C@H]1F MCULE-8479221038 [0,0,0,1,0,0|3,0,0]=4 965 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-2011367325 [0,0,0,1,0,0|3,0,0]=4 966 B8R1.5 N[C@H]1CCCC[C@H]1N MCULE-7126233212 [0,0,0,1,0,0|3,0,0]=4 967 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-1599409645 [0,0,0,1,0,0|2,1,0]=4 968 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-3318800690 [0,0,0,1,0,0|2,1,0]=4 969 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-4235445104 [0,0,0,1,0,0|2,1,0]=4 970 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6518289705 [0,0,0,1,0,0|2,1,0]=4 971 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-6606691116 [0,0,0,1,0,0|2,1,0]=4 972 B8R1.5 N[C@H]1CCCC[C@H]1O MCULE-9979333085 [0,0,0,1,0,0|2,1,0]=4 973 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-1493875164 [0,0,0,1,0,0|2,0,0]=3 974 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-2102376472 [0,0,0,1,0,0|2,0,0]=3 975 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-6109633704 [0,0,0,1,0,0|2,0,0]=3 976 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-7337274868 [0,0,0,1,0,0|2,0,0]=3 977 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-9740357152 [0,0,0,1,0,0|2,0,0]=3 978 B8R1.5 N[C@H]1CCOC[C@@H]1F MCULE-9831607120 [0,0,0,1,0,0|2,0,0]=3 979 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-1217623714 [0,0,0,1,0,0|2,0,0]=3 980 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-4607259008 [0,0,0,1,0,0|2,0,0]=3 981 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-4749541215 [0,0,0,1,0,0|2,0,0]=3 982 B8R1.5 N[C@H]1CCOC[C@@H]1O MCULE-9683658087 [0,0,0,1,0,0|2,0,0]=3 983 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-1550590585 [0,0,0,1,0,0|2,0,0]=3 984 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-4067592428 [0,0,0,1,0,0|2,0,0]=3 985 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-4649837852 [0,0,0,1,0,0|2,0,0]=3 986 B8R1.5 N[C@H]1CCOC[C@H]1F MCULE-6334068028 [0,0,0,1,0,0|2,0,0]=3 987 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-1807586879 [0,0,0,1,0,0|2,0,0]=3 988 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-1937023434 [0,0,0,1,0,0|2,0,0]=3 989 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-4374635229 [0,0,0,1,0,0|2,0,0]=3 990 B8R1.5 N[C@H]1CCOC[C@H]1O MCULE-4873019238 [0,0,0,1,0,0|2,0,0]=3 991 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-1937054893 [0,0,0,1,0,0|1,1,0]=3 992 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-4877924283 [0,0,0,1,0,0|1,1,0]=3 993 B8R1.5 N[C@H]1COCC[C@@H]1O MCULE-6674323819 [0,0,0,1,0,0|1,1,0]=3 994 B8R1.5 N[C@H]1COCC[C@H]1O MCULE-7305089306 [0,0,0,1,0,0|1,1,0]=3 995 B8R1.5 N[C@H]1COCC[C@H]1O MCULE-8372108333 [0,0,0,1,0,0|1,1,0]=3 996 B8R1.5 O=C1CCOCC1Br MCULE-1103002154 [0,0,0,1,0,0|1,1,1]=4 997 B8R1.5 O=C1CCOCC1Cl MCULE-6926183930 [0,0,0,1,0,0|1,1,1]=4 998 B8R1.5 O=C1CCOCC1F MCULE-8590362767 [0,0,0,1,0,0|1,1,1]=4 999 B8R1.5 O=C1CCOCC1O MCULE-7032874317 [0,0,0,1,0,0|1,1,1]=4 1000 B8R1.5 O=C1CCOC[C@@H]1Br MCULE-8729201111 [0,0,0,1,0,0|1,1,1]=4 1001 B8R1.5 O=C1CCOC[C@@H]1F MCULE-3075219245 [0,0,0,1,0,0|1,1,1]=4 1002 B8R1.5 OC1CCCCC1Cl MCULE-8650942069 [0,0,0,1,0,0|2,1,0]=4 1003 B8R1.5 OC1CCCCC1F MCULE-7634543650 [0,0,0,1,0,0|2,1,0]=4 1004 B8R1.5 OC1CCCCC1O MCULE-2967360901 [0,0,0,1,0,0|2,1,0]=4 1005 B8R1.5 OC1CCNCC1F MCULE-3466397366 [0,0,0,1,0,0|2,1,0]=4 1006 B8R1.5 OC1CCNCC1F MCULE-8065194779 [0,0,0,1,0,0|2,1,0]=4 1007 B8R1.5 OC1CCNCC1O MCULE-3039573850 [0,0,0,1,0,0|2,1,0]=4 1008 B8R1.5 OC1CCNCC1O MCULE-8828122539 [0,0,0,1,0,0|2,1,0]=4 1009 B8R1.5 OC1CCOCC1F MCULE-6531880501 [0,0,0,1,0,0|1,1,0]=3 1010 B8R1.5 OC1CNCCC1F MCULE-2946280821 [0,0,0,1,0,0|3,0,0]=4 1011 B8R1.5 OC1CNCCC1F MCULE-3493148821 [0,0,0,1,0,0|3,0,0]=4 1012 B8R1.5 O[C@@H]1CCCC[C@H]1F MCULE-2305949625 [0,0,0,1,0,0|2,1,0]=4 1013 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3067807104 [0,0,0,1,0,0|2,1,0]=4 1014 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-3429096841 [0,0,0,1,0,0|2,1,0]=4 1015 B8R1.5 O[C@@H]1CCCC[C@H]1O MCULE-9892753066 [0,0,0,1,0,0|2,1,0]=4 1016 B8R1.5 O[C@@H]1CCCC[C@H]1S MCULE-6222162383 [0,0,0,1,0,0|2,0,0]=3 1017 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-3951980250 [0,0,0,1,0,0|2,1,0]=4 1018 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-4022160407 [0,0,0,1,0,0|2,1,0]=4 1019 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-7163743424 [0,0,0,1,0,0|2,1,0]=4 1020 B8R1.5 O[C@@H]1CCNC[C@@H]1F MCULE-9380154478 [0,0,0,1,0,0|2,1,0]=4 1021 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-2399390264 [0,0,0,1,0,0|2,1,0]=4 1022 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-6405573375 [0,0,0,1,0,0|2,1,0]=4 1023 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-7590255724 [0,0,0,1,0,0|2,1,0]=4 1024 B8R1.5 O[C@@H]1CCNC[C@H]1F MCULE-8845231230 [0,0,0,1,0,0|2,1,0]=4 1025 B8R1.5 O[C@@H]1CCNC[C@H]1O MCULE-3688872623 [0,0,0,1,0,0|2,1,0]=4 1026 B8R1.5 O[C@@H]1CCNC[C@H]1O MCULE-5098984807 [0,0,0,1,0,0|2,1,0]=4 1027 B8R1.5 O[C@@H]1CCOC[C@@H]1F MCULE-1035298575 [0,0,0,1,0,0|1,1,0]=3 1028 B8R1.5 O[C@@H]1CCOC[C@@H]1F MCULE-7549327189 [0,0,0,1,0,0|1,1,0]=3 1029 B8R1.5 O[C@@H]1CCOC[C@H]1F MCULE-5919881662 [0,0,0,1,0,0|1,1,0]=3 1030 B8R1.5 O[C@@H]1CNCC[C@@H]1F MCULE-1622561753 [0,0,0,1,0,0|3,0,0]=4 1031 B8R1.5 O[C@@H]1CNCC[C@@H]1F MCULE-6945313787 [0,0,0,1,0,0|3,0,0]=4 1032 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-3612777118 [0,0,0,1,0,0|3,0,0]=4 1033 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-5621905223 [0,0,0,1,0,0|3,0,0]=4 1034 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-6188298332 [0,0,0,1,0,0|3,0,0]=4 1035 B8R1.5 O[C@@H]1CNCC[C@H]1F MCULE-7586426338 [0,0,0,1,0,0|3,0,0]=4 1036 B8R1.5 O[C@H]1CCCC[C@@H]1F MCULE-7833708338 [0,0,0,1,0,0|2,1,0]=4 1037 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-7078207162 [0,0,0,1,0,0|2,1,0]=4 1038 B8R1.5 O[C@H]1CCCC[C@@H]1O MCULE-9836847707 [0,0,0,1,0,0|2,1,0]=4 1039 B8R1.5 O[C@H]1CCCC[C@H]1Br MCULE-8133807743 [0,0,0,1,0,0|2,1,0]=4 1040 B8R1.5 O[C@H]1CCCC[C@H]1O MCULE-3539097516 [0,0,0,1,0,0|2,1,0]=4 1041 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-1808200479 [0,0,0,1,0,0|2,1,0]=4 1042 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-5879546904 [0,0,0,1,0,0|2,1,0]=4 1043 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-7720582046 [0,0,0,1,0,0|2,1,0]=4 1044 B8R1.5 O[C@H]1CCNC[C@@H]1F MCULE-9733376385 [0,0,0,1,0,0|2,1,0]=4 1045 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-1740802653 [0,0,0,1,0,0|2,1,0]=4 1046 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-5396588753 [0,0,0,1,0,0|2,1,0]=4 1047 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-6762598540 [0,0,0,1,0,0|2,1,0]=4 1048 B8R1.5 O[C@H]1CCNC[C@@H]1O MCULE-9747818285 [0,0,0,1,0,0|2,1,0]=4 1049 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-2742864171 [0,0,0,1,0,0|2,1,0]=4 1050 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-4720397627 [0,0,0,1,0,0|2,1,0]=4 1051 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-7747536704 [0,0,0,1,0,0|2,1,0]=4 1052 B8R1.5 O[C@H]1CCNC[C@H]1F MCULE-9341492038 [0,0,0,1,0,0|2,1,0]=4 1053 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-2865586489 [0,0,0,1,0,0|2,1,0]=4 1054 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-6097537639 [0,0,0,1,0,0|2,1,0]=4 1055 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-8152004203 [0,0,0,1,0,0|2,1,0]=4 1056 B8R1.5 O[C@H]1CCNC[C@H]1O MCULE-8500578666 [0,0,0,1,0,0|2,1,0]=4 1057 B8R1.5 O[C@H]1CCOC[C@@H]1F MCULE-6227313100 [0,0,0,1,0,0|1,1,0]=3 1058 B8R1.5 O[C@H]1CCOC[C@@H]1F MCULE-8454301102 [0,0,0,1,0,0|1,1,0]=3 1059 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-6598998730 [0,0,0,1,0,0|1,1,0]=3 1060 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-7224746770 [0,0,0,1,0,0|1,1,0]=3 1061 B8R1.5 O[C@H]1CCOC[C@H]1F MCULE-7648243504 [0,0,0,1,0,0|1,1,0]=3 1062 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-1003695930 [0,0,0,1,0,0|3,0,0]=4 1063 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-2595427193 [0,0,0,1,0,0|3,0,0]=4 1064 B8R1.5 O[C@H]1CNCC[C@@H]1F MCULE-4420509139 [0,0,0,1,0,0|3,0,0]=4 1065 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-1178411420 [0,0,0,1,0,0|3,0,0]=4 1066 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-1550810398 [0,0,0,1,0,0|3,0,0]=4 1067 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-9461941348 [0,0,0,1,0,0|3,0,0]=4 1068 B8R1.5 O[C@H]1CNCC[C@H]1F MCULE-9787124381 [0,0,0,1,0,0|3,0,0]=4 1069 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-2884977174 [0,0,0,1,0,0|2,1,0]=4 1070 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-4059971580 [0,0,0,1,0,0|2,1,0]=4 1071 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-4860264041 [0,0,0,1,0,0|2,1,0]=4 1072 B8R1.5 O[C@H]1CNCC[C@H]1O MCULE-5794552949 [0,0,0,1,0,0|2,1,0]=4 1073 B8R1.5 [C@@H]1(CCNC[C@@H]1F)O MCULE-4552431818 [0,0,0,1,0,0|2,1,0]=4 1074 B8R1.5 [C@@H]1(CCNC[C@@H]1F)O MCULE-6293331305 [0,0,0,1,0,0|2,1,0]=4 1075 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-3406818126 [0,0,0,1,0,0|3,0,0]=4 1076 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-4647745585 [0,0,0,1,0,0|3,0,0]=4 1077 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-8430119550 [0,0,0,1,0,0|3,0,0]=4 1078 B8R1.5 [C@@H]1(CCNC[C@H]1F)F MCULE-9944740207 [0,0,0,1,0,0|3,0,0]=4 1079 B8R1.5 [C@@H]1(CCNC[C@H]1F)O MCULE-2598494094 [0,0,0,1,0,0|2,1,0]=4 1080 B8R1.5 [C@@H]1(CCNC[C@H]1F)O MCULE-9897987946 [0,0,0,1,0,0|2,1,0]=4 1081 B8R1.5 [C@@H]1(CCNC[C@H]1O)C MCULE-2307148539 [0,0,0,1,0,0|2,1,0]=4 1082 B8R1.5 [C@@H]1(CCNC[C@H]1O)C MCULE-7550947729 [0,0,0,1,0,0|2,1,0]=4 1083 B8R1.5 [C@@H]1(CCOC[C@@H]1O)N MCULE-2201413833 [0,0,0,1,0,0|2,0,0]=3 1084 B8R1.5 [C@@H]1(CCOC[C@H]1N)O MCULE-7745052941 [0,0,0,1,0,0|1,1,0]=3 1085 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-6806325155 [0,0,0,1,0,0|3,0,0]=4 1086 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-8351727587 [0,0,0,1,0,0|3,0,0]=4 1087 B8R1.5 [C@@H]1(CNCC[C@@H]1F)O MCULE-9141886243 [0,0,0,1,0,0|3,0,0]=4 1088 B8R1.5 [C@@H]1(CNCC[C@H]1O)O MCULE-7522153539 [0,0,0,1,0,0|2,1,0]=4 1089 B8R1.5 [C@@H]1(CNCC[C@H]1O)O MCULE-8922491067 [0,0,0,1,0,0|2,1,0]=4 1090 B8R1.5 [C@@H]1(COCC[C@@H]1O)N MCULE-2864950342 [0,0,0,1,0,0|1,1,0]=3 1091 B8R1.5 [C@H]1(CCCC[C@H]1F)O MCULE-7751753244 [0,0,0,1,0,0|2,1,0]=4 1092 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-1090696163 [0,0,0,1,0,0|3,0,0]=4 1093 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-4240939724 [0,0,0,1,0,0|3,0,0]=4 1094 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-5876100632 [0,0,0,1,0,0|3,0,0]=4 1095 B8R1.5 [C@H]1(CCNC[C@H]1F)F MCULE-8358389020 [0,0,0,1,0,0|3,0,0]=4 1096 B8R1.5 [C@H]1(CCNC[C@H]1O)O MCULE-2825513554 [0,0,0,1,0,0|2,1,0]=4 1097 B8R1.5 [C@H]1(CCNC[C@H]1O)O MCULE-3902017522 [0,0,0,1,0,0|2,1,0]=4 1098 B8R1.5 [C@H]1(CCOC[C@@H]1O)N MCULE-3291339796 [0,0,0,1,0,0|2,0,0]=3 1099 B8R1.5 [C@H]1(CCOC[C@@H]1O)N MCULE-5641035715 [0,0,0,1,0,0|2,0,0]=3 1100 B8R1.5 [C@H]1(CNCC[C@H]1C)F MCULE-5914413594 [0,0,0,1,0,0|3,0,0]=4 1101 B8R1.5 [C@H]1(CNCC[C@H]1C)F MCULE-6184399583 [0,0,0,1,0,0|3,0,0]=4 1102 B8R1.5 [C@H]1(CNCC[C@H]1C)O MCULE-8053222550 [0,0,0,1,0,0|2,1,0]=4 1103 B8R1.5 [C@H]1(CNCC[C@H]1C)O MCULE-9640568177 [0,0,0,1,0,0|2,1,0]=4 1104 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-1419969909 [0,0,0,1,0,0|1,1,0]=3 1105 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-1584116117 [0,0,0,1,0,0|1,1,0]=3 1106 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-2275992252 [0,0,0,1,0,0|1,1,0]=3 1107 B8R1.5 [C@H]1(CNCC[C@H]1O)C MCULE-4151833845 [0,0,0,1,0,0|1,1,0]=3 1108 B8R1.5 [C@H]1(COCC[C@H]1N)C MCULE-2786096186 [0,0,0,1,0,0|1,0,0]=2 1109 B8R1.5 [C@H]1(COCC[C@H]1N)C MCULE-3516272365 [0,0,0,1,0,0|1,0,0]=2 1110 B8R1.5 [C@H]1(COCC[C@H]1N)O MCULE-2088495989 [0,0,0,1,0,0|2,0,0]=3 1111 B8R1.5 [C@H]1(COCC[C@H]1O)N MCULE-5409068801 [0,0,0,1,0,0|1,1,0]=3 1112 B8R1.11 C#CC1CCCC1O MCULE-6037624903 [0,0,0,1,0,0|1,1,1]=4 1113 B8R1.11 C#C[C@@H]1CCC[C@H]1O MCULE-7417393541 [0,0,0,1,0,0|1,1,1]=4 1114 B8R1.11 C#C[C@H]1CCC[C@@H]1O MCULE-6017503361 [0,0,0,1,0,0|1,1,1]=4 1115 B8R1.11 C#C[C@H]1CCC[C@H]1O MCULE-2764710000 [0,0,0,1,0,0|1,1,1]=4 1116 B8R1.11 C1(CCCN1C)CN MCULE-3823756764 [0,0,0,1,0,0|3,0,0]=4 1117 B8R1.11 C1(CCCN1C)CO MCULE-1790699840 [0,0,0,1,0,0|2,0,0]=3 1118 B8R1.11 CC1CCCC1C#N MCULE-4638858957 [0,0,0,1,0,0|2,0,1]=4 1119 B8R1.11 CC1CCCC1CN MCULE-3896736641 [0,0,0,1,0,0|2,0,0]=3 1120 B8R1.11 CC1CCCC1CN MCULE-8678978716 [0,0,0,1,0,0|2,0,0]=3 1121 B8R1.11 CC1CCCC1CO MCULE-9356546543 [0,0,0,1,0,0|1,0,0]=2 1122 B8R1.11 CC1CCNC1CO MCULE-3727613396 [0,0,0,1,0,0|2,0,0]=3 1123 B8R1.11 CC1CNCC1CN MCULE-3155679753 [0,0,0,1,0,0|3,0,0]=4 1124 B8R1.11 CC1CNCC1CN MCULE-9411859132 [0,0,0,1,0,0|3,0,0]=4 1125 B8R1.11 CC1CNCC1CO MCULE-2423357421 [0,0,0,1,0,0|2,0,0]=3 1126 B8R1.11 CC1CNCC1CO MCULE-9628020162 [0,0,0,1,0,0|2,0,0]=3 1127 B8R1.11 CC1COCC1CO MCULE-7218606126 [0,0,0,1,0,0|2,0,0]=3 1128 B8R1.11 CC1NCCC1CO MCULE-2170675444 [0,0,0,1,0,0|2,0,0]=3 1129 B8R1.11 CC1NCCC1CO MCULE-6327696584 [0,0,0,1,0,0|2,0,0]=3 1130 B8R1.11 CC1OCCC1CBr MCULE-2301764647 [0,0,0,1,0,0|3,0,0]=4 1131 B8R1.11 CC1OCCC1CN MCULE-8319428027 [0,0,0,1,0,0|3,0,0]=4 1132 B8R1.11 CC1OCCC1CN MCULE-9389911755 [0,0,0,1,0,0|3,0,0]=4 1133 B8R1.11 CC1OCCC1CO MCULE-4507531306 [0,0,0,1,0,0|2,0,0]=3 1134 B8R1.11 CCC1CCCC1=O MCULE-1884299455 [0,0,0,1,0,0|1,1,1]=4 1135 B8R1.11 CCC1CCCC1N MCULE-3368757457 [0,0,0,1,0,0|2,0,0]=3 1136 B8R1.11 CCC1CCNC1C MCULE-7900435915 [0,0,0,1,0,0|3,0,0]=4 1137 B8R1.11 CCC1CCNC1C MCULE-8779336209 [0,0,0,1,0,0|3,0,0]=4 1138 B8R1.11 CCC1CNCC1O MCULE-2095082658 [0,0,0,1,0,0|2,1,0]=4 1139 B8R1.11 CCC1COCC1=O MCULE-5486171882 [0,0,0,1,0,0|2,0,1]=4 1140 B8R1.11 CCC1COCC1N MCULE-2113082654 [0,0,0,1,0,0|2,0,0]=3 1141 B8R1.11 CCC1NCCC1C MCULE-2665209322 [0,0,0,1,0,0|2,0,0]=3 1142 B8R1.11 CCC1NCCC1C MCULE-2699257293 [0,0,0,1,0,0|2,0,0]=3 1143 B8R1.11 CCC1NCCC1O MCULE-6141963287 [0,0,0,1,0,0|2,1,0]=4 1144 B8R1.11 CCC1NCCC1O MCULE-9283391049 [0,0,0,1,0,0|2,1,0]=4 1145 B8R1.11 CCN1N=CCC1C MCULE-5040548749 [0,0,0,1,0,0|3,0,0]=4 1146 B8R1.11 CC[C@@H]1CCC[C@H]1N MCULE-6461151240 [0,0,0,1,0,0|2,0,0]=3 1147 B8R1.11 CC[C@@H]1OCC[C@H]1N MCULE-6631183888 [0,0,0,1,0,0|2,1,0]=4 1148 B8R1.11 CN1CCCC1CBr MCULE-6207314013 [0,0,0,1,0,0|3,0,0]=4 1149 B8R1.11 CN1CCCC1CBr MCULE-7003172406 [0,0,0,1,0,0|3,0,0]=4 1150 B8R1.11 CN1CCCC1CBr MCULE-8572986373 [0,0,0,1,0,0|3,0,0]=4 1151 B8R1.11 CN1CCCC1CCl MCULE-8890705455 [0,0,0,1,0,0|3,0,0]=4 1152 B8R1.11 CN1CCCC1CCl MCULE-9540416464 [0,0,0,1,0,0|3,0,0]=4 1153 B8R1.11 CN1CCCC1CI MCULE-3626178331 [0,0,0,1,0,0|3,0,0]=4 1154 B8R1.11 CN1CCCC1CN MCULE-2455567320 [0,0,0,1,0,0|3,0,0]=4 1155 B8R1.11 CN1CCCC1CN MCULE-4385272553 [0,0,0,1,0,0|3,0,0]=4 1156 B8R1.11 CN1CCCC1CN MCULE-6012303918 [0,0,0,1,0,0|3,0,0]=4 1157 B8R1.11 CN1CCCC1CO MCULE-9904095173 [0,0,0,1,0,0|2,0,0]=3 1158 B8R1.11 CN1CCC[C@@H]1CCl MCULE-5528936211 [0,0,0,1,0,0|3,0,0]=4 1159 B8R1.11 CN1CCC[C@@H]1CCl MCULE-9043086094 [0,0,0,1,0,0|3,0,0]=4 1160 B8R1.11 CN1CCC[C@@H]1CN MCULE-6894579934 [0,0,0,1,0,0|3,0,0]=4 1161 B8R1.11 CN1CCC[C@@H]1CN MCULE-9545868600 [0,0,0,1,0,0|3,0,0]=4 1162 B8R1.11 CN1CCC[C@@H]1CN MCULE-9979136465 [0,0,0,1,0,0|3,0,0]=4 1163 B8R1.11 CN1CCC[C@@H]1CO MCULE-1873370971 [0,0,0,1,0,0|2,0,0]=3 1164 B8R1.11 CN1CCC[C@@H]1CO MCULE-5652991406 [0,0,0,1,0,0|2,0,0]=3 1165 B8R1.11 CN1CCC[C@H]1CBr MCULE-2559727654 [0,0,0,1,0,0|3,0,0]=4 1166 B8R1.11 CN1CCC[C@H]1CBr MCULE-7318507406 [0,0,0,1,0,0|3,0,0]=4 1167 B8R1.11 CN1CCC[C@H]1CCl MCULE-3099742983 [0,0,0,1,0,0|3,0,0]=4 1168 B8R1.11 CN1CCC[C@H]1CCl MCULE-4078147384 [0,0,0,1,0,0|3,0,0]=4 1169 B8R1.11 CN1CCC[C@H]1CCl MCULE-4291983682 [0,0,0,1,0,0|3,0,0]=4 1170 B8R1.11 CN1CCC[C@H]1CI MCULE-5761103319 [0,0,0,1,0,0|3,0,0]=4 1171 B8R1.11 CN1CCC[C@H]1CN MCULE-5808625886 [0,0,0,1,0,0|3,0,0]=4 1172 B8R1.11 CN1CCC[C@H]1CN MCULE-7551556135 [0,0,0,1,0,0|3,0,0]=4 1173 B8R1.11 CN1CCC[C@H]1CN MCULE-8399390985 [0,0,0,1,0,0|3,0,0]=4 1174 B8R1.11 CN1CCC[C@H]1CN MCULE-9386333411 [0,0,0,1,0,0|3,0,0]=4 1175 B8R1.11 CN1CCC[C@H]1CO MCULE-4291089054 [0,0,0,1,0,0|2,0,0]=3 1176 B8R1.11 CN1CCC[C@H]1CO MCULE-8245872227 [0,0,0,1,0,0|2,0,0]=3 1177 B8R1.11 CNC1CCCC1O MCULE-9589316744 [0,0,0,1,0,0|2,1,0]=4 1178 B8R1.11 CNC1COCC1O MCULE-3213649270 [0,0,0,1,0,0|3,0,0]=4 1179 B8R1.11 CNC1COCC1O MCULE-9580482754 [0,0,0,1,0,0|3,0,0]=4 1180 B8R1.11 CN[C@@H]1CCC[C@@H]1O MCULE-5540430832 [0,0,0,1,0,0|2,1,0]=4 1181 B8R1.11 CN[C@@H]1CCC[C@H]1O MCULE-5681644013 [0,0,0,1,0,0|2,1,0]=4 1182 B8R1.11 CN[C@H]1CCC[C@@H]1O MCULE-2896940586 [0,0,0,1,0,0|2,1,0]=4 1183 B8R1.11 CN[C@H]1CCC[C@@H]1O MCULE-4568895508 [0,0,0,1,0,0|2,1,0]=4 1184 B8R1.11 CN[C@H]1CCC[C@H]1O MCULE-3676766170 [0,0,0,1,0,0|2,1,0]=4 1185 B8R1.11 CN[C@H]1COC[C@@H]1O MCULE-2473921085 [0,0,0,1,0,0|3,0,0]=4 1186 B8R1.11 CN[C@H]1COC[C@@H]1O MCULE-3126899770 [0,0,0,1,0,0|3,0,0]=4 1187 B8R1.11 CN[C@H]1COC[C@@H]1O MCULE-7521708435 [0,0,0,1,0,0|3,0,0]=4 1188 B8R1.11 CN[C@H]1COC[C@@H]1O MCULE-9503537203 [0,0,0,1,0,0|3,0,0]=4 1189 B8R1.11 COC1CCCC1Br MCULE-2771155480 [0,0,0,1,0,0|3,0,0]=4 1190 B8R1.11 COC1CCCC1N MCULE-8362175674 [0,0,0,1,0,0|3,0,0]=4 1191 B8R1.11 COC1CCCC1N MCULE-9069118012 [0,0,0,1,0,0|3,0,0]=4 1192 B8R1.11 COC1COCC1N MCULE-6188451020 [0,0,0,1,0,0|3,0,0]=4 1193 B8R1.11 COC1COCC1N MCULE-7557608634 [0,0,0,1,0,0|3,0,0]=4 1194 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-4692120885 [0,0,0,1,0,0|3,0,0]=4 1195 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-5926423252 [0,0,0,1,0,0|3,0,0]=4 1196 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-7482120389 [0,0,0,1,0,0|3,0,0]=4 1197 B8R1.11 CO[C@@H]1CCC[C@@H]1N MCULE-8564106437 [0,0,0,1,0,0|3,0,0]=4 1198 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-3230499380 [0,0,0,1,0,0|3,0,0]=4 1199 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-3289874569 [0,0,0,1,0,0|3,0,0]=4 1200 B8R1.11 CO[C@@H]1CCC[C@H]1N MCULE-6247013104 [0,0,0,1,0,0|3,0,0]=4 1201 B8R1.11 CO[C@@H]1CCC[C@H]1O MCULE-8222306700 [0,0,0,1,0,0|2,1,0]=4 1202 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-3467113726 [0,0,0,1,0,0|3,0,0]=4 1203 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-3863734761 [0,0,0,1,0,0|3,0,0]=4 1204 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-8760768893 [0,0,0,1,0,0|3,0,0]=4 1205 B8R1.11 CO[C@@H]1COC[C@@H]1N MCULE-9860387973 [0,0,0,1,0,0|3,0,0]=4 1206 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-1558766585 [0,0,0,1,0,0|3,0,0]=4 1207 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-2616949947 [0,0,0,1,0,0|3,0,0]=4 1208 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-3846862415 [0,0,0,1,0,0|3,0,0]=4 1209 B8R1.11 CO[C@@H]1COC[C@H]1N MCULE-7298485885 [0,0,0,1,0,0|3,0,0]=4 1210 B8R1.11 CO[C@@H]1COC[C@H]1O MCULE-8600684247 [0,0,0,1,0,0|3,0,0]=4 1211 B8R1.11 CO[C@H]1CCC[C@@H]1N MCULE-2030514470 [0,0,0,1,0,0|3,0,0]=4 1212 B8R1.11 CO[C@H]1CCC[C@@H]1N MCULE-7221434150 [0,0,0,1,0,0|3,0,0]=4 1213 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-5694225216 [0,0,0,1,0,0|3,0,0]=4 1214 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-6324790556 [0,0,0,1,0,0|3,0,0]=4 1215 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-7994033941 [0,0,0,1,0,0|3,0,0]=4 1216 B8R1.11 CO[C@H]1CCC[C@H]1N MCULE-9253743808 [0,0,0,1,0,0|3,0,0]=4 1217 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-4582501901 [0,0,0,1,0,0|3,0,0]=4 1218 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-8842335446 [0,0,0,1,0,0|3,0,0]=4 1219 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-9594556693 [0,0,0,1,0,0|3,0,0]=4 1220 B8R1.11 CO[C@H]1COC[C@@H]1N MCULE-9701067125 [0,0,0,1,0,0|3,0,0]=4 1221 B8R1.11 CO[C@H]1COC[C@H]1N MCULE-9067624195 [0,0,0,1,0,0|3,0,0]=4 1222 B8R1.11 CSC1CCCC1N MCULE-2843614842 [0,0,0,1,0,0|3,0,0]=4 1223 B8R1.11 C[C@@H]1CCN[C@@H]1CO MCULE-7458696223 [0,0,0,1,0,0|2,0,0]=3 1224 B8R1.11 C[C@@H]1CCN[C@H]1CO MCULE-7407237429 [0,0,0,1,0,0|2,0,0]=3 1225 B8R1.11 C[C@@H]1CNC[C@H]1CO MCULE-9810701855 [0,0,0,1,0,0|2,0,0]=3 1226 B8R1.11 C[C@@H]1NCC[C@@H]1CO MCULE-3472303985 [0,0,0,1,0,0|2,0,0]=3 1227 B8R1.11 C[C@@H]1NCC[C@H]1CO MCULE-2404886012 [0,0,0,1,0,0|2,0,0]=3 1228 B8R1.11 C[C@@H]1NCC[C@H]1CO MCULE-3480517072 [0,0,0,1,0,0|2,0,0]=3 1229 B8R1.11 C[C@@H]1NCC[C@H]1CO MCULE-5374631986 [0,0,0,1,0,0|2,0,0]=3 1230 B8R1.11 C[C@@H]1OCC[C@H]1CN MCULE-1134549336 [0,0,0,1,0,0|3,0,0]=4 1231 B8R1.11 C[C@@H]1OCC[C@H]1CN MCULE-7039232701 [0,0,0,1,0,0|3,0,0]=4 1232 B8R1.11 C[C@@H]1OCC[C@H]1CO MCULE-2815374259 [0,0,0,1,0,0|2,0,0]=3 1233 B8R1.11 C[C@H]1CCN[C@@H]1CO MCULE-9913318158 [0,0,0,1,0,0|2,0,0]=3 1234 B8R1.11 C[C@H]1CCN[C@H]1CO MCULE-4322110368 [0,0,0,1,0,0|2,0,0]=3 1235 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-2024872524 [0,0,0,1,0,0|2,0,0]=3 1236 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-3327012262 [0,0,0,1,0,0|2,0,0]=3 1237 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-4174376777 [0,0,0,1,0,0|2,0,0]=3 1238 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-4680966874 [0,0,0,1,0,0|2,0,0]=3 1239 B8R1.11 C[C@H]1CNC[C@@H]1CO MCULE-8985861060 [0,0,0,1,0,0|2,0,0]=3 1240 B8R1.11 C[C@H]1NCC[C@@H]1CO MCULE-1622957258 [0,0,0,1,0,0|2,0,0]=3 1241 B8R1.11 C[C@H]1NCC[C@H]1CO MCULE-7769712307 [0,0,0,1,0,0|2,0,0]=3 1242 B8R1.11 C[C@H]1NCC[C@H]1CO MCULE-9254010133 [0,0,0,1,0,0|2,0,0]=3 1243 B8R1.11 C[C@H]1OCC[C@H]1CN MCULE-1227545702 [0,0,0,1,0,0|3,0,0]=4 1244 B8R1.11 C[C@H]1OCC[C@H]1CN MCULE-9284060815 [0,0,0,1,0,0|3,0,0]=4 1245 B8R1.11 C[C@H]1OCC[C@H]1CO MCULE-8680094992 [0,0,0,1,0,0|2,0,0]=3 1246 B8R1.11 N#CC1CCCC1N MCULE-2657790377 [0,0,0,1,0,0|2,0,1]=4 1247 B8R1.11 N#CC1CCCC1N MCULE-3586283447 [0,0,0,1,0,0|2,0,1]=4 1248 B8R1.11 N#CC1CCCC1O MCULE-8441776059 [0,0,0,1,0,0|1,1,1]=4 1249 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-3868705638 [0,0,0,1,0,0|2,0,1]=4 1250 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-5875539247 [0,0,0,1,0,0|2,0,1]=4 1251 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-8719885109 [0,0,0,1,0,0|2,0,1]=4 1252 B8R1.11 N#C[C@@H]1CCC[C@@H]1N MCULE-9418838624 [0,0,0,1,0,0|2,0,1]=4 1253 B8R1.11 N#C[C@@H]1CCC[C@H]1O MCULE-4467355190 [0,0,0,1,0,0|1,1,1]=4 1254 B8R1.11 N#C[C@@H]1CCC[C@H]1O MCULE-8795058387 [0,0,0,1,0,0|1,1,1]=4 1255 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-3483623297 [0,0,0,1,0,0|2,0,1]=4 1256 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-3989890564 [0,0,0,1,0,0|2,0,1]=4 1257 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-8145436082 [0,0,0,1,0,0|2,0,1]=4 1258 B8R1.11 N#C[C@H]1CCC[C@H]1N MCULE-8299410277 [0,0,0,1,0,0|2,0,1]=4 1259 B8R1.11 NC1CCCC1CO MCULE-9652022908 [0,0,0,1,0,0|1,0,0]=2 1260 B8R1.11 NC1COCC1CO MCULE-6651647999 [0,0,0,1,0,0|2,0,0]=3 1261 B8R1.11 NCC1CCCC1=O MCULE-4144323636 [0,0,0,1,0,0|1,1,1]=4 1262 B8R1.11 NCC1CCCC1=O MCULE-8761719757 [0,0,0,1,0,0|1,1,1]=4 1263 B8R1.11 NCC1CCCC1F MCULE-6144218913 [0,0,0,1,0,0|2,0,0]=3 1264 B8R1.11 NCC1CCCC1F MCULE-6567537087 [0,0,0,1,0,0|2,0,0]=3 1265 B8R1.11 NCC1CCCC1N MCULE-8430269654 [0,0,0,1,0,0|2,0,0]=3 1266 B8R1.11 NCC1CCCC1O MCULE-6648305550 [0,0,0,1,0,0|1,1,0]=3 1267 B8R1.11 NCC1COCC1O MCULE-7629136815 [0,0,0,1,0,0|2,1,0]=4 1268 B8R1.11 NCC1COCC1O MCULE-9331285001 [0,0,0,1,0,0|2,1,0]=4 1269 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-1610227273 [0,0,0,1,0,0|2,0,0]=3 1270 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-1834909475 [0,0,0,1,0,0|2,0,0]=3 1271 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-2170917176 [0,0,0,1,0,0|2,0,0]=3 1272 B8R1.11 NC[C@@H]1CCC[C@H]1F MCULE-2741482456 [0,0,0,1,0,0|2,0,0]=3 1273 B8R1.11 NC[C@@H]1COC[C@@H]1O MCULE-1244186811 [0,0,0,1,0,0|2,1,0]=4 1274 B8R1.11 NC[C@@H]1COC[C@@H]1O MCULE-6610306543 [0,0,0,1,0,0|2,1,0]=4 1275 B8R1.11 NC[C@@H]1COC[C@H]1O MCULE-3050365915 [0,0,0,1,0,0|2,1,0]=4 1276 B8R1.11 NC[C@@H]1COC[C@H]1O MCULE-7562651947 [0,0,0,1,0,0|2,1,0]=4 1277 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-3389541880 [0,0,0,1,0,0|2,1,0]=4 1278 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-4457950567 [0,0,0,1,0,0|2,1,0]=4 1279 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-8588609893 [0,0,0,1,0,0|2,1,0]=4 1280 B8R1.11 NC[C@H]1COC[C@@H]1O MCULE-9441669251 [0,0,0,1,0,0|2,1,0]=4 1281 B8R1.11 NC[C@H]1COC[C@H]1O MCULE-8711391145 [0,0,0,1,0,0|2,1,0]=4 1282 B8R1.11 NC[C@H]1COC[C@H]1O MCULE-9812036421 [0,0,0,1,0,0|2,1,0]=4 1283 B8R1.11 NN1CCCC1CO MCULE-1842894120 [0,0,0,1,0,0|2,0,0]=3 1284 B8R1.11 NN1CCC[C@H]1CO MCULE-2058705707 [0,0,0,1,0,0|2,0,0]=3 1285 B8R1.11 NNC1CCCC1O MCULE-4679888412 [0,0,0,1,0,0|2,1,0]=4 1286 B8R1.11 NN[C@@H]1CCC[C@H]1O MCULE-6631597748 [0,0,0,1,0,0|2,1,0]=4 1287 B8R1.11 NN[C@@H]1CCC[C@H]1O MCULE-9568290705 [0,0,0,1,0,0|2,1,0]=4 1288 B8R1.11 N[C@@H]1CCC[C@H]1CO MCULE-7218353328 [0,0,0,1,0,0|1,0,0]=2 1289 B8R1.11 N[C@@H]1COC[C@@H]1CO MCULE-8267820303 [0,0,0,1,0,0|2,0,0]=3 1290 B8R1.11 N[C@@H]1COC[C@H]1CO MCULE-3070797384 [0,0,0,1,0,0|2,0,0]=3 1291 B8R1.11 N[C@@H]1COC[C@H]1CO MCULE-4572096805 [0,0,0,1,0,0|2,0,0]=3 1292 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-3793323277 [0,0,0,1,0,0|1,0,0]=2 1293 B8R1.11 N[C@H]1CCC[C@H]1CO MCULE-5297422093 [0,0,0,1,0,0|1,0,0]=2 1294 B8R1.11 N[C@H]1COC[C@@H]1CO MCULE-2948740480 [0,0,0,1,0,0|2,0,0]=3 1295 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-3409455124 [0,0,0,1,0,0|2,0,0]=3 1296 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-6058647833 [0,0,0,1,0,0|2,0,0]=3 1297 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-6847790594 [0,0,0,1,0,0|2,0,0]=3 1298 B8R1.11 N[C@H]1COC[C@H]1CO MCULE-8456266436 [0,0,0,1,0,0|2,0,0]=3 1299 B8R1.11 O=C1CCCC1CO MCULE-9171970685 [0,0,0,1,0,0|0,1,1]=3 1300 B8R1.11 O=C1CCCN1CO MCULE-6508920438 [0,0,0,1,0,0|1,1,1]=4 1301 B8R1.11 O=C1NCCC1CO MCULE-8442279545 [0,0,0,1,0,0|1,1,1]=4 1302 B8R1.11 O=C1NCC[C@@H]1CO MCULE-5339343040 [0,0,0,1,0,0|1,1,1]=4 1303 B8R1.11 OCC1CCCC1O MCULE-7244611817 [0,0,0,1,0,0|0,1,0]=2 1304 B8R1.11 OCC1CNCC1O MCULE-6800319532 [0,0,0,1,0,0|1,1,0]=3 1305 B8R1.11 OCC1CNCC1O MCULE-8508401397 [0,0,0,1,0,0|1,1,0]=3 1306 B8R1.11 OCC1NCCC1O MCULE-6288507636 [0,0,0,1,0,0|1,1,0]=3 1307 B8R1.11 OCC1NCCC1O MCULE-6806405470 [0,0,0,1,0,0|1,1,0]=3 1308 B8R1.11 OCC1OCCC1O MCULE-2601628372 [0,0,0,1,0,0|1,1,0]=3 1309 B8R1.11 OC[C@@H]1CNC[C@@H]1O MCULE-4006152813 [0,0,0,1,0,0|1,1,0]=3 1310 B8R1.11 OC[C@@H]1CNC[C@@H]1O MCULE-5884019743 [0,0,0,1,0,0|1,1,0]=3 1311 B8R1.11 OC[C@@H]1CNC[C@H]1O MCULE-4276332736 [0,0,0,1,0,0|1,1,0]=3 1312 B8R1.11 OC[C@@H]1CNC[C@H]1O MCULE-5570487527 [0,0,0,1,0,0|1,1,0]=3 1313 B8R1.11 OC[C@@H]1NCC[C@@H]1O MCULE-8384230507 [0,0,0,1,0,0|1,1,0]=3 1314 B8R1.11 OC[C@@H]1NCC[C@H]1O MCULE-3549294738 [0,0,0,1,0,0|1,1,0]=3 1315 B8R1.11 OC[C@H]1CNC[C@@H]1O MCULE-4150422763 [0,0,0,1,0,0|1,1,0]=3 1316 B8R1.11 OC[C@H]1CNC[C@@H]1O MCULE-4399626759 [0,0,0,1,0,0|1,1,0]=3 1317 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-1964844966 [0,0,0,1,0,0|1,1,0]=3 1318 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-2031563638 [0,0,0,1,0,0|1,1,0]=3 1319 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-5072230521 [0,0,0,1,0,0|1,1,0]=3 1320 B8R1.11 OC[C@H]1CNC[C@H]1O MCULE-6483520020 [0,0,0,1,0,0|1,1,0]=3 1321 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-3020492285 [0,0,0,1,0,0|1,1,0]=3 1322 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-4180813715 [0,0,0,1,0,0|1,1,0]=3 1323 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-8831128340 [0,0,0,1,0,0|1,1,0]=3 1324 B8R1.11 OC[C@H]1NCC[C@@H]1O MCULE-9415023769 [0,0,0,1,0,0|1,1,0]=3 1325 B8R1.11 OC[C@H]1NCC[C@H]1O MCULE-9396804561 [0,0,0,1,0,0|1,1,0]=3 1326 B8R1.11 OC[C@H]1OCC[C@@H]1O MCULE-4089527318 [0,0,0,1,0,0|1,1,0]=3 1327 B8R1.11 OC[C@H]1OCC[C@@H]1O MCULE-9198335558 [0,0,0,1,0,0|1,1,0]=3 1328 B8R1.11 [C@H]1(CCC[C@H]1CO)N MCULE-8523302139 [0,0,0,1,0,0|1,0,0]=2 1329 B8R1.11 [C@H]1(CCN[C@@H]1C)CO MCULE-8740397030 [0,0,0,1,0,0|2,0,0]=3 1330 B8R1.11 [C@H]1(CCN[C@@H]1C)CO MCULE-9648533132 [0,0,0,1,0,0|2,0,0]=3 1331 B8R1.11 [C@H]1(CCO[C@@H]1C)CN MCULE-6798476466 [0,0,0,1,0,0|3,0,0]=4 1332 B8R1.11 [C@H]1(CCO[C@@H]1C)CN MCULE-9186622307 [0,0,0,1,0,0|3,0,0]=4 1333 B8R1.11 [C@H]1(CCO[C@@H]1C)CO MCULE-5629055834 [0,0,0,1,0,0|2,0,0]=3 1334 B8R1.11 [C@H]1(COC[C@@H]1CN)O MCULE-1038770438 [0,0,0,1,0,0|2,1,0]=4 1335 B8R1.11 [C@H]1(COC[C@H]1CN)O MCULE-3362382906 [0,0,0,1,0,0|2,1,0]=4 1336 B8R1.11 [C@H]1(COC[C@H]1CN)O MCULE-8153203630 [0,0,0,1,0,0|2,1,0]=4 1337 B8R1.12 C1(CCC1CO)CO MCULE-2925182914 [0,0,0,1,0,0|2,0,0]=3 1338 B8R1.12 CCN1CCC1CN MCULE-7381187825 [0,0,0,1,0,0|3,0,0]=4 1339 B8R1.12 COC1CCC1CO MCULE-6344516762 [0,0,0,1,0,0|2,0,0]=3 1340 B8R1.12 CO[C@@H]1CC[C@H]1CO MCULE-4926952555 [0,0,0,1,0,0|2,0,0]=3 1341 B8R1.12 NCC1CCC1CN MCULE-4127003858 [0,0,0,1,0,0|3,0,0]=4 1342 B8R1.12 NC[C@@H]1CC[C@H]1CN MCULE-1825799395 [0,0,0,1,0,0|3,0,0]=4 1343 B8R1.12 NC[C@@H]1CC[C@H]1CN MCULE-8343153828 [0,0,0,1,0,0|3,0,0]=4 1344 B8R1.12 OC[C@@H]1CC[C@H]1CO MCULE-9248215797 [0,0,0,1,0,0|2,0,0]=3 1345 B8R1.12 [C@@H]1(CC[C@H]1CO)CO MCULE-3818148307 [0,0,0,1,0,0|2,0,0]=3 1346 B8R1.38 CC(C#N)C1CCC1 MCULE-9511129910 [0,0,0,1,0,0|2,0,1]=4 1347 B8R1.38 CC(C=O)C1CCC1 MCULE-5860376202 [0,0,0,1,0,0|1,0,2]=4 1348 B8R1.38 CC(CBr)C1CCC1 MCULE-1541605827 [0,0,0,1,0,0|2,0,0]=3 1349 B8R1.38 CC(CO)C1CCC1 MCULE-1784327025 [0,0,0,1,0,0|1,0,0]=2 1350 B8R1.38 CC(CO)C1CCO1 MCULE-2444675648 [0,0,0,1,0,0|0,1,0]=2 1351 B8R1.38 CC(CO)N1CCC1 MCULE-9016935520 [0,0,0,1,0,0|2,0,0]=3 1352 B8R1.38 CCC(=O)C1CCC1 MCULE-2054282062 [0,0,0,1,0,0|1,1,1]=4 1353 B8R1.38 CCC(=O)C1COC1 MCULE-2036532813 [0,0,0,1,0,0|0,1,1]=3 1354 B8R1.38 CCC(N)C1CCC1 MCULE-4148346502 [0,0,0,1,0,0|2,0,0]=3 1355 B8R1.38 CCC(N)C1CCC1 MCULE-8370575436 [0,0,0,1,0,0|2,0,0]=3 1356 B8R1.38 CCC(O)C1CCC1 MCULE-5180007399 [0,0,0,1,0,0|1,1,0]=3 1357 B8R1.38 CCC(O)C1COC1 MCULE-1846989475 [0,0,0,1,0,0|0,1,0]=2 1358 B8R1.38 CCN(C)C1CNC1 MCULE-2838031590 [0,0,0,1,0,0|3,0,0]=4 1359 B8R1.38 CCN(C)C1CNC1 MCULE-7913096427 [0,0,0,1,0,0|3,0,0]=4 1360 B8R1.38 CNC(C)C1CCC1 MCULE-8235929643 [0,0,0,1,0,0|3,0,0]=4 1361 B8R1.38 COC(=O)C1COC1 MCULE-8897565340 [0,0,0,1,0,0|1,1,1]=4 1362 B8R1.38 COC(C)C1CNC1 MCULE-5997179380 [0,0,0,1,0,0|3,0,0]=4 1363 B8R1.38 COC(C)C1CNC1 MCULE-8250860953 [0,0,0,1,0,0|3,0,0]=4 1364 B8R1.38 C[C@@H](CO)N1CCC1 MCULE-2471335655 [0,0,0,1,0,0|2,0,0]=3 1365 B8R1.38 NC(CO)C1CCC1 MCULE-1060557753 [0,0,0,1,0,0|2,0,0]=3 1366 B8R1.38 NC(CO)C1CCC1 MCULE-4732995704 [0,0,0,1,0,0|2,0,0]=3 1367 B8R1.38 NCC(N)C1CCC1 MCULE-5439532200 [0,0,0,1,0,0|3,0,0]=4 1368 B8R1.38 NCC(N)C1CCC1 MCULE-8490064832 [0,0,0,1,0,0|3,0,0]=4 1369 B8R1.38 NCC(O)C1CCC1 MCULE-3437732656 [0,0,0,1,0,0|2,1,0]=4 1370 B8R1.38 NCC(O)C1CCC1 MCULE-3764801914 [0,0,0,1,0,0|2,1,0]=4 1371 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-1191204694 [0,0,0,1,0,0|2,0,0]=3 1372 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-4280800914 [0,0,0,1,0,0|2,0,0]=3 1373 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-4912879577 [0,0,0,1,0,0|2,0,0]=3 1374 B8R1.38 N[C@@H](CO)C1CCC1 MCULE-8248389845 [0,0,0,1,0,0|2,0,0]=3 1375 B8R1.38 N[C@H](CO)C1CCC1 MCULE-2165772919 [0,0,0,1,0,0|2,0,0]=3 1376 B8R1.38 N[C@H](CO)C1CCC1 MCULE-5153627963 [0,0,0,1,0,0|2,0,0]=3 1377 B8R1.38 N[C@H](CO)C1CCC1 MCULE-5389043091 [0,0,0,1,0,0|2,0,0]=3 1378 B8R1.38 N[C@H](CO)C1CCC1 MCULE-7675577168 [0,0,0,1,0,0|2,0,0]=3 1379 B8R1.38 N[C@H](CO)C1COC1 MCULE-3365163158 [0,0,0,1,0,0|2,0,0]=3 1380 B8R1.38 N[C@H](CO)C1COC1 MCULE-4558714642 [0,0,0,1,0,0|2,0,0]=3 1381 B8R1.38 OCC(O)C1CCC1 MCULE-5695655912 [0,0,0,1,0,0|2,0,0]=3 1382 B8R1.39 CC(C#N)C1(CC1)C MCULE-3057470693 [0,0,0,1,0,0|2,0,1]=4 1383 B8R1.39 CC1(CC1)C(O)CN MCULE-6261487507 [0,0,0,1,0,0|2,1,0]=4 1384 B8R1.39 CC1(CC1)C(O)CO MCULE-9588411733 [0,0,0,1,0,0|2,0,0]=3 1385 B8R1.39 CNC(C)C1(CC1)C MCULE-3465029614 [0,0,0,1,0,0|3,0,0]=4 1386 B8R1.39 COC(=O)C1(CO1)C MCULE-9345493771 [0,0,0,1,0,0|1,1,1]=4 1387 B8R1.39 OCC(O)C1(CC1)F MCULE-2454090628 [0,0,0,1,0,0|2,0,0]=3 1388 B8R1.50 CC1C(CCN1C)N MCULE-9387568843 [0,0,0,1,0,0|3,0,0]=4 1389 B8R1.50 CC1CCC(C1=O)C MCULE-1473375660 [0,0,0,1,0,0|1,1,1]=4 1390 B8R1.50 CC1CCC(C1N)C MCULE-5534270110 [0,0,0,1,0,0|2,0,0]=3 1391 B8R1.50 CC1CCC(C1N)C MCULE-9569539393 [0,0,0,1,0,0|2,0,0]=3 1392 B8R1.50 CC1CCC(C1O)O MCULE-3292232581 [0,0,0,1,0,0|2,0,0]=3 1393 B8R1.50 CC1OCC(=O)C1C MCULE-5834923125 [0,0,0,1,0,0|2,0,1]=4 1394 B8R1.50 CN1C(=O)CCC1O MCULE-1070053575 [0,0,0,1,0,0|1,1,1]=4 1395 B8R1.50 NC1CCC(C1O)O MCULE-2902511864 [0,0,0,1,0,0|2,0,0]=3 1396 B8R1.50 NC1CCC(C1O)O MCULE-2997796956 [0,0,0,1,0,0|2,0,0]=3 1397 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-4654712954 [0,0,0,1,0,0|2,0,0]=3 1398 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-4756579413 [0,0,0,1,0,0|2,0,0]=3 1399 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-5386854672 [0,0,0,1,0,0|2,0,0]=3 1400 B8R1.50 N[C@@H]1CC[C@@H]([C@H]1O)O MCULE-8517121727 [0,0,0,1,0,0|2,0,0]=3 1401 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-1001347318 [0,0,0,1,0,0|2,0,0]=3 1402 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-3161518566 [0,0,0,1,0,0|2,0,0]=3 1403 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-8097854840 [0,0,0,1,0,0|2,0,0]=3 1404 B8R1.50 N[C@@H]1CC[C@H]([C@@H]1O)O MCULE-9614047785 [0,0,0,1,0,0|2,0,0]=3 1405 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-3397642974 [0,0,0,1,0,0|2,0,0]=3 1406 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-5620525999 [0,0,0,1,0,0|2,0,0]=3 1407 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-8393185418 [0,0,0,1,0,0|2,0,0]=3 1408 B8R1.50 N[C@@H]1CC[C@H]([C@H]1O)O MCULE-9763920178 [0,0,0,1,0,0|2,0,0]=3 1409 B8R1.50 OC1COC(C1O)O MCULE-2562953459 [0,0,0,1,0,0|2,1,0]=4 1410 B8R1.50 OC1OC[C@@H]([C@H]1O)O MCULE-4484765937 [0,0,0,1,0,0|2,1,0]=4 1411 B8R1.50 OC1OC[C@H]([C@@H]1O)O MCULE-4663451850 [0,0,0,1,0,0|2,1,0]=4 1412 B8R1.58 CCC1(CCC1=O)C MCULE-1365656204 [0,0,0,1,0,0|1,1,1]=4 1413 B8R1.58 CN1CCC1(C)CO MCULE-5575447175 [0,0,0,1,0,0|2,0,0]=3 1414 B8R1.58 CN1CCC1(C)CO MCULE-5625722356 [0,0,0,1,0,0|2,0,0]=3 1415 B8R1.83 CCC(=O)C1CC1C MCULE-4552256059 [0,0,0,1,0,0|1,1,1]=4 1416 B8R1.83 CCC(N)C1CC1C MCULE-5927058941 [0,0,0,1,0,0|2,0,0]=3 1417 B8R0.19 CC(CCl)OC(C)CCl MCULE-4521836322 [0,0,0,0,0,1|3,0,0]=4 1418 B8R0.19 CC(CO)CC(C)CO MCULE-5101558507 [0,0,0,0,0,1|2,0,0]=3 1419 B8R0.19 CC(CO)NC(=O)CCl MCULE-8321254604 [0,0,0,0,0,1|1,1,1]=4 1420 B8R0.19 CC(CO)NC(C)CO MCULE-9592229965 [0,0,0,0,0,1|2,0,0]=3 1421 B8R0.19 CC(CO)N[C@H](C)CO MCULE-4785692482 [0,0,0,0,0,1|2,0,0]=3 1422 B8R0.19 CC(CO)OC(C)CO MCULE-3894293331 [0,0,0,0,0,1|2,0,0]=3 1423 B8R0.19 CC(CO)OC(C)CO MCULE-7387498325 [0,0,0,0,0,1|2,0,0]=3 1424 B8R0.19 CCC(=O)CC(C)CC MCULE-8568086135 [0,0,0,0,0,1|1,1,1]=4 1425 B8R0.19 CCC(=O)OC(C)CC MCULE-9589388650 [0,0,0,0,0,1|1,1,1]=4 1426 B8R0.19 CCC(C)CC(C)CBr MCULE-5879530879 [0,0,0,0,0,1|2,0,0]=3 1427 B8R0.19 CCC(C)CC(C)CC MCULE-3505575425 [0,0,0,0,0,1|2,0,0]=3 1428 B8R0.19 CCC(C)CC(C)CO MCULE-5737704972 [0,0,0,0,0,1|1,0,0]=2 1429 B8R0.19 CCC(C)CC(N)CO MCULE-5344165944 [0,0,0,0,0,1|2,0,0]=3 1430 B8R0.19 CCC(C)CC(N)CO MCULE-6408946943 [0,0,0,0,0,1|2,0,0]=3 1431 B8R0.19 CCC(C)CC(O)CC MCULE-9706306627 [0,0,0,0,0,1|1,1,0]=3 1432 B8R0.19 CCC(C)NC(C)CC MCULE-8710688298 [0,0,0,0,0,1|2,0,0]=3 1433 B8R0.19 CCC(C)OC(C)CC MCULE-7742835008 [0,0,0,0,0,1|2,0,0]=3 1434 B8R0.19 CCC(C)SC(C)CC MCULE-4171706949 [0,0,0,0,0,1|2,0,0]=3 1435 B8R0.19 CCC(N)CC(C)CO MCULE-9757770228 [0,0,0,0,0,1|1,0,0]=2 1436 B8R0.19 CCC(O)OC(O)CC MCULE-9298226682 [0,0,0,0,0,1|2,1,0]=4 1437 B8R0.19 CCN(C)CC(C)CN MCULE-9502113012 [0,0,0,0,0,1|3,0,0]=4 1438 B8R0.19 CC[C@@H](O)C[C@H](O)CC MCULE-8992338479 [0,0,0,0,0,1|2,1,0]=4 1439 B8R0.19 CC[C@H](O)C[C@@H](O)CC MCULE-4286526192 [0,0,0,0,0,1|2,1,0]=4 1440 B5R0.1 C#CCC(C)C MCULE-2506063278 [2,0,0,0,0,0|0,0,2]=4 1441 B5R0.1 C#CCC(C)O MCULE-2487589857 [2,0,0,0,0,0|0,0,2]=4 1442 B5R0.1 C(C)(N)CCC MCULE-4800297905 [2,0,0,0,0,0|1,0,0]=3 1443 B5R0.1 C(C)(N)CCC MCULE-7674864567 [2,0,0,0,0,0|1,0,0]=3 1444 B5R0.1 C(C)(N)CCO MCULE-5545469271 [2,0,0,0,0,0|1,0,0]=3 1445 B5R0.1 C/C=C/C(C)C MCULE-8705863155 [2,0,0,0,0,0|0,0,2]=4 1446 B5R0.1 C/C=C/C(C)O MCULE-3191147789 [2,0,0,0,0,0|0,0,2]=4 1447 B5R0.1 C=C(C)CCC MCULE-8225129744 [2,0,0,0,0,0|0,0,2]=4 1448 B5R0.1 C=C(C)CCO MCULE-2689800711 [2,0,0,0,0,0|1,0,1]=4 1449 B5R0.1 C=CCC(C)C MCULE-4586731422 [2,0,0,0,0,0|0,0,2]=4 1450 B5R0.1 C=CCC(C)O MCULE-7724200334 [2,0,0,0,0,0|0,0,2]=4 1451 B5R0.1 C=CCC(C)O MCULE-9910771503 [2,0,0,0,0,0|0,0,2]=4 1452 B5R0.1 C=CC[C@@H](C)O MCULE-1663575568 [2,0,0,0,0,0|0,0,2]=4 1453 B5R0.1 C=CC[C@@H](C)O MCULE-3971480179 [2,0,0,0,0,0|0,0,2]=4 1454 B5R0.1 C=CC[C@H](C)O MCULE-5783959808 [2,0,0,0,0,0|0,0,2]=4 1455 B5R0.1 C=CC[C@H](C)O MCULE-6146696600 [2,0,0,0,0,0|0,0,2]=4 1456 B5R0.1 CC#CC(C)C MCULE-9841369985 [2,0,0,0,0,0|0,0,2]=4 1457 B5R0.1 CC#CC(C)O MCULE-5523814936 [2,0,0,0,0,0|0,0,2]=4 1458 B5R0.1 CC(=O)CCO MCULE-6328537335 [2,0,0,0,0,0|0,1,1]=4 1459 B5R0.1 CC(Br)CCBr MCULE-1045475402 [2,0,0,0,0,0|2,0,0]=4 1460 B5R0.1 CC(C)CC#N MCULE-4346986727 [2,0,0,0,0,0|1,0,1]=4 1461 B5R0.1 CC(C)CC=O MCULE-2939497534 [2,0,0,0,0,0|1,0,1]=4 1462 B5R0.1 CC(C)CCBr MCULE-7163010428 [2,0,0,0,0,0|1,0,0]=3 1463 B5R0.1 CC(C)CCCl MCULE-8360122696 [2,0,0,0,0,0|1,0,0]=3 1464 B5R0.1 CC(C)CCCl MCULE-9017922949 [2,0,0,0,0,0|1,0,0]=3 1465 B5R0.1 CC(C)CCI MCULE-4934529500 [2,0,0,0,0,0|1,0,0]=3 1466 B5R0.1 CC(C)CCN MCULE-3081003576 [2,0,0,0,0,0|1,0,0]=3 1467 B5R0.1 CC(C)CCN MCULE-5118782389 [2,0,0,0,0,0|1,0,0]=3 1468 B5R0.1 CC(C)CCN MCULE-5217981670 [2,0,0,0,0,0|1,0,0]=3 1469 B5R0.1 CC(C)CCN MCULE-6280940933 [2,0,0,0,0,0|1,0,0]=3 1470 B5R0.1 CC(C)CCO MCULE-7411270401 [2,0,0,0,0,0|1,0,0]=3 1471 B5R0.1 CC(C)CCS MCULE-7115473363 [2,0,0,0,0,0|1,0,0]=3 1472 B5R0.1 CC(C)CNN MCULE-6797887001 [2,0,0,0,0,0|2,0,0]=4 1473 B5R0.1 CC(C)CNN MCULE-9592971233 [2,0,0,0,0,0|2,0,0]=4 1474 B5R0.1 CC(C)CNN MCULE-9725792452 [2,0,0,0,0,0|2,0,0]=4 1475 B5R0.1 CC(C)CON MCULE-3476786246 [2,0,0,0,0,0|2,0,0]=4 1476 B5R0.1 CC(C)CON MCULE-4450654727 [2,0,0,0,0,0|2,0,0]=4 1477 B5R0.1 CC(C)OCCl MCULE-3680602217 [2,0,0,0,0,0|2,0,0]=4 1478 B5R0.1 CC(C)SCCl MCULE-3836735379 [2,0,0,0,0,0|2,0,0]=4 1479 B5R0.1 CC(Cl)CCCl MCULE-3656498608 [2,0,0,0,0,0|2,0,0]=4 1480 B5R0.1 CC(Cl)CCO MCULE-1955496242 [2,0,0,0,0,0|1,0,0]=3 1481 B5R0.1 CC(F)CCBr MCULE-3035340901 [2,0,0,0,0,0|2,0,0]=4 1482 B5R0.1 CC(F)CCI MCULE-6469250150 [2,0,0,0,0,0|2,0,0]=4 1483 B5R0.1 CC(F)CCN MCULE-2805813131 [2,0,0,0,0,0|2,0,0]=4 1484 B5R0.1 CC(F)CCN MCULE-5849913362 [2,0,0,0,0,0|2,0,0]=4 1485 B5R0.1 CC(N)CCN MCULE-5308134596 [2,0,0,0,0,0|2,0,0]=4 1486 B5R0.1 CC(N)CCN MCULE-5880045507 [2,0,0,0,0,0|2,0,0]=4 1487 B5R0.1 CC(N)CCN MCULE-7827515430 [2,0,0,0,0,0|2,0,0]=4 1488 B5R0.1 CC(N)CCO MCULE-1771399942 [2,0,0,0,0,0|1,0,0]=3 1489 B5R0.1 CC(N)CCO MCULE-7239872808 [2,0,0,0,0,0|1,0,0]=3 1490 B5R0.1 CC(O)CC#N MCULE-7172428142 [2,0,0,0,0,0|1,0,1]=4 1491 B5R0.1 CC(O)CCBr MCULE-7983169885 [2,0,0,0,0,0|1,0,0]=3 1492 B5R0.1 CC(O)CCCl MCULE-2952545606 [2,0,0,0,0,0|1,0,0]=3 1493 B5R0.1 CC(O)CCN MCULE-6836791276 [2,0,0,0,0,0|1,0,0]=3 1494 B5R0.1 CC(O)CCN MCULE-7186260925 [2,0,0,0,0,0|1,0,0]=3 1495 B5R0.1 CC(O)CCO MCULE-1694239851 [2,0,0,0,0,0|0,1,0]=3 1496 B5R0.1 CC(O)CCO MCULE-7784884948 [2,0,0,0,0,0|0,1,0]=3 1497 B5R0.1 CC(O)CNN MCULE-4956670781 [2,0,0,0,0,0|2,0,0]=4 1498 B5R0.1 CC(O)CNN MCULE-7917439573 [2,0,0,0,0,0|2,0,0]=4 1499 B5R0.1 CC(O)CON MCULE-1051091134 [2,0,0,0,0,0|2,0,0]=4 1500 B5R0.1 CC(O)CON MCULE-6722092589 [2,0,0,0,0,0|2,0,0]=4 1501 B5R0.1 CC(S)CCO MCULE-5702212503 [2,0,0,0,0,0|0,0,0]=2 1502 B5R0.1 CC=CC(C)C MCULE-9898453837 [2,0,0,0,0,0|0,0,2]=4 1503 B5R0.1 CC=CC(C)O MCULE-4806592836 [2,0,0,0,0,0|0,0,2]=4 1504 B5R0.1 CCC=C(C)C MCULE-2405063894 [2,0,0,0,0,0|0,0,2]=4 1505 B5R0.1 CCCB(O)O MCULE-4994980798 [2,0,0,0,0,0|2,0,0]=4 1506 B5R0.1 CCCC(=O)C MCULE-7174095676 [2,0,0,0,0,0|0,0,2]=4 1507 B5R0.1 CCCC(=O)O MCULE-4116382006 [2,0,0,0,0,0|1,0,1]=4 1508 B5R0.1 CCCC(=S)O MCULE-3382199964 [2,0,0,0,0,0|1,0,1]=4 1509 B5R0.1 CCCC(C)Br MCULE-3178073667 [2,0,0,0,0,0|1,0,0]=3 1510 B5R0.1 CCCC(C)C MCULE-9604552974 [2,0,0,0,0,0|0,0,0]=2 1511 B5R0.1 CCCC(C)N MCULE-2640298430 [2,0,0,0,0,0|1,0,0]=3 1512 B5R0.1 CCCC(C)N MCULE-7225905167 [2,0,0,0,0,0|1,0,0]=3 1513 B5R0.1 CCCC(C)O MCULE-8205906299 [2,0,0,0,0,0|0,0,0]=2 1514 B5R0.1 CCCC(C)S MCULE-1649095713 [2,0,0,0,0,0|0,1,0]=3 1515 B5R0.1 CCCC(O)Cl MCULE-3188577082 [2,0,0,0,0,0|1,0,0]=3 1516 B5R0.1 CCCN(C)C MCULE-8702643596 [2,0,0,0,0,0|1,0,0]=3 1517 B5R0.1 CCC[C@@H](C)N MCULE-2394536966 [2,0,0,0,0,0|1,0,0]=3 1518 B5R0.1 CCC[C@@H](C)N MCULE-3008898216 [2,0,0,0,0,0|1,0,0]=3 1519 B5R0.1 CCC[C@@H](C)N MCULE-5656861143 [2,0,0,0,0,0|1,0,0]=3 1520 B5R0.1 CCC[C@@H](C)N MCULE-8113159645 [2,0,0,0,0,0|1,0,0]=3 1521 B5R0.1 CCC[C@@H](C)O MCULE-1540573875 [2,0,0,0,0,0|0,0,0]=2 1522 B5R0.1 CCC[C@H](C)N MCULE-2068574015 [2,0,0,0,0,0|1,0,0]=3 1523 B5R0.1 CCC[C@H](C)N MCULE-3439133019 [2,0,0,0,0,0|1,0,0]=3 1524 B5R0.1 CCC[C@H](C)N MCULE-5495177657 [2,0,0,0,0,0|1,0,0]=3 1525 B5R0.1 CCC[C@H](C)N MCULE-7962028651 [2,0,0,0,0,0|1,0,0]=3 1526 B5R0.1 CCC[C@H](C)O MCULE-6976816276 [2,0,0,0,0,0|0,0,0]=2 1527 B5R0.1 CCNC(C)C MCULE-8064118469 [2,0,0,0,0,0|1,0,0]=3 1528 B5R0.1 CCOC(C)C MCULE-1934548340 [2,0,0,0,0,0|1,0,0]=3 1529 B5R0.1 CCOC(C)Cl MCULE-8486994638 [2,0,0,0,0,0|2,0,0]=4 1530 B5R0.1 CCSC(C)C MCULE-3738251898 [2,0,0,0,0,0|1,0,0]=3 1531 B5R0.1 CN(C)CCBr MCULE-4844398053 [2,0,0,0,0,0|2,0,0]=4 1532 B5R0.1 CN(C)CCCl MCULE-4297554717 [2,0,0,0,0,0|2,0,0]=4 1533 B5R0.1 CN(C)CCCl MCULE-4465544992 [2,0,0,0,0,0|2,0,0]=4 1534 B5R0.1 CN(C)CCI MCULE-4687894526 [2,0,0,0,0,0|2,0,0]=4 1535 B5R0.1 CN(C)CCI MCULE-7464680246 [2,0,0,0,0,0|2,0,0]=4 1536 B5R0.1 CN(C)CCI MCULE-9051868668 [2,0,0,0,0,0|2,0,0]=4 1537 B5R0.1 CN(C)CCN MCULE-6693759372 [2,0,0,0,0,0|2,0,0]=4 1538 B5R0.1 CN(C)CCN MCULE-6929925748 [2,0,0,0,0,0|2,0,0]=4 1539 B5R0.1 CN(C)CCN MCULE-7881547574 [2,0,0,0,0,0|2,0,0]=4 1540 B5R0.1 CN(C)CCO MCULE-5715813465 [2,0,0,0,0,0|2,0,0]=4 1541 B5R0.1 CN(C)CCO MCULE-7567469160 [2,0,0,0,0,0|2,0,0]=4 1542 B5R0.1 CN(C)CCO MCULE-9024108074 [2,0,0,0,0,0|2,0,0]=4 1543 B5R0.1 CN(C)CCS MCULE-4356815596 [2,0,0,0,0,0|2,0,0]=4 1544 B5R0.1 CN(C)CCS MCULE-4611688723 [2,0,0,0,0,0|2,0,0]=4 1545 B5R0.1 CN(C)CCS MCULE-6259585517 [2,0,0,0,0,0|2,0,0]=4 1546 B5R0.1 CNCC(C)C MCULE-6582386339 [2,0,0,0,0,0|1,0,0]=3 1547 B5R0.1 CNCC(C)C MCULE-6856717783 [2,0,0,0,0,0|1,0,0]=3 1548 B5R0.1 CNCC(C)F MCULE-4381138647 [2,0,0,0,0,0|2,0,0]=4 1549 B5R0.1 CNCC(C)F MCULE-9018181183 [2,0,0,0,0,0|2,0,0]=4 1550 B5R0.1 CNCC(C)O MCULE-3671071529 [2,0,0,0,0,0|1,0,0]=3 1551 B5R0.1 CNCC(C)O MCULE-4171705304 [2,0,0,0,0,0|1,0,0]=3 1552 B5R0.1 CNC[C@@H](C)O MCULE-2953164520 [2,0,0,0,0,0|1,0,0]=3 1553 B5R0.1 CNC[C@@H](C)O MCULE-3161721140 [2,0,0,0,0,0|1,0,0]=3 1554 B5R0.1 CNC[C@@H](C)O MCULE-6218150837 [2,0,0,0,0,0|1,0,0]=3 1555 B5R0.1 CNC[C@@H](C)O MCULE-8245274547 [2,0,0,0,0,0|1,0,0]=3 1556 B5R0.1 CNC[C@H](C)O MCULE-2655303492 [2,0,0,0,0,0|1,0,0]=3 1557 B5R0.1 CNC[C@H](C)O MCULE-7346940457 [2,0,0,0,0,0|1,0,0]=3 1558 B5R0.1 COCC(C)Br MCULE-6850689931 [2,0,0,0,0,0|2,0,0]=4 1559 B5R0.1 COCC(C)I MCULE-8608265714 [2,0,0,0,0,0|2,0,0]=4 1560 B5R0.1 COCC(C)N MCULE-1896873634 [2,0,0,0,0,0|2,0,0]=4 1561 B5R0.1 COCC(C)N MCULE-2549420211 [2,0,0,0,0,0|2,0,0]=4 1562 B5R0.1 COCC(C)N MCULE-3490410444 [2,0,0,0,0,0|2,0,0]=4 1563 B5R0.1 COCC(C)N MCULE-7089888882 [2,0,0,0,0,0|2,0,0]=4 1564 B5R0.1 COCC(C)O MCULE-4022733014 [2,0,0,0,0,0|1,0,0]=3 1565 B5R0.1 COCC(C)O MCULE-7513310960 [2,0,0,0,0,0|1,0,0]=3 1566 B5R0.1 COCN(C)C MCULE-1963225930 [2,0,0,0,0,0|2,0,0]=4 1567 B5R0.1 COC[C@@H](C)N MCULE-1225912236 [2,0,0,0,0,0|2,0,0]=4 1568 B5R0.1 COC[C@@H](C)N MCULE-2754628271 [2,0,0,0,0,0|2,0,0]=4 1569 B5R0.1 COC[C@@H](C)N MCULE-4676764915 [2,0,0,0,0,0|2,0,0]=4 1570 B5R0.1 COC[C@@H](C)N MCULE-8891950737 [2,0,0,0,0,0|2,0,0]=4 1571 B5R0.1 COC[C@@H](C)O MCULE-6287552520 [2,0,0,0,0,0|1,0,0]=3 1572 B5R0.1 COC[C@@H](C)O MCULE-7942118801 [2,0,0,0,0,0|1,0,0]=3 1573 B5R0.1 COC[C@H](C)N MCULE-2465679418 [2,0,0,0,0,0|2,0,0]=4 1574 B5R0.1 COC[C@H](C)N MCULE-2998593539 [2,0,0,0,0,0|2,0,0]=4 1575 B5R0.1 COC[C@H](C)N MCULE-3161045661 [2,0,0,0,0,0|2,0,0]=4 1576 B5R0.1 COC[C@H](C)N MCULE-9550165578 [2,0,0,0,0,0|2,0,0]=4 1577 B5R0.1 COC[C@H](C)O MCULE-5908531683 [2,0,0,0,0,0|1,0,0]=3 1578 B5R0.1 COC[C@H](C)O MCULE-8619138238 [2,0,0,0,0,0|1,0,0]=3 1579 B5R0.1 CS(=O)CCO MCULE-8331553582 [2,0,0,0,0,0|1,1,0]=4 1580 B5R0.1 CSCC(C)N MCULE-7985946030 [2,0,0,0,0,0|2,0,0]=4 1581 B5R0.1 CSCC(C)O MCULE-2227652351 [2,0,0,0,0,0|1,0,0]=3 1582 B5R0.1 CSCN(C)C MCULE-2931143051 [2,0,0,0,0,0|2,0,0]=4 1583 B5R0.1 C[C@@H](N)CCO MCULE-4224878672 [2,0,0,0,0,0|1,0,0]=3 1584 B5R0.1 C[C@@H](N)CCO MCULE-5727539473 [2,0,0,0,0,0|1,0,0]=3 1585 B5R0.1 C[C@@H](O)CC#N MCULE-2879004464 [2,0,0,0,0,0|1,0,1]=4 1586 B5R0.1 C[C@@H](O)CCN MCULE-7588849994 [2,0,0,0,0,0|1,0,0]=3 1587 B5R0.1 C[C@@H](O)CCN MCULE-7895006310 [2,0,0,0,0,0|1,0,0]=3 1588 B5R0.1 C[C@@H](O)CCN MCULE-9071323255 [2,0,0,0,0,0|1,0,0]=3 1589 B5R0.1 C[C@@H](O)CCN MCULE-9627550610 [2,0,0,0,0,0|1,0,0]=3 1590 B5R0.1 C[C@@H](O)CCO MCULE-6277947442 [2,0,0,0,0,0|0,1,0]=3 1591 B5R0.1 C[C@@H](O)CCO MCULE-9742368348 [2,0,0,0,0,0|0,1,0]=3 1592 B5R0.1 C[C@@H](O)CON MCULE-3740397343 [2,0,0,0,0,0|2,0,0]=4 1593 B5R0.1 C[C@@H](O)CON MCULE-8274376872 [2,0,0,0,0,0|2,0,0]=4 1594 B5R0.1 C[C@H](N)CCO MCULE-1496375567 [2,0,0,0,0,0|1,0,0]=3 1595 B5R0.1 C[C@H](N)CCO MCULE-4744824708 [2,0,0,0,0,0|1,0,0]=3 1596 B5R0.1 C[C@H](N)CCO MCULE-7219173683 [2,0,0,0,0,0|1,0,0]=3 1597 B5R0.1 C[C@H](N)CCO MCULE-9164942837 [2,0,0,0,0,0|1,0,0]=3 1598 B5R0.1 C[C@H](O)CC#N MCULE-1968982761 [2,0,0,0,0,0|1,0,1]=4 1599 B5R0.1 C[C@H](O)CCN MCULE-7570743309 [2,0,0,0,0,0|1,0,0]=3 1600 B5R0.1 C[C@H](O)CCN MCULE-9428853702 [2,0,0,0,0,0|1,0,0]=3 1601 B5R0.1 C[C@H](O)CCO MCULE-2504912618 [2,0,0,0,0,0|0,1,0]=3 1602 B5R0.1 C[C@H](O)CCO MCULE-2958119786 [2,0,0,0,0,0|0,1,0]=3 1603 B5R0.1 C[C@H](O)CON MCULE-4216605221 [2,0,0,0,0,0|2,0,0]=4 1604 B5R0.1 C[C@H](O)CON MCULE-9863094719 [2,0,0,0,0,0|2,0,0]=4 1605 B5R0.1 C[NH+](C)CCBr MCULE-4990293495 [2,0,0,0,0,0|2,0,0]=4 1606 B5R0.1 C[S+](C)CCCl MCULE-1305595131 [2,0,0,0,0,0|2,0,0]=4 1607 B5R0.1 C[S+](C)CCCl MCULE-9761617787 [2,0,0,0,0,0|2,0,0]=4 1608 B5R0.1 C[S@@](=O)CCO MCULE-4485824334 [2,0,0,0,0,0|1,1,0]=4 1609 B5R0.1 OCCC(F)F MCULE-9207688926 [2,0,0,0,0,0|2,0,0]=4 1610 B5R0.1 [C@@H](C)(O)CCC MCULE-9717120293 [2,0,0,0,0,0|0,0,0]=2 1611 B5R0.1 [C@@H](C)(O)CNC MCULE-2044067921 [2,0,0,0,0,0|1,0,0]=3 1612 B5R0.1 [C@H](C)(O)CC#N MCULE-6894178072 [2,0,0,0,0,0|1,0,1]=4 1613 B5R0.1 [C@H](C)(O)CCC MCULE-2689023898 [2,0,0,0,0,0|0,0,0]=2 1614 B5R0.2 BrCCCCBr MCULE-5088378536 [2,0,0,0,0,0|2,0,0]=4 1615 B5R0.2 C#CCCCC MCULE-5706969297 [2,0,0,0,0,0|1,0,1]=4 1616 B5R0.2 C#CCCCO MCULE-6360852809 [2,0,0,0,0,0|0,0,2]=4 1617 B5R0.2 C/C=C/CCO MCULE-3952855392 [2,0,0,0,0,0|0,0,2]=4 1618 B5R0.2 C=CCCCC MCULE-4750698031 [2,0,0,0,0,0|1,0,1]=4 1619 B5R0.2 C=CCCCO MCULE-5946342321 [2,0,0,0,0,0|0,0,2]=4 1620 B5R0.2 CC#CCCO MCULE-9400138491 [2,0,0,0,0,0|0,0,2]=4 1621 B5R0.2 CC/C=C\CO MCULE-5480473249 [2,0,0,0,0,0|0,0,2]=4 1622 B5R0.2 CC=CCCO MCULE-4302367089 [2,0,0,0,0,0|0,0,2]=4 1623 B5R0.2 CCC#CCO MCULE-8633965917 [2,0,0,0,0,0|0,0,2]=4 1624 B5R0.2 CCC=CCO MCULE-5633399984 [2,0,0,0,0,0|0,0,2]=4 1625 B5R0.2 CCCC=NO MCULE-7364375780 [2,0,0,0,0,0|1,0,1]=4 1626 B5R0.2 CCCCC#N MCULE-4015236167 [2,0,0,0,0,0|1,0,1]=4 1627 B5R0.2 CCCCC=O MCULE-4736782822 [2,0,0,0,0,0|0,0,2]=4 1628 B5R0.2 CCCCCBr MCULE-8513521912 [2,0,0,0,0,0|1,0,0]=3 1629 B5R0.2 CCCCCC MCULE-3465692202 [2,0,0,0,0,0|1,0,0]=3 1630 B5R0.2 CCCCCCl MCULE-4412759460 [2,0,0,0,0,0|1,0,0]=3 1631 B5R0.2 CCCCCF MCULE-6399883281 [2,0,0,0,0,0|1,0,0]=3 1632 B5R0.2 CCCCCI MCULE-4590300793 [2,0,0,0,0,0|1,0,0]=3 1633 B5R0.2 CCCCCN MCULE-3371742982 [2,0,0,0,0,0|1,0,0]=3 1634 B5R0.2 CCCCCN MCULE-4371067300 [2,0,0,0,0,0|1,0,0]=3 1635 B5R0.2 CCCCCN MCULE-6547961798 [2,0,0,0,0,0|1,0,0]=3 1636 B5R0.2 CCCCCN MCULE-7483248760 [2,0,0,0,0,0|1,0,0]=3 1637 B5R0.2 CCCCCO MCULE-8714292632 [2,0,0,0,0,0|0,0,0]=2 1638 B5R0.2 CCCCCS MCULE-5476379340 [2,0,0,0,0,0|0,1,0]=3 1639 B5R0.2 CCCCNC MCULE-9321610906 [2,0,0,0,0,0|2,0,0]=4 1640 B5R0.2 CCCCNN MCULE-6681305566 [2,0,0,0,0,0|2,0,0]=4 1641 B5R0.2 CCCCNN MCULE-6890760890 [2,0,0,0,0,0|2,0,0]=4 1642 B5R0.2 CCCCNN MCULE-7362497327 [2,0,0,0,0,0|2,0,0]=4 1643 B5R0.2 CCCCNN MCULE-8463623644 [2,0,0,0,0,0|2,0,0]=4 1644 B5R0.2 CCCCNO MCULE-1911206569 [2,0,0,0,0,0|1,0,0]=3 1645 B5R0.2 CCCCNO MCULE-3820646216 [2,0,0,0,0,0|1,0,0]=3 1646 B5R0.2 CCCCOC MCULE-9814272675 [2,0,0,0,0,0|2,0,0]=4 1647 B5R0.2 CCCCON MCULE-7582349983 [2,0,0,0,0,0|2,0,0]=4 1648 B5R0.2 CCCCON MCULE-8175627798 [2,0,0,0,0,0|2,0,0]=4 1649 B5R0.2 CCCCSC MCULE-2799775567 [2,0,0,0,0,0|2,0,0]=4 1650 B5R0.2 CCCNCC MCULE-7948828264 [2,0,0,0,0,0|2,0,0]=4 1651 B5R0.2 CCCNCC MCULE-9107549207 [2,0,0,0,0,0|2,0,0]=4 1652 B5R0.2 CCCOCBr MCULE-3585683043 [2,0,0,0,0,0|2,0,0]=4 1653 B5R0.2 CCCOCC MCULE-9971916790 [2,0,0,0,0,0|2,0,0]=4 1654 B5R0.2 CCCOCCl MCULE-1932627202 [2,0,0,0,0,0|2,0,0]=4 1655 B5R0.2 CCCSCC MCULE-4547385568 [2,0,0,0,0,0|2,0,0]=4 1656 B5R0.2 CCNCCCl MCULE-2589770119 [2,0,0,0,0,0|2,0,0]=4 1657 B5R0.2 CCNCCCl MCULE-3098032672 [2,0,0,0,0,0|2,0,0]=4 1658 B5R0.2 CCNCCN MCULE-7854769899 [2,0,0,0,0,0|2,0,0]=4 1659 B5R0.2 CCNCCO MCULE-2537734730 [2,0,0,0,0,0|1,0,0]=3 1660 B5R0.2 CCNCCO MCULE-3738714907 [2,0,0,0,0,0|1,0,0]=3 1661 B5R0.2 CCOCCBr MCULE-4818900555 [2,0,0,0,0,0|2,0,0]=4 1662 B5R0.2 CCOCCCl MCULE-1290576729 [2,0,0,0,0,0|2,0,0]=4 1663 B5R0.2 CCOCCI MCULE-1833092968 [2,0,0,0,0,0|2,0,0]=4 1664 B5R0.2 CCOCCN MCULE-1254431240 [2,0,0,0,0,0|2,0,0]=4 1665 B5R0.2 CCOCCN MCULE-4039110889 [2,0,0,0,0,0|2,0,0]=4 1666 B5R0.2 CCOCCN MCULE-4400456933 [2,0,0,0,0,0|2,0,0]=4 1667 B5R0.2 CCOCCO MCULE-4311513289 [2,0,0,0,0,0|1,0,0]=3 1668 B5R0.2 CCOCCS MCULE-3968740645 [2,0,0,0,0,0|1,1,0]=4 1669 B5R0.2 CCSCCBr MCULE-9449933342 [2,0,0,0,0,0|2,0,0]=4 1670 B5R0.2 CCSCCCl MCULE-4057847237 [2,0,0,0,0,0|2,0,0]=4 1671 B5R0.2 CCSCCN MCULE-3375644872 [2,0,0,0,0,0|2,0,0]=4 1672 B5R0.2 CCSCCN MCULE-4466279976 [2,0,0,0,0,0|2,0,0]=4 1673 B5R0.2 CCSCCO MCULE-3557086162 [2,0,0,0,0,0|1,0,0]=3 1674 B5R0.2 CCSCCS MCULE-4583054157 [2,0,0,0,0,0|1,1,0]=4 1675 B5R0.2 CNCCCBr MCULE-3376600253 [2,0,0,0,0,0|2,0,0]=4 1676 B5R0.2 CNCCCBr MCULE-6212326106 [2,0,0,0,0,0|2,0,0]=4 1677 B5R0.2 CNCCCCl MCULE-1007719210 [2,0,0,0,0,0|2,0,0]=4 1678 B5R0.2 CNCCCCl MCULE-6146901643 [2,0,0,0,0,0|2,0,0]=4 1679 B5R0.2 CNCCCF MCULE-7647417887 [2,0,0,0,0,0|2,0,0]=4 1680 B5R0.2 CNCCCN MCULE-1736081896 [2,0,0,0,0,0|2,0,0]=4 1681 B5R0.2 CNCCCO MCULE-9530478547 [2,0,0,0,0,0|1,0,0]=3 1682 B5R0.2 COCCCBr MCULE-6489536401 [2,0,0,0,0,0|2,0,0]=4 1683 B5R0.2 COCCCCl MCULE-9192274624 [2,0,0,0,0,0|2,0,0]=4 1684 B5R0.2 COCCCF MCULE-5055725246 [2,0,0,0,0,0|2,0,0]=4 1685 B5R0.2 COCCCI MCULE-9111605439 [2,0,0,0,0,0|2,0,0]=4 1686 B5R0.2 COCCCN MCULE-1421362990 [2,0,0,0,0,0|2,0,0]=4 1687 B5R0.2 COCCCN MCULE-4783132205 [2,0,0,0,0,0|2,0,0]=4 1688 B5R0.2 COCCCO MCULE-4041418048 [2,0,0,0,0,0|1,0,0]=3 1689 B5R0.2 COCCCS MCULE-2371333731 [2,0,0,0,0,0|1,1,0]=4 1690 B5R0.2 CONCCO MCULE-9787830121 [2,0,0,0,0,0|2,0,0]=4 1691 B5R0.2 CSCCCBr MCULE-8399851816 [2,0,0,0,0,0|2,0,0]=4 1692 B5R0.2 CSCCCCl MCULE-1829120476 [2,0,0,0,0,0|2,0,0]=4 1693 B5R0.2 CSCCCN MCULE-1030938424 [2,0,0,0,0,0|2,0,0]=4 1694 B5R0.2 CSCCCN MCULE-4664984921 [2,0,0,0,0,0|2,0,0]=4 1695 B5R0.2 CSCCCO MCULE-9232413185 [2,0,0,0,0,0|1,0,0]=3 1696 B5R0.2 CSCCCS MCULE-8405766359 [2,0,0,0,0,0|1,1,0]=4 1697 B5R0.2 ClCCCCBr MCULE-7973194927 [2,0,0,0,0,0|2,0,0]=4 1698 B5R0.2 ClCCCCCl MCULE-4863501782 [2,0,0,0,0,0|2,0,0]=4 1699 B5R0.2 ClCCCCI MCULE-4303507089 [2,0,0,0,0,0|2,0,0]=4 1700 B5R0.2 FCCCCBr MCULE-8408956872 [2,0,0,0,0,0|2,0,0]=4 1701 B5R0.2 FCCCCF MCULE-1347438150 [2,0,0,0,0,0|2,0,0]=4 1702 B5R0.2 ICCCCI MCULE-1390457250 [2,0,0,0,0,0|2,0,0]=4 1703 B5R0.2 N#CCCCO MCULE-2108386837 [2,0,0,0,0,0|1,0,1]=4 1704 B5R0.2 NCCCCBr MCULE-7095299053 [2,0,0,0,0,0|2,0,0]=4 1705 B5R0.2 NCCCCBr MCULE-7716027825 [2,0,0,0,0,0|2,0,0]=4 1706 B5R0.2 NCCCCCl MCULE-8484381726 [2,0,0,0,0,0|2,0,0]=4 1707 B5R0.2 NCCCCCl MCULE-9917306082 [2,0,0,0,0,0|2,0,0]=4 1708 B5R0.2 NCCCCF MCULE-4260727945 [2,0,0,0,0,0|2,0,0]=4 1709 B5R0.2 NCCCCF MCULE-7716720921 [2,0,0,0,0,0|2,0,0]=4 1710 B5R0.2 NCCCCN MCULE-3098044935 [2,0,0,0,0,0|2,0,0]=4 1711 B5R0.2 NCCCCN MCULE-7898833229 [2,0,0,0,0,0|2,0,0]=4 1712 B5R0.2 NCCCCN MCULE-8029479697 [2,0,0,0,0,0|2,0,0]=4 1713 B5R0.2 NCCCCN MCULE-8509656776 [2,0,0,0,0,0|2,0,0]=4 1714 B5R0.2 NCCCCO MCULE-7395674091 [2,0,0,0,0,0|1,0,0]=3 1715 B5R0.2 NCCCCS MCULE-4353910418 [2,0,0,0,0,0|1,1,0]=4 1716 B5R0.2 NCCCCS MCULE-9812416858 [2,0,0,0,0,0|1,1,0]=4 1717 B5R0.2 NNCCCO MCULE-5557482626 [2,0,0,0,0,0|2,0,0]=4 1718 B5R0.2 NNCCCO MCULE-7351853032 [2,0,0,0,0,0|2,0,0]=4 1719 B5R0.2 NNCCCO MCULE-7919314403 [2,0,0,0,0,0|2,0,0]=4 1720 B5R0.2 NOCCCO MCULE-1072312935 [2,0,0,0,0,0|2,0,0]=4 1721 B5R0.2 NOCCCO MCULE-3715520109 [2,0,0,0,0,0|2,0,0]=4 1722 B5R0.2 O=CCCCO MCULE-8728420992 [2,0,0,0,0,0|1,0,1]=4 1723 B5R0.2 OCCCCBr MCULE-9231591925 [2,0,0,0,0,0|1,0,0]=3 1724 B5R0.2 OCCCCCl MCULE-3507644812 [2,0,0,0,0,0|1,0,0]=3 1725 B5R0.2 OCCCCF MCULE-9242285588 [2,0,0,0,0,0|1,0,0]=3 1726 B5R0.2 OCCCCI MCULE-8723720522 [2,0,0,0,0,0|1,0,0]=3 1727 B5R0.2 OCCCCO MCULE-2010022287 [2,0,0,0,0,0|1,0,0]=3 1728 B5R0.2 OCCCCO MCULE-6551106098 [2,0,0,0,0,0|1,0,0]=3 1729 B5R0.2 OCCCCS MCULE-8169490949 [2,0,0,0,0,0|1,0,0]=3 1730 B5R0.2 OCCNCO MCULE-2141033453 [2,0,0,0,0,0|2,0,0]=4 1731 B5R0.2 SCCCCS MCULE-6695609899 [2,0,0,0,0,0|1,1,0]=4 1732 B5R0.3 C=C(CC)CC MCULE-9174509622 [2,0,0,0,0,0|1,0,1]=4 1733 B5R0.3 C=C(CC)CO MCULE-8127766352 [2,0,0,0,0,0|0,0,2]=4 1734 B5R0.3 C=CC(C)CC MCULE-8112547661 [2,0,0,0,0,0|1,0,1]=4 1735 B5R0.3 CC(=NO)CS MCULE-9694340512 [2,0,0,0,0,0|1,0,1]=4 1736 B5R0.3 CC(C#N)CO MCULE-1644391554 [2,0,0,0,0,0|1,0,1]=4 1737 B5R0.3 CC(CBr)CBr MCULE-7586113999 [2,0,0,0,0,0|2,0,0]=4 1738 B5R0.3 CC(CCl)CBr MCULE-5101754687 [2,0,0,0,0,0|2,0,0]=4 1739 B5R0.3 CC(CCl)CCl MCULE-1169456620 [2,0,0,0,0,0|2,0,0]=4 1740 B5R0.3 CC(CI)CI MCULE-4568725580 [2,0,0,0,0,0|2,0,0]=4 1741 B5R0.3 CC(CN)CCl MCULE-2423692318 [2,0,0,0,0,0|2,0,0]=4 1742 B5R0.3 CC(CN)CCl MCULE-8419541212 [2,0,0,0,0,0|2,0,0]=4 1743 B5R0.3 CC(CN)CN MCULE-1464804013 [2,0,0,0,0,0|2,0,0]=4 1744 B5R0.3 CC(CN)CN MCULE-3273307813 [2,0,0,0,0,0|2,0,0]=4 1745 B5R0.3 CC(CN)CO MCULE-5880795484 [2,0,0,0,0,0|1,0,0]=3 1746 B5R0.3 CC(CN)CO MCULE-8083007887 [2,0,0,0,0,0|1,0,0]=3 1747 B5R0.3 CC(CO)CBr MCULE-3815333295 [2,0,0,0,0,0|1,0,0]=3 1748 B5R0.3 CC(CO)CBr MCULE-5695891877 [2,0,0,0,0,0|1,0,0]=3 1749 B5R0.3 CC(CO)CO MCULE-2340730326 [2,0,0,0,0,0|0,1,0]=3 1750 B5R0.3 CC(CO)CS MCULE-1990992504 [2,0,0,0,0,0|0,0,0]=2 1751 B5R0.3 CC(CO)NN MCULE-3362748538 [2,0,0,0,0,0|2,0,0]=4 1752 B5R0.3 CC(CO)NN MCULE-4440318216 [2,0,0,0,0,0|2,0,0]=4 1753 B5R0.3 CC/C(=N/O)/C MCULE-9139048973 [2,0,0,0,0,0|1,0,1]=4 1754 B5R0.3 CCC(=NO)C MCULE-1859652505 [2,0,0,0,0,0|1,0,1]=4 1755 B5R0.3 CCC(=O)CC MCULE-8236549739 [2,0,0,0,0,0|0,1,1]=4 1756 B5R0.3 CCC(=O)CO MCULE-8674894820 [2,0,0,0,0,0|0,1,1]=4 1757 B5R0.3 CCC(Br)CBr MCULE-5254958560 [2,0,0,0,0,0|2,0,0]=4 1758 B5R0.3 CCC(Br)CC MCULE-7435628721 [2,0,0,0,0,0|1,0,0]=3 1759 B5R0.3 CCC(Br)CO MCULE-7211805716 [2,0,0,0,0,0|1,0,0]=3 1760 B5R0.3 CCC(C)C#N MCULE-6204122967 [2,0,0,0,0,0|1,0,1]=4 1761 B5R0.3 CCC(C)C=O MCULE-2523669899 [2,0,0,0,0,0|0,0,2]=4 1762 B5R0.3 CCC(C)CBr MCULE-5451416952 [2,0,0,0,0,0|1,0,0]=3 1763 B5R0.3 CCC(C)CC MCULE-2542807917 [2,0,0,0,0,0|1,0,0]=3 1764 B5R0.3 CCC(C)CCl MCULE-7450386476 [2,0,0,0,0,0|1,0,0]=3 1765 B5R0.3 CCC(C)CI MCULE-5444509280 [2,0,0,0,0,0|1,0,0]=3 1766 B5R0.3 CCC(C)CN MCULE-2777327284 [2,0,0,0,0,0|1,0,0]=3 1767 B5R0.3 CCC(C)CN MCULE-7014901600 [2,0,0,0,0,0|1,0,0]=3 1768 B5R0.3 CCC(C)CO MCULE-6521026296 [2,0,0,0,0,0|0,0,0]=2 1769 B5R0.3 CCC(C)CS MCULE-7795095685 [2,0,0,0,0,0|0,1,0]=3 1770 B5R0.3 CCC(C)NC MCULE-2676584804 [2,0,0,0,0,0|2,0,0]=4 1771 B5R0.3 CCC(C)NC MCULE-6158046887 [2,0,0,0,0,0|2,0,0]=4 1772 B5R0.3 CCC(C)NN MCULE-6074476998 [2,0,0,0,0,0|2,0,0]=4 1773 B5R0.3 CCC(C)NN MCULE-8130021960 [2,0,0,0,0,0|2,0,0]=4 1774 B5R0.3 CCC(C)NN MCULE-8519369369 [2,0,0,0,0,0|2,0,0]=4 1775 B5R0.3 CCC(C)NO MCULE-1247092627 [2,0,0,0,0,0|1,0,0]=3 1776 B5R0.3 CCC(C)NO MCULE-6169819668 [2,0,0,0,0,0|1,0,0]=3 1777 B5R0.3 CCC(C)OC MCULE-7354431606 [2,0,0,0,0,0|2,0,0]=4 1778 B5R0.3 CCC(C)ON MCULE-2907890438 [2,0,0,0,0,0|2,0,0]=4 1779 B5R0.3 CCC(C)ON MCULE-4364205813 [2,0,0,0,0,0|2,0,0]=4 1780 B5R0.3 CCC(Cl)CCl MCULE-5122022797 [2,0,0,0,0,0|2,0,0]=4 1781 B5R0.3 CCC(Cl)CO MCULE-1756262629 [2,0,0,0,0,0|1,0,0]=3 1782 B5R0.3 CCC(F)CBr MCULE-3226052264 [2,0,0,0,0,0|2,0,0]=4 1783 B5R0.3 CCC(F)CN MCULE-1291385596 [2,0,0,0,0,0|2,0,0]=4 1784 B5R0.3 CCC(F)CN MCULE-7421331323 [2,0,0,0,0,0|2,0,0]=4 1785 B5R0.3 CCC(I)CC MCULE-1119844552 [2,0,0,0,0,0|1,0,0]=3 1786 B5R0.3 CCC(N)CBr MCULE-3567691924 [2,0,0,0,0,0|2,0,0]=4 1787 B5R0.3 CCC(N)CC MCULE-4261937519 [2,0,0,0,0,0|1,0,0]=3 1788 B5R0.3 CCC(N)CC MCULE-5899128891 [2,0,0,0,0,0|1,0,0]=3 1789 B5R0.3 CCC(N)CN MCULE-6911484065 [2,0,0,0,0,0|2,0,0]=4 1790 B5R0.3 CCC(N)CN MCULE-8376506697 [2,0,0,0,0,0|2,0,0]=4 1791 B5R0.3 CCC(N)CO MCULE-1135809021 [2,0,0,0,0,0|1,0,0]=3 1792 B5R0.3 CCC(N)CO MCULE-7588854111 [2,0,0,0,0,0|1,0,0]=3 1793 B5R0.3 CCC(O)CBr MCULE-4205031860 [2,0,0,0,0,0|1,1,0]=4 1794 B5R0.3 CCC(O)CC MCULE-5553645045 [2,0,0,0,0,0|0,1,0]=3 1795 B5R0.3 CCC(O)CCl MCULE-8359810208 [2,0,0,0,0,0|1,1,0]=4 1796 B5R0.3 CCC(O)CN MCULE-5197026448 [2,0,0,0,0,0|1,1,0]=4 1797 B5R0.3 CCC(O)CO MCULE-2488753438 [2,0,0,0,0,0|0,1,0]=3 1798 B5R0.3 CCC(O)CO MCULE-7297282094 [2,0,0,0,0,0|0,1,0]=3 1799 B5R0.3 CCC(S)CC MCULE-2556259434 [2,0,0,0,0,0|0,0,0]=2 1800 B5R0.3 CCC(S)CS MCULE-9332449950 [2,0,0,0,0,0|0,1,0]=3 1801 B5R0.3 CCC([NH3+])CBr MCULE-6971158198 [2,0,0,0,0,0|2,0,0]=4 1802 B5R0.3 CCN(C)CC MCULE-7207964917 [2,0,0,0,0,0|2,0,0]=4 1803 B5R0.3 CCN(N)CC MCULE-9853386945 [2,0,0,0,0,0|2,0,0]=4 1804 B5R0.3 CCN(N)CC MCULE-9962617398 [2,0,0,0,0,0|2,0,0]=4 1805 B5R0.3 CCN(O)CC MCULE-6022935768 [2,0,0,0,0,0|1,1,0]=4 1806 B5R0.3 CCP(=O)CC MCULE-2216184595 [2,0,0,0,0,0|1,1,0]=4 1807 B5R0.3 CCP(Cl)CC MCULE-4484529264 [2,0,0,0,0,0|2,0,0]=4 1808 B5R0.3 CCS(=O)CC MCULE-5102735179 [2,0,0,0,0,0|1,1,0]=4 1809 B5R0.3 CC[C@@H](C)CBr MCULE-5675886072 [2,0,0,0,0,0|1,0,0]=3 1810 B5R0.3 CC[C@@H](C)CN MCULE-7612408107 [2,0,0,0,0,0|1,0,0]=3 1811 B5R0.3 CC[C@@H](C)CO MCULE-6700783698 [2,0,0,0,0,0|0,0,0]=2 1812 B5R0.3 CC[C@@H](C)CO MCULE-8175790803 [2,0,0,0,0,0|0,0,0]=2 1813 B5R0.3 CC[C@@H](N)CO MCULE-3821348404 [2,0,0,0,0,0|1,0,0]=3 1814 B5R0.3 CC[C@@H](N)CO MCULE-7190248306 [2,0,0,0,0,0|1,0,0]=3 1815 B5R0.3 CC[C@@H](O)CN MCULE-2854535153 [2,0,0,0,0,0|1,1,0]=4 1816 B5R0.3 CC[C@@H](O)CN MCULE-8228547956 [2,0,0,0,0,0|1,1,0]=4 1817 B5R0.3 CC[C@@H](O)CO MCULE-3948477298 [2,0,0,0,0,0|0,1,0]=3 1818 B5R0.3 CC[C@@H](O)CO MCULE-5098109795 [2,0,0,0,0,0|0,1,0]=3 1819 B5R0.3 CC[C@H](C)C#N MCULE-9118306872 [2,0,0,0,0,0|1,0,1]=4 1820 B5R0.3 CC[C@H](C)CBr MCULE-3263714447 [2,0,0,0,0,0|1,0,0]=3 1821 B5R0.3 CC[C@H](C)CBr MCULE-3384648570 [2,0,0,0,0,0|1,0,0]=3 1822 B5R0.3 CC[C@H](C)CCl MCULE-6795758745 [2,0,0,0,0,0|1,0,0]=3 1823 B5R0.3 CC[C@H](C)CCl MCULE-8147276830 [2,0,0,0,0,0|1,0,0]=3 1824 B5R0.3 CC[C@H](C)CI MCULE-9690776923 [2,0,0,0,0,0|1,0,0]=3 1825 B5R0.3 CC[C@H](C)CN MCULE-1380819951 [2,0,0,0,0,0|1,0,0]=3 1826 B5R0.3 CC[C@H](C)CN MCULE-1396096112 [2,0,0,0,0,0|1,0,0]=3 1827 B5R0.3 CC[C@H](C)CN MCULE-2971933862 [2,0,0,0,0,0|1,0,0]=3 1828 B5R0.3 CC[C@H](C)CN MCULE-3698084674 [2,0,0,0,0,0|1,0,0]=3 1829 B5R0.3 CC[C@H](C)CO MCULE-1493424061 [2,0,0,0,0,0|0,0,0]=2 1830 B5R0.3 CC[C@H](C)CO MCULE-6879443668 [2,0,0,0,0,0|0,0,0]=2 1831 B5R0.3 CC[C@H](N)CF MCULE-3646304583 [2,0,0,0,0,0|2,0,0]=4 1832 B5R0.3 CC[C@H](N)CF MCULE-4493834638 [2,0,0,0,0,0|2,0,0]=4 1833 B5R0.3 CC[C@H](N)CO MCULE-5500083870 [2,0,0,0,0,0|1,0,0]=3 1834 B5R0.3 CC[C@H](N)CO MCULE-6312512384 [2,0,0,0,0,0|1,0,0]=3 1835 B5R0.3 CC[C@H](O)CN MCULE-4385930741 [2,0,0,0,0,0|1,1,0]=4 1836 B5R0.3 CC[C@H](O)CO MCULE-2194264642 [2,0,0,0,0,0|0,1,0]=3 1837 B5R0.3 CC[C@H](O)CO MCULE-5503575962 [2,0,0,0,0,0|0,1,0]=3 1838 B5R0.3 CNC(C)CN MCULE-1599162912 [2,0,0,0,0,0|2,0,0]=4 1839 B5R0.3 CNC(C)CN MCULE-1637391260 [2,0,0,0,0,0|2,0,0]=4 1840 B5R0.3 CNC(C)CO MCULE-3841057780 [2,0,0,0,0,0|1,0,0]=3 1841 B5R0.3 CNC(C)CO MCULE-6474892275 [2,0,0,0,0,0|1,0,0]=3 1842 B5R0.3 CN[C@@H](C)CO MCULE-1633741835 [2,0,0,0,0,0|1,0,0]=3 1843 B5R0.3 CN[C@@H](C)CO MCULE-6736108875 [2,0,0,0,0,0|1,0,0]=3 1844 B5R0.3 CN[C@@H](C)CO MCULE-7554801630 [2,0,0,0,0,0|1,0,0]=3 1845 B5R0.3 CN[C@@H](C)CO MCULE-9312521497 [2,0,0,0,0,0|1,0,0]=3 1846 B5R0.3 CN[C@H](C)CO MCULE-2402322400 [2,0,0,0,0,0|1,0,0]=3 1847 B5R0.3 CN[C@H](C)CO MCULE-4362091386 [2,0,0,0,0,0|1,0,0]=3 1848 B5R0.3 CN[C@H](C)CO MCULE-5426855707 [2,0,0,0,0,0|1,0,0]=3 1849 B5R0.3 CN[C@H](C)CO MCULE-9777995604 [2,0,0,0,0,0|1,0,0]=3 1850 B5R0.3 COC(C)CBr MCULE-6831960550 [2,0,0,0,0,0|2,0,0]=4 1851 B5R0.3 COC(C)CCl MCULE-6614968111 [2,0,0,0,0,0|2,0,0]=4 1852 B5R0.3 COC(C)CI MCULE-9561627722 [2,0,0,0,0,0|2,0,0]=4 1853 B5R0.3 COC(C)CN MCULE-1378513525 [2,0,0,0,0,0|2,0,0]=4 1854 B5R0.3 COC(C)CN MCULE-6114730248 [2,0,0,0,0,0|2,0,0]=4 1855 B5R0.3 COC(C)CN MCULE-7516064224 [2,0,0,0,0,0|2,0,0]=4 1856 B5R0.3 COC(C)CN MCULE-8277408054 [2,0,0,0,0,0|2,0,0]=4 1857 B5R0.3 COC(C)CO MCULE-5269990702 [2,0,0,0,0,0|1,0,0]=3 1858 B5R0.3 COC(C)CO MCULE-7173093332 [2,0,0,0,0,0|1,0,0]=3 1859 B5R0.3 CO[C@@H](C)CN MCULE-1448950160 [2,0,0,0,0,0|2,0,0]=4 1860 B5R0.3 CO[C@@H](C)CN MCULE-3784073249 [2,0,0,0,0,0|2,0,0]=4 1861 B5R0.3 CO[C@@H](C)CN MCULE-6073633931 [2,0,0,0,0,0|2,0,0]=4 1862 B5R0.3 CO[C@@H](C)CN MCULE-9516756218 [2,0,0,0,0,0|2,0,0]=4 1863 B5R0.3 CO[C@@H](C)CO MCULE-5600457791 [2,0,0,0,0,0|1,0,0]=3 1864 B5R0.3 CO[C@@H](C)CO MCULE-7981152382 [2,0,0,0,0,0|1,0,0]=3 1865 B5R0.3 CO[C@H](C)CN MCULE-4143562009 [2,0,0,0,0,0|2,0,0]=4 1866 B5R0.3 CO[C@H](C)CN MCULE-4184510827 [2,0,0,0,0,0|2,0,0]=4 1867 B5R0.3 CO[C@H](C)CN MCULE-9625722424 [2,0,0,0,0,0|2,0,0]=4 1868 B5R0.3 CO[C@H](C)CN MCULE-9882567615 [2,0,0,0,0,0|2,0,0]=4 1869 B5R0.3 CO[C@H](C)CO MCULE-4211976708 [2,0,0,0,0,0|1,0,0]=3 1870 B5R0.3 CO[C@H](C)CO MCULE-7592020348 [2,0,0,0,0,0|1,0,0]=3 1871 B5R0.3 CSC(C)CN MCULE-8841622109 [2,0,0,0,0,0|2,0,0]=4 1872 B5R0.3 CSC(C)CO MCULE-4646435737 [2,0,0,0,0,0|1,0,0]=3 1873 B5R0.3 C[C@@H](CN)CO MCULE-4662215148 [2,0,0,0,0,0|1,0,0]=3 1874 B5R0.3 C[C@@H](CN)CO MCULE-7870198689 [2,0,0,0,0,0|1,0,0]=3 1875 B5R0.3 C[C@@H](CO)CBr MCULE-3691541800 [2,0,0,0,0,0|1,0,0]=3 1876 B5R0.3 C[C@@H](CO)CBr MCULE-4447849056 [2,0,0,0,0,0|1,0,0]=3 1877 B5R0.3 C[C@H](CO)CBr MCULE-4031825779 [2,0,0,0,0,0|1,0,0]=3 1878 B5R0.3 C[C@H](CO)CBr MCULE-6846167456 [2,0,0,0,0,0|1,0,0]=3 1879 B5R0.3 NC(CO)CF MCULE-3756808200 [2,0,0,0,0,0|2,0,0]=4 1880 B5R0.3 NC(CO)CF MCULE-9468719402 [2,0,0,0,0,0|2,0,0]=4 1881 B5R0.3 NC(CO)CO MCULE-1559988016 [2,0,0,0,0,0|1,1,0]=4 1882 B5R0.3 NC(CO)CO MCULE-4954119952 [2,0,0,0,0,0|1,1,0]=4 1883 B5R0.3 NCC(F)CO MCULE-6156319956 [2,0,0,0,0,0|2,0,0]=4 1884 B5R0.3 NCC(F)CO MCULE-7472307328 [2,0,0,0,0,0|2,0,0]=4 1885 B5R0.3 NCC(O)CO MCULE-2689763818 [2,0,0,0,0,0|1,1,0]=4 1886 B5R0.3 NCC(O)CO MCULE-6096620010 [2,0,0,0,0,0|1,1,0]=4 1887 B5R0.3 NCC(O)CO MCULE-7307777212 [2,0,0,0,0,0|1,1,0]=4 1888 B5R0.3 NC[C@@H](F)CO MCULE-3273711180 [2,0,0,0,0,0|2,0,0]=4 1889 B5R0.3 NC[C@@H](F)CO MCULE-6673969522 [2,0,0,0,0,0|2,0,0]=4 1890 B5R0.3 NC[C@@H](N)CO MCULE-7333007012 [2,0,0,0,0,0|2,0,0]=4 1891 B5R0.3 NC[C@@H](N)CO MCULE-9200386635 [2,0,0,0,0,0|2,0,0]=4 1892 B5R0.3 NC[C@@H](O)CO MCULE-7897503444 [2,0,0,0,0,0|1,1,0]=4 1893 B5R0.3 NC[C@@H](O)CO MCULE-8044821624 [2,0,0,0,0,0|1,1,0]=4 1894 B5R0.3 NC[C@@H](O)CO MCULE-9443333756 [2,0,0,0,0,0|1,1,0]=4 1895 B5R0.3 NC[C@H](F)CO MCULE-2595736378 [2,0,0,0,0,0|2,0,0]=4 1896 B5R0.3 NC[C@H](F)CO MCULE-7417074078 [2,0,0,0,0,0|2,0,0]=4 1897 B5R0.3 NC[C@H](F)CO MCULE-7938231499 [2,0,0,0,0,0|2,0,0]=4 1898 B5R0.3 NC[C@H](N)CO MCULE-1060049548 [2,0,0,0,0,0|2,0,0]=4 1899 B5R0.3 NC[C@H](N)CO MCULE-9942356112 [2,0,0,0,0,0|2,0,0]=4 1900 B5R0.3 NC[C@H](O)CO MCULE-5835551322 [2,0,0,0,0,0|1,1,0]=4 1901 B5R0.3 NC[C@H](O)CO MCULE-6021133883 [2,0,0,0,0,0|1,1,0]=4 1902 B5R0.3 NC[C@H](O)CO MCULE-7461568841 [2,0,0,0,0,0|1,1,0]=4 1903 B5R0.3 NC[C@H](O)CO MCULE-8112454132 [2,0,0,0,0,0|1,1,0]=4 1904 B5R0.3 N[C@@H](CO)CF MCULE-1103631898 [2,0,0,0,0,0|2,0,0]=4 1905 B5R0.3 N[C@@H](CO)CF MCULE-1137418239 [2,0,0,0,0,0|2,0,0]=4 1906 B5R0.3 N[C@@H](CO)CF MCULE-7452275160 [2,0,0,0,0,0|2,0,0]=4 1907 B5R0.3 N[C@@H](CO)CF MCULE-9154795583 [2,0,0,0,0,0|2,0,0]=4 1908 B5R0.3 N[C@H](CO)CF MCULE-1070351343 [2,0,0,0,0,0|2,0,0]=4 1909 B5R0.3 N[C@H](CO)CF MCULE-4715788718 [2,0,0,0,0,0|2,0,0]=4 1910 B5R0.3 N[C@H](CO)CF MCULE-8220585202 [2,0,0,0,0,0|2,0,0]=4 1911 B5R0.3 N[C@H](CO)CF MCULE-8991857376 [2,0,0,0,0,0|2,0,0]=4 1912 B5R0.3 OCC(Br)CBr MCULE-9616107956 [2,0,0,0,0,0|2,0,0]=4 1913 B5R0.3 OCC(Br)CO MCULE-9272628834 [2,0,0,0,0,0|1,1,0]=4 1914 B5R0.3 OCC(Cl)CCl MCULE-2120585852 [2,0,0,0,0,0|2,0,0]=4 1915 B5R0.3 OCC(Cl)CO MCULE-7487945326 [2,0,0,0,0,0|1,1,0]=4 1916 B5R0.3 OCC(F)CBr MCULE-2889937576 [2,0,0,0,0,0|2,0,0]=4 1917 B5R0.3 OCC(F)CO MCULE-2970537690 [2,0,0,0,0,0|1,1,0]=4 1918 B5R0.3 OCC(O)CBr MCULE-9116190245 [2,0,0,0,0,0|1,1,0]=4 1919 B5R0.3 OCC(O)CCl MCULE-7895191088 [2,0,0,0,0,0|1,1,0]=4 1920 B5R0.3 OCC(O)CCl MCULE-8992242488 [2,0,0,0,0,0|1,1,0]=4 1921 B5R0.3 OCC(O)CF MCULE-3575952891 [2,0,0,0,0,0|1,1,0]=4 1922 B5R0.3 OCC(O)CF MCULE-8981430411 [2,0,0,0,0,0|1,1,0]=4 1923 B5R0.3 OCC(O)CI MCULE-6705992930 [2,0,0,0,0,0|1,1,0]=4 1924 B5R0.3 OCC(O)CO MCULE-6349111826 [2,0,0,0,0,0|1,1,0]=4 1925 B5R0.3 OCC(O)CS MCULE-6300188207 [2,0,0,0,0,0|1,0,0]=3 1926 B5R0.3 OCC(S)CS MCULE-9735516119 [2,0,0,0,0,0|1,0,0]=3 1927 B5R0.3 OC[C@@H](O)CCl MCULE-1311776512 [2,0,0,0,0,0|1,1,0]=4 1928 B5R0.3 OC[C@@H](O)CCl MCULE-2685107404 [2,0,0,0,0,0|1,1,0]=4 1929 B5R0.3 OC[C@@H](O)CF MCULE-3274443966 [2,0,0,0,0,0|1,1,0]=4 1930 B5R0.3 OC[C@@H](O)CF MCULE-5908395855 [2,0,0,0,0,0|1,1,0]=4 1931 B5R0.3 OC[C@H](O)CBr MCULE-5035020863 [2,0,0,0,0,0|1,1,0]=4 1932 B5R0.3 OC[C@H](O)CCl MCULE-2098232262 [2,0,0,0,0,0|1,1,0]=4 1933 B5R0.3 OC[C@H](O)CCl MCULE-5801605349 [2,0,0,0,0,0|1,1,0]=4 1934 B5R0.3 OC[C@H](O)CF MCULE-3309672397 [2,0,0,0,0,0|1,1,0]=4 1935 B5R0.3 OC[C@H](O)CF MCULE-7695783253 [2,0,0,0,0,0|1,1,0]=4 1936 B5R0.5 C=C(C)C(C)C MCULE-2535284443 [2,0,0,0,0,0|1,0,1]=4 1937 B5R0.5 C=C(C)C(C)O MCULE-3768810742 [2,0,0,0,0,0|1,0,1]=4 1938 B5R0.5 CC(=O)C(C)C MCULE-5982732938 [2,0,0,0,0,0|0,1,1]=4 1939 B5R0.5 CC(=O)C(C)O MCULE-5374414264 [2,0,0,0,0,0|0,1,1]=4 1940 B5R0.5 CC(=O)C(C)S MCULE-2716722148 [2,0,0,0,0,0|0,0,2]=4 1941 B5R0.5 CC(Br)C(C)Br MCULE-8272754345 [2,0,0,0,0,0|2,0,0]=4 1942 B5R0.5 CC(C)C(=O)S MCULE-9552406593 [2,0,0,0,0,0|1,0,1]=4 1943 B5R0.5 CC(C)C(C)Br MCULE-8934980523 [2,0,0,0,0,0|1,0,0]=3 1944 B5R0.5 CC(C)C(C)C MCULE-7887644548 [2,0,0,0,0,0|1,0,0]=3 1945 B5R0.5 CC(C)C(C)I MCULE-7528764320 [2,0,0,0,0,0|1,0,0]=3 1946 B5R0.5 CC(C)C(C)N MCULE-1630754475 [2,0,0,0,0,0|1,0,0]=3 1947 B5R0.5 CC(C)C(C)N MCULE-1801901816 [2,0,0,0,0,0|1,0,0]=3 1948 B5R0.5 CC(C)C(C)N MCULE-3544463874 [2,0,0,0,0,0|1,0,0]=3 1949 B5R0.5 CC(C)C(C)N MCULE-4774844065 [2,0,0,0,0,0|1,0,0]=3 1950 B5R0.5 CC(C)C(C)O MCULE-4829392845 [2,0,0,0,0,0|0,1,0]=3 1951 B5R0.5 CC(C)C(C)S MCULE-7489203323 [2,0,0,0,0,0|0,0,0]=2 1952 B5R0.5 CC(C)C(I)I MCULE-6684789578 [2,0,0,0,0,0|2,0,0]=4 1953 B5R0.5 CC(C)N(C)C MCULE-1993251030 [2,0,0,0,0,0|2,0,0]=4 1954 B5R0.5 CC(C)[C@@H](C)N MCULE-1953734886 [2,0,0,0,0,0|1,0,0]=3 1955 B5R0.5 CC(C)[C@@H](C)N MCULE-3105334197 [2,0,0,0,0,0|1,0,0]=3 1956 B5R0.5 CC(C)[C@@H](C)N MCULE-9470429569 [2,0,0,0,0,0|1,0,0]=3 1957 B5R0.5 CC(C)[C@@H](C)O MCULE-3565458505 [2,0,0,0,0,0|0,1,0]=3 1958 B5R0.5 CC(C)[C@H](C)N MCULE-2859174363 [2,0,0,0,0,0|1,0,0]=3 1959 B5R0.5 CC(C)[C@H](C)N MCULE-3034457659 [2,0,0,0,0,0|1,0,0]=3 1960 B5R0.5 CC(C)[C@H](C)N MCULE-5904658917 [2,0,0,0,0,0|1,0,0]=3 1961 B5R0.5 CC(C)[C@H](C)O MCULE-1553214756 [2,0,0,0,0,0|0,1,0]=3 1962 B5R0.5 CC(C)[C@H](C)O MCULE-8141633445 [2,0,0,0,0,0|0,1,0]=3 1963 B5R0.5 CC(Cl)C(C)Cl MCULE-6954506926 [2,0,0,0,0,0|2,0,0]=4 1964 B5R0.5 CC(N)C(C)N MCULE-6724099648 [2,0,0,0,0,0|2,0,0]=4 1965 B5R0.5 CC(N)C(C)O MCULE-3512899672 [2,0,0,0,0,0|1,0,0]=3 1966 B5R0.5 CC(N)C(C)O MCULE-6286987696 [2,0,0,0,0,0|1,0,0]=3 1967 B5R0.5 CC(O)C(C)Br MCULE-1140424623 [2,0,0,0,0,0|1,0,0]=3 1968 B5R0.5 CC(O)C(C)Cl MCULE-3352632568 [2,0,0,0,0,0|1,0,0]=3 1969 B5R0.5 CC(O)C(C)O MCULE-2858785316 [2,0,0,0,0,0|0,1,0]=3 1970 B5R0.5 CC(O)C(C)S MCULE-3741743569 [2,0,0,0,0,0|0,0,0]=2 1971 B5R0.5 CC(O)C(F)F MCULE-1258374037 [2,0,0,0,0,0|2,0,0]=4 1972 B5R0.5 CC(S)C(=O)O MCULE-6944738352 [2,0,0,0,0,0|1,0,1]=4 1973 B5R0.5 CC(S)C(C)S MCULE-3508721208 [2,0,0,0,0,0|0,1,0]=3 1974 B5R0.5 C[C@@H](N)[C@@H](C)N MCULE-5194916344 [2,0,0,0,0,0|2,0,0]=4 1975 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-4537991630 [2,0,0,0,0,0|1,0,0]=3 1976 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5710552020 [2,0,0,0,0,0|1,0,0]=3 1977 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-5951487868 [2,0,0,0,0,0|1,0,0]=3 1978 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8093543292 [2,0,0,0,0,0|1,0,0]=3 1979 B5R0.5 C[C@@H](N)[C@@H](C)O MCULE-8196664475 [2,0,0,0,0,0|1,0,0]=3 1980 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-2843927827 [2,0,0,0,0,0|0,1,0]=3 1981 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-3739961672 [2,0,0,0,0,0|0,1,0]=3 1982 B5R0.5 C[C@@H](O)[C@@H](C)O MCULE-5488313047 [2,0,0,0,0,0|0,1,0]=3 1983 B5R0.5 C[C@H](Br)[C@@H](C)Br MCULE-7263507123 [2,0,0,0,0,0|2,0,0]=4 1984 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-6389040758 [2,0,0,0,0,0|1,0,0]=3 1985 B5R0.5 C[C@H](N)[C@@H](C)O MCULE-7956913866 [2,0,0,0,0,0|1,0,0]=3 1986 B5R0.5 C[C@H](N)[C@H](C)N MCULE-1560418234 [2,0,0,0,0,0|2,0,0]=4 1987 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1340338147 [2,0,0,0,0,0|1,0,0]=3 1988 B5R0.5 C[C@H](N)[C@H](C)O MCULE-1738016964 [2,0,0,0,0,0|1,0,0]=3 1989 B5R0.5 C[C@H](N)[C@H](C)O MCULE-2254798251 [2,0,0,0,0,0|1,0,0]=3 1990 B5R0.5 C[C@H](N)[C@H](C)O MCULE-7688101680 [2,0,0,0,0,0|1,0,0]=3 1991 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-3776841970 [2,0,0,0,0,0|1,0,0]=3 1992 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-4906999918 [2,0,0,0,0,0|1,0,0]=3 1993 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5860404631 [2,0,0,0,0,0|1,0,0]=3 1994 B5R0.5 C[C@H](O)[C@@H](C)N MCULE-5888789996 [2,0,0,0,0,0|1,0,0]=3 1995 B5R0.5 C[C@H](O)[C@@H](C)O MCULE-8389904530 [2,0,0,0,0,0|0,1,0]=3 1996 B5R0.5 C[C@H](O)[C@H](C)O MCULE-8448870055 [2,0,0,0,0,0|0,1,0]=3 1997 B5R0.5 C[C@H](O)[C@H](C)O MCULE-9615630900 [2,0,0,0,0,0|0,1,0]=3 1998 B5R0.5 C[C@H](S)[C@@H](C)O MCULE-3347141817 [2,0,0,0,0,0|0,0,0]=2 1999 B5R0.5 [NH3+]C(C)C(C)[NH3+] MCULE-4215582247 [2,0,0,0,0,0|2,0,0]=4 2000 B7R0.2 C/C(=N\O)/CC(C)C MCULE-1223937315 [1,1,0,0,0,0|1,0,1]=4 2001 B7R0.2 C=C(C)CC(C)CC MCULE-1001667584 [1,1,0,0,0,0|1,0,1]=4 2002 B7R0.2 C=C(C)CC(N)CO MCULE-9114906744 [1,1,0,0,0,0|1,0,1]=4 2003 B7R0.2 C=CC(C)CC(C)C MCULE-9111388336 [1,1,0,0,0,0|1,0,1]=4 2004 B7R0.2 CC(=NO)CC(C)C MCULE-1446840557 [1,1,0,0,0,0|1,0,1]=4 2005 B7R0.2 CC(=O)NC(C)CO MCULE-9455210462 [1,1,0,0,0,0|1,0,1]=4 2006 B7R0.2 CC(=O)N[C@H](C)CO MCULE-2174899443 [1,1,0,0,0,0|1,0,1]=4 2007 B7R0.2 CC(=O)N[C@H](C)CO MCULE-5097293473 [1,1,0,0,0,0|1,0,1]=4 2008 B7R0.2 CC(C)CC(C)C=O MCULE-4209363554 [1,1,0,0,0,0|0,0,2]=4 2009 B7R0.2 CC(C)CC(C)CBr MCULE-6800285380 [1,1,0,0,0,0|1,0,0]=3 2010 B7R0.2 CC(C)CC(C)CO MCULE-5856507691 [1,1,0,0,0,0|0,0,0]=2 2011 B7R0.2 CC(C)CC(N)CF MCULE-3937400151 [1,1,0,0,0,0|2,0,0]=4 2012 B7R0.2 CC(C)CC(N)CF MCULE-7951827838 [1,1,0,0,0,0|2,0,0]=4 2013 B7R0.2 CC(C)CC(N)CN MCULE-3441513735 [1,1,0,0,0,0|2,0,0]=4 2014 B7R0.2 CC(C)CC(N)CO MCULE-6347344178 [1,1,0,0,0,0|1,0,0]=3 2015 B7R0.2 CC(C)CC(N)CO MCULE-7024759986 [1,1,0,0,0,0|1,0,0]=3 2016 B7R0.2 CC(C)CC(N)CS MCULE-8932651812 [1,1,0,0,0,0|1,1,0]=4 2017 B7R0.2 CC(C)CC(O)CN MCULE-9414833333 [1,1,0,0,0,0|2,0,0]=4 2018 B7R0.2 CC(C)CC(O)CN MCULE-9784331526 [1,1,0,0,0,0|2,0,0]=4 2019 B7R0.2 CC(C)C[C@@H](N)CBr MCULE-4869966214 [1,1,0,0,0,0|2,0,0]=4 2020 B7R0.2 CC(C)C[C@@H](N)CO MCULE-1979401982 [1,1,0,0,0,0|1,0,0]=3 2021 B7R0.2 CC(C)C[C@@H](N)CO MCULE-3025407298 [1,1,0,0,0,0|1,0,0]=3 2022 B7R0.2 CC(C)C[C@H](N)CBr MCULE-4224057266 [1,1,0,0,0,0|2,0,0]=4 2023 B7R0.2 CC(C)C[C@H](N)CO MCULE-2790872575 [1,1,0,0,0,0|1,0,0]=3 2024 B7R0.2 CC(C)C[C@H](N)CO MCULE-9198147139 [1,1,0,0,0,0|1,0,0]=3 2025 B7R0.2 CC(CBr)CC(F)F MCULE-3122361238 [1,1,0,0,0,0|2,0,0]=4 2026 B7R0.2 CC(CCl)CN(C)C MCULE-4809914471 [1,1,0,0,0,0|2,0,0]=4 2027 B7R0.2 CC(CCl)CN(C)C MCULE-7169724566 [1,1,0,0,0,0|2,0,0]=4 2028 B7R0.2 CC(CN)CC(F)F MCULE-2945792041 [1,1,0,0,0,0|2,0,0]=4 2029 B7R0.2 CC(CN)CC(F)F MCULE-5449897456 [1,1,0,0,0,0|2,0,0]=4 2030 B7R0.2 CC(CN)CN(C)C MCULE-4741402612 [1,1,0,0,0,0|2,0,0]=4 2031 B7R0.2 CC(CO)CC(F)F MCULE-1470130605 [1,1,0,0,0,0|1,0,0]=3 2032 B7R0.2 CC(CO)CN(C)C MCULE-3103307387 [1,1,0,0,0,0|1,0,0]=3 2033 B7R0.2 CC(O)CC(C)CN MCULE-3086796159 [1,1,0,0,0,0|1,0,0]=3 2034 B7R0.2 CCC(C)CB(O)O MCULE-4978906892 [1,1,0,0,0,0|2,0,0]=4 2035 B7R0.2 CCC(C)CC(=O)C MCULE-5801548800 [1,1,0,0,0,0|1,0,1]=4 2036 B7R0.2 CCC(C)CC(=O)O MCULE-3409782202 [1,1,0,0,0,0|1,0,1]=4 2037 B7R0.2 CCC(C)CC(=O)O MCULE-6537278030 [1,1,0,0,0,0|1,0,1]=4 2038 B7R0.2 CCC(C)CC(C)C MCULE-9492683095 [1,1,0,0,0,0|1,0,0]=3 2039 B7R0.2 CCC(C)CC(C)N MCULE-2633957870 [1,1,0,0,0,0|1,0,0]=3 2040 B7R0.2 CCC(C)CC(C)N MCULE-5740038174 [1,1,0,0,0,0|1,0,0]=3 2041 B7R0.2 CCC(N)CC(=O)O MCULE-1744910444 [1,1,0,0,0,0|1,0,1]=4 2042 B7R0.2 CCC(N)CC(=O)O MCULE-5610499925 [1,1,0,0,0,0|1,0,1]=4 2043 B7R0.2 CCC(N)CC(C)O MCULE-1447243469 [1,1,0,0,0,0|1,0,0]=3 2044 B7R0.2 CCC(O)CC(=O)O MCULE-4663578527 [1,1,0,0,0,0|0,1,1]=4 2045 B7R0.2 CCC(O)CC(C)O MCULE-3115543235 [1,1,0,0,0,0|0,1,0]=3 2046 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-5550070887 [1,1,0,0,0,0|1,0,1]=4 2047 B7R0.2 CC[C@@H](C)CC(=O)O MCULE-9572363620 [1,1,0,0,0,0|1,0,1]=4 2048 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-1158271004 [1,1,0,0,0,0|1,0,1]=4 2049 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-2354820947 [1,1,0,0,0,0|1,0,1]=4 2050 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-4284161835 [1,1,0,0,0,0|1,0,1]=4 2051 B7R0.2 CC[C@@H](N)CC(=O)O MCULE-9523089766 [1,1,0,0,0,0|1,0,1]=4 2052 B7R0.2 CC[C@H](C)CC(=O)O MCULE-4177365854 [1,1,0,0,0,0|1,0,1]=4 2053 B7R0.2 CC[C@H](C)CC(=O)O MCULE-5173108207 [1,1,0,0,0,0|1,0,1]=4 2054 B7R0.2 CC[C@H](N)CC(=O)O MCULE-1463536674 [1,1,0,0,0,0|1,0,1]=4 2055 B7R0.2 CC[C@H](N)CC(=O)O MCULE-2865599647 [1,1,0,0,0,0|1,0,1]=4 2056 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4506847599 [1,1,0,0,0,0|1,0,1]=4 2057 B7R0.2 CC[C@H](N)CC(=O)O MCULE-4819674539 [1,1,0,0,0,0|1,0,1]=4 2058 B7R0.2 CN(C)CC(N)CO MCULE-2789134862 [1,1,0,0,0,0|2,0,0]=4 2059 B7R0.2 CN(C)CC(N)CO MCULE-4090276677 [1,1,0,0,0,0|2,0,0]=4 2060 B7R0.2 CN(C)CC(O)CO MCULE-3436894516 [1,1,0,0,0,0|2,0,0]=4 2061 B7R0.2 CN(C)C[C@@H](O)CO MCULE-7101033572 [1,1,0,0,0,0|2,0,0]=4 2062 B7R0.2 CN(C)C[C@H](O)CO MCULE-4297947949 [1,1,0,0,0,0|2,0,0]=4 2063 B7R0.2 CNC(C)CC(C)C MCULE-4458579180 [1,1,0,0,0,0|2,0,0]=4 2064 B7R0.2 CNC(C)CC(C)C MCULE-9768203107 [1,1,0,0,0,0|2,0,0]=4 2065 B7R0.2 COC(C)CC(C)O MCULE-3635789827 [1,1,0,0,0,0|2,0,0]=4 2066 B7R0.2 NC(CO)CC(F)F MCULE-5033329865 [1,1,0,0,0,0|2,0,0]=4 2067 B7R0.2 NC(CO)CC(F)F MCULE-6986507912 [1,1,0,0,0,0|2,0,0]=4 2068 B7R0.3 C#CCCC(O)CC MCULE-2969540863 [1,1,0,0,0,0|1,1,0]=4 2069 B7R0.3 C#CCC[C@@H](N)CO MCULE-6761945465 [1,1,0,0,0,0|1,0,1]=4 2070 B7R0.3 C#CCC[C@@H](N)CO MCULE-9589288760 [1,1,0,0,0,0|1,0,1]=4 2071 B7R0.3 C#CCC[C@H](N)CO MCULE-5308019604 [1,1,0,0,0,0|1,0,1]=4 2072 B7R0.3 C#CCC[C@H](N)CO MCULE-7191637286 [1,1,0,0,0,0|1,0,1]=4 2073 B7R0.3 C#CCOC(C)CO MCULE-5112536028 [1,1,0,0,0,0|0,0,2]=4 2074 B7R0.3 C=CCCC(C)CN MCULE-2246705867 [1,1,0,0,0,0|1,0,1]=4 2075 B7R0.3 C=CCCC(C)CN MCULE-5238030814 [1,1,0,0,0,0|1,0,1]=4 2076 B7R0.3 C=CCCC(N)CC MCULE-4520234599 [1,1,0,0,0,0|2,0,0]=4 2077 B7R0.3 C=CCCC(N)CC MCULE-9493759139 [1,1,0,0,0,0|2,0,0]=4 2078 B7R0.3 C=CCCC(N)CO MCULE-2658614123 [1,1,0,0,0,0|1,0,1]=4 2079 B7R0.3 C=CCCC(O)CC MCULE-1265881694 [1,1,0,0,0,0|1,1,0]=4 2080 B7R0.3 C=CCC[C@@H](O)CO MCULE-6352864696 [1,1,0,0,0,0|1,0,1]=4 2081 B7R0.3 C=CCO[C@@H](C)CO MCULE-6699692288 [1,1,0,0,0,0|0,0,2]=4 2082 B7R0.3 CC#CCC(N)CO MCULE-1082443924 [1,1,0,0,0,0|1,0,1]=4 2083 B7R0.3 CC(CBr)OCCBr MCULE-2889401501 [1,1,0,0,0,0|2,0,0]=4 2084 B7R0.3 CC(CCCO)NN MCULE-8201748999 [1,1,0,0,0,0|2,0,0]=4 2085 B7R0.3 CC(CN)CCCN MCULE-1249275042 [1,1,0,0,0,0|1,0,0]=3 2086 B7R0.3 CC(CN)CCCO MCULE-2908684674 [1,1,0,0,0,0|1,0,0]=3 2087 B7R0.3 CC(CN)CCCO MCULE-5608783947 [1,1,0,0,0,0|1,0,0]=3 2088 B7R0.3 CC(CN)CCCO MCULE-9269954426 [1,1,0,0,0,0|1,0,0]=3 2089 B7R0.3 CC(CO)CCCO MCULE-8589885622 [1,1,0,0,0,0|0,0,0]=2 2090 B7R0.3 CC(CO)NCCO MCULE-5180763491 [1,1,0,0,0,0|1,0,0]=3 2091 B7R0.3 CC/C=C/C(C)CC MCULE-2438890702 [1,1,0,0,0,0|1,0,1]=4 2092 B7R0.3 CC=CCC(C)CC MCULE-4817855750 [1,1,0,0,0,0|1,0,1]=4 2093 B7R0.3 CCC(=O)NCCO MCULE-7351790148 [1,1,0,0,0,0|0,1,1]=4 2094 B7R0.3 CCC(=O)OCCO MCULE-6019276519 [1,1,0,0,0,0|0,1,1]=4 2095 B7R0.3 CCC(C)CCCO MCULE-2323419626 [1,1,0,0,0,0|1,0,0]=3 2096 B7R0.3 CCC(C)NCCO MCULE-1340916666 [1,1,0,0,0,0|1,0,0]=3 2097 B7R0.3 CCC(Cl)CCCCl MCULE-6770226574 [1,1,0,0,0,0|2,0,0]=4 2098 B7R0.3 CCC(N)CCCO MCULE-3868205501 [1,1,0,0,0,0|1,0,0]=3 2099 B7R0.3 CCC(N)CCOC MCULE-8279767210 [1,1,0,0,0,0|1,0,0]=3 2100 B7R0.3 CCC(O)CCCN MCULE-1491163174 [1,1,0,0,0,0|1,1,0]=4 2101 B7R0.3 CCC(O)CCCN MCULE-5150508895 [1,1,0,0,0,0|1,1,0]=4 2102 B7R0.3 CCC(O)CCCO MCULE-1099760826 [1,1,0,0,0,0|0,1,0]=3 2103 B7R0.3 CCC(O)CCOC MCULE-1245099360 [1,1,0,0,0,0|0,1,0]=3 2104 B7R0.3 CCC=CC(C)CC MCULE-8910467842 [1,1,0,0,0,0|1,0,1]=4 2105 B7R0.3 CCCC=C(C)CC MCULE-4699949699 [1,1,0,0,0,0|1,0,1]=4 2106 B7R0.3 CCCCC(=NO)C MCULE-8239265636 [1,1,0,0,0,0|1,0,1]=4 2107 B7R0.3 CCCCC(Br)CBr MCULE-9142273359 [1,1,0,0,0,0|2,0,0]=4 2108 B7R0.3 CCCCC(Br)CC MCULE-3813549657 [1,1,0,0,0,0|2,0,0]=4 2109 B7R0.3 CCCCC(C)CC MCULE-9471981954 [1,1,0,0,0,0|1,0,0]=3 2110 B7R0.3 CCCCC(C)NC MCULE-7492621121 [1,1,0,0,0,0|2,0,0]=4 2111 B7R0.3 CCCCC(Cl)CCl MCULE-6681580076 [1,1,0,0,0,0|2,0,0]=4 2112 B7R0.3 CCCCC(N)CC MCULE-1353863738 [1,1,0,0,0,0|2,0,0]=4 2113 B7R0.3 CCCCC(N)CC MCULE-9870475040 [1,1,0,0,0,0|2,0,0]=4 2114 B7R0.3 CCCCC(N)CN MCULE-2038464943 [1,1,0,0,0,0|2,0,0]=4 2115 B7R0.3 CCCCC(N)CO MCULE-1874423109 [1,1,0,0,0,0|1,0,0]=3 2116 B7R0.3 CCCCC(N)CO MCULE-2041767659 [1,1,0,0,0,0|1,0,0]=3 2117 B7R0.3 CCCCC(N)CO MCULE-4533575851 [1,1,0,0,0,0|1,0,0]=3 2118 B7R0.3 CCCCC(N)CO MCULE-7141990411 [1,1,0,0,0,0|1,0,0]=3 2119 B7R0.3 CCCCC(O)CBr MCULE-8416535559 [1,1,0,0,0,0|2,0,0]=4 2120 B7R0.3 CCCCC(O)CC MCULE-3912386534 [1,1,0,0,0,0|1,1,0]=4 2121 B7R0.3 CCCCC(O)CN MCULE-1383380728 [1,1,0,0,0,0|2,0,0]=4 2122 B7R0.3 CCCCC(O)CO MCULE-6903923961 [1,1,0,0,0,0|1,0,0]=3 2123 B7R0.3 CCCCN(C)CC MCULE-7723007145 [1,1,0,0,0,0|2,0,0]=4 2124 B7R0.3 CCCC[C@@H](N)CO MCULE-1379297850 [1,1,0,0,0,0|1,0,0]=3 2125 B7R0.3 CCCC[C@@H](N)CO MCULE-5016786633 [1,1,0,0,0,0|1,0,0]=3 2126 B7R0.3 CCCC[C@@H](N)CO MCULE-6669873658 [1,1,0,0,0,0|1,0,0]=3 2127 B7R0.3 CCCC[C@@H](N)CO MCULE-6809294141 [1,1,0,0,0,0|1,0,0]=3 2128 B7R0.3 CCCC[C@H](C)C=O MCULE-7821873587 [1,1,0,0,0,0|0,0,2]=4 2129 B7R0.3 CCCC[C@H](N)CO MCULE-3277509271 [1,1,0,0,0,0|1,0,0]=3 2130 B7R0.3 CCCC[C@H](N)CO MCULE-5867397890 [1,1,0,0,0,0|1,0,0]=3 2131 B7R0.3 CCCNC(C)CC MCULE-8533643430 [1,1,0,0,0,0|1,0,0]=3 2132 B7R0.3 CCCNC(C)CO MCULE-6575712324 [1,1,0,0,0,0|0,0,0]=2 2133 B7R0.3 CCCOC(C)CN MCULE-2816840734 [1,1,0,0,0,0|1,0,0]=3 2134 B7R0.3 CCCOC(C)CN MCULE-6461157704 [1,1,0,0,0,0|1,0,0]=3 2135 B7R0.3 CCN(C)CCCCl MCULE-3619674048 [1,1,0,0,0,0|2,0,0]=4 2136 B7R0.3 CCN(C)CCCCl MCULE-3845564178 [1,1,0,0,0,0|2,0,0]=4 2137 B7R0.3 CCN(C)CCCN MCULE-2231565296 [1,1,0,0,0,0|2,0,0]=4 2138 B7R0.3 CCN(C)CCCO MCULE-9090885474 [1,1,0,0,0,0|2,0,0]=4 2139 B7R0.3 CCN(C)CCNC MCULE-3001815120 [1,1,0,0,0,0|2,0,0]=4 2140 B7R0.3 CCNCC(C)C#N MCULE-5920854475 [1,1,0,0,0,0|1,0,1]=4 2141 B7R0.3 CCNCC(C)CC MCULE-8768620428 [1,1,0,0,0,0|1,0,0]=3 2142 B7R0.3 CCNCC(C)CC MCULE-9491990692 [1,1,0,0,0,0|1,0,0]=3 2143 B7R0.3 CCNCC(C)OC MCULE-9115511555 [1,1,0,0,0,0|2,0,0]=4 2144 B7R0.3 CCNCC(O)CC MCULE-9820144398 [1,1,0,0,0,0|1,1,0]=4 2145 B7R0.3 CCOCC(C)CO MCULE-6831759423 [1,1,0,0,0,0|0,0,0]=2 2146 B7R0.3 CCOCC(N)CC MCULE-2793834769 [1,1,0,0,0,0|2,0,0]=4 2147 B7R0.3 CCOCC(N)CC MCULE-5142543434 [1,1,0,0,0,0|2,0,0]=4 2148 B7R0.3 CCOCC(N)CO MCULE-8546500751 [1,1,0,0,0,0|1,0,0]=3 2149 B7R0.3 CCOCC(O)CCl MCULE-5119359541 [1,1,0,0,0,0|2,0,0]=4 2150 B7R0.3 CCOCC(O)CN MCULE-2355759727 [1,1,0,0,0,0|2,0,0]=4 2151 B7R0.3 CCOCC(O)CO MCULE-2728952355 [1,1,0,0,0,0|1,0,0]=3 2152 B7R0.3 CCSCC(C)NC MCULE-6245105657 [1,1,0,0,0,0|2,0,0]=4 2153 B7R0.3 CCSCC(C)NN MCULE-5847763411 [1,1,0,0,0,0|2,0,0]=4 2154 B7R0.3 CC[C@H](C)CCCO MCULE-1760153718 [1,1,0,0,0,0|1,0,0]=3 2155 B7R0.3 CC[C@H](C)CCCO MCULE-3488695651 [1,1,0,0,0,0|1,0,0]=3 2156 B7R0.3 CNC(C)CCSC MCULE-2095620023 [1,1,0,0,0,0|2,0,0]=4 2157 B7R0.3 COCCC(C)CN MCULE-7288397543 [1,1,0,0,0,0|1,0,0]=3 2158 B7R0.3 COCCC(N)CO MCULE-9758817920 [1,1,0,0,0,0|1,0,0]=3 2159 B7R0.3 COCOC(C)CO MCULE-5033492685 [1,1,0,0,0,0|1,0,0]=3 2160 B7R0.3 COCO[C@@H](C)CO MCULE-2279257941 [1,1,0,0,0,0|1,0,0]=3 2161 B7R0.3 COCO[C@H](C)CO MCULE-6639618074 [1,1,0,0,0,0|1,0,0]=3 2162 B7R0.3 COCO[C@H](C)CO MCULE-9421136678 [1,1,0,0,0,0|1,0,0]=3 2163 B7R0.3 CSCCC(N)CO MCULE-1688371230 [1,1,0,0,0,0|1,0,0]=3 2164 B7R0.3 CSCCC(O)CN MCULE-3835830442 [1,1,0,0,0,0|2,0,0]=4 2165 B7R0.3 CSCC[C@@H](N)CO MCULE-2764794918 [1,1,0,0,0,0|1,0,0]=3 2166 B7R0.3 CSCC[C@@H](N)CO MCULE-7120101109 [1,1,0,0,0,0|1,0,0]=3 2167 B7R0.3 CSCC[C@H](N)CN MCULE-6460179286 [1,1,0,0,0,0|2,0,0]=4 2168 B7R0.3 CSCC[C@H](N)CO MCULE-6014525130 [1,1,0,0,0,0|1,0,0]=3 2169 B7R0.3 CSCC[C@H](N)CO MCULE-9216326176 [1,1,0,0,0,0|1,0,0]=3 2170 B7R0.3 C[C@@H](CN)CCCO MCULE-2859776250 [1,1,0,0,0,0|1,0,0]=3 2171 B7R0.3 C[C@@H](CN)CCCO MCULE-3245433953 [1,1,0,0,0,0|1,0,0]=3 2172 B7R0.3 C[C@@H](CN)CCCO MCULE-7698870351 [1,1,0,0,0,0|1,0,0]=3 2173 B7R0.3 C[C@@H](CN)CCCO MCULE-9900676606 [1,1,0,0,0,0|1,0,0]=3 2174 B7R0.3 NCC(Cl)CCCCl MCULE-1250767606 [1,1,0,0,0,0|2,0,0]=4 2175 B7R0.3 NCC(Cl)CCCCl MCULE-1634382406 [1,1,0,0,0,0|2,0,0]=4 2176 B7R0.3 OCCCC(O)CO MCULE-3529953491 [1,1,0,0,0,0|1,0,0]=3 2177 B7R0.5 CC(=O)C(C)CCO MCULE-3907160101 [1,1,0,0,0,0|1,0,1]=4 2178 B7R0.5 CC(=O)C(Cl)CCO MCULE-1606704903 [1,1,0,0,0,0|1,0,1]=4 2179 B7R0.5 CC(C)C(C)CCO MCULE-9837449555 [1,1,0,0,0,0|1,0,0]=3 2180 B7R0.5 CC(C)C(N)CCO MCULE-4571836019 [1,1,0,0,0,0|1,0,0]=3 2181 B7R0.5 CC(C)C(O)CCCl MCULE-3510291624 [1,1,0,0,0,0|1,1,0]=4 2182 B7R0.5 CC(C)C(O)CCN MCULE-2039463209 [1,1,0,0,0,0|1,1,0]=4 2183 B7R0.5 CC(C)C(O)CCN MCULE-2941304015 [1,1,0,0,0,0|1,1,0]=4 2184 B7R0.5 CC(C)C(O)CCO MCULE-8819967893 [1,1,0,0,0,0|0,1,0]=3 2185 B7R0.5 CC(C)N(C)CCO MCULE-5948661117 [1,1,0,0,0,0|2,0,0]=4 2186 B7R0.5 CC(C)[C@H](N)CCO MCULE-5628923252 [1,1,0,0,0,0|1,0,0]=3 2187 B7R0.5 CC(C)[C@H](O)CCN MCULE-1853419872 [1,1,0,0,0,0|1,1,0]=4 2188 B7R0.5 CC(C)[C@H](O)CCN MCULE-1886424228 [1,1,0,0,0,0|1,1,0]=4 2189 B7R0.5 CC(C)[C@H](O)CCN MCULE-7762475170 [1,1,0,0,0,0|1,1,0]=4 2190 B7R0.5 CC(C)[C@H](O)CCN MCULE-8675177820 [1,1,0,0,0,0|1,1,0]=4 2191 B7R0.5 CC(CCN)C(=O)O MCULE-8098419324 [1,1,0,0,0,0|1,0,1]=4 2192 B7R0.5 CC(CCN)C(=O)O MCULE-8509861009 [1,1,0,0,0,0|1,0,1]=4 2193 B7R0.5 CC(CCO)C(=O)O MCULE-9724304469 [1,1,0,0,0,0|1,0,1]=4 2194 B7R0.5 CC(CCO)N(C)C MCULE-4175956173 [1,1,0,0,0,0|2,0,0]=4 2195 B7R0.5 CCCC(Br)C(=O)O MCULE-4304229911 [1,1,0,0,0,0|1,0,1]=4 2196 B7R0.5 CCCC(Br)C(C)Br MCULE-4740207556 [1,1,0,0,0,0|2,0,0]=4 2197 B7R0.5 CCCC(C)C(=O)C MCULE-5585795289 [1,1,0,0,0,0|0,0,2]=4 2198 B7R0.5 CCCC(C)C(=O)Cl MCULE-4855016209 [1,1,0,0,0,0|0,0,2]=4 2199 B7R0.5 CCCC(C)C(=O)N MCULE-1948746391 [1,1,0,0,0,0|0,0,2]=4 2200 B7R0.5 CCCC(C)C(=O)O MCULE-7779384365 [1,1,0,0,0,0|0,0,1]=3 2201 B7R0.5 CCCC(C)C(C)C MCULE-1008931357 [1,1,0,0,0,0|1,0,0]=3 2202 B7R0.5 CCCC(C)C(C)N MCULE-3555650010 [1,1,0,0,0,0|1,0,0]=3 2203 B7R0.5 CCCC(C)C(C)N MCULE-8637319249 [1,1,0,0,0,0|1,0,0]=3 2204 B7R0.5 CCCC(C)C(C)O MCULE-3222709632 [1,1,0,0,0,0|0,0,0]=2 2205 B7R0.5 CCCC(Cl)C(=O)O MCULE-1265367924 [1,1,0,0,0,0|1,0,1]=4 2206 B7R0.5 CCCC(F)C(=O)O MCULE-5551678948 [1,1,0,0,0,0|1,0,1]=4 2207 B7R0.5 CCCC(N)C(=O)O MCULE-1684743992 [1,1,0,0,0,0|1,0,1]=4 2208 B7R0.5 CCCC(N)C(=O)O MCULE-5263067403 [1,1,0,0,0,0|1,0,1]=4 2209 B7R0.5 CCCC(N)C(=O)O MCULE-7151907627 [1,1,0,0,0,0|1,0,1]=4 2210 B7R0.5 CCCC(O)C(=O)O MCULE-8533446195 [1,1,0,0,0,0|1,0,1]=4 2211 B7R0.5 CCCC(O)C(=O)O MCULE-9586449213 [1,1,0,0,0,0|1,0,1]=4 2212 B7R0.5 CCCC(O)C(C)C MCULE-8942406791 [1,1,0,0,0,0|1,1,0]=4 2213 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-1302378905 [1,1,0,0,0,0|1,0,1]=4 2214 B7R0.5 CCC[C@@H](N)C(=O)O MCULE-5246507817 [1,1,0,0,0,0|1,0,1]=4 2215 B7R0.5 CCC[C@@H](O)C(=O)O MCULE-2742119346 [1,1,0,0,0,0|1,0,1]=4 2216 B7R0.5 CCC[C@H](Br)C(=O)O MCULE-3070253588 [1,1,0,0,0,0|1,0,1]=4 2217 B7R0.5 CCC[C@H](N)C(=O)O MCULE-2890516597 [1,1,0,0,0,0|1,0,1]=4 2218 B7R0.5 CCC[C@H](N)C(=O)O MCULE-4690406880 [1,1,0,0,0,0|1,0,1]=4 2219 B7R0.5 CCC[C@H](N)C(=O)O MCULE-9323049450 [1,1,0,0,0,0|1,0,1]=4 2220 B7R0.5 CCC[C@H](O)C(=O)O MCULE-6533548138 [1,1,0,0,0,0|1,0,1]=4 2221 B7R0.5 CCC[C@H](O)C(=O)O MCULE-8321722254 [1,1,0,0,0,0|1,0,1]=4 2222 B7R0.5 CCNC(C)C(=O)O MCULE-5445574810 [1,1,0,0,0,0|1,0,1]=4 2223 B7R0.5 CCNC(C)C(=O)O MCULE-5666785247 [1,1,0,0,0,0|1,0,1]=4 2224 B7R0.5 CCNC(C)C(C)C MCULE-4222747158 [1,1,0,0,0,0|2,0,0]=4 2225 B7R0.5 CCNC(C)C(C)C MCULE-4653009965 [1,1,0,0,0,0|2,0,0]=4 2226 B7R0.5 CCN[C@H](C)C(=O)O MCULE-9676358201 [1,1,0,0,0,0|1,0,1]=4 2227 B7R0.5 CCOC(C)C(=O)O MCULE-2185795311 [1,1,0,0,0,0|1,0,1]=4 2228 B7R0.5 CCSC(C)C(=O)O MCULE-9817243573 [1,1,0,0,0,0|1,0,1]=4 2229 B7R0.5 CNCC(C)C(=O)O MCULE-4255373615 [1,1,0,0,0,0|1,0,1]=4 2230 B7R0.5 CNCC(C)C(=O)O MCULE-8076489545 [1,1,0,0,0,0|1,0,1]=4 2231 B7R0.5 COCC(C)C(=O)O MCULE-9776415948 [1,1,0,0,0,0|1,0,1]=4 2232 B7R0.5 COCC(C)C(C)N MCULE-6465669754 [1,1,0,0,0,0|2,0,0]=4 2233 B7R0.5 CSCC(C)C(=O)O MCULE-7112130175 [1,1,0,0,0,0|1,0,1]=4 2234 B7R0.5 C[C@@H](CCS)C(=O)O MCULE-2918304262 [1,1,0,0,0,0|1,0,1]=4 2235 B7R0.5 NC(CCO)C(F)F MCULE-1854847569 [1,1,0,0,0,0|2,0,0]=4 2236 B7R0.7 C=C(CCC)CCO MCULE-1774943854 [1,1,0,0,0,0|0,0,2]=4 2237 B7R0.7 C=CCC(O)CCC MCULE-4006607391 [1,1,0,0,0,0|2,0,0]=4 2238 B7R0.7 CC(CCBr)CCBr MCULE-4358998001 [1,1,0,0,0,0|2,0,0]=4 2239 B7R0.7 CC(CCN)CCO MCULE-7864092529 [1,1,0,0,0,0|1,0,0]=3 2240 B7R0.7 CC(CCO)CCO MCULE-5426211201 [1,1,0,0,0,0|1,0,0]=3 2241 B7R0.7 CCCC(Br)CCBr MCULE-7954993658 [1,1,0,0,0,0|2,0,0]=4 2242 B7R0.7 CCCC(Br)CCC MCULE-4124374663 [1,1,0,0,0,0|2,0,0]=4 2243 B7R0.7 CCCC(C)CCC MCULE-5291190768 [1,1,0,0,0,0|1,0,0]=3 2244 B7R0.7 CCCC(C)CCO MCULE-6887128167 [1,1,0,0,0,0|0,0,0]=2 2245 B7R0.7 CCCC(C)N=C=O MCULE-9843542105 [1,1,0,0,0,0|0,0,2]=4 2246 B7R0.7 CCCC(C)N=C=S MCULE-8776201078 [1,1,0,0,0,0|0,1,1]=4 2247 B7R0.7 CCCC(C)NCC MCULE-3443551812 [1,1,0,0,0,0|1,0,0]=3 2248 B7R0.7 CCCC(C)NCC MCULE-7227087576 [1,1,0,0,0,0|1,0,0]=3 2249 B7R0.7 CCCC(C)OCC MCULE-2678814077 [1,1,0,0,0,0|1,0,0]=3 2250 B7R0.7 CCCC(C)SC#N MCULE-3982266922 [1,1,0,0,0,0|1,0,1]=4 2251 B7R0.7 CCCC(N)CCC MCULE-1003038397 [1,1,0,0,0,0|2,0,0]=4 2252 B7R0.7 CCCC(N)CCC MCULE-3454953409 [1,1,0,0,0,0|2,0,0]=4 2253 B7R0.7 CCCC(N)CCO MCULE-3641094890 [1,1,0,0,0,0|1,0,0]=3 2254 B7R0.7 CCCC(N)CCO MCULE-5323991138 [1,1,0,0,0,0|1,0,0]=3 2255 B7R0.7 CCCC(N)CCO MCULE-6597027417 [1,1,0,0,0,0|1,0,0]=3 2256 B7R0.7 CCCC(N)CCO MCULE-8093709628 [1,1,0,0,0,0|1,0,0]=3 2257 B7R0.7 CCCC(O)CCC MCULE-1942797307 [1,1,0,0,0,0|1,1,0]=4 2258 B7R0.7 CCCC(O)CCN MCULE-3796998426 [1,1,0,0,0,0|1,1,0]=4 2259 B7R0.7 CCCC(O)CCO MCULE-6957178966 [1,1,0,0,0,0|0,1,0]=3 2260 B7R0.7 CCCC(S)CCC MCULE-4775274873 [1,1,0,0,0,0|1,0,0]=3 2261 B7R0.7 CCCC(S)CCO MCULE-7972451905 [1,1,0,0,0,0|0,0,0]=2 2262 B7R0.7 CCCN(C)CCC MCULE-9743961087 [1,1,0,0,0,0|2,0,0]=4 2263 B7R0.7 CCC[C@@H](N)CCO MCULE-1862127512 [1,1,0,0,0,0|1,0,0]=3 2264 B7R0.7 CCC[C@@H](N)CCO MCULE-3031366486 [1,1,0,0,0,0|1,0,0]=3 2265 B7R0.7 CCC[C@@H](N)CCO MCULE-4433535200 [1,1,0,0,0,0|1,0,0]=3 2266 B7R0.7 CCC[C@@H](N)CCO MCULE-8325506694 [1,1,0,0,0,0|1,0,0]=3 2267 B7R0.7 CCC[C@H](N)CCO MCULE-3164100995 [1,1,0,0,0,0|1,0,0]=3 2268 B7R0.7 CCC[C@H](N)CCO MCULE-3262978007 [1,1,0,0,0,0|1,0,0]=3 2269 B7R0.7 CCC[C@H](N)CCO MCULE-3382311889 [1,1,0,0,0,0|1,0,0]=3 2270 B7R0.7 CCC[C@H](N)CCO MCULE-4865013919 [1,1,0,0,0,0|1,0,0]=3 2271 B7R0.7 CCNC(=O)CCO MCULE-3624072697 [1,1,0,0,0,0|0,1,1]=4 2272 B7R0.7 CCNC(C)CCO MCULE-5904294074 [1,1,0,0,0,0|1,0,0]=3 2273 B7R0.7 CCNC(C)COC MCULE-3519332383 [1,1,0,0,0,0|1,0,0]=3 2274 B7R0.7 CCNC(C)COC MCULE-9226487666 [1,1,0,0,0,0|1,0,0]=3 2275 B7R0.7 CCOC(=N)CCO MCULE-8135932013 [1,1,0,0,0,0|1,0,1]=4 2276 B7R0.7 CCOC(=N)CCO MCULE-9125708150 [1,1,0,0,0,0|1,0,1]=4 2277 B7R0.7 CCOC(=O)CCO MCULE-3972081033 [1,1,0,0,0,0|0,1,1]=4 2278 B7R0.7 CCOC(C)CNC MCULE-9630095723 [1,1,0,0,0,0|2,0,0]=4 2279 B7R0.7 CCOC(C)OCC MCULE-7152410134 [1,1,0,0,0,0|2,0,0]=4 2280 B7R0.7 CCSC(C)CC=O MCULE-8200772170 [1,1,0,0,0,0|1,0,1]=4 2281 B7R0.7 CN(CCN)CCO MCULE-2960427748 [1,1,0,0,0,0|2,0,0]=4 2282 B7R0.7 CN(CCO)CCO MCULE-3967840948 [1,1,0,0,0,0|2,0,0]=4 2283 B7R0.7 CN(CCO)CCO MCULE-6878116085 [1,1,0,0,0,0|2,0,0]=4 2284 B7R0.7 CNCC(O)COC MCULE-8497493216 [1,1,0,0,0,0|2,0,0]=4 2285 B7R0.7 COCC(Br)COC MCULE-8590528928 [1,1,0,0,0,0|2,0,0]=4 2286 B7R0.7 COCC(C)CC#N MCULE-8156908577 [1,1,0,0,0,0|1,0,1]=4 2287 B7R0.7 COCC(C)CCO MCULE-6812981556 [1,1,0,0,0,0|1,0,0]=3 2288 B7R0.7 COCC(Cl)COC MCULE-1871071718 [1,1,0,0,0,0|2,0,0]=4 2289 B7R0.7 COCC(N)CCO MCULE-2569422233 [1,1,0,0,0,0|1,0,0]=3 2290 B7R0.7 COCC(N)COC MCULE-3531117264 [1,1,0,0,0,0|2,0,0]=4 2291 B7R0.7 COCC(N)COC MCULE-3609597955 [1,1,0,0,0,0|2,0,0]=4 2292 B7R0.7 COCC(O)CCN MCULE-9524454931 [1,1,0,0,0,0|1,1,0]=4 2293 B7R0.7 COCC(O)COC MCULE-5364514636 [1,1,0,0,0,0|2,0,0]=4 2294 B7R0.7 COCC(O)CON MCULE-3159534337 [1,1,0,0,0,0|2,0,0]=4 2295 B7R0.7 CSCC(N)CCO MCULE-2899374338 [1,1,0,0,0,0|1,0,0]=3 2296 B7R0.7 O=C(CCO)CCO MCULE-8765223516 [1,1,0,0,0,0|0,1,1]=4 2297 B7R0.7 O=S(CCO)CCO MCULE-3068452870 [1,1,0,0,0,0|1,1,0]=4 2298 B7R0.7 OCCC(O)CCO MCULE-1162803524 [1,1,0,0,0,0|0,1,0]=3 2299 B7R0.11 C#CC(C)(O)CCC MCULE-3734924257 [1,1,0,0,0,0|1,0,1]=4 2300 B7R0.11 C#CCC(C)(C)CO MCULE-6291879237 [1,1,0,0,0,0|0,0,2]=4 2301 B7R0.11 C=CC(C)(C)CCC MCULE-7100135827 [1,1,0,0,0,0|1,0,1]=4 2302 B7R0.11 C=CCC(C)(C)CO MCULE-7471335170 [1,1,0,0,0,0|0,0,2]=4 2303 B7R0.11 CC(C)(CCl)CCCl MCULE-9732928702 [1,1,0,0,0,0|2,0,0]=4 2304 B7R0.11 CC(C)(CN)CCO MCULE-8453542373 [1,1,0,0,0,0|2,0,0]=4 2305 B7R0.11 CC(C)(CO)CC#N MCULE-2362583171 [1,1,0,0,0,0|1,0,1]=4 2306 B7R0.11 CC(C)(CO)CCN MCULE-5221703852 [1,1,0,0,0,0|1,0,0]=3 2307 B7R0.11 CC(C)(CO)CCN MCULE-7380535368 [1,1,0,0,0,0|1,0,0]=3 2308 B7R0.11 CC(C)(CO)CCO MCULE-1756560398 [1,1,0,0,0,0|1,0,0]=3 2309 B7R0.11 CC(C)(CO)CNN MCULE-2193719969 [1,1,0,0,0,0|2,0,0]=4 2310 B7R0.11 CC(C)(CO)CNN MCULE-7849188244 [1,1,0,0,0,0|2,0,0]=4 2311 B7R0.11 CC(N)(CO)CCF MCULE-5569472665 [1,1,0,0,0,0|1,0,0]=3 2312 B7R0.11 CC(O)(CO)CCO MCULE-4148316300 [1,1,0,0,0,0|1,0,0]=3 2313 B7R0.11 CCC(C)(C)CCBr MCULE-8754627573 [1,1,0,0,0,0|2,0,0]=4 2314 B7R0.11 CCC(C)(C)CCCl MCULE-2699346020 [1,1,0,0,0,0|2,0,0]=4 2315 B7R0.11 CCC(C)(C)CCN MCULE-3224833531 [1,1,0,0,0,0|2,0,0]=4 2316 B7R0.11 CCC(C)(C)CCN MCULE-6016829915 [1,1,0,0,0,0|2,0,0]=4 2317 B7R0.11 CCC(C)(C)CCO MCULE-5248034600 [1,1,0,0,0,0|1,0,0]=3 2318 B7R0.11 CCC(C)(N)CCO MCULE-7673513204 [1,1,0,0,0,0|1,0,0]=3 2319 B7R0.11 CCC(C)(O)CCO MCULE-6173398477 [1,1,0,0,0,0|0,1,0]=3 2320 B7R0.11 CCC(F)(F)CCCl MCULE-4272513464 [1,1,0,0,0,0|2,0,0]=4 2321 B7R0.11 CCCC(C)(C)C#N MCULE-6368929813 [1,1,0,0,0,0|1,0,1]=4 2322 B7R0.11 CCCC(C)(C)C=O MCULE-1675435662 [1,1,0,0,0,0|0,0,2]=4 2323 B7R0.11 CCCC(C)(C)CC MCULE-6673337989 [1,1,0,0,0,0|1,0,0]=3 2324 B7R0.11 CCCC(C)(N)C#N MCULE-6266398743 [1,1,0,0,0,0|1,0,1]=4 2325 B7R0.11 CCCC(C)(N)CN MCULE-3215432035 [1,1,0,0,0,0|1,0,0]=3 2326 B7R0.11 CCCC(C)(N)CO MCULE-9180767555 [1,1,0,0,0,0|0,0,0]=2 2327 B7R0.11 CCCC(C)(O)C#N MCULE-3772295069 [1,1,0,0,0,0|1,0,1]=4 2328 B7R0.11 CCCC(C)(O)CC MCULE-9155096022 [1,1,0,0,0,0|1,0,0]=3 2329 B7R0.11 CCCC(C)(O)CN MCULE-4716937953 [1,1,0,0,0,0|1,0,0]=3 2330 B7R0.11 CCCC(C)(O)CO MCULE-3737630396 [1,1,0,0,0,0|0,0,0]=2 2331 B7R0.11 CCNC(C)(C)CO MCULE-9120392867 [1,1,0,0,0,0|1,0,0]=3 2332 B7R0.11 CCNC(C)(C)CO MCULE-9465450982 [1,1,0,0,0,0|1,0,0]=3 2333 B7R0.11 CCOC(C)(C)CC MCULE-6659357523 [1,1,0,0,0,0|2,0,0]=4 2334 B7R0.11 CCOC(C)(C)CN MCULE-5951578625 [1,1,0,0,0,0|2,0,0]=4 2335 B7R0.11 CCOC(C)(C)CN MCULE-9391246326 [1,1,0,0,0,0|2,0,0]=4 2336 B7R0.11 CCOC(C)(C)CO MCULE-6294474255 [1,1,0,0,0,0|1,0,0]=3 2337 B7R0.11 CCO[C@](C)(O)CO MCULE-2547633573 [1,1,0,0,0,0|1,0,0]=3 2338 B7R0.11 CCS(=O)(=O)CCO MCULE-1810929722 [1,1,0,0,0,0|1,1,0]=4 2339 B7R0.11 CNC(C)(C)CCO MCULE-4689746373 [1,1,0,0,0,0|2,0,0]=4 2340 B7R0.11 CNCC(C)(C)CN MCULE-1948897636 [1,1,0,0,0,0|2,0,0]=4 2341 B7R0.11 CNCC(C)(C)CO MCULE-1912751262 [1,1,0,0,0,0|1,0,0]=3 2342 B7R0.11 CNCC(F)(F)CO MCULE-2629238823 [1,1,0,0,0,0|2,0,0]=4 2343 B7R0.11 COC(C)(C)CCO MCULE-4448949329 [1,1,0,0,0,0|2,0,0]=4 2344 B7R0.11 COCC(C)(C)CBr MCULE-2591763859 [1,1,0,0,0,0|2,0,0]=4 2345 B7R0.11 COCC(C)(C)CN MCULE-6321252323 [1,1,0,0,0,0|2,0,0]=4 2346 B7R0.11 COCC(C)(C)CN MCULE-8662870324 [1,1,0,0,0,0|2,0,0]=4 2347 B7R0.11 COCC(C)(C)CO MCULE-2985367717 [1,1,0,0,0,0|1,0,0]=3 2348 B7R0.11 COCC(C)(N)CN MCULE-1467574919 [1,1,0,0,0,0|2,0,0]=4 2349 B7R0.11 COCC(C)(N)CO MCULE-2603485329 [1,1,0,0,0,0|1,0,0]=3 2350 B7R0.11 COCC(C)(N)CO MCULE-3416999559 [1,1,0,0,0,0|1,0,0]=3 2351 B7R0.11 COCC(C)(O)CN MCULE-8403551049 [1,1,0,0,0,0|2,0,0]=4 2352 B7R0.11 COCC(C)(O)CN MCULE-8479817538 [1,1,0,0,0,0|2,0,0]=4 2353 B7R0.11 COCC(F)(F)CO MCULE-7603400715 [1,1,0,0,0,0|2,0,0]=4 2354 B7R0.11 CSCC(C)(C)CO MCULE-4089291196 [1,1,0,0,0,0|1,0,0]=3 2355 B7R0.11 CSCC(C)(O)CN MCULE-7935135383 [1,1,0,0,0,0|2,0,0]=4 2356 B7R0.11 OCCC(F)(F)CO MCULE-9524877710 [1,1,0,0,0,0|2,0,0]=4 2357 B7R0.12 C=CCC(CO)CO MCULE-4178696072 [1,1,0,0,0,0|0,0,2]=4 2358 B7R0.12 CCC(CC)CCN MCULE-4512470364 [1,1,0,0,0,0|2,0,0]=4 2359 B7R0.12 CCC(CC)CCO MCULE-1684491793 [1,1,0,0,0,0|1,0,0]=3 2360 B7R0.12 CCC(CN)CCO MCULE-4612619767 [1,1,0,0,0,0|1,0,0]=3 2361 B7R0.12 CCC(CSC)NC MCULE-6079897043 [1,1,0,0,0,0|2,0,0]=4 2362 B7R0.12 CCCC(C#N)NC MCULE-1865924335 [1,1,0,0,0,0|1,0,1]=4 2363 B7R0.12 CCCC(C#N)NC MCULE-4445984378 [1,1,0,0,0,0|1,0,1]=4 2364 B7R0.12 CCCC(C#N)OC MCULE-8004262029 [1,1,0,0,0,0|1,0,1]=4 2365 B7R0.12 CCCC(CN)OC MCULE-6456891707 [1,1,0,0,0,0|1,0,0]=3 2366 B7R0.12 CCCC(CO)CO MCULE-2372919180 [1,1,0,0,0,0|0,0,0]=2 2367 B7R0.12 CCCC(CO)OC MCULE-9427398002 [1,1,0,0,0,0|0,0,0]=2 2368 B7R0.12 CCCC(OC)OC MCULE-9755419351 [1,1,0,0,0,0|2,0,0]=4 2369 B7R0.12 CCCN(CC)CC MCULE-4397223277 [1,1,0,0,0,0|2,0,0]=4 2370 B7R0.12 CCN(CC)CCO MCULE-6638681325 [1,1,0,0,0,0|2,0,0]=4 2371 B7R0.12 CCN(CC)CCO MCULE-8115329454 [1,1,0,0,0,0|2,0,0]=4 2372 B7R0.12 CCN(CCO)N=O MCULE-3100234015 [1,1,0,0,0,0|1,1,0]=4 2373 B7R0.12 CCNC(CC)CC MCULE-2150962345 [1,1,0,0,0,0|2,0,0]=4 2374 B7R0.12 CCNC(CC)CC MCULE-7819167061 [1,1,0,0,0,0|2,0,0]=4 2375 B7R0.12 CCNC(CC)CO MCULE-2240229411 [1,1,0,0,0,0|1,0,0]=3 2376 B7R0.12 CCN[C@@H](CC)CO MCULE-3793090402 [1,1,0,0,0,0|1,0,0]=3 2377 B7R0.12 CCN[C@@H](CC)CO MCULE-7960570694 [1,1,0,0,0,0|1,0,0]=3 2378 B7R0.12 CCOC(CC)CBr MCULE-9805591276 [1,1,0,0,0,0|2,0,0]=4 2379 B7R0.12 CCOC(CC)CN MCULE-3206225209 [1,1,0,0,0,0|2,0,0]=4 2380 B7R0.12 CCOC(CC)CN MCULE-9811140121 [1,1,0,0,0,0|2,0,0]=4 2381 B7R0.12 CCOC(CN)CN MCULE-8474624366 [1,1,0,0,0,0|2,0,0]=4 2382 B7R0.12 CCOC(CO)CBr MCULE-3004663873 [1,1,0,0,0,0|1,0,0]=3 2383 B7R0.12 COC(CN)CCN MCULE-6044078562 [1,1,0,0,0,0|2,0,0]=4 2384 B7R0.12 COC(CO)CCN MCULE-1177905249 [1,1,0,0,0,0|1,0,0]=3 2385 B7R0.12 COCC(CBr)OC MCULE-9551672317 [1,1,0,0,0,0|2,0,0]=4 2386 B7R0.12 COCC(CN)OC MCULE-4660699329 [1,1,0,0,0,0|2,0,0]=4 2387 B7R0.12 COCC(CO)OC MCULE-6775038884 [1,1,0,0,0,0|1,0,0]=3 2388 B7R0.12 COC[C@@H](CO)OC MCULE-7098934437 [1,1,0,0,0,0|1,0,0]=3 2389 B7R0.12 COC[C@H](CN)OC MCULE-7911151873 [1,1,0,0,0,0|2,0,0]=4 2390 B7R0.12 NCCC(CO)CO MCULE-7028267284 [1,1,0,0,0,0|1,0,0]=3 2391 B7R0.12 NCCC(CO)CO MCULE-8865812482 [1,1,0,0,0,0|1,0,0]=3 2392 B7R0.12 OCCC(CO)CO MCULE-7198799967 [1,1,0,0,0,0|1,0,0]=3 2393 B7R0.13 CC(=O)C(C)(C)CO MCULE-7885820738 [1,1,0,0,0,0|0,1,1]=4 2394 B7R0.13 CC(C)(CO)C(F)F MCULE-5444524351 [1,1,0,0,0,0|2,0,0]=4 2395 B7R0.13 CC(C)C(C)(C)CBr MCULE-1417156153 [1,1,0,0,0,0|2,0,0]=4 2396 B7R0.13 CC(C)C(C)(C)CN MCULE-1474008645 [1,1,0,0,0,0|2,0,0]=4 2397 B7R0.13 CC(C)C(C)(C)CN MCULE-3575810096 [1,1,0,0,0,0|2,0,0]=4 2398 B7R0.13 CC(C)C(C)(C)CO MCULE-1206498909 [1,1,0,0,0,0|1,0,0]=3 2399 B7R0.13 CC(C)C(C)(N)CN MCULE-2884198159 [1,1,0,0,0,0|2,0,0]=4 2400 B7R0.13 CC(C)C(C)(O)CN MCULE-2436598879 [1,1,0,0,0,0|1,1,0]=4 2401 B7R0.13 CC(C)C(C)(O)CO MCULE-7640109698 [1,1,0,0,0,0|1,0,0]=3 2402 B7R0.13 CC(O)C(C)(C)CN MCULE-2675460571 [1,1,0,0,0,0|1,1,0]=4 2403 B7R0.13 CC(O)C(C)(C)CO MCULE-1064066796 [1,1,0,0,0,0|0,1,0]=3 2404 B7R0.13 CCC(C)(C)C(C)N MCULE-8507623985 [1,1,0,0,0,0|2,0,0]=4 2405 B7R0.13 CCC(C)(C)C(C)N MCULE-9937664897 [1,1,0,0,0,0|2,0,0]=4 2406 B7R0.13 CCC(C)(O)C(C)O MCULE-5475978311 [1,1,0,0,0,0|0,1,0]=3 2407 B7R0.13 CCS(=N)(=O)C(C)C MCULE-7010212578 [1,1,0,0,0,0|1,1,0]=4 2408 B7R0.13 CCS(=O)(=O)C(C)C MCULE-1453045345 [1,1,0,0,0,0|1,1,0]=4 2409 B7R0.13 CN(C)C(C)(C)CO MCULE-8067899319 [1,1,0,0,0,0|2,0,0]=4 2410 B7R0.14 CC(C)(C)C(N)CN MCULE-8180805916 [1,1,0,0,0,0|2,0,0]=4 2411 B7R0.14 CC(C)(C)C(N)CN MCULE-8277347683 [1,1,0,0,0,0|2,0,0]=4 2412 B7R0.14 CC(C)(C)C(N)CO MCULE-7753244981 [1,1,0,0,0,0|2,0,0]=4 2413 B7R0.14 CC(C)(C)C(N)CO MCULE-8719256669 [1,1,0,0,0,0|2,0,0]=4 2414 B7R0.14 CC(C)(C)C(O)CBr MCULE-7385281890 [1,1,0,0,0,0|1,1,0]=4 2415 B7R0.14 CC(C)(C)C(O)CCl MCULE-2463075191 [1,1,0,0,0,0|1,1,0]=4 2416 B7R0.14 CC(C)(C)C(O)CN MCULE-1008278452 [1,1,0,0,0,0|1,1,0]=4 2417 B7R0.14 CC(C)(C)C(O)CO MCULE-2952507658 [1,1,0,0,0,0|1,1,0]=4 2418 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-3982110596 [1,1,0,0,0,0|2,0,0]=4 2419 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-5537283120 [1,1,0,0,0,0|2,0,0]=4 2420 B7R0.14 CC(C)(C)[C@@H](N)CO MCULE-9278147798 [1,1,0,0,0,0|2,0,0]=4 2421 B7R0.14 CC(C)(C)[C@H](N)CO MCULE-2023958874 [1,1,0,0,0,0|2,0,0]=4 2422 B7R0.14 CC(C)(C)[C@H](N)CO MCULE-6480065609 [1,1,0,0,0,0|2,0,0]=4 2423 B7R0.14 CC(C)(O)C(F)CN MCULE-4048927334 [1,1,0,0,0,0|2,0,0]=4 2424 B7R0.14 CC(C)(O)C(F)CN MCULE-5250059338 [1,1,0,0,0,0|2,0,0]=4 2425 B7R0.14 CC(C)(O)C(F)CN MCULE-6618174177 [1,1,0,0,0,0|2,0,0]=4 2426 B7R0.14 CC(C)(O)C(O)CN MCULE-5716430192 [1,1,0,0,0,0|1,1,0]=4 2427 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-4206986361 [1,1,0,0,0,0|2,0,0]=4 2428 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-4332950642 [1,1,0,0,0,0|2,0,0]=4 2429 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-5233683424 [1,1,0,0,0,0|2,0,0]=4 2430 B7R0.14 CC(C)(O)[C@@H](F)CN MCULE-9403366864 [1,1,0,0,0,0|2,0,0]=4 2431 B7R0.14 CC(C)(O)[C@H](F)CN MCULE-3837695935 [1,1,0,0,0,0|2,0,0]=4 2432 B7R0.14 CC(C)(O)[C@H](F)CN MCULE-5691809916 [1,1,0,0,0,0|2,0,0]=4 2433 B7R0.14 CC(C)(O)[C@H](F)CN MCULE-5910344650 [1,1,0,0,0,0|2,0,0]=4 2434 B7R0.14 CC(CBr)C(C)(C)C MCULE-6651711768 [1,1,0,0,0,0|2,0,0]=4 2435 B7R0.14 CC(CBr)C(C)(F)F MCULE-1127900198 [1,1,0,0,0,0|2,0,0]=4 2436 B7R0.14 CC(CCl)C(C)(C)C MCULE-3598136068 [1,1,0,0,0,0|2,0,0]=4 2437 B7R0.14 CC(CI)C(C)(C)C MCULE-7307944422 [1,1,0,0,0,0|2,0,0]=4 2438 B7R0.14 CC(CN)C(C)(C)C MCULE-9518533099 [1,1,0,0,0,0|2,0,0]=4 2439 B7R0.14 CC(CN)C(C)(C)C MCULE-9752514124 [1,1,0,0,0,0|2,0,0]=4 2440 B7R0.14 CC(CO)C(C)(C)C MCULE-7343676375 [1,1,0,0,0,0|1,0,0]=3 2441 B7R0.14 CC(CO)C(C)(C)O MCULE-8073024148 [1,1,0,0,0,0|0,1,0]=3 2442 B7R0.14 CC(CO)C(C)(F)F MCULE-3224311448 [1,1,0,0,0,0|1,0,0]=3 2443 B7R0.14 CC(CO)C(F)(F)F MCULE-9030047774 [1,1,0,0,0,0|2,0,0]=4 2444 B7R0.14 CCC(=O)C(C)(C)C MCULE-1267009248 [1,1,0,0,0,0|0,1,1]=4 2445 B7R0.14 CCC(C)C(C)(C)C MCULE-9713655910 [1,1,0,0,0,0|1,0,0]=3 2446 B7R0.14 CCC(N)C(C)(C)O MCULE-2452246439 [1,1,0,0,0,0|1,0,0]=3 2447 B7R0.14 CCC(N)C(C)(C)O MCULE-3686970762 [1,1,0,0,0,0|1,0,0]=3 2448 B7R0.14 CCC(O)C(C)(C)C MCULE-4883174975 [1,1,0,0,0,0|0,1,0]=3 2449 B7R0.14 CC[C@@H](N)C(C)(C)C MCULE-2279581739 [1,1,0,0,0,0|1,0,0]=3 2450 B7R0.14 CC[C@@H](N)C(C)(C)C MCULE-9333884063 [1,1,0,0,0,0|1,0,0]=3 2451 B7R0.14 CC[C@@H](N)C(C)(C)O MCULE-2250873384 [1,1,0,0,0,0|1,0,0]=3 2452 B7R0.14 CC[C@@H](N)C(C)(C)O MCULE-7069208023 [1,1,0,0,0,0|1,0,0]=3 2453 B7R0.14 CC[C@H](N)C(C)(C)O MCULE-6344226071 [1,1,0,0,0,0|1,0,0]=3 2454 B7R0.14 CC[C@H](N)C(C)(C)O MCULE-7677944024 [1,1,0,0,0,0|1,0,0]=3 2455 B7R0.14 CNC(C)C(C)(C)C MCULE-4693587118 [1,1,0,0,0,0|2,0,0]=4 2456 B7R0.14 CNC(C)C(C)(C)C MCULE-9517831875 [1,1,0,0,0,0|2,0,0]=4 2457 B7R0.14 CNC(C)C(C)(C)O MCULE-9520032279 [1,1,0,0,0,0|2,0,0]=4 2458 B7R0.14 C[C@@H](CO)C(C)(C)O MCULE-1478332547 [1,1,0,0,0,0|0,1,0]=3 2459 B7R0.14 C[C@@H](CO)C(C)(C)O MCULE-2286439441 [1,1,0,0,0,0|0,1,0]=3 2460 B7R0.14 C[C@@H](CO)C(F)(F)F MCULE-7511013445 [1,1,0,0,0,0|2,0,0]=4 2461 B7R0.14 [NH3+]C(CO)C(C)(C)C MCULE-6310162573 [1,1,0,0,0,0|2,0,0]=4 2462 B7R0.15 CC(=O)C(CO)CO MCULE-6408384667 [1,1,0,0,0,0|0,1,1]=4 2463 B7R0.15 CC(C)C(CN)CO MCULE-2517509906 [1,1,0,0,0,0|1,0,0]=3 2464 B7R0.15 CC(C)C(CO)CO MCULE-8569465631 [1,1,0,0,0,0|1,0,0]=3 2465 B7R0.15 CC(C)C(CO)ON MCULE-7037439016 [1,1,0,0,0,0|1,1,0]=4 2466 B7R0.15 CC(C)C(CO)ON MCULE-9325437885 [1,1,0,0,0,0|1,1,0]=4 2467 B7R0.15 CC(O)C(CO)CO MCULE-9986430379 [1,1,0,0,0,0|0,1,0]=3 2468 B7R0.15 CCC(C=O)C(C)C MCULE-4336481271 [1,1,0,0,0,0|0,1,0]=3 2469 B7R0.15 CCC(CC)C(C)C MCULE-3824081707 [1,1,0,0,0,0|1,0,0]=3 2470 B7R0.15 CCC(CC)C(C)N MCULE-1696057542 [1,1,0,0,0,0|2,0,0]=4 2471 B7R0.15 CCC(CC)C(C)O MCULE-9742014522 [1,1,0,0,0,0|1,0,0]=3 2472 B7R0.15 CCC(CN)C(C)C MCULE-1827845015 [1,1,0,0,0,0|1,0,0]=3 2473 B7R0.15 CCC(CN)N(C)C MCULE-3799974702 [1,1,0,0,0,0|2,0,0]=4 2474 B7R0.15 CCC(CN)N(C)C MCULE-4033411563 [1,1,0,0,0,0|2,0,0]=4 2475 B7R0.15 CCC(CO)C(C)C MCULE-5089280337 [1,1,0,0,0,0|0,1,0]=3 2476 B7R0.15 CCC(CO)N(C)C MCULE-2812328375 [1,1,0,0,0,0|1,1,0]=4 2477 B7R0.15 CCC(SC)C(=O)O MCULE-3373016779 [1,1,0,0,0,0|1,0,1]=4 2478 B7R0.15 CCN(CC)C(C)C MCULE-4939079362 [1,1,0,0,0,0|2,0,0]=4 2479 B7R0.15 CCN(N=O)C(C)C MCULE-9728358196 [1,1,0,0,0,0|1,1,0]=4 2480 B7R0.15 CN(C)C(CN)CO MCULE-6987208473 [1,1,0,0,0,0|2,0,0]=4 2481 B7R0.15 CN(C)C(CO)CO MCULE-6589056011 [1,1,0,0,0,0|2,0,0]=4 2482 B7R0.15 CNC(CO)C(C)C MCULE-5445088789 [1,1,0,0,0,0|1,0,0]=3 2483 B7R0.15 COC(C=O)C(C)C MCULE-9722853501 [1,1,0,0,0,0|1,1,0]=4 2484 B7R0.15 COC(CBr)C(C)C MCULE-2169119261 [1,1,0,0,0,0|1,1,0]=4 2485 B7R0.15 COC(CN)C(C)C MCULE-9651783224 [1,1,0,0,0,0|1,1,0]=4 2486 B7R0.15 COC(CO)C(C)Br MCULE-6071239484 [1,1,0,0,0,0|1,0,0]=3 2487 B7R0.15 COC(CO)C(C)C MCULE-8695619177 [1,1,0,0,0,0|1,0,0]=3 2488 B7R0.15 COC(CO)C(C)N MCULE-9816044841 [1,1,0,0,0,0|1,0,0]=3 2489 B7R0.15 COC(OC)C(C)C MCULE-7291024997 [1,1,0,0,0,0|1,1,0]=4 2490 B7R0.15 COC(OC)C(C)O MCULE-9058387582 [1,1,0,0,0,0|1,1,0]=4 2491 B7R0.15 COC(OC)[C@@H](C)O MCULE-2524252240 [1,1,0,0,0,0|1,1,0]=4 2492 B7R0.15 COC(OC)[C@H](C)O MCULE-2577056762 [1,1,0,0,0,0|1,1,0]=4 2493 B7R0.15 CO[C@@H](C=O)C(C)C MCULE-6654651958 [1,1,0,0,0,0|1,1,0]=4 2494 B7R0.15 CO[C@@H](CO)C(C)C MCULE-3676351737 [1,1,0,0,0,0|1,0,0]=3 2495 B7R0.15 CO[C@H](C=O)C(C)C MCULE-4139034238 [1,1,0,0,0,0|1,1,0]=4 2496 B7R0.15 CO[C@H](CO)C(C)C MCULE-2189146072 [1,1,0,0,0,0|1,0,0]=3 2497 B7R0.15 CSC(CO)C(C)N MCULE-6491195363 [1,1,0,0,0,0|1,0,0]=3 2498 B7R0.16 BN(C(C)C)C(C)C MCULE-9596820026 [1,1,0,0,0,0|2,0,0]=4 2499 B7R0.16 CC(=O)C(Br)C(C)C MCULE-2864707278 [1,1,0,0,0,0|1,0,1]=4 2500 B7R0.16 CC(=O)C(Cl)C(C)C MCULE-2825069638 [1,1,0,0,0,0|1,0,1]=4 2501 B7R0.16 CC(C)C(=O)C(C)Br MCULE-3431811578 [1,1,0,0,0,0|0,1,1]=4 2502 B7R0.16 CC(C)C(=O)C(C)C MCULE-2525492530 [1,1,0,0,0,0|0,1,1]=4 2503 B7R0.16 CC(C)C(C)C(=O)O MCULE-4998524686 [1,1,0,0,0,0|1,0,1]=4 2504 B7R0.16 CC(C)C(C)C(C)C MCULE-2831761094 [1,1,0,0,0,0|1,0,0]=3 2505 B7R0.16 CC(C)C(N)C(C)C MCULE-2164638983 [1,1,0,0,0,0|1,0,0]=3 2506 B7R0.16 CC(C)C(N)C(C)C MCULE-8563510082 [1,1,0,0,0,0|1,0,0]=3 2507 B7R0.16 CC(C)C(O)C(C)C MCULE-3471523029 [1,1,0,0,0,0|0,1,0]=3 2508 B7R0.16 CC(C)C(O)C(C)N MCULE-1856841813 [1,1,0,0,0,0|0,1,0]=3 2509 B7R0.16 CC(C)C(S)C(C)C MCULE-3605843125 [1,1,0,0,0,0|0,0,0]=2 2510 B7R0.16 CC(C)N(C)C(C)C MCULE-6950075898 [1,1,0,0,0,0|2,0,0]=4 2511 B7R0.16 CC(C)P(Cl)C(C)C MCULE-8760220652 [1,1,0,0,0,0|2,0,0]=4 2512 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-4413397700 [1,1,0,0,0,0|1,0,1]=4 2513 B7R0.16 CC(C)[C@H](C)C(=O)O MCULE-6269612306 [1,1,0,0,0,0|1,0,1]=4 2514 B7R0.16 CC(N)C(C)C(=O)O MCULE-2921617741 [1,1,0,0,0,0|1,0,1]=4 2515 B7R0.16 CC(N)C(C)C(=O)O MCULE-8511267926 [1,1,0,0,0,0|1,0,1]=4 2516 B7R0.16 CC(O)C(C)C(=O)O MCULE-2499360516 [1,1,0,0,0,0|0,1,1]=4 2517 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2245171795 [1,1,0,0,0,0|1,0,1]=4 2518 B7R0.16 C[C@H](C(=O)O)[C@@H](C)N MCULE-2727261050 [1,1,0,0,0,0|1,0,1]=4 2519 B7R0.16 C[C@H](C(=O)O)[C@@H](C)O MCULE-8875933839 [1,1,0,0,0,0|0,1,1]=4 2520 B9R0.22 CCC(C)CC(C)(O)CC MCULE-1418889839 [0,1,0,0,0,1|1,1,0]=4 2521 B9R0.26 CCN(CC)CC(C)CO MCULE-5104369830 [0,1,0,0,0,1|2,0,0]=4 2522 B9R0.27 CC(CO)N(C)C(C)CO MCULE-8899875161 [0,1,0,0,0,1|2,0,0]=4 2523 B9R0.27 CCC(C)C(=O)C(C)CC MCULE-5205263443 [0,1,0,0,0,1|2,0,0]=4 2524 B9R0.34 CCC(=O)OC(C)COC MCULE-8750401706 [0,1,0,0,0,1|0,1,1]=4 2525 B9R0.34 CCCC(C)CC(C)CC MCULE-6332739976 [0,1,0,0,0,1|2,0,0]=4 2526 B9R0.34 [C@@H](C)(CO)OC(C)OCC MCULE-1195285206 [0,1,0,0,0,1|1,0,0]=3 2527 B9R0.42 CCC(C)CC(C)C(=O)O MCULE-6856405301 [0,1,0,0,0,1|1,0,1]=4 2528 B9R0.6 CCCC(C)C(O)C(C)C MCULE-8969797324 [0,2,0,0,0,0|1,1,0]=4 2529 B9R0.6 CCCC(O)C(C)C(C)O MCULE-2897758601 [0,2,0,0,0,0|0,1,0]=3 2530 B9R0.6 COCC(C)C(C)C(=O)O MCULE-8168198082 [0,2,0,0,0,0|1,0,1]=4 2531 B9R0.25 CC(CO)C(N)C(C)(C)C MCULE-3677731378 [0,2,0,0,0,0|1,0,0]=3 2532 B9R0.25 CC(CO)C(O)C(C)(C)C MCULE-9367736640 [0,2,0,0,0,0|0,1,0]=3 2533 B9R0.25 CC(CO)N(C)C(C)(C)O MCULE-4397618271 [0,2,0,0,0,0|2,0,0]=4 2534 B9R0.29 CCC(C)C(CC)C(=O)N MCULE-4344033333 [0,2,0,0,0,0|1,1,0]=4 2535 B9R0.29 CCC(C)C(CO)N(C)C MCULE-7471164138 [0,2,0,0,0,0|1,0,0]=3 2536 B9R0.29 CCC(C)C(NC)C(=O)O MCULE-1957885665 [0,2,0,0,0,0|1,0,1]=4 2537 B9R0.29 CCC(C)C(OC)C(=O)O MCULE-7966384544 [0,2,0,0,0,0|1,0,1]=4 2538 B9R0.29 CC[C@@H](C)[C@H](NC)C(=O)O MCULE-8364477291 [0,2,0,0,0,0|1,0,1]=4 2539 B9R0.29 CC[C@H](C)[C@@H](CC)C(=O)N MCULE-3247505890 [0,2,0,0,0,0|1,1,0]=4 2540 B9R0.29 CC[C@H](C)[C@@H](NC)C(=O)O MCULE-6136891317 [0,2,0,0,0,0|1,0,1]=4 2541 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-1871065287 [0,2,0,0,0,0|1,0,1]=4 2542 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-3891615565 [0,2,0,0,0,0|1,0,1]=4 2543 B9R0.29 CC[C@H](C)[C@H](NC)C(=O)O MCULE-9489341112 [0,2,0,0,0,0|1,0,1]=4 2544 B9R0.29 [C@H](C)(CC)[C@H](NC)C(=O)O MCULE-1663789159 [0,2,0,0,0,0|1,0,1]=4 2545 B9R0.32 CC(C)C(=O)C(C)(C)CO MCULE-3368124870 [0,2,0,0,0,0|0,1,1]=4 2546 B9R0.32 CC(C)C(N)C(C)(C)CO MCULE-6267851118 [0,2,0,0,0,0|1,0,0]=3 2547 B9R0.32 CC(C)C(O)C(C)(C)CO MCULE-3777364262 [0,2,0,0,0,0|0,1,0]=3 2548 B9R0.32 CC(C)C(O)C(C)(C)CO MCULE-8458650598 [0,2,0,0,0,0|0,1,0]=3 2549 B9R0.41 CCC(CC)C(C)C(=O)O MCULE-8487981910 [0,2,0,0,0,0|1,0,1]=4 2550 B9R0.79 CC(C)[C@@H](O)[C@@H](C)C(=O)O MCULE-5667397461 [0,2,0,0,0,0|0,1,1]=4 2551 B9R0.8 CCCCC(C)C(C)CC MCULE-4441142939 [0,2,0,0,0,0|2,0,0]=4 2552 B9R0.8 COCCC(O)C(O)CO MCULE-8755237951 [0,2,0,0,0,0|1,1,0]=4 2553 B9R0.8 COCC[C@H](O)[C@H](O)CO MCULE-6552589711 [0,2,0,0,0,0|1,1,0]=4 2554 B9R0.19 CCCC(O)C(C)(C)CO MCULE-6796111058 [0,2,0,0,0,0|0,1,0]=3 2555 B9R0.19 CCOC(=O)C(C)(C)CO MCULE-4450228796 [0,2,0,0,0,0|0,1,1]=4 2556 B9R0.19 CCOC(=O)C(C)(O)CO MCULE-2282982715 [0,2,0,0,0,0|0,1,1]=4 2557 B9R0.23 CC(O)CN(C)C(C)CO MCULE-4772326357 [0,2,0,0,0,0|2,0,0]=4 2558 B9R0.23 CCC(C)C(N)CC(=O)O MCULE-4327977098 [0,2,0,0,0,0|2,0,0]=4 2559 B9R0.23 CCC(C)C(N)CC(=O)O MCULE-9731178196 [0,2,0,0,0,0|2,0,0]=4 2560 B9R0.23 CCN(C)C(C)CC(=O)O MCULE-8864839000 [0,2,0,0,0,0|2,0,0]=4 2561 B9R0.23 CCN(C)C(C)CC(=O)O MCULE-9691138087 [0,2,0,0,0,0|2,0,0]=4 2562 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-3497593262 [0,2,0,0,0,0|2,0,0]=4 2563 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-4155901879 [0,2,0,0,0,0|2,0,0]=4 2564 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-8221314475 [0,2,0,0,0,0|2,0,0]=4 2565 B9R0.23 CC[C@@H](C)[C@H](N)CC(=O)O MCULE-9196761404 [0,2,0,0,0,0|2,0,0]=4 2566 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O MCULE-2430009158 [0,2,0,0,0,0|2,0,0]=4 2567 B9R0.23 CC[C@H](C)[C@@H](N)CC(=O)O MCULE-9647386489 [0,2,0,0,0,0|2,0,0]=4 2568 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-2618743733 [0,2,0,0,0,0|2,0,0]=4 2569 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-5773439736 [0,2,0,0,0,0|2,0,0]=4 2570 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-6590436922 [0,2,0,0,0,0|2,0,0]=4 2571 B9R0.23 CC[C@H](C)[C@H](N)CC(=O)O MCULE-9722049324 [0,2,0,0,0,0|2,0,0]=4 2572 B9R0.35 CCCC(C)C(C)CCC MCULE-6352331898 [0,2,0,0,0,0|2,0,0]=4 2573 B9R0.35 CCCC(C)C(C)NCC MCULE-2966995580 [0,2,0,0,0,0|2,0,0]=4 2574 B9R0.35 CCCC(C)C(C)NCC MCULE-8532267003 [0,2,0,0,0,0|2,0,0]=4 2575 B9R0.35 CCCC(C)C(O)CCC MCULE-9443004795 [0,2,0,0,0,0|1,1,0]=4 2576 B9R0.35 COC[C@H](O)[C@@H](O)COC MCULE-8381238593 [0,2,0,0,0,0|1,1,0]=4 2577 B9R0.37 CCC(CC)C(N)CCO MCULE-9349458788 [0,2,0,0,0,0|2,0,0]=4 2578 B9R0.37 CCCC(O)C(CC)CO MCULE-4462593004 [0,2,0,0,0,0|0,1,0]=3 2579 B9R0.37 CCOC(=O)C(CO)CO MCULE-6705009475 [0,2,0,0,0,0|0,1,1]=4 2580 B9R0.31 CCC(C)(O)C(C)(O)CC MCULE-6311444082 [0,2,0,0,0,0|1,1,0]=4 2581 B9R0.31 CCC(F)(F)C(C)(C)CN MCULE-3046035680 [0,2,0,0,0,0|2,0,0]=4 2582 B9R0.31 CCC(F)(F)C(C)(C)CO MCULE-2186146542 [0,2,0,0,0,0|1,0,0]=3 2583 B9R0.71 CCN(CC)C(C)(C)CO MCULE-1931631398 [0,2,0,0,0,0|2,0,0]=4 2584 B9R0.36 CCC(CC)C(CC)CC MCULE-1538347361 [0,2,0,0,0,0|2,0,0]=4 2585 B7R1.1 BrCC1CCCC1 MCULE-2472505847 [1,0,0,1,0,0|1,0,0]=3 2586 B7R1.1 BrCC1CCCN1 MCULE-2152950124 [1,0,0,1,0,0|2,0,0]=4 2587 B7R1.1 BrCC1CCCN1 MCULE-6083580584 [1,0,0,1,0,0|2,0,0]=4 2588 B7R1.1 BrCC1CCCN1 MCULE-8116807965 [1,0,0,1,0,0|2,0,0]=4 2589 B7R1.1 BrCC1CCCO1 MCULE-6801721633 [1,0,0,1,0,0|2,0,0]=4 2590 B7R1.1 BrCC1CCNC1 MCULE-3841325509 [1,0,0,1,0,0|2,0,0]=4 2591 B7R1.1 BrCC1CCNC1 MCULE-4302321173 [1,0,0,1,0,0|2,0,0]=4 2592 B7R1.1 BrCC1CCNC1 MCULE-7802125485 [1,0,0,1,0,0|2,0,0]=4 2593 B7R1.1 BrCC1CCOC1 MCULE-5109533414 [1,0,0,1,0,0|2,0,0]=4 2594 B7R1.1 BrC[C@@H]1CCCN1 MCULE-2609238545 [1,0,0,1,0,0|2,0,0]=4 2595 B7R1.1 BrC[C@@H]1CCCN1 MCULE-4300877722 [1,0,0,1,0,0|2,0,0]=4 2596 B7R1.1 BrC[C@@H]1CCCN1 MCULE-7501559292 [1,0,0,1,0,0|2,0,0]=4 2597 B7R1.1 BrC[C@@H]1CCCN1 MCULE-9528927495 [1,0,0,1,0,0|2,0,0]=4 2598 B7R1.1 BrC[C@H]1CCCO1 MCULE-3468061610 [1,0,0,1,0,0|2,0,0]=4 2599 B7R1.1 BrC[C@H]1CCCO1 MCULE-9305844681 [1,0,0,1,0,0|2,0,0]=4 2600 B7R1.1 BrC[C@H]1CCOC1 MCULE-3326059942 [1,0,0,1,0,0|2,0,0]=4 2601 B7R1.1 C#CC1CCCC1 MCULE-2058689962 [1,0,0,1,0,0|1,0,1]=4 2602 B7R1.1 C1(CCCN1)CF MCULE-2705678622 [1,0,0,1,0,0|2,0,0]=4 2603 B7R1.1 C1(CCCN1)CF MCULE-3175080744 [1,0,0,1,0,0|2,0,0]=4 2604 B7R1.1 C1(CCCN1)CN MCULE-3568349121 [1,0,0,1,0,0|2,0,0]=4 2605 B7R1.1 C1(CCCN1)CN MCULE-9944820727 [1,0,0,1,0,0|2,0,0]=4 2606 B7R1.1 C1(CCCN1)CO MCULE-7277085817 [1,0,0,1,0,0|1,0,0]=3 2607 B7R1.1 C1(CCNC1)CC MCULE-1733412139 [1,0,0,1,0,0|2,0,0]=4 2608 B7R1.1 C1(CCNC1)CC MCULE-9295480110 [1,0,0,1,0,0|2,0,0]=4 2609 B7R1.1 C1(CCNC1)CO MCULE-7897000858 [1,0,0,1,0,0|1,0,0]=3 2610 B7R1.1 C1(CCNC1)CO MCULE-9939548436 [1,0,0,1,0,0|1,0,0]=3 2611 B7R1.1 C1(CCOC1)CN MCULE-1674920995 [1,0,0,1,0,0|2,0,0]=4 2612 B7R1.1 C1(CCOC1)CN MCULE-9715233219 [1,0,0,1,0,0|2,0,0]=4 2613 B7R1.1 C1(CCOC1)CO MCULE-2350780678 [1,0,0,1,0,0|1,0,0]=3 2614 B7R1.1 C1(CCOC1)NC MCULE-8636753374 [1,0,0,1,0,0|2,0,0]=4 2615 B7R1.1 C=CC1CCCC1 MCULE-6144532155 [1,0,0,1,0,0|1,0,1]=4 2616 B7R1.1 CCC1CCCC1 MCULE-1974854934 [1,0,0,1,0,0|1,0,0]=3 2617 B7R1.1 CCC1CCCN1 MCULE-1775351089 [1,0,0,1,0,0|2,0,0]=4 2618 B7R1.1 CCC1CCCN1 MCULE-2065682250 [1,0,0,1,0,0|2,0,0]=4 2619 B7R1.1 CCC1CCCN1 MCULE-8326168982 [1,0,0,1,0,0|2,0,0]=4 2620 B7R1.1 CCC1CCCN1 MCULE-9831560442 [1,0,0,1,0,0|2,0,0]=4 2621 B7R1.1 CCC1CCNC1 MCULE-1558031098 [1,0,0,1,0,0|2,0,0]=4 2622 B7R1.1 CCC1CCNC1 MCULE-1877930466 [1,0,0,1,0,0|2,0,0]=4 2623 B7R1.1 CCN1CCCC1 MCULE-3590039255 [1,0,0,1,0,0|2,0,0]=4 2624 B7R1.1 CC[C@@H]1CCCN1 MCULE-1829706908 [1,0,0,1,0,0|2,0,0]=4 2625 B7R1.1 CC[C@@H]1CCCN1 MCULE-6310895621 [1,0,0,1,0,0|2,0,0]=4 2626 B7R1.1 CC[C@@H]1CCCN1 MCULE-6770634475 [1,0,0,1,0,0|2,0,0]=4 2627 B7R1.1 CC[C@@H]1CCCN1 MCULE-9259891597 [1,0,0,1,0,0|2,0,0]=4 2628 B7R1.1 CC[C@@H]1CCNC1 MCULE-1468303255 [1,0,0,1,0,0|2,0,0]=4 2629 B7R1.1 CC[C@@H]1CCNC1 MCULE-2434021547 [1,0,0,1,0,0|2,0,0]=4 2630 B7R1.1 CC[C@@H]1CCNC1 MCULE-4288710106 [1,0,0,1,0,0|2,0,0]=4 2631 B7R1.1 CC[C@@H]1CCNC1 MCULE-5295271815 [1,0,0,1,0,0|2,0,0]=4 2632 B7R1.1 CC[C@H]1CCCN1 MCULE-2347458277 [1,0,0,1,0,0|2,0,0]=4 2633 B7R1.1 CC[C@H]1CCCN1 MCULE-3796565634 [1,0,0,1,0,0|2,0,0]=4 2634 B7R1.1 CC[C@H]1CCCN1 MCULE-6193768639 [1,0,0,1,0,0|2,0,0]=4 2635 B7R1.1 CC[C@H]1CCCN1 MCULE-9679619003 [1,0,0,1,0,0|2,0,0]=4 2636 B7R1.1 CC[C@H]1CCNC1 MCULE-5122116015 [1,0,0,1,0,0|2,0,0]=4 2637 B7R1.1 CC[C@H]1CCNC1 MCULE-5302237772 [1,0,0,1,0,0|2,0,0]=4 2638 B7R1.1 CC[C@H]1CCNC1 MCULE-9447387540 [1,0,0,1,0,0|2,0,0]=4 2639 B7R1.1 CC[C@H]1CCNC1 MCULE-9743799071 [1,0,0,1,0,0|2,0,0]=4 2640 B7R1.1 CNC1CCCC1 MCULE-1391832163 [1,0,0,1,0,0|2,0,0]=4 2641 B7R1.1 CNC1CCCC1 MCULE-8242451793 [1,0,0,1,0,0|2,0,0]=4 2642 B7R1.1 CNC1CCOC1 MCULE-5628928593 [1,0,0,1,0,0|2,0,0]=4 2643 B7R1.1 CNC1CCOC1 MCULE-7465078745 [1,0,0,1,0,0|2,0,0]=4 2644 B7R1.1 CNC1CCOC1 MCULE-8928979869 [1,0,0,1,0,0|2,0,0]=4 2645 B7R1.1 CN[C@@H]1CCOC1 MCULE-2275496757 [1,0,0,1,0,0|2,0,0]=4 2646 B7R1.1 CN[C@@H]1CCOC1 MCULE-4479731635 [1,0,0,1,0,0|2,0,0]=4 2647 B7R1.1 CN[C@@H]1CCOC1 MCULE-4936509842 [1,0,0,1,0,0|2,0,0]=4 2648 B7R1.1 CN[C@@H]1CCOC1 MCULE-7543653230 [1,0,0,1,0,0|2,0,0]=4 2649 B7R1.1 CN[C@H]1CCOC1 MCULE-3884907072 [1,0,0,1,0,0|2,0,0]=4 2650 B7R1.1 CN[C@H]1CCOC1 MCULE-5671082057 [1,0,0,1,0,0|2,0,0]=4 2651 B7R1.1 CN[C@H]1CCOC1 MCULE-7223789451 [1,0,0,1,0,0|2,0,0]=4 2652 B7R1.1 CN[C@H]1CCOC1 MCULE-7903690510 [1,0,0,1,0,0|2,0,0]=4 2653 B7R1.1 COC1CCCC1 MCULE-7539347010 [1,0,0,1,0,0|2,0,0]=4 2654 B7R1.1 ClCC1CCCC1 MCULE-7652893931 [1,0,0,1,0,0|1,0,0]=3 2655 B7R1.1 ClCC1CCCN1 MCULE-3656101962 [1,0,0,1,0,0|2,0,0]=4 2656 B7R1.1 ClCC1CCCN1 MCULE-9792407426 [1,0,0,1,0,0|2,0,0]=4 2657 B7R1.1 ClCC1CCCO1 MCULE-9816764842 [1,0,0,1,0,0|2,0,0]=4 2658 B7R1.1 ClCC1CCNC1 MCULE-3647066500 [1,0,0,1,0,0|2,0,0]=4 2659 B7R1.1 ClCC1CCNC1 MCULE-4046034551 [1,0,0,1,0,0|2,0,0]=4 2660 B7R1.1 ClCC1CCOC1 MCULE-1203835826 [1,0,0,1,0,0|2,0,0]=4 2661 B7R1.1 ClC[C@@H]1CCCN1 MCULE-1712418178 [1,0,0,1,0,0|2,0,0]=4 2662 B7R1.1 ClC[C@@H]1CCCN1 MCULE-2092217865 [1,0,0,1,0,0|2,0,0]=4 2663 B7R1.1 ClC[C@@H]1CCCN1 MCULE-4473753787 [1,0,0,1,0,0|2,0,0]=4 2664 B7R1.1 ClC[C@@H]1CCCN1 MCULE-9545872560 [1,0,0,1,0,0|2,0,0]=4 2665 B7R1.1 ClC[C@@H]1CCNC1 MCULE-3561633948 [1,0,0,1,0,0|2,0,0]=4 2666 B7R1.1 ClC[C@@H]1CCNC1 MCULE-9146547190 [1,0,0,1,0,0|2,0,0]=4 2667 B7R1.1 ClC[C@H]1CCCN1 MCULE-1186865731 [1,0,0,1,0,0|2,0,0]=4 2668 B7R1.1 ClC[C@H]1CCCN1 MCULE-3107383611 [1,0,0,1,0,0|2,0,0]=4 2669 B7R1.1 ClC[C@H]1CCNC1 MCULE-1113644310 [1,0,0,1,0,0|2,0,0]=4 2670 B7R1.1 ClC[C@H]1CCNC1 MCULE-4950070763 [1,0,0,1,0,0|2,0,0]=4 2671 B7R1.1 FCC1CCCN1 MCULE-3216030316 [1,0,0,1,0,0|2,0,0]=4 2672 B7R1.1 FCC1CCCN1 MCULE-4540803550 [1,0,0,1,0,0|2,0,0]=4 2673 B7R1.1 FCC1CCNC1 MCULE-1978414491 [1,0,0,1,0,0|2,0,0]=4 2674 B7R1.1 FCC1CCNC1 MCULE-5950087621 [1,0,0,1,0,0|2,0,0]=4 2675 B7R1.1 FCC1CCNC1 MCULE-7750703127 [1,0,0,1,0,0|2,0,0]=4 2676 B7R1.1 FCC1CCNC1 MCULE-8603606998 [1,0,0,1,0,0|2,0,0]=4 2677 B7R1.1 FC[C@@H]1CCCN1 MCULE-2463314208 [1,0,0,1,0,0|2,0,0]=4 2678 B7R1.1 FC[C@@H]1CCCN1 MCULE-3740139569 [1,0,0,1,0,0|2,0,0]=4 2679 B7R1.1 FC[C@@H]1CCCN1 MCULE-6899304468 [1,0,0,1,0,0|2,0,0]=4 2680 B7R1.1 FC[C@@H]1CCCN1 MCULE-9916936373 [1,0,0,1,0,0|2,0,0]=4 2681 B7R1.1 FC[C@@H]1CCNC1 MCULE-2159002313 [1,0,0,1,0,0|2,0,0]=4 2682 B7R1.1 FC[C@@H]1CCNC1 MCULE-4712597711 [1,0,0,1,0,0|2,0,0]=4 2683 B7R1.1 FC[C@@H]1CCNC1 MCULE-6166975534 [1,0,0,1,0,0|2,0,0]=4 2684 B7R1.1 FC[C@@H]1CCNC1 MCULE-7608233986 [1,0,0,1,0,0|2,0,0]=4 2685 B7R1.1 FC[C@H]1CCCN1 MCULE-1380365453 [1,0,0,1,0,0|2,0,0]=4 2686 B7R1.1 FC[C@H]1CCCN1 MCULE-1512160666 [1,0,0,1,0,0|2,0,0]=4 2687 B7R1.1 FC[C@H]1CCCN1 MCULE-2904385734 [1,0,0,1,0,0|2,0,0]=4 2688 B7R1.1 FC[C@H]1CCCN1 MCULE-9837641384 [1,0,0,1,0,0|2,0,0]=4 2689 B7R1.1 FC[C@H]1CCNC1 MCULE-2828011524 [1,0,0,1,0,0|2,0,0]=4 2690 B7R1.1 FC[C@H]1CCNC1 MCULE-4192540640 [1,0,0,1,0,0|2,0,0]=4 2691 B7R1.1 FC[C@H]1CCNC1 MCULE-5280605995 [1,0,0,1,0,0|2,0,0]=4 2692 B7R1.1 FC[C@H]1CCNC1 MCULE-8886310417 [1,0,0,1,0,0|2,0,0]=4 2693 B7R1.1 ICC1CCCC1 MCULE-5940886897 [1,0,0,1,0,0|1,0,0]=3 2694 B7R1.1 ICC1CCCN1 MCULE-3467617934 [1,0,0,1,0,0|2,0,0]=4 2695 B7R1.1 ICC1CCCN1 MCULE-7784862806 [1,0,0,1,0,0|2,0,0]=4 2696 B7R1.1 ICC1CCCO1 MCULE-3981288245 [1,0,0,1,0,0|2,0,0]=4 2697 B7R1.1 ICC1CCNC1 MCULE-4259439945 [1,0,0,1,0,0|2,0,0]=4 2698 B7R1.1 ICC1CCNC1 MCULE-6061564929 [1,0,0,1,0,0|2,0,0]=4 2699 B7R1.1 ICC1CCOC1 MCULE-2014671156 [1,0,0,1,0,0|2,0,0]=4 2700 B7R1.1 IC[C@@H]1CCCN1 MCULE-4843756038 [1,0,0,1,0,0|2,0,0]=4 2701 B7R1.1 IC[C@@H]1CCCN1 MCULE-8213667136 [1,0,0,1,0,0|2,0,0]=4 2702 B7R1.1 IC[C@H]1CCOC1 MCULE-5163407500 [1,0,0,1,0,0|2,0,0]=4 2703 B7R1.1 N#CC1CCCC1 MCULE-1484517612 [1,0,0,1,0,0|1,0,1]=4 2704 B7R1.1 NCC1CCCC1 MCULE-3629796849 [1,0,0,1,0,0|1,0,0]=3 2705 B7R1.1 NCC1CCCC1 MCULE-8453900433 [1,0,0,1,0,0|1,0,0]=3 2706 B7R1.1 NCC1CCCN1 MCULE-4764684364 [1,0,0,1,0,0|2,0,0]=4 2707 B7R1.1 NCC1CCCN1 MCULE-8971980286 [1,0,0,1,0,0|2,0,0]=4 2708 B7R1.1 NCC1CCCO1 MCULE-2797516262 [1,0,0,1,0,0|2,0,0]=4 2709 B7R1.1 NCC1CCCO1 MCULE-5970677903 [1,0,0,1,0,0|2,0,0]=4 2710 B7R1.1 NCC1CCCO1 MCULE-6166235034 [1,0,0,1,0,0|2,0,0]=4 2711 B7R1.1 NCC1CCCS1 MCULE-5278325816 [1,0,0,1,0,0|2,0,0]=4 2712 B7R1.1 NCC1CCNC1 MCULE-1458513231 [1,0,0,1,0,0|2,0,0]=4 2713 B7R1.1 NCC1CCNC1 MCULE-3817893631 [1,0,0,1,0,0|2,0,0]=4 2714 B7R1.1 NCC1CCOC1 MCULE-4208746127 [1,0,0,1,0,0|2,0,0]=4 2715 B7R1.1 NCC1CCOC1 MCULE-6540410947 [1,0,0,1,0,0|2,0,0]=4 2716 B7R1.1 NCC1CCSC1 MCULE-6868901477 [1,0,0,1,0,0|2,0,0]=4 2717 B7R1.1 NC[C@@H]1CCCN1 MCULE-4726727563 [1,0,0,1,0,0|2,0,0]=4 2718 B7R1.1 NC[C@@H]1CCCN1 MCULE-7513400460 [1,0,0,1,0,0|2,0,0]=4 2719 B7R1.1 NC[C@@H]1CCCN1 MCULE-7622329174 [1,0,0,1,0,0|2,0,0]=4 2720 B7R1.1 NC[C@@H]1CCCN1 MCULE-8573395464 [1,0,0,1,0,0|2,0,0]=4 2721 B7R1.1 NC[C@@H]1CCCO1 MCULE-1103643839 [1,0,0,1,0,0|2,0,0]=4 2722 B7R1.1 NC[C@@H]1CCCO1 MCULE-1402571993 [1,0,0,1,0,0|2,0,0]=4 2723 B7R1.1 NC[C@@H]1CCCO1 MCULE-1448381041 [1,0,0,1,0,0|2,0,0]=4 2724 B7R1.1 NC[C@@H]1CCCO1 MCULE-6664501749 [1,0,0,1,0,0|2,0,0]=4 2725 B7R1.1 NC[C@@H]1CCOC1 MCULE-2941934022 [1,0,0,1,0,0|2,0,0]=4 2726 B7R1.1 NC[C@@H]1CCOC1 MCULE-2981279377 [1,0,0,1,0,0|2,0,0]=4 2727 B7R1.1 NC[C@@H]1CCOC1 MCULE-6671508282 [1,0,0,1,0,0|2,0,0]=4 2728 B7R1.1 NC[C@@H]1CCOC1 MCULE-7170580817 [1,0,0,1,0,0|2,0,0]=4 2729 B7R1.1 NC[C@H]1CCCN1 MCULE-2813912286 [1,0,0,1,0,0|2,0,0]=4 2730 B7R1.1 NC[C@H]1CCCN1 MCULE-5505144820 [1,0,0,1,0,0|2,0,0]=4 2731 B7R1.1 NC[C@H]1CCCN1 MCULE-7325312327 [1,0,0,1,0,0|2,0,0]=4 2732 B7R1.1 NC[C@H]1CCCN1 MCULE-7708925831 [1,0,0,1,0,0|2,0,0]=4 2733 B7R1.1 NC[C@H]1CCCO1 MCULE-1196018690 [1,0,0,1,0,0|2,0,0]=4 2734 B7R1.1 NC[C@H]1CCCO1 MCULE-2037746017 [1,0,0,1,0,0|2,0,0]=4 2735 B7R1.1 NC[C@H]1CCCO1 MCULE-3470426685 [1,0,0,1,0,0|2,0,0]=4 2736 B7R1.1 NC[C@H]1CCCO1 MCULE-9918683284 [1,0,0,1,0,0|2,0,0]=4 2737 B7R1.1 NC[C@H]1CCOC1 MCULE-1537228220 [1,0,0,1,0,0|2,0,0]=4 2738 B7R1.1 NC[C@H]1CCOC1 MCULE-2673094483 [1,0,0,1,0,0|2,0,0]=4 2739 B7R1.1 NC[C@H]1CCOC1 MCULE-4873739830 [1,0,0,1,0,0|2,0,0]=4 2740 B7R1.1 NC[C@H]1CCOC1 MCULE-6059527282 [1,0,0,1,0,0|2,0,0]=4 2741 B7R1.1 NNC1CCCC1 MCULE-1363058529 [1,0,0,1,0,0|2,0,0]=4 2742 B7R1.1 NNC1CCCC1 MCULE-2803402819 [1,0,0,1,0,0|2,0,0]=4 2743 B7R1.1 NNC1CCCC1 MCULE-5556380186 [1,0,0,1,0,0|2,0,0]=4 2744 B7R1.1 NOC1CCCC1 MCULE-1504814106 [1,0,0,1,0,0|2,0,0]=4 2745 B7R1.1 NOC1CCCC1 MCULE-1973418119 [1,0,0,1,0,0|2,0,0]=4 2746 B7R1.1 O=CC1CCCC1 MCULE-4938681495 [1,0,0,1,0,0|0,0,2]=4 2747 B7R1.1 OCC1=CCCC1 MCULE-8850570361 [1,0,0,1,0,0|0,0,2]=4 2748 B7R1.1 OCC1C=CCC1 MCULE-1237002603 [1,0,0,1,0,0|0,0,2]=4 2749 B7R1.1 OCC1CC=CC1 MCULE-4213030098 [1,0,0,1,0,0|0,0,2]=4 2750 B7R1.1 OCC1CCCC1 MCULE-2985338933 [1,0,0,1,0,0|0,0,0]=2 2751 B7R1.1 OCC1CCCN1 MCULE-1016922679 [1,0,0,1,0,0|1,0,0]=3 2752 B7R1.1 OCC1CCCN1 MCULE-8224535891 [1,0,0,1,0,0|1,0,0]=3 2753 B7R1.1 OCC1CCCO1 MCULE-5877114547 [1,0,0,1,0,0|1,0,0]=3 2754 B7R1.1 OCC1CCCO1 MCULE-5884880244 [1,0,0,1,0,0|1,0,0]=3 2755 B7R1.1 OCC1CCCS1 MCULE-6106081414 [1,0,0,1,0,0|1,0,0]=3 2756 B7R1.1 OCC1CCNC1 MCULE-7883947611 [1,0,0,1,0,0|1,0,0]=3 2757 B7R1.1 OCC1CCNC1 MCULE-9689521155 [1,0,0,1,0,0|1,0,0]=3 2758 B7R1.1 OCC1CCOC1 MCULE-8926405046 [1,0,0,1,0,0|1,0,0]=3 2759 B7R1.1 OCC1CCON1 MCULE-1199975481 [1,0,0,1,0,0|2,0,0]=4 2760 B7R1.1 OCC1CCON1 MCULE-4772487016 [1,0,0,1,0,0|2,0,0]=4 2761 B7R1.1 OCC1CCSC1 MCULE-2226132734 [1,0,0,1,0,0|1,0,0]=3 2762 B7R1.1 OCC1COCO1 MCULE-3470022742 [1,0,0,1,0,0|2,0,0]=4 2763 B7R1.1 OCC1OCCO1 MCULE-8334027179 [1,0,0,1,0,0|2,0,0]=4 2764 B7R1.1 OC[C@@H]1CCCN1 MCULE-1791547752 [1,0,0,1,0,0|1,0,0]=3 2765 B7R1.1 OC[C@@H]1CCCN1 MCULE-6448856585 [1,0,0,1,0,0|1,0,0]=3 2766 B7R1.1 OC[C@@H]1CCCN1 MCULE-7214801659 [1,0,0,1,0,0|1,0,0]=3 2767 B7R1.1 OC[C@@H]1CCCN1 MCULE-7248451975 [1,0,0,1,0,0|1,0,0]=3 2768 B7R1.1 OC[C@@H]1CCCO1 MCULE-1788377708 [1,0,0,1,0,0|1,0,0]=3 2769 B7R1.1 OC[C@@H]1CCCO1 MCULE-3533553137 [1,0,0,1,0,0|1,0,0]=3 2770 B7R1.1 OC[C@@H]1CCNC1 MCULE-3126404140 [1,0,0,1,0,0|1,0,0]=3 2771 B7R1.1 OC[C@@H]1CCNC1 MCULE-4876549629 [1,0,0,1,0,0|1,0,0]=3 2772 B7R1.1 OC[C@@H]1CCNC1 MCULE-7050415145 [1,0,0,1,0,0|1,0,0]=3 2773 B7R1.1 OC[C@@H]1CCNC1 MCULE-8785146407 [1,0,0,1,0,0|1,0,0]=3 2774 B7R1.1 OC[C@@H]1CCOC1 MCULE-2004616524 [1,0,0,1,0,0|1,0,0]=3 2775 B7R1.1 OC[C@@H]1CCOC1 MCULE-3801423698 [1,0,0,1,0,0|1,0,0]=3 2776 B7R1.1 OC[C@H]1CCCN1 MCULE-1266532697 [1,0,0,1,0,0|1,0,0]=3 2777 B7R1.1 OC[C@H]1CCCN1 MCULE-1724166794 [1,0,0,1,0,0|1,0,0]=3 2778 B7R1.1 OC[C@H]1CCCN1 MCULE-7513431964 [1,0,0,1,0,0|1,0,0]=3 2779 B7R1.1 OC[C@H]1CCCN1 MCULE-8398083695 [1,0,0,1,0,0|1,0,0]=3 2780 B7R1.1 OC[C@H]1CCCO1 MCULE-3501680239 [1,0,0,1,0,0|1,0,0]=3 2781 B7R1.1 OC[C@H]1CCCO1 MCULE-4925106568 [1,0,0,1,0,0|1,0,0]=3 2782 B7R1.1 OC[C@H]1CCNC1 MCULE-3909770597 [1,0,0,1,0,0|1,0,0]=3 2783 B7R1.1 OC[C@H]1CCNC1 MCULE-5006682123 [1,0,0,1,0,0|1,0,0]=3 2784 B7R1.1 OC[C@H]1CCNC1 MCULE-8265382423 [1,0,0,1,0,0|1,0,0]=3 2785 B7R1.1 OC[C@H]1CCNC1 MCULE-8371969680 [1,0,0,1,0,0|1,0,0]=3 2786 B7R1.1 OC[C@H]1CCOC1 MCULE-4226412289 [1,0,0,1,0,0|1,0,0]=3 2787 B7R1.1 OC[C@H]1CCOC1 MCULE-9076004118 [1,0,0,1,0,0|1,0,0]=3 2788 B7R1.1 ON=C1CCCC1 MCULE-9338449832 [1,0,0,1,0,0|1,0,1]=4 2789 B7R1.1 ONC1CCCC1 MCULE-1143510043 [1,0,0,1,0,0|1,0,0]=3 2790 B7R1.1 ONC1CCCC1 MCULE-7548854169 [1,0,0,1,0,0|1,0,0]=3 2791 B7R1.1 SCC1CCCC1 MCULE-7973872166 [1,0,0,1,0,0|0,1,0]=3 2792 B7R1.1 SCC1CCCO1 MCULE-5962232488 [1,0,0,1,0,0|1,1,0]=4 2793 B7R1.1 SCC1CCOC1 MCULE-4504314486 [1,0,0,1,0,0|1,1,0]=4 2794 B7R1.2 C1(CCN(C1)C)O MCULE-5142099784 [1,0,0,1,0,0|2,0,0]=4 2795 B7R1.2 CC1=NC(CO1)C MCULE-2489340707 [1,0,0,1,0,0|1,0,1]=4 2796 B7R1.2 CC1CC(=O)CO1 MCULE-7022597277 [1,0,0,1,0,0|1,0,1]=4 2797 B7R1.2 CC1CC(CN1)F MCULE-5211772527 [1,0,0,1,0,0|2,0,0]=4 2798 B7R1.2 CC1CC(CN1)F MCULE-6845898511 [1,0,0,1,0,0|2,0,0]=4 2799 B7R1.2 CC1CC(CN1)O MCULE-5630063862 [1,0,0,1,0,0|2,0,0]=4 2800 B7R1.2 CC1CC(CN1)O MCULE-7427731937 [1,0,0,1,0,0|2,0,0]=4 2801 B7R1.2 CC1CC(CO1)N MCULE-5031195609 [1,0,0,1,0,0|1,0,0]=3 2802 B7R1.2 CC1CC(CO1)N MCULE-6627149239 [1,0,0,1,0,0|1,0,0]=3 2803 B7R1.2 CC1CC(CO1)O MCULE-1304022283 [1,0,0,1,0,0|1,0,0]=3 2804 B7R1.2 CC1CC(CS1)N MCULE-2886562999 [1,0,0,1,0,0|1,1,0]=4 2805 B7R1.2 CC1CCC(C1)Br MCULE-3834311364 [1,0,0,1,0,0|2,0,0]=4 2806 B7R1.2 CC1CCC(C1)Cl MCULE-7669391571 [1,0,0,1,0,0|2,0,0]=4 2807 B7R1.2 CC1CCC(C1)N MCULE-3681457592 [1,0,0,1,0,0|2,0,0]=4 2808 B7R1.2 CC1CCC(C1)N MCULE-8238390084 [1,0,0,1,0,0|2,0,0]=4 2809 B7R1.2 CC1CCC(C1)O MCULE-7892602703 [1,0,0,1,0,0|1,0,0]=3 2810 B7R1.2 CC1CCC(N1)C MCULE-8652550641 [1,0,0,1,0,0|2,0,0]=4 2811 B7R1.2 CC1CCC(N1)C MCULE-9945795318 [1,0,0,1,0,0|2,0,0]=4 2812 B7R1.2 CC1CCC(O1)C MCULE-6766843462 [1,0,0,1,0,0|2,0,0]=4 2813 B7R1.2 CC1CC[C@H](N1)C MCULE-7537248866 [1,0,0,1,0,0|2,0,0]=4 2814 B7R1.2 CC1CC[C@H](N1)C MCULE-8839413924 [1,0,0,1,0,0|2,0,0]=4 2815 B7R1.2 CC1CNC(C1)C MCULE-3051496448 [1,0,0,1,0,0|1,0,0]=3 2816 B7R1.2 CC1CNC(C1)C MCULE-9324057254 [1,0,0,1,0,0|1,0,0]=3 2817 B7R1.2 CC1COC(=O)C1 MCULE-7226555218 [1,0,0,1,0,0|1,0,1]=4 2818 B7R1.2 CC1COC(O1)C MCULE-5670718739 [1,0,0,1,0,0|1,0,0]=3 2819 B7R1.2 CN1CCC(C1)O MCULE-7899934177 [1,0,0,1,0,0|2,0,0]=4 2820 B7R1.2 CN1CC[C@@H](C1)O MCULE-1236945758 [1,0,0,1,0,0|2,0,0]=4 2821 B7R1.2 CN1CC[C@@H](C1)O MCULE-4275527304 [1,0,0,1,0,0|2,0,0]=4 2822 B7R1.2 CN1CC[C@H](C1)O MCULE-6665002754 [1,0,0,1,0,0|2,0,0]=4 2823 B7R1.2 CN1CC[C@H](C1)O MCULE-8080661086 [1,0,0,1,0,0|2,0,0]=4 2824 B7R1.2 C[C@@H]1CC[C@@H](C1)N MCULE-9471729241 [1,0,0,1,0,0|2,0,0]=4 2825 B7R1.2 C[C@@H]1CC[C@H](C1)N MCULE-5368765184 [1,0,0,1,0,0|2,0,0]=4 2826 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-1673197449 [1,0,0,1,0,0|2,0,0]=4 2827 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-2729648845 [1,0,0,1,0,0|2,0,0]=4 2828 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-4960548681 [1,0,0,1,0,0|2,0,0]=4 2829 B7R1.2 C[C@@H]1CC[C@H](N1)C MCULE-9686295802 [1,0,0,1,0,0|2,0,0]=4 2830 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1121808555 [1,0,0,1,0,0|1,0,1]=4 2831 B7R1.2 C[C@@H]1COC(=O)C1 MCULE-1627827491 [1,0,0,1,0,0|1,0,1]=4 2832 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-1790804170 [1,0,0,1,0,0|2,0,0]=4 2833 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-2224321786 [1,0,0,1,0,0|2,0,0]=4 2834 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6164070045 [1,0,0,1,0,0|2,0,0]=4 2835 B7R1.2 C[C@@H]1C[C@@H](CN1)F MCULE-6870592338 [1,0,0,1,0,0|2,0,0]=4 2836 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-1211015225 [1,0,0,1,0,0|2,0,0]=4 2837 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8025231795 [1,0,0,1,0,0|2,0,0]=4 2838 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8074184383 [1,0,0,1,0,0|2,0,0]=4 2839 B7R1.2 C[C@@H]1C[C@@H](CN1)O MCULE-8403784233 [1,0,0,1,0,0|2,0,0]=4 2840 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-1165785658 [1,0,0,1,0,0|2,0,0]=4 2841 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-2237025386 [1,0,0,1,0,0|2,0,0]=4 2842 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-4695463101 [1,0,0,1,0,0|2,0,0]=4 2843 B7R1.2 C[C@@H]1C[C@H](CN1)F MCULE-9859386988 [1,0,0,1,0,0|2,0,0]=4 2844 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-4359200896 [1,0,0,1,0,0|2,0,0]=4 2845 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-5029850022 [1,0,0,1,0,0|2,0,0]=4 2846 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8880723450 [1,0,0,1,0,0|2,0,0]=4 2847 B7R1.2 C[C@@H]1C[C@H](CN1)O MCULE-8966000465 [1,0,0,1,0,0|2,0,0]=4 2848 B7R1.2 C[C@H]1CC[C@@H](C1)N MCULE-1080493056 [1,0,0,1,0,0|2,0,0]=4 2849 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-4583560293 [1,0,0,1,0,0|2,0,0]=4 2850 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8297612622 [1,0,0,1,0,0|2,0,0]=4 2851 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8699883146 [1,0,0,1,0,0|2,0,0]=4 2852 B7R1.2 C[C@H]1CC[C@@H](N1)C MCULE-8917914682 [1,0,0,1,0,0|2,0,0]=4 2853 B7R1.2 C[C@H]1CC[C@H](C1)C MCULE-8059507758 [1,0,0,1,0,0|1,0,0]=3 2854 B7R1.2 C[C@H]1CC[C@H](C1)N MCULE-7070775136 [1,0,0,1,0,0|2,0,0]=4 2855 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-1935235769 [1,0,0,1,0,0|2,0,0]=4 2856 B7R1.2 C[C@H]1CC[C@H](N1)C MCULE-9833374653 [1,0,0,1,0,0|2,0,0]=4 2857 B7R1.2 C[C@H]1COC(=O)C1 MCULE-6050720348 [1,0,0,1,0,0|1,0,1]=4 2858 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-1742492020 [1,0,0,1,0,0|2,0,0]=4 2859 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-4690497151 [1,0,0,1,0,0|2,0,0]=4 2860 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-7372620241 [1,0,0,1,0,0|2,0,0]=4 2861 B7R1.2 C[C@H]1C[C@@H](CN1)F MCULE-8319027426 [1,0,0,1,0,0|2,0,0]=4 2862 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-1346257695 [1,0,0,1,0,0|2,0,0]=4 2863 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-3035291598 [1,0,0,1,0,0|2,0,0]=4 2864 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-8611352921 [1,0,0,1,0,0|2,0,0]=4 2865 B7R1.2 C[C@H]1C[C@@H](CN1)O MCULE-9413190353 [1,0,0,1,0,0|2,0,0]=4 2866 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-1099206732 [1,0,0,1,0,0|2,0,0]=4 2867 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8257992498 [1,0,0,1,0,0|2,0,0]=4 2868 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-8335445065 [1,0,0,1,0,0|2,0,0]=4 2869 B7R1.2 C[C@H]1C[C@H](CN1)F MCULE-9395416229 [1,0,0,1,0,0|2,0,0]=4 2870 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-3188785695 [1,0,0,1,0,0|2,0,0]=4 2871 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-4518572489 [1,0,0,1,0,0|2,0,0]=4 2872 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-5322353871 [1,0,0,1,0,0|2,0,0]=4 2873 B7R1.2 C[C@H]1C[C@H](CN1)O MCULE-9693826142 [1,0,0,1,0,0|2,0,0]=4 2874 B7R1.2 NC1CCC(C1)F MCULE-1052463910 [1,0,0,1,0,0|2,0,0]=4 2875 B7R1.2 NC1CCC(C1)F MCULE-1362820422 [1,0,0,1,0,0|2,0,0]=4 2876 B7R1.2 NC1CCC(C1)N MCULE-7855552124 [1,0,0,1,0,0|2,0,0]=4 2877 B7R1.2 NC1CCC(C1)N MCULE-9706705284 [1,0,0,1,0,0|2,0,0]=4 2878 B7R1.2 NC1CCC(C1)O MCULE-5821071286 [1,0,0,1,0,0|1,0,0]=3 2879 B7R1.2 NC1CCC(C1)O MCULE-9391783901 [1,0,0,1,0,0|1,0,0]=3 2880 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-1039943323 [1,0,0,1,0,0|2,0,0]=4 2881 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-3861238775 [1,0,0,1,0,0|2,0,0]=4 2882 B7R1.2 N[C@@H]1CC[C@@H](C1)F MCULE-4709681384 [1,0,0,1,0,0|2,0,0]=4 2883 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-2973461190 [1,0,0,1,0,0|1,0,0]=3 2884 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-5462229704 [1,0,0,1,0,0|1,0,0]=3 2885 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-6746606174 [1,0,0,1,0,0|1,0,0]=3 2886 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7196403409 [1,0,0,1,0,0|1,0,0]=3 2887 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-7511735313 [1,0,0,1,0,0|1,0,0]=3 2888 B7R1.2 N[C@@H]1CC[C@@H](C1)O MCULE-9023897758 [1,0,0,1,0,0|1,0,0]=3 2889 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-1973308112 [1,0,0,1,0,0|2,0,0]=4 2890 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-2885294836 [1,0,0,1,0,0|2,0,0]=4 2891 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-3217124168 [1,0,0,1,0,0|2,0,0]=4 2892 B7R1.2 N[C@@H]1CC[C@H](C1)F MCULE-3983968357 [1,0,0,1,0,0|2,0,0]=4 2893 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-2953432986 [1,0,0,1,0,0|2,0,0]=4 2894 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-5679004800 [1,0,0,1,0,0|2,0,0]=4 2895 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-7275989455 [1,0,0,1,0,0|2,0,0]=4 2896 B7R1.2 N[C@@H]1CC[C@H](C1)N MCULE-9713633356 [1,0,0,1,0,0|2,0,0]=4 2897 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-3286276562 [1,0,0,1,0,0|1,0,0]=3 2898 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-5345953109 [1,0,0,1,0,0|1,0,0]=3 2899 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-6442703385 [1,0,0,1,0,0|1,0,0]=3 2900 B7R1.2 N[C@@H]1CC[C@H](C1)O MCULE-7457197538 [1,0,0,1,0,0|1,0,0]=3 2901 B7R1.2 N[C@H]1CC[C@@H](C1)F MCULE-7847317272 [1,0,0,1,0,0|2,0,0]=4 2902 B7R1.2 N[C@H]1CC[C@@H](C1)F MCULE-8833201415 [1,0,0,1,0,0|2,0,0]=4 2903 B7R1.2 N[C@H]1CC[C@@H](C1)N MCULE-3035711729 [1,0,0,1,0,0|2,0,0]=4 2904 B7R1.2 N[C@H]1CC[C@@H](C1)N MCULE-6912512686 [1,0,0,1,0,0|2,0,0]=4 2905 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-2764158583 [1,0,0,1,0,0|1,0,0]=3 2906 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-5047569623 [1,0,0,1,0,0|1,0,0]=3 2907 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-7674066148 [1,0,0,1,0,0|1,0,0]=3 2908 B7R1.2 N[C@H]1CC[C@@H](C1)O MCULE-8478778872 [1,0,0,1,0,0|1,0,0]=3 2909 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-1792150017 [1,0,0,1,0,0|2,0,0]=4 2910 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-4563758183 [1,0,0,1,0,0|2,0,0]=4 2911 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-4785441600 [1,0,0,1,0,0|2,0,0]=4 2912 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-5413630050 [1,0,0,1,0,0|2,0,0]=4 2913 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-7223746698 [1,0,0,1,0,0|2,0,0]=4 2914 B7R1.2 N[C@H]1CC[C@H](C1)F MCULE-9000616089 [1,0,0,1,0,0|2,0,0]=4 2915 B7R1.2 N[C@H]1CC[C@H](C1)N MCULE-3378648870 [1,0,0,1,0,0|2,0,0]=4 2916 B7R1.2 N[C@H]1CC[C@H](C1)N MCULE-7356571170 [1,0,0,1,0,0|2,0,0]=4 2917 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-3786824722 [1,0,0,1,0,0|1,0,0]=3 2918 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-4140170961 [1,0,0,1,0,0|1,0,0]=3 2919 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5760466174 [1,0,0,1,0,0|1,0,0]=3 2920 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-5995468864 [1,0,0,1,0,0|1,0,0]=3 2921 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-6230469368 [1,0,0,1,0,0|1,0,0]=3 2922 B7R1.2 N[C@H]1CC[C@H](C1)O MCULE-9622062244 [1,0,0,1,0,0|1,0,0]=3 2923 B7R1.2 O=C1CCC(C1)O MCULE-8500536547 [1,0,0,1,0,0|0,1,1]=4 2924 B7R1.2 OC1CCC(C1)O MCULE-2799846813 [1,0,0,1,0,0|0,1,0]=3 2925 B7R1.2 OC1CCC(O1)O MCULE-8012370358 [1,0,0,1,0,0|1,1,0]=4 2926 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-4481324218 [1,0,0,1,0,0|0,1,0]=3 2927 B7R1.2 O[C@@H]1CC[C@H](C1)O MCULE-6560672131 [1,0,0,1,0,0|0,1,0]=3 2928 B7R1.2 O[C@H]1CC[C@H](C1)O MCULE-4640874873 [1,0,0,1,0,0|0,1,0]=3 2929 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-3137346382 [1,0,0,1,0,0|1,0,0]=3 2930 B7R1.2 [C@@H]1(CC[C@@H](C1)O)N MCULE-9954737796 [1,0,0,1,0,0|1,0,0]=3 2931 B7R1.2 [C@H]1(CC[C@H](C1)O)O MCULE-4834858159 [1,0,0,1,0,0|0,1,0]=3 2932 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-1916837136 [1,0,0,1,0,0|2,0,0]=4 2933 B7R1.2 [C@H]1(CN[C@@H](C1)C)O MCULE-8263093896 [1,0,0,1,0,0|2,0,0]=4 2934 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9065610836 [1,0,0,1,0,0|2,0,0]=4 2935 B7R1.2 [C@H]1(CN[C@H](C1)C)O MCULE-9910248291 [1,0,0,1,0,0|2,0,0]=4 2936 B7R1.3 BrC1CCCCC1 MCULE-7879113781 [1,0,0,1,0,0|2,0,0]=4 2937 B7R1.3 BrC1CCCNC1 MCULE-5734359694 [1,0,0,1,0,0|2,0,0]=4 2938 B7R1.3 BrC1CCCNC1 MCULE-8772964999 [1,0,0,1,0,0|2,0,0]=4 2939 B7R1.3 BrC1CCCNC1 MCULE-9975168983 [1,0,0,1,0,0|2,0,0]=4 2940 B7R1.3 BrC1CCCOC1 MCULE-5781416415 [1,0,0,1,0,0|1,0,0]=3 2941 B7R1.3 BrC1CCNCC1 MCULE-2524082443 [1,0,0,1,0,0|2,0,0]=4 2942 B7R1.3 BrC1CCNCC1 MCULE-9389571955 [1,0,0,1,0,0|2,0,0]=4 2943 B7R1.3 BrC1CCNCC1 MCULE-9646097822 [1,0,0,1,0,0|2,0,0]=4 2944 B7R1.3 BrC1CCOCC1 MCULE-4896539126 [1,0,0,1,0,0|1,0,0]=3 2945 B7R1.3 BrC1CCSCC1 MCULE-1239956252 [1,0,0,1,0,0|1,1,0]=4 2946 B7R1.3 C1(CCCNC1)F MCULE-2873742972 [1,0,0,1,0,0|2,0,0]=4 2947 B7R1.3 C1(CCCNC1)F MCULE-8247715411 [1,0,0,1,0,0|2,0,0]=4 2948 B7R1.3 C1(CCCNC1)N MCULE-2184623611 [1,0,0,1,0,0|2,0,0]=4 2949 B7R1.3 C1(CCCNC1)N MCULE-6177601832 [1,0,0,1,0,0|2,0,0]=4 2950 B7R1.3 C1(CCCNC1)O MCULE-5944071030 [1,0,0,1,0,0|2,0,0]=4 2951 B7R1.3 C1(CCCNC1)O MCULE-9769032939 [1,0,0,1,0,0|2,0,0]=4 2952 B7R1.3 C1(CCCOC1)N MCULE-7160456966 [1,0,0,1,0,0|1,0,0]=3 2953 B7R1.3 C1(CCCOC1)N MCULE-9418657332 [1,0,0,1,0,0|1,0,0]=3 2954 B7R1.3 C1(CNCCN1)C MCULE-7759957935 [1,0,0,1,0,0|2,0,0]=4 2955 B7R1.3 C1(CNCCO1)C MCULE-2805380245 [1,0,0,1,0,0|2,0,0]=4 2956 B7R1.3 C1(CNCCO1)C MCULE-3532041523 [1,0,0,1,0,0|2,0,0]=4 2957 B7R1.3 C=C1CCCOC1 MCULE-5236529273 [1,0,0,1,0,0|0,0,2]=4 2958 B7R1.3 C=C1CCOCC1 MCULE-2744722311 [1,0,0,1,0,0|1,0,1]=4 2959 B7R1.3 CC1C=CCCC1 MCULE-8057302830 [1,0,0,1,0,0|1,0,1]=4 2960 B7R1.3 CC1CC=CCC1 MCULE-6343106785 [1,0,0,1,0,0|1,0,1]=4 2961 B7R1.3 CC1CCCCC1 MCULE-3843525768 [1,0,0,1,0,0|1,0,0]=3 2962 B7R1.3 CC1CCCCN1 MCULE-1741870990 [1,0,0,1,0,0|2,0,0]=4 2963 B7R1.3 CC1CCCCN1 MCULE-4453126703 [1,0,0,1,0,0|2,0,0]=4 2964 B7R1.3 CC1CCCCN1 MCULE-6620063962 [1,0,0,1,0,0|2,0,0]=4 2965 B7R1.3 CC1CCCCN1 MCULE-6838766744 [1,0,0,1,0,0|2,0,0]=4 2966 B7R1.3 CC1CCCCN1 MCULE-9227931620 [1,0,0,1,0,0|2,0,0]=4 2967 B7R1.3 CC1CCCCO1 MCULE-4439683294 [1,0,0,1,0,0|2,0,0]=4 2968 B7R1.3 CC1CCCNC1 MCULE-3344207132 [1,0,0,1,0,0|1,0,0]=3 2969 B7R1.3 CC1CCCNC1 MCULE-5707832183 [1,0,0,1,0,0|1,0,0]=3 2970 B7R1.3 CC1CCCNC1 MCULE-7033850891 [1,0,0,1,0,0|1,0,0]=3 2971 B7R1.3 CC1CCCNC1 MCULE-7153943487 [1,0,0,1,0,0|1,0,0]=3 2972 B7R1.3 CC1CCNCC1 MCULE-5873723365 [1,0,0,1,0,0|2,0,0]=4 2973 B7R1.3 CC1CCNCC1 MCULE-6994675149 [1,0,0,1,0,0|2,0,0]=4 2974 B7R1.3 CC1CCNCC1 MCULE-9043030659 [1,0,0,1,0,0|2,0,0]=4 2975 B7R1.3 CC1CCOCC1 MCULE-8623581625 [1,0,0,1,0,0|1,0,0]=3 2976 B7R1.3 CC1CCOCN1 MCULE-5420262342 [1,0,0,1,0,0|2,0,0]=4 2977 B7R1.3 CC1CCOCO1 MCULE-5013590651 [1,0,0,1,0,0|2,0,0]=4 2978 B7R1.3 CC1CNCCN1 MCULE-2536395443 [1,0,0,1,0,0|2,0,0]=4 2979 B7R1.3 CC1CNCCN1 MCULE-6313957247 [1,0,0,1,0,0|2,0,0]=4 2980 B7R1.3 CC1CNCCO1 MCULE-3071497485 [1,0,0,1,0,0|2,0,0]=4 2981 B7R1.3 CC1CNCCO1 MCULE-7956728736 [1,0,0,1,0,0|2,0,0]=4 2982 B7R1.3 CC1CNCCS1 MCULE-7391261862 [1,0,0,1,0,0|2,0,0]=4 2983 B7R1.3 CC1COCCN1 MCULE-1305824409 [1,0,0,1,0,0|1,0,0]=3 2984 B7R1.3 CC1COCCN1 MCULE-4570632464 [1,0,0,1,0,0|1,0,0]=3 2985 B7R1.3 CC1COCCN1 MCULE-6275555682 [1,0,0,1,0,0|1,0,0]=3 2986 B7R1.3 CC1COCCN1 MCULE-8711024794 [1,0,0,1,0,0|1,0,0]=3 2987 B7R1.3 CC1CSCCN1 MCULE-2923436126 [1,0,0,1,0,0|1,1,0]=4 2988 B7R1.3 CN1CCCCC1 MCULE-3308944277 [1,0,0,1,0,0|2,0,0]=4 2989 B7R1.3 CN1CCOCC1 MCULE-1649171852 [1,0,0,1,0,0|2,0,0]=4 2990 B7R1.3 C[C@@H]1CCCCN1 MCULE-1372285636 [1,0,0,1,0,0|2,0,0]=4 2991 B7R1.3 C[C@@H]1CCCCN1 MCULE-1676908545 [1,0,0,1,0,0|2,0,0]=4 2992 B7R1.3 C[C@@H]1CCCCN1 MCULE-4298634468 [1,0,0,1,0,0|2,0,0]=4 2993 B7R1.3 C[C@@H]1CCCCN1 MCULE-6629826210 [1,0,0,1,0,0|2,0,0]=4 2994 B7R1.3 C[C@@H]1CCCNC1 MCULE-1079173995 [1,0,0,1,0,0|1,0,0]=3 2995 B7R1.3 C[C@@H]1CCCNC1 MCULE-1230145662 [1,0,0,1,0,0|1,0,0]=3 2996 B7R1.3 C[C@@H]1CCCNC1 MCULE-3423787676 [1,0,0,1,0,0|1,0,0]=3 2997 B7R1.3 C[C@@H]1CCCNC1 MCULE-9303264483 [1,0,0,1,0,0|1,0,0]=3 2998 B7R1.3 C[C@@H]1CNCCN1 MCULE-2959336973 [1,0,0,1,0,0|2,0,0]=4 2999 B7R1.3 C[C@@H]1CNCCN1 MCULE-3870060141 [1,0,0,1,0,0|2,0,0]=4 3000 B7R1.3 C[C@@H]1CNCCN1 MCULE-4214817913 [1,0,0,1,0,0|2,0,0]=4 3001 B7R1.3 C[C@@H]1CNCCN1 MCULE-4368092239 [1,0,0,1,0,0|2,0,0]=4 3002 B7R1.3 C[C@@H]1CNCCO1 MCULE-1787977539 [1,0,0,1,0,0|2,0,0]=4 3003 B7R1.3 C[C@@H]1CNCCO1 MCULE-2608004746 [1,0,0,1,0,0|2,0,0]=4 3004 B7R1.3 C[C@@H]1CNCCO1 MCULE-5447097956 [1,0,0,1,0,0|2,0,0]=4 3005 B7R1.3 C[C@@H]1CNCCO1 MCULE-9396954187 [1,0,0,1,0,0|2,0,0]=4 3006 B7R1.3 C[C@@H]1COCCN1 MCULE-2750151013 [1,0,0,1,0,0|1,0,0]=3 3007 B7R1.3 C[C@@H]1COCCN1 MCULE-4003273424 [1,0,0,1,0,0|1,0,0]=3 3008 B7R1.3 C[C@@H]1COCCN1 MCULE-4627627990 [1,0,0,1,0,0|1,0,0]=3 3009 B7R1.3 C[C@@H]1COCCN1 MCULE-8600287111 [1,0,0,1,0,0|1,0,0]=3 3010 B7R1.3 C[C@@H]1CSCCN1 MCULE-2613889704 [1,0,0,1,0,0|1,1,0]=4 3011 B7R1.3 C[C@H]1CCCCN1 MCULE-3586455704 [1,0,0,1,0,0|2,0,0]=4 3012 B7R1.3 C[C@H]1CCCCN1 MCULE-5638638213 [1,0,0,1,0,0|2,0,0]=4 3013 B7R1.3 C[C@H]1CCCCN1 MCULE-5867717461 [1,0,0,1,0,0|2,0,0]=4 3014 B7R1.3 C[C@H]1CCCCN1 MCULE-7106826493 [1,0,0,1,0,0|2,0,0]=4 3015 B7R1.3 C[C@H]1CCCNC1 MCULE-3372852932 [1,0,0,1,0,0|1,0,0]=3 3016 B7R1.3 C[C@H]1CCCNC1 MCULE-5146147676 [1,0,0,1,0,0|1,0,0]=3 3017 B7R1.3 C[C@H]1CCCNC1 MCULE-7894943546 [1,0,0,1,0,0|1,0,0]=3 3018 B7R1.3 C[C@H]1CCCNC1 MCULE-8016414984 [1,0,0,1,0,0|1,0,0]=3 3019 B7R1.3 C[C@H]1CNCCN1 MCULE-1403559972 [1,0,0,1,0,0|2,0,0]=4 3020 B7R1.3 C[C@H]1CNCCN1 MCULE-5769724060 [1,0,0,1,0,0|2,0,0]=4 3021 B7R1.3 C[C@H]1CNCCO1 MCULE-3158147539 [1,0,0,1,0,0|2,0,0]=4 3022 B7R1.3 C[C@H]1CNCCO1 MCULE-5193705878 [1,0,0,1,0,0|2,0,0]=4 3023 B7R1.3 C[C@H]1CNCCO1 MCULE-8337677707 [1,0,0,1,0,0|2,0,0]=4 3024 B7R1.3 C[C@H]1CNCCO1 MCULE-9425432414 [1,0,0,1,0,0|2,0,0]=4 3025 B7R1.3 C[C@H]1COCCN1 MCULE-1467834624 [1,0,0,1,0,0|1,0,0]=3 3026 B7R1.3 C[C@H]1COCCN1 MCULE-3486079226 [1,0,0,1,0,0|1,0,0]=3 3027 B7R1.3 C[C@H]1COCCN1 MCULE-5726525044 [1,0,0,1,0,0|1,0,0]=3 3028 B7R1.3 C[C@H]1COCCN1 MCULE-9977133603 [1,0,0,1,0,0|1,0,0]=3 3029 B7R1.3 C[C@H]1CSCCN1 MCULE-4076273874 [1,0,0,1,0,0|1,1,0]=4 3030 B7R1.3 ClC1CCCCC1 MCULE-9519865350 [1,0,0,1,0,0|2,0,0]=4 3031 B7R1.3 ClC1CCCNC1 MCULE-3870722463 [1,0,0,1,0,0|2,0,0]=4 3032 B7R1.3 ClC1CCCNC1 MCULE-8461718443 [1,0,0,1,0,0|2,0,0]=4 3033 B7R1.3 ClC1CCCOC1 MCULE-5733907796 [1,0,0,1,0,0|1,0,0]=3 3034 B7R1.3 ClC1CCNCC1 MCULE-1320213535 [1,0,0,1,0,0|2,0,0]=4 3035 B7R1.3 ClC1CCNCC1 MCULE-3278149456 [1,0,0,1,0,0|2,0,0]=4 3036 B7R1.3 ClC1CCOCC1 MCULE-5672440693 [1,0,0,1,0,0|1,0,0]=3 3037 B7R1.3 ClN1CCOCC1 MCULE-2275187473 [1,0,0,1,0,0|2,0,0]=4 3038 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-1513190720 [1,0,0,1,0,0|2,0,0]=4 3039 B7R1.3 Cl[C@@H]1CCCNC1 MCULE-4702442384 [1,0,0,1,0,0|2,0,0]=4 3040 B7R1.3 Cl[C@H]1CCCNC1 MCULE-1906196638 [1,0,0,1,0,0|2,0,0]=4 3041 B7R1.3 Cl[C@H]1CCCNC1 MCULE-5435721723 [1,0,0,1,0,0|2,0,0]=4 3042 B7R1.3 FC1CCCCC1 MCULE-4555555520 [1,0,0,1,0,0|2,0,0]=4 3043 B7R1.3 FC1CCCNC1 MCULE-1207637035 [1,0,0,1,0,0|2,0,0]=4 3044 B7R1.3 FC1CCCNC1 MCULE-8874983109 [1,0,0,1,0,0|2,0,0]=4 3045 B7R1.3 FC1CCCOC1 MCULE-9003204358 [1,0,0,1,0,0|1,0,0]=3 3046 B7R1.3 FC1CCNCC1 MCULE-1146732226 [1,0,0,1,0,0|2,0,0]=4 3047 B7R1.3 FC1CCNCC1 MCULE-9481825539 [1,0,0,1,0,0|2,0,0]=4 3048 B7R1.3 F[C@@H]1CCCNC1 MCULE-1015853975 [1,0,0,1,0,0|2,0,0]=4 3049 B7R1.3 F[C@@H]1CCCNC1 MCULE-2442101978 [1,0,0,1,0,0|2,0,0]=4 3050 B7R1.3 F[C@@H]1CCCNC1 MCULE-3088687742 [1,0,0,1,0,0|2,0,0]=4 3051 B7R1.3 F[C@@H]1CCCNC1 MCULE-3298158493 [1,0,0,1,0,0|2,0,0]=4 3052 B7R1.3 F[C@H]1CCCNC1 MCULE-5863769143 [1,0,0,1,0,0|2,0,0]=4 3053 B7R1.3 F[C@H]1CCCNC1 MCULE-9142728260 [1,0,0,1,0,0|2,0,0]=4 3054 B7R1.3 F[C@H]1CCCNC1 MCULE-9496728832 [1,0,0,1,0,0|2,0,0]=4 3055 B7R1.3 F[C@H]1CCCNC1 MCULE-9795686850 [1,0,0,1,0,0|2,0,0]=4 3056 B7R1.3 IC1CCCCC1 MCULE-4499971048 [1,0,0,1,0,0|2,0,0]=4 3057 B7R1.3 IC1CCNCC1 MCULE-1161879837 [1,0,0,1,0,0|2,0,0]=4 3058 B7R1.3 IC1CCNCC1 MCULE-3953687682 [1,0,0,1,0,0|2,0,0]=4 3059 B7R1.3 IC1CCOCC1 MCULE-7226892860 [1,0,0,1,0,0|1,0,0]=3 3060 B7R1.3 IC1CCSCC1 MCULE-6684613275 [1,0,0,1,0,0|1,1,0]=4 3061 B7R1.3 IN1CCOCC1 MCULE-2342142292 [1,0,0,1,0,0|2,0,0]=4 3062 B7R1.3 IN1CCOCC1 MCULE-6623188938 [1,0,0,1,0,0|2,0,0]=4 3063 B7R1.3 NC1CCCCC1 MCULE-1274688385 [1,0,0,1,0,0|2,0,0]=4 3064 B7R1.3 NC1CCCCC1 MCULE-6218418825 [1,0,0,1,0,0|2,0,0]=4 3065 B7R1.3 NC1CCCCC1 MCULE-7654331405 [1,0,0,1,0,0|2,0,0]=4 3066 B7R1.3 NC1CCCCC1 MCULE-9211684304 [1,0,0,1,0,0|2,0,0]=4 3067 B7R1.3 NC1CCCNC1 MCULE-2846077424 [1,0,0,1,0,0|2,0,0]=4 3068 B7R1.3 NC1CCCNC1 MCULE-6762552983 [1,0,0,1,0,0|2,0,0]=4 3069 B7R1.3 NC1CCCNC1 MCULE-8978449052 [1,0,0,1,0,0|2,0,0]=4 3070 B7R1.3 NC1CCCOC1 MCULE-3002610862 [1,0,0,1,0,0|1,0,0]=3 3071 B7R1.3 NC1CCCOC1 MCULE-8678558313 [1,0,0,1,0,0|1,0,0]=3 3072 B7R1.3 NC1CCCSC1 MCULE-5361360271 [1,0,0,1,0,0|1,1,0]=4 3073 B7R1.3 NC1CCCSC1 MCULE-5652416535 [1,0,0,1,0,0|1,1,0]=4 3074 B7R1.3 NC1CCNCC1 MCULE-4122223472 [1,0,0,1,0,0|2,0,0]=4 3075 B7R1.3 NC1CCNCC1 MCULE-4894618503 [1,0,0,1,0,0|2,0,0]=4 3076 B7R1.3 NC1CCOCC1 MCULE-4830730893 [1,0,0,1,0,0|1,0,0]=3 3077 B7R1.3 NC1CCOCC1 MCULE-6229850202 [1,0,0,1,0,0|1,0,0]=3 3078 B7R1.3 NC1CCOCC1 MCULE-7619874469 [1,0,0,1,0,0|1,0,0]=3 3079 B7R1.3 NC1CCSCC1 MCULE-1077822824 [1,0,0,1,0,0|1,1,0]=4 3080 B7R1.3 NC1CCSCC1 MCULE-7148332202 [1,0,0,1,0,0|1,1,0]=4 3081 B7R1.3 NN1CCOCC1 MCULE-8277539965 [1,0,0,1,0,0|2,0,0]=4 3082 B7R1.3 N[C@@H]1CCCNC1 MCULE-1539406556 [1,0,0,1,0,0|2,0,0]=4 3083 B7R1.3 N[C@@H]1CCCNC1 MCULE-3403472114 [1,0,0,1,0,0|2,0,0]=4 3084 B7R1.3 N[C@@H]1CCCNC1 MCULE-6313396868 [1,0,0,1,0,0|2,0,0]=4 3085 B7R1.3 N[C@@H]1CCCNC1 MCULE-8281902784 [1,0,0,1,0,0|2,0,0]=4 3086 B7R1.3 N[C@@H]1CCCOC1 MCULE-3329999118 [1,0,0,1,0,0|1,0,0]=3 3087 B7R1.3 N[C@@H]1CCCOC1 MCULE-5434456311 [1,0,0,1,0,0|1,0,0]=3 3088 B7R1.3 N[C@@H]1CCCOC1 MCULE-8416525332 [1,0,0,1,0,0|1,0,0]=3 3089 B7R1.3 N[C@@H]1CCCOC1 MCULE-9941756618 [1,0,0,1,0,0|1,0,0]=3 3090 B7R1.3 N[C@H]1CCCNC1 MCULE-1133561466 [1,0,0,1,0,0|2,0,0]=4 3091 B7R1.3 N[C@H]1CCCNC1 MCULE-3601314617 [1,0,0,1,0,0|2,0,0]=4 3092 B7R1.3 N[C@H]1CCCNC1 MCULE-4741120465 [1,0,0,1,0,0|2,0,0]=4 3093 B7R1.3 N[C@H]1CCCNC1 MCULE-5291619589 [1,0,0,1,0,0|2,0,0]=4 3094 B7R1.3 N[C@H]1CCCNC1 MCULE-8831721515 [1,0,0,1,0,0|2,0,0]=4 3095 B7R1.3 N[C@H]1CCCOC1 MCULE-1619050625 [1,0,0,1,0,0|1,0,0]=3 3096 B7R1.3 N[C@H]1CCCOC1 MCULE-4275969826 [1,0,0,1,0,0|1,0,0]=3 3097 B7R1.3 N[C@H]1CCCOC1 MCULE-4421099383 [1,0,0,1,0,0|1,0,0]=3 3098 B7R1.3 N[C@H]1CCCOC1 MCULE-9281030983 [1,0,0,1,0,0|1,0,0]=3 3099 B7R1.3 O=C1CCCOC1 MCULE-5268404224 [1,0,0,1,0,0|1,0,1]=4 3100 B7R1.3 O=C1CCOCC1 MCULE-6728095514 [1,0,0,1,0,0|0,1,1]=4 3101 B7R1.3 O=S1CCOCC1 MCULE-4979531002 [1,0,0,1,0,0|1,1,0]=4 3102 B7R1.3 OC1CCCCC1 MCULE-8217921343 [1,0,0,1,0,0|1,1,0]=4 3103 B7R1.3 OC1CCCNC1 MCULE-4557845355 [1,0,0,1,0,0|2,0,0]=4 3104 B7R1.3 OC1CCCNC1 MCULE-6040312691 [1,0,0,1,0,0|2,0,0]=4 3105 B7R1.3 OC1CCCOC1 MCULE-3820663957 [1,0,0,1,0,0|1,0,0]=3 3106 B7R1.3 OC1CCCOC1 MCULE-4349250540 [1,0,0,1,0,0|1,0,0]=3 3107 B7R1.3 OC1CCCSC1 MCULE-1448781710 [1,0,0,1,0,0|1,1,0]=4 3108 B7R1.3 OC1CCNCC1 MCULE-3572807775 [1,0,0,1,0,0|1,1,0]=4 3109 B7R1.3 OC1CCNCC1 MCULE-4216905638 [1,0,0,1,0,0|1,1,0]=4 3110 B7R1.3 OC1CCNCC1 MCULE-8298401309 [1,0,0,1,0,0|1,1,0]=4 3111 B7R1.3 OC1CCOCC1 MCULE-3789534226 [1,0,0,1,0,0|0,1,0]=3 3112 B7R1.3 OC1CCSCC1 MCULE-6056663037 [1,0,0,1,0,0|0,2,0]=4 3113 B7R1.3 OC1COCOC1 MCULE-1056094446 [1,0,0,1,0,0|2,0,0]=4 3114 B7R1.3 ON1CCOCC1 MCULE-9071295312 [1,0,0,1,0,0|1,1,0]=4 3115 B7R1.3 O[C@@H]1CCCNC1 MCULE-3395625072 [1,0,0,1,0,0|2,0,0]=4 3116 B7R1.3 O[C@@H]1CCCNC1 MCULE-5041834047 [1,0,0,1,0,0|2,0,0]=4 3117 B7R1.3 O[C@@H]1CCCNC1 MCULE-5939951996 [1,0,0,1,0,0|2,0,0]=4 3118 B7R1.3 O[C@@H]1CCCNC1 MCULE-8822637089 [1,0,0,1,0,0|2,0,0]=4 3119 B7R1.3 O[C@@H]1CCCOC1 MCULE-1439860824 [1,0,0,1,0,0|1,0,0]=3 3120 B7R1.3 O[C@@H]1CCCOC1 MCULE-5515107963 [1,0,0,1,0,0|1,0,0]=3 3121 B7R1.3 O[C@H]1CCCNC1 MCULE-3813591488 [1,0,0,1,0,0|2,0,0]=4 3122 B7R1.3 O[C@H]1CCCNC1 MCULE-5223055424 [1,0,0,1,0,0|2,0,0]=4 3123 B7R1.3 O[C@H]1CCCNC1 MCULE-7646198322 [1,0,0,1,0,0|2,0,0]=4 3124 B7R1.3 O[C@H]1CCCNC1 MCULE-7875547684 [1,0,0,1,0,0|2,0,0]=4 3125 B7R1.3 O[C@H]1CCCOC1 MCULE-2228949296 [1,0,0,1,0,0|1,0,0]=3 3126 B7R1.3 O[C@H]1CCCOC1 MCULE-6500179909 [1,0,0,1,0,0|1,0,0]=3 3127 B7R1.3 SC1CCCCC1 MCULE-2644288416 [1,0,0,1,0,0|1,0,0]=3 3128 B7R1.3 SC1CCCNC1 MCULE-4464031027 [1,0,0,1,0,0|2,0,0]=4 3129 B7R1.3 SC1CCCNC1 MCULE-5566651293 [1,0,0,1,0,0|2,0,0]=4 3130 B7R1.3 SC1CCCOC1 MCULE-9540212924 [1,0,0,1,0,0|1,0,0]=3 3131 B7R1.3 SC1CCNCC1 MCULE-2780144586 [1,0,0,1,0,0|1,0,0]=3 3132 B7R1.3 SC1CCNCC1 MCULE-4297654743 [1,0,0,1,0,0|1,0,0]=3 3133 B7R1.3 SC1CCOCC1 MCULE-1287019115 [1,0,0,1,0,0|0,0,0]=2 3134 B7R1.3 SC1CCSCC1 MCULE-8741596394 [1,0,0,1,0,0|0,1,0]=3 3135 B7R1.3 S[C@H]1CCCNC1 MCULE-5377455102 [1,0,0,1,0,0|2,0,0]=4 3136 B7R1.3 S[C@H]1CCCNC1 MCULE-9668422285 [1,0,0,1,0,0|2,0,0]=4 3137 B7R1.3 [NH3+]C1CCCCC1 MCULE-7876724648 [1,0,0,1,0,0|2,0,0]=4 3138 B7R1.4 BrC1CCCC1Br MCULE-9172342979 [1,0,0,1,0,0|2,0,0]=4 3139 B7R1.4 Br[C@@H]1CCC[C@H]1Br MCULE-5523481790 [1,0,0,1,0,0|2,0,0]=4 3140 B7R1.4 C=C1CCCC1O MCULE-3026250203 [1,0,0,1,0,0|0,0,2]=4 3141 B7R1.4 CC1CCCC1=O MCULE-3710290162 [1,0,0,1,0,0|0,0,2]=4 3142 B7R1.4 CC1CCCC1Br MCULE-7816907673 [1,0,0,1,0,0|1,0,0]=3 3143 B7R1.4 CC1CCCC1N MCULE-4318156403 [1,0,0,1,0,0|1,0,0]=3 3144 B7R1.4 CC1CCCC1N MCULE-4434172193 [1,0,0,1,0,0|1,0,0]=3 3145 B7R1.4 CC1CCCC1O MCULE-1288711765 [1,0,0,1,0,0|0,0,0]=2 3146 B7R1.4 CC1CCNC1C MCULE-2184586167 [1,0,0,1,0,0|2,0,0]=4 3147 B7R1.4 CC1CNCC1C MCULE-5821391512 [1,0,0,1,0,0|2,0,0]=4 3148 B7R1.4 CC1CNCC1C MCULE-6626101399 [1,0,0,1,0,0|2,0,0]=4 3149 B7R1.4 CC1CNCC1F MCULE-4834888455 [1,0,0,1,0,0|2,0,0]=4 3150 B7R1.4 CC1CNCC1F MCULE-7766072724 [1,0,0,1,0,0|2,0,0]=4 3151 B7R1.4 CC1CNCC1N MCULE-2314973615 [1,0,0,1,0,0|2,0,0]=4 3152 B7R1.4 CC1CNCC1N MCULE-8542352354 [1,0,0,1,0,0|2,0,0]=4 3153 B7R1.4 CC1CNCC1O MCULE-3308447861 [1,0,0,1,0,0|1,0,0]=3 3154 B7R1.4 CC1CNCC1O MCULE-8526879323 [1,0,0,1,0,0|1,0,0]=3 3155 B7R1.4 CC1COCC1N MCULE-5453471722 [1,0,0,1,0,0|2,0,0]=4 3156 B7R1.4 CC1COCC1N MCULE-6647217023 [1,0,0,1,0,0|2,0,0]=4 3157 B7R1.4 CC1COCC1O MCULE-5925280081 [1,0,0,1,0,0|1,0,0]=3 3158 B7R1.4 CC1CSCC1N MCULE-5628200403 [1,0,0,1,0,0|2,0,0]=4 3159 B7R1.4 CC1NCCC1O MCULE-7936666458 [1,0,0,1,0,0|1,0,0]=3 3160 B7R1.4 CC1NCCC1O MCULE-8369948926 [1,0,0,1,0,0|1,0,0]=3 3161 B7R1.4 CC1OCCC1=O MCULE-8278816952 [1,0,0,1,0,0|0,1,1]=4 3162 B7R1.4 CC1OCCC1N MCULE-4343663724 [1,0,0,1,0,0|1,0,0]=3 3163 B7R1.4 CC1OCCC1N MCULE-9003879039 [1,0,0,1,0,0|1,0,0]=3 3164 B7R1.4 CC1OCCC1O MCULE-6904695721 [1,0,0,1,0,0|0,1,0]=3 3165 B7R1.4 CC1OCCC1S MCULE-9127694888 [1,0,0,1,0,0|0,0,0]=2 3166 B7R1.4 CC1OCOC1C MCULE-9497186094 [1,0,0,1,0,0|2,0,0]=4 3167 B7R1.4 CC1SCCC1N MCULE-5160182865 [1,0,0,1,0,0|1,1,0]=4 3168 B7R1.4 CC1SCCC1N MCULE-8827106279 [1,0,0,1,0,0|1,1,0]=4 3169 B7R1.4 CC1SCCC1O MCULE-4342593310 [1,0,0,1,0,0|1,0,0]=3 3170 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-6206070680 [1,0,0,1,0,0|1,0,0]=3 3171 B7R1.4 C[C@@H]1CCC[C@@H]1N MCULE-9964938082 [1,0,0,1,0,0|1,0,0]=3 3172 B7R1.4 C[C@@H]1CCC[C@@H]1O MCULE-2617120620 [1,0,0,1,0,0|0,0,0]=2 3173 B7R1.4 C[C@@H]1CCC[C@H]1N MCULE-8385969474 [1,0,0,1,0,0|1,0,0]=3 3174 B7R1.4 C[C@@H]1CCC[C@H]1O MCULE-3398682980 [1,0,0,1,0,0|0,0,0]=2 3175 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-4592161485 [1,0,0,1,0,0|2,0,0]=4 3176 B7R1.4 C[C@@H]1CNC[C@@H]1C MCULE-5506149631 [1,0,0,1,0,0|2,0,0]=4 3177 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-4204399527 [1,0,0,1,0,0|2,0,0]=4 3178 B7R1.4 C[C@@H]1CNC[C@@H]1F MCULE-8451199903 [1,0,0,1,0,0|2,0,0]=4 3179 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2290594563 [1,0,0,1,0,0|2,0,0]=4 3180 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-2611807697 [1,0,0,1,0,0|2,0,0]=4 3181 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-3707409979 [1,0,0,1,0,0|2,0,0]=4 3182 B7R1.4 C[C@@H]1CNC[C@@H]1N MCULE-4317636252 [1,0,0,1,0,0|2,0,0]=4 3183 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-2015388080 [1,0,0,1,0,0|1,0,0]=3 3184 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-3625149028 [1,0,0,1,0,0|1,0,0]=3 3185 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-5773404554 [1,0,0,1,0,0|1,0,0]=3 3186 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6014391902 [1,0,0,1,0,0|1,0,0]=3 3187 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6476104556 [1,0,0,1,0,0|1,0,0]=3 3188 B7R1.4 C[C@@H]1CNC[C@@H]1O MCULE-6537028059 [1,0,0,1,0,0|1,0,0]=3 3189 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-2567871968 [1,0,0,1,0,0|2,0,0]=4 3190 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-5626188867 [1,0,0,1,0,0|2,0,0]=4 3191 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-7438009663 [1,0,0,1,0,0|2,0,0]=4 3192 B7R1.4 C[C@@H]1CNC[C@H]1C MCULE-8649896095 [1,0,0,1,0,0|2,0,0]=4 3193 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-4207581523 [1,0,0,1,0,0|1,0,0]=3 3194 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-6158474994 [1,0,0,1,0,0|1,0,0]=3 3195 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7380960276 [1,0,0,1,0,0|1,0,0]=3 3196 B7R1.4 C[C@@H]1CNC[C@H]1O MCULE-7589629864 [1,0,0,1,0,0|1,0,0]=3 3197 B7R1.4 C[C@@H]1COC[C@@H]1O MCULE-3198029643 [1,0,0,1,0,0|1,0,0]=3 3198 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-1145772262 [1,0,0,1,0,0|2,0,0]=4 3199 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-6639849267 [1,0,0,1,0,0|2,0,0]=4 3200 B7R1.4 C[C@@H]1COC[C@H]1N MCULE-9659959713 [1,0,0,1,0,0|2,0,0]=4 3201 B7R1.4 C[C@@H]1COC[C@H]1O MCULE-1967963278 [1,0,0,1,0,0|1,0,0]=3 3202 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-1705265213 [1,0,0,1,0,0|1,0,0]=3 3203 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-3395898129 [1,0,0,1,0,0|1,0,0]=3 3204 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-5909894286 [1,0,0,1,0,0|1,0,0]=3 3205 B7R1.4 C[C@@H]1NCC[C@@H]1O MCULE-9998480727 [1,0,0,1,0,0|1,0,0]=3 3206 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-1101330824 [1,0,0,1,0,0|1,0,0]=3 3207 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3326131093 [1,0,0,1,0,0|1,0,0]=3 3208 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-3941456644 [1,0,0,1,0,0|1,0,0]=3 3209 B7R1.4 C[C@@H]1NCC[C@H]1O MCULE-8944150043 [1,0,0,1,0,0|1,0,0]=3 3210 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-5910807847 [1,0,0,1,0,0|1,0,0]=3 3211 B7R1.4 C[C@@H]1OCC[C@H]1N MCULE-7586038907 [1,0,0,1,0,0|1,0,0]=3 3212 B7R1.4 C[C@H]1CCC[C@@H]1N MCULE-4150988023 [1,0,0,1,0,0|1,0,0]=3 3213 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-5212653059 [1,0,0,1,0,0|0,0,0]=2 3214 B7R1.4 C[C@H]1CCC[C@@H]1O MCULE-7997646273 [1,0,0,1,0,0|0,0,0]=2 3215 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-3329868072 [1,0,0,1,0,0|1,0,0]=3 3216 B7R1.4 C[C@H]1CCC[C@H]1N MCULE-4186145172 [1,0,0,1,0,0|1,0,0]=3 3217 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-3291842365 [1,0,0,1,0,0|0,0,0]=2 3218 B7R1.4 C[C@H]1CCC[C@H]1O MCULE-7570125274 [1,0,0,1,0,0|0,0,0]=2 3219 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7622265949 [1,0,0,1,0,0|2,0,0]=4 3220 B7R1.4 C[C@H]1CCN[C@@H]1C MCULE-7686056776 [1,0,0,1,0,0|2,0,0]=4 3221 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2214344957 [1,0,0,1,0,0|2,0,0]=4 3222 B7R1.4 C[C@H]1CNC[C@@H]1C MCULE-2877312650 [1,0,0,1,0,0|2,0,0]=4 3223 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2282810666 [1,0,0,1,0,0|1,0,0]=3 3224 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-2772361871 [1,0,0,1,0,0|1,0,0]=3 3225 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3274154422 [1,0,0,1,0,0|1,0,0]=3 3226 B7R1.4 C[C@H]1CNC[C@@H]1O MCULE-3608199633 [1,0,0,1,0,0|1,0,0]=3 3227 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-6069899229 [1,0,0,1,0,0|2,0,0]=4 3228 B7R1.4 C[C@H]1CNC[C@H]1N MCULE-8539137579 [1,0,0,1,0,0|2,0,0]=4 3229 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-1988679936 [1,0,0,1,0,0|1,0,0]=3 3230 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-3451477960 [1,0,0,1,0,0|1,0,0]=3 3231 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-4396463600 [1,0,0,1,0,0|1,0,0]=3 3232 B7R1.4 C[C@H]1CNC[C@H]1O MCULE-7975653844 [1,0,0,1,0,0|1,0,0]=3 3233 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-3765921602 [1,0,0,1,0,0|1,0,0]=3 3234 B7R1.4 C[C@H]1COC[C@@H]1O MCULE-5201903195 [1,0,0,1,0,0|1,0,0]=3 3235 B7R1.4 C[C@H]1COC[C@H]1O MCULE-2974083166 [1,0,0,1,0,0|1,0,0]=3 3236 B7R1.4 C[C@H]1COC[C@H]1O MCULE-6725207001 [1,0,0,1,0,0|1,0,0]=3 3237 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-5499798144 [1,0,0,1,0,0|1,0,0]=3 3238 B7R1.4 C[C@H]1NCC[C@@H]1O MCULE-7401004387 [1,0,0,1,0,0|1,0,0]=3 3239 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-7469942077 [1,0,0,1,0,0|1,0,0]=3 3240 B7R1.4 C[C@H]1NCC[C@H]1O MCULE-9976903585 [1,0,0,1,0,0|1,0,0]=3 3241 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-1432785321 [1,0,0,1,0,0|1,0,0]=3 3242 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-3008045787 [1,0,0,1,0,0|1,0,0]=3 3243 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-7656776924 [1,0,0,1,0,0|1,0,0]=3 3244 B7R1.4 C[C@H]1OCC[C@H]1N MCULE-8087379612 [1,0,0,1,0,0|1,0,0]=3 3245 B7R1.4 ClC1CCCC1Cl MCULE-1176916477 [1,0,0,1,0,0|2,0,0]=4 3246 B7R1.4 ClC1CCOC1Cl MCULE-1186010832 [1,0,0,1,0,0|2,0,0]=4 3247 B7R1.4 NC1CCCC1F MCULE-2221939717 [1,0,0,1,0,0|2,0,0]=4 3248 B7R1.4 NC1CCCC1F MCULE-7473190715 [1,0,0,1,0,0|2,0,0]=4 3249 B7R1.4 NC1CCCC1N MCULE-5161769230 [1,0,0,1,0,0|2,0,0]=4 3250 B7R1.4 NC1CCCC1N MCULE-7834445190 [1,0,0,1,0,0|2,0,0]=4 3251 B7R1.4 NC1CCCC1O MCULE-1657591641 [1,0,0,1,0,0|1,0,0]=3 3252 B7R1.4 NC1CCCC1O MCULE-6248992494 [1,0,0,1,0,0|1,0,0]=3 3253 B7R1.4 NC1COCC1O MCULE-3115911209 [1,0,0,1,0,0|2,0,0]=4 3254 B7R1.4 NC1COCC1O MCULE-9837103399 [1,0,0,1,0,0|2,0,0]=4 3255 B7R1.4 NC1CSCC1O MCULE-4474934833 [1,0,0,1,0,0|2,0,0]=4 3256 B7R1.4 NC1CSCC1O MCULE-5059305463 [1,0,0,1,0,0|2,0,0]=4 3257 B7R1.4 NC1CSCC1O MCULE-8633680588 [1,0,0,1,0,0|2,0,0]=4 3258 B7R1.4 N[C@@H]1CCC[C@@H]1F MCULE-5918995947 [1,0,0,1,0,0|2,0,0]=4 3259 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-3619202671 [1,0,0,1,0,0|1,0,0]=3 3260 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-5588562063 [1,0,0,1,0,0|1,0,0]=3 3261 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-8937650915 [1,0,0,1,0,0|1,0,0]=3 3262 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9550479411 [1,0,0,1,0,0|1,0,0]=3 3263 B7R1.4 N[C@@H]1CCC[C@@H]1O MCULE-9908988904 [1,0,0,1,0,0|1,0,0]=3 3264 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-1389039924 [1,0,0,1,0,0|2,0,0]=4 3265 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-2197861570 [1,0,0,1,0,0|2,0,0]=4 3266 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-3318849776 [1,0,0,1,0,0|2,0,0]=4 3267 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-5395257521 [1,0,0,1,0,0|2,0,0]=4 3268 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-8318262942 [1,0,0,1,0,0|2,0,0]=4 3269 B7R1.4 N[C@@H]1CCC[C@H]1F MCULE-9877401480 [1,0,0,1,0,0|2,0,0]=4 3270 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-1630250066 [1,0,0,1,0,0|2,0,0]=4 3271 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5738867214 [1,0,0,1,0,0|2,0,0]=4 3272 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-5794367720 [1,0,0,1,0,0|2,0,0]=4 3273 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-6079002018 [1,0,0,1,0,0|2,0,0]=4 3274 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7332231839 [1,0,0,1,0,0|2,0,0]=4 3275 B7R1.4 N[C@@H]1CCC[C@H]1N MCULE-7604406385 [1,0,0,1,0,0|2,0,0]=4 3276 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-2283352070 [1,0,0,1,0,0|1,0,0]=3 3277 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-3279782742 [1,0,0,1,0,0|1,0,0]=3 3278 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-6823698796 [1,0,0,1,0,0|1,0,0]=3 3279 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-7752087047 [1,0,0,1,0,0|1,0,0]=3 3280 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-8823714511 [1,0,0,1,0,0|1,0,0]=3 3281 B7R1.4 N[C@@H]1CCC[C@H]1O MCULE-9789739251 [1,0,0,1,0,0|1,0,0]=3 3282 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-2891920420 [1,0,0,1,0,0|2,0,0]=4 3283 B7R1.4 N[C@@H]1COC[C@@H]1O MCULE-5764643856 [1,0,0,1,0,0|2,0,0]=4 3284 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-1399984261 [1,0,0,1,0,0|2,0,0]=4 3285 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-2321912677 [1,0,0,1,0,0|2,0,0]=4 3286 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-4422404071 [1,0,0,1,0,0|2,0,0]=4 3287 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-7801515292 [1,0,0,1,0,0|2,0,0]=4 3288 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9112718041 [1,0,0,1,0,0|2,0,0]=4 3289 B7R1.4 N[C@@H]1COC[C@H]1O MCULE-9447703783 [1,0,0,1,0,0|2,0,0]=4 3290 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-4507133192 [1,0,0,1,0,0|2,0,0]=4 3291 B7R1.4 N[C@@H]1CSC[C@@H]1O MCULE-9327920188 [1,0,0,1,0,0|2,0,0]=4 3292 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-5323319055 [1,0,0,1,0,0|2,0,0]=4 3293 B7R1.4 N[C@@H]1CSC[C@H]1O MCULE-8008053411 [1,0,0,1,0,0|2,0,0]=4 3294 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-6629056296 [1,0,0,1,0,0|1,0,0]=3 3295 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-7682114350 [1,0,0,1,0,0|1,0,0]=3 3296 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-8554796061 [1,0,0,1,0,0|1,0,0]=3 3297 B7R1.4 N[C@H]1CCC[C@@H]1O MCULE-9329258920 [1,0,0,1,0,0|1,0,0]=3 3298 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-1361897949 [1,0,0,1,0,0|2,0,0]=4 3299 B7R1.4 N[C@H]1CCC[C@H]1N MCULE-4545374374 [1,0,0,1,0,0|2,0,0]=4 3300 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-1156997833 [1,0,0,1,0,0|1,0,0]=3 3301 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-2524879699 [1,0,0,1,0,0|1,0,0]=3 3302 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-7034968971 [1,0,0,1,0,0|1,0,0]=3 3303 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9262461574 [1,0,0,1,0,0|1,0,0]=3 3304 B7R1.4 N[C@H]1CCC[C@H]1O MCULE-9904485750 [1,0,0,1,0,0|1,0,0]=3 3305 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-1604156911 [1,0,0,1,0,0|2,0,0]=4 3306 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-3157811195 [1,0,0,1,0,0|2,0,0]=4 3307 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-4377495223 [1,0,0,1,0,0|2,0,0]=4 3308 B7R1.4 N[C@H]1COC[C@@H]1O MCULE-8412403655 [1,0,0,1,0,0|2,0,0]=4 3309 B7R1.4 N[C@H]1COC[C@H]1O MCULE-5907972681 [1,0,0,1,0,0|2,0,0]=4 3310 B7R1.4 N[C@H]1COC[C@H]1O MCULE-7502895716 [1,0,0,1,0,0|2,0,0]=4 3311 B7R1.4 N[C@H]1COC[C@H]1O MCULE-8985833831 [1,0,0,1,0,0|2,0,0]=4 3312 B7R1.4 N[C@H]1COC[C@H]1O MCULE-9971794275 [1,0,0,1,0,0|2,0,0]=4 3313 B7R1.4 O=C1CCCC1O MCULE-6795188798 [1,0,0,1,0,0|1,0,1]=4 3314 B7R1.4 O=C1OCCC1S MCULE-2130434062 [1,0,0,1,0,0|1,0,1]=4 3315 B7R1.4 OC1CCCC1Br MCULE-9027030471 [1,0,0,1,0,0|1,0,0]=3 3316 B7R1.4 OC1CCCC1Cl MCULE-5561130140 [1,0,0,1,0,0|1,0,0]=3 3317 B7R1.4 OC1CCCC1F MCULE-9111039481 [1,0,0,1,0,0|1,0,0]=3 3318 B7R1.4 OC1CCCC1O MCULE-2003945768 [1,0,0,1,0,0|1,0,0]=3 3319 B7R1.4 OC1CNCC1Br MCULE-1241091506 [1,0,0,1,0,0|2,0,0]=4 3320 B7R1.4 OC1CNCC1Br MCULE-4889737174 [1,0,0,1,0,0|2,0,0]=4 3321 B7R1.4 OC1CNCC1F MCULE-3412240528 [1,0,0,1,0,0|2,0,0]=4 3322 B7R1.4 OC1CNCC1F MCULE-7214807363 [1,0,0,1,0,0|2,0,0]=4 3323 B7R1.4 OC1CNCC1O MCULE-4416566731 [1,0,0,1,0,0|2,0,0]=4 3324 B7R1.4 OC1CNCC1O MCULE-7287658845 [1,0,0,1,0,0|2,0,0]=4 3325 B7R1.4 OC1COCC1Br MCULE-8642236751 [1,0,0,1,0,0|2,0,0]=4 3326 B7R1.4 OC1COCC1F MCULE-3255803142 [1,0,0,1,0,0|2,0,0]=4 3327 B7R1.4 OC1COCC1O MCULE-2982401803 [1,0,0,1,0,0|2,0,0]=4 3328 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-5851051143 [1,0,0,1,0,0|1,0,0]=3 3329 B7R1.4 O[C@@H]1CCC[C@H]1Cl MCULE-6816188915 [1,0,0,1,0,0|1,0,0]=3 3330 B7R1.4 O[C@@H]1CCC[C@H]1F MCULE-6825738824 [1,0,0,1,0,0|1,0,0]=3 3331 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-3171045763 [1,0,0,1,0,0|1,0,0]=3 3332 B7R1.4 O[C@@H]1CCC[C@H]1O MCULE-4369287998 [1,0,0,1,0,0|1,0,0]=3 3333 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-4544085940 [1,0,0,1,0,0|2,0,0]=4 3334 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-6356393045 [1,0,0,1,0,0|2,0,0]=4 3335 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-7332143154 [1,0,0,1,0,0|2,0,0]=4 3336 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8032995983 [1,0,0,1,0,0|2,0,0]=4 3337 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8052505932 [1,0,0,1,0,0|2,0,0]=4 3338 B7R1.4 O[C@@H]1CNC[C@@H]1F MCULE-8564653401 [1,0,0,1,0,0|2,0,0]=4 3339 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-2691246784 [1,0,0,1,0,0|2,0,0]=4 3340 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-7250968554 [1,0,0,1,0,0|2,0,0]=4 3341 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8439784112 [1,0,0,1,0,0|2,0,0]=4 3342 B7R1.4 O[C@@H]1CNC[C@H]1F MCULE-8682802807 [1,0,0,1,0,0|2,0,0]=4 3343 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-2199886254 [1,0,0,1,0,0|2,0,0]=4 3344 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-3341203076 [1,0,0,1,0,0|2,0,0]=4 3345 B7R1.4 O[C@@H]1CNC[C@H]1O MCULE-5521619072 [1,0,0,1,0,0|2,0,0]=4 3346 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-2460253154 [1,0,0,1,0,0|2,0,0]=4 3347 B7R1.4 O[C@@H]1COC[C@H]1F MCULE-3624406213 [1,0,0,1,0,0|2,0,0]=4 3348 B7R1.4 O[C@@H]1COC[C@H]1O MCULE-5846282762 [1,0,0,1,0,0|2,0,0]=4 3349 B7R1.4 O[C@H]1CCC[C@@H]1F MCULE-5487297072 [1,0,0,1,0,0|1,0,0]=3 3350 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4051443060 [1,0,0,1,0,0|1,0,0]=3 3351 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-4644231649 [1,0,0,1,0,0|1,0,0]=3 3352 B7R1.4 O[C@H]1CCC[C@@H]1O MCULE-6847877597 [1,0,0,1,0,0|1,0,0]=3 3353 B7R1.4 O[C@H]1CCC[C@H]1Br MCULE-2758354858 [1,0,0,1,0,0|1,0,0]=3 3354 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-6157730443 [1,0,0,1,0,0|1,0,0]=3 3355 B7R1.4 O[C@H]1CCC[C@H]1Cl MCULE-8785327416 [1,0,0,1,0,0|1,0,0]=3 3356 B7R1.4 O[C@H]1CCC[C@H]1O MCULE-7305350842 [1,0,0,1,0,0|1,0,0]=3 3357 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-3839318633 [1,0,0,1,0,0|2,0,0]=4 3358 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-4218821429 [1,0,0,1,0,0|2,0,0]=4 3359 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-7845583982 [1,0,0,1,0,0|2,0,0]=4 3360 B7R1.4 O[C@H]1CNC[C@@H]1F MCULE-9325791348 [1,0,0,1,0,0|2,0,0]=4 3361 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-5585016580 [1,0,0,1,0,0|2,0,0]=4 3362 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-6252837981 [1,0,0,1,0,0|2,0,0]=4 3363 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-7474807017 [1,0,0,1,0,0|2,0,0]=4 3364 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-8814174366 [1,0,0,1,0,0|2,0,0]=4 3365 B7R1.4 O[C@H]1CNC[C@@H]1O MCULE-9936814184 [1,0,0,1,0,0|2,0,0]=4 3366 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-2104048645 [1,0,0,1,0,0|2,0,0]=4 3367 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5086480017 [1,0,0,1,0,0|2,0,0]=4 3368 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5328004683 [1,0,0,1,0,0|2,0,0]=4 3369 B7R1.4 O[C@H]1CNC[C@H]1F MCULE-5990996560 [1,0,0,1,0,0|2,0,0]=4 3370 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-8087937166 [1,0,0,1,0,0|2,0,0]=4 3371 B7R1.4 O[C@H]1CNC[C@H]1O MCULE-9522092804 [1,0,0,1,0,0|2,0,0]=4 3372 B7R1.4 O[C@H]1COC[C@@H]1F MCULE-7724910066 [1,0,0,1,0,0|2,0,0]=4 3373 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-2140544466 [1,0,0,1,0,0|2,0,0]=4 3374 B7R1.4 O[C@H]1COC[C@@H]1O MCULE-9526811966 [1,0,0,1,0,0|2,0,0]=4 3375 B7R1.4 O[C@H]1COC[C@H]1O MCULE-2862505352 [1,0,0,1,0,0|2,0,0]=4 3376 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-2430440513 [1,0,0,1,0,0|1,0,0]=3 3377 B7R1.4 [C@@H]1(CCC[C@H]1N)C MCULE-8503171996 [1,0,0,1,0,0|1,0,0]=3 3378 B7R1.4 [C@@H]1(CCC[C@H]1N)F MCULE-5545998720 [1,0,0,1,0,0|2,0,0]=4 3379 B7R1.4 [C@@H]1(CNC[C@@H]1O)O MCULE-2661544949 [1,0,0,1,0,0|2,0,0]=4 3380 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-1484680203 [1,0,0,1,0,0|2,0,0]=4 3381 B7R1.4 [C@H]1(CNC[C@H]1F)O MCULE-7754900549 [1,0,0,1,0,0|2,0,0]=4 3382 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-5920046767 [1,0,0,1,0,0|2,0,0]=4 3383 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-6282053067 [1,0,0,1,0,0|2,0,0]=4 3384 B7R1.4 [C@H]1(COC[C@H]1N)C MCULE-8432332245 [1,0,0,1,0,0|2,0,0]=4 3385 B7R1.4 [NH3+][C@@H]1CSC[C@@H]1O MCULE-5747970201 [1,0,0,1,0,0|2,0,0]=4 3386 B7R1.4 [NH3+][C@@H]1CSC[C@H]1O MCULE-4897701746 [1,0,0,1,0,0|2,0,0]=4 3387 B7R1.5 CCCC1CC1N MCULE-6204339829 [1,0,0,1,0,0|1,0,0]=3 3388 B7R1.5 CCOC1CC1N MCULE-1141331549 [1,0,0,1,0,0|2,0,0]=4 3389 B7R1.5 CNCC1CC1C MCULE-9748636910 [1,0,0,1,0,0|2,0,0]=4 3390 B7R1.6 BrCCC1CCC1 MCULE-8124070706 [1,0,0,1,0,0|2,0,0]=4 3391 B7R1.6 BrCCC1CCO1 MCULE-2777479085 [1,0,0,1,0,0|1,1,0]=4 3392 B7R1.6 BrCCC1COC1 MCULE-8858681111 [1,0,0,1,0,0|1,0,0]=3 3393 B7R1.6 CCCC1CCN1 MCULE-7330412999 [1,0,0,1,0,0|2,0,0]=4 3394 B7R1.6 CCCC1CNC1 MCULE-4374477641 [1,0,0,1,0,0|1,0,0]=3 3395 B7R1.6 CCCC1CNC1 MCULE-8036298863 [1,0,0,1,0,0|1,0,0]=3 3396 B7R1.6 CCNC1CCC1 MCULE-2055959297 [1,0,0,1,0,0|2,0,0]=4 3397 B7R1.6 CCNC1CCC1 MCULE-2989731173 [1,0,0,1,0,0|2,0,0]=4 3398 B7R1.6 CCNC1CNC1 MCULE-3810334615 [1,0,0,1,0,0|2,0,0]=4 3399 B7R1.6 CCNC1CNC1 MCULE-3811754191 [1,0,0,1,0,0|2,0,0]=4 3400 B7R1.6 CCNC1COC1 MCULE-6357248771 [1,0,0,1,0,0|1,0,0]=3 3401 B7R1.6 CCNC1COC1 MCULE-8144856469 [1,0,0,1,0,0|1,0,0]=3 3402 B7R1.6 CCOC1CNC1 MCULE-5408347465 [1,0,0,1,0,0|2,0,0]=4 3403 B7R1.6 CCOC1CNC1 MCULE-5853062591 [1,0,0,1,0,0|2,0,0]=4 3404 B7R1.6 CCOC1CNC1 MCULE-7457457501 [1,0,0,1,0,0|2,0,0]=4 3405 B7R1.6 CCOC1CNC1 MCULE-9277972796 [1,0,0,1,0,0|2,0,0]=4 3406 B7R1.6 CNCC1CCC1 MCULE-3632390845 [1,0,0,1,0,0|2,0,0]=4 3407 B7R1.6 CNCC1CCC1 MCULE-4932211047 [1,0,0,1,0,0|2,0,0]=4 3408 B7R1.6 CNCC1CNC1 MCULE-3335619423 [1,0,0,1,0,0|2,0,0]=4 3409 B7R1.6 CNCC1COC1 MCULE-9048388624 [1,0,0,1,0,0|1,0,0]=3 3410 B7R1.6 COCC1CNC1 MCULE-4967592714 [1,0,0,1,0,0|2,0,0]=4 3411 B7R1.6 COCC1CNC1 MCULE-6804867712 [1,0,0,1,0,0|2,0,0]=4 3412 B7R1.6 COCC1CNC1 MCULE-9862500955 [1,0,0,1,0,0|2,0,0]=4 3413 B7R1.6 ICCC1CCO1 MCULE-3778448773 [1,0,0,1,0,0|1,1,0]=4 3414 B7R1.6 ICCC1COC1 MCULE-6063305860 [1,0,0,1,0,0|1,0,0]=3 3415 B7R1.6 N#CCC1COC1 MCULE-7466805866 [1,0,0,1,0,0|1,0,1]=4 3416 B7R1.6 NCCC1CCC1 MCULE-2620603238 [1,0,0,1,0,0|2,0,0]=4 3417 B7R1.6 NCCC1CCC1 MCULE-8653518690 [1,0,0,1,0,0|2,0,0]=4 3418 B7R1.6 NCCC1CCO1 MCULE-3619983020 [1,0,0,1,0,0|1,1,0]=4 3419 B7R1.6 NCCC1CNC1 MCULE-7195412134 [1,0,0,1,0,0|2,0,0]=4 3420 B7R1.6 NCCC1COC1 MCULE-6363254952 [1,0,0,1,0,0|1,0,0]=3 3421 B7R1.6 NCCC1COC1 MCULE-6907504739 [1,0,0,1,0,0|1,0,0]=3 3422 B7R1.6 NCCC1CSC1 MCULE-5034757527 [1,0,0,1,0,0|1,1,0]=4 3423 B7R1.6 NCC[C@@H]1CCO1 MCULE-5442768835 [1,0,0,1,0,0|1,1,0]=4 3424 B7R1.6 O=CCC1COC1 MCULE-3070858256 [1,0,0,1,0,0|1,0,1]=4 3425 B7R1.6 OCCC1CCC1 MCULE-1014969390 [1,0,0,1,0,0|1,0,0]=3 3426 B7R1.6 OCCC1CCN1 MCULE-4368379502 [1,0,0,1,0,0|1,0,0]=3 3427 B7R1.6 OCCC1CCO1 MCULE-3323265996 [1,0,0,1,0,0|0,1,0]=3 3428 B7R1.6 OCCC1CNC1 MCULE-1975411420 [1,0,0,1,0,0|2,0,0]=4 3429 B7R1.6 OCCC1CNC1 MCULE-4993890888 [1,0,0,1,0,0|2,0,0]=4 3430 B7R1.6 OCCC1COC1 MCULE-2515762048 [1,0,0,1,0,0|1,0,0]=3 3431 B7R1.6 OCCN1CCC1 MCULE-5517552533 [1,0,0,1,0,0|2,0,0]=4 3432 B7R1.6 OCC[C@@H]1CCN1 MCULE-9567198532 [1,0,0,1,0,0|1,0,0]=3 3433 B7R1.6 OCC[C@@H]1CCO1 MCULE-6606073727 [1,0,0,1,0,0|0,1,0]=3 3434 B7R1.6 OCC[C@H]1CCN1 MCULE-7385668340 [1,0,0,1,0,0|1,0,0]=3 3435 B7R1.6 OCC[C@H]1CCO1 MCULE-4848994972 [1,0,0,1,0,0|0,1,0]=3 3436 B7R1.6 OCC[C@H]1CCO1 MCULE-9787306242 [1,0,0,1,0,0|0,1,0]=3 3437 B7R1.8 CC1CCC1CO MCULE-4677269341 [1,0,0,1,0,0|1,0,0]=3 3438 B7R1.8 CN1CCC1CO MCULE-3475629266 [1,0,0,1,0,0|2,0,0]=4 3439 B7R1.8 CN1CC[C@@H]1CO MCULE-2590783241 [1,0,0,1,0,0|2,0,0]=4 3440 B7R1.8 CN1CC[C@@H]1CO MCULE-9683847113 [1,0,0,1,0,0|2,0,0]=4 3441 B7R1.8 CN1CC[C@H]1CO MCULE-6507300625 [1,0,0,1,0,0|2,0,0]=4 3442 B7R1.8 CN1CC[C@H]1CO MCULE-9641004134 [1,0,0,1,0,0|2,0,0]=4 3443 B7R1.8 NCC1CCC1F MCULE-6621673772 [1,0,0,1,0,0|2,0,0]=4 3444 B7R1.8 NCC1CCC1F MCULE-8982565541 [1,0,0,1,0,0|2,0,0]=4 3445 B7R1.8 O=C1CCC1CO MCULE-5501600764 [1,0,0,1,0,0|0,1,1]=4 3446 B7R1.8 O=C1CC[C@@H]1CO MCULE-9840363539 [1,0,0,1,0,0|0,1,1]=4 3447 B7R1.8 OCC1CCC1F MCULE-2481035584 [1,0,0,1,0,0|1,0,0]=3 3448 B7R1.8 OCC1CCC1O MCULE-9764745395 [1,0,0,1,0,0|0,1,0]=3 3449 B7R1.8 OC[C@@H]1CC[C@H]1O MCULE-5043281368 [1,0,0,1,0,0|0,1,0]=3 3450 B7R1.8 OC[C@H]1CC[C@H]1O MCULE-1536326248 [1,0,0,1,0,0|0,1,0]=3 3451 B7R1.9 C#CC1CC1CO MCULE-9506693915 [1,0,0,1,0,0|0,0,2]=4 3452 B7R1.9 C#C[C@H]1C[C@H]1CO MCULE-5176741676 [1,0,0,1,0,0|0,0,2]=4 3453 B7R1.9 CCC1CC1CN MCULE-6264158284 [1,0,0,1,0,0|1,0,0]=3 3454 B7R1.9 CCC1CC1CN MCULE-7047201371 [1,0,0,1,0,0|1,0,0]=3 3455 B7R1.9 CCC1CC1CO MCULE-3342087238 [1,0,0,1,0,0|0,0,0]=2 3456 B7R1.9 N#CC1CC1CO MCULE-7679796035 [1,0,0,1,0,0|1,0,1]=4 3457 B7R1.9 NCC1CC1CN MCULE-2708697512 [1,0,0,1,0,0|2,0,0]=4 3458 B7R1.9 NCC1CC1CN MCULE-8017169356 [1,0,0,1,0,0|2,0,0]=4 3459 B7R1.9 NCC1CC1CO MCULE-2679526126 [1,0,0,1,0,0|1,0,0]=3 3460 B7R1.9 NC[C@@H]1C[C@H]1CN MCULE-1460900772 [1,0,0,1,0,0|2,0,0]=4 3461 B7R1.9 NC[C@@H]1C[C@H]1CN MCULE-5609779965 [1,0,0,1,0,0|2,0,0]=4 3462 B7R1.9 NC[C@H]1C[C@@H]1CO MCULE-4100547975 [1,0,0,1,0,0|1,0,0]=3 3463 B7R1.9 NC[C@H]1C[C@H]1CN MCULE-4880621233 [1,0,0,1,0,0|2,0,0]=4 3464 B7R1.9 NC[C@H]1C[C@H]1CN MCULE-9980954134 [1,0,0,1,0,0|2,0,0]=4 3465 B7R1.9 NC[C@H]1C[C@H]1CO MCULE-4756509186 [1,0,0,1,0,0|1,0,0]=3 3466 B7R1.9 OCC1CC1CO MCULE-5153064657 [1,0,0,1,0,0|1,0,0]=3 3467 B7R1.9 OC[C@H]1C[C@H]1CO MCULE-9036138013 [1,0,0,1,0,0|1,0,0]=3 3468 B7R1.10 C=C1CC(C1)CO MCULE-6295731045 [1,0,0,1,0,0|0,0,2]=4 3469 B7R1.10 CC1CC(C1)C#N MCULE-7387519905 [1,0,0,1,0,0|1,0,1]=4 3470 B7R1.10 CC1CC(C1)C=O MCULE-1258886786 [1,0,0,1,0,0|0,0,2]=4 3471 B7R1.10 CC1CC(C1)CBr MCULE-3814375250 [1,0,0,1,0,0|1,0,0]=3 3472 B7R1.10 CC1CC(C1)CN MCULE-4821587591 [1,0,0,1,0,0|1,0,0]=3 3473 B7R1.10 CC1CC(C1)CN MCULE-8372628495 [1,0,0,1,0,0|1,0,0]=3 3474 B7R1.10 CC1CC(C1)CO MCULE-5730978355 [1,0,0,1,0,0|0,0,0]=2 3475 B7R1.10 CCN1CC(C1)O MCULE-6471655695 [1,0,0,1,0,0|2,0,0]=4 3476 B7R1.10 CCN1CC(C1)O MCULE-9317904836 [1,0,0,1,0,0|2,0,0]=4 3477 B7R1.10 CN1CC(C1)CBr MCULE-6612509681 [1,0,0,1,0,0|2,0,0]=4 3478 B7R1.10 CN1CC(C1)CN MCULE-3348262246 [1,0,0,1,0,0|2,0,0]=4 3479 B7R1.10 CN1CC(C1)CN MCULE-4845485123 [1,0,0,1,0,0|2,0,0]=4 3480 B7R1.10 CN1CC(C1)CO MCULE-7263385340 [1,0,0,1,0,0|1,0,0]=3 3481 B7R1.10 CN1CC(C1)CO MCULE-8892079014 [1,0,0,1,0,0|1,0,0]=3 3482 B7R1.10 CNC1CC(C1)C MCULE-5081801744 [1,0,0,1,0,0|2,0,0]=4 3483 B7R1.10 CNC1CC(C1)C MCULE-9449007216 [1,0,0,1,0,0|2,0,0]=4 3484 B7R1.10 CNC1CC(C1)O MCULE-1360972312 [1,0,0,1,0,0|2,0,0]=4 3485 B7R1.10 CNC1CC(C1)O MCULE-1798280109 [1,0,0,1,0,0|2,0,0]=4 3486 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-2573139583 [1,0,0,1,0,0|2,0,0]=4 3487 B7R1.10 CN[C@H]1C[C@@H](C1)O MCULE-8240672064 [1,0,0,1,0,0|2,0,0]=4 3488 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-1676114682 [1,0,0,1,0,0|2,0,0]=4 3489 B7R1.10 CN[C@H]1C[C@H](C1)O MCULE-5219886186 [1,0,0,1,0,0|2,0,0]=4 3490 B7R1.10 COC1CC(C1)O MCULE-6762585493 [1,0,0,1,0,0|2,0,0]=4 3491 B7R1.10 CO[C@H]1C[C@@H](C1)O MCULE-8355585959 [1,0,0,1,0,0|2,0,0]=4 3492 B7R1.10 CO[C@H]1C[C@H](C1)O MCULE-4960775262 [1,0,0,1,0,0|2,0,0]=4 3493 B7R1.10 CSC1CC(C1)O MCULE-1605912153 [1,0,0,1,0,0|2,0,0]=4 3494 B7R1.10 NC1CC(C1)CO MCULE-4549811698 [1,0,0,1,0,0|1,0,0]=3 3495 B7R1.10 NC1CC(C1)CO MCULE-9310533439 [1,0,0,1,0,0|1,0,0]=3 3496 B7R1.10 NCC1CC(C1)F MCULE-8395280530 [1,0,0,1,0,0|2,0,0]=4 3497 B7R1.10 NCC1CC(C1)F MCULE-9102367552 [1,0,0,1,0,0|2,0,0]=4 3498 B7R1.10 NCC1CC(C1)O MCULE-1448807479 [1,0,0,1,0,0|2,0,0]=4 3499 B7R1.10 NCC1CC(C1)O MCULE-5095960848 [1,0,0,1,0,0|2,0,0]=4 3500 B7R1.10 NC[C@H]1C[C@@H](C1)F MCULE-5013421604 [1,0,0,1,0,0|2,0,0]=4 3501 B7R1.10 NC[C@H]1C[C@@H](C1)F MCULE-9543558044 [1,0,0,1,0,0|2,0,0]=4 3502 B7R1.10 NC[C@H]1C[C@@H](C1)O MCULE-2155101378 [1,0,0,1,0,0|2,0,0]=4 3503 B7R1.10 NC[C@H]1C[C@@H](C1)O MCULE-3237212031 [1,0,0,1,0,0|2,0,0]=4 3504 B7R1.10 NC[C@H]1C[C@H](C1)O MCULE-3137766844 [1,0,0,1,0,0|2,0,0]=4 3505 B7R1.10 NC[C@H]1C[C@H](C1)O MCULE-6173771659 [1,0,0,1,0,0|2,0,0]=4 3506 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-1976271596 [1,0,0,1,0,0|1,0,0]=3 3507 B7R1.10 N[C@H]1C[C@@H](C1)CO MCULE-2004610084 [1,0,0,1,0,0|1,0,0]=3 3508 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-3406959231 [1,0,0,1,0,0|1,0,0]=3 3509 B7R1.10 N[C@H]1C[C@H](C1)CO MCULE-9771399616 [1,0,0,1,0,0|1,0,0]=3 3510 B7R1.10 O=C1CC(C1)CO MCULE-6785243243 [1,0,0,1,0,0|1,0,1]=4 3511 B7R1.10 OC1CC(C1)CBr MCULE-8641406432 [1,0,0,1,0,0|2,0,0]=4 3512 B7R1.10 OC1CC(C1)CF MCULE-9152872996 [1,0,0,1,0,0|2,0,0]=4 3513 B7R1.10 OCC1CC(C1)Br MCULE-6426656913 [1,0,0,1,0,0|1,0,0]=3 3514 B7R1.10 OCC1CC(C1)Cl MCULE-8102550006 [1,0,0,1,0,0|1,0,0]=3 3515 B7R1.10 OCC1CC(C1)F MCULE-8343173774 [1,0,0,1,0,0|1,0,0]=3 3516 B7R1.10 OCC1CC(C1)O MCULE-3885216336 [1,0,0,1,0,0|1,0,0]=3 3517 B7R1.10 OC[C@H]1C[C@H](C1)O MCULE-2350233032 [1,0,0,1,0,0|1,0,0]=3 3518 B7R1.10 O[C@H]1C[C@H](C1)CF MCULE-2417083162 [1,0,0,1,0,0|2,0,0]=4 3519 B7R1.10 [C@@H]1(C[C@H](C1)CN)F MCULE-1449288209 [1,0,0,1,0,0|2,0,0]=4 3520 B7R1.10 [C@@H]1(C[C@H](C1)CN)F MCULE-2879792720 [1,0,0,1,0,0|2,0,0]=4 3521 B7R1.21 CC1(CC1)CCBr MCULE-4700835198 [1,0,0,1,0,0|2,0,0]=4 3522 B7R1.21 CC1(CC1)CCN MCULE-1525421562 [1,0,0,1,0,0|2,0,0]=4 3523 B7R1.21 CC1(CC1)CCN MCULE-2587012619 [1,0,0,1,0,0|2,0,0]=4 3524 B7R1.21 CC1(CC1)CCO MCULE-4173763460 [1,0,0,1,0,0|1,0,0]=3 3525 B7R1.21 CCCC1(CC1)N MCULE-2015286161 [1,0,0,1,0,0|2,0,0]=4 3526 B7R1.21 CCCC1(CC1)N MCULE-9864007655 [1,0,0,1,0,0|2,0,0]=4 3527 B7R1.21 CCNC1(CC1)C MCULE-7289521608 [1,0,0,1,0,0|2,0,0]=4 3528 B7R1.21 CCNC1(CC1)C MCULE-7847765564 [1,0,0,1,0,0|2,0,0]=4 3529 B7R1.21 CNCC1(CC1)C MCULE-5523822723 [1,0,0,1,0,0|2,0,0]=4 3530 B7R1.21 COCC1(CO1)C MCULE-8694642597 [1,0,0,1,0,0|1,0,0]=3 3531 B7R1.21 NC1(CC1)CCO MCULE-6023170197 [1,0,0,1,0,0|1,0,0]=3 3532 B7R1.21 NC1(CC1)CCO MCULE-6146864546 [1,0,0,1,0,0|1,0,0]=3 3533 B7R1.21 NCCC1(CC1)N MCULE-1950553965 [1,0,0,1,0,0|2,0,0]=4 3534 B7R1.21 NCCC1(CC1)N MCULE-4555905032 [1,0,0,1,0,0|2,0,0]=4 3535 B7R1.21 NCCC1(CC1)O MCULE-7254265215 [1,0,0,1,0,0|1,1,0]=4 3536 B7R1.21 NCCC1(CC1)O MCULE-9873887297 [1,0,0,1,0,0|1,1,0]=4 3537 B7R1.21 OC1(CC1)CCBr MCULE-4785989916 [1,0,0,1,0,0|1,1,0]=4 3538 B7R1.21 OCCC1(CC1)O MCULE-9575986419 [1,0,0,1,0,0|0,1,0]=3 3539 B7R1.22 C/C(=N/O)/C1CC1 MCULE-9504873944 [1,0,0,1,0,0|1,0,1]=4 3540 B7R1.22 CC(=NO)C1CC1 MCULE-2639658638 [1,0,0,1,0,0|1,0,1]=4 3541 B7R1.22 CC(C#N)C1CC1 MCULE-5117863339 [1,0,0,1,0,0|1,0,1]=4 3542 B7R1.22 CC(C=O)C1CC1 MCULE-9307079880 [1,0,0,1,0,0|0,0,2]=4 3543 B7R1.22 CC(CBr)C1CC1 MCULE-6817011252 [1,0,0,1,0,0|1,0,0]=3 3544 B7R1.22 CC(CN)C1CC1 MCULE-8672047249 [1,0,0,1,0,0|1,0,0]=3 3545 B7R1.22 CC(CN)C1CC1 MCULE-9115092780 [1,0,0,1,0,0|1,0,0]=3 3546 B7R1.22 CC(CO)C1CC1 MCULE-8325587009 [1,0,0,1,0,0|0,0,0]=2 3547 B7R1.22 CC(NN)C1CC1 MCULE-4645972246 [1,0,0,1,0,0|2,0,0]=4 3548 B7R1.22 CC(NN)C1CC1 MCULE-5779482348 [1,0,0,1,0,0|2,0,0]=4 3549 B7R1.22 CC(NN)C1CC1 MCULE-8729564000 [1,0,0,1,0,0|2,0,0]=4 3550 B7R1.22 CC(ON)C1CC1 MCULE-7159103218 [1,0,0,1,0,0|2,0,0]=4 3551 B7R1.22 CC(ON)C1CC1 MCULE-9475793465 [1,0,0,1,0,0|2,0,0]=4 3552 B7R1.22 CCC(N)C1CC1 MCULE-2935155085 [1,0,0,1,0,0|2,0,0]=4 3553 B7R1.22 CCC(N)C1CC1 MCULE-7295156418 [1,0,0,1,0,0|2,0,0]=4 3554 B7R1.22 CCC(O)C1CC1 MCULE-5753196768 [1,0,0,1,0,0|1,1,0]=4 3555 B7R1.22 CC[C@@H](N)C1CC1 MCULE-8184175332 [1,0,0,1,0,0|2,0,0]=4 3556 B7R1.22 CC[C@H](N)C1CC1 MCULE-5395953598 [1,0,0,1,0,0|2,0,0]=4 3557 B7R1.22 CC[C@H](N)C1CC1 MCULE-6843001585 [1,0,0,1,0,0|2,0,0]=4 3558 B7R1.22 CC[C@H](N)C1CC1 MCULE-8773009184 [1,0,0,1,0,0|2,0,0]=4 3559 B7R1.22 CNC(C)C1CC1 MCULE-3862123004 [1,0,0,1,0,0|2,0,0]=4 3560 B7R1.22 CNC(C)C1CC1 MCULE-5338638792 [1,0,0,1,0,0|2,0,0]=4 3561 B7R1.22 ClCC(Cl)C1CO1 MCULE-4739045871 [1,0,0,1,0,0|2,0,0]=4 3562 B7R1.22 NC(CO)C1CC1 MCULE-5154854421 [1,0,0,1,0,0|1,0,0]=3 3563 B7R1.22 NC(CO)C1CC1 MCULE-8775546228 [1,0,0,1,0,0|1,0,0]=3 3564 B7R1.22 NCC(N)C1CC1 MCULE-9464810605 [1,0,0,1,0,0|2,0,0]=4 3565 B7R1.22 NCC(O)C1CC1 MCULE-4953920778 [1,0,0,1,0,0|2,0,0]=4 3566 B7R1.22 NCC(O)C1CC1 MCULE-5905916662 [1,0,0,1,0,0|2,0,0]=4 3567 B7R1.22 NC[C@@H](N)C1CC1 MCULE-3450570705 [1,0,0,1,0,0|2,0,0]=4 3568 B7R1.22 NC[C@@H](N)C1CC1 MCULE-4753758413 [1,0,0,1,0,0|2,0,0]=4 3569 B7R1.22 NC[C@@H](N)C1CC1 MCULE-4823446729 [1,0,0,1,0,0|2,0,0]=4 3570 B7R1.22 NC[C@@H](N)C1CC1 MCULE-7123860849 [1,0,0,1,0,0|2,0,0]=4 3571 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5231249344 [1,0,0,1,0,0|1,0,0]=3 3572 B7R1.22 N[C@@H](CO)C1CC1 MCULE-5233980282 [1,0,0,1,0,0|1,0,0]=3 3573 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9664157108 [1,0,0,1,0,0|1,0,0]=3 3574 B7R1.22 N[C@@H](CO)C1CC1 MCULE-9941605288 [1,0,0,1,0,0|1,0,0]=3 3575 B7R1.22 N[C@H](CO)C1CC1 MCULE-3523450080 [1,0,0,1,0,0|1,0,0]=3 3576 B7R1.22 N[C@H](CO)C1CC1 MCULE-6097147899 [1,0,0,1,0,0|1,0,0]=3 3577 B7R1.22 N[C@H](CO)C1CC1 MCULE-9050007019 [1,0,0,1,0,0|1,0,0]=3 3578 B7R1.22 N[C@H](CO)C1CC1 MCULE-9945100855 [1,0,0,1,0,0|1,0,0]=3 3579 B7R1.22 O=C(CO)C1CC1 MCULE-4276266642 [1,0,0,1,0,0|1,0,1]=4 3580 B7R1.22 OC(CBr)C1CC1 MCULE-1163924206 [1,0,0,1,0,0|2,0,0]=4 3581 B7R1.22 OCC(O)C1CC1 MCULE-9694056700 [1,0,0,1,0,0|1,0,0]=3 3582 B7R1.25 CC1(CCC1)C#N MCULE-9909167812 [1,0,0,1,0,0|1,0,1]=4 3583 B7R1.25 CC1(CCC1)C=O MCULE-9513047998 [1,0,0,1,0,0|0,0,2]=4 3584 B7R1.25 CC1(CCC1)CBr MCULE-8887285694 [1,0,0,1,0,0|1,0,0]=3 3585 B7R1.25 CC1(CCC1)CN MCULE-2351992333 [1,0,0,1,0,0|1,0,0]=3 3586 B7R1.25 CC1(CCC1)CN MCULE-4768166684 [1,0,0,1,0,0|1,0,0]=3 3587 B7R1.25 CC1(CCC1)CO MCULE-9646690839 [1,0,0,1,0,0|0,0,0]=2 3588 B7R1.25 CC1(CCC1)CS MCULE-2920048402 [1,0,0,1,0,0|0,1,0]=3 3589 B7R1.25 CC1(CCN1)CO MCULE-2134260042 [1,0,0,1,0,0|1,0,0]=3 3590 B7R1.25 CC1(CCN1)CO MCULE-3210259937 [1,0,0,1,0,0|1,0,0]=3 3591 B7R1.25 CC1(CCO1)CN MCULE-1371408706 [1,0,0,1,0,0|2,0,0]=4 3592 B7R1.25 CC1(CCO1)CO MCULE-6424264752 [1,0,0,1,0,0|1,0,0]=3 3593 B7R1.25 CC1(CNC1)CF MCULE-3915015007 [1,0,0,1,0,0|2,0,0]=4 3594 B7R1.25 CC1(CNC1)CF MCULE-9466310680 [1,0,0,1,0,0|2,0,0]=4 3595 B7R1.25 CC1(CNC1)CN MCULE-1219615860 [1,0,0,1,0,0|2,0,0]=4 3596 B7R1.25 CC1(CNC1)CN MCULE-8264013292 [1,0,0,1,0,0|2,0,0]=4 3597 B7R1.25 CC1(CNC1)CO MCULE-4856424189 [1,0,0,1,0,0|1,0,0]=3 3598 B7R1.25 CC1(CNC1)CO MCULE-7118798664 [1,0,0,1,0,0|1,0,0]=3 3599 B7R1.25 CC1(COC1)CBr MCULE-5644951797 [1,0,0,1,0,0|2,0,0]=4 3600 B7R1.25 CC1(COC1)CCl MCULE-3299014950 [1,0,0,1,0,0|2,0,0]=4 3601 B7R1.25 CC1(COC1)CI MCULE-2311899293 [1,0,0,1,0,0|2,0,0]=4 3602 B7R1.25 CC1(COC1)CN MCULE-1465461565 [1,0,0,1,0,0|2,0,0]=4 3603 B7R1.25 CC1(COC1)CN MCULE-9032740574 [1,0,0,1,0,0|2,0,0]=4 3604 B7R1.25 CC1(COC1)CN MCULE-9508101523 [1,0,0,1,0,0|2,0,0]=4 3605 B7R1.25 CC1(COC1)CO MCULE-5859568263 [1,0,0,1,0,0|1,0,0]=3 3606 B7R1.25 CC1(COC1)CS MCULE-6297617076 [1,0,0,1,0,0|1,1,0]=4 3607 B7R1.25 CC1(CSC1)CO MCULE-2267957602 [1,0,0,1,0,0|1,0,0]=3 3608 B7R1.25 CCC1(CCC1)N MCULE-5053916607 [1,0,0,1,0,0|2,0,0]=4 3609 B7R1.25 CCC1(CCC1)N MCULE-5413278315 [1,0,0,1,0,0|2,0,0]=4 3610 B7R1.25 CCC1(CNC1)C MCULE-6047240128 [1,0,0,1,0,0|2,0,0]=4 3611 B7R1.25 CCC1(CNC1)C MCULE-7401095376 [1,0,0,1,0,0|2,0,0]=4 3612 B7R1.25 C[C@@]1(CCO1)CN MCULE-8755107224 [1,0,0,1,0,0|2,0,0]=4 3613 B7R1.25 C[C@@]1(CCO1)CO MCULE-4685471926 [1,0,0,1,0,0|1,0,0]=3 3614 B7R1.25 C[C@@]1(CCO1)CO MCULE-5799098537 [1,0,0,1,0,0|1,0,0]=3 3615 B7R1.25 C[C@]1(CCO1)CO MCULE-5749345841 [1,0,0,1,0,0|1,0,0]=3 3616 B7R1.25 FC1(CCC1)CBr MCULE-3319458488 [1,0,0,1,0,0|2,0,0]=4 3617 B7R1.25 NC1(CCC1)CF MCULE-1820863854 [1,0,0,1,0,0|2,0,0]=4 3618 B7R1.25 NC1(CCC1)CF MCULE-4073039809 [1,0,0,1,0,0|2,0,0]=4 3619 B7R1.25 NC1(CCC1)CO MCULE-3303213714 [1,0,0,1,0,0|1,0,0]=3 3620 B7R1.25 NC1(CCC1)CO MCULE-7230626576 [1,0,0,1,0,0|1,0,0]=3 3621 B7R1.25 NC1(COC1)CO MCULE-5347414182 [1,0,0,1,0,0|2,0,0]=4 3622 B7R1.25 NCC1(CCC1)F MCULE-4269584193 [1,0,0,1,0,0|2,0,0]=4 3623 B7R1.25 NCC1(CCC1)F MCULE-8050912377 [1,0,0,1,0,0|2,0,0]=4 3624 B7R1.25 NCC1(CCC1)N MCULE-4976713787 [1,0,0,1,0,0|2,0,0]=4 3625 B7R1.25 NCC1(CCC1)N MCULE-8019875303 [1,0,0,1,0,0|2,0,0]=4 3626 B7R1.25 NCC1(CCC1)O MCULE-1242555690 [1,0,0,1,0,0|2,0,0]=4 3627 B7R1.25 OC1(CCC1)CBr MCULE-7282991867 [1,0,0,1,0,0|2,0,0]=4 3628 B7R1.25 OCC1(CCC1)F MCULE-5944864184 [1,0,0,1,0,0|1,0,0]=3 3629 B7R1.25 OCC1(CCC1)O MCULE-2830358505 [1,0,0,1,0,0|1,0,0]=3 3630 B7R1.25 OCC1(CNC1)F MCULE-7526502512 [1,0,0,1,0,0|2,0,0]=4 3631 B7R1.25 OCC1(CNC1)F MCULE-7804174908 [1,0,0,1,0,0|2,0,0]=4 3632 B7R1.25 OCC1(CNC1)O MCULE-1089145184 [1,0,0,1,0,0|2,0,0]=4 3633 B7R1.25 OCC1(CNC1)O MCULE-8217738451 [1,0,0,1,0,0|2,0,0]=4 3634 B7R1.25 OCC1(CNC1)O MCULE-9215525935 [1,0,0,1,0,0|2,0,0]=4 3635 B7R1.25 OCC1(CNC1)O MCULE-9389454165 [1,0,0,1,0,0|2,0,0]=4 3636 B7R1.25 OCC1(COC1)F MCULE-9098723776 [1,0,0,1,0,0|2,0,0]=4 3637 B7R1.25 OCC1(COC1)O MCULE-4207928663 [1,0,0,1,0,0|2,0,0]=4 3638 B7R1.27 CC1(CC1Br)CN MCULE-1556714007 [1,0,0,1,0,0|2,0,0]=4 3639 B7R1.27 CC1(CC1Br)CN MCULE-5280385523 [1,0,0,1,0,0|2,0,0]=4 3640 B7R1.27 CC1(CC1Br)CO MCULE-5286402958 [1,0,0,1,0,0|1,0,0]=3 3641 B7R1.27 CC1(CC1F)CO MCULE-9626513813 [1,0,0,1,0,0|1,0,0]=3 3642 B7R1.27 CC1CC1(C)C=O MCULE-1780701123 [1,0,0,1,0,0|0,0,2]=4 3643 B7R1.27 CCC1(CC1N)C MCULE-2073505141 [1,0,0,1,0,0|2,0,0]=4 3644 B7R1.27 CCC1(CC1N)C MCULE-3927183672 [1,0,0,1,0,0|2,0,0]=4 3645 B7R1.12 CC(C)[C@@H]1C[C@H]1N MCULE-1713655941 [1,0,0,1,0,0|2,0,0]=4 3646 B7R1.12 CC(C)[C@@H]1C[C@H]1N MCULE-5926317826 [1,0,0,1,0,0|2,0,0]=4 3647 B7R1.17 CC1(CCC1=O)C MCULE-3723871956 [1,0,0,1,0,0|0,1,1]=4 3648 B7R1.17 CC1(CCC1Br)C MCULE-2707590334 [1,0,0,1,0,0|1,0,0]=3 3649 B7R1.17 CC1(CCC1N)C MCULE-3143969489 [1,0,0,1,0,0|1,0,0]=3 3650 B7R1.17 CC1(CCC1N)C MCULE-7719131610 [1,0,0,1,0,0|1,0,0]=3 3651 B7R1.17 CC1(CCC1O)C MCULE-7385359414 [1,0,0,1,0,0|0,1,0]=3 3652 B7R1.17 CC1(CC[C@@H]1O)C MCULE-9766955692 [1,0,0,1,0,0|0,1,0]=3 3653 B7R1.17 CC1(NCC1O)C MCULE-5840741801 [1,0,0,1,0,0|1,1,0]=4 3654 B7R1.17 CC1(NCC1O)C MCULE-7044413523 [1,0,0,1,0,0|1,1,0]=4 3655 B7R1.17 CC1(OCC1N)C MCULE-2792085100 [1,0,0,1,0,0|2,0,0]=4 3656 B7R1.17 CC1(OCC1O)C MCULE-4679216060 [1,0,0,1,0,0|1,1,0]=4 3657 B7R1.17 CC1(OC[C@@H]1N)C MCULE-1806722832 [1,0,0,1,0,0|2,0,0]=4 3658 B7R1.17 CC1(SCC1N)C MCULE-2967285527 [1,0,0,1,0,0|2,0,0]=4 3659 B7R1.17 CC1(SCC1N)C MCULE-3093982180 [1,0,0,1,0,0|2,0,0]=4 3660 B7R1.18 CC(=O)C1COC1 MCULE-3416774210 [1,0,0,1,0,0|0,1,1]=4 3661 B7R1.18 CC(C)C1CNC1 MCULE-4830353053 [1,0,0,1,0,0|2,0,0]=4 3662 B7R1.18 CC(C)C1CNC1 MCULE-7304386148 [1,0,0,1,0,0|2,0,0]=4 3663 B7R1.18 CC(N)C1CCC1 MCULE-1055775237 [1,0,0,1,0,0|2,0,0]=4 3664 B7R1.18 CC(N)C1CCC1 MCULE-4303681430 [1,0,0,1,0,0|2,0,0]=4 3665 B7R1.18 CC(N)C1COC1 MCULE-1380624257 [1,0,0,1,0,0|1,0,0]=3 3666 B7R1.18 CC(N)C1CSC1 MCULE-5095506053 [1,0,0,1,0,0|1,1,0]=4 3667 B7R1.18 CC(O)C1CCC1 MCULE-7846963519 [1,0,0,1,0,0|1,0,0]=3 3668 B7R1.18 CC(O)C1CNC1 MCULE-1265886795 [1,0,0,1,0,0|1,1,0]=4 3669 B7R1.18 CC(O)C1CNC1 MCULE-5108259269 [1,0,0,1,0,0|1,1,0]=4 3670 B7R1.18 CC(O)C1CNC1 MCULE-8265279011 [1,0,0,1,0,0|1,1,0]=4 3671 B7R1.18 CC(O)C1COC1 MCULE-4981198639 [1,0,0,1,0,0|0,1,0]=3 3672 B7R1.18 C[C@@H](N)C1CCC1 MCULE-4670161237 [1,0,0,1,0,0|2,0,0]=4 3673 B7R1.18 C[C@@H](N)C1CCC1 MCULE-6520272933 [1,0,0,1,0,0|2,0,0]=4 3674 B7R1.18 C[C@@H](N)C1CCC1 MCULE-8342688572 [1,0,0,1,0,0|2,0,0]=4 3675 B7R1.18 C[C@@H](N)C1CCC1 MCULE-9076983662 [1,0,0,1,0,0|2,0,0]=4 3676 B7R1.18 C[C@@H](N)C1COC1 MCULE-7669553866 [1,0,0,1,0,0|1,0,0]=3 3677 B7R1.18 C[C@@H](O)C1CCC1 MCULE-6990873960 [1,0,0,1,0,0|1,0,0]=3 3678 B7R1.18 C[C@@H](O)C1COC1 MCULE-5223611242 [1,0,0,1,0,0|0,1,0]=3 3679 B7R1.18 C[C@@H](O)C1COC1 MCULE-5819578881 [1,0,0,1,0,0|0,1,0]=3 3680 B7R1.18 C[C@H](N)C1CCC1 MCULE-2555280675 [1,0,0,1,0,0|2,0,0]=4 3681 B7R1.18 C[C@H](N)C1CCC1 MCULE-3888125434 [1,0,0,1,0,0|2,0,0]=4 3682 B7R1.18 C[C@H](N)C1CCC1 MCULE-6963105805 [1,0,0,1,0,0|2,0,0]=4 3683 B7R1.18 C[C@H](N)C1CCC1 MCULE-7483270694 [1,0,0,1,0,0|2,0,0]=4 3684 B7R1.18 C[C@H](N)C1COC1 MCULE-8337949293 [1,0,0,1,0,0|1,0,0]=3 3685 B7R1.18 C[C@H](O)C1CCC1 MCULE-5072123772 [1,0,0,1,0,0|1,0,0]=3 3686 B7R1.18 C[C@H](O)C1CCC1 MCULE-6701623925 [1,0,0,1,0,0|1,0,0]=3 3687 B7R1.18 C[C@H](O)C1CNC1 MCULE-4694154501 [1,0,0,1,0,0|1,1,0]=4 3688 B7R1.18 C[C@H](O)C1CNC1 MCULE-5870270724 [1,0,0,1,0,0|1,1,0]=4 3689 B7R1.18 C[C@H](O)C1COC1 MCULE-1396791034 [1,0,0,1,0,0|0,1,0]=3 3690 B7R1.18 C[C@H](O)C1COC1 MCULE-8805369596 [1,0,0,1,0,0|0,1,0]=3 3691 B7R1.19 CC(=O)C1(CO1)C MCULE-3263824467 [1,0,0,1,0,0|0,1,1]=4 3692 B7R1.19 CC(C)C1(CC1)N MCULE-4070811283 [1,0,0,1,0,0|1,0,0]=3 3693 B7R1.19 CC(C)C1(CC1)N MCULE-8353733005 [1,0,0,1,0,0|1,0,0]=3 3694 B7R1.19 CC(C)C1(CC1)O MCULE-3516849541 [1,0,0,1,0,0|0,1,0]=3 3695 B7R1.19 CC(C)C1(CO1)C MCULE-6945955143 [1,0,0,1,0,0|1,0,0]=3 3696 B7R1.19 CC(N)C1(CC1)C MCULE-5748183771 [1,0,0,1,0,0|2,0,0]=4 3697 B7R1.19 CC(N)C1(CC1)C MCULE-5829560197 [1,0,0,1,0,0|2,0,0]=4 3698 B7R1.19 CC(N)C1(CC1)O MCULE-9318031577 [1,0,0,1,0,0|1,1,0]=4 3699 B7R1.19 CC(O)C1(CC1)C MCULE-6644959738 [1,0,0,1,0,0|1,0,0]=3 3700 B7R1.19 CC(O)C1(CC1)N MCULE-7865299177 [1,0,0,1,0,0|1,0,0]=3 3701 B7R1.19 CC1(CO1)C(F)F MCULE-3665337434 [1,0,0,1,0,0|2,0,0]=4 3702 B7R1.23 CC1(CC1CN)C MCULE-5243006209 [1,0,0,1,0,0|2,0,0]=4 3703 B7R1.23 CC1(CC1CN)C MCULE-8803769775 [1,0,0,1,0,0|2,0,0]=4 3704 B7R1.23 CC1(CC1CO)Br MCULE-1246890004 [1,0,0,1,0,0|1,0,0]=3 3705 B7R1.23 CC1(CC1CO)C MCULE-3855230422 [1,0,0,1,0,0|1,0,0]=3 3706 B7R1.23 CC1(C[C@@H]1CO)C MCULE-2771980454 [1,0,0,1,0,0|1,0,0]=3 3707 B7R1.23 CC1(C[C@H]1CO)C MCULE-7876524457 [1,0,0,1,0,0|1,0,0]=3 3708 B7R1.23 CC1(OC1CBr)C MCULE-1797899499 [1,0,0,1,0,0|1,1,0]=4 3709 B7R1.23 CC1(OC1CCl)C MCULE-6494110934 [1,0,0,1,0,0|1,1,0]=4 3710 B7R1.23 CC1(OC1CO)C MCULE-5147602353 [1,0,0,1,0,0|1,1,0]=4 3711 B7R1.23 CNC1CC1(C)C MCULE-2392748327 [1,0,0,1,0,0|2,0,0]=4 3712 B7R1.23 CNC1CC1(C)C MCULE-6195602506 [1,0,0,1,0,0|2,0,0]=4 3713 B7R1.23 OCC1CC1(Br)Br MCULE-7089012177 [1,0,0,1,0,0|2,0,0]=4 3714 B7R1.23 OCC1CC1(Cl)Cl MCULE-7270696266 [1,0,0,1,0,0|2,0,0]=4 3715 B7R1.23 OCC1CC1(F)F MCULE-7947011827 [1,0,0,1,0,0|2,0,0]=4 3716 B7R1.23 OCC1CC1(F)F MCULE-8758794887 [1,0,0,1,0,0|2,0,0]=4 3717 B7R1.23 OC[C@@H]1CC1(F)F MCULE-7341169417 [1,0,0,1,0,0|2,0,0]=4 3718 B7R1.23 OC[C@@H]1CC1(F)F MCULE-8085476948 [1,0,0,1,0,0|2,0,0]=4 3719 B7R1.23 OC[C@H]1CC1(F)F MCULE-4517768682 [1,0,0,1,0,0|2,0,0]=4 3720 B7R1.23 OC[C@H]1CC1(F)F MCULE-7100712334 [1,0,0,1,0,0|2,0,0]=4 3721 B9R1.2 C1(CCCN(C1)C)CO MCULE-7393298394 [0,0,0,1,0,1|2,0,0]=4 3722 B9R1.2 CC1CC(CCO1)CO MCULE-1147018894 [0,0,0,1,0,1|2,0,0]=4 3723 B9R1.2 CC1CCCC(C1)CBr MCULE-4436738297 [0,0,0,1,0,1|2,0,0]=4 3724 B9R1.2 CC1CCCC(C1)CN MCULE-5692325071 [0,0,0,1,0,1|2,0,0]=4 3725 B9R1.2 CC1CCCC(C1)CO MCULE-5618525751 [0,0,0,1,0,1|1,0,0]=3 3726 B9R1.2 CC1CCCC(N1)CO MCULE-1132392693 [0,0,0,1,0,1|1,0,0]=3 3727 B9R1.2 CC1CCCC(O1)CN MCULE-9065375307 [0,0,0,1,0,1|2,0,0]=4 3728 B9R1.2 CC1CNCC(C1)CO MCULE-1604083581 [0,0,0,1,0,1|2,0,0]=4 3729 B9R1.2 CC1CNCC(O1)CO MCULE-6915504187 [0,0,0,1,0,1|2,0,0]=4 3730 B9R1.2 CCC1CCCC(C1)C MCULE-6755768980 [0,0,0,1,0,1|2,0,0]=4 3731 B9R1.2 CCC1CCCC(C1)N MCULE-8754064896 [0,0,0,1,0,1|2,0,0]=4 3732 B9R1.2 CCC1CCCC(C1)O MCULE-5149394080 [0,0,0,1,0,1|1,1,0]=4 3733 B9R1.2 CCC1CNCC(O1)C MCULE-6402129304 [0,0,0,1,0,1|2,0,0]=4 3734 B9R1.2 CCC1COCC(N1)C MCULE-1227991263 [0,0,0,1,0,1|1,0,0]=3 3735 B9R1.2 CC[C@@H]1CCC[C@@H](N1)C MCULE-4368459266 [0,0,0,1,0,1|2,0,0]=4 3736 B9R1.2 CC[C@@H]1CNC[C@@H](N1)C MCULE-8386790724 [0,0,0,1,0,1|2,0,0]=4 3737 B9R1.2 CC[C@H]1CNC[C@H](O1)C MCULE-1726802726 [0,0,0,1,0,1|2,0,0]=4 3738 B9R1.2 CN1CCCC(C1)CO MCULE-1489029640 [0,0,0,1,0,1|2,0,0]=4 3739 B9R1.2 CN1CCC[C@@H](C1)CO MCULE-7399583774 [0,0,0,1,0,1|2,0,0]=4 3740 B9R1.2 CN1CCC[C@@H](C1)CO MCULE-9308847454 [0,0,0,1,0,1|2,0,0]=4 3741 B9R1.2 CN1CCC[C@H](C1)CO MCULE-1288636914 [0,0,0,1,0,1|2,0,0]=4 3742 B9R1.2 CN1CCC[C@H](C1)CO MCULE-7586480861 [0,0,0,1,0,1|2,0,0]=4 3743 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-4030187082 [0,0,0,1,0,1|2,0,0]=4 3744 B9R1.2 C[C@@H]1CNC[C@H](O1)CO MCULE-8521542499 [0,0,0,1,0,1|2,0,0]=4 3745 B9R1.2 C[C@@H]1C[C@@H](CCN1)CO MCULE-8058559032 [0,0,0,1,0,1|2,0,0]=4 3746 B9R1.2 C[C@@H]1C[C@@H](CCN1)CO MCULE-9351987850 [0,0,0,1,0,1|2,0,0]=4 3747 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6331587635 [0,0,0,1,0,1|2,0,0]=4 3748 B9R1.2 C[C@H]1CNC[C@H](O1)CO MCULE-6791243811 [0,0,0,1,0,1|2,0,0]=4 3749 B9R1.2 FC1CCCC(C1)CBr MCULE-9227693146 [0,0,0,1,0,1|2,0,0]=4 3750 B9R1.2 NC1CCCC(C1)CO MCULE-1724466395 [0,0,0,1,0,1|1,0,0]=3 3751 B9R1.2 NC1CCCC(C1)CO MCULE-8087216563 [0,0,0,1,0,1|1,0,0]=3 3752 B9R1.2 NC1CCOC(C1)CO MCULE-2895862257 [0,0,0,1,0,1|2,0,0]=4 3753 B9R1.2 NC1CCOC(C1)CO MCULE-9883092947 [0,0,0,1,0,1|2,0,0]=4 3754 B9R1.2 NCC1CCCC(C1)F MCULE-2632687383 [0,0,0,1,0,1|2,0,0]=4 3755 B9R1.2 NCC1CCCC(C1)F MCULE-7609751819 [0,0,0,1,0,1|2,0,0]=4 3756 B9R1.2 NCC1CCCC(C1)N MCULE-9853807311 [0,0,0,1,0,1|2,0,0]=4 3757 B9R1.2 NCC1CCCC(C1)O MCULE-3067555499 [0,0,0,1,0,1|1,1,0]=4 3758 B9R1.2 NC[C@@H]1CCC[C@H](C1)O MCULE-9062593795 [0,0,0,1,0,1|1,1,0]=4 3759 B9R1.2 N[C@@H]1CCC[C@@H](C1)CO MCULE-1617324917 [0,0,0,1,0,1|1,0,0]=3 3760 B9R1.2 N[C@@H]1CCC[C@@H](C1)CO MCULE-8272213010 [0,0,0,1,0,1|1,0,0]=3 3761 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-2296534416 [0,0,0,1,0,1|1,0,0]=3 3762 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-5952407491 [0,0,0,1,0,1|1,0,0]=3 3763 B9R1.2 N[C@@H]1CCC[C@H](C1)CO MCULE-6614147143 [0,0,0,1,0,1|1,0,0]=3 3764 B9R1.2 N[C@H]1CCC[C@@H](C1)CO MCULE-2015163295 [0,0,0,1,0,1|1,0,0]=3 3765 B9R1.2 N[C@H]1CCC[C@@H](C1)CO MCULE-3293475931 [0,0,0,1,0,1|1,0,0]=3 3766 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-1868841620 [0,0,0,1,0,1|1,0,0]=3 3767 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-6949082967 [0,0,0,1,0,1|1,0,0]=3 3768 B9R1.2 N[C@H]1CCC[C@H](C1)CO MCULE-9275476449 [0,0,0,1,0,1|1,0,0]=3 3769 B9R1.2 O=C1CCCC(C1)CO MCULE-5732276352 [0,0,0,1,0,1|0,1,1]=4 3770 B9R1.2 O=C1CCCC(N1)CO MCULE-6546170250 [0,0,0,1,0,1|0,1,1]=4 3771 B9R1.2 O=C1CCC[C@@H](N1)CO MCULE-6845836782 [0,0,0,1,0,1|0,1,1]=4 3772 B9R1.2 O=C1CCC[C@H](C1)CO MCULE-7659844168 [0,0,0,1,0,1|0,1,1]=4 3773 B9R1.2 O=C1CCC[C@H](N1)CO MCULE-2745722091 [0,0,0,1,0,1|0,1,1]=4 3774 B9R1.2 O=C1CCC[C@H](N1)CO MCULE-3358051383 [0,0,0,1,0,1|0,1,1]=4 3775 B9R1.2 OC1CCCC(C1)CCl MCULE-3541903770 [0,0,0,1,0,1|1,1,0]=4 3776 B9R1.2 OCC1CNCC(C1)F MCULE-4143657441 [0,0,0,1,0,1|2,0,0]=4 3777 B9R1.2 OCC1CNCC(C1)F MCULE-8277902234 [0,0,0,1,0,1|2,0,0]=4 3778 B9R1.2 OC[C@@H]1C[C@@H](CCN1)O MCULE-6189374946 [0,0,0,1,0,1|1,1,0]=4 3779 B9R1.2 OC[C@@H]1C[C@@H](CCN1)O MCULE-7813341428 [0,0,0,1,0,1|1,1,0]=4 3780 B9R1.2 OC[C@H]1C[C@H](CCN1)O MCULE-6277104745 [0,0,0,1,0,1|1,1,0]=4 3781 B9R1.2 OC[C@H]1C[C@H](CCN1)O MCULE-9933354273 [0,0,0,1,0,1|1,1,0]=4 3782 B9R1.2 [C@H]1(CNC[C@@H](O1)CO)C MCULE-4259776230 [0,0,0,1,0,1|2,0,0]=4 3783 B9R1.21 CCN1CCC(C1)CO MCULE-9507301668 [0,0,0,1,0,1|2,0,0]=4 3784 B9R1.21 CCN1CC[C@@H](C1)CO MCULE-4701790174 [0,0,0,1,0,1|2,0,0]=4 3785 B9R1.21 CCN1CC[C@H](C1)CO MCULE-2438276159 [0,0,0,1,0,1|2,0,0]=4 3786 B9R1.21 OCC1CCC(N1)CO MCULE-1103775354 [0,0,0,1,0,1|2,0,0]=4 3787 B9R1.21 OCC1CCC(O1)CO MCULE-3334782559 [0,0,0,1,0,1|2,0,0]=4 3788 B9R1.21 OCC1CNC(C1)CO MCULE-7672485489 [0,0,0,1,0,1|2,0,0]=4 3789 B9R1.21 OCC1CNC(C1)CO MCULE-7965706550 [0,0,0,1,0,1|2,0,0]=4 3790 B9R1.21 OC[C@@H]1CC[C@@H](O1)CO MCULE-5217154467 [0,0,0,1,0,1|2,0,0]=4 3791 B9R1.23 CCC1N=C(C(S1)C)C MCULE-1221109563 [0,0,0,1,0,1|1,0,1]=4 3792 B9R1.23 OCC1CC(C(O1)O)O MCULE-1894937679 [0,0,0,1,0,1|1,1,0]=4 3793 B9R1.37 CC1OC(C(C1C)N)C MCULE-6300493082 [0,0,0,1,0,1|2,0,0]=4 3794 B9R1.37 CC1OC(C(C1C)N)C MCULE-8122167979 [0,0,0,1,0,1|2,0,0]=4 3795 B9R1.37 CC1OC(C(C1O)O)O MCULE-7774087123 [0,0,0,1,0,1|1,1,0]=4 3796 B9R1.48 CC1CCCCC(N1)C MCULE-5797406782 [0,0,0,1,0,1|2,0,0]=4 3797 B9R1.48 C[C@@H]1CCCC[C@H](N1)C MCULE-7954748247 [0,0,0,1,0,1|2,0,0]=4 3798 B9R1.48 C[C@H]1CCCC[C@@H](N1)C MCULE-2719547061 [0,0,0,1,0,1|2,0,0]=4 3799 B9R1.48 C[C@H]1CCCC[C@H](N1)C MCULE-7122277223 [0,0,0,1,0,1|2,0,0]=4 3800 B9R1.69 CC1CC(=O)CCC1O MCULE-7552412875 [0,0,0,1,0,1|0,1,1]=4 3801 B9R1.69 CC1CC(CCC1O)N MCULE-2064143098 [0,0,0,1,0,1|1,0,0]=3 3802 B9R1.69 CC1CCC(C(C1)C)C MCULE-8423605383 [0,0,0,1,0,1|2,0,0]=4 3803 B9R1.69 CC1CCC(C(C1)C)N MCULE-8155557981 [0,0,0,1,0,1|2,0,0]=4 3804 B9R1.69 CC1CCC(C(C1)C)O MCULE-1958135453 [0,0,0,1,0,1|1,0,0]=3 3805 B9R1.69 CC1CCC(C(C1)N)C MCULE-3108482020 [0,0,0,1,0,1|2,0,0]=4 3806 B9R1.69 CC1CCC(C(C1)N)C MCULE-8540581791 [0,0,0,1,0,1|2,0,0]=4 3807 B9R1.69 CC1CCC(C(C1)O)C MCULE-8174479267 [0,0,0,1,0,1|1,1,0]=4 3808 B9R1.69 CC1CCC(C(N1)C)N MCULE-4753292681 [0,0,0,1,0,1|2,0,0]=4 3809 B9R1.69 CC1CCC(CC1C)N MCULE-1561023388 [0,0,0,1,0,1|2,0,0]=4 3810 B9R1.69 CC1CCC(CC1C)O MCULE-6171532647 [0,0,0,1,0,1|1,1,0]=4 3811 B9R1.69 CC1CN(CCC1O)C MCULE-2311637252 [0,0,0,1,0,1|2,0,0]=4 3812 B9R1.69 CC1CN(CCC1O)C MCULE-2388697417 [0,0,0,1,0,1|2,0,0]=4 3813 B9R1.69 CC1CNC(C(C1)C)C MCULE-6407956484 [0,0,0,1,0,1|2,0,0]=4 3814 B9R1.69 CC1CNC(C(O1)C)C MCULE-7872244038 [0,0,0,1,0,1|2,0,0]=4 3815 B9R1.69 CC1NC(=O)CCC1O MCULE-3879531993 [0,0,0,1,0,1|0,1,1]=4 3816 B9R1.69 C[C@@H]1CC(=O)CC[C@@H]1O MCULE-8675773780 [0,0,0,1,0,1|0,1,1]=4 3817 B9R1.69 C[C@H]1CC(=O)CC[C@@H]1O MCULE-5873948412 [0,0,0,1,0,1|0,1,1]=4 3818 B9R1.79 NC(CO)CC1CCC1 MCULE-2309333579 [0,0,0,1,0,1|2,0,0]=4 3819 B9R1.79 NC(CO)CC1CCC1 MCULE-6676177211 [0,0,0,1,0,1|2,0,0]=4 3820 B9R1.125 CC1(CC(CN1)O)CO MCULE-2899118253 [0,0,0,1,0,1|1,1,0]=4 3821 B9R1.125 CC1(CC(CN1)O)CO MCULE-8954323319 [0,0,0,1,0,1|1,1,0]=4 3822 B9R1.125 CC1(CCC(=O)N1)CO MCULE-9700105207 [0,0,0,1,0,1|0,1,1]=4 3823 B9R1.3 C1(CCNC(C1C)C)O MCULE-7157710103 [0,1,0,1,0,0|1,0,0]=3 3824 B9R1.3 C1(CCNC(C1C)C)O MCULE-8288554330 [0,1,0,1,0,0|1,0,0]=3 3825 B9R1.3 CC1CCCC(C1C)C MCULE-9375072995 [0,1,0,1,0,0|2,0,0]=4 3826 B9R1.3 CC1CCCC(C1C)N MCULE-7085283833 [0,1,0,1,0,0|2,0,0]=4 3827 B9R1.3 CC1CCCC(C1C)O MCULE-1285216829 [0,1,0,1,0,0|1,0,0]=3 3828 B9R1.3 CC1CCCC(C1N)C MCULE-4904455493 [0,1,0,1,0,0|2,0,0]=4 3829 B9R1.3 CC1CCCC(C1N)C MCULE-9589109711 [0,1,0,1,0,0|2,0,0]=4 3830 B9R1.3 CC1CCCC(C1O)C MCULE-8568932421 [0,1,0,1,0,0|1,1,0]=4 3831 B9R1.3 CC1CNCC(C1O)C MCULE-6809685999 [0,1,0,1,0,0|1,1,0]=4 3832 B9R1.3 CC1CNCC(C1O)C MCULE-8043720997 [0,1,0,1,0,0|1,1,0]=4 3833 B9R1.3 CC1COCC(C1=O)C MCULE-6746359512 [0,1,0,1,0,0|0,1,1]=4 3834 B9R1.3 CC1COCC(C1N)C MCULE-8557502930 [0,1,0,1,0,0|1,0,0]=3 3835 B9R1.3 CC1CSCC(C1N)C MCULE-8942533897 [0,1,0,1,0,0|1,1,0]=4 3836 B9R1.3 CC1OCCC(C1O)O MCULE-6494583965 [0,1,0,1,0,0|1,1,0]=4 3837 B9R1.3 C[C@@H]1CNC[C@@H]([C@@H]1O)O MCULE-4065345114 [0,1,0,1,0,0|1,1,0]=4 3838 B9R1.3 C[C@@H]1CNC[C@@H]([C@@H]1O)O MCULE-5732596905 [0,1,0,1,0,0|1,1,0]=4 3839 B9R1.3 C[C@H]1CNC[C@@H]([C@@H]1O)O MCULE-3640440568 [0,1,0,1,0,0|1,1,0]=4 3840 B9R1.3 C[C@H]1CNC[C@@H]([C@@H]1O)O MCULE-9501528896 [0,1,0,1,0,0|1,1,0]=4 3841 B9R1.3 NC1C(CCCC1O)O MCULE-1978359416 [0,1,0,1,0,0|1,1,0]=4 3842 B9R1.3 N[C@@H]1CCC[C@H]([C@@H]1O)O MCULE-7294484287 [0,1,0,1,0,0|2,0,0]=4 3843 B9R1.3 N[C@H]1CCC[C@@H]([C@@H]1O)O MCULE-4901407173 [0,1,0,1,0,0|2,0,0]=4 3844 B9R1.3 N[C@H]1CCC[C@H]([C@@H]1O)O MCULE-2706489441 [0,1,0,1,0,0|2,0,0]=4 3845 B9R1.3 OC1CCCC(C1O)O MCULE-2835511427 [0,1,0,1,0,0|1,1,0]=4 3846 B9R1.3 [C@@H]1(CCC[C@H]([C@@H]1N)O)O MCULE-9327450801 [0,1,0,1,0,0|1,1,0]=4 3847 B9R1.41 CC(C)C1CCCC1N MCULE-5814373788 [0,1,0,1,0,0|2,0,0]=4 3848 B9R1.41 CC(O)C1CCCN1C MCULE-1709841217 [0,1,0,1,0,0|2,0,0]=4 3849 B9R1.41 CC1CCCC1C(=O)O MCULE-5150428001 [0,1,0,1,0,0|1,0,1]=4 3850 B9R1.41 C[C@H](O)[C@@H]1CCCN1C MCULE-3481136719 [0,1,0,1,0,0|2,0,0]=4 3851 B9R1.41 C[C@H](O)[C@@H]1CCCN1C MCULE-8355283874 [0,1,0,1,0,0|2,0,0]=4 3852 B9R1.41 NC1CCCC1C(=O)O MCULE-4916984038 [0,1,0,1,0,0|1,0,1]=4 3853 B9R1.41 NC1CCCC1C(=O)O MCULE-7220342321 [0,1,0,1,0,0|1,0,1]=4 3854 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-3446631182 [0,1,0,1,0,0|1,0,1]=4 3855 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-4537266002 [0,1,0,1,0,0|1,0,1]=4 3856 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9091292908 [0,1,0,1,0,0|1,0,1]=4 3857 B9R1.41 N[C@@H]1CCC[C@@H]1C(=O)O MCULE-9780104108 [0,1,0,1,0,0|1,0,1]=4 3858 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-1397305924 [0,1,0,1,0,0|1,0,1]=4 3859 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-5447983159 [0,1,0,1,0,0|1,0,1]=4 3860 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-6345808896 [0,1,0,1,0,0|1,0,1]=4 3861 B9R1.41 N[C@@H]1CCC[C@H]1C(=O)O MCULE-7658809060 [0,1,0,1,0,0|1,0,1]=4 3862 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-5128495564 [0,1,0,1,0,0|1,0,1]=4 3863 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-7721875754 [0,1,0,1,0,0|1,0,1]=4 3864 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-8287396944 [0,1,0,1,0,0|1,0,1]=4 3865 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9470915806 [0,1,0,1,0,0|1,0,1]=4 3866 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9776724097 [0,1,0,1,0,0|1,0,1]=4 3867 B9R1.41 N[C@H]1CCC[C@@H]1C(=O)O MCULE-9997148303 [0,1,0,1,0,0|1,0,1]=4 3868 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-1768949677 [0,1,0,1,0,0|1,0,1]=4 3869 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-2999200875 [0,1,0,1,0,0|1,0,1]=4 3870 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-4735278058 [0,1,0,1,0,0|1,0,1]=4 3871 B9R1.41 N[C@H]1CCC[C@H]1C(=O)O MCULE-7501259126 [0,1,0,1,0,0|1,0,1]=4 3872 B9R1.41 O=C(O)C1CCCC1O MCULE-5519958446 [0,1,0,1,0,0|0,1,1]=4 3873 B9R1.41 O=C(O)[C@H]1CCC[C@H]1O MCULE-7220456005 [0,1,0,1,0,0|0,1,1]=4 3874 B9R1.93 CC(C)C1(CC1CO)C MCULE-2936124643 [0,1,0,1,0,0|1,0,0]=3 3875 B9R1.96 CN(C)C1CCC1CO MCULE-5766506996 [0,1,0,1,0,0|2,0,0]=4 3876 B9R1.96 CN(C)[C@H]1CC[C@H]1CO MCULE-1227513531 [0,1,0,1,0,0|2,0,0]=4 3877 B9R1.96 CN(C)[C@H]1CC[C@H]1CO MCULE-3808433921 [0,1,0,1,0,0|2,0,0]=4 3878 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-1352377374 [0,1,0,1,0,0|1,0,1]=4 3879 B9R1.110 CC(C(=O)O)C1CCC1 MCULE-3278183132 [0,1,0,1,0,0|1,0,1]=4 3880 B9R1.110 CC(C(=O)O)C1CCO1 MCULE-4481804660 [0,1,0,1,0,0|0,1,1]=4 3881 B9R1.110 CC(C)C(N)C1CCC1 MCULE-3337597801 [0,1,0,1,0,0|2,0,0]=4 3882 B9R1.111 CC(C(=O)O)C1(CC1)N MCULE-1517881247 [0,1,0,1,0,0|1,0,1]=4 3883 B9R1.127 CCC1(CC1C(=O)O)C MCULE-5907126944 [0,1,0,1,0,0|1,0,1]=4 3884 B9R1.132 OCC1NCC(C1O)O MCULE-7093172739 [0,1,0,1,0,0|1,1,0]=4 3885 B9R1.132 OCC1NCC(C1O)O MCULE-9377849443 [0,1,0,1,0,0|1,1,0]=4 3886 B9R1.132 OCC1OCC(C1O)O MCULE-6035918255 [0,1,0,1,0,0|1,1,0]=4 3887 B9R1.132 OC[C@@H]1OC[C@H]([C@H]1O)O MCULE-5977248366 [0,1,0,1,0,0|1,1,0]=4 3888 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-1707860323 [0,1,0,1,0,0|1,1,0]=4 3889 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-3279393618 [0,1,0,1,0,0|1,1,0]=4 3890 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-8001939489 [0,1,0,1,0,0|1,1,0]=4 3891 B9R1.132 OC[C@H]1NC[C@@H]([C@@H]1O)O MCULE-9735967120 [0,1,0,1,0,0|1,1,0]=4 3892 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O MCULE-2264267716 [0,1,0,1,0,0|1,1,0]=4 3893 B9R1.132 OC[C@H]1NC[C@H]([C@@H]1O)O MCULE-3690741497 [0,1,0,1,0,0|1,1,0]=4 3894 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-1695946114 [0,1,0,1,0,0|1,1,0]=4 3895 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-4767198765 [0,1,0,1,0,0|1,1,0]=4 3896 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-7740799111 [0,1,0,1,0,0|1,1,0]=4 3897 B9R1.132 OC[C@H]1NC[C@H]([C@H]1O)O MCULE-9816210484 [0,1,0,1,0,0|1,1,0]=4 3898 B9R1.132 OC[C@H]1OC[C@@H]([C@@H]1O)O MCULE-2426542638 [0,1,0,1,0,0|1,1,0]=4 3899 B9R1.132 OC[C@H]1OC[C@@H]([C@H]1O)O MCULE-2697830391 [0,1,0,1,0,0|1,1,0]=4 3900 B9R1.132 OC[C@H]1OC[C@@H]([C@H]1O)O MCULE-3664631398 [0,1,0,1,0,0|1,1,0]=4 3901 B9R1.132 OC[C@H]1SC[C@@H]([C@@H]1O)O MCULE-5460809648 [0,1,0,1,0,0|1,1,0]=4 3902 B9R1.5 CC1CCCCCC1N MCULE-5854491023 [0,1,0,1,0,0|2,0,0]=4 3903 B9R1.5 CC1CCCNCC1C MCULE-3413141564 [0,1,0,1,0,0|2,0,0]=4 3904 B9R1.5 CC1CCCNCC1C MCULE-6316766408 [0,1,0,1,0,0|2,0,0]=4 3905 B9R1.5 CC1CCNCCC1O MCULE-2014482309 [0,1,0,1,0,0|1,1,0]=4 3906 B9R1.5 CC1CCNCCC1O MCULE-7020970444 [0,1,0,1,0,0|1,1,0]=4 3907 B9R1.5 CC1CNCCCC1O MCULE-7042298511 [0,1,0,1,0,0|1,1,0]=4 3908 B9R1.5 CC1CNCCCC1O MCULE-8658161534 [0,1,0,1,0,0|1,1,0]=4 3909 B9R1.11 CC(CBr)C1CCCC1 MCULE-7239123079 [0,1,0,1,0,0|2,0,0]=4 3910 B9R1.11 CC(CO)N1CCCC1 MCULE-2818984547 [0,1,0,1,0,0|2,0,0]=4 3911 B9R1.11 CCC(=O)C1CCOC1 MCULE-1322014645 [0,1,0,1,0,0|0,1,1]=4 3912 B9R1.11 CCC(C)C1=NCCS1 MCULE-5440756916 [0,1,0,1,0,0|1,0,1]=4 3913 B9R1.11 CCC(C)C1CCCN1 MCULE-6263276107 [0,1,0,1,0,0|2,0,0]=4 3914 B9R1.11 CCC(C)C1CCNC1 MCULE-1019713366 [0,1,0,1,0,0|2,0,0]=4 3915 B9R1.11 CCC(N)C1CCCC1 MCULE-2018376160 [0,1,0,1,0,0|2,0,0]=4 3916 B9R1.11 CCC(N)C1CCCO1 MCULE-7946594021 [0,1,0,1,0,0|2,0,0]=4 3917 B9R1.11 CCC(N)C1CCOC1 MCULE-9731711708 [0,1,0,1,0,0|1,0,0]=3 3918 B9R1.11 CC[C@@H](C)C1=NCCS1 MCULE-6896500555 [0,1,0,1,0,0|1,0,1]=4 3919 B9R1.11 C[C@@H](CO)N1CCCC1 MCULE-3412759469 [0,1,0,1,0,0|2,0,0]=4 3920 B9R1.11 C[C@H](CO)N1CCCC1 MCULE-3282668740 [0,1,0,1,0,0|2,0,0]=4 3921 B9R1.11 NC(CO)C1CCCC1 MCULE-3542083676 [0,1,0,1,0,0|2,0,0]=4 3922 B9R1.11 NC(CO)C1CCCC1 MCULE-5931245443 [0,1,0,1,0,0|2,0,0]=4 3923 B9R1.11 NC(CO)C1CCCO1 MCULE-1115414738 [0,1,0,1,0,0|1,1,0]=4 3924 B9R1.11 NC(CO)C1CCOC1 MCULE-3949685203 [0,1,0,1,0,0|1,1,0]=4 3925 B9R1.11 NC(CO)C1CCOC1 MCULE-7535404270 [0,1,0,1,0,0|1,1,0]=4 3926 B9R1.11 NCC(O)C1CCOC1 MCULE-2353712692 [0,1,0,1,0,0|1,1,0]=4 3927 B9R1.11 NCC(O)C1CCOC1 MCULE-2647033518 [0,1,0,1,0,0|1,1,0]=4 3928 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-1672080667 [0,1,0,1,0,0|2,0,0]=4 3929 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-2468572391 [0,1,0,1,0,0|2,0,0]=4 3930 B9R1.11 N[C@H](CO)C1CCCC1 MCULE-9200212417 [0,1,0,1,0,0|2,0,0]=4 3931 B9R1.11 [C@H](C)(CC)C1=NCCS1 MCULE-2800029343 [0,1,0,1,0,0|1,0,1]=4 3932 B9R1.15 C#CC1CCCCC1C MCULE-6198776424 [0,1,0,1,0,0|2,0,0]=4 3933 B9R1.15 CC1CC=CCC1CO MCULE-7534551137 [0,1,0,1,0,0|1,0,1]=4 3934 B9R1.15 CC1CCCCC1C=O MCULE-5772126890 [0,1,0,1,0,0|1,1,0]=4 3935 B9R1.15 CC1CCCCC1CBr MCULE-8034060072 [0,1,0,1,0,0|2,0,0]=4 3936 B9R1.15 CC1CCCCC1CN MCULE-2749107040 [0,1,0,1,0,0|2,0,0]=4 3937 B9R1.15 CC1CCCCC1NN MCULE-1627711305 [0,1,0,1,0,0|2,0,0]=4 3938 B9R1.15 CC1CCCCC1NN MCULE-6482426688 [0,1,0,1,0,0|2,0,0]=4 3939 B9R1.15 CC1CCCCC1NN MCULE-6532690515 [0,1,0,1,0,0|2,0,0]=4 3940 B9R1.15 CC1CCCNC1CN MCULE-6481829543 [0,1,0,1,0,0|2,0,0]=4 3941 B9R1.15 CC1CCCNC1CO MCULE-4408087733 [0,1,0,1,0,0|1,0,0]=3 3942 B9R1.15 CC1CCNCC1CO MCULE-7653018616 [0,1,0,1,0,0|1,0,0]=3 3943 B9R1.15 CC1COCCC1C#N MCULE-9164226850 [0,1,0,1,0,0|1,0,0]=3 3944 B9R1.15 CC1COCCC1CN MCULE-3656342813 [0,1,0,1,0,0|1,0,0]=3 3945 B9R1.15 CC1NCCCC1CO MCULE-2033869519 [0,1,0,1,0,0|1,0,0]=3 3946 B9R1.15 CC1OCCNC1CO MCULE-1741355006 [0,1,0,1,0,0|2,0,0]=4 3947 B9R1.15 CC1OCCNC1CO MCULE-9766545086 [0,1,0,1,0,0|2,0,0]=4 3948 B9R1.15 CCC1CCCCC1Br MCULE-1178311442 [0,1,0,1,0,0|2,0,0]=4 3949 B9R1.15 CCC1CCCCC1C MCULE-1792942786 [0,1,0,1,0,0|2,0,0]=4 3950 B9R1.15 CCC1CCCCC1N MCULE-3637799906 [0,1,0,1,0,0|2,0,0]=4 3951 B9R1.15 CCC1CCCCC1O MCULE-7514335194 [0,1,0,1,0,0|1,1,0]=4 3952 B9R1.15 CCC1COCCC1=O MCULE-8876011937 [0,1,0,1,0,0|0,1,1]=4 3953 B9R1.15 CCC1COCCC1N MCULE-9616117607 [0,1,0,1,0,0|1,0,0]=3 3954 B9R1.15 CCC1COCCC1O MCULE-9521346817 [0,1,0,1,0,0|0,1,0]=3 3955 B9R1.15 CN1CCCCC1CO MCULE-6705032794 [0,1,0,1,0,0|2,0,0]=4 3956 B9R1.15 CN1CCCCC1CO MCULE-7433359891 [0,1,0,1,0,0|2,0,0]=4 3957 B9R1.15 CN1CCCC[C@@H]1CO MCULE-4169808027 [0,1,0,1,0,0|2,0,0]=4 3958 B9R1.15 CN1CCCC[C@@H]1CO MCULE-5806828736 [0,1,0,1,0,0|2,0,0]=4 3959 B9R1.15 CN1CCCC[C@H]1CO MCULE-5720351306 [0,1,0,1,0,0|2,0,0]=4 3960 B9R1.15 CN1CCCC[C@H]1CO MCULE-6512254506 [0,1,0,1,0,0|2,0,0]=4 3961 B9R1.15 CN1CCNCC1CO MCULE-7112745401 [0,1,0,1,0,0|2,0,0]=4 3962 B9R1.15 CN1CCNCC1CO MCULE-8816850395 [0,1,0,1,0,0|2,0,0]=4 3963 B9R1.15 CN1CCOCC1CN MCULE-2623897181 [0,1,0,1,0,0|2,0,0]=4 3964 B9R1.15 CN1CCOCC1CN MCULE-9594066530 [0,1,0,1,0,0|2,0,0]=4 3965 B9R1.15 CN1CCOCC1CO MCULE-2139047530 [0,1,0,1,0,0|2,0,0]=4 3966 B9R1.15 CN1CCOCC1CO MCULE-4226067396 [0,1,0,1,0,0|2,0,0]=4 3967 B9R1.15 CN1CCOCC1CO MCULE-9641882387 [0,1,0,1,0,0|2,0,0]=4 3968 B9R1.15 CN1CCOC[C@@H]1CN MCULE-1095994023 [0,1,0,1,0,0|2,0,0]=4 3969 B9R1.15 CN1CCOC[C@@H]1CN MCULE-1169616561 [0,1,0,1,0,0|2,0,0]=4 3970 B9R1.15 CN1CCOC[C@@H]1CN MCULE-5187873186 [0,1,0,1,0,0|2,0,0]=4 3971 B9R1.15 CN1CCOC[C@@H]1CN MCULE-7882001609 [0,1,0,1,0,0|2,0,0]=4 3972 B9R1.15 CN1CCOC[C@@H]1CO MCULE-6676365616 [0,1,0,1,0,0|2,0,0]=4 3973 B9R1.15 CN1CCOC[C@@H]1CO MCULE-7199870435 [0,1,0,1,0,0|2,0,0]=4 3974 B9R1.15 CN1CCOC[C@H]1CN MCULE-6452214978 [0,1,0,1,0,0|2,0,0]=4 3975 B9R1.15 CN1CCOC[C@H]1CN MCULE-9193603176 [0,1,0,1,0,0|2,0,0]=4 3976 B9R1.15 CN1CCOC[C@H]1CO MCULE-1567784253 [0,1,0,1,0,0|2,0,0]=4 3977 B9R1.15 CN1CCOC[C@H]1CO MCULE-4386696956 [0,1,0,1,0,0|2,0,0]=4 3978 B9R1.15 CN1CCOC[C@H]1CO MCULE-4994265717 [0,1,0,1,0,0|2,0,0]=4 3979 B9R1.15 CN1CCOC[C@H]1CO MCULE-9355808488 [0,1,0,1,0,0|2,0,0]=4 3980 B9R1.15 CNC1CCCCC1C MCULE-2012338656 [0,1,0,1,0,0|2,0,0]=4 3981 B9R1.15 CNC1CCCCC1C MCULE-4226953987 [0,1,0,1,0,0|2,0,0]=4 3982 B9R1.15 CNC1CCCCC1O MCULE-4436069957 [0,1,0,1,0,0|1,1,0]=4 3983 B9R1.15 CNC1CCCCC1O MCULE-5405173336 [0,1,0,1,0,0|1,1,0]=4 3984 B9R1.15 CN[C@@H]1CCCC[C@@H]1C MCULE-5411502617 [0,1,0,1,0,0|2,0,0]=4 3985 B9R1.15 CN[C@@H]1CCCC[C@@H]1O MCULE-1137921028 [0,1,0,1,0,0|1,1,0]=4 3986 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-3605342765 [0,1,0,1,0,0|1,1,0]=4 3987 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-5222257369 [0,1,0,1,0,0|1,1,0]=4 3988 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-5595138673 [0,1,0,1,0,0|1,1,0]=4 3989 B9R1.15 CN[C@@H]1CCCC[C@H]1O MCULE-8677073091 [0,1,0,1,0,0|1,1,0]=4 3990 B9R1.15 CN[C@H]1CCCC[C@@H]1O MCULE-1707284588 [0,1,0,1,0,0|1,1,0]=4 3991 B9R1.15 CN[C@H]1CCCC[C@@H]1O MCULE-2780832664 [0,1,0,1,0,0|1,1,0]=4 3992 B9R1.15 CN[C@H]1CCCC[C@@H]1O MCULE-5064297221 [0,1,0,1,0,0|1,1,0]=4 3993 B9R1.15 CN[C@H]1CCCC[C@H]1C MCULE-9095592965 [0,1,0,1,0,0|2,0,0]=4 3994 B9R1.15 CN[C@H]1CCCC[C@H]1O MCULE-1705616364 [0,1,0,1,0,0|1,1,0]=4 3995 B9R1.15 CN[C@H]1CCCC[C@H]1O MCULE-9104661315 [0,1,0,1,0,0|1,1,0]=4 3996 B9R1.15 COC1CCCCC1N MCULE-1737804569 [0,1,0,1,0,0|2,0,0]=4 3997 B9R1.15 COC1CCCCC1N MCULE-2194963487 [0,1,0,1,0,0|2,0,0]=4 3998 B9R1.15 COC1CCCCC1O MCULE-9502513295 [0,1,0,1,0,0|1,1,0]=4 3999 B9R1.15 COC1CCNCC1C MCULE-6572363150 [0,1,0,1,0,0|1,1,0]=4 4000 B9R1.15 COC1CCNCC1C MCULE-9231668375 [0,1,0,1,0,0|1,1,0]=4 4001 B9R1.15 COC1CCOCC1N MCULE-2339019157 [0,1,0,1,0,0|1,1,0]=4 4002 B9R1.15 COC1CCOCC1N MCULE-3754642498 [0,1,0,1,0,0|1,1,0]=4 4003 B9R1.15 COC1CNCCC1C MCULE-7419288321 [0,1,0,1,0,0|2,0,0]=4 4004 B9R1.15 COC1CNCCC1C MCULE-8027196152 [0,1,0,1,0,0|2,0,0]=4 4005 B9R1.15 COC1COCCC1=O MCULE-1867615078 [0,1,0,1,0,0|0,1,1]=4 4006 B9R1.15 COC1COCCC1N MCULE-2610127479 [0,1,0,1,0,0|1,0,0]=3 4007 B9R1.15 COC1COCCC1N MCULE-5980111106 [0,1,0,1,0,0|1,0,0]=3 4008 B9R1.15 COC1COCCC1O MCULE-4002896267 [0,1,0,1,0,0|0,1,0]=3 4009 B9R1.15 CO[C@@H]1CCCC[C@@H]1N MCULE-1989542198 [0,1,0,1,0,0|2,0,0]=4 4010 B9R1.15 CO[C@@H]1CCCC[C@@H]1N MCULE-6852448083 [0,1,0,1,0,0|2,0,0]=4 4011 B9R1.15 CO[C@@H]1CCCC[C@H]1Br MCULE-6359637259 [0,1,0,1,0,0|2,0,0]=4 4012 B9R1.15 CO[C@@H]1CCCC[C@H]1I MCULE-4229510302 [0,1,0,1,0,0|2,0,0]=4 4013 B9R1.15 CO[C@@H]1CCCC[C@H]1N MCULE-2893854338 [0,1,0,1,0,0|2,0,0]=4 4014 B9R1.15 CO[C@@H]1CCCC[C@H]1N MCULE-9329529471 [0,1,0,1,0,0|2,0,0]=4 4015 B9R1.15 CO[C@@H]1CCNC[C@@H]1C MCULE-6937999613 [0,1,0,1,0,0|1,1,0]=4 4016 B9R1.15 CO[C@@H]1CCNC[C@H]1C MCULE-3269567126 [0,1,0,1,0,0|1,1,0]=4 4017 B9R1.15 CO[C@@H]1CCOC[C@@H]1N MCULE-1952254967 [0,1,0,1,0,0|1,1,0]=4 4018 B9R1.15 CO[C@@H]1CCOC[C@@H]1N MCULE-6506526189 [0,1,0,1,0,0|1,1,0]=4 4019 B9R1.15 CO[C@@H]1CCOC[C@H]1N MCULE-4110998380 [0,1,0,1,0,0|1,1,0]=4 4020 B9R1.15 CO[C@@H]1CCOC[C@H]1N MCULE-4975019043 [0,1,0,1,0,0|1,1,0]=4 4021 B9R1.15 CO[C@@H]1CCOC[C@H]1N MCULE-7897581898 [0,1,0,1,0,0|1,1,0]=4 4022 B9R1.15 CO[C@@H]1CCOC[C@H]1N MCULE-9438744527 [0,1,0,1,0,0|1,1,0]=4 4023 B9R1.15 CO[C@@H]1CNCC[C@@H]1C MCULE-7888271922 [0,1,0,1,0,0|2,0,0]=4 4024 B9R1.15 CO[C@@H]1CNCC[C@@H]1C MCULE-9709371025 [0,1,0,1,0,0|2,0,0]=4 4025 B9R1.15 CO[C@@H]1CNCC[C@H]1C MCULE-2338099561 [0,1,0,1,0,0|2,0,0]=4 4026 B9R1.15 CO[C@@H]1CNCC[C@H]1C MCULE-5997296248 [0,1,0,1,0,0|2,0,0]=4 4027 B9R1.15 CO[C@@H]1CNCC[C@H]1F MCULE-8978919146 [0,1,0,1,0,0|2,0,0]=4 4028 B9R1.15 CO[C@@H]1COCCC1=O MCULE-1760263882 [0,1,0,1,0,0|0,1,1]=4 4029 B9R1.15 CO[C@@H]1COCC[C@@H]1N MCULE-1690232834 [0,1,0,1,0,0|1,0,0]=3 4030 B9R1.15 CO[C@@H]1COCC[C@@H]1N MCULE-3005233421 [0,1,0,1,0,0|1,0,0]=3 4031 B9R1.15 CO[C@@H]1COCC[C@@H]1N MCULE-3350884306 [0,1,0,1,0,0|1,0,0]=3 4032 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-5292719252 [0,1,0,1,0,0|1,0,0]=3 4033 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-5893587941 [0,1,0,1,0,0|1,0,0]=3 4034 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-6732618277 [0,1,0,1,0,0|1,0,0]=3 4035 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-7200503666 [0,1,0,1,0,0|1,0,0]=3 4036 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-7347456098 [0,1,0,1,0,0|1,0,0]=3 4037 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-7764251079 [0,1,0,1,0,0|1,0,0]=3 4038 B9R1.15 CO[C@@H]1COCC[C@H]1N MCULE-9959357254 [0,1,0,1,0,0|1,0,0]=3 4039 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-2586194317 [0,1,0,1,0,0|2,0,0]=4 4040 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-3721985129 [0,1,0,1,0,0|2,0,0]=4 4041 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-5933697798 [0,1,0,1,0,0|2,0,0]=4 4042 B9R1.15 CO[C@H]1CCCC[C@@H]1N MCULE-8173559541 [0,1,0,1,0,0|2,0,0]=4 4043 B9R1.15 CO[C@H]1CCCC[C@@H]1O MCULE-5178021878 [0,1,0,1,0,0|1,1,0]=4 4044 B9R1.15 CO[C@H]1CCCC[C@H]1N MCULE-1897256905 [0,1,0,1,0,0|2,0,0]=4 4045 B9R1.15 CO[C@H]1CCCC[C@H]1N MCULE-2520513048 [0,1,0,1,0,0|2,0,0]=4 4046 B9R1.15 CO[C@H]1CCNC[C@@H]1C MCULE-4739410328 [0,1,0,1,0,0|1,1,0]=4 4047 B9R1.15 CO[C@H]1CCNC[C@H]1C MCULE-7934229731 [0,1,0,1,0,0|1,1,0]=4 4048 B9R1.15 CO[C@H]1CCOC[C@@H]1N MCULE-2730884989 [0,1,0,1,0,0|1,1,0]=4 4049 B9R1.15 CO[C@H]1CCOC[C@@H]1N MCULE-4217006981 [0,1,0,1,0,0|1,1,0]=4 4050 B9R1.15 CO[C@H]1CCOC[C@H]1N MCULE-1293806136 [0,1,0,1,0,0|1,1,0]=4 4051 B9R1.15 CO[C@H]1CCOC[C@H]1N MCULE-5751918733 [0,1,0,1,0,0|1,1,0]=4 4052 B9R1.15 CO[C@H]1CCOC[C@H]1N MCULE-7877424101 [0,1,0,1,0,0|1,1,0]=4 4053 B9R1.15 CO[C@H]1CCOC[C@H]1N MCULE-9079567930 [0,1,0,1,0,0|1,1,0]=4 4054 B9R1.15 CO[C@H]1CNCC[C@@H]1C MCULE-2481587773 [0,1,0,1,0,0|2,0,0]=4 4055 B9R1.15 CO[C@H]1CNCC[C@@H]1C MCULE-8312413940 [0,1,0,1,0,0|2,0,0]=4 4056 B9R1.15 CO[C@H]1CNCC[C@@H]1F MCULE-2359199932 [0,1,0,1,0,0|2,0,0]=4 4057 B9R1.15 CO[C@H]1CNCC[C@H]1C MCULE-3369664933 [0,1,0,1,0,0|2,0,0]=4 4058 B9R1.15 CO[C@H]1CNCC[C@H]1C MCULE-6381125186 [0,1,0,1,0,0|2,0,0]=4 4059 B9R1.15 CO[C@H]1COCCC1=O MCULE-6122311097 [0,1,0,1,0,0|0,1,1]=4 4060 B9R1.15 CO[C@H]1COCC[C@@H]1N MCULE-2924350485 [0,1,0,1,0,0|1,0,0]=3 4061 B9R1.15 CO[C@H]1COCC[C@@H]1N MCULE-6248531340 [0,1,0,1,0,0|1,0,0]=3 4062 B9R1.15 CO[C@H]1COCC[C@@H]1N MCULE-9169417719 [0,1,0,1,0,0|1,0,0]=3 4063 B9R1.15 CO[C@H]1COCC[C@@H]1N MCULE-9444528578 [0,1,0,1,0,0|1,0,0]=3 4064 B9R1.15 CO[C@H]1COCC[C@H]1N MCULE-5932043600 [0,1,0,1,0,0|1,0,0]=3 4065 B9R1.15 CO[C@H]1COCC[C@H]1N MCULE-6623157502 [0,1,0,1,0,0|1,0,0]=3 4066 B9R1.15 CO[C@H]1COCC[C@H]1N MCULE-7220613082 [0,1,0,1,0,0|1,0,0]=3 4067 B9R1.15 CO[C@H]1COCC[C@H]1N MCULE-8475817626 [0,1,0,1,0,0|1,0,0]=3 4068 B9R1.15 CSC1CCCCC1O MCULE-1801870498 [0,1,0,1,0,0|1,1,0]=4 4069 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-2713680724 [0,1,0,1,0,0|2,0,0]=4 4070 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-4338380603 [0,1,0,1,0,0|2,0,0]=4 4071 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-7590170950 [0,1,0,1,0,0|2,0,0]=4 4072 B9R1.15 C[C@@H]1OCCN[C@H]1CO MCULE-8556273106 [0,1,0,1,0,0|2,0,0]=4 4073 B9R1.15 C[C@H]1CCCN[C@@H]1CO MCULE-1290896647 [0,1,0,1,0,0|1,0,0]=3 4074 B9R1.15 C[C@H]1CCCN[C@@H]1CO MCULE-3602411590 [0,1,0,1,0,0|1,0,0]=3 4075 B9R1.15 C[C@H]1NCCC[C@H]1CO MCULE-6295458608 [0,1,0,1,0,0|1,0,0]=3 4076 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-2162620553 [0,1,0,1,0,0|2,0,0]=4 4077 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-4393718690 [0,1,0,1,0,0|2,0,0]=4 4078 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-6427512664 [0,1,0,1,0,0|2,0,0]=4 4079 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-6736855904 [0,1,0,1,0,0|2,0,0]=4 4080 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-8696304905 [0,1,0,1,0,0|2,0,0]=4 4081 B9R1.15 C[C@H]1OCCN[C@@H]1CO MCULE-9103105556 [0,1,0,1,0,0|2,0,0]=4 4082 B9R1.15 NC1CC=CCC1CO MCULE-6021579782 [0,1,0,1,0,0|1,0,1]=4 4083 B9R1.15 NC1CC=CCC1CO MCULE-9027602175 [0,1,0,1,0,0|1,0,1]=4 4084 B9R1.15 NC1CCCCC1CO MCULE-5262753422 [0,1,0,1,0,0|1,0,0]=3 4085 B9R1.15 NC1CCCCC1CO MCULE-9191988425 [0,1,0,1,0,0|1,0,0]=3 4086 B9R1.15 NC1CCOCC1CO MCULE-7912086901 [0,1,0,1,0,0|1,0,0]=3 4087 B9R1.15 NC1COCCC1CO MCULE-3392980000 [0,1,0,1,0,0|1,0,0]=3 4088 B9R1.15 NC1COCCC1CO MCULE-8617350186 [0,1,0,1,0,0|1,0,0]=3 4089 B9R1.15 NCC1CCCCC1F MCULE-5222863833 [0,1,0,1,0,0|2,0,0]=4 4090 B9R1.15 NCC1CCCCC1F MCULE-5775855535 [0,1,0,1,0,0|2,0,0]=4 4091 B9R1.15 NCC1CCCCC1N MCULE-1706815858 [0,1,0,1,0,0|2,0,0]=4 4092 B9R1.15 NCC1CCCCC1N MCULE-4873726709 [0,1,0,1,0,0|2,0,0]=4 4093 B9R1.15 NCC1CCCCC1O MCULE-3106014100 [0,1,0,1,0,0|1,1,0]=4 4094 B9R1.15 NCC1CCNCC1O MCULE-3055394995 [0,1,0,1,0,0|1,1,0]=4 4095 B9R1.15 NCC1CCNCC1O MCULE-6224685083 [0,1,0,1,0,0|1,1,0]=4 4096 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-2628011610 [0,1,0,1,0,0|1,1,0]=4 4097 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-4130182685 [0,1,0,1,0,0|1,1,0]=4 4098 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-4171309495 [0,1,0,1,0,0|1,1,0]=4 4099 B9R1.15 NC[C@@H]1CCNC[C@@H]1O MCULE-9652322332 [0,1,0,1,0,0|1,1,0]=4 4100 B9R1.15 NC[C@@H]1CCNC[C@H]1O MCULE-2431660086 [0,1,0,1,0,0|1,1,0]=4 4101 B9R1.15 NC[C@@H]1CCNC[C@H]1O MCULE-5301710683 [0,1,0,1,0,0|1,1,0]=4 4102 B9R1.15 NC[C@H]1CCCC[C@@H]1O MCULE-1443897301 [0,1,0,1,0,0|1,1,0]=4 4103 B9R1.15 NC[C@H]1CCCC[C@@H]1O MCULE-4382665718 [0,1,0,1,0,0|1,1,0]=4 4104 B9R1.15 NC[C@H]1CCNC[C@@H]1O MCULE-7451941473 [0,1,0,1,0,0|1,1,0]=4 4105 B9R1.15 NC[C@H]1CCNC[C@@H]1O MCULE-8077996531 [0,1,0,1,0,0|1,1,0]=4 4106 B9R1.15 N[C@@H]1CCCC[C@@H]1CO MCULE-2333094825 [0,1,0,1,0,0|1,0,0]=3 4107 B9R1.15 N[C@@H]1CCCC[C@@H]1CO MCULE-6100111885 [0,1,0,1,0,0|1,0,0]=3 4108 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-2541489944 [0,1,0,1,0,0|1,0,0]=3 4109 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-4358798149 [0,1,0,1,0,0|1,0,0]=3 4110 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-6886498483 [0,1,0,1,0,0|1,0,0]=3 4111 B9R1.15 N[C@@H]1CCCC[C@H]1CO MCULE-9434700277 [0,1,0,1,0,0|1,0,0]=3 4112 B9R1.15 N[C@H]1CCCC[C@H]1CO MCULE-7191404876 [0,1,0,1,0,0|1,0,0]=3 4113 B9R1.15 N[C@H]1CCCC[C@H]1CO MCULE-8159159865 [0,1,0,1,0,0|1,0,0]=3 4114 B9R1.15 N[C@H]1COCC[C@H]1CO MCULE-5880045699 [0,1,0,1,0,0|1,0,0]=3 4115 B9R1.15 N[C@H]1COCC[C@H]1CO MCULE-8504787876 [0,1,0,1,0,0|1,0,0]=3 4116 B9R1.15 O=C1CCCCC1CO MCULE-1345678838 [0,1,0,1,0,0|0,1,1]=4 4117 B9R1.15 O=C1NCCCC1CO MCULE-3810407789 [0,1,0,1,0,0|0,1,1]=4 4118 B9R1.15 OC1CCCCC1CBr MCULE-3516289492 [0,1,0,1,0,0|1,1,0]=4 4119 B9R1.15 OCC1CCCCC1O MCULE-1945714569 [0,1,0,1,0,0|0,1,0]=3 4120 B9R1.15 OCC1CCNCC1F MCULE-2928396204 [0,1,0,1,0,0|1,0,0]=3 4121 B9R1.15 OCC1CCNCC1F MCULE-4498079199 [0,1,0,1,0,0|1,0,0]=3 4122 B9R1.15 OCC1CCNCC1O MCULE-7571515188 [0,1,0,1,0,0|0,1,0]=3 4123 B9R1.15 OCC1CCNCC1O MCULE-8029631005 [0,1,0,1,0,0|0,1,0]=3 4124 B9R1.15 OCC1CNCCC1O MCULE-1394638729 [0,1,0,1,0,0|0,1,0]=3 4125 B9R1.15 OCC1CNCCC1O MCULE-3316949664 [0,1,0,1,0,0|0,1,0]=3 4126 B9R1.15 OCC1NCCCC1O MCULE-4567185313 [0,1,0,1,0,0|0,1,0]=3 4127 B9R1.15 OCC1NCCCC1O MCULE-6603271501 [0,1,0,1,0,0|0,1,0]=3 4128 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-2280671949 [0,1,0,1,0,0|1,0,0]=3 4129 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-5182685629 [0,1,0,1,0,0|1,0,0]=3 4130 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-6426816664 [0,1,0,1,0,0|1,0,0]=3 4131 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-6911928107 [0,1,0,1,0,0|1,0,0]=3 4132 B9R1.15 OC[C@@H]1CCNC[C@@H]1F MCULE-7067705943 [0,1,0,1,0,0|1,0,0]=3 4133 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-3094062800 [0,1,0,1,0,0|0,1,0]=3 4134 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-6303448234 [0,1,0,1,0,0|0,1,0]=3 4135 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-6793824447 [0,1,0,1,0,0|0,1,0]=3 4136 B9R1.15 OC[C@@H]1CCNC[C@@H]1O MCULE-9672123449 [0,1,0,1,0,0|0,1,0]=3 4137 B9R1.15 OC[C@@H]1CCNC[C@H]1O MCULE-2277053036 [0,1,0,1,0,0|0,1,0]=3 4138 B9R1.15 OC[C@@H]1CCNC[C@H]1O MCULE-4840185571 [0,1,0,1,0,0|0,1,0]=3 4139 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-1589442124 [0,1,0,1,0,0|0,1,0]=3 4140 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-5378098662 [0,1,0,1,0,0|0,1,0]=3 4141 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-5907126780 [0,1,0,1,0,0|0,1,0]=3 4142 B9R1.15 OC[C@H]1CCNC[C@@H]1O MCULE-6675818472 [0,1,0,1,0,0|0,1,0]=3 4143 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-3084007189 [0,1,0,1,0,0|1,0,0]=3 4144 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-6039491253 [0,1,0,1,0,0|1,0,0]=3 4145 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-6077710469 [0,1,0,1,0,0|1,0,0]=3 4146 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-7212928624 [0,1,0,1,0,0|1,0,0]=3 4147 B9R1.15 OC[C@H]1CCNC[C@H]1F MCULE-8482961967 [0,1,0,1,0,0|1,0,0]=3 4148 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-1138683406 [0,1,0,1,0,0|0,1,0]=3 4149 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-2009456098 [0,1,0,1,0,0|0,1,0]=3 4150 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-6847756490 [0,1,0,1,0,0|0,1,0]=3 4151 B9R1.15 OC[C@H]1CCNC[C@H]1O MCULE-8689272206 [0,1,0,1,0,0|0,1,0]=3 4152 B9R1.15 OC[C@H]1CNCC[C@H]1O MCULE-1702794715 [0,1,0,1,0,0|0,1,0]=3 4153 B9R1.15 OC[C@H]1CNCC[C@H]1O MCULE-9636833446 [0,1,0,1,0,0|0,1,0]=3 4154 B9R1.15 [C@H]1(CNCC[C@H]1CN)O MCULE-2780379872 [0,1,0,1,0,0|1,1,0]=4 4155 B9R1.15 [C@H]1(CNCC[C@H]1CN)O MCULE-6533831464 [0,1,0,1,0,0|1,1,0]=4 4156 B9R1.15 [C@H]1(CNCC[C@H]1CO)O MCULE-6865852051 [0,1,0,1,0,0|0,1,0]=3 4157 B9R1.22 CC1CC(C(O1)C)CN MCULE-8332746873 [0,1,0,1,0,0|2,0,0]=4 4158 B9R1.22 CC1CN(CC1CN)C MCULE-9170479028 [0,1,0,1,0,0|2,0,0]=4 4159 B9R1.22 CN1CC(CC1CO)N MCULE-1845795343 [0,1,0,1,0,0|2,0,0]=4 4160 B9R1.22 CN1CC(CC1CO)O MCULE-2631177865 [0,1,0,1,0,0|2,0,0]=4 4161 B9R1.22 CN1CC(CC1CO)O MCULE-7941036683 [0,1,0,1,0,0|2,0,0]=4 4162 B9R1.22 CN1C[C@@H](C[C@H]1CO)F MCULE-3142904022 [0,1,0,1,0,0|2,0,0]=4 4163 B9R1.22 CN1C[C@@H](C[C@H]1CO)F MCULE-4168126464 [0,1,0,1,0,0|2,0,0]=4 4164 B9R1.22 CN1C[C@@H](C[C@H]1CO)N MCULE-6364925454 [0,1,0,1,0,0|2,0,0]=4 4165 B9R1.22 CN1C[C@@H](C[C@H]1CO)N MCULE-7340998334 [0,1,0,1,0,0|2,0,0]=4 4166 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-6835957451 [0,1,0,1,0,0|2,0,0]=4 4167 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-6937864936 [0,1,0,1,0,0|2,0,0]=4 4168 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-7885385401 [0,1,0,1,0,0|2,0,0]=4 4169 B9R1.22 CN1C[C@@H](C[C@H]1CO)O MCULE-9581024864 [0,1,0,1,0,0|2,0,0]=4 4170 B9R1.22 CN1C[C@H](C[C@H]1CO)F MCULE-4625607347 [0,1,0,1,0,0|2,0,0]=4 4171 B9R1.22 CN1C[C@H](C[C@H]1CO)F MCULE-8259673538 [0,1,0,1,0,0|2,0,0]=4 4172 B9R1.22 CN1C[C@H](C[C@H]1CO)N MCULE-1031920182 [0,1,0,1,0,0|2,0,0]=4 4173 B9R1.22 CN1C[C@H](C[C@H]1CO)N MCULE-5184140250 [0,1,0,1,0,0|2,0,0]=4 4174 B9R1.22 CN1C[C@H](C[C@H]1CO)O MCULE-6254507858 [0,1,0,1,0,0|2,0,0]=4 4175 B9R1.22 NC1CC(C(C1)CO)O MCULE-6483016480 [0,1,0,1,0,0|0,1,0]=3 4176 B9R1.22 NC1CC(C(C1)CO)O MCULE-7351789396 [0,1,0,1,0,0|0,1,0]=3 4177 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-1625502283 [0,1,0,1,0,0|0,1,0]=3 4178 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-2916623249 [0,1,0,1,0,0|0,1,0]=3 4179 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-3265275024 [0,1,0,1,0,0|0,1,0]=3 4180 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-5953198671 [0,1,0,1,0,0|0,1,0]=3 4181 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-6935436356 [0,1,0,1,0,0|0,1,0]=3 4182 B9R1.22 N[C@H]1C[C@@H]([C@@H](C1)CO)O MCULE-8122722811 [0,1,0,1,0,0|0,1,0]=3 4183 B9R1.22 OCC1OC(CC1O)O MCULE-1321369472 [0,1,0,1,0,0|1,1,0]=4 4184 B9R1.22 OC[C@@H]1OC(C[C@H]1O)O MCULE-2396008864 [0,1,0,1,0,0|1,1,0]=4 4185 B9R1.22 OC[C@@H]1OC(C[C@H]1O)O MCULE-3186725991 [0,1,0,1,0,0|1,1,0]=4 4186 B9R1.22 OC[C@@H]1OC(C[C@H]1O)O MCULE-8127322430 [0,1,0,1,0,0|1,1,0]=4 4187 B9R1.22 OC[C@H]1OC(C[C@@H]1O)O MCULE-5678157789 [0,1,0,1,0,0|1,1,0]=4 4188 B9R1.33 C=CCC1CCCC1N MCULE-2299466622 [0,1,0,1,0,0|2,0,0]=4 4189 B9R1.33 CC1CCCC1CCO MCULE-1752596263 [0,1,0,1,0,0|1,0,0]=3 4190 B9R1.33 CCNC1COCC1O MCULE-7678905536 [0,1,0,1,0,0|2,0,0]=4 4191 B9R1.33 CCN[C@H]1COC[C@@H]1O MCULE-1056741017 [0,1,0,1,0,0|2,0,0]=4 4192 B9R1.33 CCN[C@H]1COC[C@@H]1O MCULE-9348333209 [0,1,0,1,0,0|2,0,0]=4 4193 B9R1.33 CCOC1CCCC1N MCULE-1724274632 [0,1,0,1,0,0|2,0,0]=4 4194 B9R1.33 CCOC1COCC1N MCULE-2162651380 [0,1,0,1,0,0|2,0,0]=4 4195 B9R1.33 CCOC1COCC1N MCULE-9082503329 [0,1,0,1,0,0|2,0,0]=4 4196 B9R1.33 CCO[C@@H]1COC[C@H]1N MCULE-1741753592 [0,1,0,1,0,0|2,0,0]=4 4197 B9R1.33 CCO[C@@H]1COC[C@H]1N MCULE-6669405898 [0,1,0,1,0,0|2,0,0]=4 4198 B9R1.33 CCO[C@H]1COC[C@@H]1N MCULE-2150046389 [0,1,0,1,0,0|2,0,0]=4 4199 B9R1.33 CCO[C@H]1COC[C@@H]1N MCULE-4858617743 [0,1,0,1,0,0|2,0,0]=4 4200 B9R1.33 CCO[C@H]1COC[C@@H]1N MCULE-8083115654 [0,1,0,1,0,0|2,0,0]=4 4201 B9R1.33 CCO[C@H]1COC[C@@H]1N MCULE-8977340327 [0,1,0,1,0,0|2,0,0]=4 4202 B9R1.33 CCSC1CCCC1N MCULE-9127222601 [0,1,0,1,0,0|2,0,0]=4 4203 B9R1.33 CN1CCCC1CCO MCULE-3612604787 [0,1,0,1,0,0|2,0,0]=4 4204 B9R1.33 CN1CCC[C@@H]1CCO MCULE-4024477366 [0,1,0,1,0,0|2,0,0]=4 4205 B9R1.33 CN1CCC[C@@H]1CCO MCULE-6759736828 [0,1,0,1,0,0|2,0,0]=4 4206 B9R1.33 CN1CCC[C@H]1CCO MCULE-6063605807 [0,1,0,1,0,0|2,0,0]=4 4207 B9R1.33 CN1CCC[C@H]1CCO MCULE-8959854431 [0,1,0,1,0,0|2,0,0]=4 4208 B9R1.33 CNCC1CCCC1O MCULE-1707127587 [0,1,0,1,0,0|1,1,0]=4 4209 B9R1.33 COCC1CCCC1=O MCULE-9169493233 [0,1,0,1,0,0|0,1,1]=4 4210 B9R1.33 COCC1CCCC1N MCULE-2339282845 [0,1,0,1,0,0|1,0,0]=3 4211 B9R1.33 COCC1CCCN1N MCULE-6988443424 [0,1,0,1,0,0|2,0,0]=4 4212 B9R1.33 COCC1CNCC1C MCULE-2188367533 [0,1,0,1,0,0|2,0,0]=4 4213 B9R1.33 COCC1CNCC1C MCULE-6945846357 [0,1,0,1,0,0|2,0,0]=4 4214 B9R1.33 COC[C@@H]1CCCN1N MCULE-3051184560 [0,1,0,1,0,0|2,0,0]=4 4215 B9R1.33 COC[C@@H]1CCCN1N MCULE-8980221130 [0,1,0,1,0,0|2,0,0]=4 4216 B9R1.33 COC[C@@H]1CCC[C@@H]1N MCULE-2489009816 [0,1,0,1,0,0|1,0,0]=3 4217 B9R1.33 COC[C@@H]1CCC[C@@H]1N MCULE-5278260852 [0,1,0,1,0,0|1,0,0]=3 4218 B9R1.33 COC[C@H]1CCCN1N MCULE-2874814564 [0,1,0,1,0,0|2,0,0]=4 4219 B9R1.33 COC[C@H]1CCCN1N MCULE-4674244085 [0,1,0,1,0,0|2,0,0]=4 4220 B9R1.33 COC[C@H]1CCCN1N MCULE-5407605601 [0,1,0,1,0,0|2,0,0]=4 4221 B9R1.33 COC[C@H]1CCCN1N MCULE-7726859230 [0,1,0,1,0,0|2,0,0]=4 4222 B9R1.33 COC[C@H]1CCC[C@H]1N MCULE-1111361143 [0,1,0,1,0,0|1,0,0]=3 4223 B9R1.33 COC[C@H]1CCC[C@H]1N MCULE-2193207837 [0,1,0,1,0,0|1,0,0]=3 4224 B9R1.33 NC1CCCC1CCO MCULE-4115683269 [0,1,0,1,0,0|1,0,0]=3 4225 B9R1.33 OCCC1CCCC1O MCULE-2038693822 [0,1,0,1,0,0|0,1,0]=3 4226 B9R1.73 CCCC(N)C1CCC1 MCULE-2304710158 [0,1,0,1,0,0|2,0,0]=4 4227 B9R1.73 CCOC(=O)C1COC1 MCULE-6651672783 [0,1,0,1,0,0|0,1,1]=4 4228 B9R1.73 CN(CCN)C1COC1 MCULE-7340786047 [0,1,0,1,0,0|2,0,0]=4 4229 B9R1.73 NC(CCO)C1CCC1 MCULE-1474058368 [0,1,0,1,0,0|2,0,0]=4 4230 B9R1.73 NC(CCO)C1CCC1 MCULE-1872378337 [0,1,0,1,0,0|2,0,0]=4 4231 B9R1.73 NCCC(O)C1CCC1 MCULE-6094534332 [0,1,0,1,0,0|1,1,0]=4 4232 B9R1.74 CCOC(=O)C1(CO1)C MCULE-8409787595 [0,1,0,1,0,0|0,1,1]=4 4233 B9R1.74 COCC(N)C1(CC1)C MCULE-5939097981 [0,1,0,1,0,0|2,0,0]=4 4234 B9R1.74 COCC(O)C1(CC1)N MCULE-8418151970 [0,1,0,1,0,0|2,0,0]=4 4235 B9R1.82 CCN(C)C1CC(C1)O MCULE-4103324110 [0,1,0,1,0,0|2,0,0]=4 4236 B9R1.82 CCN(C)C1CC(C1)O MCULE-4168224875 [0,1,0,1,0,0|2,0,0]=4 4237 B9R1.202 CC1(CCNC1=O)CO MCULE-3034841692 [0,1,0,1,0,0|0,1,1]=4 4238 B9R1.202 CC1CCCC1(C)CN MCULE-5501074724 [0,1,0,1,0,0|2,0,0]=4 4239 B9R1.202 CC1CCCC1(O)CN MCULE-5192081064 [0,1,0,1,0,0|2,0,0]=4 4240 B9R1.202 CC1CNCC1(C)CO MCULE-3212764422 [0,1,0,1,0,0|1,0,0]=3 4241 B9R1.202 CC1CNCC1(C)CO MCULE-9218006550 [0,1,0,1,0,0|1,0,0]=3 4242 B9R1.24 CC1(CCCC1CN)C MCULE-2825475131 [0,1,0,1,0,0|2,0,0]=4 4243 B9R1.24 CC1(CCCC1CO)C MCULE-4941414251 [0,1,0,1,0,0|1,0,0]=3 4244 B9R1.24 CC1(CCCC1CO)N MCULE-2343642043 [0,1,0,1,0,0|1,0,0]=3 4245 B9R1.24 CC1(CCCC1CO)N MCULE-9579192803 [0,1,0,1,0,0|1,0,0]=3 4246 B9R1.24 CC1(CNCC1CO)C MCULE-1867559828 [0,1,0,1,0,0|2,0,0]=4 4247 B9R1.24 CC1(NCCC1CO)C MCULE-4504449817 [0,1,0,1,0,0|2,0,0]=4 4248 B9R1.24 CC1(OCCC1CO)C MCULE-6604005971 [0,1,0,1,0,0|2,0,0]=4 4249 B9R1.24 CC1(SCCC1CO)C MCULE-5045966886 [0,1,0,1,0,0|2,0,0]=4 4250 B9R1.24 C[N+]1(CCCC1CO)C MCULE-4698183859 [0,1,0,1,0,0|2,0,0]=4 4251 B9R1.24 NCC1CCCC1(F)F MCULE-5921834572 [0,1,0,1,0,0|2,0,0]=4 4252 B9R1.24 NCC1CCCC1(F)F MCULE-7486005682 [0,1,0,1,0,0|2,0,0]=4 4253 B9R1.24 O=S1(=O)CCCC1CO MCULE-2122998276 [0,1,0,1,0,0|1,1,0]=4 4254 B9R1.24 OCC1CCCC1(F)F MCULE-7160393856 [0,1,0,1,0,0|1,0,0]=3 4255 B9R1.24 OCC1CNCC1(F)F MCULE-3238161550 [0,1,0,1,0,0|2,0,0]=4 4256 B9R1.24 OCC1CNCC1(F)F MCULE-7293698860 [0,1,0,1,0,0|2,0,0]=4 4257 B9R1.24 OCC1NCCC1(F)F MCULE-2512971507 [0,1,0,1,0,0|2,0,0]=4 4258 B9R1.24 OCC1NCCC1(F)F MCULE-8015196659 [0,1,0,1,0,0|2,0,0]=4 4259 B9R1.40 CC1(CCCCC1N)C MCULE-5951764286 [0,1,0,1,0,0|2,0,0]=4 4260 B9R1.40 CC1(CCCCC1N)O MCULE-5300265774 [0,1,0,1,0,0|2,0,0]=4 4261 B9R1.40 CC1(CCCCC1O)C MCULE-1365001070 [0,1,0,1,0,0|1,1,0]=4 4262 B9R1.40 CC1(CCOCC1O)O MCULE-9069325911 [0,1,0,1,0,0|1,1,0]=4 4263 B9R1.40 CC1(CNCCC1O)C MCULE-2471331536 [0,1,0,1,0,0|1,1,0]=4 4264 B9R1.40 CC1(CNCCC1O)F MCULE-2463645268 [0,1,0,1,0,0|1,1,0]=4 4265 B9R1.40 CC1(CNCCC1O)F MCULE-5270582869 [0,1,0,1,0,0|1,1,0]=4 4266 B9R1.40 CC1(CNCC[C@@H]1O)C MCULE-4112498170 [0,1,0,1,0,0|1,1,0]=4 4267 B9R1.40 CC1(COCCC1=O)C MCULE-2901452802 [0,1,0,1,0,0|0,1,1]=4 4268 B9R1.40 CC1(COCCC1N)C MCULE-1030253270 [0,1,0,1,0,0|1,0,0]=3 4269 B9R1.40 CC1(COCCC1N)C MCULE-2743564615 [0,1,0,1,0,0|1,0,0]=3 4270 B9R1.40 CC1(COCCC1O)C MCULE-5191216126 [0,1,0,1,0,0|0,1,0]=3 4271 B9R1.40 CC1CCCCC1(C)N MCULE-4488389841 [0,1,0,1,0,0|2,0,0]=4 4272 B9R1.40 CC1CCCCC1(F)F MCULE-7532748980 [0,1,0,1,0,0|2,0,0]=4 4273 B9R1.40 CC1CCNCC1(C)C MCULE-9805063465 [0,1,0,1,0,0|2,0,0]=4 4274 B9R1.40 CC1CCNCC1(C)O MCULE-6091048331 [0,1,0,1,0,0|2,0,0]=4 4275 B9R1.40 CC1CCNCC1(C)O MCULE-7827878467 [0,1,0,1,0,0|2,0,0]=4 4276 B9R1.40 CC1CNCCC1(C)O MCULE-3050558506 [0,1,0,1,0,0|1,1,0]=4 4277 B9R1.40 CC1CNCCC1(C)O MCULE-7122670765 [0,1,0,1,0,0|1,1,0]=4 4278 B9R1.40 CC1CNCCC1(F)F MCULE-2637468914 [0,1,0,1,0,0|2,0,0]=4 4279 B9R1.40 CC1CNCCC1(F)F MCULE-8183993795 [0,1,0,1,0,0|2,0,0]=4 4280 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O MCULE-2566777989 [0,1,0,1,0,0|2,0,0]=4 4281 B9R1.40 C[C@@H]1CCNC[C@@]1(C)O MCULE-7280139378 [0,1,0,1,0,0|2,0,0]=4 4282 B9R1.40 C[C@@H]1CCNC[C@]1(C)O MCULE-1559795322 [0,1,0,1,0,0|2,0,0]=4 4283 B9R1.40 C[C@@H]1CCNC[C@]1(C)O MCULE-6569914928 [0,1,0,1,0,0|2,0,0]=4 4284 B9R1.40 C[C@@H]1CNCCC1(F)F MCULE-1207432722 [0,1,0,1,0,0|2,0,0]=4 4285 B9R1.40 C[C@@H]1CNCCC1(F)F MCULE-3275792230 [0,1,0,1,0,0|2,0,0]=4 4286 B9R1.40 C[C@@]1(CCOC[C@H]1O)O MCULE-3803598208 [0,1,0,1,0,0|1,1,0]=4 4287 B9R1.40 C[C@H]1CCNC[C@@]1(C)O MCULE-1130241051 [0,1,0,1,0,0|2,0,0]=4 4288 B9R1.40 C[C@H]1CCNC[C@@]1(C)O MCULE-3222740777 [0,1,0,1,0,0|2,0,0]=4 4289 B9R1.40 C[C@H]1CCNC[C@]1(C)O MCULE-1911925525 [0,1,0,1,0,0|2,0,0]=4 4290 B9R1.40 C[C@H]1CCNC[C@]1(C)O MCULE-9810022632 [0,1,0,1,0,0|2,0,0]=4 4291 B9R1.40 NC1CCOCC1(F)F MCULE-1247820479 [0,1,0,1,0,0|2,0,0]=4 4292 B9R1.40 NC1CCOCC1(F)F MCULE-3193127277 [0,1,0,1,0,0|2,0,0]=4 4293 B9R1.40 NC1COCCC1(F)F MCULE-6728037062 [0,1,0,1,0,0|2,0,0]=4 4294 B9R1.40 NC1COCCC1(F)F MCULE-9221551015 [0,1,0,1,0,0|2,0,0]=4 4295 B9R1.40 N[C@@H]1CCOCC1(F)F MCULE-9820493641 [0,1,0,1,0,0|2,0,0]=4 4296 B9R1.40 N[C@H]1CCOCC1(F)F MCULE-4946845169 [0,1,0,1,0,0|2,0,0]=4 4297 B9R1.40 OC1(CCOCC1F)O MCULE-5129581737 [0,1,0,1,0,0|1,1,0]=4 4298 B9R1.40 OC1(CCOC[C@@H]1F)O MCULE-4768109328 [0,1,0,1,0,0|1,1,0]=4 4299 B9R1.62 CC(C)(CN)C1CCC1 MCULE-8259290025 [0,1,0,1,0,0|2,0,0]=4 4300 B9R1.62 CC(C)(CN)C1CCC1 MCULE-9714003350 [0,1,0,1,0,0|2,0,0]=4 4301 B9R1.62 CC(C)(CO)C1CCC1 MCULE-4617502237 [0,1,0,1,0,0|1,0,0]=3 4302 B9R1.106 CC1(C(=O)CCC1O)C MCULE-3636393805 [0,1,0,1,0,0|0,1,1]=4 4303 B9R1.107 CO[C@@H]1C[C@@H](C1(C)C)O MCULE-7055913941 [0,1,0,1,0,0|2,0,0]=4 4304 B9R1.14 CCC1CCCC1CN MCULE-1703862248 [0,1,0,1,0,0|2,0,0]=4 4305 B9R1.14 CCC1CNCC1CC MCULE-7269079242 [0,1,0,1,0,0|2,0,0]=4 4306 B9R1.14 CCC1CNCC1CO MCULE-2035722014 [0,1,0,1,0,0|1,0,0]=3 4307 B9R1.14 CCC1NCCC1CO MCULE-7281322099 [0,1,0,1,0,0|1,0,0]=3 4308 B9R1.14 CCN1CCCC1CO MCULE-6449869915 [0,1,0,1,0,0|2,0,0]=4 4309 B9R1.14 CCN1CCC[C@@H]1CO MCULE-3480163864 [0,1,0,1,0,0|2,0,0]=4 4310 B9R1.14 CCN1CCC[C@H]1CO MCULE-1120119069 [0,1,0,1,0,0|2,0,0]=4 4311 B9R1.14 CCN1CCC[C@H]1CO MCULE-6346417572 [0,1,0,1,0,0|2,0,0]=4 4312 B9R1.14 CC[C@H]1CNC[C@@H]1CO MCULE-1076286750 [0,1,0,1,0,0|1,0,0]=3 4313 B9R1.14 CC[C@H]1CNC[C@@H]1CO MCULE-9319128709 [0,1,0,1,0,0|1,0,0]=3 4314 B9R1.14 CNC1CCCC1SC MCULE-6806973828 [0,1,0,1,0,0|2,0,0]=4 4315 B9R1.14 COC1CCCC1CN MCULE-9251673750 [0,1,0,1,0,0|1,1,0]=4 4316 B9R1.14 O=CN1CCC[C@H]1CO MCULE-9305304920 [0,1,0,1,0,0|1,1,0]=4 4317 B9R1.14 OCC1CNCC1CO MCULE-3216303466 [0,1,0,1,0,0|1,1,0]=4 4318 B9R1.14 OCC1CNCC1CO MCULE-8556792970 [0,1,0,1,0,0|1,1,0]=4 4319 B9R1.14 OC[C@@H]1CNC[C@@H]1CO MCULE-5441133280 [0,1,0,1,0,0|1,1,0]=4 4320 B9R1.14 OC[C@@H]1CNC[C@@H]1CO MCULE-8785740812 [0,1,0,1,0,0|1,1,0]=4 4321 B9R1.14 OC[C@@H]1CNC[C@H]1CO MCULE-1923940000 [0,1,0,1,0,0|1,1,0]=4 4322 B9R1.14 OC[C@@H]1CNC[C@H]1CO MCULE-8086146822 [0,1,0,1,0,0|1,1,0]=4 4323 B9R1.14 OC[C@H]1CNC[C@@H]1CO MCULE-3807624796 [0,1,0,1,0,0|1,1,0]=4 4324 B9R1.14 OC[C@H]1CNC[C@@H]1CO MCULE-7784303809 [0,1,0,1,0,0|1,1,0]=4 4325 B9R1.27 CCC1C(=O)NCC1C MCULE-6984020668 [0,1,0,1,0,0|1,1,0]=4 4326 B9R1.70 COC(CBr)C1CCC1 MCULE-6497400619 [0,1,0,1,0,0|2,0,0]=4 4327 B9R1.70 COC(CN)C1CCC1 MCULE-8917947705 [0,1,0,1,0,0|2,0,0]=4 4328 B9R1.70 COC(CO)C1CCC1 MCULE-6598157025 [0,1,0,1,0,0|1,0,0]=3 4329 B9R1.70 NCC(CO)C1CCC1 MCULE-5699600966 [0,1,0,1,0,0|1,0,0]=3 4330 B9R1.70 OCC(CO)C1CCC1 MCULE-1317295718 [0,1,0,1,0,0|1,0,0]=3 4331 B9R1.94 CCC1(CC1CN)CC MCULE-3601766058 [0,1,0,1,0,0|2,0,0]=4 4332 B9R1.94 CCC1(CC1CN)CC MCULE-6642311787 [0,1,0,1,0,0|2,0,0]=4 4333 B9R1.120 CC1CCC1(CO)CO MCULE-7776828217 [0,1,0,1,0,0|1,0,0]=3 4334 B9R2.6 CC12CCCCC1O2 MCULE-1483489668 [0,0,0,2,0,0|1,1,0]=4 4335 B9R2.6 CC12CCNCC1C2 MCULE-3852242839 [0,0,0,2,0,0|2,0,0]=4 4336 B9R2.6 CC12CCNCC1C2 MCULE-7139431712 [0,0,0,2,0,0|2,0,0]=4 4337 B9R2.6 NC12CCCCC1C2 MCULE-3557350963 [0,0,0,2,0,0|2,0,0]=4 4338 B9R2.6 NC12CCCCC1C2 MCULE-6590814117 [0,0,0,2,0,0|2,0,0]=4 4339 B9R2.6 OC12CCNCC1C2 MCULE-1458272289 [0,0,0,2,0,0|1,1,0]=4 4340 B9R2.6 OC12CCNCC1C2 MCULE-1870414348 [0,0,0,2,0,0|1,1,0]=4 4341 B9R2.39 BrC1CC2CCC1C2 MCULE-2525306417 [0,0,0,2,0,0|2,0,0]=4 4342 B9R2.39 BrC1C[C@H]2CC[C@@H]1C2 MCULE-5339713795 [0,0,0,2,0,0|2,0,0]=4 4343 B9R2.39 ClC1CC2CCC1C2 MCULE-2627012901 [0,0,0,2,0,0|2,0,0]=4 4344 B9R2.39 FC1CC2CC1CN2 MCULE-1663966389 [0,0,0,2,0,0|2,0,0]=4 4345 B9R2.39 FC1CC2CC1CN2 MCULE-5419735508 [0,0,0,2,0,0|2,0,0]=4 4346 B9R2.39 NC1CC2CCC1C2 MCULE-1646830516 [0,0,0,2,0,0|2,0,0]=4 4347 B9R2.39 NC1CC2CCC1C2 MCULE-4489292957 [0,0,0,2,0,0|2,0,0]=4 4348 B9R2.39 NC1C[C@@H]2CC[C@H]1C2 MCULE-4406518687 [0,0,0,2,0,0|2,0,0]=4 4349 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-1907155621 [0,0,0,2,0,0|2,0,0]=4 4350 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-3506388726 [0,0,0,2,0,0|2,0,0]=4 4351 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-3640859726 [0,0,0,2,0,0|2,0,0]=4 4352 B9R2.39 N[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-4236102525 [0,0,0,2,0,0|2,0,0]=4 4353 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-3600979102 [0,0,0,2,0,0|2,0,0]=4 4354 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-4880538936 [0,0,0,2,0,0|2,0,0]=4 4355 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-5004847824 [0,0,0,2,0,0|2,0,0]=4 4356 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-5227933535 [0,0,0,2,0,0|2,0,0]=4 4357 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-5286948756 [0,0,0,2,0,0|2,0,0]=4 4358 B9R2.39 N[C@H]1C[C@@H]2CC[C@H]1C2 MCULE-7553153313 [0,0,0,2,0,0|2,0,0]=4 4359 B9R2.39 OC1CC2CC1CN2 MCULE-1326051035 [0,0,0,2,0,0|1,1,0]=4 4360 B9R2.39 OC1CC2CC1CN2 MCULE-9945384104 [0,0,0,2,0,0|1,1,0]=4 4361 B9R2.39 OC1CC2CCC1C2 MCULE-6414891759 [0,0,0,2,0,0|1,1,0]=4 4362 B9R2.39 OC1C[C@@H]2CC[C@H]1C2 MCULE-9639323400 [0,0,0,2,0,0|1,1,0]=4 4363 B9R2.39 O[C@@H]1C[C@@H]2CC[C@H]1C2 MCULE-4979276205 [0,0,0,2,0,0|1,1,0]=4 4364 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CN2 MCULE-6890871381 [0,0,0,2,0,0|1,1,0]=4 4365 B9R2.39 O[C@@H]1C[C@@H]2C[C@H]1CN2 MCULE-9981789594 [0,0,0,2,0,0|1,1,0]=4 4366 B9R2.39 O[C@@H]1C[C@H]2CC[C@@H]1C2 MCULE-6071426979 [0,0,0,2,0,0|1,1,0]=4 4367 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CN2 MCULE-2620883448 [0,0,0,2,0,0|1,1,0]=4 4368 B9R2.39 O[C@H]1C[C@@H]2C[C@H]1CN2 MCULE-8888575594 [0,0,0,2,0,0|1,1,0]=4 4369 B9R2.39 [C@@H]1(C[C@@H]2CC[C@H]1C2)O MCULE-6218681459 [0,0,0,2,0,0|1,1,0]=4 4370 B9R2.39 [C@@H]12CN[C@H](C1)C[C@@H]2F MCULE-2399716018 [0,0,0,2,0,0|2,0,0]=4 4371 B9R2.39 [C@@H]12CN[C@H](C1)C[C@@H]2F MCULE-2742153627 [0,0,0,2,0,0|2,0,0]=4 4372 B9R2.39 [C@@H]12CN[C@H](C1)C[C@H]2F MCULE-8659848505 [0,0,0,2,0,0|2,0,0]=4 4373 B9R2.39 [C@@H]12CN[C@H](C1)C[C@H]2F MCULE-8736875169 [0,0,0,2,0,0|2,0,0]=4 4374 B9R2.39 [C@H]12CC[C@H](C1)CC2N MCULE-3255653886 [0,0,0,2,0,0|2,0,0]=4 4375 B9R2.39 [C@H]12CC[C@H](C1)CC2O MCULE-7175651186 [0,0,0,2,0,0|1,1,0]=4 4376 B9R2.39 [C@H]12CC[C@H](C1)C[C@@H]2Br MCULE-5055207580 [0,0,0,2,0,0|2,0,0]=4 4377 B9R2.39 [C@H]12CC[C@H](C1)C[C@@H]2Br MCULE-6523129084 [0,0,0,2,0,0|2,0,0]=4 4378 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-6992871131 [0,0,0,2,0,0|2,0,0]=4 4379 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-7207127845 [0,0,0,2,0,0|2,0,0]=4 4380 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-7451668129 [0,0,0,2,0,0|2,0,0]=4 4381 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)N MCULE-9963967295 [0,0,0,2,0,0|2,0,0]=4 4382 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-4118507960 [0,0,0,2,0,0|1,1,0]=4 4383 B9R2.39 [C@H]12CC[C@H](C1)[C@@H](C2)O MCULE-9141970579 [0,0,0,2,0,0|1,1,0]=4 4384 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)N MCULE-9389098423 [0,0,0,2,0,0|2,0,0]=4 4385 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)N MCULE-9481703506 [0,0,0,2,0,0|2,0,0]=4 4386 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-4746309717 [0,0,0,2,0,0|1,1,0]=4 4387 B9R2.39 [C@H]12CC[C@H](C1)[C@H](C2)O MCULE-5454625797 [0,0,0,2,0,0|1,1,0]=4 4388 B9R2.50 C1CCC2NCC2C1 MCULE-8742032434 [0,0,0,2,0,0|2,0,0]=4 4389 B9R2.50 C1CC[C@H]2NC[C@H]2C1 MCULE-6463847774 [0,0,0,2,0,0|2,0,0]=4 4390 B9R2.53 OC1C2CNCC1C2 MCULE-3720434836 [0,0,0,2,0,0|1,1,0]=4 4391 B9R2.53 OC1C2CNCC1C2 MCULE-9173593961 [0,0,0,2,0,0|1,1,0]=4 4392 B9R2.53 O[C@@H]1[C@@H]2CNC[C@H]1C2 MCULE-4636094600 [0,0,0,2,0,0|1,1,0]=4 4393 B9R2.53 O[C@@H]1[C@@H]2CNC[C@H]1C2 MCULE-5175095450 [0,0,0,2,0,0|1,1,0]=4 4394 B9R2.109 NC1CCCC2C1C2 MCULE-4068109415 [0,0,0,2,0,0|2,0,0]=4 4395 B9R2.109 NC1CCCC2C1C2 MCULE-5773759079 [0,0,0,2,0,0|2,0,0]=4 4396 B9R2.3 C1CC2CCNC2C1 MCULE-5515150209 [0,0,0,2,0,0|2,0,0]=4 4397 B9R2.3 C1CC2CCNC2C1 MCULE-5871309108 [0,0,0,2,0,0|2,0,0]=4 4398 B9R2.3 C1CC2CNCC2C1 MCULE-3990530688 [0,0,0,2,0,0|2,0,0]=4 4399 B9R2.3 C1CC2CNCC2C1 MCULE-7336505089 [0,0,0,2,0,0|2,0,0]=4 4400 B9R2.3 C1CC2COCC2N1 MCULE-6156066041 [0,0,0,2,0,0|2,0,0]=4 4401 B9R2.3 C1C[C@@H]2CNC[C@@H]2C1 MCULE-1442161488 [0,0,0,2,0,0|2,0,0]=4 4402 B9R2.3 C1C[C@@H]2CNC[C@@H]2C1 MCULE-8304704842 [0,0,0,2,0,0|2,0,0]=4 4403 B9R2.3 C1C[C@H]2CNC[C@@H]2C1 MCULE-3619853039 [0,0,0,2,0,0|2,0,0]=4 4404 B9R2.3 C1C[C@H]2CNC[C@@H]2C1 MCULE-8709026258 [0,0,0,2,0,0|2,0,0]=4 4405 B9R2.3 C1NCC2C1COC2 MCULE-5372509005 [0,0,0,2,0,0|2,0,0]=4 4406 B9R2.3 C1NCC2C1COC2 MCULE-7565962965 [0,0,0,2,0,0|2,0,0]=4 4407 B9R2.3 C1NC[C@H]2[C@@H]1COC2 MCULE-1357427078 [0,0,0,2,0,0|2,0,0]=4 4408 B9R2.3 C1NC[C@H]2[C@@H]1COC2 MCULE-7789539229 [0,0,0,2,0,0|2,0,0]=4 4409 B9R2.3 C1NC[C@H]2[C@H]1COC2 MCULE-4657680429 [0,0,0,2,0,0|2,0,0]=4 4410 B9R2.3 [C@@H]12CNC[C@H]1COC2 MCULE-3792500992 [0,0,0,2,0,0|2,0,0]=4 4411 B9R2.3 [C@H]12CCC[C@@H]1CNC2 MCULE-2983694048 [0,0,0,2,0,0|2,0,0]=4 4412 B9R2.3 [C@H]12CCC[C@H]1NCC2 MCULE-5749214212 [0,0,0,2,0,0|2,0,0]=4 4413 B9R2.3 [C@H]12CCC[C@H]1NCC2 MCULE-5820731225 [0,0,0,2,0,0|2,0,0]=4 4414 B9R2.3 [C@H]12CNC[C@@H]1COC2 MCULE-1493350422 [0,0,0,2,0,0|2,0,0]=4 4415 B9R2.3 [C@H]12CNC[C@@H]1COC2 MCULE-8215777140 [0,0,0,2,0,0|2,0,0]=4 4416 B9R2.5 NC1CCCC12CC2 MCULE-1030422927 [0,0,0,2,0,0|2,0,0]=4 4417 B9R2.5 NC1CCCC12CC2 MCULE-4139786949 [0,0,0,2,0,0|2,0,0]=4 4418 B9R2.5 OC1CCCC12CC2 MCULE-8792740966 [0,0,0,2,0,0|1,1,0]=4 4419 B9R2.5 O[C@@H]1CCCC12CC2 MCULE-4216021733 [0,0,0,2,0,0|1,1,0]=4 4420 B9R2.5 O[C@@H]1CCCC12CC2 MCULE-5811995546 [0,0,0,2,0,0|1,1,0]=4 4421 B9R2.7 NC1CC2C1CCC2 MCULE-1766749220 [0,0,0,2,0,0|2,0,0]=4 4422 B9R2.7 NC1CC2C1CCC2 MCULE-4720445583 [0,0,0,2,0,0|2,0,0]=4 4423 B9R2.7 OC1CC2C1CCN2 MCULE-1875106894 [0,0,0,2,0,0|2,0,0]=4 4424 B9R2.7 OC1CC2C1CCN2 MCULE-5530554744 [0,0,0,2,0,0|2,0,0]=4 4425 B9R2.7 OC1CC2C1CNC2 MCULE-6123020535 [0,0,0,2,0,0|2,0,0]=4 4426 B9R2.7 OC1CC2C1CNC2 MCULE-6145264990 [0,0,0,2,0,0|2,0,0]=4 4427 B9R2.7 OC1CC2C1NCC2 MCULE-1724056091 [0,0,0,2,0,0|2,0,0]=4 4428 B9R2.7 OC1CC2C1NCC2 MCULE-4088023944 [0,0,0,2,0,0|2,0,0]=4 4429 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CCN2 MCULE-5150400350 [0,0,0,2,0,0|2,0,0]=4 4430 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CCN2 MCULE-7322559182 [0,0,0,2,0,0|2,0,0]=4 4431 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-1183667109 [0,0,0,2,0,0|2,0,0]=4 4432 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-2697058127 [0,0,0,2,0,0|2,0,0]=4 4433 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-9205223064 [0,0,0,2,0,0|2,0,0]=4 4434 B9R2.7 O[C@@H]1C[C@@H]2[C@H]1CNC2 MCULE-9459444695 [0,0,0,2,0,0|2,0,0]=4 4435 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CCN2 MCULE-2081667277 [0,0,0,2,0,0|2,0,0]=4 4436 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CCN2 MCULE-3236594496 [0,0,0,2,0,0|2,0,0]=4 4437 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CNC2 MCULE-4765047696 [0,0,0,2,0,0|2,0,0]=4 4438 B9R2.7 O[C@H]1C[C@@H]2[C@H]1CNC2 MCULE-8087349478 [0,0,0,2,0,0|2,0,0]=4 4439 B9R2.7 [C@@H]12CNC[C@@H]1C[C@@H]2O MCULE-2617041228 [0,0,0,2,0,0|2,0,0]=4 4440 B9R2.7 [C@@H]12CNC[C@@H]1C[C@@H]2O MCULE-3794611955 [0,0,0,2,0,0|2,0,0]=4 4441 B9R2.7 [C@@H]12CNC[C@@H]1C[C@H]2O MCULE-8722541506 [0,0,0,2,0,0|2,0,0]=4 4442 B9R2.7 [C@@H]12CNC[C@@H]1C[C@H]2O MCULE-9165377590 [0,0,0,2,0,0|2,0,0]=4 4443 B9R2.7 [C@@H]12CNC[C@@H]1[C@@H](C2)O MCULE-3033237914 [0,0,0,2,0,0|2,0,0]=4 4444 B9R2.7 [C@@H]12CNC[C@@H]1[C@@H](C2)O MCULE-3748787889 [0,0,0,2,0,0|2,0,0]=4 4445 B9R2.7 [C@@H]12C[C@@H]([C@@H]1CCN2)O MCULE-5782413728 [0,0,0,2,0,0|2,0,0]=4 4446 B9R2.7 [C@@H]12C[C@@H]([C@@H]1CCN2)O MCULE-9662765768 [0,0,0,2,0,0|2,0,0]=4 4447 B9R2.24 BrC1C2CCC1NC2 MCULE-9633334883 [0,0,0,2,0,0|2,0,0]=4 4448 B9R2.24 OC1C2CCC1NC2 MCULE-3410343986 [0,0,0,2,0,0|1,1,0]=4 4449 B9R2.24 OC1C2CCC1NC2 MCULE-7793208491 [0,0,0,2,0,0|1,1,0]=4 4450 B9R2.56 CCC12CNCC1C2 MCULE-4892494743 [0,0,0,2,0,0|2,0,0]=4 4451 B9R2.56 CCC12CNCC1C2 MCULE-9372840219 [0,0,0,2,0,0|2,0,0]=4 4452 B9R2.56 CC[C@]12CNC[C@H]1C2 MCULE-6315765450 [0,0,0,2,0,0|2,0,0]=4 4453 B9R2.56 NCC12COCC1C2 MCULE-4605594372 [0,0,0,2,0,0|2,0,0]=4 4454 B9R2.56 NCC12COCC1C2 MCULE-7228404394 [0,0,0,2,0,0|2,0,0]=4 4455 B9R2.56 OCC12CNCC1C2 MCULE-2183499557 [0,0,0,2,0,0|2,0,0]=4 4456 B9R2.56 OCC12CNCC1C2 MCULE-9347935345 [0,0,0,2,0,0|2,0,0]=4 4457 B9R2.56 OCC12COCC1C2 MCULE-7115607299 [0,0,0,2,0,0|2,0,0]=4 4458 B9R2.56 OC[C@]12CNC[C@H]1C2 MCULE-3314930374 [0,0,0,2,0,0|2,0,0]=4 4459 B9R2.56 [C@@H]12CNC[C@@]1(C2)CO MCULE-6677000826 [0,0,0,2,0,0|2,0,0]=4 4460 B9R2.56 [C@@H]12COC[C@@]1(C2)CN MCULE-5567633895 [0,0,0,2,0,0|2,0,0]=4 4461 B9R2.56 [C@@H]12COC[C@@]1(C2)CN MCULE-8388083695 [0,0,0,2,0,0|2,0,0]=4 4462 B9R2.56 [C@@H]12COC[C@@]1(C2)CN MCULE-8470952255 [0,0,0,2,0,0|2,0,0]=4 4463 B9R2.56 [C@@H]12COC[C@@]1(C2)CN MCULE-9874210324 [0,0,0,2,0,0|2,0,0]=4 4464 B9R2.56 [C@@H]12COC[C@@]1(C2)CO MCULE-3925746673 [0,0,0,2,0,0|2,0,0]=4 4465 B9R2.56 [C@@H]12COC[C@@]1(C2)CO MCULE-6112691555 [0,0,0,2,0,0|2,0,0]=4 4466 B9R2.56 [C@H]12COC[C@]1(C2)CO MCULE-8930198647 [0,0,0,2,0,0|2,0,0]=4 4467 B9R2.56 [C@H]12COC[C@]1(C2)CO MCULE-9519595251 [0,0,0,2,0,0|2,0,0]=4 4468 B9R2.70 C12CNC(C1C2)CO MCULE-4394798761 [0,0,0,2,0,0|2,0,0]=4 4469 B9R2.70 C12CNC(C1C2)CO MCULE-8368311568 [0,0,0,2,0,0|2,0,0]=4 4470 B9R2.70 [C@@H]1(NC[C@H]2[C@@H]1C2)CO MCULE-3868037858 [0,0,0,2,0,0|2,0,0]=4 4471 B9R2.70 [C@@H]1(NC[C@H]2[C@@H]1C2)CO MCULE-9214226537 [0,0,0,2,0,0|2,0,0]=4 4472 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-1920097396 [0,0,0,2,0,0|2,0,0]=4 4473 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-2926228582 [0,0,0,2,0,0|2,0,0]=4 4474 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-4595239988 [0,0,0,2,0,0|2,0,0]=4 4475 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-7784163101 [0,0,0,2,0,0|2,0,0]=4 4476 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-8164622872 [0,0,0,2,0,0|2,0,0]=4 4477 B9R2.70 [C@@H]12CN[C@@H]([C@@H]1C2)CO MCULE-9132252654 [0,0,0,2,0,0|2,0,0]=4 4478 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-2610856714 [0,0,0,2,0,0|2,0,0]=4 4479 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-5772132528 [0,0,0,2,0,0|2,0,0]=4 4480 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-8152584888 [0,0,0,2,0,0|2,0,0]=4 4481 B9R2.70 [C@H]12C[C@H]1CN[C@@H]2CO MCULE-8708552456 [0,0,0,2,0,0|2,0,0]=4 4482 B9R2.91 C1CC(C1)C2CCN2 MCULE-3402483441 [0,0,0,2,0,0|2,0,0]=4 4483 B9R2.91 C1CC(C1)C2CCN2 MCULE-9442810167 [0,0,0,2,0,0|2,0,0]=4 4484 B9R2.91 C1CC(C1)C2CNC2 MCULE-2460548441 [0,0,0,2,0,0|2,0,0]=4 4485 B9R2.91 C1CC(C1)C2CNC2 MCULE-2487746813 [0,0,0,2,0,0|2,0,0]=4 4486 B9R2.91 C1NCC1C2COC2 MCULE-1906409664 [0,0,0,2,0,0|2,0,0]=4 4487 B9R2.91 C1NCC1C2COC2 MCULE-6645087871 [0,0,0,2,0,0|2,0,0]=4 4488 B9R2.140 CC1CCC12CNC2 MCULE-5084303075 [0,0,0,2,0,0|2,0,0]=4 4489 B9R2.140 CC1CCC12CNC2 MCULE-9942116613 [0,0,0,2,0,0|2,0,0]=4 4490 B9R2.140 FC1CCC12CNC2 MCULE-5714409899 [0,0,0,2,0,0|2,0,0]=4 4491 B9R2.140 FC1CCC12CNC2 MCULE-9956152347 [0,0,0,2,0,0|2,0,0]=4 4492 B9R2.140 NC1CCC12CCC2 MCULE-3510185463 [0,0,0,2,0,0|2,0,0]=4 4493 B9R2.140 NC1CCC12CCC2 MCULE-5334555168 [0,0,0,2,0,0|2,0,0]=4 4494 B9R2.140 O=C1CCC12COC2 MCULE-9129224642 [0,0,0,2,0,0|0,1,1]=4 4495 B9R2.140 OC1CCC12CCC2 MCULE-4886802881 [0,0,0,2,0,0|1,1,0]=4 4496 B9R2.140 OC1CCC12CNC2 MCULE-2751329725 [0,0,0,2,0,0|1,1,0]=4 4497 B9R2.140 OC1CCC12CNC2 MCULE-5543992162 [0,0,0,2,0,0|1,1,0]=4 4498 B9R2.140 OC1CCC12CNC2 MCULE-6981202255 [0,0,0,2,0,0|1,1,0]=4 4499 B9R2.140 OC1CCC12COC2 MCULE-5757589077 [0,0,0,2,0,0|0,1,0]=3 4500 B9R2.140 OC1COC12CCC2 MCULE-1719734089 [0,0,0,2,0,0|2,0,0]=4 4501 B9R2.140 O[C@H]1CCC12COC2 MCULE-6567729778 [0,0,0,2,0,0|0,1,0]=3 4502 B9R2.153 NCC1CC12CCC2 MCULE-2371481990 [0,0,0,2,0,0|2,0,0]=4 4503 B9R2.153 OCC1CC12CCC2 MCULE-2729278824 [0,0,0,2,0,0|1,0,0]=3 4504 B9R2.187 NC1(CC1)C2CCC2 MCULE-1385394442 [0,0,0,2,0,0|2,0,0]=4 4505 B9R2.187 NC1(CC1)C2CCC2 MCULE-4772823026 [0,0,0,2,0,0|2,0,0]=4 4506 B9R2.187 NC1(CC1)C2COC2 MCULE-1551778482 [0,0,0,2,0,0|1,0,0]=3 4507 B9R2.187 NC1(CC1)C2COC2 MCULE-7028525088 [0,0,0,2,0,0|1,0,0]=3 4508 B9R2.189 CC1(CC1)C2(CC2)N MCULE-7506510006 [0,0,0,2,0,0|2,0,0]=4 4509 B9R2.189 CC1(CC1)C2(CC2)N MCULE-9439559373 [0,0,0,2,0,0|2,0,0]=4 4510 B9R0.24 CCC(C)CCC(C)CO MCULE-2874782306 [0,0,0,0,0,2|1,0,0]=3 4511 B9R0.24 CCC(C)SSC(C)CC MCULE-6317169760 [0,0,0,0,0,2|2,0,0]=4 4512 B9R0.24 COC(C)COC(C)CO MCULE-2586481016 [0,0,0,0,0,2|2,0,0]=4